A0A3Q0KSS1_SCHMA Loading...

Putative rhodopsin-like orphan GPCR

AlphaFold DB , UniProt , Accession A0A3Q0KSS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 452 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	47.5	Very low	42.4	Very low	226 Å²	226	151.5 Å²	151.5	100%	1.113	76%	0.755	S	S	*	*				0	84.4	0	-74.6	174.3	167.3	0	0	106
2	N	40.1	Very low	42.3	Very low	154 Å²	154	156.1 Å²	156.1	82%	0.824	77%	0.768	S	S	*	*				78.4	122.5	93.5	-80.3	19.8	0	0	0	109
3	S	39.9	Very low	43.1	Very low	83 Å²	83	152.5 Å²	152.5	58%	0.58	76%	0.763	S	S	*	*			cis	-175.9	145.4	8.2	-86.2	0	0	0	0	105.9
4	T	42.4	Very low	43.5	Very low	110 Å²	110	154.7 Å²	154.7	68%	0.675	77%	0.77	S	S	*	*			trans	67.1	114.5	132.8	57.6	0	0	0	0	119.1
5	L	41.2	Very low	43.8	Very low	148 Å²	148	157.5 Å²	157.5	78%	0.775	78%	0.78	S	S	*	*				70.5	128.5	96.9	-62.7	160.3	0	0	0	110.3
6	I	47	Very low	44.3	Very low	135 Å²	135	158.3 Å²	158.3	69%	0.692	78%	0.781	S	S	*	*				-164.6	138.5	59.6	-70	163.9	0	0	0	107.6	D8	I6-D8 HydrophobicContact CG2-CB 4.41Å
7	P	44.9	Very low	44.7	Very low	111 Å²	111	160.4 Å²	160.4	72%	0.721	79%	0.788	S	S	*	*			trans	-103.1	117.5	167	34	-21.5	0	0	0	110.3
8	D	43.3	Very low	45.2	Very low	128 Å²	128	159.2 Å²	159.2	68%	0.684	79%	0.785	S	S	*	*			trans	-168	140.5	172.3	-76	-39.2	0	0	0	105.2	I6	I6-D8 HydrophobicContact CG2-CB 4.41Å
9	Y	38.7	Very low	45.9	Very low	177 Å²	177	159.8 Å²	159.8	69%	0.694	79%	0.785	S	S	*	*			cis	-177.2	167.5	-3	-124.5	-85.9	0	0	0	104.2
10	Y	40.3	Very low	46.3	Very low	190 Å²	190	155.8 Å²	155.8	75%	0.745	77%	0.772	S	S	*	*			trans	72.6	106.4	156.9	-68.3	-68.9	0	0	0	120.6
11	Y	41.2	Very low	46.5	Very low	205 Å²	205	154.1 Å²	154.1	80%	0.804	76%	0.762	S	S	*	*				164.6	118.5	94.1	-120.1	-84	0	0	0	108.4	P13	Y11-P13 WeakPolarHBondContact O-CD 3.46Å
12	F	40.7	Very low	47.1	Very low	206 Å²	206	148.2 Å²	148.2	90%	0.904	74%	0.741	S	S	*	*			trans	-93.1	109.7	165.6	-120.6	-89.5	0	0	0	107
13	P	53	Low	47.8	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	73%	0.734	S	S	*	*			trans	-89.7	130.5	162	18.9	-2.6	0	0	0	109.6	Y11	Y11-P13 WeakPolarHBondContact O-CD 3.46Å
14	Q	49.5	Very low	48.7	Very low	184 Å²	184	150.1 Å²	150.1	86%	0.86	74%	0.735	S	S	*	*			trans	-23	139.4	169	-70	165	-22.2	0	0	116.7	Q16	Q14-Q16 PolarHBondContact O-N 3.02Å
15	Q	47.3	Very low	49.5	Very low	197 Å²	197	150.7 Å²	150.7	92%	0.921	73%	0.731	S	S	*	*			trans	-51.1	95.5	162.4	-68.4	176.2	-20.6	0	0	110.9	Q17	Q15-Q17 PolarHBondContact O-N 2.84Å
16	Q	51.2	Low	50.4	Low	170 Å²	170	150.1 Å²	150.1	79%	0.794	72%	0.724	S	S	*	*			trans	-72.8	112.5	153.9	-97.4	174.2	-14.2	0	0	107.1	Q14 L18	Q14-Q16 PolarHBondContact O-N 3.02Å; Q16-L18 PolarHBondContact O-N 3.26Å
17	Q	51.3	Low	51.1	Low	194 Å²	194	148.6 Å²	148.6	91%	0.907	71%	0.712	S	S	*	*			trans	-59.4	85.9	159.7	-76	-178.6	-34.8	0	0	107.9	Q15 Q19	Q15-Q17 PolarHBondContact O-N 2.84Å; Q17-Q19 PolarHBondContact O-N 3.37Å; Q17-Q19 VanDerWaalsContact O-N 3.13Å
18	L	54.6	Low	52	Low	139 Å²	139	147.2 Å²	147.2	73%	0.728	70%	0.702	S	S	*	*			trans	-65.7	110.9	167.3	-134.9	86.3	0	0	0	105.9	Q16	Q16-L18 PolarHBondContact O-N 3.26Å
19	Q	58.6	Low	53.2	Low	170 Å²	170	146.5 Å²	146.5	79%	0.794	70%	0.697	S	S	*	*			trans	-48.7	134.2	165	-75.4	-179	-27.5	0	0	107.9	Q17 Q21	Q17-Q19 PolarHBondContact O-N 3.37Å; Q17-Q19 VanDerWaalsContact O-N 3.13Å; Q19-Q21 PolarHBondContact O-N 3.37Å
20	P	54.3	Low	54.4	Low	79 Å²	79	141.2 Å²	141.2	51%	0.513	69%	0.686	S	S	.	*			trans	-59.3	111	178	23.7	-30.1	0	0	0	107
21	Q	50.1	Low	55.9	Low	121 Å²	121	135.6 Å²	135.6	57%	0.565	67%	0.668	S	S	*	*			trans	-56.4	139.6	172.7	-79.3	-153.7	-7.2	0	0	107.5	Q19 Q23 Q24	Q19-Q21 PolarHBondContact O-N 3.37Å; Q21-Q23 PolarHBondContact O-N 3.3Å; Q21-Q24 PolarHBondContact O-N 3.44Å
22	P	58.7	Low	57.5	Low	103 Å²	103	129 Å²	129	67%	0.669	65%	0.65	S	S	*	*	H	α-helix	trans	-53.6	-20.3	-177.2	16.2	-28.9	0	0	0	113.7	Q26	P22-Q26 PolarHBondContact O-N 3.2Å
23	Q	56	Low	58.9	Low	144 Å²	144	124.9 Å²	124.9	67%	0.673	64%	0.636	S	S	*	*	H	α-helix	trans	-65.4	-34.6	173.2	-68.6	-173	-13.6	0	0	114.4	Q21 Q26 F27	Q21-Q23 PolarHBondContact O-N 3.3Å; Q23-Q26 PolarHBondContact O-N 3.4Å; Q23-F27 PolarHBondContact O-N 3.42Å; Q23-F27 VanDerWaalsContact O-N 3.11Å
24	Q	57.6	Low	59.7	Low	132 Å²	132	123.2 Å²	123.2	62%	0.617	62%	0.616	S	S	*	*	H	α-helix	trans	-70.2	-37.4	177.9	-100	-179.7	-15.4	0	0	112.1	Q21 F27 T28	Q21-Q24 PolarHBondContact O-N 3.44Å; Q24-F27 PolarHBondContact O-N 3.42Å; Q24-T28 PolarHBondContact O-N 3.4Å; Q24-T28 PolarHBondContact O-OG1 3.06Å
25	Q	59.3	Low	60.9	Low	123 Å²	123	119 Å²	119	58%	0.575	60%	0.599	S	S	*	*	H	α-helix	trans	-65.1	-40.2	174.7	-87.2	-179.5	-18.8	0	0	111.7	F27 T28 I29	Q25-F27 VanDerWaalsContact C-N 3.29Å; Q25-F27 PolarHBondContact O-N 3.49Å; Q25-T28 PolarHBondContact O-N 3.21Å; Q25-I29 VanDerWaalsContact O-CG1 3.29Å; Q25-I29 WeakPolarHBondContact O-CG1 3.48Å; Q25-I29 PolarHBondContact O-N 3.12Å
26	Q	60.2	Low	62.5	Low	136 Å²	136	115.9 Å²	115.9	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-65.3	-34.6	177.8	-159.4	170.1	-1.9	0	0	112.1	P22 Q23 S30	P22-Q26 PolarHBondContact O-N 3.2Å; Q23-Q26 PolarHBondContact O-N 3.4Å; Q26-S30 PolarHBondContact O-N 3.21Å; Q26-S30 PolarHBondContact O-OG 3.17Å
27	F	62	Low	63.6	Low	102 Å²	102	111 Å²	111	45%	0.447	56%	0.564	S	S	.	*	H	α-helix	trans	-67.3	-45.3	174.1	-167.3	-108.5	0	0	0	112.3	Q23 Q24 Q25 I29 S30 I31	Q23-F27 PolarHBondContact O-N 3.42Å; Q23-F27 VanDerWaalsContact O-N 3.11Å; Q24-F27 PolarHBondContact O-N 3.42Å; Q25-F27 VanDerWaalsContact C-N 3.29Å; Q25-F27 PolarHBondContact O-N 3.49Å; F27-I29 PolarHBondContact O-N 3.1Å; F27-S30 WeakPolarHBondContact O-CB 3.44Å; F27-S30 PolarHBondContact O-N 3.28Å; F27-S30 VanDerWaalsContact O-N 3.16Å; F27-I31 HydrophobicContact CD1-CD1 3.61Å; F27-I31 HydrophobicContact CE1-CD1 3.37Å; F27-I31 HydrophobicContact CE1-CG1 4.36Å; F27-I31 HydrophobicContact CG-CD1 4.43Å; F27-I31 HydrophobicContact CZ-CD1 4.01Å; F27-I31 WeakPolarHBondContact O-CG1 3.34Å; F27-I31 PolarHBondContact O-N 3.09Å
28	T	64.8	Low	64.6	Low	83 Å²	83	102.5 Å²	102.5	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-38.9	178	-51.6	0	0	0	0	112.6	Q24 Q25 S30 I31 T32	Q24-T28 PolarHBondContact O-N 3.4Å; Q24-T28 PolarHBondContact O-OG1 3.06Å; Q25-T28 PolarHBondContact O-N 3.21Å; T28-S30 VanDerWaalsContact C-N 3.3Å; T28-S30 PolarHBondContact O-N 3.15Å; T28-I31 PolarHBondContact O-N 2.82Å; T28-T32 WeakPolarHBondContact O-CG2 3.39Å; T28-T32 PolarHBondContact O-N 2.92Å; T28-T32 PolarHBondContact O-OG1 3.39Å
