A0A077Z605_TRITR Loading...

Transmembrane 9 superfamily member

AlphaFold DB , UniProt , Accession A0A077Z605, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 656 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.4	Very low	68.6	Low	227 Å²	227	132.5 Å²	132.5	100%	1.118	69%	0.69	S	S	*	*				0	94.7	0	-87	-178	174.5	0	0	109.3	K3	M1-K3 VanDerWaalsContact C-N 3.35Å; M1-K3 PolarHBondContact O-N 2.94Å
2	V	47.4	Very low	70.1	Confident	147 Å²	147	130 Å²	130	89%	0.891	68%	0.676	S	S	*	*			trans	-78.2	98.9	154.3	179.1	0	0	0	0	103.5	R4	V2-R4 PolarHBondContact O-N 3.33Å; V2-R4 VanDerWaalsContact O-N 3.07Å
3	K	55.2	Low	71.3	Confident	180 Å²	180	128 Å²	128	78%	0.783	67%	0.666	S	S	*	*			trans	-56.8	118.9	170.4	-83.8	-174.8	174.2	-177.2	0	105.4	M1 L5	M1-K3 VanDerWaalsContact C-N 3.35Å; M1-K3 PolarHBondContact O-N 2.94Å; K3-L5 PolarHBondContact O-N 3.46Å
4	R	59.9	Low	72.4	Confident	228 Å²	228	126.7 Å²	126.7	86%	0.86	66%	0.66	S	S	*	*			trans	-48.7	127.5	170.8	-78.3	-178.9	173.2	178.9	-2.4	106.5	V2 N6	V2-R4 PolarHBondContact O-N 3.33Å; V2-R4 VanDerWaalsContact O-N 3.07Å; R4-N6 PolarHBondContact O-N 2.83Å
5	L	62.1	Low	73.4	Confident	122 Å²	122	123.3 Å²	123.3	64%	0.639	65%	0.646	S	S	*	*			trans	-56.8	113	174.3	-146.7	88.2	0	0	0	105.9	K3 A7 L10	K3-L5 PolarHBondContact O-N 3.46Å; L5-A7 PolarHBondContact O-N 3.32Å; L5-L10 HydrophobicContact CD2-CB 4.48Å; L5-L10 HydrophobicContact CD2-CD1 4.05Å
6	N	75.2	Confident	74.1	Confident	107 Å²	107	120.2 Å²	120.2	57%	0.572	63%	0.634	S	S	*	*			trans	-62.4	139	-177.5	-80.1	-10.7	0	0	0	108.4	R4 T8 T9 L10	R4-N6 PolarHBondContact O-N 2.83Å; N6-T8 PolarHBondContact O-N 2.63Å; N6-T9 PolarHBondContact N-OG1 3.07Å; N6-T9 PolarHBondContact O-N 3.2Å; N6-T9 PolarHBondContact O-OG1 3.29Å; N6-L10 PolarHBondContact O-N 2.91Å
7	A	80.4	Confident	74.4	Confident	83 Å²	83	116.6 Å²	116.6	69%	0.686	63%	0.625	S	S	*	*	H	α-helix	trans	-52.1	-31	-180	0	0	0	0	0	112.5	L5 L10 L11	L5-A7 PolarHBondContact O-N 3.32Å; A7-L10 PolarHBondContact O-N 3.49Å; A7-L11 WeakPolarHBondContact O-CB 3.46Å; A7-L11 PolarHBondContact O-N 2.99Å
8	T	82.5	Confident	74.8	Confident	93 Å²	93	116.7 Å²	116.7	57%	0.571	63%	0.631	S	S	*	*	H	α-helix	trans	-61.4	-43.6	172.8	52.8	0	0	0	0	113.3	N6 L10 L11 I12	N6-T8 PolarHBondContact O-N 2.63Å; T8-L10 VanDerWaalsContact C-N 3.34Å; T8-L10 PolarHBondContact O-N 3.27Å; T8-L11 PolarHBondContact O-N 3.28Å; T8-I12 VanDerWaalsContact O-CG1 3.24Å; T8-I12 WeakPolarHBondContact O-CG1 3.24Å; T8-I12 PolarHBondContact O-N 3Å
9	T	83	Confident	75.1	Confident	61 Å²	61	119.6 Å²	119.6	37%	0.374	64%	0.637	S	S	.	*	H	α-helix	trans	-66	-35.9	176.1	49.5	0	0	0	0	112.4	N6 L13	N6-T9 PolarHBondContact N-OG1 3.07Å; N6-T9 PolarHBondContact O-N 3.2Å; N6-T9 PolarHBondContact O-OG1 3.29Å; T9-L13 WeakPolarHBondContact O-CB 3.4Å; T9-L13 PolarHBondContact O-N 3.32Å
10	L	84.1	Confident	75.2	Confident	94 Å²	94	118.6 Å²	118.6	49%	0.492	64%	0.635	S	S	.	*	H	α-helix	trans	-66.4	-43.3	174.3	-167.1	79.3	0	0	0	111.1	L5 N6 A7 T8 L13 L14	L5-L10 HydrophobicContact CD2-CB 4.48Å; L5-L10 HydrophobicContact CD2-CD1 4.05Å; N6-L10 PolarHBondContact O-N 2.91Å; A7-L10 PolarHBondContact O-N 3.49Å; T8-L10 VanDerWaalsContact C-N 3.34Å; T8-L10 PolarHBondContact O-N 3.27Å; L10-L13 WeakPolarHBondContact O-CB 3.48Å; L10-L13 PolarHBondContact O-N 2.82Å; L10-L14 HydrophobicContact CD2-CD1 4.46Å; L10-L14 HydrophobicContact CG-CD1 4.15Å; L10-L14 PolarHBondContact O-N 3.23Å
11	L	86.6	Confident	75	Confident	115 Å²	115	118.7 Å²	118.7	60%	0.602	64%	0.64	S	S	*	*	H	α-helix	trans	-65.4	-40.9	178.7	-159.5	116.9	0	0	0	111.6	A7 T8 L14 V15	A7-L11 WeakPolarHBondContact O-CB 3.46Å; A7-L11 PolarHBondContact O-N 2.99Å; T8-L11 PolarHBondContact O-N 3.28Å; L11-L14 PolarHBondContact O-N 3.5Å; L11-V15 VanDerWaalsContact O-CG2 3.3Å; L11-V15 WeakPolarHBondContact O-CG2 3.49Å; L11-V15 PolarHBondContact O-N 3.47Å
12	I	86.7	Confident	75.9	Confident	103 Å²	103	113.5 Å²	113.5	53%	0.528	63%	0.627	S	S	.	*	H	α-helix	trans	-61.3	-45.5	173.2	-68.1	163.9	0	0	0	110.3	T8 L14 V15 T16	T8-I12 VanDerWaalsContact O-CG1 3.24Å; T8-I12 WeakPolarHBondContact O-CG1 3.24Å; T8-I12 PolarHBondContact O-N 3Å; I12-L14 VanDerWaalsContact C-N 3.35Å; I12-L14 PolarHBondContact O-N 3Å; I12-V15 PolarHBondContact O-N 2.75Å; I12-T16 HydrophobicContact CG2-CG2 4.32Å; I12-T16 WeakPolarHBondContact O-CB 3.3Å; I12-T16 WeakPolarHBondContact O-CG2 3.35Å; I12-T16 PolarHBondContact O-N 2.66Å; I12-T16 PolarHBondContact O-OG1 2.95Å; I12-T16 VanDerWaalsContact O-OG1 3.05Å
13	L	85.3	Confident	76.4	Confident	104 Å²	104	114 Å²	114	55%	0.545	62%	0.617	S	S	.	*	H	α-helix	trans	-57.6	-45.9	175.6	-92	155.3	0	0	0	111.8	T9 L10 T16 A17	T9-L13 WeakPolarHBondContact O-CB 3.4Å; T9-L13 PolarHBondContact O-N 3.32Å; L10-L13 WeakPolarHBondContact O-CB 3.48Å; L10-L13 PolarHBondContact O-N 2.82Å; L13-T16 WeakPolarHBondContact CA-OG1 3.49Å; L13-T16 PolarHBondContact O-N 3.44Å; L13-T16 PolarHBondContact O-OG1 3.05Å; L13-A17 WeakPolarHBondContact O-CB 3.45Å; L13-A17 PolarHBondContact O-N 2.88Å
14	L	86.6	Confident	76.3	Confident	110 Å²	110	111.7 Å²	111.7	58%	0.576	60%	0.604	S	S	*	*	H	α-helix	trans	-62.8	-46.2	176.6	-81.8	151.5	0	0	0	112.4	L10 L11 I12 T16 A17 T18	L10-L14 HydrophobicContact CD2-CD1 4.46Å; L10-L14 HydrophobicContact CG-CD1 4.15Å; L10-L14 PolarHBondContact O-N 3.23Å; L11-L14 PolarHBondContact O-N 3.5Å; I12-L14 VanDerWaalsContact C-N 3.35Å; I12-L14 PolarHBondContact O-N 3Å; L14-T16 VanDerWaalsContact C-N 3.35Å; L14-T16 PolarHBondContact O-N 3.31Å; L14-A17 WeakPolarHBondContact O-CB 3.46Å; L14-A17 PolarHBondContact O-N 3.27Å; L14-A17 VanDerWaalsContact O-N 3.16Å; L14-T18 PolarHBondContact O-N 3Å; L14-T18 VanDerWaalsContact O-N 3.12Å
15	V	87.4	Confident	75.7	Confident	75 Å²	75	104.2 Å²	104.2	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-63.4	-41.5	176.6	173.8	0	0	0	0	110.7	L11 I12 A17 T18 K19	L11-V15 VanDerWaalsContact O-CG2 3.3Å; L11-V15 WeakPolarHBondContact O-CG2 3.49Å; L11-V15 PolarHBondContact O-N 3.47Å; I12-V15 PolarHBondContact O-N 2.75Å; V15-A17 VanDerWaalsContact C-N 3.31Å; V15-A17 PolarHBondContact O-N 2.93Å; V15-T18 PolarHBondContact O-N 3.17Å; V15-T18 PolarHBondContact O-OG1 3.12Å; V15-K19 PolarHBondContact O-N 3.02Å
16	T	84.2	Confident	75.1	Confident	74 Å²	74	102.8 Å²	102.8	45%	0.454	58%	0.579	S	S	.	*	H	α-helix	trans	-65.6	-33.5	174.6	55.9	0	0	0	0	112.5	I12 L13 L14 T18 K19	I12-T16 HydrophobicContact CG2-CG2 4.32Å; I12-T16 WeakPolarHBondContact O-CB 3.3Å; I12-T16 WeakPolarHBondContact O-CG2 3.35Å; I12-T16 PolarHBondContact O-N 2.66Å; I12-T16 PolarHBondContact O-OG1 2.95Å; I12-T16 VanDerWaalsContact O-OG1 3.05Å; L13-T16 WeakPolarHBondContact CA-OG1 3.49Å; L13-T16 PolarHBondContact O-N 3.44Å; L13-T16 PolarHBondContact O-OG1 3.05Å; L14-T16 VanDerWaalsContact C-N 3.35Å; L14-T16 PolarHBondContact O-N 3.31Å; T16-T18 VanDerWaalsContact C-N 3.31Å; T16-T18 PolarHBondContact O-N 3.36Å; T16-K19 PolarHBondContact O-N 3.34Å; T16-K19 VanDerWaalsContact O-N 3.15Å
17	A	79.9	Confident	74.1	Confident	59 Å²	59	98.8 Å²	98.8	49%	0.488	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-34.7	175.2	0	0	0	0	0	112	L13 L14 V15 K19 V20	L13-A17 WeakPolarHBondContact O-CB 3.45Å; L13-A17 PolarHBondContact O-N 2.88Å; L14-A17 WeakPolarHBondContact O-CB 3.46Å; L14-A17 PolarHBondContact O-N 3.27Å; L14-A17 VanDerWaalsContact O-N 3.16Å; V15-A17 VanDerWaalsContact C-N 3.31Å; V15-A17 PolarHBondContact O-N 2.93Å; A17-K19 PolarHBondContact O-N 3.5Å; A17-V20 WeakPolarHBondContact O-CB 3.16Å; A17-V20 WeakPolarHBondContact O-CG2 3.19Å; A17-V20 PolarHBondContact O-N 3.05Å; A17-V20 VanDerWaalsContact O-N 3.15Å
18	T	82.2	Confident	73	Confident	118 Å²	118	99.8 Å²	99.8	72%	0.724	56%	0.556	S	S	*	*	H	α-helix	trans	-68.5	-20.7	174.9	64.1	0	0	0	0	113.9	L14 V15 T16 V20	L14-T18 PolarHBondContact O-N 3Å; L14-T18 VanDerWaalsContact O-N 3.12Å; V15-T18 PolarHBondContact O-N 3.17Å; V15-T18 PolarHBondContact O-OG1 3.12Å; T16-T18 VanDerWaalsContact C-N 3.31Å; T16-T18 PolarHBondContact O-N 3.36Å; T18-V20 VanDerWaalsContact C-N 3.3Å
19	K	79.2	Confident	72.3	Confident	173 Å²	173	102.3 Å²	102.3	75%	0.752	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-4	174.1	-66.2	-166.4	177.5	-172.7	0	113.3	V15 T16 A17 T21	V15-K19 PolarHBondContact O-N 3.02Å; T16-K19 PolarHBondContact O-N 3.34Å; T16-K19 VanDerWaalsContact O-N 3.15Å; A17-K19 PolarHBondContact O-N 3.5Å; K19-T21 PolarHBondContact O-N 3.48Å; K19-T21 VanDerWaalsContact O-N 3.16Å
20	V	76.9	Confident	71.9	Confident	99 Å²	99	100.2 Å²	100.2	60%	0.6	54%	0.544	S	S	*	.			trans	-73	110.5	177	-179.7	0	0	0	0	108.2	A17 T18 S22	A17-V20 WeakPolarHBondContact O-CB 3.16Å; A17-V20 WeakPolarHBondContact O-CG2 3.19Å; A17-V20 PolarHBondContact O-N 3.05Å; A17-V20 VanDerWaalsContact O-N 3.15Å; T18-V20 VanDerWaalsContact C-N 3.3Å; V20-S22 PolarHBondContact O-N 3.12Å
21	T	72.1	Confident	71.9	Confident	120 Å²	120	98 Å²	98	74%	0.736	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-61.4	117.4	163.7	50.4	0	0	0	0	107.7	K19 F23	K19-T21 PolarHBondContact O-N 3.48Å; K19-T21 VanDerWaalsContact O-N 3.16Å; T21-F23 PolarHBondContact O-N 3.42Å
22	S	58.2	Low	71.9	Confident	119 Å²	119	92.7 Å²	92.7	83%	0.832	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-55.1	117.9	170.8	57	0	0	0	0	108.3	V20	V20-S22 PolarHBondContact O-N 3.12Å
23	F	56.1	Low	72	Confident	158 Å²	158	88 Å²	88	69%	0.693	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-95.9	142.7	175.1	73.9	-88.2	0	0	0	109.6	T21 L25	T21-F23 PolarHBondContact O-N 3.42Å; F23-L25 HydrophobicContact CE2-CD1 4.44Å; F23-L25 HydrophobicContact CE2-CG 4.19Å; F23-L25 PolarHBondContact O-N 2.93Å
24	Y	53.3	Low	72.1	Confident	131 Å²	131	83 Å²	83	51%	0.514	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-65	129.5	175.6	168.2	-118.7	0	0	0	110.2	P26 G27	Y24-P26 HydrophobicContact CD1-CG 4.37Å; Y24-P26 HydrophobicContact CE1-CB 4.15Å; Y24-P26 HydrophobicContact CE1-CG 4.31Å; Y24-P26 VanDerWaalsContact O-CD 3.29Å; Y24-P26 WeakPolarHBondContact O-CD 3.49Å; Y24-G27 PolarHBondContact OH-N 2.9Å
25	L	48.8	Very low	72.2	Confident	71 Å²	71	81.2 Å²	81.2	37%	0.372	45%	0.445	S	S	.	.			trans	-86.5	110.8	167.4	-86	109.4	0	0	0	109.2	F23 G27 L28	F23-L25 HydrophobicContact CE2-CD1 4.44Å; F23-L25 HydrophobicContact CE2-CG 4.19Å; F23-L25 PolarHBondContact O-N 2.93Å; L25-G27 PolarHBondContact O-N 2.74Å; L25-L28 HydrophobicContact CB-CD1 3.71Å; L25-L28 PolarHBondContact O-N 2.9Å
26	P	47.6	Very low	71.9	Confident	91 Å²	91	80.9 Å²	80.9	59%	0.591	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	136.6	-179.8	-22.5	34	0	0	0	112.5	Y24	Y24-P26 HydrophobicContact CD1-CG 4.37Å; Y24-P26 HydrophobicContact CE1-CB 4.15Å; Y24-P26 HydrophobicContact CE1-CG 4.31Å; Y24-P26 VanDerWaalsContact O-CD 3.29Å; Y24-P26 WeakPolarHBondContact O-CD 3.49Å
27	G	54.8	Low	71.8	Confident	23 Å²	23	86.9 Å²	86.9	24%	0.237	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-3.2	176.7	0	0	0	0	0	115.7	Y24 L25	Y24-G27 PolarHBondContact OH-N 2.9Å; L25-G27 PolarHBondContact O-N 2.74Å
28	L	57.6	Low	71.8	Confident	104 Å²	104	89.4 Å²	89.4	55%	0.545	46%	0.464	S	S	.	.	S	Bend	trans	-93.4	-32.8	175.3	-83	170.8	0	0	0	114	L25	L25-L28 HydrophobicContact CB-CD1 3.71Å; L25-L28 PolarHBondContact O-N 2.9Å
29	Y	67.8	Low	71.7	Confident	146 Å²	146	88.8 Å²	88.8	57%	0.573	45%	0.453	S	S	*	.	S	Bend	trans	-91.2	134.4	-177.2	-158.9	-97.9	0	0	0	110.8
30	P	75.8	Confident	71.7	Confident	17 Å²	17	83.9 Å²	83.9	11%	0.11	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-66.7	136.4	176.2	26.6	-33.6	0	0	0	111.1	W276	P30-W276 HydrophobicContact CB-CD2 4.04Å; P30-W276 HydrophobicContact CB-CE3 4.47Å; P30-W276 HydrophobicContact CB-CH2 4.23Å; P30-W276 HydrophobicContact CB-CZ2 3.77Å
31	V	82.7	Confident	71.7	Confident	48 Å²	48	85.1 Å²	85.1	29%	0.291	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-87.2	125.2	166.8	-175.5	0	0	0	0	107.9	F33	V31-F33 HydrophobicContact CB-CE2 4.03Å; V31-F33 HydrophobicContact CB-CZ 4.2Å; V31-F33 HydrophobicContact CG1-CD2 4.41Å; V31-F33 HydrophobicContact CG1-CE1 4.09Å; V31-F33 HydrophobicContact CG1-CE2 3.83Å; V31-F33 HydrophobicContact CG1-CZ 3.65Å
32	N	86.8	Confident	71.9	Confident	4 Å²	4	83.6 Å²	83.6	2%	0.021	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	136.1	173.7	-59.9	-32.9	0	0	0	109	C43 K44 L197 Y203 R211	N32-C43 WeakPolarHBondContact O-CA 3.43Å; N32-K44 PolarHBondContact O-N 2.94Å; N32-K44 VanDerWaalsContact O-N 3.15Å; N32-L197 WeakPolarHBondContact OD1-CD1 3.23Å; N32-Y203 PolarHBondContact ND2-OH 3.44Å; N32-R211 PolarHBondContact OD1-NE 3.46Å
33	F	89.3	Confident	73	Confident	3 Å²	3	78.1 Å²	78.1	1%	0.013	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.9	176.6	-65	-82.9	0	0	0	110.7	V31 K44 H46 V47 F102 D145 G209 G210 I212	V31-F33 HydrophobicContact CB-CE2 4.03Å; V31-F33 HydrophobicContact CB-CZ 4.2Å; V31-F33 HydrophobicContact CG1-CD2 4.41Å; V31-F33 HydrophobicContact CG1-CE1 4.09Å; V31-F33 HydrophobicContact CG1-CE2 3.83Å; V31-F33 HydrophobicContact CG1-CZ 3.65Å; F33-K44 CarbonylContact C-O 3.47Å; F33-K44 VanDerWaalsContact CA-O 3.23Å; F33-K44 WeakPolarHBondContact CA-O 3.16Å; F33-K44 HydrophobicContact CD1-CB 4.42Å; F33-H46 WeakPolarHBondContact CE1-O 3.41Å; F33-V47 HydrophobicContact CD1-CG2 3.81Å; F33-V47 HydrophobicContact CE1-CB 4.42Å; F33-V47 HydrophobicContact CE1-CG2 4.03Å; F33-V47 HydrophobicContact CG-CG2 4.26Å; F33-F102 HydrophobicContact CB-CB 3.98Å; F33-F102 HydrophobicContact CB-CD1 4.21Å; F33-F102 HydrophobicContact CB-CD2 3.32Å; F33-F102 HydrophobicContact CB-CE2 3.78Å; F33-F102 HydrophobicContact CB-CG 3.56Å; F33-F102 HydrophobicContact CB-CZ 4.38Å; F33-F102 HydrophobicContact CG-CD2 4.22Å; F33-F102 VanDerWaalsContact O-CE1 3.31Å; F33-F102 WeakPolarHBondContact O-CE1 3.47Å; F33-D145 HydrophobicContact CE2-CB 4.19Å; F33-D145 HydrophobicContact CZ-CB 4.38Å; F33-G209 CarbonylContact O-C 3.56Å; F33-G209 WeakPolarHBondContact O-CA 3.26Å; F33-G210 PolarHBondContact N-O 2.88Å; F33-G210 PolarHBondContact O-N 3.38Å; F33-I212 HydrophobicContact CD2-CD1 3.78Å; F33-I212 HydrophobicContact CD2-CG1 3.88Å; F33-I212 HydrophobicContact CE2-CD1 3.56Å; F33-I212 HydrophobicContact CE2-CG1 4Å; F33-I212 HydrophobicContact CG-CD1 4.49Å; F33-I212 HydrophobicContact CZ-CD1 4.11Å
34	C	87.8	Confident	74.4	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.395	C	S	.	.			trans	-127.7	159.2	-176.6	-75.6	0	0	0	0	110.8	K38 C43 K44 S45 I208 G209	C34-K38 HydrophobicContact CB-CB 4.42Å; C34-C43 VanDerWaalsContact CA-SG 3.59Å; C34-C43 HydrophobicContact CB-CB 3.84Å; C34-C43 WeakPolarHBondContact CB-SG 3.41Å; C34-C43 PolarHBondContact N-SG 3.42Å; C34-C43 WeakPolarHBondContact SG-CB 3.41Å; C34-C43 CovalentContact SG-SG 2.01Å; C34-C43 PolarHBondContact SG-SG 2.77Å; C34-K44 PolarHBondContact N-O 3.38Å; C34-S45 VanDerWaalsContact O-CA 3.25Å; C34-S45 WeakPolarHBondContact O-CA 3.25Å; C34-I208 VanDerWaalsContact SG-C 3.57Å; C34-I208 PolarHBondContact SG-O 3.31Å; C34-G209 VanDerWaalsContact SG-CA 3.55Å
35	E	86.9	Confident	76.1	Confident	73 Å²	73	70.8 Å²	70.8	34%	0.341	37%	0.374	S	S	.	.			trans	-62.2	149.6	168.2	-70.4	176.3	-177.5	0	0	110.6	K37 K38 E39 N103	E35-K37 PolarHBondContact O-N 3.32Å; E35-K38 CarbonylContact O-C 3.57Å; E35-K38 WeakPolarHBondContact O-CA 3.24Å; E35-K38 PolarHBondContact O-N 3.47Å; E35-E39 PolarHBondContact O-N 3.42Å; E35-N103 HydrophobicContact CG-CB 4.1Å; E35-N103 PolarHBondContact OE1-ND2 2.83Å
36	P	82.1	Confident	78	Confident	68 Å²	68	71 Å²	71	44%	0.442	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-58.2	-24.7	-175.6	21.7	-34	0	0	0	114.3	K38	P36-K38 VanDerWaalsContact C-N 3.25Å; P36-K38 PolarHBondContact O-N 3.27Å
37	K	83	Confident	80.1	Confident	199 Å²	199	66.6 Å²	66.6	87%	0.865	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-73.4	-15.8	175.2	-65.2	-177.2	178	-178.9	0	113.7	E35	E35-K37 PolarHBondContact O-N 3.32Å
38	K	79.7	Confident	81.8	Confident	113 Å²	113	67.6 Å²	67.6	49%	0.491	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-121.9	22.7	-174.2	-55.1	-175.2	-173.9	174.7	0	112	C34 E35 P36 T40 I208	C34-K38 HydrophobicContact CB-CB 4.42Å; E35-K38 CarbonylContact O-C 3.57Å; E35-K38 WeakPolarHBondContact O-CA 3.24Å; E35-K38 PolarHBondContact O-N 3.47Å; P36-K38 VanDerWaalsContact C-N 3.25Å; P36-K38 PolarHBondContact O-N 3.27Å; K38-T40 PolarHBondContact O-N 2.88Å; K38-I208 HydrophobicContact CB-CG2 3.84Å; K38-I208 HydrophobicContact CD-CG2 3.56Å; K38-I208 HydrophobicContact CG-CG2 4.32Å
39	E	80	Confident	83.4	Confident	105 Å²	105	62.8 Å²	62.8	49%	0.491	32%	0.322	S	S	.	.			trans	-64.1	131.5	179.5	-176.5	149.2	-142.4	0	0	110.5	E35 S45	E35-E39 PolarHBondContact O-N 3.42Å; E39-S45 PolarHBondContact OE1-N 2.76Å; E39-S45 PolarHBondContact OE1-OG 3.06Å; E39-S45 WeakPolarHBondContact OE2-CB 3.44Å; E39-S45 PolarHBondContact OE2-OG 3.42Å
40	T	78.9	Confident	84.6	Confident	69 Å²	69	58 Å²	58	42%	0.423	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-134.9	169.2	179.5	52.6	0	0	0	0	109	K38 T42 C43	K38-T40 PolarHBondContact O-N 2.88Å; T40-T42 PolarHBondContact O-N 3.17Å; T40-T42 VanDerWaalsContact O-N 3.16Å; T40-C43 PolarHBondContact N-O 3.33Å; T40-C43 VanDerWaalsContact N-O 3.09Å; T40-C43 CarbonylContact O-C 3.52Å; T40-C43 PolarHBondContact O-N 3.06Å; T40-C43 VanDerWaalsContact O-N 3.13Å; T40-C43 WeakPolarHBondContact OG1-CB 3.45Å; T40-C43 PolarHBondContact OG1-N 3.43Å
41	S	77	Confident	85.3	Confident	125 Å²	125	57.2 Å²	57.2	87%	0.874	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.2	178	55.5	0	0	0	0	113.5
42	T	75.8	Confident	85.8	Confident	89 Å²	89	55.3 Å²	55.3	55%	0.546	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-13	179.2	55.2	0	0	0	0	113.7	T40	T40-T42 PolarHBondContact O-N 3.17Å; T40-T42 VanDerWaalsContact O-N 3.16Å
43	C	81.5	Confident	86	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.02	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	108.2	-174.9	-154.7	0	0	0	0	111.8	N32 C34 T40	N32-C43 WeakPolarHBondContact O-CA 3.43Å; C34-C43 VanDerWaalsContact CA-SG 3.59Å; C34-C43 HydrophobicContact CB-CB 3.84Å; C34-C43 WeakPolarHBondContact CB-SG 3.41Å; C34-C43 PolarHBondContact N-SG 3.42Å; C34-C43 WeakPolarHBondContact SG-CB 3.41Å; C34-C43 CovalentContact SG-SG 2.01Å; C34-C43 PolarHBondContact SG-SG 2.77Å; T40-C43 PolarHBondContact N-O 3.33Å; T40-C43 VanDerWaalsContact N-O 3.09Å; T40-C43 CarbonylContact O-C 3.52Å; T40-C43 PolarHBondContact O-N 3.06Å; T40-C43 VanDerWaalsContact O-N 3.13Å; T40-C43 WeakPolarHBondContact OG1-CB 3.45Å; T40-C43 PolarHBondContact OG1-N 3.43Å
44	K	86.2	Confident	86.1	Confident	124 Å²	124	56.4 Å²	56.4	54%	0.539	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	144.2	-174.6	-62.8	-175.8	178.1	-174.3	0	111.5	N32 F33 C34	N32-K44 PolarHBondContact O-N 2.94Å; N32-K44 VanDerWaalsContact O-N 3.15Å; F33-K44 CarbonylContact C-O 3.47Å; F33-K44 VanDerWaalsContact CA-O 3.23Å; F33-K44 WeakPolarHBondContact CA-O 3.16Å; F33-K44 HydrophobicContact CD1-CB 4.42Å; C34-K44 PolarHBondContact N-O 3.38Å
45	S	88	Confident	86.2	Confident	11 Å²	11	56.8 Å²	56.8	8%	0.077	29%	0.293	C	S	.	.	S	Bend	trans	-88.1	-32.1	177.6	68.4	0	0	0	0	114.3	C34 E39 F102	C34-S45 VanDerWaalsContact O-CA 3.25Å; C34-S45 WeakPolarHBondContact O-CA 3.25Å; E39-S45 PolarHBondContact OE1-N 2.76Å; E39-S45 PolarHBondContact OE1-OG 3.06Å; E39-S45 WeakPolarHBondContact OE2-CB 3.44Å; E39-S45 PolarHBondContact OE2-OG 3.42Å; S45-F102 PolarHBondContact O-N 3.38Å
46	H	90	Very high	86.3	Confident	75 Å²	75	53.3 Å²	53.3	35%	0.347	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.3	-179.7	-175.1	-101.7	0	0	0	111.3	F33 P48 I100	F33-H46 WeakPolarHBondContact CE1-O 3.41Å; H46-P48 VanDerWaalsContact O-CD 3.24Å; H46-P48 WeakPolarHBondContact O-CD 3.41Å; H46-I100 PolarHBondContact CD2-O 3.19Å
47	V	91.2	Very high	86.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	100.1	174.1	-180	0	0	0	0	107.9	F33 V49 I100 F102 V144 I212	F33-V47 HydrophobicContact CD1-CG2 3.81Å; F33-V47 HydrophobicContact CE1-CB 4.42Å; F33-V47 HydrophobicContact CE1-CG2 4.03Å; F33-V47 HydrophobicContact CG-CG2 4.26Å; V47-V49 PolarHBondContact O-N 2.87Å; V47-I100 HydrophobicContact CB-CB 4.17Å; V47-I100 HydrophobicContact CB-CG2 4.05Å; V47-I100 HydrophobicContact CG2-CG2 4.46Å; V47-I100 PolarHBondContact N-O 3.17Å; V47-F102 HydrophobicContact CG2-CB 4.24Å; V47-F102 HydrophobicContact CG2-CD2 4.49Å; V47-V144 HydrophobicContact CG1-CG1 3.49Å; V47-V144 VanDerWaalsContact CG1-CG1 3.49Å; V47-I212 HydrophobicContact CG1-CD1 3.62Å; V47-I212 HydrophobicContact CG2-CD1 4.14Å
48	P	89.8	Confident	86.3	Confident	43 Å²	43	49.2 Å²	49.2	28%	0.279	26%	0.255	S	S	.	.			trans	-69.9	129.1	-178.9	29.4	-34.4	0	0	0	110.4	H46 F50	H46-P48 VanDerWaalsContact O-CD 3.24Å; H46-P48 WeakPolarHBondContact O-CD 3.41Å; P48-F50 HydrophobicContact CB-CE2 3.83Å; P48-F50 HydrophobicContact CB-CZ 3.91Å; P48-F50 HydrophobicContact CG-CE2 3.97Å; P48-F50 HydrophobicContact CG-CZ 4.28Å
49	V	91.5	Very high	86.6	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.6	170.1	-178.9	0	0	0	0	107.8	V47 S96 Y98 I100 W142 V144 F190	V47-V49 PolarHBondContact O-N 2.87Å; V49-S96 VanDerWaalsContact CB-OG 3.31Å; V49-S96 WeakPolarHBondContact CB-OG 3.44Å; V49-S96 WeakPolarHBondContact O-CB 3.35Å; V49-S96 PolarHBondContact O-N 3.46Å; V49-S96 PolarHBondContact O-OG 3.39Å; V49-Y98 HydrophobicContact CG1-CD2 4.32Å; V49-I100 HydrophobicContact CG2-CD1 3.5Å; V49-I100 HydrophobicContact CG2-CG1 4.17Å; V49-W142 HydrophobicContact CG1-CE3 4.43Å; V49-V144 HydrophobicContact CB-CG2 4.26Å; V49-V144 HydrophobicContact CG1-CG2 4.06Å; V49-V144 HydrophobicContact CG2-CG2 3.89Å; V49-F190 HydrophobicContact CG1-CZ 4.46Å
50	F	92	Very high	86.9	Confident	45 Å²	45	40 Å²	40	20%	0.197	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142.1	174.8	-57	-84.7	0	0	0	110.3	P48 P80 I93 R94 W142 I143	P48-F50 HydrophobicContact CB-CE2 3.83Å; P48-F50 HydrophobicContact CB-CZ 3.91Å; P48-F50 HydrophobicContact CG-CE2 3.97Å; P48-F50 HydrophobicContact CG-CZ 4.28Å; F50-P80 HydrophobicContact CD1-CG 4.22Å; F50-P80 HydrophobicContact CE1-CG 4.2Å; F50-I93 HydrophobicContact CB-CG2 3.6Å; F50-I93 HydrophobicContact CD1-CG2 4.15Å; F50-I93 HydrophobicContact CG-CG2 4.04Å; F50-R94 CarbonylContact C-O 3.5Å; F50-R94 WeakPolarHBondContact CA-O 3.27Å; F50-W142 WeakPolarHBondContact O-CA 3.3Å; F50-I143 HydrophobicContact CB-CB 4.24Å; F50-I143 PolarHBondContact N-O 2.93Å; F50-I143 PolarHBondContact O-N 3.2Å
51	V	92	Very high	87.3	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.2	172.1	-61.5	0	0	0	0	109.3	Y65 I93 R94 W142	V51-Y65 HydrophobicContact CB-CD1 4.26Å; V51-Y65 HydrophobicContact CB-CD2 3.81Å; V51-Y65 HydrophobicContact CB-CE2 4.22Å; V51-Y65 HydrophobicContact CB-CG 3.83Å; V51-Y65 HydrophobicContact CG1-CD1 4.41Å; V51-Y65 HydrophobicContact CG1-CD2 4.01Å; V51-Y65 HydrophobicContact CG1-CE1 4.27Å; V51-Y65 HydrophobicContact CG1-CE2 3.89Å; V51-Y65 HydrophobicContact CG1-CG 4.27Å; V51-Y65 HydrophobicContact CG2-CD1 3.7Å; V51-Y65 HydrophobicContact CG2-CD2 4.12Å; V51-Y65 HydrophobicContact CG2-CE1 4.27Å; V51-Y65 HydrophobicContact CG2-CG 3.59Å; V51-I93 WeakPolarHBondContact O-CA 3.46Å; V51-R94 HydrophobicContact CG2-CB 3.94Å; V51-R94 WeakPolarHBondContact CG2-O 3.37Å; V51-R94 PolarHBondContact N-O 3.33Å; V51-R94 PolarHBondContact O-N 3.27Å; V51-W142 HydrophobicContact CG1-CD2 4.45Å; V51-W142 HydrophobicContact CG1-CG 4.36Å; V51-W142 HydrophobicContact CG1-CZ2 4.43Å
52	N	91.5	Very high	88	Confident	8 Å²	8	31.3 Å²	31.3	4%	0.043	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-176.3	172.5	-160	-0.5	0	0	0	109.6	R92 H141 I143	N52-R92 WeakPolarHBondContact CA-O 3.49Å; N52-R92 PolarHBondContact OD1-N 2.89Å; N52-R92 PolarHBondContact OD1-O 3.23Å; N52-H141 WeakPolarHBondContact CA-O 3.15Å; N52-H141 HydrophobicContact CB-CB 4.19Å; N52-H141 WeakPolarHBondContact CB-O 3.37Å; N52-H141 PolarHBondContact N-O 3.35Å; N52-I143 HydrophobicContact CB-CD1 4.31Å
53	R	91	Very high	88.7	Confident	29 Å²	29	29.2 Å²	29.2	11%	0.109	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	157.6	171.4	63.9	163.1	174.7	-159.5	-7.9	113.6	Y63 F89 G90 T456	R53-Y63 CarbonylContact C-O 3.5Å; R53-Y63 VanDerWaalsContact CA-O 3.27Å; R53-Y63 WeakPolarHBondContact CA-O 3.44Å; R53-Y63 WeakPolarHBondContact CB-O 3.21Å; R53-F89 PolarHBondContact NH1-O 3.08Å; R53-F89 PolarHBondContact NH2-O 3.03Å; R53-G90 WeakPolarHBondContact CD-O 3.42Å; R53-T456 PolarHBondContact NH1-OG1 3.11Å
54	L	92.7	Very high	89.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140.6	167.4	-66.9	80.3	0	0	0	109.8	T62 Y63 Y65 F68 F70 Y138 T139 M166	L54-T62 VanDerWaalsContact O-CA 3.27Å; L54-T62 WeakPolarHBondContact O-CA 3.26Å; L54-T62 VanDerWaalsContact O-CB 3.24Å; L54-T62 WeakPolarHBondContact O-CB 3.3Å; L54-Y63 PolarHBondContact N-O 2.95Å; L54-Y63 PolarHBondContact O-N 2.86Å; L54-Y65 HydrophobicContact CD1-CD2 4.11Å; L54-F68 HydrophobicContact CB-CE2 4.35Å; L54-F68 HydrophobicContact CD1-CD2 4.27Å; L54-F68 HydrophobicContact CD1-CE2 4.44Å; L54-F68 HydrophobicContact CD2-CD2 4Å; L54-F68 HydrophobicContact CD2-CE2 3.85Å; L54-F68 HydrophobicContact CG-CE2 4.46Å; L54-F70 HydrophobicContact CD1-CE2 4.49Å; L54-F70 HydrophobicContact CD2-CE2 4Å; L54-F70 HydrophobicContact CD2-CZ 4.4Å; L54-Y138 HydrophobicContact CB-CD1 3.9Å; L54-T139 WeakPolarHBondContact CA-O 3.48Å; L54-M166 HydrophobicContact CD2-SD 4.47Å
55	D	90.1	Very high	89.4	Confident	8 Å²	8	25.8 Å²	25.8	4%	0.043	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	168.4	176.6	63.5	3.1	0	0	0	111	T62 Y138 T139 H141 H542	D55-T62 HydrophobicContact CB-CG2 3.88Å; D55-Y138 VanDerWaalsContact C-CD1 3.45Å; D55-Y138 CarbonylContact O-C 3.56Å; D55-Y138 WeakPolarHBondContact O-CA 3.36Å; D55-Y138 VanDerWaalsContact O-CD1 3.31Å; D55-Y138 WeakPolarHBondContact O-CD1 3.18Å; D55-T139 PolarHBondContact O-N 3.2Å; D55-T139 PolarHBondContact OD1-OG1 3.23Å; D55-H141 IonicContact OD1-CE1 3.49Å; D55-H141 PolarHBondContact OD1-CE1 2.92Å; D55-H141 IonicContact OD1-ND1 2.82Å; D55-H141 PolarHBondContact OD1-ND1 3.2Å; D55-H141 IonicContact OD2-CE1 3.37Å; D55-H141 PolarHBondContact OD2-CE1 3.41Å; D55-H141 IonicContact OD2-ND1 3.6Å; D55-H141 IonicContact OD2-NE2 3.59Å; D55-H542 WeakPolarHBondContact OD2-CB 3.37Å; D55-H542 IonicContact OD2-CD2 3.53Å; D55-H542 PolarHBondContact OD2-CD2 2.8Å; D55-H542 IonicContact OD2-CG 3.82Å; D55-H542 IonicContact OD2-ND1 2.85Å; D55-H542 IonicContact OD2-NE2 3.7Å
56	S	87.7	Confident	89.4	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.007	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.3	-179.7	165.7	0	0	0	0	110.1	N58 S59 L136	S56-N58 PolarHBondContact O-N 3.31Å; S56-N58 PolarHBondContact OG-N 3.42Å; S56-S59 PolarHBondContact O-N 3.13Å; S56-S59 PolarHBondContact OG-N 3.26Å; S56-L136 PolarHBondContact OG-O 2.67Å
57	K	81.9	Confident	89.4	Confident	129 Å²	129	29 Å²	29	56%	0.561	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.9	170.7	-64.6	-178.4	-178.9	176	0	113.2	M610	K57-M610 WeakPolarHBondContact O-CE 3.32Å
58	N	84	Confident	89.3	Confident	52 Å²	52	29.6 Å²	29.6	28%	0.278	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-7.3	-178	-60.7	-28.9	0	0	0	113	S56 L136 T609 M610	S56-N58 PolarHBondContact O-N 3.31Å; S56-N58 PolarHBondContact OG-N 3.42Å; N58-L136 HydrophobicContact CB-CD2 4.16Å; N58-L136 PolarHBondContact ND2-O 2.61Å; N58-T609 WeakPolarHBondContact OD1-CB 3.35Å; N58-T609 PolarHBondContact OD1-OG1 3.1Å; N58-M610 VanDerWaalsContact O-SD 3.36Å
59	S	85.3	Confident	89.3	Confident	7 Å²	7	28.9 Å²	28.9	5%	0.049	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	138	175.9	-163.5	0	0	0	0	112.6	S56 L61 M610 S615	S56-S59 PolarHBondContact O-N 3.13Å; S56-S59 PolarHBondContact OG-N 3.26Å; S59-L61 PolarHBondContact O-N 3.16Å; S59-L61 PolarHBondContact OG-N 3.47Å; S59-M610 WeakPolarHBondContact CA-SD 3.37Å; S59-M610 PolarHBondContact N-SD 3.25Å; S59-S615 PolarHBondContact OG-OG 3.44Å; S59-S615 VanDerWaalsContact OG-OG 3.13Å
60	V	86.5	Confident	89.3	Confident	16 Å²	16	28.9 Å²	28.9	10%	0.097	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	-20	169.8	174.1	0	0	0	0	111.6	W540 M610 S615 L618	V60-W540 HydrophobicContact CB-CZ3 4.49Å; V60-W540 HydrophobicContact CG1-CZ3 3.82Å; V60-W540 HydrophobicContact CG2-CE3 4.14Å; V60-W540 HydrophobicContact CG2-CZ3 3.84Å; V60-M610 HydrophobicContact CG2-CE 4.03Å; V60-M610 HydrophobicContact CG2-SD 3.87Å; V60-M610 PolarHBondContact N-SD 3.49Å; V60-S615 PolarHBondContact N-OG 3.12Å; V60-L618 HydrophobicContact CG1-CB 4.14Å; V60-L618 HydrophobicContact CG1-CD1 4.46Å
61	L	88.4	Confident	89.1	Confident	10 Å²	10	26.9 Å²	26.9	5%	0.052	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.4	179.3	-60.6	173.1	0	0	0	109.2	S59 Y138 M449 K452 V614 L618	S59-L61 PolarHBondContact O-N 3.16Å; S59-L61 PolarHBondContact OG-N 3.47Å; L61-Y138 PolarHBondContact O-OH 2.79Å; L61-Y138 VanDerWaalsContact O-OH 3.06Å; L61-M449 HydrophobicContact CD2-CE 4.14Å; L61-M449 HydrophobicContact CD2-SD 3.46Å; L61-M449 WeakPolarHBondContact CD2-SD 3.3Å; L61-K452 HydrophobicContact CD1-CB 4.33Å; L61-K452 HydrophobicContact CD1-CG 4.4Å; L61-K452 HydrophobicContact CD2-CB 4.33Å; L61-V614 HydrophobicContact CD2-CG1 4.48Å; L61-L618 HydrophobicContact CD2-CD1 3.78Å
62	T	90.5	Very high	88.8	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	154.5	168.9	64.6	0	0	0	0	109.3	L54 D55 S454 S455 T456	L54-T62 VanDerWaalsContact O-CA 3.27Å; L54-T62 WeakPolarHBondContact O-CA 3.26Å; L54-T62 VanDerWaalsContact O-CB 3.24Å; L54-T62 WeakPolarHBondContact O-CB 3.3Å; D55-T62 HydrophobicContact CB-CG2 3.88Å; T62-S454 PolarHBondContact N-OG 3Å; T62-S454 CarbonylContact O-C 3.44Å; T62-S454 WeakPolarHBondContact O-CA 3.35Å; T62-S454 WeakPolarHBondContact O-CB 3.3Å; T62-S454 PolarHBondContact O-OG 3.09Å; T62-S455 WeakPolarHBondContact CB-OG 3.25Å; T62-S455 PolarHBondContact O-N 3.49Å; T62-S455 PolarHBondContact O-OG 2.96Å; T62-S455 PolarHBondContact OG1-OG 3.2Å; T62-T456 WeakPolarHBondContact OG1-CB 3.39Å; T62-T456 PolarHBondContact OG1-N 2.86Å; T62-T456 PolarHBondContact OG1-OG1 3Å
63	Y	91.3	Very high	88.2	Confident	46 Å²	46	30.9 Å²	30.9	18%	0.18	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	154.6	177.9	-68.5	-68.1	0	0	0	110.6	R53 L54 D67 F68 Y138 S455	R53-Y63 CarbonylContact C-O 3.5Å; R53-Y63 VanDerWaalsContact CA-O 3.27Å; R53-Y63 WeakPolarHBondContact CA-O 3.44Å; R53-Y63 WeakPolarHBondContact CB-O 3.21Å; L54-Y63 PolarHBondContact N-O 2.95Å; L54-Y63 PolarHBondContact O-N 2.86Å; Y63-D67 HydrophobicContact CD1-CB 4.48Å; Y63-F68 HydrophobicContact CD2-CE2 4.41Å; Y63-F68 HydrophobicContact CD2-CZ 4.26Å; Y63-F68 HydrophobicContact CG-CE2 4.43Å; Y63-Y138 AromaticContact CD2-CE1 3.75Å; Y63-Y138 HydrophobicContact CD2-CE1 3.75Å; Y63-Y138 HydrophobicContact CD2-CE2 4.45Å; Y63-Y138 AromaticContact CD2-CZ 3.64Å; Y63-Y138 WeakPolarHBondContact CD2-OH 3.24Å; Y63-Y138 HydrophobicContact CE2-CE1 4.32Å; Y63-Y138 HydrophobicContact CE2-CE2 4.47Å; Y63-Y138 AromaticContact CE2-CZ 3.76Å; Y63-Y138 WeakPolarHBondContact CE2-OH 3.43Å; Y63-S455 VanDerWaalsContact C-OG 3.28Å; Y63-S455 WeakPolarHBondContact CA-OG 3.33Å; Y63-S455 PolarHBondContact N-OG 2.83Å; Y63-S455 PolarHBondContact O-OG 2.92Å
64	E	90.8	Very high	87.5	Confident	46 Å²	46	33 Å²	33	22%	0.215	17%	0.17	C	C	.	.			trans	-74.8	159.7	173.1	-62.7	-163.6	-174	0	0	109.7	H66 D67 R92	E64-H66 PolarHBondContact O-N 3.48Å; E64-D67 PolarHBondContact N-OD2 3.37Å; E64-D67 PolarHBondContact O-N 3.37Å; E64-R92 HydrophobicContact CG-CB 4.14Å; E64-R92 HydrophobicContact CG-CG 4.03Å; E64-R92 WeakPolarHBondContact OE1-CG 3.42Å; E64-R92 IonicContact OE1-NE 3.04Å
65	Y	90.8	Very high	86.2	Confident	9 Å²	9	42.3 Å²	42.3	4%	0.035	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-58.8	-31.8	176.6	-172.3	-97.1	0	0	0	112.5	V51 L54 F70 C71 L72 H140 W142	V51-Y65 HydrophobicContact CB-CD1 4.26Å; V51-Y65 HydrophobicContact CB-CD2 3.81Å; V51-Y65 HydrophobicContact CB-CE2 4.22Å; V51-Y65 HydrophobicContact CB-CG 3.83Å; V51-Y65 HydrophobicContact CG1-CD1 4.41Å; V51-Y65 HydrophobicContact CG1-CD2 4.01Å; V51-Y65 HydrophobicContact CG1-CE1 4.27Å; V51-Y65 HydrophobicContact CG1-CE2 3.89Å; V51-Y65 HydrophobicContact CG1-CG 4.27Å; V51-Y65 HydrophobicContact CG2-CD1 3.7Å; V51-Y65 HydrophobicContact CG2-CD2 4.12Å; V51-Y65 HydrophobicContact CG2-CE1 4.27Å; V51-Y65 HydrophobicContact CG2-CG 3.59Å; L54-Y65 HydrophobicContact CD1-CD2 4.11Å; Y65-F70 HydrophobicContact CD1-CB 4.4Å; Y65-F70 HydrophobicContact CD1-CD2 4.5Å; Y65-F70 AromaticContact CD2-CD2 3.95Å; Y65-F70 HydrophobicContact CD2-CD2 3.95Å; Y65-F70 HydrophobicContact CE1-CB 3.61Å; Y65-F70 HydrophobicContact CE1-CD2 4.29Å; Y65-F70 HydrophobicContact CE1-CG 4.38Å; Y65-F70 HydrophobicContact CE2-CB 4.19Å; Y65-F70 AromaticContact CE2-CD2 3.69Å; Y65-F70 HydrophobicContact CE2-CD2 3.69Å; Y65-F70 HydrophobicContact CE2-CE2 4.4Å; Y65-F70 HydrophobicContact CE2-CG 4.15Å; Y65-F70 HydrophobicContact CG-CD2 4.35Å; Y65-F70 VanDerWaalsContact CZ-CB 3.48Å; Y65-F70 AromaticContact CZ-CD2 3.88Å; Y65-F70 AromaticContact CZ-CG 3.94Å; Y65-F70 WeakPolarHBondContact O-CD2 3.44Å; Y65-F70 WeakPolarHBondContact OH-CB 3.11Å; Y65-C71 WeakPolarHBondContact CE1-O 3.38Å; Y65-L72 HydrophobicContact CD1-CD2 3.95Å; Y65-L72 HydrophobicContact CE1-CD2 4.05Å; Y65-H140 AromaticContact CE2-CE1 3.76Å; Y65-H140 AromaticContact CE2-ND1 3.78Å; Y65-W142 HydrophobicContact CE2-CZ2 4.29Å; Y65-W142 AromaticContact CE2-NE1 3.9Å
66	H	89.3	Confident	84.9	Confident	76 Å²	76	50.9 Å²	50.9	35%	0.352	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-79.9	-14.4	-178.9	-58.2	-84.9	0	0	0	114.4	E64 F68 L72 R94	E64-H66 PolarHBondContact O-N 3.48Å; H66-F68 CarbonylContact C-O 3.42Å; H66-F68 PolarHBondContact O-N 3.49Å; H66-L72 VanDerWaalsContact CE1-CD2 3.49Å; H66-L72 WeakPolarHBondContact CE1-CD2 3.34Å; H66-L72 WeakPolarHBondContact ND1-CD1 3Å; H66-L72 WeakPolarHBondContact ND1-CD2 3.39Å; H66-R94 WeakPolarHBondContact NE2-CG 3.21Å
67	D	88.2	Confident	84	Confident	78 Å²	78	54.4 Å²	54.4	42%	0.417	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-68.2	-23.2	176.9	-69.4	-32.8	0	0	0	111.4	Y63 E64	Y63-D67 HydrophobicContact CD1-CB 4.48Å; E64-D67 PolarHBondContact N-OD2 3.37Å; E64-D67 PolarHBondContact O-N 3.37Å
68	F	90.7	Very high	83.3	Confident	11 Å²	11	56.9 Å²	56.9	5%	0.048	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	145.2	169.5	-60.7	-82.7	0	0	0	109.6	L54 Y63 H66 F70 A129 L130 M166	L54-F68 HydrophobicContact CB-CE2 4.35Å; L54-F68 HydrophobicContact CD1-CD2 4.27Å; L54-F68 HydrophobicContact CD1-CE2 4.44Å; L54-F68 HydrophobicContact CD2-CD2 4Å; L54-F68 HydrophobicContact CD2-CE2 3.85Å; L54-F68 HydrophobicContact CG-CE2 4.46Å; Y63-F68 HydrophobicContact CD2-CE2 4.41Å; Y63-F68 HydrophobicContact CD2-CZ 4.26Å; Y63-F68 HydrophobicContact CG-CE2 4.43Å; H66-F68 CarbonylContact C-O 3.42Å; H66-F68 PolarHBondContact O-N 3.49Å; F68-F70 HydrophobicContact CB-CD2 3.51Å; F68-F70 HydrophobicContact CB-CE1 4.33Å; F68-F70 HydrophobicContact CB-CE2 3.16Å; F68-F70 HydrophobicContact CB-CG 4.22Å; F68-F70 HydrophobicContact CB-CZ 3.63Å; F68-F70 AromaticContact CD2-CE2 3.84Å; F68-F70 HydrophobicContact CD2-CE2 3.84Å; F68-F70 HydrophobicContact CD2-CZ 4.46Å; F68-F70 HydrophobicContact CG-CD2 4.44Å; F68-F70 AromaticContact CG-CE2 3.66Å; F68-F70 HydrophobicContact CG-CE2 3.66Å; F68-F70 HydrophobicContact CG-CZ 4Å; F68-F70 PolarHBondContact O-N 3.12Å; F68-A129 WeakPolarHBondContact CE1-O 3.38Å; F68-L130 HydrophobicContact CB-CD2 4.2Å; F68-L130 HydrophobicContact CD1-CD2 4.21Å; F68-M166 HydrophobicContact CE1-CE 4.36Å
69	D	89.2	Confident	82.7	Confident	29 Å²	29	57.4 Å²	57.4	16%	0.155	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	56.9	-177	-163.3	9.6	0	0	0	112.8	K114 Y116 K126	D69-K114 IonicContact OD1-NZ 2.71Å; D69-K114 PolarHBondContact OD1-NZ 2.74Å; D69-Y116 HydrophobicContact CB-CE1 4.47Å; D69-Y116 WeakPolarHBondContact CB-OH 3.39Å; D69-Y116 PolarHBondContact O-OH 3.46Å; D69-Y116 WeakPolarHBondContact OD2-CE1 3.32Å; D69-Y116 PolarHBondContact OD2-OH 3.08Å; D69-K126 HydrophobicContact CB-CB 4.24Å; D69-K126 HydrophobicContact CB-CD 4.26Å; D69-K126 HydrophobicContact CB-CG 4.21Å; D69-K126 VanDerWaalsContact OD2-CD 3.25Å; D69-K126 WeakPolarHBondContact OD2-CD 3.27Å; D69-K126 VanDerWaalsContact OD2-CE 3.26Å; D69-K126 WeakPolarHBondContact OD2-CE 3.31Å; D69-K126 IonicContact OD2-NZ 3.89Å; D69-K126 PolarHBondContact OD2-NZ 3.19Å
70	F	90.7	Very high	82.1	Confident	3 Å²	3	59.3 Å²	59.3	1%	0.013	30%	0.302	C	S	.	.			trans	-80.5	175.6	173.5	-59.8	-51.9	0	0	0	112	L54 Y65 F68 L72 K114 L130 H140 M166 L184 Y263	L54-F70 HydrophobicContact CD1-CE2 4.49Å; L54-F70 HydrophobicContact CD2-CE2 4Å; L54-F70 HydrophobicContact CD2-CZ 4.4Å; Y65-F70 HydrophobicContact CD1-CB 4.4Å; Y65-F70 HydrophobicContact CD1-CD2 4.5Å; Y65-F70 AromaticContact CD2-CD2 3.95Å; Y65-F70 HydrophobicContact CD2-CD2 3.95Å; Y65-F70 HydrophobicContact CE1-CB 3.61Å; Y65-F70 HydrophobicContact CE1-CD2 4.29Å; Y65-F70 HydrophobicContact CE1-CG 4.38Å; Y65-F70 HydrophobicContact CE2-CB 4.19Å; Y65-F70 AromaticContact CE2-CD2 3.69Å; Y65-F70 HydrophobicContact CE2-CD2 3.69Å; Y65-F70 HydrophobicContact CE2-CE2 4.4Å; Y65-F70 HydrophobicContact CE2-CG 4.15Å; Y65-F70 HydrophobicContact CG-CD2 4.35Å; Y65-F70 VanDerWaalsContact CZ-CB 3.48Å; Y65-F70 AromaticContact CZ-CD2 3.88Å; Y65-F70 AromaticContact CZ-CG 3.94Å; Y65-F70 WeakPolarHBondContact O-CD2 3.44Å; Y65-F70 WeakPolarHBondContact OH-CB 3.11Å; F68-F70 HydrophobicContact CB-CD2 3.51Å; F68-F70 HydrophobicContact CB-CE1 4.33Å; F68-F70 HydrophobicContact CB-CE2 3.16Å; F68-F70 HydrophobicContact CB-CG 4.22Å; F68-F70 HydrophobicContact CB-CZ 3.63Å; F68-F70 AromaticContact CD2-CE2 3.84Å; F68-F70 HydrophobicContact CD2-CE2 3.84Å; F68-F70 HydrophobicContact CD2-CZ 4.46Å; F68-F70 HydrophobicContact CG-CD2 4.44Å; F68-F70 AromaticContact CG-CE2 3.66Å; F68-F70 HydrophobicContact CG-CE2 3.66Å; F68-F70 HydrophobicContact CG-CZ 4Å; F68-F70 PolarHBondContact O-N 3.12Å; F70-L72 PolarHBondContact O-N 3.39Å; F70-K114 WeakPolarHBondContact O-CE 3.17Å; F70-K114 PolarHBondContact O-NZ 3.15Å; F70-L130 HydrophobicContact CD1-CD2 4.29Å; F70-L130 HydrophobicContact CE1-CD2 3.58Å; F70-L130 HydrophobicContact CZ-CD2 3.92Å; F70-H140 AromaticContact CD2-CE1 3.94Å; F70-H140 AromaticContact CE2-CE1 3.39Å; F70-H140 WeakPolarHBondContact CE2-CE1 3.43Å; F70-H140 AromaticContact CZ-CE1 3.54Å; F70-H140 AromaticContact CZ-NE2 3.81Å; F70-M166 HydrophobicContact CZ-SD 3.89Å; F70-L184 HydrophobicContact CE1-CD1 4.38Å; F70-Y263 HydrophobicContact CD1-CE1 4.3Å
71	C	89.3	Confident	81.6	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.02	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-71.4	120.4	172.7	-57.2	0	0	0	0	110.4	Y65 P97 L111 C112 Y263	Y65-C71 WeakPolarHBondContact CE1-O 3.38Å; C71-P97 HydrophobicContact CB-CG 3.82Å; C71-P97 WeakPolarHBondContact O-CG 3.35Å; C71-L111 HydrophobicContact CB-CD2 3.69Å; C71-L111 HydrophobicContact CB-CG 4.05Å; C71-C112 VanDerWaalsContact CA-SG 3.56Å; C71-C112 HydrophobicContact CB-CB 3.92Å; C71-C112 WeakPolarHBondContact CB-SG 3.47Å; C71-C112 WeakPolarHBondContact SG-CB 3.13Å; C71-C112 CovalentContact SG-SG 2.02Å; C71-C112 PolarHBondContact SG-SG 2.97Å; C71-Y263 VanDerWaalsContact SG-CB 3.54Å; C71-Y263 WeakPolarHBondContact SG-CD2 3.46Å; C71-Y263 VanDerWaalsContact SG-CG 3.58Å
72	L	84.7	Confident	81.3	Confident	80 Å²	80	70.5 Å²	70.5	42%	0.419	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-94.7	146.3	179	-53.6	-175.9	0	0	0	111	Y65 H66 F70	Y65-L72 HydrophobicContact CD1-CD2 3.95Å; Y65-L72 HydrophobicContact CE1-CD2 4.05Å; H66-L72 VanDerWaalsContact CE1-CD2 3.49Å; H66-L72 WeakPolarHBondContact CE1-CD2 3.34Å; H66-L72 WeakPolarHBondContact ND1-CD1 3Å; H66-L72 WeakPolarHBondContact ND1-CD2 3.39Å; F70-L72 PolarHBondContact O-N 3.39Å
73	G	80.1	Confident	81.1	Confident	14 Å²	14	73 Å²	73	14%	0.144	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-72.6	161.6	169.7	0	0	0	0	0	111.6
74	P	75.1	Confident	80.9	Confident	72 Å²	72	72.3 Å²	72.3	47%	0.468	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-61.4	136.2	172	23.8	-30.2	0	0	0	110.8	E76 L77	P74-E76 PolarHBondContact O-N 2.68Å; P74-L77 HydrophobicContact CG-CD1 3.64Å; P74-L77 HydrophobicContact CG-CG 4Å; P74-L77 PolarHBondContact O-N 3.11Å
75	E	66.4	Low	80.8	Confident	196 Å²	196	70.1 Å²	70.1	92%	0.916	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.8	-178.4	-68	-175.6	169.2	0	0	113.3	L77	E75-L77 PolarHBondContact O-N 3.18Å
76	E	63	Low	80.8	Confident	188 Å²	188	70.4 Å²	70.4	88%	0.879	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-18	178.4	-63.9	175	-178.8	0	0	113.8	P74 E78	P74-E76 PolarHBondContact O-N 2.68Å; E76-E78 PolarHBondContact O-N 3.35Å
77	L	67.3	Low	80.8	Confident	76 Å²	76	67.7 Å²	67.7	40%	0.398	34%	0.343	S	S	.	.	S	Bend	trans	-71.2	125.7	178.7	-74	167.6	0	0	0	110.2	P74 E75 T79 P95	P74-L77 HydrophobicContact CG-CD1 3.64Å; P74-L77 HydrophobicContact CG-CG 4Å; P74-L77 PolarHBondContact O-N 3.11Å; E75-L77 PolarHBondContact O-N 3.18Å; L77-T79 PolarHBondContact O-N 3.37Å; L77-P95 HydrophobicContact CB-CB 3.61Å; L77-P95 HydrophobicContact CB-CG 3.59Å; L77-P95 HydrophobicContact CD1-CB 3.79Å; L77-P95 HydrophobicContact CD1-CG 4.39Å; L77-P95 HydrophobicContact CG-CB 4.33Å
78	E	67.2	Low	80.8	Confident	181 Å²	181	64.9 Å²	64.9	85%	0.846	33%	0.328	S	S	*	.			trans	-54.3	115	176.9	-72.5	-175.2	169.8	0	0	111	E76	E76-E78 PolarHBondContact O-N 3.35Å
79	T	72.3	Confident	80.6	Confident	63 Å²	63	68.2 Å²	68.2	39%	0.387	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-70	131.8	170.5	54	0	0	0	0	108.7	L77 F81	L77-T79 PolarHBondContact O-N 3.37Å; T79-F81 PolarHBondContact O-N 2.89Å
80	P	73.1	Confident	80.4	Confident	46 Å²	46	66.8 Å²	66.8	30%	0.299	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-62.3	141.3	178.2	25.9	-32.5	0	0	0	110.4	F50 E82 I93	F50-P80 HydrophobicContact CD1-CG 4.22Å; F50-P80 HydrophobicContact CE1-CG 4.2Å; P80-E82 PolarHBondContact O-N 3.31Å; P80-I93 HydrophobicContact CG-CB 3.89Å; P80-I93 HydrophobicContact CG-CG2 3.47Å; P80-I93 VanDerWaalsContact CG-CG2 3.47Å
81	F	75.4	Confident	80.3	Confident	207 Å²	207	68.1 Å²	68.1	91%	0.908	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-62.9	123	175.7	-68.7	-82.7	0	0	0	110.7	T79	T79-F81 PolarHBondContact O-N 2.89Å
82	E	81	Confident	80.2	Confident	55 Å²	55	68.8 Å²	68.8	26%	0.257	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-85.1	130.1	174.5	-65.2	173.7	-177.8	0	0	109.8	P80 Q86 V87 R92 I93	P80-E82 PolarHBondContact O-N 3.31Å; E82-Q86 HydrophobicContact CB-CB 4.43Å; E82-V87 HydrophobicContact CB-CG2 3.77Å; E82-R92 VanDerWaalsContact OE1-CA 3.24Å; E82-R92 WeakPolarHBondContact OE1-CA 3.47Å; E82-R92 IonicContact OE2-NH1 3.34Å; E82-I93 PolarHBondContact OE1-N 2.97Å
83	N	86.7	Confident	80.4	Confident	55 Å²	55	65.5 Å²	65.5	29%	0.294	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-78.3	164	171.6	68.3	44.6	0	0	0	111.6	G85 Q86 V87 R389	N83-G85 PolarHBondContact O-N 3.32Å; N83-G85 VanDerWaalsContact O-N 3.17Å; N83-G85 PolarHBondContact OD1-N 3.35Å; N83-G85 VanDerWaalsContact OD1-N 3.16Å; N83-Q86 PolarHBondContact ND2-OE1 3.44Å; N83-Q86 WeakPolarHBondContact O-CB 3.46Å; N83-Q86 PolarHBondContact O-N 2.82Å; N83-Q86 VanDerWaalsContact O-N 3.07Å; N83-Q86 VanDerWaalsContact OD1-CG 3.31Å; N83-Q86 WeakPolarHBondContact OD1-CG 3.26Å; N83-Q86 PolarHBondContact OD1-N 3.08Å; N83-V87 WeakPolarHBondContact O-CG2 3.43Å; N83-V87 PolarHBondContact O-N 2.98Å; N83-R389 PolarHBondContact ND2-O 3.5Å
84	L	88	Confident	80.9	Confident	31 Å²	31	68.7 Å²	68.7	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-51	-44.6	-178.6	178.5	58.7	0	0	0	112.5	V87 L88 T394 V397 T462 L465 L469	L84-V87 PolarHBondContact O-N 3.48Å; L84-L88 HydrophobicContact CD1-CD1 4.16Å; L84-L88 HydrophobicContact CD1-CG 4.18Å; L84-L88 HydrophobicContact CG-CD1 4Å; L84-L88 HydrophobicContact CG-CG 4.43Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.22Å; L84-L88 PolarHBondContact O-N 2.94Å; L84-T394 HydrophobicContact CB-CG2 4.49Å; L84-V397 HydrophobicContact CD2-CG1 4.08Å; L84-T462 HydrophobicContact CD1-CG2 3.77Å; L84-L465 HydrophobicContact CD1-CD2 3.92Å; L84-L469 HydrophobicContact CD2-CD1 4.11Å
85	G	89	Confident	81.6	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-35.4	-178.9	0	0	0	0	0	114	N83 V87 L88 F89 G390 T394	N83-G85 PolarHBondContact O-N 3.32Å; N83-G85 VanDerWaalsContact O-N 3.17Å; N83-G85 PolarHBondContact OD1-N 3.35Å; N83-G85 VanDerWaalsContact OD1-N 3.16Å; G85-V87 VanDerWaalsContact C-N 3.35Å; G85-L88 PolarHBondContact O-N 2.98Å; G85-F89 WeakPolarHBondContact O-CB 3.26Å; G85-F89 VanDerWaalsContact O-CD2 3.23Å; G85-F89 WeakPolarHBondContact O-CD2 3.46Å; G85-F89 PolarHBondContact O-N 3.42Å; G85-G390 WeakPolarHBondContact CA-O 3.39Å; G85-T394 WeakPolarHBondContact CA-OG1 3.08Å; G85-T394 PolarHBondContact N-OG1 2.8Å
86	Q	89.5	Confident	82.8	Confident	15 Å²	15	57 Å²	57	7%	0.07	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-44.7	172.3	-72.3	-179.4	-68.7	0	0	110.6	E82 N83 L88 F89 G90 E91 R389	E82-Q86 HydrophobicContact CB-CB 4.43Å; N83-Q86 PolarHBondContact ND2-OE1 3.44Å; N83-Q86 WeakPolarHBondContact O-CB 3.46Å; N83-Q86 PolarHBondContact O-N 2.82Å; N83-Q86 VanDerWaalsContact O-N 3.07Å; N83-Q86 VanDerWaalsContact OD1-CG 3.31Å; N83-Q86 WeakPolarHBondContact OD1-CG 3.26Å; N83-Q86 PolarHBondContact OD1-N 3.08Å; Q86-L88 VanDerWaalsContact C-N 3.33Å; Q86-L88 PolarHBondContact O-N 3.23Å; Q86-F89 PolarHBondContact O-N 2.91Å; Q86-G90 PolarHBondContact O-N 2.9Å; Q86-G90 VanDerWaalsContact O-N 3.08Å; Q86-E91 HydrophobicContact CB-CB 4.14Å; Q86-E91 WeakPolarHBondContact CG-OE2 3.3Å; Q86-E91 PolarHBondContact NE2-OE2 3.48Å; Q86-E91 PolarHBondContact O-N 3.38Å; Q86-R389 HydrophobicContact CG-CB 3.96Å; Q86-R389 VanDerWaalsContact NE2-CB 3.28Å
87	V	90.2	Very high	84.1	Confident	18 Å²	18	49.3 Å²	49.3	11%	0.109	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-43	178.2	-179.8	0	0	0	0	111.3	E82 N83 L84 G85 G90 P459 T462	E82-V87 HydrophobicContact CB-CG2 3.77Å; N83-V87 WeakPolarHBondContact O-CG2 3.43Å; N83-V87 PolarHBondContact O-N 2.98Å; L84-V87 PolarHBondContact O-N 3.48Å; G85-V87 VanDerWaalsContact C-N 3.35Å; V87-G90 PolarHBondContact O-N 3.09Å; V87-G90 VanDerWaalsContact O-N 3.13Å; V87-P459 HydrophobicContact CG1-CG 4.2Å; V87-T462 HydrophobicContact CG1-CG2 3.89Å; V87-T462 WeakPolarHBondContact CG1-OG1 2.91Å
88	L	88.6	Confident	85.2	Confident	19 Å²	19	45.9 Å²	45.9	10%	0.099	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-33.6	177.6	-70.5	175	0	0	0	113.3	L84 G85 Q86 G90 M393 V397 F442 V458 T462 L466	L84-L88 HydrophobicContact CD1-CD1 4.16Å; L84-L88 HydrophobicContact CD1-CG 4.18Å; L84-L88 HydrophobicContact CG-CD1 4Å; L84-L88 HydrophobicContact CG-CG 4.43Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.22Å; L84-L88 PolarHBondContact O-N 2.94Å; G85-L88 PolarHBondContact O-N 2.98Å; Q86-L88 VanDerWaalsContact C-N 3.33Å; Q86-L88 PolarHBondContact O-N 3.23Å; L88-G90 PolarHBondContact O-N 2.77Å; L88-M393 HydrophobicContact CB-CE 4.42Å; L88-M393 HydrophobicContact CB-CG 4.09Å; L88-M393 HydrophobicContact CD1-CE 3.85Å; L88-M393 HydrophobicContact CD1-CG 3.87Å; L88-V397 HydrophobicContact CD1-CG2 3.87Å; L88-F442 HydrophobicContact CD2-CZ 4.46Å; L88-V458 HydrophobicContact CD2-CG1 4.29Å; L88-V458 HydrophobicContact CD2-CG2 4.14Å; L88-T462 HydrophobicContact CD2-CG2 4.26Å; L88-L466 HydrophobicContact CD1-CD2 4.45Å; L88-L466 HydrophobicContact CD2-CD1 3.91Å; L88-L466 HydrophobicContact CD2-CD2 4.4Å
89	F	85.3	Confident	86.3	Confident	81 Å²	81	44 Å²	44	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-75.8	-12.3	172.8	-82.5	-55.1	0	0	0	113	R53 G85 Q86 M393	R53-F89 PolarHBondContact NH1-O 3.08Å; R53-F89 PolarHBondContact NH2-O 3.03Å; G85-F89 WeakPolarHBondContact O-CB 3.26Å; G85-F89 VanDerWaalsContact O-CD2 3.23Å; G85-F89 WeakPolarHBondContact O-CD2 3.46Å; G85-F89 PolarHBondContact O-N 3.42Å; Q86-F89 PolarHBondContact O-N 2.91Å; F89-M393 HydrophobicContact CD2-CB 3.99Å; F89-M393 HydrophobicContact CE2-CB 3.43Å; F89-M393 VanDerWaalsContact CE2-CB 3.43Å; F89-M393 HydrophobicContact CE2-CG 4.24Å; F89-M393 HydrophobicContact CZ-CB 3.95Å; F89-M393 HydrophobicContact CZ-CG 4.49Å
90	G	86.4	Confident	87.2	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	16.1	-177.8	0	0	0	0	0	114.5	R53 Q86 V87 L88	R53-G90 WeakPolarHBondContact CD-O 3.42Å; Q86-G90 PolarHBondContact O-N 2.9Å; Q86-G90 VanDerWaalsContact O-N 3.08Å; V87-G90 PolarHBondContact O-N 3.09Å; V87-G90 VanDerWaalsContact O-N 3.13Å; L88-G90 PolarHBondContact O-N 2.77Å
91	E	87.2	Confident	88.1	Confident	31 Å²	31	41 Å²	41	15%	0.145	19%	0.191	C	C	.	.			trans	-68.6	134.8	171.4	-66.9	-169.3	172.6	0	0	109.9	Q86	Q86-E91 HydrophobicContact CB-CB 4.14Å; Q86-E91 WeakPolarHBondContact CG-OE2 3.3Å; Q86-E91 PolarHBondContact NE2-OE2 3.48Å; Q86-E91 PolarHBondContact O-N 3.38Å
92	R	88	Confident	88.8	Confident	17 Å²	17	31.5 Å²	31.5	6%	0.064	15%	0.149	C	C	.	.			trans	-136.6	91.8	-179.3	-67	-69.5	-177.2	-84.5	-15.9	108.3	N52 E64 E82 S455 A457	N52-R92 WeakPolarHBondContact CA-O 3.49Å; N52-R92 PolarHBondContact OD1-N 2.89Å; N52-R92 PolarHBondContact OD1-O 3.23Å; E64-R92 HydrophobicContact CG-CB 4.14Å; E64-R92 HydrophobicContact CG-CG 4.03Å; E64-R92 WeakPolarHBondContact OE1-CG 3.42Å; E64-R92 IonicContact OE1-NE 3.04Å; E82-R92 VanDerWaalsContact OE1-CA 3.24Å; E82-R92 WeakPolarHBondContact OE1-CA 3.47Å; E82-R92 IonicContact OE2-NH1 3.34Å; R92-S455 PolarHBondContact NH2-O 2.89Å; R92-A457 PolarHBondContact NH2-O 2.81Å
93	I	88.9	Confident	89.2	Confident	11 Å²	11	31.6 Å²	31.6	6%	0.056	15%	0.152	C	C	.	.			trans	-93.4	120.6	-170.5	-56.7	174.6	0	0	0	109.3	F50 V51 P80 E82 I143	F50-I93 HydrophobicContact CB-CG2 3.6Å; F50-I93 HydrophobicContact CD1-CG2 4.15Å; F50-I93 HydrophobicContact CG-CG2 4.04Å; V51-I93 WeakPolarHBondContact O-CA 3.46Å; P80-I93 HydrophobicContact CG-CB 3.89Å; P80-I93 HydrophobicContact CG-CG2 3.47Å; P80-I93 VanDerWaalsContact CG-CG2 3.47Å; E82-I93 PolarHBondContact OE1-N 2.97Å; I93-I143 HydrophobicContact CD1-CD1 3.73Å; I93-I143 HydrophobicContact CG1-CD1 3.92Å; I93-I143 HydrophobicContact CG2-CD1 4.11Å
94	R	89.8	Confident	89.4	Confident	81 Å²	81	34.4 Å²	34.4	31%	0.306	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.5	-177.7	-60.8	-66	-172.7	-162.1	0.4	111.2	F50 V51 H66	F50-R94 CarbonylContact C-O 3.5Å; F50-R94 WeakPolarHBondContact CA-O 3.27Å; V51-R94 HydrophobicContact CG2-CB 3.94Å; V51-R94 WeakPolarHBondContact CG2-O 3.37Å; V51-R94 PolarHBondContact N-O 3.33Å; V51-R94 PolarHBondContact O-N 3.27Å; H66-R94 WeakPolarHBondContact NE2-CG 3.21Å
95	P	90.4	Very high	89.6	Confident	16 Å²	16	37.5 Å²	37.5	10%	0.104	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	139.9	174.3	28.3	-33.6	0	0	0	110.3	L77	L77-P95 HydrophobicContact CB-CB 3.61Å; L77-P95 HydrophobicContact CB-CG 3.59Å; L77-P95 HydrophobicContact CD1-CB 3.79Å; L77-P95 HydrophobicContact CD1-CG 4.39Å; L77-P95 HydrophobicContact CG-CB 4.33Å
96	S	90.8	Very high	89.7	Confident	7 Å²	7	38.5 Å²	38.5	5%	0.049	18%	0.183	C	C	.	.			trans	-95.9	162.6	176.4	79.2	0	0	0	0	111.6	V49 Y98	V49-S96 VanDerWaalsContact CB-OG 3.31Å; V49-S96 WeakPolarHBondContact CB-OG 3.44Å; V49-S96 WeakPolarHBondContact O-CB 3.35Å; V49-S96 PolarHBondContact O-N 3.46Å; V49-S96 PolarHBondContact O-OG 3.39Å; S96-Y98 PolarHBondContact O-N 3.28Å; S96-Y98 WeakPolarHBondContact OG-CD2 3.4Å; S96-Y98 PolarHBondContact OG-N 3.09Å
97	P	90.6	Very high	89.7	Confident	25 Å²	25	43.1 Å²	43.1	16%	0.162	21%	0.212	C	C	.	.	S	Bend	trans	-78.5	1.1	175.2	25.9	-24.7	0	0	0	114.2	C71 K99 L111	C71-P97 HydrophobicContact CB-CG 3.82Å; C71-P97 WeakPolarHBondContact O-CG 3.35Å; P97-K99 PolarHBondContact O-N 3.25Å; P97-L111 HydrophobicContact CB-CD1 3.92Å; P97-L111 HydrophobicContact CB-CG 4.49Å; P97-L111 HydrophobicContact CG-CD1 3.87Å; P97-L111 HydrophobicContact CG-CD2 4.13Å; P97-L111 HydrophobicContact CG-CG 4.08Å
98	Y	91.1	Very high	89.4	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.016	22%	0.215	C	C	.	.			trans	-71.9	114	-177	-65.9	-78.7	0	0	0	111.4	V49 S96 I100 L111 W142 F190 Y265	V49-Y98 HydrophobicContact CG1-CD2 4.32Å; S96-Y98 PolarHBondContact O-N 3.28Å; S96-Y98 WeakPolarHBondContact OG-CD2 3.4Å; S96-Y98 PolarHBondContact OG-N 3.09Å; Y98-I100 PolarHBondContact O-N 3.45Å; Y98-L111 HydrophobicContact CD1-CD1 3.77Å; Y98-L111 HydrophobicContact CD1-CD2 4.17Å; Y98-L111 HydrophobicContact CE1-CD1 3.89Å; Y98-L111 HydrophobicContact CE1-CD2 3.44Å; Y98-L111 VanDerWaalsContact CE1-CD2 3.44Å; Y98-L111 HydrophobicContact CE1-CG 4.2Å; Y98-L111 HydrophobicContact CE2-CD2 4.01Å; Y98-L111 HydrophobicContact CG-CD1 4.2Å; Y98-L111 VanDerWaalsContact OH-CD2 3.26Å; Y98-L111 WeakPolarHBondContact OH-CD2 2.94Å; Y98-W142 HydrophobicContact CD2-CH2 4.43Å; Y98-W142 AromaticContact CE2-CH2 3.4Å; Y98-W142 HydrophobicContact CE2-CH2 3.4Å; Y98-W142 VanDerWaalsContact CE2-CH2 3.4Å; Y98-W142 HydrophobicContact CE2-CZ2 4.02Å; Y98-W142 AromaticContact CE2-CZ3 3.83Å; Y98-W142 HydrophobicContact CE2-CZ3 3.83Å; Y98-W142 AromaticContact CZ-CH2 3.54Å; Y98-W142 VanDerWaalsContact OH-CH2 3.3Å; Y98-W142 WeakPolarHBondContact OH-CH2 3.5Å; Y98-F190 AromaticContact CD1-CE2 3.92Å; Y98-F190 HydrophobicContact CD1-CE2 3.92Å; Y98-F190 HydrophobicContact CD1-CZ 4.4Å; Y98-F190 HydrophobicContact CE1-CE2 4.1Å; Y98-F190 HydrophobicContact CG-CE2 4.32Å; Y98-F190 HydrophobicContact CG-CZ 4.4Å; Y98-Y265 AromaticContact CD1-CD1 3.71Å; Y98-Y265 HydrophobicContact CD1-CD1 3.71Å; Y98-Y265 HydrophobicContact CD1-CD2 4.05Å; Y98-Y265 HydrophobicContact CD1-CE1 4.05Å; Y98-Y265 HydrophobicContact CD1-CE2 4.37Å; Y98-Y265 AromaticContact CD1-CG 3.69Å; Y98-Y265 HydrophobicContact CD1-CG 3.69Å; Y98-Y265 AromaticContact CE1-CD1 3.82Å; Y98-Y265 HydrophobicContact CE1-CD1 3.82Å; Y98-Y265 AromaticContact CE1-CG 3.84Å; Y98-Y265 HydrophobicContact CE1-CG 3.84Å
99	K	89.1	Confident	89.5	Confident	142 Å²	142	46 Å²	46	62%	0.617	23%	0.225	S	C	*	.			trans	-95.7	82.7	178.3	-64.3	-177.8	-179.1	-178.8	0	110.5	P97 K109	P97-K99 PolarHBondContact O-N 3.25Å; K99-K109 PolarHBondContact O-NZ 2.9Å
100	I	91.8	Very high	89.7	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.4	179.4	-55.1	-173.7	0	0	0	109.5	H46 V47 V49 Y98 F190 I192 V267 F269	H46-I100 PolarHBondContact CD2-O 3.19Å; V47-I100 HydrophobicContact CB-CB 4.17Å; V47-I100 HydrophobicContact CB-CG2 4.05Å; V47-I100 HydrophobicContact CG2-CG2 4.46Å; V47-I100 PolarHBondContact N-O 3.17Å; V49-I100 HydrophobicContact CG2-CD1 3.5Å; V49-I100 HydrophobicContact CG2-CG1 4.17Å; Y98-I100 PolarHBondContact O-N 3.45Å; I100-F190 HydrophobicContact CD1-CD2 4.17Å; I100-F190 HydrophobicContact CD1-CE2 4.26Å; I100-F190 HydrophobicContact CD1-CG 4.29Å; I100-F190 HydrophobicContact CD1-CZ 4.46Å; I100-I192 HydrophobicContact CD1-CD1 4.33Å; I100-I192 HydrophobicContact CG2-CD1 4.06Å; I100-V267 HydrophobicContact CD1-CG2 4.01Å; I100-V267 HydrophobicContact CG1-CG2 3.98Å; I100-V267 HydrophobicContact CG2-CG1 3.92Å; I100-V267 HydrophobicContact CG2-CG2 4.26Å; I100-F269 HydrophobicContact CG2-CE2 4.24Å; I100-F269 HydrophobicContact CG2-CZ 3.8Å
