A0A077ZEW7_TRITR Loading...

Guanine nucleotide-binding protein alpha-3 subunit

AlphaFold DB , UniProt , Accession A0A077ZEW7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 354 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	40	Very low	71.1	Confident	229 Å²	229	120.1 Å²	120.1	100%	1.128	63%	0.626	S	S	*	*				0	106.8	0	-63.3	-175.5	-159.3	0	0	107.7	H3	M1-H3 PolarHBondContact O-N 2.84Å; M1-H3 VanDerWaalsContact O-N 3.09Å
2	G	51.6	Low	72.5	Confident	80 Å²	80	112.8 Å²	112.8	83%	0.825	60%	0.597	S	S	*	*			trans	-71.2	102.6	175.8	0	0	0	0	0	108.4	C4	G2-C4 VanDerWaalsContact C-N 3.32Å; G2-C4 PolarHBondContact O-N 3.09Å
3	H	54.2	Low	73.8	Confident	186 Å²	186	117.5 Å²	117.5	86%	0.861	60%	0.601	S	S	*	*			trans	-58.8	100.7	170.6	-91.8	-77.1	0	0	0	107.6	M1 A5	M1-H3 PolarHBondContact O-N 2.84Å; M1-H3 VanDerWaalsContact O-N 3.09Å; H3-A5 PolarHBondContact O-N 3.02Å
4	C	60.7	Low	74.9	Confident	114 Å²	114	119.9 Å²	119.9	77%	0.77	61%	0.605	S	S	*	*			trans	-66.9	101.2	174.4	-141.1	0	0	0	0	105.6	G2 S6	G2-C4 VanDerWaalsContact C-N 3.32Å; G2-C4 PolarHBondContact O-N 3.09Å; C4-S6 PolarHBondContact O-N 3.05Å
5	A	66.6	Low	76	Confident	22 Å²	22	122.1 Å²	122.1	18%	0.182	60%	0.604	C	S	.	*			trans	-47.5	127.3	178.7	0	0	0	0	0	109.1	H3 E9 K10	H3-A5 PolarHBondContact O-N 3.02Å; A5-E9 WeakPolarHBondContact CA-OE2 3.49Å; A5-E9 HydrophobicContact CB-CB 4.23Å; A5-E9 VanDerWaalsContact CB-OE2 3.27Å; A5-E9 WeakPolarHBondContact CB-OE2 3.27Å; A5-K10 HydrophobicContact CB-CG 4.2Å; A5-K10 WeakPolarHBondContact O-CE 3.5Å
6	S	80.8	Confident	77	Confident	50 Å²	50	120.2 Å²	120.2	35%	0.35	60%	0.596	S	S	.	*			trans	-57.8	154.7	-176.6	76.2	0	0	0	0	109.3	C4 E8 E9 K10	C4-S6 PolarHBondContact O-N 3.05Å; S6-E8 PolarHBondContact O-N 3.18Å; S6-E8 VanDerWaalsContact O-N 3.15Å; S6-E9 PolarHBondContact N-OE2 3.15Å; S6-E9 PolarHBondContact O-N 2.94Å; S6-E9 WeakPolarHBondContact OG-CG 3.15Å; S6-E9 PolarHBondContact OG-N 3.33Å; S6-E9 VanDerWaalsContact OG-N 3.16Å; S6-K10 PolarHBondContact O-N 3.16Å
7	R	83.8	Confident	77.8	Confident	200 Å²	200	120.8 Å²	120.8	76%	0.755	60%	0.595	S	S	*	*	H	α-helix	trans	-52.4	-37.6	176.5	-179.3	178.2	168.7	176.7	-1.7	111.1	K10 E11	R7-K10 PolarHBondContact O-N 3.05Å; R7-E11 WeakPolarHBondContact CG-OE1 3.34Å; R7-E11 IonicContact CZ-OE1 3.89Å; R7-E11 IonicContact NE-OE1 3.05Å; R7-E11 PolarHBondContact NE-OE1 3.38Å; R7-E11 IonicContact NH2-OE1 3.82Å; R7-E11 WeakPolarHBondContact O-CG 3.31Å; R7-E11 PolarHBondContact O-N 2.98Å
8	E	84.3	Confident	78.6	Confident	146 Å²	146	122.8 Å²	122.8	68%	0.682	60%	0.599	S	S	*	*	H	α-helix	trans	-63.9	-43.1	175.9	-62.8	178.4	165.5	0	0	112.8	S6 K10 E11 A12	S6-E8 PolarHBondContact O-N 3.18Å; S6-E8 VanDerWaalsContact O-N 3.15Å; E8-K10 PolarHBondContact O-N 3.44Å; E8-E11 PolarHBondContact O-N 2.79Å; E8-A12 VanDerWaalsContact O-CB 3.31Å; E8-A12 WeakPolarHBondContact O-CB 3.46Å; E8-A12 PolarHBondContact O-N 3.3Å
9	E	86.2	Confident	79.2	Confident	99 Å²	99	121.3 Å²	121.3	46%	0.463	59%	0.593	S	S	.	*	H	α-helix	trans	-64	-39.9	175.6	-75.4	175.9	177	0	0	112.1	A5 S6 A12 R13	A5-E9 WeakPolarHBondContact CA-OE2 3.49Å; A5-E9 HydrophobicContact CB-CB 4.23Å; A5-E9 VanDerWaalsContact CB-OE2 3.27Å; A5-E9 WeakPolarHBondContact CB-OE2 3.27Å; S6-E9 PolarHBondContact N-OE2 3.15Å; S6-E9 PolarHBondContact O-N 2.94Å; S6-E9 WeakPolarHBondContact OG-CG 3.15Å; S6-E9 PolarHBondContact OG-N 3.33Å; S6-E9 VanDerWaalsContact OG-N 3.16Å; E9-A12 PolarHBondContact O-N 3.49Å; E9-R13 WeakPolarHBondContact O-CB 3.38Å; E9-R13 WeakPolarHBondContact O-CG 3.44Å; E9-R13 PolarHBondContact O-N 2.91Å
10	K	86.5	Confident	79.7	Confident	112 Å²	112	120.6 Å²	120.6	49%	0.487	59%	0.589	S	S	.	*	H	α-helix	trans	-65.2	-40.4	175.5	-69.9	-179.5	-176.7	173.6	0	111.4	A5 S6 R7 E8 K14	A5-K10 HydrophobicContact CB-CG 4.2Å; A5-K10 WeakPolarHBondContact O-CE 3.5Å; S6-K10 PolarHBondContact O-N 3.16Å; R7-K10 PolarHBondContact O-N 3.05Å; E8-K10 PolarHBondContact O-N 3.44Å; K10-K14 WeakPolarHBondContact O-CG 3.37Å; K10-K14 PolarHBondContact O-N 3.35Å; K10-K14 VanDerWaalsContact O-N 3.1Å
11	E	87.8	Confident	80.2	Confident	83 Å²	83	118.2 Å²	118.2	39%	0.388	58%	0.579	S	S	.	*	H	α-helix	trans	-68.9	-39.9	175.9	-73.4	174.8	-169.4	0	0	111.8	R7 E8 K14 R15	R7-E11 WeakPolarHBondContact CG-OE1 3.34Å; R7-E11 IonicContact CZ-OE1 3.89Å; R7-E11 IonicContact NE-OE1 3.05Å; R7-E11 PolarHBondContact NE-OE1 3.38Å; R7-E11 IonicContact NH2-OE1 3.82Å; R7-E11 WeakPolarHBondContact O-CG 3.31Å; R7-E11 PolarHBondContact O-N 2.98Å; E8-E11 PolarHBondContact O-N 2.79Å; E11-K14 PolarHBondContact O-N 2.88Å; E11-R15 WeakPolarHBondContact O-CG 3.36Å; E11-R15 PolarHBondContact O-N 3.16Å
12	A	87.8	Confident	82.5	Confident	33 Å²	33	111.9 Å²	111.9	27%	0.273	55%	0.546	S	S	.	.	H	α-helix	trans	-62.2	-46.8	173.7	0	0	0	0	0	112.2	E8 E9 K14 R15 N16	E8-A12 VanDerWaalsContact O-CB 3.31Å; E8-A12 WeakPolarHBondContact O-CB 3.46Å; E8-A12 PolarHBondContact O-N 3.3Å; E9-A12 PolarHBondContact O-N 3.49Å; A12-K14 VanDerWaalsContact C-N 3.32Å; A12-K14 PolarHBondContact O-N 3.16Å; A12-R15 PolarHBondContact O-N 3.38Å; A12-R15 VanDerWaalsContact O-N 3.15Å; A12-N16 PolarHBondContact O-N 3.1Å
13	R	88.4	Confident	84.2	Confident	173 Å²	173	112.9 Å²	112.9	65%	0.653	53%	0.531	S	S	*	.	H	α-helix	trans	-60.5	-40	174.9	-75.4	179.7	-176.3	177.1	3.9	112.4	E9 K17	E9-R13 WeakPolarHBondContact O-CB 3.38Å; E9-R13 WeakPolarHBondContact O-CG 3.44Å; E9-R13 PolarHBondContact O-N 2.91Å; R13-K17 WeakPolarHBondContact O-CB 3.47Å; R13-K17 PolarHBondContact O-N 3.4Å
14	K	89.8	Confident	85.6	Confident	151 Å²	151	112.2 Å²	112.2	66%	0.657	52%	0.521	S	S	*	.	H	α-helix	trans	-64.1	-39.4	174.8	-76.7	178.1	-179.3	-177.5	0	112.1	K10 E11 A12 K18	K10-K14 WeakPolarHBondContact O-CG 3.37Å; K10-K14 PolarHBondContact O-N 3.35Å; K10-K14 VanDerWaalsContact O-N 3.1Å; E11-K14 PolarHBondContact O-N 2.88Å; A12-K14 VanDerWaalsContact C-N 3.32Å; A12-K14 PolarHBondContact O-N 3.16Å; K14-K18 WeakPolarHBondContact O-CG 3.34Å; K14-K18 PolarHBondContact O-N 3.13Å; K14-K18 VanDerWaalsContact O-N 3.16Å
15	R	90.7	Very high	86.7	Confident	154 Å²	154	113.1 Å²	113.1	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-65.9	-48.7	175	-74.4	-176	-69.3	-155.8	-0.9	111.7	E11 A12 K17 K18 I19	E11-R15 WeakPolarHBondContact O-CG 3.36Å; E11-R15 PolarHBondContact O-N 3.16Å; A12-R15 PolarHBondContact O-N 3.38Å; A12-R15 VanDerWaalsContact O-N 3.15Å; R15-K17 PolarHBondContact O-N 3.43Å; R15-K18 WeakPolarHBondContact O-CB 3.43Å; R15-K18 PolarHBondContact O-N 2.98Å; R15-K18 VanDerWaalsContact O-N 3.16Å; R15-I19 WeakPolarHBondContact O-CG1 3.38Å; R15-I19 PolarHBondContact O-N 3.15Å
16	N	92	Very high	87.6	Confident	91 Å²	91	115.7 Å²	115.7	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-45	178.9	-72.1	-0.5	0	0	0	111.7	A12 K18 I19 E20	A12-N16 PolarHBondContact O-N 3.1Å; N16-K18 VanDerWaalsContact C-N 3.33Å; N16-K18 PolarHBondContact O-N 2.88Å; N16-I19 PolarHBondContact O-N 2.96Å; N16-I19 VanDerWaalsContact O-N 3.13Å; N16-E20 WeakPolarHBondContact O-CG 3.37Å; N16-E20 PolarHBondContact O-N 2.97Å
17	K	92.1	Very high	87.6	Confident	131 Å²	131	118.7 Å²	118.7	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-59.8	-42.1	175.8	-173.5	175.4	-179.9	178.7	0	112.3	R13 R15 I19 E20 D21	R13-K17 WeakPolarHBondContact O-CB 3.47Å; R13-K17 PolarHBondContact O-N 3.4Å; R15-K17 PolarHBondContact O-N 3.43Å; K17-I19 VanDerWaalsContact C-N 3.33Å; K17-I19 PolarHBondContact O-N 2.96Å; K17-E20 PolarHBondContact O-N 2.86Å; K17-D21 WeakPolarHBondContact O-CB 3.44Å; K17-D21 VanDerWaalsContact O-CG 3.22Å; K17-D21 PolarHBondContact O-N 2.82Å
18	K	91.2	Very high	87.4	Confident	156 Å²	156	111.9 Å²	111.9	68%	0.678	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-39.3	175.3	-77.2	-178.5	177.8	-171.5	0	112.3	K14 R15 N16 Q22	K14-K18 WeakPolarHBondContact O-CG 3.34Å; K14-K18 PolarHBondContact O-N 3.13Å; K14-K18 VanDerWaalsContact O-N 3.16Å; R15-K18 WeakPolarHBondContact O-CB 3.43Å; R15-K18 PolarHBondContact O-N 2.98Å; R15-K18 VanDerWaalsContact O-N 3.16Å; N16-K18 VanDerWaalsContact C-N 3.33Å; N16-K18 PolarHBondContact O-N 2.88Å; K18-Q22 WeakPolarHBondContact O-CB 3.36Å; K18-Q22 PolarHBondContact O-N 3.48Å
19	I	89.7	Confident	87.3	Confident	95 Å²	95	109 Å²	109	49%	0.487	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-47.7	176.3	-67.5	165.7	0	0	0	109.9	R15 N16 K17 D21 Q22 M23	R15-I19 WeakPolarHBondContact O-CG1 3.38Å; R15-I19 PolarHBondContact O-N 3.15Å; N16-I19 PolarHBondContact O-N 2.96Å; N16-I19 VanDerWaalsContact O-N 3.13Å; K17-I19 VanDerWaalsContact C-N 3.33Å; K17-I19 PolarHBondContact O-N 2.96Å; I19-D21 PolarHBondContact O-N 2.78Å; I19-Q22 PolarHBondContact O-N 2.81Å; I19-M23 HydrophobicContact CG2-CG 4.31Å; I19-M23 HydrophobicContact CG2-SD 3.99Å; I19-M23 WeakPolarHBondContact O-CB 3.49Å; I19-M23 VanDerWaalsContact O-CG 3.27Å; I19-M23 WeakPolarHBondContact O-CG 3.27Å; I19-M23 PolarHBondContact O-N 3.38Å
20	E	90.4	Very high	87	Confident	107 Å²	107	108.6 Å²	108.6	50%	0.5	51%	0.511	S	S	.	.	H	α-helix	trans	-60.8	-44.2	177.2	-72.3	173.6	-170.4	0	0	112.4	N16 K17 Q22 M23 R24	N16-E20 WeakPolarHBondContact O-CG 3.37Å; N16-E20 PolarHBondContact O-N 2.97Å; K17-E20 PolarHBondContact O-N 2.86Å; E20-Q22 VanDerWaalsContact C-N 3.33Å; E20-Q22 PolarHBondContact O-N 3.1Å; E20-M23 PolarHBondContact O-N 3.48Å; E20-R24 WeakPolarHBondContact O-CG 3.24Å; E20-R24 PolarHBondContact O-N 3.36Å
21	D	90.4	Very high	86.8	Confident	70 Å²	70	108.6 Å²	108.6	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-39.4	177.2	-72.7	-23.6	0	0	0	111.3	K17 I19 K25	K17-D21 WeakPolarHBondContact O-CB 3.44Å; K17-D21 VanDerWaalsContact O-CG 3.22Å; K17-D21 PolarHBondContact O-N 2.82Å; I19-D21 PolarHBondContact O-N 2.78Å; D21-K25 WeakPolarHBondContact O-CG 3.49Å; D21-K25 PolarHBondContact O-N 2.86Å; D21-K25 VanDerWaalsContact O-N 3.17Å
22	Q	87.9	Confident	86.8	Confident	96 Å²	96	111.8 Å²	111.8	45%	0.449	52%	0.524	S	S	.	.	H	α-helix	trans	-68.6	-44	175.6	-170.8	60.9	42.2	0	0	111.3	K18 I19 E20 R24 K25 D26	K18-Q22 WeakPolarHBondContact O-CB 3.36Å; K18-Q22 PolarHBondContact O-N 3.48Å; I19-Q22 PolarHBondContact O-N 2.81Å; E20-Q22 VanDerWaalsContact C-N 3.33Å; E20-Q22 PolarHBondContact O-N 3.1Å; Q22-R24 VanDerWaalsContact C-N 3.31Å; Q22-R24 PolarHBondContact O-N 3.36Å; Q22-K25 WeakPolarHBondContact O-CB 3.37Å; Q22-K25 PolarHBondContact O-N 3.25Å; Q22-K25 VanDerWaalsContact O-N 3.1Å; Q22-D26 PolarHBondContact NE2-OD1 3.17Å; Q22-D26 PolarHBondContact O-N 3.48Å
23	M	85.8	Confident	87.1	Confident	102 Å²	102	111.8 Å²	111.8	50%	0.502	52%	0.521	S	S	.	.	H	α-helix	trans	-58.7	-42	176.5	-75.2	179.6	68.4	0	0	112	I19 E20 K25 D26 Q27	I19-M23 HydrophobicContact CG2-CG 4.31Å; I19-M23 HydrophobicContact CG2-SD 3.99Å; I19-M23 WeakPolarHBondContact O-CB 3.49Å; I19-M23 VanDerWaalsContact O-CG 3.27Å; I19-M23 WeakPolarHBondContact O-CG 3.27Å; I19-M23 PolarHBondContact O-N 3.38Å; E20-M23 PolarHBondContact O-N 3.48Å; M23-K25 VanDerWaalsContact C-N 3.35Å; M23-D26 PolarHBondContact O-N 3.38Å; M23-Q27 WeakPolarHBondContact O-CB 3.44Å; M23-Q27 VanDerWaalsContact O-CG 3.24Å; M23-Q27 WeakPolarHBondContact O-CG 3.38Å; M23-Q27 PolarHBondContact O-N 2.97Å
24	R	84.9	Confident	87.3	Confident	171 Å²	171	103.7 Å²	103.7	65%	0.645	49%	0.49	S	S	*	.	H	α-helix	trans	-64.2	-39.5	175.8	-73.2	177.2	-177.4	-173.3	1.9	112.1	E20 Q22 S28	E20-R24 WeakPolarHBondContact O-CG 3.24Å; E20-R24 PolarHBondContact O-N 3.36Å; Q22-R24 VanDerWaalsContact C-N 3.31Å; Q22-R24 PolarHBondContact O-N 3.36Å; R24-S28 WeakPolarHBondContact O-CB 3.46Å; R24-S28 PolarHBondContact O-N 3.43Å
25	K	84.5	Confident	87.6	Confident	133 Å²	133	97.5 Å²	97.5	58%	0.578	46%	0.463	S	S	*	.	H	α-helix	trans	-65	-46.6	174.4	-73.7	176.1	-179.4	-177.7	0	111.3	D21 Q22 M23 Q27 S28 V29	D21-K25 WeakPolarHBondContact O-CG 3.49Å; D21-K25 PolarHBondContact O-N 2.86Å; D21-K25 VanDerWaalsContact O-N 3.17Å; Q22-K25 WeakPolarHBondContact O-CB 3.37Å; Q22-K25 PolarHBondContact O-N 3.25Å; Q22-K25 VanDerWaalsContact O-N 3.1Å; M23-K25 VanDerWaalsContact C-N 3.35Å; K25-Q27 VanDerWaalsContact C-N 3.31Å; K25-Q27 PolarHBondContact O-N 3.14Å; K25-S28 WeakPolarHBondContact O-CB 3.31Å; K25-S28 PolarHBondContact O-N 2.68Å; K25-S28 VanDerWaalsContact O-N 3.14Å; K25-V29 WeakPolarHBondContact O-CG2 3.35Å; K25-V29 PolarHBondContact O-N 2.98Å
26	D	84	Confident	87.9	Confident	77 Å²	77	90.1 Å²	90.1	41%	0.412	44%	0.435	S	S	.	.	H	α-helix	trans	-63.1	-39.8	179.5	-64.1	-15.2	0	0	0	111	Q22 M23 V29 T30	Q22-D26 PolarHBondContact NE2-OD1 3.17Å; Q22-D26 PolarHBondContact O-N 3.48Å; M23-D26 PolarHBondContact O-N 3.38Å; D26-V29 PolarHBondContact O-N 2.91Å; D26-T30 VanDerWaalsContact O-CB 3.29Å; D26-T30 WeakPolarHBondContact O-CB 3.46Å; D26-T30 PolarHBondContact O-N 2.78Å; D26-T30 PolarHBondContact O-OG1 2.88Å
27	Q	80.8	Confident	88.1	Confident	112 Å²	112	85.9 Å²	85.9	52%	0.523	41%	0.412	S	S	.	.	H	α-helix	trans	-62.3	-45.8	172.4	-76.9	174.7	-11.9	0	0	111.6	M23 K25 V29 T30 L31	M23-Q27 WeakPolarHBondContact O-CB 3.44Å; M23-Q27 VanDerWaalsContact O-CG 3.24Å; M23-Q27 WeakPolarHBondContact O-CG 3.38Å; M23-Q27 PolarHBondContact O-N 2.97Å; K25-Q27 VanDerWaalsContact C-N 3.31Å; K25-Q27 PolarHBondContact O-N 3.14Å; Q27-V29 VanDerWaalsContact C-N 3.33Å; Q27-V29 PolarHBondContact O-N 3.28Å; Q27-T30 PolarHBondContact O-N 3.43Å; Q27-L31 WeakPolarHBondContact O-CB 3.38Å; Q27-L31 VanDerWaalsContact O-CG 3.31Å; Q27-L31 WeakPolarHBondContact O-CG 3.29Å; Q27-L31 PolarHBondContact O-N 3.41Å
28	S	80.7	Confident	88.4	Confident	57 Å²	57	79.6 Å²	79.6	40%	0.399	39%	0.385	S	S	.	.	H	α-helix	trans	-63.2	-37.8	177.8	-177.8	0	0	0	0	112.8	R24 K25 R32	R24-S28 WeakPolarHBondContact O-CB 3.46Å; R24-S28 PolarHBondContact O-N 3.43Å; K25-S28 WeakPolarHBondContact O-CB 3.31Å; K25-S28 PolarHBondContact O-N 2.68Å; K25-S28 VanDerWaalsContact O-N 3.14Å; S28-R32 WeakPolarHBondContact O-CG 3.5Å; S28-R32 PolarHBondContact O-N 3.41Å
29	V	81.4	Confident	88.7	Confident	86 Å²	86	72.2 Å²	72.2	52%	0.521	35%	0.353	S	S	.	.	H	α-helix	trans	-69.1	-44.6	175.3	171.4	0	0	0	0	110.1	K25 D26 Q27 L31 R32 T33	K25-V29 WeakPolarHBondContact O-CG2 3.35Å; K25-V29 PolarHBondContact O-N 2.98Å; D26-V29 PolarHBondContact O-N 2.91Å; Q27-V29 VanDerWaalsContact C-N 3.33Å; Q27-V29 PolarHBondContact O-N 3.28Å; V29-L31 VanDerWaalsContact C-N 3.34Å; V29-L31 PolarHBondContact O-N 3.43Å; V29-R32 CarbonylContact O-C 3.49Å; V29-R32 PolarHBondContact O-N 2.85Å; V29-T33 PolarHBondContact O-N 3.05Å; V29-T33 PolarHBondContact O-OG1 3.07Å
30	T	80.8	Confident	89.1	Confident	91 Å²	91	67.7 Å²	67.7	56%	0.558	33%	0.33	S	S	*	.	H	α-helix	trans	-59.1	-44.2	178.5	-57.4	0	0	0	0	111.5	D26 Q27 R32 T33	D26-T30 VanDerWaalsContact O-CB 3.29Å; D26-T30 WeakPolarHBondContact O-CB 3.46Å; D26-T30 PolarHBondContact O-N 2.78Å; D26-T30 PolarHBondContact O-OG1 2.88Å; Q27-T30 PolarHBondContact O-N 3.43Å; T30-R32 PolarHBondContact O-N 3.42Å; T30-T33 PolarHBondContact O-N 3.45Å
31	L	82	Confident	89.4	Confident	112 Å²	112	62.7 Å²	62.7	59%	0.586	31%	0.307	S	S	*	.	H	α-helix	trans	-62.9	-28.1	177.4	-73.4	171.5	0	0	0	113	Q27 V29 M351	Q27-L31 WeakPolarHBondContact O-CB 3.38Å; Q27-L31 VanDerWaalsContact O-CG 3.31Å; Q27-L31 WeakPolarHBondContact O-CG 3.29Å; Q27-L31 PolarHBondContact O-N 3.41Å; V29-L31 VanDerWaalsContact C-N 3.34Å; V29-L31 PolarHBondContact O-N 3.43Å; L31-M351 HydrophobicContact CB-SD 4.23Å
32	R	88	Confident	89.6	Confident	149 Å²	149	59.8 Å²	59.8	56%	0.562	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	0.6	176.9	-66.2	-177	-177.9	-171.5	-0.5	113.5	S28 V29 T30 L195 T196	S28-R32 WeakPolarHBondContact O-CG 3.5Å; S28-R32 PolarHBondContact O-N 3.41Å; V29-R32 CarbonylContact O-C 3.49Å; V29-R32 PolarHBondContact O-N 2.85Å; T30-R32 PolarHBondContact O-N 3.42Å; R32-L195 HydrophobicContact CB-CD2 4.18Å; R32-L195 HydrophobicContact CG-CD2 4.48Å; R32-L195 WeakPolarHBondContact O-CA 3.46Å; R32-T196 PolarHBondContact O-N 3.14Å
33	T	92.6	Very high	90	Very high	34 Å²	34	56.8 Å²	56.8	21%	0.209	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.1	-180	-58.1	0	0	0	0	110	V29 T30 T196 R198	V29-T33 PolarHBondContact O-N 3.05Å; V29-T33 PolarHBondContact O-OG1 3.07Å; T30-T33 PolarHBondContact O-N 3.45Å; T33-T196 CarbonylContact C-O 3.5Å; T33-T196 VanDerWaalsContact CA-O 3.27Å; T33-T196 WeakPolarHBondContact CA-O 3.32Å; T33-R198 HydrophobicContact CG2-CB 4.23Å
34	I	94	Very high	90.6	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.015	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115.2	172.8	-66	172.1	0	0	0	108.5	L36 L195 T196 F197 R198 N220 I343 I344 N347	I34-L36 HydrophobicContact CG2-CD2 3.71Å; I34-L36 HydrophobicContact CG2-CG 4.27Å; I34-L195 HydrophobicContact CD1-CB 4.33Å; I34-L195 HydrophobicContact CD1-CD1 3.76Å; I34-T196 PolarHBondContact N-O 3.45Å; I34-F197 HydrophobicContact CB-CD1 3.92Å; I34-F197 HydrophobicContact CB-CE1 3.83Å; I34-F197 HydrophobicContact CB-CG 4.48Å; I34-F197 HydrophobicContact CB-CZ 4.32Å; I34-F197 HydrophobicContact CD1-CE1 3.82Å; I34-F197 HydrophobicContact CD1-CE2 4.13Å; I34-F197 HydrophobicContact CD1-CZ 3.54Å; I34-F197 HydrophobicContact CG1-CE1 4.43Å; I34-F197 HydrophobicContact CG1-CZ 4.49Å; I34-F197 HydrophobicContact CG2-CD1 3.84Å; I34-F197 HydrophobicContact CG2-CE1 3.59Å; I34-F197 HydrophobicContact CG2-CZ 4.41Å; I34-F197 WeakPolarHBondContact O-CA 3.44Å; I34-R198 PolarHBondContact O-N 3.04Å; I34-N220 HydrophobicContact CG2-CB 4.02Å; I34-I343 HydrophobicContact CD1-CG2 4.19Å; I34-I343 HydrophobicContact CG2-CG2 3.67Å; I34-I344 HydrophobicContact CD1-CG1 4.14Å; I34-N347 HydrophobicContact CD1-CB 4.45Å
35	K	95.3	Very high	91.1	Very high	20 Å²	20	44.3 Å²	44.3	9%	0.087	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.1	175.7	-173.7	-178.5	176.9	-173.6	0	111	R198 I200 C215 D217 N218 V219 N220 A221	K35-R198 CarbonylContact C-O 3.56Å; K35-R198 WeakPolarHBondContact CA-O 3.06Å; K35-I200 HydrophobicContact CD-CD1 4.32Å; K35-I200 HydrophobicContact CG-CD1 4.26Å; K35-C215 VanDerWaalsContact CE-O 3.32Å; K35-C215 WeakPolarHBondContact CE-O 3.44Å; K35-C215 PolarHBondContact NZ-O 2.56Å; K35-D217 PolarHBondContact NZ-O 3.02Å; K35-N218 WeakPolarHBondContact CB-O 3.42Å; K35-N218 WeakPolarHBondContact CD-O 3.21Å; K35-V219 HydrophobicContact CD-CG2 4.03Å; K35-V219 HydrophobicContact CG-CG2 4.47Å; K35-N220 PolarHBondContact N-OD1 2.94Å; K35-N220 PolarHBondContact O-N 2.89Å; K35-A221 PolarHBondContact O-N 3.38Å
36	L	96.9	Very high	91.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.1	174	-52.7	-174.5	0	0	0	109.8	I34 M53 F197 R198 V199 I200 A221 I223 L340 I343	I34-L36 HydrophobicContact CG2-CD2 3.71Å; I34-L36 HydrophobicContact CG2-CG 4.27Å; L36-M53 HydrophobicContact CD1-CE 4.48Å; L36-F197 HydrophobicContact CD1-CD1 3.88Å; L36-F197 HydrophobicContact CD1-CE1 4.29Å; L36-F197 HydrophobicContact CG-CD1 4.19Å; L36-R198 PolarHBondContact N-O 3.49Å; L36-V199 HydrophobicContact CB-CG1 4.3Å; L36-V199 HydrophobicContact CB-CG2 4.24Å; L36-V199 HydrophobicContact CD1-CG2 4.06Å; L36-V199 HydrophobicContact CG-CG2 4.42Å; L36-V199 WeakPolarHBondContact O-CA 3.38Å; L36-I200 PolarHBondContact O-N 2.96Å; L36-A221 WeakPolarHBondContact CA-O 3.45Å; L36-A221 HydrophobicContact CD2-CB 3.81Å; L36-I223 HydrophobicContact CD1-CD1 4.44Å; L36-L340 HydrophobicContact CD1-CD2 3.7Å; L36-I343 HydrophobicContact CD2-CD1 3.74Å; L36-I343 HydrophobicContact CD2-CG2 4.48Å
37	L	97.6	Very high	92.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.5	177.3	-174.1	61.1	0	0	0	110.5	L39 I200 C215 F216 V219 A221 I222 I223	L37-L39 HydrophobicContact CD1-CD2 4.37Å; L37-L39 HydrophobicContact CD2-CD1 3.95Å; L37-L39 HydrophobicContact CD2-CD2 4.03Å; L37-L39 HydrophobicContact CD2-CG 4.09Å; L37-L39 HydrophobicContact CG-CD1 4.27Å; L37-L39 HydrophobicContact CG-CD2 3.91Å; L37-L39 HydrophobicContact CG-CG 3.89Å; L37-I200 HydrophobicContact CD1-CB 3.9Å; L37-I200 HydrophobicContact CD1-CG2 3.86Å; L37-C215 HydrophobicContact CD1-CB 3.75Å; L37-C215 HydrophobicContact CD2-CB 4.34Å; L37-F216 HydrophobicContact CD2-CD1 3.74Å; L37-F216 HydrophobicContact CD2-CE1 3.88Å; L37-V219 HydrophobicContact CB-CG1 4.02Å; L37-V219 HydrophobicContact CB-CG2 4.2Å; L37-V219 HydrophobicContact CD2-CG2 4.16Å; L37-A221 PolarHBondContact N-O 2.89Å; L37-I222 HydrophobicContact CB-CG1 4.34Å; L37-I222 WeakPolarHBondContact O-CA 3.43Å; L37-I223 PolarHBondContact O-N 3.06Å
38	L	98.1	Very high	93.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	117.3	175.6	-52.2	-173.2	0	0	0	109.4	K46 I49 L50 V199 I200 D201 I223	L38-K46 HydrophobicContact CB-CB 4.24Å; L38-K46 HydrophobicContact CB-CD 4.39Å; L38-K46 HydrophobicContact CB-CG 4.42Å; L38-K46 WeakPolarHBondContact CD1-O 3.38Å; L38-I49 HydrophobicContact CD1-CG2 4.33Å; L38-L50 HydrophobicContact CD1-CB 4.01Å; L38-L50 HydrophobicContact CD1-CD1 4.4Å; L38-V199 HydrophobicContact CD1-CG1 4Å; L38-V199 HydrophobicContact CD2-CG1 4.01Å; L38-V199 HydrophobicContact CG-CG1 3.88Å; L38-I200 WeakPolarHBondContact CB-O 3.33Å; L38-I200 PolarHBondContact N-O 3.27Å; L38-D201 HydrophobicContact CD1-CB 4.32Å; L38-I223 WeakPolarHBondContact CA-O 3.27Å; L38-I223 HydrophobicContact CD2-CB 3.75Å; L38-I223 HydrophobicContact CD2-CD1 3.93Å; L38-I223 HydrophobicContact CD2-CG1 4.25Å; L38-I223 HydrophobicContact CD2-CG2 4.29Å
39	L	97.9	Very high	94	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	160.3	-179.7	-63.3	179.7	0	0	0	111.6	L37 V202 W212 I222 I223 F224 I225 I254 F260	L37-L39 HydrophobicContact CD1-CD2 4.37Å; L37-L39 HydrophobicContact CD2-CD1 3.95Å; L37-L39 HydrophobicContact CD2-CD2 4.03Å; L37-L39 HydrophobicContact CD2-CG 4.09Å; L37-L39 HydrophobicContact CG-CD1 4.27Å; L37-L39 HydrophobicContact CG-CD2 3.91Å; L37-L39 HydrophobicContact CG-CG 3.89Å; L39-V202 HydrophobicContact CD2-CG2 3.71Å; L39-W212 HydrophobicContact CB-CH2 4.45Å; L39-W212 HydrophobicContact CB-CZ3 4.46Å; L39-W212 HydrophobicContact CD2-CD2 3.84Å; L39-W212 HydrophobicContact CD2-CE3 3.8Å; L39-W212 HydrophobicContact CD2-CG 4.33Å; L39-W212 HydrophobicContact CD2-CH2 4.23Å; L39-W212 HydrophobicContact CD2-CZ2 4.3Å; L39-W212 HydrophobicContact CD2-CZ3 4Å; L39-I222 HydrophobicContact CB-CG2 4.4Å; L39-I222 HydrophobicContact CD1-CD1 4.15Å; L39-I222 HydrophobicContact CD1-CG1 4.41Å; L39-I222 HydrophobicContact CD1-CG2 4.08Å; L39-I222 HydrophobicContact CG-CG2 4.4Å; L39-I223 PolarHBondContact N-O 2.93Å; L39-F224 HydrophobicContact CB-CD2 4.09Å; L39-F224 CarbonylContact O-C 2.98Å; L39-F224 WeakPolarHBondContact O-CA 3.33Å; L39-I225 PolarHBondContact O-N 3.27Å; L39-I254 HydrophobicContact CD1-CD1 4.32Å; L39-I254 HydrophobicContact CD1-CG1 4.45Å; L39-I254 HydrophobicContact CD1-CG2 3.71Å; L39-F260 HydrophobicContact CD1-CE2 4.44Å; L39-F260 HydrophobicContact CD1-CZ 4.48Å
40	G	97.8	Very high	94.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.			trans	140.9	167	-177.5	0	0	0	0	0	112.6	K46 G204	G40-K46 PolarHBondContact O-NZ 2.76Å; G40-G204 WeakPolarHBondContact O-CA 3.21Å
41	A	96.7	Very high	95.6	Very high	2 Å²	2	23.5 Å²	23.5	2%	0.017	12%	0.119	C	C	.	.	S	Bend	trans	-60.4	166.6	-178.2	0	0	0	0	0	112.3	S44 K46 L250	A41-S44 PolarHBondContact O-N 3.09Å; A41-S44 PolarHBondContact O-OG 3.37Å; A41-K46 PolarHBondContact O-NZ 2.95Å; A41-L250 HydrophobicContact CB-CD2 4.2Å
42	G	94.8	Very high	96.3	Very high	9 Å²	9	18.2 Å²	18.2	9%	0.093	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	145.5	169.4	0	0	0	0	0	109.9	S44 G204	G42-S44 PolarHBondContact O-N 3.37Å; G42-G204 VanDerWaalsContact N-C 3.3Å; G42-G204 PolarHBondContact N-O 3.49Å
43	E	95.2	Very high	96.7	Very high	33 Å²	33	11.1 Å²	11.1	15%	0.154	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	3.7	172.6	-36.1	-160.4	135	0	0	115.7	G45 R179 R236 R243 K271	E43-G45 PolarHBondContact O-N 3.07Å; E43-R179 IonicContact OE1-CZ 3.08Å; E43-R179 IonicContact OE1-NE 3.56Å; E43-R179 PolarHBondContact OE1-NE 2.72Å; E43-R179 IonicContact OE1-NH2 3.17Å; E43-R179 PolarHBondContact OE1-NH2 3.24Å; E43-R236 VanDerWaalsContact CD-NH2 3.25Å; E43-R236 IonicContact OE1-CZ 2.94Å; E43-R236 IonicContact OE1-NE 2.79Å; E43-R236 PolarHBondContact OE1-NE 3.24Å; E43-R236 VanDerWaalsContact OE1-NE 3.15Å; E43-R236 IonicContact OE1-NH1 3.88Å; E43-R236 IonicContact OE1-NH2 3.51Å; E43-R236 PolarHBondContact OE1-NH2 3.11Å; E43-R236 IonicContact OE2-CZ 3.41Å; E43-R236 VanDerWaalsContact OE2-CZ 3.25Å; E43-R236 IonicContact OE2-NE 3.58Å; E43-R236 PolarHBondContact OE2-NE 3.09Å; E43-R236 IonicContact OE2-NH2 2.71Å; E43-R236 PolarHBondContact OE2-NH2 2.82Å; E43-R243 IonicContact OE2-CZ 2.67Å; E43-R243 IonicContact OE2-NH1 3.04Å; E43-R243 PolarHBondContact OE2-NH1 3.3Å; E43-R243 IonicContact OE2-NH2 2.8Å; E43-R243 PolarHBondContact OE2-NH2 2.68Å; E43-K271 WeakPolarHBondContact O-CE 3.31Å; E43-K271 PolarHBondContact O-NZ 3.17Å
44	S	97.6	Very high	96.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.063	C	C	.	.	S	Bend	trans	-67.9	-17.3	178.5	70	0	0	0	0	115.1	A41 G42 I225 N270	A41-S44 PolarHBondContact O-N 3.09Å; A41-S44 PolarHBondContact O-OG 3.37Å; G42-S44 PolarHBondContact O-N 3.37Å; S44-I225 WeakPolarHBondContact CB-O 3.33Å; S44-I225 VanDerWaalsContact O-CG2 3.26Å; S44-I225 WeakPolarHBondContact O-CG2 3.46Å; S44-I225 PolarHBondContact OG-O 3.42Å; S44-N270 PolarHBondContact O-ND2 3.39Å
45	G	97.3	Very high	96.9	Very high	11 Å²	11	12.8 Å²	12.8	11%	0.113	7%	0.07	C	C	.	.	S	Bend	trans	110	11.2	178.2	0	0	0	0	0	115.7	E43 S47 T48 I49	E43-G45 PolarHBondContact O-N 3.07Å; G45-S47 PolarHBondContact O-N 2.75Å; G45-T48 WeakPolarHBondContact O-CB 3.49Å; G45-T48 PolarHBondContact O-N 2.66Å; G45-T48 VanDerWaalsContact O-N 3.13Å; G45-I49 PolarHBondContact O-N 3.13Å
46	K	97.7	Very high	96.9	Very high	11 Å²	11	13.8 Å²	13.8	5%	0.048	8%	0.076	C	C	.	.	H	α-helix	trans	-53.4	-54.4	178.9	-57.4	-176.8	-64.9	-65.4	0	113.9	L38 G40 A41 T48 I49 L50 D201 V202 I225	L38-K46 HydrophobicContact CB-CB 4.24Å; L38-K46 HydrophobicContact CB-CD 4.39Å; L38-K46 HydrophobicContact CB-CG 4.42Å; L38-K46 WeakPolarHBondContact CD1-O 3.38Å; G40-K46 PolarHBondContact O-NZ 2.76Å; A41-K46 PolarHBondContact O-NZ 2.95Å; K46-T48 PolarHBondContact O-N 2.89Å; K46-I49 WeakPolarHBondContact O-CB 3.22Å; K46-I49 PolarHBondContact O-N 2.86Å; K46-L50 PolarHBondContact O-N 3.09Å; K46-D201 WeakPolarHBondContact CB-OD1 3.38Å; K46-V202 WeakPolarHBondContact CE-O 3.13Å; K46-I225 HydrophobicContact CB-CD1 4.14Å; K46-I225 HydrophobicContact CG-CB 4.19Å; K46-I225 HydrophobicContact CG-CD1 3.9Å; K46-I225 HydrophobicContact CG-CG1 4.43Å
47	S	97.6	Very high	96.7	Very high	31 Å²	31	15.9 Å²	15.9	22%	0.217	9%	0.085	C	C	.	.	H	α-helix	trans	-63.4	-28.1	179.7	-47	0	0	0	0	112.1	G45 L50 K51 T182 D201	G45-S47 PolarHBondContact O-N 2.75Å; S47-L50 PolarHBondContact O-N 3.28Å; S47-K51 WeakPolarHBondContact O-CB 3.37Å; S47-K51 WeakPolarHBondContact O-CG 3.41Å; S47-K51 PolarHBondContact O-N 3.23Å; S47-T182 PolarHBondContact OG-OG1 2.97Å; S47-D201 VanDerWaalsContact CA-OD2 3.3Å; S47-D201 WeakPolarHBondContact CA-OD2 3.35Å; S47-D201 VanDerWaalsContact CB-OD2 3.28Å; S47-D201 WeakPolarHBondContact CB-OD2 3.4Å; S47-D201 PolarHBondContact OG-OD2 2.73Å
48	T	97.8	Very high	96.5	Very high	24 Å²	24	19.8 Å²	19.8	15%	0.147	10%	0.102	C	C	.	.	H	α-helix	trans	-70.3	-42.2	173.2	-49.4	0	0	0	0	111.2	G45 K46 L50 K51 Q52 L176 A326 T327	G45-T48 WeakPolarHBondContact O-CB 3.49Å; G45-T48 PolarHBondContact O-N 2.66Å; G45-T48 VanDerWaalsContact O-N 3.13Å; K46-T48 PolarHBondContact O-N 2.89Å; T48-L50 VanDerWaalsContact C-N 3.31Å; T48-L50 PolarHBondContact O-N 3.09Å; T48-K51 WeakPolarHBondContact O-CB 3.43Å; T48-K51 PolarHBondContact O-N 2.9Å; T48-Q52 WeakPolarHBondContact O-CG 3.43Å; T48-Q52 PolarHBondContact O-N 3.1Å; T48-L176 HydrophobicContact CG2-CB 4.33Å; T48-L176 HydrophobicContact CG2-CD2 3.91Å; T48-A326 HydrophobicContact CG2-CB 3.62Å; T48-A326 WeakPolarHBondContact CG2-O 3.43Å; T48-T327 HydrophobicContact CG2-CG2 4.04Å
49	I	97.8	Very high	96.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-39.8	172	-65.8	-62.5	0	0	0	111.2	L38 G45 K46 Q52 M53 I225 F268 A326 V332	L38-I49 HydrophobicContact CD1-CG2 4.33Å; G45-I49 PolarHBondContact O-N 3.13Å; K46-I49 WeakPolarHBondContact O-CB 3.22Å; K46-I49 PolarHBondContact O-N 2.86Å; I49-Q52 WeakPolarHBondContact O-CB 3.26Å; I49-Q52 PolarHBondContact O-N 2.78Å; I49-M53 WeakPolarHBondContact O-CG 3.37Å; I49-M53 PolarHBondContact O-N 2.83Å; I49-I225 HydrophobicContact CB-CD1 3.99Å; I49-I225 HydrophobicContact CG1-CD1 3.72Å; I49-I225 HydrophobicContact CG2-CD1 4.35Å; I49-F268 HydrophobicContact CD1-CD2 4.21Å; I49-F268 HydrophobicContact CD1-CE2 4.26Å; I49-F268 HydrophobicContact CG1-CD2 4.32Å; I49-F268 HydrophobicContact CG2-CE2 4.36Å; I49-A326 HydrophobicContact CD1-CB 3.68Å; I49-A326 HydrophobicContact CG1-CB 4.11Å; I49-V332 HydrophobicContact CD1-CG1 4.23Å; I49-V332 HydrophobicContact CD1-CG2 4.11Å
50	L	97.2	Very high	96.1	Very high	10 Å²	10	28.4 Å²	28.4	5%	0.052	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-41.3	174.6	-170.5	70	0	0	0	112.1	L38 K46 S47 T48 Q52 M53 K54 T186 V188 V199 D201	L38-L50 HydrophobicContact CD1-CB 4.01Å; L38-L50 HydrophobicContact CD1-CD1 4.4Å; K46-L50 PolarHBondContact O-N 3.09Å; S47-L50 PolarHBondContact O-N 3.28Å; T48-L50 VanDerWaalsContact C-N 3.31Å; T48-L50 PolarHBondContact O-N 3.09Å; L50-Q52 VanDerWaalsContact C-N 3.32Å; L50-Q52 PolarHBondContact O-N 2.79Å; L50-M53 WeakPolarHBondContact O-CB 3.34Å; L50-M53 PolarHBondContact O-N 3.4Å; L50-K54 PolarHBondContact O-N 2.94Å; L50-K54 VanDerWaalsContact O-N 3.13Å; L50-T186 HydrophobicContact CD2-CG2 3.81Å; L50-V188 HydrophobicContact CD1-CB 3.71Å; L50-V188 HydrophobicContact CD1-CG2 3.59Å; L50-V188 HydrophobicContact CD2-CG2 3.96Å; L50-V188 HydrophobicContact CG-CB 4.32Å; L50-V188 HydrophobicContact CG-CG2 3.62Å; L50-V199 HydrophobicContact CD1-CB 3.8Å; L50-V199 HydrophobicContact CD1-CG1 3.61Å; L50-D201 HydrophobicContact CB-CB 4.33Å; L50-D201 HydrophobicContact CD2-CB 3.56Å; L50-D201 HydrophobicContact CG-CB 4.39Å
51	K	97	Very high	96	Very high	44 Å²	44	30 Å²	30	19%	0.191	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-40.7	172.8	-73.8	168.4	179.5	-177.9	0	111.3	S47 T48 K54 I55 F61 V175 L176 T178	S47-K51 WeakPolarHBondContact O-CB 3.37Å; S47-K51 WeakPolarHBondContact O-CG 3.41Å; S47-K51 PolarHBondContact O-N 3.23Å; T48-K51 WeakPolarHBondContact O-CB 3.43Å; T48-K51 PolarHBondContact O-N 2.9Å; K51-K54 WeakPolarHBondContact O-CA 3.44Å; K51-K54 VanDerWaalsContact O-CB 3.26Å; K51-K54 WeakPolarHBondContact O-CB 3.29Å; K51-K54 PolarHBondContact O-N 2.98Å; K51-K54 VanDerWaalsContact O-N 3.1Å; K51-I55 WeakPolarHBondContact O-CG1 3.47Å; K51-I55 PolarHBondContact O-N 3.13Å; K51-F61 HydrophobicContact CB-CE2 4.41Å; K51-F61 HydrophobicContact CB-CZ 3.81Å; K51-F61 HydrophobicContact CG-CZ 3.89Å; K51-V175 HydrophobicContact CD-CG1 4.17Å; K51-V175 PolarHBondContact NZ-O 3.34Å; K51-L176 HydrophobicContact CB-CD2 3.75Å; K51-T178 PolarHBondContact NZ-OG1 3.29Å
52	Q	97.3	Very high	96	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-39	175.5	-70.8	-74.1	20.4	0	0	113	T48 I49 L50 K54 I55 L56 L176 A326 T329 V332	T48-Q52 WeakPolarHBondContact O-CG 3.43Å; T48-Q52 PolarHBondContact O-N 3.1Å; I49-Q52 WeakPolarHBondContact O-CB 3.26Å; I49-Q52 PolarHBondContact O-N 2.78Å; L50-Q52 VanDerWaalsContact C-N 3.32Å; L50-Q52 PolarHBondContact O-N 2.79Å; Q52-K54 PolarHBondContact O-N 3.24Å; Q52-I55 PolarHBondContact O-N 2.92Å; Q52-I55 VanDerWaalsContact O-N 3.13Å; Q52-L56 WeakPolarHBondContact O-CB 3.5Å; Q52-L56 WeakPolarHBondContact O-CG 3.34Å; Q52-L56 PolarHBondContact O-N 2.89Å; Q52-L176 HydrophobicContact CG-CD2 3.91Å; Q52-A326 WeakPolarHBondContact CG-O 3.44Å; Q52-A326 PolarHBondContact NE2-O 3.3Å; Q52-T329 PolarHBondContact NE2-OG1 2.86Å; Q52-T329 PolarHBondContact OE1-OG1 3.26Å; Q52-V332 HydrophobicContact CB-CB 4.38Å; Q52-V332 HydrophobicContact CB-CG1 3.6Å; Q52-V332 HydrophobicContact CG-CB 4.25Å; Q52-V332 HydrophobicContact CG-CG1 3.95Å; Q52-V332 HydrophobicContact CG-CG2 4.13Å
53	M	95.4	Very high	96	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-37.3	170.7	-71	-80.1	-171	0	0	111.6	L36 I49 L50 H57 F190 L336 L340	L36-M53 HydrophobicContact CD1-CE 4.48Å; I49-M53 WeakPolarHBondContact O-CG 3.37Å; I49-M53 PolarHBondContact O-N 2.83Å; L50-M53 WeakPolarHBondContact O-CB 3.34Å; L50-M53 PolarHBondContact O-N 3.4Å; M53-H57 WeakPolarHBondContact O-CB 3.26Å; M53-H57 PolarHBondContact O-N 2.81Å; M53-F190 HydrophobicContact CB-CE1 4.2Å; M53-F190 HydrophobicContact CG-CE1 4.42Å; M53-F190 HydrophobicContact SD-CE1 3.69Å; M53-F190 HydrophobicContact SD-CZ 3.66Å; M53-L336 HydrophobicContact CE-CD1 3.58Å; M53-L336 HydrophobicContact CE-CD2 3.35Å; M53-L336 HydrophobicContact CE-CG 3.98Å; M53-L336 HydrophobicContact CG-CD1 4.08Å; M53-L336 HydrophobicContact SD-CD1 3.63Å; M53-L340 HydrophobicContact CE-CD2 4.48Å