29	I	68	Low	65.9	Low	112 Å²	112	102.9 Å²	102.9	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-62.7	-39.9	174.8	-67	166.1	0	0	0	110.5	Q25 F27 T32 L33	Q25-I29 VanDerWaalsContact O-CG1 3.29Å; Q25-I29 WeakPolarHBondContact O-CG1 3.48Å; Q25-I29 PolarHBondContact O-N 3.12Å; F27-I29 PolarHBondContact O-N 3.1Å; I29-T32 WeakPolarHBondContact CA-OG1 3.34Å; I29-T32 PolarHBondContact O-N 3.16Å; I29-T32 PolarHBondContact O-OG1 3.43Å; I29-L33 WeakPolarHBondContact O-CB 3.24Å; I29-L33 PolarHBondContact O-N 3.19Å
30	S	64.8	Low	66.8	Low	67 Å²	67	102.5 Å²	102.5	47%	0.469	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-40.6	178.7	-56.6	0	0	0	0	112.3	Q26 F27 T28 Y34	Q26-S30 PolarHBondContact O-N 3.21Å; Q26-S30 PolarHBondContact O-OG 3.17Å; F27-S30 WeakPolarHBondContact O-CB 3.44Å; F27-S30 PolarHBondContact O-N 3.28Å; F27-S30 VanDerWaalsContact O-N 3.16Å; T28-S30 VanDerWaalsContact C-N 3.3Å; T28-S30 PolarHBondContact O-N 3.15Å; S30-Y34 VanDerWaalsContact O-CB 3.26Å; S30-Y34 WeakPolarHBondContact O-CB 3.14Å; S30-Y34 PolarHBondContact O-N 3.46Å
31	I	71	Confident	68	Low	72 Å²	72	99.6 Å²	99.6	37%	0.369	49%	0.493	S	S	.	.	H	α-helix	trans	-66.4	-45.6	177	-66.7	168.1	0	0	0	111.4	F27 T28 Y34 D35	F27-I31 HydrophobicContact CD1-CD1 3.61Å; F27-I31 HydrophobicContact CE1-CD1 3.37Å; F27-I31 HydrophobicContact CE1-CG1 4.36Å; F27-I31 HydrophobicContact CG-CD1 4.43Å; F27-I31 HydrophobicContact CZ-CD1 4.01Å; F27-I31 WeakPolarHBondContact O-CG1 3.34Å; F27-I31 PolarHBondContact O-N 3.09Å; T28-I31 PolarHBondContact O-N 2.82Å; I31-Y34 WeakPolarHBondContact O-CB 3.32Å; I31-Y34 PolarHBondContact O-N 3.43Å; I31-D35 PolarHBondContact O-N 3.31Å
32	T	74.3	Confident	69	Low	67 Å²	67	95.7 Å²	95.7	41%	0.411	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-40.7	-179.8	48.8	0	0	0	0	112.5	T28 I29 Y34 D35 H36	T28-T32 WeakPolarHBondContact O-CG2 3.39Å; T28-T32 PolarHBondContact O-N 2.92Å; T28-T32 PolarHBondContact O-OG1 3.39Å; I29-T32 WeakPolarHBondContact CA-OG1 3.34Å; I29-T32 PolarHBondContact O-N 3.16Å; I29-T32 PolarHBondContact O-OG1 3.43Å; T32-Y34 VanDerWaalsContact C-N 3.33Å; T32-D35 PolarHBondContact O-N 3.48Å; T32-H36 PolarHBondContact O-CD2 3.4Å; T32-H36 PolarHBondContact O-N 2.94Å; T32-H36 VanDerWaalsContact O-N 3.11Å
33	L	70.8	Confident	70.1	Confident	119 Å²	119	94.1 Å²	94.1	62%	0.623	46%	0.464	S	S	*	.	H	α-helix	trans	-63.1	-41.2	173.3	-169.1	80.7	0	0	0	111.3	I29 H36 L37	I29-L33 WeakPolarHBondContact O-CB 3.24Å; I29-L33 PolarHBondContact O-N 3.19Å; L33-H36 PolarHBondContact O-N 3.3Å; L33-L37 PolarHBondContact O-N 3.29Å
34	Y	69.3	Low	71.8	Confident	73 Å²	73	95.4 Å²	95.4	29%	0.286	46%	0.463	S	S	.	.	H	α-helix	trans	-57.6	-50.8	174.7	169.1	-97.3	0	0	0	111.2	S30 I31 T32 H36 L37 C38 F372	S30-Y34 VanDerWaalsContact O-CB 3.26Å; S30-Y34 WeakPolarHBondContact O-CB 3.14Å; S30-Y34 PolarHBondContact O-N 3.46Å; I31-Y34 WeakPolarHBondContact O-CB 3.32Å; I31-Y34 PolarHBondContact O-N 3.43Å; T32-Y34 VanDerWaalsContact C-N 3.33Å; Y34-H36 VanDerWaalsContact C-N 3.3Å; Y34-H36 PolarHBondContact O-N 3.41Å; Y34-L37 PolarHBondContact O-N 3.15Å; Y34-C38 WeakPolarHBondContact CE2-SG 3.39Å; Y34-C38 VanDerWaalsContact CZ-SG 3.55Å; Y34-C38 WeakPolarHBondContact O-CB 3.39Å; Y34-C38 PolarHBondContact O-N 3.04Å; Y34-C38 PolarHBondContact O-SG 3.13Å; Y34-F372 HydrophobicContact CD2-CB 3.62Å; Y34-F372 HydrophobicContact CD2-CD1 4.49Å; Y34-F372 AromaticContact CD2-CD2 3.33Å; Y34-F372 HydrophobicContact CD2-CD2 3.33Å; Y34-F372 AromaticContact CD2-CE2 3.97Å; Y34-F372 HydrophobicContact CD2-CE2 3.97Å; Y34-F372 AromaticContact CD2-CG 3.58Å; Y34-F372 HydrophobicContact CD2-CG 3.58Å; Y34-F372 HydrophobicContact CE2-CB 3.53Å; Y34-F372 AromaticContact CE2-CD2 3.52Å; Y34-F372 HydrophobicContact CE2-CD2 3.52Å; Y34-F372 HydrophobicContact CE2-CE2 4.45Å; Y34-F372 AromaticContact CE2-CG 3.85Å; Y34-F372 HydrophobicContact CE2-CG 3.85Å
35	D	75.7	Confident	73.4	Confident	95 Å²	95	91.2 Å²	91.2	51%	0.508	44%	0.442	S	S	.	.	H	α-helix	trans	-60.7	-39.9	-179.9	-81.4	-11.3	0	0	0	112.1	I31 T32 K39	I31-D35 PolarHBondContact O-N 3.31Å; T32-D35 PolarHBondContact O-N 3.48Å; D35-K39 VanDerWaalsContact O-CB 3.23Å; D35-K39 WeakPolarHBondContact O-CB 3.32Å; D35-K39 PolarHBondContact O-N 2.96Å
36	H	80.3	Confident	74.9	Confident	133 Å²	133	85.4 Å²	85.4	62%	0.616	42%	0.415	S	S	*	.	H	α-helix	trans	-70.6	-45.5	177.3	-78.4	-60.2	0	0	0	113.1	T32 L33 Y34 K39 Y40	T32-H36 PolarHBondContact O-CD2 3.4Å; T32-H36 PolarHBondContact O-N 2.94Å; T32-H36 VanDerWaalsContact O-N 3.11Å; L33-H36 PolarHBondContact O-N 3.3Å; Y34-H36 VanDerWaalsContact C-N 3.3Å; Y34-H36 PolarHBondContact O-N 3.41Å; H36-K39 PolarHBondContact O-N 3.39Å; H36-Y40 PolarHBondContact O-N 3.42Å
37	L	73.8	Confident	76.4	Confident	66 Å²	66	80 Å²	80	35%	0.346	39%	0.392	S	S	.	.	H	α-helix	trans	-68.5	-41.7	-179.9	-157.8	97.6	0	0	0	110.4	L33 Y34 Y40 F41 F372 L376	L33-L37 PolarHBondContact O-N 3.29Å; Y34-L37 PolarHBondContact O-N 3.15Å; L37-Y40 PolarHBondContact O-N 3.29Å; L37-F41 WeakPolarHBondContact O-CB 3.3Å; L37-F41 PolarHBondContact O-N 3.31Å; L37-F372 HydrophobicContact CB-CE2 3.88Å; L37-F372 HydrophobicContact CB-CZ 3.7Å; L37-F372 HydrophobicContact CD2-CE1 4.15Å; L37-F372 HydrophobicContact CD2-CE2 3.6Å; L37-F372 HydrophobicContact CD2-CZ 3.14Å; L37-F372 HydrophobicContact CG-CE2 4.26Å; L37-F372 HydrophobicContact CG-CZ 3.94Å; L37-L376 HydrophobicContact CD2-CD1 4.08Å; L37-L376 HydrophobicContact CD2-CD2 4.01Å
38	C	73.1	Confident	78	Confident	17 Å²	17	78.4 Å²	78.4	12%	0.115	39%	0.39	C	S	.	.	H	α-helix	trans	-50.8	-63.6	166.4	-77.7	0	0	0	0	108.1	Y34 Y40 F41 L42	Y34-C38 WeakPolarHBondContact CE2-SG 3.39Å; Y34-C38 VanDerWaalsContact CZ-SG 3.55Å; Y34-C38 WeakPolarHBondContact O-CB 3.39Å; Y34-C38 PolarHBondContact O-N 3.04Å; Y34-C38 PolarHBondContact O-SG 3.13Å; C38-Y40 VanDerWaalsContact C-N 3.26Å; C38-Y40 PolarHBondContact O-N 2.71Å; C38-F41 PolarHBondContact O-N 2.74Å; C38-L42 VanDerWaalsContact C-CG 3.49Å; C38-L42 HydrophobicContact CB-CD1 3.59Å; C38-L42 HydrophobicContact CB-CG 4.17Å; C38-L42 WeakPolarHBondContact O-CB 3.45Å; C38-L42 WeakPolarHBondContact O-CG 3.27Å; C38-L42 PolarHBondContact O-N 3.49Å