101	L	92.5	Very high	89.8	Confident	45 Å²	45	47.6 Å²	47.6	24%	0.236	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.8	174.5	-67	172.8	0	0	0	108.9	K104 F269	L101-K104 HydrophobicContact CB-CB 4.04Å; L101-K104 HydrophobicContact CB-CD 4.31Å; L101-K104 HydrophobicContact CD1-CD 3.87Å; L101-K104 PolarHBondContact O-N 2.91Å; L101-F269 WeakPolarHBondContact O-CE2 3.39Å; L101-F269 WeakPolarHBondContact O-CZ 3.47Å
102	F	90.7	Very high	90	Very high	7 Å²	7	47.7 Å²	47.7	3%	0.031	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	137.9	-178.5	-176.6	-101.3	0	0	0	112.2	F33 S45 V47 K104 Y194 F269	F33-F102 HydrophobicContact CB-CB 3.98Å; F33-F102 HydrophobicContact CB-CD1 4.21Å; F33-F102 HydrophobicContact CB-CD2 3.32Å; F33-F102 HydrophobicContact CB-CE2 3.78Å; F33-F102 HydrophobicContact CB-CG 3.56Å; F33-F102 HydrophobicContact CB-CZ 4.38Å; F33-F102 HydrophobicContact CG-CD2 4.22Å; F33-F102 VanDerWaalsContact O-CE1 3.31Å; F33-F102 WeakPolarHBondContact O-CE1 3.47Å; S45-F102 PolarHBondContact O-N 3.38Å; V47-F102 HydrophobicContact CG2-CB 4.24Å; V47-F102 HydrophobicContact CG2-CD2 4.49Å; F102-K104 PolarHBondContact O-N 3.49Å; F102-Y194 HydrophobicContact CE1-CE2 4.49Å; F102-Y194 HydrophobicContact CE2-CD2 4.06Å; F102-Y194 HydrophobicContact CE2-CG 4.02Å; F102-Y194 AromaticContact CZ-CD2 3.55Å; F102-Y194 HydrophobicContact CZ-CD2 3.55Å; F102-Y194 AromaticContact CZ-CE2 3.85Å; F102-Y194 HydrophobicContact CZ-CE2 3.85Å; F102-Y194 AromaticContact CZ-CG 3.98Å; F102-Y194 HydrophobicContact CZ-CG 3.98Å; F102-F269 HydrophobicContact CD2-CE1 4.08Å
103	N	88.5	Confident	90	Very high	57 Å²	57	49 Å²	49	31%	0.305	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	18.2	-178.7	-158.2	37.3	0	0	0	115.5	E35 Y194	E35-N103 HydrophobicContact CG-CB 4.1Å; E35-N103 PolarHBondContact OE1-ND2 2.83Å; N103-Y194 PolarHBondContact OD1-OH 2.93Å
104	K	91.2	Very high	90	Very high	115 Å²	115	50.7 Å²	50.7	50%	0.5	26%	0.259	S	S	.	.			trans	-111.1	100.2	175.5	-171.1	-177.9	-177.3	177.1	0	110.2	L101 F102 Q106	L101-K104 HydrophobicContact CB-CB 4.04Å; L101-K104 HydrophobicContact CB-CD 4.31Å; L101-K104 HydrophobicContact CD1-CD 3.87Å; L101-K104 PolarHBondContact O-N 2.91Å; F102-K104 PolarHBondContact O-N 3.49Å; K104-Q106 PolarHBondContact O-N 3.02Å
105	N	92.5	Very high	90	Very high	96 Å²	96	50.5 Å²	50.5	51%	0.513	27%	0.267	S	S	.	.			trans	-63	133.8	174.1	-67.6	-11.8	0	0	0	110.2	V267 F269	N105-V267 VanDerWaalsContact CA-O 3.3Å; N105-V267 WeakPolarHBondContact CA-O 3.25Å; N105-F269 PolarHBondContact OD1-N 3.03Å
106	Q	91	Very high	90	Very high	20 Å²	20	49.9 Å²	49.9	9%	0.093	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.2	179.1	-68.3	175.8	42.2	0	0	107.5	K104 S266 V267	K104-Q106 PolarHBondContact O-N 3.02Å; Q106-S266 CarbonylContact O-C 3.56Å; Q106-S266 WeakPolarHBondContact O-CA 3.27Å; Q106-S266 VanDerWaalsContact O-CB 3.31Å; Q106-S266 WeakPolarHBondContact O-CB 3.29Å; Q106-V267 PolarHBondContact N-O 3.24Å; Q106-V267 PolarHBondContact O-N 2.99Å
107	T	88.2	Confident	89.9	Confident	112 Å²	112	53 Å²	53	69%	0.687	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.2	179.8	53	0	0	0	0	109.3	K109	T107-K109 PolarHBondContact O-N 2.99Å
108	C	85.7	Confident	89.8	Confident	24 Å²	24	54.4 Å²	54.4	16%	0.162	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55.8	45.4	170	-158.7	0	0	0	0	115.2	V242 C244 Y265 S266	C108-V242 VanDerWaalsContact SG-CG1 3.56Å; C108-C244 WeakPolarHBondContact CA-SG 3.26Å; C108-C244 HydrophobicContact CB-CB 3.7Å; C108-C244 WeakPolarHBondContact CB-SG 3.22Å; C108-C244 VanDerWaalsContact SG-CA 3.58Å; C108-C244 WeakPolarHBondContact SG-CB 3.32Å; C108-C244 PolarHBondContact SG-N 3.4Å; C108-C244 CovalentContact SG-SG 2.02Å; C108-C244 PolarHBondContact SG-SG 3.22Å; C108-Y265 PolarHBondContact N-O 2.93Å; C108-S266 PolarHBondContact N-OG 3.23Å; C108-S266 VanDerWaalsContact N-OG 3.13Å
109	K	89.6	Confident	89.7	Confident	75 Å²	75	58.4 Å²	58.4	33%	0.326	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	136.4	178.9	-174.1	168.2	168.8	-159.9	0	111	K99 T107 T264 Y265	K99-K109 PolarHBondContact O-NZ 2.9Å; T107-K109 PolarHBondContact O-N 2.99Å; K109-T264 CarbonylContact O-C 3.54Å; K109-T264 WeakPolarHBondContact O-CA 3.21Å; K109-T264 WeakPolarHBondContact O-CB 3.1Å; K109-Y265 HydrophobicContact CB-CD1 4.32Å; K109-Y265 HydrophobicContact CB-CE1 3.95Å; K109-Y265 HydrophobicContact CB-CE2 4.39Å; K109-Y265 HydrophobicContact CD-CE1 4.14Å; K109-Y265 HydrophobicContact CD-CE2 4.26Å; K109-Y265 VanDerWaalsContact CD-OH 3.24Å; K109-Y265 WeakPolarHBondContact CD-OH 3.43Å; K109-Y265 WeakPolarHBondContact CE-OH 3.28Å; K109-Y265 HydrophobicContact CG-CE1 3.94Å; K109-Y265 PolarHBondContact N-O 3.22Å; K109-Y265 PolarHBondContact NZ-OH 2.85Å; K109-Y265 WeakPolarHBondContact O-CD1 3.26Å; K109-Y265 PolarHBondContact O-N 2.74Å
110	L	89.5	Confident	89.8	Confident	83 Å²	83	55 Å²	55	44%	0.435	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130.2	173.2	-176.4	64.3	0	0	0	110.7	V242 V262 T264	L110-V242 HydrophobicContact CB-CG2 4.32Å; L110-V242 HydrophobicContact CD1-CG2 4.25Å; L110-V262 HydrophobicContact CD1-CG1 3.36Å; L110-T264 HydrophobicContact CD1-CG2 4.46Å
111	L	89.2	Confident	89.7	Confident	30 Å²	30	58 Å²	58	16%	0.157	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-63.7	172.4	-172.5	69.6	0	0	0	110.9	C71 P97 Y98 Y263 Y265	C71-L111 HydrophobicContact CB-CD2 3.69Å; C71-L111 HydrophobicContact CB-CG 4.05Å; P97-L111 HydrophobicContact CB-CD1 3.92Å; P97-L111 HydrophobicContact CB-CG 4.49Å; P97-L111 HydrophobicContact CG-CD1 3.87Å; P97-L111 HydrophobicContact CG-CD2 4.13Å; P97-L111 HydrophobicContact CG-CG 4.08Å; Y98-L111 HydrophobicContact CD1-CD1 3.77Å; Y98-L111 HydrophobicContact CD1-CD2 4.17Å; Y98-L111 HydrophobicContact CE1-CD1 3.89Å; Y98-L111 HydrophobicContact CE1-CD2 3.44Å; Y98-L111 VanDerWaalsContact CE1-CD2 3.44Å; Y98-L111 HydrophobicContact CE1-CG 4.2Å; Y98-L111 HydrophobicContact CE2-CD2 4.01Å; Y98-L111 HydrophobicContact CG-CD1 4.2Å; Y98-L111 VanDerWaalsContact OH-CD2 3.26Å; Y98-L111 WeakPolarHBondContact OH-CD2 2.94Å; L111-Y263 WeakPolarHBondContact CB-O 3.21Å; L111-Y263 PolarHBondContact N-O 3.36Å; L111-Y265 HydrophobicContact CB-CD1 4.12Å; L111-Y265 HydrophobicContact CB-CE1 4.26Å; L111-Y265 HydrophobicContact CD1-CD1 4.22Å; L111-Y265 HydrophobicContact CD1-CE1 3.9Å
112	C	90.3	Very high	89.6	Confident	33 Å²	33	57.8 Å²	57.8	22%	0.223	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	164.2	174.4	90.2	0	0	0	0	110.5	C71 Y263	C71-C112 VanDerWaalsContact CA-SG 3.56Å; C71-C112 HydrophobicContact CB-CB 3.92Å; C71-C112 WeakPolarHBondContact CB-SG 3.47Å; C71-C112 WeakPolarHBondContact SG-CB 3.13Å; C71-C112 CovalentContact SG-SG 2.02Å; C71-C112 PolarHBondContact SG-SG 2.97Å; C112-Y263 PolarHBondContact O-N 3.21Å
113	S	88.6	Confident	89.6	Confident	44 Å²	44	58.5 Å²	58.5	31%	0.308	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.9	171.4	157.1	0	0	0	0	109.4	K239 D260 V261	S113-K239 WeakPolarHBondContact OG-CE 3.04Å; S113-D260 PolarHBondContact OG-OD1 2.86Å; S113-V261 CarbonylContact C-O 3.51Å; S113-V261 WeakPolarHBondContact CA-O 3.2Å
114	K	89.7	Confident	89.7	Confident	47 Å²	47	57.7 Å²	57.7	20%	0.204	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.9	178.2	-63.8	-73.1	-173	157.8	0	108.3	D69 F70 Y116 V261 Y263	D69-K114 IonicContact OD1-NZ 2.71Å; D69-K114 PolarHBondContact OD1-NZ 2.74Å; F70-K114 WeakPolarHBondContact O-CE 3.17Å; F70-K114 PolarHBondContact O-NZ 3.15Å; K114-Y116 HydrophobicContact CB-CE2 3.75Å; K114-V261 HydrophobicContact CB-CB 4.4Å; K114-V261 PolarHBondContact N-O 2.94Å; K114-V261 PolarHBondContact O-N 3.48Å; K114-Y263 HydrophobicContact CG-CD2 4.47Å; K114-Y263 HydrophobicContact CG-CE2 3.96Å
115	V	89.1	Confident	89.7	Confident	78 Å²	78	60.2 Å²	60.2	47%	0.473	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.7	178	-175.3	0	0	0	0	108.8	K239 L259	V115-K239 VanDerWaalsContact CG2-NZ 3.29Å; V115-L259 WeakPolarHBondContact CA-O 3.5Å
116	Y	90.1	Very high	89.6	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.008	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.1	178.2	-54.9	-79.1	0	0	0	109.8	D69 K114 D123 K126 V127 T258 L259 V261	D69-Y116 HydrophobicContact CB-CE1 4.47Å; D69-Y116 WeakPolarHBondContact CB-OH 3.39Å; D69-Y116 PolarHBondContact O-OH 3.46Å; D69-Y116 WeakPolarHBondContact OD2-CE1 3.32Å; D69-Y116 PolarHBondContact OD2-OH 3.08Å; K114-Y116 HydrophobicContact CB-CE2 3.75Å; Y116-D123 HydrophobicContact CD1-CB 4.02Å; Y116-K126 HydrophobicContact CD1-CB 4.47Å; Y116-K126 HydrophobicContact CE1-CB 3.99Å; Y116-K126 HydrophobicContact CE1-CD 4.16Å; Y116-V127 HydrophobicContact CD1-CG2 3.87Å; Y116-V127 HydrophobicContact CD2-CG2 3.91Å; Y116-V127 HydrophobicContact CE1-CG2 4.39Å; Y116-V127 HydrophobicContact CE2-CG2 4.43Å; Y116-V127 HydrophobicContact CG-CG2 3.59Å; Y116-T258 WeakPolarHBondContact O-CA 3.39Å; Y116-L259 HydrophobicContact CD2-CB 4.4Å; Y116-L259 HydrophobicContact CD2-CD2 4.09Å; Y116-L259 HydrophobicContact CD2-CG 4.45Å; Y116-L259 PolarHBondContact N-O 2.86Å; Y116-L259 PolarHBondContact O-N 3.3Å; Y116-V261 HydrophobicContact CD2-CG2 3.97Å; Y116-V261 HydrophobicContact CE2-CB 4.39Å; Y116-V261 HydrophobicContact CE2-CG2 3.53Å
117	N	89.9	Confident	89.5	Confident	74 Å²	74	58.6 Å²	58.6	40%	0.396	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.5	175.2	-172.9	-12.4	0	0	0	109.7	A119 N120 D123 K257	N117-A119 PolarHBondContact O-N 3.05Å; N117-A119 WeakPolarHBondContact OD1-CB 2.92Å; N117-A119 PolarHBondContact OD1-N 2.79Å; N117-A119 VanDerWaalsContact OD1-N 3.07Å; N117-N120 PolarHBondContact O-N 3.35Å; N117-D123 PolarHBondContact N-OD2 2.81Å; N117-K257 PolarHBondContact OD1-O 2.87Å
118	S	88.3	Confident	89.7	Confident	54 Å²	54	58.5 Å²	58.5	38%	0.378	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-17.2	179.5	64.5	0	0	0	0	114.1	N120 F256 K257	S118-N120 PolarHBondContact O-N 3.41Å; S118-F256 WeakPolarHBondContact CB-O 3.45Å; S118-F256 PolarHBondContact OG-O 2.8Å; S118-K257 PolarHBondContact N-O 3.26Å; S118-K257 PolarHBondContact OG-O 3.44Å
119	A	89.2	Confident	89.9	Confident	87 Å²	87	59 Å²	59	72%	0.719	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23	170.4	0	0	0	0	0	113.1	N117	N117-A119 PolarHBondContact O-N 3.05Å; N117-A119 WeakPolarHBondContact OD1-CB 2.92Å; N117-A119 PolarHBondContact OD1-N 2.79Å; N117-A119 VanDerWaalsContact OD1-N 3.07Å
120	N	90.3	Very high	89.9	Confident	72 Å²	72	55.4 Å²	55.4	39%	0.385	32%	0.318	S	S	.	.			trans	-99.2	113.3	-179.1	-177.8	5.4	0	0	0	111.2	N117 S118 A122 D123 V124	N117-N120 PolarHBondContact O-N 3.35Å; S118-N120 PolarHBondContact O-N 3.41Å; N120-A122 PolarHBondContact O-N 3.44Å; N120-A122 VanDerWaalsContact O-N 3.1Å; N120-A122 WeakPolarHBondContact OD1-CB 3.5Å; N120-A122 PolarHBondContact OD1-N 3.46Å; N120-D123 HydrophobicContact CB-CB 4.13Å; N120-D123 WeakPolarHBondContact CB-OD2 3.33Å; N120-D123 PolarHBondContact ND2-OD1 2.78Å; N120-D123 PolarHBondContact ND2-OD2 2.94Å; N120-D123 PolarHBondContact O-N 2.91Å; N120-V124 PolarHBondContact O-N 3.26Å; N120-V124 VanDerWaalsContact O-N 3.1Å
121	A	90.2	Very high	90	Very high	63 Å²	63	51.8 Å²	51.8	52%	0.521	30%	0.299	S	S	.	.	H	α-helix	trans	-60.9	-21	179	0	0	0	0	0	114.2	R125	A121-R125 WeakPolarHBondContact O-CG 3.48Å; A121-R125 PolarHBondContact O-N 2.93Å; A121-R125 PolarHBondContact O-NE 3.27Å; A121-R125 VanDerWaalsContact O-NE 3.07Å
122	A	90.5	Very high	90	Very high	40 Å²	40	54.9 Å²	54.9	33%	0.331	31%	0.313	S	S	.	.	H	α-helix	trans	-75	-40.4	173.3	0	0	0	0	0	111.9	N120 R125 K126	N120-A122 PolarHBondContact O-N 3.44Å; N120-A122 VanDerWaalsContact O-N 3.1Å; N120-A122 WeakPolarHBondContact OD1-CB 3.5Å; N120-A122 PolarHBondContact OD1-N 3.46Å; A122-R125 PolarHBondContact O-N 3.04Å; A122-K126 WeakPolarHBondContact O-CG 3.48Å; A122-K126 PolarHBondContact O-N 3.28Å; A122-K126 VanDerWaalsContact O-N 3.13Å
123	D	90.1	Very high	90	Very high	23 Å²	23	53.3 Å²	53.3	12%	0.123	30%	0.302	C	S	.	.	H	α-helix	trans	-69.6	-39.5	179.6	-66.2	-20.3	0	0	0	111.2	Y116 N117 N120 R125 K126 V127	Y116-D123 HydrophobicContact CD1-CB 4.02Å; N117-D123 PolarHBondContact N-OD2 2.81Å; N120-D123 HydrophobicContact CB-CB 4.13Å; N120-D123 WeakPolarHBondContact CB-OD2 3.33Å; N120-D123 PolarHBondContact ND2-OD1 2.78Å; N120-D123 PolarHBondContact ND2-OD2 2.94Å; N120-D123 PolarHBondContact O-N 2.91Å; D123-R125 VanDerWaalsContact C-N 3.3Å; D123-R125 PolarHBondContact O-N 3.02Å; D123-K126 PolarHBondContact O-N 3.22Å; D123-V127 WeakPolarHBondContact O-CG2 3.38Å; D123-V127 PolarHBondContact O-N 3.22Å
124	V	90	Very high	90	Very high	39 Å²	39	51.4 Å²	51.4	24%	0.236	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-44.9	172.1	176.1	0	0	0	0	111	N120 K126 V127 Q128 F256	N120-V124 PolarHBondContact O-N 3.26Å; N120-V124 VanDerWaalsContact O-N 3.1Å; V124-K126 PolarHBondContact O-N 3.45Å; V124-V127 PolarHBondContact O-N 3.34Å; V124-Q128 HydrophobicContact CG1-CG 4.4Å; V124-Q128 WeakPolarHBondContact O-CB 3.39Å; V124-Q128 VanDerWaalsContact O-CG 3.25Å; V124-Q128 WeakPolarHBondContact O-CG 3.45Å; V124-Q128 PolarHBondContact O-N 2.74Å; V124-F256 HydrophobicContact CG2-CZ 4.37Å
125	R	91	Very high	90	Very high	168 Å²	168	56.2 Å²	56.2	63%	0.634	31%	0.305	S	S	*	.	H	α-helix	trans	-64.1	-38.2	177.9	-79.8	-177.8	-84.7	169.4	-10	113	A121 A122 D123 Q128 A129	A121-R125 WeakPolarHBondContact O-CG 3.48Å; A121-R125 PolarHBondContact O-N 2.93Å; A121-R125 PolarHBondContact O-NE 3.27Å; A121-R125 VanDerWaalsContact O-NE 3.07Å; A122-R125 PolarHBondContact O-N 3.04Å; D123-R125 VanDerWaalsContact C-N 3.3Å; D123-R125 PolarHBondContact O-N 3.02Å; R125-Q128 PolarHBondContact O-N 3.16Å; R125-A129 WeakPolarHBondContact O-CB 3.36Å; R125-A129 PolarHBondContact O-N 3.44Å
126	K	91.2	Very high	89.9	Confident	82 Å²	82	54.4 Å²	54.4	36%	0.357	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-44.7	177.1	-71.2	162.5	159	-157.1	0	111.8	D69 Y116 A122 D123 V124 A129 L130	D69-K126 HydrophobicContact CB-CB 4.24Å; D69-K126 HydrophobicContact CB-CD 4.26Å; D69-K126 HydrophobicContact CB-CG 4.21Å; D69-K126 VanDerWaalsContact OD2-CD 3.25Å; D69-K126 WeakPolarHBondContact OD2-CD 3.27Å; D69-K126 VanDerWaalsContact OD2-CE 3.26Å; D69-K126 WeakPolarHBondContact OD2-CE 3.31Å; D69-K126 IonicContact OD2-NZ 3.89Å; D69-K126 PolarHBondContact OD2-NZ 3.19Å; Y116-K126 HydrophobicContact CD1-CB 4.47Å; Y116-K126 HydrophobicContact CE1-CB 3.99Å; Y116-K126 HydrophobicContact CE1-CD 4.16Å; A122-K126 WeakPolarHBondContact O-CG 3.48Å; A122-K126 PolarHBondContact O-N 3.28Å; A122-K126 VanDerWaalsContact O-N 3.13Å; D123-K126 PolarHBondContact O-N 3.22Å; V124-K126 PolarHBondContact O-N 3.45Å; K126-A129 WeakPolarHBondContact O-CB 3.28Å; K126-A129 PolarHBondContact O-N 3.15Å; K126-L130 PolarHBondContact O-N 3.08Å; K126-L130 VanDerWaalsContact O-N 3.11Å
127	V	90	Very high	89.8	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-41.6	175.9	176.5	0	0	0	0	110.8	Y116 D123 V124 A129 L130 I131 I252 F256 L259	Y116-V127 HydrophobicContact CD1-CG2 3.87Å; Y116-V127 HydrophobicContact CD2-CG2 3.91Å; Y116-V127 HydrophobicContact CE1-CG2 4.39Å; Y116-V127 HydrophobicContact CE2-CG2 4.43Å; Y116-V127 HydrophobicContact CG-CG2 3.59Å; D123-V127 WeakPolarHBondContact O-CG2 3.38Å; D123-V127 PolarHBondContact O-N 3.22Å; V124-V127 PolarHBondContact O-N 3.34Å; V127-A129 VanDerWaalsContact C-N 3.3Å; V127-A129 PolarHBondContact O-N 2.99Å; V127-L130 WeakPolarHBondContact O-CB 3.22Å; V127-L130 PolarHBondContact O-N 2.98Å; V127-I131 HydrophobicContact CG1-CD1 3.99Å; V127-I131 HydrophobicContact CG1-CG1 4.41Å; V127-I131 WeakPolarHBondContact O-CG1 3.25Å; V127-I131 PolarHBondContact O-N 3.34Å; V127-I252 HydrophobicContact CG1-CG2 3.6Å; V127-F256 HydrophobicContact CB-CD1 4.48Å; V127-F256 HydrophobicContact CB-CE1 3.58Å; V127-F256 HydrophobicContact CB-CZ 3.8Å; V127-F256 HydrophobicContact CG1-CD1 3.93Å; V127-F256 HydrophobicContact CG1-CE1 3.48Å; V127-F256 VanDerWaalsContact CG1-CE1 3.48Å; V127-F256 HydrophobicContact CG1-CZ 4.13Å; V127-F256 HydrophobicContact CG2-CE1 3.8Å; V127-F256 HydrophobicContact CG2-CE2 4.21Å; V127-F256 HydrophobicContact CG2-CZ 3.53Å; V127-L259 HydrophobicContact CG1-CD2 4.26Å; V127-L259 HydrophobicContact CG2-CD2 4.06Å
128	Q	90.6	Very high	89.9	Confident	110 Å²	110	52.4 Å²	52.4	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-37.8	173.5	-76.4	174.8	-12.5	0	0	112.7	V124 R125 I131 H132	V124-Q128 HydrophobicContact CG1-CG 4.4Å; V124-Q128 WeakPolarHBondContact O-CB 3.39Å; V124-Q128 VanDerWaalsContact O-CG 3.25Å; V124-Q128 WeakPolarHBondContact O-CG 3.45Å; V124-Q128 PolarHBondContact O-N 2.74Å; R125-Q128 PolarHBondContact O-N 3.16Å; Q128-I131 PolarHBondContact O-N 3.44Å; Q128-H132 WeakPolarHBondContact O-CB 3.26Å; Q128-H132 PolarHBondContact O-N 2.86Å
129	A	90.3	Very high	90	Very high	34 Å²	34	51.1 Å²	51.1	28%	0.281	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-43.5	175.1	0	0	0	0	0	111.7	F68 R125 K126 V127 H132 G133	F68-A129 WeakPolarHBondContact CE1-O 3.38Å; R125-A129 WeakPolarHBondContact O-CB 3.36Å; R125-A129 PolarHBondContact O-N 3.44Å; K126-A129 WeakPolarHBondContact O-CB 3.28Å; K126-A129 PolarHBondContact O-N 3.15Å; V127-A129 VanDerWaalsContact C-N 3.3Å; V127-A129 PolarHBondContact O-N 2.99Å; A129-H132 PolarHBondContact O-N 3.27Å; A129-G133 PolarHBondContact O-N 3.46Å
130	L	90.4	Very high	90.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-50.3	173.9	-67.6	170.7	0	0	0	111.2	F68 F70 K126 V127 H132 G133 I134 M166 L184	F68-L130 HydrophobicContact CB-CD2 4.2Å; F68-L130 HydrophobicContact CD1-CD2 4.21Å; F70-L130 HydrophobicContact CD1-CD2 4.29Å; F70-L130 HydrophobicContact CE1-CD2 3.58Å; F70-L130 HydrophobicContact CZ-CD2 3.92Å; K126-L130 PolarHBondContact O-N 3.08Å; K126-L130 VanDerWaalsContact O-N 3.11Å; V127-L130 WeakPolarHBondContact O-CB 3.22Å; V127-L130 PolarHBondContact O-N 2.98Å; L130-H132 VanDerWaalsContact C-N 3.35Å; L130-H132 PolarHBondContact O-N 2.91Å; L130-G133 PolarHBondContact O-N 3.44Å; L130-I134 VanDerWaalsContact O-CG1 3.26Å; L130-I134 WeakPolarHBondContact O-CG1 3.32Å; L130-I134 PolarHBondContact O-N 3.41Å; L130-M166 WeakPolarHBondContact O-CE 3.3Å; L130-L184 HydrophobicContact CD1-CD2 4.43Å; L130-L184 HydrophobicContact CD2-CD1 4.45Å
131	I	90.4	Very high	90.3	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-46.8	177.2	-66.9	171.8	0	0	0	111.1	V127 Q128 G133 I134 R135 F182 I252 E254	V127-I131 HydrophobicContact CG1-CD1 3.99Å; V127-I131 HydrophobicContact CG1-CG1 4.41Å; V127-I131 WeakPolarHBondContact O-CG1 3.25Å; V127-I131 PolarHBondContact O-N 3.34Å; Q128-I131 PolarHBondContact O-N 3.44Å; I131-G133 VanDerWaalsContact C-N 3.31Å; I131-G133 PolarHBondContact O-N 3.19Å; I131-I134 PolarHBondContact O-N 3.2Å; I131-I134 VanDerWaalsContact O-N 3.07Å; I131-R135 WeakPolarHBondContact O-CB 3.36Å; I131-R135 PolarHBondContact O-N 3.42Å; I131-F182 HydrophobicContact CG1-CD2 4.28Å; I131-F182 HydrophobicContact CG2-CD1 4.12Å; I131-F182 HydrophobicContact CG2-CD2 3.63Å; I131-F182 HydrophobicContact CG2-CE1 3.96Å; I131-F182 HydrophobicContact CG2-CE2 3.43Å; I131-F182 VanDerWaalsContact CG2-CE2 3.43Å; I131-F182 HydrophobicContact CG2-CG 3.97Å; I131-F182 HydrophobicContact CG2-CZ 3.61Å; I131-I252 HydrophobicContact CD1-CG2 3.74Å; I131-I252 HydrophobicContact CG1-CB 4.47Å; I131-I252 HydrophobicContact CG1-CG2 3.63Å; I131-E254 HydrophobicContact CD1-CB 4.5Å; I131-E254 HydrophobicContact CD1-CG 3.77Å
132	H	89.9	Confident	90.5	Very high	96 Å²	96	42.7 Å²	42.7	44%	0.444	21%	0.212	S	C	.	.	H	α-helix	trans	-59.4	-44.4	-179.8	179.3	68.2	0	0	0	111.4	Q128 A129 L130 I134 L136	Q128-H132 WeakPolarHBondContact O-CB 3.26Å; Q128-H132 PolarHBondContact O-N 2.86Å; A129-H132 PolarHBondContact O-N 3.27Å; L130-H132 VanDerWaalsContact C-N 3.35Å; L130-H132 PolarHBondContact O-N 2.91Å; H132-I134 VanDerWaalsContact C-N 3.32Å; H132-I134 PolarHBondContact O-N 3.02Å; H132-L136 VanDerWaalsContact NE2-CD1 3.28Å; H132-L136 WeakPolarHBondContact NE2-CD1 2.99Å; H132-L136 PolarHBondContact O-N 3.3Å; H132-L136 VanDerWaalsContact O-N 3.08Å
133	G	90.2	Very high	90.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-34.8	176.4	0	0	0	0	0	112.1	A129 L130 I131 R135 L136 G137 Y138 M166	A129-G133 PolarHBondContact O-N 3.46Å; L130-G133 PolarHBondContact O-N 3.44Å; I131-G133 VanDerWaalsContact C-N 3.31Å; I131-G133 PolarHBondContact O-N 3.19Å; G133-R135 VanDerWaalsContact C-N 3.34Å; G133-L136 CarbonylContact O-C 3.45Å; G133-L136 PolarHBondContact O-N 3.17Å; G133-G137 PolarHBondContact O-N 3.49Å; G133-Y138 WeakPolarHBondContact O-CD2 3.33Å; G133-Y138 PolarHBondContact O-N 3.44Å; G133-Y138 VanDerWaalsContact O-N 3.09Å; G133-M166 VanDerWaalsContact O-CE 3.26Å; G133-M166 WeakPolarHBondContact O-CE 3.33Å
134	I	88.9	Confident	90.6	Very high	3 Å²	3	40 Å²	40	2%	0.015	19%	0.192	C	C	.	.	H	α-helix	trans	-69	-44.1	-176.6	-70.2	164.8	0	0	0	107.6	L130 I131 H132 L136 G137 M166 F182 L184 I252	L130-I134 VanDerWaalsContact O-CG1 3.26Å; L130-I134 WeakPolarHBondContact O-CG1 3.32Å; L130-I134 PolarHBondContact O-N 3.41Å; I131-I134 PolarHBondContact O-N 3.2Å; I131-I134 VanDerWaalsContact O-N 3.07Å; H132-I134 VanDerWaalsContact C-N 3.32Å; H132-I134 PolarHBondContact O-N 3.02Å; I134-L136 VanDerWaalsContact C-N 3.26Å; I134-L136 PolarHBondContact O-N 2.81Å; I134-G137 PolarHBondContact O-N 3.12Å; I134-M166 HydrophobicContact CB-CE 4.2Å; I134-M166 HydrophobicContact CG1-CE 3.63Å; I134-M166 HydrophobicContact CG1-CG 4.11Å; I134-M166 HydrophobicContact CG1-SD 4.27Å; I134-F182 HydrophobicContact CB-CD1 4.35Å; I134-F182 HydrophobicContact CD1-CB 4.4Å; I134-F182 HydrophobicContact CG2-CB 4.4Å; I134-F182 HydrophobicContact CG2-CD1 3.99Å; I134-L184 HydrophobicContact CD1-CB 4.05Å; I134-L184 HydrophobicContact CD1-CD1 4.12Å; I134-I252 HydrophobicContact CD1-CD1 4.45Å
135	R	88.7	Confident	90.5	Very high	149 Å²	149	39 Å²	39	56%	0.562	19%	0.185	S	C	*	.	H	α-helix	trans	-55.2	-41.1	172.4	179.3	178.1	-103.7	160.1	-2.5	112.3	I131 G133 G137 F182	I131-R135 WeakPolarHBondContact O-CB 3.36Å; I131-R135 PolarHBondContact O-N 3.42Å; G133-R135 VanDerWaalsContact C-N 3.34Å; R135-G137 VanDerWaalsContact C-N 3.3Å; R135-F182 HydrophobicContact CB-CE1 4.02Å
136	L	87.7	Confident	90.3	Very high	39 Å²	39	33.3 Å²	33.3	20%	0.204	17%	0.167	C	C	.	.	H	α-helix	trans	-80.9	-6.7	176.9	-71.2	179.2	0	0	0	113.5	S56 N58 H132 G133 I134 Y138	S56-L136 PolarHBondContact OG-O 2.67Å; N58-L136 HydrophobicContact CB-CD2 4.16Å; N58-L136 PolarHBondContact ND2-O 2.61Å; H132-L136 VanDerWaalsContact NE2-CD1 3.28Å; H132-L136 WeakPolarHBondContact NE2-CD1 2.99Å; H132-L136 PolarHBondContact O-N 3.3Å; H132-L136 VanDerWaalsContact O-N 3.08Å; G133-L136 CarbonylContact O-C 3.45Å; G133-L136 PolarHBondContact O-N 3.17Å; I134-L136 VanDerWaalsContact C-N 3.26Å; I134-L136 PolarHBondContact O-N 2.81Å; L136-Y138 HydrophobicContact CB-CD2 3.86Å; L136-Y138 HydrophobicContact CB-CE2 3.69Å; L136-Y138 HydrophobicContact CD1-CE2 3.8Å; L136-Y138 HydrophobicContact CG-CE2 4.42Å
137	G	88.2	Confident	90.2	Very high	32 Å²	32	29.4 Å²	29.4	33%	0.33	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	44.7	178.6	0	0	0	0	0	113.4	G133 I134 R135	G133-G137 PolarHBondContact O-N 3.49Å; I134-G137 PolarHBondContact O-N 3.12Å; R135-G137 VanDerWaalsContact C-N 3.3Å
138	Y	92	Very high	90.3	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.008	16%	0.155	C	C	.	.			trans	-65.7	143.4	175.5	-82.9	-93.6	0	0	0	112.3	L54 D55 L61 Y63 G133 L136 M166	L54-Y138 HydrophobicContact CB-CD1 3.9Å; D55-Y138 VanDerWaalsContact C-CD1 3.45Å; D55-Y138 CarbonylContact O-C 3.56Å; D55-Y138 WeakPolarHBondContact O-CA 3.36Å; D55-Y138 VanDerWaalsContact O-CD1 3.31Å; D55-Y138 WeakPolarHBondContact O-CD1 3.18Å; L61-Y138 PolarHBondContact O-OH 2.79Å; L61-Y138 VanDerWaalsContact O-OH 3.06Å; Y63-Y138 AromaticContact CD2-CE1 3.75Å; Y63-Y138 HydrophobicContact CD2-CE1 3.75Å; Y63-Y138 HydrophobicContact CD2-CE2 4.45Å; Y63-Y138 AromaticContact CD2-CZ 3.64Å; Y63-Y138 WeakPolarHBondContact CD2-OH 3.24Å; Y63-Y138 HydrophobicContact CE2-CE1 4.32Å; Y63-Y138 HydrophobicContact CE2-CE2 4.47Å; Y63-Y138 AromaticContact CE2-CZ 3.76Å; Y63-Y138 WeakPolarHBondContact CE2-OH 3.43Å; G133-Y138 WeakPolarHBondContact O-CD2 3.33Å; G133-Y138 PolarHBondContact O-N 3.44Å; G133-Y138 VanDerWaalsContact O-N 3.09Å; L136-Y138 HydrophobicContact CB-CD2 3.86Å; L136-Y138 HydrophobicContact CB-CE2 3.69Å; L136-Y138 HydrophobicContact CD1-CE2 3.8Å; L136-Y138 HydrophobicContact CG-CE2 4.42Å; Y138-M166 PolarHBondContact O-N 3.35Å
139	T	91.3	Very high	90.3	Very high	28 Å²	28	24.9 Å²	24.9	17%	0.172	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.5	-179.1	77.8	0	0	0	0	112.5	L54 D55 H141 F164	L54-T139 WeakPolarHBondContact CA-O 3.48Å; D55-T139 PolarHBondContact O-N 3.2Å; D55-T139 PolarHBondContact OD1-OG1 3.23Å; T139-H141 PolarHBondContact OG1-CE1 3.49Å; T139-F164 CarbonylContact C-O 3.54Å; T139-F164 WeakPolarHBondContact CA-O 3.47Å
140	H	92.9	Very high	90.3	Very high	8 Å²	8	23.3 Å²	23.3	4%	0.037	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.5	174.8	-73.7	-68.3	0	0	0	111.2	Y65 F70 W142 G163 F164 M166	Y65-H140 AromaticContact CE2-CE1 3.76Å; Y65-H140 AromaticContact CE2-ND1 3.78Å; F70-H140 AromaticContact CD2-CE1 3.94Å; F70-H140 AromaticContact CE2-CE1 3.39Å; F70-H140 WeakPolarHBondContact CE2-CE1 3.43Å; F70-H140 AromaticContact CZ-CE1 3.54Å; F70-H140 AromaticContact CZ-NE2 3.81Å; H140-W142 AromaticContact CG-NE1 3.99Å; H140-W142 AromaticContact ND1-NE1 3.82Å; H140-G163 CarbonylContact O-C 3.46Å; H140-G163 WeakPolarHBondContact O-CA 3.25Å; H140-F164 HydrophobicContact CB-CD1 4.1Å; H140-F164 HydrophobicContact CB-CD2 4.19Å; H140-F164 HydrophobicContact CB-CE1 3.73Å; H140-F164 HydrophobicContact CB-CE2 3.82Å; H140-F164 HydrophobicContact CB-CG 4.31Å; H140-F164 HydrophobicContact CB-CZ 3.56Å; H140-F164 AromaticContact CD2-CD2 3.95Å; H140-F164 AromaticContact CD2-CE2 3.37Å; H140-F164 WeakPolarHBondContact CD2-CE2 3.21Å; H140-F164 AromaticContact CD2-CZ 3.85Å; H140-F164 AromaticContact CG-CE2 3.86Å; H140-F164 AromaticContact CG-CZ 3.88Å; H140-F164 PolarHBondContact N-O 2.93Å; H140-F164 PolarHBondContact O-N 2.99Å; H140-F164 VanDerWaalsContact O-N 3.09Å; H140-M166 VanDerWaalsContact NE2-CB 3.33Å; H140-M166 WeakPolarHBondContact NE2-CB 3.48Å
141	H	92.2	Very high	90.2	Very high	33 Å²	33	24 Å²	24	15%	0.153	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	98.6	173.2	-76.3	81.5	0	0	0	110.3	N52 D55 T139	N52-H141 WeakPolarHBondContact CA-O 3.15Å; N52-H141 HydrophobicContact CB-CB 4.19Å; N52-H141 WeakPolarHBondContact CB-O 3.37Å; N52-H141 PolarHBondContact N-O 3.35Å; D55-H141 IonicContact OD1-CE1 3.49Å; D55-H141 PolarHBondContact OD1-CE1 2.92Å; D55-H141 IonicContact OD1-ND1 2.82Å; D55-H141 PolarHBondContact OD1-ND1 3.2Å; D55-H141 IonicContact OD2-CE1 3.37Å; D55-H141 PolarHBondContact OD2-CE1 3.41Å; D55-H141 IonicContact OD2-ND1 3.6Å; D55-H141 IonicContact OD2-NE2 3.59Å; T139-H141 PolarHBondContact OG1-CE1 3.49Å
142	W	93.5	Very high	89.8	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.015	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	159.6	-179.3	-67	-0.9	0	0	0	112.2	V49 F50 V51 Y65 Y98 H140 P148 V149 F164 I188 F190	V49-W142 HydrophobicContact CG1-CE3 4.43Å; F50-W142 WeakPolarHBondContact O-CA 3.3Å; V51-W142 HydrophobicContact CG1-CD2 4.45Å; V51-W142 HydrophobicContact CG1-CG 4.36Å; V51-W142 HydrophobicContact CG1-CZ2 4.43Å; Y65-W142 HydrophobicContact CE2-CZ2 4.29Å; Y65-W142 AromaticContact CE2-NE1 3.9Å; Y98-W142 HydrophobicContact CD2-CH2 4.43Å; Y98-W142 AromaticContact CE2-CH2 3.4Å; Y98-W142 HydrophobicContact CE2-CH2 3.4Å; Y98-W142 VanDerWaalsContact CE2-CH2 3.4Å; Y98-W142 HydrophobicContact CE2-CZ2 4.02Å; Y98-W142 AromaticContact CE2-CZ3 3.83Å; Y98-W142 HydrophobicContact CE2-CZ3 3.83Å; Y98-W142 AromaticContact CZ-CH2 3.54Å; Y98-W142 VanDerWaalsContact OH-CH2 3.3Å; Y98-W142 WeakPolarHBondContact OH-CH2 3.5Å; H140-W142 AromaticContact CG-NE1 3.99Å; H140-W142 AromaticContact ND1-NE1 3.82Å; W142-P148 WeakPolarHBondContact O-CA 3.33Å; W142-V149 HydrophobicContact CB-CB 3.99Å; W142-V149 HydrophobicContact CB-CG2 3.66Å; W142-V149 PolarHBondContact O-N 2.94Å; W142-F164 AromaticContact CD2-CE1 3.6Å; W142-F164 HydrophobicContact CD2-CE1 3.6Å; W142-F164 AromaticContact CD2-CZ 3.74Å; W142-F164 HydrophobicContact CD2-CZ 3.74Å; W142-F164 AromaticContact CE2-CE1 3.94Å; W142-F164 AromaticContact CE2-CZ 3.6Å; W142-F164 AromaticContact CE3-CE1 3.59Å; W142-F164 HydrophobicContact CE3-CE1 3.59Å; W142-F164 AromaticContact CE3-CZ 3.74Å; W142-F164 HydrophobicContact CE3-CZ 3.74Å; W142-F164 HydrophobicContact CG-CE1 4.11Å; W142-F164 HydrophobicContact CH2-CE1 4.31Å; W142-F164 AromaticContact CH2-CZ 3.6Å; W142-F164 HydrophobicContact CH2-CZ 3.6Å; W142-F164 HydrophobicContact CZ2-CE1 4.32Å; W142-F164 AromaticContact CZ2-CZ 3.57Å; W142-F164 HydrophobicContact CZ2-CZ 3.57Å; W142-F164 AromaticContact CZ3-CE1 3.94Å; W142-F164 HydrophobicContact CZ3-CE1 3.94Å; W142-F164 AromaticContact CZ3-CZ 3.65Å; W142-F164 HydrophobicContact CZ3-CZ 3.65Å; W142-I188 HydrophobicContact CH2-CD1 3.18Å; W142-I188 HydrophobicContact CZ2-CD1 4.08Å; W142-I188 HydrophobicContact CZ3-CD1 3.64Å; W142-I188 HydrophobicContact CZ3-CG2 4.2Å; W142-F190 AromaticContact CE3-CE1 3.94Å; W142-F190 HydrophobicContact CE3-CE1 3.94Å; W142-F190 AromaticContact CE3-CZ 3.8Å; W142-F190 HydrophobicContact CE3-CZ 3.8Å; W142-F190 AromaticContact CZ3-CE1 3.98Å; W142-F190 HydrophobicContact CZ3-CE1 3.98Å; W142-F190 HydrophobicContact CZ3-CE2 4.31Å; W142-F190 AromaticContact CZ3-CZ 3.42Å; W142-F190 HydrophobicContact CZ3-CZ 3.42Å; W142-F190 VanDerWaalsContact CZ3-CZ 3.42Å
143	I	91.4	Very high	88.8	Confident	7 Å²	7	21.8 Å²	21.8	4%	0.036	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.3	-172	-51.1	163.2	0	0	0	109.5	F50 N52 I93 L147 R389	F50-I143 HydrophobicContact CB-CB 4.24Å; F50-I143 PolarHBondContact N-O 2.93Å; F50-I143 PolarHBondContact O-N 3.2Å; N52-I143 HydrophobicContact CB-CD1 4.31Å; I93-I143 HydrophobicContact CD1-CD1 3.73Å; I93-I143 HydrophobicContact CG1-CD1 3.92Å; I93-I143 HydrophobicContact CG2-CD1 4.11Å; I143-L147 VanDerWaalsContact CA-O 3.3Å; I143-L147 WeakPolarHBondContact CA-O 3.03Å; I143-R389 VanDerWaalsContact CD1-CZ 3.48Å
144	V	91.6	Very high	87.5	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	126.6	175	-179	0	0	0	0	108	V47 V49 N146 L147 V149 I212 V215	V47-V144 HydrophobicContact CG1-CG1 3.49Å; V47-V144 VanDerWaalsContact CG1-CG1 3.49Å; V49-V144 HydrophobicContact CB-CG2 4.26Å; V49-V144 HydrophobicContact CG1-CG2 4.06Å; V49-V144 HydrophobicContact CG2-CG2 3.89Å; V144-N146 PolarHBondContact O-N 3.32Å; V144-L147 PolarHBondContact N-O 3.14Å; V144-L147 WeakPolarHBondContact O-CA 3.41Å; V144-L147 WeakPolarHBondContact O-CB 3.44Å; V144-L147 PolarHBondContact O-N 2.74Å; V144-V149 HydrophobicContact CG2-CG2 3.93Å; V144-I212 HydrophobicContact CG1-CD1 4.24Å; V144-V215 HydrophobicContact CB-CB 4.49Å; V144-V215 HydrophobicContact CB-CG1 4.27Å; V144-V215 HydrophobicContact CB-CG2 3.99Å; V144-V215 HydrophobicContact CG1-CG2 4.04Å; V144-V215 HydrophobicContact CG2-CG1 4.1Å
145	D	88.3	Confident	86.1	Confident	18 Å²	18	32.3 Å²	32.3	10%	0.096	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	43.2	-174.9	-171.1	39	0	0	0	113.9	F33 L147 I212 R279	F33-D145 HydrophobicContact CE2-CB 4.19Å; F33-D145 HydrophobicContact CZ-CB 4.38Å; D145-L147 PolarHBondContact O-N 3.37Å; D145-I212 HydrophobicContact CB-CB 4.45Å; D145-I212 HydrophobicContact CB-CD1 4.29Å; D145-R279 IonicContact OD2-CZ 2.99Å; D145-R279 IonicContact OD2-NH1 3.66Å; D145-R279 PolarHBondContact OD2-NH1 2.78Å
146	N	86.9	Confident	84.9	Confident	47 Å²	47	28.1 Å²	28.1	25%	0.251	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	3.1	-174.6	-166.6	33.5	0	0	0	115.4	V144 A387 R389	V144-N146 PolarHBondContact O-N 3.32Å; N146-A387 PolarHBondContact ND2-O 2.64Å; N146-R389 PolarHBondContact O-NH2 3.17Å; N146-R389 PolarHBondContact OD1-NE 3.19Å
147	L	89.1	Confident	83.6	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	139.1	171.9	-67.4	167.6	0	0	0	110.9	I143 V144 D145 I213 R279 W280 I283	I143-L147 VanDerWaalsContact CA-O 3.3Å; I143-L147 WeakPolarHBondContact CA-O 3.03Å; V144-L147 PolarHBondContact N-O 3.14Å; V144-L147 WeakPolarHBondContact O-CA 3.41Å; V144-L147 WeakPolarHBondContact O-CB 3.44Å; V144-L147 PolarHBondContact O-N 2.74Å; D145-L147 PolarHBondContact O-N 3.37Å; L147-I213 VanDerWaalsContact CD1-O 3.28Å; L147-I213 WeakPolarHBondContact CD1-O 3.34Å; L147-R279 HydrophobicContact CD2-CG 4.24Å; L147-W280 HydrophobicContact CD2-CD2 4Å; L147-W280 HydrophobicContact CD2-CE3 4.48Å; L147-W280 HydrophobicContact CD2-CG 4.42Å; L147-W280 HydrophobicContact CD2-CH2 4.4Å; L147-W280 HydrophobicContact CD2-CZ2 3.88Å; L147-I283 HydrophobicContact CD2-CD1 4.1Å
148	P	90.8	Very high	82.3	Confident	16 Å²	16	34.4 Å²	34.4	10%	0.104	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.1	168.6	30.5	-33.6	0	0	0	110.5	W142 I162 W280 I283	W142-P148 WeakPolarHBondContact O-CA 3.33Å; P148-I162 HydrophobicContact CB-CG2 3.88Å; P148-W280 HydrophobicContact CG-CZ3 4.22Å; P148-I283 HydrophobicContact CG-CD1 3.6Å; P148-I283 HydrophobicContact CG-CG1 4.38Å; P148-I283 HydrophobicContact CG-CG2 4.36Å
149	V	92.4	Very high	81.2	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.006	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-72.2	134.3	172.2	177.5	0	0	0	0	109.3	W142 V144 G163 V215 A217	W142-V149 HydrophobicContact CB-CB 3.99Å; W142-V149 HydrophobicContact CB-CG2 3.66Å; W142-V149 PolarHBondContact O-N 2.94Å; V144-V149 HydrophobicContact CG2-CG2 3.93Å; V149-G163 WeakPolarHBondContact O-CA 3.35Å; V149-G163 PolarHBondContact O-N 3.47Å; V149-V215 HydrophobicContact CG1-CG1 4.42Å; V149-V215 HydrophobicContact CG2-CG1 3.87Å; V149-A217 HydrophobicContact CG1-CB 3.29Å
150	T	90.2	Very high	80.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	152	-178.9	56.9	0	0	0	0	112.6	I161 V215 K216 A217 Y282 I283 L286	T150-I161 CarbonylContact C-O 3.34Å; T150-I161 VanDerWaalsContact CA-O 3.29Å; T150-I161 WeakPolarHBondContact CA-O 3.41Å; T150-I161 WeakPolarHBondContact CB-O 3.22Å; T150-V215 PolarHBondContact N-O 3.39Å; T150-V215 VanDerWaalsContact N-O 3.08Å; T150-V215 PolarHBondContact OG1-O 3.43Å; T150-K216 CarbonylContact O-C 3.54Å; T150-K216 VanDerWaalsContact O-CA 3.23Å; T150-K216 WeakPolarHBondContact O-CA 3.42Å; T150-A217 PolarHBondContact O-N 3.39Å; T150-Y282 HydrophobicContact CG2-CE2 3.76Å; T150-I283 HydrophobicContact CG2-CG1 4.1Å; T150-L286 HydrophobicContact CG2-CD1 4.14Å
151	F	87.1	Confident	80.1	Confident	15 Å²	15	41.4 Å²	41.4	7%	0.066	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.9	174.5	169.5	-112.2	0	0	0	111	A153 C160 I161 G163 F164 A217 T218 P219 F231	F151-A153 HydrophobicContact CE1-CB 4.27Å; F151-A153 HydrophobicContact CZ-CB 4.46Å; F151-C160 CarbonylContact O-C 3.55Å; F151-C160 WeakPolarHBondContact O-CA 3.4Å; F151-C160 WeakPolarHBondContact O-CB 3.19Å; F151-I161 HydrophobicContact CB-CG1 4.24Å; F151-I161 HydrophobicContact CD1-CD1 4.04Å; F151-I161 HydrophobicContact CD1-CG1 3.98Å; F151-I161 PolarHBondContact N-O 3Å; F151-I161 PolarHBondContact O-N 3.09Å; F151-G163 WeakPolarHBondContact CB-O 3.11Å; F151-G163 PolarHBondContact N-O 3.32Å; F151-F164 HydrophobicContact CB-CB 3.81Å; F151-F164 HydrophobicContact CG-CB 4.13Å; F151-A217 WeakPolarHBondContact CD2-O 3.41Å; F151-T218 HydrophobicContact CD2-CG2 4.44Å; F151-P219 HydrophobicContact CD2-CG 4.34Å; F151-P219 HydrophobicContact CE2-CG 4.13Å; F151-F231 HydrophobicContact CE2-CE1 4.45Å; F151-F231 AromaticContact CZ-CE1 3.84Å; F151-F231 HydrophobicContact CZ-CE1 3.84Å; F151-F231 AromaticContact CZ-CZ 3.91Å; F151-F231 HydrophobicContact CZ-CZ 3.91Å
152	C	81.5	Confident	79.8	Confident	24 Å²	24	41.1 Å²	41.1	16%	0.162	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.6	176	-46.6	0	0	0	0	108.7	F154 C160	C152-F154 VanDerWaalsContact C-N 3.31Å; C152-F154 PolarHBondContact O-N 2.98Å; C152-C160 HydrophobicContact CB-CB 3.97Å; C152-C160 WeakPolarHBondContact CB-SG 3.22Å; C152-C160 WeakPolarHBondContact SG-CB 3.19Å; C152-C160 CovalentContact SG-SG 2.04Å; C152-C160 PolarHBondContact SG-SG 3.1Å
153	A	69.4	Low	79.6	Confident	31 Å²	31	40.9 Å²	40.9	26%	0.256	25%	0.251	S	S	.	.	S	Bend	trans	-69.8	-25.3	-175.3	0	0	0	0	0	113.8	F151 Q222	F151-A153 HydrophobicContact CE1-CB 4.27Å; F151-A153 HydrophobicContact CZ-CB 4.46Å; A153-Q222 PolarHBondContact O-NE2 3.07Å; A153-Q222 PolarHBondContact O-OE1 3.33Å
154	F	64.2	Low	79.5	Confident	110 Å²	110	40.6 Å²	40.6	48%	0.482	25%	0.249	S	C	.	.	S	Bend	trans	-132.3	138	174.6	-52.3	-89.9	0	0	0	111.2	C152 G156 S158 L229	C152-F154 VanDerWaalsContact C-N 3.31Å; C152-F154 PolarHBondContact O-N 2.98Å; F154-G156 PolarHBondContact O-N 3.39Å; F154-S158 PolarHBondContact N-OG 2.91Å; F154-S158 VanDerWaalsContact N-OG 3.14Å; F154-S158 PolarHBondContact O-OG 3.27Å; F154-L229 HydrophobicContact CZ-CD2 4.27Å
155	S	59.8	Low	79.5	Confident	114 Å²	114	41.9 Å²	41.9	80%	0.797	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	104.1	170	-175.4	0	0	0	0	110.5
156	G	62	Low	79.4	Confident	62 Å²	62	41.1 Å²	41.1	64%	0.639	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.9	-151.8	-178.2	0	0	0	0	0	112.9	F154 S158	F154-G156 PolarHBondContact O-N 3.39Å; G156-S158 PolarHBondContact O-N 2.85Å
157	N	61.2	Low	79.4	Confident	183 Å²	183	39.2 Å²	39.2	98%	0.979	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	27.2	175.3	-82.1	3.4	0	0	0	113.8
158	S	61	Low	79.2	Confident	20 Å²	20	41.5 Å²	41.5	14%	0.14	26%	0.259	C	S	.	.			trans	-76	149.8	-178.5	74.9	0	0	0	0	111.5	F154 G156 C160	F154-S158 PolarHBondContact N-OG 2.91Å; F154-S158 VanDerWaalsContact N-OG 3.14Å; F154-S158 PolarHBondContact O-OG 3.27Å; G156-S158 PolarHBondContact O-N 2.85Å; S158-C160 PolarHBondContact O-N 2.92Å; S158-C160 VanDerWaalsContact O-N 3.11Å
159	P	67.7	Low	78.6	Confident	101 Å²	101	43.1 Å²	43.1	66%	0.656	27%	0.268	S	S	*	.			trans	-65.5	115.8	176.5	26.8	-33.1	0	0	0	109.1
160	C	79.2	Confident	77.4	Confident	16 Å²	16	44.6 Å²	44.6	11%	0.108	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	150.2	169	-46.5	0	0	0	0	109.8	F151 C152 S158 L286	F151-C160 CarbonylContact O-C 3.55Å; F151-C160 WeakPolarHBondContact O-CA 3.4Å; F151-C160 WeakPolarHBondContact O-CB 3.19Å; C152-C160 HydrophobicContact CB-CB 3.97Å; C152-C160 WeakPolarHBondContact CB-SG 3.22Å; C152-C160 WeakPolarHBondContact SG-CB 3.19Å; C152-C160 CovalentContact SG-SG 2.04Å; C152-C160 PolarHBondContact SG-SG 3.1Å; S158-C160 PolarHBondContact O-N 2.92Å; S158-C160 VanDerWaalsContact O-N 3.11Å; C160-L286 HydrophobicContact CB-CD1 3.91Å; C160-L286 HydrophobicContact CB-CD2 3.54Å; C160-L286 HydrophobicContact CB-CG 4.34Å
161	I	82.1	Confident	75.7	Confident	68 Å²	68	50.8 Å²	50.8	35%	0.349	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	156.2	173.1	59.5	172.1	0	0	0	110	T150 F151	T150-I161 CarbonylContact C-O 3.34Å; T150-I161 VanDerWaalsContact CA-O 3.29Å; T150-I161 WeakPolarHBondContact CA-O 3.41Å; T150-I161 WeakPolarHBondContact CB-O 3.22Å; F151-I161 HydrophobicContact CB-CG1 4.24Å; F151-I161 HydrophobicContact CD1-CD1 4.04Å; F151-I161 HydrophobicContact CD1-CG1 3.98Å; F151-I161 PolarHBondContact N-O 3Å; F151-I161 PolarHBondContact O-N 3.09Å
162	I	86.5	Confident	73.6	Confident	26 Å²	26	55.1 Å²	55.1	13%	0.133	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	133.9	170.4	-64.7	168.3	0	0	0	107.8	P148 I283 T544	P148-I162 HydrophobicContact CB-CG2 3.88Å; I162-I283 HydrophobicContact CD1-CG2 3.82Å; I162-I283 HydrophobicContact CG1-CG2 4.08Å; I162-T544 HydrophobicContact CD1-CG2 3.4Å; I162-T544 VanDerWaalsContact CD1-CG2 3.4Å
163	G	89.3	Confident	71.8	Confident	0 Å²	0	60 Å²	60	0%	0	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	74.3	-176.5	-172.8	0	0	0	0	0	113.2	H140 V149 F151	H140-G163 CarbonylContact O-C 3.46Å; H140-G163 WeakPolarHBondContact O-CA 3.25Å; V149-G163 WeakPolarHBondContact O-CA 3.35Å; V149-G163 PolarHBondContact O-N 3.47Å; F151-G163 WeakPolarHBondContact CB-O 3.11Å; F151-G163 PolarHBondContact N-O 3.32Å
164	F	90	Very high	70.5	Confident	1 Å²	1	63.2 Å²	63.2	0%	0.004	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	144.4	175.4	56.9	-83.2	0	0	0	109.8	T139 H140 W142 F151 I188 A217 P219	T139-F164 CarbonylContact C-O 3.54Å; T139-F164 WeakPolarHBondContact CA-O 3.47Å; H140-F164 HydrophobicContact CB-CD1 4.1Å; H140-F164 HydrophobicContact CB-CD2 4.19Å; H140-F164 HydrophobicContact CB-CE1 3.73Å; H140-F164 HydrophobicContact CB-CE2 3.82Å; H140-F164 HydrophobicContact CB-CG 4.31Å; H140-F164 HydrophobicContact CB-CZ 3.56Å; H140-F164 AromaticContact CD2-CD2 3.95Å; H140-F164 AromaticContact CD2-CE2 3.37Å; H140-F164 WeakPolarHBondContact CD2-CE2 3.21Å; H140-F164 AromaticContact CD2-CZ 3.85Å; H140-F164 AromaticContact CG-CE2 3.86Å; H140-F164 AromaticContact CG-CZ 3.88Å; H140-F164 PolarHBondContact N-O 2.93Å; H140-F164 PolarHBondContact O-N 2.99Å; H140-F164 VanDerWaalsContact O-N 3.09Å; W142-F164 AromaticContact CD2-CE1 3.6Å; W142-F164 HydrophobicContact CD2-CE1 3.6Å; W142-F164 AromaticContact CD2-CZ 3.74Å; W142-F164 HydrophobicContact CD2-CZ 3.74Å; W142-F164 AromaticContact CE2-CE1 3.94Å; W142-F164 AromaticContact CE2-CZ 3.6Å; W142-F164 AromaticContact CE3-CE1 3.59Å; W142-F164 HydrophobicContact CE3-CE1 3.59Å; W142-F164 AromaticContact CE3-CZ 3.74Å; W142-F164 HydrophobicContact CE3-CZ 3.74Å; W142-F164 HydrophobicContact CG-CE1 4.11Å; W142-F164 HydrophobicContact CH2-CE1 4.31Å; W142-F164 AromaticContact CH2-CZ 3.6Å; W142-F164 HydrophobicContact CH2-CZ 3.6Å; W142-F164 HydrophobicContact CZ2-CE1 4.32Å; W142-F164 AromaticContact CZ2-CZ 3.57Å; W142-F164 HydrophobicContact CZ2-CZ 3.57Å; W142-F164 AromaticContact CZ3-CE1 3.94Å; W142-F164 HydrophobicContact CZ3-CE1 3.94Å; W142-F164 AromaticContact CZ3-CZ 3.65Å; W142-F164 HydrophobicContact CZ3-CZ 3.65Å; F151-F164 HydrophobicContact CB-CB 3.81Å; F151-F164 HydrophobicContact CG-CB 4.13Å; F164-I188 HydrophobicContact CE2-CD1 3.72Å; F164-I188 HydrophobicContact CE2-CG1 4.32Å; F164-I188 HydrophobicContact CZ-CD1 3.7Å; F164-A217 HydrophobicContact CD1-CB 4.22Å; F164-A217 HydrophobicContact CE1-CB 4.34Å; F164-P219 HydrophobicContact CB-CG 4.32Å; F164-P219 HydrophobicContact CD2-CB 4.49Å; F164-P219 HydrophobicContact CD2-CG 4.25Å
165	P	90.2	Very high	69.6	Low	27 Å²	27	60.6 Å²	60.6	18%	0.175	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	150.2	174.2	24.1	-34.1	0	0	0	110.6	G167 F185	P165-G167 VanDerWaalsContact C-N 3.31Å; P165-F185 HydrophobicContact CB-CE2 4.14Å; P165-F185 HydrophobicContact CG-CD2 4.37Å; P165-F185 HydrophobicContact CG-CE2 3.73Å; P165-F185 VanDerWaalsContact O-CD2 3.24Å; P165-F185 WeakPolarHBondContact O-CD2 3.38Å
166	M	87.8	Confident	68.9	Low	1 Å²	1	59.7 Å²	59.7	1%	0.005	38%	0.384	C	S	.	.	S	Bend	trans	-79.8	-17.7	173.4	69.8	163	174.7	0	0	113.5	L54 F68 F70 L130 G133 I134 Y138 H140 L184 F185	L54-M166 HydrophobicContact CD2-SD 4.47Å; F68-M166 HydrophobicContact CE1-CE 4.36Å; F70-M166 HydrophobicContact CZ-SD 3.89Å; L130-M166 WeakPolarHBondContact O-CE 3.3Å; G133-M166 VanDerWaalsContact O-CE 3.26Å; G133-M166 WeakPolarHBondContact O-CE 3.33Å; I134-M166 HydrophobicContact CB-CE 4.2Å; I134-M166 HydrophobicContact CG1-CE 3.63Å; I134-M166 HydrophobicContact CG1-CG 4.11Å; I134-M166 HydrophobicContact CG1-SD 4.27Å; Y138-M166 PolarHBondContact O-N 3.35Å; H140-M166 VanDerWaalsContact NE2-CB 3.33Å; H140-M166 WeakPolarHBondContact NE2-CB 3.48Å; M166-L184 WeakPolarHBondContact O-CD1 3.49Å; M166-F185 PolarHBondContact O-N 3.46Å
167	G	86	Confident	68.4	Low	7 Å²	7	61 Å²	61	7%	0.072	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	178.7	-178.4	0	0	0	0	0	111.7	P165 F183	P165-G167 VanDerWaalsContact C-N 3.31Å; G167-F183 CarbonylContact C-O 3.42Å; G167-F183 WeakPolarHBondContact CA-O 3.46Å
168	V	84.1	Confident	67.9	Low	49 Å²	49	55.8 Å²	55.8	30%	0.297	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	146.3	179.1	63.5	0	0	0	0	110.3	F183 F185 T233	V168-F183 HydrophobicContact CG1-CB 3.85Å; V168-F183 HydrophobicContact CG1-CD2 4.16Å; V168-F183 HydrophobicContact CG1-CG 4.38Å; V168-F183 PolarHBondContact N-O 3.41Å; V168-F183 WeakPolarHBondContact O-CB 3.28Å; V168-F183 PolarHBondContact O-N 3.42Å; V168-F185 HydrophobicContact CB-CZ 4.07Å; V168-F185 HydrophobicContact CG1-CE1 4.17Å; V168-F185 HydrophobicContact CG1-CZ 3.86Å; V168-T233 HydrophobicContact CG1-CG2 3.81Å
169	T	78.7	Confident	67.4	Low	50 Å²	50	58.1 Å²	58.1	31%	0.307	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	136.8	172.2	-31.5	0	0	0	0	108.5	T171 F182	T169-T171 PolarHBondContact O-N 2.76Å; T169-F182 HydrophobicContact CG2-CD1 3.86Å; T169-F182 HydrophobicContact CG2-CE1 3.74Å
170	S	67.2	Low	67.3	Low	31 Å²	31	59.2 Å²	59.2	22%	0.217	38%	0.377	C	S	.	.			trans	-58	123	172.7	-168.9	0	0	0	0	110.3	A181	S170-A181 PolarHBondContact N-O 3.36Å
171	T	54.8	Low	67.1	Low	131 Å²	131	58.6 Å²	58.6	80%	0.804	37%	0.373	S	S	*	.			trans	-101.3	13.1	173.9	55.1	0	0	0	0	112.9	T169 P173	T169-T171 PolarHBondContact O-N 2.76Å; T171-P173 WeakPolarHBondContact O-CD 3.46Å
172	E	43.3	Very low	67.1	Low	106 Å²	106	55.6 Å²	55.6	50%	0.495	36%	0.358	S	S	.	.			trans	-84.5	111.6	177.7	-75.4	-166.2	-174.6	0	0	112.4	S174 S175	E172-S174 VanDerWaalsContact C-N 3.26Å; E172-S175 PolarHBondContact OE2-OG 2.85Å
173	P	43.2	Very low	66.9	Low	127 Å²	127	55.2 Å²	55.2	83%	0.825	36%	0.355	S	S	*	.	S	Bend	trans	-74.4	-12.9	163	28.9	-34	0	0	0	113.2	T171	T171-P173 WeakPolarHBondContact O-CD 3.46Å
174	S	43.2	Very low	66.7	Low	98 Å²	98	55.2 Å²	55.2	69%	0.685	36%	0.355	S	S	*	.	S	Bend	trans	-78.2	-19.2	-173.2	41.6	0	0	0	0	114.9	E172	E172-S174 VanDerWaalsContact C-N 3.26Å
175	S	43.7	Very low	66.5	Low	55 Å²	55	55.5 Å²	55.5	39%	0.385	36%	0.357	S	S	.	.			trans	-111.2	87.8	177.4	-60.6	0	0	0	0	109.5	E172 A177 N178	E172-S175 PolarHBondContact OE2-OG 2.85Å; S175-A177 PolarHBondContact O-N 3.33Å; S175-N178 PolarHBondContact O-N 2.92Å
176	A	46.3	Very low	66.3	Low	95 Å²	95	54.3 Å²	54.3	79%	0.785	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-18.3	179.7	0	0	0	0	0	114.5
177	A	50.2	Low	66.2	Low	89 Å²	89	54.3 Å²	54.3	74%	0.736	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-19.2	179.1	0	0	0	0	0	115.4	S175	S175-A177 PolarHBondContact O-N 3.33Å
178	N	51.6	Low	66.4	Low	73 Å²	73	54.2 Å²	54.2	39%	0.39	35%	0.347	S	S	.	.			trans	-133.1	24.9	-171.7	-79.5	-20.5	0	0	0	114.2	S175 N180 A181	S175-N178 PolarHBondContact O-N 2.92Å; N178-N180 PolarHBondContact O-N 3.01Å; N178-A181 HydrophobicContact CB-CB 4.3Å; N178-A181 PolarHBondContact O-N 3.26Å
179	S	50.6	Low	66.7	Low	69 Å²	69	52.6 Å²	52.6	48%	0.483	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-13.7	-176.1	51.9	0	0	0	0	115.2
180	N	64.9	Low	67.3	Low	124 Å²	124	50.3 Å²	50.3	66%	0.663	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	27.1	178.2	-69.7	-27.5	0	0	0	113.6	N178	N178-N180 PolarHBondContact O-N 3.01Å
181	A	74.7	Confident	68.5	Low	4 Å²	4	51.5 Å²	51.5	3%	0.033	33%	0.326	C	S	.	.			trans	-79.4	126.4	176.9	0	0	0	0	0	111.5	S170 N178 F183 T251	S170-A181 PolarHBondContact N-O 3.36Å; N178-A181 HydrophobicContact CB-CB 4.3Å; N178-A181 PolarHBondContact O-N 3.26Å; A181-F183 HydrophobicContact CB-CE2 4.27Å; A181-F183 HydrophobicContact CB-CZ 4.2Å; A181-T251 HydrophobicContact CB-CG2 3.96Å
182	F	82.3	Confident	70.4	Confident	5 Å²	5	45.3 Å²	45.3	2%	0.022	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.4	170.6	-59.5	-83.9	0	0	0	109.6	I131 I134 R135 T169 I252 E254	I131-F182 HydrophobicContact CG1-CD2 4.28Å; I131-F182 HydrophobicContact CG2-CD1 4.12Å; I131-F182 HydrophobicContact CG2-CD2 3.63Å; I131-F182 HydrophobicContact CG2-CE1 3.96Å; I131-F182 HydrophobicContact CG2-CE2 3.43Å; I131-F182 VanDerWaalsContact CG2-CE2 3.43Å; I131-F182 HydrophobicContact CG2-CG 3.97Å; I131-F182 HydrophobicContact CG2-CZ 3.61Å; I134-F182 HydrophobicContact CB-CD1 4.35Å; I134-F182 HydrophobicContact CD1-CB 4.4Å; I134-F182 HydrophobicContact CG2-CB 4.4Å; I134-F182 HydrophobicContact CG2-CD1 3.99Å; R135-F182 HydrophobicContact CB-CE1 4.02Å; T169-F182 HydrophobicContact CG2-CD1 3.86Å; T169-F182 HydrophobicContact CG2-CE1 3.74Å; F182-I252 HydrophobicContact CB-CB 4.43Å; F182-I252 PolarHBondContact N-O 3.14Å; F182-I252 PolarHBondContact O-N 3.49Å; F182-E254 HydrophobicContact CE2-CG 4.48Å
183	F	82.7	Confident	72.8	Confident	17 Å²	17	42 Å²	42	8%	0.075	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.4	178	-61.1	-79.2	0	0	0	109.1	G167 V168 A181 T233 D234 L249 T251	G167-F183 CarbonylContact C-O 3.42Å; G167-F183 WeakPolarHBondContact CA-O 3.46Å; V168-F183 HydrophobicContact CG1-CB 3.85Å; V168-F183 HydrophobicContact CG1-CD2 4.16Å; V168-F183 HydrophobicContact CG1-CG 4.38Å; V168-F183 PolarHBondContact N-O 3.41Å; V168-F183 WeakPolarHBondContact O-CB 3.28Å; V168-F183 PolarHBondContact O-N 3.42Å; A181-F183 HydrophobicContact CB-CE2 4.27Å; A181-F183 HydrophobicContact CB-CZ 4.2Å; F183-T233 HydrophobicContact CB-CG2 3.77Å; F183-T233 HydrophobicContact CD1-CG2 3.91Å; F183-T233 WeakPolarHBondContact CD1-OG1 3.13Å; F183-T233 HydrophobicContact CD2-CG2 4.13Å; F183-T233 HydrophobicContact CE1-CG2 4.49Å; F183-T233 WeakPolarHBondContact CE1-OG1 3.17Å; F183-T233 HydrophobicContact CG-CG2 3.68Å; F183-D234 WeakPolarHBondContact CA-OD2 3.39Å; F183-D234 WeakPolarHBondContact CB-OD2 2.98Å; F183-L249 HydrophobicContact CE1-CB 4Å; F183-L249 HydrophobicContact CE1-CD1 4.05Å; F183-L249 HydrophobicContact CZ-CD1 4.45Å; F183-T251 HydrophobicContact CD1-CG2 3.87Å; F183-T251 HydrophobicContact CE1-CG2 3.34Å; F183-T251 HydrophobicContact CZ-CG2 3.96Å
184	L	85.1	Confident	75.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.6	-178.1	172.6	75.3	0	0	0	109.2	F70 L130 I134 M166 N186 D234 I252 V261 Y263	F70-L184 HydrophobicContact CE1-CD1 4.38Å; L130-L184 HydrophobicContact CD1-CD2 4.43Å; L130-L184 HydrophobicContact CD2-CD1 4.45Å; I134-L184 HydrophobicContact CD1-CB 4.05Å; I134-L184 HydrophobicContact CD1-CD1 4.12Å; M166-L184 WeakPolarHBondContact O-CD1 3.49Å; L184-N186 PolarHBondContact O-N 3.24Å; L184-D234 PolarHBondContact N-OD2 3.16Å; L184-D234 VanDerWaalsContact O-OD2 3.08Å; L184-I252 HydrophobicContact CB-CD1 3.5Å; L184-I252 VanDerWaalsContact CB-CD1 3.5Å; L184-I252 HydrophobicContact CB-CG1 4.23Å; L184-I252 HydrophobicContact CD2-CD1 3.8Å; L184-I252 HydrophobicContact CG-CD1 4.19Å; L184-V261 HydrophobicContact CD2-CG1 3.83Å; L184-Y263 HydrophobicContact CD2-CE1 4.46Å
185	F	86.1	Confident	77.3	Confident	7 Å²	7	33.8 Å²	33.8	3%	0.031	21%	0.21	C	C	.	.			trans	-68.5	93.7	-179.8	-62	-43	0	0	0	112.1	P165 M166 V168 P219 F231 T233 D234	P165-F185 HydrophobicContact CB-CE2 4.14Å; P165-F185 HydrophobicContact CG-CD2 4.37Å; P165-F185 HydrophobicContact CG-CE2 3.73Å; P165-F185 VanDerWaalsContact O-CD2 3.24Å; P165-F185 WeakPolarHBondContact O-CD2 3.38Å; M166-F185 PolarHBondContact O-N 3.46Å; V168-F185 HydrophobicContact CB-CZ 4.07Å; V168-F185 HydrophobicContact CG1-CE1 4.17Å; V168-F185 HydrophobicContact CG1-CZ 3.86Å; F185-P219 HydrophobicContact CB-CB 3.49Å; F185-P219 VanDerWaalsContact CB-CB 3.49Å; F185-P219 HydrophobicContact CB-CG 4.49Å; F185-P219 HydrophobicContact CD1-CB 3.95Å; F185-P219 HydrophobicContact CD2-CB 3.73Å; F185-P219 HydrophobicContact CD2-CG 3.84Å; F185-P219 HydrophobicContact CE2-CB 4.45Å; F185-P219 HydrophobicContact CE2-CG 4.19Å; F185-P219 HydrophobicContact CG-CB 3.45Å; F185-P219 VanDerWaalsContact CG-CB 3.45Å; F185-P219 HydrophobicContact CG-CG 4.07Å; F185-F231 HydrophobicContact CE1-CD1 4.28Å; F185-F231 HydrophobicContact CZ-CD1 4.27Å; F185-F231 HydrophobicContact CZ-CE1 4.37Å; F185-T233 HydrophobicContact CE1-CG2 4.46Å; F185-D234 WeakPolarHBondContact CA-OD1 3.24Å; F185-D234 WeakPolarHBondContact CD1-OD1 3.25Å; F185-D234 PolarHBondContact N-OD1 3.23Å
186	N	85.4	Confident	79.4	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	20%	0.202	C	C	.	.			trans	-89.4	-22.6	-178.4	67.8	-16.8	0	0	0	113.4	L184 D234 I235 V261 V262 Y263 T264	L184-N186 PolarHBondContact O-N 3.24Å; N186-D234 WeakPolarHBondContact OD1-CA 3.07Å; N186-I235 PolarHBondContact ND2-O 3.01Å; N186-I235 PolarHBondContact OD1-N 3.35Å; N186-V261 HydrophobicContact CB-CG1 4.47Å; N186-V262 PolarHBondContact ND2-O 3.29Å; N186-Y263 HydrophobicContact CB-CD1 4.29Å; N186-Y263 WeakPolarHBondContact O-CA 3.43Å; N186-T264 PolarHBondContact O-N 3.46Å
187	H	87.2	Confident	81	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.3	-179.1	-176.5	65.5	0	0	0	112	D189 P219 S220 I235 C244 T264 S266	H187-D189 IonicContact CD2-OD1 3.81Å; H187-D189 IonicContact CE1-OD1 2.89Å; H187-D189 IonicContact NE2-OD1 3.86Å; H187-D189 PolarHBondContact NE2-OD1 2.69Å; H187-D189 IonicContact NE2-OD2 3.98Å; H187-P219 WeakPolarHBondContact O-CA 3.11Å; H187-S220 PolarHBondContact O-N 2.9Å; H187-I235 HydrophobicContact CB-CD1 3.82Å; H187-C244 PolarHBondContact CE1-SG 3.33Å; H187-T264 WeakPolarHBondContact CA-O 3.28Å; H187-T264 PolarHBondContact ND1-O 3.14Å; H187-T264 PolarHBondContact ND1-OG1 3.46Å; H187-S266 PolarHBondContact CE1-OG 3.49Å; H187-S266 VanDerWaalsContact CE1-OG 3.28Å; H187-S266 PolarHBondContact NE2-OG 2.84Å
188	I	89.7	Confident	82.2	Confident	6 Å²	6	27.5 Å²	27.5	3%	0.031	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	120.9	-178.1	-62.6	166	0	0	0	110.9	W142 F164 F190 A217 T264 Y265 S266	W142-I188 HydrophobicContact CH2-CD1 3.18Å; W142-I188 HydrophobicContact CZ2-CD1 4.08Å; W142-I188 HydrophobicContact CZ3-CD1 3.64Å; W142-I188 HydrophobicContact CZ3-CG2 4.2Å; F164-I188 HydrophobicContact CE2-CD1 3.72Å; F164-I188 HydrophobicContact CE2-CG1 4.32Å; F164-I188 HydrophobicContact CZ-CD1 3.7Å; I188-F190 HydrophobicContact CG2-CD2 4.25Å; I188-F190 HydrophobicContact CG2-CE2 4.05Å; I188-F190 HydrophobicContact CG2-CZ 4.25Å; I188-A217 HydrophobicContact CG2-CB 3.93Å; I188-T264 PolarHBondContact N-O 3Å; I188-T264 VanDerWaalsContact N-O 3.08Å; I188-Y265 CarbonylContact O-C 3.57Å; I188-Y265 WeakPolarHBondContact O-CA 3.39Å; I188-Y265 WeakPolarHBondContact O-CB 3.48Å; I188-S266 PolarHBondContact O-N 3Å