54	K	95.5	Very high	96.1	Very high	43 Å²	43	42.3 Å²	42.3	19%	0.187	22%	0.218	C	C	.	.	H	α-helix	trans	-64.2	-44.9	174.3	-163.6	-168.7	-177.3	-156.4	0	111.4	L50 K51 Q52 K58 G60 F61 D65	L50-K54 PolarHBondContact O-N 2.94Å; L50-K54 VanDerWaalsContact O-N 3.13Å; K51-K54 WeakPolarHBondContact O-CA 3.44Å; K51-K54 VanDerWaalsContact O-CB 3.26Å; K51-K54 WeakPolarHBondContact O-CB 3.29Å; K51-K54 PolarHBondContact O-N 2.98Å; K51-K54 VanDerWaalsContact O-N 3.1Å; Q52-K54 PolarHBondContact O-N 3.24Å; K54-K58 HydrophobicContact CG-CB 4.18Å; K54-K58 HydrophobicContact CG-CD 4.41Å; K54-K58 CarbonylContact O-C 3.55Å; K54-K58 VanDerWaalsContact O-CA 3.24Å; K54-K58 WeakPolarHBondContact O-CA 3.37Å; K54-K58 PolarHBondContact O-N 2.8Å; K54-G60 VanDerWaalsContact CD-O 3.31Å; K54-G60 WeakPolarHBondContact CD-O 3.46Å; K54-G60 WeakPolarHBondContact CE-O 3.44Å; K54-G60 PolarHBondContact NZ-O 3.42Å; K54-G60 VanDerWaalsContact NZ-O 3.14Å; K54-G60 PolarHBondContact O-N 2.88Å; K54-F61 HydrophobicContact CD-CD1 4.04Å; K54-F61 HydrophobicContact CD-CE1 3.64Å; K54-F61 HydrophobicContact CD-CZ 4.05Å; K54-D65 IonicContact NZ-OD1 3.31Å; K54-D65 IonicContact NZ-OD2 2.72Å; K54-D65 PolarHBondContact NZ-OD2 2.87Å; K54-D65 VanDerWaalsContact NZ-OD2 3.08Å
55	I	96	Very high	96	Very high	30 Å²	30	44.8 Å²	44.8	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-51.1	177	-63.9	162.7	0	0	0	111.4	K51 Q52 F61 E172 L176 T329	K51-I55 WeakPolarHBondContact O-CG1 3.47Å; K51-I55 PolarHBondContact O-N 3.13Å; Q52-I55 PolarHBondContact O-N 2.92Å; Q52-I55 VanDerWaalsContact O-N 3.13Å; I55-F61 HydrophobicContact CD1-CD2 4.37Å; I55-F61 HydrophobicContact CD1-CE2 3.78Å; I55-F61 HydrophobicContact CG1-CD2 3.94Å; I55-F61 HydrophobicContact CG1-CE2 3.56Å; I55-E172 HydrophobicContact CD1-CG 3.53Å; I55-E172 HydrophobicContact CG1-CG 4.12Å; I55-E172 WeakPolarHBondContact CG1-OE2 3.37Å; I55-L176 HydrophobicContact CD1-CD1 3.93Å; I55-L176 HydrophobicContact CD1-CD2 3.89Å; I55-L176 HydrophobicContact CD1-CG 4.11Å; I55-T329 HydrophobicContact CG2-CG2 4.24Å
56	L	95.4	Very high	96.1	Very high	40 Å²	40	45.9 Å²	45.9	21%	0.209	23%	0.233	C	C	.	.	H	α-helix	trans	-78.7	-27.5	-170.4	-65.7	169.8	0	0	0	113.6	Q52 T329 V332 Q333 L336	Q52-L56 WeakPolarHBondContact O-CB 3.5Å; Q52-L56 WeakPolarHBondContact O-CG 3.34Å; Q52-L56 PolarHBondContact O-N 2.89Å; L56-T329 HydrophobicContact CD2-CG2 3.78Å; L56-T329 HydrophobicContact CG-CG2 4.42Å; L56-V332 HydrophobicContact CD1-CG1 4.15Å; L56-Q333 HydrophobicContact CD1-CB 3.92Å; L56-Q333 HydrophobicContact CD1-CG 4.47Å; L56-Q333 HydrophobicContact CD2-CB 3.82Å; L56-Q333 HydrophobicContact CD2-CG 3.99Å; L56-L336 HydrophobicContact CD1-CD1 4Å
57	H	93.7	Very high	96	Very high	44 Å²	44	49.5 Å²	49.5	20%	0.204	25%	0.25	C	S	.	.	H	α-helix	trans	-134.3	-1.8	-170.3	-52.3	-54.3	0	0	0	115	M53 F190	M53-H57 WeakPolarHBondContact O-CB 3.26Å; M53-H57 PolarHBondContact O-N 2.81Å; H57-F190 HydrophobicContact CB-CB 3.98Å; H57-F190 HydrophobicContact CB-CD1 4.11Å; H57-F190 HydrophobicContact CB-CD2 3.46Å; H57-F190 VanDerWaalsContact CB-CD2 3.46Å; H57-F190 HydrophobicContact CB-CE1 4.45Å; H57-F190 HydrophobicContact CB-CE2 3.86Å; H57-F190 HydrophobicContact CB-CG 3.6Å; H57-F190 HydrophobicContact CB-CZ 4.33Å; H57-F190 AromaticContact CD2-CE2 3.73Å; H57-F190 AromaticContact CD2-CZ 3.74Å; H57-F190 AromaticContact CG-CD2 3.95Å; H57-F190 AromaticContact CG-CE2 3.83Å; H57-F190 WeakPolarHBondContact O-CB 3.35Å
58	K	92.1	Very high	96	Very high	84 Å²	84	54 Å²	54	37%	0.365	27%	0.269	S	S	.	.	S	Bend	trans	-146.5	59.6	-176.6	-164.1	-171.3	178.9	163	0	113.2	K54 G60 V188 L189 F190	K54-K58 HydrophobicContact CG-CB 4.18Å; K54-K58 HydrophobicContact CG-CD 4.41Å; K54-K58 CarbonylContact O-C 3.55Å; K54-K58 VanDerWaalsContact O-CA 3.24Å; K54-K58 WeakPolarHBondContact O-CA 3.37Å; K54-K58 PolarHBondContact O-N 2.8Å; K58-G60 PolarHBondContact O-N 2.8Å; K58-V188 HydrophobicContact CD-CG1 3.76Å; K58-L189 WeakPolarHBondContact CD-O 3.1Å; K58-F190 HydrophobicContact CB-CB 4.42Å
59	D	93.2	Very high	96	Very high	172 Å²	172	54.1 Å²	54.1	92%	0.92	27%	0.269	S	S	*	.			trans	56.6	4.9	171	-50.5	-48.7	0	0	0	116.6
60	G	94.9	Very high	96	Very high	8 Å²	8	57.5 Å²	57.5	8%	0.082	28%	0.282	C	S	.	.			trans	65.2	-139	-179.5	0	0	0	0	0	114.9	K54 K58	K54-G60 VanDerWaalsContact CD-O 3.31Å; K54-G60 WeakPolarHBondContact CD-O 3.46Å; K54-G60 WeakPolarHBondContact CE-O 3.44Å; K54-G60 PolarHBondContact NZ-O 3.42Å; K54-G60 VanDerWaalsContact NZ-O 3.14Å; K54-G60 PolarHBondContact O-N 2.88Å; K58-G60 PolarHBondContact O-N 2.8Å
61	F	96.2	Very high	96	Very high	34 Å²	34	59.7 Å²	59.7	15%	0.149	30%	0.296	C	S	.	.			trans	-114.7	132.9	-175.1	-62.9	-77.6	0	0	0	110.8	K51 K54 I55 D65 F66 E172 V175	K51-F61 HydrophobicContact CB-CE2 4.41Å; K51-F61 HydrophobicContact CB-CZ 3.81Å; K51-F61 HydrophobicContact CG-CZ 3.89Å; K54-F61 HydrophobicContact CD-CD1 4.04Å; K54-F61 HydrophobicContact CD-CE1 3.64Å; K54-F61 HydrophobicContact CD-CZ 4.05Å; I55-F61 HydrophobicContact CD1-CD2 4.37Å; I55-F61 HydrophobicContact CD1-CE2 3.78Å; I55-F61 HydrophobicContact CG1-CD2 3.94Å; I55-F61 HydrophobicContact CG1-CE2 3.56Å; F61-D65 HydrophobicContact CB-CB 4.04Å; F61-D65 HydrophobicContact CD1-CB 4.04Å; F61-F66 HydrophobicContact CB-CD1 4.32Å; F61-F66 HydrophobicContact CB-CE1 3.57Å; F61-F66 HydrophobicContact CB-CZ 3.78Å; F61-F66 HydrophobicContact CG-CE1 4.37Å; F61-E172 HydrophobicContact CD2-CG 4.2Å; F61-V175 HydrophobicContact CD1-CG1 4.04Å; F61-V175 HydrophobicContact CD2-CG1 4.15Å; F61-V175 HydrophobicContact CE1-CG1 3.69Å; F61-V175 HydrophobicContact CE2-CB 4.46Å; F61-V175 HydrophobicContact CE2-CG1 3.78Å; F61-V175 HydrophobicContact CG-CG1 4.28Å; F61-V175 HydrophobicContact CZ-CG1 3.56Å
62	S	96.1	Very high	96.1	Very high	57 Å²	57	59.4 Å²	59.4	40%	0.399	30%	0.298	S	S	.	.			trans	-79.8	166.3	175.1	65	0	0	0	0	111.6	H64 D65 F66	S62-H64 PolarHBondContact O-N 2.72Å; S62-D65 PolarHBondContact N-OD2 3.39Å; S62-D65 WeakPolarHBondContact O-CB 3.29Å; S62-D65 PolarHBondContact O-N 3.18Å; S62-D65 VanDerWaalsContact OG-CG 3.28Å; S62-D65 PolarHBondContact OG-N 2.88Å; S62-D65 VanDerWaalsContact OG-N 3.17Å; S62-D65 PolarHBondContact OG-OD2 3.42Å; S62-F66 WeakPolarHBondContact O-CD2 3.21Å; S62-F66 PolarHBondContact O-N 2.73Å
63	Q	95.7	Very high	96.2	Very high	131 Å²	131	59.4 Å²	59.4	61%	0.612	30%	0.298	S	S	*	.	H	α-helix	trans	-57	-38	171.2	-176.5	176.5	-12.6	0	0	112.2	D65 F66 E67 L169	Q63-D65 VanDerWaalsContact C-N 3.32Å; Q63-D65 PolarHBondContact O-N 3.28Å; Q63-F66 WeakPolarHBondContact O-CB 3.37Å; Q63-F66 PolarHBondContact O-N 3.35Å; Q63-F66 VanDerWaalsContact O-N 3.14Å; Q63-E67 PolarHBondContact NE2-OE1 3.26Å; Q63-E67 PolarHBondContact O-N 3.14Å; Q63-L169 HydrophobicContact CG-CD2 4.4Å
64	H	96.7	Very high	96.3	Very high	114 Å²	114	59.7 Å²	59.7	53%	0.528	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-38.4	175.2	-177.1	61.9	0	0	0	112.1	S62 F66 E67 M68	S62-H64 PolarHBondContact O-N 2.72Å; H64-F66 VanDerWaalsContact C-N 3.28Å; H64-F66 PolarHBondContact O-N 3.5Å; H64-E67 PolarHBondContact O-N 3.31Å; H64-M68 WeakPolarHBondContact O-CB 3.38Å; H64-M68 VanDerWaalsContact O-CG 3.28Å; H64-M68 WeakPolarHBondContact O-CG 3.32Å; H64-M68 PolarHBondContact O-N 3.05Å
65	D	96	Very high	96.5	Very high	52 Å²	52	58.9 Å²	58.9	28%	0.278	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-39.7	173.7	-66.8	-61.2	0	0	0	111.2	K54 F61 S62 Q63 M68 I69	K54-D65 IonicContact NZ-OD1 3.31Å; K54-D65 IonicContact NZ-OD2 2.72Å; K54-D65 PolarHBondContact NZ-OD2 2.87Å; K54-D65 VanDerWaalsContact NZ-OD2 3.08Å; F61-D65 HydrophobicContact CB-CB 4.04Å; F61-D65 HydrophobicContact CD1-CB 4.04Å; S62-D65 PolarHBondContact N-OD2 3.39Å; S62-D65 WeakPolarHBondContact O-CB 3.29Å; S62-D65 PolarHBondContact O-N 3.18Å; S62-D65 VanDerWaalsContact OG-CG 3.28Å; S62-D65 PolarHBondContact OG-N 2.88Å; S62-D65 VanDerWaalsContact OG-N 3.17Å; S62-D65 PolarHBondContact OG-OD2 3.42Å; Q63-D65 VanDerWaalsContact C-N 3.32Å; Q63-D65 PolarHBondContact O-N 3.28Å; D65-M68 PolarHBondContact O-N 3.15Å; D65-I69 PolarHBondContact O-N 3.22Å; D65-I69 VanDerWaalsContact O-N 3.07Å
66	F	97.8	Very high	96.6	Very high	35 Å²	35	58.3 Å²	58.3	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-37.3	176.8	-59.7	-39.8	0	0	0	113	F61 S62 Q63 H64 I69 R70 L169 P170 V175	F61-F66 HydrophobicContact CB-CD1 4.32Å; F61-F66 HydrophobicContact CB-CE1 3.57Å; F61-F66 HydrophobicContact CB-CZ 3.78Å; F61-F66 HydrophobicContact CG-CE1 4.37Å; S62-F66 WeakPolarHBondContact O-CD2 3.21Å; S62-F66 PolarHBondContact O-N 2.73Å; Q63-F66 WeakPolarHBondContact O-CB 3.37Å; Q63-F66 PolarHBondContact O-N 3.35Å; Q63-F66 VanDerWaalsContact O-N 3.14Å; H64-F66 VanDerWaalsContact C-N 3.28Å; H64-F66 PolarHBondContact O-N 3.5Å; F66-I69 WeakPolarHBondContact O-CG2 3.42Å; F66-R70 PolarHBondContact O-N 3.28Å; F66-L169 HydrophobicContact CB-CD1 3.83Å; F66-L169 HydrophobicContact CB-CD2 4.37Å; F66-L169 HydrophobicContact CB-CG 3.97Å; F66-P170 WeakPolarHBondContact CB-O 3.46Å; F66-P170 VanDerWaalsContact CG-O 3.28Å; F66-P170 WeakPolarHBondContact CG-O 3.43Å; F66-P170 WeakPolarHBondContact O-CD 3.31Å; F66-P170 WeakPolarHBondContact O-CG 3.4Å; F66-V175 HydrophobicContact CD1-CG2 3.68Å; F66-V175 HydrophobicContact CE1-CG2 3.8Å
67	E	97.3	Very high	96.7	Very high	86 Å²	86	56.4 Å²	56.4	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-43.1	173.7	-71.7	168.9	-173.4	0	0	111.3	Q63 H64 I69 R70 L169	Q63-E67 PolarHBondContact NE2-OE1 3.26Å; Q63-E67 PolarHBondContact O-N 3.14Å; H64-E67 PolarHBondContact O-N 3.31Å; E67-I69 PolarHBondContact O-N 3.25Å; E67-R70 WeakPolarHBondContact O-CB 2.96Å; E67-R70 PolarHBondContact O-N 2.99Å; E67-L169 HydrophobicContact CG-CD1 3.93Å
68	M	96.9	Very high	97	Very high	126 Å²	126	54.3 Å²	54.3	62%	0.621	28%	0.276	S	S	*	.	H	α-helix	trans	-68.1	-30.7	-179.8	-71.6	-59.6	-60.3	0	0	113.5	H64 D65	H64-M68 WeakPolarHBondContact O-CB 3.38Å; H64-M68 VanDerWaalsContact O-CG 3.28Å; H64-M68 WeakPolarHBondContact O-CG 3.32Å; H64-M68 PolarHBondContact O-N 3.05Å; D65-M68 PolarHBondContact O-N 3.15Å
69	I	97.4	Very high	97.3	Very high	26 Å²	26	53.6 Å²	53.6	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-83.4	-17.3	177.7	-155.9	64.5	0	0	0	113	D65 F66 E67 V72 V73 P170 V175 T178	D65-I69 PolarHBondContact O-N 3.22Å; D65-I69 VanDerWaalsContact O-N 3.07Å; F66-I69 WeakPolarHBondContact O-CG2 3.42Å; E67-I69 PolarHBondContact O-N 3.25Å; I69-V72 HydrophobicContact CD1-CB 3.94Å; I69-V72 HydrophobicContact CD1-CG1 4.24Å; I69-V72 HydrophobicContact CD1-CG2 4Å; I69-V72 HydrophobicContact CG1-CB 4.32Å; I69-V72 WeakPolarHBondContact O-CA 3.46Å; I69-V72 VanDerWaalsContact O-CB 3.29Å; I69-V72 WeakPolarHBondContact O-CB 3.27Å; I69-V72 PolarHBondContact O-N 2.82Å; I69-V73 PolarHBondContact O-N 2.89Å; I69-V73 VanDerWaalsContact O-N 3.13Å; I69-P170 HydrophobicContact CG2-CB 3.57Å; I69-P170 HydrophobicContact CG2-CG 3.67Å; I69-V175 HydrophobicContact CG2-CG2 3.89Å; I69-T178 HydrophobicContact CD1-CG2 4.21Å; I69-T178 HydrophobicContact CG1-CG2 3.71Å
70	R	98.1	Very high	97.6	Very high	72 Å²	72	45.6 Å²	45.6	27%	0.272	23%	0.232	S	C	.	.	H	α-helix	trans	-51.9	-47.6	-175.2	-176.9	-169.5	-68.1	174.1	-8.4	113.4	F66 E67 V72 V73 Y74 F168 P170	F66-R70 PolarHBondContact O-N 3.28Å; E67-R70 WeakPolarHBondContact O-CB 2.96Å; E67-R70 PolarHBondContact O-N 2.99Å; R70-V72 PolarHBondContact O-N 2.62Å; R70-V73 PolarHBondContact O-N 3.17Å; R70-V73 VanDerWaalsContact O-N 3.14Å; R70-Y74 HydrophobicContact CG-CD2 4.22Å; R70-Y74 HydrophobicContact CG-CE2 3.57Å; R70-Y74 WeakPolarHBondContact O-CD2 3.31Å; R70-Y74 PolarHBondContact O-N 2.82Å; R70-F168 HydrophobicContact CG-CD1 4Å; R70-F168 HydrophobicContact CG-CE1 4.05Å; R70-F168 PolarHBondContact NE-O 3.08Å; R70-F168 PolarHBondContact NH2-O 3.14Å; R70-P170 HydrophobicContact CB-CG 3.75Å; R70-P170 HydrophobicContact CG-CG 4.23Å
71	P	98.3	Very high	97.7	Very high	56 Å²	56	45.2 Å²	45.2	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-31.4	177.2	-23	35.5	0	0	0	113.5	S75 A117	P71-S75 WeakPolarHBondContact O-CB 3.21Å; P71-S75 PolarHBondContact O-N 3.45Å; P71-A117 WeakPolarHBondContact CA-O 3.46Å; P71-A117 HydrophobicContact CB-CB 4.01Å; P71-A117 WeakPolarHBondContact CB-O 3.47Å
72	V	98.3	Very high	97.9	Very high	37 Å²	37	43.7 Å²	43.7	22%	0.224	22%	0.221	C	C	.	.	H	α-helix	trans	-69.8	-38.1	177.8	-177.3	0	0	0	0	111	I69 R70 S75 N76 T178 V180	I69-V72 HydrophobicContact CD1-CB 3.94Å; I69-V72 HydrophobicContact CD1-CG1 4.24Å; I69-V72 HydrophobicContact CD1-CG2 4Å; I69-V72 HydrophobicContact CG1-CB 4.32Å; I69-V72 WeakPolarHBondContact O-CA 3.46Å; I69-V72 VanDerWaalsContact O-CB 3.29Å; I69-V72 WeakPolarHBondContact O-CB 3.27Å; I69-V72 PolarHBondContact O-N 2.82Å; R70-V72 PolarHBondContact O-N 2.62Å; V72-S75 PolarHBondContact O-N 2.82Å; V72-N76 VanDerWaalsContact O-CB 3.3Å; V72-N76 WeakPolarHBondContact O-CB 3.05Å; V72-N76 PolarHBondContact O-N 3.17Å; V72-T178 HydrophobicContact CG1-CG2 4.2Å; V72-V180 HydrophobicContact CG1-CG2 3.65Å; V72-V180 HydrophobicContact CG2-CG2 4.37Å
73	V	98.5	Very high	98	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-47.2	175.9	177.2	0	0	0	0	110.6	I69 R70 N76 T77 F156 L163 F168 P170 D174 T178	I69-V73 PolarHBondContact O-N 2.89Å; I69-V73 VanDerWaalsContact O-N 3.13Å; R70-V73 PolarHBondContact O-N 3.17Å; R70-V73 VanDerWaalsContact O-N 3.14Å; V73-N76 PolarHBondContact O-N 3.02Å; V73-T77 WeakPolarHBondContact O-CB 3.28Å; V73-T77 PolarHBondContact O-N 2.92Å; V73-T77 PolarHBondContact O-OG1 3.42Å; V73-F156 HydrophobicContact CG1-CD1 3.87Å; V73-F156 HydrophobicContact CG1-CE1 3.63Å; V73-F156 HydrophobicContact CG1-CZ 4.32Å; V73-F156 HydrophobicContact CG2-CE1 4.43Å; V73-L163 HydrophobicContact CG1-CD2 3.89Å; V73-L163 HydrophobicContact CG1-CG 4.19Å; V73-F168 HydrophobicContact CB-CE1 4.39Å; V73-F168 HydrophobicContact CB-CZ 4.44Å; V73-F168 HydrophobicContact CG1-CE1 4.17Å; V73-F168 HydrophobicContact CG1-CZ 3.84Å; V73-P170 HydrophobicContact CG2-CB 4.25Å; V73-P170 HydrophobicContact CG2-CG 4.01Å; V73-D174 HydrophobicContact CG2-CB 4.09Å; V73-T178 HydrophobicContact CG2-CG2 3.55Å
74	Y	98.6	Very high	98.1	Very high	7 Å²	7	35.7 Å²	35.7	3%	0.027	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-51.2	175.8	-65.8	-45.5	0	0	0	111.5	R70 N76 T77 V78 D116 E118 P119 F120 L163 F168	R70-Y74 HydrophobicContact CG-CD2 4.22Å; R70-Y74 HydrophobicContact CG-CE2 3.57Å; R70-Y74 WeakPolarHBondContact O-CD2 3.31Å; R70-Y74 PolarHBondContact O-N 2.82Å; Y74-N76 PolarHBondContact O-N 3.07Å; Y74-T77 WeakPolarHBondContact O-CB 3.24Å; Y74-T77 PolarHBondContact O-N 3.41Å; Y74-T77 VanDerWaalsContact O-N 3.14Å; Y74-V78 WeakPolarHBondContact O-CG2 3.37Å; Y74-V78 PolarHBondContact O-N 2.78Å; Y74-D116 CarbonylContact C-O 3.37Å; Y74-D116 WeakPolarHBondContact CB-O 3.45Å; Y74-E118 WeakPolarHBondContact CD2-O 3.44Å; Y74-P119 HydrophobicContact CE2-CB 4.24Å; Y74-P119 HydrophobicContact CE2-CG 4.04Å; Y74-F120 AromaticContact CD1-CD1 3.96Å; Y74-F120 HydrophobicContact CD1-CD1 3.96Å; Y74-F120 AromaticContact CD1-CE1 3.54Å; Y74-F120 HydrophobicContact CD1-CE1 3.54Å; Y74-F120 HydrophobicContact CD1-CE2 4.23Å; Y74-F120 HydrophobicContact CD1-CG 4.47Å; Y74-F120 AromaticContact CD1-CZ 3.69Å; Y74-F120 HydrophobicContact CD1-CZ 3.69Å; Y74-F120 HydrophobicContact CE1-CE1 4.45Å; Y74-F120 HydrophobicContact CE1-CZ 4.49Å; Y74-F120 HydrophobicContact CG-CE1 4.07Å; Y74-L163 WeakPolarHBondContact CE1-O 3.45Å; Y74-F168 AromaticContact CE1-CD1 3.79Å; Y74-F168 HydrophobicContact CE1-CD1 3.79Å; Y74-F168 HydrophobicContact CE1-CE1 4.09Å; Y74-F168 HydrophobicContact CE2-CD1 4.5Å; Y74-F168 AromaticContact CZ-CD1 3.61Å; Y74-F168 VanDerWaalsContact OH-CD1 3.3Å; Y74-F168 WeakPolarHBondContact OH-CD1 2.97Å
75	S	98.6	Very high	98.2	Very high	26 Å²	26	30.6 Å²	30.6	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-61.5	-47.6	-178.7	-176.4	0	0	0	0	111.5	P71 V72 T77 V78 H79 D116	P71-S75 WeakPolarHBondContact O-CB 3.21Å; P71-S75 PolarHBondContact O-N 3.45Å; V72-S75 PolarHBondContact O-N 2.82Å; S75-T77 VanDerWaalsContact C-N 3.26Å; S75-T77 PolarHBondContact O-N 3.18Å; S75-V78 PolarHBondContact O-N 2.86Å; S75-H79 WeakPolarHBondContact O-CB 3.31Å; S75-H79 PolarHBondContact O-CD2 2.86Å; S75-H79 PolarHBondContact O-N 3.37Å; S75-H79 PolarHBondContact OG-CD2 3.04Å; S75-D116 WeakPolarHBondContact CA-O 3.26Å; S75-D116 PolarHBondContact N-O 2.84Å; S75-D116 PolarHBondContact OG-OD2 3.22Å
76	N	98.6	Very high	98.3	Very high	17 Å²	17	34.5 Å²	34.5	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-57.8	-38.1	176.7	-72.1	175.4	0	0	0	112.5	V72 V73 Y74 A80 F156 T178 R179	V72-N76 VanDerWaalsContact O-CB 3.3Å; V72-N76 WeakPolarHBondContact O-CB 3.05Å; V72-N76 PolarHBondContact O-N 3.17Å; V73-N76 PolarHBondContact O-N 3.02Å; Y74-N76 PolarHBondContact O-N 3.07Å; N76-A80 WeakPolarHBondContact O-CB 3.19Å; N76-A80 PolarHBondContact O-N 2.86Å; N76-F156 HydrophobicContact CB-CE2 4.36Å; N76-T178 WeakPolarHBondContact OD1-CA 3.37Å; N76-R179 PolarHBondContact ND2-O 2.99Å; N76-R179 PolarHBondContact OD1-N 3.01Å; N76-R179 PolarHBondContact OD1-O 3.35Å
77	T	98.8	Very high	98.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.9	-47.1	179.1	-54	0	0	0	0	111.8	V73 Y74 S75 A80 M81 F120 F156 L157 L160 L163	V73-T77 WeakPolarHBondContact O-CB 3.28Å; V73-T77 PolarHBondContact O-N 2.92Å; V73-T77 PolarHBondContact O-OG1 3.42Å; Y74-T77 WeakPolarHBondContact O-CB 3.24Å; Y74-T77 PolarHBondContact O-N 3.41Å; Y74-T77 VanDerWaalsContact O-N 3.14Å; S75-T77 VanDerWaalsContact C-N 3.26Å; S75-T77 PolarHBondContact O-N 3.18Å; T77-A80 WeakPolarHBondContact O-CB 3.18Å; T77-A80 PolarHBondContact O-N 2.99Å; T77-M81 PolarHBondContact O-N 3.15Å; T77-M81 VanDerWaalsContact O-N 3.14Å; T77-F120 HydrophobicContact CG2-CE2 4.29Å; T77-F120 HydrophobicContact CG2-CZ 3.91Å; T77-F156 HydrophobicContact CG2-CB 4.15Å; T77-F156 WeakPolarHBondContact OG1-CB 3.35Å; T77-L157 HydrophobicContact CG2-CD2 4.05Å; T77-L160 HydrophobicContact CG2-CD2 3.77Å; T77-L163 HydrophobicContact CG2-CD2 3.9Å; T77-L163 WeakPolarHBondContact OG1-CD2 3.4Å
78	V	98.7	Very high	98.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65	-43.9	178.9	175.3	0	0	0	0	110.7	Y74 S75 A80 M81 L82 V107 V111 D116 F120 L124	Y74-V78 WeakPolarHBondContact O-CG2 3.37Å; Y74-V78 PolarHBondContact O-N 2.78Å; S75-V78 PolarHBondContact O-N 2.86Å; V78-A80 VanDerWaalsContact C-N 3.33Å; V78-A80 PolarHBondContact O-N 3.33Å; V78-M81 PolarHBondContact O-N 3.25Å; V78-L82 WeakPolarHBondContact O-CB 3.35Å; V78-L82 PolarHBondContact O-N 3.31Å; V78-V107 HydrophobicContact CG1-CG1 4.28Å; V78-V111 HydrophobicContact CG1-CG2 3.47Å; V78-V111 VanDerWaalsContact CG1-CG2 3.47Å; V78-D116 HydrophobicContact CB-CB 4.04Å; V78-D116 HydrophobicContact CG1-CB 3.85Å; V78-D116 HydrophobicContact CG2-CB 4.45Å; V78-F120 HydrophobicContact CG2-CD1 4.4Å; V78-F120 HydrophobicContact CG2-CE1 3.64Å; V78-F120 HydrophobicContact CG2-CZ 4.27Å; V78-L124 HydrophobicContact CG2-CD2 4.28Å
79	H	98.5	Very high	98.4	Very high	70 Å²	70	32.3 Å²	32.3	32%	0.324	15%	0.151	S	C	.	.	H	α-helix	trans	-69	-29.6	177.1	-77.8	-78.9	0	0	0	112.9	S75 L82 A83 D116	S75-H79 WeakPolarHBondContact O-CB 3.31Å; S75-H79 PolarHBondContact O-CD2 2.86Å; S75-H79 PolarHBondContact O-N 3.37Å; S75-H79 PolarHBondContact OG-CD2 3.04Å; H79-L82 PolarHBondContact O-N 3.08Å; H79-A83 WeakPolarHBondContact O-CB 3.45Å; H79-A83 PolarHBondContact O-N 2.95Å; H79-D116 IonicContact CD2-OD2 2.85Å; H79-D116 PolarHBondContact CD2-OD2 3.05Å; H79-D116 VanDerWaalsContact CD2-OD2 3.31Å; H79-D116 IonicContact NE2-OD2 3.25Å; H79-D116 PolarHBondContact NE2-OD2 3.09Å
80	A	98.7	Very high	98.4	Very high	4 Å²	4	37.4 Å²	37.4	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-48.6	170.9	0	0	0	0	0	111.2	N76 T77 V78 A83 V84 A153 L157	N76-A80 WeakPolarHBondContact O-CB 3.19Å; N76-A80 PolarHBondContact O-N 2.86Å; T77-A80 WeakPolarHBondContact O-CB 3.18Å; T77-A80 PolarHBondContact O-N 2.99Å; V78-A80 VanDerWaalsContact C-N 3.33Å; V78-A80 PolarHBondContact O-N 3.33Å; A80-A83 PolarHBondContact O-N 3.04Å; A80-V84 WeakPolarHBondContact O-CG2 3.43Å; A80-V84 PolarHBondContact O-N 2.92Å; A80-A153 HydrophobicContact CB-CB 3.67Å; A80-L157 HydrophobicContact CB-CD1 4.27Å; A80-L157 HydrophobicContact CB-CG 4.49Å
81	M	98.9	Very high	98.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-45.1	174.7	-177.3	58.2	70.8	0	0	111.3	T77 V78 A83 V84 L85 V107 L128 L131 W132 V137 L157	T77-M81 PolarHBondContact O-N 3.15Å; T77-M81 VanDerWaalsContact O-N 3.14Å; V78-M81 PolarHBondContact O-N 3.25Å; M81-A83 VanDerWaalsContact C-N 3.27Å; M81-A83 PolarHBondContact O-N 3.19Å; M81-V84 PolarHBondContact O-N 3.29Å; M81-V84 VanDerWaalsContact O-N 3.11Å; M81-L85 HydrophobicContact CG-CD1 4Å; M81-L85 HydrophobicContact CG-CG 4.2Å; M81-L85 WeakPolarHBondContact O-CG 3.45Å; M81-L85 PolarHBondContact O-N 3.44Å; M81-L85 HydrophobicContact SD-CD2 4.48Å; M81-L85 HydrophobicContact SD-CG 4.24Å; M81-V107 HydrophobicContact CG-CG1 4.31Å; M81-V107 HydrophobicContact CG-CG2 4.17Å; M81-L128 HydrophobicContact CB-CD2 3.7Å; M81-L128 HydrophobicContact CE-CD2 4.48Å; M81-L128 HydrophobicContact CG-CD2 3.75Å; M81-L131 HydrophobicContact CE-CB 3.7Å; M81-L131 HydrophobicContact CG-CD1 4.08Å; M81-L131 HydrophobicContact SD-CB 3.84Å; M81-L131 HydrophobicContact SD-CD1 4.14Å; M81-W132 HydrophobicContact CE-CB 3.93Å; M81-W132 HydrophobicContact CE-CE3 4.31Å; M81-V137 HydrophobicContact SD-CG1 4.22Å; M81-L157 HydrophobicContact CB-CD2 4.26Å; M81-L157 HydrophobicContact CE-CD1 4.5Å; M81-L157 HydrophobicContact CE-CD2 3.97Å
82	L	98.7	Very high	98.4	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-56.8	-40.3	177.5	-175.4	69.9	0	0	0	112.4	V78 H79 L85 R86 V107 Y108 V111	V78-L82 WeakPolarHBondContact O-CB 3.35Å; V78-L82 PolarHBondContact O-N 3.31Å; H79-L82 PolarHBondContact O-N 3.08Å; L82-L85 PolarHBondContact O-N 2.8Å; L82-R86 WeakPolarHBondContact O-CB 3.34Å; L82-R86 WeakPolarHBondContact O-CG 3.43Å; L82-R86 PolarHBondContact O-N 3.15Å; L82-V107 HydrophobicContact CB-CG1 4.42Å; L82-Y108 HydrophobicContact CD1-CD1 3.44Å; L82-Y108 VanDerWaalsContact CD1-CD1 3.44Å; L82-Y108 HydrophobicContact CD1-CE1 3.34Å; L82-Y108 HydrophobicContact CD1-CG 4.3Å; L82-V111 HydrophobicContact CD2-CB 4.47Å; L82-V111 HydrophobicContact CD2-CG1 4.07Å; L82-V111 HydrophobicContact CD2-CG2 4.11Å
83	A	98.6	Very high	98.4	Very high	21 Å²	21	39.2 Å²	39.2	17%	0.174	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-45	176.6	0	0	0	0	0	111.4	H79 A80 M81 R86 A87 I149	H79-A83 WeakPolarHBondContact O-CB 3.45Å; H79-A83 PolarHBondContact O-N 2.95Å; A80-A83 PolarHBondContact O-N 3.04Å; M81-A83 VanDerWaalsContact C-N 3.27Å; M81-A83 PolarHBondContact O-N 3.19Å; A83-R86 PolarHBondContact O-N 3.37Å; A83-A87 WeakPolarHBondContact O-CB 3.28Å; A83-A87 PolarHBondContact O-N 3.04Å; A83-I149 HydrophobicContact CB-CB 4.35Å; A83-I149 HydrophobicContact CB-CD1 4.35Å; A83-I149 HydrophobicContact CB-CG1 4.27Å
84	V	98.8	Very high	98.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-46.8	175.5	-177.1	0	0	0	0	110.9	A80 M81 R86 A87 M88 V137 C140 Y141 I149	A80-V84 WeakPolarHBondContact O-CG2 3.43Å; A80-V84 PolarHBondContact O-N 2.92Å; M81-V84 PolarHBondContact O-N 3.29Å; M81-V84 VanDerWaalsContact O-N 3.11Å; V84-R86 VanDerWaalsContact C-N 3.32Å; V84-R86 PolarHBondContact O-N 2.88Å; V84-A87 CarbonylContact O-C 3.58Å; V84-A87 WeakPolarHBondContact O-CB 3.5Å; V84-A87 PolarHBondContact O-N 2.98Å; V84-A87 VanDerWaalsContact O-N 3.11Å; V84-M88 HydrophobicContact CG1-CG 4.49Å; V84-M88 WeakPolarHBondContact O-CG 3.47Å; V84-M88 PolarHBondContact O-N 3.41Å; V84-V137 HydrophobicContact CG1-CG1 3.83Å; V84-C140 HydrophobicContact CG1-CB 4.04Å; V84-Y141 HydrophobicContact CG2-CD2 4.02Å; V84-I149 HydrophobicContact CG2-CD1 3.61Å
85	L	98.7	Very high	98.4	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-38.8	179.7	-66.7	174.8	0	0	0	112.9	M81 L82 M88 F95 A104 V107 Y108 L131	M81-L85 HydrophobicContact CG-CD1 4Å; M81-L85 HydrophobicContact CG-CG 4.2Å; M81-L85 WeakPolarHBondContact O-CG 3.45Å; M81-L85 PolarHBondContact O-N 3.44Å; M81-L85 HydrophobicContact SD-CD2 4.48Å; M81-L85 HydrophobicContact SD-CG 4.24Å; L82-L85 PolarHBondContact O-N 2.8Å; L85-M88 HydrophobicContact CD2-SD 4.35Å; L85-F95 HydrophobicContact CD2-CE1 3.79Å; L85-F95 HydrophobicContact CD2-CZ 3.76Å; L85-A104 HydrophobicContact CD1-CB 4Å; L85-A104 HydrophobicContact CD2-CB 3.91Å; L85-V107 HydrophobicContact CD1-CB 3.91Å; L85-V107 HydrophobicContact CD1-CG1 3.98Å; L85-V107 HydrophobicContact CD1-CG2 4.24Å; L85-Y108 HydrophobicContact CB-CE2 4.35Å; L85-Y108 HydrophobicContact CD1-CE2 4.39Å; L85-L131 HydrophobicContact CD1-CD1 4.27Å; L85-L131 HydrophobicContact CD2-CD1 4.42Å; L85-L131 HydrophobicContact CD2-CD2 4.03Å
86	R	98.4	Very high	98.4	Very high	134 Å²	134	50.2 Å²	50.2	51%	0.506	24%	0.243	S	C	.	.	H	α-helix	trans	-68.3	-40.4	174.3	-74.6	173.6	172.4	164.3	-0.7	111.6	L82 A83 V84 M88 Y89 Q90 Y108	L82-R86 WeakPolarHBondContact O-CB 3.34Å; L82-R86 WeakPolarHBondContact O-CG 3.43Å; L82-R86 PolarHBondContact O-N 3.15Å; A83-R86 PolarHBondContact O-N 3.37Å; V84-R86 VanDerWaalsContact C-N 3.32Å; V84-R86 PolarHBondContact O-N 2.88Å; R86-M88 VanDerWaalsContact C-N 3.34Å; R86-Y89 PolarHBondContact O-N 3.4Å; R86-Q90 WeakPolarHBondContact O-CG 3.45Å; R86-Q90 PolarHBondContact O-N 2.8Å; R86-Q90 VanDerWaalsContact O-N 3.16Å; R86-Y108 HydrophobicContact CG-CE1 4.32Å
87	A	98.5	Very high	98.4	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-34.7	177.1	0	0	0	0	0	112.3	A83 V84 Y89 Q90 L91 Y147	A83-A87 WeakPolarHBondContact O-CB 3.28Å; A83-A87 PolarHBondContact O-N 3.04Å; V84-A87 CarbonylContact O-C 3.58Å; V84-A87 WeakPolarHBondContact O-CB 3.5Å; V84-A87 PolarHBondContact O-N 2.98Å; V84-A87 VanDerWaalsContact O-N 3.11Å; A87-Y89 VanDerWaalsContact C-N 3.29Å; A87-Y89 PolarHBondContact O-N 2.86Å; A87-Q90 PolarHBondContact O-N 3.29Å; A87-Q90 VanDerWaalsContact O-N 3.16Å; A87-L91 VanDerWaalsContact O-CB 3.3Å; A87-L91 WeakPolarHBondContact O-CB 3.47Å; A87-L91 VanDerWaalsContact O-CG 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.3Å; A87-L91 PolarHBondContact O-N 2.96Å; A87-Y147 HydrophobicContact CB-CD1 3.44Å; A87-Y147 VanDerWaalsContact CB-CD1 3.44Å; A87-Y147 HydrophobicContact CB-CD2 3.58Å; A87-Y147 HydrophobicContact CB-CE1 3.55Å; A87-Y147 HydrophobicContact CB-CE2 3.68Å; A87-Y147 HydrophobicContact CB-CG 3.44Å; A87-Y147 VanDerWaalsContact CB-CG 3.44Å
88	M	98.6	Very high	98.3	Very high	7 Å²	7	57 Å²	57	3%	0.034	29%	0.285	C	S	.	.	H	α-helix	trans	-55.8	-46.1	174.1	-75.5	-178.2	76.6	0	0	111.3	V84 L85 R86 L91 N92 I93 F95 V137 C140	V84-M88 HydrophobicContact CG1-CG 4.49Å; V84-M88 WeakPolarHBondContact O-CG 3.47Å; V84-M88 PolarHBondContact O-N 3.41Å; L85-M88 HydrophobicContact CD2-SD 4.35Å; R86-M88 VanDerWaalsContact C-N 3.34Å; M88-L91 PolarHBondContact O-N 3.17Å; M88-N92 PolarHBondContact O-N 3.45Å; M88-N92 VanDerWaalsContact O-N 3.07Å; M88-I93 HydrophobicContact CE-CG2 4.25Å; M88-I93 WeakPolarHBondContact CE-O 3.01Å; M88-I93 PolarHBondContact O-N 3.04Å; M88-F95 HydrophobicContact CE-CD1 3.56Å; M88-F95 HydrophobicContact CE-CE1 3.67Å; M88-F95 HydrophobicContact CE-CG 4.06Å; M88-F95 HydrophobicContact CE-CZ 4.24Å; M88-F95 HydrophobicContact SD-CD1 4.16Å; M88-F95 HydrophobicContact SD-CE1 3.67Å; M88-F95 HydrophobicContact SD-CZ 4.21Å; M88-V137 HydrophobicContact CE-CG2 4.16Å; M88-V137 HydrophobicContact SD-CB 4.28Å; M88-V137 HydrophobicContact SD-CG2 3.63Å; M88-C140 HydrophobicContact CG-CB 3.43Å; M88-C140 VanDerWaalsContact CG-CB 3.43Å; M88-C140 VanDerWaalsContact CG-SG 3.53Å; M88-C140 PolarHBondContact N-SG 3.14Å; M88-C140 HydrophobicContact SD-CB 4.48Å
89	Y	97.3	Very high	98.3	Very high	193 Å²	193	61.6 Å²	61.6	76%	0.757	31%	0.306	S	S	*	.	H	α-helix	trans	-62.8	-46.8	175	-179.6	-100.1	0	0	0	112.2	R86 A87 L91 N92	R86-Y89 PolarHBondContact O-N 3.4Å; A87-Y89 VanDerWaalsContact C-N 3.29Å; A87-Y89 PolarHBondContact O-N 2.86Å; Y89-L91 VanDerWaalsContact C-N 3.31Å; Y89-L91 PolarHBondContact O-N 2.96Å; Y89-N92 PolarHBondContact O-N 3.29Å
90	Q	97.1	Very high	98.3	Very high	133 Å²	133	60 Å²	60	62%	0.621	30%	0.297	S	S	*	.	H	α-helix	trans	-64.1	-34.4	-179.4	-69.8	174.4	-14.3	0	0	113.3	R86 A87	R86-Q90 WeakPolarHBondContact O-CG 3.45Å; R86-Q90 PolarHBondContact O-N 2.8Å; R86-Q90 VanDerWaalsContact O-N 3.16Å; A87-Q90 PolarHBondContact O-N 3.29Å; A87-Q90 VanDerWaalsContact O-N 3.16Å
91	L	97.9	Very high	98.2	Very high	37 Å²	37	64.5 Å²	64.5	19%	0.194	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	3.5	-176.9	-60.6	179.1	0	0	0	113	A87 M88 Y89 I93 R143 E146 Y147	A87-L91 VanDerWaalsContact O-CB 3.3Å; A87-L91 WeakPolarHBondContact O-CB 3.47Å; A87-L91 VanDerWaalsContact O-CG 3.28Å; A87-L91 WeakPolarHBondContact O-CG 3.3Å; A87-L91 PolarHBondContact O-N 2.96Å; M88-L91 PolarHBondContact O-N 3.17Å; Y89-L91 VanDerWaalsContact C-N 3.31Å; Y89-L91 PolarHBondContact O-N 2.96Å; L91-I93 VanDerWaalsContact C-N 3.33Å; L91-I93 HydrophobicContact CB-CD1 3.87Å; L91-I93 HydrophobicContact CB-CG1 3.99Å; L91-I93 HydrophobicContact CD1-CD1 4.22Å; L91-I93 PolarHBondContact O-N 3.03Å; L91-R143 HydrophobicContact CD1-CB 4.17Å; L91-E146 HydrophobicContact CD2-CB 4.43Å; L91-E146 WeakPolarHBondContact CD2-OE2 3.41Å; L91-Y147 HydrophobicContact CD1-CD1 4.18Å; L91-Y147 HydrophobicContact CD1-CE1 4.3Å
92	N	98	Very high	98.2	Very high	146 Å²	146	70.2 Å²	70.2	78%	0.781	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	48.6	-175.2	-59.9	-57	0	0	0	112.7	M88 Y89	M88-N92 PolarHBondContact O-N 3.45Å; M88-N92 VanDerWaalsContact O-N 3.07Å; Y89-N92 PolarHBondContact O-N 3.29Å
93	I	98.4	Very high	98.2	Very high	20 Å²	20	70.3 Å²	70.3	10%	0.103	34%	0.343	C	S	.	.			trans	-104.4	120.3	175.9	-58.8	172.4	0	0	0	108.3	M88 L91 G136 L139 C140	M88-I93 HydrophobicContact CE-CG2 4.25Å; M88-I93 WeakPolarHBondContact CE-O 3.01Å; M88-I93 PolarHBondContact O-N 3.04Å; L91-I93 VanDerWaalsContact C-N 3.33Å; L91-I93 HydrophobicContact CB-CD1 3.87Å; L91-I93 HydrophobicContact CB-CG1 3.99Å; L91-I93 HydrophobicContact CD1-CD1 4.22Å; L91-I93 PolarHBondContact O-N 3.03Å; I93-G136 WeakPolarHBondContact CG2-O 3.28Å; I93-L139 HydrophobicContact CG2-CD2 4.22Å; I93-C140 HydrophobicContact CD1-CB 3.73Å; I93-C140 HydrophobicContact CG2-CB 4.4Å
94	E	98.3	Very high	98.2	Very high	168 Å²	168	69.4 Å²	69.4	79%	0.785	34%	0.336	S	S	*	.			trans	-82.8	157.3	177.1	-62.1	-177.1	168.1	0	0	111.5	G136	E94-G136 WeakPolarHBondContact O-CA 3.2Å
95	F	98.7	Very high	98.2	Very high	35 Å²	35	74.7 Å²	74.7	15%	0.154	36%	0.361	C	S	.	.			trans	-66.5	144.8	166.9	-62.6	-72.4	0	0	0	109.9	L85 M88 D97 R100 A104 L131 V137	L85-F95 HydrophobicContact CD2-CE1 3.79Å; L85-F95 HydrophobicContact CD2-CZ 3.76Å; M88-F95 HydrophobicContact CE-CD1 3.56Å; M88-F95 HydrophobicContact CE-CE1 3.67Å; M88-F95 HydrophobicContact CE-CG 4.06Å; M88-F95 HydrophobicContact CE-CZ 4.24Å; M88-F95 HydrophobicContact SD-CD1 4.16Å; M88-F95 HydrophobicContact SD-CE1 3.67Å; M88-F95 HydrophobicContact SD-CZ 4.21Å; F95-D97 WeakPolarHBondContact CB-O 3.44Å; F95-R100 HydrophobicContact CB-CB 3.99Å; F95-R100 HydrophobicContact CD1-CB 3.56Å; F95-R100 HydrophobicContact CD1-CG 4.32Å; F95-R100 HydrophobicContact CD2-CB 4.31Å; F95-R100 HydrophobicContact CE1-CB 4.11Å; F95-R100 HydrophobicContact CG-CB 3.69Å; F95-A104 HydrophobicContact CE2-CB 4.47Å; F95-A104 HydrophobicContact CZ-CB 3.88Å; F95-L131 HydrophobicContact CD1-CD2 4.39Å; F95-L131 HydrophobicContact CE1-CD2 3.74Å; F95-L131 HydrophobicContact CZ-CD2 4.4Å; F95-V137 HydrophobicContact CD1-CG2 3.84Å; F95-V137 HydrophobicContact CE1-CG2 3.76Å
96	A	98.5	Very high	98.2	Very high	60 Å²	60	76.7 Å²	76.7	50%	0.496	37%	0.371	S	S	.	.	S	Bend	trans	-70.7	-36.7	173	0	0	0	0	0	111.6	D134 S135	A96-D134 WeakPolarHBondContact CB-OD2 3.24Å; A96-D134 PolarHBondContact N-OD1 3.1Å; A96-D134 VanDerWaalsContact N-OD1 3.12Å; A96-D134 PolarHBondContact N-OD2 3.27Å; A96-S135 WeakPolarHBondContact CB-OG 3.41Å
97	D	98.3	Very high	98.2	Very high	58 Å²	58	70.3 Å²	70.3	31%	0.31	35%	0.346	S	S	.	.	S	Bend	trans	-106.3	112.7	167.6	176.9	2.3	0	0	0	110.2	F95 E99 R100 D134	F95-D97 WeakPolarHBondContact CB-O 3.44Å; D97-E99 PolarHBondContact O-N 3.13Å; D97-E99 WeakPolarHBondContact OD1-CB 3.35Å; D97-E99 PolarHBondContact OD1-N 3.32Å; D97-R100 HydrophobicContact CB-CG 4.15Å; D97-R100 VanDerWaalsContact O-CB 3.23Å; D97-R100 WeakPolarHBondContact O-CB 3.33Å; D97-R100 VanDerWaalsContact O-CG 3.29Å; D97-R100 WeakPolarHBondContact O-CG 3.45Å; D97-R100 PolarHBondContact O-N 3.13Å; D97-R100 IonicContact OD2-CZ 3.24Å; D97-R100 IonicContact OD2-NH1 2.77Å; D97-R100 PolarHBondContact OD2-NH1 2.94Å; D97-R100 IonicContact OD2-NH2 3.49Å; D97-R100 PolarHBondContact OD2-NH2 2.78Å; D97-D134 PolarHBondContact N-OD2 3.14Å
98	P	97.7	Very high	98.2	Very high	102 Å²	102	74.4 Å²	74.4	66%	0.662	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.2	178.5	-27.3	35.6	0	0	0	114.7	R100 Q101	P98-R100 PolarHBondContact O-N 3.31Å; P98-Q101 WeakPolarHBondContact O-CB 3.34Å; P98-Q101 PolarHBondContact O-N 2.87Å; P98-Q101 VanDerWaalsContact O-N 3.15Å
99	E	97.4	Very high	98.2	Very high	96 Å²	96	76.7 Å²	76.7	45%	0.449	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.6	176.1	-70.2	-67.3	125.1	0	0	112.7	D97 Q101 K102	D97-E99 PolarHBondContact O-N 3.13Å; D97-E99 WeakPolarHBondContact OD1-CB 3.35Å; D97-E99 PolarHBondContact OD1-N 3.32Å; E99-Q101 PolarHBondContact O-N 3.11Å; E99-Q101 VanDerWaalsContact O-N 3.12Å; E99-K102 WeakPolarHBondContact O-CB 3.28Å; E99-K102 PolarHBondContact O-N 3.35Å; E99-K102 IonicContact OE1-NZ 2.7Å; E99-K102 WeakPolarHBondContact OE2-CE 3.36Å; E99-K102 IonicContact OE2-NZ 3.39Å; E99-K102 PolarHBondContact OE2-NZ 3.46Å