39	K	80.6	Confident	79.3	Confident	146 Å²	146	74.9 Å²	74.9	64%	0.635	37%	0.368	S	S	*	.	H	α-helix	trans	-50.1	-43	-177.7	-168.1	174	-176.5	176.4	0	114.3	D35 H36 V43	D35-K39 VanDerWaalsContact O-CB 3.23Å; D35-K39 WeakPolarHBondContact O-CB 3.32Å; D35-K39 PolarHBondContact O-N 2.96Å; H36-K39 PolarHBondContact O-N 3.39Å; K39-V43 HydrophobicContact CG-CG2 4.29Å; K39-V43 WeakPolarHBondContact O-CB 3.45Å; K39-V43 WeakPolarHBondContact O-CG2 3.32Å; K39-V43 PolarHBondContact O-N 3.43Å; K39-V43 VanDerWaalsContact O-N 3.12Å
40	Y	79.2	Confident	80.6	Confident	163 Å²	163	70 Å²	70	64%	0.639	34%	0.344	S	S	*	.	H	α-helix	trans	-65.6	-51.4	175.8	-179.1	-97.9	0	0	0	112.9	H36 L37 C38 L42 W44	H36-Y40 PolarHBondContact O-N 3.42Å; L37-Y40 PolarHBondContact O-N 3.29Å; C38-Y40 VanDerWaalsContact C-N 3.26Å; C38-Y40 PolarHBondContact O-N 2.71Å; Y40-L42 PolarHBondContact O-N 3.11Å; Y40-W44 PolarHBondContact O-N 2.98Å
41	F	78.4	Confident	82.1	Confident	18 Å²	18	70.1 Å²	70.1	8%	0.079	34%	0.342	C	S	.	.	I	π-helix	trans	-63.5	-42.9	-176.3	-173.1	-89.6	0	0	0	112	L37 C38 Y45 L46 L376 S379	L37-F41 WeakPolarHBondContact O-CB 3.3Å; L37-F41 PolarHBondContact O-N 3.31Å; C38-F41 PolarHBondContact O-N 2.74Å; F41-Y45 AromaticContact CD2-CD1 3.91Å; F41-Y45 HydrophobicContact CD2-CD1 3.91Å; F41-Y45 HydrophobicContact CD2-CG 4.06Å; F41-Y45 AromaticContact CE1-CD1 3.96Å; F41-Y45 HydrophobicContact CE1-CD1 3.96Å; F41-Y45 HydrophobicContact CE1-CE1 4.36Å; F41-Y45 AromaticContact CE2-CD1 3.08Å; F41-Y45 HydrophobicContact CE2-CD1 3.08Å; F41-Y45 HydrophobicContact CE2-CD2 4.27Å; F41-Y45 AromaticContact CE2-CE1 3.35Å; F41-Y45 HydrophobicContact CE2-CE1 3.35Å; F41-Y45 HydrophobicContact CE2-CE2 4.44Å; F41-Y45 AromaticContact CE2-CG 3.59Å; F41-Y45 HydrophobicContact CE2-CG 3.59Å; F41-Y45 AromaticContact CZ-CD1 3.03Å; F41-Y45 HydrophobicContact CZ-CD1 3.03Å; F41-Y45 AromaticContact CZ-CE1 3.21Å; F41-Y45 HydrophobicContact CZ-CE1 3.21Å; F41-Y45 AromaticContact CZ-CG 3.99Å; F41-Y45 HydrophobicContact CZ-CG 3.99Å; F41-Y45 WeakPolarHBondContact O-CB 3.42Å; F41-Y45 PolarHBondContact O-N 3.05Å; F41-L46 HydrophobicContact CE1-CB 4.44Å; F41-L46 PolarHBondContact O-N 3.39Å; F41-L46 VanDerWaalsContact O-N 3.15Å; F41-L376 HydrophobicContact CD2-CD1 3.7Å; F41-L376 HydrophobicContact CE2-CD1 3.82Å; F41-L376 HydrophobicContact CG-CD1 4.42Å; F41-S379 VanDerWaalsContact CE2-OG 3.3Å; F41-S379 WeakPolarHBondContact CE2-OG 3.37Å; F41-S379 WeakPolarHBondContact CZ-OG 2.79Å
42	L	71.6	Confident	83.2	Confident	39 Å²	39	70.9 Å²	70.9	20%	0.204	35%	0.346	C	S	.	.	I	π-helix	trans	-72.4	-40.3	-177.9	-59.1	176.3	0	0	0	112.1	C38 Y40 P47 I100 W101	C38-L42 VanDerWaalsContact C-CG 3.49Å; C38-L42 HydrophobicContact CB-CD1 3.59Å; C38-L42 HydrophobicContact CB-CG 4.17Å; C38-L42 WeakPolarHBondContact O-CB 3.45Å; C38-L42 WeakPolarHBondContact O-CG 3.27Å; C38-L42 PolarHBondContact O-N 3.49Å; Y40-L42 PolarHBondContact O-N 3.11Å; L42-P47 WeakPolarHBondContact O-CD 3.29Å; L42-I100 HydrophobicContact CB-CG2 3.25Å; L42-I100 HydrophobicContact CD1-CG2 3.45Å; L42-I100 VanDerWaalsContact CD1-CG2 3.45Å; L42-I100 HydrophobicContact CD2-CB 3.78Å; L42-I100 HydrophobicContact CD2-CD1 3.18Å; L42-I100 HydrophobicContact CD2-CG1 3.45Å; L42-I100 VanDerWaalsContact CD2-CG1 3.45Å; L42-I100 HydrophobicContact CD2-CG2 2.98Å; L42-I100 HydrophobicContact CG-CB 4.4Å; L42-I100 HydrophobicContact CG-CG2 3.18Å; L42-W101 PolarHBondContact O-NE1 3.38Å
43	V	82.6	Confident	84.3	Confident	69 Å²	69	67.7 Å²	67.7	42%	0.418	33%	0.326	S	S	.	.	I	π-helix	trans	-79.1	-41.3	-174.4	173.5	0	0	0	0	112.2	K39	K39-V43 HydrophobicContact CG-CG2 4.29Å; K39-V43 WeakPolarHBondContact O-CB 3.45Å; K39-V43 WeakPolarHBondContact O-CG2 3.32Å; K39-V43 PolarHBondContact O-N 3.43Å; K39-V43 VanDerWaalsContact O-N 3.12Å
44	W	89.7	Confident	85.4	Confident	171 Å²	171	63.8 Å²	63.8	65%	0.648	30%	0.304	S	S	*	.	I	π-helix	trans	-112.7	-49	-170.1	-71.5	109	0	0	0	113.8	Y40 T48	Y40-W44 PolarHBondContact O-N 2.98Å; W44-T48 VanDerWaalsContact O-CB 3.24Å; W44-T48 WeakPolarHBondContact O-CB 3.2Å; W44-T48 PolarHBondContact O-N 2.89Å; W44-T48 PolarHBondContact O-OG1 3.38Å
45	Y	91.3	Very high	86.7	Confident	45 Å²	45	67.2 Å²	67.2	18%	0.176	32%	0.321	C	S	.	.	I	π-helix	trans	-66.5	-54.5	-171.1	171.2	-84.2	0	0	0	111.3	F41 T48 V49 S379 L383	F41-Y45 AromaticContact CD2-CD1 3.91Å; F41-Y45 HydrophobicContact CD2-CD1 3.91Å; F41-Y45 HydrophobicContact CD2-CG 4.06Å; F41-Y45 AromaticContact CE1-CD1 3.96Å; F41-Y45 HydrophobicContact CE1-CD1 3.96Å; F41-Y45 HydrophobicContact CE1-CE1 4.36Å; F41-Y45 AromaticContact CE2-CD1 3.08Å; F41-Y45 HydrophobicContact CE2-CD1 3.08Å; F41-Y45 HydrophobicContact CE2-CD2 4.27Å; F41-Y45 AromaticContact CE2-CE1 3.35Å; F41-Y45 HydrophobicContact CE2-CE1 3.35Å; F41-Y45 HydrophobicContact CE2-CE2 4.44Å; F41-Y45 AromaticContact CE2-CG 3.59Å; F41-Y45 HydrophobicContact CE2-CG 3.59Å; F41-Y45 AromaticContact CZ-CD1 3.03Å; F41-Y45 HydrophobicContact CZ-CD1 3.03Å; F41-Y45 AromaticContact CZ-CE1 3.21Å; F41-Y45 HydrophobicContact CZ-CE1 3.21Å; F41-Y45 AromaticContact CZ-CG 3.99Å; F41-Y45 HydrophobicContact CZ-CG 3.99Å; F41-Y45 WeakPolarHBondContact O-CB 3.42Å; F41-Y45 PolarHBondContact O-N 3.05Å; Y45-T48 PolarHBondContact O-N 3.48Å; Y45-V49 HydrophobicContact CD1-CG2 4.19Å; Y45-V49 HydrophobicContact CD2-CG2 4.17Å; Y45-V49 HydrophobicContact CE1-CB 4.48Å; Y45-V49 HydrophobicContact CE1-CG2 3.8Å; Y45-V49 HydrophobicContact CE2-CG2 3.82Å; Y45-V49 HydrophobicContact CG-CG2 4.37Å; Y45-V49 WeakPolarHBondContact O-CG2 3.39Å; Y45-V49 PolarHBondContact O-N 3.05Å; Y45-S379 PolarHBondContact OH-O 3.49Å; Y45-L383 HydrophobicContact CE2-CD2 4.19Å; Y45-L383 WeakPolarHBondContact OH-CD1 3.34Å; Y45-L383 WeakPolarHBondContact OH-CG 3.33Å
46	L	90.8	Very high	87.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65	-47.7	-170.6	-173.4	69.4	0	0	0	112.9	F41 T48 V49 I50 M96 L97 I100 L382	F41-L46 HydrophobicContact CE1-CB 4.44Å; F41-L46 PolarHBondContact O-N 3.39Å; F41-L46 VanDerWaalsContact O-N 3.15Å; L46-T48 VanDerWaalsContact C-N 3.27Å; L46-T48 PolarHBondContact O-N 3.27Å; L46-V49 PolarHBondContact O-N 3.05Å; L46-I50 HydrophobicContact CD1-CD1 3.94Å; L46-I50 HydrophobicContact CD1-CG1 4.31Å; L46-I50 HydrophobicContact CD2-CD1 4.38Å; L46-I50 HydrophobicContact CG-CD1 3.71Å; L46-I50 HydrophobicContact CG-CG1 4.44Å; L46-I50 WeakPolarHBondContact O-CB 3.35Å; L46-I50 VanDerWaalsContact O-CG1 3.25Å; L46-I50 WeakPolarHBondContact O-CG1 3.48Å; L46-I50 PolarHBondContact O-N 3.15Å; L46-M96 HydrophobicContact CD1-CE 4.43Å; L46-M96 HydrophobicContact CD2-CB 3.94Å; L46-L97 HydrophobicContact CD2-CB 4.13Å; L46-L97 HydrophobicContact CD2-CD1 4.16Å; L46-L97 HydrophobicContact CG-CD1 4.41Å; L46-I100 HydrophobicContact CD2-CD1 3.65Å; L46-L382 HydrophobicContact CD1-CD1 4.11Å