189	D	89.4	Confident	83.1	Confident	15 Å²	15	29.8 Å²	29.8	8%	0.08	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	111.2	172.6	-81.6	-25.1	0	0	0	109.3	H187 A217 T218 R221 S266	H187-D189 IonicContact CD2-OD1 3.81Å; H187-D189 IonicContact CE1-OD1 2.89Å; H187-D189 IonicContact NE2-OD1 3.86Å; H187-D189 PolarHBondContact NE2-OD1 2.69Å; H187-D189 IonicContact NE2-OD2 3.98Å; D189-A217 WeakPolarHBondContact O-CA 3.46Å; D189-T218 WeakPolarHBondContact CB-OG1 3.38Å; D189-T218 PolarHBondContact N-O 3.09Å; D189-T218 PolarHBondContact O-N 3.22Å; D189-T218 PolarHBondContact O-OG1 3.41Å; D189-R221 WeakPolarHBondContact OD2-CG 3.17Å; D189-R221 IonicContact OD2-CZ 3.94Å; D189-R221 IonicContact OD2-NE 3.09Å; D189-R221 PolarHBondContact OD2-NE 3.34Å; D189-R221 IonicContact OD2-NH2 3.82Å; D189-S266 WeakPolarHBondContact OD1-CB 3.27Å; D189-S266 PolarHBondContact OD1-OG 2.93Å
190	F	92.4	Very high	83.9	Confident	1 Å²	1	28.1 Å²	28.1	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	125.8	170.9	-68.7	-84	0	0	0	110.5	V49 Y98 I100 W142 I188 I192 V215 A217 S266 V267 T268	V49-F190 HydrophobicContact CG1-CZ 4.46Å; Y98-F190 AromaticContact CD1-CE2 3.92Å; Y98-F190 HydrophobicContact CD1-CE2 3.92Å; Y98-F190 HydrophobicContact CD1-CZ 4.4Å; Y98-F190 HydrophobicContact CE1-CE2 4.1Å; Y98-F190 HydrophobicContact CG-CE2 4.32Å; Y98-F190 HydrophobicContact CG-CZ 4.4Å; I100-F190 HydrophobicContact CD1-CD2 4.17Å; I100-F190 HydrophobicContact CD1-CE2 4.26Å; I100-F190 HydrophobicContact CD1-CG 4.29Å; I100-F190 HydrophobicContact CD1-CZ 4.46Å; W142-F190 AromaticContact CE3-CE1 3.94Å; W142-F190 HydrophobicContact CE3-CE1 3.94Å; W142-F190 AromaticContact CE3-CZ 3.8Å; W142-F190 HydrophobicContact CE3-CZ 3.8Å; W142-F190 AromaticContact CZ3-CE1 3.98Å; W142-F190 HydrophobicContact CZ3-CE1 3.98Å; W142-F190 HydrophobicContact CZ3-CE2 4.31Å; W142-F190 AromaticContact CZ3-CZ 3.42Å; W142-F190 HydrophobicContact CZ3-CZ 3.42Å; W142-F190 VanDerWaalsContact CZ3-CZ 3.42Å; I188-F190 HydrophobicContact CG2-CD2 4.25Å; I188-F190 HydrophobicContact CG2-CE2 4.05Å; I188-F190 HydrophobicContact CG2-CZ 4.25Å; F190-I192 HydrophobicContact CB-CG1 4.48Å; F190-V215 HydrophobicContact CD1-CG1 4.43Å; F190-A217 HydrophobicContact CD1-CB 4.4Å; F190-S266 PolarHBondContact N-O 3.2Å; F190-V267 HydrophobicContact CB-CG1 4.38Å; F190-V267 HydrophobicContact CB-CG2 4.36Å; F190-V267 HydrophobicContact CD2-CG2 4.31Å; F190-V267 WeakPolarHBondContact O-CA 3.34Å; F190-T268 PolarHBondContact O-N 3.38Å
191	L	92.6	Very high	83.8	Confident	57 Å²	57	27.7 Å²	27.7	30%	0.298	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	106.5	168	178.2	68.9	0	0	0	107.9	K216 T268 V270	L191-K216 HydrophobicContact CB-CB 4.23Å; L191-K216 HydrophobicContact CD2-CD 4.08Å; L191-K216 PolarHBondContact N-O 2.81Å; L191-K216 PolarHBondContact O-N 3.42Å; L191-T268 WeakPolarHBondContact CA-O 3.24Å; L191-T268 HydrophobicContact CD1-CG2 4.31Å; L191-V270 HydrophobicContact CD1-CB 4.43Å; L191-V270 HydrophobicContact CD1-CG2 3.58Å
192	I	93.8	Very high	83.2	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	110.4	-178.4	-58.8	175.1	0	0	0	108.2	I100 F190 I212 V215 V267 T268 F269 V270	I100-I192 HydrophobicContact CD1-CD1 4.33Å; I100-I192 HydrophobicContact CG2-CD1 4.06Å; F190-I192 HydrophobicContact CB-CG1 4.48Å; I192-I212 HydrophobicContact CG2-CD1 4.34Å; I192-I212 HydrophobicContact CG2-CG1 4.12Å; I192-I212 HydrophobicContact CG2-CG2 3.98Å; I192-V215 HydrophobicContact CG1-CG1 4.33Å; I192-V215 HydrophobicContact CG2-CG2 4.48Å; I192-V267 HydrophobicContact CD1-CG1 3.93Å; I192-T268 PolarHBondContact N-O 3.26Å; I192-F269 HydrophobicContact CB-CD1 3.83Å; I192-F269 HydrophobicContact CB-CE1 3.85Å; I192-F269 HydrophobicContact CD1-CE1 3.87Å; I192-F269 HydrophobicContact CD1-CZ 3.91Å; I192-F269 HydrophobicContact CG1-CE1 4.45Å; I192-F269 HydrophobicContact CG2-CD1 3.86Å; I192-F269 HydrophobicContact CG2-CE1 3.7Å; I192-F269 WeakPolarHBondContact O-CA 3.49Å; I192-V270 PolarHBondContact O-N 2.93Å
193	E	93.3	Very high	82.1	Confident	36 Å²	36	35.9 Å²	35.9	17%	0.168	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.6	173.3	-68.2	167.9	-164.4	0	0	109.2	I213 S214 K216 V270 T272	E193-I213 PolarHBondContact O-N 2.82Å; E193-S214 WeakPolarHBondContact CB-OG 3.41Å; E193-S214 WeakPolarHBondContact CG-OG 3.19Å; E193-S214 PolarHBondContact N-O 3.09Å; E193-S214 PolarHBondContact O-N 2.9Å; E193-S214 PolarHBondContact OE2-OG 3.27Å; E193-K216 IonicContact OE1-NZ 3.69Å; E193-K216 PolarHBondContact OE1-NZ 2.98Å; E193-V270 CarbonylContact C-O 3.57Å; E193-V270 VanDerWaalsContact CA-O 3.26Å; E193-V270 WeakPolarHBondContact CA-O 3.44Å; E193-V270 HydrophobicContact CG-CB 4.34Å; E193-T272 HydrophobicContact CB-CG2 3.72Å; E193-T272 HydrophobicContact CG-CG2 3.81Å
194	Y	92.1	Very high	80.7	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.027	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.9	-179.7	75.9	-83.5	0	0	0	111.5	F102 N103 D196 R211 F269 V270 K271 T272	F102-Y194 HydrophobicContact CE1-CE2 4.49Å; F102-Y194 HydrophobicContact CE2-CD2 4.06Å; F102-Y194 HydrophobicContact CE2-CG 4.02Å; F102-Y194 AromaticContact CZ-CD2 3.55Å; F102-Y194 HydrophobicContact CZ-CD2 3.55Å; F102-Y194 AromaticContact CZ-CE2 3.85Å; F102-Y194 HydrophobicContact CZ-CE2 3.85Å; F102-Y194 AromaticContact CZ-CG 3.98Å; F102-Y194 HydrophobicContact CZ-CG 3.98Å; N103-Y194 PolarHBondContact OD1-OH 2.93Å; Y194-D196 HydrophobicContact CE2-CB 4.48Å; Y194-R211 CarbonylContact C-O 3.56Å; Y194-R211 VanDerWaalsContact CA-O 3.22Å; Y194-R211 WeakPolarHBondContact CA-O 3.36Å; Y194-R211 WeakPolarHBondContact CB-O 3.35Å; Y194-F269 HydrophobicContact CD1-CB 4.08Å; Y194-F269 HydrophobicContact CD1-CD1 4.03Å; Y194-F269 HydrophobicContact CE1-CB 3.8Å; Y194-F269 HydrophobicContact CE1-CD1 4.4Å; Y194-V270 WeakPolarHBondContact CD1-O 3.47Å; Y194-V270 PolarHBondContact N-O 2.84Å; Y194-K271 HydrophobicContact CE1-CG 3.91Å; Y194-K271 HydrophobicContact CE2-CG 4Å; Y194-K271 CarbonylContact O-C 3.58Å; Y194-K271 VanDerWaalsContact O-CA 3.31Å; Y194-K271 WeakPolarHBondContact O-CA 3.32Å; Y194-K271 WeakPolarHBondContact OH-CE 3.39Å; Y194-T272 PolarHBondContact O-N 2.8Å
195	R	89.7	Confident	79.3	Confident	45 Å²	45	50 Å²	50	17%	0.17	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.8	169.3	167.3	171.7	-177.7	134.1	8.7	109.8	D200 G210 R211 I213 T272 D273 V274	R195-D200 IonicContact CZ-OD1 2.79Å; R195-D200 IonicContact CZ-OD2 3.72Å; R195-D200 IonicContact NE-OD1 3.9Å; R195-D200 IonicContact NE-OD2 2.77Å; R195-D200 PolarHBondContact NE-OD2 3.33Å; R195-D200 IonicContact NH2-OD1 2.76Å; R195-D200 PolarHBondContact NH2-OD1 3.07Å; R195-D200 IonicContact NH2-OD2 2.7Å; R195-D200 PolarHBondContact NH2-OD2 3.23Å; R195-G210 CarbonylContact O-C 3.53Å; R195-G210 WeakPolarHBondContact O-CA 3.48Å; R195-R211 PolarHBondContact N-O 3.02Å; R195-R211 PolarHBondContact O-N 3.02Å; R195-I213 HydrophobicContact CB-CD1 3.38Å; R195-I213 HydrophobicContact CB-CG1 4.33Å; R195-T272 WeakPolarHBondContact CA-O 3.27Å; R195-T272 WeakPolarHBondContact CB-O 3.44Å; R195-D273 PolarHBondContact NH1-O 3.38Å; R195-V274 VanDerWaalsContact CD-O 3.23Å; R195-V274 WeakPolarHBondContact CD-O 3.36Å; R195-V274 PolarHBondContact NH1-O 3.44Å; R195-V274 VanDerWaalsContact NH1-O 3.1Å
196	D	87.2	Confident	78.1	Confident	44 Å²	44	56 Å²	56	24%	0.235	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	128	173.3	-159.4	-24.6	0	0	0	108.9	Y194 S198 K271	Y194-D196 HydrophobicContact CE2-CB 4.48Å; D196-S198 WeakPolarHBondContact OD1-CB 3.45Å; D196-S198 PolarHBondContact OD1-N 2.68Å; D196-S198 VanDerWaalsContact OD1-N 3.13Å; D196-S198 PolarHBondContact OD1-OG 3.37Å; D196-S198 PolarHBondContact OD2-OG 2.91Å; D196-K271 IonicContact OD2-NZ 3.77Å; D196-K271 PolarHBondContact OD2-NZ 3.26Å
197	L	81.1	Confident	77	Confident	3 Å²	3	59 Å²	59	2%	0.016	32%	0.317	C	S	.	.	S	Bend	trans	-89.4	-8	178.5	-68.5	170	0	0	0	112.4	N32 T199 D200 Y203 G209 R211	N32-L197 WeakPolarHBondContact OD1-CD1 3.23Å; L197-T199 PolarHBondContact O-N 2.99Å; L197-T199 VanDerWaalsContact O-N 3.1Å; L197-D200 HydrophobicContact CD2-CB 4.41Å; L197-D200 PolarHBondContact O-N 3.19Å; L197-D200 VanDerWaalsContact O-N 3.14Å; L197-Y203 HydrophobicContact CD1-CE2 4.43Å; L197-G209 WeakPolarHBondContact CB-O 3.1Å; L197-G209 PolarHBondContact N-O 2.84Å; L197-R211 HydrophobicContact CD1-CG 3.98Å; L197-R211 HydrophobicContact CD2-CG 4.35Å; L197-R211 HydrophobicContact CG-CG 4.35Å
198	S	74.7	Confident	76.1	Confident	61 Å²	61	62.2 Å²	62.2	43%	0.427	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.9	-176.9	53.3	0	0	0	0	114.1	D196	D196-S198 WeakPolarHBondContact OD1-CB 3.45Å; D196-S198 PolarHBondContact OD1-N 2.68Å; D196-S198 VanDerWaalsContact OD1-N 3.13Å; D196-S198 PolarHBondContact OD1-OG 3.37Å; D196-S198 PolarHBondContact OD2-OG 2.91Å
199	T	69.9	Low	75.7	Confident	121 Å²	121	62.6 Å²	62.6	74%	0.742	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	2.2	-178.3	53.9	0	0	0	0	114	L197 P201	L197-T199 PolarHBondContact O-N 2.99Å; L197-T199 VanDerWaalsContact O-N 3.1Å; T199-P201 WeakPolarHBondContact O-CD 3.29Å
200	D	67.5	Low	75.6	Confident	33 Å²	33	61.9 Å²	61.9	18%	0.176	34%	0.335	C	S	.	.			trans	-81.3	116.5	-173.6	-108.8	-28.9	0	0	0	111.4	R195 L197 N202 Y203	R195-D200 IonicContact CZ-OD1 2.79Å; R195-D200 IonicContact CZ-OD2 3.72Å; R195-D200 IonicContact NE-OD1 3.9Å; R195-D200 IonicContact NE-OD2 2.77Å; R195-D200 PolarHBondContact NE-OD2 3.33Å; R195-D200 IonicContact NH2-OD1 2.76Å; R195-D200 PolarHBondContact NH2-OD1 3.07Å; R195-D200 IonicContact NH2-OD2 2.7Å; R195-D200 PolarHBondContact NH2-OD2 3.23Å; L197-D200 HydrophobicContact CD2-CB 4.41Å; L197-D200 PolarHBondContact O-N 3.19Å; L197-D200 VanDerWaalsContact O-N 3.14Å; D200-N202 PolarHBondContact O-N 3.47Å; D200-N202 VanDerWaalsContact O-N 3.16Å; D200-Y203 PolarHBondContact O-N 3.01Å
201	P	63.1	Low	75.5	Confident	115 Å²	115	63.9 Å²	63.9	75%	0.747	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-13.7	-176.9	27.7	-35.2	0	0	0	113.8	T199	T199-P201 WeakPolarHBondContact O-CD 3.29Å
202	N	62.3	Low	75.4	Confident	137 Å²	137	61.1 Å²	61.1	73%	0.733	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	8.1	-177	-70.7	-20.1	0	0	0	113.6	D200	D200-N202 PolarHBondContact O-N 3.47Å; D200-N202 VanDerWaalsContact O-N 3.16Å
203	Y	59.5	Low	75.2	Confident	44 Å²	44	61.3 Å²	61.3	17%	0.173	33%	0.329	C	S	.	.			trans	-103.1	113	-179.6	-159.3	-104.4	0	0	0	110	N32 L197 D200 D205 N206 P207	N32-Y203 PolarHBondContact ND2-OH 3.44Å; L197-Y203 HydrophobicContact CD1-CE2 4.43Å; D200-Y203 PolarHBondContact O-N 3.01Å; Y203-D205 WeakPolarHBondContact CD1-O 3.44Å; Y203-D205 HydrophobicContact CE1-CB 3.9Å; Y203-D205 WeakPolarHBondContact CE1-O 3.24Å; Y203-N206 WeakPolarHBondContact CE1-O 3.35Å; Y203-P207 HydrophobicContact CD1-CB 4.34Å
204	F	53.4	Low	75.1	Confident	204 Å²	204	59.6 Å²	59.6	90%	0.895	32%	0.321	S	S	*	.			trans	-82.1	-23.5	-172.9	-68	-82.8	0	0	0	114
205	D	55.3	Low	75.1	Confident	111 Å²	111	59.3 Å²	59.3	59%	0.594	32%	0.32	S	S	*	.	S	Bend	trans	-94.7	165.6	176.1	-73.8	-32.3	0	0	0	111	Y203 P207	Y203-D205 WeakPolarHBondContact CD1-O 3.44Å; Y203-D205 HydrophobicContact CE1-CB 3.9Å; Y203-D205 WeakPolarHBondContact CE1-O 3.24Å; D205-P207 VanDerWaalsContact O-N 3.09Å
206	N	59.7	Low	75.2	Confident	134 Å²	134	59.7 Å²	59.7	72%	0.717	32%	0.323	S	S	*	.			trans	-42.7	119.5	178.6	-72.9	-32.7	0	0	0	111.5	Y203 I208	Y203-N206 WeakPolarHBondContact CE1-O 3.35Å; N206-I208 HydrophobicContact CB-CD1 4.09Å; N206-I208 HydrophobicContact CB-CG1 4.19Å; N206-I208 PolarHBondContact O-N 3.47Å
207	P	63	Low	75.3	Confident	64 Å²	64	57.6 Å²	57.6	42%	0.416	31%	0.312	S	S	.	.			trans	-78	68.1	-168.5	33.8	-38.7	0	0	0	111.1	Y203 D205	Y203-P207 HydrophobicContact CD1-CB 4.34Å; D205-P207 VanDerWaalsContact O-N 3.09Å
208	I	69.5	Low	75.6	Confident	68 Å²	68	60 Å²	60	35%	0.349	33%	0.327	S	S	.	.			trans	-111.7	119.2	-177.5	-51.9	175.7	0	0	0	107.8	C34 K38 N206	C34-I208 VanDerWaalsContact SG-C 3.57Å; C34-I208 PolarHBondContact SG-O 3.31Å; K38-I208 HydrophobicContact CB-CG2 3.84Å; K38-I208 HydrophobicContact CD-CG2 3.56Å; K38-I208 HydrophobicContact CG-CG2 4.32Å; N206-I208 HydrophobicContact CB-CD1 4.09Å; N206-I208 HydrophobicContact CB-CG1 4.19Å; N206-I208 PolarHBondContact O-N 3.47Å
209	G	81	Confident	75.7	Confident	14 Å²	14	57.2 Å²	57.2	14%	0.144	31%	0.307	C	S	.	.			trans	115.8	-168.7	171.7	0	0	0	0	0	114.5	F33 C34 L197	F33-G209 CarbonylContact O-C 3.56Å; F33-G209 WeakPolarHBondContact O-CA 3.26Å; C34-G209 VanDerWaalsContact SG-CA 3.55Å; L197-G209 WeakPolarHBondContact CB-O 3.1Å; L197-G209 PolarHBondContact N-O 2.84Å
210	G	87.4	Confident	75.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	166.7	176.3	0	0	0	0	0	112.6	F33 R195	F33-G210 PolarHBondContact N-O 2.88Å; F33-G210 PolarHBondContact O-N 3.38Å; R195-G210 CarbonylContact O-C 3.53Å; R195-G210 WeakPolarHBondContact O-CA 3.48Å
211	R	89.3	Confident	74.3	Confident	42 Å²	42	54.9 Å²	54.9	16%	0.158	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137	178.4	-65.4	177	-179.2	168	0.2	110.2	N32 Y194 R195 L197	N32-R211 PolarHBondContact OD1-NE 3.46Å; Y194-R211 CarbonylContact C-O 3.56Å; Y194-R211 VanDerWaalsContact CA-O 3.22Å; Y194-R211 WeakPolarHBondContact CA-O 3.36Å; Y194-R211 WeakPolarHBondContact CB-O 3.35Å; R195-R211 PolarHBondContact N-O 3.02Å; R195-R211 PolarHBondContact O-N 3.02Å; L197-R211 HydrophobicContact CD1-CG 3.98Å; L197-R211 HydrophobicContact CD2-CG 4.35Å; L197-R211 HydrophobicContact CG-CG 4.35Å
212	I	91.2	Very high	73.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.1	176.8	-61.3	174.1	0	0	0	109.1	F33 V47 V144 D145 I192 V215	F33-I212 HydrophobicContact CD2-CD1 3.78Å; F33-I212 HydrophobicContact CD2-CG1 3.88Å; F33-I212 HydrophobicContact CE2-CD1 3.56Å; F33-I212 HydrophobicContact CE2-CG1 4Å; F33-I212 HydrophobicContact CG-CD1 4.49Å; F33-I212 HydrophobicContact CZ-CD1 4.11Å; V47-I212 HydrophobicContact CG1-CD1 3.62Å; V47-I212 HydrophobicContact CG2-CD1 4.14Å; V144-I212 HydrophobicContact CG1-CD1 4.24Å; D145-I212 HydrophobicContact CB-CB 4.45Å; D145-I212 HydrophobicContact CB-CD1 4.29Å; I192-I212 HydrophobicContact CG2-CD1 4.34Å; I192-I212 HydrophobicContact CG2-CG1 4.12Å; I192-I212 HydrophobicContact CG2-CG2 3.98Å; I212-V215 HydrophobicContact CG2-CG2 3.59Å
213	I	90.1	Very high	71.9	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-51.6	-179.1	-68.3	165.8	0	0	0	110.5	L147 E193 R195 T272 V274 R279 Y282	L147-I213 VanDerWaalsContact CD1-O 3.28Å; L147-I213 WeakPolarHBondContact CD1-O 3.34Å; E193-I213 PolarHBondContact O-N 2.82Å; R195-I213 HydrophobicContact CB-CD1 3.38Å; R195-I213 HydrophobicContact CB-CG1 4.33Å; I213-T272 VanDerWaalsContact CD1-OG1 3.25Å; I213-T272 WeakPolarHBondContact CD1-OG1 3.5Å; I213-V274 HydrophobicContact CD1-CB 4.15Å; I213-V274 WeakPolarHBondContact CD1-O 3.3Å; I213-V274 HydrophobicContact CG2-CB 4.12Å; I213-V274 HydrophobicContact CG2-CG1 4.11Å; I213-R279 HydrophobicContact CG2-CB 4.2Å; I213-Y282 WeakPolarHBondContact O-CE1 3.42Å
214	S	90.3	Very high	70.5	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.007	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.3	-179.3	91.2	0	0	0	0	111	E193 Y282	E193-S214 WeakPolarHBondContact CB-OG 3.41Å; E193-S214 WeakPolarHBondContact CG-OG 3.19Å; E193-S214 PolarHBondContact N-O 3.09Å; E193-S214 PolarHBondContact O-N 2.9Å; E193-S214 PolarHBondContact OE2-OG 3.27Å; S214-Y282 VanDerWaalsContact CB-CE1 3.45Å
215	V	92.5	Very high	69.6	Low	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	109.8	176.7	-175.7	0	0	0	0	108.4	V144 V149 T150 F190 I192 I212 Y282	V144-V215 HydrophobicContact CB-CB 4.49Å; V144-V215 HydrophobicContact CB-CG1 4.27Å; V144-V215 HydrophobicContact CB-CG2 3.99Å; V144-V215 HydrophobicContact CG1-CG2 4.04Å; V144-V215 HydrophobicContact CG2-CG1 4.1Å; V149-V215 HydrophobicContact CG1-CG1 4.42Å; V149-V215 HydrophobicContact CG2-CG1 3.87Å; T150-V215 PolarHBondContact N-O 3.39Å; T150-V215 VanDerWaalsContact N-O 3.08Å; T150-V215 PolarHBondContact OG1-O 3.43Å; F190-V215 HydrophobicContact CD1-CG1 4.43Å; I192-V215 HydrophobicContact CG1-CG1 4.33Å; I192-V215 HydrophobicContact CG2-CG2 4.48Å; I212-V215 HydrophobicContact CG2-CG2 3.59Å; V215-Y282 PolarHBondContact N-OH 3.4Å
216	K	91.3	Very high	68.5	Low	53 Å²	53	58.2 Å²	58.2	23%	0.23	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137	175.7	-64.7	161.7	-174.9	161.9	0	108.6	T150 L191 E193	T150-K216 CarbonylContact O-C 3.54Å; T150-K216 VanDerWaalsContact O-CA 3.23Å; T150-K216 WeakPolarHBondContact O-CA 3.42Å; L191-K216 HydrophobicContact CB-CB 4.23Å; L191-K216 HydrophobicContact CD2-CD 4.08Å; L191-K216 PolarHBondContact N-O 2.81Å; L191-K216 PolarHBondContact O-N 3.42Å; E193-K216 IonicContact OE1-NZ 3.69Å; E193-K216 PolarHBondContact OE1-NZ 2.98Å
217	A	90.1	Very high	67.6	Low	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.5	171.9	0	0	0	0	0	109.1	V149 T150 F151 F164 I188 D189 F190	V149-A217 HydrophobicContact CG1-CB 3.29Å; T150-A217 PolarHBondContact O-N 3.39Å; F151-A217 WeakPolarHBondContact CD2-O 3.41Å; F164-A217 HydrophobicContact CD1-CB 4.22Å; F164-A217 HydrophobicContact CE1-CB 4.34Å; I188-A217 HydrophobicContact CG2-CB 3.93Å; D189-A217 WeakPolarHBondContact O-CA 3.46Å; F190-A217 HydrophobicContact CD1-CB 4.4Å
218	T	85.9	Confident	66.2	Low	55 Å²	55	63 Å²	63	34%	0.337	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	111.3	173.2	50.5	0	0	0	0	109.1	F151 D189 S220	F151-T218 HydrophobicContact CD2-CG2 4.44Å; D189-T218 WeakPolarHBondContact CB-OG1 3.38Å; D189-T218 PolarHBondContact N-O 3.09Å; D189-T218 PolarHBondContact O-N 3.22Å; D189-T218 PolarHBondContact O-OG1 3.41Å; T218-S220 PolarHBondContact O-N 2.9Å
219	P	76.6	Confident	64.6	Low	1 Å²	1	65.5 Å²	65.5	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	118.6	168.1	25.5	-30	0	0	0	109.8	F151 F164 F185 H187	F151-P219 HydrophobicContact CD2-CG 4.34Å; F151-P219 HydrophobicContact CE2-CG 4.13Å; F164-P219 HydrophobicContact CB-CG 4.32Å; F164-P219 HydrophobicContact CD2-CB 4.49Å; F164-P219 HydrophobicContact CD2-CG 4.25Å; F185-P219 HydrophobicContact CB-CB 3.49Å; F185-P219 VanDerWaalsContact CB-CB 3.49Å; F185-P219 HydrophobicContact CB-CG 4.49Å; F185-P219 HydrophobicContact CD1-CB 3.95Å; F185-P219 HydrophobicContact CD2-CB 3.73Å; F185-P219 HydrophobicContact CD2-CG 3.84Å; F185-P219 HydrophobicContact CE2-CB 4.45Å; F185-P219 HydrophobicContact CE2-CG 4.19Å; F185-P219 HydrophobicContact CG-CB 3.45Å; F185-P219 VanDerWaalsContact CG-CB 3.45Å; F185-P219 HydrophobicContact CG-CG 4.07Å; H187-P219 WeakPolarHBondContact O-CA 3.11Å
220	S	64.9	Low	62.5	Low	5 Å²	5	67.9 Å²	67.9	4%	0.035	34%	0.338	C	S	.	.	S	Bend	trans	40.7	120.6	176.7	-161.3	0	0	0	0	119.5	H187 T218 Q222 R232	H187-S220 PolarHBondContact O-N 2.9Å; T218-S220 PolarHBondContact O-N 2.9Å; S220-Q222 PolarHBondContact O-N 3.41Å; S220-R232 WeakPolarHBondContact CB-O 3.39Å; S220-R232 PolarHBondContact OG-O 3.22Å
221	R	44	Very low	60.2	Low	100 Å²	100	70.2 Å²	70.2	38%	0.377	35%	0.348	S	S	.	.			trans	-53.6	118.6	-163.2	-67.7	-176.9	178.9	174.2	-3.5	117.5	D189 F223 R232	D189-R221 WeakPolarHBondContact OD2-CG 3.17Å; D189-R221 IonicContact OD2-CZ 3.94Å; D189-R221 IonicContact OD2-NE 3.09Å; D189-R221 PolarHBondContact OD2-NE 3.34Å; D189-R221 IonicContact OD2-NH2 3.82Å; R221-F223 PolarHBondContact O-N 2.98Å; R221-R232 WeakPolarHBondContact O-CB 3.43Å; R221-R232 PolarHBondContact O-NE 3.5Å
222	Q	40.4	Very low	57.8	Low	74 Å²	74	71.8 Å²	71.8	35%	0.346	35%	0.354	S	S	.	.			trans	-52.7	115	154.4	-171.7	163.6	40	0	0	110	A153 S220	A153-Q222 PolarHBondContact O-NE2 3.07Å; A153-Q222 PolarHBondContact O-OE1 3.33Å; S220-Q222 PolarHBondContact O-N 3.41Å
223	F	34.1	Very low	55.4	Low	145 Å²	145	72.3 Å²	72.3	64%	0.636	36%	0.357	S	S	*	.			trans	-100.7	116.4	154.3	-114	-110.6	0	0	0	106.8	R221 N225	R221-F223 PolarHBondContact O-N 2.98Å; F223-N225 VanDerWaalsContact C-N 3.34Å; F223-N225 PolarHBondContact O-N 3.44Å
224	L	31	Very low	53.5	Low	132 Å²	132	72.2 Å²	72.2	69%	0.691	36%	0.357	S	S	*	.			trans	-59.7	97.1	168.9	-77.3	153.9	0	0	0	108.1
225	N	33.2	Very low	51.6	Low	148 Å²	148	72.4 Å²	72.4	79%	0.791	36%	0.358	S	S	*	.			trans	-163.4	75.2	147.9	-91.6	-15.4	0	0	0	105.4	F223	F223-N225 VanDerWaalsContact C-N 3.34Å; F223-N225 PolarHBondContact O-N 3.44Å
226	F	32.1	Very low	49.6	Very low	183 Å²	183	73.9 Å²	73.9	80%	0.803	37%	0.372	S	S	*	.	S	Bend	trans	170.1	141.7	145.9	-108.5	-92.6	0	0	0	107.8	Y228	F226-Y228 PolarHBondContact O-N 3.25Å
227	S	41	Very low	47.8	Very low	105 Å²	105	72.1 Å²	72.1	73%	0.734	37%	0.365	S	S	*	.	S	Bend	trans	-67.6	16.9	-177.2	50.4	0	0	0	0	114.8
228	Y	34.4	Very low	46	Very low	193 Å²	193	79.8 Å²	79.8	76%	0.757	40%	0.399	S	S	*	.	S	Bend	trans	-140.4	148.5	-180	-72.6	-85.2	0	0	0	109.2	F226 A230	F226-Y228 PolarHBondContact O-N 3.25Å; Y228-A230 VanDerWaalsContact C-N 3.3Å; Y228-A230 PolarHBondContact O-N 3.05Å
229	L	36.4	Very low	44.5	Very low	120 Å²	120	82.3 Å²	82.3	63%	0.628	41%	0.405	S	S	*	.			trans	-53.7	78	-175	-71.5	161.4	0	0	0	113.5	F154 F231	F154-L229 HydrophobicContact CZ-CD2 4.27Å; L229-F231 VanDerWaalsContact C-N 3.34Å; L229-F231 HydrophobicContact CD2-CD2 4.46Å; L229-F231 HydrophobicContact CD2-CE2 3.89Å; L229-F231 PolarHBondContact O-N 2.88Å
230	A	36.5	Very low	43.5	Very low	65 Å²	65	90 Å²	90	54%	0.537	45%	0.446	S	S	.	.			trans	-87.5	80.5	160.3	0	0	0	0	0	107.6	Y228 R232	Y228-A230 VanDerWaalsContact C-N 3.3Å; Y228-A230 PolarHBondContact O-N 3.05Å; A230-R232 PolarHBondContact O-N 3.47Å
231	F	39.6	Very low	43.4	Very low	48 Å²	48	93.3 Å²	93.3	21%	0.211	47%	0.469	C	S	.	.			trans	-55.4	128.8	154.8	-77.7	-86.4	0	0	0	105.8	F151 F185 L229 T233	F151-F231 HydrophobicContact CE2-CE1 4.45Å; F151-F231 AromaticContact CZ-CE1 3.84Å; F151-F231 HydrophobicContact CZ-CE1 3.84Å; F151-F231 AromaticContact CZ-CZ 3.91Å; F151-F231 HydrophobicContact CZ-CZ 3.91Å; F185-F231 HydrophobicContact CE1-CD1 4.28Å; F185-F231 HydrophobicContact CZ-CD1 4.27Å; F185-F231 HydrophobicContact CZ-CE1 4.37Å; L229-F231 VanDerWaalsContact C-N 3.34Å; L229-F231 HydrophobicContact CD2-CD2 4.46Å; L229-F231 HydrophobicContact CD2-CE2 3.89Å; L229-F231 PolarHBondContact O-N 2.88Å; F231-T233 HydrophobicContact CB-CG2 3.75Å; F231-T233 PolarHBondContact O-N 3.37Å
232	R	39.2	Very low	44.5	Very low	75 Å²	75	90.4 Å²	90.4	28%	0.283	46%	0.462	S	S	.	.			trans	-66.7	85.6	155.5	-83.7	-161.9	-78.6	-147.5	0.3	105.2	S220 R221 A230 D234	S220-R232 WeakPolarHBondContact CB-O 3.39Å; S220-R232 PolarHBondContact OG-O 3.22Å; R221-R232 WeakPolarHBondContact O-CB 3.43Å; R221-R232 PolarHBondContact O-NE 3.5Å; A230-R232 PolarHBondContact O-N 3.47Å; R232-D234 PolarHBondContact O-N 3.43Å
233	T	40.3	Very low	45.9	Very low	11 Å²	11	89.8 Å²	89.8	7%	0.067	46%	0.462	C	S	.	.			trans	-63.9	111.4	176.8	45.6	0	0	0	0	106.7	V168 F183 F185 F231 L249	V168-T233 HydrophobicContact CG1-CG2 3.81Å; F183-T233 HydrophobicContact CB-CG2 3.77Å; F183-T233 HydrophobicContact CD1-CG2 3.91Å; F183-T233 WeakPolarHBondContact CD1-OG1 3.13Å; F183-T233 HydrophobicContact CD2-CG2 4.13Å; F183-T233 HydrophobicContact CE1-CG2 4.49Å; F183-T233 WeakPolarHBondContact CE1-OG1 3.17Å; F183-T233 HydrophobicContact CG-CG2 3.68Å; F185-T233 HydrophobicContact CE1-CG2 4.46Å; F231-T233 HydrophobicContact CB-CG2 3.75Å; F231-T233 PolarHBondContact O-N 3.37Å; T233-L249 WeakPolarHBondContact O-CA 3.23Å; T233-L249 WeakPolarHBondContact O-CB 3.48Å; T233-L249 WeakPolarHBondContact O-CD2 3.33Å; T233-L249 WeakPolarHBondContact OG1-CD2 3.4Å
234	D	49.9	Very low	47.5	Very low	2 Å²	2	83.8 Å²	83.8	1%	0.011	44%	0.437	C	S	.	.			trans	61	117.1	153.6	-39.3	-32.2	0	0	0	117.5	F183 L184 F185 N186 R232 G236 L249 M250	F183-D234 WeakPolarHBondContact CA-OD2 3.39Å; F183-D234 WeakPolarHBondContact CB-OD2 2.98Å; L184-D234 PolarHBondContact N-OD2 3.16Å; L184-D234 VanDerWaalsContact O-OD2 3.08Å; F185-D234 WeakPolarHBondContact CA-OD1 3.24Å; F185-D234 WeakPolarHBondContact CD1-OD1 3.25Å; F185-D234 PolarHBondContact N-OD1 3.23Å; N186-D234 WeakPolarHBondContact OD1-CA 3.07Å; R232-D234 PolarHBondContact O-N 3.43Å; D234-G236 PolarHBondContact O-N 2.96Å; D234-L249 CarbonylContact O-C 3.5Å; D234-L249 WeakPolarHBondContact O-CA 3.34Å; D234-M250 HydrophobicContact CB-CB 3.54Å; D234-M250 PolarHBondContact O-N 3.47Å; D234-M250 VanDerWaalsContact OD2-O 3.13Å
235	I	51.2	Low	49.2	Very low	6 Å²	6	84.5 Å²	84.5	3%	0.031	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-80.9	117.2	178.2	-61.2	132.5	0	0	0	109.4	N186 H187 H237 N243 C244 N246	N186-I235 PolarHBondContact ND2-O 3.01Å; N186-I235 PolarHBondContact OD1-N 3.35Å; H187-I235 HydrophobicContact CB-CD1 3.82Å; I235-H237 VanDerWaalsContact C-N 3.31Å; I235-H237 WeakPolarHBondContact CG2-CE1 3.5Å; I235-H237 WeakPolarHBondContact CG2-ND1 2.86Å; I235-H237 PolarHBondContact O-CD2 3.49Å; I235-H237 PolarHBondContact O-N 3.39Å; I235-N243 WeakPolarHBondContact CG2-O 3.36Å; I235-C244 HydrophobicContact CD1-CB 3.64Å; I235-C244 WeakPolarHBondContact CD1-O 3.24Å; I235-N246 HydrophobicContact CG2-CB 4.08Å
236	G	50.1	Low	50.4	Low	30 Å²	30	80.6 Å²	80.6	31%	0.309	42%	0.416	S	S	.	.			trans	-62.2	88.8	160.9	0	0	0	0	0	111.1	D234 S248	D234-G236 PolarHBondContact O-N 2.96Å; G236-S248 PolarHBondContact N-O 3.04Å; G236-S248 PolarHBondContact N-OG 3Å
237	H	52.5	Low	51.5	Low	17 Å²	17	76.6 Å²	76.6	8%	0.079	41%	0.408	C	S	.	.			trans	-79.2	142.2	173.1	-60.5	-67.6	0	0	0	110.7	I235 V242 C244 V262 T264	I235-H237 VanDerWaalsContact C-N 3.31Å; I235-H237 WeakPolarHBondContact CG2-CE1 3.5Å; I235-H237 WeakPolarHBondContact CG2-ND1 2.86Å; I235-H237 PolarHBondContact O-CD2 3.49Å; I235-H237 PolarHBondContact O-N 3.39Å; H237-V242 HydrophobicContact CB-CG1 4.41Å; H237-V242 VanDerWaalsContact CE1-CG1 3.44Å; H237-V242 WeakPolarHBondContact CE1-CG1 3.24Å; H237-V242 VanDerWaalsContact ND1-CG1 3.28Å; H237-V242 WeakPolarHBondContact ND1-CG1 3.39Å; H237-C244 VanDerWaalsContact CE1-SG 3.52Å; H237-V262 HydrophobicContact CB-CB 3.78Å; H237-V262 HydrophobicContact CB-CG1 3.81Å; H237-V262 HydrophobicContact CB-CG2 4.09Å; H237-T264 VanDerWaalsContact CD2-CG2 3.47Å; H237-T264 WeakPolarHBondContact CD2-CG2 3.4Å; H237-T264 VanDerWaalsContact NE2-CG2 3.27Å; H237-T264 WeakPolarHBondContact NE2-CG2 3.36Å; H237-T264 PolarHBondContact NE2-OG1 3.04Å
238	K	53.5	Low	52.2	Low	161 Å²	161	74.2 Å²	74.2	70%	0.7	39%	0.392	S	S	*	.	B	Isolated β-bridge	trans	-88.7	139	158.8	-71.2	-179.8	178.8	178.6	0	108.1	D240 S241	K238-D240 PolarHBondContact O-N 3.18Å; K238-S241 CarbonylContact O-C 3.57Å; K238-S241 PolarHBondContact O-N 2.94Å; K238-S241 VanDerWaalsContact O-N 3.14Å
239	K	53	Low	53.3	Low	107 Å²	107	69.4 Å²	69.4	47%	0.465	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-39.3	-178.8	-82.4	178.9	174.5	170.8	0	113.8	S113 V115 D260	S113-K239 WeakPolarHBondContact OG-CE 3.04Å; V115-K239 VanDerWaalsContact CG2-NZ 3.29Å; K239-D260 WeakPolarHBondContact CE-OD2 3.18Å; K239-D260 IonicContact NZ-OD2 2.75Å
240	D	56.7	Low	54.7	Low	163 Å²	163	64.5 Å²	64.5	87%	0.872	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.1	-171.3	-52.7	-34.2	0	0	0	114	K238	K238-D240 PolarHBondContact O-N 3.18Å
241	S	62.8	Low	56.4	Low	75 Å²	75	63.3 Å²	63.3	52%	0.524	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-148	91.4	178.8	48.6	0	0	0	0	111	K238 N243	K238-S241 CarbonylContact O-C 3.57Å; K238-S241 PolarHBondContact O-N 2.94Å; K238-S241 VanDerWaalsContact O-N 3.14Å; S241-N243 PolarHBondContact O-N 2.9Å; S241-N243 VanDerWaalsContact O-N 3.11Å
242	V	65.8	Low	58.2	Low	39 Å²	39	61 Å²	61	24%	0.236	33%	0.329	C	S	.	.			trans	-76.2	99.7	179.9	-171	0	0	0	0	109.3	C108 L110 H237 T264	C108-V242 VanDerWaalsContact SG-CG1 3.56Å; L110-V242 HydrophobicContact CB-CG2 4.32Å; L110-V242 HydrophobicContact CD1-CG2 4.25Å; H237-V242 HydrophobicContact CB-CG1 4.41Å; H237-V242 VanDerWaalsContact CE1-CG1 3.44Å; H237-V242 WeakPolarHBondContact CE1-CG1 3.24Å; H237-V242 VanDerWaalsContact ND1-CG1 3.28Å; H237-V242 WeakPolarHBondContact ND1-CG1 3.39Å; V242-T264 HydrophobicContact CG1-CG2 3.38Å
243	N	69.7	Low	60.1	Low	61 Å²	61	62.7 Å²	62.7	33%	0.326	34%	0.338	S	S	.	.			trans	-111.6	103.8	176.1	-174.9	4.5	0	0	0	112.2	I235 S241 Q245 N246	I235-N243 WeakPolarHBondContact CG2-O 3.36Å; S241-N243 PolarHBondContact O-N 2.9Å; S241-N243 VanDerWaalsContact O-N 3.11Å; N243-Q245 PolarHBondContact O-N 2.92Å; N243-Q245 WeakPolarHBondContact OD1-CB 3.28Å; N243-Q245 PolarHBondContact OD1-N 2.71Å; N243-N246 PolarHBondContact ND2-OD1 3.5Å; N243-N246 VanDerWaalsContact ND2-OD1 3.15Å; N243-N246 PolarHBondContact O-N 2.79Å
244	C	68.8	Low	61.7	Low	19 Å²	19	67.5 Å²	67.5	13%	0.128	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	0.4	178.8	-63	0	0	0	0	114.6	C108 H187 I235 H237	C108-C244 WeakPolarHBondContact CA-SG 3.26Å; C108-C244 HydrophobicContact CB-CB 3.7Å; C108-C244 WeakPolarHBondContact CB-SG 3.22Å; C108-C244 VanDerWaalsContact SG-CA 3.58Å; C108-C244 WeakPolarHBondContact SG-CB 3.32Å; C108-C244 PolarHBondContact SG-N 3.4Å; C108-C244 CovalentContact SG-SG 2.02Å; C108-C244 PolarHBondContact SG-SG 3.22Å; H187-C244 PolarHBondContact CE1-SG 3.33Å; I235-C244 HydrophobicContact CD1-CB 3.64Å; I235-C244 WeakPolarHBondContact CD1-O 3.24Å; H237-C244 VanDerWaalsContact CE1-SG 3.52Å
245	Q	66	Low	63	Low	147 Å²	147	75 Å²	75	69%	0.687	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-9.3	174.2	-59.1	-178.8	-11.7	0	0	112.6	N243	N243-Q245 PolarHBondContact O-N 2.92Å; N243-Q245 WeakPolarHBondContact OD1-CB 3.28Å; N243-Q245 PolarHBondContact OD1-N 2.71Å
246	N	59.1	Low	64.4	Low	65 Å²	65	75.8 Å²	75.8	35%	0.348	40%	0.403	S	S	.	.			trans	-67.4	130.2	-179.7	-79.2	-7.2	0	0	0	111.2	I235 N243 S248	I235-N246 HydrophobicContact CG2-CB 4.08Å; N243-N246 PolarHBondContact ND2-OD1 3.5Å; N243-N246 VanDerWaalsContact ND2-OD1 3.15Å; N243-N246 PolarHBondContact O-N 2.79Å; N246-S248 VanDerWaalsContact C-N 3.26Å; N246-S248 PolarHBondContact O-N 3.09Å
247	P	54.3	Low	65.9	Low	99 Å²	99	82.7 Å²	82.7	64%	0.643	43%	0.425	S	S	*	.			trans	-82.4	3.9	179.9	33.7	-36.2	0	0	0	114	L249	P247-L249 PolarHBondContact O-N 3.38Å
248	S	55.4	Low	67.3	Low	56 Å²	56	86.9 Å²	86.9	39%	0.392	45%	0.452	S	S	.	.			trans	-70.8	112.2	-175.7	53.5	0	0	0	0	110.8	G236 N246 M250	G236-S248 PolarHBondContact N-O 3.04Å; G236-S248 PolarHBondContact N-OG 3Å; N246-S248 VanDerWaalsContact C-N 3.26Å; N246-S248 PolarHBondContact O-N 3.09Å; S248-M250 PolarHBondContact O-N 3.25Å
249	L	59.2	Low	68.8	Low	91 Å²	91	80.1 Å²	80.1	48%	0.476	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-71.8	124.4	-178.9	-44.4	176	0	0	0	111.3	F183 T233 D234 P247 T251	F183-L249 HydrophobicContact CE1-CB 4Å; F183-L249 HydrophobicContact CE1-CD1 4.05Å; F183-L249 HydrophobicContact CZ-CD1 4.45Å; T233-L249 WeakPolarHBondContact O-CA 3.23Å; T233-L249 WeakPolarHBondContact O-CB 3.48Å; T233-L249 WeakPolarHBondContact O-CD2 3.33Å; T233-L249 WeakPolarHBondContact OG1-CD2 3.4Å; D234-L249 CarbonylContact O-C 3.5Å; D234-L249 WeakPolarHBondContact O-CA 3.34Å; P247-L249 PolarHBondContact O-N 3.38Å; L249-T251 PolarHBondContact O-N 3.17Å
250	M	65.7	Low	70.3	Confident	17 Å²	17	78 Å²	78	8%	0.084	42%	0.417	C	S	.	.			trans	-81	106.4	171.4	177	171.7	-176.7	0	0	110.1	D234 S248 L259 D260 V261	D234-M250 HydrophobicContact CB-CB 3.54Å; D234-M250 PolarHBondContact O-N 3.47Å; D234-M250 VanDerWaalsContact OD2-O 3.13Å; S248-M250 PolarHBondContact O-N 3.25Å; M250-L259 HydrophobicContact CE-CD1 3.97Å; M250-L259 HydrophobicContact CE-CG 4.24Å; M250-D260 WeakPolarHBondContact CE-O 3.32Å; M250-V261 HydrophobicContact CE-CB 3.77Å; M250-V261 HydrophobicContact CE-CG1 3.82Å; M250-V261 HydrophobicContact CE-CG2 3.43Å; M250-V261 VanDerWaalsContact CE-CG2 3.43Å; M250-V261 HydrophobicContact SD-CG1 4.2Å
251	T	70.9	Confident	71.7	Confident	40 Å²	40	70.2 Å²	70.2	25%	0.245	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.3	174.2	51	0	0	0	0	110.3	A181 F183 L249	A181-T251 HydrophobicContact CB-CG2 3.96Å; F183-T251 HydrophobicContact CD1-CG2 3.87Å; F183-T251 HydrophobicContact CE1-CG2 3.34Å; F183-T251 HydrophobicContact CZ-CG2 3.96Å; L249-T251 PolarHBondContact O-N 3.17Å
252	I	77.2	Confident	72.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	115.8	166	-54.2	-175.8	0	0	0	106.8	V127 I131 I134 F182 L184 L259	V127-I252 HydrophobicContact CG1-CG2 3.6Å; I131-I252 HydrophobicContact CD1-CG2 3.74Å; I131-I252 HydrophobicContact CG1-CB 4.47Å; I131-I252 HydrophobicContact CG1-CG2 3.63Å; I134-I252 HydrophobicContact CD1-CD1 4.45Å; F182-I252 HydrophobicContact CB-CB 4.43Å; F182-I252 PolarHBondContact N-O 3.14Å; F182-I252 PolarHBondContact O-N 3.49Å; L184-I252 HydrophobicContact CB-CD1 3.5Å; L184-I252 VanDerWaalsContact CB-CD1 3.5Å; L184-I252 HydrophobicContact CB-CG1 4.23Å; L184-I252 HydrophobicContact CD2-CD1 3.8Å; L184-I252 HydrophobicContact CG-CD1 4.19Å; I252-L259 HydrophobicContact CG1-CD2 4.38Å; I252-L259 HydrophobicContact CG2-CD2 4.21Å
253	K	79	Confident	73.8	Confident	110 Å²	110	65.5 Å²	65.5	48%	0.478	34%	0.342	S	S	.	.			trans	-101.3	146.2	171	-65	-174.4	177.4	-174.2	0	108.9	D255	K253-D255 VanDerWaalsContact C-N 3.25Å; K253-D255 PolarHBondContact O-N 2.73Å
254	E	75.1	Confident	74.8	Confident	113 Å²	113	62.6 Å²	62.6	53%	0.528	33%	0.327	S	S	.	.	S	Bend	trans	-60.4	-39.6	174.1	-68.8	-178.8	176.3	0	0	110.6	I131 F182 F256	I131-E254 HydrophobicContact CD1-CB 4.5Å; I131-E254 HydrophobicContact CD1-CG 3.77Å; F182-E254 HydrophobicContact CE2-CG 4.48Å; E254-F256 PolarHBondContact O-N 3.11Å
255	D	77.1	Confident	75.9	Confident	159 Å²	159	61.9 Å²	61.9	85%	0.85	32%	0.321	S	S	*	.	S	Bend	trans	-93.3	62.3	179.7	-60.9	-28.2	0	0	0	112.8	K253	K253-D255 VanDerWaalsContact C-N 3.25Å; K253-D255 PolarHBondContact O-N 2.73Å
256	F	80.2	Confident	77.1	Confident	23 Å²	23	55 Å²	55	10%	0.101	29%	0.289	C	S	.	.			trans	-86.4	152	175.4	69.1	-82.1	0	0	0	112	S118 V124 V127 E254 L259	S118-F256 WeakPolarHBondContact CB-O 3.45Å; S118-F256 PolarHBondContact OG-O 2.8Å; V124-F256 HydrophobicContact CG2-CZ 4.37Å; V127-F256 HydrophobicContact CB-CD1 4.48Å; V127-F256 HydrophobicContact CB-CE1 3.58Å; V127-F256 HydrophobicContact CB-CZ 3.8Å; V127-F256 HydrophobicContact CG1-CD1 3.93Å; V127-F256 HydrophobicContact CG1-CE1 3.48Å; V127-F256 VanDerWaalsContact CG1-CE1 3.48Å; V127-F256 HydrophobicContact CG1-CZ 4.13Å; V127-F256 HydrophobicContact CG2-CE1 3.8Å; V127-F256 HydrophobicContact CG2-CE2 4.21Å; V127-F256 HydrophobicContact CG2-CZ 3.53Å; E254-F256 PolarHBondContact O-N 3.11Å; F256-L259 HydrophobicContact CB-CB 4.47Å; F256-L259 HydrophobicContact CD2-CB 3.82Å; F256-L259 HydrophobicContact CE2-CB 4.37Å; F256-L259 HydrophobicContact CG-CB 4.26Å
257	K	81.1	Confident	78.7	Confident	174 Å²	174	51.9 Å²	51.9	76%	0.757	27%	0.273	S	S	*	.	S	Bend	trans	-94.9	-59.4	167.4	-70.7	-175.2	178.7	-178.1	0	110.4	N117 S118	N117-K257 PolarHBondContact OD1-O 2.87Å; S118-K257 PolarHBondContact N-O 3.26Å; S118-K257 PolarHBondContact OG-O 3.44Å
258	T	83.1	Confident	80.6	Confident	106 Å²	106	49.8 Å²	49.8	65%	0.65	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.8	173.8	52.6	0	0	0	0	108.4	Y116	Y116-T258 WeakPolarHBondContact O-CA 3.39Å
259	L	85.3	Confident	82.4	Confident	19 Å²	19	47.8 Å²	47.8	10%	0.099	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.2	179.3	-176.4	76.2	0	0	0	108.7	V115 Y116 V127 M250 I252 F256 V261	V115-L259 WeakPolarHBondContact CA-O 3.5Å; Y116-L259 HydrophobicContact CD2-CB 4.4Å; Y116-L259 HydrophobicContact CD2-CD2 4.09Å; Y116-L259 HydrophobicContact CD2-CG 4.45Å; Y116-L259 PolarHBondContact N-O 2.86Å; Y116-L259 PolarHBondContact O-N 3.3Å; V127-L259 HydrophobicContact CG1-CD2 4.26Å; V127-L259 HydrophobicContact CG2-CD2 4.06Å; M250-L259 HydrophobicContact CE-CD1 3.97Å; M250-L259 HydrophobicContact CE-CG 4.24Å; I252-L259 HydrophobicContact CG1-CD2 4.38Å; I252-L259 HydrophobicContact CG2-CD2 4.21Å; F256-L259 HydrophobicContact CB-CB 4.47Å; F256-L259 HydrophobicContact CD2-CB 3.82Å; F256-L259 HydrophobicContact CE2-CB 4.37Å; F256-L259 HydrophobicContact CG-CB 4.26Å; L259-V261 HydrophobicContact CD2-CG2 4.06Å; L259-V261 HydrophobicContact CG-CG2 4.16Å
260	D	84.2	Confident	84	Confident	62 Å²	62	46.3 Å²	46.3	33%	0.332	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.5	173.6	-167.3	-6.1	0	0	0	109	S113 K239 M250	S113-D260 PolarHBondContact OG-OD1 2.86Å; K239-D260 WeakPolarHBondContact CE-OD2 3.18Å; K239-D260 IonicContact NZ-OD2 2.75Å; M250-D260 WeakPolarHBondContact CE-O 3.32Å
261	V	84.8	Confident	85.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	110.7	177.8	-167.2	0	0	0	0	108.4	S113 K114 Y116 L184 N186 M250 L259 Y263	S113-V261 CarbonylContact C-O 3.51Å; S113-V261 WeakPolarHBondContact CA-O 3.2Å; K114-V261 HydrophobicContact CB-CB 4.4Å; K114-V261 PolarHBondContact N-O 2.94Å; K114-V261 PolarHBondContact O-N 3.48Å; Y116-V261 HydrophobicContact CD2-CG2 3.97Å; Y116-V261 HydrophobicContact CE2-CB 4.39Å; Y116-V261 HydrophobicContact CE2-CG2 3.53Å; L184-V261 HydrophobicContact CD2-CG1 3.83Å; N186-V261 HydrophobicContact CB-CG1 4.47Å; M250-V261 HydrophobicContact CE-CB 3.77Å; M250-V261 HydrophobicContact CE-CG1 3.82Å; M250-V261 HydrophobicContact CE-CG2 3.43Å; M250-V261 VanDerWaalsContact CE-CG2 3.43Å; M250-V261 HydrophobicContact SD-CG1 4.2Å; L259-V261 HydrophobicContact CD2-CG2 4.06Å; L259-V261 HydrophobicContact CG-CG2 4.16Å; V261-Y263 HydrophobicContact CB-CE2 4.23Å; V261-Y263 HydrophobicContact CG1-CD2 4.22Å; V261-Y263 HydrophobicContact CG1-CE1 4.28Å; V261-Y263 HydrophobicContact CG1-CE2 3.67Å
262	V	85.4	Confident	86.2	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117	176.7	-175.7	0	0	0	0	108.6	L110 N186 H237 T264	L110-V262 HydrophobicContact CD1-CG1 3.36Å; N186-V262 PolarHBondContact ND2-O 3.29Å; H237-V262 HydrophobicContact CB-CB 3.78Å; H237-V262 HydrophobicContact CB-CG1 3.81Å; H237-V262 HydrophobicContact CB-CG2 4.09Å; V262-T264 HydrophobicContact CG1-CG2 4.06Å
263	Y	88.9	Confident	86.7	Confident	12 Å²	12	58.3 Å²	58.3	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.3	177.7	-66.6	-87.2	0	0	0	110.7	F70 C71 L111 C112 K114 L184 N186 V261	F70-Y263 HydrophobicContact CD1-CE1 4.3Å; C71-Y263 VanDerWaalsContact SG-CB 3.54Å; C71-Y263 WeakPolarHBondContact SG-CD2 3.46Å; C71-Y263 VanDerWaalsContact SG-CG 3.58Å; L111-Y263 WeakPolarHBondContact CB-O 3.21Å; L111-Y263 PolarHBondContact N-O 3.36Å; C112-Y263 PolarHBondContact O-N 3.21Å; K114-Y263 HydrophobicContact CG-CD2 4.47Å; K114-Y263 HydrophobicContact CG-CE2 3.96Å; L184-Y263 HydrophobicContact CD2-CE1 4.46Å; N186-Y263 HydrophobicContact CB-CD1 4.29Å; N186-Y263 WeakPolarHBondContact O-CA 3.43Å; V261-Y263 HydrophobicContact CB-CE2 4.23Å; V261-Y263 HydrophobicContact CG1-CD2 4.22Å; V261-Y263 HydrophobicContact CG1-CE1 4.28Å; V261-Y263 HydrophobicContact CG1-CE2 3.67Å
264	T	89.6	Confident	87.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.7	-175.5	61.2	0	0	0	0	111.3	K109 L110 N186 H187 I188 H237 V242 V262	K109-T264 CarbonylContact O-C 3.54Å; K109-T264 WeakPolarHBondContact O-CA 3.21Å; K109-T264 WeakPolarHBondContact O-CB 3.1Å; L110-T264 HydrophobicContact CD1-CG2 4.46Å; N186-T264 PolarHBondContact O-N 3.46Å; H187-T264 WeakPolarHBondContact CA-O 3.28Å; H187-T264 PolarHBondContact ND1-O 3.14Å; H187-T264 PolarHBondContact ND1-OG1 3.46Å; I188-T264 PolarHBondContact N-O 3Å; I188-T264 VanDerWaalsContact N-O 3.08Å; H237-T264 VanDerWaalsContact CD2-CG2 3.47Å; H237-T264 WeakPolarHBondContact CD2-CG2 3.4Å; H237-T264 VanDerWaalsContact NE2-CG2 3.27Å; H237-T264 WeakPolarHBondContact NE2-CG2 3.36Å; H237-T264 PolarHBondContact NE2-OG1 3.04Å; V242-T264 HydrophobicContact CG1-CG2 3.38Å; V262-T264 HydrophobicContact CG1-CG2 4.06Å
265	Y	91.4	Very high	87.5	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	155.1	177.8	65.4	-76.5	0	0	0	112.6	Y98 C108 K109 L111 I188 V267	Y98-Y265 AromaticContact CD1-CD1 3.71Å; Y98-Y265 HydrophobicContact CD1-CD1 3.71Å; Y98-Y265 HydrophobicContact CD1-CD2 4.05Å; Y98-Y265 HydrophobicContact CD1-CE1 4.05Å; Y98-Y265 HydrophobicContact CD1-CE2 4.37Å; Y98-Y265 AromaticContact CD1-CG 3.69Å; Y98-Y265 HydrophobicContact CD1-CG 3.69Å; Y98-Y265 AromaticContact CE1-CD1 3.82Å; Y98-Y265 HydrophobicContact CE1-CD1 3.82Å; Y98-Y265 AromaticContact CE1-CG 3.84Å; Y98-Y265 HydrophobicContact CE1-CG 3.84Å; C108-Y265 PolarHBondContact N-O 2.93Å; K109-Y265 HydrophobicContact CB-CD1 4.32Å; K109-Y265 HydrophobicContact CB-CE1 3.95Å; K109-Y265 HydrophobicContact CB-CE2 4.39Å; K109-Y265 HydrophobicContact CD-CE1 4.14Å; K109-Y265 HydrophobicContact CD-CE2 4.26Å; K109-Y265 VanDerWaalsContact CD-OH 3.24Å; K109-Y265 WeakPolarHBondContact CD-OH 3.43Å; K109-Y265 WeakPolarHBondContact CE-OH 3.28Å; K109-Y265 HydrophobicContact CG-CE1 3.94Å; K109-Y265 PolarHBondContact N-O 3.22Å; K109-Y265 PolarHBondContact NZ-OH 2.85Å; K109-Y265 WeakPolarHBondContact O-CD1 3.26Å; K109-Y265 PolarHBondContact O-N 2.74Å; L111-Y265 HydrophobicContact CB-CD1 4.12Å; L111-Y265 HydrophobicContact CB-CE1 4.26Å; L111-Y265 HydrophobicContact CD1-CD1 4.22Å; L111-Y265 HydrophobicContact CD1-CE1 3.9Å; I188-Y265 CarbonylContact O-C 3.57Å; I188-Y265 WeakPolarHBondContact O-CA 3.39Å; I188-Y265 WeakPolarHBondContact O-CB 3.48Å; Y265-V267 HydrophobicContact CD2-CG2 3.82Å; Y265-V267 HydrophobicContact CE2-CG2 4.02Å
266	S	91.2	Very high	87.8	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.014	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153.9	164.9	-39.7	0	0	0	0	109.8	Q106 C108 H187 I188 D189 F190	Q106-S266 CarbonylContact O-C 3.56Å; Q106-S266 WeakPolarHBondContact O-CA 3.27Å; Q106-S266 VanDerWaalsContact O-CB 3.31Å; Q106-S266 WeakPolarHBondContact O-CB 3.29Å; C108-S266 PolarHBondContact N-OG 3.23Å; C108-S266 VanDerWaalsContact N-OG 3.13Å; H187-S266 PolarHBondContact CE1-OG 3.49Å; H187-S266 VanDerWaalsContact CE1-OG 3.28Å; H187-S266 PolarHBondContact NE2-OG 2.84Å; I188-S266 PolarHBondContact O-N 3Å; D189-S266 WeakPolarHBondContact OD1-CB 3.27Å; D189-S266 PolarHBondContact OD1-OG 2.93Å; F190-S266 PolarHBondContact N-O 3.2Å
267	V	93.3	Very high	87.9	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.7	175.6	-172	0	0	0	0	108.2	I100 N105 Q106 F190 I192 Y265 F269	I100-V267 HydrophobicContact CD1-CG2 4.01Å; I100-V267 HydrophobicContact CG1-CG2 3.98Å; I100-V267 HydrophobicContact CG2-CG1 3.92Å; I100-V267 HydrophobicContact CG2-CG2 4.26Å; N105-V267 VanDerWaalsContact CA-O 3.3Å; N105-V267 WeakPolarHBondContact CA-O 3.25Å; Q106-V267 PolarHBondContact N-O 3.24Å; Q106-V267 PolarHBondContact O-N 2.99Å; F190-V267 HydrophobicContact CB-CG1 4.38Å; F190-V267 HydrophobicContact CB-CG2 4.36Å; F190-V267 HydrophobicContact CD2-CG2 4.31Å; F190-V267 WeakPolarHBondContact O-CA 3.34Å; I192-V267 HydrophobicContact CD1-CG1 3.93Å; Y265-V267 HydrophobicContact CD2-CG2 3.82Å; Y265-V267 HydrophobicContact CE2-CG2 4.02Å; V267-F269 HydrophobicContact CG1-CD2 3.93Å; V267-F269 HydrophobicContact CG1-CE2 3.45Å; V267-F269 VanDerWaalsContact CG1-CE2 3.45Å; V267-F269 HydrophobicContact CG1-CZ 3.99Å
268	T	93.7	Very high	88.1	Confident	54 Å²	54	48.9 Å²	48.9	33%	0.331	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.2	174.3	-52.3	0	0	0	0	108.5	F190 L191 I192 V270	F190-T268 PolarHBondContact O-N 3.38Å; L191-T268 WeakPolarHBondContact CA-O 3.24Å; L191-T268 HydrophobicContact CD1-CG2 4.31Å; I192-T268 PolarHBondContact N-O 3.26Å; T268-V270 HydrophobicContact CG2-CG2 4.33Å
269	F	93.9	Very high	88.2	Confident	15 Å²	15	44.3 Å²	44.3	7%	0.066	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.4	173.9	-73.5	-87.6	0	0	0	110.4	I100 L101 F102 N105 I192 Y194 V267	I100-F269 HydrophobicContact CG2-CE2 4.24Å; I100-F269 HydrophobicContact CG2-CZ 3.8Å; L101-F269 WeakPolarHBondContact O-CE2 3.39Å; L101-F269 WeakPolarHBondContact O-CZ 3.47Å; F102-F269 HydrophobicContact CD2-CE1 4.08Å; N105-F269 PolarHBondContact OD1-N 3.03Å; I192-F269 HydrophobicContact CB-CD1 3.83Å; I192-F269 HydrophobicContact CB-CE1 3.85Å; I192-F269 HydrophobicContact CD1-CE1 3.87Å; I192-F269 HydrophobicContact CD1-CZ 3.91Å; I192-F269 HydrophobicContact CG1-CE1 4.45Å; I192-F269 HydrophobicContact CG2-CD1 3.86Å; I192-F269 HydrophobicContact CG2-CE1 3.7Å; I192-F269 WeakPolarHBondContact O-CA 3.49Å; Y194-F269 HydrophobicContact CD1-CB 4.08Å; Y194-F269 HydrophobicContact CD1-CD1 4.03Å; Y194-F269 HydrophobicContact CE1-CB 3.8Å; Y194-F269 HydrophobicContact CE1-CD1 4.4Å; V267-F269 HydrophobicContact CG1-CD2 3.93Å; V267-F269 HydrophobicContact CG1-CE2 3.45Å; V267-F269 VanDerWaalsContact CG1-CE2 3.45Å; V267-F269 HydrophobicContact CG1-CZ 3.99Å
270	V	93.5	Very high	88.1	Confident	59 Å²	59	45.3 Å²	45.3	36%	0.358	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.9	178.2	177	0	0	0	0	109.6	L191 I192 E193 Y194 T268	L191-V270 HydrophobicContact CD1-CB 4.43Å; L191-V270 HydrophobicContact CD1-CG2 3.58Å; I192-V270 PolarHBondContact O-N 2.93Å; E193-V270 CarbonylContact C-O 3.57Å; E193-V270 VanDerWaalsContact CA-O 3.26Å; E193-V270 WeakPolarHBondContact CA-O 3.44Å; E193-V270 HydrophobicContact CG-CB 4.34Å; Y194-V270 WeakPolarHBondContact CD1-O 3.47Å; Y194-V270 PolarHBondContact N-O 2.84Å; T268-V270 HydrophobicContact CG2-CG2 4.33Å
271	K	92.1	Very high	88	Confident	126 Å²	126	46 Å²	46	55%	0.548	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	137.7	176.8	-66.5	-170.9	179.8	-162.2	0	110.8	Y194 D196	Y194-K271 HydrophobicContact CE1-CG 3.91Å; Y194-K271 HydrophobicContact CE2-CG 4Å; Y194-K271 CarbonylContact O-C 3.58Å; Y194-K271 VanDerWaalsContact O-CA 3.31Å; Y194-K271 WeakPolarHBondContact O-CA 3.32Å; Y194-K271 WeakPolarHBondContact OH-CE 3.39Å; D196-K271 IonicContact OD2-NZ 3.77Å; D196-K271 PolarHBondContact OD2-NZ 3.26Å
272	T	89.9	Confident	87.8	Confident	27 Å²	27	48.4 Å²	48.4	17%	0.166	26%	0.256	C	S	.	.			trans	-138.5	151.2	175.6	62.3	0	0	0	0	112.4	E193 Y194 R195 I213	E193-T272 HydrophobicContact CB-CG2 3.72Å; E193-T272 HydrophobicContact CG-CG2 3.81Å; Y194-T272 PolarHBondContact O-N 2.8Å; R195-T272 WeakPolarHBondContact CA-O 3.27Å; R195-T272 WeakPolarHBondContact CB-O 3.44Å; I213-T272 VanDerWaalsContact CD1-OG1 3.25Å; I213-T272 WeakPolarHBondContact CD1-OG1 3.5Å
273	D	87.6	Confident	87.5	Confident	157 Å²	157	48.3 Å²	48.3	84%	0.84	26%	0.256	S	S	*	.			trans	-93.1	1.6	-177	-61.4	-40.5	0	0	0	113.8	R195	R195-D273 PolarHBondContact NH1-O 3.38Å
274	V	86.7	Confident	86.7	Confident	66 Å²	66	49.1 Å²	49.1	40%	0.4	26%	0.261	S	S	.	.			trans	-63.1	139.6	-178.2	178.9	0	0	0	0	109.9	R195 I213 S278	R195-V274 VanDerWaalsContact CD-O 3.23Å; R195-V274 WeakPolarHBondContact CD-O 3.36Å; R195-V274 PolarHBondContact NH1-O 3.44Å; R195-V274 VanDerWaalsContact NH1-O 3.1Å; I213-V274 HydrophobicContact CD1-CB 4.15Å; I213-V274 WeakPolarHBondContact CD1-O 3.3Å; I213-V274 HydrophobicContact CG2-CB 4.12Å; I213-V274 HydrophobicContact CG2-CG1 4.11Å; V274-S278 VanDerWaalsContact CG1-OG 3.3Å; V274-S278 WeakPolarHBondContact CG1-OG 3.4Å
275	K	85.4	Confident	85.7	Confident	144 Å²	144	55.4 Å²	55.4	63%	0.626	29%	0.294	S	S	*	.			trans	-70.1	141.4	178.5	-68.8	179.5	-179.5	176.1	0	109.9	A277 S278	K275-A277 PolarHBondContact O-N 2.93Å; K275-A277 VanDerWaalsContact O-N 3.16Å; K275-S278 PolarHBondContact O-N 2.86Å; K275-S278 PolarHBondContact O-OG 3.42Å
276	W	82.7	Confident	84.3	Confident	48 Å²	48	56.9 Å²	56.9	18%	0.182	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-57.4	-33.7	177	-179.2	85.2	0	0	0	112.4	P30 S278 R279	P30-W276 HydrophobicContact CB-CD2 4.04Å; P30-W276 HydrophobicContact CB-CE3 4.47Å; P30-W276 HydrophobicContact CB-CH2 4.23Å; P30-W276 HydrophobicContact CB-CZ2 3.77Å; W276-S278 VanDerWaalsContact C-N 3.26Å; W276-S278 PolarHBondContact O-N 3.05Å; W276-R279 VanDerWaalsContact O-CB 3.25Å; W276-R279 WeakPolarHBondContact O-CB 3.2Å; W276-R279 WeakPolarHBondContact O-CD 3.12Å; W276-R279 WeakPolarHBondContact O-CG 3.2Å; W276-R279 PolarHBondContact O-N 3.5Å
277	A	82.1	Confident	82.8	Confident	90 Å²	90	59 Å²	59	74%	0.744	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-62.4	-29.4	176.9	0	0	0	0	0	113.6	K275	K275-A277 PolarHBondContact O-N 2.93Å; K275-A277 VanDerWaalsContact O-N 3.16Å
278	S	84.4	Confident	81.1	Confident	33 Å²	33	61.2 Å²	61.2	23%	0.231	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-95.8	14.4	178.7	56.5	0	0	0	0	113	V274 K275 W276 W280 D281	V274-S278 VanDerWaalsContact CG1-OG 3.3Å; V274-S278 WeakPolarHBondContact CG1-OG 3.4Å; K275-S278 PolarHBondContact O-N 2.86Å; K275-S278 PolarHBondContact O-OG 3.42Å; W276-S278 VanDerWaalsContact C-N 3.26Å; W276-S278 PolarHBondContact O-N 3.05Å; S278-W280 PolarHBondContact O-N 3.47Å; S278-D281 WeakPolarHBondContact CB-OD2 3.38Å; S278-D281 WeakPolarHBondContact O-CB 3.2Å; S278-D281 PolarHBondContact O-N 2.79Å; S278-D281 VanDerWaalsContact O-N 3.14Å
279	R	86.2	Confident	79.6	Confident	10 Å²	10	61.5 Å²	61.5	4%	0.038	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.4	-175.8	73.1	-175.6	-175.8	155.2	-1.8	114.6	D145 L147 I213 W276 Y282	D145-R279 IonicContact OD2-CZ 2.99Å; D145-R279 IonicContact OD2-NH1 3.66Å; D145-R279 PolarHBondContact OD2-NH1 2.78Å; L147-R279 HydrophobicContact CD2-CG 4.24Å; I213-R279 HydrophobicContact CG2-CB 4.2Å; W276-R279 VanDerWaalsContact O-CB 3.25Å; W276-R279 WeakPolarHBondContact O-CB 3.2Å; W276-R279 WeakPolarHBondContact O-CD 3.12Å; W276-R279 WeakPolarHBondContact O-CG 3.2Å; W276-R279 PolarHBondContact O-N 3.5Å; R279-Y282 WeakPolarHBondContact O-CD1 3.49Å; R279-Y282 WeakPolarHBondContact O-CE1 3.43Å
280	W	83.6	Confident	78.5	Confident	39 Å²	39	63.1 Å²	63.1	15%	0.148	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-16.3	178	-76.3	88.3	0	0	0	112.8	L147 P148 S278 Y282 I283 L284 A387	L147-W280 HydrophobicContact CD2-CD2 4Å; L147-W280 HydrophobicContact CD2-CE3 4.48Å; L147-W280 HydrophobicContact CD2-CG 4.42Å; L147-W280 HydrophobicContact CD2-CH2 4.4Å; L147-W280 HydrophobicContact CD2-CZ2 3.88Å; P148-W280 HydrophobicContact CG-CZ3 4.22Å; S278-W280 PolarHBondContact O-N 3.47Å; W280-Y282 VanDerWaalsContact C-N 3.25Å; W280-Y282 PolarHBondContact O-N 3.44Å; W280-I283 HydrophobicContact CE3-CD1 3.85Å; W280-I283 HydrophobicContact CZ3-CD1 4.1Å; W280-I283 PolarHBondContact O-N 3.19Å; W280-L284 HydrophobicContact CB-CD1 3.77Å; W280-L284 HydrophobicContact CB-CG 4.18Å; W280-L284 VanDerWaalsContact O-CG 3.22Å; W280-L284 WeakPolarHBondContact O-CG 3.29Å; W280-L284 PolarHBondContact O-N 2.93Å; W280-A387 HydrophobicContact CZ2-CB 3.76Å
281	D	80.9	Confident	77.8	Confident	78 Å²	78	66 Å²	66	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-35.9	-171.8	-67.1	-4.2	0	0	0	112.4	S278 I283 L284 N285	S278-D281 WeakPolarHBondContact CB-OD2 3.38Å; S278-D281 WeakPolarHBondContact O-CB 3.2Å; S278-D281 PolarHBondContact O-N 2.79Å; S278-D281 VanDerWaalsContact O-N 3.14Å; D281-I283 PolarHBondContact O-N 2.77Å; D281-L284 PolarHBondContact O-N 3.49Å; D281-N285 VanDerWaalsContact O-CB 3.25Å; D281-N285 WeakPolarHBondContact O-CB 3.47Å; D281-N285 VanDerWaalsContact O-CG 3.25Å; D281-N285 PolarHBondContact O-N 2.96Å; D281-N285 PolarHBondContact O-ND2 3.46Å
282	Y	80.3	Confident	77.1	Confident	49 Å²	49	64 Å²	64	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-67.5	-23.5	178.5	85.6	-90.7	0	0	0	113.3	T150 I213 S214 V215 R279 W280 L286	T150-Y282 HydrophobicContact CG2-CE2 3.76Å; I213-Y282 WeakPolarHBondContact O-CE1 3.42Å; S214-Y282 VanDerWaalsContact CB-CE1 3.45Å; V215-Y282 PolarHBondContact N-OH 3.4Å; R279-Y282 WeakPolarHBondContact O-CD1 3.49Å; R279-Y282 WeakPolarHBondContact O-CE1 3.43Å; W280-Y282 VanDerWaalsContact C-N 3.25Å; W280-Y282 PolarHBondContact O-N 3.44Å; Y282-L286 WeakPolarHBondContact O-CD2 3.41Å; Y282-L286 WeakPolarHBondContact O-CG 3.4Å
283	I	79.3	Confident	76.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-87.1	-42.5	175.8	-62.4	158.7	0	0	0	109.6	L147 P148 T150 I162 W280 D281 L286	L147-I283 HydrophobicContact CD2-CD1 4.1Å; P148-I283 HydrophobicContact CG-CD1 3.6Å; P148-I283 HydrophobicContact CG-CG1 4.38Å; P148-I283 HydrophobicContact CG-CG2 4.36Å; T150-I283 HydrophobicContact CG2-CG1 4.1Å; I162-I283 HydrophobicContact CD1-CG2 3.82Å; I162-I283 HydrophobicContact CG1-CG2 4.08Å; W280-I283 HydrophobicContact CE3-CD1 3.85Å; W280-I283 HydrophobicContact CZ3-CD1 4.1Å; W280-I283 PolarHBondContact O-N 3.19Å; D281-I283 PolarHBondContact O-N 2.77Å; I283-L286 WeakPolarHBondContact O-CB 3.18Å; I283-L286 WeakPolarHBondContact O-CG 3.43Å; I283-L286 PolarHBondContact O-N 2.85Å
284	L	73.8	Confident	76.3	Confident	29 Å²	29	62.8 Å²	62.8	15%	0.152	33%	0.333	C	S	.	.	H	α-helix	trans	-70.8	-32.6	-174.1	-63.6	176.8	0	0	0	112.5	W280 D281 L286 Y546	W280-L284 HydrophobicContact CB-CD1 3.77Å; W280-L284 HydrophobicContact CB-CG 4.18Å; W280-L284 VanDerWaalsContact O-CG 3.22Å; W280-L284 WeakPolarHBondContact O-CG 3.29Å; W280-L284 PolarHBondContact O-N 2.93Å; D281-L284 PolarHBondContact O-N 3.49Å; L284-L286 VanDerWaalsContact C-N 3.27Å; L284-L286 PolarHBondContact O-N 2.97Å; L284-Y546 HydrophobicContact CD1-CD1 3.74Å; L284-Y546 HydrophobicContact CD1-CD2 3.52Å; L284-Y546 HydrophobicContact CD1-CE1 3.62Å; L284-Y546 HydrophobicContact CD1-CE2 3.39Å; L284-Y546 HydrophobicContact CD1-CG 3.7Å; L284-Y546 VanDerWaalsContact CD1-CZ 3.44Å; L284-Y546 VanDerWaalsContact CD2-CB 3.48Å; L284-Y546 HydrophobicContact CD2-CD1 4.17Å; L284-Y546 HydrophobicContact CD2-CD2 3.41Å; L284-Y546 VanDerWaalsContact CD2-CD2 3.41Å; L284-Y546 HydrophobicContact CD2-CE2 4.16Å; L284-Y546 HydrophobicContact CD2-CG 3.41Å; L284-Y546 VanDerWaalsContact CD2-CG 3.41Å; L284-Y546 HydrophobicContact CG-CD1 4.37Å; L284-Y546 HydrophobicContact CG-CD2 4.07Å; L284-Y546 HydrophobicContact CG-CE2 4.4Å; L284-Y546 HydrophobicContact CG-CG 4.06Å
285	N	68	Low	76	Confident	132 Å²	132	66.7 Å²	66.7	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-9	176.2	-71.7	-25	0	0	0	113.8	D281 N287	D281-N285 VanDerWaalsContact O-CB 3.25Å; D281-N285 WeakPolarHBondContact O-CB 3.47Å; D281-N285 VanDerWaalsContact O-CG 3.25Å; D281-N285 PolarHBondContact O-N 2.96Å; D281-N285 PolarHBondContact O-ND2 3.46Å; N285-N287 VanDerWaalsContact C-N 3.35Å; N285-N287 PolarHBondContact O-N 3.24Å
286	L	62.7	Low	75.8	Confident	35 Å²	35	60 Å²	60	18%	0.183	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-30.2	-173.3	-63.7	176.1	0	0	0	114.1	T150 C160 Y282 I283 L284	T150-L286 HydrophobicContact CG2-CD1 4.14Å; C160-L286 HydrophobicContact CB-CD1 3.91Å; C160-L286 HydrophobicContact CB-CD2 3.54Å; C160-L286 HydrophobicContact CB-CG 4.34Å; Y282-L286 WeakPolarHBondContact O-CD2 3.41Å; Y282-L286 WeakPolarHBondContact O-CG 3.4Å; I283-L286 WeakPolarHBondContact O-CB 3.18Å; I283-L286 WeakPolarHBondContact O-CG 3.43Å; I283-L286 PolarHBondContact O-N 2.85Å; L284-L286 VanDerWaalsContact C-N 3.27Å; L284-L286 PolarHBondContact O-N 2.97Å
287	N	58.5	Low	75.9	Confident	46 Å²	46	58.5 Å²	58.5	25%	0.246	31%	0.312	C	S	.	.	S	Bend	trans	-113	-22.8	-154.7	-74	-36.8	0	0	0	116.6	N285	N285-N287 VanDerWaalsContact C-N 3.35Å; N285-N287 PolarHBondContact O-N 3.24Å
288	V	58.7	Low	75.9	Confident	49 Å²	49	57.9 Å²	57.9	30%	0.297	30%	0.302	S	S	.	.			trans	-159.3	136.6	-177.1	-174.7	0	0	0	0	112.8	S290 F534	V288-S290 PolarHBondContact O-N 3.38Å; V288-F534 HydrophobicContact CB-CE1 4.18Å; V288-F534 HydrophobicContact CG1-CD1 4.33Å; V288-F534 HydrophobicContact CG1-CE1 3.34Å; V288-F534 HydrophobicContact CG1-CZ 3.63Å; V288-F534 HydrophobicContact CG2-CD1 4Å; V288-F534 HydrophobicContact CG2-CE1 3.66Å