100	R	98.4	Very high	98.3	Very high	36 Å²	36	68 Å²	68	14%	0.136	35%	0.349	C	S	.	.	H	α-helix	trans	-61	-17.6	173.4	-66	-57.9	86.3	75.4	16	113.2	F95 D97 P98 K102 D103 A104 R130 L131 D134	F95-R100 HydrophobicContact CB-CB 3.99Å; F95-R100 HydrophobicContact CD1-CB 3.56Å; F95-R100 HydrophobicContact CD1-CG 4.32Å; F95-R100 HydrophobicContact CD2-CB 4.31Å; F95-R100 HydrophobicContact CE1-CB 4.11Å; F95-R100 HydrophobicContact CG-CB 3.69Å; D97-R100 HydrophobicContact CB-CG 4.15Å; D97-R100 VanDerWaalsContact O-CB 3.23Å; D97-R100 WeakPolarHBondContact O-CB 3.33Å; D97-R100 VanDerWaalsContact O-CG 3.29Å; D97-R100 WeakPolarHBondContact O-CG 3.45Å; D97-R100 PolarHBondContact O-N 3.13Å; D97-R100 IonicContact OD2-CZ 3.24Å; D97-R100 IonicContact OD2-NH1 2.77Å; D97-R100 PolarHBondContact OD2-NH1 2.94Å; D97-R100 IonicContact OD2-NH2 3.49Å; D97-R100 PolarHBondContact OD2-NH2 2.78Å; P98-R100 PolarHBondContact O-N 3.31Å; R100-K102 PolarHBondContact O-N 3.43Å; R100-D103 WeakPolarHBondContact CD-OD2 3.4Å; R100-D103 IonicContact CZ-OD2 3.44Å; R100-D103 IonicContact NE-OD2 3.35Å; R100-D103 PolarHBondContact NE-OD2 3.5Å; R100-D103 IonicContact NH2-OD2 3.47Å; R100-D103 WeakPolarHBondContact O-CB 3.43Å; R100-D103 PolarHBondContact O-N 3.04Å; R100-A104 PolarHBondContact O-N 3.35Å; R100-R130 WeakPolarHBondContact CD-O 3.3Å; R100-L131 HydrophobicContact CB-CD2 3.96Å; R100-D134 HydrophobicContact CG-CB 4.09Å
101	Q	98.3	Very high	98.3	Very high	100 Å²	100	63 Å²	63	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-56.1	-37	171.1	-174.3	63	29.2	0	0	111.9	P98 E99 A104 Q105	P98-Q101 WeakPolarHBondContact O-CB 3.34Å; P98-Q101 PolarHBondContact O-N 2.87Å; P98-Q101 VanDerWaalsContact O-N 3.15Å; E99-Q101 PolarHBondContact O-N 3.11Å; E99-Q101 VanDerWaalsContact O-N 3.12Å; Q101-A104 PolarHBondContact O-N 3.45Å; Q101-Q105 WeakPolarHBondContact O-CG 3.45Å; Q101-Q105 PolarHBondContact O-N 3.32Å; Q101-Q105 VanDerWaalsContact O-N 3.13Å
102	K	98.3	Very high	98.3	Very high	119 Å²	119	69.4 Å²	69.4	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-68.7	-38.7	176.2	-64.4	172.9	-176.6	161.4	0	111.4	E99 R100 Q105 I106	E99-K102 WeakPolarHBondContact O-CB 3.28Å; E99-K102 PolarHBondContact O-N 3.35Å; E99-K102 IonicContact OE1-NZ 2.7Å; E99-K102 WeakPolarHBondContact OE2-CE 3.36Å; E99-K102 IonicContact OE2-NZ 3.39Å; E99-K102 PolarHBondContact OE2-NZ 3.46Å; R100-K102 PolarHBondContact O-N 3.43Å; K102-Q105 WeakPolarHBondContact O-CB 3.44Å; K102-Q105 PolarHBondContact O-N 3.25Å; K102-I106 PolarHBondContact O-N 2.97Å
103	D	98.8	Very high	98.3	Very high	3 Å²	3	64.8 Å²	64.8	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-65.7	-41.7	176	-66	-47.3	0	0	0	111.5	R100 Q105 I106 V107 A127 R130 L131	R100-D103 WeakPolarHBondContact CD-OD2 3.4Å; R100-D103 IonicContact CZ-OD2 3.44Å; R100-D103 IonicContact NE-OD2 3.35Å; R100-D103 PolarHBondContact NE-OD2 3.5Å; R100-D103 IonicContact NH2-OD2 3.47Å; R100-D103 WeakPolarHBondContact O-CB 3.43Å; R100-D103 PolarHBondContact O-N 3.04Å; D103-Q105 VanDerWaalsContact C-N 3.3Å; D103-Q105 PolarHBondContact O-N 3.44Å; D103-I106 WeakPolarHBondContact O-CB 3.34Å; D103-I106 PolarHBondContact O-N 3.07Å; D103-I106 VanDerWaalsContact O-N 3.13Å; D103-V107 PolarHBondContact O-N 3.23Å; D103-A127 HydrophobicContact CB-CB 3.79Å; D103-A127 WeakPolarHBondContact OD1-CA 3.44Å; D103-R130 IonicContact OD1-CZ 2.81Å; D103-R130 IonicContact OD1-NE 3.99Å; D103-R130 PolarHBondContact OD1-NE 3.36Å; D103-R130 IonicContact OD1-NH2 3.62Å; D103-R130 PolarHBondContact OD1-NH2 2.84Å; D103-R130 IonicContact OD2-CZ 3.65Å; D103-R130 IonicContact OD2-NE 3.84Å; D103-R130 PolarHBondContact OD2-NE 3.26Å; D103-R130 IonicContact OD2-NH2 3.63Å; D103-L131 HydrophobicContact CB-CD1 3.97Å; D103-L131 HydrophobicContact CB-CD2 3.95Å; D103-L131 HydrophobicContact CB-CG 3.68Å
104	A	98.7	Very high	98.3	Very high	2 Å²	2	71.5 Å²	71.5	2%	0.017	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-41.7	174.6	0	0	0	0	0	111.5	L85 F95 R100 Q101 I106 V107 Y108 L131	L85-A104 HydrophobicContact CD1-CB 4Å; L85-A104 HydrophobicContact CD2-CB 3.91Å; F95-A104 HydrophobicContact CE2-CB 4.47Å; F95-A104 HydrophobicContact CZ-CB 3.88Å; R100-A104 PolarHBondContact O-N 3.35Å; Q101-A104 PolarHBondContact O-N 3.45Å; A104-I106 VanDerWaalsContact C-N 3.28Å; A104-I106 PolarHBondContact O-N 3.49Å; A104-V107 PolarHBondContact O-N 2.89Å; A104-V107 VanDerWaalsContact O-N 3.15Å; A104-Y108 HydrophobicContact CB-CE2 4.44Å; A104-Y108 WeakPolarHBondContact O-CD2 3.28Å; A104-Y108 PolarHBondContact O-N 3.23Å; A104-L131 HydrophobicContact CB-CD2 4.48Å
105	Q	98.5	Very high	98.3	Very high	112 Å²	112	69.9 Å²	69.9	52%	0.523	36%	0.356	S	S	.	.	H	α-helix	trans	-59.2	-36.9	175.5	-72.7	171.4	1.2	0	0	112.6	Q101 K102 D103 Y108 A109	Q101-Q105 WeakPolarHBondContact O-CG 3.45Å; Q101-Q105 PolarHBondContact O-N 3.32Å; Q101-Q105 VanDerWaalsContact O-N 3.13Å; K102-Q105 WeakPolarHBondContact O-CB 3.44Å; K102-Q105 PolarHBondContact O-N 3.25Å; D103-Q105 VanDerWaalsContact C-N 3.3Å; D103-Q105 PolarHBondContact O-N 3.44Å; Q105-Y108 PolarHBondContact O-N 2.93Å; Q105-A109 VanDerWaalsContact O-CB 3.24Å; Q105-A109 WeakPolarHBondContact O-CB 3.28Å; Q105-A109 PolarHBondContact O-N 3.45Å
106	I	98.6	Very high	98.3	Very high	48 Å²	48	69.2 Å²	69.2	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-42.8	175.8	-65.5	167.1	0	0	0	110.9	K102 D103 A104 A109 T110 L124 A127	K102-I106 PolarHBondContact O-N 2.97Å; D103-I106 WeakPolarHBondContact O-CB 3.34Å; D103-I106 PolarHBondContact O-N 3.07Å; D103-I106 VanDerWaalsContact O-N 3.13Å; A104-I106 VanDerWaalsContact C-N 3.28Å; A104-I106 PolarHBondContact O-N 3.49Å; I106-A109 PolarHBondContact O-N 2.91Å; I106-T110 WeakPolarHBondContact O-CB 3.46Å; I106-T110 PolarHBondContact O-N 2.84Å; I106-T110 PolarHBondContact O-OG1 3.23Å; I106-L124 HydrophobicContact CG2-CB 4.27Å; I106-L124 HydrophobicContact CG2-CD1 4.12Å; I106-A127 HydrophobicContact CB-CB 4.14Å; I106-A127 HydrophobicContact CD1-CB 4.04Å; I106-A127 HydrophobicContact CG2-CB 4.17Å
107	V	98.7	Very high	98.2	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.1	-48.3	176.7	179.4	0	0	0	0	110.8	V78 M81 L82 L85 D103 A104 A109 T110 V111 L124 L128 L131	V78-V107 HydrophobicContact CG1-CG1 4.28Å; M81-V107 HydrophobicContact CG-CG1 4.31Å; M81-V107 HydrophobicContact CG-CG2 4.17Å; L82-V107 HydrophobicContact CB-CG1 4.42Å; L85-V107 HydrophobicContact CD1-CB 3.91Å; L85-V107 HydrophobicContact CD1-CG1 3.98Å; L85-V107 HydrophobicContact CD1-CG2 4.24Å; D103-V107 PolarHBondContact O-N 3.23Å; A104-V107 PolarHBondContact O-N 2.89Å; A104-V107 VanDerWaalsContact O-N 3.15Å; V107-A109 PolarHBondContact O-N 3.47Å; V107-T110 PolarHBondContact O-N 2.54Å; V107-V111 PolarHBondContact O-N 2.82Å; V107-L124 HydrophobicContact CG2-CD1 4.19Å; V107-L128 HydrophobicContact CG2-CD2 3.88Å; V107-L131 HydrophobicContact CG2-CD1 3.69Å
108	Y	98.5	Very high	98.2	Very high	88 Å²	88	70.2 Å²	70.2	35%	0.345	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-44.3	176.4	-76.6	-68.1	0	0	0	112.3	L82 L85 R86 A104 Q105 T110 V111 H112	L82-Y108 HydrophobicContact CD1-CD1 3.44Å; L82-Y108 VanDerWaalsContact CD1-CD1 3.44Å; L82-Y108 HydrophobicContact CD1-CE1 3.34Å; L82-Y108 HydrophobicContact CD1-CG 4.3Å; L85-Y108 HydrophobicContact CB-CE2 4.35Å; L85-Y108 HydrophobicContact CD1-CE2 4.39Å; R86-Y108 HydrophobicContact CG-CE1 4.32Å; A104-Y108 HydrophobicContact CB-CE2 4.44Å; A104-Y108 WeakPolarHBondContact O-CD2 3.28Å; A104-Y108 PolarHBondContact O-N 3.23Å; Q105-Y108 PolarHBondContact O-N 2.93Å; Y108-T110 VanDerWaalsContact C-N 3.34Å; Y108-T110 PolarHBondContact O-N 3.48Å; Y108-V111 PolarHBondContact O-N 3Å; Y108-H112 WeakPolarHBondContact O-CB 3.46Å; Y108-H112 PolarHBondContact O-N 2.89Å
109	A	98.4	Very high	98.2	Very high	54 Å²	54	69.8 Å²	69.8	45%	0.446	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-36.8	179.1	0	0	0	0	0	112.4	Q105 I106 V107 H112 A113	Q105-A109 VanDerWaalsContact O-CB 3.24Å; Q105-A109 WeakPolarHBondContact O-CB 3.28Å; Q105-A109 PolarHBondContact O-N 3.45Å; I106-A109 PolarHBondContact O-N 2.91Å; V107-A109 PolarHBondContact O-N 3.47Å; A109-H112 PolarHBondContact O-N 2.54Å; A109-A113 VanDerWaalsContact O-CB 3.24Å; A109-A113 WeakPolarHBondContact O-CB 3.48Å; A109-A113 PolarHBondContact O-N 3.02Å
110	T	98.6	Very high	98.2	Very high	11 Å²	11	66.2 Å²	66.2	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-49	176.8	-60.8	0	0	0	0	111.2	I106 V107 Y108 A113 Q114 R115 L124	I106-T110 WeakPolarHBondContact O-CB 3.46Å; I106-T110 PolarHBondContact O-N 2.84Å; I106-T110 PolarHBondContact O-OG1 3.23Å; V107-T110 PolarHBondContact O-N 2.54Å; Y108-T110 VanDerWaalsContact C-N 3.34Å; Y108-T110 PolarHBondContact O-N 3.48Å; T110-A113 CarbonylContact O-C 3.58Å; T110-A113 PolarHBondContact O-N 2.99Å; T110-Q114 PolarHBondContact O-N 2.91Å; T110-R115 HydrophobicContact CG2-CB 4.2Å; T110-R115 PolarHBondContact O-N 3.27Å; T110-L124 HydrophobicContact CG2-CD2 3.73Å
111	V	98.3	Very high	98.1	Very high	29 Å²	29	67.1 Å²	67.1	18%	0.176	35%	0.346	C	S	.	.	H	α-helix	trans	-68.3	-40.9	179.7	177.3	0	0	0	0	111	V78 L82 V107 Y108 A113 Q114 D116	V78-V111 HydrophobicContact CG1-CG2 3.47Å; V78-V111 VanDerWaalsContact CG1-CG2 3.47Å; L82-V111 HydrophobicContact CD2-CB 4.47Å; L82-V111 HydrophobicContact CD2-CG1 4.07Å; L82-V111 HydrophobicContact CD2-CG2 4.11Å; V107-V111 PolarHBondContact O-N 2.82Å; Y108-V111 PolarHBondContact O-N 3Å; V111-A113 VanDerWaalsContact C-N 3.26Å; V111-A113 PolarHBondContact O-N 2.78Å; V111-Q114 PolarHBondContact O-N 2.81Å; V111-D116 HydrophobicContact CG2-CB 4.2Å
112	H	98.1	Very high	98.1	Very high	170 Å²	170	68.7 Å²	68.7	79%	0.787	36%	0.358	S	S	*	.	H	α-helix	trans	-61.3	-37.3	176.3	-176	65.8	0	0	0	112.2	Y108 A109 Q114	Y108-H112 WeakPolarHBondContact O-CB 3.46Å; Y108-H112 PolarHBondContact O-N 2.89Å; A109-H112 PolarHBondContact O-N 2.54Å; H112-Q114 PolarHBondContact O-N 2.85Å
113	A	98.1	Very high	98.1	Very high	50 Å²	50	66.1 Å²	66.1	41%	0.413	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	1.7	175	0	0	0	0	0	114	A109 T110 V111 R115	A109-A113 VanDerWaalsContact O-CB 3.24Å; A109-A113 WeakPolarHBondContact O-CB 3.48Å; A109-A113 PolarHBondContact O-N 3.02Å; T110-A113 CarbonylContact O-C 3.58Å; T110-A113 PolarHBondContact O-N 2.99Å; V111-A113 VanDerWaalsContact C-N 3.26Å; V111-A113 PolarHBondContact O-N 2.78Å; A113-R115 HydrophobicContact CB-CG 4.23Å; A113-R115 PolarHBondContact O-N 3.34Å
114	Q	97.7	Very high	98	Very high	161 Å²	161	66.1 Å²	66.1	75%	0.752	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	32	-177.2	-56.8	-178.2	-17.5	0	0	114.2	T110 V111 H112	T110-Q114 PolarHBondContact O-N 2.91Å; V111-Q114 PolarHBondContact O-N 2.81Å; H112-Q114 PolarHBondContact O-N 2.85Å
115	R	97.8	Very high	98	Very high	133 Å²	133	66.6 Å²	66.6	50%	0.502	36%	0.358	S	S	.	.			trans	-102.1	15.5	178.9	-63.8	-167.8	-74	172.6	-2.9	113.1	T110 A113 A117 E118	T110-R115 HydrophobicContact CG2-CB 4.2Å; T110-R115 PolarHBondContact O-N 3.27Å; A113-R115 HydrophobicContact CB-CG 4.23Å; A113-R115 PolarHBondContact O-N 3.34Å; R115-A117 VanDerWaalsContact C-N 3.25Å; R115-A117 PolarHBondContact O-N 3.49Å; R115-E118 HydrophobicContact CB-CG 4.41Å; R115-E118 WeakPolarHBondContact CD-OE2 3.25Å; R115-E118 WeakPolarHBondContact CG-OE2 3.35Å; R115-E118 PolarHBondContact O-N 3.09Å
116	D	97.9	Very high	98	Very high	22 Å²	22	66.3 Å²	66.3	12%	0.118	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.5	-177.2	57.8	-68.3	0	0	0	113.6	Y74 S75 V78 H79 V111	Y74-D116 CarbonylContact C-O 3.37Å; Y74-D116 WeakPolarHBondContact CB-O 3.45Å; S75-D116 WeakPolarHBondContact CA-O 3.26Å; S75-D116 PolarHBondContact N-O 2.84Å; S75-D116 PolarHBondContact OG-OD2 3.22Å; V78-D116 HydrophobicContact CB-CB 4.04Å; V78-D116 HydrophobicContact CG1-CB 3.85Å; V78-D116 HydrophobicContact CG2-CB 4.45Å; H79-D116 IonicContact CD2-OD2 2.85Å; H79-D116 PolarHBondContact CD2-OD2 3.05Å; H79-D116 VanDerWaalsContact CD2-OD2 3.31Å; H79-D116 IonicContact NE2-OD2 3.25Å; H79-D116 PolarHBondContact NE2-OD2 3.09Å; V111-D116 HydrophobicContact CG2-CB 4.2Å
117	A	97.7	Very high	98	Very high	41 Å²	41	64 Å²	64	34%	0.339	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.3	176.5	0	0	0	0	0	113.6	P71 R115	P71-A117 WeakPolarHBondContact CA-O 3.46Å; P71-A117 HydrophobicContact CB-CB 4.01Å; P71-A117 WeakPolarHBondContact CB-O 3.47Å; R115-A117 VanDerWaalsContact C-N 3.25Å; R115-A117 PolarHBondContact O-N 3.49Å
118	E	97.5	Very high	98	Very high	97 Å²	97	64 Å²	64	45%	0.453	35%	0.345	S	S	.	.	S	Bend	trans	-90.4	159.3	178.8	-63.3	177.8	-173.9	0	0	111.2	Y74 R115 F120	Y74-E118 WeakPolarHBondContact CD2-O 3.44Å; R115-E118 HydrophobicContact CB-CG 4.41Å; R115-E118 WeakPolarHBondContact CD-OE2 3.25Å; R115-E118 WeakPolarHBondContact CG-OE2 3.35Å; R115-E118 PolarHBondContact O-N 3.09Å; E118-F120 PolarHBondContact O-N 3.21Å
119	P	97.7	Very high	98	Very high	93 Å²	93	63.4 Å²	63.4	60%	0.604	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-51.7	136.9	167.2	-24.8	34.6	0	0	0	111.4	Y74 S121	Y74-P119 HydrophobicContact CE2-CB 4.24Å; Y74-P119 HydrophobicContact CE2-CG 4.04Å; P119-S121 PolarHBondContact O-N 2.84Å
120	F	98	Very high	98	Very high	21 Å²	21	66 Å²	66	9%	0.092	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-62.6	129.9	-176.4	-58.9	-24	0	0	0	111.1	Y74 T77 V78 E118 L124 L128 L160 L163	Y74-F120 AromaticContact CD1-CD1 3.96Å; Y74-F120 HydrophobicContact CD1-CD1 3.96Å; Y74-F120 AromaticContact CD1-CE1 3.54Å; Y74-F120 HydrophobicContact CD1-CE1 3.54Å; Y74-F120 HydrophobicContact CD1-CE2 4.23Å; Y74-F120 HydrophobicContact CD1-CG 4.47Å; Y74-F120 AromaticContact CD1-CZ 3.69Å; Y74-F120 HydrophobicContact CD1-CZ 3.69Å; Y74-F120 HydrophobicContact CE1-CE1 4.45Å; Y74-F120 HydrophobicContact CE1-CZ 4.49Å; Y74-F120 HydrophobicContact CG-CE1 4.07Å; T77-F120 HydrophobicContact CG2-CE2 4.29Å; T77-F120 HydrophobicContact CG2-CZ 3.91Å; V78-F120 HydrophobicContact CG2-CD1 4.4Å; V78-F120 HydrophobicContact CG2-CE1 3.64Å; V78-F120 HydrophobicContact CG2-CZ 4.27Å; E118-F120 PolarHBondContact O-N 3.21Å; F120-L124 HydrophobicContact CB-CD2 4.3Å; F120-L124 HydrophobicContact CD1-CD2 3.74Å; F120-L124 HydrophobicContact CD1-CG 4.49Å; F120-L124 HydrophobicContact CE1-CD2 4.44Å; F120-L124 HydrophobicContact CG-CD2 4.24Å; F120-L128 HydrophobicContact CD2-CD1 4.1Å; F120-L128 HydrophobicContact CE1-CD1 4.39Å; F120-L128 HydrophobicContact CE2-CD1 3.87Å; F120-L128 HydrophobicContact CG-CD1 4.46Å; F120-L128 HydrophobicContact CZ-CD1 4.02Å; F120-L160 HydrophobicContact CE2-CD2 4.28Å; F120-L163 HydrophobicContact CE2-CB 3.9Å; F120-L163 HydrophobicContact CE2-CD2 4.45Å
121	S	97.1	Very high	98.1	Very high	56 Å²	56	65.4 Å²	65.4	39%	0.392	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65	156.3	165.7	66.1	0	0	0	0	110.2	P119 S123 L124 S125	P119-S121 PolarHBondContact O-N 2.84Å; S121-S123 PolarHBondContact O-N 3.33Å; S121-S123 VanDerWaalsContact O-N 3.17Å; S121-S123 PolarHBondContact OG-OG 3.3Å; S121-L124 PolarHBondContact O-N 2.78Å; S121-L124 WeakPolarHBondContact OG-CB 3.48Å; S121-L124 PolarHBondContact OG-N 3.3Å; S121-S125 WeakPolarHBondContact O-CB 3.33Å; S121-S125 PolarHBondContact O-N 2.88Å
122	D	97.1	Very high	98.1	Very high	133 Å²	133	64.5 Å²	64.5	71%	0.711	33%	0.333	S	S	*	.	H	α-helix	trans	-53.1	-40.7	176.1	-65.9	-27.5	0	0	0	112.2	Q126	D122-Q126 WeakPolarHBondContact O-CB 3.38Å; D122-Q126 VanDerWaalsContact O-CG 3.27Å; D122-Q126 WeakPolarHBondContact O-CG 3.2Å; D122-Q126 PolarHBondContact O-N 3.02Å
123	S	97.7	Very high	98.1	Very high	64 Å²	64	60.2 Å²	60.2	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-43.3	177.1	55.3	0	0	0	0	112.9	S121 A127	S121-S123 PolarHBondContact O-N 3.33Å; S121-S123 VanDerWaalsContact O-N 3.17Å; S121-S123 PolarHBondContact OG-OG 3.3Å; S123-A127 VanDerWaalsContact O-CB 3.24Å; S123-A127 WeakPolarHBondContact O-CB 3.38Å; S123-A127 PolarHBondContact O-N 2.67Å
124	L	98.4	Very high	98.1	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-70.2	-43.1	178.1	177.9	63.1	0	0	0	110.9	V78 I106 V107 T110 F120 S121 Q126 A127 L128	V78-L124 HydrophobicContact CG2-CD2 4.28Å; I106-L124 HydrophobicContact CG2-CB 4.27Å; I106-L124 HydrophobicContact CG2-CD1 4.12Å; V107-L124 HydrophobicContact CG2-CD1 4.19Å; T110-L124 HydrophobicContact CG2-CD2 3.73Å; F120-L124 HydrophobicContact CB-CD2 4.3Å; F120-L124 HydrophobicContact CD1-CD2 3.74Å; F120-L124 HydrophobicContact CD1-CG 4.49Å; F120-L124 HydrophobicContact CE1-CD2 4.44Å; F120-L124 HydrophobicContact CG-CD2 4.24Å; S121-L124 PolarHBondContact O-N 2.78Å; S121-L124 WeakPolarHBondContact OG-CB 3.48Å; S121-L124 PolarHBondContact OG-N 3.3Å; L124-Q126 PolarHBondContact O-N 3.31Å; L124-A127 PolarHBondContact O-N 3.17Å; L124-L128 HydrophobicContact CD1-CD1 4.15Å; L124-L128 HydrophobicContact CD1-CD2 4.41Å; L124-L128 HydrophobicContact CD1-CG 3.98Å; L124-L128 HydrophobicContact CG-CD1 3.98Å; L124-L128 HydrophobicContact CG-CG 4.25Å; L124-L128 WeakPolarHBondContact O-CB 3.21Å; L124-L128 VanDerWaalsContact O-CG 3.3Å; L124-L128 WeakPolarHBondContact O-CG 3.47Å; L124-L128 PolarHBondContact O-N 3.08Å
125	S	98.1	Very high	98.2	Very high	12 Å²	12	54.6 Å²	54.6	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-56.8	-49.9	176.9	175.8	0	0	0	0	111.5	S121 A127 L128 Q129 S164	S121-S125 WeakPolarHBondContact O-CB 3.33Å; S121-S125 PolarHBondContact O-N 2.88Å; S125-A127 PolarHBondContact O-N 2.8Å; S125-L128 PolarHBondContact O-N 2.82Å; S125-Q129 VanDerWaalsContact O-CG 3.31Å; S125-Q129 WeakPolarHBondContact O-CG 3.45Å; S125-Q129 PolarHBondContact O-N 3.05Å; S125-Q129 VanDerWaalsContact O-N 3.09Å; S125-Q129 PolarHBondContact O-NE2 2.94Å; S125-Q129 PolarHBondContact OG-NE2 3.26Å; S125-S164 WeakPolarHBondContact CB-OG 3.31Å; S125-S164 WeakPolarHBondContact OG-CB 3.26Å; S125-S164 PolarHBondContact OG-OG 3.21Å
126	Q	98.3	Very high	98.2	Very high	105 Å²	105	48.6 Å²	48.6	49%	0.491	28%	0.282	S	S	.	.	H	α-helix	trans	-63.9	-41.5	177.4	-69.9	173.7	32.8	0	0	111.7	D122 L124 Q129 R130	D122-Q126 WeakPolarHBondContact O-CB 3.38Å; D122-Q126 VanDerWaalsContact O-CG 3.27Å; D122-Q126 WeakPolarHBondContact O-CG 3.2Å; D122-Q126 PolarHBondContact O-N 3.02Å; L124-Q126 PolarHBondContact O-N 3.31Å; Q126-Q129 PolarHBondContact O-N 2.94Å; Q126-R130 WeakPolarHBondContact O-CB 3.49Å; Q126-R130 WeakPolarHBondContact O-CG 3.5Å; Q126-R130 PolarHBondContact O-N 2.78Å
127	A	98.6	Very high	98.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-49.7	177.5	0	0	0	0	0	111.9	D103 I106 S123 L124 S125 Q129 R130 L131	D103-A127 HydrophobicContact CB-CB 3.79Å; D103-A127 WeakPolarHBondContact OD1-CA 3.44Å; I106-A127 HydrophobicContact CB-CB 4.14Å; I106-A127 HydrophobicContact CD1-CB 4.04Å; I106-A127 HydrophobicContact CG2-CB 4.17Å; S123-A127 VanDerWaalsContact O-CB 3.24Å; S123-A127 WeakPolarHBondContact O-CB 3.38Å; S123-A127 PolarHBondContact O-N 2.67Å; L124-A127 PolarHBondContact O-N 3.17Å; S125-A127 PolarHBondContact O-N 2.8Å; A127-Q129 VanDerWaalsContact C-N 3.32Å; A127-Q129 PolarHBondContact O-N 2.93Å; A127-R130 PolarHBondContact O-N 3.15Å; A127-L131 VanDerWaalsContact O-CB 3.3Å; A127-L131 WeakPolarHBondContact O-CB 3.49Å; A127-L131 WeakPolarHBondContact O-CG 3.24Å; A127-L131 PolarHBondContact O-N 2.71Å
128	L	98.8	Very high	98.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-43.7	177.8	-70.3	173.8	0	0	0	111.5	M81 V107 F120 L124 S125 W132 L160	M81-L128 HydrophobicContact CB-CD2 3.7Å; M81-L128 HydrophobicContact CE-CD2 4.48Å; M81-L128 HydrophobicContact CG-CD2 3.75Å; V107-L128 HydrophobicContact CG2-CD2 3.88Å; F120-L128 HydrophobicContact CD2-CD1 4.1Å; F120-L128 HydrophobicContact CE1-CD1 4.39Å; F120-L128 HydrophobicContact CE2-CD1 3.87Å; F120-L128 HydrophobicContact CG-CD1 4.46Å; F120-L128 HydrophobicContact CZ-CD1 4.02Å; L124-L128 HydrophobicContact CD1-CD1 4.15Å; L124-L128 HydrophobicContact CD1-CD2 4.41Å; L124-L128 HydrophobicContact CD1-CG 3.98Å; L124-L128 HydrophobicContact CG-CD1 3.98Å; L124-L128 HydrophobicContact CG-CG 4.25Å; L124-L128 WeakPolarHBondContact O-CB 3.21Å; L124-L128 VanDerWaalsContact O-CG 3.3Å; L124-L128 WeakPolarHBondContact O-CG 3.47Å; L124-L128 PolarHBondContact O-N 3.08Å; S125-L128 PolarHBondContact O-N 2.82Å; L128-W132 WeakPolarHBondContact O-CB 3.39Å; L128-W132 PolarHBondContact O-N 2.97Å; L128-L160 HydrophobicContact CB-CD1 3.84Å; L128-L160 HydrophobicContact CB-CD2 3.8Å; L128-L160 HydrophobicContact CB-CG 4.45Å; L128-L160 HydrophobicContact CD1-CD2 3.88Å; L128-L160 HydrophobicContact CG-CD2 4.42Å; L128-L160 WeakPolarHBondContact O-CD1 3.36Å
129	Q	98.7	Very high	98.3	Very high	75 Å²	75	50 Å²	50	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-46.1	179.8	-72.5	178.9	70.7	0	0	112.1	S125 Q126 A127 W132 A133 L160	S125-Q129 VanDerWaalsContact O-CG 3.31Å; S125-Q129 WeakPolarHBondContact O-CG 3.45Å; S125-Q129 PolarHBondContact O-N 3.05Å; S125-Q129 VanDerWaalsContact O-N 3.09Å; S125-Q129 PolarHBondContact O-NE2 2.94Å; S125-Q129 PolarHBondContact OG-NE2 3.26Å; Q126-Q129 PolarHBondContact O-N 2.94Å; A127-Q129 VanDerWaalsContact C-N 3.32Å; A127-Q129 PolarHBondContact O-N 2.93Å; Q129-W132 PolarHBondContact O-N 2.83Å; Q129-A133 WeakPolarHBondContact O-CB 3.28Å; Q129-A133 PolarHBondContact O-N 3.23Å; Q129-L160 HydrophobicContact CG-CB 3.74Å; Q129-L160 HydrophobicContact CG-CD1 4.07Å
130	R	98.7	Very high	98.4	Very high	108 Å²	108	45.6 Å²	45.6	41%	0.408	25%	0.25	S	S	.	.	H	α-helix	trans	-64.3	-41.4	177	-72.4	-165.6	-65.3	-136.4	-5.8	112.2	R100 D103 Q126 A127 A133 D134	R100-R130 WeakPolarHBondContact CD-O 3.3Å; D103-R130 IonicContact OD1-CZ 2.81Å; D103-R130 IonicContact OD1-NE 3.99Å; D103-R130 PolarHBondContact OD1-NE 3.36Å; D103-R130 IonicContact OD1-NH2 3.62Å; D103-R130 PolarHBondContact OD1-NH2 2.84Å; D103-R130 IonicContact OD2-CZ 3.65Å; D103-R130 IonicContact OD2-NE 3.84Å; D103-R130 PolarHBondContact OD2-NE 3.26Å; D103-R130 IonicContact OD2-NH2 3.63Å; Q126-R130 WeakPolarHBondContact O-CB 3.49Å; Q126-R130 WeakPolarHBondContact O-CG 3.5Å; Q126-R130 PolarHBondContact O-N 2.78Å; A127-R130 PolarHBondContact O-N 3.15Å; R130-A133 PolarHBondContact O-N 2.82Å; R130-D134 PolarHBondContact O-N 3.09Å
131	L	98.9	Very high	98.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.8	-48	174.7	-73.8	169.3	0	0	0	111	M81 L85 F95 R100 D103 A104 V107 A127 A133 D134 V137	M81-L131 HydrophobicContact CE-CB 3.7Å; M81-L131 HydrophobicContact CG-CD1 4.08Å; M81-L131 HydrophobicContact SD-CB 3.84Å; M81-L131 HydrophobicContact SD-CD1 4.14Å; L85-L131 HydrophobicContact CD1-CD1 4.27Å; L85-L131 HydrophobicContact CD2-CD1 4.42Å; L85-L131 HydrophobicContact CD2-CD2 4.03Å; F95-L131 HydrophobicContact CD1-CD2 4.39Å; F95-L131 HydrophobicContact CE1-CD2 3.74Å; F95-L131 HydrophobicContact CZ-CD2 4.4Å; R100-L131 HydrophobicContact CB-CD2 3.96Å; D103-L131 HydrophobicContact CB-CD1 3.97Å; D103-L131 HydrophobicContact CB-CD2 3.95Å; D103-L131 HydrophobicContact CB-CG 3.68Å; A104-L131 HydrophobicContact CB-CD2 4.48Å; V107-L131 HydrophobicContact CG2-CD1 3.69Å; A127-L131 VanDerWaalsContact O-CB 3.3Å; A127-L131 WeakPolarHBondContact O-CB 3.49Å; A127-L131 WeakPolarHBondContact O-CG 3.24Å; A127-L131 PolarHBondContact O-N 2.71Å; L131-A133 PolarHBondContact O-N 3.24Å; L131-D134 VanDerWaalsContact O-CB 3.3Å; L131-D134 WeakPolarHBondContact O-CB 3.48Å; L131-D134 PolarHBondContact O-N 2.85Å; L131-V137 HydrophobicContact CD2-CG2 4.36Å; L131-V137 WeakPolarHBondContact O-CB 3.36Å; L131-V137 WeakPolarHBondContact O-CG1 3.14Å; L131-V137 VanDerWaalsContact O-CG2 3.28Å; L131-V137 WeakPolarHBondContact O-CG2 3.38Å
132	W	98.7	Very high	98.4	Very high	9 Å²	9	46.3 Å²	46.3	3%	0.034	25%	0.253	C	S	.	.	H	α-helix	trans	-69.4	-22.4	-178.6	-168.1	-128.2	0	0	0	113.8	M81 L128 Q129 V137 R138 Y141 L157 D158 L160	M81-W132 HydrophobicContact CE-CB 3.93Å; M81-W132 HydrophobicContact CE-CE3 4.31Å; L128-W132 WeakPolarHBondContact O-CB 3.39Å; L128-W132 PolarHBondContact O-N 2.97Å; Q129-W132 PolarHBondContact O-N 2.83Å; W132-V137 HydrophobicContact CE3-CG1 4.11Å; W132-R138 VanDerWaalsContact CD1-NH2 3.27Å; W132-R138 VanDerWaalsContact NE1-CZ 3.25Å; W132-R138 PolarHBondContact O-NE 2.74Å; W132-Y141 AromaticContact CH2-CD1 3.68Å; W132-Y141 HydrophobicContact CH2-CD1 3.68Å; W132-Y141 AromaticContact CH2-CD2 3.8Å; W132-Y141 HydrophobicContact CH2-CD2 3.8Å; W132-Y141 HydrophobicContact CH2-CE1 4.1Å; W132-Y141 HydrophobicContact CH2-CE2 4.2Å; W132-Y141 AromaticContact CH2-CG 3.52Å; W132-Y141 HydrophobicContact CH2-CG 3.52Å; W132-Y141 HydrophobicContact CZ3-CD1 4.39Å; W132-Y141 HydrophobicContact CZ3-CD2 4.04Å; W132-Y141 AromaticContact CZ3-CG 3.82Å; W132-Y141 HydrophobicContact CZ3-CG 3.82Å; W132-L157 VanDerWaalsContact CD1-C 3.43Å; W132-L157 HydrophobicContact CD2-CB 3.68Å; W132-L157 HydrophobicContact CD2-CD1 4.14Å; W132-L157 HydrophobicContact CD2-CG 4.46Å; W132-L157 VanDerWaalsContact CE2-CB 3.48Å; W132-L157 HydrophobicContact CE3-CB 4.21Å; W132-L157 HydrophobicContact CE3-CD1 3.78Å; W132-L157 HydrophobicContact CG-CB 3.96Å; W132-L157 HydrophobicContact CH2-CB 4.38Å; W132-L157 HydrophobicContact CH2-CD1 3.99Å; W132-L157 HydrophobicContact CZ2-CB 3.86Å; W132-L157 HydrophobicContact CZ2-CD1 4.32Å; W132-L157 HydrophobicContact CZ3-CD1 3.71Å; W132-L157 VanDerWaalsContact NE1-C 3.28Å; W132-L157 PolarHBondContact NE1-O 3.02Å; W132-D158 PolarHBondContact NE1-OD1 3.48Å; W132-L160 HydrophobicContact CB-CD1 4.04Å
133	A	98.5	Very high	98.4	Very high	81 Å²	81	43.7 Å²	43.7	67%	0.669	23%	0.233	S	C	*	.	H	α-helix	trans	-79.7	-17.4	171.7	0	0	0	0	0	113.6	Q129 R130 L131	Q129-A133 WeakPolarHBondContact O-CB 3.28Å; Q129-A133 PolarHBondContact O-N 3.23Å; R130-A133 PolarHBondContact O-N 2.82Å; L131-A133 PolarHBondContact O-N 3.24Å
134	D	98.8	Very high	98.3	Very high	10 Å²	10	41.4 Å²	41.4	5%	0.053	22%	0.216	C	C	.	.			trans	-69.4	132.6	-178.8	-176.2	-87.9	0	0	0	111.7	A96 D97 R100 R130 L131 G136 V137 R138	A96-D134 WeakPolarHBondContact CB-OD2 3.24Å; A96-D134 PolarHBondContact N-OD1 3.1Å; A96-D134 VanDerWaalsContact N-OD1 3.12Å; A96-D134 PolarHBondContact N-OD2 3.27Å; D97-D134 PolarHBondContact N-OD2 3.14Å; R100-D134 HydrophobicContact CG-CB 4.09Å; R130-D134 PolarHBondContact O-N 3.09Å; L131-D134 VanDerWaalsContact O-CB 3.3Å; L131-D134 WeakPolarHBondContact O-CB 3.48Å; L131-D134 PolarHBondContact O-N 2.85Å; D134-G136 VanDerWaalsContact C-N 3.34Å; D134-G136 PolarHBondContact O-N 3.43Å; D134-G136 VanDerWaalsContact OD1-CA 3.27Å; D134-G136 WeakPolarHBondContact OD1-CA 3.47Å; D134-G136 PolarHBondContact OD1-N 3.2Å; D134-V137 HydrophobicContact CB-CB 4.15Å; D134-V137 HydrophobicContact CB-CG2 3.88Å; D134-V137 PolarHBondContact O-N 3.44Å; D134-V137 PolarHBondContact OD1-N 3.25Å; D134-V137 VanDerWaalsContact OD1-N 3.07Å; D134-R138 WeakPolarHBondContact O-CG 3.4Å; D134-R138 PolarHBondContact O-N 2.93Å
135	S	98.6	Very high	98.2	Very high	82 Å²	82	43.4 Å²	43.4	57%	0.573	23%	0.227	S	C	*	.	H	α-helix	trans	-72.1	-26.1	-176.4	58.3	0	0	0	0	113.3	A96 L139	A96-S135 WeakPolarHBondContact CB-OG 3.41Å; S135-L139 VanDerWaalsContact O-CB 3.25Å; S135-L139 WeakPolarHBondContact O-CB 3.42Å; S135-L139 PolarHBondContact O-N 3.31Å
136	G	98.6	Very high	98.1	Very high	7 Å²	7	47.2 Å²	47.2	7%	0.072	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-43	171.2	0	0	0	0	0	111.8	I93 E94 D134 L139 C140	I93-G136 WeakPolarHBondContact CG2-O 3.28Å; E94-G136 WeakPolarHBondContact O-CA 3.2Å; D134-G136 VanDerWaalsContact C-N 3.34Å; D134-G136 PolarHBondContact O-N 3.43Å; D134-G136 VanDerWaalsContact OD1-CA 3.27Å; D134-G136 WeakPolarHBondContact OD1-CA 3.47Å; D134-G136 PolarHBondContact OD1-N 3.2Å; G136-L139 PolarHBondContact O-N 3.1Å; G136-C140 PolarHBondContact O-N 3.06Å
137	V	98.8	Very high	98.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-46	172.7	176.6	0	0	0	0	110.9	M81 V84 M88 F95 L131 W132 D134 L139 C140 Y141	M81-V137 HydrophobicContact SD-CG1 4.22Å; V84-V137 HydrophobicContact CG1-CG1 3.83Å; M88-V137 HydrophobicContact CE-CG2 4.16Å; M88-V137 HydrophobicContact SD-CB 4.28Å; M88-V137 HydrophobicContact SD-CG2 3.63Å; F95-V137 HydrophobicContact CD1-CG2 3.84Å; F95-V137 HydrophobicContact CE1-CG2 3.76Å; L131-V137 HydrophobicContact CD2-CG2 4.36Å; L131-V137 WeakPolarHBondContact O-CB 3.36Å; L131-V137 WeakPolarHBondContact O-CG1 3.14Å; L131-V137 VanDerWaalsContact O-CG2 3.28Å; L131-V137 WeakPolarHBondContact O-CG2 3.38Å; W132-V137 HydrophobicContact CE3-CG1 4.11Å; D134-V137 HydrophobicContact CB-CB 4.15Å; D134-V137 HydrophobicContact CB-CG2 3.88Å; D134-V137 PolarHBondContact O-N 3.44Å; D134-V137 PolarHBondContact OD1-N 3.25Å; D134-V137 VanDerWaalsContact OD1-N 3.07Å; V137-L139 VanDerWaalsContact C-N 3.35Å; V137-L139 PolarHBondContact O-N 3.13Å; V137-C140 PolarHBondContact O-N 3.34Å; V137-Y141 PolarHBondContact O-N 3.14Å
138	R	98.5	Very high	98	Very high	95 Å²	95	45.3 Å²	45.3	36%	0.358	23%	0.234	S	C	.	.	H	α-helix	trans	-62.8	-39.3	176.4	-71.2	-71.8	-170.7	159.7	6.4	112.4	W132 D134 Y141 S142 D158	W132-R138 VanDerWaalsContact CD1-NH2 3.27Å; W132-R138 VanDerWaalsContact NE1-CZ 3.25Å; W132-R138 PolarHBondContact O-NE 2.74Å; D134-R138 WeakPolarHBondContact O-CG 3.4Å; D134-R138 PolarHBondContact O-N 2.93Å; R138-Y141 PolarHBondContact O-N 2.84Å; R138-S142 PolarHBondContact O-N 3.47Å; R138-D158 IonicContact CZ-OD1 2.7Å; R138-D158 IonicContact NH1-OD1 3.44Å; R138-D158 PolarHBondContact NH1-OD1 3.4Å; R138-D158 VanDerWaalsContact NH1-OD1 3.08Å; R138-D158 IonicContact NH2-OD1 3.15Å; R138-D158 PolarHBondContact NH2-OD1 3.38Å
139	L	98.5	Very high	97.9	Very high	96 Å²	96	45.8 Å²	45.8	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-46.7	174.8	175.8	62.2	0	0	0	110.8	I93 S135 G136 V137 Y141 S142	I93-L139 HydrophobicContact CG2-CD2 4.22Å; S135-L139 VanDerWaalsContact O-CB 3.25Å; S135-L139 WeakPolarHBondContact O-CB 3.42Å; S135-L139 PolarHBondContact O-N 3.31Å; G136-L139 PolarHBondContact O-N 3.1Å; V137-L139 VanDerWaalsContact C-N 3.35Å; V137-L139 PolarHBondContact O-N 3.13Å; L139-Y141 VanDerWaalsContact C-N 3.35Å; L139-Y141 PolarHBondContact O-N 3.25Å; L139-S142 WeakPolarHBondContact O-CB 3.36Å; L139-S142 PolarHBondContact O-N 3.28Å; L139-S142 VanDerWaalsContact O-N 3.16Å; L139-S142 PolarHBondContact O-OG 2.96Å
140	C	98.7	Very high	97.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-40.7	176.1	-174.8	0	0	0	0	112.3	V84 M88 I93 G136 V137 S142 R143 Y147	V84-C140 HydrophobicContact CG1-CB 4.04Å; M88-C140 HydrophobicContact CG-CB 3.43Å; M88-C140 VanDerWaalsContact CG-CB 3.43Å; M88-C140 VanDerWaalsContact CG-SG 3.53Å; M88-C140 PolarHBondContact N-SG 3.14Å; M88-C140 HydrophobicContact SD-CB 4.48Å; I93-C140 HydrophobicContact CD1-CB 3.73Å; I93-C140 HydrophobicContact CG2-CB 4.4Å; G136-C140 PolarHBondContact O-N 3.06Å; V137-C140 PolarHBondContact O-N 3.34Å; C140-S142 VanDerWaalsContact C-N 3.28Å; C140-S142 PolarHBondContact O-N 3.02Å; C140-R143 PolarHBondContact O-N 3.26Å; C140-R143 VanDerWaalsContact O-N 3.15Å; C140-Y147 WeakPolarHBondContact O-CE1 3.28Å; C140-Y147 PolarHBondContact O-OH 3.35Å
141	Y	98.4	Very high	97.7	Very high	32 Å²	32	40.9 Å²	40.9	13%	0.125	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-36.2	173.6	-176.8	-98.2	0	0	0	112.9	V84 W132 V137 R138 L139 R143 N144 Y147 I149 A153 K154	V84-Y141 HydrophobicContact CG2-CD2 4.02Å; W132-Y141 AromaticContact CH2-CD1 3.68Å; W132-Y141 HydrophobicContact CH2-CD1 3.68Å; W132-Y141 AromaticContact CH2-CD2 3.8Å; W132-Y141 HydrophobicContact CH2-CD2 3.8Å; W132-Y141 HydrophobicContact CH2-CE1 4.1Å; W132-Y141 HydrophobicContact CH2-CE2 4.2Å; W132-Y141 AromaticContact CH2-CG 3.52Å; W132-Y141 HydrophobicContact CH2-CG 3.52Å; W132-Y141 HydrophobicContact CZ3-CD1 4.39Å; W132-Y141 HydrophobicContact CZ3-CD2 4.04Å; W132-Y141 AromaticContact CZ3-CG 3.82Å; W132-Y141 HydrophobicContact CZ3-CG 3.82Å; V137-Y141 PolarHBondContact O-N 3.14Å; R138-Y141 PolarHBondContact O-N 2.84Å; L139-Y141 VanDerWaalsContact C-N 3.35Å; L139-Y141 PolarHBondContact O-N 3.25Å; Y141-R143 PolarHBondContact O-N 2.84Å; Y141-R143 VanDerWaalsContact O-N 3.12Å; Y141-N144 WeakPolarHBondContact O-CB 3.42Å; Y141-N144 PolarHBondContact O-N 3.41Å; Y141-N144 PolarHBondContact O-ND2 2.77Å; Y141-Y147 WeakPolarHBondContact CA-OH 3.37Å; Y141-I149 HydrophobicContact CD2-CD1 4Å; Y141-I149 HydrophobicContact CE2-CD1 3.89Å; Y141-A153 HydrophobicContact CE2-CB 3.95Å; Y141-K154 HydrophobicContact CE1-CB 4Å; Y141-K154 HydrophobicContact CE1-CD 4.25Å; Y141-K154 WeakPolarHBondContact OH-CB 3.18Å
142	S	96.9	Very high	97.6	Very high	59 Å²	59	41.3 Å²	41.3	41%	0.413	22%	0.224	S	C	.	.	H	α-helix	trans	-62.2	-20.8	178.2	79.2	0	0	0	0	113.8	R138 L139 C140	R138-S142 PolarHBondContact O-N 3.47Å; L139-S142 WeakPolarHBondContact O-CB 3.36Å; L139-S142 PolarHBondContact O-N 3.28Å; L139-S142 VanDerWaalsContact O-N 3.16Å; L139-S142 PolarHBondContact O-OG 2.96Å; C140-S142 VanDerWaalsContact C-N 3.28Å; C140-S142 PolarHBondContact O-N 3.02Å