47	P	93.2	Very high	88.2	Confident	23 Å²	23	56.7 Å²	56.7	15%	0.149	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-37.3	174.9	-21.3	31.7	0	0	0	112.7	L42 T51 L97 W101	L42-P47 WeakPolarHBondContact O-CD 3.29Å; P47-T51 WeakPolarHBondContact O-CB 3.38Å; P47-T51 PolarHBondContact O-N 2.99Å; P47-T51 PolarHBondContact O-OG1 3.14Å; P47-L97 HydrophobicContact CG-CD1 3.95Å; P47-W101 HydrophobicContact CB-CZ2 4.31Å; P47-W101 HydrophobicContact CG-CH2 4.29Å; P47-W101 HydrophobicContact CG-CZ2 3.4Å; P47-W101 VanDerWaalsContact CG-CZ2 3.4Å
48	T	94	Very high	89.1	Confident	68 Å²	68	57.3 Å²	57.3	42%	0.417	27%	0.273	S	S	.	.	H	α-helix	trans	-65.4	-48.7	179	-60.1	0	0	0	0	111.1	W44 Y45 L46 T51 L52	W44-T48 VanDerWaalsContact O-CB 3.24Å; W44-T48 WeakPolarHBondContact O-CB 3.2Å; W44-T48 PolarHBondContact O-N 2.89Å; W44-T48 PolarHBondContact O-OG1 3.38Å; Y45-T48 PolarHBondContact O-N 3.48Å; L46-T48 VanDerWaalsContact C-N 3.27Å; L46-T48 PolarHBondContact O-N 3.27Å; T48-T51 PolarHBondContact O-N 3.21Å; T48-L52 HydrophobicContact CG2-CD1 3.74Å; T48-L52 HydrophobicContact CG2-CG 4.32Å; T48-L52 VanDerWaalsContact O-CB 3.3Å; T48-L52 WeakPolarHBondContact O-CB 3.49Å; T48-L52 VanDerWaalsContact O-CG 3.3Å; T48-L52 WeakPolarHBondContact O-CG 3.43Å; T48-L52 PolarHBondContact O-N 3.03Å
49	V	94	Very high	90	Very high	9 Å²	9	58.8 Å²	58.8	6%	0.055	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-44.1	178.7	172.4	0	0	0	0	111.1	Y45 L46 G53 L382 L383 C386	Y45-V49 HydrophobicContact CD1-CG2 4.19Å; Y45-V49 HydrophobicContact CD2-CG2 4.17Å; Y45-V49 HydrophobicContact CE1-CB 4.48Å; Y45-V49 HydrophobicContact CE1-CG2 3.8Å; Y45-V49 HydrophobicContact CE2-CG2 3.82Å; Y45-V49 HydrophobicContact CG-CG2 4.37Å; Y45-V49 WeakPolarHBondContact O-CG2 3.39Å; Y45-V49 PolarHBondContact O-N 3.05Å; L46-V49 PolarHBondContact O-N 3.05Å; V49-G53 WeakPolarHBondContact O-CA 3.41Å; V49-G53 PolarHBondContact O-N 3.48Å; V49-L382 HydrophobicContact CG1-CB 3.94Å; V49-L383 HydrophobicContact CG2-CD2 3.87Å; V49-C386 HydrophobicContact CG1-CB 3.99Å; V49-C386 PolarHBondContact O-SG 3.13Å
50	I	94.6	Very high	90.5	Very high	10 Å²	10	52 Å²	52	5%	0.051	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-49.5	178.1	-69.9	170.3	0	0	0	110.6	L46 G53 F54 G93 L97	L46-I50 HydrophobicContact CD1-CD1 3.94Å; L46-I50 HydrophobicContact CD1-CG1 4.31Å; L46-I50 HydrophobicContact CD2-CD1 4.38Å; L46-I50 HydrophobicContact CG-CD1 3.71Å; L46-I50 HydrophobicContact CG-CG1 4.44Å; L46-I50 WeakPolarHBondContact O-CB 3.35Å; L46-I50 VanDerWaalsContact O-CG1 3.25Å; L46-I50 WeakPolarHBondContact O-CG1 3.48Å; L46-I50 PolarHBondContact O-N 3.15Å; I50-G53 PolarHBondContact O-N 3.37Å; I50-F54 HydrophobicContact CG2-CD2 3.48Å; I50-F54 VanDerWaalsContact CG2-CD2 3.48Å; I50-F54 HydrophobicContact CG2-CE2 3.53Å; I50-F54 WeakPolarHBondContact O-CB 3.39Å; I50-F54 VanDerWaalsContact O-CD2 3.26Å; I50-F54 WeakPolarHBondContact O-CD2 3.47Å; I50-F54 PolarHBondContact O-N 3.23Å; I50-G93 VanDerWaalsContact CD1-C 3.46Å; I50-G93 WeakPolarHBondContact CD1-O 3.4Å; I50-L97 HydrophobicContact CD1-CB 3.8Å; I50-L97 HydrophobicContact CD1-CD1 4.47Å; I50-L97 HydrophobicContact CD1-CD2 4.23Å; I50-L97 HydrophobicContact CD1-CG 4.4Å
51	T	95.2	Very high	91.1	Very high	70 Å²	70	48 Å²	48	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-62.3	-51.9	-178.1	-57.8	0	0	0	0	111	P47 T48 G53 F54 F55	P47-T51 WeakPolarHBondContact O-CB 3.38Å; P47-T51 PolarHBondContact O-N 2.99Å; P47-T51 PolarHBondContact O-OG1 3.14Å; T48-T51 PolarHBondContact O-N 3.21Å; T51-G53 VanDerWaalsContact C-N 3.29Å; T51-G53 PolarHBondContact O-N 3.47Å; T51-F54 PolarHBondContact O-N 3.32Å; T51-F55 HydrophobicContact CG2-CD2 3.72Å; T51-F55 HydrophobicContact CG2-CE2 3.64Å; T51-F55 WeakPolarHBondContact O-CD2 3.5Å; T51-F55 PolarHBondContact O-N 3.13Å; T51-F55 VanDerWaalsContact O-N 3.11Å
52	L	95.7	Very high	91.7	Very high	87 Å²	87	50.5 Å²	50.5	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-62.6	-37.9	177.6	-69.7	177	0	0	0	111.9	T48 G56	T48-L52 HydrophobicContact CG2-CD1 3.74Å; T48-L52 HydrophobicContact CG2-CG 4.32Å; T48-L52 VanDerWaalsContact O-CB 3.3Å; T48-L52 WeakPolarHBondContact O-CB 3.49Å; T48-L52 VanDerWaalsContact O-CG 3.3Å; T48-L52 WeakPolarHBondContact O-CG 3.43Å; T48-L52 PolarHBondContact O-N 3.03Å; L52-G56 WeakPolarHBondContact O-CA 3.32Å; L52-G56 PolarHBondContact O-N 3.5Å
53	G	95.6	Very high	92.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-45.3	178.2	0	0	0	0	0	112.6	V49 I50 T51 S57 C386	V49-G53 WeakPolarHBondContact O-CA 3.41Å; V49-G53 PolarHBondContact O-N 3.48Å; I50-G53 PolarHBondContact O-N 3.37Å; T51-G53 VanDerWaalsContact C-N 3.29Å; T51-G53 PolarHBondContact O-N 3.47Å; G53-S57 VanDerWaalsContact O-CB 3.23Å; G53-S57 WeakPolarHBondContact O-CB 3.42Å; G53-S57 PolarHBondContact O-N 3.12Å; G53-S57 PolarHBondContact O-OG 3.33Å; G53-C386 PolarHBondContact N-SG 3.47Å; G53-C386 VanDerWaalsContact N-SG 3.44Å
54	F	95.5	Very high	92.9	Very high	37 Å²	37	46 Å²	46	16%	0.162	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-53.8	178	-92.2	-66.2	0	0	0	111.9	I50 T51 G56 S57 I58 F86 L89 L90 I94	I50-F54 HydrophobicContact CG2-CD2 3.48Å; I50-F54 VanDerWaalsContact CG2-CD2 3.48Å; I50-F54 HydrophobicContact CG2-CE2 3.53Å; I50-F54 WeakPolarHBondContact O-CB 3.39Å; I50-F54 VanDerWaalsContact O-CD2 3.26Å; I50-F54 WeakPolarHBondContact O-CD2 3.47Å; I50-F54 PolarHBondContact O-N 3.23Å; T51-F54 PolarHBondContact O-N 3.32Å; F54-G56 VanDerWaalsContact C-N 3.29Å; F54-G56 PolarHBondContact O-N 3.04Å; F54-S57 PolarHBondContact O-N 3.41Å; F54-I58 WeakPolarHBondContact O-CG1 3.08Å; F54-I58 PolarHBondContact O-N 3.32Å; F54-F86 AromaticContact CD1-CD2 3.87Å; F54-F86 HydrophobicContact CD1-CD2 3.87Å; F54-F86 AromaticContact CD1-CE2 3.55Å; F54-F86 HydrophobicContact CD1-CE2 3.55Å; F54-F86 HydrophobicContact CD1-CZ 4.4Å; F54-F86 HydrophobicContact CE1-CD2 4.06Å; F54-F86 AromaticContact CE1-CE2 3.65Å; F54-F86 HydrophobicContact CE1-CE2 3.65Å; F54-F86 HydrophobicContact CE1-CZ 4.09Å; F54-L89 HydrophobicContact CE1-CB 4.5Å; F54-L89 HydrophobicContact CE2-CB 4.23Å; F54-L89 HydrophobicContact CZ-CB 4.2Å; F54-L90 HydrophobicContact CE1-CB 4.29Å; F54-L90 HydrophobicContact CE1-CD1 4.18Å; F54-L90 HydrophobicContact CZ-CB 4.13Å; F54-L90 HydrophobicContact CZ-CD1 4.02Å; F54-I94 HydrophobicContact CE2-CD1 4.13Å; F54-I94 HydrophobicContact CE2-CG1 3.99Å; F54-I94 HydrophobicContact CZ-CD1 3.84Å; F54-I94 HydrophobicContact CZ-CG1 4.08Å