289	S	61.6	Low	75.8	Confident	59 Å²	59	59.8 Å²	59.8	41%	0.413	31%	0.31	S	S	.	.			trans	-67.1	120.5	167.5	50.6	0	0	0	0	111.6	N291 I292	S289-N291 PolarHBondContact O-N 3.34Å; S289-I292 PolarHBondContact O-N 3.45Å; S289-I292 VanDerWaalsContact O-N 3.13Å; S289-I292 WeakPolarHBondContact OG-CD1 3.23Å
290	S	70.1	Confident	75.7	Confident	50 Å²	50	59.4 Å²	59.4	35%	0.35	31%	0.309	S	S	.	.	H	α-helix	trans	-50.3	-26.8	173.1	52	0	0	0	0	113.3	V288 I292 Q293 W294	V288-S290 PolarHBondContact O-N 3.38Å; S290-I292 VanDerWaalsContact C-N 3.31Å; S290-I292 PolarHBondContact O-N 2.67Å; S290-Q293 PolarHBondContact O-N 3.04Å; S290-Q293 VanDerWaalsContact O-N 3.11Å; S290-W294 VanDerWaalsContact O-CD1 3.29Å; S290-W294 PolarHBondContact O-N 2.92Å; S290-W294 VanDerWaalsContact O-N 3.16Å
291	N	78.4	Confident	75.8	Confident	119 Å²	119	61.4 Å²	61.4	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-54.6	-40.5	177.6	-63.8	-17.1	0	0	0	113.6	S289 Q293 W294 F295	S289-N291 PolarHBondContact O-N 3.34Å; N291-Q293 VanDerWaalsContact C-N 3.29Å; N291-Q293 PolarHBondContact O-N 2.99Å; N291-W294 PolarHBondContact O-N 2.73Å; N291-F295 PolarHBondContact O-N 3.01Å
292	I	78.8	Confident	76.1	Confident	83 Å²	83	63 Å²	63	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-66.6	-36	-179.2	-62.3	169.8	0	0	0	110.4	S289 S290 F295 G296 V530 F534	S289-I292 PolarHBondContact O-N 3.45Å; S289-I292 VanDerWaalsContact O-N 3.13Å; S289-I292 WeakPolarHBondContact OG-CD1 3.23Å; S290-I292 VanDerWaalsContact C-N 3.31Å; S290-I292 PolarHBondContact O-N 2.67Å; I292-F295 PolarHBondContact O-N 2.69Å; I292-G296 PolarHBondContact O-N 3.02Å; I292-V530 HydrophobicContact CG2-CG1 4.24Å; I292-F534 HydrophobicContact CB-CZ 4.32Å; I292-F534 HydrophobicContact CG2-CE2 4.28Å; I292-F534 HydrophobicContact CG2-CZ 3.87Å
293	Q	76.6	Confident	76.2	Confident	5 Å²	5	62 Å²	62	2%	0.023	33%	0.327	C	S	.	.	H	α-helix	trans	-71.9	-41.5	179.8	-60.6	-164.9	11.3	0	0	112.1	S290 N291 F295 G296 I297 F534 M547 F550	S290-Q293 PolarHBondContact O-N 3.04Å; S290-Q293 VanDerWaalsContact O-N 3.11Å; N291-Q293 VanDerWaalsContact C-N 3.29Å; N291-Q293 PolarHBondContact O-N 2.99Å; Q293-F295 VanDerWaalsContact C-N 3.32Å; Q293-F295 PolarHBondContact O-N 3.16Å; Q293-G296 PolarHBondContact O-N 3.48Å; Q293-I297 PolarHBondContact O-N 2.88Å; Q293-F534 HydrophobicContact CG-CD2 4.3Å; Q293-F534 HydrophobicContact CG-CE2 3.68Å; Q293-F534 HydrophobicContact CG-CZ 4.12Å; Q293-M547 HydrophobicContact CG-SD 4.31Å; Q293-M547 PolarHBondContact NE2-SD 3.14Å; Q293-M547 VanDerWaalsContact OE1-CB 3.24Å; Q293-M547 PolarHBondContact OE1-SD 3.38Å; Q293-F550 HydrophobicContact CB-CD1 3.89Å; Q293-F550 HydrophobicContact CB-CE1 4.18Å; Q293-F550 HydrophobicContact CB-CG 4.47Å
294	W	82.7	Confident	76.4	Confident	155 Å²	155	63.3 Å²	63.3	59%	0.587	33%	0.334	S	S	*	.	H	α-helix	trans	-61	-40.8	173.5	-77.6	112.2	0	0	0	112.1	S290 N291 G296 I297 S298 F550	S290-W294 VanDerWaalsContact O-CD1 3.29Å; S290-W294 PolarHBondContact O-N 2.92Å; S290-W294 VanDerWaalsContact O-N 3.16Å; N291-W294 PolarHBondContact O-N 2.73Å; W294-G296 PolarHBondContact O-N 3.44Å; W294-I297 PolarHBondContact O-N 3.49Å; W294-S298 WeakPolarHBondContact O-CB 3.46Å; W294-S298 PolarHBondContact O-N 3.03Å; W294-F550 AromaticContact CD2-CE1 3.78Å; W294-F550 HydrophobicContact CD2-CE1 3.78Å; W294-F550 HydrophobicContact CD2-CZ 4.24Å; W294-F550 AromaticContact CE2-CE1 3.58Å; W294-F550 AromaticContact CE2-CZ 3.56Å; W294-F550 HydrophobicContact CE3-CE1 4.27Å; W294-F550 HydrophobicContact CG-CE1 4.14Å; W294-F550 HydrophobicContact CH2-CE1 4.39Å; W294-F550 AromaticContact CZ2-CE1 3.92Å; W294-F550 HydrophobicContact CZ2-CE1 3.92Å; W294-F550 AromaticContact CZ2-CZ 3.72Å; W294-F550 HydrophobicContact CZ2-CZ 3.72Å; W294-F550 AromaticContact NE1-CE1 3.82Å; W294-F550 AromaticContact NE1-CZ 3.57Å
295	F	82	Confident	77.1	Confident	148 Å²	148	67 Å²	67	65%	0.649	35%	0.353	S	S	*	.	H	α-helix	trans	-60.1	-44.8	173.2	-178.8	-98.9	0	0	0	111.9	N291 I292 Q293 I297 S298 N299	N291-F295 PolarHBondContact O-N 3.01Å; I292-F295 PolarHBondContact O-N 2.69Å; Q293-F295 VanDerWaalsContact C-N 3.32Å; Q293-F295 PolarHBondContact O-N 3.16Å; F295-I297 PolarHBondContact O-N 3.44Å; F295-S298 PolarHBondContact O-N 2.85Å; F295-N299 PolarHBondContact O-N 3.35Å
296	G	80.8	Confident	77.9	Confident	3 Å²	3	66.9 Å²	66.9	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-61	-43	176.5	0	0	0	0	0	113.6	I292 Q293 W294 S300	I292-G296 PolarHBondContact O-N 3.02Å; Q293-G296 PolarHBondContact O-N 3.48Å; W294-G296 PolarHBondContact O-N 3.44Å; G296-S300 WeakPolarHBondContact O-CB 3.29Å; G296-S300 PolarHBondContact O-N 3.46Å; G296-S300 VanDerWaalsContact O-N 3.09Å; G296-S300 PolarHBondContact O-OG 3.21Å
297	I	83.7	Confident	78.8	Confident	16 Å²	16	65.5 Å²	65.5	8%	0.082	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-46.3	175.1	-69.9	-173.5	0	0	0	110.6	Q293 W294 F295 N299 S300 I301 F550 V554 I557	Q293-I297 PolarHBondContact O-N 2.88Å; W294-I297 PolarHBondContact O-N 3.49Å; F295-I297 PolarHBondContact O-N 3.44Å; I297-N299 VanDerWaalsContact C-N 3.33Å; I297-N299 PolarHBondContact O-N 3.34Å; I297-S300 PolarHBondContact O-N 3.25Å; I297-S300 VanDerWaalsContact O-N 3.1Å; I297-I301 HydrophobicContact CG2-CD1 3.7Å; I297-I301 HydrophobicContact CG2-CG1 4.24Å; I297-I301 WeakPolarHBondContact O-CG1 3.34Å; I297-I301 PolarHBondContact O-N 3.26Å; I297-F550 HydrophobicContact CD1-CB 4.32Å; I297-F550 HydrophobicContact CD1-CD1 3.34Å; I297-F550 HydrophobicContact CD1-CE1 4.01Å; I297-F550 HydrophobicContact CD1-CG 4.21Å; I297-F550 HydrophobicContact CG1-CD1 4.32Å; I297-V554 HydrophobicContact CD1-CG2 4.38Å; I297-V554 HydrophobicContact CG1-CG2 3.84Å; I297-I557 HydrophobicContact CG2-CD1 4.47Å
298	S	82.8	Confident	80.1	Confident	78 Å²	78	65.3 Å²	65.3	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-57.9	-45.4	179.6	-171.3	0	0	0	0	111.9	W294 F295 S300 I301 L302	W294-S298 WeakPolarHBondContact O-CB 3.46Å; W294-S298 PolarHBondContact O-N 3.03Å; F295-S298 PolarHBondContact O-N 2.85Å; S298-S300 VanDerWaalsContact C-N 3.32Å; S298-S300 PolarHBondContact O-N 3.46Å; S298-I301 PolarHBondContact O-N 3.02Å; S298-L302 PolarHBondContact O-N 3.09Å; S298-L302 VanDerWaalsContact O-N 3.14Å
299	N	81.3	Confident	81.4	Confident	73 Å²	73	66.9 Å²	66.9	39%	0.39	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-39.2	176.6	-174.3	44.4	0	0	0	112	F295 I297 L302 I303	F295-N299 PolarHBondContact O-N 3.35Å; I297-N299 VanDerWaalsContact C-N 3.33Å; I297-N299 PolarHBondContact O-N 3.34Å; N299-L302 WeakPolarHBondContact O-CB 3.48Å; N299-L302 PolarHBondContact O-N 2.89Å; N299-I303 WeakPolarHBondContact O-CG1 3.38Å; N299-I303 PolarHBondContact O-N 3.5Å; N299-I303 VanDerWaalsContact O-N 3.14Å
300	S	84.7	Confident	82.3	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.014	35%	0.347	C	S	.	.	H	α-helix	trans	-70	-37.1	-179.7	-54.5	0	0	0	0	112.6	G296 I297 S298 L302 I303 I304 C527	G296-S300 WeakPolarHBondContact O-CB 3.29Å; G296-S300 PolarHBondContact O-N 3.46Å; G296-S300 VanDerWaalsContact O-N 3.09Å; G296-S300 PolarHBondContact O-OG 3.21Å; I297-S300 PolarHBondContact O-N 3.25Å; I297-S300 VanDerWaalsContact O-N 3.1Å; S298-S300 VanDerWaalsContact C-N 3.32Å; S298-S300 PolarHBondContact O-N 3.46Å; S300-L302 VanDerWaalsContact C-N 3.31Å; S300-I303 PolarHBondContact O-N 3.46Å; S300-I304 PolarHBondContact O-N 3.02Å; S300-I304 VanDerWaalsContact O-N 3.08Å; S300-C527 PolarHBondContact OG-O 2.96Å
301	I	86.4	Confident	82.6	Confident	80 Å²	80	66 Å²	66	41%	0.41	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-40.9	173.1	-69.3	171	0	0	0	110.3	I297 S298 I303 I304 L305 I557	I297-I301 HydrophobicContact CG2-CD1 3.7Å; I297-I301 HydrophobicContact CG2-CG1 4.24Å; I297-I301 WeakPolarHBondContact O-CG1 3.34Å; I297-I301 PolarHBondContact O-N 3.26Å; S298-I301 PolarHBondContact O-N 3.02Å; I301-I303 VanDerWaalsContact C-N 3.32Å; I301-I303 PolarHBondContact O-N 3.47Å; I301-I304 PolarHBondContact O-N 3.39Å; I301-L305 HydrophobicContact CG2-CD1 4.04Å; I301-L305 HydrophobicContact CG2-CG 4.31Å; I301-L305 WeakPolarHBondContact O-CG 3.38Å; I301-L305 PolarHBondContact O-N 3.42Å; I301-I557 HydrophobicContact CG1-CD1 4.17Å
302	L	86.5	Confident	82.7	Confident	113 Å²	113	61.6 Å²	61.6	59%	0.592	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-40.9	176.5	-174.7	146.2	0	0	0	111.9	S298 N299 S300 L305 F306	S298-L302 PolarHBondContact O-N 3.09Å; S298-L302 VanDerWaalsContact O-N 3.14Å; N299-L302 WeakPolarHBondContact O-CB 3.48Å; N299-L302 PolarHBondContact O-N 2.89Å; S300-L302 VanDerWaalsContact C-N 3.31Å; L302-L305 PolarHBondContact O-N 2.84Å; L302-F306 PolarHBondContact O-N 3.39Å
303	I	81.8	Confident	82.8	Confident	26 Å²	26	62.4 Å²	62.4	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-44.3	175.1	-65.1	167.3	0	0	0	111.1	N299 S300 I301 F306 L307	N299-I303 WeakPolarHBondContact O-CG1 3.38Å; N299-I303 PolarHBondContact O-N 3.5Å; N299-I303 VanDerWaalsContact O-N 3.14Å; S300-I303 PolarHBondContact O-N 3.46Å; I301-I303 VanDerWaalsContact C-N 3.32Å; I301-I303 PolarHBondContact O-N 3.47Å; I303-F306 PolarHBondContact O-N 2.74Å; I303-L307 HydrophobicContact CG2-CD1 3.87Å; I303-L307 HydrophobicContact CG2-CG 4.45Å; I303-L307 WeakPolarHBondContact O-CG 3.44Å; I303-L307 PolarHBondContact O-N 2.88Å
304	I	85	Confident	82.6	Confident	29 Å²	29	63.2 Å²	63.2	15%	0.149	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-45.9	176.2	-68.6	164.3	0	0	0	111.1	S300 I301 F306 L307 S308 I557 V560	S300-I304 PolarHBondContact O-N 3.02Å; S300-I304 VanDerWaalsContact O-N 3.08Å; I301-I304 PolarHBondContact O-N 3.39Å; I304-F306 PolarHBondContact O-N 2.89Å; I304-L307 PolarHBondContact O-N 3.35Å; I304-S308 VanDerWaalsContact O-CB 3.29Å; I304-S308 WeakPolarHBondContact O-CB 3.4Å; I304-S308 PolarHBondContact O-N 3.33Å; I304-S308 PolarHBondContact O-OG 3.46Å; I304-I557 HydrophobicContact CD1-CB 3.67Å; I304-I557 HydrophobicContact CD1-CG1 3.61Å; I304-I557 HydrophobicContact CD1-CG2 3.27Å; I304-I557 HydrophobicContact CG1-CG2 4.08Å; I304-V560 HydrophobicContact CG2-CG1 4.09Å
305	L	88.2	Confident	82.1	Confident	105 Å²	105	59.1 Å²	59.1	55%	0.55	32%	0.317	S	S	.	.	H	α-helix	trans	-59.5	-39.9	179.2	-73.1	174.2	0	0	0	111.1	I301 L302 S308 T309	I301-L305 HydrophobicContact CG2-CD1 4.04Å; I301-L305 HydrophobicContact CG2-CG 4.31Å; I301-L305 WeakPolarHBondContact O-CG 3.38Å; I301-L305 PolarHBondContact O-N 3.42Å; L302-L305 PolarHBondContact O-N 2.84Å; L305-S308 WeakPolarHBondContact CA-OG 3.47Å; L305-S308 PolarHBondContact O-OG 2.9Å; L305-S308 VanDerWaalsContact O-OG 3.05Å; L305-T309 VanDerWaalsContact O-CB 3.22Å; L305-T309 WeakPolarHBondContact O-CB 3.29Å; L305-T309 PolarHBondContact O-N 2.9Å; L305-T309 PolarHBondContact O-OG1 2.99Å
306	F	85.2	Confident	81.8	Confident	131 Å²	131	57.9 Å²	57.9	58%	0.575	32%	0.316	S	S	*	.	H	α-helix	trans	-63.9	-46.5	174.2	178.5	-102.1	0	0	0	112.5	L302 I303 I304 T309 M310	L302-F306 PolarHBondContact O-N 3.39Å; I303-F306 PolarHBondContact O-N 2.74Å; I304-F306 PolarHBondContact O-N 2.89Å; F306-T309 PolarHBondContact O-N 3.5Å; F306-M310 WeakPolarHBondContact O-CB 3.45Å; F306-M310 PolarHBondContact O-N 3.26Å
307	L	81.7	Confident	81.5	Confident	5 Å²	5	64.4 Å²	64.4	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-70.5	-43.3	-178.2	-71.6	171.7	0	0	0	113.3	I303 I304 T309 M310 I311 L523 T561 E564 T565	I303-L307 HydrophobicContact CG2-CD1 3.87Å; I303-L307 HydrophobicContact CG2-CG 4.45Å; I303-L307 WeakPolarHBondContact O-CG 3.44Å; I303-L307 PolarHBondContact O-N 2.88Å; I304-L307 PolarHBondContact O-N 3.35Å; L307-T309 VanDerWaalsContact C-N 3.31Å; L307-T309 PolarHBondContact O-N 3.1Å; L307-M310 WeakPolarHBondContact O-CB 3.23Å; L307-M310 PolarHBondContact O-N 3.02Å; L307-I311 WeakPolarHBondContact O-CG1 3.36Å; L307-I311 PolarHBondContact O-N 3.21Å; L307-L523 HydrophobicContact CD1-CB 4.49Å; L307-L523 HydrophobicContact CD1-CD1 4.33Å; L307-L523 HydrophobicContact CD2-CD1 3.75Å; L307-T561 HydrophobicContact CD1-CG2 3.76Å; L307-E564 WeakPolarHBondContact CB-OE2 3.47Å; L307-T565 HydrophobicContact CD1-CG2 3.93Å; L307-T565 HydrophobicContact CD2-CG2 4.46Å
308	S	85.1	Confident	80.6	Confident	43 Å²	43	64.8 Å²	64.8	30%	0.301	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-39.8	172.9	58.3	0	0	0	0	111.7	I304 L305 I311 G312 E564	I304-S308 VanDerWaalsContact O-CB 3.29Å; I304-S308 WeakPolarHBondContact O-CB 3.4Å; I304-S308 PolarHBondContact O-N 3.33Å; I304-S308 PolarHBondContact O-OG 3.46Å; L305-S308 WeakPolarHBondContact CA-OG 3.47Å; L305-S308 PolarHBondContact O-OG 2.9Å; L305-S308 VanDerWaalsContact O-OG 3.05Å; S308-I311 PolarHBondContact O-N 2.98Å; S308-G312 PolarHBondContact O-N 3.47Å; S308-E564 WeakPolarHBondContact CB-OE1 3.42Å; S308-E564 PolarHBondContact N-OE2 3.34Å
309	T	86.1	Confident	79.8	Confident	81 Å²	81	65.8 Å²	65.8	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-64	-44.3	172.6	-59.8	0	0	0	0	111.1	L305 F306 L307 G312 I313	L305-T309 VanDerWaalsContact O-CB 3.22Å; L305-T309 WeakPolarHBondContact O-CB 3.29Å; L305-T309 PolarHBondContact O-N 2.9Å; L305-T309 PolarHBondContact O-OG1 2.99Å; F306-T309 PolarHBondContact O-N 3.5Å; L307-T309 VanDerWaalsContact C-N 3.31Å; L307-T309 PolarHBondContact O-N 3.1Å; T309-G312 PolarHBondContact O-N 2.98Å; T309-I313 HydrophobicContact CG2-CD1 3.92Å; T309-I313 HydrophobicContact CG2-CG1 4.45Å; T309-I313 VanDerWaalsContact O-CG1 3.29Å; T309-I313 WeakPolarHBondContact O-CG1 3.33Å; T309-I313 PolarHBondContact O-N 3.44Å
310	M	79.7	Confident	79.3	Confident	67 Å²	67	71.9 Å²	71.9	33%	0.33	36%	0.359	S	S	.	.	H	α-helix	trans	-61.2	-45.6	176.9	-177	178.9	178.9	0	0	111.7	F306 L307 I313 I314 V568 F572	F306-M310 WeakPolarHBondContact O-CB 3.45Å; F306-M310 PolarHBondContact O-N 3.26Å; L307-M310 WeakPolarHBondContact O-CB 3.23Å; L307-M310 PolarHBondContact O-N 3.02Å; M310-I313 PolarHBondContact O-N 3.4Å; M310-I314 HydrophobicContact CE-CD1 4.25Å; M310-I314 HydrophobicContact CG-CD1 4.04Å; M310-I314 VanDerWaalsContact O-CG1 3.23Å; M310-I314 WeakPolarHBondContact O-CG1 3.32Å; M310-I314 PolarHBondContact O-N 3.48Å; M310-V568 HydrophobicContact CE-CG1 4.12Å; M310-F572 HydrophobicContact CE-CE2 3.84Å; M310-F572 HydrophobicContact CE-CZ 4.05Å
311	I	76.8	Confident	78.3	Confident	25 Å²	25	78.9 Å²	78.9	13%	0.128	39%	0.386	C	S	.	.	H	α-helix	trans	-62.3	-44.6	174.1	-72.3	165.9	0	0	0	110.6	L307 S308 I313 I314 L315 E564 V568	L307-I311 WeakPolarHBondContact O-CG1 3.36Å; L307-I311 PolarHBondContact O-N 3.21Å; S308-I311 PolarHBondContact O-N 2.98Å; I311-I313 VanDerWaalsContact C-N 3.33Å; I311-I313 PolarHBondContact O-N 2.9Å; I311-I314 PolarHBondContact O-N 2.8Å; I311-L315 HydrophobicContact CG2-CD1 3.66Å; I311-L315 HydrophobicContact CG2-CG 4.11Å; I311-L315 WeakPolarHBondContact O-CB 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.45Å; I311-L315 PolarHBondContact O-N 3.11Å; I311-E564 VanDerWaalsContact CD1-CA 3.49Å; I311-E564 HydrophobicContact CD1-CB 3.3Å; I311-E564 HydrophobicContact CD1-CG 3.39Å; I311-V568 HydrophobicContact CD1-CG2 3.7Å; I311-V568 HydrophobicContact CG1-CG2 3.15Å
312	G	80.5	Confident	77.1	Confident	26 Å²	26	76.8 Å²	76.8	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-56.2	-47.3	175.9	0	0	0	0	0	111.3	S308 T309 L315 L316	S308-G312 PolarHBondContact O-N 3.47Å; T309-G312 PolarHBondContact O-N 2.98Å; G312-L315 PolarHBondContact O-N 3.32Å; G312-L316 WeakPolarHBondContact O-CB 3.37Å; G312-L316 WeakPolarHBondContact O-CD1 3.4Å; G312-L316 WeakPolarHBondContact O-CG 3.45Å; G312-L316 PolarHBondContact O-N 3.1Å
313	I	81.6	Confident	76	Confident	100 Å²	100	76 Å²	76	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-42.6	176	-67.8	166.2	0	0	0	111.2	T309 M310 I311 R317	T309-I313 HydrophobicContact CG2-CD1 3.92Å; T309-I313 HydrophobicContact CG2-CG1 4.45Å; T309-I313 VanDerWaalsContact O-CG1 3.29Å; T309-I313 WeakPolarHBondContact O-CG1 3.33Å; T309-I313 PolarHBondContact O-N 3.44Å; M310-I313 PolarHBondContact O-N 3.4Å; I311-I313 VanDerWaalsContact C-N 3.33Å; I311-I313 PolarHBondContact O-N 2.9Å; I313-R317 WeakPolarHBondContact O-CA 3.17Å; I313-R317 WeakPolarHBondContact O-CB 3.15Å; I313-R317 PolarHBondContact O-N 2.86Å
314	I	72.7	Confident	75.2	Confident	22 Å²	22	77.3 Å²	77.3	11%	0.113	39%	0.385	C	S	.	.	H	α-helix	trans	-61.7	-52.1	177.3	-70	164.6	0	0	0	109.8	M310 I311 L316 R317 T318 V568 Y571 F572	M310-I314 HydrophobicContact CE-CD1 4.25Å; M310-I314 HydrophobicContact CG-CD1 4.04Å; M310-I314 VanDerWaalsContact O-CG1 3.23Å; M310-I314 WeakPolarHBondContact O-CG1 3.32Å; M310-I314 PolarHBondContact O-N 3.48Å; I311-I314 PolarHBondContact O-N 2.8Å; I314-L316 PolarHBondContact O-N 2.82Å; I314-R317 PolarHBondContact O-N 3.27Å; I314-T318 HydrophobicContact CG2-CG2 4.32Å; I314-T318 VanDerWaalsContact O-CB 3.25Å; I314-T318 WeakPolarHBondContact O-CB 3.36Å; I314-T318 WeakPolarHBondContact O-CG2 3.35Å; I314-T318 PolarHBondContact O-N 3.19Å; I314-T318 PolarHBondContact O-OG1 3.37Å; I314-V568 HydrophobicContact CD1-CG1 3.96Å; I314-V568 HydrophobicContact CD1-CG2 4.33Å; I314-Y571 HydrophobicContact CG2-CD1 3.35Å; I314-Y571 HydrophobicContact CG2-CE1 3.49Å; I314-Y571 VanDerWaalsContact CG2-CE1 3.49Å; I314-Y571 HydrophobicContact CG2-CG 4.14Å; I314-F572 HydrophobicContact CD1-CE1 4.2Å; I314-F572 HydrophobicContact CD1-CE2 4.03Å; I314-F572 HydrophobicContact CD1-CZ 3.55Å; I314-F572 HydrophobicContact CG1-CZ 4.22Å
315	L	72.5	Confident	74.1	Confident	69 Å²	69	80.7 Å²	80.7	36%	0.361	40%	0.396	S	S	.	.	H	α-helix	trans	-60.3	-47.1	178.1	-70.3	174.2	0	0	0	111.2	I311 G312 T318 L319 F645	I311-L315 HydrophobicContact CG2-CD1 3.66Å; I311-L315 HydrophobicContact CG2-CG 4.11Å; I311-L315 WeakPolarHBondContact O-CB 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.45Å; I311-L315 PolarHBondContact O-N 3.11Å; G312-L315 PolarHBondContact O-N 3.32Å; L315-T318 WeakPolarHBondContact CA-OG1 3.19Å; L315-T318 PolarHBondContact O-N 2.96Å; L315-T318 PolarHBondContact O-OG1 3.39Å; L315-L319 WeakPolarHBondContact O-CB 3.4Å; L315-L319 WeakPolarHBondContact O-CD1 3.24Å; L315-L319 WeakPolarHBondContact O-CG 3.48Å; L315-L319 PolarHBondContact O-N 3.24Å; L315-F645 HydrophobicContact CD2-CE2 4.25Å
316	L	75.3	Confident	72.5	Confident	121 Å²	121	81.8 Å²	81.8	63%	0.634	39%	0.394	S	S	*	.	H	α-helix	trans	-63.6	-45.1	178	-74.4	170	0	0	0	112.1	G312 I314 T318 R320	G312-L316 WeakPolarHBondContact O-CB 3.37Å; G312-L316 WeakPolarHBondContact O-CD1 3.4Å; G312-L316 WeakPolarHBondContact O-CG 3.45Å; G312-L316 PolarHBondContact O-N 3.1Å; I314-L316 PolarHBondContact O-N 2.82Å; L316-T318 VanDerWaalsContact C-N 3.28Å; L316-T318 PolarHBondContact O-N 3.44Å; L316-R320 WeakPolarHBondContact O-CB 3.26Å; L316-R320 PolarHBondContact O-N 3.42Å
317	R	73.2	Confident	71.4	Confident	141 Å²	141	80.9 Å²	80.9	53%	0.532	40%	0.395	S	S	.	.	H	α-helix	trans	-64.2	-37.1	179.4	-176.4	177.9	-177.4	178.9	2.3	111.2	I313 I314 R321	I313-R317 WeakPolarHBondContact O-CA 3.17Å; I313-R317 WeakPolarHBondContact O-CB 3.15Å; I313-R317 PolarHBondContact O-N 2.86Å; I314-R317 PolarHBondContact O-N 3.27Å; R317-R321 WeakPolarHBondContact O-CB 3.39Å; R317-R321 WeakPolarHBondContact O-CG 3.44Å; R317-R321 PolarHBondContact O-N 3.28Å
318	T	64.8	Low	70.5	Confident	24 Å²	24	86.9 Å²	86.9	15%	0.147	42%	0.423	C	S	.	.	H	α-helix	trans	-79.4	-44.8	-176.3	55.7	0	0	0	0	110.7	I314 L315 L316 R321 D322 Y571	I314-T318 HydrophobicContact CG2-CG2 4.32Å; I314-T318 VanDerWaalsContact O-CB 3.25Å; I314-T318 WeakPolarHBondContact O-CB 3.36Å; I314-T318 WeakPolarHBondContact O-CG2 3.35Å; I314-T318 PolarHBondContact O-N 3.19Å; I314-T318 PolarHBondContact O-OG1 3.37Å; L315-T318 WeakPolarHBondContact CA-OG1 3.19Å; L315-T318 PolarHBondContact O-N 2.96Å; L315-T318 PolarHBondContact O-OG1 3.39Å; L316-T318 VanDerWaalsContact C-N 3.28Å; L316-T318 PolarHBondContact O-N 3.44Å; T318-R321 PolarHBondContact O-N 3.02Å; T318-D322 WeakPolarHBondContact O-CB 3.41Å; T318-D322 PolarHBondContact O-N 3.18Å; T318-Y571 WeakPolarHBondContact CB-OH 3.23Å; T318-Y571 HydrophobicContact CG2-CE1 3.66Å; T318-Y571 HydrophobicContact CG2-CE2 4.39Å; T318-Y571 WeakPolarHBondContact CG2-OH 3.4Å
319	L	66.9	Low	69.1	Low	98 Å²	98	88 Å²	88	51%	0.513	42%	0.422	S	S	.	.	H	α-helix	trans	-59.7	-46.4	170.1	-72.8	165.1	0	0	0	112.1	L315 D322 I323	L315-L319 WeakPolarHBondContact O-CB 3.4Å; L315-L319 WeakPolarHBondContact O-CD1 3.24Å; L315-L319 WeakPolarHBondContact O-CG 3.48Å; L315-L319 PolarHBondContact O-N 3.24Å; L319-D322 PolarHBondContact O-N 2.91Å; L319-I323 WeakPolarHBondContact O-CB 3.29Å; L319-I323 VanDerWaalsContact O-CG1 3.22Å; L319-I323 WeakPolarHBondContact O-CG1 3.28Å; L319-I323 PolarHBondContact O-N 3.01Å
320	R	70.8	Confident	67.6	Low	201 Å²	201	91.3 Å²	91.3	76%	0.758	44%	0.437	S	S	*	.	H	α-helix	trans	-66.3	-41.4	-180	-172.2	-179.8	-176.3	-161.3	1.4	111.9	L316 D322 A324	L316-R320 WeakPolarHBondContact O-CB 3.26Å; L316-R320 PolarHBondContact O-N 3.42Å; R320-D322 VanDerWaalsContact C-N 3.3Å; R320-A324 WeakPolarHBondContact O-CB 3.34Å; R320-A324 PolarHBondContact O-N 3.39Å
321	R	64.2	Low	66.4	Low	150 Å²	150	94.5 Å²	94.5	57%	0.566	46%	0.456	S	S	*	.	H	α-helix	trans	-63.3	-38.8	174	-80.9	176.4	169.4	-171.1	-11.2	111.4	R317 T318 R325	R317-R321 WeakPolarHBondContact O-CB 3.39Å; R317-R321 WeakPolarHBondContact O-CG 3.44Å; R317-R321 PolarHBondContact O-N 3.28Å; T318-R321 PolarHBondContact O-N 3.02Å; R321-R325 WeakPolarHBondContact O-CB 3.45Å; R321-R325 PolarHBondContact O-N 2.82Å
322	D	59.8	Low	65.3	Low	35 Å²	35	97.1 Å²	97.1	19%	0.187	47%	0.472	C	S	.	.	H	α-helix	trans	-68.3	-47.9	176.1	-83.8	-16	0	0	0	112.1	T318 L319 R320 R325 Y326 K342	T318-D322 WeakPolarHBondContact O-CB 3.41Å; T318-D322 PolarHBondContact O-N 3.18Å; L319-D322 PolarHBondContact O-N 2.91Å; R320-D322 VanDerWaalsContact C-N 3.3Å; D322-R325 PolarHBondContact O-N 3.08Å; D322-Y326 VanDerWaalsContact O-CD2 3.26Å; D322-Y326 WeakPolarHBondContact O-CD2 3.45Å; D322-Y326 PolarHBondContact O-N 2.92Å; D322-K342 WeakPolarHBondContact OD1-CE 3.29Å; D322-K342 IonicContact OD1-NZ 2.99Å; D322-K342 PolarHBondContact OD1-NZ 2.82Å; D322-K342 WeakPolarHBondContact OD2-CE 3.29Å; D322-K342 IonicContact OD2-NZ 2.97Å; D322-K342 PolarHBondContact OD2-NZ 3.18Å
323	I	63.9	Low	64	Low	98 Å²	98	104.1 Å²	104.1	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-48.5	179	-67.5	162.8	0	0	0	111.3	L319 R325 Y326 N327	L319-I323 WeakPolarHBondContact O-CB 3.29Å; L319-I323 VanDerWaalsContact O-CG1 3.22Å; L319-I323 WeakPolarHBondContact O-CG1 3.28Å; L319-I323 PolarHBondContact O-N 3.01Å; I323-R325 PolarHBondContact O-N 3.27Å; I323-Y326 PolarHBondContact O-N 3.25Å; I323-N327 PolarHBondContact O-N 2.77Å
324	A	64.7	Low	62.2	Low	53 Å²	53	105.8 Å²	105.8	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-60	-32.2	180	0	0	0	0	0	111.8	R320 Q328	R320-A324 WeakPolarHBondContact O-CB 3.34Å; R320-A324 PolarHBondContact O-N 3.39Å; A324-Q328 WeakPolarHBondContact O-CG 3.4Å; A324-Q328 PolarHBondContact O-N 2.84Å
325	R	62.6	Low	61.2	Low	99 Å²	99	112 Å²	112	37%	0.374	55%	0.553	S	S	.	*	H	α-helix	trans	-75.2	-46.3	176	-137.2	-166.1	-90.2	-162.9	-16	112.1	R321 D322 I323 N327 Q328 F329	R321-R325 WeakPolarHBondContact O-CB 3.45Å; R321-R325 PolarHBondContact O-N 2.82Å; D322-R325 PolarHBondContact O-N 3.08Å; I323-R325 PolarHBondContact O-N 3.27Å; R325-N327 PolarHBondContact O-N 3.43Å; R325-Q328 WeakPolarHBondContact O-CA 3.35Å; R325-Q328 WeakPolarHBondContact O-CB 3.26Å; R325-Q328 PolarHBondContact O-N 2.96Å; R325-F329 HydrophobicContact CB-CD2 4.5Å; R325-F329 HydrophobicContact CB-CE2 3.81Å; R325-F329 VanDerWaalsContact CD-CE2 3.4Å; R325-F329 HydrophobicContact CG-CD2 4.26Å; R325-F329 HydrophobicContact CG-CE2 3.22Å; R325-F329 HydrophobicContact CG-CZ 3.5Å; R325-F329 WeakPolarHBondContact O-CD2 3.31Å; R325-F329 VanDerWaalsContact O-CE2 3.3Å; R325-F329 WeakPolarHBondContact O-CE2 3.46Å; R325-F329 PolarHBondContact O-N 3.48Å
326	Y	55.4	Low	60.2	Low	129 Å²	129	113.8 Å²	113.8	51%	0.506	56%	0.559	S	S	.	*	H	α-helix	trans	-53.9	-42	174.5	-88.4	-70.7	0	0	0	112	D322 I323 Q328 F329	D322-Y326 VanDerWaalsContact O-CD2 3.26Å; D322-Y326 WeakPolarHBondContact O-CD2 3.45Å; D322-Y326 PolarHBondContact O-N 2.92Å; I323-Y326 PolarHBondContact O-N 3.25Å; Y326-Q328 PolarHBondContact O-N 3.42Å; Y326-F329 PolarHBondContact O-N 3.09Å; Y326-F329 VanDerWaalsContact O-N 3.13Å
327	N	61.4	Low	59.1	Low	111 Å²	111	114.9 Å²	114.9	59%	0.594	56%	0.561	S	S	*	*	H	α-helix	trans	-67.5	-21.2	176.7	-69.9	-0.8	0	0	0	114	I323 R325	I323-N327 PolarHBondContact O-N 2.77Å; R325-N327 PolarHBondContact O-N 3.43Å
328	Q	61.9	Low	58.4	Low	132 Å²	132	110.5 Å²	110.5	62%	0.617	55%	0.547	S	S	*	.	H	α-helix	trans	-80.8	-23.1	173.8	-74.7	176.5	-30	0	0	112.1	A324 R325 Y326	A324-Q328 WeakPolarHBondContact O-CG 3.4Å; A324-Q328 PolarHBondContact O-N 2.84Å; R325-Q328 WeakPolarHBondContact O-CA 3.35Å; R325-Q328 WeakPolarHBondContact O-CB 3.26Å; R325-Q328 PolarHBondContact O-N 2.96Å; Y326-Q328 PolarHBondContact O-N 3.42Å
329	F	55.5	Low	58.5	Low	65 Å²	65	114.8 Å²	114.8	29%	0.285	56%	0.563	S	S	.	*	H	α-helix	trans	-92.4	-11.9	-174	-63.2	-55.6	0	0	0	116	R325 Y326 N331 T332 Q336	R325-F329 HydrophobicContact CB-CD2 4.5Å; R325-F329 HydrophobicContact CB-CE2 3.81Å; R325-F329 VanDerWaalsContact CD-CE2 3.4Å; R325-F329 HydrophobicContact CG-CD2 4.26Å; R325-F329 HydrophobicContact CG-CE2 3.22Å; R325-F329 HydrophobicContact CG-CZ 3.5Å; R325-F329 WeakPolarHBondContact O-CD2 3.31Å; R325-F329 VanDerWaalsContact O-CE2 3.3Å; R325-F329 WeakPolarHBondContact O-CE2 3.46Å; R325-F329 PolarHBondContact O-N 3.48Å; Y326-F329 PolarHBondContact O-N 3.09Å; Y326-F329 VanDerWaalsContact O-N 3.13Å; F329-N331 PolarHBondContact O-N 3.46Å; F329-T332 PolarHBondContact O-N 3.03Å; F329-Q336 VanDerWaalsContact CE1-NE2 3.28Å
330	D	55	Low	58.9	Low	151 Å²	151	110.9 Å²	110.9	81%	0.807	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-10.2	162	-92.4	-11.7	0	0	0	111.8
331	N	54.2	Low	59.4	Low	135 Å²	135	102.3 Å²	102.3	72%	0.722	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	-6.7	-176.6	-68	-35.8	0	0	0	116.9	F329	F329-N331 PolarHBondContact O-N 3.46Å
332	T	53.6	Low	60.2	Low	79 Å²	79	96.3 Å²	96.3	49%	0.485	49%	0.493	S	S	.	.			trans	-151	117.9	-178.8	51	0	0	0	0	113.8	F329 D334	F329-T332 PolarHBondContact O-N 3.03Å; T332-D334 PolarHBondContact O-N 3.43Å
333	D	53.3	Low	61.4	Low	174 Å²	174	96.3 Å²	96.3	93%	0.93	49%	0.492	S	S	*	.			trans	-69.8	32.1	179.1	-78	-36.6	0	0	0	115.4
334	D	45.2	Very low	62.5	Low	134 Å²	134	91.7 Å²	91.7	72%	0.717	47%	0.468	S	S	*	.			trans	-86.9	124.3	179.7	-77.6	-31.8	0	0	0	112.3	T332 Q336	T332-D334 PolarHBondContact O-N 3.43Å; D334-Q336 PolarHBondContact O-N 3.05Å; D334-Q336 VanDerWaalsContact O-N 3.12Å
335	V	50.4	Low	63.6	Low	154 Å²	154	90.8 Å²	90.8	93%	0.933	46%	0.455	S	S	*	.			trans	-53.8	107.9	173.4	178.6	0	0	0	0	109.9
336	Q	52.3	Low	64.8	Low	106 Å²	106	86.1 Å²	86.1	50%	0.495	44%	0.438	S	S	.	.			trans	-106.3	133.1	-169.2	-150.8	170.4	34.3	0	0	115	F329 D334 E338	F329-Q336 VanDerWaalsContact CE1-NE2 3.28Å; D334-Q336 PolarHBondContact O-N 3.05Å; D334-Q336 VanDerWaalsContact O-N 3.12Å; Q336-E338 PolarHBondContact O-N 2.75Å
337	E	52.8	Low	66.5	Low	143 Å²	143	80.2 Å²	80.2	67%	0.668	42%	0.415	S	S	*	.			trans	-63	115.7	162	-61.6	179.2	162.2	0	0	109.2	F339	E337-F339 HydrophobicContact CB-CE2 4.35Å; E337-F339 HydrophobicContact CB-CZ 4.31Å; E337-F339 VanDerWaalsContact O-CD2 3.25Å; E337-F339 WeakPolarHBondContact O-CD2 3.28Å; E337-F339 VanDerWaalsContact O-CE2 3.27Å; E337-F339 WeakPolarHBondContact O-CE2 3.36Å
338	E	58.5	Low	67.9	Low	50 Å²	50	75 Å²	75	23%	0.234	39%	0.387	C	S	.	.			trans	-59.1	161	168.4	-49	-178.1	133	0	0	109.1	Q336 K342 L343 H345	Q336-E338 PolarHBondContact O-N 2.75Å; E338-K342 HydrophobicContact CB-CB 3.84Å; E338-K342 HydrophobicContact CG-CB 4.41Å; E338-L343 HydrophobicContact CB-CD2 3.86Å; E338-L343 HydrophobicContact CB-CG 4.01Å; E338-L343 WeakPolarHBondContact O-CD1 3.21Å; E338-L343 WeakPolarHBondContact O-CD2 3.45Å; E338-L343 WeakPolarHBondContact O-CG 3.23Å; E338-L343 PolarHBondContact OE2-N 2.78Å; E338-H345 IonicContact OE1-ND1 3.77Å; E338-H345 IonicContact OE2-CE1 4Å; E338-H345 PolarHBondContact OE2-CE1 2.9Å; E338-H345 VanDerWaalsContact OE2-CE1 3.31Å; E338-H345 IonicContact OE2-ND1 3.31Å; E338-H345 PolarHBondContact OE2-ND1 3.25Å
339	F	66.3	Low	69.4	Low	113 Å²	113	68.9 Å²	68.9	50%	0.496	36%	0.358	S	S	.	.			trans	-128.6	145.1	175.8	-72.9	-83	0	0	0	112.5	E337 W341	E337-F339 HydrophobicContact CB-CE2 4.35Å; E337-F339 HydrophobicContact CB-CZ 4.31Å; E337-F339 VanDerWaalsContact O-CD2 3.25Å; E337-F339 WeakPolarHBondContact O-CD2 3.28Å; E337-F339 VanDerWaalsContact O-CE2 3.27Å; E337-F339 WeakPolarHBondContact O-CE2 3.36Å; F339-W341 PolarHBondContact O-N 3.46Å
340	G	75.3	Confident	71.1	Confident	16 Å²	16	68.6 Å²	68.6	17%	0.165	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	-116.1	173.7	0	0	0	0	0	114	K342 L574	G340-K342 PolarHBondContact O-N 2.79Å; G340-L574 CarbonylContact C-O 3.42Å
341	W	80.7	Confident	72.9	Confident	21 Å²	21	65 Å²	65	8%	0.08	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-25.2	-175.1	69.1	-91.1	0	0	0	113.8	F339 V344 Y571 L574 I649 Y650 L653	F339-W341 PolarHBondContact O-N 3.46Å; W341-V344 WeakPolarHBondContact O-CG2 3.27Å; W341-Y571 AromaticContact CD1-CE2 3.93Å; W341-Y571 HydrophobicContact CG-CE2 4.3Å; W341-L574 WeakPolarHBondContact CA-O 3.5Å; W341-L574 HydrophobicContact CB-CB 3.68Å; W341-L574 PolarHBondContact N-O 2.63Å; W341-I649 HydrophobicContact CD2-CD1 4.11Å; W341-I649 HydrophobicContact CE3-CD1 3.96Å; W341-I649 HydrophobicContact CE3-CG1 4.31Å; W341-I649 HydrophobicContact CH2-CD1 3.8Å; W341-I649 HydrophobicContact CH2-CG1 3.58Å; W341-I649 HydrophobicContact CZ2-CD1 3.91Å; W341-I649 HydrophobicContact CZ2-CG1 4.14Å; W341-I649 HydrophobicContact CZ3-CB 4.48Å; W341-I649 HydrophobicContact CZ3-CD1 3.82Å; W341-I649 HydrophobicContact CZ3-CG1 3.67Å; W341-I649 HydrophobicContact CZ3-CG2 4.23Å; W341-Y650 AromaticContact CE3-CE1 3.87Å; W341-Y650 HydrophobicContact CE3-CE1 3.87Å; W341-Y650 HydrophobicContact CE3-CE2 4.48Å; W341-Y650 AromaticContact CE3-CZ 3.81Å; W341-Y650 HydrophobicContact CZ3-CD1 4.25Å; W341-Y650 AromaticContact CZ3-CE1 3.97Å; W341-Y650 HydrophobicContact CZ3-CE1 3.97Å; W341-Y650 PolarHBondContact O-OH 3.31Å; W341-L653 HydrophobicContact CH2-CD1 3.92Å; W341-L653 HydrophobicContact CZ3-CD1 4.03Å
342	K	82.1	Confident	74.7	Confident	25 Å²	25	59.6 Å²	59.6	11%	0.109	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-69.2	-41.9	179.4	-66.9	-176	170.7	172.9	0	111.5	D322 E338 G340 V344 H345 L653	D322-K342 WeakPolarHBondContact OD1-CE 3.29Å; D322-K342 IonicContact OD1-NZ 2.99Å; D322-K342 PolarHBondContact OD1-NZ 2.82Å; D322-K342 WeakPolarHBondContact OD2-CE 3.29Å; D322-K342 IonicContact OD2-NZ 2.97Å; D322-K342 PolarHBondContact OD2-NZ 3.18Å; E338-K342 HydrophobicContact CB-CB 3.84Å; E338-K342 HydrophobicContact CG-CB 4.41Å; G340-K342 PolarHBondContact O-N 2.79Å; K342-V344 PolarHBondContact O-N 3.4Å; K342-H345 WeakPolarHBondContact O-CB 3.27Å; K342-H345 PolarHBondContact O-N 3.36Å; K342-H345 PolarHBondContact O-ND1 2.89Å; K342-L653 HydrophobicContact CB-CD1 4.23Å; K342-L653 HydrophobicContact CD-CD1 3.85Å; K342-L653 HydrophobicContact CG-CD1 3.67Å
343	L	83.6	Confident	76.5	Confident	35 Å²	35	64.3 Å²	64.3	18%	0.183	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-52.4	-28	177.5	-80	171.9	0	0	0	115.4	E338 E577	E338-L343 HydrophobicContact CB-CD2 3.86Å; E338-L343 HydrophobicContact CB-CG 4.01Å; E338-L343 WeakPolarHBondContact O-CD1 3.21Å; E338-L343 WeakPolarHBondContact O-CD2 3.45Å; E338-L343 WeakPolarHBondContact O-CG 3.23Å; E338-L343 PolarHBondContact OE2-N 2.78Å; L343-E577 WeakPolarHBondContact CD1-OE1 3.48Å
344	V	87.9	Confident	78.4	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-92.9	8.2	-178.7	-69.6	0	0	0	0	113.1	W341 K342 G346 D347 V348 L574 E577	W341-V344 WeakPolarHBondContact O-CG2 3.27Å; K342-V344 PolarHBondContact O-N 3.4Å; V344-G346 PolarHBondContact O-N 3.45Å; V344-G346 VanDerWaalsContact O-N 3.09Å; V344-D347 PolarHBondContact O-N 3.43Å; V344-V348 HydrophobicContact CB-CG2 4.14Å; V344-V348 HydrophobicContact CG2-CG2 3.9Å; V344-V348 WeakPolarHBondContact O-CG2 3.29Å; V344-V348 PolarHBondContact O-N 3.42Å; V344-V348 VanDerWaalsContact O-N 3.08Å; V344-L574 HydrophobicContact CG2-CD2 4.16Å; V344-E577 HydrophobicContact CG1-CB 4.13Å; V344-E577 WeakPolarHBondContact CG1-O 3.29Å
345	H	86.8	Confident	80.7	Confident	35 Å²	35	56.9 Å²	56.9	16%	0.162	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-38.7	179.8	70.4	-97.2	0	0	0	112.5	E338 K342 D347 V495 Y650 L653	E338-H345 IonicContact OE1-ND1 3.77Å; E338-H345 IonicContact OE2-CE1 4Å; E338-H345 PolarHBondContact OE2-CE1 2.9Å; E338-H345 VanDerWaalsContact OE2-CE1 3.31Å; E338-H345 IonicContact OE2-ND1 3.31Å; E338-H345 PolarHBondContact OE2-ND1 3.25Å; K342-H345 WeakPolarHBondContact O-CB 3.27Å; K342-H345 PolarHBondContact O-N 3.36Å; K342-H345 PolarHBondContact O-ND1 2.89Å; H345-D347 VanDerWaalsContact C-N 3.31Å; H345-D347 PolarHBondContact O-N 2.82Å; H345-V495 HydrophobicContact CB-CG1 4.07Å; H345-V495 WeakPolarHBondContact O-CG1 3.27Å; H345-Y650 HydrophobicContact CB-CD1 3.85Å; H345-Y650 HydrophobicContact CB-CE1 3.7Å; H345-L653 HydrophobicContact CB-CD2 3.73Å
346	G	87.7	Confident	82.9	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.01	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-9	179	0	0	0	0	0	115.6	V344 T497 N498	V344-G346 PolarHBondContact O-N 3.45Å; V344-G346 VanDerWaalsContact O-N 3.09Å; G346-T497 CarbonylContact O-C 3.53Å; G346-T497 WeakPolarHBondContact O-CA 3.25Å; G346-N498 PolarHBondContact O-N 2.81Å
347	D	91.4	Very high	85	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.027	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-13.6	-177.1	-81.9	-50.4	0	0	0	114.3	V344 H345 F349 R350 R502 Y579	V344-D347 PolarHBondContact O-N 3.43Å; H345-D347 VanDerWaalsContact C-N 3.31Å; H345-D347 PolarHBondContact O-N 2.82Å; D347-F349 VanDerWaalsContact C-N 3.3Å; D347-F349 PolarHBondContact O-N 2.97Å; D347-R350 WeakPolarHBondContact O-CB 3.46Å; D347-R350 PolarHBondContact O-N 2.98Å; D347-R350 IonicContact OD1-CZ 2.82Å; D347-R350 VanDerWaalsContact OD1-CZ 3.3Å; D347-R350 IonicContact OD1-NE 2.74Å; D347-R350 PolarHBondContact OD1-NE 3.24Å; D347-R350 IonicContact OD1-NH2 3.3Å; D347-R350 PolarHBondContact OD1-NH2 2.81Å; D347-R502 WeakPolarHBondContact OD2-CB 3.34Å; D347-R502 PolarHBondContact OD2-N 3.18Å; D347-Y579 HydrophobicContact CB-CD1 3.79Å; D347-Y579 HydrophobicContact CB-CD2 3.91Å; D347-Y579 HydrophobicContact CB-CE1 4.23Å; D347-Y579 HydrophobicContact CB-CE2 4.36Å; D347-Y579 HydrophobicContact CB-CG 3.62Å
348	V	91.5	Very high	87.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-37.1	-175.5	169.8	0	0	0	0	113.7	V344 R350 L574 W581 W582 V646 Y650	V344-V348 HydrophobicContact CB-CG2 4.14Å; V344-V348 HydrophobicContact CG2-CG2 3.9Å; V344-V348 WeakPolarHBondContact O-CG2 3.29Å; V344-V348 PolarHBondContact O-N 3.42Å; V344-V348 VanDerWaalsContact O-N 3.08Å; V348-R350 VanDerWaalsContact C-N 3.32Å; V348-L574 HydrophobicContact CG2-CD2 3.97Å; V348-W581 PolarHBondContact O-NE1 3.39Å; V348-W582 PolarHBondContact O-NE1 3.4Å; V348-W582 VanDerWaalsContact O-NE1 3.14Å; V348-V646 HydrophobicContact CG1-CG1 3.23Å; V348-Y650 HydrophobicContact CB-CE2 4.04Å; V348-Y650 HydrophobicContact CG1-CD2 3.95Å; V348-Y650 HydrophobicContact CG1-CE2 3.59Å; V348-Y650 HydrophobicContact CG2-CE1 4.18Å; V348-Y650 HydrophobicContact CG2-CE2 3.63Å; V348-Y650 VanDerWaalsContact CG2-CZ 3.41Å; V348-Y650 WeakPolarHBondContact CG2-OH 3.01Å
349	F	93.1	Very high	89	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.018	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	10.6	179.9	-64.1	-68.5	0	0	0	113.8	D347 Y493 P494 T497 W582 V646 R647 Y650	D347-F349 VanDerWaalsContact C-N 3.3Å; D347-F349 PolarHBondContact O-N 2.97Å; F349-Y493 HydrophobicContact CB-CD1 4.32Å; F349-Y493 HydrophobicContact CB-CD2 3.86Å; F349-Y493 HydrophobicContact CB-CE2 4.16Å; F349-Y493 HydrophobicContact CB-CG 3.94Å; F349-Y493 AromaticContact CD1-CD1 3.35Å; F349-Y493 HydrophobicContact CD1-CD1 3.35Å; F349-Y493 HydrophobicContact CD1-CD2 4.41Å; F349-Y493 AromaticContact CD1-CE1 3.64Å; F349-Y493 HydrophobicContact CD1-CE1 3.64Å; F349-Y493 AromaticContact CD1-CG 3.8Å; F349-Y493 HydrophobicContact CD1-CG 3.8Å; F349-Y493 HydrophobicContact CD2-CG 4.3Å; F349-Y493 AromaticContact CE1-CD1 3.75Å; F349-Y493 HydrophobicContact CE1-CD1 3.75Å; F349-Y493 HydrophobicContact CE1-CE1 4.18Å; F349-Y493 HydrophobicContact CE1-CG 4.43Å; F349-Y493 AromaticContact CG-CD1 3.81Å; F349-Y493 HydrophobicContact CG-CD1 3.81Å; F349-Y493 HydrophobicContact CG-CD2 4.18Å; F349-Y493 HydrophobicContact CG-CE1 4.35Å; F349-Y493 AromaticContact CG-CG 3.73Å; F349-Y493 HydrophobicContact CG-CG 3.73Å; F349-Y493 HydrophobicContact CZ-CD1 4.48Å; F349-P494 HydrophobicContact CE2-CG 3.65Å; F349-P494 HydrophobicContact CZ-CG 3.77Å; F349-T497 HydrophobicContact CB-CG2 3.88Å; F349-W582 HydrophobicContact CD1-CZ2 4.5Å; F349-V646 HydrophobicContact CE1-CG1 4Å; F349-V646 HydrophobicContact CZ-CG1 3.96Å; F349-R647 HydrophobicContact CE1-CG 3.74Å; F349-R647 HydrophobicContact CZ-CG 4.07Å; F349-Y650 HydrophobicContact CE2-CD2 4.48Å; F349-Y650 HydrophobicContact CE2-CG 4.43Å
350	R	92.3	Very high	90.5	Very high	59 Å²	59	34.3 Å²	34.3	22%	0.223	18%	0.177	C	C	.	.	S	Bend	trans	-61.5	138.9	176.4	-173.9	176	-70.5	-84.6	-1.7	110.3	D347 V348 N498 Q499 W582	D347-R350 WeakPolarHBondContact O-CB 3.46Å; D347-R350 PolarHBondContact O-N 2.98Å; D347-R350 IonicContact OD1-CZ 2.82Å; D347-R350 VanDerWaalsContact OD1-CZ 3.3Å; D347-R350 IonicContact OD1-NE 2.74Å; D347-R350 PolarHBondContact OD1-NE 3.24Å; D347-R350 IonicContact OD1-NH2 3.3Å; D347-R350 PolarHBondContact OD1-NH2 2.81Å; V348-R350 VanDerWaalsContact C-N 3.32Å; R350-N498 PolarHBondContact NH2-O 3.2Å; R350-Q499 PolarHBondContact NH1-O 2.91Å; R350-Q499 PolarHBondContact NH2-O 3.39Å; R350-W582 PolarHBondContact O-NE1 3.34Å
351	P	91.7	Very high	91.6	Very high	77 Å²	77	34.9 Å²	34.9	50%	0.5	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-55.2	127.9	176.1	21.5	-35.7	0	0	0	112.1	V418	P351-V418 HydrophobicContact CB-CG1 3.34Å
352	P	93.2	Very high	92.4	Very high	20 Å²	20	33.9 Å²	33.9	13%	0.13	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-70.7	157.8	175	28.6	-34.6	0	0	0	111.7	C355 L358 W582	P352-C355 HydrophobicContact CG-CB 4.06Å; P352-C355 PolarHBondContact O-N 2.9Å; P352-L358 HydrophobicContact CG-CD2 3.97Å; P352-W582 HydrophobicContact CB-CB 3.68Å; P352-W582 HydrophobicContact CB-CG 3.87Å; P352-W582 HydrophobicContact CG-CB 3.8Å; P352-W582 HydrophobicContact CG-CD2 3.93Å; P352-W582 HydrophobicContact CG-CE3 4.15Å; P352-W582 HydrophobicContact CG-CG 3.77Å
353	K	90	Very high	93.2	Very high	179 Å²	179	32.7 Å²	32.7	78%	0.778	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	142	167.3	-62.5	-173.6	177.3	-173.7	0	109.2	C355 W583	K353-C355 VanDerWaalsContact C-N 3.28Å; K353-C355 PolarHBondContact O-N 3.3Å; K353-W583 PolarHBondContact O-NE1 3.3Å
354	N	93.7	Very high	93.8	Very high	123 Å²	123	31.1 Å²	31.1	66%	0.658	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	40.5	179.7	-61.3	-14.8	0	0	0	114.6	L356 L357 L358 W583	N354-L356 PolarHBondContact O-N 3Å; N354-L356 VanDerWaalsContact O-N 3.09Å; N354-L357 HydrophobicContact CB-CB 4.5Å; N354-L357 PolarHBondContact O-N 3.29Å; N354-L358 PolarHBondContact O-N 3.26Å; N354-W583 HydrophobicContact CB-CZ2 4.25Å
355	C	94	Very high	94.3	Very high	29 Å²	29	31.1 Å²	31.1	20%	0.196	16%	0.158	C	C	.	.	H	α-helix	trans	-54.1	-30.7	-179	61.8	0	0	0	0	114.4	P352 K353 L358 S359 V418	P352-C355 HydrophobicContact CG-CB 4.06Å; P352-C355 PolarHBondContact O-N 2.9Å; K353-C355 VanDerWaalsContact C-N 3.28Å; K353-C355 PolarHBondContact O-N 3.3Å; C355-L358 PolarHBondContact O-N 3.03Å; C355-S359 PolarHBondContact O-N 3.07Å; C355-S359 PolarHBondContact O-OG 3.05Å; C355-V418 HydrophobicContact CB-CG1 3.82Å
356	L	96.1	Very high	94.9	Very high	33 Å²	33	30.3 Å²	30.3	17%	0.173	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-44.3	174.8	-176.1	75.8	0	0	0	112.4	N354 S359 V360 Y415 L425 N426 L429	N354-L356 PolarHBondContact O-N 3Å; N354-L356 VanDerWaalsContact O-N 3.09Å; L356-S359 PolarHBondContact O-OG 2.9Å; L356-V360 WeakPolarHBondContact O-CG2 3.32Å; L356-V360 PolarHBondContact O-N 3.36Å; L356-Y415 HydrophobicContact CB-CD2 4.46Å; L356-Y415 HydrophobicContact CB-CE2 3.83Å; L356-Y415 HydrophobicContact CD1-CD2 4.16Å; L356-Y415 HydrophobicContact CD1-CE1 4.37Å; L356-Y415 HydrophobicContact CD1-CE2 3.65Å; L356-Y415 HydrophobicContact CG-CE2 4.39Å; L356-L425 HydrophobicContact CD2-CD2 3.63Å; L356-L425 HydrophobicContact CD2-CG 3.89Å; L356-N426 VanDerWaalsContact CD1-CA 3.47Å; L356-N426 HydrophobicContact CD1-CB 3.55Å; L356-L429 HydrophobicContact CD2-CD2 3.96Å; L356-L429 HydrophobicContact CG-CD2 4.07Å
357	L	96.8	Very high	95.4	Very high	56 Å²	56	30.3 Å²	30.3	29%	0.293	16%	0.155	S	C	.	.	H	α-helix	trans	-72	-40.5	-178.6	-176.7	66.3	0	0	0	110.5	N354 S359 V360 F361 L433 W583	N354-L357 HydrophobicContact CB-CB 4.5Å; N354-L357 PolarHBondContact O-N 3.29Å; L357-S359 PolarHBondContact O-N 3.41Å; L357-V360 PolarHBondContact O-N 3.05Å; L357-F361 HydrophobicContact CD1-CD1 4.13Å; L357-F361 HydrophobicContact CD1-CE1 3.62Å; L357-F361 HydrophobicContact CD1-CE2 4.2Å; L357-F361 HydrophobicContact CD1-CZ 3.67Å; L357-F361 HydrophobicContact CD2-CE2 4.25Å; L357-F361 HydrophobicContact CD2-CZ 4.35Å; L357-F361 HydrophobicContact CG-CD2 4.36Å; L357-F361 HydrophobicContact CG-CE1 4.32Å; L357-F361 HydrophobicContact CG-CE2 4.08Å; L357-F361 HydrophobicContact CG-CZ 4.07Å; L357-F361 PolarHBondContact O-N 3.2Å; L357-L433 HydrophobicContact CD1-CD2 3.47Å; L357-L433 VanDerWaalsContact CD1-CD2 3.47Å; L357-W583 HydrophobicContact CB-CH2 4.12Å; L357-W583 HydrophobicContact CB-CZ2 4.12Å; L357-W583 HydrophobicContact CD2-CH2 3.94Å; L357-W583 HydrophobicContact CD2-CZ2 4.36Å; L357-W583 HydrophobicContact CG-CH2 3.91Å; L357-W583 HydrophobicContact CG-CZ2 4.38Å
358	L	97.5	Very high	95.7	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-60.1	-45.1	176.7	-174.5	62.5	0	0	0	111.2	P352 N354 C355 V360 F361 V362 W582 W583 F586 F639	P352-L358 HydrophobicContact CG-CD2 3.97Å; N354-L358 PolarHBondContact O-N 3.26Å; C355-L358 PolarHBondContact O-N 3.03Å; L358-V360 VanDerWaalsContact C-N 3.31Å; L358-V360 PolarHBondContact O-N 3.28Å; L358-F361 PolarHBondContact O-N 2.98Å; L358-V362 HydrophobicContact CD1-CG2 4.1Å; L358-V362 HydrophobicContact CG-CG2 4.33Å; L358-V362 WeakPolarHBondContact O-CB 3.34Å; L358-V362 VanDerWaalsContact O-CG2 3.24Å; L358-V362 WeakPolarHBondContact O-CG2 3.4Å; L358-V362 PolarHBondContact O-N 3.27Å; L358-W582 HydrophobicContact CD2-CB 3.91Å; L358-W582 HydrophobicContact CD2-CE3 4.37Å; L358-W583 HydrophobicContact CB-CD2 4.42Å; L358-W583 HydrophobicContact CB-CH2 3.91Å; L358-W583 HydrophobicContact CB-CZ2 3.55Å; L358-W583 HydrophobicContact CB-CZ3 4.48Å; L358-W583 HydrophobicContact CD1-CD2 3.95Å; L358-W583 HydrophobicContact CD1-CE3 3.77Å; L358-W583 HydrophobicContact CD1-CH2 4.18Å; L358-W583 HydrophobicContact CD1-CZ2 4.36Å; L358-W583 HydrophobicContact CD1-CZ3 3.88Å; L358-W583 HydrophobicContact CG-CZ2 4.47Å; L358-F586 HydrophobicContact CD1-CB 3.84Å; L358-F586 HydrophobicContact CD1-CD2 4.18Å; L358-F586 HydrophobicContact CD1-CG 3.99Å; L358-F639 HydrophobicContact CD1-CD2 4.33Å; L358-F639 HydrophobicContact CD2-CD2 4.39Å; L358-F639 HydrophobicContact CD2-CE2 3.84Å; L358-F639 HydrophobicContact CD2-CZ 4.43Å; L358-F639 HydrophobicContact CG-CE2 4.39Å
359	S	97	Very high	96	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-35.2	177.5	52.2	0	0	0	0	113.1	C355 L356 L357 G363 S411 N426	C355-S359 PolarHBondContact O-N 3.07Å; C355-S359 PolarHBondContact O-OG 3.05Å; L356-S359 PolarHBondContact O-OG 2.9Å; L357-S359 PolarHBondContact O-N 3.41Å; S359-G363 PolarHBondContact O-N 3.42Å; S359-G363 VanDerWaalsContact O-N 3.1Å; S359-S411 VanDerWaalsContact C-OG 3.31Å; S359-S411 WeakPolarHBondContact O-CA 3.4Å; S359-S411 VanDerWaalsContact O-CB 3.26Å; S359-S411 WeakPolarHBondContact O-CB 3.48Å; S359-S411 PolarHBondContact O-OG 3.23Å; S359-N426 PolarHBondContact OG-OD1 3.49Å
360	V	97.9	Very high	96.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.8	-47.9	174.8	170	0	0	0	0	111.2	L356 L357 L358 G363 S364 L429 L433	L356-V360 WeakPolarHBondContact O-CG2 3.32Å; L356-V360 PolarHBondContact O-N 3.36Å; L357-V360 PolarHBondContact O-N 3.05Å; L358-V360 VanDerWaalsContact C-N 3.31Å; L358-V360 PolarHBondContact O-N 3.28Å; V360-G363 PolarHBondContact O-N 3.33Å; V360-S364 PolarHBondContact O-N 3.3Å; V360-S364 PolarHBondContact O-OG 3.45Å; V360-L429 HydrophobicContact CG1-CG 4.48Å; V360-L429 HydrophobicContact CG2-CB 3.92Å; V360-L429 HydrophobicContact CG2-CD2 3.95Å; V360-L429 HydrophobicContact CG2-CG 3.97Å; V360-L433 HydrophobicContact CG1-CB 4.27Å; V360-L433 HydrophobicContact CG1-CD2 4.01Å
361	F	98.2	Very high	96.4	Very high	27 Å²	27	31.4 Å²	31.4	12%	0.118	17%	0.167	C	C	.	.	H	α-helix	trans	-65.3	-41.7	-179.1	-76	1.3	0	0	0	112.9	L357 L358 G363 S364 G365 L433 W583 F586 F631 L632	L357-F361 HydrophobicContact CD1-CD1 4.13Å; L357-F361 HydrophobicContact CD1-CE1 3.62Å; L357-F361 HydrophobicContact CD1-CE2 4.2Å; L357-F361 HydrophobicContact CD1-CZ 3.67Å; L357-F361 HydrophobicContact CD2-CE2 4.25Å; L357-F361 HydrophobicContact CD2-CZ 4.35Å; L357-F361 HydrophobicContact CG-CD2 4.36Å; L357-F361 HydrophobicContact CG-CE1 4.32Å; L357-F361 HydrophobicContact CG-CE2 4.08Å; L357-F361 HydrophobicContact CG-CZ 4.07Å; L357-F361 PolarHBondContact O-N 3.2Å; L358-F361 PolarHBondContact O-N 2.98Å; F361-G363 VanDerWaalsContact C-N 3.35Å; F361-S364 PolarHBondContact O-N 3.13Å; F361-G365 PolarHBondContact O-N 3.31Å; F361-L433 HydrophobicContact CD1-CD2 4.48Å; F361-L433 HydrophobicContact CE1-CD2 3.8Å; F361-W583 HydrophobicContact CD2-CH2 4.35Å; F361-W583 HydrophobicContact CD2-CZ3 4.3Å; F361-F586 HydrophobicContact CB-CE1 4.38Å; F361-F586 HydrophobicContact CB-CE2 3.97Å; F361-F586 HydrophobicContact CB-CZ 3.7Å; F361-F586 HydrophobicContact CD2-CE1 4.14Å; F361-F586 HydrophobicContact CD2-CZ 4.2Å; F361-F586 HydrophobicContact CG-CZ 4.39Å; F361-F631 HydrophobicContact CE2-CE1 4.48Å; F361-L632 HydrophobicContact CB-CD2 3.85Å; F361-L632 HydrophobicContact CD1-CD2 3.86Å; F361-L632 HydrophobicContact CD2-CD2 4.26Å; F361-L632 HydrophobicContact CE1-CD2 4.44Å; F361-L632 HydrophobicContact CG-CD2 3.75Å
362	V	98.1	Very high	96.6	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.1	-39.7	175.6	174.5	0	0	0	0	111.1	L358 T366 V410 L414 F586 F639 M640	L358-V362 HydrophobicContact CD1-CG2 4.1Å; L358-V362 HydrophobicContact CG-CG2 4.33Å; L358-V362 WeakPolarHBondContact O-CB 3.34Å; L358-V362 VanDerWaalsContact O-CG2 3.24Å; L358-V362 WeakPolarHBondContact O-CG2 3.4Å; L358-V362 PolarHBondContact O-N 3.27Å; V362-T366 WeakPolarHBondContact O-CB 3.31Å; V362-T366 PolarHBondContact O-N 2.99Å; V362-T366 PolarHBondContact O-OG1 3.2Å; V362-V410 HydrophobicContact CG1-CG1 4.06Å; V362-L414 HydrophobicContact CB-CD2 3.82Å; V362-L414 HydrophobicContact CG1-CD2 3.89Å; V362-L414 HydrophobicContact CG2-CD2 3.97Å; V362-F586 HydrophobicContact CG2-CD2 3.76Å; V362-F586 HydrophobicContact CG2-CE2 4.08Å; V362-F639 HydrophobicContact CB-CD1 4.27Å; V362-F639 HydrophobicContact CG1-CD1 3.71Å; V362-F639 HydrophobicContact CG1-CE1 4.25Å; V362-F639 HydrophobicContact CG2-CB 4Å; V362-F639 HydrophobicContact CG2-CD1 3.52Å; V362-F639 HydrophobicContact CG2-CD2 4.33Å; V362-F639 HydrophobicContact CG2-CE1 4.14Å; V362-F639 HydrophobicContact CG2-CG 3.64Å; V362-M640 HydrophobicContact CG1-CG 4.2Å; V362-M640 HydrophobicContact CG1-SD 4Å
363	G	98	Very high	96.7	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-53.3	174.6	0	0	0	0	0	112.2	S359 V360 F361 G365 T366 Q367 N407	S359-G363 PolarHBondContact O-N 3.42Å; S359-G363 VanDerWaalsContact O-N 3.1Å; V360-G363 PolarHBondContact O-N 3.33Å; F361-G363 VanDerWaalsContact C-N 3.35Å; G363-G365 VanDerWaalsContact C-N 3.35Å; G363-G365 PolarHBondContact O-N 3.22Å; G363-T366 PolarHBondContact O-N 2.93Å; G363-Q367 PolarHBondContact O-N 3.21Å; G363-N407 WeakPolarHBondContact CA-OD1 3.2Å; G363-N407 PolarHBondContact O-OD1 2.9Å
364	S	98	Very high	97	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-40.8	179.1	-64.2	0	0	0	0	112.1	V360 F361 T366 Q367 L368 N407 C434	V360-S364 PolarHBondContact O-N 3.3Å; V360-S364 PolarHBondContact O-OG 3.45Å; F361-S364 PolarHBondContact O-N 3.13Å; S364-T366 VanDerWaalsContact C-N 3.35Å; S364-T366 PolarHBondContact O-N 2.85Å; S364-Q367 WeakPolarHBondContact O-CB 3.2Å; S364-Q367 PolarHBondContact O-N 2.73Å; S364-L368 WeakPolarHBondContact O-CG 3.3Å; S364-L368 PolarHBondContact O-N 3.37Å; S364-N407 PolarHBondContact N-OD1 3.32Å; S364-N407 VanDerWaalsContact N-OD1 3.07Å; S364-C434 WeakPolarHBondContact OG-CB 3.4Å; S364-C434 PolarHBondContact OG-SG 3.03Å
365	G	98.1	Very high	97	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.4	-35.9	175.4	0	0	0	0	0	113.2	F361 G363 L368 L369 L632	F361-G365 PolarHBondContact O-N 3.31Å; G363-G365 VanDerWaalsContact C-N 3.35Å; G363-G365 PolarHBondContact O-N 3.22Å; G365-L368 PolarHBondContact O-N 3.07Å; G365-L369 WeakPolarHBondContact O-CB 3.21Å; G365-L369 PolarHBondContact O-N 3.42Å; G365-L632 VanDerWaalsContact CA-O 3.24Å; G365-L632 WeakPolarHBondContact CA-O 3.42Å
366	T	98	Very high	97	Very high	19 Å²	19	19.3 Å²	19.3	12%	0.117	10%	0.102	C	C	.	.	H	α-helix	trans	-70.2	-35.7	176	-50.8	0	0	0	0	111.9	V362 G363 S364 L369 C370 V406 V410	V362-T366 WeakPolarHBondContact O-CB 3.31Å; V362-T366 PolarHBondContact O-N 2.99Å; V362-T366 PolarHBondContact O-OG1 3.2Å; G363-T366 PolarHBondContact O-N 2.93Å; S364-T366 VanDerWaalsContact C-N 3.35Å; S364-T366 PolarHBondContact O-N 2.85Å; T366-L369 PolarHBondContact O-N 3.16Å; T366-C370 PolarHBondContact O-N 2.94Å; T366-C370 PolarHBondContact O-SG 3.34Å; T366-V406 HydrophobicContact CG2-CG1 3.89Å; T366-V410 HydrophobicContact CG2-CG2 4Å
367	Q	98	Very high	96.8	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-60.2	-47.5	170.4	172.9	-175.9	13.4	0	0	111.5	G363 S364 L369 C370 M371 Y400 F403 N407	G363-Q367 PolarHBondContact O-N 3.21Å; S364-Q367 WeakPolarHBondContact O-CB 3.2Å; S364-Q367 PolarHBondContact O-N 2.73Å; Q367-L369 VanDerWaalsContact C-N 3.32Å; Q367-L369 PolarHBondContact O-N 2.95Å; Q367-C370 PolarHBondContact O-N 3.31Å; Q367-M371 WeakPolarHBondContact O-CB 3.32Å; Q367-M371 PolarHBondContact O-N 2.86Å; Q367-Y400 HydrophobicContact CG-CD2 4.11Å; Q367-Y400 HydrophobicContact CG-CE2 4.01Å; Q367-Y400 PolarHBondContact NE2-O 2.8Å; Q367-F403 HydrophobicContact CG-CB 4Å; Q367-N407 HydrophobicContact CB-CB 3.85Å; Q367-N407 HydrophobicContact CG-CB 4.34Å; Q367-N407 PolarHBondContact OE1-ND2 2.92Å
368	L	97.9	Very high	96.6	Very high	7 Å²	7	20.8 Å²	20.8	4%	0.037	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-39.6	176.8	-70.4	169.2	0	0	0	111.9	S364 G365 M371 T372 Y400 I629 L632 L633	S364-L368 WeakPolarHBondContact O-CG 3.3Å; S364-L368 PolarHBondContact O-N 3.37Å; G365-L368 PolarHBondContact O-N 3.07Å; L368-M371 HydrophobicContact CD2-CE 3.92Å; L368-T372 WeakPolarHBondContact O-CB 3.27Å; L368-T372 WeakPolarHBondContact O-CG2 3.48Å; L368-T372 PolarHBondContact O-N 3.45Å; L368-T372 PolarHBondContact O-OG1 3.37Å; L368-Y400 HydrophobicContact CD2-CD2 4.02Å; L368-Y400 HydrophobicContact CD2-CE2 3.78Å; L368-Y400 HydrophobicContact CG-CE2 4.43Å; L368-I629 HydrophobicContact CD1-CB 4.47Å; L368-I629 HydrophobicContact CD1-CG2 3.91Å; L368-I629 HydrophobicContact CD2-CG2 3.91Å; L368-I629 HydrophobicContact CG-CG2 4.46Å; L368-L632 HydrophobicContact CD1-CB 3.87Å; L368-L632 HydrophobicContact CD1-CD1 4.19Å; L368-L633 HydrophobicContact CB-CB 4.32Å; L368-L633 HydrophobicContact CB-CD1 4.46Å
369	L	97.8	Very high	96.2	Very high	42 Å²	42	20.9 Å²	20.9	22%	0.22	11%	0.11	C	C	.	.	H	α-helix	trans	-61.5	-47.9	174.9	177.9	140.2	0	0	0	112.1	G365 T366 Q367 T372 F373 L559 L633 V637	G365-L369 WeakPolarHBondContact O-CB 3.21Å; G365-L369 PolarHBondContact O-N 3.42Å; T366-L369 PolarHBondContact O-N 3.16Å; Q367-L369 VanDerWaalsContact C-N 3.32Å; Q367-L369 PolarHBondContact O-N 2.95Å; L369-T372 WeakPolarHBondContact CA-OG1 3.18Å; L369-T372 PolarHBondContact O-N 2.75Å; L369-T372 PolarHBondContact O-OG1 3.46Å; L369-F373 WeakPolarHBondContact O-CB 3.46Å; L369-F373 PolarHBondContact O-N 3.48Å; L369-L559 HydrophobicContact CD1-CD2 3.75Å; L369-L633 HydrophobicContact CB-CG 4.46Å; L369-V637 HydrophobicContact CD1-CG2 3.22Å
370	C	97.9	Very high	95.7	Very high	27 Å²	27	26.7 Å²	26.7	18%	0.182	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-43.1	179.8	-64.4	0	0	0	0	111.3	T366 Q367 V374 F403	T366-C370 PolarHBondContact O-N 2.94Å; T366-C370 PolarHBondContact O-SG 3.34Å; Q367-C370 PolarHBondContact O-N 3.31Å; C370-V374 WeakPolarHBondContact O-CB 3.46Å; C370-V374 WeakPolarHBondContact O-CG2 3.39Å; C370-V374 PolarHBondContact O-N 3.28Å; C370-F403 HydrophobicContact CB-CB 4.48Å; C370-F403 HydrophobicContact CB-CD1 3.72Å; C370-F403 HydrophobicContact CB-CD2 3.95Å; C370-F403 HydrophobicContact CB-CE1 3.85Å; C370-F403 HydrophobicContact CB-CE2 4.07Å; C370-F403 HydrophobicContact CB-CG 3.8Å; C370-F403 HydrophobicContact CB-CZ 4.03Å; C370-F403 WeakPolarHBondContact O-CE2 3.28Å
371	M	96.7	Very high	95.1	Very high	15 Å²	15	31.5 Å²	31.5	7%	0.074	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-52.7	176.2	176.8	-154.9	70.2	0	0	111.5	Q367 L368 T375 L396 L399 Y400 F403	Q367-M371 WeakPolarHBondContact O-CB 3.32Å; Q367-M371 PolarHBondContact O-N 2.86Å; L368-M371 HydrophobicContact CD2-CE 3.92Å; M371-T375 VanDerWaalsContact O-CB 3.32Å; M371-T375 WeakPolarHBondContact O-CB 3.41Å; M371-T375 PolarHBondContact O-N 3.05Å; M371-T375 PolarHBondContact O-OG1 2.85Å; M371-L396 HydrophobicContact CE-CD2 3.77Å; M371-L396 HydrophobicContact CG-CD2 4.23Å; M371-L396 HydrophobicContact SD-CD2 4.08Å; M371-L399 HydrophobicContact CB-CB 4.5Å; M371-L399 HydrophobicContact CG-CB 3.96Å; M371-Y400 VanDerWaalsContact SD-CB 3.59Å; M371-Y400 HydrophobicContact SD-CD2 3.8Å; M371-Y400 HydrophobicContact SD-CG 4.15Å; M371-F403 HydrophobicContact CB-CD2 4.08Å