143	R	96.9	Very high	97.5	Very high	79 Å²	79	41 Å²	41	30%	0.298	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	24	176.4	-63	174.9	68	-175.9	-0.7	113	L91 C140 Y141 N145 E146 Y147	L91-R143 HydrophobicContact CD1-CB 4.17Å; C140-R143 PolarHBondContact O-N 3.26Å; C140-R143 VanDerWaalsContact O-N 3.15Å; Y141-R143 PolarHBondContact O-N 2.84Å; Y141-R143 VanDerWaalsContact O-N 3.12Å; R143-N145 PolarHBondContact O-N 3.29Å; R143-E146 HydrophobicContact CB-CG 4.48Å; R143-E146 WeakPolarHBondContact CB-OE1 3.39Å; R143-E146 IonicContact CZ-OE1 2.72Å; R143-E146 IonicContact CZ-OE2 2.74Å; R143-E146 IonicContact NE-OE1 3.51Å; R143-E146 PolarHBondContact NE-OE1 3.33Å; R143-E146 IonicContact NE-OE2 2.88Å; R143-E146 PolarHBondContact NE-OE2 2.8Å; R143-E146 IonicContact NH2-OE1 2.68Å; R143-E146 PolarHBondContact NH2-OE1 2.88Å; R143-E146 IonicContact NH2-OE2 3.08Å; R143-E146 PolarHBondContact NH2-OE2 2.83Å; R143-E146 WeakPolarHBondContact O-CB 3.39Å; R143-E146 PolarHBondContact O-N 3.13Å; R143-Y147 WeakPolarHBondContact O-CE1 3.48Å
144	N	96.2	Very high	97.5	Very high	15 Å²	15	41.1 Å²	41.1	8%	0.08	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-4.3	-177.4	62.9	15	0	0	0	116.3	Y141 E146 I149 Q233	Y141-N144 WeakPolarHBondContact O-CB 3.42Å; Y141-N144 PolarHBondContact O-N 3.41Å; Y141-N144 PolarHBondContact O-ND2 2.77Å; N144-E146 VanDerWaalsContact C-N 3.32Å; N144-I149 HydrophobicContact CB-CG2 3.61Å; N144-Q233 PolarHBondContact O-NE2 2.94Å
145	N	95.8	Very high	97.5	Very high	46 Å²	46	43.5 Å²	43.5	25%	0.246	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.4	167.8	61.6	-70.9	0	0	0	112.6	R143 D232 Q233	R143-N145 PolarHBondContact O-N 3.29Å; N145-D232 HydrophobicContact CB-CB 4.45Å; N145-D232 WeakPolarHBondContact CB-OD2 3.09Å; N145-Q233 HydrophobicContact CB-CG 4.32Å
146	E	96.4	Very high	97.5	Very high	93 Å²	93	39.6 Å²	39.6	44%	0.435	19%	0.189	S	C	.	.	S	Bend	trans	-90.6	-6.4	-175.2	-60.2	-179.9	-132.9	0	0	113.9	L91 R143 N144	L91-E146 HydrophobicContact CD2-CB 4.43Å; L91-E146 WeakPolarHBondContact CD2-OE2 3.41Å; R143-E146 HydrophobicContact CB-CG 4.48Å; R143-E146 WeakPolarHBondContact CB-OE1 3.39Å; R143-E146 IonicContact CZ-OE1 2.72Å; R143-E146 IonicContact CZ-OE2 2.74Å; R143-E146 IonicContact NE-OE1 3.51Å; R143-E146 PolarHBondContact NE-OE1 3.33Å; R143-E146 IonicContact NE-OE2 2.88Å; R143-E146 PolarHBondContact NE-OE2 2.8Å; R143-E146 IonicContact NH2-OE1 2.68Å; R143-E146 PolarHBondContact NH2-OE1 2.88Å; R143-E146 IonicContact NH2-OE2 3.08Å; R143-E146 PolarHBondContact NH2-OE2 2.83Å; R143-E146 WeakPolarHBondContact O-CB 3.39Å; R143-E146 PolarHBondContact O-N 3.13Å; N144-E146 VanDerWaalsContact C-N 3.32Å
147	Y	97.3	Very high	97.5	Very high	17 Å²	17	39.4 Å²	39.4	7%	0.067	19%	0.186	C	C	.	.	S	Bend	trans	-149.8	172.3	179.5	60.3	-86.2	0	0	0	111.3	A87 L91 C140 Y141 R143 I149	A87-Y147 HydrophobicContact CB-CD1 3.44Å; A87-Y147 VanDerWaalsContact CB-CD1 3.44Å; A87-Y147 HydrophobicContact CB-CD2 3.58Å; A87-Y147 HydrophobicContact CB-CE1 3.55Å; A87-Y147 HydrophobicContact CB-CE2 3.68Å; A87-Y147 HydrophobicContact CB-CG 3.44Å; A87-Y147 VanDerWaalsContact CB-CG 3.44Å; L91-Y147 HydrophobicContact CD1-CD1 4.18Å; L91-Y147 HydrophobicContact CD1-CE1 4.3Å; C140-Y147 WeakPolarHBondContact O-CE1 3.28Å; C140-Y147 PolarHBondContact O-OH 3.35Å; Y141-Y147 WeakPolarHBondContact CA-OH 3.37Å; R143-Y147 WeakPolarHBondContact O-CE1 3.48Å; Y147-I149 HydrophobicContact CD2-CB 4.17Å; Y147-I149 HydrophobicContact CD2-CG2 4.23Å; Y147-I149 HydrophobicContact CE2-CB 3.85Å; Y147-I149 HydrophobicContact CE2-CD1 4.09Å; Y147-I149 HydrophobicContact CE2-CG2 3.83Å
148	Q	97	Very high	97.5	Very high	47 Å²	47	42.7 Å²	42.7	22%	0.22	20%	0.204	C	C	.	.			trans	-87.4	114.1	-176	-54	-59.8	-19.2	0	0	110.9	T234 R236 N239	Q148-T234 PolarHBondContact NE2-O 2.81Å; Q148-T234 VanDerWaalsContact NE2-O 3.09Å; Q148-R236 HydrophobicContact CB-CG 4.3Å; Q148-R236 HydrophobicContact CG-CG 4Å; Q148-R236 VanDerWaalsContact OE1-CG 3.25Å; Q148-N239 PolarHBondContact NE2-OD1 3.01Å
149	I	97.1	Very high	97.4	Very high	11 Å²	11	41 Å²	41	6%	0.056	20%	0.202	C	C	.	.			trans	-147.1	148.3	175.3	-173.8	165.1	0	0	0	110	A83 V84 Y141 N144 Y147 A153	A83-I149 HydrophobicContact CB-CB 4.35Å; A83-I149 HydrophobicContact CB-CD1 4.35Å; A83-I149 HydrophobicContact CB-CG1 4.27Å; V84-I149 HydrophobicContact CG2-CD1 3.61Å; Y141-I149 HydrophobicContact CD2-CD1 4Å; Y141-I149 HydrophobicContact CE2-CD1 3.89Å; N144-I149 HydrophobicContact CB-CG2 3.61Å; Y147-I149 HydrophobicContact CD2-CB 4.17Å; Y147-I149 HydrophobicContact CD2-CG2 4.23Å; Y147-I149 HydrophobicContact CE2-CB 3.85Å; Y147-I149 HydrophobicContact CE2-CD1 4.09Å; Y147-I149 HydrophobicContact CE2-CG2 3.83Å; I149-A153 HydrophobicContact CD1-CB 3.66Å; I149-A153 HydrophobicContact CG1-CB 3.74Å
150	D	96.6	Very high	97.5	Very high	27 Å²	27	36.5 Å²	36.5	14%	0.144	18%	0.179	C	C	.	.			trans	-76.1	140.9	178.6	-66.5	-31.9	0	0	0	111.2	S152 A153 R236	D150-S152 PolarHBondContact O-N 2.83Å; D150-S152 VanDerWaalsContact O-N 3.08Å; D150-A153 WeakPolarHBondContact O-CB 3.41Å; D150-A153 PolarHBondContact O-N 3.34Å; D150-R236 IonicContact OD1-CZ 3.34Å; D150-R236 IonicContact OD1-NH1 3.73Å; D150-R236 PolarHBondContact OD1-NH1 3.31Å; D150-R236 IonicContact OD1-NH2 3.76Å; D150-R236 PolarHBondContact OD1-NH2 3.37Å
151	D	95.6	Very high	97.4	Very high	53 Å²	53	40.3 Å²	40.3	28%	0.283	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.7	179	-68	-43.3	0	0	0	113.4	A153 K271 L274	D151-A153 VanDerWaalsContact C-N 3.26Å; D151-A153 PolarHBondContact O-N 2.75Å; D151-K271 VanDerWaalsContact OD2-CD 3.26Å; D151-K271 WeakPolarHBondContact OD2-CD 3.43Å; D151-K271 VanDerWaalsContact OD2-CE 3.3Å; D151-K271 WeakPolarHBondContact OD2-CE 3.28Å; D151-K271 IonicContact OD2-NZ 2.67Å; D151-K271 PolarHBondContact OD2-NZ 3.18Å; D151-L274 HydrophobicContact CB-CD1 3.59Å; D151-L274 VanDerWaalsContact CG-CD1 3.49Å
152	S	96.8	Very high	97.4	Very high	9 Å²	9	41.5 Å²	41.5	6%	0.063	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-4.6	178.2	52.8	0	0	0	0	114.1	D150 K154 Y155 F156 R177	D150-S152 PolarHBondContact O-N 2.83Å; D150-S152 VanDerWaalsContact O-N 3.08Å; S152-K154 PolarHBondContact O-N 3.31Å; S152-Y155 WeakPolarHBondContact O-CB 3.41Å; S152-Y155 PolarHBondContact O-N 2.89Å; S152-Y155 VanDerWaalsContact O-N 3.1Å; S152-F156 WeakPolarHBondContact O-CD2 3.42Å; S152-F156 PolarHBondContact O-N 3.06Å; S152-F156 VanDerWaalsContact O-N 3.16Å; S152-R177 WeakPolarHBondContact CB-O 3.46Å; S152-R177 PolarHBondContact OG-O 3.09Å
153	A	98.4	Very high	97.4	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-51.4	-54.1	-178.9	0	0	0	0	0	112.4	A80 Y141 I149 D150 D151 Y155 F156 L157	A80-A153 HydrophobicContact CB-CB 3.67Å; Y141-A153 HydrophobicContact CE2-CB 3.95Å; I149-A153 HydrophobicContact CD1-CB 3.66Å; I149-A153 HydrophobicContact CG1-CB 3.74Å; D150-A153 WeakPolarHBondContact O-CB 3.41Å; D150-A153 PolarHBondContact O-N 3.34Å; D151-A153 VanDerWaalsContact C-N 3.26Å; D151-A153 PolarHBondContact O-N 2.75Å; A153-Y155 VanDerWaalsContact C-N 3.32Å; A153-Y155 PolarHBondContact O-N 3.2Å; A153-F156 PolarHBondContact O-N 3.49Å; A153-L157 HydrophobicContact CB-CD1 4.49Å; A153-L157 VanDerWaalsContact O-CB 3.28Å; A153-L157 WeakPolarHBondContact O-CB 3.29Å; A153-L157 WeakPolarHBondContact O-CG 3.44Å; A153-L157 PolarHBondContact O-N 3.17Å
154	K	97.9	Very high	97.4	Very high	84 Å²	84	36.3 Å²	36.3	37%	0.365	18%	0.184	S	C	.	.	H	α-helix	trans	-60.9	-38.8	179	171.3	170.3	165.4	51.7	0	112.8	Y141 S152 F156 D158	Y141-K154 HydrophobicContact CE1-CB 4Å; Y141-K154 HydrophobicContact CE1-CD 4.25Å; Y141-K154 WeakPolarHBondContact OH-CB 3.18Å; S152-K154 PolarHBondContact O-N 3.31Å; K154-F156 PolarHBondContact O-N 2.88Å; K154-D158 WeakPolarHBondContact CG-OD2 3.49Å; K154-D158 IonicContact NZ-OD1 2.69Å; K154-D158 IonicContact NZ-OD2 3.83Å; K154-D158 PolarHBondContact NZ-OD2 3Å; K154-D158 VanDerWaalsContact O-CB 3.27Å; K154-D158 WeakPolarHBondContact O-CB 3.4Å; K154-D158 VanDerWaalsContact O-CG 3.24Å; K154-D158 PolarHBondContact O-N 3.23Å
155	Y	98.3	Very high	97.5	Very high	61 Å²	61	37.5 Å²	37.5	24%	0.239	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-47	179.5	171	-99.1	0	0	0	111.9	S152 A153 Q173 D174 R177	S152-Y155 WeakPolarHBondContact O-CB 3.41Å; S152-Y155 PolarHBondContact O-N 2.89Å; S152-Y155 VanDerWaalsContact O-N 3.1Å; A153-Y155 VanDerWaalsContact C-N 3.32Å; A153-Y155 PolarHBondContact O-N 3.2Å; Y155-Q173 HydrophobicContact CE2-CG 3.82Å; Y155-Q173 WeakPolarHBondContact OH-CG 3.26Å; Y155-D174 WeakPolarHBondContact CE1-OD1 3.33Å; Y155-D174 PolarHBondContact OH-OD1 3.3Å; Y155-R177 HydrophobicContact CD1-CB 3.85Å; Y155-R177 HydrophobicContact CD1-CG 3.83Å; Y155-R177 HydrophobicContact CE1-CB 4.06Å; Y155-R177 HydrophobicContact CE1-CG 3.99Å; Y155-R177 HydrophobicContact CG-CG 4.14Å
156	F	98.6	Very high	97.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-77	-39.9	179.4	-65.8	-57.9	0	0	0	113	V73 N76 T77 S152 A153 K154 D158 D159 L160 L163 D174 R177 T178	V73-F156 HydrophobicContact CG1-CD1 3.87Å; V73-F156 HydrophobicContact CG1-CE1 3.63Å; V73-F156 HydrophobicContact CG1-CZ 4.32Å; V73-F156 HydrophobicContact CG2-CE1 4.43Å; N76-F156 HydrophobicContact CB-CE2 4.36Å; T77-F156 HydrophobicContact CG2-CB 4.15Å; T77-F156 WeakPolarHBondContact OG1-CB 3.35Å; S152-F156 WeakPolarHBondContact O-CD2 3.42Å; S152-F156 PolarHBondContact O-N 3.06Å; S152-F156 VanDerWaalsContact O-N 3.16Å; A153-F156 PolarHBondContact O-N 3.49Å; K154-F156 PolarHBondContact O-N 2.88Å; F156-D158 PolarHBondContact O-N 3.19Å; F156-D159 CarbonylContact O-C 3.59Å; F156-D159 PolarHBondContact O-N 2.99Å; F156-L160 PolarHBondContact O-N 2.89Å; F156-L163 HydrophobicContact CB-CD2 4.12Å; F156-L163 HydrophobicContact CD1-CD2 4.08Å; F156-L163 HydrophobicContact CG-CD2 4.48Å; F156-D174 HydrophobicContact CE1-CB 4.28Å; F156-D174 WeakPolarHBondContact CE1-OD1 3.38Å; F156-R177 HydrophobicContact CE2-CB 4.26Å; F156-R177 HydrophobicContact CZ-CB 3.94Å; F156-T178 HydrophobicContact CZ-CG2 4.2Å
157	L	98.7	Very high	97.2	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-69.7	-32.1	-177.9	-67.2	175.3	0	0	0	112.7	T77 A80 M81 W132 A153 D159 L160	T77-L157 HydrophobicContact CG2-CD2 4.05Å; A80-L157 HydrophobicContact CB-CD1 4.27Å; A80-L157 HydrophobicContact CB-CG 4.49Å; M81-L157 HydrophobicContact CB-CD2 4.26Å; M81-L157 HydrophobicContact CE-CD1 4.5Å; M81-L157 HydrophobicContact CE-CD2 3.97Å; W132-L157 VanDerWaalsContact CD1-C 3.43Å; W132-L157 HydrophobicContact CD2-CB 3.68Å; W132-L157 HydrophobicContact CD2-CD1 4.14Å; W132-L157 HydrophobicContact CD2-CG 4.46Å; W132-L157 VanDerWaalsContact CE2-CB 3.48Å; W132-L157 HydrophobicContact CE3-CB 4.21Å; W132-L157 HydrophobicContact CE3-CD1 3.78Å; W132-L157 HydrophobicContact CG-CB 3.96Å; W132-L157 HydrophobicContact CH2-CB 4.38Å; W132-L157 HydrophobicContact CH2-CD1 3.99Å; W132-L157 HydrophobicContact CZ2-CB 3.86Å; W132-L157 HydrophobicContact CZ2-CD1 4.32Å; W132-L157 HydrophobicContact CZ3-CD1 3.71Å; W132-L157 VanDerWaalsContact NE1-C 3.28Å; W132-L157 PolarHBondContact NE1-O 3.02Å; A153-L157 HydrophobicContact CB-CD1 4.49Å; A153-L157 VanDerWaalsContact O-CB 3.28Å; A153-L157 WeakPolarHBondContact O-CB 3.29Å; A153-L157 WeakPolarHBondContact O-CG 3.44Å; A153-L157 PolarHBondContact O-N 3.17Å; L157-D159 PolarHBondContact O-N 3.15Å; L157-L160 HydrophobicContact CD2-CD2 4.43Å; L157-L160 VanDerWaalsContact O-CD1 3.29Å; L157-L160 WeakPolarHBondContact O-CD1 3.45Å; L157-L160 VanDerWaalsContact O-CG 3.25Å; L157-L160 WeakPolarHBondContact O-CG 3.42Å
158	D	98.5	Very high	97.2	Very high	69 Å²	69	44.9 Å²	44.9	37%	0.369	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.7	175.2	-74.9	-20.6	0	0	0	113.3	W132 R138 K154 F156	W132-D158 PolarHBondContact NE1-OD1 3.48Å; R138-D158 IonicContact CZ-OD1 2.7Å; R138-D158 IonicContact NH1-OD1 3.44Å; R138-D158 PolarHBondContact NH1-OD1 3.4Å; R138-D158 VanDerWaalsContact NH1-OD1 3.08Å; R138-D158 IonicContact NH2-OD1 3.15Å; R138-D158 PolarHBondContact NH2-OD1 3.38Å; K154-D158 WeakPolarHBondContact CG-OD2 3.49Å; K154-D158 IonicContact NZ-OD1 2.69Å; K154-D158 IonicContact NZ-OD2 3.83Å; K154-D158 PolarHBondContact NZ-OD2 3Å; K154-D158 VanDerWaalsContact O-CB 3.27Å; K154-D158 WeakPolarHBondContact O-CB 3.4Å; K154-D158 VanDerWaalsContact O-CG 3.24Å; K154-D158 PolarHBondContact O-N 3.23Å; F156-D158 PolarHBondContact O-N 3.19Å
159	D	97.9	Very high	97.2	Very high	59 Å²	59	45.6 Å²	45.6	32%	0.316	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	30.9	-174.3	-157.7	8.9	0	0	0	112.8	F156 L157 P161 R162 L163	F156-D159 CarbonylContact O-C 3.59Å; F156-D159 PolarHBondContact O-N 2.99Å; L157-D159 PolarHBondContact O-N 3.15Å; D159-P161 VanDerWaalsContact C-N 3.3Å; D159-R162 PolarHBondContact O-N 3.34Å; D159-R162 WeakPolarHBondContact OD1-CB 3.44Å; D159-R162 WeakPolarHBondContact OD2-CD 3.3Å; D159-R162 IonicContact OD2-CZ 3.38Å; D159-R162 IonicContact OD2-NE 3Å; D159-R162 PolarHBondContact OD2-NE 3.13Å; D159-R162 IonicContact OD2-NH2 3.23Å; D159-L163 WeakPolarHBondContact O-CD1 3.41Å; D159-L163 PolarHBondContact O-N 3.24Å
160	L	98.5	Very high	97.2	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-51.8	-38	177.2	-74.6	165.2	0	0	0	114.2	T77 F120 L128 Q129 W132 F156 L157 R162 L163 S164	T77-L160 HydrophobicContact CG2-CD2 3.77Å; F120-L160 HydrophobicContact CE2-CD2 4.28Å; L128-L160 HydrophobicContact CB-CD1 3.84Å; L128-L160 HydrophobicContact CB-CD2 3.8Å; L128-L160 HydrophobicContact CB-CG 4.45Å; L128-L160 HydrophobicContact CD1-CD2 3.88Å; L128-L160 HydrophobicContact CG-CD2 4.42Å; L128-L160 WeakPolarHBondContact O-CD1 3.36Å; Q129-L160 HydrophobicContact CG-CB 3.74Å; Q129-L160 HydrophobicContact CG-CD1 4.07Å; W132-L160 HydrophobicContact CB-CD1 4.04Å; F156-L160 PolarHBondContact O-N 2.89Å; L157-L160 HydrophobicContact CD2-CD2 4.43Å; L157-L160 VanDerWaalsContact O-CD1 3.29Å; L157-L160 WeakPolarHBondContact O-CD1 3.45Å; L157-L160 VanDerWaalsContact O-CG 3.25Å; L157-L160 WeakPolarHBondContact O-CG 3.42Å; L160-R162 VanDerWaalsContact C-N 3.33Å; L160-R162 PolarHBondContact O-N 3.08Å; L160-L163 PolarHBondContact O-N 3.33Å; L160-S164 VanDerWaalsContact O-CB 3.3Å; L160-S164 WeakPolarHBondContact O-CB 3.41Å; L160-S164 PolarHBondContact O-N 2.94Å; L160-S164 PolarHBondContact O-OG 3.45Å
161	P	97.4	Very high	97.3	Very high	79 Å²	79	46.8 Å²	46.8	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-59	-41	175.6	-26.7	36.7	0	0	0	113.1	D159 S164 A165	D159-P161 VanDerWaalsContact C-N 3.3Å; P161-S164 PolarHBondContact O-N 3.36Å; P161-A165 PolarHBondContact O-N 2.81Å
162	R	98.1	Very high	97.4	Very high	57 Å²	57	47.3 Å²	47.3	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-46.6	176.4	-177.7	-177.1	63.2	100.1	-1.2	111.1	D159 L160 S164 A165 F168 N171 D174	D159-R162 PolarHBondContact O-N 3.34Å; D159-R162 WeakPolarHBondContact OD1-CB 3.44Å; D159-R162 WeakPolarHBondContact OD2-CD 3.3Å; D159-R162 IonicContact OD2-CZ 3.38Å; D159-R162 IonicContact OD2-NE 3Å; D159-R162 PolarHBondContact OD2-NE 3.13Å; D159-R162 IonicContact OD2-NH2 3.23Å; L160-R162 VanDerWaalsContact C-N 3.33Å; L160-R162 PolarHBondContact O-N 3.08Å; R162-S164 PolarHBondContact O-N 3.36Å; R162-A165 WeakPolarHBondContact O-CB 3.46Å; R162-A165 PolarHBondContact O-N 3.24Å; R162-F168 HydrophobicContact CG-CD2 4.27Å; R162-F168 HydrophobicContact CG-CE2 4.42Å; R162-F168 VanDerWaalsContact NH1-CE2 3.33Å; R162-F168 VanDerWaalsContact O-CD2 3.26Å; R162-F168 WeakPolarHBondContact O-CD2 3.34Å; R162-N171 PolarHBondContact NH1-ND2 3.18Å; R162-D174 IonicContact CZ-OD1 2.89Å; R162-D174 IonicContact CZ-OD2 3.71Å; R162-D174 IonicContact NH1-OD1 2.78Å; R162-D174 PolarHBondContact NH1-OD1 2.96Å; R162-D174 IonicContact NH1-OD2 3.45Å; R162-D174 PolarHBondContact NH1-OD2 3.45Å; R162-D174 IonicContact NH2-OD1 3.88Å; R162-D174 PolarHBondContact NH2-OD1 3.4Å; R162-D174 IonicContact NH2-OD2 3.08Å
163	L	98	Very high	97.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-27.9	179	-85.1	65.6	0	0	0	112.2	V73 Y74 T77 F120 F156 D159 L160 A165 F168	V73-L163 HydrophobicContact CG1-CD2 3.89Å; V73-L163 HydrophobicContact CG1-CG 4.19Å; Y74-L163 WeakPolarHBondContact CE1-O 3.45Å; T77-L163 HydrophobicContact CG2-CD2 3.9Å; T77-L163 WeakPolarHBondContact OG1-CD2 3.4Å; F120-L163 HydrophobicContact CE2-CB 3.9Å; F120-L163 HydrophobicContact CE2-CD2 4.45Å; F156-L163 HydrophobicContact CB-CD2 4.12Å; F156-L163 HydrophobicContact CD1-CD2 4.08Å; F156-L163 HydrophobicContact CG-CD2 4.48Å; D159-L163 WeakPolarHBondContact O-CD1 3.41Å; D159-L163 PolarHBondContact O-N 3.24Å; L160-L163 PolarHBondContact O-N 3.33Å; L163-A165 VanDerWaalsContact C-N 3.34Å; L163-F168 HydrophobicContact CB-CE2 4.47Å; L163-F168 HydrophobicContact CD1-CE2 3.9Å; L163-F168 HydrophobicContact CD1-CZ 4.28Å; L163-F168 HydrophobicContact CG-CE2 3.91Å; L163-F168 HydrophobicContact CG-CZ 3.97Å
164	S	97	Very high	97.4	Very high	30 Å²	30	49.4 Å²	49.4	21%	0.21	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.3	179.6	-54.2	0	0	0	0	114	S125 L160 P161 R162	S125-S164 WeakPolarHBondContact CB-OG 3.31Å; S125-S164 WeakPolarHBondContact OG-CB 3.26Å; S125-S164 PolarHBondContact OG-OG 3.21Å; L160-S164 VanDerWaalsContact O-CB 3.3Å; L160-S164 WeakPolarHBondContact O-CB 3.41Å; L160-S164 PolarHBondContact O-N 2.94Å; L160-S164 PolarHBondContact O-OG 3.45Å; P161-S164 PolarHBondContact O-N 3.36Å; R162-S164 PolarHBondContact O-N 3.36Å
165	A	96.9	Very high	97.4	Very high	40 Å²	40	45.7 Å²	45.7	33%	0.331	25%	0.246	S	C	.	.	S	Bend	trans	-66.9	138.4	179.5	0	0	0	0	0	110.8	P161 R162 L163 E167 F168	P161-A165 PolarHBondContact O-N 2.81Å; R162-A165 WeakPolarHBondContact O-CB 3.46Å; R162-A165 PolarHBondContact O-N 3.24Å; L163-A165 VanDerWaalsContact C-N 3.34Å; A165-E167 PolarHBondContact O-N 2.92Å; A165-F168 HydrophobicContact CB-CB 4.46Å; A165-F168 WeakPolarHBondContact O-CB 3.05Å; A165-F168 PolarHBondContact O-N 3.49Å
166	P	92.8	Very high	97.4	Very high	132 Å²	132	42.9 Å²	42.9	86%	0.857	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.7	-179.7	-27.4	34.8	0	0	0	114	F168	P166-F168 VanDerWaalsContact C-N 3.34Å
167	E	93.6	Very high	97.3	Very high	171 Å²	171	45.3 Å²	45.3	80%	0.799	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	21.2	179.6	-62.4	-66.6	174.8	0	0	112.5	A165 L169	A165-E167 PolarHBondContact O-N 2.92Å; E167-L169 PolarHBondContact O-N 3.38Å; E167-L169 VanDerWaalsContact O-N 3.13Å
168	F	97.2	Very high	97.3	Very high	7 Å²	7	45.6 Å²	45.6	3%	0.031	25%	0.246	C	C	.	.			trans	-54	122	-179.3	169	-102.8	0	0	0	111.4	R70 V73 Y74 R162 L163 A165 P166 P170	R70-F168 HydrophobicContact CG-CD1 4Å; R70-F168 HydrophobicContact CG-CE1 4.05Å; R70-F168 PolarHBondContact NE-O 3.08Å; R70-F168 PolarHBondContact NH2-O 3.14Å; V73-F168 HydrophobicContact CB-CE1 4.39Å; V73-F168 HydrophobicContact CB-CZ 4.44Å; V73-F168 HydrophobicContact CG1-CE1 4.17Å; V73-F168 HydrophobicContact CG1-CZ 3.84Å; Y74-F168 AromaticContact CE1-CD1 3.79Å; Y74-F168 HydrophobicContact CE1-CD1 3.79Å; Y74-F168 HydrophobicContact CE1-CE1 4.09Å; Y74-F168 HydrophobicContact CE2-CD1 4.5Å; Y74-F168 AromaticContact CZ-CD1 3.61Å; Y74-F168 VanDerWaalsContact OH-CD1 3.3Å; Y74-F168 WeakPolarHBondContact OH-CD1 2.97Å; R162-F168 HydrophobicContact CG-CD2 4.27Å; R162-F168 HydrophobicContact CG-CE2 4.42Å; R162-F168 VanDerWaalsContact NH1-CE2 3.33Å; R162-F168 VanDerWaalsContact O-CD2 3.26Å; R162-F168 WeakPolarHBondContact O-CD2 3.34Å; L163-F168 HydrophobicContact CB-CE2 4.47Å; L163-F168 HydrophobicContact CD1-CE2 3.9Å; L163-F168 HydrophobicContact CD1-CZ 4.28Å; L163-F168 HydrophobicContact CG-CE2 3.91Å; L163-F168 HydrophobicContact CG-CZ 3.97Å; A165-F168 HydrophobicContact CB-CB 4.46Å; A165-F168 WeakPolarHBondContact O-CB 3.05Å; A165-F168 PolarHBondContact O-N 3.49Å; P166-F168 VanDerWaalsContact C-N 3.34Å; F168-P170 HydrophobicContact CE1-CG 3.88Å; F168-P170 HydrophobicContact CZ-CG 4.09Å
169	L	97.3	Very high	97.2	Very high	62 Å²	62	45 Å²	45	33%	0.325	24%	0.239	S	C	.	.			trans	-122.1	130.2	168.7	-173.9	70.6	0	0	0	108.5	Q63 F66 E67 E167	Q63-L169 HydrophobicContact CG-CD2 4.4Å; F66-L169 HydrophobicContact CB-CD1 3.83Å; F66-L169 HydrophobicContact CB-CD2 4.37Å; F66-L169 HydrophobicContact CB-CG 3.97Å; E67-L169 HydrophobicContact CG-CD1 3.93Å; E167-L169 PolarHBondContact O-N 3.38Å; E167-L169 VanDerWaalsContact O-N 3.13Å
170	P	98.2	Very high	97	Very high	2 Å²	2	46 Å²	46	1%	0.013	25%	0.247	C	C	.	.			trans	-56.9	146.8	172	-26	35.6	0	0	0	111.9	F66 I69 R70 V73 F168 D174	F66-P170 WeakPolarHBondContact CB-O 3.46Å; F66-P170 VanDerWaalsContact CG-O 3.28Å; F66-P170 WeakPolarHBondContact CG-O 3.43Å; F66-P170 WeakPolarHBondContact O-CD 3.31Å; F66-P170 WeakPolarHBondContact O-CG 3.4Å; I69-P170 HydrophobicContact CG2-CB 3.57Å; I69-P170 HydrophobicContact CG2-CG 3.67Å; R70-P170 HydrophobicContact CB-CG 3.75Å; R70-P170 HydrophobicContact CG-CG 4.23Å; V73-P170 HydrophobicContact CG2-CB 4.25Å; V73-P170 HydrophobicContact CG2-CG 4.01Å; F168-P170 HydrophobicContact CE1-CG 3.88Å; F168-P170 HydrophobicContact CZ-CG 4.09Å; P170-D174 VanDerWaalsContact CA-OD2 3.28Å; P170-D174 WeakPolarHBondContact CA-OD2 3.41Å; P170-D174 HydrophobicContact CB-CB 3.87Å
171	N	97.2	Very high	96.8	Very high	61 Å²	61	51 Å²	51	33%	0.326	27%	0.268	S	S	.	.			trans	-104	179.3	169.4	62.4	47.6	0	0	0	110.9	R162 Q173 D174 V175	R162-N171 PolarHBondContact NH1-ND2 3.18Å; N171-Q173 PolarHBondContact O-N 2.9Å; N171-Q173 WeakPolarHBondContact OD1-CA 3.37Å; N171-Q173 WeakPolarHBondContact OD1-CB 3.49Å; N171-Q173 PolarHBondContact OD1-N 3.48Å; N171-D174 VanDerWaalsContact CG-OD2 3.28Å; N171-D174 PolarHBondContact N-OD2 3.46Å; N171-D174 PolarHBondContact ND2-OD2 2.9Å; N171-D174 WeakPolarHBondContact O-CB 3.38Å; N171-D174 PolarHBondContact O-N 3.43Å; N171-D174 VanDerWaalsContact O-N 3.15Å; N171-D174 PolarHBondContact OD1-N 2.77Å; N171-D174 PolarHBondContact OD1-OD2 2.95Å; N171-V175 PolarHBondContact O-N 3.48Å; N171-V175 VanDerWaalsContact O-N 3.09Å
172	E	97.6	Very high	96.6	Very high	65 Å²	65	48.3 Å²	48.3	30%	0.304	25%	0.25	S	C	.	.	H	α-helix	trans	-56.4	-37.1	178.2	-175	173.5	98	0	0	113	I55 F61 V175 L176	I55-E172 HydrophobicContact CD1-CG 3.53Å; I55-E172 HydrophobicContact CG1-CG 4.12Å; I55-E172 WeakPolarHBondContact CG1-OE2 3.37Å; F61-E172 HydrophobicContact CD2-CG 4.2Å; E172-V175 WeakPolarHBondContact O-CB 3.27Å; E172-V175 PolarHBondContact O-N 2.67Å; E172-L176 HydrophobicContact CG-CD1 4.39Å; E172-L176 WeakPolarHBondContact O-CG 3.31Å; E172-L176 PolarHBondContact O-N 3.39Å
173	Q	97.7	Very high	96.2	Very high	53 Å²	53	50.1 Å²	50.1	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-70.2	-35.8	179.1	-171.7	64.9	-9.8	0	0	112.2	Y155 N171 V175 L176 R177 T327	Y155-Q173 HydrophobicContact CE2-CG 3.82Å; Y155-Q173 WeakPolarHBondContact OH-CG 3.26Å; N171-Q173 PolarHBondContact O-N 2.9Å; N171-Q173 WeakPolarHBondContact OD1-CA 3.37Å; N171-Q173 WeakPolarHBondContact OD1-CB 3.49Å; N171-Q173 PolarHBondContact OD1-N 3.48Å; Q173-V175 VanDerWaalsContact C-N 3.32Å; Q173-L176 PolarHBondContact O-N 3.1Å; Q173-R177 HydrophobicContact CG-CG 4.26Å; Q173-R177 VanDerWaalsContact O-CB 3.32Å; Q173-R177 WeakPolarHBondContact O-CB 3.37Å; Q173-R177 WeakPolarHBondContact O-CG 3.18Å; Q173-R177 PolarHBondContact O-N 3.01Å; Q173-T327 PolarHBondContact NE2-O 3.21Å; Q173-T327 PolarHBondContact OE1-O 3.13Å
174	D	98.3	Very high	95.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-45.1	170.4	-61.4	-51.7	0	0	0	110.5	V73 Y155 F156 R162 P170 N171 L176 R177 T178	V73-D174 HydrophobicContact CG2-CB 4.09Å; Y155-D174 WeakPolarHBondContact CE1-OD1 3.33Å; Y155-D174 PolarHBondContact OH-OD1 3.3Å; F156-D174 HydrophobicContact CE1-CB 4.28Å; F156-D174 WeakPolarHBondContact CE1-OD1 3.38Å; R162-D174 IonicContact CZ-OD1 2.89Å; R162-D174 IonicContact CZ-OD2 3.71Å; R162-D174 IonicContact NH1-OD1 2.78Å; R162-D174 PolarHBondContact NH1-OD1 2.96Å; R162-D174 IonicContact NH1-OD2 3.45Å; R162-D174 PolarHBondContact NH1-OD2 3.45Å; R162-D174 IonicContact NH2-OD1 3.88Å; R162-D174 PolarHBondContact NH2-OD1 3.4Å; R162-D174 IonicContact NH2-OD2 3.08Å; P170-D174 VanDerWaalsContact CA-OD2 3.28Å; P170-D174 WeakPolarHBondContact CA-OD2 3.41Å; P170-D174 HydrophobicContact CB-CB 3.87Å; N171-D174 VanDerWaalsContact CG-OD2 3.28Å; N171-D174 PolarHBondContact N-OD2 3.46Å; N171-D174 PolarHBondContact ND2-OD2 2.9Å; N171-D174 WeakPolarHBondContact O-CB 3.38Å; N171-D174 PolarHBondContact O-N 3.43Å; N171-D174 VanDerWaalsContact O-N 3.15Å; N171-D174 PolarHBondContact OD1-N 2.77Å; N171-D174 PolarHBondContact OD1-OD2 2.95Å; D174-L176 VanDerWaalsContact C-N 3.32Å; D174-L176 PolarHBondContact O-N 3.19Å; D174-R177 PolarHBondContact O-N 2.81Å; D174-R177 VanDerWaalsContact O-N 3.17Å; D174-T178 WeakPolarHBondContact O-CG2 3.28Å; D174-T178 PolarHBondContact O-N 2.7Å
175	V	97.8	Very high	95.6	Very high	6 Å²	6	53.6 Å²	53.6	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-58.1	-44.6	176.1	176.9	0	0	0	0	110.8	K51 F61 F66 I69 N171 E172 Q173 R177 T178	K51-V175 HydrophobicContact CD-CG1 4.17Å; K51-V175 PolarHBondContact NZ-O 3.34Å; F61-V175 HydrophobicContact CD1-CG1 4.04Å; F61-V175 HydrophobicContact CD2-CG1 4.15Å; F61-V175 HydrophobicContact CE1-CG1 3.69Å; F61-V175 HydrophobicContact CE2-CB 4.46Å; F61-V175 HydrophobicContact CE2-CG1 3.78Å; F61-V175 HydrophobicContact CG-CG1 4.28Å; F61-V175 HydrophobicContact CZ-CG1 3.56Å; F66-V175 HydrophobicContact CD1-CG2 3.68Å; F66-V175 HydrophobicContact CE1-CG2 3.8Å; I69-V175 HydrophobicContact CG2-CG2 3.89Å; N171-V175 PolarHBondContact O-N 3.48Å; N171-V175 VanDerWaalsContact O-N 3.09Å; E172-V175 WeakPolarHBondContact O-CB 3.27Å; E172-V175 PolarHBondContact O-N 2.67Å; Q173-V175 VanDerWaalsContact C-N 3.32Å; V175-R177 VanDerWaalsContact C-N 3.34Å; V175-R177 PolarHBondContact O-N 3.5Å; V175-T178 PolarHBondContact O-OG1 2.95Å
176	L	97.8	Very high	95.5	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-67.1	-32.2	178.7	-70.1	172	0	0	0	113.2	T48 K51 Q52 I55 E172 Q173 D174 T327	T48-L176 HydrophobicContact CG2-CB 4.33Å; T48-L176 HydrophobicContact CG2-CD2 3.91Å; K51-L176 HydrophobicContact CB-CD2 3.75Å; Q52-L176 HydrophobicContact CG-CD2 3.91Å; I55-L176 HydrophobicContact CD1-CD1 3.93Å; I55-L176 HydrophobicContact CD1-CD2 3.89Å; I55-L176 HydrophobicContact CD1-CG 4.11Å; E172-L176 HydrophobicContact CG-CD1 4.39Å; E172-L176 WeakPolarHBondContact O-CG 3.31Å; E172-L176 PolarHBondContact O-N 3.39Å; Q173-L176 PolarHBondContact O-N 3.1Å; D174-L176 VanDerWaalsContact C-N 3.32Å; D174-L176 PolarHBondContact O-N 3.19Å; L176-T327 HydrophobicContact CB-CG2 4.35Å
177	R	97.9	Very high	95.6	Very high	51 Å²	51	51.9 Å²	51.9	19%	0.192	27%	0.267	C	S	.	.	H	α-helix	trans	-90.8	-17.4	-176.9	-65.6	-75.9	-178.3	179.5	4.5	114	S152 Y155 F156 Q173 D174 V175 T327	S152-R177 WeakPolarHBondContact CB-O 3.46Å; S152-R177 PolarHBondContact OG-O 3.09Å; Y155-R177 HydrophobicContact CD1-CB 3.85Å; Y155-R177 HydrophobicContact CD1-CG 3.83Å; Y155-R177 HydrophobicContact CE1-CB 4.06Å; Y155-R177 HydrophobicContact CE1-CG 3.99Å; Y155-R177 HydrophobicContact CG-CG 4.14Å; F156-R177 HydrophobicContact CE2-CB 4.26Å; F156-R177 HydrophobicContact CZ-CB 3.94Å; Q173-R177 HydrophobicContact CG-CG 4.26Å; Q173-R177 VanDerWaalsContact O-CB 3.32Å; Q173-R177 WeakPolarHBondContact O-CB 3.37Å; Q173-R177 WeakPolarHBondContact O-CG 3.18Å; Q173-R177 PolarHBondContact O-N 3.01Å; D174-R177 PolarHBondContact O-N 2.81Å; D174-R177 VanDerWaalsContact O-N 3.17Å; V175-R177 VanDerWaalsContact C-N 3.34Å; V175-R177 PolarHBondContact O-N 3.5Å; R177-T327 HydrophobicContact CG-CG2 4.38Å; R177-T327 VanDerWaalsContact CZ-CB 3.44Å; R177-T327 PolarHBondContact NH1-OG1 2.7Å; R177-T327 PolarHBondContact NH2-OG1 3.06Å
178	T	97.7	Very high	95.6	Very high	8 Å²	8	44.4 Å²	44.4	5%	0.049	23%	0.233	C	C	.	.			trans	-62.3	138.7	174.9	54.5	0	0	0	0	112.2	K51 I69 V72 V73 N76 F156 D174 V175	K51-T178 PolarHBondContact NZ-OG1 3.29Å; I69-T178 HydrophobicContact CD1-CG2 4.21Å; I69-T178 HydrophobicContact CG1-CG2 3.71Å; V72-T178 HydrophobicContact CG1-CG2 4.2Å; V73-T178 HydrophobicContact CG2-CG2 3.55Å; N76-T178 WeakPolarHBondContact OD1-CA 3.37Å; F156-T178 HydrophobicContact CZ-CG2 4.2Å; D174-T178 WeakPolarHBondContact O-CG2 3.28Å; D174-T178 PolarHBondContact O-N 2.7Å; V175-T178 PolarHBondContact O-OG1 2.95Å
179	R	95.8	Very high	95.5	Very high	58 Å²	58	47.9 Å²	47.9	22%	0.219	25%	0.251	C	S	.	.			trans	-106.1	111.2	177	-178.7	72.9	-176.9	80	14.6	109.7	E43 N76 K181	E43-R179 IonicContact OE1-CZ 3.08Å; E43-R179 IonicContact OE1-NE 3.56Å; E43-R179 PolarHBondContact OE1-NE 2.72Å; E43-R179 IonicContact OE1-NH2 3.17Å; E43-R179 PolarHBondContact OE1-NH2 3.24Å; N76-R179 PolarHBondContact ND2-O 2.99Å; N76-R179 PolarHBondContact OD1-N 3.01Å; N76-R179 PolarHBondContact OD1-O 3.35Å; R179-K181 VanDerWaalsContact NH1-CA 3.28Å; R179-K181 VanDerWaalsContact NH1-N 3.19Å
180	V	95.2	Very high	95.4	Very high	80 Å²	80	45.4 Å²	45.4	49%	0.485	24%	0.238	S	C	.	.			trans	-121.1	127.1	166.5	-178.4	0	0	0	0	108.4	V72 T182	V72-V180 HydrophobicContact CG1-CG2 3.65Å; V72-V180 HydrophobicContact CG2-CG2 4.37Å; V180-T182 PolarHBondContact O-N 2.83Å
181	K	94.1	Very high	95.2	Very high	107 Å²	107	51 Å²	51	47%	0.465	26%	0.263	S	S	.	.			trans	-61.7	107.9	173.9	-179.8	173.6	176	-177.2	0	109	R179 T183	R179-K181 VanDerWaalsContact NH1-CA 3.28Å; R179-K181 VanDerWaalsContact NH1-N 3.19Å; K181-T183 PolarHBondContact O-N 3.17Å
182	T	93	Very high	94.8	Very high	22 Å²	22	49.9 Å²	49.9	14%	0.135	26%	0.257	C	S	.	.			trans	-62.7	116.3	174.2	-43.4	0	0	0	0	109.5	S47 V180 G203	S47-T182 PolarHBondContact OG-OG1 2.97Å; V180-T182 PolarHBondContact O-N 2.83Å; T182-G203 WeakPolarHBondContact O-CA 3.3Å
183	T	90.3	Very high	94.4	Very high	96 Å²	96	53.3 Å²	53.3	59%	0.589	27%	0.271	S	S	*	.			trans	-109.5	138.5	172.3	55.3	0	0	0	0	108.3	K181	K181-T183 PolarHBondContact O-N 3.17Å
184	G	89.9	Confident	93.9	Very high	22 Å²	22	53.5 Å²	53.5	23%	0.227	29%	0.287	C	S	.	.	S	Bend	trans	69.8	-144.1	-180	0	0	0	0	0	114.1	G203 E208	G184-G203 PolarHBondContact O-N 2.95Å; G184-E208 PolarHBondContact N-OE2 3.26Å; G184-E208 VanDerWaalsContact N-OE2 3.08Å
185	I	92.2	Very high	93.6	Very high	80 Å²	80	53.9 Å²	53.9	41%	0.41	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.8	-169.4	-57.8	163.1	0	0	0	108.3	I200 V202 H214 C215	I185-I200 HydrophobicContact CG2-CG2 3.52Å; I185-V202 HydrophobicContact CG1-CG1 4.07Å; I185-V202 HydrophobicContact CG2-CG1 4.38Å; I185-H214 HydrophobicContact CD1-CB 4.39Å; I185-C215 WeakPolarHBondContact CD1-SG 3.43Å
186	T	93.5	Very high	93.3	Very high	66 Å²	66	55.1 Å²	55.1	41%	0.405	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.2	174.9	-56	0	0	0	0	109.4	L50 I200 D201	L50-T186 HydrophobicContact CD2-CG2 3.81Å; T186-I200 WeakPolarHBondContact O-CA 3.22Å; T186-D201 PolarHBondContact N-O 3.33Å; T186-D201 PolarHBondContact O-N 3.1Å
187	E	94.7	Very high	93.2	Very high	71 Å²	71	55 Å²	55	33%	0.332	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.9	-174.3	-177.4	177	157.7	0	0	111.8	L189 R198 V199 I200	E187-L189 HydrophobicContact CG-CG 4.43Å; E187-L189 WeakPolarHBondContact OE1-CD2 3.14Å; E187-L189 WeakPolarHBondContact OE1-CG 3.38Å; E187-R198 HydrophobicContact CG-CG 4.11Å; E187-R198 VanDerWaalsContact OE1-CD 3.26Å; E187-R198 WeakPolarHBondContact OE1-CD 3.48Å; E187-R198 WeakPolarHBondContact OE1-CG 3.35Å; E187-R198 IonicContact OE1-CZ 3.55Å; E187-R198 IonicContact OE1-NE 3.45Å; E187-R198 PolarHBondContact OE1-NE 2.92Å; E187-R198 IonicContact OE1-NH2 3.54Å; E187-R198 IonicContact OE2-CZ 3.67Å; E187-R198 VanDerWaalsContact OE2-CZ 3.29Å; E187-R198 IonicContact OE2-NE 2.76Å; E187-R198 PolarHBondContact OE2-NE 2.96Å; E187-R198 IonicContact OE2-NH2 3.84Å; E187-R198 PolarHBondContact OE2-NH2 3.46Å; E187-V199 WeakPolarHBondContact CA-O 3.34Å; E187-I200 HydrophobicContact CG-CG1 4.44Å
188	V	94.8	Very high	93.1	Very high	14 Å²	14	56.8 Å²	56.8	9%	0.085	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.2	168.3	176.5	0	0	0	0	108.9	L50 K58 F190 V199	L50-V188 HydrophobicContact CD1-CB 3.71Å; L50-V188 HydrophobicContact CD1-CG2 3.59Å; L50-V188 HydrophobicContact CD2-CG2 3.96Å; L50-V188 HydrophobicContact CG-CB 4.32Å; L50-V188 HydrophobicContact CG-CG2 3.62Å; K58-V188 HydrophobicContact CD-CG1 3.76Å; V188-F190 HydrophobicContact CG1-CD1 4.3Å; V188-V199 PolarHBondContact N-O 3.31Å; V188-V199 PolarHBondContact O-N 3.27Å
189	L	95.3	Very high	93.1	Very high	80 Å²	80	56.4 Å²	56.4	42%	0.419	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.6	173.7	-67.5	165.3	0	0	0	109.9	K58 E187 T196 F197 R198	K58-L189 WeakPolarHBondContact CD-O 3.1Å; E187-L189 HydrophobicContact CG-CG 4.43Å; E187-L189 WeakPolarHBondContact OE1-CD2 3.14Å; E187-L189 WeakPolarHBondContact OE1-CG 3.38Å; L189-T196 HydrophobicContact CD2-CG2 4.29Å; L189-F197 VanDerWaalsContact CA-O 3.29Å; L189-F197 WeakPolarHBondContact CA-O 3.32Å; L189-R198 HydrophobicContact CD2-CB 3.68Å; L189-R198 HydrophobicContact CD2-CG 3.88Å