55	F	95	Very high	92.9	Very high	145 Å²	145	42.3 Å²	42.3	64%	0.636	21%	0.213	S	C	*	.	H	α-helix	trans	-61.4	-42.2	178.8	-76.7	-64.9	0	0	0	111.3	T51 F59	T51-F55 HydrophobicContact CG2-CD2 3.72Å; T51-F55 HydrophobicContact CG2-CE2 3.64Å; T51-F55 WeakPolarHBondContact O-CD2 3.5Å; T51-F55 PolarHBondContact O-N 3.13Å; T51-F55 VanDerWaalsContact O-N 3.11Å; F55-F59 WeakPolarHBondContact O-CB 3.4Å; F55-F59 PolarHBondContact O-N 3.43Å
56	G	94	Very high	92.6	Very high	2 Å²	2	46.5 Å²	46.5	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-44.8	176.3	0	0	0	0	0	113.5	L52 F54 C60 W389	L52-G56 WeakPolarHBondContact O-CA 3.32Å; L52-G56 PolarHBondContact O-N 3.5Å; F54-G56 VanDerWaalsContact C-N 3.29Å; F54-G56 PolarHBondContact O-N 3.04Å; G56-C60 WeakPolarHBondContact O-CB 3.4Å; G56-C60 PolarHBondContact O-N 3.32Å; G56-W389 VanDerWaalsContact O-CB 3.29Å; G56-W389 WeakPolarHBondContact O-CB 3.47Å
57	S	93.8	Very high	92.1	Very high	6 Å²	6	47.2 Å²	47.2	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-68.5	-44.8	-180	-59.4	0	0	0	0	111.8	G53 F54 F59 C60 F61 C82	G53-S57 VanDerWaalsContact O-CB 3.23Å; G53-S57 WeakPolarHBondContact O-CB 3.42Å; G53-S57 PolarHBondContact O-N 3.12Å; G53-S57 PolarHBondContact O-OG 3.33Å; F54-S57 PolarHBondContact O-N 3.41Å; S57-F59 PolarHBondContact O-N 2.79Å; S57-C60 PolarHBondContact O-N 2.78Å; S57-F61 WeakPolarHBondContact O-CB 3.35Å; S57-F61 PolarHBondContact O-N 3.37Å; S57-C82 PolarHBondContact O-SG 2.88Å
58	I	93.7	Very high	91.5	Very high	79 Å²	79	56.1 Å²	56.1	41%	0.405	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-47.9	175.8	-67.4	167.9	0	0	0	110.2	F54 C60 F61 I62 F86	F54-I58 WeakPolarHBondContact O-CG1 3.08Å; F54-I58 PolarHBondContact O-N 3.32Å; I58-C60 VanDerWaalsContact C-N 3.33Å; I58-C60 PolarHBondContact O-N 3.45Å; I58-F61 PolarHBondContact O-N 3.13Å; I58-I62 HydrophobicContact CG2-CD1 3.87Å; I58-I62 WeakPolarHBondContact O-CG1 3.33Å; I58-I62 PolarHBondContact O-N 3.06Å; I58-F86 HydrophobicContact CD1-CE2 4.26Å; I58-F86 HydrophobicContact CG1-CD2 4.28Å; I58-F86 HydrophobicContact CG1-CE2 3.99Å
59	F	91.5	Very high	90.7	Very high	47 Å²	47	56 Å²	56	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-44.2	177.5	173.9	-102.6	0	0	0	111.8	F55 S57 F63 W389 F399 T403	F55-F59 WeakPolarHBondContact O-CB 3.4Å; F55-F59 PolarHBondContact O-N 3.43Å; S57-F59 PolarHBondContact O-N 2.79Å; F59-F63 VanDerWaalsContact O-CB 3.32Å; F59-F63 WeakPolarHBondContact O-CB 3.49Å; F59-F63 PolarHBondContact O-N 3.45Å; F59-W389 HydrophobicContact CD1-CE3 4.49Å; F59-F399 HydrophobicContact CE1-CE1 4.05Å; F59-F399 AromaticContact CE1-CZ 3.73Å; F59-F399 HydrophobicContact CE1-CZ 3.73Å; F59-F399 HydrophobicContact CZ-CE1 4.3Å; F59-F399 HydrophobicContact CZ-CZ 4.19Å; F59-T403 HydrophobicContact CE1-CG2 4.43Å; F59-T403 HydrophobicContact CE2-CG2 3.99Å; F59-T403 HydrophobicContact CZ-CG2 3.42Å; F59-T403 VanDerWaalsContact CZ-CG2 3.42Å
60	C	91.8	Very high	90.1	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-45.5	176.4	-178.8	0	0	0	0	111.8	G56 S57 I58 F63 L64 W389 Y392	G56-C60 WeakPolarHBondContact O-CB 3.4Å; G56-C60 PolarHBondContact O-N 3.32Å; S57-C60 PolarHBondContact O-N 2.78Å; I58-C60 VanDerWaalsContact C-N 3.33Å; I58-C60 PolarHBondContact O-N 3.45Å; C60-F63 WeakPolarHBondContact O-CB 3.47Å; C60-F63 PolarHBondContact O-N 3.31Å; C60-L64 WeakPolarHBondContact O-CB 3.2Å; C60-L64 VanDerWaalsContact O-CG 3.28Å; C60-L64 WeakPolarHBondContact O-CG 3.34Å; C60-L64 PolarHBondContact O-N 2.97Å; C60-W389 HydrophobicContact CB-CB 4.06Å; C60-Y392 HydrophobicContact CB-CD2 4.45Å; C60-Y392 WeakPolarHBondContact SG-CD2 3.41Å; C60-Y392 WeakPolarHBondContact SG-CE2 3.18Å
61	F	92	Very high	89.7	Confident	80 Å²	80	59.6 Å²	59.6	35%	0.351	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-50	179.3	-175.3	-103.6	0	0	0	111.8	S57 I58 F63 L64 I65 I79 V83	S57-F61 WeakPolarHBondContact O-CB 3.35Å; S57-F61 PolarHBondContact O-N 3.37Å; I58-F61 PolarHBondContact O-N 3.13Å; F61-F63 VanDerWaalsContact C-N 3.31Å; F61-F63 PolarHBondContact O-N 3.38Å; F61-L64 PolarHBondContact O-N 3.24Å; F61-I65 HydrophobicContact CD1-CD1 3.74Å; F61-I65 HydrophobicContact CE1-CD1 3.3Å; F61-I65 HydrophobicContact CE2-CD1 4.19Å; F61-I65 HydrophobicContact CG-CD1 4.36Å; F61-I65 HydrophobicContact CZ-CD1 3.56Å; F61-I65 WeakPolarHBondContact O-CG1 3.31Å; F61-I65 PolarHBondContact O-N 3.18Å; F61-I65 VanDerWaalsContact O-N 3.07Å; F61-I79 HydrophobicContact CD2-CG2 4.47Å; F61-I79 HydrophobicContact CE2-CG2 4.02Å; F61-V83 HydrophobicContact CD2-CG2 3.98Å; F61-V83 HydrophobicContact CE2-CG2 3.63Å
62	I	90.7	Very high	89.4	Confident	71 Å²	71	60.1 Å²	60.1	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-58.5	-46	175.8	-67	168.9	0	0	0	110.3	I58 L64 I65 H66	I58-I62 HydrophobicContact CG2-CD1 3.87Å; I58-I62 WeakPolarHBondContact O-CG1 3.33Å; I58-I62 PolarHBondContact O-N 3.06Å; I62-L64 PolarHBondContact O-N 3.32Å; I62-I65 PolarHBondContact O-N 2.88Å; I62-H66 PolarHBondContact O-CD2 3Å; I62-H66 PolarHBondContact O-N 3.43Å; I62-H66 VanDerWaalsContact O-N 3.16Å