372	T	95.4	Very high	94.4	Very high	27 Å²	27	32.1 Å²	32.1	17%	0.166	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-45.3	-178.8	47.9	0	0	0	0	111.6	L368 L369 T375 L376 F555 L633	L368-T372 WeakPolarHBondContact O-CB 3.27Å; L368-T372 WeakPolarHBondContact O-CG2 3.48Å; L368-T372 PolarHBondContact O-N 3.45Å; L368-T372 PolarHBondContact O-OG1 3.37Å; L369-T372 WeakPolarHBondContact CA-OG1 3.18Å; L369-T372 PolarHBondContact O-N 2.75Å; L369-T372 PolarHBondContact O-OG1 3.46Å; T372-T375 PolarHBondContact O-N 2.9Å; T372-L376 WeakPolarHBondContact O-CB 3.43Å; T372-L376 VanDerWaalsContact O-CG 3.26Å; T372-L376 WeakPolarHBondContact O-CG 3.34Å; T372-L376 PolarHBondContact O-N 3.16Å; T372-F555 WeakPolarHBondContact OG1-CZ 3.43Å; T372-L633 HydrophobicContact CG2-CD1 3.85Å; T372-L633 WeakPolarHBondContact OG1-CD1 3.4Å
373	F	96.6	Very high	93.6	Very high	81 Å²	81	37.6 Å²	37.6	36%	0.355	20%	0.198	S	C	.	.	H	α-helix	trans	-58.2	-52.1	178.1	-179.1	-98.4	0	0	0	112.1	L369 T375 L376 V377 F552 F555 L556	L369-F373 WeakPolarHBondContact O-CB 3.46Å; L369-F373 PolarHBondContact O-N 3.48Å; F373-T375 PolarHBondContact O-N 3.35Å; F373-L376 PolarHBondContact O-N 2.74Å; F373-V377 HydrophobicContact CD1-CG2 4.37Å; F373-V377 HydrophobicContact CE1-CG2 4.03Å; F373-V377 HydrophobicContact CZ-CG2 4.17Å; F373-V377 WeakPolarHBondContact O-CG2 3.4Å; F373-V377 PolarHBondContact O-N 3.17Å; F373-F552 HydrophobicContact CD2-CE2 4.31Å; F373-F552 AromaticContact CE2-CE2 4Å; F373-F552 HydrophobicContact CE2-CE2 4Å; F373-F552 HydrophobicContact CE2-CZ 4.34Å; F373-F555 HydrophobicContact CB-CE1 4.05Å; F373-F555 HydrophobicContact CD2-CE1 4.12Å; F373-L556 HydrophobicContact CD2-CD2 4.47Å; F373-L556 HydrophobicContact CE2-CD2 3.91Å
374	V	96.1	Very high	92.9	Very high	38 Å²	38	37.9 Å²	37.9	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-67.4	-37.1	-178.9	175.3	0	0	0	0	111.8	C370 L376 V377 F378 L399 F403	C370-V374 WeakPolarHBondContact O-CB 3.46Å; C370-V374 WeakPolarHBondContact O-CG2 3.39Å; C370-V374 PolarHBondContact O-N 3.28Å; V374-L376 VanDerWaalsContact C-N 3.32Å; V374-L376 PolarHBondContact O-N 3.31Å; V374-V377 PolarHBondContact O-N 3.17Å; V374-F378 HydrophobicContact CG1-CD2 4.09Å; V374-F378 HydrophobicContact CG1-CE2 3.75Å; V374-F378 HydrophobicContact CG1-CZ 4.2Å; V374-F378 PolarHBondContact O-N 2.95Å; V374-L399 HydrophobicContact CB-CD1 4.1Å; V374-L399 HydrophobicContact CG1-CD1 3.8Å; V374-L399 HydrophobicContact CG1-CD2 4.06Å; V374-F403 HydrophobicContact CB-CE2 4.17Å; V374-F403 HydrophobicContact CB-CZ 4.36Å; V374-F403 HydrophobicContact CG2-CE2 4.07Å; V374-F403 HydrophobicContact CG2-CZ 3.8Å
375	T	93.8	Very high	92	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-45	173.9	-56	0	0	0	0	110.9	M371 T372 F373 F378 A379 C395 L396 L399	M371-T375 VanDerWaalsContact O-CB 3.32Å; M371-T375 WeakPolarHBondContact O-CB 3.41Å; M371-T375 PolarHBondContact O-N 3.05Å; M371-T375 PolarHBondContact O-OG1 2.85Å; T372-T375 PolarHBondContact O-N 2.9Å; F373-T375 PolarHBondContact O-N 3.35Å; T375-F378 PolarHBondContact O-N 3.3Å; T375-A379 WeakPolarHBondContact O-CB 3.45Å; T375-A379 PolarHBondContact O-N 3.07Å; T375-C395 HydrophobicContact CG2-CB 4.48Å; T375-L396 HydrophobicContact CG2-CD2 3.84Å; T375-L396 HydrophobicContact CG2-CG 3.98Å; T375-L396 WeakPolarHBondContact OG1-CD2 3.22Å; T375-L399 WeakPolarHBondContact OG1-CD1 3.21Å
376	L	93	Very high	90.9	Very high	21 Å²	21	40.9 Å²	40.9	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-68.7	-33.3	179.3	-69.8	172.9	0	0	0	112.6	T372 F373 V374 A379 F380 L551 F552 F555	T372-L376 WeakPolarHBondContact O-CB 3.43Å; T372-L376 VanDerWaalsContact O-CG 3.26Å; T372-L376 WeakPolarHBondContact O-CG 3.34Å; T372-L376 PolarHBondContact O-N 3.16Å; F373-L376 PolarHBondContact O-N 2.74Å; V374-L376 VanDerWaalsContact C-N 3.32Å; V374-L376 PolarHBondContact O-N 3.31Å; L376-A379 PolarHBondContact O-N 3.06Å; L376-F380 WeakPolarHBondContact O-CB 3.4Å; L376-F380 PolarHBondContact O-N 3.47Å; L376-L551 HydrophobicContact CD2-CB 4.45Å; L376-L551 HydrophobicContact CD2-CD2 3.55Å; L376-L551 HydrophobicContact CD2-CG 3.75Å; L376-F552 HydrophobicContact CB-CB 4.4Å; L376-F552 HydrophobicContact CB-CD2 3.73Å; L376-F555 HydrophobicContact CD1-CB 3.56Å; L376-F555 HydrophobicContact CD1-CD1 3.6Å; L376-F555 HydrophobicContact CD1-CD2 3.96Å; L376-F555 HydrophobicContact CD1-CE1 4.25Å; L376-F555 HydrophobicContact CD1-CG 3.43Å; L376-F555 VanDerWaalsContact CD1-CG 3.43Å
377	V	93.2	Very high	89.9	Confident	42 Å²	42	40.8 Å²	40.8	26%	0.255	22%	0.221	S	C	.	.	H	α-helix	trans	-62.7	-46.4	171.3	171.2	0	0	0	0	110.6	F373 V374 A379 F380 L381 F552	F373-V377 HydrophobicContact CD1-CG2 4.37Å; F373-V377 HydrophobicContact CE1-CG2 4.03Å; F373-V377 HydrophobicContact CZ-CG2 4.17Å; F373-V377 WeakPolarHBondContact O-CG2 3.4Å; F373-V377 PolarHBondContact O-N 3.17Å; V374-V377 PolarHBondContact O-N 3.17Å; V377-A379 VanDerWaalsContact C-N 3.28Å; V377-A379 PolarHBondContact O-N 2.94Å; V377-F380 PolarHBondContact O-N 3.35Å; V377-L381 HydrophobicContact CG1-CD1 4.12Å; V377-L381 WeakPolarHBondContact O-CG 3.36Å; V377-L381 PolarHBondContact O-N 3.46Å; V377-F552 HydrophobicContact CG2-CE2 3.77Å; V377-F552 HydrophobicContact CG2-CZ 4.06Å
378	F	91.3	Very high	89	Confident	78 Å²	78	43.2 Å²	43.2	34%	0.342	23%	0.23	S	C	.	.	H	α-helix	trans	-65.3	-31.5	175.3	-70.7	-32.9	0	0	0	113.3	V374 T375 G382 F383 V384 L399	V374-F378 HydrophobicContact CG1-CD2 4.09Å; V374-F378 HydrophobicContact CG1-CE2 3.75Å; V374-F378 HydrophobicContact CG1-CZ 4.2Å; V374-F378 PolarHBondContact O-N 2.95Å; T375-F378 PolarHBondContact O-N 3.3Å; F378-G382 PolarHBondContact O-N 2.83Å; F378-F383 HydrophobicContact CB-CB 4.37Å; F378-F383 AromaticContact CD1-CD2 3.97Å; F378-F383 HydrophobicContact CD1-CD2 3.97Å; F378-F383 PolarHBondContact O-N 2.84Å; F378-V384 HydrophobicContact CB-CG2 3.82Å; F378-V384 PolarHBondContact O-N 2.95Å; F378-L399 HydrophobicContact CD2-CD1 4.42Å
379	A	88.4	Confident	88.2	Confident	6 Å²	6	44.6 Å²	44.6	5%	0.05	24%	0.235	C	C	.	.	H	α-helix	trans	-69.1	-42.2	172.7	0	0	0	0	0	112	T375 L376 V377 L381 G382 V384 F548	T375-A379 WeakPolarHBondContact O-CB 3.45Å; T375-A379 PolarHBondContact O-N 3.07Å; L376-A379 PolarHBondContact O-N 3.06Å; V377-A379 VanDerWaalsContact C-N 3.28Å; V377-A379 PolarHBondContact O-N 2.94Å; A379-L381 VanDerWaalsContact C-N 3.35Å; A379-L381 PolarHBondContact O-N 2.81Å; A379-G382 PolarHBondContact O-N 3.36Å; A379-V384 HydrophobicContact CB-CB 4.15Å; A379-F548 HydrophobicContact CB-CB 3.92Å; A379-F548 HydrophobicContact CB-CD1 3.67Å; A379-F548 HydrophobicContact CB-CE1 4.34Å; A379-F548 HydrophobicContact CB-CG 3.82Å
380	F	87	Confident	87.6	Confident	121 Å²	121	43 Å²	43	53%	0.531	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-40.4	175.4	177.6	-108.8	0	0	0	112.4	L376 V377 G382 F552	L376-F380 WeakPolarHBondContact O-CB 3.4Å; L376-F380 PolarHBondContact O-N 3.47Å; V377-F380 PolarHBondContact O-N 3.35Å; F380-G382 PolarHBondContact O-N 3.38Å; F380-F552 HydrophobicContact CB-CD1 4.46Å; F380-F552 HydrophobicContact CB-CG 4.49Å; F380-F552 HydrophobicContact CD2-CD1 4.45Å; F380-F552 HydrophobicContact CG-CD1 4.3Å
381	L	86.8	Confident	87.2	Confident	102 Å²	102	42.7 Å²	42.7	53%	0.534	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.8	174.9	-64.4	175.2	0	0	0	113.6	V377 A379 F383	V377-L381 HydrophobicContact CG1-CD1 4.12Å; V377-L381 WeakPolarHBondContact O-CG 3.36Å; V377-L381 PolarHBondContact O-N 3.46Å; A379-L381 VanDerWaalsContact C-N 3.35Å; A379-L381 PolarHBondContact O-N 2.81Å; L381-F383 HydrophobicContact CB-CD2 3.73Å; L381-F383 HydrophobicContact CB-CE2 3.82Å; L381-F383 HydrophobicContact CD1-CD2 4.25Å; L381-F383 HydrophobicContact CD1-CE2 3.88Å
382	G	81.6	Confident	86.8	Confident	39 Å²	39	44.1 Å²	44.1	40%	0.402	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	4.2	178.3	0	0	0	0	0	115.5	F378 A379 F380 V384	F378-G382 PolarHBondContact O-N 2.83Å; A379-G382 PolarHBondContact O-N 3.36Å; F380-G382 PolarHBondContact O-N 3.38Å; G382-V384 PolarHBondContact O-N 3.08Å
383	F	82.9	Confident	86.6	Confident	115 Å²	115	45.5 Å²	45.5	50%	0.504	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-27.7	176.6	-66.8	-59.7	0	0	0	112.9	F378 L381 R388	F378-F383 HydrophobicContact CB-CB 4.37Å; F378-F383 AromaticContact CD1-CD2 3.97Å; F378-F383 HydrophobicContact CD1-CD2 3.97Å; F378-F383 PolarHBondContact O-N 2.84Å; L381-F383 HydrophobicContact CB-CD2 3.73Å; L381-F383 HydrophobicContact CB-CE2 3.82Å; L381-F383 HydrophobicContact CD1-CD2 4.25Å; L381-F383 HydrophobicContact CD1-CE2 3.88Å; F383-R388 PolarHBondContact O-NH1 3.44Å
384	V	83.4	Confident	86.4	Confident	6 Å²	6	43 Å²	43	4%	0.036	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	56.7	178.4	-169.8	0	0	0	0	109.2	F378 A379 G382 T392 C395	F378-V384 HydrophobicContact CB-CG2 3.82Å; F378-V384 PolarHBondContact O-N 2.95Å; A379-V384 HydrophobicContact CB-CB 4.15Å; G382-V384 PolarHBondContact O-N 3.08Å; V384-T392 HydrophobicContact CG1-CG2 4Å; V384-T392 WeakPolarHBondContact CG1-OG1 3.43Å; V384-C395 HydrophobicContact CG2-CB 4.41Å
385	S	77.6	Confident	86.2	Confident	31 Å²	31	42.2 Å²	42.2	22%	0.217	23%	0.23	C	C	.	.			trans	-81.9	154.2	176.8	61.8	0	0	0	0	111.4	A387 R388	S385-A387 PolarHBondContact O-N 3.32Å; S385-A387 VanDerWaalsContact O-N 3.13Å; S385-R388 PolarHBondContact O-N 2.95Å
386	P	74.9	Confident	86.3	Confident	34 Å²	34	44.2 Å²	44.2	22%	0.221	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.9	176.6	-24.6	39.4	0	0	0	113.2	R388 Y546 F548	P386-R388 PolarHBondContact O-N 3.19Å; P386-Y546 HydrophobicContact CG-CD2 3.92Å; P386-F548 HydrophobicContact CG-CE2 3.87Å; P386-F548 HydrophobicContact CG-CZ 4.49Å
387	A	78	Confident	86.4	Confident	17 Å²	17	44.4 Å²	44.4	14%	0.14	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.4	171.3	0	0	0	0	0	112.6	N146 W280 S385	N146-A387 PolarHBondContact ND2-O 2.64Å; W280-A387 HydrophobicContact CZ2-CB 3.76Å; S385-A387 PolarHBondContact O-N 3.32Å; S385-A387 VanDerWaalsContact O-N 3.13Å
388	R	78.5	Confident	86.4	Confident	52 Å²	52	46 Å²	46	20%	0.196	25%	0.248	C	C	.	.	S	Bend	trans	-100.6	87.2	169.2	-64.2	-177.6	-177.3	164.7	1.2	109.8	F383 S385 P386 G390 S391	F383-R388 PolarHBondContact O-NH1 3.44Å; S385-R388 PolarHBondContact O-N 2.95Å; P386-R388 PolarHBondContact O-N 3.19Å; R388-G390 PolarHBondContact O-N 3.16Å; R388-S391 WeakPolarHBondContact O-CB 3.11Å; R388-S391 PolarHBondContact O-N 3.36Å; R388-S391 VanDerWaalsContact O-N 3.09Å; R388-S391 PolarHBondContact O-OG 2.95Å
389	R	81.4	Confident	86.7	Confident	36 Å²	36	43.3 Å²	43.3	14%	0.136	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	135.1	178.2	-62.6	165.2	-170.8	-101.6	-5.8	111.1	N83 Q86 I143 N146 S391	N83-R389 PolarHBondContact ND2-O 3.5Å; Q86-R389 HydrophobicContact CG-CB 3.96Å; Q86-R389 VanDerWaalsContact NE2-CB 3.28Å; I143-R389 VanDerWaalsContact CD1-CZ 3.48Å; N146-R389 PolarHBondContact O-NH2 3.17Å; N146-R389 PolarHBondContact OD1-NE 3.19Å; R389-S391 PolarHBondContact O-N 3.4Å
390	G	86.1	Confident	87.1	Confident	10 Å²	10	45.3 Å²	45.3	10%	0.103	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	0.4	179.7	0	0	0	0	0	116.6	G85 R388 T392 M393 T394	G85-G390 WeakPolarHBondContact CA-O 3.39Å; R388-G390 PolarHBondContact O-N 3.16Å; G390-T392 VanDerWaalsContact C-N 3.33Å; G390-T392 PolarHBondContact O-N 3.46Å; G390-M393 PolarHBondContact O-N 3.03Å; G390-T394 PolarHBondContact O-N 3.33Å; G390-T394 PolarHBondContact O-OG1 3.34Å
391	S	87.6	Confident	87.5	Confident	20 Å²	20	40.1 Å²	40.1	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-38.8	-178.9	61.9	0	0	0	0	112.7	R388 R389 M393 T394 C395	R388-S391 WeakPolarHBondContact O-CB 3.11Å; R388-S391 PolarHBondContact O-N 3.36Å; R388-S391 VanDerWaalsContact O-N 3.09Å; R388-S391 PolarHBondContact O-OG 2.95Å; R389-S391 PolarHBondContact O-N 3.4Å; S391-M393 PolarHBondContact O-N 3.22Å; S391-T394 PolarHBondContact O-N 3Å; S391-C395 VanDerWaalsContact O-CB 3.24Å; S391-C395 WeakPolarHBondContact O-CB 3.27Å; S391-C395 PolarHBondContact O-N 2.92Å
392	T	88.7	Confident	88	Confident	44 Å²	44	41.2 Å²	41.2	27%	0.27	22%	0.223	S	C	.	.	H	α-helix	trans	-59.3	-49.4	179.2	-43.1	0	0	0	0	111.9	V384 G390 C395 L396	V384-T392 HydrophobicContact CG1-CG2 4Å; V384-T392 WeakPolarHBondContact CG1-OG1 3.43Å; G390-T392 VanDerWaalsContact C-N 3.33Å; G390-T392 PolarHBondContact O-N 3.46Å; T392-C395 WeakPolarHBondContact O-CB 3.37Å; T392-C395 PolarHBondContact O-N 3.47Å; T392-L396 HydrophobicContact CG2-CD1 4.39Å; T392-L396 WeakPolarHBondContact O-CG 3.49Å; T392-L396 PolarHBondContact O-N 3.4Å
393	M	91	Very high	88.7	Confident	56 Å²	56	41.4 Å²	41.4	28%	0.276	21%	0.213	S	C	.	.	H	α-helix	trans	-69.2	-39.7	-179	-173.1	63.4	179.1	0	0	111.7	L88 F89 G390 S391 C395 L396 V397	L88-M393 HydrophobicContact CB-CE 4.42Å; L88-M393 HydrophobicContact CB-CG 4.09Å; L88-M393 HydrophobicContact CD1-CE 3.85Å; L88-M393 HydrophobicContact CD1-CG 3.87Å; F89-M393 HydrophobicContact CD2-CB 3.99Å; F89-M393 HydrophobicContact CE2-CB 3.43Å; F89-M393 VanDerWaalsContact CE2-CB 3.43Å; F89-M393 HydrophobicContact CE2-CG 4.24Å; F89-M393 HydrophobicContact CZ-CB 3.95Å; F89-M393 HydrophobicContact CZ-CG 4.49Å; G390-M393 PolarHBondContact O-N 3.03Å; S391-M393 PolarHBondContact O-N 3.22Å; M393-C395 VanDerWaalsContact C-N 3.32Å; M393-C395 PolarHBondContact O-N 3.49Å; M393-L396 PolarHBondContact O-N 2.96Å; M393-L396 HydrophobicContact SD-CD1 4.45Å; M393-V397 HydrophobicContact CE-CG2 4.12Å; M393-V397 WeakPolarHBondContact O-CG2 3.27Å; M393-V397 PolarHBondContact O-N 2.88Å
394	T	92.4	Very high	89.4	Confident	28 Å²	28	36 Å²	36	17%	0.172	19%	0.189	C	C	.	.	H	α-helix	trans	-59.1	-45.8	174.2	-53.9	0	0	0	0	110.9	L84 G85 G390 S391 V397 I398	L84-T394 HydrophobicContact CB-CG2 4.49Å; G85-T394 WeakPolarHBondContact CA-OG1 3.08Å; G85-T394 PolarHBondContact N-OG1 2.8Å; G390-T394 PolarHBondContact O-N 3.33Å; G390-T394 PolarHBondContact O-OG1 3.34Å; S391-T394 PolarHBondContact O-N 3Å; T394-V397 PolarHBondContact O-N 3.32Å; T394-I398 HydrophobicContact CG2-CD1 3.7Å; T394-I398 HydrophobicContact CG2-CG1 4.46Å; T394-I398 WeakPolarHBondContact O-CB 3.46Å; T394-I398 VanDerWaalsContact O-CG1 3.26Å; T394-I398 WeakPolarHBondContact O-CG1 3.24Å; T394-I398 PolarHBondContact O-N 2.88Å
395	C	93.5	Very high	90.1	Very high	22 Å²	22	38.7 Å²	38.7	15%	0.149	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-46.2	177.2	-170	0	0	0	0	111.6	T375 V384 S391 T392 M393 I398 L399	T375-C395 HydrophobicContact CG2-CB 4.48Å; V384-C395 HydrophobicContact CG2-CB 4.41Å; S391-C395 VanDerWaalsContact O-CB 3.24Å; S391-C395 WeakPolarHBondContact O-CB 3.27Å; S391-C395 PolarHBondContact O-N 2.92Å; T392-C395 WeakPolarHBondContact O-CB 3.37Å; T392-C395 PolarHBondContact O-N 3.47Å; M393-C395 VanDerWaalsContact C-N 3.32Å; M393-C395 PolarHBondContact O-N 3.49Å; C395-I398 PolarHBondContact O-N 2.93Å; C395-L399 VanDerWaalsContact O-CB 3.27Å; C395-L399 WeakPolarHBondContact O-CB 3.23Å; C395-L399 VanDerWaalsContact O-CG 3.28Å; C395-L399 WeakPolarHBondContact O-CG 3.5Å; C395-L399 PolarHBondContact O-N 2.93Å; C395-L399 VanDerWaalsContact SG-CD1 3.51Å
396	L	94.5	Very high	91	Very high	49 Å²	49	38.9 Å²	38.9	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-58.1	-50.2	176.6	-75.1	167.9	0	0	0	112.1	M371 T375 T392 M393 L399 Y400	M371-L396 HydrophobicContact CE-CD2 3.77Å; M371-L396 HydrophobicContact CG-CD2 4.23Å; M371-L396 HydrophobicContact SD-CD2 4.08Å; T375-L396 HydrophobicContact CG2-CD2 3.84Å; T375-L396 HydrophobicContact CG2-CG 3.98Å; T375-L396 WeakPolarHBondContact OG1-CD2 3.22Å; T392-L396 HydrophobicContact CG2-CD1 4.39Å; T392-L396 WeakPolarHBondContact O-CG 3.49Å; T392-L396 PolarHBondContact O-N 3.4Å; M393-L396 PolarHBondContact O-N 2.96Å; M393-L396 HydrophobicContact SD-CD1 4.45Å; L396-L399 PolarHBondContact O-N 3.27Å; L396-Y400 VanDerWaalsContact O-CB 3.24Å; L396-Y400 WeakPolarHBondContact O-CB 3.41Å; L396-Y400 PolarHBondContact O-N 2.67Å
397	V	94.7	Very high	92.1	Very high	24 Å²	24	37.4 Å²	37.4	15%	0.145	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-46.1	-178.6	173.5	0	0	0	0	111.2	L84 L88 M393 T394 Y400 V401 L466 L469	L84-V397 HydrophobicContact CD2-CG1 4.08Å; L88-V397 HydrophobicContact CD1-CG2 3.87Å; M393-V397 HydrophobicContact CE-CG2 4.12Å; M393-V397 WeakPolarHBondContact O-CG2 3.27Å; M393-V397 PolarHBondContact O-N 2.88Å; T394-V397 PolarHBondContact O-N 3.32Å; V397-Y400 WeakPolarHBondContact O-CB 3.49Å; V397-Y400 PolarHBondContact O-N 3.28Å; V397-V401 VanDerWaalsContact O-CG2 3.29Å; V397-V401 WeakPolarHBondContact O-CG2 3.32Å; V397-V401 PolarHBondContact O-N 2.89Å; V397-V401 VanDerWaalsContact O-N 3.11Å; V397-L466 HydrophobicContact CG1-CD2 4.3Å; V397-L469 HydrophobicContact CG1-CD1 4Å
398	I	95	Very high	93	Very high	76 Å²	76	36.7 Å²	36.7	39%	0.39	19%	0.187	S	C	.	.	H	α-helix	trans	-63.8	-48.5	-179.9	-68.9	173.5	0	0	0	110.7	T394 C395 Y400 V401 F402	T394-I398 HydrophobicContact CG2-CD1 3.7Å; T394-I398 HydrophobicContact CG2-CG1 4.46Å; T394-I398 WeakPolarHBondContact O-CB 3.46Å; T394-I398 VanDerWaalsContact O-CG1 3.26Å; T394-I398 WeakPolarHBondContact O-CG1 3.24Å; T394-I398 PolarHBondContact O-N 2.88Å; C395-I398 PolarHBondContact O-N 2.93Å; I398-Y400 VanDerWaalsContact C-N 3.32Å; I398-Y400 PolarHBondContact O-N 3.1Å; I398-V401 PolarHBondContact O-N 3.41Å; I398-F402 HydrophobicContact CG2-CD2 3.64Å; I398-F402 HydrophobicContact CG2-CE2 3.55Å; I398-F402 VanDerWaalsContact O-CD2 3.25Å; I398-F402 WeakPolarHBondContact O-CD2 3.47Å; I398-F402 PolarHBondContact O-N 3.44Å
399	L	96.3	Very high	94	Very high	22 Å²	22	37.8 Å²	37.8	12%	0.115	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-36.8	178.9	-71	175.3	0	0	0	111.8	M371 V374 T375 F378 C395 L396 V401 F402 F403	M371-L399 HydrophobicContact CB-CB 4.5Å; M371-L399 HydrophobicContact CG-CB 3.96Å; V374-L399 HydrophobicContact CB-CD1 4.1Å; V374-L399 HydrophobicContact CG1-CD1 3.8Å; V374-L399 HydrophobicContact CG1-CD2 4.06Å; T375-L399 WeakPolarHBondContact OG1-CD1 3.21Å; F378-L399 HydrophobicContact CD2-CD1 4.42Å; C395-L399 VanDerWaalsContact O-CB 3.27Å; C395-L399 WeakPolarHBondContact O-CB 3.23Å; C395-L399 VanDerWaalsContact O-CG 3.28Å; C395-L399 WeakPolarHBondContact O-CG 3.5Å; C395-L399 PolarHBondContact O-N 2.93Å; C395-L399 VanDerWaalsContact SG-CD1 3.51Å; L396-L399 PolarHBondContact O-N 3.27Å; L399-V401 VanDerWaalsContact C-N 3.31Å; L399-V401 PolarHBondContact O-N 3Å; L399-F402 PolarHBondContact O-N 3.37Å; L399-F403 HydrophobicContact CB-CD2 4.15Å; L399-F403 HydrophobicContact CB-CE2 4.19Å; L399-F403 HydrophobicContact CD2-CE2 4.04Å; L399-F403 WeakPolarHBondContact O-CB 3.49Å; L399-F403 WeakPolarHBondContact O-CD2 3.31Å; L399-F403 PolarHBondContact O-N 3.17Å
400	Y	96.8	Very high	94.7	Very high	47 Å²	47	37 Å²	37	18%	0.184	19%	0.191	C	C	.	.	H	α-helix	trans	-57.2	-47.2	174.3	-175.5	-104.8	0	0	0	111.2	Q367 L368 M371 L396 V397 I398 F403 G404	Q367-Y400 HydrophobicContact CG-CD2 4.11Å; Q367-Y400 HydrophobicContact CG-CE2 4.01Å; Q367-Y400 PolarHBondContact NE2-O 2.8Å; L368-Y400 HydrophobicContact CD2-CD2 4.02Å; L368-Y400 HydrophobicContact CD2-CE2 3.78Å; L368-Y400 HydrophobicContact CG-CE2 4.43Å; M371-Y400 VanDerWaalsContact SD-CB 3.59Å; M371-Y400 HydrophobicContact SD-CD2 3.8Å; M371-Y400 HydrophobicContact SD-CG 4.15Å; L396-Y400 VanDerWaalsContact O-CB 3.24Å; L396-Y400 WeakPolarHBondContact O-CB 3.41Å; L396-Y400 PolarHBondContact O-N 2.67Å; V397-Y400 WeakPolarHBondContact O-CB 3.49Å; V397-Y400 PolarHBondContact O-N 3.28Å; I398-Y400 VanDerWaalsContact C-N 3.32Å; I398-Y400 PolarHBondContact O-N 3.1Å; Y400-F403 PolarHBondContact O-N 2.97Å; Y400-G404 PolarHBondContact O-N 3.01Å
401	V	96.5	Very high	95.3	Very high	12 Å²	12	36.6 Å²	36.6	7%	0.073	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-48.4	179	169.7	0	0	0	0	111.1	V397 I398 L399 F403 G404 L469 I473	V397-V401 VanDerWaalsContact O-CG2 3.29Å; V397-V401 WeakPolarHBondContact O-CG2 3.32Å; V397-V401 PolarHBondContact O-N 2.89Å; V397-V401 VanDerWaalsContact O-N 3.11Å; I398-V401 PolarHBondContact O-N 3.41Å; L399-V401 VanDerWaalsContact C-N 3.31Å; L399-V401 PolarHBondContact O-N 3Å; V401-F403 PolarHBondContact O-N 3.33Å; V401-G404 PolarHBondContact O-N 3.35Å; V401-G404 VanDerWaalsContact O-N 3.17Å; V401-L469 HydrophobicContact CG2-CB 4.08Å; V401-I473 HydrophobicContact CG1-CB 3.87Å; V401-I473 HydrophobicContact CG1-CG2 3.36Å
402	F	96	Very high	95.7	Very high	125 Å²	125	35.6 Å²	35.6	55%	0.548	18%	0.179	S	C	.	.	H	α-helix	trans	-64.7	-40.5	178.7	-81	-67.5	0	0	0	113.2	I398 L399 G404 I405	I398-F402 HydrophobicContact CG2-CD2 3.64Å; I398-F402 HydrophobicContact CG2-CE2 3.55Å; I398-F402 VanDerWaalsContact O-CD2 3.25Å; I398-F402 WeakPolarHBondContact O-CD2 3.47Å; I398-F402 PolarHBondContact O-N 3.44Å; L399-F402 PolarHBondContact O-N 3.37Å; F402-G404 PolarHBondContact O-N 3.44Å; F402-G404 VanDerWaalsContact O-N 3.12Å; F402-I405 WeakPolarHBondContact O-CG2 3.47Å; F402-I405 PolarHBondContact O-N 3.23Å
403	F	97.6	Very high	96.1	Very high	44 Å²	44	35.9 Å²	35.9	19%	0.193	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	3.6	177.1	-71.8	-56.6	0	0	0	114	Q367 C370 M371 V374 L399 Y400 V401 I405 V406 N407	Q367-F403 HydrophobicContact CG-CB 4Å; C370-F403 HydrophobicContact CB-CB 4.48Å; C370-F403 HydrophobicContact CB-CD1 3.72Å; C370-F403 HydrophobicContact CB-CD2 3.95Å; C370-F403 HydrophobicContact CB-CE1 3.85Å; C370-F403 HydrophobicContact CB-CE2 4.07Å; C370-F403 HydrophobicContact CB-CG 3.8Å; C370-F403 HydrophobicContact CB-CZ 4.03Å; C370-F403 WeakPolarHBondContact O-CE2 3.28Å; M371-F403 HydrophobicContact CB-CD2 4.08Å; V374-F403 HydrophobicContact CB-CE2 4.17Å; V374-F403 HydrophobicContact CB-CZ 4.36Å; V374-F403 HydrophobicContact CG2-CE2 4.07Å; V374-F403 HydrophobicContact CG2-CZ 3.8Å; L399-F403 HydrophobicContact CB-CD2 4.15Å; L399-F403 HydrophobicContact CB-CE2 4.19Å; L399-F403 HydrophobicContact CD2-CE2 4.04Å; L399-F403 WeakPolarHBondContact O-CB 3.49Å; L399-F403 WeakPolarHBondContact O-CD2 3.31Å; L399-F403 PolarHBondContact O-N 3.17Å; Y400-F403 PolarHBondContact O-N 2.97Å; V401-F403 PolarHBondContact O-N 3.33Å; F403-I405 PolarHBondContact O-N 3.16Å; F403-V406 HydrophobicContact CD1-CG2 3.78Å; F403-V406 WeakPolarHBondContact O-CB 3.13Å; F403-V406 PolarHBondContact O-N 3.18Å; F403-N407 PolarHBondContact O-N 3.44Å
404	G	96.8	Very high	96.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-51.1	-35.7	164.4	0	0	0	0	0	112.4	Y400 V401 F402 V406 N407 G408 T478	Y400-G404 PolarHBondContact O-N 3.01Å; V401-G404 PolarHBondContact O-N 3.35Å; V401-G404 VanDerWaalsContact O-N 3.17Å; F402-G404 PolarHBondContact O-N 3.44Å; F402-G404 VanDerWaalsContact O-N 3.12Å; G404-V406 VanDerWaalsContact C-N 3.31Å; G404-V406 PolarHBondContact O-N 3.27Å; G404-N407 WeakPolarHBondContact O-CB 3.49Å; G404-N407 PolarHBondContact O-N 2.91Å; G404-G408 PolarHBondContact O-N 3.44Å; G404-G408 VanDerWaalsContact O-N 3.09Å; G404-T478 VanDerWaalsContact O-CA 3.27Å; G404-T478 WeakPolarHBondContact O-CA 3.44Å; G404-T478 VanDerWaalsContact O-CG2 3.22Å; G404-T478 WeakPolarHBondContact O-CG2 3.32Å
405	I	97.4	Very high	96.5	Very high	64 Å²	64	33.4 Å²	33.4	33%	0.328	16%	0.161	S	C	.	.	H	α-helix	trans	-61.2	-37.4	175.7	-163.6	170.3	0	0	0	113.2	F402 F403 Y409 L477 T480 G481	F402-I405 WeakPolarHBondContact O-CG2 3.47Å; F402-I405 PolarHBondContact O-N 3.23Å; F403-I405 PolarHBondContact O-N 3.16Å; I405-Y409 WeakPolarHBondContact O-CB 3.22Å; I405-Y409 PolarHBondContact O-N 3.06Å; I405-Y409 VanDerWaalsContact O-N 3.08Å; I405-L477 WeakPolarHBondContact CA-O 3.5Å; I405-L477 HydrophobicContact CB-CD2 4.08Å; I405-T480 HydrophobicContact CD1-CG2 4.47Å; I405-G481 VanDerWaalsContact O-CA 3.3Å; I405-G481 WeakPolarHBondContact O-CA 3.37Å
406	V	97.9	Very high	96.5	Very high	35 Å²	35	34.9 Å²	34.9	21%	0.212	17%	0.165	C	C	.	.	H	α-helix	trans	-70.5	-41.4	178.3	177.3	0	0	0	0	110.1	T366 F403 G404 G408 Y409 V410	T366-V406 HydrophobicContact CG2-CG1 3.89Å; F403-V406 HydrophobicContact CD1-CG2 3.78Å; F403-V406 WeakPolarHBondContact O-CB 3.13Å; F403-V406 PolarHBondContact O-N 3.18Å; G404-V406 VanDerWaalsContact C-N 3.31Å; G404-V406 PolarHBondContact O-N 3.27Å; V406-G408 PolarHBondContact O-N 3.05Å; V406-Y409 PolarHBondContact O-N 2.83Å; V406-V410 HydrophobicContact CG1-CG2 4.02Å; V406-V410 WeakPolarHBondContact O-CB 3.21Å; V406-V410 WeakPolarHBondContact O-CG2 3.46Å; V406-V410 PolarHBondContact O-N 3.36Å
407	N	97.8	Very high	96.4	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.011	15%	0.153	C	C	.	.	H	α-helix	trans	-54.1	-56.8	175.6	-171.3	-3.6	0	0	0	111.1	G363 S364 Q367 F403 G404 Y409 V410 S411 T430 T478	G363-N407 WeakPolarHBondContact CA-OD1 3.2Å; G363-N407 PolarHBondContact O-OD1 2.9Å; S364-N407 PolarHBondContact N-OD1 3.32Å; S364-N407 VanDerWaalsContact N-OD1 3.07Å; Q367-N407 HydrophobicContact CB-CB 3.85Å; Q367-N407 HydrophobicContact CG-CB 4.34Å; Q367-N407 PolarHBondContact OE1-ND2 2.92Å; F403-N407 PolarHBondContact O-N 3.44Å; G404-N407 WeakPolarHBondContact O-CB 3.49Å; G404-N407 PolarHBondContact O-N 2.91Å; N407-Y409 VanDerWaalsContact C-N 3.32Å; N407-Y409 PolarHBondContact O-N 3.47Å; N407-V410 PolarHBondContact O-N 2.73Å; N407-S411 VanDerWaalsContact O-CB 3.25Å; N407-S411 WeakPolarHBondContact O-CB 3.17Å; N407-S411 PolarHBondContact O-N 2.94Å; N407-T430 HydrophobicContact CB-CG2 4.5Å; N407-T430 VanDerWaalsContact CG-CG2 3.47Å; N407-T430 WeakPolarHBondContact OD1-CG2 3.49Å; N407-T478 HydrophobicContact CB-CG2 4.34Å
408	G	97.2	Very high	96.3	Very high	2 Å²	2	32 Å²	32	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-57.1	-44.8	-179.9	0	0	0	0	0	112.5	G404 V406 A412 T478 A482	G404-G408 PolarHBondContact O-N 3.44Å; G404-G408 VanDerWaalsContact O-N 3.09Å; V406-G408 PolarHBondContact O-N 3.05Å; G408-A412 WeakPolarHBondContact O-CB 2.98Å; G408-A412 PolarHBondContact O-N 3.19Å; G408-T478 WeakPolarHBondContact CA-O 3.22Å; G408-A482 VanDerWaalsContact O-CA 3.31Å; G408-A482 WeakPolarHBondContact O-CA 3.46Å
409	Y	97.8	Very high	96	Very high	76 Å²	76	30.3 Å²	30.3	30%	0.298	15%	0.15	S	C	.	.	H	α-helix	trans	-64.1	-51.7	-179.8	177.7	-98.3	0	0	0	112.6	I405 V406 N407 A412 R413 G481 F484 K488	I405-Y409 WeakPolarHBondContact O-CB 3.22Å; I405-Y409 PolarHBondContact O-N 3.06Å; I405-Y409 VanDerWaalsContact O-N 3.08Å; V406-Y409 PolarHBondContact O-N 2.83Å; N407-Y409 VanDerWaalsContact C-N 3.32Å; N407-Y409 PolarHBondContact O-N 3.47Å; Y409-A412 PolarHBondContact O-N 3.33Å; Y409-R413 HydrophobicContact CD1-CG 4.28Å; Y409-R413 HydrophobicContact CD2-CG 4.2Å; Y409-R413 HydrophobicContact CE1-CG 3.98Å; Y409-R413 HydrophobicContact CE2-CG 3.89Å; Y409-R413 HydrophobicContact CG-CG 4.4Å; Y409-R413 WeakPolarHBondContact O-CB 3.44Å; Y409-R413 WeakPolarHBondContact O-CG 3.45Å; Y409-R413 PolarHBondContact O-N 3.08Å; Y409-G481 VanDerWaalsContact CA-O 3.26Å; Y409-G481 WeakPolarHBondContact CA-O 3.33Å; Y409-G481 VanDerWaalsContact N-C 3.34Å; Y409-G481 PolarHBondContact N-O 2.64Å; Y409-F484 HydrophobicContact CD2-CB 4.46Å; Y409-K488 HydrophobicContact CE2-CD 4.33Å; Y409-K488 PolarHBondContact OH-NZ 3.16Å
410	V	97.5	Very high	95.7	Very high	20 Å²	20	30.1 Å²	30.1	12%	0.121	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-45.3	-176.7	173.9	0	0	0	0	110.6	V362 T366 V406 N407 R413 L414	V362-V410 HydrophobicContact CG1-CG1 4.06Å; T366-V410 HydrophobicContact CG2-CG2 4Å; V406-V410 HydrophobicContact CG1-CG2 4.02Å; V406-V410 WeakPolarHBondContact O-CB 3.21Å; V406-V410 WeakPolarHBondContact O-CG2 3.46Å; V406-V410 PolarHBondContact O-N 3.36Å; N407-V410 PolarHBondContact O-N 2.73Å; V410-R413 PolarHBondContact O-N 3.48Å; V410-L414 WeakPolarHBondContact O-CB 2.94Å; V410-L414 PolarHBondContact O-N 3.4Å
411	S	97.6	Very high	95.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-49.1	178.1	-172.6	0	0	0	0	111.9	S359 N407 R413 L414 Y415 N426 T430	S359-S411 VanDerWaalsContact C-OG 3.31Å; S359-S411 WeakPolarHBondContact O-CA 3.4Å; S359-S411 VanDerWaalsContact O-CB 3.26Å; S359-S411 WeakPolarHBondContact O-CB 3.48Å; S359-S411 PolarHBondContact O-OG 3.23Å; N407-S411 VanDerWaalsContact O-CB 3.25Å; N407-S411 WeakPolarHBondContact O-CB 3.17Å; N407-S411 PolarHBondContact O-N 2.94Å; S411-R413 PolarHBondContact O-N 3.26Å; S411-L414 PolarHBondContact O-N 3.05Å; S411-Y415 WeakPolarHBondContact O-CB 3.43Å; S411-Y415 PolarHBondContact O-N 3.09Å; S411-N426 PolarHBondContact OG-ND2 3.13Å; S411-T430 PolarHBondContact OG-OG1 3.38Å
412	A	97.2	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.5	-42.2	178.9	0	0	0	0	0	112.6	G408 Y409 K416 A482 Y486	G408-A412 WeakPolarHBondContact O-CB 2.98Å; G408-A412 PolarHBondContact O-N 3.19Å; Y409-A412 PolarHBondContact O-N 3.33Å; A412-K416 VanDerWaalsContact O-CB 3.24Å; A412-K416 WeakPolarHBondContact O-CB 3.48Å; A412-K416 PolarHBondContact O-N 3.4Å; A412-A482 HydrophobicContact CB-CB 4.03Å; A412-Y486 HydrophobicContact CB-CD2 3.67Å; A412-Y486 HydrophobicContact CB-CE1 4.32Å; A412-Y486 HydrophobicContact CB-CE2 3.44Å; A412-Y486 VanDerWaalsContact CB-CE2 3.44Å; A412-Y486 HydrophobicContact CB-CG 4.19Å
413	R	95.7	Very high	95.3	Very high	50 Å²	50	41.8 Å²	41.8	19%	0.189	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-44.9	178.1	-75.3	-66.2	-65.3	160.9	-5.5	111.8	Y409 V410 S411 A417 G485 P489	Y409-R413 HydrophobicContact CD1-CG 4.28Å; Y409-R413 HydrophobicContact CD2-CG 4.2Å; Y409-R413 HydrophobicContact CE1-CG 3.98Å; Y409-R413 HydrophobicContact CE2-CG 3.89Å; Y409-R413 HydrophobicContact CG-CG 4.4Å; Y409-R413 WeakPolarHBondContact O-CB 3.44Å; Y409-R413 WeakPolarHBondContact O-CG 3.45Å; Y409-R413 PolarHBondContact O-N 3.08Å; V410-R413 PolarHBondContact O-N 3.48Å; S411-R413 PolarHBondContact O-N 3.26Å; R413-A417 WeakPolarHBondContact O-CB 3.43Å; R413-A417 PolarHBondContact O-N 3.26Å; R413-G485 WeakPolarHBondContact CD-O 3.3Å; R413-P489 PolarHBondContact NH1-O 3.37Å
414	L	95.3	Very high	95.1	Very high	16 Å²	16	46.4 Å²	46.4	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-45.7	-179.8	-177.4	54.9	0	0	0	111.6	V362 V410 S411 K416 A417 V418 W582 F639 F643	V362-L414 HydrophobicContact CB-CD2 3.82Å; V362-L414 HydrophobicContact CG1-CD2 3.89Å; V362-L414 HydrophobicContact CG2-CD2 3.97Å; V410-L414 WeakPolarHBondContact O-CB 2.94Å; V410-L414 PolarHBondContact O-N 3.4Å; S411-L414 PolarHBondContact O-N 3.05Å; L414-K416 VanDerWaalsContact C-N 3.34Å; L414-K416 PolarHBondContact O-N 3.44Å; L414-A417 WeakPolarHBondContact O-CB 3.44Å; L414-A417 PolarHBondContact O-N 3.21Å; L414-V418 WeakPolarHBondContact O-CG2 3.39Å; L414-V418 PolarHBondContact O-N 2.92Å; L414-W582 HydrophobicContact CD1-CZ3 3.93Å; L414-F639 HydrophobicContact CD1-CE1 3.79Å; L414-F639 HydrophobicContact CD1-CZ 3.76Å; L414-F639 HydrophobicContact CD2-CD1 4.23Å; L414-F639 HydrophobicContact CD2-CE1 3.45Å; L414-F639 VanDerWaalsContact CD2-CE1 3.45Å; L414-F639 HydrophobicContact CD2-CZ 3.83Å; L414-F639 HydrophobicContact CG-CE1 4.3Å; L414-F639 HydrophobicContact CG-CZ 4.44Å; L414-F643 HydrophobicContact CD1-CE2 4.38Å
415	Y	96.4	Very high	95.1	Very high	15 Å²	15	50.1 Å²	50.1	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-40.7	177.3	-167.5	-111.8	0	0	0	112.2	L356 S411 V418 G419 G420 K422 N426 Y486	L356-Y415 HydrophobicContact CB-CD2 4.46Å; L356-Y415 HydrophobicContact CB-CE2 3.83Å; L356-Y415 HydrophobicContact CD1-CD2 4.16Å; L356-Y415 HydrophobicContact CD1-CE1 4.37Å; L356-Y415 HydrophobicContact CD1-CE2 3.65Å; L356-Y415 HydrophobicContact CG-CE2 4.39Å; S411-Y415 WeakPolarHBondContact O-CB 3.43Å; S411-Y415 PolarHBondContact O-N 3.09Å; Y415-V418 PolarHBondContact O-N 3.45Å; Y415-G419 PolarHBondContact O-N 2.95Å; Y415-G420 VanDerWaalsContact CE1-C 3.42Å; Y415-G420 VanDerWaalsContact CE1-CA 3.43Å; Y415-G420 VanDerWaalsContact CZ-CA 3.48Å; Y415-G420 PolarHBondContact O-N 3.45Å; Y415-K422 PolarHBondContact OH-N 3.21Å; Y415-N426 HydrophobicContact CD1-CB 3.85Å; Y415-N426 HydrophobicContact CE1-CB 4.13Å; Y415-N426 HydrophobicContact CG-CB 4.11Å; Y415-Y486 WeakPolarHBondContact CD1-OH 3.01Å
416	K	94.8	Very high	95.1	Very high	54 Å²	54	47.1 Å²	47.1	24%	0.235	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-38	174.3	-170.8	175.5	-172.7	175.5	0	112.1	A412 L414 V418 G419 Y486 K488	A412-K416 VanDerWaalsContact O-CB 3.24Å; A412-K416 WeakPolarHBondContact O-CB 3.48Å; A412-K416 PolarHBondContact O-N 3.4Å; L414-K416 VanDerWaalsContact C-N 3.34Å; L414-K416 PolarHBondContact O-N 3.44Å; K416-V418 PolarHBondContact O-N 3.43Å; K416-G419 PolarHBondContact O-N 3.37Å; K416-Y486 HydrophobicContact CB-CD1 4.12Å; K416-Y486 HydrophobicContact CB-CE1 4.08Å; K416-Y486 HydrophobicContact CD-CD1 4.16Å; K416-Y486 HydrophobicContact CG-CD1 4.45Å; K416-Y486 PolarHBondContact NZ-O 3.23Å; K416-K488 WeakPolarHBondContact CE-O 3.44Å; K416-K488 PolarHBondContact NZ-O 3.2Å
417	A	92.3	Very high	95.1	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-39.7	177.8	0	0	0	0	0	111.9	R413 L414 G419 R490 P491 Y493	R413-A417 WeakPolarHBondContact O-CB 3.43Å; R413-A417 PolarHBondContact O-N 3.26Å; L414-A417 WeakPolarHBondContact O-CB 3.44Å; L414-A417 PolarHBondContact O-N 3.21Å; A417-G419 PolarHBondContact O-N 3.39Å; A417-R490 VanDerWaalsContact O-CZ 3.31Å; A417-R490 PolarHBondContact O-NE 3.1Å; A417-R490 PolarHBondContact O-NH2 3.49Å; A417-P491 HydrophobicContact CB-CG 3.71Å; A417-Y493 VanDerWaalsContact CB-OH 3.3Å; A417-Y493 WeakPolarHBondContact CB-OH 3.46Å; A417-Y493 VanDerWaalsContact O-CE2 3.23Å; A417-Y493 WeakPolarHBondContact O-CE2 3.24Å; A417-Y493 PolarHBondContact O-OH 3.27Å
418	V	91.3	Very high	95	Very high	12 Å²	12	49.5 Å²	49.5	7%	0.073	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-7.7	-180	178.2	0	0	0	0	112.9	P351 C355 L414 Y415 K416 W582	P351-V418 HydrophobicContact CB-CG1 3.34Å; C355-V418 HydrophobicContact CB-CG1 3.82Å; L414-V418 WeakPolarHBondContact O-CG2 3.39Å; L414-V418 PolarHBondContact O-N 2.92Å; Y415-V418 PolarHBondContact O-N 3.45Å; K416-V418 PolarHBondContact O-N 3.43Å; V418-W582 HydrophobicContact CG2-CH2 3.91Å; V418-W582 HydrophobicContact CG2-CZ3 3.82Å
419	G	90.1	Very high	95	Very high	39 Å²	39	51.5 Å²	51.5	40%	0.402	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	25.2	-177.7	0	0	0	0	0	113.5	Y415 K416 A417 I421	Y415-G419 PolarHBondContact O-N 2.95Å; K416-G419 PolarHBondContact O-N 3.37Å; A417-G419 PolarHBondContact O-N 3.39Å; G419-I421 PolarHBondContact O-N 2.95Å
420	G	90.6	Very high	95	Very high	19 Å²	19	48 Å²	48	20%	0.196	24%	0.238	C	C	.	.			trans	-65.4	127.9	179.2	0	0	0	0	0	113.2	Y415	Y415-G420 VanDerWaalsContact CE1-C 3.42Å; Y415-G420 VanDerWaalsContact CE1-CA 3.43Å; Y415-G420 VanDerWaalsContact CZ-CA 3.48Å; Y415-G420 PolarHBondContact O-N 3.45Å
421	I	91.6	Very high	94.9	Very high	151 Å²	151	47.2 Å²	47.2	77%	0.774	23%	0.234	S	C	*	.	S	Bend	trans	-86.8	-37.9	-174.9	-56.1	166.8	0	0	0	111.6	G419 W423	G419-I421 PolarHBondContact O-N 2.95Å; I421-W423 PolarHBondContact O-N 3.35Å
422	K	94.4	Very high	94.8	Very high	141 Å²	141	50.8 Å²	50.8	61%	0.613	25%	0.249	S	C	*	.			trans	-81	58.2	-173.3	-61.4	-175.5	180	-179	0	112.3	Y415 K424 L425 N426	Y415-K422 PolarHBondContact OH-N 3.21Å; K422-K424 VanDerWaalsContact C-N 3.33Å; K422-K424 PolarHBondContact O-N 2.86Å; K422-L425 HydrophobicContact CB-CB 4.14Å; K422-L425 HydrophobicContact CD-CD2 4.23Å; K422-L425 PolarHBondContact O-N 3.04Å; K422-N426 PolarHBondContact O-N 3.26Å; K422-N426 VanDerWaalsContact O-N 3.11Å
423	W	93.2	Very high	94.8	Very high	136 Å²	136	53 Å²	53	52%	0.515	26%	0.261	S	S	.	.	H	α-helix	trans	-59.4	-39.6	-175	68.9	-92.6	0	0	0	113.1	I421 L425 N426 V427 Y486	I421-W423 PolarHBondContact O-N 3.35Å; W423-L425 VanDerWaalsContact C-N 3.33Å; W423-L425 PolarHBondContact O-N 2.93Å; W423-N426 WeakPolarHBondContact O-CB 3.38Å; W423-N426 PolarHBondContact O-N 3.15Å; W423-V427 WeakPolarHBondContact O-CG2 3.39Å; W423-V427 PolarHBondContact O-N 3.26Å; W423-Y486 HydrophobicContact CB-CD1 4.31Å; W423-Y486 HydrophobicContact CB-CE1 3.74Å; W423-Y486 HydrophobicContact CB-CE2 3.96Å
424	K	95.2	Very high	94.8	Very high	142 Å²	142	50.6 Å²	50.6	62%	0.617	25%	0.252	S	S	*	.	H	α-helix	trans	-58.8	-45.3	177.5	-65.3	-175.7	-180	179.9	0	111.7	K422 N426 V427 L428	K422-K424 VanDerWaalsContact C-N 3.33Å; K422-K424 PolarHBondContact O-N 2.86Å; K424-N426 VanDerWaalsContact C-N 3.34Å; K424-V427 PolarHBondContact O-N 3.43Å; K424-L428 WeakPolarHBondContact O-CG 3.17Å; K424-L428 PolarHBondContact O-N 3.28Å
425	L	96.7	Very high	94.8	Very high	78 Å²	78	50.6 Å²	50.6	41%	0.408	25%	0.253	S	S	.	.	H	α-helix	trans	-65.6	-38.3	178.3	-178.7	63	0	0	0	111.4	L356 K422 W423 L428 L429	L356-L425 HydrophobicContact CD2-CD2 3.63Å; L356-L425 HydrophobicContact CD2-CG 3.89Å; K422-L425 HydrophobicContact CB-CB 4.14Å; K422-L425 HydrophobicContact CD-CD2 4.23Å; K422-L425 PolarHBondContact O-N 3.04Å; W423-L425 VanDerWaalsContact C-N 3.33Å; W423-L425 PolarHBondContact O-N 2.93Å; L425-L428 PolarHBondContact O-N 3.45Å; L425-L429 VanDerWaalsContact O-CB 3.26Å; L425-L429 WeakPolarHBondContact O-CB 3.37Å; L425-L429 PolarHBondContact O-N 3.4Å
426	N	97.3	Very high	94.8	Very high	1 Å²	1	51 Å²	51	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-52.1	174.3	-175	77.9	0	0	0	110.5	L356 S359 S411 Y415 K422 W423 K424 L428 L429 T430 Y486	L356-N426 VanDerWaalsContact CD1-CA 3.47Å; L356-N426 HydrophobicContact CD1-CB 3.55Å; S359-N426 PolarHBondContact OG-OD1 3.49Å; S411-N426 PolarHBondContact OG-ND2 3.13Å; Y415-N426 HydrophobicContact CD1-CB 3.85Å; Y415-N426 HydrophobicContact CE1-CB 4.13Å; Y415-N426 HydrophobicContact CG-CB 4.11Å; K422-N426 PolarHBondContact O-N 3.26Å; K422-N426 VanDerWaalsContact O-N 3.11Å; W423-N426 WeakPolarHBondContact O-CB 3.38Å; W423-N426 PolarHBondContact O-N 3.15Å; K424-N426 VanDerWaalsContact C-N 3.34Å; N426-L428 PolarHBondContact O-N 3.04Å; N426-L429 PolarHBondContact O-N 2.94Å; N426-T430 WeakPolarHBondContact O-CB 3.36Å; N426-T430 PolarHBondContact O-N 3.13Å; N426-T430 PolarHBondContact O-OG1 3.08Å; N426-Y486 WeakPolarHBondContact CB-OH 3.22Å; N426-Y486 PolarHBondContact ND2-OH 3.48Å; N426-Y486 VanDerWaalsContact ND2-OH 3.17Å
427	V	96.6	Very high	94.9	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-46.6	-179.7	-176	0	0	0	0	111.8	W423 K424 L429 T430 C431 F479 A482 Y486	W423-V427 WeakPolarHBondContact O-CG2 3.39Å; W423-V427 PolarHBondContact O-N 3.26Å; K424-V427 PolarHBondContact O-N 3.43Å; V427-L429 PolarHBondContact O-N 2.95Å; V427-T430 WeakPolarHBondContact O-CB 3.3Å; V427-T430 PolarHBondContact O-N 3.25Å; V427-C431 PolarHBondContact O-N 3.48Å; V427-C431 PolarHBondContact O-SG 2.94Å; V427-F479 HydrophobicContact CB-CE1 4.39Å; V427-F479 HydrophobicContact CG1-CD1 3.53Å; V427-F479 HydrophobicContact CG1-CD2 4.16Å; V427-F479 HydrophobicContact CG1-CE1 3.48Å; V427-F479 VanDerWaalsContact CG1-CE1 3.48Å; V427-F479 HydrophobicContact CG1-CE2 4.14Å; V427-F479 HydrophobicContact CG1-CG 3.89Å; V427-F479 HydrophobicContact CG1-CZ 3.81Å; V427-A482 HydrophobicContact CB-CB 4.47Å; V427-A482 HydrophobicContact CG1-CB 4.06Å; V427-A482 HydrophobicContact CG2-CB 3.62Å; V427-Y486 HydrophobicContact CG2-CD2 4.48Å; V427-Y486 HydrophobicContact CG2-CE2 3.76Å
428	L	96.5	Very high	95.1	Very high	81 Å²	81	53.2 Å²	53.2	42%	0.424	28%	0.275	S	S	.	.	H	α-helix	trans	-60.3	-45.9	178	-71.3	172.9	0	0	0	111.9	K424 L425 N426 T430 C431 F432 F479	K424-L428 WeakPolarHBondContact O-CG 3.17Å; K424-L428 PolarHBondContact O-N 3.28Å; L425-L428 PolarHBondContact O-N 3.45Å; N426-L428 PolarHBondContact O-N 3.04Å; L428-T430 VanDerWaalsContact C-N 3.33Å; L428-T430 PolarHBondContact O-N 3.48Å; L428-C431 PolarHBondContact O-N 3.29Å; L428-C431 VanDerWaalsContact O-N 3.16Å; L428-F432 HydrophobicContact CD2-CE2 4.09Å; L428-F432 VanDerWaalsContact O-CD2 3.22Å; L428-F432 WeakPolarHBondContact O-CD2 3.45Å; L428-F432 PolarHBondContact O-N 2.92Å; L428-F432 VanDerWaalsContact O-N 3.09Å; L428-F479 HydrophobicContact CD2-CZ 4.07Å
429	L	97.2	Very high	95.3	Very high	45 Å²	45	54.8 Å²	54.8	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-36.8	179.8	-163.6	69.3	0	0	0	111.5	L356 V360 L425 N426 V427 C431 F432 L433	L356-L429 HydrophobicContact CD2-CD2 3.96Å; L356-L429 HydrophobicContact CG-CD2 4.07Å; V360-L429 HydrophobicContact CG1-CG 4.48Å; V360-L429 HydrophobicContact CG2-CB 3.92Å; V360-L429 HydrophobicContact CG2-CD2 3.95Å; V360-L429 HydrophobicContact CG2-CG 3.97Å; L425-L429 VanDerWaalsContact O-CB 3.26Å; L425-L429 WeakPolarHBondContact O-CB 3.37Å; L425-L429 PolarHBondContact O-N 3.4Å; N426-L429 PolarHBondContact O-N 2.94Å; V427-L429 PolarHBondContact O-N 2.95Å; L429-C431 VanDerWaalsContact C-N 3.29Å; L429-C431 PolarHBondContact O-N 3.12Å; L429-F432 PolarHBondContact O-N 3.35Å; L429-L433 HydrophobicContact CD1-CB 3.77Å; L429-L433 HydrophobicContact CD1-CD1 4.06Å; L429-L433 HydrophobicContact CD1-CD2 3.99Å; L429-L433 HydrophobicContact CD1-CG 4.15Å; L429-L433 HydrophobicContact CD2-CD2 4.13Å; L429-L433 HydrophobicContact CG-CB 3.89Å; L429-L433 HydrophobicContact CG-CD2 3.87Å; L429-L433 HydrophobicContact CG-CG 4.39Å; L429-L433 WeakPolarHBondContact O-CB 3.49Å; L429-L433 PolarHBondContact O-N 2.83Å
430	T	96.8	Very high	95.5	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-38.4	172.5	-53	0	0	0	0	112.1	N407 S411 N426 V427 L428	N407-T430 HydrophobicContact CB-CG2 4.5Å; N407-T430 VanDerWaalsContact CG-CG2 3.47Å; N407-T430 WeakPolarHBondContact OD1-CG2 3.49Å; S411-T430 PolarHBondContact OG-OG1 3.38Å; N426-T430 WeakPolarHBondContact O-CB 3.36Å; N426-T430 PolarHBondContact O-N 3.13Å; N426-T430 PolarHBondContact O-OG1 3.08Å; V427-T430 WeakPolarHBondContact O-CB 3.3Å; V427-T430 PolarHBondContact O-N 3.25Å; L428-T430 VanDerWaalsContact C-N 3.33Å; L428-T430 PolarHBondContact O-N 3.48Å
431	C	95.8	Very high	95.8	Very high	3 Å²	3	56 Å²	56	2%	0.02	28%	0.282	C	S	.	.	H	α-helix	trans	-75.8	-31.8	-178.7	-62.5	0	0	0	0	113.5	V427 L428 L429 P435 W470 L475 T478	V427-C431 PolarHBondContact O-N 3.48Å; V427-C431 PolarHBondContact O-SG 2.94Å; L428-C431 PolarHBondContact O-N 3.29Å; L428-C431 VanDerWaalsContact O-N 3.16Å; L429-C431 VanDerWaalsContact C-N 3.29Å; L429-C431 PolarHBondContact O-N 3.12Å; C431-P435 WeakPolarHBondContact O-CG 3.41Å; C431-W470 PolarHBondContact O-NE1 3.36Å; C431-L475 HydrophobicContact CB-CG 4.49Å; C431-T478 PolarHBondContact SG-OG1 3.34Å
432	F	96.2	Very high	95.9	Very high	75 Å²	75	50.7 Å²	50.7	33%	0.329	25%	0.254	S	S	.	.	H	α-helix	trans	-115.6	-31.1	-167	-66.4	-60.4	0	0	0	115.3	L428 L429 G436 W470 F471 L475	L428-F432 HydrophobicContact CD2-CE2 4.09Å; L428-F432 VanDerWaalsContact O-CD2 3.22Å; L428-F432 WeakPolarHBondContact O-CD2 3.45Å; L428-F432 PolarHBondContact O-N 2.92Å; L428-F432 VanDerWaalsContact O-N 3.09Å; L429-F432 PolarHBondContact O-N 3.35Å; F432-G436 WeakPolarHBondContact O-CA 3.39Å; F432-G436 PolarHBondContact O-N 3.38Å; F432-W470 AromaticContact CD1-CZ2 3.86Å; F432-W470 HydrophobicContact CD1-CZ2 3.86Å; F432-W470 HydrophobicContact CE1-CZ2 4.49Å; F432-F471 HydrophobicContact CE1-CD1 4.25Å; F432-F471 AromaticContact CE1-CE1 3.52Å; F432-F471 HydrophobicContact CE1-CE1 3.52Å; F432-F471 HydrophobicContact CE1-CZ 4.14Å; F432-F471 HydrophobicContact CZ-CE1 4.18Å; F432-L475 HydrophobicContact CE1-CD1 3.82Å; F432-L475 HydrophobicContact CE2-CD1 4.41Å; F432-L475 HydrophobicContact CZ-CD1 3.48Å; F432-L475 VanDerWaalsContact CZ-CD1 3.48Å
433	L	96.7	Very high	96	Very high	45 Å²	45	48.3 Å²	48.3	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-64.3	-169.2	-176.1	65.6	0	0	0	112.5	L357 V360 F361 L429 I437	L357-L433 HydrophobicContact CD1-CD2 3.47Å; L357-L433 VanDerWaalsContact CD1-CD2 3.47Å; V360-L433 HydrophobicContact CG1-CB 4.27Å; V360-L433 HydrophobicContact CG1-CD2 4.01Å; F361-L433 HydrophobicContact CD1-CD2 4.48Å; F361-L433 HydrophobicContact CE1-CD2 3.8Å; L429-L433 HydrophobicContact CD1-CB 3.77Å; L429-L433 HydrophobicContact CD1-CD1 4.06Å; L429-L433 HydrophobicContact CD1-CD2 3.99Å; L429-L433 HydrophobicContact CD1-CG 4.15Å; L429-L433 HydrophobicContact CD2-CD2 4.13Å; L429-L433 HydrophobicContact CG-CB 3.89Å; L429-L433 HydrophobicContact CG-CD2 3.87Å; L429-L433 HydrophobicContact CG-CG 4.39Å; L429-L433 WeakPolarHBondContact O-CB 3.49Å; L429-L433 PolarHBondContact O-N 2.83Å; L433-I437 HydrophobicContact CD1-CD1 4.18Å; L433-I437 HydrophobicContact CG-CD1 4.32Å; L433-I437 WeakPolarHBondContact O-CD1 3.44Å; L433-I437 VanDerWaalsContact O-CG1 3.23Å; L433-I437 WeakPolarHBondContact O-CG1 3.42Å; L433-I437 PolarHBondContact O-N 3.35Å
434	C	96.2	Very high	96	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-52.2	-177.7	-61	0	0	0	0	112.9	S364 G436 I437 I438 F628 L632	S364-C434 WeakPolarHBondContact OG-CB 3.4Å; S364-C434 PolarHBondContact OG-SG 3.03Å; C434-G436 VanDerWaalsContact C-N 3.28Å; C434-G436 PolarHBondContact O-N 3.26Å; C434-I437 PolarHBondContact O-N 2.9Å; C434-I438 WeakPolarHBondContact O-CG1 3.39Å; C434-I438 PolarHBondContact O-N 3.36Å; C434-F628 HydrophobicContact CB-CE1 4.45Å; C434-L632 HydrophobicContact CB-CD1 4.07Å
435	P	95.4	Very high	96	Very high	15 Å²	15	39.3 Å²	39.3	10%	0.097	21%	0.211	C	C	.	.	H	α-helix	trans	-65	-31.6	177.8	24.9	-34	0	0	0	112.5	C431 I438 F439 W470	C431-P435 WeakPolarHBondContact O-CG 3.41Å; P435-I438 PolarHBondContact O-N 2.86Å; P435-F439 VanDerWaalsContact O-CB 3.23Å; P435-F439 WeakPolarHBondContact O-CB 3.34Å; P435-F439 PolarHBondContact O-N 3.19Å; P435-W470 HydrophobicContact CB-CZ2 3.91Å; P435-W470 HydrophobicContact CG-CZ2 3.9Å
436	G	96.1	Very high	95.8	Very high	25 Å²	25	35.6 Å²	35.6	26%	0.258	19%	0.191	S	C	.	.	H	α-helix	trans	-68.1	-39.2	176.2	0	0	0	0	0	113.5	F432 C434 G440	F432-G436 WeakPolarHBondContact O-CA 3.39Å; F432-G436 PolarHBondContact O-N 3.38Å; C434-G436 VanDerWaalsContact C-N 3.28Å; C434-G436 PolarHBondContact O-N 3.26Å; G436-G440 PolarHBondContact O-N 2.99Å
437	I	97	Very high	95.7	Very high	67 Å²	67	38.7 Å²	38.7	34%	0.344	21%	0.21	S	C	.	.	H	α-helix	trans	-61.6	-47.4	172.5	-68.9	163.2	0	0	0	110.3	L433 C434 G440 L441 F628	L433-I437 HydrophobicContact CD1-CD1 4.18Å; L433-I437 HydrophobicContact CG-CD1 4.32Å; L433-I437 WeakPolarHBondContact O-CD1 3.44Å; L433-I437 VanDerWaalsContact O-CG1 3.23Å; L433-I437 WeakPolarHBondContact O-CG1 3.42Å; L433-I437 PolarHBondContact O-N 3.35Å; C434-I437 PolarHBondContact O-N 2.9Å; I437-G440 PolarHBondContact O-N 3.34Å; I437-L441 HydrophobicContact CG2-CD1 4.28Å; I437-L441 WeakPolarHBondContact O-CG 3.46Å; I437-L441 PolarHBondContact O-N 3.2Å; I437-L441 VanDerWaalsContact O-N 3.09Å; I437-F628 HydrophobicContact CB-CE1 4.27Å; I437-F628 HydrophobicContact CD1-CZ 3.98Å; I437-F628 HydrophobicContact CG2-CD1 4.35Å; I437-F628 HydrophobicContact CG2-CE1 4.09Å; I437-F628 HydrophobicContact CG2-CZ 4.4Å
438	I	96	Very high	95.6	Very high	33 Å²	33	40.4 Å²	40.4	17%	0.169	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-48.9	-179.9	-65.9	167.3	0	0	0	110.5	C434 P435 G440 L441 F442 I625 F628 I629	C434-I438 WeakPolarHBondContact O-CG1 3.39Å; C434-I438 PolarHBondContact O-N 3.36Å; P435-I438 PolarHBondContact O-N 2.86Å; I438-G440 PolarHBondContact O-N 2.85Å; I438-L441 PolarHBondContact O-N 3.48Å; I438-F442 WeakPolarHBondContact O-CB 3.35Å; I438-F442 PolarHBondContact O-N 3.47Å; I438-I625 HydrophobicContact CG2-CG2 4.08Å; I438-F628 HydrophobicContact CD1-CD1 4.35Å; I438-F628 HydrophobicContact CD1-CE1 4.42Å; I438-F628 HydrophobicContact CG1-CD1 3.95Å; I438-F628 HydrophobicContact CG1-CE1 4.15Å; I438-I629 HydrophobicContact CD1-CD1 4.16Å; I438-I629 HydrophobicContact CD1-CG1 3.74Å; I438-I629 HydrophobicContact CG1-CG1 4.36Å
439	F	95.3	Very high	95.4	Very high	45 Å²	45	36.6 Å²	36.6	20%	0.197	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-40	179.4	-176.5	-94.7	0	0	0	111.9	P435 F442 F443 L467 W470	P435-F439 VanDerWaalsContact O-CB 3.23Å; P435-F439 WeakPolarHBondContact O-CB 3.34Å; P435-F439 PolarHBondContact O-N 3.19Å; F439-F442 PolarHBondContact O-N 3.46Å; F439-F443 HydrophobicContact CE1-CB 4.33Å; F439-F443 WeakPolarHBondContact O-CB 3.48Å; F439-F443 PolarHBondContact O-N 3.42Å; F439-L467 HydrophobicContact CE1-CD2 3.94Å; F439-L467 HydrophobicContact CE2-CD2 3.91Å; F439-L467 HydrophobicContact CE2-CG 4.12Å; F439-L467 HydrophobicContact CZ-CD1 4.21Å; F439-L467 HydrophobicContact CZ-CD2 3.54Å; F439-L467 HydrophobicContact CZ-CG 3.86Å; F439-W470 HydrophobicContact CB-CZ3 3.96Å; F439-W470 HydrophobicContact CD1-CZ3 4.08Å; F439-W470 HydrophobicContact CG-CE3 4.42Å; F439-W470 AromaticContact CG-CZ3 3.93Å; F439-W470 HydrophobicContact CG-CZ3 3.93Å
440	G	95.6	Very high	95.1	Very high	37 Å²	37	38.7 Å²	38.7	38%	0.381	20%	0.203	S	C	.	.	H	α-helix	trans	-61.7	-47.6	177.5	0	0	0	0	0	112.7	G436 I437 I438 F443 M444	G436-G440 PolarHBondContact O-N 2.99Å; I437-G440 PolarHBondContact O-N 3.34Å; I438-G440 PolarHBondContact O-N 2.85Å; G440-F443 PolarHBondContact O-N 3.23Å; G440-M444 WeakPolarHBondContact O-CB 3.45Å; G440-M444 PolarHBondContact O-N 3.16Å
441	L	95.9	Very high	94.9	Very high	48 Å²	48	42.4 Å²	42.4	25%	0.251	24%	0.235	S	C	.	.	H	α-helix	trans	-65.8	-41.3	176	-69.3	174.9	0	0	0	111.9	I437 I438 M444 C445 I624 I625	I437-L441 HydrophobicContact CG2-CD1 4.28Å; I437-L441 WeakPolarHBondContact O-CG 3.46Å; I437-L441 PolarHBondContact O-N 3.2Å; I437-L441 VanDerWaalsContact O-N 3.09Å; I438-L441 PolarHBondContact O-N 3.48Å; L441-M444 PolarHBondContact O-N 2.74Å; L441-C445 PolarHBondContact O-N 3.33Å; L441-C445 PolarHBondContact O-SG 3.43Å; L441-I624 HydrophobicContact CD1-CG2 3.95Å; L441-I625 HydrophobicContact CB-CD1 3.73Å; L441-I625 HydrophobicContact CB-CG1 3.67Å; L441-I625 HydrophobicContact CD1-CG1 3.86Å; L441-I625 HydrophobicContact CG-CG1 4.44Å
442	F	94.9	Very high	94.6	Very high	39 Å²	39	47.2 Å²	47.2	17%	0.171	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176.4	177.4	-109.4	0	0	0	111.8	L88 I438 F439 C445 N446 V458 L463 L466 Y622 I625	L88-F442 HydrophobicContact CD2-CZ 4.46Å; I438-F442 WeakPolarHBondContact O-CB 3.35Å; I438-F442 PolarHBondContact O-N 3.47Å; F439-F442 PolarHBondContact O-N 3.46Å; F442-C445 WeakPolarHBondContact O-CB 3.48Å; F442-C445 PolarHBondContact O-N 3.2Å; F442-N446 WeakPolarHBondContact CD1-ND2 3.37Å; F442-N446 VanDerWaalsContact CE1-ND2 3.27Å; F442-N446 WeakPolarHBondContact CE1-ND2 3.34Å; F442-N446 VanDerWaalsContact CE2-ND2 3.32Å; F442-N446 WeakPolarHBondContact CE2-ND2 3.43Å; F442-N446 WeakPolarHBondContact CZ-ND2 3.09Å; F442-N446 PolarHBondContact O-N 2.97Å; F442-N446 PolarHBondContact O-ND2 3.14Å; F442-V458 HydrophobicContact CZ-CB 4.47Å; F442-V458 HydrophobicContact CZ-CG2 3.75Å; F442-L463 HydrophobicContact CD1-CD2 4.31Å; F442-L463 HydrophobicContact CE1-CD2 3.66Å; F442-L466 HydrophobicContact CE1-CD1 3.92Å; F442-Y622 HydrophobicContact CD2-CE1 4.36Å; F442-I625 HydrophobicContact CB-CD1 4.35Å
443	F	95	Very high	94.2	Very high	90 Å²	90	51.8 Å²	51.8	40%	0.395	28%	0.275	S	S	.	.	H	α-helix	trans	-63.3	-43.7	176.7	-178.2	-100.8	0	0	0	111.1	F439 G440 C445 N446 V447 W450 L463	F439-F443 HydrophobicContact CE1-CB 4.33Å; F439-F443 WeakPolarHBondContact O-CB 3.48Å; F439-F443 PolarHBondContact O-N 3.42Å; G440-F443 PolarHBondContact O-N 3.23Å; F443-C445 VanDerWaalsContact C-N 3.33Å; F443-C445 PolarHBondContact O-N 2.68Å; F443-N446 PolarHBondContact O-N 3.02Å; F443-N446 VanDerWaalsContact O-N 3.1Å; F443-V447 HydrophobicContact CD1-CG2 4.11Å; F443-V447 HydrophobicContact CE1-CG2 3.72Å; F443-V447 HydrophobicContact CE2-CG2 4.5Å; F443-V447 HydrophobicContact CZ-CG2 3.94Å; F443-V447 WeakPolarHBondContact O-CG2 3.14Å; F443-V447 PolarHBondContact O-N 3.42Å; F443-W450 HydrophobicContact CE2-CH2 4.24Å; F443-W450 HydrophobicContact CE2-CZ3 4.12Å; F443-L463 HydrophobicContact CD2-CD1 4.39Å
444	M	94.2	Very high	93.7	Very high	90 Å²	90	50 Å²	50	44%	0.443	27%	0.266	S	S	.	.	H	α-helix	trans	-56.7	-45.5	173.2	177.5	-174.4	154.1	0	0	111.8	G440 L441 N446 V447 I448	G440-M444 WeakPolarHBondContact O-CB 3.45Å; G440-M444 PolarHBondContact O-N 3.16Å; L441-M444 PolarHBondContact O-N 2.74Å; M444-N446 VanDerWaalsContact C-N 3.33Å; M444-N446 PolarHBondContact O-N 3.38Å; M444-V447 PolarHBondContact O-N 3.14Å; M444-I448 HydrophobicContact CE-CD1 4.29Å; M444-I448 WeakPolarHBondContact O-CG1 3.46Å; M444-I448 PolarHBondContact O-N 2.9Å
445	C	94.2	Very high	93.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-45.3	174.5	-64.5	0	0	0	0	111.2	L441 F442 F443 V447 I448 M449 L618 S621 Y622	L441-C445 PolarHBondContact O-N 3.33Å; L441-C445 PolarHBondContact O-SG 3.43Å; F442-C445 WeakPolarHBondContact O-CB 3.48Å; F442-C445 PolarHBondContact O-N 3.2Å; F443-C445 VanDerWaalsContact C-N 3.33Å; F443-C445 PolarHBondContact O-N 2.68Å; C445-V447 VanDerWaalsContact C-N 3.34Å; C445-V447 PolarHBondContact O-N 3.31Å; C445-I448 WeakPolarHBondContact O-CB 3.36Å; C445-I448 PolarHBondContact O-N 2.9Å; C445-M449 WeakPolarHBondContact O-CG 3.29Å; C445-M449 PolarHBondContact O-N 2.9Å; C445-L618 HydrophobicContact CB-CD2 4.04Å; C445-S621 WeakPolarHBondContact SG-CB 3.33Å; C445-Y622 HydrophobicContact CB-CE1 4.3Å; C445-Y622 HydrophobicContact CB-CE2 4.39Å
446	N	93.8	Very high	92.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-36.7	179.2	-80.9	-79.8	0	0	0	113	F442 F443 M444 I448 M449 W450 V458	F442-N446 WeakPolarHBondContact CD1-ND2 3.37Å; F442-N446 VanDerWaalsContact CE1-ND2 3.27Å; F442-N446 WeakPolarHBondContact CE1-ND2 3.34Å; F442-N446 VanDerWaalsContact CE2-ND2 3.32Å; F442-N446 WeakPolarHBondContact CE2-ND2 3.43Å; F442-N446 WeakPolarHBondContact CZ-ND2 3.09Å; F442-N446 PolarHBondContact O-N 2.97Å; F442-N446 PolarHBondContact O-ND2 3.14Å; F443-N446 PolarHBondContact O-N 3.02Å; F443-N446 VanDerWaalsContact O-N 3.1Å; M444-N446 VanDerWaalsContact C-N 3.33Å; M444-N446 PolarHBondContact O-N 3.38Å; N446-I448 VanDerWaalsContact C-N 3.34Å; N446-I448 PolarHBondContact O-N 3.1Å; N446-M449 PolarHBondContact O-N 3.3Å; N446-W450 PolarHBondContact O-N 3.45Å; N446-V458 VanDerWaalsContact OD1-CB 3.31Å; N446-V458 WeakPolarHBondContact OD1-CB 3.5Å; N446-V458 WeakPolarHBondContact OD1-CG2 3.31Å; N446-V458 PolarHBondContact OD1-N 3.15Å
447	V	94.3	Very high	92.4	Very high	66 Å²	66	49.8 Å²	49.8	40%	0.4	26%	0.26	S	S	.	.	H	α-helix	trans	-60.3	-44	173.9	171.3	0	0	0	0	111.2	F443 M444 C445 M449 W450 A451	F443-V447 HydrophobicContact CD1-CG2 4.11Å; F443-V447 HydrophobicContact CE1-CG2 3.72Å; F443-V447 HydrophobicContact CE2-CG2 4.5Å; F443-V447 HydrophobicContact CZ-CG2 3.94Å; F443-V447 WeakPolarHBondContact O-CG2 3.14Å; F443-V447 PolarHBondContact O-N 3.42Å; M444-V447 PolarHBondContact O-N 3.14Å; C445-V447 VanDerWaalsContact C-N 3.34Å; C445-V447 PolarHBondContact O-N 3.31Å; V447-M449 VanDerWaalsContact C-N 3.32Å; V447-M449 PolarHBondContact O-N 3.09Å; V447-W450 HydrophobicContact CG2-CE3 4.25Å; V447-W450 HydrophobicContact CG2-CZ3 4.16Å; V447-W450 PolarHBondContact O-N 3.15Å; V447-A451 WeakPolarHBondContact O-CB 3.1Å; V447-A451 PolarHBondContact O-N 3.45Å