190	F	94.9	Very high	93.2	Very high	10 Å²	10	53.8 Å²	53.8	4%	0.044	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159.1	172	62.8	-94.5	0	0	0	111.4	M53 H57 K58 V188 L192 F197 V199 L340	M53-F190 HydrophobicContact CB-CE1 4.2Å; M53-F190 HydrophobicContact CG-CE1 4.42Å; M53-F190 HydrophobicContact SD-CE1 3.69Å; M53-F190 HydrophobicContact SD-CZ 3.66Å; H57-F190 HydrophobicContact CB-CB 3.98Å; H57-F190 HydrophobicContact CB-CD1 4.11Å; H57-F190 HydrophobicContact CB-CD2 3.46Å; H57-F190 VanDerWaalsContact CB-CD2 3.46Å; H57-F190 HydrophobicContact CB-CE1 4.45Å; H57-F190 HydrophobicContact CB-CE2 3.86Å; H57-F190 HydrophobicContact CB-CG 3.6Å; H57-F190 HydrophobicContact CB-CZ 4.33Å; H57-F190 AromaticContact CD2-CE2 3.73Å; H57-F190 AromaticContact CD2-CZ 3.74Å; H57-F190 AromaticContact CG-CD2 3.95Å; H57-F190 AromaticContact CG-CE2 3.83Å; H57-F190 WeakPolarHBondContact O-CB 3.35Å; K58-F190 HydrophobicContact CB-CB 4.42Å; V188-F190 HydrophobicContact CG1-CD1 4.3Å; F190-L192 HydrophobicContact CD2-CB 4.26Å; F190-L192 HydrophobicContact CE2-CB 4.13Å; F190-L192 HydrophobicContact CE2-CD2 4.5Å; F190-F197 HydrophobicContact CD1-CB 4.12Å; F190-F197 HydrophobicContact CD2-CB 3.86Å; F190-F197 HydrophobicContact CD2-CD2 4.36Å; F190-F197 HydrophobicContact CD2-CG 4.37Å; F190-F197 HydrophobicContact CE1-CB 3.78Å; F190-F197 HydrophobicContact CE2-CB 3.49Å; F190-F197 VanDerWaalsContact CE2-CB 3.49Å; F190-F197 HydrophobicContact CE2-CD1 4.49Å; F190-F197 AromaticContact CE2-CD2 3.83Å; F190-F197 HydrophobicContact CE2-CD2 3.83Å; F190-F197 AromaticContact CE2-CG 3.68Å; F190-F197 HydrophobicContact CE2-CG 3.68Å; F190-F197 HydrophobicContact CG-CB 4.17Å; F190-F197 HydrophobicContact CZ-CB 3.45Å; F190-F197 VanDerWaalsContact CZ-CB 3.45Å; F190-F197 HydrophobicContact CZ-CD1 4.32Å; F190-F197 HydrophobicContact CZ-CD2 4.43Å; F190-F197 AromaticContact CZ-CG 3.82Å; F190-F197 HydrophobicContact CZ-CG 3.82Å; F190-F197 PolarHBondContact N-O 2.92Å; F190-F197 VanDerWaalsContact N-O 3.1Å; F190-F197 PolarHBondContact O-N 2.73Å; F190-V199 HydrophobicContact CD1-CG2 4.49Å; F190-V199 HydrophobicContact CE1-CG2 3.61Å; F190-V199 HydrophobicContact CZ-CG2 4.29Å; F190-L340 HydrophobicContact CZ-CD1 4.4Å
191	E	92.6	Very high	93.3	Very high	118 Å²	118	50 Å²	50	55%	0.551	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.3	177.4	-68.1	-62.9	142.8	0	0	110.3	L195 T196	E191-L195 WeakPolarHBondContact CA-O 3.47Å; E191-L195 VanDerWaalsContact OE2-C 3.29Å; E191-T196 WeakPolarHBondContact OE1-CA 3.26Å; E191-T196 WeakPolarHBondContact OE1-CB 3.45Å; E191-T196 VanDerWaalsContact OE1-CG2 3.32Å; E191-T196 WeakPolarHBondContact OE1-CG2 3.44Å; E191-T196 PolarHBondContact OE1-OG1 3.39Å; E191-T196 PolarHBondContact OE2-N 2.97Å; E191-T196 PolarHBondContact OE2-OG1 2.94Å
192	L	90.8	Very high	93.4	Very high	38 Å²	38	45 Å²	45	20%	0.199	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	126.6	175.2	-179.4	66.5	0	0	0	110	F190 G194 L195 F197 L340 I344	F190-L192 HydrophobicContact CD2-CB 4.26Å; F190-L192 HydrophobicContact CE2-CB 4.13Å; F190-L192 HydrophobicContact CE2-CD2 4.5Å; L192-G194 PolarHBondContact O-N 3.32Å; L192-G194 VanDerWaalsContact O-N 3.13Å; L192-L195 PolarHBondContact N-O 2.97Å; L192-L195 PolarHBondContact O-N 2.98Å; L192-F197 HydrophobicContact CB-CD2 3.85Å; L192-F197 HydrophobicContact CB-CE2 3.8Å; L192-F197 HydrophobicContact CD2-CE2 4.18Å; L192-F197 HydrophobicContact CG-CE2 4.39Å; L192-L340 HydrophobicContact CD2-CB 4.14Å; L192-L340 HydrophobicContact CD2-CD1 3.7Å; L192-L340 HydrophobicContact CD2-CG 4.49Å; L192-I344 HydrophobicContact CD2-CD1 4.33Å
193	K	87.7	Confident	93.5	Very high	137 Å²	137	44 Å²	44	60%	0.596	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	35.9	179.3	-62.1	179.4	179	176.4	0	113.4	L195 D341 I344	K193-L195 VanDerWaalsContact C-N 3.32Å; K193-D341 VanDerWaalsContact NZ-CG 3.29Å; K193-D341 IonicContact NZ-OD1 2.73Å; K193-D341 PolarHBondContact NZ-OD1 2.79Å; K193-D341 IonicContact NZ-OD2 2.97Å; K193-D341 PolarHBondContact NZ-OD2 3.42Å; K193-I344 HydrophobicContact CB-CD1 4.37Å; K193-I344 HydrophobicContact CD-CD1 4Å
194	G	87.1	Confident	93.7	Very high	57 Å²	57	39.6 Å²	39.6	59%	0.588	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.1	11.4	179.2	0	0	0	0	0	115.2	L192	L192-G194 PolarHBondContact O-N 3.32Å; L192-G194 VanDerWaalsContact O-N 3.13Å
195	L	91.7	Very high	93.9	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	140.6	175.9	-63	164.6	0	0	0	110	R32 I34 E191 L192 K193 F197 I344	R32-L195 HydrophobicContact CB-CD2 4.18Å; R32-L195 HydrophobicContact CG-CD2 4.48Å; R32-L195 WeakPolarHBondContact O-CA 3.46Å; I34-L195 HydrophobicContact CD1-CB 4.33Å; I34-L195 HydrophobicContact CD1-CD1 3.76Å; E191-L195 WeakPolarHBondContact CA-O 3.47Å; E191-L195 VanDerWaalsContact OE2-C 3.29Å; L192-L195 PolarHBondContact N-O 2.97Å; L192-L195 PolarHBondContact O-N 2.98Å; K193-L195 VanDerWaalsContact C-N 3.32Å; L195-F197 HydrophobicContact CB-CE2 4.13Å; L195-I344 HydrophobicContact CD1-CB 4.32Å; L195-I344 HydrophobicContact CD1-CD1 4.46Å; L195-I344 HydrophobicContact CD1-CG1 3.85Å; L195-I344 HydrophobicContact CD1-CG2 3.86Å
196	T	93.4	Very high	94	Very high	32 Å²	32	39.9 Å²	39.9	20%	0.196	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	115.9	175.1	-52	0	0	0	0	109.1	R32 T33 I34 L189 E191	R32-T196 PolarHBondContact O-N 3.14Å; T33-T196 CarbonylContact C-O 3.5Å; T33-T196 VanDerWaalsContact CA-O 3.27Å; T33-T196 WeakPolarHBondContact CA-O 3.32Å; I34-T196 PolarHBondContact N-O 3.45Å; L189-T196 HydrophobicContact CD2-CG2 4.29Å; E191-T196 WeakPolarHBondContact OE1-CA 3.26Å; E191-T196 WeakPolarHBondContact OE1-CB 3.45Å; E191-T196 VanDerWaalsContact OE1-CG2 3.32Å; E191-T196 WeakPolarHBondContact OE1-CG2 3.44Å; E191-T196 PolarHBondContact OE1-OG1 3.39Å; E191-T196 PolarHBondContact OE2-N 2.97Å; E191-T196 PolarHBondContact OE2-OG1 2.94Å
197	F	95.5	Very high	94	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.4	172.7	-79	-94.5	0	0	0	110.7	I34 L36 L189 F190 L192 L195 L340 I344	I34-F197 HydrophobicContact CB-CD1 3.92Å; I34-F197 HydrophobicContact CB-CE1 3.83Å; I34-F197 HydrophobicContact CB-CG 4.48Å; I34-F197 HydrophobicContact CB-CZ 4.32Å; I34-F197 HydrophobicContact CD1-CE1 3.82Å; I34-F197 HydrophobicContact CD1-CE2 4.13Å; I34-F197 HydrophobicContact CD1-CZ 3.54Å; I34-F197 HydrophobicContact CG1-CE1 4.43Å; I34-F197 HydrophobicContact CG1-CZ 4.49Å; I34-F197 HydrophobicContact CG2-CD1 3.84Å; I34-F197 HydrophobicContact CG2-CE1 3.59Å; I34-F197 HydrophobicContact CG2-CZ 4.41Å; I34-F197 WeakPolarHBondContact O-CA 3.44Å; L36-F197 HydrophobicContact CD1-CD1 3.88Å; L36-F197 HydrophobicContact CD1-CE1 4.29Å; L36-F197 HydrophobicContact CG-CD1 4.19Å; L189-F197 VanDerWaalsContact CA-O 3.29Å; L189-F197 WeakPolarHBondContact CA-O 3.32Å; F190-F197 HydrophobicContact CD1-CB 4.12Å; F190-F197 HydrophobicContact CD2-CB 3.86Å; F190-F197 HydrophobicContact CD2-CD2 4.36Å; F190-F197 HydrophobicContact CD2-CG 4.37Å; F190-F197 HydrophobicContact CE1-CB 3.78Å; F190-F197 HydrophobicContact CE2-CB 3.49Å; F190-F197 VanDerWaalsContact CE2-CB 3.49Å; F190-F197 HydrophobicContact CE2-CD1 4.49Å; F190-F197 AromaticContact CE2-CD2 3.83Å; F190-F197 HydrophobicContact CE2-CD2 3.83Å; F190-F197 AromaticContact CE2-CG 3.68Å; F190-F197 HydrophobicContact CE2-CG 3.68Å; F190-F197 HydrophobicContact CG-CB 4.17Å; F190-F197 HydrophobicContact CZ-CB 3.45Å; F190-F197 VanDerWaalsContact CZ-CB 3.45Å; F190-F197 HydrophobicContact CZ-CD1 4.32Å; F190-F197 HydrophobicContact CZ-CD2 4.43Å; F190-F197 AromaticContact CZ-CG 3.82Å; F190-F197 HydrophobicContact CZ-CG 3.82Å; F190-F197 PolarHBondContact N-O 2.92Å; F190-F197 VanDerWaalsContact N-O 3.1Å; F190-F197 PolarHBondContact O-N 2.73Å; L192-F197 HydrophobicContact CB-CD2 3.85Å; L192-F197 HydrophobicContact CB-CE2 3.8Å; L192-F197 HydrophobicContact CD2-CE2 4.18Å; L192-F197 HydrophobicContact CG-CE2 4.39Å; L195-F197 HydrophobicContact CB-CE2 4.13Å; F197-L340 HydrophobicContact CD1-CD2 3.79Å; F197-L340 HydrophobicContact CE1-CD2 3.4Å; F197-L340 VanDerWaalsContact CE1-CD2 3.4Å; F197-L340 HydrophobicContact CZ-CD2 4.03Å; F197-I344 HydrophobicContact CE2-CD1 4.07Å; F197-I344 HydrophobicContact CE2-CG1 4.25Å; F197-I344 HydrophobicContact CZ-CD1 3.84Å; F197-I344 HydrophobicContact CZ-CG1 3.69Å
198	R	95.9	Very high	94	Very high	88 Å²	88	37.6 Å²	37.6	33%	0.332	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	99.2	174.4	178.7	171.7	-171.6	-155.6	-1	109.5	T33 I34 K35 L36 E187 L189 I200	T33-R198 HydrophobicContact CG2-CB 4.23Å; I34-R198 PolarHBondContact O-N 3.04Å; K35-R198 CarbonylContact C-O 3.56Å; K35-R198 WeakPolarHBondContact CA-O 3.06Å; L36-R198 PolarHBondContact N-O 3.49Å; E187-R198 HydrophobicContact CG-CG 4.11Å; E187-R198 VanDerWaalsContact OE1-CD 3.26Å; E187-R198 WeakPolarHBondContact OE1-CD 3.48Å; E187-R198 WeakPolarHBondContact OE1-CG 3.35Å; E187-R198 IonicContact OE1-CZ 3.55Å; E187-R198 IonicContact OE1-NE 3.45Å; E187-R198 PolarHBondContact OE1-NE 2.92Å; E187-R198 IonicContact OE1-NH2 3.54Å; E187-R198 IonicContact OE2-CZ 3.67Å; E187-R198 VanDerWaalsContact OE2-CZ 3.29Å; E187-R198 IonicContact OE2-NE 2.76Å; E187-R198 PolarHBondContact OE2-NE 2.96Å; E187-R198 IonicContact OE2-NH2 3.84Å; E187-R198 PolarHBondContact OE2-NH2 3.46Å; L189-R198 HydrophobicContact CD2-CB 3.68Å; L189-R198 HydrophobicContact CD2-CG 3.88Å; R198-I200 HydrophobicContact CG-CD1 4.42Å; R198-I200 HydrophobicContact CG-CG1 4.21Å
199	V	97	Very high	94	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.7	-179.5	-168.1	0	0	0	0	109.8	L36 L38 L50 E187 V188 F190	L36-V199 HydrophobicContact CB-CG1 4.3Å; L36-V199 HydrophobicContact CB-CG2 4.24Å; L36-V199 HydrophobicContact CD1-CG2 4.06Å; L36-V199 HydrophobicContact CG-CG2 4.42Å; L36-V199 WeakPolarHBondContact O-CA 3.38Å; L38-V199 HydrophobicContact CD1-CG1 4Å; L38-V199 HydrophobicContact CD2-CG1 4.01Å; L38-V199 HydrophobicContact CG-CG1 3.88Å; L50-V199 HydrophobicContact CD1-CB 3.8Å; L50-V199 HydrophobicContact CD1-CG1 3.61Å; E187-V199 WeakPolarHBondContact CA-O 3.34Å; V188-V199 PolarHBondContact N-O 3.31Å; V188-V199 PolarHBondContact O-N 3.27Å; F190-V199 HydrophobicContact CD1-CG2 4.49Å; F190-V199 HydrophobicContact CE1-CG2 3.61Å; F190-V199 HydrophobicContact CZ-CG2 4.29Å
200	I	97.4	Very high	93.9	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.3	-175.8	-57.6	-174.8	0	0	0	109.8	K35 L36 L37 L38 I185 T186 E187 R198 V202 C215	K35-I200 HydrophobicContact CD-CD1 4.32Å; K35-I200 HydrophobicContact CG-CD1 4.26Å; L36-I200 PolarHBondContact O-N 2.96Å; L37-I200 HydrophobicContact CD1-CB 3.9Å; L37-I200 HydrophobicContact CD1-CG2 3.86Å; L38-I200 WeakPolarHBondContact CB-O 3.33Å; L38-I200 PolarHBondContact N-O 3.27Å; I185-I200 HydrophobicContact CG2-CG2 3.52Å; T186-I200 WeakPolarHBondContact O-CA 3.22Å; E187-I200 HydrophobicContact CG-CG1 4.44Å; R198-I200 HydrophobicContact CG-CD1 4.42Å; R198-I200 HydrophobicContact CG-CG1 4.21Å; I200-V202 HydrophobicContact CG2-CG1 4.17Å; I200-C215 HydrophobicContact CG2-CB 4.42Å
201	D	97.2	Very high	93.8	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.011	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.1	169.3	-177.1	34.4	0	0	0	110.6	L38 K46 S47 L50 T186	L38-D201 HydrophobicContact CD1-CB 4.32Å; K46-D201 WeakPolarHBondContact CB-OD1 3.38Å; S47-D201 VanDerWaalsContact CA-OD2 3.3Å; S47-D201 WeakPolarHBondContact CA-OD2 3.35Å; S47-D201 VanDerWaalsContact CB-OD2 3.28Å; S47-D201 WeakPolarHBondContact CB-OD2 3.4Å; S47-D201 PolarHBondContact OG-OD2 2.73Å; L50-D201 HydrophobicContact CB-CB 4.33Å; L50-D201 HydrophobicContact CD2-CB 3.56Å; L50-D201 HydrophobicContact CG-CB 4.39Å; T186-D201 PolarHBondContact N-O 3.33Å; T186-D201 PolarHBondContact O-N 3.1Å
202	V	96.4	Very high	93.9	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.4	-178.1	-66.2	0	0	0	0	110.7	L39 K46 I185 I200 G204 W212	L39-V202 HydrophobicContact CD2-CG2 3.71Å; K46-V202 WeakPolarHBondContact CE-O 3.13Å; I185-V202 HydrophobicContact CG1-CG1 4.07Å; I185-V202 HydrophobicContact CG2-CG1 4.38Å; I200-V202 HydrophobicContact CG2-CG1 4.17Å; V202-G204 PolarHBondContact O-N 2.85Å; V202-W212 HydrophobicContact CG2-CD2 4.34Å; V202-W212 HydrophobicContact CG2-CG 4.15Å; V202-W212 HydrophobicContact CG2-CZ2 4.4Å; V202-W212 VanDerWaalsContact CG2-NE1 3.28Å
203	G	95.6	Very high	94	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	22%	0.221	C	C	.	.			trans	-55.2	130.1	174.3	0	0	0	0	0	112.4	T182 G184 E208 W212	T182-G203 WeakPolarHBondContact O-CA 3.3Å; G184-G203 PolarHBondContact O-N 2.95Å; G203-E208 WeakPolarHBondContact O-CB 3.41Å; G203-W212 PolarHBondContact O-NE1 3.44Å
204	G	94.2	Very high	94.2	Very high	2 Å²	2	44.8 Å²	44.8	2%	0.021	22%	0.223	C	C	.	.			trans	-93.8	-16.6	-175.1	0	0	0	0	0	115.6	G40 G42 V202 R209	G40-G204 WeakPolarHBondContact O-CA 3.21Å; G42-G204 VanDerWaalsContact N-C 3.3Å; G42-G204 PolarHBondContact N-O 3.49Å; V202-G204 PolarHBondContact O-N 2.85Å; G204-R209 PolarHBondContact O-NE 2.84Å
205	Q	94.5	Very high	94.5	Very high	18 Å²	18	42.3 Å²	42.3	8%	0.084	20%	0.197	C	C	.	.	S	Bend	trans	-63.7	151.4	179.2	-64.8	80.7	3.3	0	0	110.3	S207 E208 R209	Q205-S207 PolarHBondContact O-N 2.88Å; Q205-E208 PolarHBondContact O-N 3.4Å; Q205-R209 WeakPolarHBondContact O-CG 3.3Å; Q205-R209 PolarHBondContact O-N 2.91Å
206	R	94.5	Very high	94.6	Very high	91 Å²	91	42.9 Å²	42.9	34%	0.343	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-36.1	-176.9	-72	-177.6	173.5	158.1	11.3	113.2	E208 E237 D238 T241 E246	R206-E208 VanDerWaalsContact C-N 3.29Å; R206-E208 PolarHBondContact O-N 2.91Å; R206-E237 PolarHBondContact N-OE1 2.79Å; R206-D238 IonicContact CZ-OD2 2.6Å; R206-D238 IonicContact NH1-OD2 3.89Å; R206-D238 PolarHBondContact NH1-OD2 3.42Å; R206-D238 IonicContact NH2-OD2 2.73Å; R206-D238 PolarHBondContact NH2-OD2 3.24Å; R206-T241 PolarHBondContact NH2-OG1 2.88Å; R206-E246 IonicContact CZ-OE1 3.58Å; R206-E246 IonicContact CZ-OE2 3.55Å; R206-E246 IonicContact NE-OE1 2.67Å; R206-E246 PolarHBondContact NE-OE1 3.5Å; R206-E246 IonicContact NE-OE2 3.52Å; R206-E246 IonicContact NH2-OE1 2.67Å; R206-E246 IonicContact NH2-OE2 2.81Å; R206-E246 PolarHBondContact NH2-OE2 3.35Å
207	S	93.7	Very high	94.5	Very high	72 Å²	72	46 Å²	46	50%	0.503	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-27.3	177.8	65.9	0	0	0	0	114.3	Q205	Q205-S207 PolarHBondContact O-N 2.88Å
208	E	94.9	Very high	94.2	Very high	17 Å²	17	52.6 Å²	52.6	8%	0.079	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-20.9	-174.4	-61.5	-55.8	106	0	0	112.7	G184 G203 Q205 R206 K210 K211	G184-E208 PolarHBondContact N-OE2 3.26Å; G184-E208 VanDerWaalsContact N-OE2 3.08Å; G203-E208 WeakPolarHBondContact O-CB 3.41Å; Q205-E208 PolarHBondContact O-N 3.4Å; R206-E208 VanDerWaalsContact C-N 3.29Å; R206-E208 PolarHBondContact O-N 2.91Å; E208-K210 VanDerWaalsContact C-N 3.25Å; E208-K210 PolarHBondContact O-N 2.78Å; E208-K210 VanDerWaalsContact O-N 3.15Å; E208-K211 VanDerWaalsContact O-CB 3.31Å; E208-K211 WeakPolarHBondContact O-CB 3.09Å; E208-K211 PolarHBondContact O-N 2.88Å; E208-K211 IonicContact OE1-NZ 2.75Å; E208-K211 PolarHBondContact OE1-NZ 2.65Å; E208-K211 IonicContact OE2-NZ 3.29Å; E208-K211 PolarHBondContact OE2-NZ 2.74Å
209	R	94.5	Very high	94.2	Very high	49 Å²	49	48.8 Å²	48.8	19%	0.185	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-63.6	-25.6	-171.4	-57	-169.1	-167.6	156	5	114.7	G204 Q205 K211 W212 E246	G204-R209 PolarHBondContact O-NE 2.84Å; Q205-R209 WeakPolarHBondContact O-CG 3.3Å; Q205-R209 PolarHBondContact O-N 2.91Å; R209-K211 PolarHBondContact O-N 3.31Å; R209-W212 HydrophobicContact CB-CD2 4.16Å; R209-W212 HydrophobicContact CB-CE3 4.5Å; R209-W212 HydrophobicContact CB-CZ2 4.49Å; R209-W212 HydrophobicContact CG-CD2 4.38Å; R209-W212 HydrophobicContact CG-CH2 4.21Å; R209-W212 HydrophobicContact CG-CZ2 3.82Å; R209-W212 VanDerWaalsContact O-CB 3.28Å; R209-W212 WeakPolarHBondContact O-CB 3.25Å; R209-W212 VanDerWaalsContact O-CG 3.27Å; R209-W212 PolarHBondContact O-N 3.17Å; R209-W212 VanDerWaalsContact O-N 3.14Å; R209-E246 IonicContact CZ-OE1 3.35Å; R209-E246 IonicContact NH1-OE1 2.62Å; R209-E246 PolarHBondContact NH1-OE1 3.29Å; R209-E246 IonicContact NH2-OE1 3.28Å; R209-E246 PolarHBondContact NH2-OE1 3.17Å
210	K	92.1	Very high	94	Very high	186 Å²	186	50.6 Å²	50.6	81%	0.809	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-60.5	-27	173.9	-67.4	-176.5	180	-179.9	0	112.3	E208 W212	E208-K210 VanDerWaalsContact C-N 3.25Å; E208-K210 PolarHBondContact O-N 2.78Å; E208-K210 VanDerWaalsContact O-N 3.15Å; K210-W212 VanDerWaalsContact C-N 3.29Å; K210-W212 PolarHBondContact O-N 3.1Å
211	K	93.2	Very high	93.9	Very high	80 Å²	80	50.5 Å²	50.5	35%	0.348	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-78.2	-14.4	-179.3	-56.1	174.4	-174.7	169.3	0	112.7	E208 R209 I213 H214	E208-K211 VanDerWaalsContact O-CB 3.31Å; E208-K211 WeakPolarHBondContact O-CB 3.09Å; E208-K211 PolarHBondContact O-N 2.88Å; E208-K211 IonicContact OE1-NZ 2.75Å; E208-K211 PolarHBondContact OE1-NZ 2.65Å; E208-K211 IonicContact OE2-NZ 3.29Å; E208-K211 PolarHBondContact OE2-NZ 2.74Å; R209-K211 PolarHBondContact O-N 3.31Å; K211-I213 VanDerWaalsContact C-N 3.27Å; K211-I213 PolarHBondContact O-N 2.65Å; K211-H214 WeakPolarHBondContact O-CB 3.23Å; K211-H214 PolarHBondContact O-CD2 3.04Å; K211-H214 VanDerWaalsContact O-CD2 3.28Å; K211-H214 PolarHBondContact O-N 3.47Å
212	W	95	Very high	93.9	Very high	9 Å²	9	50.4 Å²	50.4	3%	0.034	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-62.3	-34.5	-174.8	-68.3	3.3	0	0	0	113.1	L39 V202 G203 R209 K210 H214 C215 F216 L250 I254	L39-W212 HydrophobicContact CB-CH2 4.45Å; L39-W212 HydrophobicContact CB-CZ3 4.46Å; L39-W212 HydrophobicContact CD2-CD2 3.84Å; L39-W212 HydrophobicContact CD2-CE3 3.8Å; L39-W212 HydrophobicContact CD2-CG 4.33Å; L39-W212 HydrophobicContact CD2-CH2 4.23Å; L39-W212 HydrophobicContact CD2-CZ2 4.3Å; L39-W212 HydrophobicContact CD2-CZ3 4Å; V202-W212 HydrophobicContact CG2-CD2 4.34Å; V202-W212 HydrophobicContact CG2-CG 4.15Å; V202-W212 HydrophobicContact CG2-CZ2 4.4Å; V202-W212 VanDerWaalsContact CG2-NE1 3.28Å; G203-W212 PolarHBondContact O-NE1 3.44Å; R209-W212 HydrophobicContact CB-CD2 4.16Å; R209-W212 HydrophobicContact CB-CE3 4.5Å; R209-W212 HydrophobicContact CB-CZ2 4.49Å; R209-W212 HydrophobicContact CG-CD2 4.38Å; R209-W212 HydrophobicContact CG-CH2 4.21Å; R209-W212 HydrophobicContact CG-CZ2 3.82Å; R209-W212 VanDerWaalsContact O-CB 3.28Å; R209-W212 WeakPolarHBondContact O-CB 3.25Å; R209-W212 VanDerWaalsContact O-CG 3.27Å; R209-W212 PolarHBondContact O-N 3.17Å; R209-W212 VanDerWaalsContact O-N 3.14Å; K210-W212 VanDerWaalsContact C-N 3.29Å; K210-W212 PolarHBondContact O-N 3.1Å; W212-H214 PolarHBondContact O-N 2.73Å; W212-H214 VanDerWaalsContact O-N 3.09Å; W212-C215 WeakPolarHBondContact O-CB 3.45Å; W212-C215 PolarHBondContact O-N 3.32Å; W212-F216 HydrophobicContact CB-CE1 3.72Å; W212-F216 HydrophobicContact CB-CZ 3.94Å; W212-F216 WeakPolarHBondContact O-CD1 3.26Å; W212-F216 WeakPolarHBondContact O-CE1 3.24Å; W212-L250 HydrophobicContact CH2-CD1 3.88Å; W212-L250 HydrophobicContact CH2-CD2 3.96Å; W212-L250 HydrophobicContact CH2-CG 4.29Å; W212-L250 HydrophobicContact CZ3-CD1 3.74Å; W212-L250 HydrophobicContact CZ3-CG 4.45Å; W212-I254 HydrophobicContact CE3-CD1 4.06Å; W212-I254 HydrophobicContact CZ3-CD1 3.88Å; W212-I254 HydrophobicContact CZ3-CG1 4.15Å
213	I	92	Very high	94	Very high	83 Å²	83	50.3 Å²	50.3	43%	0.426	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-56.6	-29	180	-166	163.2	0	0	0	112.5	K211 C215 F216 W259	K211-I213 VanDerWaalsContact C-N 3.27Å; K211-I213 PolarHBondContact O-N 2.65Å; I213-C215 PolarHBondContact O-N 2.94Å; I213-C215 VanDerWaalsContact O-N 3.09Å; I213-F216 PolarHBondContact O-N 2.85Å; I213-W259 HydrophobicContact CD1-CZ2 4.09Å; I213-W259 HydrophobicContact CG1-CZ2 4.41Å
214	H	91.9	Very high	94.1	Very high	141 Å²	141	50.3 Å²	50.3	65%	0.653	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-67.9	-7.4	176.1	-57.8	-58.3	0	0	0	113.9	I185 K211 W212	I185-H214 HydrophobicContact CD1-CB 4.39Å; K211-H214 WeakPolarHBondContact O-CB 3.23Å; K211-H214 PolarHBondContact O-CD2 3.04Å; K211-H214 VanDerWaalsContact O-CD2 3.28Å; K211-H214 PolarHBondContact O-N 3.47Å; W212-H214 PolarHBondContact O-N 2.73Å; W212-H214 VanDerWaalsContact O-N 3.09Å
215	C	94.7	Very high	94.3	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.027	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-112.9	1	-180	-59.1	0	0	0	0	113.2	K35 L37 I185 I200 W212 I213 V219	K35-C215 VanDerWaalsContact CE-O 3.32Å; K35-C215 WeakPolarHBondContact CE-O 3.44Å; K35-C215 PolarHBondContact NZ-O 2.56Å; L37-C215 HydrophobicContact CD1-CB 3.75Å; L37-C215 HydrophobicContact CD2-CB 4.34Å; I185-C215 WeakPolarHBondContact CD1-SG 3.43Å; I200-C215 HydrophobicContact CG2-CB 4.42Å; W212-C215 WeakPolarHBondContact O-CB 3.45Å; W212-C215 PolarHBondContact O-N 3.32Å; I213-C215 PolarHBondContact O-N 2.94Å; I213-C215 VanDerWaalsContact O-N 3.09Å; C215-V219 VanDerWaalsContact O-CG2 3.27Å; C215-V219 WeakPolarHBondContact O-CG2 3.21Å
216	F	93.9	Very high	94.5	Very high	21 Å²	21	49.3 Å²	49.3	9%	0.092	24%	0.239	C	C	.	.			trans	-82	-21.8	-169.2	-73.6	7.8	0	0	0	114.3	L37 W212 I213 V219 I254 W259 F260	L37-F216 HydrophobicContact CD2-CD1 3.74Å; L37-F216 HydrophobicContact CD2-CE1 3.88Å; W212-F216 HydrophobicContact CB-CE1 3.72Å; W212-F216 HydrophobicContact CB-CZ 3.94Å; W212-F216 WeakPolarHBondContact O-CD1 3.26Å; W212-F216 WeakPolarHBondContact O-CE1 3.24Å; I213-F216 PolarHBondContact O-N 2.85Å; F216-V219 WeakPolarHBondContact O-CG2 3.19Å; F216-I254 HydrophobicContact CZ-CD1 4.48Å; F216-W259 HydrophobicContact CB-CD2 4.47Å; F216-W259 HydrophobicContact CB-CE3 4.15Å; F216-W259 HydrophobicContact CD2-CB 3.87Å; F216-W259 HydrophobicContact CD2-CD2 4.07Å; F216-W259 AromaticContact CD2-CG 3.72Å; F216-W259 HydrophobicContact CD2-CG 3.72Å; F216-W259 HydrophobicContact CE2-CB 4.49Å; F216-W259 HydrophobicContact CE2-CG 4.39Å; F216-F260 HydrophobicContact CB-CE1 4.1Å; F216-F260 HydrophobicContact CB-CZ 4.34Å; F216-F260 AromaticContact CD1-CE1 3.98Å; F216-F260 HydrophobicContact CD1-CE1 3.98Å; F216-F260 AromaticContact CD1-CZ 3.48Å; F216-F260 HydrophobicContact CD1-CZ 3.48Å; F216-F260 VanDerWaalsContact CD1-CZ 3.48Å; F216-F260 HydrophobicContact CD2-CE1 4.03Å; F216-F260 HydrophobicContact CD2-CE2 4.25Å; F216-F260 AromaticContact CD2-CZ 3.54Å; F216-F260 HydrophobicContact CD2-CZ 3.54Å; F216-F260 HydrophobicContact CE1-CE1 4.4Å; F216-F260 HydrophobicContact CE1-CE2 4.23Å; F216-F260 AromaticContact CE1-CZ 3.46Å; F216-F260 HydrophobicContact CE1-CZ 3.46Å; F216-F260 VanDerWaalsContact CE1-CZ 3.46Å; F216-F260 HydrophobicContact CE2-CE1 4.44Å; F216-F260 AromaticContact CE2-CE2 3.86Å; F216-F260 HydrophobicContact CE2-CE2 3.86Å; F216-F260 AromaticContact CE2-CZ 3.52Å; F216-F260 HydrophobicContact CE2-CZ 3.52Å; F216-F260 AromaticContact CG-CE1 3.78Å; F216-F260 HydrophobicContact CG-CE1 3.78Å; F216-F260 AromaticContact CG-CZ 3.52Å; F216-F260 HydrophobicContact CG-CZ 3.52Å; F216-F260 AromaticContact CZ-CE2 3.85Å; F216-F260 HydrophobicContact CZ-CE2 3.85Å; F216-F260 AromaticContact CZ-CZ 3.48Å; F216-F260 HydrophobicContact CZ-CZ 3.48Å; F216-F260 VanDerWaalsContact CZ-CZ 3.48Å
217	D	91.2	Very high	94.7	Very high	99 Å²	99	45 Å²	45	53%	0.529	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	138.3	179.5	-64	-27.3	0	0	0	112.1	K35 V219	K35-D217 PolarHBondContact NZ-O 3.02Å; D217-V219 PolarHBondContact O-N 3.49Å; D217-V219 VanDerWaalsContact O-N 3.13Å
218	N	89.4	Confident	94.9	Very high	137 Å²	137	41.6 Å²	41.6	73%	0.733	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	33.2	171.5	-50.3	-50	0	0	0	114.3	K35	K35-N218 WeakPolarHBondContact CB-O 3.42Å; K35-N218 WeakPolarHBondContact CD-O 3.21Å
219	V	94.3	Very high	95.1	Very high	9 Å²	9	40.8 Å²	40.8	6%	0.055	20%	0.195	C	C	.	.			trans	-75	136	172	175.3	0	0	0	0	108.6	K35 L37 C215 F216 D217 A221 I222 I263	K35-V219 HydrophobicContact CD-CG2 4.03Å; K35-V219 HydrophobicContact CG-CG2 4.47Å; L37-V219 HydrophobicContact CB-CG1 4.02Å; L37-V219 HydrophobicContact CB-CG2 4.2Å; L37-V219 HydrophobicContact CD2-CG2 4.16Å; C215-V219 VanDerWaalsContact O-CG2 3.27Å; C215-V219 WeakPolarHBondContact O-CG2 3.21Å; F216-V219 WeakPolarHBondContact O-CG2 3.19Å; D217-V219 PolarHBondContact O-N 3.49Å; D217-V219 VanDerWaalsContact O-N 3.13Å; V219-A221 VanDerWaalsContact CG1-O 3.29Å; V219-A221 WeakPolarHBondContact CG1-O 3.24Å; V219-I222 HydrophobicContact CG1-CG1 4.09Å; V219-I263 HydrophobicContact CG1-CG2 4.09Å; V219-I263 WeakPolarHBondContact O-CD1 3.39Å
220	N	93.2	Very high	95.2	Very high	38 Å²	38	38.6 Å²	38.6	20%	0.203	19%	0.187	C	C	.	.			trans	-94.1	-36.8	174.6	-60.4	82.2	0	0	0	111.4	I34 K35 H264 N347	I34-N220 HydrophobicContact CG2-CB 4.02Å; K35-N220 PolarHBondContact N-OD1 2.94Å; K35-N220 PolarHBondContact O-N 2.89Å; N220-H264 PolarHBondContact O-N 3.36Å; N220-N347 PolarHBondContact ND2-OD1 3.46Å
221	A	95.6	Very high	95.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	149.7	177.9	0	0	0	0	0	112.3	K35 L36 L37 V219 H264 I343	K35-A221 PolarHBondContact O-N 3.38Å; L36-A221 WeakPolarHBondContact CA-O 3.45Å; L36-A221 HydrophobicContact CD2-CB 3.81Å; L37-A221 PolarHBondContact N-O 2.89Å; V219-A221 VanDerWaalsContact CG1-O 3.29Å; V219-A221 WeakPolarHBondContact CG1-O 3.24Å; A221-H264 CarbonylContact C-O 3.53Å; A221-H264 VanDerWaalsContact CA-O 3.3Å; A221-H264 WeakPolarHBondContact CA-O 3.31Å; A221-H264 HydrophobicContact CB-CB 3.9Å; A221-I343 HydrophobicContact CB-CD1 3.77Å; A221-I343 HydrophobicContact CB-CG1 4.08Å
222	I	97	Very high	95.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.6	170.9	-72.4	168.3	0	0	0	108.7	L37 L39 V219 F224 I254 F260 I263 H264 F265 I266	L37-I222 HydrophobicContact CB-CG1 4.34Å; L37-I222 WeakPolarHBondContact O-CA 3.43Å; L39-I222 HydrophobicContact CB-CG2 4.4Å; L39-I222 HydrophobicContact CD1-CD1 4.15Å; L39-I222 HydrophobicContact CD1-CG1 4.41Å; L39-I222 HydrophobicContact CD1-CG2 4.08Å; L39-I222 HydrophobicContact CG-CG2 4.4Å; V219-I222 HydrophobicContact CG1-CG1 4.09Å; I222-F224 HydrophobicContact CG2-CB 4.36Å; I222-I254 HydrophobicContact CD1-CG2 4.24Å; I222-F260 HydrophobicContact CD1-CB 4.18Å; I222-F260 HydrophobicContact CD1-CD1 3.54Å; I222-F260 HydrophobicContact CD1-CD2 3.47Å; I222-F260 VanDerWaalsContact CD1-CD2 3.47Å; I222-F260 HydrophobicContact CD1-CE1 3.62Å; I222-F260 HydrophobicContact CD1-CE2 3.54Å; I222-F260 HydrophobicContact CD1-CG 3.45Å; I222-F260 VanDerWaalsContact CD1-CG 3.45Å; I222-F260 HydrophobicContact CD1-CZ 3.58Å; I222-I263 HydrophobicContact CD1-CG2 4.27Å; I222-I263 HydrophobicContact CG1-CG2 4.11Å; I222-H264 PolarHBondContact N-O 3.34Å; I222-F265 HydrophobicContact CB-CD2 4.26Å; I222-F265 HydrophobicContact CB-CE1 4.34Å; I222-F265 HydrophobicContact CB-CE2 4.02Å; I222-F265 HydrophobicContact CB-CZ 4.08Å; I222-F265 HydrophobicContact CD1-CE1 4.45Å; I222-F265 HydrophobicContact CD1-CE2 3.58Å; I222-F265 HydrophobicContact CD1-CZ 3.52Å; I222-F265 HydrophobicContact CG1-CE2 4.27Å; I222-F265 HydrophobicContact CG1-CZ 4.38Å; I222-F265 HydrophobicContact CG2-CD1 4.41Å; I222-F265 HydrophobicContact CG2-CE1 4.01Å; I222-F265 HydrophobicContact CG2-CZ 4.12Å; I222-I266 PolarHBondContact O-N 3.48Å
223	I	97.9	Very high	95.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	101.4	165	-55.8	175.3	0	0	0	106.3	L36 L37 L38 L39 I225 I266 F268	L36-I223 HydrophobicContact CD1-CD1 4.44Å; L37-I223 PolarHBondContact O-N 3.06Å; L38-I223 WeakPolarHBondContact CA-O 3.27Å; L38-I223 HydrophobicContact CD2-CB 3.75Å; L38-I223 HydrophobicContact CD2-CD1 3.93Å; L38-I223 HydrophobicContact CD2-CG1 4.25Å; L38-I223 HydrophobicContact CD2-CG2 4.29Å; L39-I223 PolarHBondContact N-O 2.93Å; I223-I225 HydrophobicContact CG2-CD1 4.27Å; I223-I225 HydrophobicContact CG2-CG1 3.93Å; I223-I266 WeakPolarHBondContact CA-O 3.35Å; I223-I266 HydrophobicContact CG1-CB 4.24Å; I223-I266 HydrophobicContact CG1-CD1 4.06Å; I223-I266 HydrophobicContact CG2-CG2 4.36Å; I223-F268 HydrophobicContact CG2-CD1 4.21Å; I223-F268 HydrophobicContact CG2-CD2 3.6Å; I223-F268 HydrophobicContact CG2-CE1 4.22Å; I223-F268 HydrophobicContact CG2-CE2 3.61Å; I223-F268 HydrophobicContact CG2-CG 3.9Å; I223-F268 HydrophobicContact CG2-CZ 3.92Å
224	F	98.5	Very high	96.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.3	174.1	-169	-83.5	0	0	0	109.6	L39 I222 L250 F251 I254 I266 L267 F268 F308	L39-F224 HydrophobicContact CB-CD2 4.09Å; L39-F224 CarbonylContact O-C 2.98Å; L39-F224 WeakPolarHBondContact O-CA 3.33Å; I222-F224 HydrophobicContact CG2-CB 4.36Å; F224-L250 HydrophobicContact CE2-CD2 4.31Å; F224-L250 HydrophobicContact CE2-CG 3.96Å; F224-L250 HydrophobicContact CZ-CB 4.25Å; F224-L250 HydrophobicContact CZ-CD2 4.15Å; F224-L250 HydrophobicContact CZ-CG 4.01Å; F224-F251 HydrophobicContact CB-CD2 4.06Å; F224-F251 HydrophobicContact CB-CE2 4.15Å; F224-F251 HydrophobicContact CD1-CB 4.39Å; F224-F251 AromaticContact CD1-CD2 3.53Å; F224-F251 HydrophobicContact CD1-CD2 3.53Å; F224-F251 HydrophobicContact CD1-CE2 4.29Å; F224-F251 HydrophobicContact CD1-CG 4.41Å; F224-F251 AromaticContact CD2-CD2 3.96Å; F224-F251 HydrophobicContact CD2-CD2 3.96Å; F224-F251 HydrophobicContact CE1-CB 3.82Å; F224-F251 AromaticContact CE1-CD2 3.86Å; F224-F251 HydrophobicContact CE1-CD2 3.86Å; F224-F251 HydrophobicContact CE1-CG 4.32Å; F224-F251 HydrophobicContact CE2-CB 4.17Å; F224-F251 HydrophobicContact CE2-CD2 4.24Å; F224-F251 AromaticContact CG-CD2 3.57Å; F224-F251 HydrophobicContact CG-CD2 3.57Å; F224-F251 HydrophobicContact CG-CE2 4.17Å; F224-F251 HydrophobicContact CZ-CB 3.69Å; F224-F251 HydrophobicContact CZ-CD2 4.2Å; F224-F251 HydrophobicContact CZ-CG 4.48Å; F224-I254 HydrophobicContact CE2-CG1 4.44Å; F224-I266 PolarHBondContact N-O 3.26Å; F224-L267 HydrophobicContact CD1-CD1 3.91Å; F224-L267 CarbonylContact O-C 3.6Å; F224-L267 WeakPolarHBondContact O-CA 3.48Å; F224-F268 PolarHBondContact O-N 2.89Å; F224-F308 HydrophobicContact CE1-CE1 4.22Å
225	I	98.7	Very high	96.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.9	-174.8	-54	170.6	0	0	0	108.6	L39 S44 K46 I49 I223 F268 N270	L39-I225 PolarHBondContact O-N 3.27Å; S44-I225 WeakPolarHBondContact CB-O 3.33Å; S44-I225 VanDerWaalsContact O-CG2 3.26Å; S44-I225 WeakPolarHBondContact O-CG2 3.46Å; S44-I225 PolarHBondContact OG-O 3.42Å; K46-I225 HydrophobicContact CB-CD1 4.14Å; K46-I225 HydrophobicContact CG-CB 4.19Å; K46-I225 HydrophobicContact CG-CD1 3.9Å; K46-I225 HydrophobicContact CG-CG1 4.43Å; I49-I225 HydrophobicContact CB-CD1 3.99Å; I49-I225 HydrophobicContact CG1-CD1 3.72Å; I49-I225 HydrophobicContact CG2-CD1 4.35Å; I223-I225 HydrophobicContact CG2-CD1 4.27Å; I223-I225 HydrophobicContact CG2-CG1 3.93Å; I225-F268 HydrophobicContact CB-CB 4.44Å; I225-F268 HydrophobicContact CD1-CD2 4.44Å; I225-F268 HydrophobicContact CG1-CB 4.06Å; I225-F268 HydrophobicContact CG1-CD2 4.16Å; I225-F268 HydrophobicContact CG1-CG 4.49Å; I225-F268 HydrophobicContact CG2-CB 4.28Å; I225-N270 HydrophobicContact CG2-CB 3.82Å
226	S	98.7	Very high	96.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.8	176.2	-174.3	0	0	0	0	110.2	S247 F268 N270 F308	S226-S247 WeakPolarHBondContact CB-OG 3.37Å; S226-S247 PolarHBondContact OG-OG 3.21Å; S226-F268 PolarHBondContact N-O 3.3Å; S226-N270 PolarHBondContact O-N 2.97Å; S226-F308 WeakPolarHBondContact OG-CZ 3.24Å
227	S	98.5	Very high	96.2	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	116.3	177.5	-171.2	0	0	0	0	110.6	S229 E230 M244 K271	S227-S229 VanDerWaalsContact C-N 3.28Å; S227-S229 PolarHBondContact O-N 3.32Å; S227-S229 PolarHBondContact OG-OG 2.94Å; S227-S229 VanDerWaalsContact OG-OG 3.1Å; S227-E230 VanDerWaalsContact CB-CD 3.5Å; S227-E230 WeakPolarHBondContact CB-OE2 3.42Å; S227-E230 PolarHBondContact O-N 2.85Å; S227-E230 WeakPolarHBondContact OG-CG 3.15Å; S227-M244 WeakPolarHBondContact O-CE 3.23Å; S227-K271 VanDerWaalsContact OG-CD 3.23Å; S227-K271 WeakPolarHBondContact OG-CD 3.21Å; S227-K271 VanDerWaalsContact OG-CE 3.25Å; S227-K271 WeakPolarHBondContact OG-CE 3.45Å; S227-K271 PolarHBondContact OG-NZ 3.43Å; S227-K271 VanDerWaalsContact OG-NZ 3.17Å
228	L	98.7	Very high	96.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-61.8	-39.3	172.8	-74.6	170.4	0	0	0	111.4	E230 Y231 L269 N270 K272 F275 V301 I304	L228-E230 PolarHBondContact O-N 2.79Å; L228-E230 VanDerWaalsContact O-N 3.13Å; L228-Y231 VanDerWaalsContact O-CD1 3.32Å; L228-Y231 WeakPolarHBondContact O-CD1 3.42Å; L228-L269 HydrophobicContact CD1-CB 3.88Å; L228-L269 HydrophobicContact CD2-CB 3.96Å; L228-L269 HydrophobicContact CD2-CD1 4.28Å; L228-L269 HydrophobicContact CD2-CD2 4.41Å; L228-L269 HydrophobicContact CD2-CG 4.45Å; L228-L269 HydrophobicContact CG-CB 3.81Å; L228-N270 WeakPolarHBondContact CB-O 3.27Å; L228-N270 PolarHBondContact N-O 3.44Å; L228-K272 HydrophobicContact CD1-CB 4.1Å; L228-F275 HydrophobicContact CB-CB 3.65Å; L228-F275 HydrophobicContact CB-CD2 3.91Å; L228-F275 HydrophobicContact CB-CG 3.77Å; L228-F275 VanDerWaalsContact O-CD2 3.26Å; L228-F275 WeakPolarHBondContact O-CD2 3.27Å; L228-V301 HydrophobicContact CD1-CG1 4.22Å; L228-V301 HydrophobicContact CD1-CG2 4.03Å; L228-V301 HydrophobicContact CD2-CG1 4.4Å; L228-V301 HydrophobicContact CD2-CG2 4.47Å; L228-I304 HydrophobicContact CD2-CB 4.2Å; L228-I304 HydrophobicContact CD2-CD1 3.83Å; L228-I304 HydrophobicContact CD2-CG2 3.86Å