63	F	88.4	Confident	89.1	Confident	13 Å²	13	57.7 Å²	57.7	6%	0.057	29%	0.286	C	S	.	.	H	α-helix	trans	-59.7	-48.8	177.8	176.2	-86.2	0	0	0	111.5	F59 C60 F61 I65 H66 S67 F70 F399 R402	F59-F63 VanDerWaalsContact O-CB 3.32Å; F59-F63 WeakPolarHBondContact O-CB 3.49Å; F59-F63 PolarHBondContact O-N 3.45Å; C60-F63 WeakPolarHBondContact O-CB 3.47Å; C60-F63 PolarHBondContact O-N 3.31Å; F61-F63 VanDerWaalsContact C-N 3.31Å; F61-F63 PolarHBondContact O-N 3.38Å; F63-I65 VanDerWaalsContact C-N 3.34Å; F63-I65 PolarHBondContact O-N 3.01Å; F63-H66 CarbonylContact O-C 3.59Å; F63-H66 PolarHBondContact O-N 3.4Å; F63-S67 VanDerWaalsContact CE1-CB 3.42Å; F63-S67 WeakPolarHBondContact O-CB 3.47Å; F63-S67 PolarHBondContact O-N 2.91Å; F63-S67 PolarHBondContact O-OG 3.29Å; F63-F70 HydrophobicContact CE1-CE2 4.09Å; F63-F399 HydrophobicContact CB-CE2 4.37Å; F63-F399 AromaticContact CD1-CD2 3.74Å; F63-F399 HydrophobicContact CD1-CD2 3.74Å; F63-F399 AromaticContact CD1-CE2 3.22Å; F63-F399 HydrophobicContact CD1-CE2 3.22Å; F63-F399 HydrophobicContact CD1-CZ 4.15Å; F63-F399 AromaticContact CD2-CD2 3.94Å; F63-F399 HydrophobicContact CD2-CD2 3.94Å; F63-F399 HydrophobicContact CD2-CE1 4.49Å; F63-F399 AromaticContact CD2-CE2 3.54Å; F63-F399 HydrophobicContact CD2-CE2 3.54Å; F63-F399 AromaticContact CD2-CZ 3.84Å; F63-F399 HydrophobicContact CD2-CZ 3.84Å; F63-F399 AromaticContact CE1-CD2 3.17Å; F63-F399 HydrophobicContact CE1-CD2 3.17Å; F63-F399 AromaticContact CE1-CE2 3.22Å; F63-F399 HydrophobicContact CE1-CE2 3.22Å; F63-F399 HydrophobicContact CE1-CG 4.31Å; F63-F399 HydrophobicContact CE1-CZ 4.39Å; F63-F399 HydrophobicContact CE2-CB 4.48Å; F63-F399 HydrophobicContact CE2-CD1 4.4Å; F63-F399 AromaticContact CE2-CD2 3.38Å; F63-F399 HydrophobicContact CE2-CD2 3.38Å; F63-F399 HydrophobicContact CE2-CE1 4.5Å; F63-F399 AromaticContact CE2-CE2 3.51Å; F63-F399 HydrophobicContact CE2-CE2 3.51Å; F63-F399 AromaticContact CE2-CG 3.84Å; F63-F399 HydrophobicContact CE2-CG 3.84Å; F63-F399 HydrophobicContact CE2-CZ 4.08Å; F63-F399 HydrophobicContact CG-CD2 4.1Å; F63-F399 AromaticContact CG-CE2 3.4Å; F63-F399 HydrophobicContact CG-CE2 3.4Å; F63-F399 VanDerWaalsContact CG-CE2 3.4Å; F63-F399 AromaticContact CG-CZ 3.88Å; F63-F399 HydrophobicContact CG-CZ 3.88Å; F63-F399 HydrophobicContact CZ-CB 4.17Å; F63-F399 AromaticContact CZ-CD2 2.98Å; F63-F399 HydrophobicContact CZ-CD2 2.98Å; F63-F399 AromaticContact CZ-CE2 3.38Å; F63-F399 HydrophobicContact CZ-CE2 3.38Å; F63-F399 AromaticContact CZ-CG 3.72Å; F63-F399 HydrophobicContact CZ-CG 3.72Å; F63-F399 HydrophobicContact CZ-CZ 4.37Å; F63-R402 HydrophobicContact CE2-CB 4.21Å
64	L	89.9	Confident	88.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-45.7	-176.9	-75.3	173.7	0	0	0	110.8	C60 F61 I62 H66 S67 F70 L75 L78 I79 C82	C60-L64 WeakPolarHBondContact O-CB 3.2Å; C60-L64 VanDerWaalsContact O-CG 3.28Å; C60-L64 WeakPolarHBondContact O-CG 3.34Å; C60-L64 PolarHBondContact O-N 2.97Å; F61-L64 PolarHBondContact O-N 3.24Å; I62-L64 PolarHBondContact O-N 3.32Å; L64-H66 VanDerWaalsContact C-N 3.32Å; L64-H66 PolarHBondContact O-N 3.21Å; L64-S67 PolarHBondContact O-N 3.47Å; L64-S67 PolarHBondContact O-OG 3.01Å; L64-S67 VanDerWaalsContact O-OG 3.06Å; L64-F70 HydrophobicContact CD2-CD2 3.86Å; L64-F70 HydrophobicContact CD2-CE2 3.61Å; L64-L75 HydrophobicContact CB-CD1 3.91Å; L64-L75 HydrophobicContact CD2-CD1 3.95Å; L64-L75 HydrophobicContact CG-CD1 4.49Å; L64-L75 WeakPolarHBondContact O-CD1 3.36Å; L64-L78 HydrophobicContact CD1-CB 3.92Å; L64-L78 HydrophobicContact CD2-CB 3.99Å; L64-L78 HydrophobicContact CD2-CD1 4.01Å; L64-I79 HydrophobicContact CB-CG1 3.94Å; L64-I79 HydrophobicContact CD1-CG1 4.12Å; L64-C82 HydrophobicContact CD1-CB 4.13Å
65	I	89.4	Confident	88.6	Confident	93 Å²	93	57.6 Å²	57.6	48%	0.477	29%	0.287	S	S	.	.	H	α-helix	trans	-58.6	-42.1	177.1	-70.4	172.7	0	0	0	111.8	F61 I62 F63	F61-I65 HydrophobicContact CD1-CD1 3.74Å; F61-I65 HydrophobicContact CE1-CD1 3.3Å; F61-I65 HydrophobicContact CE2-CD1 4.19Å; F61-I65 HydrophobicContact CG-CD1 4.36Å; F61-I65 HydrophobicContact CZ-CD1 3.56Å; F61-I65 WeakPolarHBondContact O-CG1 3.31Å; F61-I65 PolarHBondContact O-N 3.18Å; F61-I65 VanDerWaalsContact O-N 3.07Å; I62-I65 PolarHBondContact O-N 2.88Å; F63-I65 VanDerWaalsContact C-N 3.34Å; F63-I65 PolarHBondContact O-N 3.01Å
66	H	86.9	Confident	88.5	Confident	133 Å²	133	52.1 Å²	52.1	62%	0.616	26%	0.264	S	S	*	.	H	α-helix	trans	-84.9	-16.6	-179.1	-69.3	-56.6	0	0	0	114	I62 F63 L64 K68	I62-H66 PolarHBondContact O-CD2 3Å; I62-H66 PolarHBondContact O-N 3.43Å; I62-H66 VanDerWaalsContact O-N 3.16Å; F63-H66 CarbonylContact O-C 3.59Å; F63-H66 PolarHBondContact O-N 3.4Å; L64-H66 VanDerWaalsContact C-N 3.32Å; L64-H66 PolarHBondContact O-N 3.21Å; H66-K68 PolarHBondContact O-N 2.94Å
67	S	78.8	Confident	88.5	Confident	15 Å²	15	52.5 Å²	52.5	11%	0.105	27%	0.265	C	S	.	.			trans	-79.6	114.5	-174.1	75	0	0	0	0	111.8	F63 L64 M69	F63-S67 VanDerWaalsContact CE1-CB 3.42Å; F63-S67 WeakPolarHBondContact O-CB 3.47Å; F63-S67 PolarHBondContact O-N 2.91Å; F63-S67 PolarHBondContact O-OG 3.29Å; L64-S67 PolarHBondContact O-N 3.47Å; L64-S67 PolarHBondContact O-OG 3.01Å; L64-S67 VanDerWaalsContact O-OG 3.06Å; S67-M69 PolarHBondContact O-N 3.36Å
68	K	80.9	Confident	88.5	Confident	211 Å²	211	52.3 Å²	52.3	92%	0.917	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	13.8	165.6	-62.5	-174.3	179.4	-178.2	0	112.9	H66	H66-K68 PolarHBondContact O-N 2.94Å
69	M	77.3	Confident	88.5	Confident	66 Å²	66	50.7 Å²	50.7	33%	0.325	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-31.6	-172.1	-170.8	176	74.2	0	0	112.2	S67 K398	S67-M69 PolarHBondContact O-N 3.36Å; M69-K398 HydrophobicContact SD-CB 4.18Å
70	F	81.3	Confident	88.8	Confident	20 Å²	20	49 Å²	49	9%	0.088	25%	0.249	C	C	.	.	S	Bend	trans	-98.7	146.2	-176.2	-58.1	-61.8	0	0	0	110.6	F63 L64 L74 L75 L78 V333	F63-F70 HydrophobicContact CE1-CE2 4.09Å; L64-F70 HydrophobicContact CD2-CD2 3.86Å; L64-F70 HydrophobicContact CD2-CE2 3.61Å; F70-L74 HydrophobicContact CB-CB 4.47Å; F70-L74 HydrophobicContact CB-CD2 3.94Å; F70-L74 HydrophobicContact CD1-CD2 3.36Å; F70-L74 HydrophobicContact CE1-CD2 4.06Å; F70-L74 HydrophobicContact CG-CD2 3.9Å; F70-L75 HydrophobicContact CB-CB 4.35Å; F70-L75 HydrophobicContact CD2-CD1 4.42Å; F70-L78 HydrophobicContact CD1-CD1 4.2Å; F70-L78 HydrophobicContact CD2-CD1 4Å; F70-L78 HydrophobicContact CE1-CD1 4.13Å; F70-L78 HydrophobicContact CE2-CD1 3.97Å; F70-L78 HydrophobicContact CG-CD1 4.08Å; F70-L78 HydrophobicContact CZ-CD1 4Å; F70-V333 HydrophobicContact CD1-CG2 4.06Å; F70-V333 HydrophobicContact CE1-CG2 3.94Å
71	T	85.4	Confident	88.9	Confident	74 Å²	74	49 Å²	49	45%	0.454	25%	0.249	S	C	.	.			trans	-62.6	143.9	168.1	54.8	0	0	0	0	108.9	N73 L74 L75	T71-N73 PolarHBondContact O-N 3.23Å; T71-N73 VanDerWaalsContact O-N 3.09Å; T71-L74 WeakPolarHBondContact O-CA 3.34Å; T71-L74 WeakPolarHBondContact O-CB 3.41Å; T71-L74 PolarHBondContact O-N 2.77Å; T71-L75 PolarHBondContact O-N 3.39Å
72	S	88.9	Confident	89.1	Confident	80 Å²	80	45.4 Å²	45.4	56%	0.559	23%	0.234	S	C	*	.	H	α-helix	trans	-53.2	-36.7	-177.7	-51.3	0	0	0	0	112.6	L74 L75 I76	S72-L74 VanDerWaalsContact C-N 3.33Å; S72-L74 PolarHBondContact O-N 3Å; S72-L75 PolarHBondContact O-N 3.36Å; S72-I76 PolarHBondContact O-N 2.93Å