448	I	93.9	Very high	92.1	Very high	41 Å²	41	46.7 Å²	46.7	21%	0.21	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-41.5	175.7	-63.8	169.1	0	0	0	110.6	M444 C445 N446 A451 K452 V614 V617 L618	M444-I448 HydrophobicContact CE-CD1 4.29Å; M444-I448 WeakPolarHBondContact O-CG1 3.46Å; M444-I448 PolarHBondContact O-N 2.9Å; C445-I448 WeakPolarHBondContact O-CB 3.36Å; C445-I448 PolarHBondContact O-N 2.9Å; N446-I448 VanDerWaalsContact C-N 3.34Å; N446-I448 PolarHBondContact O-N 3.1Å; I448-A451 PolarHBondContact O-N 3.18Å; I448-K452 PolarHBondContact O-N 3.5Å; I448-K452 VanDerWaalsContact O-N 3.16Å; I448-V614 HydrophobicContact CG2-CG1 3.67Å; I448-V617 HydrophobicContact CD1-CG1 4Å; I448-L618 HydrophobicContact CB-CD2 4.18Å; I448-L618 HydrophobicContact CG2-CD1 4.34Å; I448-L618 HydrophobicContact CG2-CD2 4.06Å; I448-L618 HydrophobicContact CG2-CG 4.21Å
449	M	92	Very high	91.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-67	-40.8	-179.8	-65.4	-66.8	-80.9	0	0	112.5	L61 C445 N446 V447 K452 K453 S454 T456 A457 L618	L61-M449 HydrophobicContact CD2-CE 4.14Å; L61-M449 HydrophobicContact CD2-SD 3.46Å; L61-M449 WeakPolarHBondContact CD2-SD 3.3Å; C445-M449 WeakPolarHBondContact O-CG 3.29Å; C445-M449 PolarHBondContact O-N 2.9Å; N446-M449 PolarHBondContact O-N 3.3Å; V447-M449 VanDerWaalsContact C-N 3.32Å; V447-M449 PolarHBondContact O-N 3.09Å; M449-K452 CarbonylContact O-C 3.5Å; M449-K452 PolarHBondContact O-N 3.29Å; M449-K453 PolarHBondContact O-N 3.13Å; M449-S454 WeakPolarHBondContact CE-OG 3.16Å; M449-S454 PolarHBondContact O-N 3.15Å; M449-T456 VanDerWaalsContact CE-CB 3.42Å; M449-T456 HydrophobicContact CE-CG2 3.85Å; M449-A457 HydrophobicContact CB-CB 3.6Å; M449-L618 HydrophobicContact CG-CD1 4.42Å; M449-L618 HydrophobicContact CG-CD2 4.02Å; M449-L618 HydrophobicContact SD-CD1 3.36Å; M449-L618 WeakPolarHBondContact SD-CD1 3.42Å; M449-L618 HydrophobicContact SD-CD2 4Å; M449-L618 HydrophobicContact SD-CG 4.33Å
450	W	92.8	Very high	91.7	Very high	88 Å²	88	52 Å²	52	33%	0.333	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-41.3	173.2	-69.2	-39.2	0	0	0	112	F443 N446 V447 K452 K453 A457 V458 L463	F443-W450 HydrophobicContact CE2-CH2 4.24Å; F443-W450 HydrophobicContact CE2-CZ3 4.12Å; N446-W450 PolarHBondContact O-N 3.45Å; V447-W450 HydrophobicContact CG2-CE3 4.25Å; V447-W450 HydrophobicContact CG2-CZ3 4.16Å; V447-W450 PolarHBondContact O-N 3.15Å; W450-K452 PolarHBondContact O-N 2.82Å; W450-K453 PolarHBondContact O-N 3.01Å; W450-A457 HydrophobicContact CG-CB 4.2Å; W450-V458 VanDerWaalsContact CE2-O 3.29Å; W450-V458 WeakPolarHBondContact CZ2-O 3Å; W450-V458 PolarHBondContact NE1-O 3.31Å; W450-L463 HydrophobicContact CH2-CD1 3.12Å; W450-L463 HydrophobicContact CZ2-CD1 3.28Å; W450-L463 HydrophobicContact CZ2-CG 4.42Å; W450-L463 HydrophobicContact CZ3-CD1 4.33Å
451	A	91.5	Very high	91.5	Very high	82 Å²	82	54.6 Å²	54.6	68%	0.678	28%	0.281	S	S	*	.	H	α-helix	trans	-60	-28.2	175.9	0	0	0	0	0	112.3	V447 I448	V447-A451 WeakPolarHBondContact O-CB 3.1Å; V447-A451 PolarHBondContact O-N 3.45Å; I448-A451 PolarHBondContact O-N 3.18Å
452	K	89.5	Confident	91.3	Very high	103 Å²	103	53.1 Å²	53.1	45%	0.448	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	4.3	174.6	-66.9	-56.5	-171.1	-176.7	0	114.8	L61 I448 M449 W450 S454 V614	L61-K452 HydrophobicContact CD1-CB 4.33Å; L61-K452 HydrophobicContact CD1-CG 4.4Å; L61-K452 HydrophobicContact CD2-CB 4.33Å; I448-K452 PolarHBondContact O-N 3.5Å; I448-K452 VanDerWaalsContact O-N 3.16Å; M449-K452 CarbonylContact O-C 3.5Å; M449-K452 PolarHBondContact O-N 3.29Å; W450-K452 PolarHBondContact O-N 2.82Å; K452-S454 PolarHBondContact O-N 2.77Å; K452-V614 HydrophobicContact CG-CG1 4.23Å
453	K	87.5	Confident	91.2	Very high	172 Å²	172	51.5 Å²	51.5	75%	0.748	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	38.9	-176.9	-58.8	-176.3	177.4	-175.9	0	113	M449 W450	M449-K453 PolarHBondContact O-N 3.13Å; W450-K453 PolarHBondContact O-N 3.01Å
454	S	87.6	Confident	91.2	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.042	27%	0.266	C	S	.	.			trans	-79	144.7	179.2	178	0	0	0	0	111.4	T62 M449 K452 T456 A457	T62-S454 PolarHBondContact N-OG 3Å; T62-S454 CarbonylContact O-C 3.44Å; T62-S454 WeakPolarHBondContact O-CA 3.35Å; T62-S454 WeakPolarHBondContact O-CB 3.3Å; T62-S454 PolarHBondContact O-OG 3.09Å; M449-S454 WeakPolarHBondContact CE-OG 3.16Å; M449-S454 PolarHBondContact O-N 3.15Å; K452-S454 PolarHBondContact O-N 2.77Å; S454-T456 VanDerWaalsContact C-N 3.26Å; S454-T456 PolarHBondContact O-N 3.48Å; S454-A457 WeakPolarHBondContact O-CB 3.41Å; S454-A457 PolarHBondContact O-N 2.99Å
455	S	84.4	Confident	91.2	Very high	4 Å²	4	49.1 Å²	49.1	3%	0.028	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-24.7	178.4	61	0	0	0	0	114.2	T62 Y63 R92 A457	T62-S455 WeakPolarHBondContact CB-OG 3.25Å; T62-S455 PolarHBondContact O-N 3.49Å; T62-S455 PolarHBondContact O-OG 2.96Å; T62-S455 PolarHBondContact OG1-OG 3.2Å; Y63-S455 VanDerWaalsContact C-OG 3.28Å; Y63-S455 WeakPolarHBondContact CA-OG 3.33Å; Y63-S455 PolarHBondContact N-OG 2.83Å; Y63-S455 PolarHBondContact O-OG 2.92Å; R92-S455 PolarHBondContact NH2-O 2.89Å; S455-A457 PolarHBondContact O-N 3.17Å
456	T	85.2	Confident	91.2	Very high	24 Å²	24	50.5 Å²	50.5	15%	0.147	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.7	173.7	-64.8	0	0	0	0	112.3	R53 T62 M449 S454 V458	R53-T456 PolarHBondContact NH1-OG1 3.11Å; T62-T456 WeakPolarHBondContact OG1-CB 3.39Å; T62-T456 PolarHBondContact OG1-N 2.86Å; T62-T456 PolarHBondContact OG1-OG1 3Å; M449-T456 VanDerWaalsContact CE-CB 3.42Å; M449-T456 HydrophobicContact CE-CG2 3.85Å; S454-T456 VanDerWaalsContact C-N 3.26Å; S454-T456 PolarHBondContact O-N 3.48Å; T456-V458 PolarHBondContact O-N 3.48Å
457	A	89.5	Confident	91.3	Very high	9 Å²	9	53.2 Å²	53.2	7%	0.074	29%	0.285	C	S	.	.	S	Bend	trans	-63.4	125.5	171.3	0	0	0	0	0	110	R92 M449 W450 S454 S455	R92-A457 PolarHBondContact NH2-O 2.81Å; M449-A457 HydrophobicContact CB-CB 3.6Å; W450-A457 HydrophobicContact CG-CB 4.2Å; S454-A457 WeakPolarHBondContact O-CB 3.41Å; S454-A457 PolarHBondContact O-N 2.99Å; S455-A457 PolarHBondContact O-N 3.17Å
458	V	91.6	Very high	91.3	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.012	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-70.9	127.9	179.8	177.5	0	0	0	0	109	L88 F442 N446 W450 T456 T462 L463	L88-V458 HydrophobicContact CD2-CG1 4.29Å; L88-V458 HydrophobicContact CD2-CG2 4.14Å; F442-V458 HydrophobicContact CZ-CB 4.47Å; F442-V458 HydrophobicContact CZ-CG2 3.75Å; N446-V458 VanDerWaalsContact OD1-CB 3.31Å; N446-V458 WeakPolarHBondContact OD1-CB 3.5Å; N446-V458 WeakPolarHBondContact OD1-CG2 3.31Å; N446-V458 PolarHBondContact OD1-N 3.15Å; W450-V458 VanDerWaalsContact CE2-O 3.29Å; W450-V458 WeakPolarHBondContact CZ2-O 3Å; W450-V458 PolarHBondContact NE1-O 3.31Å; T456-V458 PolarHBondContact O-N 3.48Å; V458-T462 HydrophobicContact CG1-CG2 3.64Å; V458-L463 HydrophobicContact CB-CD2 4.36Å; V458-L463 HydrophobicContact CB-CG 4.43Å; V458-L463 HydrophobicContact CG1-CD2 4.09Å; V458-L463 HydrophobicContact CG1-CG 4.03Å
459	P	90.7	Very high	91.4	Very high	43 Å²	43	55.7 Å²	55.7	28%	0.279	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-61	147.9	179	-23.3	34.8	0	0	0	111.1	V87 P461 T462 L463	V87-P459 HydrophobicContact CG1-CG 4.2Å; P459-P461 VanDerWaalsContact C-CD 3.47Å; P459-T462 WeakPolarHBondContact O-CB 3.23Å; P459-T462 PolarHBondContact O-N 2.92Å; P459-L463 PolarHBondContact O-N 3.25Å
460	F	91.1	Very high	91.6	Very high	146 Å²	146	57.2 Å²	57.2	64%	0.64	30%	0.296	S	S	*	.	H	α-helix	trans	-52.4	-43.7	179.8	179.1	-99.3	0	0	0	113.9	T462 L463 C464	F460-T462 VanDerWaalsContact C-N 3.26Å; F460-T462 PolarHBondContact O-N 2.92Å; F460-L463 WeakPolarHBondContact O-CB 3.22Å; F460-L463 PolarHBondContact O-N 2.9Å; F460-L463 VanDerWaalsContact O-N 3.08Å; F460-C464 VanDerWaalsContact CE1-SG 3.54Å; F460-C464 PolarHBondContact O-N 3.2Å
461	P	92	Very high	91.7	Very high	92 Å²	92	57.6 Å²	57.6	60%	0.597	30%	0.3	S	S	*	.	H	α-helix	trans	-58.7	-36.9	176.6	-25.3	35.3	0	0	0	113.4	P459 C464 L465	P459-P461 VanDerWaalsContact C-CD 3.47Å; P461-C464 WeakPolarHBondContact O-CB 3.4Å; P461-C464 PolarHBondContact O-N 2.97Å; P461-L465 PolarHBondContact O-N 3.31Å
462	T	92.2	Very high	91.9	Very high	18 Å²	18	55.5 Å²	55.5	11%	0.11	29%	0.287	C	S	.	.	H	α-helix	trans	-69.4	-35.1	177.9	-51.6	0	0	0	0	111.4	L84 V87 L88 V458 P459 F460 L465 L466	L84-T462 HydrophobicContact CD1-CG2 3.77Å; V87-T462 HydrophobicContact CG1-CG2 3.89Å; V87-T462 WeakPolarHBondContact CG1-OG1 2.91Å; L88-T462 HydrophobicContact CD2-CG2 4.26Å; V458-T462 HydrophobicContact CG1-CG2 3.64Å; P459-T462 WeakPolarHBondContact O-CB 3.23Å; P459-T462 PolarHBondContact O-N 2.92Å; F460-T462 VanDerWaalsContact C-N 3.26Å; F460-T462 PolarHBondContact O-N 2.92Å; T462-L465 WeakPolarHBondContact O-CB 3.24Å; T462-L465 PolarHBondContact O-N 3.13Å; T462-L466 WeakPolarHBondContact O-CG 3.1Å; T462-L466 PolarHBondContact O-N 2.67Å
463	L	92.8	Very high	92.1	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-65.7	-40.4	171.5	-70.3	176.4	0	0	0	112.1	F442 F443 W450 V458 P459 F460 L465 L466 L467	F442-L463 HydrophobicContact CD1-CD2 4.31Å; F442-L463 HydrophobicContact CE1-CD2 3.66Å; F443-L463 HydrophobicContact CD2-CD1 4.39Å; W450-L463 HydrophobicContact CH2-CD1 3.12Å; W450-L463 HydrophobicContact CZ2-CD1 3.28Å; W450-L463 HydrophobicContact CZ2-CG 4.42Å; W450-L463 HydrophobicContact CZ3-CD1 4.33Å; V458-L463 HydrophobicContact CB-CD2 4.36Å; V458-L463 HydrophobicContact CB-CG 4.43Å; V458-L463 HydrophobicContact CG1-CD2 4.09Å; V458-L463 HydrophobicContact CG1-CG 4.03Å; P459-L463 PolarHBondContact O-N 3.25Å; F460-L463 WeakPolarHBondContact O-CB 3.22Å; F460-L463 PolarHBondContact O-N 2.9Å; F460-L463 VanDerWaalsContact O-N 3.08Å; L463-L465 VanDerWaalsContact C-N 3.27Å; L463-L465 PolarHBondContact O-N 3.4Å; L463-L466 HydrophobicContact CD2-CD1 4.25Å; L463-L466 PolarHBondContact O-N 2.93Å; L463-L467 WeakPolarHBondContact O-CG 3.44Å; L463-L467 PolarHBondContact O-N 3.44Å
464	C	94.5	Very high	92.5	Very high	53 Å²	53	45.5 Å²	45.5	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-39	171.5	-65.8	0	0	0	0	111.5	F460 P461 L467 F468	F460-C464 VanDerWaalsContact CE1-SG 3.54Å; F460-C464 PolarHBondContact O-N 3.2Å; P461-C464 WeakPolarHBondContact O-CB 3.4Å; P461-C464 PolarHBondContact O-N 2.97Å; C464-L467 PolarHBondContact O-N 3.38Å; C464-F468 WeakPolarHBondContact O-CB 3.3Å; C464-F468 PolarHBondContact O-N 2.91Å
465	L	94.1	Very high	92.9	Very high	77 Å²	77	46.6 Å²	46.6	40%	0.403	25%	0.252	S	S	.	.	H	α-helix	trans	-63.9	-43.9	174.5	178.7	63.9	0	0	0	112.1	L84 P461 T462 L463 L467 F468 L469	L84-L465 HydrophobicContact CD1-CD2 3.92Å; P461-L465 PolarHBondContact O-N 3.31Å; T462-L465 WeakPolarHBondContact O-CB 3.24Å; T462-L465 PolarHBondContact O-N 3.13Å; L463-L465 VanDerWaalsContact C-N 3.27Å; L463-L465 PolarHBondContact O-N 3.4Å; L465-L467 VanDerWaalsContact C-N 3.33Å; L465-L467 PolarHBondContact O-N 3.37Å; L465-F468 PolarHBondContact O-N 3.36Å; L465-L469 HydrophobicContact CD1-CG 4.48Å; L465-L469 HydrophobicContact CG-CD1 4.38Å; L465-L469 WeakPolarHBondContact O-CB 3.46Å; L465-L469 WeakPolarHBondContact O-CG 3.38Å; L465-L469 PolarHBondContact O-N 2.88Å
466	L	94.3	Very high	93.5	Very high	29 Å²	29	49.2 Å²	49.2	15%	0.152	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-40.7	175.5	-66.6	179.1	0	0	0	111.8	L88 V397 F442 T462 L463 L469 W470	L88-L466 HydrophobicContact CD1-CD2 4.45Å; L88-L466 HydrophobicContact CD2-CD1 3.91Å; L88-L466 HydrophobicContact CD2-CD2 4.4Å; V397-L466 HydrophobicContact CG1-CD2 4.3Å; F442-L466 HydrophobicContact CE1-CD1 3.92Å; T462-L466 WeakPolarHBondContact O-CG 3.1Å; T462-L466 PolarHBondContact O-N 2.67Å; L463-L466 HydrophobicContact CD2-CD1 4.25Å; L463-L466 PolarHBondContact O-N 2.93Å; L466-L469 PolarHBondContact O-N 3.48Å; L466-W470 WeakPolarHBondContact O-CB 3.5Å; L466-W470 PolarHBondContact O-N 3.39Å
467	L	95	Very high	94	Very high	56 Å²	56	50 Å²	50	29%	0.293	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-42.2	173.7	-73.8	170.3	0	0	0	111.1	F439 L463 C464 L465 W470 F471	F439-L467 HydrophobicContact CE1-CD2 3.94Å; F439-L467 HydrophobicContact CE2-CD2 3.91Å; F439-L467 HydrophobicContact CE2-CG 4.12Å; F439-L467 HydrophobicContact CZ-CD1 4.21Å; F439-L467 HydrophobicContact CZ-CD2 3.54Å; F439-L467 HydrophobicContact CZ-CG 3.86Å; L463-L467 WeakPolarHBondContact O-CG 3.44Å; L463-L467 PolarHBondContact O-N 3.44Å; C464-L467 PolarHBondContact O-N 3.38Å; L465-L467 VanDerWaalsContact C-N 3.33Å; L465-L467 PolarHBondContact O-N 3.37Å; L467-W470 HydrophobicContact CD2-CE3 4.15Å; L467-W470 HydrophobicContact CD2-CZ3 4.44Å; L467-W470 PolarHBondContact O-N 3.26Å; L467-F471 HydrophobicContact CB-CD2 4.47Å; L467-F471 HydrophobicContact CD2-CD2 4.14Å; L467-F471 HydrophobicContact CD2-CE2 3.73Å; L467-F471 WeakPolarHBondContact O-CD2 3.24Å; L467-F471 PolarHBondContact O-N 3.29Å
468	F	96	Very high	94.4	Very high	129 Å²	129	49.7 Å²	49.7	57%	0.566	27%	0.269	S	S	*	.	H	α-helix	trans	-63.6	-43.6	175	178.5	-100.3	0	0	0	112.2	C464 L465 W470 G472 I473	C464-F468 WeakPolarHBondContact O-CB 3.3Å; C464-F468 PolarHBondContact O-N 2.91Å; L465-F468 PolarHBondContact O-N 3.36Å; F468-W470 VanDerWaalsContact C-N 3.25Å; F468-W470 PolarHBondContact O-N 3.34Å; F468-G472 WeakPolarHBondContact O-CA 3.16Å; F468-G472 PolarHBondContact O-N 3.2Å; F468-I473 HydrophobicContact CE1-CD1 4.34Å
469	L	95.2	Very high	94.6	Very high	30 Å²	30	53.6 Å²	53.6	16%	0.157	29%	0.286	C	S	.	.	I	π-helix	trans	-61.1	-35.8	174.3	-73	173.9	0	0	0	111.8	L84 V397 V401 L465 L466 I473 S474	L84-L469 HydrophobicContact CD2-CD1 4.11Å; V397-L469 HydrophobicContact CG1-CD1 4Å; V401-L469 HydrophobicContact CG2-CB 4.08Å; L465-L469 HydrophobicContact CD1-CG 4.48Å; L465-L469 HydrophobicContact CG-CD1 4.38Å; L465-L469 WeakPolarHBondContact O-CB 3.46Å; L465-L469 WeakPolarHBondContact O-CG 3.38Å; L465-L469 PolarHBondContact O-N 2.88Å; L466-L469 PolarHBondContact O-N 3.48Å; L469-I473 HydrophobicContact CD2-CD1 4.02Å; L469-S474 WeakPolarHBondContact O-CB 3.46Å; L469-S474 PolarHBondContact O-N 3.34Å
470	W	95.7	Very high	94.9	Very high	34 Å²	34	54.5 Å²	54.5	13%	0.129	29%	0.29	C	S	.	.	I	π-helix	trans	-73.7	-61.7	177	-177.8	16	0	0	0	112.5	C431 F432 P435 F439 L466 L467 F468 S474 L475	C431-W470 PolarHBondContact O-NE1 3.36Å; F432-W470 AromaticContact CD1-CZ2 3.86Å; F432-W470 HydrophobicContact CD1-CZ2 3.86Å; F432-W470 HydrophobicContact CE1-CZ2 4.49Å; P435-W470 HydrophobicContact CB-CZ2 3.91Å; P435-W470 HydrophobicContact CG-CZ2 3.9Å; F439-W470 HydrophobicContact CB-CZ3 3.96Å; F439-W470 HydrophobicContact CD1-CZ3 4.08Å; F439-W470 HydrophobicContact CG-CE3 4.42Å; F439-W470 AromaticContact CG-CZ3 3.93Å; F439-W470 HydrophobicContact CG-CZ3 3.93Å; L466-W470 WeakPolarHBondContact O-CB 3.5Å; L466-W470 PolarHBondContact O-N 3.39Å; L467-W470 HydrophobicContact CD2-CE3 4.15Å; L467-W470 HydrophobicContact CD2-CZ3 4.44Å; L467-W470 PolarHBondContact O-N 3.26Å; F468-W470 VanDerWaalsContact C-N 3.25Å; F468-W470 PolarHBondContact O-N 3.34Å; W470-S474 WeakPolarHBondContact O-CB 3.31Å; W470-S474 PolarHBondContact O-N 2.89Å; W470-L475 WeakPolarHBondContact O-CB 3.43Å; W470-L475 PolarHBondContact O-N 2.61Å
471	F	95.7	Very high	95.2	Very high	95 Å²	95	47.6 Å²	47.6	42%	0.417	26%	0.26	S	S	.	.	I	π-helix	trans	-76.2	-35.5	-174.7	-73.2	-85.6	0	0	0	113.2	F432 L467 L475 P476	F432-F471 HydrophobicContact CE1-CD1 4.25Å; F432-F471 AromaticContact CE1-CE1 3.52Å; F432-F471 HydrophobicContact CE1-CE1 3.52Å; F432-F471 HydrophobicContact CE1-CZ 4.14Å; F432-F471 HydrophobicContact CZ-CE1 4.18Å; L467-F471 HydrophobicContact CB-CD2 4.47Å; L467-F471 HydrophobicContact CD2-CD2 4.14Å; L467-F471 HydrophobicContact CD2-CE2 3.73Å; L467-F471 WeakPolarHBondContact O-CD2 3.24Å; L467-F471 PolarHBondContact O-N 3.29Å; F471-L475 HydrophobicContact CD1-CD1 3.98Å; F471-P476 WeakPolarHBondContact O-CD 3.05Å
472	G	94.5	Very high	95.4	Very high	38 Å²	38	43.3 Å²	43.3	39%	0.392	23%	0.233	S	C	.	.	I	π-helix	trans	-82.7	-29.7	-175.9	0	0	0	0	0	114.2	F468	F468-G472 WeakPolarHBondContact O-CA 3.16Å; F468-G472 PolarHBondContact O-N 3.2Å
473	I	95.3	Very high	95.6	Very high	59 Å²	59	49.2 Å²	49.2	30%	0.303	25%	0.254	S	S	.	.	I	π-helix	trans	-124.1	-61	-174.5	-61.8	166.2	0	0	0	111.5	V401 F468 L469 L475 P476 L477	V401-I473 HydrophobicContact CG1-CB 3.87Å; V401-I473 HydrophobicContact CG1-CG2 3.36Å; F468-I473 HydrophobicContact CE1-CD1 4.34Å; L469-I473 HydrophobicContact CD2-CD1 4.02Å; I473-L475 VanDerWaalsContact C-N 3.34Å; I473-L475 PolarHBondContact O-N 2.86Å; I473-P476 VanDerWaalsContact O-CD 3.28Å; I473-P476 WeakPolarHBondContact O-CD 3.31Å; I473-L477 HydrophobicContact CG2-CD1 3.46Å; I473-L477 VanDerWaalsContact CG2-CD1 3.46Å; I473-L477 WeakPolarHBondContact O-CD1 3.34Å; I473-L477 PolarHBondContact O-N 3.07Å; I473-L477 VanDerWaalsContact O-N 3.09Å
474	S	95	Very high	95.7	Very high	6 Å²	6	53.8 Å²	53.8	4%	0.042	27%	0.274	C	S	.	.	I	π-helix	trans	-58.5	-43.5	-174.5	-173.4	0	0	0	0	112.5	L469 W470 L477 T478	L469-S474 WeakPolarHBondContact O-CB 3.46Å; L469-S474 PolarHBondContact O-N 3.34Å; W470-S474 WeakPolarHBondContact O-CB 3.31Å; W470-S474 PolarHBondContact O-N 2.89Å; S474-L477 WeakPolarHBondContact O-CB 3.47Å; S474-L477 PolarHBondContact O-N 3.48Å; S474-T478 WeakPolarHBondContact O-CG2 3.48Å; S474-T478 PolarHBondContact O-N 3.34Å; S474-T478 PolarHBondContact O-OG1 3.06Å
475	L	95.9	Very high	95.8	Very high	30 Å²	30	51.3 Å²	51.3	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-52.5	178.7	-179.4	164.5	0	0	0	112.2	C431 F432 W470 F471 I473 L477 T478 F479	C431-L475 HydrophobicContact CB-CG 4.49Å; F432-L475 HydrophobicContact CE1-CD1 3.82Å; F432-L475 HydrophobicContact CE2-CD1 4.41Å; F432-L475 HydrophobicContact CZ-CD1 3.48Å; F432-L475 VanDerWaalsContact CZ-CD1 3.48Å; W470-L475 WeakPolarHBondContact O-CB 3.43Å; W470-L475 PolarHBondContact O-N 2.61Å; F471-L475 HydrophobicContact CD1-CD1 3.98Å; I473-L475 VanDerWaalsContact C-N 3.34Å; I473-L475 PolarHBondContact O-N 2.86Å; L475-L477 PolarHBondContact O-N 2.96Å; L475-T478 WeakPolarHBondContact CA-OG1 3.2Å; L475-T478 PolarHBondContact O-N 3.27Å; L475-T478 PolarHBondContact O-OG1 2.92Å; L475-F479 HydrophobicContact CD2-CD2 3.59Å; L475-F479 HydrophobicContact CD2-CE2 3.64Å; L475-F479 HydrophobicContact CG-CD2 4.13Å; L475-F479 HydrophobicContact CG-CE2 4.07Å; L475-F479 WeakPolarHBondContact O-CD2 3.33Å; L475-F479 PolarHBondContact O-N 3.25Å
476	P	96.7	Very high	95.8	Very high	59 Å²	59	49.5 Å²	49.5	38%	0.383	25%	0.245	S	C	.	.	H	α-helix	trans	-56.3	-36.7	172.9	-30.4	35.7	0	0	0	114.1	F471 I473 F479 T480	F471-P476 WeakPolarHBondContact O-CD 3.05Å; I473-P476 VanDerWaalsContact O-CD 3.28Å; I473-P476 WeakPolarHBondContact O-CD 3.31Å; P476-F479 PolarHBondContact O-N 3.26Å; P476-T480 WeakPolarHBondContact O-CB 3.5Å; P476-T480 PolarHBondContact O-N 2.63Å; P476-T480 PolarHBondContact O-OG1 2.6Å
477	L	96.5	Very high	95.8	Very high	39 Å²	39	56.6 Å²	56.6	20%	0.204	27%	0.27	C	S	.	.	H	α-helix	trans	-65.8	-43.9	176.7	-86.2	149.1	0	0	0	112.3	I405 I473 S474 L475 T480 G481	I405-L477 WeakPolarHBondContact CA-O 3.5Å; I405-L477 HydrophobicContact CB-CD2 4.08Å; I473-L477 HydrophobicContact CG2-CD1 3.46Å; I473-L477 VanDerWaalsContact CG2-CD1 3.46Å; I473-L477 WeakPolarHBondContact O-CD1 3.34Å; I473-L477 PolarHBondContact O-N 3.07Å; I473-L477 VanDerWaalsContact O-N 3.09Å; S474-L477 WeakPolarHBondContact O-CB 3.47Å; S474-L477 PolarHBondContact O-N 3.48Å; L475-L477 PolarHBondContact O-N 2.96Å; L477-T480 PolarHBondContact O-N 3.13Å; L477-G481 PolarHBondContact O-N 3.13Å
478	T	96.8	Very high	95.6	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-41	175.1	56.3	0	0	0	0	111.4	G404 N407 G408 C431 S474 L475 T480 G481 A482	G404-T478 VanDerWaalsContact O-CA 3.27Å; G404-T478 WeakPolarHBondContact O-CA 3.44Å; G404-T478 VanDerWaalsContact O-CG2 3.22Å; G404-T478 WeakPolarHBondContact O-CG2 3.32Å; N407-T478 HydrophobicContact CB-CG2 4.34Å; G408-T478 WeakPolarHBondContact CA-O 3.22Å; C431-T478 PolarHBondContact SG-OG1 3.34Å; S474-T478 WeakPolarHBondContact O-CG2 3.48Å; S474-T478 PolarHBondContact O-N 3.34Å; S474-T478 PolarHBondContact O-OG1 3.06Å; L475-T478 WeakPolarHBondContact CA-OG1 3.2Å; L475-T478 PolarHBondContact O-N 3.27Å; L475-T478 PolarHBondContact O-OG1 2.92Å; T478-T480 PolarHBondContact O-N 2.68Å; T478-G481 PolarHBondContact O-N 3.24Å; T478-A482 WeakPolarHBondContact O-CB 3.25Å; T478-A482 PolarHBondContact O-N 3.42Å
479	F	96.4	Very high	95.4	Very high	83 Å²	83	57.7 Å²	57.7	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-44.2	173.1	-91.9	-89.4	0	0	0	112.1	V427 L428 L475 P476 A482 Y483	V427-F479 HydrophobicContact CB-CE1 4.39Å; V427-F479 HydrophobicContact CG1-CD1 3.53Å; V427-F479 HydrophobicContact CG1-CD2 4.16Å; V427-F479 HydrophobicContact CG1-CE1 3.48Å; V427-F479 VanDerWaalsContact CG1-CE1 3.48Å; V427-F479 HydrophobicContact CG1-CE2 4.14Å; V427-F479 HydrophobicContact CG1-CG 3.89Å; V427-F479 HydrophobicContact CG1-CZ 3.81Å; L428-F479 HydrophobicContact CD2-CZ 4.07Å; L475-F479 HydrophobicContact CD2-CD2 3.59Å; L475-F479 HydrophobicContact CD2-CE2 3.64Å; L475-F479 HydrophobicContact CG-CD2 4.13Å; L475-F479 HydrophobicContact CG-CE2 4.07Å; L475-F479 WeakPolarHBondContact O-CD2 3.33Å; L475-F479 PolarHBondContact O-N 3.25Å; P476-F479 PolarHBondContact O-N 3.26Å; F479-A482 PolarHBondContact O-N 3.16Å; F479-Y483 WeakPolarHBondContact O-CB 3.35Å; F479-Y483 PolarHBondContact O-N 2.92Å
480	T	96.6	Very high	95.1	Very high	62 Å²	62	62.7 Å²	62.7	38%	0.38	30%	0.3	S	S	.	.	H	α-helix	trans	-61.6	-45.5	177.6	-60	0	0	0	0	111.2	I405 P476 L477 T478 A482 Y483 F484	I405-T480 HydrophobicContact CD1-CG2 4.47Å; P476-T480 WeakPolarHBondContact O-CB 3.5Å; P476-T480 PolarHBondContact O-N 2.63Å; P476-T480 PolarHBondContact O-OG1 2.6Å; L477-T480 PolarHBondContact O-N 3.13Å; T478-T480 PolarHBondContact O-N 2.68Å; T480-A482 PolarHBondContact O-N 2.86Å; T480-Y483 WeakPolarHBondContact O-CB 3.27Å; T480-Y483 PolarHBondContact O-N 3.36Å; T480-F484 HydrophobicContact CG2-CD2 3.96Å; T480-F484 HydrophobicContact CG2-CE2 3.57Å; T480-F484 WeakPolarHBondContact O-CD2 3.46Å; T480-F484 PolarHBondContact O-N 3.29Å; T480-F484 VanDerWaalsContact O-N 3.12Å
481	G	97.4	Very high	94.6	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-46.2	174.2	0	0	0	0	0	112.4	I405 Y409 L477 T478 F484 G485	I405-G481 VanDerWaalsContact O-CA 3.3Å; I405-G481 WeakPolarHBondContact O-CA 3.37Å; Y409-G481 VanDerWaalsContact CA-O 3.26Å; Y409-G481 WeakPolarHBondContact CA-O 3.33Å; Y409-G481 VanDerWaalsContact N-C 3.34Å; Y409-G481 PolarHBondContact N-O 2.64Å; L477-G481 PolarHBondContact O-N 3.13Å; T478-G481 PolarHBondContact O-N 3.24Å; G481-F484 PolarHBondContact O-N 3.47Å; G481-G485 PolarHBondContact O-N 3.09Å
482	A	96.9	Very high	94	Very high	3 Å²	3	61.2 Å²	61.2	3%	0.025	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-40.2	178	0	0	0	0	0	112.6	G408 A412 V427 T478 F479 T480 F484 G485 Y486	G408-A482 VanDerWaalsContact O-CA 3.31Å; G408-A482 WeakPolarHBondContact O-CA 3.46Å; A412-A482 HydrophobicContact CB-CB 4.03Å; V427-A482 HydrophobicContact CB-CB 4.47Å; V427-A482 HydrophobicContact CG1-CB 4.06Å; V427-A482 HydrophobicContact CG2-CB 3.62Å; T478-A482 WeakPolarHBondContact O-CB 3.25Å; T478-A482 PolarHBondContact O-N 3.42Å; F479-A482 PolarHBondContact O-N 3.16Å; T480-A482 PolarHBondContact O-N 2.86Å; A482-F484 PolarHBondContact O-N 2.97Å; A482-G485 WeakPolarHBondContact O-CA 3.47Å; A482-G485 PolarHBondContact O-N 3.2Å; A482-G485 VanDerWaalsContact O-N 3.12Å; A482-Y486 VanDerWaalsContact O-CD2 3.25Å; A482-Y486 WeakPolarHBondContact O-CD2 3.49Å; A482-Y486 PolarHBondContact O-N 3.24Å
483	Y	96.2	Very high	93.7	Very high	141 Å²	141	61.4 Å²	61.4	55%	0.553	30%	0.3	S	S	*	.	H	α-helix	trans	-56.7	-49.4	174.6	174.6	-97.4	0	0	0	111.4	F479 T480 G485 Y486 R487	F479-Y483 WeakPolarHBondContact O-CB 3.35Å; F479-Y483 PolarHBondContact O-N 2.92Å; T480-Y483 WeakPolarHBondContact O-CB 3.27Å; T480-Y483 PolarHBondContact O-N 3.36Å; Y483-G485 VanDerWaalsContact C-N 3.31Å; Y483-G485 PolarHBondContact O-N 3.03Å; Y483-Y486 PolarHBondContact O-N 3.04Å; Y483-R487 WeakPolarHBondContact O-CB 3.35Å; Y483-R487 PolarHBondContact O-N 2.99Å
484	F	95.9	Very high	93.2	Very high	102 Å²	102	61.2 Å²	61.2	45%	0.447	30%	0.303	S	S	.	.	H	α-helix	trans	-65.4	-33.7	175.1	-71.2	-60.7	0	0	0	112.9	Y409 T480 G481 A482 K488	Y409-F484 HydrophobicContact CD2-CB 4.46Å; T480-F484 HydrophobicContact CG2-CD2 3.96Å; T480-F484 HydrophobicContact CG2-CE2 3.57Å; T480-F484 WeakPolarHBondContact O-CD2 3.46Å; T480-F484 PolarHBondContact O-N 3.29Å; T480-F484 VanDerWaalsContact O-N 3.12Å; G481-F484 PolarHBondContact O-N 3.47Å; A482-F484 PolarHBondContact O-N 2.97Å; F484-K488 PolarHBondContact O-N 3.43Å
485	G	95.2	Very high	92.8	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-47.2	175.6	0	0	0	0	0	112.8	R413 G481 A482 Y483	R413-G485 WeakPolarHBondContact CD-O 3.3Å; G481-G485 PolarHBondContact O-N 3.09Å; A482-G485 WeakPolarHBondContact O-CA 3.47Å; A482-G485 PolarHBondContact O-N 3.2Å; A482-G485 VanDerWaalsContact O-N 3.12Å; Y483-G485 VanDerWaalsContact C-N 3.31Å; Y483-G485 PolarHBondContact O-N 3.03Å
486	Y	94.4	Very high	92.4	Very high	40 Å²	40	71.3 Å²	71.3	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-74.5	-27	178.6	-75.8	-63.7	0	0	0	113.7	A412 Y415 K416 W423 N426 V427 A482 Y483 K488	A412-Y486 HydrophobicContact CB-CD2 3.67Å; A412-Y486 HydrophobicContact CB-CE1 4.32Å; A412-Y486 HydrophobicContact CB-CE2 3.44Å; A412-Y486 VanDerWaalsContact CB-CE2 3.44Å; A412-Y486 HydrophobicContact CB-CG 4.19Å; Y415-Y486 WeakPolarHBondContact CD1-OH 3.01Å; K416-Y486 HydrophobicContact CB-CD1 4.12Å; K416-Y486 HydrophobicContact CB-CE1 4.08Å; K416-Y486 HydrophobicContact CD-CD1 4.16Å; K416-Y486 HydrophobicContact CG-CD1 4.45Å; K416-Y486 PolarHBondContact NZ-O 3.23Å; W423-Y486 HydrophobicContact CB-CD1 4.31Å; W423-Y486 HydrophobicContact CB-CE1 3.74Å; W423-Y486 HydrophobicContact CB-CE2 3.96Å; N426-Y486 WeakPolarHBondContact CB-OH 3.22Å; N426-Y486 PolarHBondContact ND2-OH 3.48Å; N426-Y486 VanDerWaalsContact ND2-OH 3.17Å; V427-Y486 HydrophobicContact CG2-CD2 4.48Å; V427-Y486 HydrophobicContact CG2-CE2 3.76Å; A482-Y486 VanDerWaalsContact O-CD2 3.25Å; A482-Y486 WeakPolarHBondContact O-CD2 3.49Å; A482-Y486 PolarHBondContact O-N 3.24Å; Y483-Y486 PolarHBondContact O-N 3.04Å; Y486-K488 VanDerWaalsContact C-N 3.32Å; Y486-K488 PolarHBondContact O-N 2.97Å
487	R	93.7	Very high	91.9	Very high	178 Å²	178	71.8 Å²	71.8	67%	0.672	34%	0.342	S	S	*	.	H	α-helix	trans	-66.6	-32.9	177	-170.5	173.2	177.9	179.3	-0.1	112.6	Y483	Y483-R487 WeakPolarHBondContact O-CB 3.35Å; Y483-R487 PolarHBondContact O-N 2.99Å
488	K	91.5	Very high	91.5	Very high	103 Å²	103	74.3 Å²	74.3	45%	0.448	36%	0.356	S	S	.	.	S	Bend	trans	-67.6	142.7	176.1	-74.9	-171.6	179.2	-179.6	0	111.3	Y409 K416 F484 Y486	Y409-K488 HydrophobicContact CE2-CD 4.33Å; Y409-K488 PolarHBondContact OH-NZ 3.16Å; K416-K488 WeakPolarHBondContact CE-O 3.44Å; K416-K488 PolarHBondContact NZ-O 3.2Å; F484-K488 PolarHBondContact O-N 3.43Å; Y486-K488 VanDerWaalsContact C-N 3.32Å; Y486-K488 PolarHBondContact O-N 2.97Å
489	P	91.9	Very high	91.1	Very high	105 Å²	105	83 Å²	83	68%	0.682	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.4	155.7	177.8	26.2	-34.8	0	0	0	111	R413	R413-P489 PolarHBondContact NH1-O 3.37Å
490	R	88.7	Confident	90.7	Very high	134 Å²	134	85.7 Å²	85.7	51%	0.506	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-55.1	130.3	176.7	-174.2	177.1	-178.3	-178.5	0.4	108.5	A417 A492	A417-R490 VanDerWaalsContact O-CZ 3.31Å; A417-R490 PolarHBondContact O-NE 3.1Å; A417-R490 PolarHBondContact O-NH2 3.49Å; R490-A492 PolarHBondContact O-N 3.14Å
491	P	84.9	Confident	90.4	Very high	17 Å²	17	85.7 Å²	85.7	11%	0.11	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-57.4	126.7	173	-2.8	8.5	0	0	0	109.3	A417 Y493	A417-P491 HydrophobicContact CB-CG 3.71Å; P491-Y493 PolarHBondContact O-N 2.82Å
492	A	84.9	Confident	89.9	Confident	82 Å²	82	90.2 Å²	90.2	68%	0.678	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-66.6	131.6	171.2	0	0	0	0	0	109.3	R490 R647	R490-A492 PolarHBondContact O-N 3.14Å; A492-R647 PolarHBondContact O-NH2 3.37Å
493	Y	87.1	Confident	89.5	Confident	41 Å²	41	98.6 Å²	98.6	16%	0.161	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-85.6	145	168.2	-65.8	-51.3	0	0	0	109	F349 A417 P491 V495 F643	F349-Y493 HydrophobicContact CB-CD1 4.32Å; F349-Y493 HydrophobicContact CB-CD2 3.86Å; F349-Y493 HydrophobicContact CB-CE2 4.16Å; F349-Y493 HydrophobicContact CB-CG 3.94Å; F349-Y493 AromaticContact CD1-CD1 3.35Å; F349-Y493 HydrophobicContact CD1-CD1 3.35Å; F349-Y493 HydrophobicContact CD1-CD2 4.41Å; F349-Y493 AromaticContact CD1-CE1 3.64Å; F349-Y493 HydrophobicContact CD1-CE1 3.64Å; F349-Y493 AromaticContact CD1-CG 3.8Å; F349-Y493 HydrophobicContact CD1-CG 3.8Å; F349-Y493 HydrophobicContact CD2-CG 4.3Å; F349-Y493 AromaticContact CE1-CD1 3.75Å; F349-Y493 HydrophobicContact CE1-CD1 3.75Å; F349-Y493 HydrophobicContact CE1-CE1 4.18Å; F349-Y493 HydrophobicContact CE1-CG 4.43Å; F349-Y493 AromaticContact CG-CD1 3.81Å; F349-Y493 HydrophobicContact CG-CD1 3.81Å; F349-Y493 HydrophobicContact CG-CD2 4.18Å; F349-Y493 HydrophobicContact CG-CE1 4.35Å; F349-Y493 AromaticContact CG-CG 3.73Å; F349-Y493 HydrophobicContact CG-CG 3.73Å; F349-Y493 HydrophobicContact CZ-CD1 4.48Å; A417-Y493 VanDerWaalsContact CB-OH 3.3Å; A417-Y493 WeakPolarHBondContact CB-OH 3.46Å; A417-Y493 VanDerWaalsContact O-CE2 3.23Å; A417-Y493 WeakPolarHBondContact O-CE2 3.24Å; A417-Y493 PolarHBondContact O-OH 3.27Å; P491-Y493 PolarHBondContact O-N 2.82Å; Y493-V495 PolarHBondContact O-N 2.71Å; Y493-F643 HydrophobicContact CE1-CE2 4.31Å; Y493-F643 HydrophobicContact CE1-CZ 4.37Å
494	P	84.8	Confident	89.2	Confident	56 Å²	56	94 Å²	94	36%	0.364	45%	0.454	S	S	.	.	S	Bend	trans	-66.6	-25.7	-176.5	27	-34.6	0	0	0	112.8	F349	F349-P494 HydrophobicContact CE2-CG 3.65Å; F349-P494 HydrophobicContact CZ-CG 3.77Å
495	V	86.2	Confident	88.8	Confident	20 Å²	20	91.3 Å²	91.3	12%	0.121	45%	0.447	C	S	.	.	S	Bend	trans	-128.5	145.1	-174.9	-176.9	0	0	0	0	109.7	H345 Y493 Y650	H345-V495 HydrophobicContact CB-CG1 4.07Å; H345-V495 WeakPolarHBondContact O-CG1 3.27Å; Y493-V495 PolarHBondContact O-N 2.71Å; V495-Y650 HydrophobicContact CG2-CD1 4.47Å
496	R	86.8	Confident	88.5	Confident	227 Å²	227	97.6 Å²	97.6	86%	0.857	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-75.4	144.5	175.8	-66.1	-175.8	-178.6	-175	2.9	110.7
497	T	87.1	Confident	88.1	Confident	70 Å²	70	97.7 Å²	97.7	43%	0.429	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-90.8	131.7	176.8	53.9	0	0	0	0	111.3	G346 F349	G346-T497 CarbonylContact O-C 3.53Å; G346-T497 WeakPolarHBondContact O-CA 3.25Å; F349-T497 HydrophobicContact CB-CG2 3.88Å
498	N	88.4	Confident	87.8	Confident	91 Å²	91	92.2 Å²	92.2	49%	0.487	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-65.3	151	173.3	-71.9	-18.6	0	0	0	111.2	G346 R350	G346-N498 PolarHBondContact O-N 2.81Å; R350-N498 PolarHBondContact NH2-O 3.2Å
499	Q	87.3	Confident	87.6	Confident	187 Å²	187	91.9 Å²	91.9	87%	0.874	48%	0.484	S	S	*	.	S	Bend	trans	-69.4	-46.1	179.1	-67.1	-176.3	-5.5	0	0	111.2	R350	R350-Q499 PolarHBondContact NH1-O 2.91Å; R350-Q499 PolarHBondContact NH2-O 3.39Å
500	I	89.9	Confident	87.2	Confident	140 Å²	140	93.5 Å²	93.5	72%	0.718	48%	0.48	S	S	*	.	S	Bend	trans	-92.8	128.2	-178.4	-58.6	169.9	0	0	0	109.4
501	P	89.2	Confident	87	Confident	62 Å²	62	87.8 Å²	87.8	40%	0.403	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-71.9	135.5	175.4	28.4	-32.4	0	0	0	111.3	Y579	P501-Y579 WeakPolarHBondContact CB-OH 3.41Å
502	R	87.3	Confident	87.2	Confident	96 Å²	96	93.7 Å²	93.7	36%	0.362	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-63.7	146.2	171	-173.5	179.4	168.9	133.4	-1.2	111.3	D347 E577 Y579	D347-R502 WeakPolarHBondContact OD2-CB 3.34Å; D347-R502 PolarHBondContact OD2-N 3.18Å; R502-E577 IonicContact CZ-OE2 2.74Å; R502-E577 IonicContact NE-OE2 3.74Å; R502-E577 IonicContact NH2-OE1 2.74Å; R502-E577 IonicContact NH2-OE2 3.42Å; R502-E577 PolarHBondContact NH2-OE2 2.89Å; R502-Y579 WeakPolarHBondContact O-CE1 3.21Å
503	Q	88.3	Confident	87.3	Confident	178 Å²	178	93.2 Å²	93.2	83%	0.832	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-73.4	134.5	171.4	-65.3	-177.1	-0.6	0	0	110.3
504	I	89.2	Confident	87.3	Confident	46 Å²	46	98.8 Å²	98.8	24%	0.236	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-88.8	125.5	-177	-59.9	164.8	0	0	0	108.3	D578 Y579 R580	I504-D578 WeakPolarHBondContact CD1-OD1 3.45Å; I504-D578 HydrophobicContact CG2-CB 3.78Å; I504-Y579 HydrophobicContact CD1-CD1 4.39Å; I504-Y579 HydrophobicContact CD1-CE1 3.91Å; I504-Y579 HydrophobicContact CG1-CD1 4.21Å; I504-Y579 HydrophobicContact CG1-CE1 3.8Å; I504-R580 HydrophobicContact CD1-CG 4.15Å
505	P	88.6	Confident	87.6	Confident	45 Å²	45	99 Å²	99	29%	0.292	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-65.1	154.2	179.6	26.5	-33.4	0	0	0	111.5	Q507 E577	P505-Q507 PolarHBondContact O-N 3.31Å; P505-Q507 PolarHBondContact O-NE2 3Å; P505-E577 HydrophobicContact CG-CB 3.86Å; P505-E577 HydrophobicContact CG-CG 4.38Å
506	P	87.8	Confident	87.7	Confident	131 Å²	131	98.2 Å²	98.2	85%	0.851	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-59.8	123.1	178.8	25	-33.6	0	0	0	110.7
507	Q	86	Confident	87.9	Confident	43 Å²	43	88 Å²	88	20%	0.201	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-89	146	-179	-62	-59.7	-58.6	0	0	111.4	P505 A511 G576	P505-Q507 PolarHBondContact O-N 3.31Å; P505-Q507 PolarHBondContact O-NE2 3Å; Q507-A511 HydrophobicContact CB-CB 4.23Å; Q507-G576 PolarHBondContact NE2-O 3.07Å
508	P	87.5	Confident	88.1	Confident	62 Å²	62	88.6 Å²	88.6	40%	0.403	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60.8	156.4	170.5	27.8	-34.2	0	0	0	110.6	F510 A511 R512	P508-F510 VanDerWaalsContact C-N 3.3Å; P508-F510 HydrophobicContact CB-CD1 3.83Å; P508-F510 HydrophobicContact CB-CE1 3.45Å; P508-F510 VanDerWaalsContact CB-CE1 3.45Å; P508-F510 HydrophobicContact CB-CZ 4.1Å; P508-F510 HydrophobicContact CG-CD1 4.09Å; P508-F510 HydrophobicContact CG-CE1 3.45Å; P508-F510 VanDerWaalsContact CG-CE1 3.45Å; P508-F510 HydrophobicContact CG-CE2 4.25Å; P508-F510 HydrophobicContact CG-CZ 3.54Å; P508-F510 PolarHBondContact O-N 3.16Å; P508-A511 HydrophobicContact CG-CB 3.75Å; P508-A511 PolarHBondContact O-N 3.14Å; P508-R512 PolarHBondContact O-N 3.31Å
509	T	86.9	Confident	88	Confident	96 Å²	96	89.6 Å²	89.6	59%	0.589	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-55.1	-41.9	-172.1	48.5	0	0	0	0	113.2	A511 R512	T509-A511 VanDerWaalsContact C-N 3.29Å; T509-A511 PolarHBondContact O-N 3.19Å; T509-R512 WeakPolarHBondContact O-CB 3.42Å; T509-R512 PolarHBondContact O-N 3.11Å
510	F	84.9	Confident	88	Confident	139 Å²	139	80.8 Å²	80.8	61%	0.61	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-67.1	-27.4	178.1	69.9	-94.2	0	0	0	113.4	P508 R512 A516	P508-F510 VanDerWaalsContact C-N 3.3Å; P508-F510 HydrophobicContact CB-CD1 3.83Å; P508-F510 HydrophobicContact CB-CE1 3.45Å; P508-F510 VanDerWaalsContact CB-CE1 3.45Å; P508-F510 HydrophobicContact CB-CZ 4.1Å; P508-F510 HydrophobicContact CG-CD1 4.09Å; P508-F510 HydrophobicContact CG-CE1 3.45Å; P508-F510 VanDerWaalsContact CG-CE1 3.45Å; P508-F510 HydrophobicContact CG-CE2 4.25Å; P508-F510 HydrophobicContact CG-CZ 3.54Å; P508-F510 PolarHBondContact O-N 3.16Å; F510-R512 VanDerWaalsContact C-N 3.34Å; F510-A516 PolarHBondContact O-N 3.47Å
511	A	84.5	Confident	88	Confident	15 Å²	15	74.1 Å²	74.1	12%	0.124	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-86.7	-5.5	-178.9	0	0	0	0	0	113.1	Q507 P508 T509 R584	Q507-A511 HydrophobicContact CB-CB 4.23Å; P508-A511 HydrophobicContact CG-CB 3.75Å; P508-A511 PolarHBondContact O-N 3.14Å; T509-A511 VanDerWaalsContact C-N 3.29Å; T509-A511 PolarHBondContact O-N 3.19Å; A511-R584 PolarHBondContact O-NH2 2.89Å
512	R	88.3	Confident	88.1	Confident	140 Å²	140	74.6 Å²	74.6	53%	0.528	38%	0.384	S	S	.	.	S	Bend	trans	-60.7	154.6	173.1	-69.4	-177.5	-178.4	-179.4	-0.3	110.9	P508 T509 F510 F514 P515 A516	P508-R512 PolarHBondContact O-N 3.31Å; T509-R512 WeakPolarHBondContact O-CB 3.42Å; T509-R512 PolarHBondContact O-N 3.11Å; F510-R512 VanDerWaalsContact C-N 3.34Å; R512-F514 PolarHBondContact O-N 3.16Å; R512-P515 HydrophobicContact CB-CG 4.3Å; R512-P515 WeakPolarHBondContact O-CD 3.32Å; R512-A516 VanDerWaalsContact O-CB 3.29Å; R512-A516 WeakPolarHBondContact O-CB 3.01Å; R512-A516 PolarHBondContact O-N 3.5Å; R512-A516 VanDerWaalsContact O-N 3.16Å
513	P	86.2	Confident	88.2	Confident	72 Å²	72	73.2 Å²	73.2	47%	0.468	38%	0.383	S	S	.	.	H	α-helix	trans	-58.6	-45.3	-170.7	20.5	-33.9	0	0	0	113.5	T517	P513-T517 VanDerWaalsContact O-CB 3.29Å; P513-T517 WeakPolarHBondContact O-CB 3.48Å; P513-T517 PolarHBondContact O-N 2.91Å; P513-T517 PolarHBondContact O-OG1 3.31Å
514	F	89.1	Confident	88.4	Confident	159 Å²	159	64.7 Å²	64.7	70%	0.697	34%	0.343	S	S	*	.	H	α-helix	trans	-68.6	-59.5	-179.4	-66.5	-72.1	0	0	0	112.2	R512 A516 T517 F518	R512-F514 PolarHBondContact O-N 3.16Å; F514-A516 VanDerWaalsContact C-N 3.28Å; F514-A516 PolarHBondContact O-N 3.49Å; F514-T517 WeakPolarHBondContact O-CB 3.21Å; F514-T517 PolarHBondContact O-N 3.45Å; F514-F518 HydrophobicContact CB-CE2 4.49Å; F514-F518 VanDerWaalsContact O-CD2 3.27Å; F514-F518 WeakPolarHBondContact O-CD2 3.23Å; F514-F518 PolarHBondContact O-N 3.04Å
515	P	90.5	Very high	88.5	Confident	61 Å²	61	64 Å²	64	40%	0.396	34%	0.339	S	S	.	.	H	α-helix	trans	-54.8	-41.4	-178	-27.7	37.3	0	0	0	113.7	R512 T517 F518 M519	R512-P515 HydrophobicContact CB-CG 4.3Å; R512-P515 WeakPolarHBondContact O-CD 3.32Å; P515-T517 VanDerWaalsContact C-N 3.33Å; P515-T517 PolarHBondContact O-N 2.97Å; P515-F518 PolarHBondContact O-N 3.47Å; P515-M519 PolarHBondContact O-N 2.84Å
516	A	88.5	Confident	88.5	Confident	3 Å²	3	63.2 Å²	63.2	3%	0.025	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-36.9	177.1	0	0	0	0	0	112.9	F510 R512 F514 A520	F510-A516 PolarHBondContact O-N 3.47Å; R512-A516 VanDerWaalsContact O-CB 3.29Å; R512-A516 WeakPolarHBondContact O-CB 3.01Å; R512-A516 PolarHBondContact O-N 3.5Å; R512-A516 VanDerWaalsContact O-N 3.16Å; F514-A516 VanDerWaalsContact C-N 3.28Å; F514-A516 PolarHBondContact O-N 3.49Å; A516-A520 WeakPolarHBondContact O-CB 3.47Å; A516-A520 PolarHBondContact O-N 3.36Å
517	T	90.9	Very high	88.5	Confident	12 Å²	12	57 Å²	57	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-69.5	-40.2	178.3	-60.1	0	0	0	0	111.6	P513 F514 P515 A520 L587 F591	P513-T517 VanDerWaalsContact O-CB 3.29Å; P513-T517 WeakPolarHBondContact O-CB 3.48Å; P513-T517 PolarHBondContact O-N 2.91Å; P513-T517 PolarHBondContact O-OG1 3.31Å; F514-T517 WeakPolarHBondContact O-CB 3.21Å; F514-T517 PolarHBondContact O-N 3.45Å; P515-T517 VanDerWaalsContact C-N 3.33Å; P515-T517 PolarHBondContact O-N 2.97Å; T517-A520 WeakPolarHBondContact O-CB 3.25Å; T517-A520 PolarHBondContact O-N 3.03Å; T517-L587 HydrophobicContact CG2-CB 4Å; T517-L587 WeakPolarHBondContact CG2-O 3.24Å; T517-F591 HydrophobicContact CG2-CB 3.58Å; T517-F591 HydrophobicContact CG2-CD1 4.43Å; T517-F591 HydrophobicContact CG2-CD2 4.05Å; T517-F591 HydrophobicContact CG2-CG 3.77Å
518	F	90.6	Very high	88.7	Confident	83 Å²	83	55.6 Å²	55.6	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-51.2	172.9	-81.8	-88.6	0	0	0	110.5	F514 P515 A520 G521 F591 F594 Y595	F514-F518 HydrophobicContact CB-CE2 4.49Å; F514-F518 VanDerWaalsContact O-CD2 3.27Å; F514-F518 WeakPolarHBondContact O-CD2 3.23Å; F514-F518 PolarHBondContact O-N 3.04Å; P515-F518 PolarHBondContact O-N 3.47Å; F518-A520 PolarHBondContact O-N 2.01Å; F518-G521 PolarHBondContact O-N 3.25Å; F518-F591 HydrophobicContact CB-CE1 4.49Å; F518-F591 HydrophobicContact CD1-CD1 4.17Å; F518-F591 AromaticContact CD1-CE1 3.21Å; F518-F591 HydrophobicContact CD1-CE1 3.21Å; F518-F591 AromaticContact CD1-CZ 3.77Å; F518-F591 HydrophobicContact CD1-CZ 3.77Å; F518-F591 HydrophobicContact CD2-CE1 4.25Å; F518-F591 HydrophobicContact CD2-CZ 4.4Å; F518-F591 AromaticContact CE1-CE1 3.24Å; F518-F591 HydrophobicContact CE1-CE1 3.24Å; F518-F591 AromaticContact CE1-CZ 3.28Å; F518-F591 HydrophobicContact CE1-CZ 3.28Å; F518-F591 HydrophobicContact CE2-CE1 4.27Å; F518-F591 AromaticContact CE2-CZ 3.98Å; F518-F591 HydrophobicContact CE2-CZ 3.98Å; F518-F591 HydrophobicContact CG-CD1 4.4Å; F518-F591 AromaticContact CG-CE1 3.74Å; F518-F591 HydrophobicContact CG-CE1 3.74Å; F518-F591 HydrophobicContact CG-CZ 4.29Å; F518-F591 AromaticContact CZ-CE1 3.79Å; F518-F591 HydrophobicContact CZ-CE1 3.79Å; F518-F591 HydrophobicContact CZ-CE2 4.39Å; F518-F591 AromaticContact CZ-CZ 3.39Å; F518-F591 HydrophobicContact CZ-CZ 3.39Å; F518-F594 HydrophobicContact CD1-CD1 4.47Å; F518-F594 HydrophobicContact CD1-CE1 4.23Å; F518-F594 HydrophobicContact CE1-CD1 4.12Å; F518-F594 AromaticContact CE1-CE1 3.68Å; F518-F594 HydrophobicContact CE1-CE1 3.68Å; F518-F594 HydrophobicContact CE1-CZ 4.01Å; F518-Y595 WeakPolarHBondContact O-CE2 3.24Å; F518-Y595 PolarHBondContact O-OH 3.43Å
519	M	87.2	Confident	88.8	Confident	111 Å²	111	57.6 Å²	57.6	55%	0.547	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-35.1	-179.9	-169.2	177.9	72.5	0	0	112.8	P515 G521 L569	P515-M519 PolarHBondContact O-N 2.84Å; M519-G521 PolarHBondContact O-N 2.95Å; M519-L569 HydrophobicContact CE-CD2 4.22Å
520	A	87.7	Confident	88.8	Confident	3 Å²	3	54.4 Å²	54.4	3%	0.025	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-41.6	179.4	0	0	0	0	0	113.7	A516 T517 F518 V522 P524 L569 S588	A516-A520 WeakPolarHBondContact O-CB 3.47Å; A516-A520 PolarHBondContact O-N 3.36Å; T517-A520 WeakPolarHBondContact O-CB 3.25Å; T517-A520 PolarHBondContact O-N 3.03Å; F518-A520 PolarHBondContact O-N 2.01Å; A520-V522 VanDerWaalsContact C-N 3.33Å; A520-V522 PolarHBondContact O-N 2.9Å; A520-P524 WeakPolarHBondContact O-CD 3.22Å; A520-L569 HydrophobicContact CB-CD1 3.21Å; A520-S588 VanDerWaalsContact CB-O 3.29Å; A520-S588 WeakPolarHBondContact CB-O 3.3Å
521	G	89.6	Confident	88.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-77.3	-15	-171.7	0	0	0	0	0	114.7	F518 M519 P524 F525 Y595	F518-G521 PolarHBondContact O-N 3.25Å; M519-G521 PolarHBondContact O-N 2.95Å; G521-P524 WeakPolarHBondContact O-CD 3.15Å; G521-F525 VanDerWaalsContact O-CB 3.27Å; G521-F525 WeakPolarHBondContact O-CB 3.25Å; G521-F525 PolarHBondContact O-N 3.45Å; G521-Y595 VanDerWaalsContact C-CE2 3.46Å
522	V	90.9	Very high	89.1	Confident	72 Å²	72	47.9 Å²	47.9	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-64.9	-47	-177.3	178.3	0	0	0	0	111.5	A520 F525 G526 Y595	A520-V522 VanDerWaalsContact C-N 3.33Å; A520-V522 PolarHBondContact O-N 2.9Å; V522-F525 PolarHBondContact O-N 3.2Å; V522-G526 PolarHBondContact O-N 3.05Å; V522-Y595 HydrophobicContact CG2-CE1 3.99Å; V522-Y595 HydrophobicContact CG2-CE2 3.99Å; V522-Y595 VanDerWaalsContact CG2-CZ 3.45Å; V522-Y595 WeakPolarHBondContact CG2-OH 3.43Å
523	L	88.7	Confident	89	Confident	66 Å²	66	44.4 Å²	44.4	35%	0.346	23%	0.231	S	C	.	.	H	α-helix	trans	-68	-47.8	-174.7	-64.2	165.6	0	0	0	112.8	L307 F525 G526 C527 T565	L307-L523 HydrophobicContact CD1-CB 4.49Å; L307-L523 HydrophobicContact CD1-CD1 4.33Å; L307-L523 HydrophobicContact CD2-CD1 3.75Å; L523-F525 VanDerWaalsContact C-N 3.29Å; L523-F525 PolarHBondContact O-N 2.75Å; L523-G526 PolarHBondContact O-N 2.95Å; L523-C527 PolarHBondContact O-N 3.18Å; L523-C527 PolarHBondContact O-SG 3.21Å; L523-C527 VanDerWaalsContact O-SG 3.33Å; L523-T565 HydrophobicContact CB-CG2 4.14Å; L523-T565 HydrophobicContact CD1-CG2 4.07Å
524	P	92.1	Very high	89	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-35.7	174.8	-18.5	30.6	0	0	0	112.5	A520 G521 C527 I528 L558 T561 L562 T565 T592	A520-P524 WeakPolarHBondContact O-CD 3.22Å; G521-P524 WeakPolarHBondContact O-CD 3.15Å; P524-C527 PolarHBondContact O-N 3Å; P524-I528 PolarHBondContact O-N 2.96Å; P524-L558 HydrophobicContact CB-CD1 4.09Å; P524-T561 HydrophobicContact CB-CG2 4.17Å; P524-T561 HydrophobicContact CG-CG2 4.07Å; P524-L562 HydrophobicContact CB-CD2 3.56Å; P524-L562 HydrophobicContact CB-CG 4.18Å; P524-L562 HydrophobicContact CG-CD2 3.79Å; P524-T565 HydrophobicContact CG-CG2 4.24Å; P524-T592 HydrophobicContact CB-CG2 3.8Å
525	F	92	Very high	88.9	Confident	31 Å²	31	36.4 Å²	36.4	14%	0.136	19%	0.19	C	C	.	.	H	α-helix	trans	-65.4	-41.7	175.8	179.2	-103.6	0	0	0	111.9	G521 V522 L523 C527 I528 Y529 T592 Y595 Y599	G521-F525 VanDerWaalsContact O-CB 3.27Å; G521-F525 WeakPolarHBondContact O-CB 3.25Å; G521-F525 PolarHBondContact O-N 3.45Å; V522-F525 PolarHBondContact O-N 3.2Å; L523-F525 VanDerWaalsContact C-N 3.29Å; L523-F525 PolarHBondContact O-N 2.75Å; F525-C527 VanDerWaalsContact C-N 3.26Å; F525-C527 PolarHBondContact O-N 2.7Å; F525-I528 HydrophobicContact CD2-CG1 4.46Å; F525-I528 VanDerWaalsContact O-CG1 3.3Å; F525-I528 WeakPolarHBondContact O-CG1 3.04Å; F525-I528 PolarHBondContact O-N 3.05Å; F525-I528 VanDerWaalsContact O-N 3.15Å; F525-Y529 AromaticContact CE1-CD2 3.98Å; F525-Y529 HydrophobicContact CE1-CD2 3.98Å; F525-Y529 AromaticContact CZ-CD2 3.96Å; F525-Y529 HydrophobicContact CZ-CD2 3.96Å; F525-Y529 PolarHBondContact O-N 2.92Å; F525-T592 HydrophobicContact CB-CG2 4.03Å; F525-Y595 HydrophobicContact CB-CD2 4.48Å; F525-Y595 HydrophobicContact CB-CG 4.25Å; F525-Y595 HydrophobicContact CD1-CG 4.41Å; F525-Y595 VanDerWaalsContact CG-CB 3.42Å; F525-Y595 HydrophobicContact CG-CG 4.22Å; F525-Y599 HydrophobicContact CZ-CD2 4.25Å; F525-Y599 HydrophobicContact CZ-CG 4.18Å
526	G	88.7	Confident	88.9	Confident	28 Å²	28	33.8 Å²	33.8	29%	0.289	17%	0.172	S	C	.	.	H	α-helix	trans	-57.5	-37	175.6	0	0	0	0	0	113.4	V522 L523 I528	V522-G526 PolarHBondContact O-N 3.05Å; L523-G526 PolarHBondContact O-N 2.95Å; G526-I528 PolarHBondContact O-N 3.02Å
527	C	88.6	Confident	88.7	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-36.3	177.5	-63	0	0	0	0	112.8	S300 L523 P524 F525 I557	S300-C527 PolarHBondContact OG-O 2.96Å; L523-C527 PolarHBondContact O-N 3.18Å; L523-C527 PolarHBondContact O-SG 3.21Å; L523-C527 VanDerWaalsContact O-SG 3.33Å; P524-C527 PolarHBondContact O-N 3Å; F525-C527 VanDerWaalsContact C-N 3.26Å; F525-C527 PolarHBondContact O-N 2.7Å; C527-I557 HydrophobicContact CB-CG2 4.3Å
528	I	90	Very high	88.3	Confident	12 Å²	12	35.8 Å²	35.8	6%	0.062	19%	0.185	C	C	.	.	H	α-helix	trans	-95.9	-11.3	-175.2	63.4	176.5	0	0	0	113.6	P524 F525 G526 V530 Q531 M532 V554 L558 F630	P524-I528 PolarHBondContact O-N 2.96Å; F525-I528 HydrophobicContact CD2-CG1 4.46Å; F525-I528 VanDerWaalsContact O-CG1 3.3Å; F525-I528 WeakPolarHBondContact O-CG1 3.04Å; F525-I528 PolarHBondContact O-N 3.05Å; F525-I528 VanDerWaalsContact O-N 3.15Å; G526-I528 PolarHBondContact O-N 3.02Å; I528-V530 VanDerWaalsContact C-N 3.31Å; I528-V530 PolarHBondContact O-N 2.87Å; I528-Q531 PolarHBondContact O-N 3.46Å; I528-M532 WeakPolarHBondContact O-CB 3.4Å; I528-M532 PolarHBondContact O-N 3.41Å; I528-V554 HydrophobicContact CG2-CG1 4.18Å; I528-L558 HydrophobicContact CG2-CB 3.96Å; I528-L558 HydrophobicContact CG2-CD1 3.76Å; I528-L558 HydrophobicContact CG2-CD2 4.05Å; I528-L558 HydrophobicContact CG2-CG 4.11Å; I528-F630 HydrophobicContact CD1-CE1 4.01Å; I528-F630 HydrophobicContact CD1-CE2 4.41Å; I528-F630 HydrophobicContact CD1-CZ 3.52Å
529	Y	89.5	Confident	88	Confident	104 Å²	104	36.1 Å²	36.1	41%	0.408	19%	0.19	S	C	.	.	H	α-helix	trans	-48	-48.9	-172.8	176	-102	0	0	0	113.5	F525 Q531 M532 F533 Y599	F525-Y529 AromaticContact CE1-CD2 3.98Å; F525-Y529 HydrophobicContact CE1-CD2 3.98Å; F525-Y529 AromaticContact CZ-CD2 3.96Å; F525-Y529 HydrophobicContact CZ-CD2 3.96Å; F525-Y529 PolarHBondContact O-N 2.92Å; Y529-Q531 PolarHBondContact O-N 3.4Å; Y529-M532 PolarHBondContact O-N 2.92Å; Y529-F533 PolarHBondContact O-N 2.9Å; Y529-F533 VanDerWaalsContact O-N 3.12Å; Y529-Y599 HydrophobicContact CD2-CD2 4.31Å; Y529-Y599 HydrophobicContact CD2-CE2 4.19Å; Y529-Y599 AromaticContact CE2-CD2 3.85Å; Y529-Y599 HydrophobicContact CE2-CD2 3.85Å; Y529-Y599 AromaticContact CE2-CE2 3.54Å; Y529-Y599 HydrophobicContact CE2-CE2 3.54Å
530	V	86.2	Confident	87.8	Confident	30 Å²	30	31.8 Å²	31.8	18%	0.182	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-43.1	-179.7	175.1	0	0	0	0	111.6	I292 I528 F534	I292-V530 HydrophobicContact CG2-CG1 4.24Å; I528-V530 VanDerWaalsContact C-N 3.31Å; I528-V530 PolarHBondContact O-N 2.87Å; V530-F534 HydrophobicContact CG1-CD2 4.42Å; V530-F534 HydrophobicContact CG1-CE2 3.79Å; V530-F534 WeakPolarHBondContact O-CD2 3.04Å
531	Q	87.4	Confident	87	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.028	18%	0.177	C	C	.	.	H	α-helix	trans	-72.7	-33.6	178.2	-65.2	-58.9	-25.5	0	0	112.1	I528 Y529 F533 F534 I535 Y545 V554	I528-Q531 PolarHBondContact O-N 3.46Å; Y529-Q531 PolarHBondContact O-N 3.4Å; Q531-F533 VanDerWaalsContact C-N 3.29Å; Q531-F533 PolarHBondContact O-N 2.96Å; Q531-F534 PolarHBondContact O-N 2.85Å; Q531-F534 VanDerWaalsContact O-N 3.13Å; Q531-I535 WeakPolarHBondContact O-CG1 3.44Å; Q531-I535 PolarHBondContact O-N 3.24Å; Q531-Y545 PolarHBondContact OE1-OH 3.03Å; Q531-V554 HydrophobicContact CB-CG1 4.34Å; Q531-V554 HydrophobicContact CG-CB 3.89Å; Q531-V554 HydrophobicContact CG-CG1 3.76Å; Q531-V554 HydrophobicContact CG-CG2 3.69Å
532	M	88.3	Confident	86.1	Confident	10 Å²	10	35.4 Å²	35.4	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-40.9	177.3	-159	65.3	-118.7	0	0	110.9	I528 Y529 F534 I535 F536 L596 Y599 F626	I528-M532 WeakPolarHBondContact O-CB 3.4Å; I528-M532 PolarHBondContact O-N 3.41Å; Y529-M532 PolarHBondContact O-N 2.92Å; M532-F534 VanDerWaalsContact C-N 3.32Å; M532-F534 PolarHBondContact O-N 3.11Å; M532-I535 HydrophobicContact CE-CB 3.87Å; M532-I535 HydrophobicContact CE-CD1 4.39Å; M532-I535 HydrophobicContact CE-CG2 3.69Å; M532-I535 PolarHBondContact O-N 3.02Å; M532-F536 HydrophobicContact CE-CD2 3.26Å; M532-F536 HydrophobicContact CE-CE2 3.17Å; M532-F536 HydrophobicContact CE-CG 4.44Å; M532-F536 HydrophobicContact CE-CZ 4.26Å; M532-F536 HydrophobicContact CG-CD2 3.78Å; M532-F536 HydrophobicContact CG-CE2 3.68Å; M532-F536 WeakPolarHBondContact O-CD2 3.28Å; M532-F536 PolarHBondContact O-N 3.48Å; M532-F536 HydrophobicContact SD-CD2 4.31Å; M532-F536 HydrophobicContact SD-CE2 4.05Å; M532-L596 HydrophobicContact CE-CD1 3.98Å; M532-L596 HydrophobicContact CG-CD1 3.55Å; M532-L596 HydrophobicContact SD-CD1 3.37Å; M532-L596 WeakPolarHBondContact SD-CD1 3.2Å; M532-Y599 HydrophobicContact CG-CD1 4.12Å; M532-Y599 HydrophobicContact CG-CE1 4.16Å; M532-F626 HydrophobicContact CE-CD1 4.43Å; M532-F626 HydrophobicContact CE-CE1 3.33Å; M532-F626 HydrophobicContact CE-CZ 3.68Å; M532-F626 HydrophobicContact SD-CE1 4.09Å; M532-F626 HydrophobicContact SD-CZ 4.38Å
533	F	87.2	Confident	85.1	Confident	68 Å²	68	34.9 Å²	34.9	30%	0.298	18%	0.181	S	C	.	.	H	α-helix	trans	-55	-46.2	173	174	-104.2	0	0	0	112.5	Y529 Q531 F536 N537 Y599	Y529-F533 PolarHBondContact O-N 2.9Å; Y529-F533 VanDerWaalsContact O-N 3.12Å; Q531-F533 VanDerWaalsContact C-N 3.29Å; Q531-F533 PolarHBondContact O-N 2.96Å; F533-F536 PolarHBondContact O-N 3.07Å; F533-N537 WeakPolarHBondContact CE1-ND2 3.35Å; F533-N537 VanDerWaalsContact CE2-ND2 3.32Å; F533-N537 WeakPolarHBondContact CE2-ND2 3.47Å; F533-N537 WeakPolarHBondContact CZ-ND2 3.03Å; F533-N537 PolarHBondContact O-N 3.46Å; F533-N537 PolarHBondContact O-ND2 3.46Å; F533-Y599 VanDerWaalsContact CA-OH 3.31Å; F533-Y599 WeakPolarHBondContact CA-OH 3.4Å; F533-Y599 WeakPolarHBondContact CB-OH 3.45Å; F533-Y599 WeakPolarHBondContact CD2-OH 3.26Å
534	F	84.7	Confident	84.1	Confident	10 Å²	10	34.3 Å²	34.3	4%	0.044	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-39.1	178	-66.1	-59.4	0	0	0	112.8	V288 I292 Q293 V530 Q531 M532 N537 S538 Y545	V288-F534 HydrophobicContact CB-CE1 4.18Å; V288-F534 HydrophobicContact CG1-CD1 4.33Å; V288-F534 HydrophobicContact CG1-CE1 3.34Å; V288-F534 HydrophobicContact CG1-CZ 3.63Å; V288-F534 HydrophobicContact CG2-CD1 4Å; V288-F534 HydrophobicContact CG2-CE1 3.66Å; I292-F534 HydrophobicContact CB-CZ 4.32Å; I292-F534 HydrophobicContact CG2-CE2 4.28Å; I292-F534 HydrophobicContact CG2-CZ 3.87Å; Q293-F534 HydrophobicContact CG-CD2 4.3Å; Q293-F534 HydrophobicContact CG-CE2 3.68Å; Q293-F534 HydrophobicContact CG-CZ 4.12Å; V530-F534 HydrophobicContact CG1-CD2 4.42Å; V530-F534 HydrophobicContact CG1-CE2 3.79Å; V530-F534 WeakPolarHBondContact O-CD2 3.04Å; Q531-F534 PolarHBondContact O-N 2.85Å; Q531-F534 VanDerWaalsContact O-N 3.13Å; M532-F534 VanDerWaalsContact C-N 3.32Å; M532-F534 PolarHBondContact O-N 3.11Å; F534-N537 PolarHBondContact O-N 3.5Å; F534-S538 VanDerWaalsContact O-CB 3.31Å; F534-S538 WeakPolarHBondContact O-CB 3.32Å; F534-S538 PolarHBondContact O-N 2.85Å; F534-Y545 HydrophobicContact CB-CD2 3.87Å; F534-Y545 HydrophobicContact CB-CE2 3.8Å; F534-Y545 HydrophobicContact CG-CE2 4.42Å
535	I	88	Confident	82.9	Confident	53 Å²	53	35.7 Å²	35.7	27%	0.272	19%	0.186	S	C	.	.	H	α-helix	trans	-64.1	-45.3	176.8	-65.7	166.4	0	0	0	110.8	Q531 M532 S538 L539 L551	Q531-I535 WeakPolarHBondContact O-CG1 3.44Å; Q531-I535 PolarHBondContact O-N 3.24Å; M532-I535 HydrophobicContact CE-CB 3.87Å; M532-I535 HydrophobicContact CE-CD1 4.39Å; M532-I535 HydrophobicContact CE-CG2 3.69Å; M532-I535 PolarHBondContact O-N 3.02Å; I535-S538 PolarHBondContact O-N 3.12Å; I535-L539 WeakPolarHBondContact O-CB 3.25Å; I535-L539 PolarHBondContact O-N 2.66Å; I535-L551 HydrophobicContact CD1-CD1 3.98Å
536	F	89.5	Confident	81.7	Confident	5 Å²	5	39.9 Å²	39.9	2%	0.022	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-42	177.9	-90.1	-94.3	0	0	0	112.3	M532 F533 S538 L539 W540 L596 Y599 F603	M532-F536 HydrophobicContact CE-CD2 3.26Å; M532-F536 HydrophobicContact CE-CE2 3.17Å; M532-F536 HydrophobicContact CE-CG 4.44Å; M532-F536 HydrophobicContact CE-CZ 4.26Å; M532-F536 HydrophobicContact CG-CD2 3.78Å; M532-F536 HydrophobicContact CG-CE2 3.68Å; M532-F536 WeakPolarHBondContact O-CD2 3.28Å; M532-F536 PolarHBondContact O-N 3.48Å; M532-F536 HydrophobicContact SD-CD2 4.31Å; M532-F536 HydrophobicContact SD-CE2 4.05Å; F533-F536 PolarHBondContact O-N 3.07Å; F536-S538 VanDerWaalsContact C-N 3.3Å; F536-S538 PolarHBondContact O-N 2.84Å; F536-L539 PolarHBondContact O-N 3.48Å; F536-W540 AromaticContact CD1-CD1 3.58Å; F536-W540 AromaticContact CD1-NE1 3.6Å; F536-W540 AromaticContact CE1-NE1 3.89Å; F536-W540 WeakPolarHBondContact O-CB 3.18Å; F536-W540 PolarHBondContact O-N 3.33Å; F536-L596 HydrophobicContact CE2-CD1 3.81Å; F536-L596 HydrophobicContact CZ-CD1 4.29Å; F536-Y599 AromaticContact CD2-CD1 3.9Å; F536-Y599 HydrophobicContact CD2-CD1 3.9Å; F536-Y599 AromaticContact CD2-CE1 3.57Å; F536-Y599 HydrophobicContact CD2-CE1 3.57Å; F536-Y599 AromaticContact CE2-CD1 3.64Å; F536-Y599 HydrophobicContact CE2-CD1 3.64Å; F536-Y599 AromaticContact CE2-CE1 3.84Å; F536-Y599 HydrophobicContact CE2-CE1 3.84Å; F536-Y599 HydrophobicContact CG-CE1 4.07Å; F536-Y599 HydrophobicContact CZ-CD1 4.21Å; F536-F603 HydrophobicContact CB-CD1 4.27Å; F536-F603 HydrophobicContact CB-CD2 4.03Å; F536-F603 HydrophobicContact CB-CE1 4.05Å; F536-F603 HydrophobicContact CB-CE2 3.8Å; F536-F603 HydrophobicContact CB-CG 4.26Å; F536-F603 HydrophobicContact CB-CZ 3.82Å; F536-F603 HydrophobicContact CD1-CB 4.44Å; F536-F603 AromaticContact CD1-CD1 3.85Å; F536-F603 HydrophobicContact CD1-CD1 3.85Å; F536-F603 HydrophobicContact CD1-CE1 4.26Å; F536-F603 HydrophobicContact CD1-CG 4.06Å; F536-F603 HydrophobicContact CG-CD1 4.43Å; F536-F603 HydrophobicContact CG-CG 4.37Å