229	S	97.7	Very high	96.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-69.9	-6.6	-174.8	68.9	0	0	0	0	114.9	S227 K278	S227-S229 VanDerWaalsContact C-N 3.28Å; S227-S229 PolarHBondContact O-N 3.32Å; S227-S229 PolarHBondContact OG-OG 2.94Å; S227-S229 VanDerWaalsContact OG-OG 3.1Å; S229-K278 VanDerWaalsContact O-CD 3.27Å; S229-K278 WeakPolarHBondContact O-CD 3.36Å; S229-K278 WeakPolarHBondContact O-CE 3.38Å; S229-K278 PolarHBondContact O-NZ 2.81Å
230	E	97.4	Very high	96.4	Very high	3 Å²	3	27.1 Å²	27.1	1%	0.014	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-92.9	3	-173.9	-76.6	-175.6	160.2	0	0	113.8	S227 L228 D232 Q233 R243 K271	S227-E230 VanDerWaalsContact CB-CD 3.5Å; S227-E230 WeakPolarHBondContact CB-OE2 3.42Å; S227-E230 PolarHBondContact O-N 2.85Å; S227-E230 WeakPolarHBondContact OG-CG 3.15Å; L228-E230 PolarHBondContact O-N 2.79Å; L228-E230 VanDerWaalsContact O-N 3.13Å; E230-D232 PolarHBondContact O-N 3.35Å; E230-Q233 PolarHBondContact O-N 2.89Å; E230-R243 HydrophobicContact CB-CB 3.75Å; E230-R243 HydrophobicContact CB-CG 4.49Å; E230-R243 HydrophobicContact CG-CB 4.42Å; E230-R243 IonicContact OE1-CZ 2.83Å; E230-R243 IonicContact OE1-NH1 3.31Å; E230-R243 PolarHBondContact OE1-NH1 2.67Å; E230-K271 IonicContact OE1-NZ 3.88Å
231	Y	98.1	Very high	96.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.8	-177.2	74.4	-82.5	0	0	0	114.5	L228 N242 F275 K278 I279 S282 L284 C287	L228-Y231 VanDerWaalsContact O-CD1 3.32Å; L228-Y231 WeakPolarHBondContact O-CD1 3.42Å; Y231-N242 PolarHBondContact O-ND2 3.36Å; Y231-F275 AromaticContact CD1-CD2 3.75Å; Y231-F275 HydrophobicContact CD1-CD2 3.75Å; Y231-F275 AromaticContact CD1-CE2 3.6Å; Y231-F275 HydrophobicContact CD1-CE2 3.6Å; Y231-F275 AromaticContact CE1-CD2 3.67Å; Y231-F275 HydrophobicContact CE1-CD2 3.67Å; Y231-F275 AromaticContact CE1-CE2 3.59Å; Y231-F275 HydrophobicContact CE1-CE2 3.59Å; Y231-F275 HydrophobicContact CG-CE2 4.36Å; Y231-K278 HydrophobicContact CD1-CD 4.43Å; Y231-K278 HydrophobicContact CE1-CB 4.39Å; Y231-K278 HydrophobicContact CE1-CD 3.68Å; Y231-K278 HydrophobicContact CE1-CG 3.95Å; Y231-K278 PolarHBondContact OH-O 3.05Å; Y231-I279 HydrophobicContact CE2-CD1 4.48Å; Y231-I279 VanDerWaalsContact OH-CA 3.31Å; Y231-I279 WeakPolarHBondContact OH-CA 3.29Å; Y231-I279 PolarHBondContact OH-N 3.35Å; Y231-S282 WeakPolarHBondContact OH-CB 3.42Å; Y231-S282 PolarHBondContact OH-O 3.12Å; Y231-L284 HydrophobicContact CD2-CD1 4.01Å; Y231-L284 HydrophobicContact CG-CD1 4.26Å; Y231-C287 HydrophobicContact CD2-CB 4.38Å; Y231-C287 VanDerWaalsContact O-CB 3.31Å; Y231-C287 WeakPolarHBondContact O-CB 3.21Å
232	D	97.6	Very high	96.7	Very high	11 Å²	11	28 Å²	28	6%	0.059	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	20	-178.8	68	-9.4	0	0	0	113.2	N145 E230 K278 S282 V286	N145-D232 HydrophobicContact CB-CB 4.45Å; N145-D232 WeakPolarHBondContact CB-OD2 3.09Å; E230-D232 PolarHBondContact O-N 3.35Å; D232-K278 VanDerWaalsContact OD1-CD 3.26Å; D232-K278 WeakPolarHBondContact OD1-CD 3.3Å; D232-K278 WeakPolarHBondContact OD1-CE 3.46Å; D232-K278 IonicContact OD1-NZ 2.99Å; D232-K278 PolarHBondContact OD1-NZ 3.46Å; D232-K278 VanDerWaalsContact OD2-CD 3.3Å; D232-K278 WeakPolarHBondContact OD2-CD 3.47Å; D232-K278 WeakPolarHBondContact OD2-CG 3.31Å; D232-K278 IonicContact OD2-NZ 3.02Å; D232-S282 VanDerWaalsContact CB-OG 3.22Å; D232-S282 WeakPolarHBondContact CB-OG 3.19Å; D232-S282 VanDerWaalsContact OD2-CB 3.22Å; D232-S282 WeakPolarHBondContact OD2-CB 3.3Å; D232-S282 PolarHBondContact OD2-OG 3.15Å; D232-V286 HydrophobicContact CB-CG1 4.46Å
233	Q	97.6	Very high	96.7	Very high	8 Å²	8	28.5 Å²	28.5	4%	0.037	14%	0.138	C	C	.	.			trans	-124.2	154.7	-177	-75.9	172.5	-31.3	0	0	112.1	N144 N145 E230 R243	N144-Q233 PolarHBondContact O-NE2 2.94Å; N145-Q233 HydrophobicContact CB-CG 4.32Å; E230-Q233 PolarHBondContact O-N 2.89Å; Q233-R243 HydrophobicContact CB-CG 4.29Å; Q233-R243 PolarHBondContact O-N 3.37Å
234	T	97.3	Very high	96.8	Very high	48 Å²	48	28.5 Å²	28.5	29%	0.294	14%	0.138	S	C	.	.	B	Isolated β-bridge	trans	-101.1	154.6	173.1	60.8	0	0	0	0	112.1	Q148 N239 T241 R243	Q148-T234 PolarHBondContact NE2-O 2.81Å; Q148-T234 VanDerWaalsContact NE2-O 3.09Å; T234-N239 WeakPolarHBondContact CB-O 3.28Å; T234-N239 PolarHBondContact OG1-O 3.1Å; T234-T241 CarbonylContact C-O 3.48Å; T234-T241 WeakPolarHBondContact CA-O 3.15Å; T234-R243 VanDerWaalsContact C-CG 3.48Å; T234-R243 PolarHBondContact O-NE 3.3Å
235	M	95.9	Very high	96.8	Very high	7 Å²	7	32.7 Å²	32.7	3%	0.034	16%	0.157	C	C	.	.			trans	-62	140.4	178.9	-66.7	-65.8	-62.2	0	0	110.9	E237 D238 N239 T241 R243 E246	M235-E237 VanDerWaalsContact CE-OE2 3.31Å; M235-E237 WeakPolarHBondContact CE-OE2 3.48Å; M235-E237 PolarHBondContact O-N 3.34Å; M235-D238 PolarHBondContact O-N 3.03Å; M235-N239 VanDerWaalsContact O-CA 3.23Å; M235-N239 WeakPolarHBondContact O-CA 3.42Å; M235-N239 PolarHBondContact O-N 2.99Å; M235-T241 HydrophobicContact CG-CG2 4.12Å; M235-T241 WeakPolarHBondContact CG-O 3.38Å; M235-T241 PolarHBondContact N-O 3.19Å; M235-R243 HydrophobicContact CG-CG 4.25Å; M235-R243 HydrophobicContact SD-CB 4.1Å; M235-R243 HydrophobicContact SD-CG 3.72Å; M235-E246 HydrophobicContact CE-CG 3.87Å; M235-E246 HydrophobicContact CG-CB 4.18Å; M235-E246 HydrophobicContact CG-CG 4.36Å; M235-E246 HydrophobicContact SD-CB 3.74Å; M235-E246 HydrophobicContact SD-CG 3.7Å
236	R	93.5	Very high	96.7	Very high	87 Å²	87	33.1 Å²	33.1	33%	0.328	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.4	174.7	-66	-173.3	-166.3	-146.4	-1.8	112.2	E43 Q148 D150 D238	E43-R236 VanDerWaalsContact CD-NH2 3.25Å; E43-R236 IonicContact OE1-CZ 2.94Å; E43-R236 IonicContact OE1-NE 2.79Å; E43-R236 PolarHBondContact OE1-NE 3.24Å; E43-R236 VanDerWaalsContact OE1-NE 3.15Å; E43-R236 IonicContact OE1-NH1 3.88Å; E43-R236 IonicContact OE1-NH2 3.51Å; E43-R236 PolarHBondContact OE1-NH2 3.11Å; E43-R236 IonicContact OE2-CZ 3.41Å; E43-R236 VanDerWaalsContact OE2-CZ 3.25Å; E43-R236 IonicContact OE2-NE 3.58Å; E43-R236 PolarHBondContact OE2-NE 3.09Å; E43-R236 IonicContact OE2-NH2 2.71Å; E43-R236 PolarHBondContact OE2-NH2 2.82Å; Q148-R236 HydrophobicContact CB-CG 4.3Å; Q148-R236 HydrophobicContact CG-CG 4Å; Q148-R236 VanDerWaalsContact OE1-CG 3.25Å; D150-R236 IonicContact OD1-CZ 3.34Å; D150-R236 IonicContact OD1-NH1 3.73Å; D150-R236 PolarHBondContact OD1-NH1 3.31Å; D150-R236 IonicContact OD1-NH2 3.76Å; D150-R236 PolarHBondContact OD1-NH2 3.37Å; R236-D238 VanDerWaalsContact C-N 3.3Å; R236-D238 PolarHBondContact O-N 3.43Å
237	E	93.1	Very high	96.7	Very high	80 Å²	80	33.2 Å²	33.2	37%	0.374	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.3	-174.6	-67.7	95	138.3	0	0	113.6	R206 M235	R206-E237 PolarHBondContact N-OE1 2.79Å; M235-E237 VanDerWaalsContact CE-OE2 3.31Å; M235-E237 WeakPolarHBondContact CE-OE2 3.48Å; M235-E237 PolarHBondContact O-N 3.34Å
238	D	93.8	Very high	96.7	Very high	30 Å²	30	34.1 Å²	34.1	16%	0.16	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.4	-12.1	-175.9	68.9	28	0	0	0	115.3	R206 M235 R236 F240 T241	R206-D238 IonicContact CZ-OD2 2.6Å; R206-D238 IonicContact NH1-OD2 3.89Å; R206-D238 PolarHBondContact NH1-OD2 3.42Å; R206-D238 IonicContact NH2-OD2 2.73Å; R206-D238 PolarHBondContact NH2-OD2 3.24Å; M235-D238 PolarHBondContact O-N 3.03Å; R236-D238 VanDerWaalsContact C-N 3.3Å; R236-D238 PolarHBondContact O-N 3.43Å; D238-F240 HydrophobicContact CB-CD1 3.78Å; D238-F240 HydrophobicContact CB-CE1 3.45Å; D238-F240 VanDerWaalsContact CB-CE1 3.45Å; D238-F240 HydrophobicContact CB-CZ 3.96Å; D238-F240 WeakPolarHBondContact O-CD1 3.4Å; D238-F240 PolarHBondContact O-N 3.05Å; D238-F240 VanDerWaalsContact O-N 3.08Å; D238-F240 PolarHBondContact OD1-N 2.8Å; D238-T241 WeakPolarHBondContact OD1-CB 3.49Å; D238-T241 PolarHBondContact OD1-N 3.08Å; D238-T241 PolarHBondContact OD1-OG1 2.89Å; D238-T241 WeakPolarHBondContact OD2-CB 3.38Å; D238-T241 PolarHBondContact OD2-OG1 3.49Å
239	N	91.6	Very high	96.7	Very high	97 Å²	97	41.2 Å²	41.2	52%	0.519	20%	0.195	S	C	.	.	S	Bend	trans	58.6	8.8	180	-59.2	-58.6	0	0	0	116.1	Q148 T234 M235	Q148-N239 PolarHBondContact NE2-OD1 3.01Å; T234-N239 WeakPolarHBondContact CB-O 3.28Å; T234-N239 PolarHBondContact OG1-O 3.1Å; M235-N239 VanDerWaalsContact O-CA 3.23Å; M235-N239 WeakPolarHBondContact O-CA 3.42Å; M235-N239 PolarHBondContact O-N 2.99Å
240	F	94.4	Very high	96.7	Very high	160 Å²	160	41.8 Å²	41.8	70%	0.702	20%	0.198	S	C	*	.	S	Bend	trans	-126	-27.8	178.1	67.7	-103.4	0	0	0	113.8	D238 N242	D238-F240 HydrophobicContact CB-CD1 3.78Å; D238-F240 HydrophobicContact CB-CE1 3.45Å; D238-F240 VanDerWaalsContact CB-CE1 3.45Å; D238-F240 HydrophobicContact CB-CZ 3.96Å; D238-F240 WeakPolarHBondContact O-CD1 3.4Å; D238-F240 PolarHBondContact O-N 3.05Å; D238-F240 VanDerWaalsContact O-N 3.08Å; D238-F240 PolarHBondContact OD1-N 2.8Å; F240-N242 PolarHBondContact O-N 2.82Å
241	T	96.8	Very high	96.8	Very high	28 Å²	28	41.6 Å²	41.6	17%	0.172	20%	0.197	C	C	.	.	S	Bend	trans	-74.5	125	178.3	-59.8	0	0	0	0	109.1	R206 T234 M235 D238 R243 E246	R206-T241 PolarHBondContact NH2-OG1 2.88Å; T234-T241 CarbonylContact C-O 3.48Å; T234-T241 WeakPolarHBondContact CA-O 3.15Å; M235-T241 HydrophobicContact CG-CG2 4.12Å; M235-T241 WeakPolarHBondContact CG-O 3.38Å; M235-T241 PolarHBondContact N-O 3.19Å; D238-T241 WeakPolarHBondContact OD1-CB 3.49Å; D238-T241 PolarHBondContact OD1-N 3.08Å; D238-T241 PolarHBondContact OD1-OG1 2.89Å; D238-T241 WeakPolarHBondContact OD2-CB 3.38Å; D238-T241 PolarHBondContact OD2-OG1 3.49Å; T241-R243 PolarHBondContact O-N 3.2Å; T241-E246 HydrophobicContact CG2-CB 4.15Å
242	N	98	Very high	96.8	Very high	28 Å²	28	43.4 Å²	43.4	15%	0.15	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-62.2	129.8	171.9	178.2	-82.6	0	0	0	110.9	Y231 F240 M244 H245 E246 C287	Y231-N242 PolarHBondContact O-ND2 3.36Å; F240-N242 PolarHBondContact O-N 2.82Å; N242-M244 PolarHBondContact O-N 2.68Å; N242-M244 WeakPolarHBondContact OD1-CB 3.18Å; N242-M244 PolarHBondContact OD1-N 2.89Å; N242-H245 HydrophobicContact CB-CB 4.25Å; N242-H245 PolarHBondContact O-N 3.02Å; N242-H245 PolarHBondContact OD1-N 3.31Å; N242-H245 VanDerWaalsContact OD1-N 3.1Å; N242-H245 PolarHBondContact OD1-ND1 3.21Å; N242-E246 PolarHBondContact O-N 2.88Å; N242-C287 PolarHBondContact OD1-SG 3.42Å
243	R	98	Very high	96.7	Very high	10 Å²	10	46.5 Å²	46.5	4%	0.038	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-37.2	-173.9	-68.2	-170.3	-179.2	-157.3	5.2	113.4	E43 E230 Q233 T234 M235 T241 E246 S247	E43-R243 IonicContact OE2-CZ 2.67Å; E43-R243 IonicContact OE2-NH1 3.04Å; E43-R243 PolarHBondContact OE2-NH1 3.3Å; E43-R243 IonicContact OE2-NH2 2.8Å; E43-R243 PolarHBondContact OE2-NH2 2.68Å; E230-R243 HydrophobicContact CB-CB 3.75Å; E230-R243 HydrophobicContact CB-CG 4.49Å; E230-R243 HydrophobicContact CG-CB 4.42Å; E230-R243 IonicContact OE1-CZ 2.83Å; E230-R243 IonicContact OE1-NH1 3.31Å; E230-R243 PolarHBondContact OE1-NH1 2.67Å; Q233-R243 HydrophobicContact CB-CG 4.29Å; Q233-R243 PolarHBondContact O-N 3.37Å; T234-R243 VanDerWaalsContact C-CG 3.48Å; T234-R243 PolarHBondContact O-NE 3.3Å; M235-R243 HydrophobicContact CG-CG 4.25Å; M235-R243 HydrophobicContact SD-CB 4.1Å; M235-R243 HydrophobicContact SD-CG 3.72Å; T241-R243 PolarHBondContact O-N 3.2Å; R243-E246 PolarHBondContact O-N 3.02Å; R243-S247 PolarHBondContact O-N 3.16Å
244	M	98.4	Very high	96.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-38.2	176.2	179.7	62.8	69.9	0	0	111.8	S227 N242 S247 L248 F288 I304 F308	S227-M244 WeakPolarHBondContact O-CE 3.23Å; N242-M244 PolarHBondContact O-N 2.68Å; N242-M244 WeakPolarHBondContact OD1-CB 3.18Å; N242-M244 PolarHBondContact OD1-N 2.89Å; M244-S247 WeakPolarHBondContact O-CB 3.3Å; M244-S247 PolarHBondContact O-N 3.48Å; M244-L248 HydrophobicContact CG-CD1 4.43Å; M244-L248 WeakPolarHBondContact O-CG 3.35Å; M244-L248 PolarHBondContact O-N 2.92Å; M244-F288 HydrophobicContact CG-CE2 4.15Å; M244-F288 HydrophobicContact CG-CZ 3.76Å; M244-I304 HydrophobicContact CE-CD1 4.31Å; M244-I304 HydrophobicContact CE-CG2 4.02Å; M244-I304 HydrophobicContact SD-CG2 4.04Å; M244-F308 HydrophobicContact SD-CE2 3.72Å; M244-F308 HydrophobicContact SD-CZ 4Å
245	H	98.3	Very high	96.6	Very high	89 Å²	89	44.3 Å²	44.3	41%	0.412	22%	0.216	S	C	.	.	H	α-helix	trans	-64.7	-41	173.1	-74.7	73.4	0	0	0	112.6	N242 S247 L248 K249 C287	N242-H245 HydrophobicContact CB-CB 4.25Å; N242-H245 PolarHBondContact O-N 3.02Å; N242-H245 PolarHBondContact OD1-N 3.31Å; N242-H245 VanDerWaalsContact OD1-N 3.1Å; N242-H245 PolarHBondContact OD1-ND1 3.21Å; H245-S247 VanDerWaalsContact C-N 3.27Å; H245-S247 PolarHBondContact O-N 3.36Å; H245-L248 PolarHBondContact O-N 3.36Å; H245-K249 WeakPolarHBondContact O-CB 3.36Å; H245-K249 PolarHBondContact O-N 3.08Å; H245-C287 PolarHBondContact CE1-O 2.94Å; H245-C287 PolarHBondContact CE1-SG 3.24Å; H245-C287 PolarHBondContact ND1-SG 3.21Å
246	E	98	Very high	96.6	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-41.6	172.8	177.5	69.7	-175.8	0	0	110.9	R206 R209 M235 T241 N242 R243 K249 L250	R206-E246 IonicContact CZ-OE1 3.58Å; R206-E246 IonicContact CZ-OE2 3.55Å; R206-E246 IonicContact NE-OE1 2.67Å; R206-E246 PolarHBondContact NE-OE1 3.5Å; R206-E246 IonicContact NE-OE2 3.52Å; R206-E246 IonicContact NH2-OE1 2.67Å; R206-E246 IonicContact NH2-OE2 2.81Å; R206-E246 PolarHBondContact NH2-OE2 3.35Å; R209-E246 IonicContact CZ-OE1 3.35Å; R209-E246 IonicContact NH1-OE1 2.62Å; R209-E246 PolarHBondContact NH1-OE1 3.29Å; R209-E246 IonicContact NH2-OE1 3.28Å; R209-E246 PolarHBondContact NH2-OE1 3.17Å; M235-E246 HydrophobicContact CE-CG 3.87Å; M235-E246 HydrophobicContact CG-CB 4.18Å; M235-E246 HydrophobicContact CG-CG 4.36Å; M235-E246 HydrophobicContact SD-CB 3.74Å; M235-E246 HydrophobicContact SD-CG 3.7Å; T241-E246 HydrophobicContact CG2-CB 4.15Å; N242-E246 PolarHBondContact O-N 2.88Å; R243-E246 PolarHBondContact O-N 3.02Å; E246-K249 PolarHBondContact O-N 3.17Å; E246-L250 WeakPolarHBondContact O-CB 3.32Å; E246-L250 PolarHBondContact O-N 2.83Å
247	S	98.6	Very high	96.7	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-44.6	176.8	-165.4	0	0	0	0	112.3	S226 R243 M244 H245 L250 F251	S226-S247 WeakPolarHBondContact CB-OG 3.37Å; S226-S247 PolarHBondContact OG-OG 3.21Å; R243-S247 PolarHBondContact O-N 3.16Å; M244-S247 WeakPolarHBondContact O-CB 3.3Å; M244-S247 PolarHBondContact O-N 3.48Å; H245-S247 VanDerWaalsContact C-N 3.27Å; H245-S247 PolarHBondContact O-N 3.36Å; S247-L250 PolarHBondContact O-N 3.1Å; S247-F251 WeakPolarHBondContact O-CB 3.19Å; S247-F251 PolarHBondContact O-N 2.94Å
248	L	98.7	Very high	96.7	Very high	20 Å²	20	44.4 Å²	44.4	11%	0.105	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-48.4	174.7	-75.7	167	0	0	0	111.7	M244 H245 L250 F251 D252 F288 K307 F308 L311	M244-L248 HydrophobicContact CG-CD1 4.43Å; M244-L248 WeakPolarHBondContact O-CG 3.35Å; M244-L248 PolarHBondContact O-N 2.92Å; H245-L248 PolarHBondContact O-N 3.36Å; L248-L250 VanDerWaalsContact C-N 3.29Å; L248-L250 PolarHBondContact O-N 3.25Å; L248-F251 PolarHBondContact O-N 2.96Å; L248-D252 PolarHBondContact O-N 2.9Å; L248-F288 HydrophobicContact CD1-CE1 3.77Å; L248-F288 HydrophobicContact CD1-CZ 3.82Å; L248-K307 HydrophobicContact CD2-CB 4.01Å; L248-F308 HydrophobicContact CD2-CD1 3.84Å; L248-F308 HydrophobicContact CD2-CD2 3.75Å; L248-F308 HydrophobicContact CD2-CE1 3.82Å; L248-F308 HydrophobicContact CD2-CE2 3.72Å; L248-F308 HydrophobicContact CD2-CG 3.79Å; L248-F308 HydrophobicContact CD2-CZ 3.73Å; L248-F308 HydrophobicContact CG-CE1 4.31Å; L248-F308 HydrophobicContact CG-CE2 4.22Å; L248-F308 HydrophobicContact CG-CZ 3.97Å; L248-L311 HydrophobicContact CB-CD1 4.08Å; L248-L311 HydrophobicContact CD2-CD1 3.69Å; L248-L311 VanDerWaalsContact O-CD1 3.31Å; L248-L311 WeakPolarHBondContact O-CD1 3.48Å
249	K	98.1	Very high	96.6	Very high	149 Å²	149	49.5 Å²	49.5	65%	0.648	25%	0.251	S	S	*	.	H	α-helix	trans	-59.4	-42	177	179.9	179.9	179.1	178.6	0	111.8	H245 E246 S253	H245-K249 WeakPolarHBondContact O-CB 3.36Å; H245-K249 PolarHBondContact O-N 3.08Å; E246-K249 PolarHBondContact O-N 3.17Å; K249-S253 PolarHBondContact O-N 3.45Å; K249-S253 VanDerWaalsContact O-N 3.17Å
250	L	97.8	Very high	96.8	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-43.3	177.5	-178.9	61	0	0	0	111.2	A41 W212 F224 E246 S247 L248 S253 I254	A41-L250 HydrophobicContact CB-CD2 4.2Å; W212-L250 HydrophobicContact CH2-CD1 3.88Å; W212-L250 HydrophobicContact CH2-CD2 3.96Å; W212-L250 HydrophobicContact CH2-CG 4.29Å; W212-L250 HydrophobicContact CZ3-CD1 3.74Å; W212-L250 HydrophobicContact CZ3-CG 4.45Å; F224-L250 HydrophobicContact CE2-CD2 4.31Å; F224-L250 HydrophobicContact CE2-CG 3.96Å; F224-L250 HydrophobicContact CZ-CB 4.25Å; F224-L250 HydrophobicContact CZ-CD2 4.15Å; F224-L250 HydrophobicContact CZ-CG 4.01Å; E246-L250 WeakPolarHBondContact O-CB 3.32Å; E246-L250 PolarHBondContact O-N 2.83Å; S247-L250 PolarHBondContact O-N 3.1Å; L248-L250 VanDerWaalsContact C-N 3.29Å; L248-L250 PolarHBondContact O-N 3.25Å; L250-S253 PolarHBondContact O-N 3.3Å; L250-I254 HydrophobicContact CD1-CG1 4.39Å; L250-I254 WeakPolarHBondContact O-CG1 3.46Å; L250-I254 PolarHBondContact O-N 2.98Å; L250-I254 VanDerWaalsContact O-N 3.09Å
251	F	98.3	Very high	96.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-46.7	175.8	-177.4	-100	0	0	0	112	F224 S247 L248 S253 I254 C255 F265 L267 F308 L311 I319	F224-F251 HydrophobicContact CB-CD2 4.06Å; F224-F251 HydrophobicContact CB-CE2 4.15Å; F224-F251 HydrophobicContact CD1-CB 4.39Å; F224-F251 AromaticContact CD1-CD2 3.53Å; F224-F251 HydrophobicContact CD1-CD2 3.53Å; F224-F251 HydrophobicContact CD1-CE2 4.29Å; F224-F251 HydrophobicContact CD1-CG 4.41Å; F224-F251 AromaticContact CD2-CD2 3.96Å; F224-F251 HydrophobicContact CD2-CD2 3.96Å; F224-F251 HydrophobicContact CE1-CB 3.82Å; F224-F251 AromaticContact CE1-CD2 3.86Å; F224-F251 HydrophobicContact CE1-CD2 3.86Å; F224-F251 HydrophobicContact CE1-CG 4.32Å; F224-F251 HydrophobicContact CE2-CB 4.17Å; F224-F251 HydrophobicContact CE2-CD2 4.24Å; F224-F251 AromaticContact CG-CD2 3.57Å; F224-F251 HydrophobicContact CG-CD2 3.57Å; F224-F251 HydrophobicContact CG-CE2 4.17Å; F224-F251 HydrophobicContact CZ-CB 3.69Å; F224-F251 HydrophobicContact CZ-CD2 4.2Å; F224-F251 HydrophobicContact CZ-CG 4.48Å; S247-F251 WeakPolarHBondContact O-CB 3.19Å; S247-F251 PolarHBondContact O-N 2.94Å; L248-F251 PolarHBondContact O-N 2.96Å; F251-S253 VanDerWaalsContact C-N 3.26Å; F251-S253 PolarHBondContact O-N 2.78Å; F251-I254 PolarHBondContact O-N 3.13Å; F251-I254 VanDerWaalsContact O-N 3.09Å; F251-C255 HydrophobicContact CD1-CB 4.2Å; F251-C255 HydrophobicContact CE1-CB 3.88Å; F251-C255 HydrophobicContact CE2-CB 4.36Å; F251-C255 HydrophobicContact CZ-CB 3.97Å; F251-C255 VanDerWaalsContact O-CB 3.24Å; F251-C255 WeakPolarHBondContact O-CB 3.45Å; F251-C255 PolarHBondContact O-N 3.05Å; F251-F265 HydrophobicContact CE2-CD1 4.28Å; F251-L267 HydrophobicContact CD2-CD1 4.41Å; F251-L267 HydrophobicContact CE2-CD1 4.2Å; F251-F308 HydrophobicContact CB-CD1 3.72Å; F251-F308 HydrophobicContact CB-CE1 3.65Å; F251-F308 HydrophobicContact CD1-CB 4.49Å; F251-F308 AromaticContact CD1-CD1 3.67Å; F251-F308 HydrophobicContact CD1-CD1 3.67Å; F251-F308 HydrophobicContact CD1-CE1 4.48Å; F251-F308 HydrophobicContact CD2-CD1 4.05Å; F251-F308 HydrophobicContact CD2-CE1 4.48Å; F251-F308 HydrophobicContact CE1-CB 4.39Å; F251-F308 HydrophobicContact CE1-CD1 4.27Å; F251-F308 VanDerWaalsContact CE1-O 3.27Å; F251-F308 WeakPolarHBondContact CE1-O 3.37Å; F251-F308 AromaticContact CG-CD1 3.53Å; F251-F308 HydrophobicContact CG-CD1 3.53Å; F251-F308 AromaticContact CG-CE1 3.97Å; F251-F308 HydrophobicContact CG-CE1 3.97Å; F251-L311 HydrophobicContact CD1-CB 4.07Å; F251-L311 HydrophobicContact CD1-CD1 3.97Å; F251-L311 HydrophobicContact CE1-CB 4.36Å; F251-I319 HydrophobicContact CE1-CD1 3.96Å; F251-I319 HydrophobicContact CZ-CD1 3.62Å; F251-I319 HydrophobicContact CZ-CG1 4.33Å; F251-I319 HydrophobicContact CZ-CG2 4.43Å
252	D	98.2	Very high	96.2	Very high	37 Å²	37	46.4 Å²	46.4	20%	0.198	24%	0.243	C	C	.	.	H	α-helix	trans	-53.7	-44.7	175.9	-176.9	55.7	0	0	0	111.7	L248 I254 N256 L311 R313	L248-D252 PolarHBondContact O-N 2.9Å; D252-I254 PolarHBondContact O-N 3.21Å; D252-N256 WeakPolarHBondContact O-CB 3.41Å; D252-N256 PolarHBondContact O-N 3.35Å; D252-N256 PolarHBondContact O-ND2 3.32Å; D252-N256 PolarHBondContact OD1-ND2 3.48Å; D252-L311 HydrophobicContact CB-CB 4.32Å; D252-L311 HydrophobicContact CB-CD1 4.15Å; D252-L311 HydrophobicContact CB-CD2 4.13Å; D252-L311 HydrophobicContact CB-CG 4.43Å; D252-R313 IonicContact OD1-CZ 2.65Å; D252-R313 IonicContact OD1-NE 3.32Å; D252-R313 IonicContact OD1-NH2 3.83Å; D252-R313 PolarHBondContact OD1-NH2 3.14Å; D252-R313 IonicContact OD2-CZ 3.39Å; D252-R313 IonicContact OD2-NH2 2.65Å; D252-R313 PolarHBondContact OD2-NH2 3.32Å
253	S	96.9	Very high	95.9	Very high	77 Å²	77	46.7 Å²	46.7	54%	0.538	24%	0.244	S	C	.	.	H	α-helix	trans	-66.5	-35.5	178.4	-178.6	0	0	0	0	113.5	K249 L250 F251	K249-S253 PolarHBondContact O-N 3.45Å; K249-S253 VanDerWaalsContact O-N 3.17Å; L250-S253 PolarHBondContact O-N 3.3Å; F251-S253 VanDerWaalsContact C-N 3.26Å; F251-S253 PolarHBondContact O-N 2.78Å
254	I	96.2	Very high	95.6	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.051	25%	0.252	C	S	.	.	H	α-helix	trans	-83.6	-49.8	-177.4	-63.9	-57.9	0	0	0	110.4	L39 W212 F216 I222 F224 L250 F251 D252 N256 S257 F260 F265	L39-I254 HydrophobicContact CD1-CD1 4.32Å; L39-I254 HydrophobicContact CD1-CG1 4.45Å; L39-I254 HydrophobicContact CD1-CG2 3.71Å; W212-I254 HydrophobicContact CE3-CD1 4.06Å; W212-I254 HydrophobicContact CZ3-CD1 3.88Å; W212-I254 HydrophobicContact CZ3-CG1 4.15Å; F216-I254 HydrophobicContact CZ-CD1 4.48Å; I222-I254 HydrophobicContact CD1-CG2 4.24Å; F224-I254 HydrophobicContact CE2-CG1 4.44Å; L250-I254 HydrophobicContact CD1-CG1 4.39Å; L250-I254 WeakPolarHBondContact O-CG1 3.46Å; L250-I254 PolarHBondContact O-N 2.98Å; L250-I254 VanDerWaalsContact O-N 3.09Å; F251-I254 PolarHBondContact O-N 3.13Å; F251-I254 VanDerWaalsContact O-N 3.09Å; D252-I254 PolarHBondContact O-N 3.21Å; I254-N256 PolarHBondContact O-N 3.36Å; I254-S257 VanDerWaalsContact O-CB 3.28Å; I254-S257 WeakPolarHBondContact O-CB 3.19Å; I254-S257 PolarHBondContact O-N 3Å; I254-F260 HydrophobicContact CD1-CE2 4.39Å; I254-F260 HydrophobicContact CG2-CD2 4.04Å; I254-F260 HydrophobicContact CG2-CE2 3.87Å; I254-F260 WeakPolarHBondContact O-CD2 3.32Å; I254-F265 HydrophobicContact CG2-CE1 3.84Å; I254-F265 HydrophobicContact CG2-CZ 3.72Å
255	C	96.3	Very high	95.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.9	-31	-178	-171.6	0	0	0	0	112.7	F251 F265 R317	F251-C255 HydrophobicContact CD1-CB 4.2Å; F251-C255 HydrophobicContact CE1-CB 3.88Å; F251-C255 HydrophobicContact CE2-CB 4.36Å; F251-C255 HydrophobicContact CZ-CB 3.97Å; F251-C255 VanDerWaalsContact O-CB 3.24Å; F251-C255 WeakPolarHBondContact O-CB 3.45Å; F251-C255 PolarHBondContact O-N 3.05Å; C255-F265 HydrophobicContact CB-CD1 4.37Å; C255-F265 HydrophobicContact CB-CE1 3.99Å; C255-R317 PolarHBondContact O-NE 3.36Å; C255-R317 VanDerWaalsContact SG-CD 3.55Å
256	N	96.4	Very high	95.4	Very high	44 Å²	44	44.1 Å²	44.1	24%	0.235	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	12.9	179.1	-58	-59.7	0	0	0	113.3	D252 I254 L311 R313	D252-N256 WeakPolarHBondContact O-CB 3.41Å; D252-N256 PolarHBondContact O-N 3.35Å; D252-N256 PolarHBondContact O-ND2 3.32Å; D252-N256 PolarHBondContact OD1-ND2 3.48Å; I254-N256 PolarHBondContact O-N 3.36Å; N256-L311 PolarHBondContact ND2-O 2.91Å; N256-R313 WeakPolarHBondContact OD1-CB 3.47Å; N256-R313 PolarHBondContact OD1-N 3.09Å
257	S	94.4	Very high	95.5	Very high	19 Å²	19	43.7 Å²	43.7	13%	0.133	23%	0.231	C	C	.	.			trans	-71.7	135.5	-179.5	-168.1	0	0	0	0	111.8	I254 W259 F260	I254-S257 VanDerWaalsContact O-CB 3.28Å; I254-S257 WeakPolarHBondContact O-CB 3.19Å; I254-S257 PolarHBondContact O-N 3Å; S257-W259 PolarHBondContact O-N 3.47Å; S257-W259 VanDerWaalsContact O-N 3.15Å; S257-F260 PolarHBondContact O-N 3.28Å
258	P	93.5	Very high	95.5	Very high	112 Å²	112	43.7 Å²	43.7	73%	0.727	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-59.5	-22.9	172.4	-24.7	34.6	0	0	0	114	F260 V261	P258-F260 PolarHBondContact O-N 2.95Å; P258-V261 WeakPolarHBondContact O-CG2 3.26Å
259	W	92.9	Very high	95.5	Very high	138 Å²	138	42.7 Å²	42.7	52%	0.523	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-64.8	-20.2	174.8	-71.1	97	0	0	0	113.1	I213 F216 S257	I213-W259 HydrophobicContact CD1-CZ2 4.09Å; I213-W259 HydrophobicContact CG1-CZ2 4.41Å; F216-W259 HydrophobicContact CB-CD2 4.47Å; F216-W259 HydrophobicContact CB-CE3 4.15Å; F216-W259 HydrophobicContact CD2-CB 3.87Å; F216-W259 HydrophobicContact CD2-CD2 4.07Å; F216-W259 AromaticContact CD2-CG 3.72Å; F216-W259 HydrophobicContact CD2-CG 3.72Å; F216-W259 HydrophobicContact CE2-CB 4.49Å; F216-W259 HydrophobicContact CE2-CG 4.39Å; S257-W259 PolarHBondContact O-N 3.47Å; S257-W259 VanDerWaalsContact O-N 3.15Å
260	F	93.9	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-124.8	22	-167.6	-54.1	-46.5	0	0	0	114.6	L39 F216 I222 I254 S257 P258 D262 I263 F265 R317	L39-F260 HydrophobicContact CD1-CE2 4.44Å; L39-F260 HydrophobicContact CD1-CZ 4.48Å; F216-F260 HydrophobicContact CB-CE1 4.1Å; F216-F260 HydrophobicContact CB-CZ 4.34Å; F216-F260 AromaticContact CD1-CE1 3.98Å; F216-F260 HydrophobicContact CD1-CE1 3.98Å; F216-F260 AromaticContact CD1-CZ 3.48Å; F216-F260 HydrophobicContact CD1-CZ 3.48Å; F216-F260 VanDerWaalsContact CD1-CZ 3.48Å; F216-F260 HydrophobicContact CD2-CE1 4.03Å; F216-F260 HydrophobicContact CD2-CE2 4.25Å; F216-F260 AromaticContact CD2-CZ 3.54Å; F216-F260 HydrophobicContact CD2-CZ 3.54Å; F216-F260 HydrophobicContact CE1-CE1 4.4Å; F216-F260 HydrophobicContact CE1-CE2 4.23Å; F216-F260 AromaticContact CE1-CZ 3.46Å; F216-F260 HydrophobicContact CE1-CZ 3.46Å; F216-F260 VanDerWaalsContact CE1-CZ 3.46Å; F216-F260 HydrophobicContact CE2-CE1 4.44Å; F216-F260 AromaticContact CE2-CE2 3.86Å; F216-F260 HydrophobicContact CE2-CE2 3.86Å; F216-F260 AromaticContact CE2-CZ 3.52Å; F216-F260 HydrophobicContact CE2-CZ 3.52Å; F216-F260 AromaticContact CG-CE1 3.78Å; F216-F260 HydrophobicContact CG-CE1 3.78Å; F216-F260 AromaticContact CG-CZ 3.52Å; F216-F260 HydrophobicContact CG-CZ 3.52Å; F216-F260 AromaticContact CZ-CE2 3.85Å; F216-F260 HydrophobicContact CZ-CE2 3.85Å; F216-F260 AromaticContact CZ-CZ 3.48Å; F216-F260 HydrophobicContact CZ-CZ 3.48Å; F216-F260 VanDerWaalsContact CZ-CZ 3.48Å; I222-F260 HydrophobicContact CD1-CB 4.18Å; I222-F260 HydrophobicContact CD1-CD1 3.54Å; I222-F260 HydrophobicContact CD1-CD2 3.47Å; I222-F260 VanDerWaalsContact CD1-CD2 3.47Å; I222-F260 HydrophobicContact CD1-CE1 3.62Å; I222-F260 HydrophobicContact CD1-CE2 3.54Å; I222-F260 HydrophobicContact CD1-CG 3.45Å; I222-F260 VanDerWaalsContact CD1-CG 3.45Å; I222-F260 HydrophobicContact CD1-CZ 3.58Å; I254-F260 HydrophobicContact CD1-CE2 4.39Å; I254-F260 HydrophobicContact CG2-CD2 4.04Å; I254-F260 HydrophobicContact CG2-CE2 3.87Å; I254-F260 WeakPolarHBondContact O-CD2 3.32Å; S257-F260 PolarHBondContact O-N 3.28Å; P258-F260 PolarHBondContact O-N 2.95Å; F260-D262 VanDerWaalsContact C-N 3.33Å; F260-D262 PolarHBondContact O-N 3.44Å; F260-I263 HydrophobicContact CB-CB 4.1Å; F260-I263 HydrophobicContact CB-CG1 4.06Å; F260-I263 HydrophobicContact CD1-CG1 4.12Å; F260-I263 PolarHBondContact O-N 3.42Å; F260-F265 HydrophobicContact CB-CE2 3.89Å; F260-F265 HydrophobicContact CB-CZ 4.29Å; F260-F265 HydrophobicContact CD2-CZ 4.26Å; F260-F265 HydrophobicContact CG-CE2 4.44Å; F260-R317 PolarHBondContact O-NH1 2.86Å; F260-R317 PolarHBondContact O-NH2 3.43Å
261	V	90.7	Very high	95.5	Very high	75 Å²	75	36 Å²	36	46%	0.455	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-48.8	-173.7	176	0	0	0	0	112.1	P258 R317	P258-V261 WeakPolarHBondContact O-CG2 3.26Å; V261-R317 PolarHBondContact O-NH2 3Å
262	D	88.3	Confident	95.5	Very high	145 Å²	145	38.6 Å²	38.6	78%	0.775	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	20.7	-176	-58.7	-45.5	0	0	0	113.5	F260	F260-D262 VanDerWaalsContact C-N 3.33Å; F260-D262 PolarHBondContact O-N 3.44Å
263	I	92.4	Very high	95.5	Very high	33 Å²	33	39 Å²	39	17%	0.169	21%	0.209	C	C	.	.			trans	-95.9	138.2	-176.3	-57.1	-49	0	0	0	111.3	V219 I222 F260 F265 R317	V219-I263 HydrophobicContact CG1-CG2 4.09Å; V219-I263 WeakPolarHBondContact O-CD1 3.39Å; I222-I263 HydrophobicContact CD1-CG2 4.27Å; I222-I263 HydrophobicContact CG1-CG2 4.11Å; F260-I263 HydrophobicContact CB-CB 4.1Å; F260-I263 HydrophobicContact CB-CG1 4.06Å; F260-I263 HydrophobicContact CD1-CG1 4.12Å; F260-I263 PolarHBondContact O-N 3.42Å; I263-F265 HydrophobicContact CG2-CE2 4.46Å; I263-R317 PolarHBondContact O-NH1 3.01Å
264	H	92.4	Very high	95.5	Very high	45 Å²	45	37 Å²	37	21%	0.208	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	132.5	175.1	-58.3	-35	0	0	0	111.4	N220 A221 I222 K346	N220-H264 PolarHBondContact O-N 3.36Å; A221-H264 CarbonylContact C-O 3.53Å; A221-H264 VanDerWaalsContact CA-O 3.3Å; A221-H264 WeakPolarHBondContact CA-O 3.31Å; A221-H264 HydrophobicContact CB-CB 3.9Å; I222-H264 PolarHBondContact N-O 3.34Å; H264-K346 WeakPolarHBondContact CE1-CD 3.29Å; H264-K346 WeakPolarHBondContact NE2-CB 3.24Å; H264-K346 WeakPolarHBondContact NE2-CD 3.33Å
265	F	95.2	Very high	95.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124	-179.9	-98.4	-113	0	0	0	111.8	I222 F251 I254 C255 F260 I263 I319 Y320	I222-F265 HydrophobicContact CB-CD2 4.26Å; I222-F265 HydrophobicContact CB-CE1 4.34Å; I222-F265 HydrophobicContact CB-CE2 4.02Å; I222-F265 HydrophobicContact CB-CZ 4.08Å; I222-F265 HydrophobicContact CD1-CE1 4.45Å; I222-F265 HydrophobicContact CD1-CE2 3.58Å; I222-F265 HydrophobicContact CD1-CZ 3.52Å; I222-F265 HydrophobicContact CG1-CE2 4.27Å; I222-F265 HydrophobicContact CG1-CZ 4.38Å; I222-F265 HydrophobicContact CG2-CD1 4.41Å; I222-F265 HydrophobicContact CG2-CE1 4.01Å; I222-F265 HydrophobicContact CG2-CZ 4.12Å; F251-F265 HydrophobicContact CE2-CD1 4.28Å; I254-F265 HydrophobicContact CG2-CE1 3.84Å; I254-F265 HydrophobicContact CG2-CZ 3.72Å; C255-F265 HydrophobicContact CB-CD1 4.37Å; C255-F265 HydrophobicContact CB-CE1 3.99Å; F260-F265 HydrophobicContact CB-CE2 3.89Å; F260-F265 HydrophobicContact CB-CZ 4.29Å; F260-F265 HydrophobicContact CD2-CZ 4.26Å; F260-F265 HydrophobicContact CG-CE2 4.44Å; I263-F265 HydrophobicContact CG2-CE2 4.46Å; F265-I319 HydrophobicContact CB-CG1 4.45Å; F265-Y320 PolarHBondContact O-N 3.15Å
266	I	97.3	Very high	95.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.5	172.3	-63	157.1	0	0	0	107.1	I222 I223 F224 F268 Y320 C339 M342 I343	I222-I266 PolarHBondContact O-N 3.48Å; I223-I266 WeakPolarHBondContact CA-O 3.35Å; I223-I266 HydrophobicContact CG1-CB 4.24Å; I223-I266 HydrophobicContact CG1-CD1 4.06Å; I223-I266 HydrophobicContact CG2-CG2 4.36Å; F224-I266 PolarHBondContact N-O 3.26Å; I266-F268 HydrophobicContact CG2-CD1 3.65Å; I266-F268 HydrophobicContact CG2-CE1 3.29Å; I266-F268 HydrophobicContact CG2-CZ 4.14Å; I266-Y320 CarbonylContact C-O 3.59Å; I266-Y320 WeakPolarHBondContact CA-O 3.37Å; I266-C339 HydrophobicContact CD1-CB 3.81Å; I266-M342 HydrophobicContact CD1-CE 3.94Å; I266-M342 HydrophobicContact CG1-CE 3.93Å; I266-I343 HydrophobicContact CD1-CD1 3.74Å; I266-I343 HydrophobicContact CD1-CG1 4.4Å
267	L	98.3	Very high	95.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.3	176	173.4	62.9	0	0	0	109.3	F224 F251 L269 F308 I319 Y320 C321 H322	F224-L267 HydrophobicContact CD1-CD1 3.91Å; F224-L267 CarbonylContact O-C 3.6Å; F224-L267 WeakPolarHBondContact O-CA 3.48Å; F251-L267 HydrophobicContact CD2-CD1 4.41Å; F251-L267 HydrophobicContact CE2-CD1 4.2Å; L267-L269 HydrophobicContact CD1-CD2 4.11Å; L267-L269 HydrophobicContact CD2-CD2 4.07Å; L267-L269 HydrophobicContact CD2-CG 4.33Å; L267-L269 HydrophobicContact CG-CD2 4.06Å; L267-L269 HydrophobicContact CG-CG 4.24Å; L267-F308 HydrophobicContact CD1-CD1 4.22Å; L267-F308 HydrophobicContact CD1-CG 4.45Å; L267-F308 HydrophobicContact CD2-CB 3.49Å; L267-F308 VanDerWaalsContact CD2-CB 3.49Å; L267-F308 HydrophobicContact CD2-CD1 4.31Å; L267-F308 HydrophobicContact CD2-CD2 4.45Å; L267-F308 HydrophobicContact CD2-CG 3.85Å; L267-I319 HydrophobicContact CB-CG2 3.65Å; L267-I319 HydrophobicContact CD2-CG2 4.37Å; L267-Y320 PolarHBondContact N-O 3.45Å; L267-C321 HydrophobicContact CB-CB 4.48Å; L267-C321 CarbonylContact O-C 3.57Å; L267-C321 VanDerWaalsContact O-CA 3.31Å; L267-C321 WeakPolarHBondContact O-CA 3.5Å; L267-H322 PolarHBondContact O-N 3.32Å