73	N	89.3	Confident	89.4	Confident	36 Å²	36	44.7 Å²	44.7	19%	0.193	23%	0.232	C	C	.	.	H	α-helix	trans	-65.8	-31.1	176.6	-68.8	-3.8	0	0	0	113.9	T71 I76 W77 I154 L159	T71-N73 PolarHBondContact O-N 3.23Å; T71-N73 VanDerWaalsContact O-N 3.09Å; N73-I76 WeakPolarHBondContact O-CG2 3.27Å; N73-W77 PolarHBondContact O-NE1 3.31Å; N73-I154 PolarHBondContact ND2-O 3.36Å; N73-I154 PolarHBondContact OD1-O 2.82Å; N73-L159 HydrophobicContact CB-CD1 3.66Å
74	L	89.9	Confident	89.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-79.1	-43.3	173.2	-179.6	68.1	0	0	0	110.3	F70 T71 S72 I76 W77 L78 L135 R139 V333	F70-L74 HydrophobicContact CB-CB 4.47Å; F70-L74 HydrophobicContact CB-CD2 3.94Å; F70-L74 HydrophobicContact CD1-CD2 3.36Å; F70-L74 HydrophobicContact CE1-CD2 4.06Å; F70-L74 HydrophobicContact CG-CD2 3.9Å; T71-L74 WeakPolarHBondContact O-CA 3.34Å; T71-L74 WeakPolarHBondContact O-CB 3.41Å; T71-L74 PolarHBondContact O-N 2.77Å; S72-L74 VanDerWaalsContact C-N 3.33Å; S72-L74 PolarHBondContact O-N 3Å; L74-I76 PolarHBondContact O-N 3.43Å; L74-W77 PolarHBondContact O-N 3.45Å; L74-L78 HydrophobicContact CD1-CG 4.4Å; L74-L78 HydrophobicContact CD2-CD1 3.88Å; L74-L78 HydrophobicContact CG-CD1 3.87Å; L74-L78 HydrophobicContact CG-CG 4.09Å; L74-L78 PolarHBondContact O-N 3.47Å; L74-L78 VanDerWaalsContact O-N 3.13Å; L74-L135 HydrophobicContact CD1-CD1 3.22Å; L74-R139 VanDerWaalsContact CG-NH2 3.27Å; L74-V333 HydrophobicContact CD1-CG1 4.5Å; L74-V333 HydrophobicContact CD2-CG1 3.79Å; L74-V333 HydrophobicContact CD2-CG2 4.06Å
75	L	91.1	Very high	90.1	Very high	35 Å²	35	44.3 Å²	44.3	18%	0.183	23%	0.231	C	C	.	.	H	α-helix	trans	-55.5	-41.1	-174.5	-178	63.3	0	0	0	111.5	L64 F70 T71 S72 W77 L78 I79	L64-L75 HydrophobicContact CB-CD1 3.91Å; L64-L75 HydrophobicContact CD2-CD1 3.95Å; L64-L75 HydrophobicContact CG-CD1 4.49Å; L64-L75 WeakPolarHBondContact O-CD1 3.36Å; F70-L75 HydrophobicContact CB-CB 4.35Å; F70-L75 HydrophobicContact CD2-CD1 4.42Å; T71-L75 PolarHBondContact O-N 3.39Å; S72-L75 PolarHBondContact O-N 3.36Å; L75-W77 VanDerWaalsContact C-N 3.32Å; L75-W77 PolarHBondContact O-N 3.02Å; L75-L78 PolarHBondContact O-N 3.4Å; L75-I79 HydrophobicContact CD1-CD1 3.92Å; L75-I79 HydrophobicContact CD1-CG1 4.09Å; L75-I79 HydrophobicContact CD2-CD1 4.31Å; L75-I79 HydrophobicContact CG-CD1 3.73Å; L75-I79 HydrophobicContact CG-CG1 4.27Å; L75-I79 WeakPolarHBondContact O-CB 3.35Å; L75-I79 VanDerWaalsContact O-CG1 3.32Å; L75-I79 WeakPolarHBondContact O-CG1 3.46Å; L75-I79 PolarHBondContact O-N 3.48Å
76	I	93.9	Very high	90.4	Very high	30 Å²	30	43 Å²	43	15%	0.154	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-38.3	178.6	-163.7	171.9	0	0	0	113.1	S72 N73 L74 S80 L156 L159 I160	S72-I76 PolarHBondContact O-N 2.93Å; N73-I76 WeakPolarHBondContact O-CG2 3.27Å; L74-I76 PolarHBondContact O-N 3.43Å; I76-S80 WeakPolarHBondContact O-CB 3.35Å; I76-S80 PolarHBondContact O-N 3.22Å; I76-L156 HydrophobicContact CB-CD1 4.31Å; I76-L156 HydrophobicContact CD1-CD1 3.95Å; I76-L156 HydrophobicContact CG2-CD1 4.43Å; I76-L159 HydrophobicContact CG2-CB 4.42Å; I76-L159 HydrophobicContact CG2-CD1 3.84Å; I76-I160 HydrophobicContact CD1-CD1 4.17Å; I76-I160 HydrophobicContact CD1-CG1 3.45Å; I76-I160 VanDerWaalsContact CD1-CG1 3.45Å
77	W	94.2	Very high	90.9	Very high	9 Å²	9	39.6 Å²	39.6	3%	0.034	21%	0.208	C	C	.	.	H	α-helix	trans	-70.2	-44.2	176.4	-61.8	118	0	0	0	111.5	N73 L74 L75 I79 S80 I81 M131 L134 L135 L159 Q163	N73-W77 PolarHBondContact O-NE1 3.31Å; L74-W77 PolarHBondContact O-N 3.45Å; L75-W77 VanDerWaalsContact C-N 3.32Å; L75-W77 PolarHBondContact O-N 3.02Å; W77-I79 VanDerWaalsContact C-N 3.35Å; W77-I79 PolarHBondContact O-N 3.05Å; W77-S80 WeakPolarHBondContact O-CB 3.31Å; W77-S80 PolarHBondContact O-N 3.19Å; W77-I81 WeakPolarHBondContact O-CG1 3.46Å; W77-I81 PolarHBondContact O-N 3.01Å; W77-M131 HydrophobicContact CE3-SD 3.73Å; W77-M131 HydrophobicContact CZ3-CE 4.3Å; W77-M131 HydrophobicContact CZ3-SD 3.6Å; W77-L134 HydrophobicContact CE3-CB 4.36Å; W77-L134 HydrophobicContact CH2-CB 3.87Å; W77-L134 HydrophobicContact CH2-CD1 3.63Å; W77-L134 HydrophobicContact CH2-CG 4.28Å; W77-L134 HydrophobicContact CZ2-CB 4.26Å; W77-L134 HydrophobicContact CZ3-CB 3.91Å; W77-L134 HydrophobicContact CZ3-CD1 3.49Å; W77-L134 VanDerWaalsContact CZ3-CD1 3.49Å; W77-L134 HydrophobicContact CZ3-CG 4.35Å; W77-L135 HydrophobicContact CB-CB 4.39Å; W77-L135 HydrophobicContact CB-CD1 4.23Å; W77-L159 HydrophobicContact CZ2-CD2 3.54Å; W77-Q163 HydrophobicContact CE3-CG 4.16Å; W77-Q163 HydrophobicContact CH2-CG 3.81Å; W77-Q163 HydrophobicContact CZ3-CG 3.41Å; W77-Q163 VanDerWaalsContact CZ3-CG 3.41Å
78	L	93.5	Very high	91.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-40.5	179.6	-60	-179.8	0	0	0	111.7	L64 F70 L74 L75 C82 L135 Y392	L64-L78 HydrophobicContact CD1-CB 3.92Å; L64-L78 HydrophobicContact CD2-CB 3.99Å; L64-L78 HydrophobicContact CD2-CD1 4.01Å; F70-L78 HydrophobicContact CD1-CD1 4.2Å; F70-L78 HydrophobicContact CD2-CD1 4Å; F70-L78 HydrophobicContact CE1-CD1 4.13Å; F70-L78 HydrophobicContact CE2-CD1 3.97Å; F70-L78 HydrophobicContact CG-CD1 4.08Å; F70-L78 HydrophobicContact CZ-CD1 4Å; L74-L78 HydrophobicContact CD1-CG 4.4Å; L74-L78 HydrophobicContact CD2-CD1 3.88Å; L74-L78 HydrophobicContact CG-CD1 3.87Å; L74-L78 HydrophobicContact CG-CG 4.09Å; L74-L78 PolarHBondContact O-N 3.47Å; L74-L78 VanDerWaalsContact O-N 3.13Å; L75-L78 PolarHBondContact O-N 3.4Å; L78-C82 VanDerWaalsContact O-CB 3.27Å; L78-C82 WeakPolarHBondContact O-CB 3.36Å; L78-C82 PolarHBondContact O-N 3.31Å; L78-L135 HydrophobicContact CD2-CD2 3.72Å; L78-Y392 HydrophobicContact CD1-CE1 4.1Å; L78-Y392 HydrophobicContact CD2-CE1 3.94Å; L78-Y392 WeakPolarHBondContact CD2-OH 3.44Å; L78-Y392 HydrophobicContact CG-CE1 4.46Å
79	I	94.5	Very high	92.6	Very high	45 Å²	45	28.9 Å²	28.9	23%	0.231	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-44.7	174	-70	174.6	0	0	0	110	F61 L64 L75 W77 I81 C82 V83	F61-I79 HydrophobicContact CD2-CG2 4.47Å; F61-I79 HydrophobicContact CE2-CG2 4.02Å; L64-I79 HydrophobicContact CB-CG1 3.94Å; L64-I79 HydrophobicContact CD1-CG1 4.12Å; L75-I79 HydrophobicContact CD1-CD1 3.92Å; L75-I79 HydrophobicContact CD1-CG1 4.09Å; L75-I79 HydrophobicContact CD2-CD1 4.31Å; L75-I79 HydrophobicContact CG-CD1 3.73Å; L75-I79 HydrophobicContact CG-CG1 4.27Å; L75-I79 WeakPolarHBondContact O-CB 3.35Å; L75-I79 VanDerWaalsContact O-CG1 3.32Å; L75-I79 WeakPolarHBondContact O-CG1 3.46Å; L75-I79 PolarHBondContact O-N 3.48Å; W77-I79 VanDerWaalsContact C-N 3.35Å; W77-I79 PolarHBondContact O-N 3.05Å; I79-I81 PolarHBondContact O-N 3.45Å; I79-C82 PolarHBondContact O-N 3.44Å; I79-V83 HydrophobicContact CG2-CG2 4.18Å; I79-V83 WeakPolarHBondContact O-CB 3.43Å; I79-V83 VanDerWaalsContact O-CG2 3.3Å; I79-V83 WeakPolarHBondContact O-CG2 3.49Å; I79-V83 PolarHBondContact O-N 3.01Å