537	N	85	Confident	80.9	Confident	20 Å²	20	40.9 Å²	40.9	11%	0.107	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-37.5	174.1	-72.7	-29.8	0	0	0	111.9	F533 F534 A541 H542 Q543 F603	F533-N537 WeakPolarHBondContact CE1-ND2 3.35Å; F533-N537 VanDerWaalsContact CE2-ND2 3.32Å; F533-N537 WeakPolarHBondContact CE2-ND2 3.47Å; F533-N537 WeakPolarHBondContact CZ-ND2 3.03Å; F533-N537 PolarHBondContact O-N 3.46Å; F533-N537 PolarHBondContact O-ND2 3.46Å; F534-N537 PolarHBondContact O-N 3.5Å; N537-A541 CarbonylContact O-C 3.46Å; N537-A541 VanDerWaalsContact O-CA 3.25Å; N537-A541 WeakPolarHBondContact O-CA 3.35Å; N537-A541 WeakPolarHBondContact O-CB 3.36Å; N537-A541 PolarHBondContact O-N 2.95Å; N537-H542 PolarHBondContact O-N 2.94Å; N537-Q543 PolarHBondContact O-N 3.25Å; N537-F603 WeakPolarHBondContact OD1-CE2 3.48Å; N537-F603 VanDerWaalsContact OD1-CZ 3.32Å; N537-F603 WeakPolarHBondContact OD1-CZ 3.25Å
538	S	82.5	Confident	80.4	Confident	38 Å²	38	42.2 Å²	42.2	27%	0.266	21%	0.205	S	C	.	.	H	α-helix	trans	-67.3	-41.7	177.1	-172.9	0	0	0	0	112.1	F534 I535 F536 H542 Q543	F534-S538 VanDerWaalsContact O-CB 3.31Å; F534-S538 WeakPolarHBondContact O-CB 3.32Å; F534-S538 PolarHBondContact O-N 2.85Å; I535-S538 PolarHBondContact O-N 3.12Å; F536-S538 VanDerWaalsContact C-N 3.3Å; F536-S538 PolarHBondContact O-N 2.84Å; S538-H542 WeakPolarHBondContact O-CA 3.13Å; S538-H542 PolarHBondContact O-N 3.37Å; S538-Q543 WeakPolarHBondContact CA-O 3.31Å; S538-Q543 VanDerWaalsContact CB-O 3.24Å; S538-Q543 WeakPolarHBondContact CB-O 2.92Å; S538-Q543 PolarHBondContact OG-O 2.95Å
539	L	84.2	Confident	80	Confident	90 Å²	90	42.8 Å²	42.8	47%	0.471	21%	0.214	S	C	.	.	H	α-helix	trans	-73.6	-44.1	-177	-170.7	65.1	0	0	0	112.9	I535 F536	I535-L539 WeakPolarHBondContact O-CB 3.25Å; I535-L539 PolarHBondContact O-N 2.66Å; F536-L539 PolarHBondContact O-N 3.48Å
540	W	83.9	Confident	79.8	Confident	19 Å²	19	39.5 Å²	39.5	7%	0.072	20%	0.202	C	C	.	.	H	α-helix	trans	-106.7	-26.6	-170.5	-59.2	109.9	0	0	0	114.6	V60 F536 F603 L608 Y619 Y622	V60-W540 HydrophobicContact CB-CZ3 4.49Å; V60-W540 HydrophobicContact CG1-CZ3 3.82Å; V60-W540 HydrophobicContact CG2-CE3 4.14Å; V60-W540 HydrophobicContact CG2-CZ3 3.84Å; F536-W540 AromaticContact CD1-CD1 3.58Å; F536-W540 AromaticContact CD1-NE1 3.6Å; F536-W540 AromaticContact CE1-NE1 3.89Å; F536-W540 WeakPolarHBondContact O-CB 3.18Å; F536-W540 PolarHBondContact O-N 3.33Å; W540-F603 HydrophobicContact CB-CE1 4.29Å; W540-L608 HydrophobicContact CB-CD2 4.1Å; W540-Y619 AromaticContact CD1-CE2 3.9Å; W540-Y619 AromaticContact CD2-CD2 3.71Å; W540-Y619 HydrophobicContact CD2-CD2 3.71Å; W540-Y619 AromaticContact CD2-CE2 3.8Å; W540-Y619 HydrophobicContact CD2-CE2 3.8Å; W540-Y619 AromaticContact CE2-CD2 3.46Å; W540-Y619 VanDerWaalsContact CE2-CD2 3.46Å; W540-Y619 AromaticContact CE2-CE2 3.4Å; W540-Y619 VanDerWaalsContact CE2-CE2 3.4Å; W540-Y619 AromaticContact CE3-CD2 3.92Å; W540-Y619 HydrophobicContact CE3-CD2 3.92Å; W540-Y619 HydrophobicContact CE3-CE2 4.46Å; W540-Y619 HydrophobicContact CG-CD2 4.41Å; W540-Y619 HydrophobicContact CG-CE2 4.09Å; W540-Y619 AromaticContact CH2-CD2 3.69Å; W540-Y619 HydrophobicContact CH2-CD2 3.69Å; W540-Y619 HydrophobicContact CH2-CE2 4.44Å; W540-Y619 HydrophobicContact CH2-CG 4.39Å; W540-Y619 AromaticContact CZ2-CD2 3.46Å; W540-Y619 HydrophobicContact CZ2-CD2 3.46Å; W540-Y619 VanDerWaalsContact CZ2-CD2 3.46Å; W540-Y619 AromaticContact CZ2-CE2 3.77Å; W540-Y619 HydrophobicContact CZ2-CE2 3.77Å; W540-Y619 HydrophobicContact CZ2-CG 4.35Å; W540-Y619 AromaticContact CZ3-CD2 3.91Å; W540-Y619 HydrophobicContact CZ3-CD2 3.91Å; W540-Y619 AromaticContact NE1-CE2 3.47Å; W540-Y622 HydrophobicContact CH2-CD2 4.04Å; W540-Y622 HydrophobicContact CH2-CG 4.35Å
541	A	70.6	Confident	79.8	Confident	25 Å²	25	39.7 Å²	39.7	21%	0.207	20%	0.202	C	C	.	.	S	Bend	trans	-101.4	9.3	174.5	0	0	0	0	0	112.2	N537 Q543	N537-A541 CarbonylContact O-C 3.46Å; N537-A541 VanDerWaalsContact O-CA 3.25Å; N537-A541 WeakPolarHBondContact O-CA 3.35Å; N537-A541 WeakPolarHBondContact O-CB 3.36Å; N537-A541 PolarHBondContact O-N 2.95Å; A541-Q543 HydrophobicContact CB-CG 4.42Å; A541-Q543 PolarHBondContact O-N 3.39Å; A541-Q543 VanDerWaalsContact O-N 3.11Å
542	H	70.5	Confident	79.9	Confident	55 Å²	55	40.9 Å²	40.9	26%	0.255	21%	0.207	S	C	.	.			trans	54.6	29	175.1	-54.3	-64.8	0	0	0	114.4	D55 N537 S538	D55-H542 WeakPolarHBondContact OD2-CB 3.37Å; D55-H542 IonicContact OD2-CD2 3.53Å; D55-H542 PolarHBondContact OD2-CD2 2.8Å; D55-H542 IonicContact OD2-CG 3.82Å; D55-H542 IonicContact OD2-ND1 2.85Å; D55-H542 IonicContact OD2-NE2 3.7Å; N537-H542 PolarHBondContact O-N 2.94Å; S538-H542 WeakPolarHBondContact O-CA 3.13Å; S538-H542 PolarHBondContact O-N 3.37Å
543	Q	69.9	Low	80	Confident	61 Å²	61	42.7 Å²	42.7	29%	0.285	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-79.8	143.3	175.5	-63.6	-174.6	-24.2	0	0	111	N537 S538 A541 Y545	N537-Q543 PolarHBondContact O-N 3.25Å; S538-Q543 WeakPolarHBondContact CA-O 3.31Å; S538-Q543 VanDerWaalsContact CB-O 3.24Å; S538-Q543 WeakPolarHBondContact CB-O 2.92Å; S538-Q543 PolarHBondContact OG-O 2.95Å; A541-Q543 HydrophobicContact CB-CG 4.42Å; A541-Q543 PolarHBondContact O-N 3.39Å; A541-Q543 VanDerWaalsContact O-N 3.11Å; Q543-Y545 PolarHBondContact O-N 2.83Å
544	T	67.4	Low	80.1	Confident	53 Å²	53	39.7 Å²	39.7	33%	0.325	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-78.2	119.5	176.6	51	0	0	0	0	111.2	I162	I162-T544 HydrophobicContact CD1-CG2 3.4Å; I162-T544 VanDerWaalsContact CD1-CG2 3.4Å
545	Y	67.4	Low	80.6	Confident	29 Å²	29	40.2 Å²	40.2	11%	0.114	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-90.1	122.8	167.4	-173.5	-92.4	0	0	0	110.5	Q531 F534 Q543 M547 L551	Q531-Y545 PolarHBondContact OE1-OH 3.03Å; F534-Y545 HydrophobicContact CB-CD2 3.87Å; F534-Y545 HydrophobicContact CB-CE2 3.8Å; F534-Y545 HydrophobicContact CG-CE2 4.42Å; Q543-Y545 PolarHBondContact O-N 2.83Å; Y545-M547 HydrophobicContact CE1-CB 4.48Å; Y545-M547 PolarHBondContact OH-O 2.63Å; Y545-L551 HydrophobicContact CE1-CB 3.92Å; Y545-L551 HydrophobicContact CE1-CD2 4.2Å; Y545-L551 PolarHBondContact OH-N 3.21Å
546	Y	67.5	Low	80.8	Confident	120 Å²	120	41 Å²	41	47%	0.471	21%	0.214	S	C	.	.			trans	-116	-19.9	-176.9	-179.8	-100.1	0	0	0	114.4	L284 P386 F548	L284-Y546 HydrophobicContact CD1-CD1 3.74Å; L284-Y546 HydrophobicContact CD1-CD2 3.52Å; L284-Y546 HydrophobicContact CD1-CE1 3.62Å; L284-Y546 HydrophobicContact CD1-CE2 3.39Å; L284-Y546 HydrophobicContact CD1-CG 3.7Å; L284-Y546 VanDerWaalsContact CD1-CZ 3.44Å; L284-Y546 VanDerWaalsContact CD2-CB 3.48Å; L284-Y546 HydrophobicContact CD2-CD1 4.17Å; L284-Y546 HydrophobicContact CD2-CD2 3.41Å; L284-Y546 VanDerWaalsContact CD2-CD2 3.41Å; L284-Y546 HydrophobicContact CD2-CE2 4.16Å; L284-Y546 HydrophobicContact CD2-CG 3.41Å; L284-Y546 VanDerWaalsContact CD2-CG 3.41Å; L284-Y546 HydrophobicContact CG-CD1 4.37Å; L284-Y546 HydrophobicContact CG-CD2 4.07Å; L284-Y546 HydrophobicContact CG-CE2 4.4Å; L284-Y546 HydrophobicContact CG-CG 4.06Å; P386-Y546 HydrophobicContact CG-CD2 3.92Å; Y546-F548 WeakPolarHBondContact O-CD2 3.44Å; Y546-F548 PolarHBondContact O-N 3.26Å
547	M	71.7	Confident	81	Confident	49 Å²	49	41.6 Å²	41.6	24%	0.241	22%	0.218	C	C	.	.			trans	-80.5	56	-170.9	-71.7	-162.3	-163.2	0	0	112.7	Q293 Y545 G549 F550 L551	Q293-M547 HydrophobicContact CG-SD 4.31Å; Q293-M547 PolarHBondContact NE2-SD 3.14Å; Q293-M547 VanDerWaalsContact OE1-CB 3.24Å; Q293-M547 PolarHBondContact OE1-SD 3.38Å; Y545-M547 HydrophobicContact CE1-CB 4.48Å; Y545-M547 PolarHBondContact OH-O 2.63Å; M547-G549 PolarHBondContact O-N 3Å; M547-F550 HydrophobicContact CB-CB 4.25Å; M547-F550 HydrophobicContact CB-CD2 3.6Å; M547-F550 HydrophobicContact CB-CE2 4.33Å; M547-F550 HydrophobicContact CB-CG 4.23Å; M547-F550 HydrophobicContact CG-CD2 4.02Å; M547-F550 HydrophobicContact CG-CE2 4.25Å; M547-F550 WeakPolarHBondContact O-CB 3.43Å; M547-F550 PolarHBondContact O-N 3.24Å; M547-F550 HydrophobicContact SD-CD2 3.85Å; M547-F550 HydrophobicContact SD-CE2 3.7Å; M547-F550 HydrophobicContact SD-CZ 4.36Å; M547-L551 PolarHBondContact O-N 3.17Å
548	F	77.9	Confident	81.4	Confident	29 Å²	29	40.9 Å²	40.9	13%	0.127	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-30.3	-177.6	-70.5	-71	0	0	0	113.9	A379 P386 Y546 F550 L551 F552	A379-F548 HydrophobicContact CB-CB 3.92Å; A379-F548 HydrophobicContact CB-CD1 3.67Å; A379-F548 HydrophobicContact CB-CE1 4.34Å; A379-F548 HydrophobicContact CB-CG 3.82Å; P386-F548 HydrophobicContact CG-CE2 3.87Å; P386-F548 HydrophobicContact CG-CZ 4.49Å; Y546-F548 WeakPolarHBondContact O-CD2 3.44Å; Y546-F548 PolarHBondContact O-N 3.26Å; F548-F550 VanDerWaalsContact C-N 3.35Å; F548-L551 HydrophobicContact CD1-CD2 4.42Å; F548-L551 PolarHBondContact O-N 3.42Å; F548-F552 PolarHBondContact O-N 3.02Å
549	G	82	Confident	82	Confident	24 Å²	24	40.5 Å²	40.5	25%	0.247	21%	0.209	C	C	.	.	H	α-helix	trans	-66.1	-35.3	174.3	0	0	0	0	0	113.7	M547 S553	M547-G549 PolarHBondContact O-N 3Å; G549-S553 WeakPolarHBondContact O-CB 3.19Å; G549-S553 PolarHBondContact O-N 3.42Å; G549-S553 PolarHBondContact O-OG 3.38Å
550	F	83.4	Confident	82.4	Confident	36 Å²	36	39.2 Å²	39.2	16%	0.158	21%	0.205	C	C	.	.	H	α-helix	trans	-68.6	-43.2	172.9	-67.8	-98.7	0	0	0	110.4	Q293 W294 I297 M547 F548 F552 S553 V554	Q293-F550 HydrophobicContact CB-CD1 3.89Å; Q293-F550 HydrophobicContact CB-CE1 4.18Å; Q293-F550 HydrophobicContact CB-CG 4.47Å; W294-F550 AromaticContact CD2-CE1 3.78Å; W294-F550 HydrophobicContact CD2-CE1 3.78Å; W294-F550 HydrophobicContact CD2-CZ 4.24Å; W294-F550 AromaticContact CE2-CE1 3.58Å; W294-F550 AromaticContact CE2-CZ 3.56Å; W294-F550 HydrophobicContact CE3-CE1 4.27Å; W294-F550 HydrophobicContact CG-CE1 4.14Å; W294-F550 HydrophobicContact CH2-CE1 4.39Å; W294-F550 AromaticContact CZ2-CE1 3.92Å; W294-F550 HydrophobicContact CZ2-CE1 3.92Å; W294-F550 AromaticContact CZ2-CZ 3.72Å; W294-F550 HydrophobicContact CZ2-CZ 3.72Å; W294-F550 AromaticContact NE1-CE1 3.82Å; W294-F550 AromaticContact NE1-CZ 3.57Å; I297-F550 HydrophobicContact CD1-CB 4.32Å; I297-F550 HydrophobicContact CD1-CD1 3.34Å; I297-F550 HydrophobicContact CD1-CE1 4.01Å; I297-F550 HydrophobicContact CD1-CG 4.21Å; I297-F550 HydrophobicContact CG1-CD1 4.32Å; M547-F550 HydrophobicContact CB-CB 4.25Å; M547-F550 HydrophobicContact CB-CD2 3.6Å; M547-F550 HydrophobicContact CB-CE2 4.33Å; M547-F550 HydrophobicContact CB-CG 4.23Å; M547-F550 HydrophobicContact CG-CD2 4.02Å; M547-F550 HydrophobicContact CG-CE2 4.25Å; M547-F550 WeakPolarHBondContact O-CB 3.43Å; M547-F550 PolarHBondContact O-N 3.24Å; M547-F550 HydrophobicContact SD-CD2 3.85Å; M547-F550 HydrophobicContact SD-CE2 3.7Å; M547-F550 HydrophobicContact SD-CZ 4.36Å; F548-F550 VanDerWaalsContact C-N 3.35Å; F550-F552 PolarHBondContact O-N 3.06Å; F550-S553 PolarHBondContact O-N 3.29Å; F550-V554 WeakPolarHBondContact O-CG2 3.4Å; F550-V554 PolarHBondContact O-N 3.25Å
551	L	86.4	Confident	82.8	Confident	34 Å²	34	38.3 Å²	38.3	18%	0.178	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-44.7	176.2	-172.9	62.7	0	0	0	112.3	L376 I535 Y545 M547 F548 F555	L376-L551 HydrophobicContact CD2-CB 4.45Å; L376-L551 HydrophobicContact CD2-CD2 3.55Å; L376-L551 HydrophobicContact CD2-CG 3.75Å; I535-L551 HydrophobicContact CD1-CD1 3.98Å; Y545-L551 HydrophobicContact CE1-CB 3.92Å; Y545-L551 HydrophobicContact CE1-CD2 4.2Å; Y545-L551 PolarHBondContact OH-N 3.21Å; M547-L551 PolarHBondContact O-N 3.17Å; F548-L551 HydrophobicContact CD1-CD2 4.42Å; F548-L551 PolarHBondContact O-N 3.42Å; L551-F555 WeakPolarHBondContact O-CB 3.39Å; L551-F555 PolarHBondContact O-N 2.8Å
552	F	90.8	Very high	84	Confident	30 Å²	30	37.1 Å²	37.1	13%	0.132	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-46	176.3	178	-115.4	0	0	0	111.8	F373 L376 V377 F380 F548 F550 V554 F555 L556	F373-F552 HydrophobicContact CD2-CE2 4.31Å; F373-F552 AromaticContact CE2-CE2 4Å; F373-F552 HydrophobicContact CE2-CE2 4Å; F373-F552 HydrophobicContact CE2-CZ 4.34Å; L376-F552 HydrophobicContact CB-CB 4.4Å; L376-F552 HydrophobicContact CB-CD2 3.73Å; V377-F552 HydrophobicContact CG2-CE2 3.77Å; V377-F552 HydrophobicContact CG2-CZ 4.06Å; F380-F552 HydrophobicContact CB-CD1 4.46Å; F380-F552 HydrophobicContact CB-CG 4.49Å; F380-F552 HydrophobicContact CD2-CD1 4.45Å; F380-F552 HydrophobicContact CG-CD1 4.3Å; F548-F552 PolarHBondContact O-N 3.02Å; F550-F552 PolarHBondContact O-N 3.06Å; F552-V554 PolarHBondContact O-N 3.3Å; F552-F555 WeakPolarHBondContact O-CB 3.32Å; F552-F555 PolarHBondContact O-N 3.35Å; F552-L556 HydrophobicContact CD1-CD1 4.39Å; F552-L556 HydrophobicContact CE1-CD1 3.82Å; F552-L556 HydrophobicContact CE1-CG 4.44Å; F552-L556 HydrophobicContact CE2-CD2 4.26Å; F552-L556 HydrophobicContact CE2-CG 4.35Å; F552-L556 HydrophobicContact CZ-CD1 3.91Å; F552-L556 HydrophobicContact CZ-CD2 4.23Å; F552-L556 HydrophobicContact CZ-CG 4.21Å; F552-L556 PolarHBondContact O-N 2.95Å
553	S	89.7	Confident	85.2	Confident	49 Å²	49	35.6 Å²	35.6	34%	0.343	19%	0.188	S	C	.	.	H	α-helix	trans	-61.1	-45.7	178.7	-57	0	0	0	0	111.8	G549 F550 F555 L556 I557	G549-S553 WeakPolarHBondContact O-CB 3.19Å; G549-S553 PolarHBondContact O-N 3.42Å; G549-S553 PolarHBondContact O-OG 3.38Å; F550-S553 PolarHBondContact O-N 3.29Å; S553-F555 VanDerWaalsContact C-N 3.3Å; S553-F555 PolarHBondContact O-N 2.97Å; S553-L556 PolarHBondContact O-N 3.15Å; S553-I557 WeakPolarHBondContact O-CG1 3.31Å; S553-I557 PolarHBondContact O-N 3.38Å
554	V	90.2	Very high	86.2	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.03	18%	0.182	C	C	.	.	H	α-helix	trans	-67.4	-32.2	177.1	174.2	0	0	0	0	111.9	I297 I528 Q531 F550 F552 I557 L558	I297-V554 HydrophobicContact CD1-CG2 4.38Å; I297-V554 HydrophobicContact CG1-CG2 3.84Å; I528-V554 HydrophobicContact CG2-CG1 4.18Å; Q531-V554 HydrophobicContact CB-CG1 4.34Å; Q531-V554 HydrophobicContact CG-CB 3.89Å; Q531-V554 HydrophobicContact CG-CG1 3.76Å; Q531-V554 HydrophobicContact CG-CG2 3.69Å; F550-V554 WeakPolarHBondContact O-CG2 3.4Å; F550-V554 PolarHBondContact O-N 3.25Å; F552-V554 PolarHBondContact O-N 3.3Å; V554-I557 PolarHBondContact O-N 3.13Å; V554-L558 WeakPolarHBondContact O-CB 3.32Å; V554-L558 PolarHBondContact O-N 3.35Å
555	F	93.3	Very high	87.3	Confident	21 Å²	21	32 Å²	32	9%	0.092	17%	0.168	C	C	.	.	H	α-helix	trans	-64.1	-42.6	173.1	-178	-105.8	0	0	0	112	T372 F373 L376 L551 F552 S553 I557 L558 L559 L633	T372-F555 WeakPolarHBondContact OG1-CZ 3.43Å; F373-F555 HydrophobicContact CB-CE1 4.05Å; F373-F555 HydrophobicContact CD2-CE1 4.12Å; L376-F555 HydrophobicContact CD1-CB 3.56Å; L376-F555 HydrophobicContact CD1-CD1 3.6Å; L376-F555 HydrophobicContact CD1-CD2 3.96Å; L376-F555 HydrophobicContact CD1-CE1 4.25Å; L376-F555 HydrophobicContact CD1-CG 3.43Å; L376-F555 VanDerWaalsContact CD1-CG 3.43Å; L551-F555 WeakPolarHBondContact O-CB 3.39Å; L551-F555 PolarHBondContact O-N 2.8Å; F552-F555 WeakPolarHBondContact O-CB 3.32Å; F552-F555 PolarHBondContact O-N 3.35Å; S553-F555 VanDerWaalsContact C-N 3.3Å; S553-F555 PolarHBondContact O-N 2.97Å; F555-I557 VanDerWaalsContact C-N 3.35Å; F555-L558 HydrophobicContact CD2-CD2 4.49Å; F555-L558 WeakPolarHBondContact O-CB 3.41Å; F555-L558 PolarHBondContact O-N 3.46Å; F555-L559 HydrophobicContact CD1-CD1 4.17Å; F555-L559 HydrophobicContact CD1-CG 4.44Å; F555-L559 HydrophobicContact CE1-CD1 3.69Å; F555-L559 HydrophobicContact CE1-CD2 4.43Å; F555-L559 HydrophobicContact CE1-CG 4.12Å; F555-L559 HydrophobicContact CE2-CD2 4.45Å; F555-L559 HydrophobicContact CZ-CD1 4.17Å; F555-L559 HydrophobicContact CZ-CD2 4.08Å; F555-L559 HydrophobicContact CZ-CG 4.24Å; F555-L559 WeakPolarHBondContact O-CG 3.2Å; F555-L559 PolarHBondContact O-N 3.37Å; F555-L633 HydrophobicContact CE2-CD1 4.3Å; F555-L633 HydrophobicContact CE2-CD2 4.39Å
556	L	93.5	Very high	88.5	Confident	68 Å²	68	30.6 Å²	30.6	36%	0.356	16%	0.163	S	C	.	.	H	α-helix	trans	-61.4	-44.5	173.7	-65.2	-179.8	0	0	0	111.7	F373 F552 S553 L558 L559 V560	F373-L556 HydrophobicContact CD2-CD2 4.47Å; F373-L556 HydrophobicContact CE2-CD2 3.91Å; F552-L556 HydrophobicContact CD1-CD1 4.39Å; F552-L556 HydrophobicContact CE1-CD1 3.82Å; F552-L556 HydrophobicContact CE1-CG 4.44Å; F552-L556 HydrophobicContact CE2-CD2 4.26Å; F552-L556 HydrophobicContact CE2-CG 4.35Å; F552-L556 HydrophobicContact CZ-CD1 3.91Å; F552-L556 HydrophobicContact CZ-CD2 4.23Å; F552-L556 HydrophobicContact CZ-CG 4.21Å; F552-L556 PolarHBondContact O-N 2.95Å; S553-L556 PolarHBondContact O-N 3.15Å; L556-L558 VanDerWaalsContact C-N 3.32Å; L556-L558 PolarHBondContact O-N 3.24Å; L556-L559 PolarHBondContact O-N 2.68Å; L556-V560 WeakPolarHBondContact O-CG2 3.49Å; L556-V560 PolarHBondContact O-N 3.23Å; L556-V560 VanDerWaalsContact O-N 3.07Å
557	I	92.3	Very high	89.7	Confident	18 Å²	18	26.1 Å²	26.1	9%	0.092	15%	0.147	C	C	.	.	H	α-helix	trans	-57.4	-47.1	175.2	-70.9	168.6	0	0	0	110.3	I297 I301 I304 C527 S553 V554 F555 L559 V560 T561	I297-I557 HydrophobicContact CG2-CD1 4.47Å; I301-I557 HydrophobicContact CG1-CD1 4.17Å; I304-I557 HydrophobicContact CD1-CB 3.67Å; I304-I557 HydrophobicContact CD1-CG1 3.61Å; I304-I557 HydrophobicContact CD1-CG2 3.27Å; I304-I557 HydrophobicContact CG1-CG2 4.08Å; C527-I557 HydrophobicContact CB-CG2 4.3Å; S553-I557 WeakPolarHBondContact O-CG1 3.31Å; S553-I557 PolarHBondContact O-N 3.38Å; V554-I557 PolarHBondContact O-N 3.13Å; F555-I557 VanDerWaalsContact C-N 3.35Å; I557-L559 PolarHBondContact O-N 2.99Å; I557-V560 PolarHBondContact O-N 2.99Å; I557-T561 PolarHBondContact O-N 2.84Å; I557-T561 PolarHBondContact O-OG1 3.1Å; I557-T561 VanDerWaalsContact O-OG1 3.05Å
558	L	93.4	Very high	90.5	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-57.4	-46.5	176.1	172.9	67.5	0	0	0	111.6	P524 I528 V554 F555 L556 V560 T561 L562 F630	P524-L558 HydrophobicContact CB-CD1 4.09Å; I528-L558 HydrophobicContact CG2-CB 3.96Å; I528-L558 HydrophobicContact CG2-CD1 3.76Å; I528-L558 HydrophobicContact CG2-CD2 4.05Å; I528-L558 HydrophobicContact CG2-CG 4.11Å; V554-L558 WeakPolarHBondContact O-CB 3.32Å; V554-L558 PolarHBondContact O-N 3.35Å; F555-L558 HydrophobicContact CD2-CD2 4.49Å; F555-L558 WeakPolarHBondContact O-CB 3.41Å; F555-L558 PolarHBondContact O-N 3.46Å; L556-L558 VanDerWaalsContact C-N 3.32Å; L556-L558 PolarHBondContact O-N 3.24Å; L558-V560 VanDerWaalsContact C-N 3.31Å; L558-V560 PolarHBondContact O-N 3.42Å; L558-T561 PolarHBondContact O-N 3.31Å; L558-L562 HydrophobicContact CD1-CD1 3.73Å; L558-L562 HydrophobicContact CD1-CD2 4.21Å; L558-L562 HydrophobicContact CD1-CG 3.75Å; L558-L562 HydrophobicContact CD2-CD1 4.3Å; L558-L562 HydrophobicContact CG-CD1 3.67Å; L558-L562 HydrophobicContact CG-CG 4.15Å; L558-L562 WeakPolarHBondContact O-CB 3.07Å; L558-L562 WeakPolarHBondContact O-CG 3.35Å; L558-L562 PolarHBondContact O-N 2.87Å; L558-F630 HydrophobicContact CD2-CE2 3.97Å; L558-F630 HydrophobicContact CD2-CZ 3.98Å
559	L	95.5	Very high	91	Very high	31 Å²	31	24.2 Å²	24.2	16%	0.162	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-42.8	179.7	-67.9	-177.6	0	0	0	111.9	L369 F555 L556 I557 A563 V637	L369-L559 HydrophobicContact CD1-CD2 3.75Å; F555-L559 HydrophobicContact CD1-CD1 4.17Å; F555-L559 HydrophobicContact CD1-CG 4.44Å; F555-L559 HydrophobicContact CE1-CD1 3.69Å; F555-L559 HydrophobicContact CE1-CD2 4.43Å; F555-L559 HydrophobicContact CE1-CG 4.12Å; F555-L559 HydrophobicContact CE2-CD2 4.45Å; F555-L559 HydrophobicContact CZ-CD1 4.17Å; F555-L559 HydrophobicContact CZ-CD2 4.08Å; F555-L559 HydrophobicContact CZ-CG 4.24Å; F555-L559 WeakPolarHBondContact O-CG 3.2Å; F555-L559 PolarHBondContact O-N 3.37Å; L556-L559 PolarHBondContact O-N 2.68Å; I557-L559 PolarHBondContact O-N 2.99Å; L559-A563 WeakPolarHBondContact O-CB 3.5Å; L559-A563 PolarHBondContact O-N 3.13Å; L559-V637 HydrophobicContact CD2-CG1 4.35Å; L559-V637 HydrophobicContact CD2-CG2 3.58Å
560	V	93.7	Very high	91.4	Very high	63 Å²	63	23.2 Å²	23.2	38%	0.382	13%	0.129	S	C	.	.	H	α-helix	trans	-63.7	-51.8	176	175.3	0	0	0	0	110.3	I304 L556 I557 L558 L562 A563 E564	I304-V560 HydrophobicContact CG2-CG1 4.09Å; L556-V560 WeakPolarHBondContact O-CG2 3.49Å; L556-V560 PolarHBondContact O-N 3.23Å; L556-V560 VanDerWaalsContact O-N 3.07Å; I557-V560 PolarHBondContact O-N 2.99Å; L558-V560 VanDerWaalsContact C-N 3.31Å; L558-V560 PolarHBondContact O-N 3.42Å; V560-L562 VanDerWaalsContact C-N 3.31Å; V560-L562 PolarHBondContact O-N 2.85Å; V560-A563 PolarHBondContact O-N 3.29Å; V560-A563 VanDerWaalsContact O-N 3.13Å; V560-E564 HydrophobicContact CG1-CG 4.12Å; V560-E564 WeakPolarHBondContact O-CB 3.46Å; V560-E564 VanDerWaalsContact O-CG 3.32Å; V560-E564 WeakPolarHBondContact O-CG 3.18Å; V560-E564 PolarHBondContact O-N 3.01Å
561	T	92.9	Very high	91.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.4	-40.2	179.7	-56.5	0	0	0	0	112.2	L307 P524 I557 L558 T565	L307-T561 HydrophobicContact CD1-CG2 3.76Å; P524-T561 HydrophobicContact CB-CG2 4.17Å; P524-T561 HydrophobicContact CG-CG2 4.07Å; I557-T561 PolarHBondContact O-N 2.84Å; I557-T561 PolarHBondContact O-OG1 3.1Å; I557-T561 VanDerWaalsContact O-OG1 3.05Å; L558-T561 PolarHBondContact O-N 3.31Å; T561-T565 HydrophobicContact CG2-CG2 4.2Å; T561-T565 WeakPolarHBondContact O-CB 3.46Å; T561-T565 VanDerWaalsContact O-CG2 3.23Å; T561-T565 WeakPolarHBondContact O-CG2 3.22Å; T561-T565 PolarHBondContact O-N 3.43Å; T561-T565 PolarHBondContact O-OG1 3.27Å
562	L	95.5	Very high	91.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-42.5	177	-71.2	168.8	0	0	0	111.7	P524 L558 V560 T565 S566 S589 C634 V637	P524-L562 HydrophobicContact CB-CD2 3.56Å; P524-L562 HydrophobicContact CB-CG 4.18Å; P524-L562 HydrophobicContact CG-CD2 3.79Å; L558-L562 HydrophobicContact CD1-CD1 3.73Å; L558-L562 HydrophobicContact CD1-CD2 4.21Å; L558-L562 HydrophobicContact CD1-CG 3.75Å; L558-L562 HydrophobicContact CD2-CD1 4.3Å; L558-L562 HydrophobicContact CG-CD1 3.67Å; L558-L562 HydrophobicContact CG-CG 4.15Å; L558-L562 WeakPolarHBondContact O-CB 3.07Å; L558-L562 WeakPolarHBondContact O-CG 3.35Å; L558-L562 PolarHBondContact O-N 2.87Å; V560-L562 VanDerWaalsContact C-N 3.31Å; V560-L562 PolarHBondContact O-N 2.85Å; L562-T565 PolarHBondContact O-OG1 2.94Å; L562-S566 VanDerWaalsContact O-CB 3.28Å; L562-S566 WeakPolarHBondContact O-CB 3.46Å; L562-S566 PolarHBondContact O-N 3.36Å; L562-S566 PolarHBondContact O-OG 3.46Å; L562-S589 PolarHBondContact O-OG 3.39Å; L562-C634 HydrophobicContact CD1-CB 4.02Å; L562-C634 HydrophobicContact CD2-CB 4.04Å; L562-V637 HydrophobicContact CB-CB 4.38Å; L562-V637 HydrophobicContact CB-CG1 3.83Å; L562-V637 HydrophobicContact CD1-CB 4.4Å; L562-V637 HydrophobicContact CD1-CG1 4.45Å
563	A	94.1	Very high	91.6	Very high	23 Å²	23	24.2 Å²	24.2	19%	0.19	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-50.8	177.1	0	0	0	0	0	110.4	L559 V560 S566 V567 V637 S641	L559-A563 WeakPolarHBondContact O-CB 3.5Å; L559-A563 PolarHBondContact O-N 3.13Å; V560-A563 PolarHBondContact O-N 3.29Å; V560-A563 VanDerWaalsContact O-N 3.13Å; A563-S566 PolarHBondContact O-N 3.04Å; A563-S566 PolarHBondContact O-OG 2.86Å; A563-V567 VanDerWaalsContact O-CG2 3.28Å; A563-V567 WeakPolarHBondContact O-CG2 3.31Å; A563-V567 PolarHBondContact O-N 3.24Å; A563-V637 HydrophobicContact CB-CG1 4.49Å; A563-S641 VanDerWaalsContact CB-OG 3.24Å; A563-S641 WeakPolarHBondContact CB-OG 3.42Å
564	E	91.5	Very high	91.6	Very high	31 Å²	31	22 Å²	22	15%	0.145	12%	0.116	C	C	.	.	H	α-helix	trans	-59	-53.4	-179.2	-75.8	-170.9	170.2	0	0	112.7	L307 S308 I311 V560 S566 V567 V568	L307-E564 WeakPolarHBondContact CB-OE2 3.47Å; S308-E564 WeakPolarHBondContact CB-OE1 3.42Å; S308-E564 PolarHBondContact N-OE2 3.34Å; I311-E564 VanDerWaalsContact CD1-CA 3.49Å; I311-E564 HydrophobicContact CD1-CB 3.3Å; I311-E564 HydrophobicContact CD1-CG 3.39Å; V560-E564 HydrophobicContact CG1-CG 4.12Å; V560-E564 WeakPolarHBondContact O-CB 3.46Å; V560-E564 VanDerWaalsContact O-CG 3.32Å; V560-E564 WeakPolarHBondContact O-CG 3.18Å; V560-E564 PolarHBondContact O-N 3.01Å; E564-S566 VanDerWaalsContact C-N 3.28Å; E564-S566 PolarHBondContact O-N 3.29Å; E564-V567 PolarHBondContact O-N 3.38Å; E564-V568 WeakPolarHBondContact O-CG2 3.28Å; E564-V568 PolarHBondContact O-N 3.08Å
565	T	90.9	Very high	91.3	Very high	7 Å²	7	23.9 Å²	23.9	4%	0.043	13%	0.129	C	C	.	.	H	α-helix	trans	-59.8	-39.6	179.9	52	0	0	0	0	112	L307 L523 P524 T561 L562 L569	L307-T565 HydrophobicContact CD1-CG2 3.93Å; L307-T565 HydrophobicContact CD2-CG2 4.46Å; L523-T565 HydrophobicContact CB-CG2 4.14Å; L523-T565 HydrophobicContact CD1-CG2 4.07Å; P524-T565 HydrophobicContact CG-CG2 4.24Å; T561-T565 HydrophobicContact CG2-CG2 4.2Å; T561-T565 WeakPolarHBondContact O-CB 3.46Å; T561-T565 VanDerWaalsContact O-CG2 3.23Å; T561-T565 WeakPolarHBondContact O-CG2 3.22Å; T561-T565 PolarHBondContact O-N 3.43Å; T561-T565 PolarHBondContact O-OG1 3.27Å; L562-T565 PolarHBondContact O-OG1 2.94Å; T565-L569 WeakPolarHBondContact O-CG 3.49Å; T565-L569 PolarHBondContact O-N 3.35Å
566	S	92.9	Very high	91	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-44.8	177	73.3	0	0	0	0	112.7	L562 A563 E564 L569 C570 S589 G638 C642	L562-S566 VanDerWaalsContact O-CB 3.28Å; L562-S566 WeakPolarHBondContact O-CB 3.46Å; L562-S566 PolarHBondContact O-N 3.36Å; L562-S566 PolarHBondContact O-OG 3.46Å; A563-S566 PolarHBondContact O-N 3.04Å; A563-S566 PolarHBondContact O-OG 2.86Å; E564-S566 VanDerWaalsContact C-N 3.28Å; E564-S566 PolarHBondContact O-N 3.29Å; S566-L569 PolarHBondContact O-N 3.38Å; S566-C570 VanDerWaalsContact O-CB 3.24Å; S566-C570 WeakPolarHBondContact O-CB 3.34Å; S566-C570 PolarHBondContact O-N 3.39Å; S566-S589 WeakPolarHBondContact CB-OG 3.47Å; S566-G638 WeakPolarHBondContact OG-CA 3.11Å; S566-G638 PolarHBondContact OG-O 3.14Å; S566-C642 PolarHBondContact O-SG 3.24Å
567	V	91.3	Very high	90.7	Very high	25 Å²	25	22.4 Å²	22.4	15%	0.152	13%	0.125	C	C	.	.	H	α-helix	trans	-66.7	-43.1	-179	170.7	0	0	0	0	111	A563 E564 L569 C570 Y571 F645	A563-V567 VanDerWaalsContact O-CG2 3.28Å; A563-V567 WeakPolarHBondContact O-CG2 3.31Å; A563-V567 PolarHBondContact O-N 3.24Å; E564-V567 PolarHBondContact O-N 3.38Å; V567-L569 PolarHBondContact O-N 3.17Å; V567-C570 PolarHBondContact O-N 3.1Å; V567-Y571 WeakPolarHBondContact O-CB 3.49Å; V567-Y571 PolarHBondContact O-N 2.76Å; V567-F645 HydrophobicContact CG1-CB 4.28Å; V567-F645 HydrophobicContact CG1-CD1 3.95Å; V567-F645 HydrophobicContact CG1-CD2 3.71Å; V567-F645 HydrophobicContact CG1-CE1 4.19Å; V567-F645 HydrophobicContact CG1-CE2 3.97Å; V567-F645 HydrophobicContact CG1-CG 3.7Å; V567-F645 HydrophobicContact CG1-CZ 4.19Å; V567-F645 HydrophobicContact CG2-CB 4.15Å; V567-F645 HydrophobicContact CG2-CG 4.45Å
568	V	88.5	Confident	90.7	Very high	13 Å²	13	22 Å²	22	8%	0.079	12%	0.123	C	C	.	.	H	α-helix	trans	-57.6	-49.5	176.5	171.9	0	0	0	0	111.1	M310 I311 I314 E564 Y571 F572	M310-V568 HydrophobicContact CE-CG1 4.12Å; I311-V568 HydrophobicContact CD1-CG2 3.7Å; I311-V568 HydrophobicContact CG1-CG2 3.15Å; I314-V568 HydrophobicContact CD1-CG1 3.96Å; I314-V568 HydrophobicContact CD1-CG2 4.33Å; E564-V568 WeakPolarHBondContact O-CG2 3.28Å; E564-V568 PolarHBondContact O-N 3.08Å; V568-Y571 PolarHBondContact O-N 2.86Å; V568-F572 HydrophobicContact CG1-CD2 3.69Å; V568-F572 HydrophobicContact CG1-CE2 3.38Å; V568-F572 HydrophobicContact CG1-CZ 4.33Å; V568-F572 WeakPolarHBondContact O-CD2 3.38Å; V568-F572 PolarHBondContact O-N 3.41Å
569	L	89.3	Confident	90.6	Very high	25 Å²	25	23.2 Å²	23.2	13%	0.131	13%	0.128	C	C	.	.	H	α-helix	trans	-69.8	-37.6	-178.6	-70.2	175.3	0	0	0	112.3	M519 A520 T565 S566 V567 Y571 F572 Q573	M519-L569 HydrophobicContact CE-CD2 4.22Å; A520-L569 HydrophobicContact CB-CD1 3.21Å; T565-L569 WeakPolarHBondContact O-CG 3.49Å; T565-L569 PolarHBondContact O-N 3.35Å; S566-L569 PolarHBondContact O-N 3.38Å; V567-L569 PolarHBondContact O-N 3.17Å; L569-Y571 VanDerWaalsContact C-N 3.28Å; L569-Y571 PolarHBondContact O-N 3.45Å; L569-F572 PolarHBondContact O-N 3.39Å; L569-Q573 WeakPolarHBondContact O-CB 3.26Å; L569-Q573 PolarHBondContact O-N 2.99Å
570	C	91.1	Very high	90.5	Very high	4 Å²	4	28.1 Å²	28.1	3%	0.027	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-41	172.3	-173.6	0	0	0	0	110.9	S566 V567 Q573 L574 C642	S566-C570 VanDerWaalsContact O-CB 3.24Å; S566-C570 WeakPolarHBondContact O-CB 3.34Å; S566-C570 PolarHBondContact O-N 3.39Å; V567-C570 PolarHBondContact O-N 3.1Å; C570-Q573 WeakPolarHBondContact O-CB 3.45Å; C570-Q573 PolarHBondContact O-N 3.34Å; C570-L574 VanDerWaalsContact O-CG 3.28Å; C570-L574 WeakPolarHBondContact O-CG 3.36Å; C570-L574 PolarHBondContact O-N 3.09Å; C570-C642 HydrophobicContact CB-CB 4.36Å; C570-C642 VanDerWaalsContact CB-SG 3.57Å
571	Y	88.1	Confident	90.5	Very high	17 Å²	17	25.1 Å²	25.1	7%	0.067	13%	0.126	C	C	.	.	H	α-helix	trans	-67.1	-46.8	178.2	-178	-98.9	0	0	0	112.6	I314 T318 W341 V567 V568 L569 Q573 L574 C575 F645 I649	I314-Y571 HydrophobicContact CG2-CD1 3.35Å; I314-Y571 HydrophobicContact CG2-CE1 3.49Å; I314-Y571 VanDerWaalsContact CG2-CE1 3.49Å; I314-Y571 HydrophobicContact CG2-CG 4.14Å; T318-Y571 WeakPolarHBondContact CB-OH 3.23Å; T318-Y571 HydrophobicContact CG2-CE1 3.66Å; T318-Y571 HydrophobicContact CG2-CE2 4.39Å; T318-Y571 WeakPolarHBondContact CG2-OH 3.4Å; W341-Y571 AromaticContact CD1-CE2 3.93Å; W341-Y571 HydrophobicContact CG-CE2 4.3Å; V567-Y571 WeakPolarHBondContact O-CB 3.49Å; V567-Y571 PolarHBondContact O-N 2.76Å; V568-Y571 PolarHBondContact O-N 2.86Å; L569-Y571 VanDerWaalsContact C-N 3.28Å; L569-Y571 PolarHBondContact O-N 3.45Å; Y571-Q573 VanDerWaalsContact C-N 3.26Å; Y571-Q573 PolarHBondContact O-N 3.28Å; Y571-L574 PolarHBondContact O-N 2.81Å; Y571-C575 WeakPolarHBondContact CE1-SG 3.23Å; Y571-C575 PolarHBondContact O-N 3.13Å; Y571-C575 PolarHBondContact O-SG 2.7Å; Y571-C575 PolarHBondContact OH-SG 3.23Å; Y571-C575 VanDerWaalsContact OH-SG 3.33Å; Y571-F645 HydrophobicContact CD2-CE1 4.22Å; Y571-F645 AromaticContact CD2-CZ 3.81Å; Y571-F645 HydrophobicContact CD2-CZ 3.81Å; Y571-F645 HydrophobicContact CG-CZ 4.41Å; Y571-I649 HydrophobicContact CD2-CD1 4.37Å; Y571-I649 HydrophobicContact CE2-CD1 4.16Å
572	F	86.5	Confident	90.7	Very high	98 Å²	98	25.4 Å²	25.4	43%	0.43	13%	0.127	S	C	.	.	H	α-helix	trans	-62.8	-36	175.2	-72.6	-45.1	0	0	0	112.3	M310 I314 V568 L569 C575 G576	M310-F572 HydrophobicContact CE-CE2 3.84Å; M310-F572 HydrophobicContact CE-CZ 4.05Å; I314-F572 HydrophobicContact CD1-CE1 4.2Å; I314-F572 HydrophobicContact CD1-CE2 4.03Å; I314-F572 HydrophobicContact CD1-CZ 3.55Å; I314-F572 HydrophobicContact CG1-CZ 4.22Å; V568-F572 HydrophobicContact CG1-CD2 3.69Å; V568-F572 HydrophobicContact CG1-CE2 3.38Å; V568-F572 HydrophobicContact CG1-CZ 4.33Å; V568-F572 WeakPolarHBondContact O-CD2 3.38Å; V568-F572 PolarHBondContact O-N 3.41Å; L569-F572 PolarHBondContact O-N 3.39Å; F572-C575 WeakPolarHBondContact O-CB 3.11Å; F572-C575 PolarHBondContact O-N 3.28Å; F572-G576 PolarHBondContact O-N 3.01Å
573	Q	89.2	Confident	90.7	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.028	14%	0.138	C	C	.	.	H	α-helix	trans	-60.8	-47.7	173.2	166.2	171.6	1.5	0	0	111.8	L569 C570 Y571 C575 G576 E577 D578 R580 R584	L569-Q573 WeakPolarHBondContact O-CB 3.26Å; L569-Q573 PolarHBondContact O-N 2.99Å; C570-Q573 WeakPolarHBondContact O-CB 3.45Å; C570-Q573 PolarHBondContact O-N 3.34Å; Y571-Q573 VanDerWaalsContact C-N 3.26Å; Y571-Q573 PolarHBondContact O-N 3.28Å; Q573-C575 VanDerWaalsContact C-N 3.32Å; Q573-G576 CarbonylContact O-C 3.59Å; Q573-G576 WeakPolarHBondContact O-CA 3.07Å; Q573-G576 PolarHBondContact O-N 3.43Å; Q573-G576 VanDerWaalsContact O-N 3.09Å; Q573-E577 PolarHBondContact O-N 3.3Å; Q573-D578 HydrophobicContact CG-CB 4.06Å; Q573-D578 WeakPolarHBondContact CG-O 3.42Å; Q573-D578 PolarHBondContact NE2-O 3.38Å; Q573-D578 PolarHBondContact O-N 2.88Å; Q573-R580 PolarHBondContact NE2-O 3.24Å; Q573-R584 VanDerWaalsContact CD-NH1 3.34Å
574	L	89.6	Confident	90.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-66	-37	178.7	-68.5	170.6	0	0	0	111.3	G340 W341 V344 V348 C570 Y571 G576 E577 V646 Y650	G340-L574 CarbonylContact C-O 3.42Å; W341-L574 WeakPolarHBondContact CA-O 3.5Å; W341-L574 HydrophobicContact CB-CB 3.68Å; W341-L574 PolarHBondContact N-O 2.63Å; V344-L574 HydrophobicContact CG2-CD2 4.16Å; V348-L574 HydrophobicContact CG2-CD2 3.97Å; C570-L574 VanDerWaalsContact O-CG 3.28Å; C570-L574 WeakPolarHBondContact O-CG 3.36Å; C570-L574 PolarHBondContact O-N 3.09Å; Y571-L574 PolarHBondContact O-N 2.81Å; L574-G576 PolarHBondContact O-N 3.46Å; L574-E577 PolarHBondContact O-N 2.94Å; L574-V646 HydrophobicContact CD1-CG2 4.18Å; L574-Y650 HydrophobicContact CD1-CE2 4.31Å
575	C	84.9	Confident	90.8	Very high	45 Å²	45	27.1 Å²	27.1	30%	0.304	13%	0.128	S	C	.	.	H	α-helix	trans	-60.3	-32.2	171.2	-69.7	0	0	0	0	112.9	Y571 F572 Q573 E577	Y571-C575 WeakPolarHBondContact CE1-SG 3.23Å; Y571-C575 PolarHBondContact O-N 3.13Å; Y571-C575 PolarHBondContact O-SG 2.7Å; Y571-C575 PolarHBondContact OH-SG 3.23Å; Y571-C575 VanDerWaalsContact OH-SG 3.33Å; F572-C575 WeakPolarHBondContact O-CB 3.11Å; F572-C575 PolarHBondContact O-N 3.28Å; Q573-C575 VanDerWaalsContact C-N 3.32Å; C575-E577 PolarHBondContact O-N 3.35Å
576	G	86.2	Confident	91.1	Very high	18 Å²	18	26.8 Å²	26.8	19%	0.186	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	10.8	172.7	0	0	0	0	0	114.2	Q507 F572 Q573 L574 D578	Q507-G576 PolarHBondContact NE2-O 3.07Å; F572-G576 PolarHBondContact O-N 3.01Å; Q573-G576 CarbonylContact O-C 3.59Å; Q573-G576 WeakPolarHBondContact O-CA 3.07Å; Q573-G576 PolarHBondContact O-N 3.43Å; Q573-G576 VanDerWaalsContact O-N 3.09Å; L574-G576 PolarHBondContact O-N 3.46Å; G576-D578 PolarHBondContact O-N 2.77Å; G576-D578 VanDerWaalsContact O-N 3.14Å
577	E	88.1	Confident	91.3	Very high	40 Å²	40	29.7 Å²	29.7	19%	0.187	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	18	-178.9	-51.3	-177.5	-172.4	0	0	114.6	L343 V344 R502 P505 Q573 L574 C575	L343-E577 WeakPolarHBondContact CD1-OE1 3.48Å; V344-E577 HydrophobicContact CG1-CB 4.13Å; V344-E577 WeakPolarHBondContact CG1-O 3.29Å; R502-E577 IonicContact CZ-OE2 2.74Å; R502-E577 IonicContact NE-OE2 3.74Å; R502-E577 IonicContact NH2-OE1 2.74Å; R502-E577 IonicContact NH2-OE2 3.42Å; R502-E577 PolarHBondContact NH2-OE2 2.89Å; P505-E577 HydrophobicContact CG-CB 3.86Å; P505-E577 HydrophobicContact CG-CG 4.38Å; Q573-E577 PolarHBondContact O-N 3.3Å; L574-E577 PolarHBondContact O-N 2.94Å; C575-E577 PolarHBondContact O-N 3.35Å
578	D	91	Very high	91.3	Very high	9 Å²	9	28.6 Å²	28.6	5%	0.048	14%	0.135	C	C	.	.			trans	-94.9	97.2	173.2	-171.4	-15.9	0	0	0	110.8	I504 Q573 G576 R580	I504-D578 WeakPolarHBondContact CD1-OD1 3.45Å; I504-D578 HydrophobicContact CG2-CB 3.78Å; Q573-D578 HydrophobicContact CG-CB 4.06Å; Q573-D578 WeakPolarHBondContact CG-O 3.42Å; Q573-D578 PolarHBondContact NE2-O 3.38Å; Q573-D578 PolarHBondContact O-N 2.88Å; G576-D578 PolarHBondContact O-N 2.77Å; G576-D578 VanDerWaalsContact O-N 3.14Å; D578-R580 PolarHBondContact O-N 2.82Å; D578-R580 VanDerWaalsContact O-N 3.17Å; D578-R580 VanDerWaalsContact OD1-CB 3.26Å; D578-R580 WeakPolarHBondContact OD1-CB 3.38Å; D578-R580 WeakPolarHBondContact OD1-CG 3.29Å; D578-R580 IonicContact OD1-CZ 2.99Å; D578-R580 PolarHBondContact OD1-N 2.9Å; D578-R580 IonicContact OD1-NE 3.57Å; D578-R580 PolarHBondContact OD1-NE 2.96Å; D578-R580 IonicContact OD1-NH2 3.1Å; D578-R580 IonicContact OD2-CZ 3.03Å; D578-R580 IonicContact OD2-NE 3.51Å; D578-R580 IonicContact OD2-NH2 3.8Å; D578-R580 PolarHBondContact OD2-NH2 2.89Å
579	Y	92.2	Very high	91.6	Very high	32 Å²	32	28 Å²	28	13%	0.125	13%	0.131	C	C	.	.			trans	-69.2	-5.5	179.3	63	-94.5	0	0	0	114.9	D347 P501 R502 I504 W581	D347-Y579 HydrophobicContact CB-CD1 3.79Å; D347-Y579 HydrophobicContact CB-CD2 3.91Å; D347-Y579 HydrophobicContact CB-CE1 4.23Å; D347-Y579 HydrophobicContact CB-CE2 4.36Å; D347-Y579 HydrophobicContact CB-CG 3.62Å; P501-Y579 WeakPolarHBondContact CB-OH 3.41Å; R502-Y579 WeakPolarHBondContact O-CE1 3.21Å; I504-Y579 HydrophobicContact CD1-CD1 4.39Å; I504-Y579 HydrophobicContact CD1-CE1 3.91Å; I504-Y579 HydrophobicContact CG1-CD1 4.21Å; I504-Y579 HydrophobicContact CG1-CE1 3.8Å; Y579-W581 PolarHBondContact O-N 2.79Å
580	R	93.5	Very high	91.9	Very high	134 Å²	134	26.8 Å²	26.8	51%	0.506	13%	0.125	S	C	.	.			trans	-83.8	56.5	-174.7	-57.3	172.1	-61.3	-175.1	-0.2	112.2	I504 Q573 D578	I504-R580 HydrophobicContact CD1-CG 4.15Å; Q573-R580 PolarHBondContact NE2-O 3.24Å; D578-R580 PolarHBondContact O-N 2.82Å; D578-R580 VanDerWaalsContact O-N 3.17Å; D578-R580 VanDerWaalsContact OD1-CB 3.26Å; D578-R580 WeakPolarHBondContact OD1-CB 3.38Å; D578-R580 WeakPolarHBondContact OD1-CG 3.29Å; D578-R580 IonicContact OD1-CZ 2.99Å; D578-R580 PolarHBondContact OD1-N 2.9Å; D578-R580 IonicContact OD1-NE 3.57Å; D578-R580 PolarHBondContact OD1-NE 2.96Å; D578-R580 IonicContact OD1-NH2 3.1Å; D578-R580 IonicContact OD2-CZ 3.03Å; D578-R580 IonicContact OD2-NE 3.51Å; D578-R580 IonicContact OD2-NH2 3.8Å; D578-R580 PolarHBondContact OD2-NH2 2.89Å
581	W	94.1	Very high	92.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-82.7	-25.5	-172.2	64.7	-92.2	0	0	0	113.6	V348 Y579 W583 R584 A585 F639 C642 F643 V646	V348-W581 PolarHBondContact O-NE1 3.39Å; Y579-W581 PolarHBondContact O-N 2.79Å; W581-W583 PolarHBondContact O-N 2.91Å; W581-R584 CarbonylContact O-C 3.55Å; W581-R584 PolarHBondContact O-N 2.79Å; W581-R584 VanDerWaalsContact O-N 3.09Å; W581-A585 HydrophobicContact CE3-CB 4.08Å; W581-A585 WeakPolarHBondContact O-CB 3.15Å; W581-A585 PolarHBondContact O-N 2.66Å; W581-F639 HydrophobicContact CZ3-CE2 4.22Å; W581-C642 HydrophobicContact CE3-CB 4.09Å; W581-C642 HydrophobicContact CZ3-CB 3.95Å; W581-F643 HydrophobicContact CH2-CB 4Å; W581-F643 AromaticContact CH2-CD2 3.85Å; W581-F643 HydrophobicContact CH2-CD2 3.85Å; W581-F643 HydrophobicContact CH2-CG 4.38Å; W581-F643 HydrophobicContact CZ3-CB 4.32Å; W581-V646 HydrophobicContact CD2-CG2 4.11Å; W581-V646 HydrophobicContact CE3-CG2 4.33Å; W581-V646 HydrophobicContact CH2-CB 4.37Å; W581-V646 HydrophobicContact CH2-CG2 4.39Å; W581-V646 HydrophobicContact CZ2-CB 4.1Å; W581-V646 HydrophobicContact CZ2-CG1 3.87Å; W581-V646 HydrophobicContact CZ2-CG2 4.19Å; W581-V646 HydrophobicContact CZ3-CG2 4.47Å
582	W	95.4	Very high	92.4	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.019	13%	0.129	C	C	.	.	H	α-helix	trans	-48.9	-60.7	-171.9	-63.2	79.9	0	0	0	114.7	V348 F349 R350 P352 L358 L414 V418 F586 F639 F643	V348-W582 PolarHBondContact O-NE1 3.4Å; V348-W582 VanDerWaalsContact O-NE1 3.14Å; F349-W582 HydrophobicContact CD1-CZ2 4.5Å; R350-W582 PolarHBondContact O-NE1 3.34Å; P352-W582 HydrophobicContact CB-CB 3.68Å; P352-W582 HydrophobicContact CB-CG 3.87Å; P352-W582 HydrophobicContact CG-CB 3.8Å; P352-W582 HydrophobicContact CG-CD2 3.93Å; P352-W582 HydrophobicContact CG-CE3 4.15Å; P352-W582 HydrophobicContact CG-CG 3.77Å; L358-W582 HydrophobicContact CD2-CB 3.91Å; L358-W582 HydrophobicContact CD2-CE3 4.37Å; L414-W582 HydrophobicContact CD1-CZ3 3.93Å; V418-W582 HydrophobicContact CG2-CH2 3.91Å; V418-W582 HydrophobicContact CG2-CZ3 3.82Å; W582-F586 PolarHBondContact O-N 3.45Å; W582-F639 HydrophobicContact CB-CE2 4.36Å; W582-F639 HydrophobicContact CD2-CE2 4.5Å; W582-F639 AromaticContact CE3-CE2 3.7Å; W582-F639 HydrophobicContact CE3-CE2 3.7Å; W582-F639 AromaticContact CE3-CZ 3.61Å; W582-F639 HydrophobicContact CE3-CZ 3.61Å; W582-F639 HydrophobicContact CZ3-CE2 4.43Å; W582-F639 AromaticContact CZ3-CZ 3.89Å; W582-F639 HydrophobicContact CZ3-CZ 3.89Å; W582-F639 WeakPolarHBondContact O-CD2 3.35Å; W582-F643 HydrophobicContact CH2-CD2 4.16Å; W582-F643 AromaticContact CH2-CE2 3.84Å; W582-F643 HydrophobicContact CH2-CE2 3.84Å; W582-F643 AromaticContact CZ3-CD2 3.98Å; W582-F643 HydrophobicContact CZ3-CD2 3.98Å; W582-F643 AromaticContact CZ3-CE2 3.94Å; W582-F643 HydrophobicContact CZ3-CE2 3.94Å
583	W	95.7	Very high	92.9	Very high	58 Å²	58	23.1 Å²	23.1	22%	0.22	11%	0.109	C	C	.	.	H	α-helix	trans	-71.4	-33.5	177.9	-84.8	105.9	0	0	0	112.4	K353 N354 L357 L358 F361 W581 A585 F586 L587	K353-W583 PolarHBondContact O-NE1 3.3Å; N354-W583 HydrophobicContact CB-CZ2 4.25Å; L357-W583 HydrophobicContact CB-CH2 4.12Å; L357-W583 HydrophobicContact CB-CZ2 4.12Å; L357-W583 HydrophobicContact CD2-CH2 3.94Å; L357-W583 HydrophobicContact CD2-CZ2 4.36Å; L357-W583 HydrophobicContact CG-CH2 3.91Å; L357-W583 HydrophobicContact CG-CZ2 4.38Å; L358-W583 HydrophobicContact CB-CD2 4.42Å; L358-W583 HydrophobicContact CB-CH2 3.91Å; L358-W583 HydrophobicContact CB-CZ2 3.55Å; L358-W583 HydrophobicContact CB-CZ3 4.48Å; L358-W583 HydrophobicContact CD1-CD2 3.95Å; L358-W583 HydrophobicContact CD1-CE3 3.77Å; L358-W583 HydrophobicContact CD1-CH2 4.18Å; L358-W583 HydrophobicContact CD1-CZ2 4.36Å; L358-W583 HydrophobicContact CD1-CZ3 3.88Å; L358-W583 HydrophobicContact CG-CZ2 4.47Å; F361-W583 HydrophobicContact CD2-CH2 4.35Å; F361-W583 HydrophobicContact CD2-CZ3 4.3Å; W581-W583 PolarHBondContact O-N 2.91Å; W583-A585 VanDerWaalsContact C-N 3.33Å; W583-A585 PolarHBondContact O-N 2.92Å; W583-F586 HydrophobicContact CE3-CD1 4.48Å; W583-F586 HydrophobicContact CZ3-CD1 4.37Å; W583-F586 PolarHBondContact O-N 2.82Å; W583-L587 WeakPolarHBondContact O-CB 3.18Å; W583-L587 VanDerWaalsContact O-CG 3.29Å; W583-L587 WeakPolarHBondContact O-CG 3.44Å; W583-L587 PolarHBondContact O-N 3.11Å
584	R	93.6	Very high	93.2	Very high	29 Å²	29	26.2 Å²	26.2	11%	0.109	12%	0.123	C	C	.	.	H	α-helix	trans	-66.1	-37.5	-178.5	-173.8	153	168.6	-147.9	8.6	111.7	A511 Q573 W581 L587 S588	A511-R584 PolarHBondContact O-NH2 2.89Å; Q573-R584 VanDerWaalsContact CD-NH1 3.34Å; W581-R584 CarbonylContact O-C 3.55Å; W581-R584 PolarHBondContact O-N 2.79Å; W581-R584 VanDerWaalsContact O-N 3.09Å; R584-L587 PolarHBondContact O-N 2.89Å; R584-S588 VanDerWaalsContact O-CB 3.28Å; R584-S588 WeakPolarHBondContact O-CB 3.36Å; R584-S588 PolarHBondContact O-N 2.89Å; R584-S588 PolarHBondContact O-OG 2.8Å
585	A	95.3	Very high	93.5	Very high	3 Å²	3	28.2 Å²	28.2	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-37.4	173.8	0	0	0	0	0	112.9	W581 W583 S588 C642	W581-A585 HydrophobicContact CE3-CB 4.08Å; W581-A585 WeakPolarHBondContact O-CB 3.15Å; W581-A585 PolarHBondContact O-N 2.66Å; W583-A585 VanDerWaalsContact C-N 3.33Å; W583-A585 PolarHBondContact O-N 2.92Å; A585-S588 PolarHBondContact O-OG 3.47Å; A585-C642 HydrophobicContact CB-CB 3.59Å
586	F	96.9	Very high	94	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.3	-47.1	173.8	-176.4	-87.7	0	0	0	111	L358 F361 V362 W582 W583 G590 F631 L632 G635 F639	L358-F586 HydrophobicContact CD1-CB 3.84Å; L358-F586 HydrophobicContact CD1-CD2 4.18Å; L358-F586 HydrophobicContact CD1-CG 3.99Å; F361-F586 HydrophobicContact CB-CE1 4.38Å; F361-F586 HydrophobicContact CB-CE2 3.97Å; F361-F586 HydrophobicContact CB-CZ 3.7Å; F361-F586 HydrophobicContact CD2-CE1 4.14Å; F361-F586 HydrophobicContact CD2-CZ 4.2Å; F361-F586 HydrophobicContact CG-CZ 4.39Å; V362-F586 HydrophobicContact CG2-CD2 3.76Å; V362-F586 HydrophobicContact CG2-CE2 4.08Å; W582-F586 PolarHBondContact O-N 3.45Å; W583-F586 HydrophobicContact CE3-CD1 4.48Å; W583-F586 HydrophobicContact CZ3-CD1 4.37Å; W583-F586 PolarHBondContact O-N 2.82Å; F586-G590 PolarHBondContact O-N 2.04Å; F586-F631 HydrophobicContact CD1-CZ 4.28Å; F586-F631 HydrophobicContact CE1-CD1 4.34Å; F586-F631 AromaticContact CE1-CE1 3.57Å; F586-F631 HydrophobicContact CE1-CE1 3.57Å; F586-F631 HydrophobicContact CE1-CE2 4.38Å; F586-F631 AromaticContact CE1-CZ 3.59Å; F586-F631 HydrophobicContact CE1-CZ 3.59Å; F586-F631 HydrophobicContact CZ-CE1 4.19Å; F586-L632 HydrophobicContact CZ-CD2 4.32Å; F586-G635 WeakPolarHBondContact CD2-O 3.44Å; F586-G635 WeakPolarHBondContact O-CA 3.12Å; F586-F639 HydrophobicContact CB-CB 4.18Å; F586-F639 HydrophobicContact CB-CD2 4.44Å; F586-F639 HydrophobicContact CD2-CB 4.12Å
587	L	95.8	Very high	94.4	Very high	61 Å²	61	28.3 Å²	28.3	32%	0.319	12%	0.121	S	C	.	.	H	α-helix	trans	-69.5	-36.8	-177.6	-69.8	173.3	0	0	0	112.5	T517 W583 R584 S589 G590 F591 F631	T517-L587 HydrophobicContact CG2-CB 4Å; T517-L587 WeakPolarHBondContact CG2-O 3.24Å; W583-L587 WeakPolarHBondContact O-CB 3.18Å; W583-L587 VanDerWaalsContact O-CG 3.29Å; W583-L587 WeakPolarHBondContact O-CG 3.44Å; W583-L587 PolarHBondContact O-N 3.11Å; R584-L587 PolarHBondContact O-N 2.89Å; L587-S589 VanDerWaalsContact C-N 3.31Å; L587-S589 PolarHBondContact O-N 2.94Å; L587-G590 PolarHBondContact O-N 2.58Å; L587-F591 WeakPolarHBondContact O-CB 3.26Å; L587-F591 PolarHBondContact O-N 2.96Å; L587-F631 HydrophobicContact CD2-CE2 4.1Å; L587-F631 HydrophobicContact CD2-CZ 3.9Å
588	S	92.3	Very high	94.8	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-55.1	-46.9	-178.9	58.9	0	0	0	0	112.2	A520 R584 A585	A520-S588 VanDerWaalsContact CB-O 3.29Å; A520-S588 WeakPolarHBondContact CB-O 3.3Å; R584-S588 VanDerWaalsContact O-CB 3.28Å; R584-S588 WeakPolarHBondContact O-CB 3.36Å; R584-S588 PolarHBondContact O-N 2.89Å; R584-S588 PolarHBondContact O-OG 2.8Å; A585-S588 PolarHBondContact O-OG 3.47Å
589	S	94.8	Very high	95	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-83.9	-38.5	178.8	-59.4	0	0	0	0	111.5	L562 S566 L587 F591 T592 C634 G638	L562-S589 PolarHBondContact O-OG 3.39Å; S566-S589 WeakPolarHBondContact CB-OG 3.47Å; L587-S589 VanDerWaalsContact C-N 3.31Å; L587-S589 PolarHBondContact O-N 2.94Å; S589-F591 PolarHBondContact O-N 2.73Å; S589-T592 VanDerWaalsContact O-CB 3.29Å; S589-T592 WeakPolarHBondContact O-CB 3.37Å; S589-T592 PolarHBondContact O-N 2.9Å; S589-T592 PolarHBondContact O-OG1 2.98Å; S589-C634 WeakPolarHBondContact CB-O 3.01Å; S589-C634 VanDerWaalsContact O-CB 3.29Å; S589-C634 WeakPolarHBondContact O-CB 3.05Å; S589-G638 VanDerWaalsContact OG-CA 3.3Å; S589-G638 WeakPolarHBondContact OG-CA 3.37Å
590	G	95.6	Very high	95.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58	-36	177.2	0	0	0	0	0	112.9	F586 L587 T592 A593 F631	F586-G590 PolarHBondContact O-N 2.04Å; L587-G590 PolarHBondContact O-N 2.58Å; G590-T592 PolarHBondContact O-N 2.02Å; G590-T592 VanDerWaalsContact O-N 3.08Å; G590-A593 VanDerWaalsContact O-CB 3.23Å; G590-A593 WeakPolarHBondContact O-CB 3.34Å; G590-A593 PolarHBondContact O-N 3.07Å; G590-F631 VanDerWaalsContact O-CD2 3.27Å; G590-F631 WeakPolarHBondContact O-CD2 3.37Å
591	F	94.8	Very high	95.1	Very high	39 Å²	39	25 Å²	25	17%	0.171	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-8.6	-178.4	-150.1	-99.7	0	0	0	114.2	T517 F518 L587 S589 A593 F594 Y595	T517-F591 HydrophobicContact CG2-CB 3.58Å; T517-F591 HydrophobicContact CG2-CD1 4.43Å; T517-F591 HydrophobicContact CG2-CD2 4.05Å; T517-F591 HydrophobicContact CG2-CG 3.77Å; F518-F591 HydrophobicContact CB-CE1 4.49Å; F518-F591 HydrophobicContact CD1-CD1 4.17Å; F518-F591 AromaticContact CD1-CE1 3.21Å; F518-F591 HydrophobicContact CD1-CE1 3.21Å; F518-F591 AromaticContact CD1-CZ 3.77Å; F518-F591 HydrophobicContact CD1-CZ 3.77Å; F518-F591 HydrophobicContact CD2-CE1 4.25Å; F518-F591 HydrophobicContact CD2-CZ 4.4Å; F518-F591 AromaticContact CE1-CE1 3.24Å; F518-F591 HydrophobicContact CE1-CE1 3.24Å; F518-F591 AromaticContact CE1-CZ 3.28Å; F518-F591 HydrophobicContact CE1-CZ 3.28Å; F518-F591 HydrophobicContact CE2-CE1 4.27Å; F518-F591 AromaticContact CE2-CZ 3.98Å; F518-F591 HydrophobicContact CE2-CZ 3.98Å; F518-F591 HydrophobicContact CG-CD1 4.4Å; F518-F591 AromaticContact CG-CE1 3.74Å; F518-F591 HydrophobicContact CG-CE1 3.74Å; F518-F591 HydrophobicContact CG-CZ 4.29Å; F518-F591 AromaticContact CZ-CE1 3.79Å; F518-F591 HydrophobicContact CZ-CE1 3.79Å; F518-F591 HydrophobicContact CZ-CE2 4.39Å; F518-F591 AromaticContact CZ-CZ 3.39Å; F518-F591 HydrophobicContact CZ-CZ 3.39Å; L587-F591 WeakPolarHBondContact O-CB 3.26Å; L587-F591 PolarHBondContact O-N 2.96Å; S589-F591 PolarHBondContact O-N 2.73Å; F591-A593 PolarHBondContact O-N 3.09Å; F591-A593 VanDerWaalsContact O-N 3.15Å; F591-F594 HydrophobicContact CD1-CB 3.74Å; F591-F594 HydrophobicContact CD1-CD1 4.16Å; F591-F594 HydrophobicContact CD1-CG 4.17Å; F591-F594 HydrophobicContact CD2-CB 4.1Å; F591-F594 HydrophobicContact CE1-CB 3.46Å; F591-F594 VanDerWaalsContact CE1-CB 3.46Å; F591-F594 AromaticContact CE1-CD1 3.28Å; F591-F594 HydrophobicContact CE1-CD1 3.28Å; F591-F594 HydrophobicContact CE1-CD2 4.22Å; F591-F594 HydrophobicContact CE1-CE1 4.03Å; F591-F594 AromaticContact CE1-CG 3.39Å; F591-F594 HydrophobicContact CE1-CG 3.39Å; F591-F594 HydrophobicContact CE2-CB 3.88Å; F591-F594 HydrophobicContact CE2-CD2 4.31Å; F591-F594 HydrophobicContact CE2-CG 4.07Å; F591-F594 HydrophobicContact CG-CB 4.03Å; F591-F594 HydrophobicContact CZ-CB 3.55Å; F591-F594 AromaticContact CZ-CD1 3.63Å; F591-F594 HydrophobicContact CZ-CD1 3.63Å; F591-F594 AromaticContact CZ-CD2 3.71Å; F591-F594 HydrophobicContact CZ-CD2 3.71Å; F591-F594 HydrophobicContact CZ-CE1 4.22Å; F591-F594 HydrophobicContact CZ-CE2 4.3Å; F591-F594 AromaticContact CZ-CG 3.33Å; F591-F594 HydrophobicContact CZ-CG 3.33Å; F591-F594 VanDerWaalsContact O-CB 3.27Å; F591-F594 WeakPolarHBondContact O-CB 3.36Å; F591-F594 PolarHBondContact O-N 3.01Å; F591-Y595 HydrophobicContact CD1-CE2 4.36Å
592	T	95.3	Very high	95.1	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-52.1	-33	162.9	-48.7	0	0	0	0	111.4	P524 F525 S589 G590 F594 Y595 L596 F630	P524-T592 HydrophobicContact CB-CG2 3.8Å; F525-T592 HydrophobicContact CB-CG2 4.03Å; S589-T592 VanDerWaalsContact O-CB 3.29Å; S589-T592 WeakPolarHBondContact O-CB 3.37Å; S589-T592 PolarHBondContact O-N 2.9Å; S589-T592 PolarHBondContact O-OG1 2.98Å; G590-T592 PolarHBondContact O-N 2.02Å; G590-T592 VanDerWaalsContact O-N 3.08Å; T592-F594 VanDerWaalsContact C-N 3.27Å; T592-F594 PolarHBondContact O-N 3.23Å; T592-Y595 PolarHBondContact O-N 3.32Å; T592-L596 PolarHBondContact O-N 3.49Å; T592-F630 HydrophobicContact CG2-CE1 3.89Å; T592-F630 HydrophobicContact CG2-CZ 4.47Å
593	A	96.5	Very high	94.9	Very high	2 Å²	2	30.9 Å²	30.9	2%	0.017	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-24.1	176.3	0	0	0	0	0	113.9	G590 F591 L596 F597 V627 F630 F631	G590-A593 VanDerWaalsContact O-CB 3.23Å; G590-A593 WeakPolarHBondContact O-CB 3.34Å; G590-A593 PolarHBondContact O-N 3.07Å; F591-A593 PolarHBondContact O-N 3.09Å; F591-A593 VanDerWaalsContact O-N 3.15Å; A593-L596 WeakPolarHBondContact O-CB 3.1Å; A593-L596 PolarHBondContact O-N 2.94Å; A593-F597 PolarHBondContact O-N 2.93Å; A593-V627 HydrophobicContact CB-CG1 4.04Å; A593-V627 WeakPolarHBondContact O-CG1 3.33Å; A593-F630 HydrophobicContact CB-CD1 3.9Å; A593-F631 HydrophobicContact CB-CB 3.68Å; A593-F631 HydrophobicContact CB-CD2 4.47Å
594	F	95.6	Very high	94.7	Very high	71 Å²	71	28.8 Å²	28.8	31%	0.311	13%	0.13	S	C	.	.	H	α-helix	trans	-66.7	-42.1	173.4	174	-98	0	0	0	111.4	F518 F591 T592 L596 F597 L598	F518-F594 HydrophobicContact CD1-CD1 4.47Å; F518-F594 HydrophobicContact CD1-CE1 4.23Å; F518-F594 HydrophobicContact CE1-CD1 4.12Å; F518-F594 AromaticContact CE1-CE1 3.68Å; F518-F594 HydrophobicContact CE1-CE1 3.68Å; F518-F594 HydrophobicContact CE1-CZ 4.01Å; F591-F594 HydrophobicContact CD1-CB 3.74Å; F591-F594 HydrophobicContact CD1-CD1 4.16Å; F591-F594 HydrophobicContact CD1-CG 4.17Å; F591-F594 HydrophobicContact CD2-CB 4.1Å; F591-F594 HydrophobicContact CE1-CB 3.46Å; F591-F594 VanDerWaalsContact CE1-CB 3.46Å; F591-F594 AromaticContact CE1-CD1 3.28Å; F591-F594 HydrophobicContact CE1-CD1 3.28Å; F591-F594 HydrophobicContact CE1-CD2 4.22Å; F591-F594 HydrophobicContact CE1-CE1 4.03Å; F591-F594 AromaticContact CE1-CG 3.39Å; F591-F594 HydrophobicContact CE1-CG 3.39Å; F591-F594 HydrophobicContact CE2-CB 3.88Å; F591-F594 HydrophobicContact CE2-CD2 4.31Å; F591-F594 HydrophobicContact CE2-CG 4.07Å; F591-F594 HydrophobicContact CG-CB 4.03Å; F591-F594 HydrophobicContact CZ-CB 3.55Å; F591-F594 AromaticContact CZ-CD1 3.63Å; F591-F594 HydrophobicContact CZ-CD1 3.63Å; F591-F594 AromaticContact CZ-CD2 3.71Å; F591-F594 HydrophobicContact CZ-CD2 3.71Å; F591-F594 HydrophobicContact CZ-CE1 4.22Å; F591-F594 HydrophobicContact CZ-CE2 4.3Å; F591-F594 AromaticContact CZ-CG 3.33Å; F591-F594 HydrophobicContact CZ-CG 3.33Å; F591-F594 VanDerWaalsContact O-CB 3.27Å; F591-F594 WeakPolarHBondContact O-CB 3.36Å; F591-F594 PolarHBondContact O-N 3.01Å; T592-F594 VanDerWaalsContact C-N 3.27Å; T592-F594 PolarHBondContact O-N 3.23Å; F594-L596 VanDerWaalsContact C-N 3.29Å; F594-L596 PolarHBondContact O-N 3.45Å; F594-F597 WeakPolarHBondContact O-CB 3.35Å; F594-F597 PolarHBondContact O-N 2.76Å; F594-F597 VanDerWaalsContact O-N 3.13Å; F594-L598 HydrophobicContact CD1-CD1 4.09Å; F594-L598 HydrophobicContact CD1-CG 4.4Å; F594-L598 HydrophobicContact CE1-CD1 3.46Å; F594-L598 VanDerWaalsContact CE1-CD1 3.46Å; F594-L598 HydrophobicContact CE1-CG 3.97Å; F594-L598 HydrophobicContact CZ-CD1 3.93Å; F594-L598 HydrophobicContact CZ-CD2 4.18Å; F594-L598 HydrophobicContact CZ-CG 4.1Å; F594-L598 PolarHBondContact O-N 3.11Å
595	Y	95.3	Very high	94.6	Very high	44 Å²	44	34.6 Å²	34.6	17%	0.173	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-36.5	174.3	-68.1	-76	0	0	0	112.1	F518 G521 V522 F525 F591 T592 F597 L598 Y599	F518-Y595 WeakPolarHBondContact O-CE2 3.24Å; F518-Y595 PolarHBondContact O-OH 3.43Å; G521-Y595 VanDerWaalsContact C-CE2 3.46Å; V522-Y595 HydrophobicContact CG2-CE1 3.99Å; V522-Y595 HydrophobicContact CG2-CE2 3.99Å; V522-Y595 VanDerWaalsContact CG2-CZ 3.45Å; V522-Y595 WeakPolarHBondContact CG2-OH 3.43Å; F525-Y595 HydrophobicContact CB-CD2 4.48Å; F525-Y595 HydrophobicContact CB-CG 4.25Å; F525-Y595 HydrophobicContact CD1-CG 4.41Å; F525-Y595 VanDerWaalsContact CG-CB 3.42Å; F525-Y595 HydrophobicContact CG-CG 4.22Å; F591-Y595 HydrophobicContact CD1-CE2 4.36Å; T592-Y595 PolarHBondContact O-N 3.32Å; Y595-F597 VanDerWaalsContact C-N 3.32Å; Y595-F597 PolarHBondContact O-N 3.08Å; Y595-L598 PolarHBondContact O-N 3.48Å; Y595-Y599 WeakPolarHBondContact O-CB 3.42Å; Y595-Y599 PolarHBondContact O-N 3.28Å