268	F	98.7	Very high	95.8	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.1	168.6	-72.8	-0.6	0	0	0	109.7	I49 I223 F224 I225 S226 I266 N270 H322 T324 V335 L336	I49-F268 HydrophobicContact CD1-CD2 4.21Å; I49-F268 HydrophobicContact CD1-CE2 4.26Å; I49-F268 HydrophobicContact CG1-CD2 4.32Å; I49-F268 HydrophobicContact CG2-CE2 4.36Å; I223-F268 HydrophobicContact CG2-CD1 4.21Å; I223-F268 HydrophobicContact CG2-CD2 3.6Å; I223-F268 HydrophobicContact CG2-CE1 4.22Å; I223-F268 HydrophobicContact CG2-CE2 3.61Å; I223-F268 HydrophobicContact CG2-CG 3.9Å; I223-F268 HydrophobicContact CG2-CZ 3.92Å; F224-F268 PolarHBondContact O-N 2.89Å; I225-F268 HydrophobicContact CB-CB 4.44Å; I225-F268 HydrophobicContact CD1-CD2 4.44Å; I225-F268 HydrophobicContact CG1-CB 4.06Å; I225-F268 HydrophobicContact CG1-CD2 4.16Å; I225-F268 HydrophobicContact CG1-CG 4.49Å; I225-F268 HydrophobicContact CG2-CB 4.28Å; S226-F268 PolarHBondContact N-O 3.3Å; I266-F268 HydrophobicContact CG2-CD1 3.65Å; I266-F268 HydrophobicContact CG2-CE1 3.29Å; I266-F268 HydrophobicContact CG2-CZ 4.14Å; F268-N270 PolarHBondContact O-N 3.41Å; F268-H322 WeakPolarHBondContact CA-O 3.43Å; F268-H322 HydrophobicContact CD1-CB 3.96Å; F268-H322 HydrophobicContact CE1-CB 4.08Å; F268-T324 HydrophobicContact CB-CG2 4.29Å; F268-T324 HydrophobicContact CD1-CG2 4.14Å; F268-T324 HydrophobicContact CD2-CG2 4.03Å; F268-T324 HydrophobicContact CE2-CG2 4.41Å; F268-T324 HydrophobicContact CG-CG2 3.9Å; F268-V335 HydrophobicContact CD1-CG1 4.17Å; F268-V335 HydrophobicContact CE1-CG1 3.34Å; F268-V335 HydrophobicContact CE2-CG1 4.32Å; F268-V335 HydrophobicContact CZ-CG1 3.45Å; F268-V335 VanDerWaalsContact CZ-CG1 3.45Å; F268-L336 HydrophobicContact CE2-CD2 4.04Å; F268-L336 HydrophobicContact CZ-CD2 3.93Å
269	L	98.7	Very high	96	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	89.8	165.5	-62.6	-176.8	0	0	0	107.7	L228 L267 V301 I304 Q305 F308 H322 H323 T324	L228-L269 HydrophobicContact CD1-CB 3.88Å; L228-L269 HydrophobicContact CD2-CB 3.96Å; L228-L269 HydrophobicContact CD2-CD1 4.28Å; L228-L269 HydrophobicContact CD2-CD2 4.41Å; L228-L269 HydrophobicContact CD2-CG 4.45Å; L228-L269 HydrophobicContact CG-CB 3.81Å; L267-L269 HydrophobicContact CD1-CD2 4.11Å; L267-L269 HydrophobicContact CD2-CD2 4.07Å; L267-L269 HydrophobicContact CD2-CG 4.33Å; L267-L269 HydrophobicContact CG-CD2 4.06Å; L267-L269 HydrophobicContact CG-CG 4.24Å; L269-V301 HydrophobicContact CD1-CG1 4.44Å; L269-I304 HydrophobicContact CD2-CG2 4.47Å; L269-Q305 HydrophobicContact CD1-CB 3.66Å; L269-Q305 HydrophobicContact CD1-CG 4.3Å; L269-F308 HydrophobicContact CD2-CD2 3.9Å; L269-F308 HydrophobicContact CD2-CE2 4.01Å; L269-H322 PolarHBondContact N-O 3.08Å; L269-H323 CarbonylContact O-C 3.1Å; L269-H323 WeakPolarHBondContact O-CA 3.39Å; L269-T324 PolarHBondContact O-N 2.77Å
270	N	98.7	Very high	96.1	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	168.3	-169.3	-170.9	33.4	0	0	0	112.9	S44 I225 S226 L228 F268 K272 T324 A326	S44-N270 PolarHBondContact O-ND2 3.39Å; I225-N270 HydrophobicContact CG2-CB 3.82Å; S226-N270 PolarHBondContact O-N 2.97Å; L228-N270 WeakPolarHBondContact CB-O 3.27Å; L228-N270 PolarHBondContact N-O 3.44Å; F268-N270 PolarHBondContact O-N 3.41Å; N270-K272 VanDerWaalsContact C-N 3.3Å; N270-K272 PolarHBondContact O-N 3.23Å; N270-T324 CarbonylContact C-O 3.55Å; N270-T324 WeakPolarHBondContact CA-O 3.48Å; N270-T324 WeakPolarHBondContact CA-OG1 3.18Å; N270-T324 WeakPolarHBondContact CB-OG1 3.3Å; N270-T324 PolarHBondContact OD1-O 3.17Å; N270-T324 PolarHBondContact OD1-OG1 3.04Å; N270-A326 PolarHBondContact OD1-N 3.23Å
271	K	98.3	Very high	96.2	Very high	18 Å²	18	43.6 Å²	43.6	8%	0.078	21%	0.206	C	C	.	.			trans	59.8	39.9	-178.1	-46.6	-169.2	-155.6	158.4	0	112.3	E43 D151 S227 E230 D273 L274 F275 T324	E43-K271 WeakPolarHBondContact O-CE 3.31Å; E43-K271 PolarHBondContact O-NZ 3.17Å; D151-K271 VanDerWaalsContact OD2-CD 3.26Å; D151-K271 WeakPolarHBondContact OD2-CD 3.43Å; D151-K271 VanDerWaalsContact OD2-CE 3.3Å; D151-K271 WeakPolarHBondContact OD2-CE 3.28Å; D151-K271 IonicContact OD2-NZ 2.67Å; D151-K271 PolarHBondContact OD2-NZ 3.18Å; S227-K271 VanDerWaalsContact OG-CD 3.23Å; S227-K271 WeakPolarHBondContact OG-CD 3.21Å; S227-K271 VanDerWaalsContact OG-CE 3.25Å; S227-K271 WeakPolarHBondContact OG-CE 3.45Å; S227-K271 PolarHBondContact OG-NZ 3.43Å; S227-K271 VanDerWaalsContact OG-NZ 3.17Å; E230-K271 IonicContact OE1-NZ 3.88Å; K271-D273 VanDerWaalsContact CA-OD1 3.3Å; K271-D273 WeakPolarHBondContact CA-OD1 3.37Å; K271-D273 PolarHBondContact O-N 3.43Å; K271-L274 HydrophobicContact CB-CB 4.33Å; K271-L274 HydrophobicContact CB-CD1 4.21Å; K271-L274 HydrophobicContact CB-CG 4.44Å; K271-L274 HydrophobicContact CD-CD1 3.99Å; K271-L274 PolarHBondContact O-N 3.13Å; K271-F275 PolarHBondContact O-N 2.7Å; K271-T324 PolarHBondContact N-O 2.86Å
272	K	98.1	Very high	96.5	Very high	54 Å²	54	40.6 Å²	40.6	24%	0.235	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-31.1	178.6	73.9	-178.6	-178.4	-176.9	0	112.7	L228 N270 A276 Y297 H323 T324 C325 N331	L228-K272 HydrophobicContact CD1-CB 4.1Å; N270-K272 VanDerWaalsContact C-N 3.3Å; N270-K272 PolarHBondContact O-N 3.23Å; K272-A276 WeakPolarHBondContact O-CB 3.05Å; K272-A276 PolarHBondContact O-N 2.77Å; K272-Y297 HydrophobicContact CB-CE2 4.21Å; K272-H323 HydrophobicContact CD-CB 4.07Å; K272-T324 WeakPolarHBondContact CG-O 3.43Å; K272-T324 PolarHBondContact N-O 2.67Å; K272-T324 VanDerWaalsContact N-O 3.1Å; K272-C325 HydrophobicContact CG-CB 4.31Å; K272-N331 PolarHBondContact NZ-ND2 3.49Å
273	D	97.6	Very high	96.9	Very high	46 Å²	46	35.9 Å²	35.9	25%	0.246	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-55	174.1	57.7	-40.2	0	0	0	110.9	K271 F275 A276 E277 C325	K271-D273 VanDerWaalsContact CA-OD1 3.3Å; K271-D273 WeakPolarHBondContact CA-OD1 3.37Å; K271-D273 PolarHBondContact O-N 3.43Å; D273-F275 VanDerWaalsContact C-N 3.3Å; D273-F275 PolarHBondContact O-N 2.67Å; D273-A276 PolarHBondContact O-N 3.26Å; D273-E277 PolarHBondContact O-N 3.38Å; D273-C325 VanDerWaalsContact CG-SG 3.56Å
274	L	97.8	Very high	97.1	Very high	33 Å²	33	34.4 Å²	34.4	17%	0.173	16%	0.157	C	C	.	.	H	α-helix	trans	-65.4	-36.5	178.9	-59	-178.2	0	0	0	111.7	D151 K271 E277 K278	D151-L274 HydrophobicContact CB-CD1 3.59Å; D151-L274 VanDerWaalsContact CG-CD1 3.49Å; K271-L274 HydrophobicContact CB-CB 4.33Å; K271-L274 HydrophobicContact CB-CD1 4.21Å; K271-L274 HydrophobicContact CB-CG 4.44Å; K271-L274 HydrophobicContact CD-CD1 3.99Å; K271-L274 PolarHBondContact O-N 3.13Å; L274-E277 PolarHBondContact O-N 3.17Å; L274-K278 WeakPolarHBondContact O-CB 3.46Å; L274-K278 PolarHBondContact O-N 3.07Å
275	F	98.3	Very high	97.4	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-44.4	174.4	-177.6	-101.2	0	0	0	112.1	L228 Y231 K271 D273 E277 K278 I279 Y297 V301 I304	L228-F275 HydrophobicContact CB-CB 3.65Å; L228-F275 HydrophobicContact CB-CD2 3.91Å; L228-F275 HydrophobicContact CB-CG 3.77Å; L228-F275 VanDerWaalsContact O-CD2 3.26Å; L228-F275 WeakPolarHBondContact O-CD2 3.27Å; Y231-F275 AromaticContact CD1-CD2 3.75Å; Y231-F275 HydrophobicContact CD1-CD2 3.75Å; Y231-F275 AromaticContact CD1-CE2 3.6Å; Y231-F275 HydrophobicContact CD1-CE2 3.6Å; Y231-F275 AromaticContact CE1-CD2 3.67Å; Y231-F275 HydrophobicContact CE1-CD2 3.67Å; Y231-F275 AromaticContact CE1-CE2 3.59Å; Y231-F275 HydrophobicContact CE1-CE2 3.59Å; Y231-F275 HydrophobicContact CG-CE2 4.36Å; K271-F275 PolarHBondContact O-N 2.7Å; D273-F275 VanDerWaalsContact C-N 3.3Å; D273-F275 PolarHBondContact O-N 2.67Å; F275-E277 VanDerWaalsContact C-N 3.25Å; F275-E277 PolarHBondContact O-N 3.42Å; F275-K278 PolarHBondContact O-N 3.36Å; F275-I279 HydrophobicContact CE1-CB 4.22Å; F275-I279 HydrophobicContact CE1-CG1 4.34Å; F275-I279 HydrophobicContact CE1-CG2 4.5Å; F275-I279 HydrophobicContact CE2-CB 4.47Å; F275-I279 HydrophobicContact CE2-CD1 4.29Å; F275-I279 HydrophobicContact CZ-CB 4.14Å; F275-I279 HydrophobicContact CZ-CD1 3.95Å; F275-I279 HydrophobicContact CZ-CG1 4.04Å; F275-I279 WeakPolarHBondContact O-CB 3.43Å; F275-I279 WeakPolarHBondContact O-CG2 3.27Å; F275-I279 PolarHBondContact O-N 3.23Å; F275-Y297 AromaticContact CD1-CD2 3.69Å; F275-Y297 HydrophobicContact CD1-CD2 3.69Å; F275-Y297 AromaticContact CD1-CE2 3.92Å; F275-Y297 HydrophobicContact CD1-CE2 3.92Å; F275-Y297 HydrophobicContact CE1-CD2 4.17Å; F275-V301 HydrophobicContact CD1-CG2 3.46Å; F275-V301 VanDerWaalsContact CD1-CG2 3.46Å; F275-V301 HydrophobicContact CE1-CB 4.47Å; F275-V301 HydrophobicContact CE1-CG2 3.31Å; F275-V301 HydrophobicContact CZ-CG2 4.29Å; F275-I304 HydrophobicContact CE2-CD1 3.8Å; F275-I304 HydrophobicContact CZ-CD1 3.88Å
276	A	98	Very high	97.5	Very high	25 Å²	25	39.1 Å²	39.1	21%	0.207	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-31.3	-180	0	0	0	0	0	113.4	K272 D273 R280 Y297	K272-A276 WeakPolarHBondContact O-CB 3.05Å; K272-A276 PolarHBondContact O-N 2.77Å; D273-A276 PolarHBondContact O-N 3.26Å; A276-R280 PolarHBondContact O-NE 3.02Å; A276-Y297 HydrophobicContact CB-CD2 3.64Å; A276-Y297 HydrophobicContact CB-CE2 4.11Å; A276-Y297 HydrophobicContact CB-CG 4.45Å
277	E	96.1	Very high	97.5	Very high	101 Å²	101	39.3 Å²	39.3	47%	0.472	19%	0.191	S	C	.	.	H	α-helix	trans	-76.3	-46.3	172.2	-66	-178.9	-169.1	0	0	112	D273 L274 F275 R280	D273-E277 PolarHBondContact O-N 3.38Å; L274-E277 PolarHBondContact O-N 3.17Å; F275-E277 VanDerWaalsContact C-N 3.25Å; F275-E277 PolarHBondContact O-N 3.42Å; E277-R280 PolarHBondContact O-N 3.5Å
278	K	96.6	Very high	97.5	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-71.4	-37.9	-171.2	-171.6	-178.8	-99.9	-157.4	0	113	S229 Y231 D232 L274 F275 R280 R281 S282	S229-K278 VanDerWaalsContact O-CD 3.27Å; S229-K278 WeakPolarHBondContact O-CD 3.36Å; S229-K278 WeakPolarHBondContact O-CE 3.38Å; S229-K278 PolarHBondContact O-NZ 2.81Å; Y231-K278 HydrophobicContact CD1-CD 4.43Å; Y231-K278 HydrophobicContact CE1-CB 4.39Å; Y231-K278 HydrophobicContact CE1-CD 3.68Å; Y231-K278 HydrophobicContact CE1-CG 3.95Å; Y231-K278 PolarHBondContact OH-O 3.05Å; D232-K278 VanDerWaalsContact OD1-CD 3.26Å; D232-K278 WeakPolarHBondContact OD1-CD 3.3Å; D232-K278 WeakPolarHBondContact OD1-CE 3.46Å; D232-K278 IonicContact OD1-NZ 2.99Å; D232-K278 PolarHBondContact OD1-NZ 3.46Å; D232-K278 VanDerWaalsContact OD2-CD 3.3Å; D232-K278 WeakPolarHBondContact OD2-CD 3.47Å; D232-K278 WeakPolarHBondContact OD2-CG 3.31Å; D232-K278 IonicContact OD2-NZ 3.02Å; L274-K278 WeakPolarHBondContact O-CB 3.46Å; L274-K278 PolarHBondContact O-N 3.07Å; F275-K278 PolarHBondContact O-N 3.36Å; K278-R280 PolarHBondContact O-N 3.24Å; K278-R281 VanDerWaalsContact O-CG 3.22Å; K278-R281 WeakPolarHBondContact O-CG 3.35Å; K278-R281 PolarHBondContact O-N 3.47Å; K278-S282 PolarHBondContact O-N 3.37Å
279	I	97.5	Very high	97.5	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.015	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.1	179.9	-164.9	58.4	0	0	0	112.9	Y231 F275 R281 L284 Q295	Y231-I279 HydrophobicContact CE2-CD1 4.48Å; Y231-I279 VanDerWaalsContact OH-CA 3.31Å; Y231-I279 WeakPolarHBondContact OH-CA 3.29Å; Y231-I279 PolarHBondContact OH-N 3.35Å; F275-I279 HydrophobicContact CE1-CB 4.22Å; F275-I279 HydrophobicContact CE1-CG1 4.34Å; F275-I279 HydrophobicContact CE1-CG2 4.5Å; F275-I279 HydrophobicContact CE2-CB 4.47Å; F275-I279 HydrophobicContact CE2-CD1 4.29Å; F275-I279 HydrophobicContact CZ-CB 4.14Å; F275-I279 HydrophobicContact CZ-CD1 3.95Å; F275-I279 HydrophobicContact CZ-CG1 4.04Å; F275-I279 WeakPolarHBondContact O-CB 3.43Å; F275-I279 WeakPolarHBondContact O-CG2 3.27Å; F275-I279 PolarHBondContact O-N 3.23Å; I279-R281 VanDerWaalsContact C-N 3.29Å; I279-R281 PolarHBondContact O-N 3.48Å; I279-L284 HydrophobicContact CD1-CB 4.02Å; I279-Q295 HydrophobicContact CD1-CG 4.34Å; I279-Q295 HydrophobicContact CG1-CG 4.32Å; I279-Q295 VanDerWaalsContact O-CG 3.23Å; I279-Q295 WeakPolarHBondContact O-CG 3.25Å; I279-Q295 PolarHBondContact O-NE2 3.01Å
280	R	95.9	Very high	97.4	Very high	204 Å²	204	48.3 Å²	48.3	77%	0.77	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-22.2	177.3	-57	179	-169.1	-168.6	-2	113.6	A276 E277 K278	A276-R280 PolarHBondContact O-NE 3.02Å; E277-R280 PolarHBondContact O-N 3.5Å; K278-R280 PolarHBondContact O-N 3.24Å
281	R	94.7	Very high	97.3	Very high	122 Å²	122	49.1 Å²	49.1	46%	0.46	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-24	-175.3	61.6	175.5	-175.9	-101.1	6	114.1	K278 I279	K278-R281 VanDerWaalsContact O-CG 3.22Å; K278-R281 WeakPolarHBondContact O-CG 3.35Å; K278-R281 PolarHBondContact O-N 3.47Å; I279-R281 VanDerWaalsContact C-N 3.29Å; I279-R281 PolarHBondContact O-N 3.48Å
282	S	96.5	Very high	97.2	Very high	11 Å²	11	57.1 Å²	57.1	8%	0.077	28%	0.278	C	S	.	.	S	Bend	trans	-124.9	115.3	-178.1	177.7	0	0	0	0	109.2	Y231 D232 K278	Y231-S282 WeakPolarHBondContact OH-CB 3.42Å; Y231-S282 PolarHBondContact OH-O 3.12Å; D232-S282 VanDerWaalsContact CB-OG 3.22Å; D232-S282 WeakPolarHBondContact CB-OG 3.19Å; D232-S282 VanDerWaalsContact OD2-CB 3.22Å; D232-S282 WeakPolarHBondContact OD2-CB 3.3Å; D232-S282 PolarHBondContact OD2-OG 3.15Å; K278-S282 PolarHBondContact O-N 3.37Å
283	P	97	Very high	97.1	Very high	46 Å²	46	56 Å²	56	30%	0.299	28%	0.282	S	S	.	.			trans	-71.4	144.8	-173.7	27.5	-31.7	0	0	0	111.5	T285 V286	P283-T285 PolarHBondContact O-N 3.09Å; P283-V286 HydrophobicContact CG-CG2 4.06Å; P283-V286 WeakPolarHBondContact O-CG2 3.24Å; P283-V286 PolarHBondContact O-N 2.85Å; P283-V286 VanDerWaalsContact O-N 3.09Å
284	L	98.2	Very high	97	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-58.6	-24.6	178.7	-172.3	61.1	0	0	0	112.4	Y231 I279 V286 C287 F288 Y291 Y303 I304	Y231-L284 HydrophobicContact CD2-CD1 4.01Å; Y231-L284 HydrophobicContact CG-CD1 4.26Å; I279-L284 HydrophobicContact CD1-CB 4.02Å; L284-V286 PolarHBondContact O-N 3.39Å; L284-C287 PolarHBondContact O-N 3.39Å; L284-F288 HydrophobicContact CD1-CD2 3.76Å; L284-F288 HydrophobicContact CD1-CE2 4.09Å; L284-F288 HydrophobicContact CD2-CD2 4.34Å; L284-F288 HydrophobicContact CG-CD2 3.87Å; L284-F288 PolarHBondContact O-N 2.6Å; L284-Y291 HydrophobicContact CB-CD1 3.94Å; L284-Y291 HydrophobicContact CB-CE1 4.18Å; L284-Y291 HydrophobicContact CD2-CD1 3.89Å; L284-Y291 HydrophobicContact CD2-CD2 3.94Å; L284-Y291 HydrophobicContact CD2-CE1 3.92Å; L284-Y291 HydrophobicContact CD2-CE2 4Å; L284-Y291 HydrophobicContact CD2-CG 3.88Å; L284-Y291 HydrophobicContact CG-CD1 4.29Å; L284-Y291 HydrophobicContact CG-CG 4.42Å; L284-Y303 HydrophobicContact CD2-CD1 3.88Å; L284-Y303 HydrophobicContact CD2-CG 4.44Å; L284-I304 HydrophobicContact CD1-CD1 3.94Å; L284-I304 HydrophobicContact CD1-CG1 4.18Å
285	T	97.9	Very high	96.8	Very high	59 Å²	59	62.7 Å²	62.7	36%	0.362	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-63.7	-15.9	177.9	51.9	0	0	0	0	114.6	P283 C287 F288 P289 Y291	P283-T285 PolarHBondContact O-N 3.09Å; T285-C287 PolarHBondContact O-N 2.89Å; T285-F288 WeakPolarHBondContact CA-O 3.19Å; T285-P289 WeakPolarHBondContact O-CA 3.34Å; T285-Y291 HydrophobicContact CG2-CD1 4.5Å
286	V	96.9	Very high	96.7	Very high	85 Å²	85	64.8 Å²	64.8	52%	0.515	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-61.4	-35.5	168.3	174.7	0	0	0	0	110.9	D232 P283 L284	D232-V286 HydrophobicContact CB-CG1 4.46Å; P283-V286 HydrophobicContact CG-CG2 4.06Å; P283-V286 WeakPolarHBondContact O-CG2 3.24Å; P283-V286 PolarHBondContact O-N 2.85Å; P283-V286 VanDerWaalsContact O-N 3.09Å; L284-V286 PolarHBondContact O-N 3.39Å
287	C	97.9	Very high	96.7	Very high	4 Å²	4	66.9 Å²	66.9	3%	0.027	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-48.9	173.9	-169.8	0	0	0	0	111	Y231 N242 H245 L284 T285 P289	Y231-C287 HydrophobicContact CD2-CB 4.38Å; Y231-C287 VanDerWaalsContact O-CB 3.31Å; Y231-C287 WeakPolarHBondContact O-CB 3.21Å; N242-C287 PolarHBondContact OD1-SG 3.42Å; H245-C287 PolarHBondContact CE1-O 2.94Å; H245-C287 PolarHBondContact CE1-SG 3.24Å; H245-C287 PolarHBondContact ND1-SG 3.21Å; L284-C287 PolarHBondContact O-N 3.39Å; T285-C287 PolarHBondContact O-N 2.89Å; C287-P289 VanDerWaalsContact O-CD 3.28Å; C287-P289 WeakPolarHBondContact O-CD 3.42Å
288	F	98.1	Very high	96.7	Very high	4 Å²	4	65.7 Å²	65.7	2%	0.018	33%	0.328	C	S	.	.			trans	-120.4	82.5	-172.7	-55.9	-69.8	0	0	0	110.6	M244 L248 L284 T285 E290 Y291 Y303 I304 K307	M244-F288 HydrophobicContact CG-CE2 4.15Å; M244-F288 HydrophobicContact CG-CZ 3.76Å; L248-F288 HydrophobicContact CD1-CE1 3.77Å; L248-F288 HydrophobicContact CD1-CZ 3.82Å; L284-F288 HydrophobicContact CD1-CD2 3.76Å; L284-F288 HydrophobicContact CD1-CE2 4.09Å; L284-F288 HydrophobicContact CD2-CD2 4.34Å; L284-F288 HydrophobicContact CG-CD2 3.87Å; L284-F288 PolarHBondContact O-N 2.6Å; T285-F288 WeakPolarHBondContact CA-O 3.19Å; F288-E290 WeakPolarHBondContact CA-OE2 3.44Å; F288-E290 PolarHBondContact O-N 3.3Å; F288-Y291 WeakPolarHBondContact O-CB 3.17Å; F288-Y291 PolarHBondContact O-N 3.39Å; F288-Y303 HydrophobicContact CB-CE1 3.76Å; F288-Y303 HydrophobicContact CD1-CE1 4.29Å; F288-Y303 HydrophobicContact CD2-CD1 4.22Å; F288-Y303 AromaticContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CG-CD1 4.47Å; F288-Y303 AromaticContact CG-CE1 3.73Å; F288-Y303 HydrophobicContact CG-CE1 3.73Å; F288-I304 HydrophobicContact CE2-CG1 4.06Å; F288-K307 HydrophobicContact CE1-CG 4.28Å; F288-K307 HydrophobicContact CZ-CG 4.44Å
289	P	97.7	Very high	96.8	Very high	93 Å²	93	68.7 Å²	68.7	60%	0.604	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.2	-176.9	-26.9	34.7	0	0	0	114.4	T285 C287 Y291	T285-P289 WeakPolarHBondContact O-CA 3.34Å; C287-P289 VanDerWaalsContact O-CD 3.28Å; C287-P289 WeakPolarHBondContact O-CD 3.42Å; P289-Y291 VanDerWaalsContact C-N 3.33Å
290	E	96.9	Very high	96.8	Very high	93 Å²	93	68.6 Å²	68.6	44%	0.435	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-12	177.7	75.6	-81.2	-160.2	0	0	114.2	F288 K292 Y303 K307	F288-E290 WeakPolarHBondContact CA-OE2 3.44Å; F288-E290 PolarHBondContact O-N 3.3Å; E290-K292 WeakPolarHBondContact O-CG 3.42Å; E290-K292 PolarHBondContact O-N 3.29Å; E290-Y303 WeakPolarHBondContact CG-OH 3.22Å; E290-Y303 PolarHBondContact OE1-OH 3.44Å; E290-K307 WeakPolarHBondContact OE1-CE 3.48Å; E290-K307 IonicContact OE1-NZ 3.62Å; E290-K307 PolarHBondContact OE1-NZ 3.21Å
291	Y	97.9	Very high	96.9	Very high	20 Å²	20	58.9 Å²	58.9	8%	0.078	31%	0.305	C	S	.	.			trans	-61.1	127.6	179.7	-179.8	-113.1	0	0	0	111.5	L284 T285 F288 P289 G293 Q294 E299 S300 Y303	L284-Y291 HydrophobicContact CB-CD1 3.94Å; L284-Y291 HydrophobicContact CB-CE1 4.18Å; L284-Y291 HydrophobicContact CD2-CD1 3.89Å; L284-Y291 HydrophobicContact CD2-CD2 3.94Å; L284-Y291 HydrophobicContact CD2-CE1 3.92Å; L284-Y291 HydrophobicContact CD2-CE2 4Å; L284-Y291 HydrophobicContact CD2-CG 3.88Å; L284-Y291 HydrophobicContact CG-CD1 4.29Å; L284-Y291 HydrophobicContact CG-CG 4.42Å; T285-Y291 HydrophobicContact CG2-CD1 4.5Å; F288-Y291 WeakPolarHBondContact O-CB 3.17Å; F288-Y291 PolarHBondContact O-N 3.39Å; P289-Y291 VanDerWaalsContact C-N 3.33Å; Y291-G293 VanDerWaalsContact CE1-O 3.23Å; Y291-G293 WeakPolarHBondContact CE1-O 3.35Å; Y291-G293 VanDerWaalsContact CZ-CA 3.41Å; Y291-G293 WeakPolarHBondContact OH-CA 3.4Å; Y291-Q294 PolarHBondContact OH-O 3.13Å; Y291-E299 VanDerWaalsContact OH-CB 3.29Å; Y291-E299 WeakPolarHBondContact OH-CB 3.1Å; Y291-S300 PolarHBondContact OH-N 3.43Å; Y291-Y303 AromaticContact CD2-CD1 3.7Å; Y291-Y303 HydrophobicContact CD2-CD1 3.7Å; Y291-Y303 AromaticContact CD2-CD2 3.53Å; Y291-Y303 HydrophobicContact CD2-CD2 3.53Å; Y291-Y303 AromaticContact CD2-CE1 3.98Å; Y291-Y303 HydrophobicContact CD2-CE1 3.98Å; Y291-Y303 AromaticContact CD2-CE2 3.81Å; Y291-Y303 HydrophobicContact CD2-CE2 3.81Å; Y291-Y303 AromaticContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CD2-CG 3.44Å; Y291-Y303 VanDerWaalsContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CE2-CD1 4.2Å; Y291-Y303 AromaticContact CE2-CD2 3.82Å; Y291-Y303 HydrophobicContact CE2-CD2 3.82Å; Y291-Y303 AromaticContact CE2-CG 3.61Å; Y291-Y303 HydrophobicContact CE2-CG 3.61Å; Y291-Y303 HydrophobicContact CG-CD1 4.48Å
292	K	96.2	Very high	97.1	Very high	186 Å²	186	57.5 Å²	57.5	81%	0.809	31%	0.307	S	S	*	.			trans	-116.1	-1.2	-178.8	-56.6	-55.1	176.6	-166.4	0	114.1	E290	E290-K292 WeakPolarHBondContact O-CG 3.42Å; E290-K292 PolarHBondContact O-N 3.29Å
293	G	95.1	Very high	97.2	Very high	31 Å²	31	58.7 Å²	58.7	32%	0.32	31%	0.31	S	S	.	.	S	Bend	trans	-75.2	175.6	177.9	0	0	0	0	0	112.2	Y291 E299	Y291-G293 VanDerWaalsContact CE1-O 3.23Å; Y291-G293 WeakPolarHBondContact CE1-O 3.35Å; Y291-G293 VanDerWaalsContact CZ-CA 3.41Å; Y291-G293 WeakPolarHBondContact OH-CA 3.4Å; G293-E299 WeakPolarHBondContact CA-OE2 3.17Å
294	Q	95.7	Very high	97.3	Very high	124 Å²	124	56.5 Å²	56.5	58%	0.579	30%	0.296	S	S	*	.			trans	-72.4	149.3	177.1	-62.2	-174.6	1.1	0	0	111.8	Y291 N296 E299	Y291-Q294 PolarHBondContact OH-O 3.13Å; Q294-N296 VanDerWaalsContact CB-ND2 3.29Å; Q294-N296 WeakPolarHBondContact CB-ND2 3.4Å; Q294-N296 PolarHBondContact O-N 3.21Å; Q294-N296 PolarHBondContact OE1-ND2 3.22Å; Q294-E299 WeakPolarHBondContact CB-OE1 3.13Å; Q294-E299 VanDerWaalsContact CD-OE1 3.29Å; Q294-E299 VanDerWaalsContact CG-OE1 3.24Å; Q294-E299 WeakPolarHBondContact CG-OE1 3.36Å; Q294-E299 PolarHBondContact N-OE2 3.12Å; Q294-E299 PolarHBondContact OE1-OE1 2.82Å
295	Q	94.4	Very high	97.3	Very high	95 Å²	95	58.4 Å²	58.4	44%	0.444	31%	0.305	S	S	.	.	S	Bend	trans	-76.8	60.7	173	-168	177.6	-16.5	0	0	111.3	I279	I279-Q295 HydrophobicContact CD1-CG 4.34Å; I279-Q295 HydrophobicContact CG1-CG 4.32Å; I279-Q295 VanDerWaalsContact O-CG 3.23Å; I279-Q295 WeakPolarHBondContact O-CG 3.25Å; I279-Q295 PolarHBondContact O-NE2 3.01Å
296	N	95.8	Very high	97.3	Very high	44 Å²	44	60.9 Å²	60.9	24%	0.235	31%	0.308	C	S	.	.	S	Bend	trans	-125.4	158.8	175.5	72.5	49.8	0	0	0	110.4	Q294 S298 E299 S300	Q294-N296 VanDerWaalsContact CB-ND2 3.29Å; Q294-N296 WeakPolarHBondContact CB-ND2 3.4Å; Q294-N296 PolarHBondContact O-N 3.21Å; Q294-N296 PolarHBondContact OE1-ND2 3.22Å; N296-S298 PolarHBondContact O-N 2.89Å; N296-S298 PolarHBondContact OD1-N 3.38Å; N296-E299 PolarHBondContact ND2-OE1 3.42Å; N296-E299 VanDerWaalsContact ND2-OE1 3.12Å; N296-E299 WeakPolarHBondContact OD1-CB 3.29Å; N296-E299 PolarHBondContact OD1-N 2.88Å; N296-S300 WeakPolarHBondContact O-CB 3.36Å; N296-S300 PolarHBondContact O-N 3.25Å; N296-S300 VanDerWaalsContact O-N 3.12Å; N296-S300 PolarHBondContact O-OG 3.32Å
297	Y	97.4	Very high	97.4	Very high	70 Å²	70	58.9 Å²	58.9	28%	0.275	29%	0.292	S	S	.	.	H	α-helix	trans	-55.3	-51	-177.6	172.8	-90.4	0	0	0	112	K272 F275 A276 S300 V301	K272-Y297 HydrophobicContact CB-CE2 4.21Å; F275-Y297 AromaticContact CD1-CD2 3.69Å; F275-Y297 HydrophobicContact CD1-CD2 3.69Å; F275-Y297 AromaticContact CD1-CE2 3.92Å; F275-Y297 HydrophobicContact CD1-CE2 3.92Å; F275-Y297 HydrophobicContact CE1-CD2 4.17Å; A276-Y297 HydrophobicContact CB-CD2 3.64Å; A276-Y297 HydrophobicContact CB-CE2 4.11Å; A276-Y297 HydrophobicContact CB-CG 4.45Å; Y297-S300 PolarHBondContact O-N 3.37Å; Y297-V301 HydrophobicContact CD1-CG2 4.44Å; Y297-V301 HydrophobicContact CD2-CG2 3.88Å; Y297-V301 HydrophobicContact CE1-CG2 4.14Å; Y297-V301 HydrophobicContact CE2-CG2 3.57Å; Y297-V301 HydrophobicContact CG-CG2 4.31Å; Y297-V301 WeakPolarHBondContact O-CB 3.26Å; Y297-V301 WeakPolarHBondContact O-CG2 3.43Å; Y297-V301 PolarHBondContact O-N 3.48Å
298	S	97.1	Very high	97.4	Very high	75 Å²	75	58.7 Å²	58.7	52%	0.524	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-51.9	-170.9	-55.2	0	0	0	0	112.5	N296 S300 N302	N296-S298 PolarHBondContact O-N 2.89Å; N296-S298 PolarHBondContact OD1-N 3.38Å; S298-S300 VanDerWaalsContact C-N 3.35Å; S298-N302 WeakPolarHBondContact O-CB 3.45Å; S298-N302 PolarHBondContact O-N 3.18Å; S298-N302 VanDerWaalsContact O-N 3.13Å; S298-N302 PolarHBondContact O-ND2 2.99Å
299	E	97.9	Very high	97.3	Very high	72 Å²	72	61.9 Å²	61.9	34%	0.336	31%	0.306	S	S	.	.	H	α-helix	trans	-68.2	-36.4	179.4	-71.2	-176.3	-127.7	0	0	112	Y291 G293 Q294 N296 Y303	Y291-E299 VanDerWaalsContact OH-CB 3.29Å; Y291-E299 WeakPolarHBondContact OH-CB 3.1Å; G293-E299 WeakPolarHBondContact CA-OE2 3.17Å; Q294-E299 WeakPolarHBondContact CB-OE1 3.13Å; Q294-E299 VanDerWaalsContact CD-OE1 3.29Å; Q294-E299 VanDerWaalsContact CG-OE1 3.24Å; Q294-E299 WeakPolarHBondContact CG-OE1 3.36Å; Q294-E299 PolarHBondContact N-OE2 3.12Å; Q294-E299 PolarHBondContact OE1-OE1 2.82Å; N296-E299 PolarHBondContact ND2-OE1 3.42Å; N296-E299 VanDerWaalsContact ND2-OE1 3.12Å; N296-E299 WeakPolarHBondContact OD1-CB 3.29Å; N296-E299 PolarHBondContact OD1-N 2.88Å; E299-Y303 WeakPolarHBondContact O-CB 3.34Å; E299-Y303 PolarHBondContact O-N 3.35Å
300	S	98.2	Very high	97.3	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-72.1	-42.7	-177.5	-62	0	0	0	0	112.1	Y291 N296 Y297 S298 Y303 I304	Y291-S300 PolarHBondContact OH-N 3.43Å; N296-S300 WeakPolarHBondContact O-CB 3.36Å; N296-S300 PolarHBondContact O-N 3.25Å; N296-S300 VanDerWaalsContact O-N 3.12Å; N296-S300 PolarHBondContact O-OG 3.32Å; Y297-S300 PolarHBondContact O-N 3.37Å; S298-S300 VanDerWaalsContact C-N 3.35Å; S300-Y303 PolarHBondContact O-N 3.13Å; S300-I304 WeakPolarHBondContact O-CG1 3.3Å; S300-I304 PolarHBondContact O-N 3.13Å
301	V	98.3	Very high	97.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-42.7	175.1	176	0	0	0	0	110.8	L228 L269 F275 Y297 Y303 I304 Q305 H323	L228-V301 HydrophobicContact CD1-CG1 4.22Å; L228-V301 HydrophobicContact CD1-CG2 4.03Å; L228-V301 HydrophobicContact CD2-CG1 4.4Å; L228-V301 HydrophobicContact CD2-CG2 4.47Å; L269-V301 HydrophobicContact CD1-CG1 4.44Å; F275-V301 HydrophobicContact CD1-CG2 3.46Å; F275-V301 VanDerWaalsContact CD1-CG2 3.46Å; F275-V301 HydrophobicContact CE1-CB 4.47Å; F275-V301 HydrophobicContact CE1-CG2 3.31Å; F275-V301 HydrophobicContact CZ-CG2 4.29Å; Y297-V301 HydrophobicContact CD1-CG2 4.44Å; Y297-V301 HydrophobicContact CD2-CG2 3.88Å; Y297-V301 HydrophobicContact CE1-CG2 4.14Å; Y297-V301 HydrophobicContact CE2-CG2 3.57Å; Y297-V301 HydrophobicContact CG-CG2 4.31Å; Y297-V301 WeakPolarHBondContact O-CB 3.26Å; Y297-V301 WeakPolarHBondContact O-CG2 3.43Å; Y297-V301 PolarHBondContact O-N 3.48Å; V301-Y303 VanDerWaalsContact C-N 3.26Å; V301-Y303 PolarHBondContact O-N 3.4Å; V301-I304 PolarHBondContact O-N 3.49Å; V301-Q305 WeakPolarHBondContact O-CB 3.22Å; V301-Q305 PolarHBondContact O-N 2.91Å; V301-H323 WeakPolarHBondContact CG1-CE1 3.48Å; V301-H323 VanDerWaalsContact CG1-NE2 3.32Å; V301-H323 WeakPolarHBondContact CG1-NE2 3.4Å
302	N	98	Very high	97.3	Very high	94 Å²	94	61.8 Å²	61.8	50%	0.503	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-38	177.1	-72.7	-14	0	0	0	111.8	S298 Q305 W306	S298-N302 WeakPolarHBondContact O-CB 3.45Å; S298-N302 PolarHBondContact O-N 3.18Å; S298-N302 VanDerWaalsContact O-N 3.13Å; S298-N302 PolarHBondContact O-ND2 2.99Å; N302-Q305 PolarHBondContact O-N 3.11Å; N302-W306 VanDerWaalsContact O-CB 3.31Å; N302-W306 WeakPolarHBondContact O-CB 3.49Å; N302-W306 PolarHBondContact O-N 2.62Å
303	Y	98.6	Very high	97.3	Very high	36 Å²	36	61.4 Å²	61.4	14%	0.141	29%	0.294	C	S	.	.	H	α-helix	trans	-66.2	-43.8	175.3	-174.9	-96.3	0	0	0	112.7	L284 F288 E290 Y291 E299 S300 V301 W306 K307	L284-Y303 HydrophobicContact CD2-CD1 3.88Å; L284-Y303 HydrophobicContact CD2-CG 4.44Å; F288-Y303 HydrophobicContact CB-CE1 3.76Å; F288-Y303 HydrophobicContact CD1-CE1 4.29Å; F288-Y303 HydrophobicContact CD2-CD1 4.22Å; F288-Y303 AromaticContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CG-CD1 4.47Å; F288-Y303 AromaticContact CG-CE1 3.73Å; F288-Y303 HydrophobicContact CG-CE1 3.73Å; E290-Y303 WeakPolarHBondContact CG-OH 3.22Å; E290-Y303 PolarHBondContact OE1-OH 3.44Å; Y291-Y303 AromaticContact CD2-CD1 3.7Å; Y291-Y303 HydrophobicContact CD2-CD1 3.7Å; Y291-Y303 AromaticContact CD2-CD2 3.53Å; Y291-Y303 HydrophobicContact CD2-CD2 3.53Å; Y291-Y303 AromaticContact CD2-CE1 3.98Å; Y291-Y303 HydrophobicContact CD2-CE1 3.98Å; Y291-Y303 AromaticContact CD2-CE2 3.81Å; Y291-Y303 HydrophobicContact CD2-CE2 3.81Å; Y291-Y303 AromaticContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CD2-CG 3.44Å; Y291-Y303 VanDerWaalsContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CE2-CD1 4.2Å; Y291-Y303 AromaticContact CE2-CD2 3.82Å; Y291-Y303 HydrophobicContact CE2-CD2 3.82Å; Y291-Y303 AromaticContact CE2-CG 3.61Å; Y291-Y303 HydrophobicContact CE2-CG 3.61Å; Y291-Y303 HydrophobicContact CG-CD1 4.48Å; E299-Y303 WeakPolarHBondContact O-CB 3.34Å; E299-Y303 PolarHBondContact O-N 3.35Å; S300-Y303 PolarHBondContact O-N 3.13Å; V301-Y303 VanDerWaalsContact C-N 3.26Å; V301-Y303 PolarHBondContact O-N 3.4Å; Y303-W306 AromaticContact CD2-CE3 3.97Å; Y303-W306 HydrophobicContact CD2-CE3 3.97Å; Y303-W306 HydrophobicContact CD2-CZ3 4.25Å; Y303-W306 AromaticContact CE2-CE3 3.83Å; Y303-W306 HydrophobicContact CE2-CE3 3.83Å; Y303-W306 AromaticContact CE2-CZ3 3.63Å; Y303-W306 HydrophobicContact CE2-CZ3 3.63Å; Y303-W306 AromaticContact CZ-CZ3 3.98Å; Y303-W306 PolarHBondContact O-N 2.84Å; Y303-K307 HydrophobicContact CD1-CG 4.26Å; Y303-K307 HydrophobicContact CE1-CD 4.39Å; Y303-K307 HydrophobicContact CE1-CG 3.94Å; Y303-K307 VanDerWaalsContact CZ-CE 3.41Å; Y303-K307 WeakPolarHBondContact O-CG 3.39Å; Y303-K307 PolarHBondContact O-N 3.11Å; Y303-K307 WeakPolarHBondContact OH-CE 3.35Å; Y303-K307 PolarHBondContact OH-NZ 2.98Å
304	I	98.6	Very high	97.2	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-45.5	175.8	-66.4	165.9	0	0	0	110.2	L228 M244 L269 F275 L284 F288 S300 V301 W306 K307 F308	L228-I304 HydrophobicContact CD2-CB 4.2Å; L228-I304 HydrophobicContact CD2-CD1 3.83Å; L228-I304 HydrophobicContact CD2-CG2 3.86Å; M244-I304 HydrophobicContact CE-CD1 4.31Å; M244-I304 HydrophobicContact CE-CG2 4.02Å; M244-I304 HydrophobicContact SD-CG2 4.04Å; L269-I304 HydrophobicContact CD2-CG2 4.47Å; F275-I304 HydrophobicContact CE2-CD1 3.8Å; F275-I304 HydrophobicContact CZ-CD1 3.88Å; L284-I304 HydrophobicContact CD1-CD1 3.94Å; L284-I304 HydrophobicContact CD1-CG1 4.18Å; F288-I304 HydrophobicContact CE2-CG1 4.06Å; S300-I304 WeakPolarHBondContact O-CG1 3.3Å; S300-I304 PolarHBondContact O-N 3.13Å; V301-I304 PolarHBondContact O-N 3.49Å; I304-W306 VanDerWaalsContact C-N 3.35Å; I304-W306 PolarHBondContact O-N 3.35Å; I304-K307 WeakPolarHBondContact O-CB 3.23Å; I304-K307 PolarHBondContact O-N 2.88Å; I304-K307 VanDerWaalsContact O-N 3.15Å; I304-F308 HydrophobicContact CG2-CD2 3.96Å; I304-F308 HydrophobicContact CG2-CE2 3.82Å; I304-F308 WeakPolarHBondContact O-CD2 3.28Å; I304-F308 PolarHBondContact O-N 3.36Å; I304-F308 VanDerWaalsContact O-N 3.12Å
305	Q	98.5	Very high	96.9	Very high	41 Å²	41	61.3 Å²	61.3	19%	0.192	31%	0.305	C	S	.	.	H	α-helix	trans	-55.9	-50.4	175.4	176	170.1	-30.1	0	0	111.3	L269 V301 N302 K307 F308 E309 C321 H323	L269-Q305 HydrophobicContact CD1-CB 3.66Å; L269-Q305 HydrophobicContact CD1-CG 4.3Å; V301-Q305 WeakPolarHBondContact O-CB 3.22Å; V301-Q305 PolarHBondContact O-N 2.91Å; N302-Q305 PolarHBondContact O-N 3.11Å; Q305-K307 VanDerWaalsContact C-N 3.29Å; Q305-K307 PolarHBondContact O-N 3.01Å; Q305-F308 PolarHBondContact O-N 2.99Å; Q305-E309 HydrophobicContact CG-CG 4.33Å; Q305-E309 VanDerWaalsContact CG-OE1 3.24Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.43Å; Q305-E309 PolarHBondContact NE2-OE1 2.73Å; Q305-E309 WeakPolarHBondContact O-CG 3.3Å; Q305-E309 PolarHBondContact O-N 3.06Å; Q305-C321 HydrophobicContact CG-CB 4.21Å; Q305-C321 PolarHBondContact OE1-SG 2.76Å; Q305-C321 VanDerWaalsContact OE1-SG 3.4Å; Q305-H323 PolarHBondContact OE1-NE2 2.93Å
306	W	97.8	Very high	96.7	Very high	112 Å²	112	65.6 Å²	65.6	42%	0.424	33%	0.325	S	S	.	.	H	α-helix	trans	-55.5	-43.2	175.9	170.6	77.2	0	0	0	111.8	N302 Y303 I304 F308 E309 Q310	N302-W306 VanDerWaalsContact O-CB 3.31Å; N302-W306 WeakPolarHBondContact O-CB 3.49Å; N302-W306 PolarHBondContact O-N 2.62Å; Y303-W306 AromaticContact CD2-CE3 3.97Å; Y303-W306 HydrophobicContact CD2-CE3 3.97Å; Y303-W306 HydrophobicContact CD2-CZ3 4.25Å; Y303-W306 AromaticContact CE2-CE3 3.83Å; Y303-W306 HydrophobicContact CE2-CE3 3.83Å; Y303-W306 AromaticContact CE2-CZ3 3.63Å; Y303-W306 HydrophobicContact CE2-CZ3 3.63Å; Y303-W306 AromaticContact CZ-CZ3 3.98Å; Y303-W306 PolarHBondContact O-N 2.84Å; I304-W306 VanDerWaalsContact C-N 3.35Å; I304-W306 PolarHBondContact O-N 3.35Å; W306-F308 VanDerWaalsContact C-N 3.31Å; W306-F308 PolarHBondContact O-N 3.16Å; W306-E309 PolarHBondContact O-N 2.83Å; W306-Q310 HydrophobicContact CD2-CG 4.09Å; W306-Q310 HydrophobicContact CG-CG 4.31Å; W306-Q310 HydrophobicContact CZ2-CG 3.91Å; W306-Q310 VanDerWaalsContact O-CG 3.24Å; W306-Q310 WeakPolarHBondContact O-CG 3.37Å; W306-Q310 PolarHBondContact O-N 3.37Å
307	K	98.5	Very high	96.6	Very high	43 Å²	43	64.7 Å²	64.7	19%	0.187	32%	0.318	C	S	.	.	H	α-helix	trans	-57.7	-40.7	175.3	-75.1	-70.1	-167.4	176.1	0	113	L248 F288 E290 Y303 I304 Q305 L311	L248-K307 HydrophobicContact CD2-CB 4.01Å; F288-K307 HydrophobicContact CE1-CG 4.28Å; F288-K307 HydrophobicContact CZ-CG 4.44Å; E290-K307 WeakPolarHBondContact OE1-CE 3.48Å; E290-K307 IonicContact OE1-NZ 3.62Å; E290-K307 PolarHBondContact OE1-NZ 3.21Å; Y303-K307 HydrophobicContact CD1-CG 4.26Å; Y303-K307 HydrophobicContact CE1-CD 4.39Å; Y303-K307 HydrophobicContact CE1-CG 3.94Å; Y303-K307 VanDerWaalsContact CZ-CE 3.41Å; Y303-K307 WeakPolarHBondContact O-CG 3.39Å; Y303-K307 PolarHBondContact O-N 3.11Å; Y303-K307 WeakPolarHBondContact OH-CE 3.35Å; Y303-K307 PolarHBondContact OH-NZ 2.98Å; I304-K307 WeakPolarHBondContact O-CB 3.23Å; I304-K307 PolarHBondContact O-N 2.88Å; I304-K307 VanDerWaalsContact O-N 3.15Å; Q305-K307 VanDerWaalsContact C-N 3.29Å; Q305-K307 PolarHBondContact O-N 3.01Å; K307-L311 WeakPolarHBondContact O-CG 3.44Å
308	F	98.6	Very high	96.3	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68.7	-45.9	175.7	-82.9	-83.4	0	0	0	111.8	F224 S226 M244 L248 F251 L267 L269 I304 Q305 W306 Q310 L311	F224-F308 HydrophobicContact CE1-CE1 4.22Å; S226-F308 WeakPolarHBondContact OG-CZ 3.24Å; M244-F308 HydrophobicContact SD-CE2 3.72Å; M244-F308 HydrophobicContact SD-CZ 4Å; L248-F308 HydrophobicContact CD2-CD1 3.84Å; L248-F308 HydrophobicContact CD2-CD2 3.75Å; L248-F308 HydrophobicContact CD2-CE1 3.82Å; L248-F308 HydrophobicContact CD2-CE2 3.72Å; L248-F308 HydrophobicContact CD2-CG 3.79Å; L248-F308 HydrophobicContact CD2-CZ 3.73Å; L248-F308 HydrophobicContact CG-CE1 4.31Å; L248-F308 HydrophobicContact CG-CE2 4.22Å; L248-F308 HydrophobicContact CG-CZ 3.97Å; F251-F308 HydrophobicContact CB-CD1 3.72Å; F251-F308 HydrophobicContact CB-CE1 3.65Å; F251-F308 HydrophobicContact CD1-CB 4.49Å; F251-F308 AromaticContact CD1-CD1 3.67Å; F251-F308 HydrophobicContact CD1-CD1 3.67Å; F251-F308 HydrophobicContact CD1-CE1 4.48Å; F251-F308 HydrophobicContact CD2-CD1 4.05Å; F251-F308 HydrophobicContact CD2-CE1 4.48Å; F251-F308 HydrophobicContact CE1-CB 4.39Å; F251-F308 HydrophobicContact CE1-CD1 4.27Å; F251-F308 VanDerWaalsContact CE1-O 3.27Å; F251-F308 WeakPolarHBondContact CE1-O 3.37Å; F251-F308 AromaticContact CG-CD1 3.53Å; F251-F308 HydrophobicContact CG-CD1 3.53Å; F251-F308 AromaticContact CG-CE1 3.97Å; F251-F308 HydrophobicContact CG-CE1 3.97Å; L267-F308 HydrophobicContact CD1-CD1 4.22Å; L267-F308 HydrophobicContact CD1-CG 4.45Å; L267-F308 HydrophobicContact CD2-CB 3.49Å; L267-F308 VanDerWaalsContact CD2-CB 3.49Å; L267-F308 HydrophobicContact CD2-CD1 4.31Å; L267-F308 HydrophobicContact CD2-CD2 4.45Å; L267-F308 HydrophobicContact CD2-CG 3.85Å; L269-F308 HydrophobicContact CD2-CD2 3.9Å; L269-F308 HydrophobicContact CD2-CE2 4.01Å; I304-F308 HydrophobicContact CG2-CD2 3.96Å; I304-F308 HydrophobicContact CG2-CE2 3.82Å; I304-F308 WeakPolarHBondContact O-CD2 3.28Å; I304-F308 PolarHBondContact O-N 3.36Å; I304-F308 VanDerWaalsContact O-N 3.12Å; Q305-F308 PolarHBondContact O-N 2.99Å; W306-F308 VanDerWaalsContact C-N 3.31Å; W306-F308 PolarHBondContact O-N 3.16Å; F308-Q310 VanDerWaalsContact C-N 3.3Å; F308-Q310 PolarHBondContact O-N 3.35Å; F308-L311 WeakPolarHBondContact O-CB 3.45Å; F308-L311 PolarHBondContact O-N 3.44Å; F308-L311 VanDerWaalsContact O-N 3.08Å
309	E	97.1	Very high	96.2	Very high	71 Å²	71	64.4 Å²	64.4	33%	0.332	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-37.5	-179	-71.1	170.1	175.1	0	0	112.3	Q305 W306 L311 N312	Q305-E309 HydrophobicContact CG-CG 4.33Å; Q305-E309 VanDerWaalsContact CG-OE1 3.24Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.43Å; Q305-E309 PolarHBondContact NE2-OE1 2.73Å; Q305-E309 WeakPolarHBondContact O-CG 3.3Å; Q305-E309 PolarHBondContact O-N 3.06Å; W306-E309 PolarHBondContact O-N 2.83Å; E309-L311 PolarHBondContact O-N 3.16Å; E309-N312 WeakPolarHBondContact O-CB 3.37Å; E309-N312 PolarHBondContact O-N 2.88Å; E309-N312 VanDerWaalsContact O-N 3.13Å
310	Q	97	Very high	96	Very high	124 Å²	124	63.3 Å²	63.3	58%	0.579	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17	176.5	-69.7	-60.4	-43.9	0	0	114.1	W306 F308 N312	W306-Q310 HydrophobicContact CD2-CG 4.09Å; W306-Q310 HydrophobicContact CG-CG 4.31Å; W306-Q310 HydrophobicContact CZ2-CG 3.91Å; W306-Q310 VanDerWaalsContact O-CG 3.24Å; W306-Q310 WeakPolarHBondContact O-CG 3.37Å; W306-Q310 PolarHBondContact O-N 3.37Å; F308-Q310 VanDerWaalsContact C-N 3.3Å; F308-Q310 PolarHBondContact O-N 3.35Å; Q310-N312 VanDerWaalsContact C-N 3.3Å
311	L	97.9	Very high	96	Very high	41 Å²	41	64.5 Å²	64.5	22%	0.215	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-14.7	177	-63.1	170.8	0	0	0	112.5	L248 F251 D252 N256 K307 F308 E309 R313	L248-L311 HydrophobicContact CB-CD1 4.08Å; L248-L311 HydrophobicContact CD2-CD1 3.69Å; L248-L311 VanDerWaalsContact O-CD1 3.31Å; L248-L311 WeakPolarHBondContact O-CD1 3.48Å; F251-L311 HydrophobicContact CD1-CB 4.07Å; F251-L311 HydrophobicContact CD1-CD1 3.97Å; F251-L311 HydrophobicContact CE1-CB 4.36Å; D252-L311 HydrophobicContact CB-CB 4.32Å; D252-L311 HydrophobicContact CB-CD1 4.15Å; D252-L311 HydrophobicContact CB-CD2 4.13Å; D252-L311 HydrophobicContact CB-CG 4.43Å; N256-L311 PolarHBondContact ND2-O 2.91Å; K307-L311 WeakPolarHBondContact O-CG 3.44Å; F308-L311 WeakPolarHBondContact O-CB 3.45Å; F308-L311 PolarHBondContact O-N 3.44Å; F308-L311 VanDerWaalsContact O-N 3.08Å; E309-L311 PolarHBondContact O-N 3.16Å; L311-R313 PolarHBondContact O-N 3.05Å
312	N	96.8	Very high	96	Very high	38 Å²	38	66.7 Å²	66.7	20%	0.203	32%	0.323	C	S	.	.			trans	-74.6	113.4	176.8	-178.6	22	0	0	0	111.2	E309 Q310 N314 R317 I319	E309-N312 WeakPolarHBondContact O-CB 3.37Å; E309-N312 PolarHBondContact O-N 2.88Å; E309-N312 VanDerWaalsContact O-N 3.13Å; Q310-N312 VanDerWaalsContact C-N 3.3Å; N312-N314 PolarHBondContact ND2-O 3.43Å; N312-N314 PolarHBondContact OD1-N 3.19Å; N312-N314 VanDerWaalsContact OD1-N 3.08Å; N312-N314 PolarHBondContact OD1-O 2.88Å; N312-R317 PolarHBondContact ND2-O 2.96Å; N312-I319 HydrophobicContact CB-CD1 3.55Å
313	R	95.7	Very high	96	Very high	179 Å²	179	64.5 Å²	64.5	68%	0.675	31%	0.309	S	S	*	.			trans	-94.8	-6.8	179.5	-56	172	-162.3	169	5.7	112.6	D252 N256 L311	D252-R313 IonicContact OD1-CZ 2.65Å; D252-R313 IonicContact OD1-NE 3.32Å; D252-R313 IonicContact OD1-NH2 3.83Å; D252-R313 PolarHBondContact OD1-NH2 3.14Å; D252-R313 IonicContact OD2-CZ 3.39Å; D252-R313 IonicContact OD2-NH2 2.65Å; D252-R313 PolarHBondContact OD2-NH2 3.32Å; N256-R313 WeakPolarHBondContact OD1-CB 3.47Å; N256-R313 PolarHBondContact OD1-N 3.09Å; L311-R313 PolarHBondContact O-N 3.05Å
314	N	93.1	Very high	95.9	Very high	45 Å²	45	62.8 Å²	62.8	24%	0.241	30%	0.303	C	S	.	.			trans	-93.5	105.4	178.6	-176.9	-18	0	0	0	109.7	N312 Q316 R317	N312-N314 PolarHBondContact ND2-O 3.43Å; N312-N314 PolarHBondContact OD1-N 3.19Å; N312-N314 VanDerWaalsContact OD1-N 3.08Å; N312-N314 PolarHBondContact OD1-O 2.88Å; N314-Q316 PolarHBondContact O-N 3.01Å; N314-Q316 VanDerWaalsContact O-N 3.15Å; N314-Q316 WeakPolarHBondContact OD1-CB 3.2Å; N314-Q316 PolarHBondContact OD1-N 3.37Å; N314-R317 HydrophobicContact CB-CB 3.85Å; N314-R317 WeakPolarHBondContact O-CB 3.44Å; N314-R317 PolarHBondContact O-N 2.94Å; N314-R317 PolarHBondContact OD1-N 3.36Å
315	A	89.8	Confident	95.9	Very high	108 Å²	108	63.2 Å²	63.2	89%	0.893	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.9	-179.6	0	0	0	0	0	114.4
316	Q	90.6	Very high	95.9	Very high	184 Å²	184	61.4 Å²	61.4	86%	0.86	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.4	175.9	-62.3	-179.4	-14.8	0	0	112.7	N314	N314-Q316 PolarHBondContact O-N 3.01Å; N314-Q316 VanDerWaalsContact O-N 3.15Å; N314-Q316 WeakPolarHBondContact OD1-CB 3.2Å; N314-Q316 PolarHBondContact OD1-N 3.37Å
317	R	92.4	Very high	95.8	Very high	25 Å²	25	57 Å²	57	9%	0.094	28%	0.283	C	S	.	.			trans	-86.3	124.2	179	-178.2	-173.8	-55.7	-90	-15.9	110	C255 F260 V261 I263 N312 N314	C255-R317 PolarHBondContact O-NE 3.36Å; C255-R317 VanDerWaalsContact SG-CD 3.55Å; F260-R317 PolarHBondContact O-NH1 2.86Å; F260-R317 PolarHBondContact O-NH2 3.43Å; V261-R317 PolarHBondContact O-NH2 3Å; I263-R317 PolarHBondContact O-NH1 3.01Å; N312-R317 PolarHBondContact ND2-O 2.96Å; N314-R317 HydrophobicContact CB-CB 3.85Å; N314-R317 WeakPolarHBondContact O-CB 3.44Å; N314-R317 PolarHBondContact O-N 2.94Å; N314-R317 PolarHBondContact OD1-N 3.36Å
318	E	92	Very high	95.8	Very high	117 Å²	117	58.1 Å²	58.1	55%	0.547	29%	0.291	S	S	.	.			trans	-94.5	133.7	167	-167.6	173.5	-172.4	0	0	109.8	Y320	E318-Y320 HydrophobicContact CB-CE2 4.13Å; E318-Y320 VanDerWaalsContact CD-CE1 3.49Å; E318-Y320 VanDerWaalsContact CD-CZ 3.4Å; E318-Y320 VanDerWaalsContact CD-OH 3.26Å; E318-Y320 HydrophobicContact CG-CE1 4.05Å; E318-Y320 HydrophobicContact CG-CE2 4.14Å; E318-Y320 PolarHBondContact OE2-OH 3.3Å
319	I	94.7	Very high	95.8	Very high	22 Å²	22	59.8 Å²	59.8	11%	0.113	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.3	172.8	-64.4	165	0	0	0	108.1	F251 F265 L267 N312 C321	F251-I319 HydrophobicContact CE1-CD1 3.96Å; F251-I319 HydrophobicContact CZ-CD1 3.62Å; F251-I319 HydrophobicContact CZ-CG1 4.33Å; F251-I319 HydrophobicContact CZ-CG2 4.43Å; F265-I319 HydrophobicContact CB-CG1 4.45Å; L267-I319 HydrophobicContact CB-CG2 3.65Å; L267-I319 HydrophobicContact CD2-CG2 4.37Å; N312-I319 HydrophobicContact CB-CD1 3.55Å; I319-C321 PolarHBondContact O-N 3.41Å
320	Y	94.7	Very high	95.8	Very high	50 Å²	50	62.3 Å²	62.3	20%	0.196	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	102.9	176	-60.9	-83.5	0	0	0	109.8	F265 I266 L267 E318 M342 K346	F265-Y320 PolarHBondContact O-N 3.15Å; I266-Y320 CarbonylContact C-O 3.59Å; I266-Y320 WeakPolarHBondContact CA-O 3.37Å; L267-Y320 PolarHBondContact N-O 3.45Å; E318-Y320 HydrophobicContact CB-CE2 4.13Å; E318-Y320 VanDerWaalsContact CD-CE1 3.49Å; E318-Y320 VanDerWaalsContact CD-CZ 3.4Å; E318-Y320 VanDerWaalsContact CD-OH 3.26Å; E318-Y320 HydrophobicContact CG-CE1 4.05Å; E318-Y320 HydrophobicContact CG-CE2 4.14Å; E318-Y320 PolarHBondContact OE2-OH 3.3Å; Y320-M342 HydrophobicContact CD1-SD 3.66Å; Y320-M342 HydrophobicContact CD2-CE 3.69Å; Y320-M342 HydrophobicContact CD2-SD 3.39Å; Y320-M342 WeakPolarHBondContact CD2-SD 3.44Å; Y320-M342 HydrophobicContact CE1-SD 3.53Å; Y320-M342 VanDerWaalsContact CE1-SD 3.53Å; Y320-M342 HydrophobicContact CE2-CE 3.95Å; Y320-M342 HydrophobicContact CE2-SD 3.24Å; Y320-M342 WeakPolarHBondContact CE2-SD 3.4Å; Y320-M342 HydrophobicContact CG-CE 4.08Å; Y320-M342 HydrophobicContact CG-SD 3.58Å; Y320-M342 VanDerWaalsContact CG-SD 3.58Å; Y320-K346 PolarHBondContact OH-NZ 2.68Å
321	C	97.4	Very high	95.8	Very high	25 Å²	25	57.4 Å²	57.4	17%	0.169	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.1	-178.3	-171.9	0	0	0	0	112	L267 Q305 I319	L267-C321 HydrophobicContact CB-CB 4.48Å; L267-C321 CarbonylContact O-C 3.57Å; L267-C321 VanDerWaalsContact O-CA 3.31Å; L267-C321 WeakPolarHBondContact O-CA 3.5Å; Q305-C321 HydrophobicContact CG-CB 4.21Å; Q305-C321 PolarHBondContact OE1-SG 2.76Å; Q305-C321 VanDerWaalsContact OE1-SG 3.4Å; I319-C321 PolarHBondContact O-N 3.41Å
322	H	97.7	Very high	95.7	Very high	46 Å²	46	55.5 Å²	55.5	21%	0.213	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137.5	172.5	-64.5	-85.6	0	0	0	111.4	L267 F268 L269 T324 V335	L267-H322 PolarHBondContact O-N 3.32Å; F268-H322 WeakPolarHBondContact CA-O 3.43Å; F268-H322 HydrophobicContact CD1-CB 3.96Å; F268-H322 HydrophobicContact CE1-CB 4.08Å; L269-H322 PolarHBondContact N-O 3.08Å; H322-T324 HydrophobicContact CB-CG2 4.39Å; H322-V335 HydrophobicContact CB-CG1 3.56Å; H322-V335 HydrophobicContact CB-CG2 4.13Å
323	H	97.8	Very high	95.7	Very high	48 Å²	48	57.7 Å²	57.7	22%	0.222	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.8	172.3	-51.7	160.4	0	0	0	109.5	L269 K272 V301 Q305	L269-H323 CarbonylContact O-C 3.1Å; L269-H323 WeakPolarHBondContact O-CA 3.39Å; K272-H323 HydrophobicContact CD-CB 4.07Å; V301-H323 WeakPolarHBondContact CG1-CE1 3.48Å; V301-H323 VanDerWaalsContact CG1-NE2 3.32Å; V301-H323 WeakPolarHBondContact CG1-NE2 3.4Å; Q305-H323 PolarHBondContact OE1-NE2 2.93Å
324	T	98.2	Very high	95.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.293	C	S	.	.			trans	-120.3	152.6	-170.1	50.8	0	0	0	0	112.9	F268 L269 N270 K271 K272 H322 N331 V335	F268-T324 HydrophobicContact CB-CG2 4.29Å; F268-T324 HydrophobicContact CD1-CG2 4.14Å; F268-T324 HydrophobicContact CD2-CG2 4.03Å; F268-T324 HydrophobicContact CE2-CG2 4.41Å; F268-T324 HydrophobicContact CG-CG2 3.9Å; L269-T324 PolarHBondContact O-N 2.77Å; N270-T324 CarbonylContact C-O 3.55Å; N270-T324 WeakPolarHBondContact CA-O 3.48Å; N270-T324 WeakPolarHBondContact CA-OG1 3.18Å; N270-T324 WeakPolarHBondContact CB-OG1 3.3Å; N270-T324 PolarHBondContact OD1-O 3.17Å; N270-T324 PolarHBondContact OD1-OG1 3.04Å; K271-T324 PolarHBondContact N-O 2.86Å; K272-T324 WeakPolarHBondContact CG-O 3.43Å; K272-T324 PolarHBondContact N-O 2.67Å; K272-T324 VanDerWaalsContact N-O 3.1Å; H322-T324 HydrophobicContact CB-CG2 4.39Å; T324-N331 VanDerWaalsContact CA-OD1 3.26Å; T324-N331 WeakPolarHBondContact CA-OD1 3.49Å; T324-V335 HydrophobicContact CG2-CB 4.28Å; T324-V335 HydrophobicContact CG2-CG1 3.9Å; T324-V335 HydrophobicContact CG2-CG2 4.1Å
325	C	98.1	Very high	95.7	Very high	8 Å²	8	54.4 Å²	54.4	5%	0.054	28%	0.283	C	S	.	.			trans	-123.3	97.9	160.3	175.2	0	0	0	0	106.3	K272 D273 T327 D328 N331 V332	K272-C325 HydrophobicContact CG-CB 4.31Å; D273-C325 VanDerWaalsContact CG-SG 3.56Å; C325-T327 PolarHBondContact O-N 2.88Å; C325-T327 PolarHBondContact SG-OG1 3.2Å; C325-D328 HydrophobicContact CB-CB 3.94Å; C325-D328 PolarHBondContact O-N 2.96Å; C325-N331 PolarHBondContact N-OD1 2.81Å; C325-V332 WeakPolarHBondContact O-CG2 3.22Å
326	A	97.8	Very high	95.9	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.033	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.6	-173.9	0	0	0	0	0	114.2	T48 I49 Q52 N270	T48-A326 HydrophobicContact CG2-CB 3.62Å; T48-A326 WeakPolarHBondContact CG2-O 3.43Å; I49-A326 HydrophobicContact CD1-CB 3.68Å; I49-A326 HydrophobicContact CG1-CB 4.11Å; Q52-A326 WeakPolarHBondContact CG-O 3.44Å; Q52-A326 PolarHBondContact NE2-O 3.3Å; N270-A326 PolarHBondContact OD1-N 3.23Å
327	T	97.1	Very high	96	Very high	20 Å²	20	43.5 Å²	43.5	12%	0.123	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	5.1	178.6	51.7	0	0	0	0	113.4	T48 Q173 L176 R177 C325	T48-T327 HydrophobicContact CG2-CG2 4.04Å; Q173-T327 PolarHBondContact NE2-O 3.21Å; Q173-T327 PolarHBondContact OE1-O 3.13Å; L176-T327 HydrophobicContact CB-CG2 4.35Å; R177-T327 HydrophobicContact CG-CG2 4.38Å; R177-T327 VanDerWaalsContact CZ-CB 3.44Å; R177-T327 PolarHBondContact NH1-OG1 2.7Å; R177-T327 PolarHBondContact NH2-OG1 3.06Å; C325-T327 PolarHBondContact O-N 2.88Å; C325-T327 PolarHBondContact SG-OG1 3.2Å
328	D	97.9	Very high	95.9	Very high	65 Å²	65	44.5 Å²	44.5	35%	0.348	23%	0.229	S	C	.	.			trans	-109	101.4	171.4	174.8	-8.8	0	0	0	108	C325 N330 N331 V332	C325-D328 HydrophobicContact CB-CB 3.94Å; C325-D328 PolarHBondContact O-N 2.96Å; D328-N330 VanDerWaalsContact C-N 3.25Å; D328-N330 PolarHBondContact O-N 2.98Å; D328-N330 WeakPolarHBondContact OD1-CB 3.28Å; D328-N330 PolarHBondContact OD1-N 3.42Å; D328-N330 VanDerWaalsContact OD1-N 3.09Å; D328-N331 HydrophobicContact CB-CB 3.95Å; D328-N331 PolarHBondContact O-N 2.96Å; D328-N331 PolarHBondContact OD1-N 3.07Å; D328-N331 VanDerWaalsContact OD1-N 3.1Å; D328-N331 WeakPolarHBondContact OD2-CB 3.17Å; D328-V332 WeakPolarHBondContact O-CG2 3.3Å; D328-V332 PolarHBondContact O-N 2.98Å
329	T	97.5	Very high	95.9	Very high	35 Å²	35	39 Å²	39	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-35.8	-175.6	-53.6	0	0	0	0	112.2	Q52 I55 L56 V332 Q333	Q52-T329 PolarHBondContact NE2-OG1 2.86Å; Q52-T329 PolarHBondContact OE1-OG1 3.26Å; I55-T329 HydrophobicContact CG2-CG2 4.24Å; L56-T329 HydrophobicContact CD2-CG2 3.78Å; L56-T329 HydrophobicContact CG-CG2 4.42Å; T329-V332 PolarHBondContact O-N 3.34Å; T329-Q333 VanDerWaalsContact O-CB 3.28Å; T329-Q333 WeakPolarHBondContact O-CB 3.23Å; T329-Q333 PolarHBondContact O-N 2.92Å
330	N	97.4	Very high	95.8	Very high	124 Å²	124	38 Å²	38	66%	0.663	20%	0.199	S	C	*	.	H	α-helix	trans	-68.8	-44.2	178.3	-66.6	-34.2	0	0	0	111.2	D328 V332 Q333 F334	D328-N330 VanDerWaalsContact C-N 3.25Å; D328-N330 PolarHBondContact O-N 2.98Å; D328-N330 WeakPolarHBondContact OD1-CB 3.28Å; D328-N330 PolarHBondContact OD1-N 3.42Å; D328-N330 VanDerWaalsContact OD1-N 3.09Å; N330-V332 VanDerWaalsContact C-N 3.33Å; N330-V332 PolarHBondContact O-N 3.29Å; N330-Q333 PolarHBondContact O-N 2.86Å; N330-F334 PolarHBondContact O-N 3.46Å; N330-F334 VanDerWaalsContact O-N 3.1Å
331	N	97.3	Very high	95.6	Very high	22 Å²	22	39 Å²	39	12%	0.118	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-41.2	176.7	175.9	-118.5	0	0	0	111.7	K272 T324 C325 D328 V335	K272-N331 PolarHBondContact NZ-ND2 3.49Å; T324-N331 VanDerWaalsContact CA-OD1 3.26Å; T324-N331 WeakPolarHBondContact CA-OD1 3.49Å; C325-N331 PolarHBondContact N-OD1 2.81Å; D328-N331 HydrophobicContact CB-CB 3.95Å; D328-N331 PolarHBondContact O-N 2.96Å; D328-N331 PolarHBondContact OD1-N 3.07Å; D328-N331 VanDerWaalsContact OD1-N 3.1Å; D328-N331 WeakPolarHBondContact OD2-CB 3.17Å; N331-V335 WeakPolarHBondContact O-CG2 3.35Å; N331-V335 PolarHBondContact O-N 3.06Å
332	V	96.6	Very high	95.2	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-67.6	-44.8	178.6	176.2	0	0	0	0	110.8	I49 Q52 L56 C325 D328 T329 N330 F334 V335 L336	I49-V332 HydrophobicContact CD1-CG1 4.23Å; I49-V332 HydrophobicContact CD1-CG2 4.11Å; Q52-V332 HydrophobicContact CB-CB 4.38Å; Q52-V332 HydrophobicContact CB-CG1 3.6Å; Q52-V332 HydrophobicContact CG-CB 4.25Å; Q52-V332 HydrophobicContact CG-CG1 3.95Å; Q52-V332 HydrophobicContact CG-CG2 4.13Å; L56-V332 HydrophobicContact CD1-CG1 4.15Å; C325-V332 WeakPolarHBondContact O-CG2 3.22Å; D328-V332 WeakPolarHBondContact O-CG2 3.3Å; D328-V332 PolarHBondContact O-N 2.98Å; T329-V332 PolarHBondContact O-N 3.34Å; N330-V332 VanDerWaalsContact C-N 3.33Å; N330-V332 PolarHBondContact O-N 3.29Å; V332-F334 PolarHBondContact O-N 2.93Å; V332-V335 PolarHBondContact O-N 3.12Å; V332-L336 HydrophobicContact CG1-CD1 3.45Å; V332-L336 VanDerWaalsContact CG1-CD1 3.45Å; V332-L336 HydrophobicContact CG1-CG 3.77Å; V332-L336 WeakPolarHBondContact O-CB 3.29Å; V332-L336 VanDerWaalsContact O-CG 3.25Å; V332-L336 WeakPolarHBondContact O-CG 3.34Å; V332-L336 PolarHBondContact O-N 2.8Å
333	Q	96.2	Very high	94.9	Very high	83 Å²	83	37.3 Å²	37.3	39%	0.388	20%	0.197	S	C	.	.	H	α-helix	trans	-54.8	-52.1	176.3	-175.1	175.5	3.3	0	0	111.7	L56 T329 N330 V335 L336 D337	L56-Q333 HydrophobicContact CD1-CB 3.92Å; L56-Q333 HydrophobicContact CD1-CG 4.47Å; L56-Q333 HydrophobicContact CD2-CB 3.82Å; L56-Q333 HydrophobicContact CD2-CG 3.99Å; T329-Q333 VanDerWaalsContact O-CB 3.28Å; T329-Q333 WeakPolarHBondContact O-CB 3.23Å; T329-Q333 PolarHBondContact O-N 2.92Å; N330-Q333 PolarHBondContact O-N 2.86Å; Q333-V335 VanDerWaalsContact C-N 3.32Å; Q333-V335 PolarHBondContact O-N 3.26Å; Q333-L336 PolarHBondContact O-N 3.12Å; Q333-D337 WeakPolarHBondContact O-CB 3.36Å; Q333-D337 VanDerWaalsContact O-CG 3.24Å; Q333-D337 PolarHBondContact O-N 3.47Å
334	F	95.2	Very high	94.5	Very high	152 Å²	152	35.6 Å²	35.6	67%	0.667	19%	0.19	S	C	*	.	H	α-helix	trans	-56.3	-44.7	178.8	175.9	-96.3	0	0	0	112.9	N330 V332 A338	N330-F334 PolarHBondContact O-N 3.46Å; N330-F334 VanDerWaalsContact O-N 3.1Å; V332-F334 PolarHBondContact O-N 2.93Å; F334-A338 PolarHBondContact O-N 2.91Å
335	V	94	Very high	94	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.024	21%	0.208	C	C	.	.	H	α-helix	trans	-71.7	-40.9	-178.8	170.9	0	0	0	0	111.4	F268 H322 T324 N331 V332 Q333 A338 C339	F268-V335 HydrophobicContact CD1-CG1 4.17Å; F268-V335 HydrophobicContact CE1-CG1 3.34Å; F268-V335 HydrophobicContact CE2-CG1 4.32Å; F268-V335 HydrophobicContact CZ-CG1 3.45Å; F268-V335 VanDerWaalsContact CZ-CG1 3.45Å; H322-V335 HydrophobicContact CB-CG1 3.56Å; H322-V335 HydrophobicContact CB-CG2 4.13Å; T324-V335 HydrophobicContact CG2-CB 4.28Å; T324-V335 HydrophobicContact CG2-CG1 3.9Å; T324-V335 HydrophobicContact CG2-CG2 4.1Å; N331-V335 WeakPolarHBondContact O-CG2 3.35Å; N331-V335 PolarHBondContact O-N 3.06Å; V332-V335 PolarHBondContact O-N 3.12Å; Q333-V335 VanDerWaalsContact C-N 3.32Å; Q333-V335 PolarHBondContact O-N 3.26Å; V335-A338 PolarHBondContact O-N 3.15Å; V335-C339 WeakPolarHBondContact O-CB 3.31Å; V335-C339 PolarHBondContact O-N 3.37Å; V335-C339 PolarHBondContact O-SG 3.05Å
336	L	92.7	Very high	93.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-43.5	179.3	-70.1	-175.4	0	0	0	111.7	M53 L56 F268 V332 Q333 A338 C339 L340	M53-L336 HydrophobicContact CE-CD1 3.58Å; M53-L336 HydrophobicContact CE-CD2 3.35Å; M53-L336 HydrophobicContact CE-CG 3.98Å; M53-L336 HydrophobicContact CG-CD1 4.08Å; M53-L336 HydrophobicContact SD-CD1 3.63Å; L56-L336 HydrophobicContact CD1-CD1 4Å; F268-L336 HydrophobicContact CE2-CD2 4.04Å; F268-L336 HydrophobicContact CZ-CD2 3.93Å; V332-L336 HydrophobicContact CG1-CD1 3.45Å; V332-L336 VanDerWaalsContact CG1-CD1 3.45Å; V332-L336 HydrophobicContact CG1-CG 3.77Å; V332-L336 WeakPolarHBondContact O-CB 3.29Å; V332-L336 VanDerWaalsContact O-CG 3.25Å; V332-L336 WeakPolarHBondContact O-CG 3.34Å; V332-L336 PolarHBondContact O-N 2.8Å; Q333-L336 PolarHBondContact O-N 3.12Å; L336-A338 VanDerWaalsContact C-N 3.3Å; L336-A338 PolarHBondContact O-N 3.15Å; L336-C339 PolarHBondContact O-N 3.07Å; L336-C339 VanDerWaalsContact O-N 3.11Å; L336-L340 HydrophobicContact CB-CD1 4.49Å; L336-L340 WeakPolarHBondContact O-CB 3.36Å; L336-L340 WeakPolarHBondContact O-CG 3.23Å; L336-L340 PolarHBondContact O-N 2.95Å
337	D	93.1	Very high	92.6	Very high	61 Å²	61	41 Å²	41	33%	0.326	22%	0.221	S	C	.	.	H	α-helix	trans	-56.7	-45.9	176.7	-71.7	-17.6	0	0	0	110.9	Q333 C339 D341	Q333-D337 WeakPolarHBondContact O-CB 3.36Å; Q333-D337 VanDerWaalsContact O-CG 3.24Å; Q333-D337 PolarHBondContact O-N 3.47Å; D337-C339 PolarHBondContact O-N 3.28Å; D337-D341 VanDerWaalsContact O-CB 3.28Å; D337-D341 WeakPolarHBondContact O-CB 3.44Å; D337-D341 PolarHBondContact O-N 3.16Å
338	A	91.8	Very high	91.8	Very high	46 Å²	46	42.2 Å²	42.2	38%	0.38	23%	0.226	S	C	.	.	H	α-helix	trans	-61.5	-42.9	175.9	0	0	0	0	0	112.8	F334 V335 L336 M342	F334-A338 PolarHBondContact O-N 2.91Å; V335-A338 PolarHBondContact O-N 3.15Å; L336-A338 VanDerWaalsContact C-N 3.3Å; L336-A338 PolarHBondContact O-N 3.15Å; A338-M342 WeakPolarHBondContact O-CB 3.46Å; A338-M342 PolarHBondContact O-N 3.12Å
339	C	92	Very high	91	Very high	2 Å²	2	46 Å²	46	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-67.5	-47.2	179.1	-70.6	0	0	0	0	112.3	I266 V335 L336 D337 M342 I343	I266-C339 HydrophobicContact CD1-CB 3.81Å; V335-C339 WeakPolarHBondContact O-CB 3.31Å; V335-C339 PolarHBondContact O-N 3.37Å; V335-C339 PolarHBondContact O-SG 3.05Å; L336-C339 PolarHBondContact O-N 3.07Å; L336-C339 VanDerWaalsContact O-N 3.11Å; D337-C339 PolarHBondContact O-N 3.28Å; C339-M342 PolarHBondContact O-N 2.88Å; C339-I343 WeakPolarHBondContact O-CD1 3.48Å; C339-I343 WeakPolarHBondContact O-CG1 3.24Å; C339-I343 PolarHBondContact O-N 3.07Å
340	L	92	Very high	89.9	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-42	-177.1	-64.5	175.4	0	0	0	110.3	L36 M53 F190 L192 F197 L336 M342 I343 I344	L36-L340 HydrophobicContact CD1-CD2 3.7Å; M53-L340 HydrophobicContact CE-CD2 4.48Å; F190-L340 HydrophobicContact CZ-CD1 4.4Å; L192-L340 HydrophobicContact CD2-CB 4.14Å; L192-L340 HydrophobicContact CD2-CD1 3.7Å; L192-L340 HydrophobicContact CD2-CG 4.49Å; F197-L340 HydrophobicContact CD1-CD2 3.79Å; F197-L340 HydrophobicContact CE1-CD2 3.4Å; F197-L340 VanDerWaalsContact CE1-CD2 3.4Å; F197-L340 HydrophobicContact CZ-CD2 4.03Å; L336-L340 HydrophobicContact CB-CD1 4.49Å; L336-L340 WeakPolarHBondContact O-CB 3.36Å; L336-L340 WeakPolarHBondContact O-CG 3.23Å; L336-L340 PolarHBondContact O-N 2.95Å; L340-M342 VanDerWaalsContact C-N 3.34Å; L340-M342 PolarHBondContact O-N 2.64Å; L340-I343 PolarHBondContact O-N 3.49Å; L340-I344 WeakPolarHBondContact O-CB 3.45Å; L340-I344 WeakPolarHBondContact O-CG1 3.32Å; L340-I344 PolarHBondContact O-N 2.74Å
341	D	90.1	Very high	88.6	Confident	71 Å²	71	45.5 Å²	45.5	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-41.4	177	-79.6	-2.2	0	0	0	112.5	K193 D337 I344 A345	K193-D341 VanDerWaalsContact NZ-CG 3.29Å; K193-D341 IonicContact NZ-OD1 2.73Å; K193-D341 PolarHBondContact NZ-OD1 2.79Å; K193-D341 IonicContact NZ-OD2 2.97Å; K193-D341 PolarHBondContact NZ-OD2 3.42Å; D337-D341 VanDerWaalsContact O-CB 3.28Å; D337-D341 WeakPolarHBondContact O-CB 3.44Å; D337-D341 PolarHBondContact O-N 3.16Å; D341-I344 PolarHBondContact O-N 3.34Å; D341-A345 WeakPolarHBondContact O-CB 3.42Å; D341-A345 PolarHBondContact O-N 3.47Å
342	M	89.3	Confident	87.3	Confident	34 Å²	34	47.5 Å²	47.5	17%	0.167	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-46.5	173	177.1	-164.5	66.3	0	0	111.7	I266 Y320 A338 C339 L340 A345 K346	I266-M342 HydrophobicContact CD1-CE 3.94Å; I266-M342 HydrophobicContact CG1-CE 3.93Å; Y320-M342 HydrophobicContact CD1-SD 3.66Å; Y320-M342 HydrophobicContact CD2-CE 3.69Å; Y320-M342 HydrophobicContact CD2-SD 3.39Å; Y320-M342 WeakPolarHBondContact CD2-SD 3.44Å; Y320-M342 HydrophobicContact CE1-SD 3.53Å; Y320-M342 VanDerWaalsContact CE1-SD 3.53Å; Y320-M342 HydrophobicContact CE2-CE 3.95Å; Y320-M342 HydrophobicContact CE2-SD 3.24Å; Y320-M342 WeakPolarHBondContact CE2-SD 3.4Å; Y320-M342 HydrophobicContact CG-CE 4.08Å; Y320-M342 HydrophobicContact CG-SD 3.58Å; Y320-M342 VanDerWaalsContact CG-SD 3.58Å; A338-M342 WeakPolarHBondContact O-CB 3.46Å; A338-M342 PolarHBondContact O-N 3.12Å; C339-M342 PolarHBondContact O-N 2.88Å; L340-M342 VanDerWaalsContact C-N 3.34Å; L340-M342 PolarHBondContact O-N 2.64Å; M342-A345 PolarHBondContact O-N 3.45Å; M342-K346 WeakPolarHBondContact O-CG 3.46Å; M342-K346 PolarHBondContact O-N 3.33Å
343	I	90.5	Very high	85.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-42.3	-179.3	-67.9	162.4	0	0	0	110.4	I34 L36 A221 I266 C339 L340 K346 N347	I34-I343 HydrophobicContact CD1-CG2 4.19Å; I34-I343 HydrophobicContact CG2-CG2 3.67Å; L36-I343 HydrophobicContact CD2-CD1 3.74Å; L36-I343 HydrophobicContact CD2-CG2 4.48Å; A221-I343 HydrophobicContact CB-CD1 3.77Å; A221-I343 HydrophobicContact CB-CG1 4.08Å; I266-I343 HydrophobicContact CD1-CD1 3.74Å; I266-I343 HydrophobicContact CD1-CG1 4.4Å; C339-I343 WeakPolarHBondContact O-CD1 3.48Å; C339-I343 WeakPolarHBondContact O-CG1 3.24Å; C339-I343 PolarHBondContact O-N 3.07Å; L340-I343 PolarHBondContact O-N 3.49Å; I343-K346 PolarHBondContact O-N 2.69Å; I343-N347 WeakPolarHBondContact CG2-ND2 3.47Å; I343-N347 WeakPolarHBondContact O-CB 3.44Å; I343-N347 PolarHBondContact O-N 3.44Å; I343-N347 PolarHBondContact O-ND2 3.35Å
344	I	89.8	Confident	83.3	Confident	13 Å²	13	55.9 Å²	55.9	7%	0.067	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-49.6	176.9	-69	169.5	0	0	0	109.9	I34 L192 K193 L195 F197 L340 D341 K346 N347 L348	I34-I344 HydrophobicContact CD1-CG1 4.14Å; L192-I344 HydrophobicContact CD2-CD1 4.33Å; K193-I344 HydrophobicContact CB-CD1 4.37Å; K193-I344 HydrophobicContact CD-CD1 4Å; L195-I344 HydrophobicContact CD1-CB 4.32Å; L195-I344 HydrophobicContact CD1-CD1 4.46Å; L195-I344 HydrophobicContact CD1-CG1 3.85Å; L195-I344 HydrophobicContact CD1-CG2 3.86Å; F197-I344 HydrophobicContact CE2-CD1 4.07Å; F197-I344 HydrophobicContact CE2-CG1 4.25Å; F197-I344 HydrophobicContact CZ-CD1 3.84Å; F197-I344 HydrophobicContact CZ-CG1 3.69Å; L340-I344 WeakPolarHBondContact O-CB 3.45Å; L340-I344 WeakPolarHBondContact O-CG1 3.32Å; L340-I344 PolarHBondContact O-N 2.74Å; D341-I344 PolarHBondContact O-N 3.34Å; I344-K346 VanDerWaalsContact C-N 3.28Å; I344-K346 PolarHBondContact O-N 3.38Å; I344-N347 PolarHBondContact O-N 2.88Å; I344-L348 HydrophobicContact CG2-CD1 3.61Å; I344-L348 HydrophobicContact CG2-CG 4.17Å; I344-L348 WeakPolarHBondContact O-CB 3.27Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 2.72Å
345	A	87.7	Confident	82.7	Confident	46 Å²	46	51.1 Å²	51.1	38%	0.38	31%	0.307	S	S	.	.	H	α-helix	trans	-59.1	-38.9	-179.9	0	0	0	0	0	112.5	D341 M342 K349	D341-A345 WeakPolarHBondContact O-CB 3.42Å; D341-A345 PolarHBondContact O-N 3.47Å; M342-A345 PolarHBondContact O-N 3.45Å; A345-K349 VanDerWaalsContact O-CG 3.26Å; A345-K349 WeakPolarHBondContact O-CG 3.33Å; A345-K349 PolarHBondContact O-N 2.94Å
346	K	84.3	Confident	82.1	Confident	61 Å²	61	53.6 Å²	53.6	27%	0.265	32%	0.322	S	S	.	.	H	α-helix	trans	-73.6	-40.5	177.7	-69.3	-172.9	-176.7	-179.1	0	112.8	H264 Y320 M342 I343 I344 K349 S350	H264-K346 WeakPolarHBondContact CE1-CD 3.29Å; H264-K346 WeakPolarHBondContact NE2-CB 3.24Å; H264-K346 WeakPolarHBondContact NE2-CD 3.33Å; Y320-K346 PolarHBondContact OH-NZ 2.68Å; M342-K346 WeakPolarHBondContact O-CG 3.46Å; M342-K346 PolarHBondContact O-N 3.33Å; I343-K346 PolarHBondContact O-N 2.69Å; I344-K346 VanDerWaalsContact C-N 3.28Å; I344-K346 PolarHBondContact O-N 3.38Å; K346-K349 PolarHBondContact O-N 3.05Å; K346-S350 PolarHBondContact O-N 2.96Å; K346-S350 VanDerWaalsContact O-N 3.07Å
347	N	82.6	Confident	81.5	Confident	18 Å²	18	56.5 Å²	56.5	10%	0.096	34%	0.34	C	S	.	.	H	α-helix	trans	-68.2	-36.8	176.3	-78.1	-70.7	0	0	0	112.4	I34 N220 I343 I344 K349 S350 M351	I34-N347 HydrophobicContact CD1-CB 4.45Å; N220-N347 PolarHBondContact ND2-OD1 3.46Å; I343-N347 WeakPolarHBondContact CG2-ND2 3.47Å; I343-N347 WeakPolarHBondContact O-CB 3.44Å; I343-N347 PolarHBondContact O-N 3.44Å; I343-N347 PolarHBondContact O-ND2 3.35Å; I344-N347 PolarHBondContact O-N 2.88Å; N347-K349 VanDerWaalsContact C-N 3.35Å; N347-S350 WeakPolarHBondContact CA-OG 3.35Å; N347-S350 PolarHBondContact O-N 3.01Å; N347-S350 PolarHBondContact O-OG 3.23Å; N347-M351 HydrophobicContact CB-CE 4.38Å; N347-M351 WeakPolarHBondContact O-CE 3.07Å; N347-M351 WeakPolarHBondContact O-CG 3.25Å; N347-M351 PolarHBondContact O-N 3.05Å; N347-M351 VanDerWaalsContact O-N 3.09Å
348	L	80.3	Confident	80.8	Confident	45 Å²	45	56.2 Å²	56.2	24%	0.236	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-38.4	175.1	-71.3	172.2	0	0	0	112.2	I344 M351 G352 L353	I344-L348 HydrophobicContact CG2-CD1 3.61Å; I344-L348 HydrophobicContact CG2-CG 4.17Å; I344-L348 WeakPolarHBondContact O-CB 3.27Å; I344-L348 WeakPolarHBondContact O-CG 3.49Å; I344-L348 PolarHBondContact O-N 2.72Å; L348-M351 HydrophobicContact CD2-CE 3.87Å; L348-M351 HydrophobicContact CG-CE 4.48Å; L348-M351 PolarHBondContact O-N 3.12Å; L348-G352 PolarHBondContact O-N 2.84Å; L348-L353 HydrophobicContact CD2-CB 4.21Å; L348-L353 HydrophobicContact CD2-CD1 4.1Å; L348-L353 PolarHBondContact O-N 3.44Å
349	K	80	Confident	80.2	Confident	145 Å²	145	56.9 Å²	56.9	63%	0.63	34%	0.338	S	S	*	.	H	α-helix	trans	-62.9	-43.2	173.1	-75.5	174.2	-178	-177	0	112.2	A345 K346 N347 M351 G352 C354	A345-K349 VanDerWaalsContact O-CG 3.26Å; A345-K349 WeakPolarHBondContact O-CG 3.33Å; A345-K349 PolarHBondContact O-N 2.94Å; K346-K349 PolarHBondContact O-N 3.05Å; N347-K349 VanDerWaalsContact C-N 3.35Å; K349-M351 PolarHBondContact O-N 3.33Å; K349-G352 PolarHBondContact O-N 2.86Å; K349-G352 VanDerWaalsContact O-N 3.11Å; K349-C354 HydrophobicContact CG-CB 4.35Å
350	S	74.1	Confident	79.4	Confident	94 Å²	94	60.5 Å²	60.5	66%	0.657	36%	0.36	S	S	*	.	H	α-helix	trans	-67.9	-25.2	177.6	65	0	0	0	0	113.1	K346 N347	K346-S350 PolarHBondContact O-N 2.96Å; K346-S350 VanDerWaalsContact O-N 3.07Å; N347-S350 WeakPolarHBondContact CA-OG 3.35Å; N347-S350 PolarHBondContact O-N 3.01Å; N347-S350 PolarHBondContact O-OG 3.23Å
351	M	72.1	Confident	78.5	Confident	54 Å²	54	64.7 Å²	64.7	27%	0.266	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.9	172.1	-71.3	-172.6	-83.4	0	0	114.6	L31 N347 L348 K349 L353	L31-M351 HydrophobicContact CB-SD 4.23Å; N347-M351 HydrophobicContact CB-CE 4.38Å; N347-M351 WeakPolarHBondContact O-CE 3.07Å; N347-M351 WeakPolarHBondContact O-CG 3.25Å; N347-M351 PolarHBondContact O-N 3.05Å; N347-M351 VanDerWaalsContact O-N 3.09Å; L348-M351 HydrophobicContact CD2-CE 3.87Å; L348-M351 HydrophobicContact CG-CE 4.48Å; L348-M351 PolarHBondContact O-N 3.12Å; K349-M351 PolarHBondContact O-N 3.33Å; M351-L353 VanDerWaalsContact C-N 3.32Å; M351-L353 HydrophobicContact CB-CD1 3.9Å; M351-L353 HydrophobicContact CB-CG 4.04Å; M351-L353 HydrophobicContact CE-CD1 4.38Å; M351-L353 HydrophobicContact SD-CD1 4.12Å
352	G	69.4	Low	77.6	Confident	64 Å²	64	64.2 Å²	64.2	66%	0.66	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	23.9	-175.5	0	0	0	0	0	114.4	L348 K349	L348-G352 PolarHBondContact O-N 2.84Å; K349-G352 PolarHBondContact O-N 2.86Å; K349-G352 VanDerWaalsContact O-N 3.11Å
353	L	61	Low	76.6	Confident	119 Å²	119	66.8 Å²	66.8	62%	0.623	40%	0.403	S	S	*	.			trans	-99.4	5.1	-176.5	-68.5	171.9	0	0	0	113.9	L348 M351	L348-L353 HydrophobicContact CD2-CB 4.21Å; L348-L353 HydrophobicContact CD2-CD1 4.1Å; L348-L353 PolarHBondContact O-N 3.44Å; M351-L353 VanDerWaalsContact C-N 3.32Å; M351-L353 HydrophobicContact CB-CD1 3.9Å; M351-L353 HydrophobicContact CB-CG 4.04Å; M351-L353 HydrophobicContact CE-CD1 4.38Å; M351-L353 HydrophobicContact SD-CD1 4.12Å
354	C	47.3	Very low	75.3	Confident	142 Å²	142	72.8 Å²	72.8	96%	0.959	44%	0.44	S	S	*	.			trans	-139.3	0	178.2	-74.8	0	0	0	0	111.9	K349	K349-C354 HydrophobicContact CG-CB 4.35Å

Retrieved 354 of 354 residues in 304.3 ms (Link to these results)

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