596	L	95.5	Very high	94.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-39.5	171.4	178.3	62.1	0	0	0	112.4	M532 F536 T592 A593 F594 Y599 S600 F626 V627 F630	M532-L596 HydrophobicContact CE-CD1 3.98Å; M532-L596 HydrophobicContact CG-CD1 3.55Å; M532-L596 HydrophobicContact SD-CD1 3.37Å; M532-L596 WeakPolarHBondContact SD-CD1 3.2Å; F536-L596 HydrophobicContact CE2-CD1 3.81Å; F536-L596 HydrophobicContact CZ-CD1 4.29Å; T592-L596 PolarHBondContact O-N 3.49Å; A593-L596 WeakPolarHBondContact O-CB 3.1Å; A593-L596 PolarHBondContact O-N 2.94Å; F594-L596 VanDerWaalsContact C-N 3.29Å; F594-L596 PolarHBondContact O-N 3.45Å; L596-Y599 WeakPolarHBondContact O-CB 3.26Å; L596-Y599 PolarHBondContact O-N 2.94Å; L596-S600 PolarHBondContact O-N 3.29Å; L596-F626 HydrophobicContact CD1-CE1 4.12Å; L596-F626 HydrophobicContact CD2-CD1 3.88Å; L596-F626 HydrophobicContact CD2-CE1 3.58Å; L596-F626 HydrophobicContact CD2-CZ 4.43Å; L596-F626 HydrophobicContact CG-CD1 4.5Å; L596-F626 HydrophobicContact CG-CE1 4.28Å; L596-V627 HydrophobicContact CD2-CG2 4.22Å; L596-V627 HydrophobicContact CG-CG2 4.11Å; L596-F630 HydrophobicContact CD2-CB 3.93Å; L596-F630 HydrophobicContact CD2-CD1 3.62Å; L596-F630 HydrophobicContact CD2-CE1 4.27Å; L596-F630 HydrophobicContact CD2-CG 3.78Å
597	F	96	Very high	93.7	Very high	65 Å²	65	42.7 Å²	42.7	29%	0.285	20%	0.201	S	C	.	.	H	α-helix	trans	-65	-45.8	174.2	-178.7	-109.6	0	0	0	111.9	A593 F594 Y595 Y599 S600 I601 I624 V627	A593-F597 PolarHBondContact O-N 2.93Å; F594-F597 WeakPolarHBondContact O-CB 3.35Å; F594-F597 PolarHBondContact O-N 2.76Å; F594-F597 VanDerWaalsContact O-N 3.13Å; Y595-F597 VanDerWaalsContact C-N 3.32Å; Y595-F597 PolarHBondContact O-N 3.08Å; F597-Y599 VanDerWaalsContact C-N 3.27Å; F597-Y599 PolarHBondContact O-N 3.4Å; F597-S600 WeakPolarHBondContact O-CB 3.25Å; F597-S600 PolarHBondContact O-N 3.45Å; F597-S600 VanDerWaalsContact O-N 3.07Å; F597-S600 PolarHBondContact O-OG 3.38Å; F597-I601 HydrophobicContact CD1-CD1 4.11Å; F597-I601 HydrophobicContact CE1-CD1 3.68Å; F597-I601 HydrophobicContact CZ-CD1 4.06Å; F597-I601 PolarHBondContact O-N 3.2Å; F597-I601 VanDerWaalsContact O-N 3.13Å; F597-I624 HydrophobicContact CE2-CG1 4.33Å; F597-V627 HydrophobicContact CB-CG1 4.19Å; F597-V627 HydrophobicContact CB-CG2 3.92Å; F597-V627 HydrophobicContact CD2-CG2 4.33Å
598	L	95.6	Very high	93.3	Very high	79 Å²	79	40.6 Å²	40.6	41%	0.414	19%	0.19	S	C	.	.	H	α-helix	trans	-58.7	-40.4	173.7	-68.1	-178	0	0	0	112.1	F594 Y595 S600 I601 Y602	F594-L598 HydrophobicContact CD1-CD1 4.09Å; F594-L598 HydrophobicContact CD1-CG 4.4Å; F594-L598 HydrophobicContact CE1-CD1 3.46Å; F594-L598 VanDerWaalsContact CE1-CD1 3.46Å; F594-L598 HydrophobicContact CE1-CG 3.97Å; F594-L598 HydrophobicContact CZ-CD1 3.93Å; F594-L598 HydrophobicContact CZ-CD2 4.18Å; F594-L598 HydrophobicContact CZ-CG 4.1Å; F594-L598 PolarHBondContact O-N 3.11Å; Y595-L598 PolarHBondContact O-N 3.48Å; L598-S600 VanDerWaalsContact C-N 3.33Å; L598-S600 PolarHBondContact O-N 2.93Å; L598-I601 PolarHBondContact O-N 2.99Å; L598-Y602 PolarHBondContact O-N 3.48Å
599	Y	94.7	Very high	92.7	Very high	12 Å²	12	44.3 Å²	44.3	5%	0.047	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-39.4	174.5	-176.9	-100.2	0	0	0	112.3	F525 Y529 M532 F533 F536 Y595 L596 F597 I601 Y602 F603	F525-Y599 HydrophobicContact CZ-CD2 4.25Å; F525-Y599 HydrophobicContact CZ-CG 4.18Å; Y529-Y599 HydrophobicContact CD2-CD2 4.31Å; Y529-Y599 HydrophobicContact CD2-CE2 4.19Å; Y529-Y599 AromaticContact CE2-CD2 3.85Å; Y529-Y599 HydrophobicContact CE2-CD2 3.85Å; Y529-Y599 AromaticContact CE2-CE2 3.54Å; Y529-Y599 HydrophobicContact CE2-CE2 3.54Å; M532-Y599 HydrophobicContact CG-CD1 4.12Å; M532-Y599 HydrophobicContact CG-CE1 4.16Å; F533-Y599 VanDerWaalsContact CA-OH 3.31Å; F533-Y599 WeakPolarHBondContact CA-OH 3.4Å; F533-Y599 WeakPolarHBondContact CB-OH 3.45Å; F533-Y599 WeakPolarHBondContact CD2-OH 3.26Å; F536-Y599 AromaticContact CD2-CD1 3.9Å; F536-Y599 HydrophobicContact CD2-CD1 3.9Å; F536-Y599 AromaticContact CD2-CE1 3.57Å; F536-Y599 HydrophobicContact CD2-CE1 3.57Å; F536-Y599 AromaticContact CE2-CD1 3.64Å; F536-Y599 HydrophobicContact CE2-CD1 3.64Å; F536-Y599 AromaticContact CE2-CE1 3.84Å; F536-Y599 HydrophobicContact CE2-CE1 3.84Å; F536-Y599 HydrophobicContact CG-CE1 4.07Å; F536-Y599 HydrophobicContact CZ-CD1 4.21Å; Y595-Y599 WeakPolarHBondContact O-CB 3.42Å; Y595-Y599 PolarHBondContact O-N 3.28Å; L596-Y599 WeakPolarHBondContact O-CB 3.26Å; L596-Y599 PolarHBondContact O-N 2.94Å; F597-Y599 VanDerWaalsContact C-N 3.27Å; F597-Y599 PolarHBondContact O-N 3.4Å; Y599-I601 VanDerWaalsContact C-N 3.28Å; Y599-I601 PolarHBondContact O-N 3.42Å; Y599-Y602 HydrophobicContact CD2-CD1 4.15Å; Y599-Y602 HydrophobicContact CE2-CD1 4.05Å; Y599-Y602 HydrophobicContact CE2-CE1 4.38Å; Y599-Y602 PolarHBondContact O-N 3.39Å; Y599-F603 HydrophobicContact CE1-CB 4.43Å; Y599-F603 HydrophobicContact CE1-CD2 4.36Å; Y599-F603 WeakPolarHBondContact O-CB 3.17Å; Y599-F603 PolarHBondContact O-N 2.81Å
600	S	93.9	Very high	92	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.007	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-34.6	175.8	77.4	0	0	0	0	112.6	L596 F597 L598 F604 Y619	L596-S600 PolarHBondContact O-N 3.29Å; F597-S600 WeakPolarHBondContact O-CB 3.25Å; F597-S600 PolarHBondContact O-N 3.45Å; F597-S600 VanDerWaalsContact O-N 3.07Å; F597-S600 PolarHBondContact O-OG 3.38Å; L598-S600 VanDerWaalsContact C-N 3.33Å; L598-S600 PolarHBondContact O-N 2.93Å; S600-F604 PolarHBondContact O-N 3.38Å; S600-F604 VanDerWaalsContact O-N 3.14Å; S600-Y619 WeakPolarHBondContact O-CE1 3.22Å; S600-Y619 PolarHBondContact O-OH 2.79Å
601	I	94.5	Very high	91.2	Very high	53 Å²	53	52.5 Å²	52.5	27%	0.272	26%	0.256	S	S	.	.	H	α-helix	trans	-67.7	-48.9	173.4	-64.3	167	0	0	0	110	F597 L598 Y599 F603 F604 F605 F620	F597-I601 HydrophobicContact CD1-CD1 4.11Å; F597-I601 HydrophobicContact CE1-CD1 3.68Å; F597-I601 HydrophobicContact CZ-CD1 4.06Å; F597-I601 PolarHBondContact O-N 3.2Å; F597-I601 VanDerWaalsContact O-N 3.13Å; L598-I601 PolarHBondContact O-N 2.99Å; Y599-I601 VanDerWaalsContact C-N 3.28Å; Y599-I601 PolarHBondContact O-N 3.42Å; I601-F603 VanDerWaalsContact C-N 3.34Å; I601-F603 PolarHBondContact O-N 2.9Å; I601-F604 WeakPolarHBondContact O-CB 3.37Å; I601-F604 PolarHBondContact O-N 3.41Å; I601-F605 HydrophobicContact CG2-CD2 3.91Å; I601-F605 HydrophobicContact CG2-CE2 3.79Å; I601-F605 VanDerWaalsContact O-CD2 3.3Å; I601-F605 WeakPolarHBondContact O-CD2 3.48Å; I601-F605 PolarHBondContact O-N 3.19Å; I601-F620 HydrophobicContact CG1-CE1 3.78Å; I601-F620 HydrophobicContact CG1-CZ 4.33Å
602	Y	93.8	Very high	90.7	Very high	127 Å²	127	53.2 Å²	53.2	50%	0.498	27%	0.266	S	S	.	.	H	α-helix	trans	-56.8	-47.3	176.9	166	-99.5	0	0	0	111.8	L598 Y599 F604 F605 A606	L598-Y602 PolarHBondContact O-N 3.48Å; Y599-Y602 HydrophobicContact CD2-CD1 4.15Å; Y599-Y602 HydrophobicContact CE2-CD1 4.05Å; Y599-Y602 HydrophobicContact CE2-CE1 4.38Å; Y599-Y602 PolarHBondContact O-N 3.39Å; Y602-F604 VanDerWaalsContact C-N 3.3Å; Y602-F604 PolarHBondContact O-N 3.25Å; Y602-F605 PolarHBondContact O-N 3.46Å; Y602-A606 HydrophobicContact CD2-CB 4.2Å; Y602-A606 HydrophobicContact CE1-CB 4.26Å; Y602-A606 HydrophobicContact CE2-CB 3.77Å; Y602-A606 WeakPolarHBondContact O-CB 3.4Å; Y602-A606 PolarHBondContact O-N 3.13Å
603	F	92	Very high	90.4	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.009	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-38.9	-179.3	-171.4	-91.4	0	0	0	111.9	F536 N537 W540 Y599 I601 K607 L608	F536-F603 HydrophobicContact CB-CD1 4.27Å; F536-F603 HydrophobicContact CB-CD2 4.03Å; F536-F603 HydrophobicContact CB-CE1 4.05Å; F536-F603 HydrophobicContact CB-CE2 3.8Å; F536-F603 HydrophobicContact CB-CG 4.26Å; F536-F603 HydrophobicContact CB-CZ 3.82Å; F536-F603 HydrophobicContact CD1-CB 4.44Å; F536-F603 AromaticContact CD1-CD1 3.85Å; F536-F603 HydrophobicContact CD1-CD1 3.85Å; F536-F603 HydrophobicContact CD1-CE1 4.26Å; F536-F603 HydrophobicContact CD1-CG 4.06Å; F536-F603 HydrophobicContact CG-CD1 4.43Å; F536-F603 HydrophobicContact CG-CG 4.37Å; N537-F603 WeakPolarHBondContact OD1-CE2 3.48Å; N537-F603 VanDerWaalsContact OD1-CZ 3.32Å; N537-F603 WeakPolarHBondContact OD1-CZ 3.25Å; W540-F603 HydrophobicContact CB-CE1 4.29Å; Y599-F603 HydrophobicContact CE1-CB 4.43Å; Y599-F603 HydrophobicContact CE1-CD2 4.36Å; Y599-F603 WeakPolarHBondContact O-CB 3.17Å; Y599-F603 PolarHBondContact O-N 2.81Å; I601-F603 VanDerWaalsContact C-N 3.34Å; I601-F603 PolarHBondContact O-N 2.9Å; F603-K607 HydrophobicContact CD2-CB 4.28Å; F603-K607 HydrophobicContact CD2-CG 4.18Å; F603-K607 HydrophobicContact CE1-CB 4.41Å; F603-K607 HydrophobicContact CE2-CB 4.07Å; F603-K607 HydrophobicContact CE2-CG 4.07Å; F603-K607 HydrophobicContact CZ-CB 4.14Å; F603-K607 WeakPolarHBondContact O-CB 3.3Å; F603-K607 PolarHBondContact O-N 2.93Å; F603-L608 HydrophobicContact CD1-CD1 4.1Å; F603-L608 HydrophobicContact CD1-CG 4.04Å; F603-L608 HydrophobicContact CE1-CD1 4.16Å; F603-L608 HydrophobicContact CE1-CD2 3.9Å; F603-L608 HydrophobicContact CE1-CG 3.89Å; F603-L608 PolarHBondContact O-N 2.97Å
604	F	91.1	Very high	90.1	Very high	14 Å²	14	59.9 Å²	59.9	6%	0.061	31%	0.306	C	S	.	.	H	α-helix	trans	-58.6	-52.8	175.5	-177	-94.6	0	0	0	111.7	S600 I601 Y602 L608 M610 F616 Y619 F620	S600-F604 PolarHBondContact O-N 3.38Å; S600-F604 VanDerWaalsContact O-N 3.14Å; I601-F604 WeakPolarHBondContact O-CB 3.37Å; I601-F604 PolarHBondContact O-N 3.41Å; Y602-F604 VanDerWaalsContact C-N 3.3Å; Y602-F604 PolarHBondContact O-N 3.25Å; F604-L608 HydrophobicContact CD2-CB 4.44Å; F604-L608 HydrophobicContact CD2-CD1 4.04Å; F604-L608 WeakPolarHBondContact O-CB 3.47Å; F604-L608 PolarHBondContact O-N 3.5Å; F604-L608 VanDerWaalsContact O-O 3.06Å; F604-M610 HydrophobicContact CE2-CB 3.97Å; F604-M610 HydrophobicContact CZ-CB 4.23Å; F604-F616 AromaticContact CE1-CD2 3.74Å; F604-F616 HydrophobicContact CE1-CD2 3.74Å; F604-F616 HydrophobicContact CE1-CE2 4.11Å; F604-F616 HydrophobicContact CE2-CD2 4.25Å; F604-F616 HydrophobicContact CZ-CB 4.4Å; F604-F616 AromaticContact CZ-CD2 3.56Å; F604-F616 HydrophobicContact CZ-CD2 3.56Å; F604-F616 HydrophobicContact CZ-CE2 4.37Å; F604-F616 HydrophobicContact CZ-CG 4.45Å; F604-Y619 HydrophobicContact CB-CD1 4.31Å; F604-Y619 HydrophobicContact CB-CE1 3.68Å; F604-Y619 AromaticContact CD2-CD1 3.6Å; F604-Y619 HydrophobicContact CD2-CD1 3.6Å; F604-Y619 HydrophobicContact CD2-CD2 4.48Å; F604-Y619 AromaticContact CD2-CE1 3.83Å; F604-Y619 HydrophobicContact CD2-CE1 3.83Å; F604-Y619 AromaticContact CD2-CG 3.95Å; F604-Y619 HydrophobicContact CD2-CG 3.95Å; F604-Y619 HydrophobicContact CE2-CD1 4.36Å; F604-Y619 HydrophobicContact CE2-CG 4.49Å; F604-Y619 HydrophobicContact CG-CD1 4.24Å; F604-Y619 HydrophobicContact CG-CE1 4.12Å; F604-F620 HydrophobicContact CB-CZ 4.31Å; F604-F620 HydrophobicContact CD1-CE2 4.31Å; F604-F620 HydrophobicContact CD1-CZ 4.47Å; F604-F620 HydrophobicContact CD2-CE2 4.35Å; F604-F620 HydrophobicContact CG-CE2 4.19Å; F604-F620 HydrophobicContact CG-CZ 4.25Å
605	F	91.3	Very high	89.8	Confident	150 Å²	150	56.5 Å²	56.5	66%	0.658	29%	0.291	S	S	*	.	H	α-helix	trans	-75.6	-32.2	-177	-70.1	-67.7	0	0	0	114.1	I601 Y602	I601-F605 HydrophobicContact CG2-CD2 3.91Å; I601-F605 HydrophobicContact CG2-CE2 3.79Å; I601-F605 VanDerWaalsContact O-CD2 3.3Å; I601-F605 WeakPolarHBondContact O-CD2 3.48Å; I601-F605 PolarHBondContact O-N 3.19Å; Y602-F605 PolarHBondContact O-N 3.46Å
606	A	89.8	Confident	89.6	Confident	51 Å²	51	58.7 Å²	58.7	42%	0.421	30%	0.302	S	S	.	.	H	α-helix	trans	-88.2	-26.1	-173.9	0	0	0	0	0	114	Y602	Y602-A606 HydrophobicContact CD2-CB 4.2Å; Y602-A606 HydrophobicContact CE1-CB 4.26Å; Y602-A606 HydrophobicContact CE2-CB 3.77Å; Y602-A606 WeakPolarHBondContact O-CB 3.4Å; Y602-A606 PolarHBondContact O-N 3.13Å
607	K	84.6	Confident	89.5	Confident	122 Å²	122	61.1 Å²	61.1	53%	0.53	32%	0.317	S	S	.	.	H	α-helix	trans	-127.6	-28.5	-171	-66.4	-64.3	-176	-176.4	0	114.6	F603	F603-K607 HydrophobicContact CD2-CB 4.28Å; F603-K607 HydrophobicContact CD2-CG 4.18Å; F603-K607 HydrophobicContact CE1-CB 4.41Å; F603-K607 HydrophobicContact CE2-CB 4.07Å; F603-K607 HydrophobicContact CE2-CG 4.07Å; F603-K607 HydrophobicContact CZ-CB 4.14Å; F603-K607 WeakPolarHBondContact O-CB 3.3Å; F603-K607 PolarHBondContact O-N 2.93Å
608	L	85.6	Confident	89.3	Confident	18 Å²	18	58 Å²	58	9%	0.094	30%	0.303	C	S	.	.			trans	-93.9	128.2	-179	-60.6	-179.8	0	0	0	110.6	W540 F603 F604 M610 Y619	W540-L608 HydrophobicContact CB-CD2 4.1Å; F603-L608 HydrophobicContact CD1-CD1 4.1Å; F603-L608 HydrophobicContact CD1-CG 4.04Å; F603-L608 HydrophobicContact CE1-CD1 4.16Å; F603-L608 HydrophobicContact CE1-CD2 3.9Å; F603-L608 HydrophobicContact CE1-CG 3.89Å; F603-L608 PolarHBondContact O-N 2.97Å; F604-L608 HydrophobicContact CD2-CB 4.44Å; F604-L608 HydrophobicContact CD2-CD1 4.04Å; F604-L608 WeakPolarHBondContact O-CB 3.47Å; F604-L608 PolarHBondContact O-N 3.5Å; F604-L608 VanDerWaalsContact O-O 3.06Å; L608-M610 HydrophobicContact CB-CG 3.82Å; L608-M610 PolarHBondContact O-N 3.03Å; L608-Y619 HydrophobicContact CD1-CD2 3.77Å; L608-Y619 HydrophobicContact CD1-CE2 3.47Å; L608-Y619 VanDerWaalsContact CD1-CE2 3.47Å
609	T	81.3	Confident	89.3	Confident	80 Å²	80	54.3 Å²	54.3	49%	0.491	28%	0.283	S	S	.	.			trans	-94.9	35.7	179	41.6	0	0	0	0	111.5	N58 N611	N58-T609 WeakPolarHBondContact OD1-CB 3.35Å; N58-T609 PolarHBondContact OD1-OG1 3.1Å; T609-N611 PolarHBondContact O-N 3.4Å
610	M	79.8	Confident	89.3	Confident	12 Å²	12	55.1 Å²	55.1	6%	0.059	29%	0.287	C	S	.	.			trans	-86.3	109.6	-169.9	-62	-92.2	174.8	0	0	110.9	K57 N58 S59 V60 F604 L608	K57-M610 WeakPolarHBondContact O-CE 3.32Å; N58-M610 VanDerWaalsContact O-SD 3.36Å; S59-M610 WeakPolarHBondContact CA-SD 3.37Å; S59-M610 PolarHBondContact N-SD 3.25Å; V60-M610 HydrophobicContact CG2-CE 4.03Å; V60-M610 HydrophobicContact CG2-SD 3.87Å; V60-M610 PolarHBondContact N-SD 3.49Å; F604-M610 HydrophobicContact CE2-CB 3.97Å; F604-M610 HydrophobicContact CZ-CB 4.23Å; L608-M610 HydrophobicContact CB-CG 3.82Å; L608-M610 PolarHBondContact O-N 3.03Å
611	N	77.9	Confident	89.3	Confident	161 Å²	161	55.8 Å²	55.8	86%	0.861	29%	0.292	S	S	*	.			trans	-96.7	-13.5	-177.5	-68.5	-13.6	0	0	0	114.5	T609	T609-N611 PolarHBondContact O-N 3.4Å
612	S	84.6	Confident	89.3	Confident	53 Å²	53	55.8 Å²	55.8	37%	0.371	29%	0.289	S	S	.	.			trans	-83.4	133.2	-175.3	-176.3	0	0	0	0	112.4	V614 S615 F616	S612-V614 PolarHBondContact O-N 3.3Å; S612-V614 PolarHBondContact OG-N 3.05Å; S612-S615 PolarHBondContact O-N 3.1Å; S612-S615 VanDerWaalsContact O-N 3.15Å; S612-F616 PolarHBondContact O-N 3.47Å
613	V	88.7	Confident	89.4	Confident	111 Å²	111	50 Å²	50	67%	0.673	27%	0.266	S	S	*	.	H	α-helix	trans	-56.3	-36.1	173.7	-179.5	0	0	0	0	111.5	F616 V617	V613-F616 WeakPolarHBondContact O-CB 3.31Å; V613-F616 PolarHBondContact O-N 2.98Å; V613-V617 HydrophobicContact CG1-CG2 4.48Å; V613-V617 WeakPolarHBondContact O-CG2 3.17Å; V613-V617 PolarHBondContact O-N 2.82Å
614	V	90.3	Very high	89.6	Confident	32 Å²	32	53.5 Å²	53.5	19%	0.194	29%	0.285	C	S	.	.	H	α-helix	trans	-67.5	-45.1	179.4	178.8	0	0	0	0	110.9	L61 I448 K452 S612 F616 V617 L618	L61-V614 HydrophobicContact CD2-CG1 4.48Å; I448-V614 HydrophobicContact CG2-CG1 3.67Å; K452-V614 HydrophobicContact CG-CG1 4.23Å; S612-V614 PolarHBondContact O-N 3.3Å; S612-V614 PolarHBondContact OG-N 3.05Å; V614-F616 VanDerWaalsContact C-N 3.3Å; V614-F616 PolarHBondContact O-N 2.91Å; V614-V617 PolarHBondContact O-N 2.98Å; V614-L618 HydrophobicContact CG1-CD1 3.87Å; V614-L618 HydrophobicContact CG1-CG 4.46Å; V614-L618 WeakPolarHBondContact O-CB 2.97Å; V614-L618 VanDerWaalsContact O-CG 3.29Å; V614-L618 WeakPolarHBondContact O-CG 3.37Å; V614-L618 PolarHBondContact O-N 2.62Å
615	S	89.4	Confident	89.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-37.1	175.9	-59.5	0	0	0	0	111.7	S59 V60 S612 Y619	S59-S615 PolarHBondContact OG-OG 3.44Å; S59-S615 VanDerWaalsContact OG-OG 3.13Å; V60-S615 PolarHBondContact N-OG 3.12Å; S612-S615 PolarHBondContact O-N 3.1Å; S612-S615 VanDerWaalsContact O-N 3.15Å; S615-Y619 VanDerWaalsContact O-CB 3.25Å; S615-Y619 WeakPolarHBondContact O-CB 3.45Å; S615-Y619 PolarHBondContact O-N 3.28Å
616	F	91.6	Very high	90.1	Very high	90 Å²	90	50 Å²	50	40%	0.395	27%	0.27	S	S	.	.	H	α-helix	trans	-58.7	-53.3	172.7	177.9	-86.5	0	0	0	111.7	F604 S612 V613 V614 L618 Y619 F620	F604-F616 AromaticContact CE1-CD2 3.74Å; F604-F616 HydrophobicContact CE1-CD2 3.74Å; F604-F616 HydrophobicContact CE1-CE2 4.11Å; F604-F616 HydrophobicContact CE2-CD2 4.25Å; F604-F616 HydrophobicContact CZ-CB 4.4Å; F604-F616 AromaticContact CZ-CD2 3.56Å; F604-F616 HydrophobicContact CZ-CD2 3.56Å; F604-F616 HydrophobicContact CZ-CE2 4.37Å; F604-F616 HydrophobicContact CZ-CG 4.45Å; S612-F616 PolarHBondContact O-N 3.47Å; V613-F616 WeakPolarHBondContact O-CB 3.31Å; V613-F616 PolarHBondContact O-N 2.98Å; V614-F616 VanDerWaalsContact C-N 3.3Å; V614-F616 PolarHBondContact O-N 2.91Å; F616-L618 PolarHBondContact O-N 3.14Å; F616-Y619 PolarHBondContact O-N 3.13Å; F616-F620 HydrophobicContact CD1-CD2 4.09Å; F616-F620 AromaticContact CD2-CD2 3.96Å; F616-F620 HydrophobicContact CD2-CD2 3.96Å; F616-F620 AromaticContact CD2-CE2 3.67Å; F616-F620 HydrophobicContact CD2-CE2 3.67Å; F616-F620 AromaticContact CE1-CD2 3.85Å; F616-F620 HydrophobicContact CE1-CD2 3.85Å; F616-F620 HydrophobicContact CE1-CE2 4.2Å; F616-F620 AromaticContact CE2-CD2 3.73Å; F616-F620 HydrophobicContact CE2-CD2 3.73Å; F616-F620 AromaticContact CE2-CE2 3.24Å; F616-F620 HydrophobicContact CE2-CE2 3.24Å; F616-F620 HydrophobicContact CE2-CZ 4.27Å; F616-F620 HydrophobicContact CG-CD2 4.13Å; F616-F620 HydrophobicContact CG-CE2 4.3Å; F616-F620 AromaticContact CZ-CD2 3.65Å; F616-F620 HydrophobicContact CZ-CD2 3.65Å; F616-F620 AromaticContact CZ-CE2 3.54Å; F616-F620 HydrophobicContact CZ-CE2 3.54Å; F616-F620 WeakPolarHBondContact O-CD2 3.15Å; F616-F620 PolarHBondContact O-N 2.99Å; F616-F620 VanDerWaalsContact O-N 3.09Å
617	V	93	Very high	90.4	Very high	51 Å²	51	48.6 Å²	48.6	31%	0.309	26%	0.256	S	S	.	.	H	α-helix	trans	-61.8	-43.8	-179.3	172.3	0	0	0	0	111.4	I448 V613 V614 S621	I448-V617 HydrophobicContact CD1-CG1 4Å; V613-V617 HydrophobicContact CG1-CG2 4.48Å; V613-V617 WeakPolarHBondContact O-CG2 3.17Å; V613-V617 PolarHBondContact O-N 2.82Å; V614-V617 PolarHBondContact O-N 2.98Å; V617-S621 VanDerWaalsContact O-CB 3.28Å; V617-S621 WeakPolarHBondContact O-CB 3.27Å; V617-S621 PolarHBondContact O-N 3.46Å; V617-S621 PolarHBondContact O-OG 3.41Å
618	L	93.1	Very high	91	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-46.5	178.4	-72.1	168	0	0	0	111.8	V60 L61 C445 I448 M449 V614 F616 F620 S621 Y622	V60-L618 HydrophobicContact CG1-CB 4.14Å; V60-L618 HydrophobicContact CG1-CD1 4.46Å; L61-L618 HydrophobicContact CD2-CD1 3.78Å; C445-L618 HydrophobicContact CB-CD2 4.04Å; I448-L618 HydrophobicContact CB-CD2 4.18Å; I448-L618 HydrophobicContact CG2-CD1 4.34Å; I448-L618 HydrophobicContact CG2-CD2 4.06Å; I448-L618 HydrophobicContact CG2-CG 4.21Å; M449-L618 HydrophobicContact CG-CD1 4.42Å; M449-L618 HydrophobicContact CG-CD2 4.02Å; M449-L618 HydrophobicContact SD-CD1 3.36Å; M449-L618 WeakPolarHBondContact SD-CD1 3.42Å; M449-L618 HydrophobicContact SD-CD2 4Å; M449-L618 HydrophobicContact SD-CG 4.33Å; V614-L618 HydrophobicContact CG1-CD1 3.87Å; V614-L618 HydrophobicContact CG1-CG 4.46Å; V614-L618 WeakPolarHBondContact O-CB 2.97Å; V614-L618 VanDerWaalsContact O-CG 3.29Å; V614-L618 WeakPolarHBondContact O-CG 3.37Å; V614-L618 PolarHBondContact O-N 2.62Å; F616-L618 PolarHBondContact O-N 3.14Å; L618-F620 PolarHBondContact O-N 2.75Å; L618-S621 PolarHBondContact O-N 3.4Å; L618-Y622 HydrophobicContact CD2-CE2 4.46Å; L618-Y622 WeakPolarHBondContact O-CD2 3.33Å; L618-Y622 PolarHBondContact O-N 2.96Å
619	Y	93.7	Very high	91.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-55.7	-53.5	178	173.9	-95.2	0	0	0	111.5	W540 S600 F604 L608 S615 F616 S621 Y622 C623	W540-Y619 AromaticContact CD1-CE2 3.9Å; W540-Y619 AromaticContact CD2-CD2 3.71Å; W540-Y619 HydrophobicContact CD2-CD2 3.71Å; W540-Y619 AromaticContact CD2-CE2 3.8Å; W540-Y619 HydrophobicContact CD2-CE2 3.8Å; W540-Y619 AromaticContact CE2-CD2 3.46Å; W540-Y619 VanDerWaalsContact CE2-CD2 3.46Å; W540-Y619 AromaticContact CE2-CE2 3.4Å; W540-Y619 VanDerWaalsContact CE2-CE2 3.4Å; W540-Y619 AromaticContact CE3-CD2 3.92Å; W540-Y619 HydrophobicContact CE3-CD2 3.92Å; W540-Y619 HydrophobicContact CE3-CE2 4.46Å; W540-Y619 HydrophobicContact CG-CD2 4.41Å; W540-Y619 HydrophobicContact CG-CE2 4.09Å; W540-Y619 AromaticContact CH2-CD2 3.69Å; W540-Y619 HydrophobicContact CH2-CD2 3.69Å; W540-Y619 HydrophobicContact CH2-CE2 4.44Å; W540-Y619 HydrophobicContact CH2-CG 4.39Å; W540-Y619 AromaticContact CZ2-CD2 3.46Å; W540-Y619 HydrophobicContact CZ2-CD2 3.46Å; W540-Y619 VanDerWaalsContact CZ2-CD2 3.46Å; W540-Y619 AromaticContact CZ2-CE2 3.77Å; W540-Y619 HydrophobicContact CZ2-CE2 3.77Å; W540-Y619 HydrophobicContact CZ2-CG 4.35Å; W540-Y619 AromaticContact CZ3-CD2 3.91Å; W540-Y619 HydrophobicContact CZ3-CD2 3.91Å; W540-Y619 AromaticContact NE1-CE2 3.47Å; S600-Y619 WeakPolarHBondContact O-CE1 3.22Å; S600-Y619 PolarHBondContact O-OH 2.79Å; F604-Y619 HydrophobicContact CB-CD1 4.31Å; F604-Y619 HydrophobicContact CB-CE1 3.68Å; F604-Y619 AromaticContact CD2-CD1 3.6Å; F604-Y619 HydrophobicContact CD2-CD1 3.6Å; F604-Y619 HydrophobicContact CD2-CD2 4.48Å; F604-Y619 AromaticContact CD2-CE1 3.83Å; F604-Y619 HydrophobicContact CD2-CE1 3.83Å; F604-Y619 AromaticContact CD2-CG 3.95Å; F604-Y619 HydrophobicContact CD2-CG 3.95Å; F604-Y619 HydrophobicContact CE2-CD1 4.36Å; F604-Y619 HydrophobicContact CE2-CG 4.49Å; F604-Y619 HydrophobicContact CG-CD1 4.24Å; F604-Y619 HydrophobicContact CG-CE1 4.12Å; L608-Y619 HydrophobicContact CD1-CD2 3.77Å; L608-Y619 HydrophobicContact CD1-CE2 3.47Å; L608-Y619 VanDerWaalsContact CD1-CE2 3.47Å; S615-Y619 VanDerWaalsContact O-CB 3.25Å; S615-Y619 WeakPolarHBondContact O-CB 3.45Å; S615-Y619 PolarHBondContact O-N 3.28Å; F616-Y619 PolarHBondContact O-N 3.13Å; Y619-S621 VanDerWaalsContact C-N 3.32Å; Y619-S621 PolarHBondContact O-N 2.79Å; Y619-Y622 PolarHBondContact O-N 3.36Å; Y619-C623 VanDerWaalsContact CZ-SG 3.56Å; Y619-C623 WeakPolarHBondContact O-CB 3.36Å; Y619-C623 PolarHBondContact O-N 3.33Å; Y619-C623 PolarHBondContact O-SG 3.44Å
620	F	95	Very high	92.3	Very high	30 Å²	30	43.3 Å²	43.3	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-67	-34.1	-178.7	-80.4	-69.8	0	0	0	112.5	I601 F604 F616 L618 C623 I624	I601-F620 HydrophobicContact CG1-CE1 3.78Å; I601-F620 HydrophobicContact CG1-CZ 4.33Å; F604-F620 HydrophobicContact CB-CZ 4.31Å; F604-F620 HydrophobicContact CD1-CE2 4.31Å; F604-F620 HydrophobicContact CD1-CZ 4.47Å; F604-F620 HydrophobicContact CD2-CE2 4.35Å; F604-F620 HydrophobicContact CG-CE2 4.19Å; F604-F620 HydrophobicContact CG-CZ 4.25Å; F616-F620 HydrophobicContact CD1-CD2 4.09Å; F616-F620 AromaticContact CD2-CD2 3.96Å; F616-F620 HydrophobicContact CD2-CD2 3.96Å; F616-F620 AromaticContact CD2-CE2 3.67Å; F616-F620 HydrophobicContact CD2-CE2 3.67Å; F616-F620 AromaticContact CE1-CD2 3.85Å; F616-F620 HydrophobicContact CE1-CD2 3.85Å; F616-F620 HydrophobicContact CE1-CE2 4.2Å; F616-F620 AromaticContact CE2-CD2 3.73Å; F616-F620 HydrophobicContact CE2-CD2 3.73Å; F616-F620 AromaticContact CE2-CE2 3.24Å; F616-F620 HydrophobicContact CE2-CE2 3.24Å; F616-F620 HydrophobicContact CE2-CZ 4.27Å; F616-F620 HydrophobicContact CG-CD2 4.13Å; F616-F620 HydrophobicContact CG-CE2 4.3Å; F616-F620 AromaticContact CZ-CD2 3.65Å; F616-F620 HydrophobicContact CZ-CD2 3.65Å; F616-F620 AromaticContact CZ-CE2 3.54Å; F616-F620 HydrophobicContact CZ-CE2 3.54Å; F616-F620 WeakPolarHBondContact O-CD2 3.15Å; F616-F620 PolarHBondContact O-N 2.99Å; F616-F620 VanDerWaalsContact O-N 3.09Å; L618-F620 PolarHBondContact O-N 2.75Å; F620-C623 PolarHBondContact O-N 2.76Å; F620-I624 WeakPolarHBondContact O-CB 3.49Å; F620-I624 WeakPolarHBondContact O-CD1 3.38Å; F620-I624 WeakPolarHBondContact O-CG1 3.01Å; F620-I624 PolarHBondContact O-N 2.95Å
621	S	94.6	Very high	93.2	Very high	14 Å²	14	44.8 Å²	44.8	10%	0.098	23%	0.234	C	C	.	.	H	α-helix	trans	-64.4	-46.2	176.2	-58.8	0	0	0	0	111.9	C445 V617 L618 Y619 I624 I625	C445-S621 WeakPolarHBondContact SG-CB 3.33Å; V617-S621 VanDerWaalsContact O-CB 3.28Å; V617-S621 WeakPolarHBondContact O-CB 3.27Å; V617-S621 PolarHBondContact O-N 3.46Å; V617-S621 PolarHBondContact O-OG 3.41Å; L618-S621 PolarHBondContact O-N 3.4Å; Y619-S621 VanDerWaalsContact C-N 3.32Å; Y619-S621 PolarHBondContact O-N 2.79Å; S621-I624 PolarHBondContact O-N 2.92Å; S621-I625 WeakPolarHBondContact O-CG1 3.26Å; S621-I625 PolarHBondContact O-N 3.08Å; S621-I625 VanDerWaalsContact O-N 3.12Å
622	Y	94.2	Very high	94.2	Very high	54 Å²	54	37.1 Å²	37.1	21%	0.212	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-39.1	174.3	-74.7	-60.2	0	0	0	112.5	F442 C445 W540 L618 Y619 I624 I625 F626	F442-Y622 HydrophobicContact CD2-CE1 4.36Å; C445-Y622 HydrophobicContact CB-CE1 4.3Å; C445-Y622 HydrophobicContact CB-CE2 4.39Å; W540-Y622 HydrophobicContact CH2-CD2 4.04Å; W540-Y622 HydrophobicContact CH2-CG 4.35Å; L618-Y622 HydrophobicContact CD2-CE2 4.46Å; L618-Y622 WeakPolarHBondContact O-CD2 3.33Å; L618-Y622 PolarHBondContact O-N 2.96Å; Y619-Y622 PolarHBondContact O-N 3.36Å; Y622-I624 VanDerWaalsContact C-N 3.35Å; Y622-I624 PolarHBondContact O-N 2.8Å; Y622-I625 HydrophobicContact CD1-CD1 4.37Å; Y622-I625 PolarHBondContact O-N 2.93Å; Y622-F626 WeakPolarHBondContact O-CB 3.47Å; Y622-F626 PolarHBondContact O-N 3.35Å
623	C	95.3	Very high	94.8	Very high	4 Å²	4	35 Å²	35	3%	0.027	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-40	174.9	-73.9	0	0	0	0	112	Y619 F620 F626 V627	Y619-C623 VanDerWaalsContact CZ-SG 3.56Å; Y619-C623 WeakPolarHBondContact O-CB 3.36Å; Y619-C623 PolarHBondContact O-N 3.33Å; Y619-C623 PolarHBondContact O-SG 3.44Å; F620-C623 PolarHBondContact O-N 2.76Å; C623-F626 PolarHBondContact O-N 2.96Å; C623-V627 WeakPolarHBondContact O-CB 3.39Å; C623-V627 WeakPolarHBondContact O-CG2 3.33Å; C623-V627 PolarHBondContact O-N 2.83Å
624	I	96.7	Very high	95.2	Very high	77 Å²	77	29.7 Å²	29.7	40%	0.395	15%	0.145	S	C	.	.	H	α-helix	trans	-63	-43.4	175.2	-72.6	164	0	0	0	110.9	L441 F597 F620 S621 Y622 F626 V627 F628	L441-I624 HydrophobicContact CD1-CG2 3.95Å; F597-I624 HydrophobicContact CE2-CG1 4.33Å; F620-I624 WeakPolarHBondContact O-CB 3.49Å; F620-I624 WeakPolarHBondContact O-CD1 3.38Å; F620-I624 WeakPolarHBondContact O-CG1 3.01Å; F620-I624 PolarHBondContact O-N 2.95Å; S621-I624 PolarHBondContact O-N 2.92Å; Y622-I624 VanDerWaalsContact C-N 3.35Å; Y622-I624 PolarHBondContact O-N 2.8Å; I624-F626 VanDerWaalsContact C-N 3.33Å; I624-F626 PolarHBondContact O-N 3.31Å; I624-V627 PolarHBondContact O-N 2.94Å; I624-F628 VanDerWaalsContact O-CB 3.3Å; I624-F628 WeakPolarHBondContact O-CB 3.05Å; I624-F628 PolarHBondContact O-N 3.48Å
625	I	96.7	Very high	95.6	Very high	17 Å²	17	28.1 Å²	28.1	9%	0.087	14%	0.136	C	C	.	.	H	α-helix	trans	-58.7	-48.5	174.9	-66	167.6	0	0	0	110	I438 L441 F442 S621 Y622 F628 I629	I438-I625 HydrophobicContact CG2-CG2 4.08Å; L441-I625 HydrophobicContact CB-CD1 3.73Å; L441-I625 HydrophobicContact CB-CG1 3.67Å; L441-I625 HydrophobicContact CD1-CG1 3.86Å; L441-I625 HydrophobicContact CG-CG1 4.44Å; F442-I625 HydrophobicContact CB-CD1 4.35Å; S621-I625 WeakPolarHBondContact O-CG1 3.26Å; S621-I625 PolarHBondContact O-N 3.08Å; S621-I625 VanDerWaalsContact O-N 3.12Å; Y622-I625 HydrophobicContact CD1-CD1 4.37Å; Y622-I625 PolarHBondContact O-N 2.93Å; I625-F628 PolarHBondContact O-N 2.95Å; I625-I629 HydrophobicContact CG2-CD1 3.83Å; I625-I629 WeakPolarHBondContact O-CG1 3.21Å; I625-I629 PolarHBondContact O-N 2.88Å
626	F	95.5	Very high	96	Very high	72 Å²	72	28.2 Å²	28.2	32%	0.316	14%	0.136	S	C	.	.	H	α-helix	trans	-62.6	-45.9	-179.2	-176.6	-117	0	0	0	112.3	M532 L596 Y622 C623 I624 F628 I629 F630	M532-F626 HydrophobicContact CE-CD1 4.43Å; M532-F626 HydrophobicContact CE-CE1 3.33Å; M532-F626 HydrophobicContact CE-CZ 3.68Å; M532-F626 HydrophobicContact SD-CE1 4.09Å; M532-F626 HydrophobicContact SD-CZ 4.38Å; L596-F626 HydrophobicContact CD1-CE1 4.12Å; L596-F626 HydrophobicContact CD2-CD1 3.88Å; L596-F626 HydrophobicContact CD2-CE1 3.58Å; L596-F626 HydrophobicContact CD2-CZ 4.43Å; L596-F626 HydrophobicContact CG-CD1 4.5Å; L596-F626 HydrophobicContact CG-CE1 4.28Å; Y622-F626 WeakPolarHBondContact O-CB 3.47Å; Y622-F626 PolarHBondContact O-N 3.35Å; C623-F626 PolarHBondContact O-N 2.96Å; I624-F626 VanDerWaalsContact C-N 3.33Å; I624-F626 PolarHBondContact O-N 3.31Å; F626-F628 VanDerWaalsContact C-N 3.35Å; F626-F628 PolarHBondContact O-N 2.92Å; F626-I629 PolarHBondContact O-N 3Å; F626-F630 WeakPolarHBondContact O-CB 3.37Å; F626-F630 PolarHBondContact O-N 3.21Å
627	V	97.4	Very high	96.3	Very high	23 Å²	23	24.5 Å²	24.5	14%	0.139	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-41.1	176.2	165.8	0	0	0	0	111.3	A593 L596 F597 C623 I624 F630 F631	A593-V627 HydrophobicContact CB-CG1 4.04Å; A593-V627 WeakPolarHBondContact O-CG1 3.33Å; L596-V627 HydrophobicContact CD2-CG2 4.22Å; L596-V627 HydrophobicContact CG-CG2 4.11Å; F597-V627 HydrophobicContact CB-CG1 4.19Å; F597-V627 HydrophobicContact CB-CG2 3.92Å; F597-V627 HydrophobicContact CD2-CG2 4.33Å; C623-V627 WeakPolarHBondContact O-CB 3.39Å; C623-V627 WeakPolarHBondContact O-CG2 3.33Å; C623-V627 PolarHBondContact O-N 2.83Å; I624-V627 PolarHBondContact O-N 2.94Å; V627-F630 PolarHBondContact O-N 2.82Å; V627-F631 VanDerWaalsContact O-CB 3.28Å; V627-F631 WeakPolarHBondContact O-CB 3.44Å; V627-F631 PolarHBondContact O-N 2.91Å
628	F	97.9	Very high	96.5	Very high	37 Å²	37	22.1 Å²	22.1	16%	0.162	11%	0.106	C	C	.	.	H	α-helix	trans	-65.7	-44	178.2	179.6	-111.8	0	0	0	112.3	C434 I437 I438 I624 I625 F626 F630 F631 L632	C434-F628 HydrophobicContact CB-CE1 4.45Å; I437-F628 HydrophobicContact CB-CE1 4.27Å; I437-F628 HydrophobicContact CD1-CZ 3.98Å; I437-F628 HydrophobicContact CG2-CD1 4.35Å; I437-F628 HydrophobicContact CG2-CE1 4.09Å; I437-F628 HydrophobicContact CG2-CZ 4.4Å; I438-F628 HydrophobicContact CD1-CD1 4.35Å; I438-F628 HydrophobicContact CD1-CE1 4.42Å; I438-F628 HydrophobicContact CG1-CD1 3.95Å; I438-F628 HydrophobicContact CG1-CE1 4.15Å; I624-F628 VanDerWaalsContact O-CB 3.3Å; I624-F628 WeakPolarHBondContact O-CB 3.05Å; I624-F628 PolarHBondContact O-N 3.48Å; I625-F628 PolarHBondContact O-N 2.95Å; F626-F628 VanDerWaalsContact C-N 3.35Å; F626-F628 PolarHBondContact O-N 2.92Å; F628-F630 VanDerWaalsContact C-N 3.31Å; F628-F630 PolarHBondContact O-N 2.81Å; F628-F631 WeakPolarHBondContact O-CB 3.49Å; F628-F631 PolarHBondContact O-N 2.83Å; F628-L632 HydrophobicContact CD1-CD1 4.25Å; F628-L632 HydrophobicContact CE1-CD1 3.73Å; F628-L632 HydrophobicContact CE2-CD1 4.38Å; F628-L632 HydrophobicContact CE2-CG 4.4Å; F628-L632 HydrophobicContact CZ-CD1 3.81Å; F628-L632 HydrophobicContact CZ-CD2 4.5Å; F628-L632 HydrophobicContact CZ-CG 4.3Å; F628-L632 WeakPolarHBondContact O-CG 3.5Å; F628-L632 PolarHBondContact O-N 2.8Å; F628-L632 VanDerWaalsContact O-N 3.11Å
629	I	97.3	Very high	96.7	Very high	46 Å²	46	22.1 Å²	22.1	24%	0.236	11%	0.106	C	C	.	.	H	α-helix	trans	-59.6	-45.6	174.2	-70.5	169.7	0	0	0	110.1	L368 I438 I625 F626 L632 L633	L368-I629 HydrophobicContact CD1-CB 4.47Å; L368-I629 HydrophobicContact CD1-CG2 3.91Å; L368-I629 HydrophobicContact CD2-CG2 3.91Å; L368-I629 HydrophobicContact CG-CG2 4.46Å; I438-I629 HydrophobicContact CD1-CD1 4.16Å; I438-I629 HydrophobicContact CD1-CG1 3.74Å; I438-I629 HydrophobicContact CG1-CG1 4.36Å; I625-I629 HydrophobicContact CG2-CD1 3.83Å; I625-I629 WeakPolarHBondContact O-CG1 3.21Å; I625-I629 PolarHBondContact O-N 2.88Å; F626-I629 PolarHBondContact O-N 3Å; I629-L632 PolarHBondContact O-N 2.81Å; I629-L633 PolarHBondContact O-N 3.48Å; I629-L633 VanDerWaalsContact O-N 3.1Å
630	F	97	Very high	96.9	Very high	25 Å²	25	25.4 Å²	25.4	11%	0.11	12%	0.123	C	C	.	.	H	α-helix	trans	-65.7	-40.5	179.6	-165.9	-108	0	0	0	112.3	I528 L558 T592 A593 L596 F626 V627 F628 L632 L633 C634	I528-F630 HydrophobicContact CD1-CE1 4.01Å; I528-F630 HydrophobicContact CD1-CE2 4.41Å; I528-F630 HydrophobicContact CD1-CZ 3.52Å; L558-F630 HydrophobicContact CD2-CE2 3.97Å; L558-F630 HydrophobicContact CD2-CZ 3.98Å; T592-F630 HydrophobicContact CG2-CE1 3.89Å; T592-F630 HydrophobicContact CG2-CZ 4.47Å; A593-F630 HydrophobicContact CB-CD1 3.9Å; L596-F630 HydrophobicContact CD2-CB 3.93Å; L596-F630 HydrophobicContact CD2-CD1 3.62Å; L596-F630 HydrophobicContact CD2-CE1 4.27Å; L596-F630 HydrophobicContact CD2-CG 3.78Å; F626-F630 WeakPolarHBondContact O-CB 3.37Å; F626-F630 PolarHBondContact O-N 3.21Å; V627-F630 PolarHBondContact O-N 2.82Å; F628-F630 VanDerWaalsContact C-N 3.31Å; F628-F630 PolarHBondContact O-N 2.81Å; F630-L632 PolarHBondContact O-N 2.93Å; F630-L633 PolarHBondContact O-N 3.07Å; F630-C634 WeakPolarHBondContact CE1-SG 2.96Å; F630-C634 WeakPolarHBondContact CZ-SG 3.44Å; F630-C634 WeakPolarHBondContact O-CB 3.08Å; F630-C634 PolarHBondContact O-N 2.96Å; F630-C634 PolarHBondContact O-SG 3.03Å; F630-C634 VanDerWaalsContact O-SG 3.35Å
631	F	97.9	Very high	96.9	Very high	43 Å²	43	25.4 Å²	25.4	19%	0.189	13%	0.126	C	C	.	.	H	α-helix	trans	-57.2	-46.6	174.8	172.6	-101.1	0	0	0	112	F361 F586 L587 G590 A593 V627 F628 G635	F361-F631 HydrophobicContact CE2-CE1 4.48Å; F586-F631 HydrophobicContact CD1-CZ 4.28Å; F586-F631 HydrophobicContact CE1-CD1 4.34Å; F586-F631 AromaticContact CE1-CE1 3.57Å; F586-F631 HydrophobicContact CE1-CE1 3.57Å; F586-F631 HydrophobicContact CE1-CE2 4.38Å; F586-F631 AromaticContact CE1-CZ 3.59Å; F586-F631 HydrophobicContact CE1-CZ 3.59Å; F586-F631 HydrophobicContact CZ-CE1 4.19Å; L587-F631 HydrophobicContact CD2-CE2 4.1Å; L587-F631 HydrophobicContact CD2-CZ 3.9Å; G590-F631 VanDerWaalsContact O-CD2 3.27Å; G590-F631 WeakPolarHBondContact O-CD2 3.37Å; A593-F631 HydrophobicContact CB-CB 3.68Å; A593-F631 HydrophobicContact CB-CD2 4.47Å; V627-F631 VanDerWaalsContact O-CB 3.28Å; V627-F631 WeakPolarHBondContact O-CB 3.44Å; V627-F631 PolarHBondContact O-N 2.91Å; F628-F631 WeakPolarHBondContact O-CB 3.49Å; F628-F631 PolarHBondContact O-N 2.83Å; F631-G635 PolarHBondContact O-N 3.21Å
632	L	98.3	Very high	96.9	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-64.2	-46.2	178	-68.5	176.5	0	0	0	111.7	F361 G365 L368 C434 F586 F628 I629 F630 A636	F361-L632 HydrophobicContact CB-CD2 3.85Å; F361-L632 HydrophobicContact CD1-CD2 3.86Å; F361-L632 HydrophobicContact CD2-CD2 4.26Å; F361-L632 HydrophobicContact CE1-CD2 4.44Å; F361-L632 HydrophobicContact CG-CD2 3.75Å; G365-L632 VanDerWaalsContact CA-O 3.24Å; G365-L632 WeakPolarHBondContact CA-O 3.42Å; L368-L632 HydrophobicContact CD1-CB 3.87Å; L368-L632 HydrophobicContact CD1-CD1 4.19Å; C434-L632 HydrophobicContact CB-CD1 4.07Å; F586-L632 HydrophobicContact CZ-CD2 4.32Å; F628-L632 HydrophobicContact CD1-CD1 4.25Å; F628-L632 HydrophobicContact CE1-CD1 3.73Å; F628-L632 HydrophobicContact CE2-CD1 4.38Å; F628-L632 HydrophobicContact CE2-CG 4.4Å; F628-L632 HydrophobicContact CZ-CD1 3.81Å; F628-L632 HydrophobicContact CZ-CD2 4.5Å; F628-L632 HydrophobicContact CZ-CG 4.3Å; F628-L632 WeakPolarHBondContact O-CG 3.5Å; F628-L632 PolarHBondContact O-N 2.8Å; F628-L632 VanDerWaalsContact O-N 3.11Å; I629-L632 PolarHBondContact O-N 2.81Å; F630-L632 PolarHBondContact O-N 2.93Å; L632-A636 WeakPolarHBondContact O-CB 3.28Å; L632-A636 PolarHBondContact O-N 3.06Å
633	L	97.8	Very high	97	Very high	7 Å²	7	23.2 Å²	23.2	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-59.7	-54.4	178.6	-176.2	157.7	0	0	0	110.9	L368 L369 T372 F555 I629 F630 G635 A636 V637	L368-L633 HydrophobicContact CB-CB 4.32Å; L368-L633 HydrophobicContact CB-CD1 4.46Å; L369-L633 HydrophobicContact CB-CG 4.46Å; T372-L633 HydrophobicContact CG2-CD1 3.85Å; T372-L633 WeakPolarHBondContact OG1-CD1 3.4Å; F555-L633 HydrophobicContact CE2-CD1 4.3Å; F555-L633 HydrophobicContact CE2-CD2 4.39Å; I629-L633 PolarHBondContact O-N 3.48Å; I629-L633 VanDerWaalsContact O-N 3.1Å; F630-L633 PolarHBondContact O-N 3.07Å; L633-G635 PolarHBondContact O-N 3.33Å; L633-A636 PolarHBondContact O-N 2.89Å; L633-V637 WeakPolarHBondContact O-CG2 3.27Å; L633-V637 PolarHBondContact O-N 3.1Å
634	C	97.6	Very high	96.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-42	-178.2	-66.8	0	0	0	0	112	L562 S589 F630 A636 V637 G638	L562-C634 HydrophobicContact CD1-CB 4.02Å; L562-C634 HydrophobicContact CD2-CB 4.04Å; S589-C634 WeakPolarHBondContact CB-O 3.01Å; S589-C634 VanDerWaalsContact O-CB 3.29Å; S589-C634 WeakPolarHBondContact O-CB 3.05Å; F630-C634 WeakPolarHBondContact CE1-SG 2.96Å; F630-C634 WeakPolarHBondContact CZ-SG 3.44Å; F630-C634 WeakPolarHBondContact O-CB 3.08Å; F630-C634 PolarHBondContact O-N 2.96Å; F630-C634 PolarHBondContact O-SG 3.03Å; F630-C634 VanDerWaalsContact O-SG 3.35Å; C634-A636 VanDerWaalsContact C-N 3.35Å; C634-A636 PolarHBondContact O-N 3.43Å; C634-V637 PolarHBondContact O-N 2.02Å; C634-G638 PolarHBondContact O-N 3.41Å; C634-G638 VanDerWaalsContact O-N 3.1Å
635	G	97.7	Very high	96.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-38	178.6	0	0	0	0	0	112.9	F586 F631 L633 G638 F639	F586-G635 WeakPolarHBondContact CD2-O 3.44Å; F586-G635 WeakPolarHBondContact O-CA 3.12Å; F631-G635 PolarHBondContact O-N 3.21Å; L633-G635 PolarHBondContact O-N 3.33Å; G635-G638 PolarHBondContact O-N 3.06Å; G635-F639 VanDerWaalsContact O-CB 3.27Å; G635-F639 WeakPolarHBondContact O-CB 3.32Å; G635-F639 PolarHBondContact O-N 2.94Å
636	A	98	Very high	96.4	Very high	2 Å²	2	23.8 Å²	23.8	2%	0.017	12%	0.124	C	C	.	.	H	α-helix	trans	-65.2	-40.7	175.6	0	0	0	0	0	112.4	L632 L633 C634 F639 M640	L632-A636 WeakPolarHBondContact O-CB 3.28Å; L632-A636 PolarHBondContact O-N 3.06Å; L633-A636 PolarHBondContact O-N 2.89Å; C634-A636 VanDerWaalsContact C-N 3.35Å; C634-A636 PolarHBondContact O-N 3.43Å; A636-F639 PolarHBondContact O-N 3.43Å; A636-M640 VanDerWaalsContact O-CB 3.3Å; A636-M640 WeakPolarHBondContact O-CB 3.42Å; A636-M640 WeakPolarHBondContact O-CG 3.43Å; A636-M640 PolarHBondContact O-N 3.24Å
637	V	98	Very high	96.2	Very high	12 Å²	12	24.3 Å²	24.3	7%	0.073	12%	0.124	C	C	.	.	H	α-helix	trans	-60.5	-50.9	175.7	176.5	0	0	0	0	111.1	L369 L559 L562 A563 L633 C634 F639 M640 S641	L369-V637 HydrophobicContact CD1-CG2 3.22Å; L559-V637 HydrophobicContact CD2-CG1 4.35Å; L559-V637 HydrophobicContact CD2-CG2 3.58Å; L562-V637 HydrophobicContact CB-CB 4.38Å; L562-V637 HydrophobicContact CB-CG1 3.83Å; L562-V637 HydrophobicContact CD1-CB 4.4Å; L562-V637 HydrophobicContact CD1-CG1 4.45Å; A563-V637 HydrophobicContact CB-CG1 4.49Å; L633-V637 WeakPolarHBondContact O-CG2 3.27Å; L633-V637 PolarHBondContact O-N 3.1Å; C634-V637 PolarHBondContact O-N 2.02Å; V637-F639 PolarHBondContact O-N 2.64Å; V637-M640 PolarHBondContact O-N 3.41Å; V637-S641 WeakPolarHBondContact O-CB 3.34Å; V637-S641 PolarHBondContact O-N 3.19Å; V637-S641 PolarHBondContact O-OG 3.42Å
638	G	96.7	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-46.8	179.4	0	0	0	0	0	112	S566 S589 C634 G635 S641 C642	S566-G638 WeakPolarHBondContact OG-CA 3.11Å; S566-G638 PolarHBondContact OG-O 3.14Å; S589-G638 VanDerWaalsContact OG-CA 3.3Å; S589-G638 WeakPolarHBondContact OG-CA 3.37Å; C634-G638 PolarHBondContact O-N 3.41Å; C634-G638 VanDerWaalsContact O-N 3.1Å; G635-G638 PolarHBondContact O-N 3.06Å; G638-S641 PolarHBondContact O-N 3.21Å; G638-C642 WeakPolarHBondContact O-CB 3.41Å; G638-C642 PolarHBondContact O-N 3.07Å; G638-C642 PolarHBondContact O-SG 2.89Å; G638-C642 VanDerWaalsContact O-SG 3.38Å
639	F	97.8	Very high	95.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61	-49.2	177.8	179.7	-91	0	0	0	112.8	L358 V362 L414 W581 W582 F586 G635 A636 V637 S641 C642 F643	L358-F639 HydrophobicContact CD1-CD2 4.33Å; L358-F639 HydrophobicContact CD2-CD2 4.39Å; L358-F639 HydrophobicContact CD2-CE2 3.84Å; L358-F639 HydrophobicContact CD2-CZ 4.43Å; L358-F639 HydrophobicContact CG-CE2 4.39Å; V362-F639 HydrophobicContact CB-CD1 4.27Å; V362-F639 HydrophobicContact CG1-CD1 3.71Å; V362-F639 HydrophobicContact CG1-CE1 4.25Å; V362-F639 HydrophobicContact CG2-CB 4Å; V362-F639 HydrophobicContact CG2-CD1 3.52Å; V362-F639 HydrophobicContact CG2-CD2 4.33Å; V362-F639 HydrophobicContact CG2-CE1 4.14Å; V362-F639 HydrophobicContact CG2-CG 3.64Å; L414-F639 HydrophobicContact CD1-CE1 3.79Å; L414-F639 HydrophobicContact CD1-CZ 3.76Å; L414-F639 HydrophobicContact CD2-CD1 4.23Å; L414-F639 HydrophobicContact CD2-CE1 3.45Å; L414-F639 VanDerWaalsContact CD2-CE1 3.45Å; L414-F639 HydrophobicContact CD2-CZ 3.83Å; L414-F639 HydrophobicContact CG-CE1 4.3Å; L414-F639 HydrophobicContact CG-CZ 4.44Å; W581-F639 HydrophobicContact CZ3-CE2 4.22Å; W582-F639 HydrophobicContact CB-CE2 4.36Å; W582-F639 HydrophobicContact CD2-CE2 4.5Å; W582-F639 AromaticContact CE3-CE2 3.7Å; W582-F639 HydrophobicContact CE3-CE2 3.7Å; W582-F639 AromaticContact CE3-CZ 3.61Å; W582-F639 HydrophobicContact CE3-CZ 3.61Å; W582-F639 HydrophobicContact CZ3-CE2 4.43Å; W582-F639 AromaticContact CZ3-CZ 3.89Å; W582-F639 HydrophobicContact CZ3-CZ 3.89Å; W582-F639 WeakPolarHBondContact O-CD2 3.35Å; F586-F639 HydrophobicContact CB-CB 4.18Å; F586-F639 HydrophobicContact CB-CD2 4.44Å; F586-F639 HydrophobicContact CD2-CB 4.12Å; G635-F639 VanDerWaalsContact O-CB 3.27Å; G635-F639 WeakPolarHBondContact O-CB 3.32Å; G635-F639 PolarHBondContact O-N 2.94Å; A636-F639 PolarHBondContact O-N 3.43Å; V637-F639 PolarHBondContact O-N 2.64Å; F639-S641 VanDerWaalsContact C-N 3.31Å; F639-S641 PolarHBondContact O-N 2.81Å; F639-C642 PolarHBondContact O-N 3.45Å; F639-F643 HydrophobicContact CE1-CB 4.11Å; F639-F643 HydrophobicContact CE1-CD2 4.37Å; F639-F643 HydrophobicContact CE1-CG 4.39Å; F639-F643 HydrophobicContact CZ-CB 4.37Å; F639-F643 HydrophobicContact CZ-CD2 4.16Å; F639-F643 VanDerWaalsContact O-CB 3.29Å; F639-F643 WeakPolarHBondContact O-CB 3.5Å; F639-F643 PolarHBondContact O-N 3.22Å
640	M	97	Very high	94.7	Very high	70 Å²	70	27.5 Å²	27.5	35%	0.345	14%	0.135	S	C	.	.	H	α-helix	trans	-65.7	-37	-176.8	-71.5	-65.1	-73.7	0	0	111.7	V362 A636 V637 F643 C644	V362-M640 HydrophobicContact CG1-CG 4.2Å; V362-M640 HydrophobicContact CG1-SD 4Å; A636-M640 VanDerWaalsContact O-CB 3.3Å; A636-M640 WeakPolarHBondContact O-CB 3.42Å; A636-M640 WeakPolarHBondContact O-CG 3.43Å; A636-M640 PolarHBondContact O-N 3.24Å; V637-M640 PolarHBondContact O-N 3.41Å; M640-F643 PolarHBondContact O-N 2.91Å; M640-C644 PolarHBondContact O-N 3.29Å; M640-C644 PolarHBondContact O-SG 3.31Å
641	S	95.6	Very high	94.1	Very high	30 Å²	30	29.3 Å²	29.3	21%	0.21	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-50.2	175.7	-56.3	0	0	0	0	111	A563 V637 G638 F639 F643 C644 F645	A563-S641 VanDerWaalsContact CB-OG 3.24Å; A563-S641 WeakPolarHBondContact CB-OG 3.42Å; V637-S641 WeakPolarHBondContact O-CB 3.34Å; V637-S641 PolarHBondContact O-N 3.19Å; V637-S641 PolarHBondContact O-OG 3.42Å; G638-S641 PolarHBondContact O-N 3.21Å; F639-S641 VanDerWaalsContact C-N 3.31Å; F639-S641 PolarHBondContact O-N 2.81Å; S641-F643 PolarHBondContact O-N 3.27Å; S641-C644 PolarHBondContact O-N 2.96Å; S641-F645 WeakPolarHBondContact O-CB 3.45Å; S641-F645 PolarHBondContact O-N 3.28Å
642	C	95.1	Very high	93.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-41.5	175.1	-71.4	0	0	0	0	112.5	S566 C570 W581 A585 G638 F639 C644 F645 V646	S566-C642 PolarHBondContact O-SG 3.24Å; C570-C642 HydrophobicContact CB-CB 4.36Å; C570-C642 VanDerWaalsContact CB-SG 3.57Å; W581-C642 HydrophobicContact CE3-CB 4.09Å; W581-C642 HydrophobicContact CZ3-CB 3.95Å; A585-C642 HydrophobicContact CB-CB 3.59Å; G638-C642 WeakPolarHBondContact O-CB 3.41Å; G638-C642 PolarHBondContact O-N 3.07Å; G638-C642 PolarHBondContact O-SG 2.89Å; G638-C642 VanDerWaalsContact O-SG 3.38Å; F639-C642 PolarHBondContact O-N 3.45Å; C642-C644 VanDerWaalsContact C-N 3.33Å; C642-C644 PolarHBondContact O-N 3.22Å; C642-F645 PolarHBondContact O-N 2.72Å; C642-V646 WeakPolarHBondContact O-CB 3.17Å; C642-V646 VanDerWaalsContact O-CG2 3.22Å; C642-V646 WeakPolarHBondContact O-CG2 3.38Å; C642-V646 PolarHBondContact O-N 3.34Å
643	F	95.4	Very high	92.2	Very high	22 Å²	22	33 Å²	33	10%	0.096	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-40.1	178.2	-177.8	-93.2	0	0	0	112	L414 Y493 W581 W582 F639 M640 S641 R647	L414-F643 HydrophobicContact CD1-CE2 4.38Å; Y493-F643 HydrophobicContact CE1-CE2 4.31Å; Y493-F643 HydrophobicContact CE1-CZ 4.37Å; W581-F643 HydrophobicContact CH2-CB 4Å; W581-F643 AromaticContact CH2-CD2 3.85Å; W581-F643 HydrophobicContact CH2-CD2 3.85Å; W581-F643 HydrophobicContact CH2-CG 4.38Å; W581-F643 HydrophobicContact CZ3-CB 4.32Å; W582-F643 HydrophobicContact CH2-CD2 4.16Å; W582-F643 AromaticContact CH2-CE2 3.84Å; W582-F643 HydrophobicContact CH2-CE2 3.84Å; W582-F643 AromaticContact CZ3-CD2 3.98Å; W582-F643 HydrophobicContact CZ3-CD2 3.98Å; W582-F643 AromaticContact CZ3-CE2 3.94Å; W582-F643 HydrophobicContact CZ3-CE2 3.94Å; F639-F643 HydrophobicContact CE1-CB 4.11Å; F639-F643 HydrophobicContact CE1-CD2 4.37Å; F639-F643 HydrophobicContact CE1-CG 4.39Å; F639-F643 HydrophobicContact CZ-CB 4.37Å; F639-F643 HydrophobicContact CZ-CD2 4.16Å; F639-F643 VanDerWaalsContact O-CB 3.29Å; F639-F643 WeakPolarHBondContact O-CB 3.5Å; F639-F643 PolarHBondContact O-N 3.22Å; M640-F643 PolarHBondContact O-N 2.91Å; S641-F643 PolarHBondContact O-N 3.27Å; F643-R647 VanDerWaalsContact CE1-CD 3.41Å; F643-R647 HydrophobicContact CE1-CG 4.48Å; F643-R647 HydrophobicContact CZ-CG 4.49Å; F643-R647 WeakPolarHBondContact O-CB 3.36Å; F643-R647 VanDerWaalsContact O-CG 3.3Å; F643-R647 WeakPolarHBondContact O-CG 3.12Å; F643-R647 PolarHBondContact O-N 3.38Å; F643-R647 VanDerWaalsContact O-N 3.17Å
644	C	93	Very high	90.7	Very high	77 Å²	77	41.8 Å²	41.8	52%	0.52	21%	0.214	S	C	.	.	H	α-helix	trans	-67.6	-45.1	173.9	-66	0	0	0	0	111.7	M640 S641 C642 R647 K648	M640-C644 PolarHBondContact O-N 3.29Å; M640-C644 PolarHBondContact O-SG 3.31Å; S641-C644 PolarHBondContact O-N 2.96Å; C642-C644 VanDerWaalsContact C-N 3.33Å; C642-C644 PolarHBondContact O-N 3.22Å; C644-R647 PolarHBondContact O-N 3.33Å; C644-K648 WeakPolarHBondContact O-CB 3.2Å; C644-K648 PolarHBondContact O-N 3.36Å
645	F	91.6	Very high	88.9	Confident	33 Å²	33	44.6 Å²	44.6	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-58.8	-52.2	178	171.1	-106.6	0	0	0	112.3	L315 V567 Y571 S641 C642 R647 K648 I649	L315-F645 HydrophobicContact CD2-CE2 4.25Å; V567-F645 HydrophobicContact CG1-CB 4.28Å; V567-F645 HydrophobicContact CG1-CD1 3.95Å; V567-F645 HydrophobicContact CG1-CD2 3.71Å; V567-F645 HydrophobicContact CG1-CE1 4.19Å; V567-F645 HydrophobicContact CG1-CE2 3.97Å; V567-F645 HydrophobicContact CG1-CG 3.7Å; V567-F645 HydrophobicContact CG1-CZ 4.19Å; V567-F645 HydrophobicContact CG2-CB 4.15Å; V567-F645 HydrophobicContact CG2-CG 4.45Å; Y571-F645 HydrophobicContact CD2-CE1 4.22Å; Y571-F645 AromaticContact CD2-CZ 3.81Å; Y571-F645 HydrophobicContact CD2-CZ 3.81Å; Y571-F645 HydrophobicContact CG-CZ 4.41Å; S641-F645 WeakPolarHBondContact O-CB 3.45Å; S641-F645 PolarHBondContact O-N 3.28Å; C642-F645 PolarHBondContact O-N 2.72Å; F645-R647 PolarHBondContact O-N 3.15Å; F645-K648 PolarHBondContact O-N 2.78Å; F645-K648 VanDerWaalsContact O-N 3.08Å; F645-I649 HydrophobicContact CE2-CD1 4.46Å; F645-I649 HydrophobicContact CZ-CD1 3.93Å; F645-I649 PolarHBondContact O-N 3.11Å
646	V	92.2	Very high	86.5	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-44.7	-179.7	171.7	0	0	0	0	110.7	V348 F349 L574 W581 C642 K648 I649 Y650	V348-V646 HydrophobicContact CG1-CG1 3.23Å; F349-V646 HydrophobicContact CE1-CG1 4Å; F349-V646 HydrophobicContact CZ-CG1 3.96Å; L574-V646 HydrophobicContact CD1-CG2 4.18Å; W581-V646 HydrophobicContact CD2-CG2 4.11Å; W581-V646 HydrophobicContact CE3-CG2 4.33Å; W581-V646 HydrophobicContact CH2-CB 4.37Å; W581-V646 HydrophobicContact CH2-CG2 4.39Å; W581-V646 HydrophobicContact CZ2-CB 4.1Å; W581-V646 HydrophobicContact CZ2-CG1 3.87Å; W581-V646 HydrophobicContact CZ2-CG2 4.19Å; W581-V646 HydrophobicContact CZ3-CG2 4.47Å; C642-V646 WeakPolarHBondContact O-CB 3.17Å; C642-V646 VanDerWaalsContact O-CG2 3.22Å; C642-V646 WeakPolarHBondContact O-CG2 3.38Å; C642-V646 PolarHBondContact O-N 3.34Å; V646-K648 VanDerWaalsContact C-N 3.27Å; V646-K648 PolarHBondContact O-N 3.49Å; V646-I649 WeakPolarHBondContact O-CG2 3.44Å; V646-Y650 HydrophobicContact CG1-CD2 3.82Å; V646-Y650 HydrophobicContact CG1-CE2 4.02Å; V646-Y650 VanDerWaalsContact O-CD2 3.26Å; V646-Y650 WeakPolarHBondContact O-CD2 3.2Å; V646-Y650 PolarHBondContact O-N 3.48Å
647	R	91.3	Very high	85.9	Confident	83 Å²	83	58.7 Å²	58.7	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-37.1	175.2	-73.5	-176.1	73.8	-168.9	4.2	112.5	F349 A492 F643 C644 F645 S651	F349-R647 HydrophobicContact CE1-CG 3.74Å; F349-R647 HydrophobicContact CZ-CG 4.07Å; A492-R647 PolarHBondContact O-NH2 3.37Å; F643-R647 VanDerWaalsContact CE1-CD 3.41Å; F643-R647 HydrophobicContact CE1-CG 4.48Å; F643-R647 HydrophobicContact CZ-CG 4.49Å; F643-R647 WeakPolarHBondContact O-CB 3.36Å; F643-R647 VanDerWaalsContact O-CG 3.3Å; F643-R647 WeakPolarHBondContact O-CG 3.12Å; F643-R647 PolarHBondContact O-N 3.38Å; F643-R647 VanDerWaalsContact O-N 3.17Å; C644-R647 PolarHBondContact O-N 3.33Å; F645-R647 PolarHBondContact O-N 3.15Å; R647-S651 VanDerWaalsContact O-CB 3.27Å; R647-S651 WeakPolarHBondContact O-CB 3.06Å; R647-S651 PolarHBondContact O-N 2.96Å; R647-S651 VanDerWaalsContact O-N 3.11Å; R647-S651 PolarHBondContact O-OG 3Å
648	K	88.5	Confident	85.2	Confident	141 Å²	141	61.2 Å²	61.2	61%	0.613	32%	0.318	S	S	*	.	H	α-helix	trans	-71	-48.2	179.9	-173.5	59.6	176.9	173	0	111.8	C644 F645 V646 Y650 S651 V652	C644-K648 WeakPolarHBondContact O-CB 3.2Å; C644-K648 PolarHBondContact O-N 3.36Å; F645-K648 PolarHBondContact O-N 2.78Å; F645-K648 VanDerWaalsContact O-N 3.08Å; V646-K648 VanDerWaalsContact C-N 3.27Å; V646-K648 PolarHBondContact O-N 3.49Å; K648-Y650 PolarHBondContact O-N 3.01Å; K648-S651 PolarHBondContact O-N 3.2Å; K648-S651 PolarHBondContact O-OG 2.93Å; K648-V652 PolarHBondContact O-N 2.87Å
649	I	85.2	Confident	84.6	Confident	30 Å²	30	64.6 Å²	64.6	15%	0.154	34%	0.335	C	S	.	.	H	α-helix	trans	-63.4	-41.9	-176.9	-157.2	177.7	0	0	0	111.7	W341 Y571 F645 V646 V652	W341-I649 HydrophobicContact CD2-CD1 4.11Å; W341-I649 HydrophobicContact CE3-CD1 3.96Å; W341-I649 HydrophobicContact CE3-CG1 4.31Å; W341-I649 HydrophobicContact CH2-CD1 3.8Å; W341-I649 HydrophobicContact CH2-CG1 3.58Å; W341-I649 HydrophobicContact CZ2-CD1 3.91Å; W341-I649 HydrophobicContact CZ2-CG1 4.14Å; W341-I649 HydrophobicContact CZ3-CB 4.48Å; W341-I649 HydrophobicContact CZ3-CD1 3.82Å; W341-I649 HydrophobicContact CZ3-CG1 3.67Å; W341-I649 HydrophobicContact CZ3-CG2 4.23Å; Y571-I649 HydrophobicContact CD2-CD1 4.37Å; Y571-I649 HydrophobicContact CE2-CD1 4.16Å; F645-I649 HydrophobicContact CE2-CD1 4.46Å; F645-I649 HydrophobicContact CZ-CD1 3.93Å; F645-I649 PolarHBondContact O-N 3.11Å; V646-I649 WeakPolarHBondContact O-CG2 3.44Å; I649-V652 PolarHBondContact O-N 3.2Å
650	Y	87.3	Confident	83.8	Confident	1 Å²	1	68.4 Å²	68.4	0%	0.004	36%	0.355	C	S	.	.	H	α-helix	trans	-78.7	-15.7	177.2	-71.6	-75.7	0	0	0	113.9	W341 H345 V348 F349 V495 L574 V646 K648 V652 L653	W341-Y650 AromaticContact CE3-CE1 3.87Å; W341-Y650 HydrophobicContact CE3-CE1 3.87Å; W341-Y650 HydrophobicContact CE3-CE2 4.48Å; W341-Y650 AromaticContact CE3-CZ 3.81Å; W341-Y650 HydrophobicContact CZ3-CD1 4.25Å; W341-Y650 AromaticContact CZ3-CE1 3.97Å; W341-Y650 HydrophobicContact CZ3-CE1 3.97Å; W341-Y650 PolarHBondContact O-OH 3.31Å; H345-Y650 HydrophobicContact CB-CD1 3.85Å; H345-Y650 HydrophobicContact CB-CE1 3.7Å; V348-Y650 HydrophobicContact CB-CE2 4.04Å; V348-Y650 HydrophobicContact CG1-CD2 3.95Å; V348-Y650 HydrophobicContact CG1-CE2 3.59Å; V348-Y650 HydrophobicContact CG2-CE1 4.18Å; V348-Y650 HydrophobicContact CG2-CE2 3.63Å; V348-Y650 VanDerWaalsContact CG2-CZ 3.41Å; V348-Y650 WeakPolarHBondContact CG2-OH 3.01Å; F349-Y650 HydrophobicContact CE2-CD2 4.48Å; F349-Y650 HydrophobicContact CE2-CG 4.43Å; V495-Y650 HydrophobicContact CG2-CD1 4.47Å; L574-Y650 HydrophobicContact CD1-CE2 4.31Å; V646-Y650 HydrophobicContact CG1-CD2 3.82Å; V646-Y650 HydrophobicContact CG1-CE2 4.02Å; V646-Y650 VanDerWaalsContact O-CD2 3.26Å; V646-Y650 WeakPolarHBondContact O-CD2 3.2Å; V646-Y650 PolarHBondContact O-N 3.48Å; K648-Y650 PolarHBondContact O-N 3.01Å; Y650-V652 PolarHBondContact O-N 3.31Å; Y650-L653 HydrophobicContact CD1-CD2 4.3Å
651	S	84.5	Confident	83	Confident	64 Å²	64	68.3 Å²	68.3	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-73.3	-17.7	170.6	70.4	0	0	0	0	113.8	R647 K648	R647-S651 VanDerWaalsContact O-CB 3.27Å; R647-S651 WeakPolarHBondContact O-CB 3.06Å; R647-S651 PolarHBondContact O-N 2.96Å; R647-S651 VanDerWaalsContact O-N 3.11Å; R647-S651 PolarHBondContact O-OG 3Å; K648-S651 PolarHBondContact O-N 3.2Å; K648-S651 PolarHBondContact O-OG 2.93Å
652	V	81.7	Confident	82.2	Confident	102 Å²	102	70.8 Å²	70.8	62%	0.618	37%	0.366	S	S	*	.	H	α-helix	trans	-90.3	-19	177.8	179.2	0	0	0	0	111.1	K648 I649 Y650 K654	K648-V652 PolarHBondContact O-N 2.87Å; I649-V652 PolarHBondContact O-N 3.2Å; Y650-V652 PolarHBondContact O-N 3.31Å; V652-K654 PolarHBondContact O-N 3.06Å
653	L	74.8	Confident	81.3	Confident	19 Å²	19	75.9 Å²	75.9	10%	0.099	39%	0.392	C	S	.	.			trans	-69.7	110.7	178.4	-156.1	91	0	0	0	109.1	W341 K342 H345 Y650 V655	W341-L653 HydrophobicContact CH2-CD1 3.92Å; W341-L653 HydrophobicContact CZ3-CD1 4.03Å; K342-L653 HydrophobicContact CB-CD1 4.23Å; K342-L653 HydrophobicContact CD-CD1 3.85Å; K342-L653 HydrophobicContact CG-CD1 3.67Å; H345-L653 HydrophobicContact CB-CD2 3.73Å; Y650-L653 HydrophobicContact CD1-CD2 4.3Å; L653-V655 HydrophobicContact CD2-CB 4.19Å; L653-V655 HydrophobicContact CD2-CG2 3.28Å; L653-V655 HydrophobicContact CG-CG2 3.69Å; L653-V655 PolarHBondContact O-N 2.86Å; L653-V655 VanDerWaalsContact O-N 3.17Å
654	K	65.2	Low	80.2	Confident	191 Å²	191	80 Å²	80	83%	0.83	41%	0.414	S	S	*	.			trans	-79.4	89.2	169.3	-67.7	-177.1	-178.9	-179.8	0	108.1	V652	V652-K654 PolarHBondContact O-N 3.06Å
655	V	59.8	Low	79.1	Confident	60 Å²	60	80.3 Å²	80.3	36%	0.364	41%	0.406	S	S	.	.			trans	-124.4	80.2	168.7	-178.1	0	0	0	0	105.7	L653	L653-V655 HydrophobicContact CD2-CB 4.19Å; L653-V655 HydrophobicContact CD2-CG2 3.28Å; L653-V655 HydrophobicContact CG-CG2 3.69Å; L653-V655 PolarHBondContact O-N 2.86Å; L653-V655 VanDerWaalsContact O-N 3.17Å
656	D	47.2	Very low	78	Confident	239 Å²	239	84.5 Å²	84.5	100%	1.278	43%	0.429	S	S	*	.			trans	-119.4	0	162	-80.9	-34.8	0	0	0	107.7

Retrieved 656 of 656 residues in 215.6 ms (Link to these results)

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