80	S	96	Very high	93.5	Very high	13 Å²	13	29.3 Å²	29.3	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-59	-46	177.9	-172.5	0	0	0	0	112.2	I76 W77 V83 S84 W127 M131	I76-S80 WeakPolarHBondContact O-CB 3.35Å; I76-S80 PolarHBondContact O-N 3.22Å; W77-S80 WeakPolarHBondContact O-CB 3.31Å; W77-S80 PolarHBondContact O-N 3.19Å; S80-V83 PolarHBondContact O-N 3.22Å; S80-S84 WeakPolarHBondContact O-CB 3.44Å; S80-S84 PolarHBondContact O-N 3.08Å; S80-W127 PolarHBondContact OG-NE1 3.19Å; S80-W127 VanDerWaalsContact OG-NE1 3.13Å; S80-M131 WeakPolarHBondContact OG-CG 3.29Å; S80-M131 PolarHBondContact OG-SD 2.91Å
81	I	95.7	Very high	94.3	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-49.1	175.1	-66.3	166.6	0	0	0	110.2	W77 I79 V83 S84 D85 M131 Q132 L135	W77-I81 WeakPolarHBondContact O-CG1 3.46Å; W77-I81 PolarHBondContact O-N 3.01Å; I79-I81 PolarHBondContact O-N 3.45Å; I81-V83 VanDerWaalsContact C-N 3.34Å; I81-V83 PolarHBondContact O-N 2.9Å; I81-S84 WeakPolarHBondContact O-CB 3.22Å; I81-S84 PolarHBondContact O-N 3.29Å; I81-S84 VanDerWaalsContact O-N 3.13Å; I81-D85 WeakPolarHBondContact O-CB 3.45Å; I81-D85 PolarHBondContact O-N 3.03Å; I81-M131 HydrophobicContact CD1-CB 4.43Å; I81-M131 HydrophobicContact CG1-CB 3.65Å; I81-Q132 HydrophobicContact CD1-CB 4.33Å; I81-L135 HydrophobicContact CD1-CD2 3.74Å
82	C	95.7	Very high	94.7	Very high	4 Å²	4	26.2 Å²	26.2	3%	0.027	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-40.5	-179.2	-174.1	0	0	0	0	113	S57 L64 L78 I79 F86	S57-C82 PolarHBondContact O-SG 2.88Å; L64-C82 HydrophobicContact CD1-CB 4.13Å; L78-C82 VanDerWaalsContact O-CB 3.27Å; L78-C82 WeakPolarHBondContact O-CB 3.36Å; L78-C82 PolarHBondContact O-N 3.31Å; I79-C82 PolarHBondContact O-N 3.44Å; C82-F86 WeakPolarHBondContact O-CB 3.23Å; C82-F86 PolarHBondContact O-N 3.33Å; C82-F86 VanDerWaalsContact O-N 3.1Å
83	V	96.1	Very high	95	Very high	56 Å²	56	22.4 Å²	22.4	34%	0.339	12%	0.119	S	C	.	.	H	α-helix	trans	-66.4	-43.6	175.4	170.5	0	0	0	0	110	F61 I79 S80 I81 D85 F86 L87	F61-V83 HydrophobicContact CD2-CG2 3.98Å; F61-V83 HydrophobicContact CE2-CG2 3.63Å; I79-V83 HydrophobicContact CG2-CG2 4.18Å; I79-V83 WeakPolarHBondContact O-CB 3.43Å; I79-V83 VanDerWaalsContact O-CG2 3.3Å; I79-V83 WeakPolarHBondContact O-CG2 3.49Å; I79-V83 PolarHBondContact O-N 3.01Å; S80-V83 PolarHBondContact O-N 3.22Å; I81-V83 VanDerWaalsContact C-N 3.34Å; I81-V83 PolarHBondContact O-N 2.9Å; V83-D85 PolarHBondContact O-N 3.42Å; V83-F86 PolarHBondContact O-N 3.3Å; V83-L87 HydrophobicContact CG1-CD1 3.98Å; V83-L87 HydrophobicContact CG1-CG 4.42Å; V83-L87 VanDerWaalsContact O-CG 3.28Å; V83-L87 WeakPolarHBondContact O-CG 3.33Å; V83-L87 PolarHBondContact O-N 2.91Å
84	S	96.8	Very high	95.3	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.007	12%	0.124	C	C	.	.	H	α-helix	trans	-60.2	-46.2	176.5	-160.6	0	0	0	0	112.2	S80 I81 F86 L87 I88 L124 S128	S80-S84 WeakPolarHBondContact O-CB 3.44Å; S80-S84 PolarHBondContact O-N 3.08Å; I81-S84 WeakPolarHBondContact O-CB 3.22Å; I81-S84 PolarHBondContact O-N 3.29Å; I81-S84 VanDerWaalsContact O-N 3.13Å; S84-F86 VanDerWaalsContact C-N 3.34Å; S84-F86 PolarHBondContact O-N 3.31Å; S84-L87 PolarHBondContact O-N 2.86Å; S84-L87 VanDerWaalsContact O-N 3.16Å; S84-I88 VanDerWaalsContact O-CG1 3.26Å; S84-I88 WeakPolarHBondContact O-CG1 3.33Å; S84-I88 PolarHBondContact O-N 3.24Å; S84-L124 PolarHBondContact OG-O 3.34Å; S84-L124 VanDerWaalsContact OG-O 3.11Å; S84-S128 WeakPolarHBondContact OG-CB 3.45Å; S84-S128 PolarHBondContact OG-N 3.37Å
85	D	96	Very high	95.6	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-42.6	-179.4	-69.3	-13.4	0	0	0	111.4	I81 V83 I88 L89 S128 T385 N388	I81-D85 WeakPolarHBondContact O-CB 3.45Å; I81-D85 PolarHBondContact O-N 3.03Å; V83-D85 PolarHBondContact O-N 3.42Å; D85-I88 PolarHBondContact O-N 3.23Å; D85-L89 WeakPolarHBondContact O-CG 3.45Å; D85-L89 PolarHBondContact O-N 2.73Å; D85-S128 PolarHBondContact OD1-OG 3.23Å; D85-S128 VanDerWaalsContact OD1-OG 3.06Å; D85-T385 HydrophobicContact CB-CG2 4.1Å; D85-N388 PolarHBondContact OD2-ND2 2.88Å
86	F	96.9	Very high	95.6	Very high	65 Å²	65	22 Å²	22	29%	0.285	12%	0.116	S	C	.	.	H	α-helix	trans	-59.6	-46.7	172.8	176.2	-94	0	0	0	111.5	F54 I58 C82 V83 S84 L89 L90	F54-F86 AromaticContact CD1-CD2 3.87Å; F54-F86 HydrophobicContact CD1-CD2 3.87Å; F54-F86 AromaticContact CD1-CE2 3.55Å; F54-F86 HydrophobicContact CD1-CE2 3.55Å; F54-F86 HydrophobicContact CD1-CZ 4.4Å; F54-F86 HydrophobicContact CE1-CD2 4.06Å; F54-F86 AromaticContact CE1-CE2 3.65Å; F54-F86 HydrophobicContact CE1-CE2 3.65Å; F54-F86 HydrophobicContact CE1-CZ 4.09Å; I58-F86 HydrophobicContact CD1-CE2 4.26Å; I58-F86 HydrophobicContact CG1-CD2 4.28Å; I58-F86 HydrophobicContact CG1-CE2 3.99Å; C82-F86 WeakPolarHBondContact O-CB 3.23Å; C82-F86 PolarHBondContact O-N 3.33Å; C82-F86 VanDerWaalsContact O-N 3.1Å; V83-F86 PolarHBondContact O-N 3.3Å; S84-F86 VanDerWaalsContact C-N 3.34Å; S84-F86 PolarHBondContact O-N 3.31Å; F86-L89 PolarHBondContact O-N 2.86Å; F86-L90 HydrophobicContact CE1-CD2 4.41Å; F86-L90 WeakPolarHBondContact O-CB 3.38Å; F86-L90 PolarHBondContact O-N 2.87Å
87	L	97.6	Very high	95.5	Very high	62 Å²	62	22.2 Å²	22.2	33%	0.325	12%	0.117	S	C	.	.	H	α-helix	trans	-66.6	-38.1	179.6	-69.1	175.7	0	0	0	112.1	V83 S84 L90 T91 L124	V83-L87 HydrophobicContact CG1-CD1 3.98Å; V83-L87 HydrophobicContact CG1-CG 4.42Å; V83-L87 VanDerWaalsContact O-CG 3.28Å; V83-L87 WeakPolarHBondContact O-CG 3.33Å; V83-L87 PolarHBondContact O-N 2.91Å; S84-L87 PolarHBondContact O-N 2.86Å; S84-L87 VanDerWaalsContact O-N 3.16Å; L87-L90 HydrophobicContact CD2-CD2 4.38Å; L87-L90 WeakPolarHBondContact O-CB 2.95Å; L87-L90 PolarHBondContact O-N 3.26Å; L87-T91 WeakPolarHBondContact O-CG2 3.37Å; L87-T91 PolarHBondContact O-N 3.35Å; L87-T91 PolarHBondContact O-OG1 3.35Å; L87-L124 HydrophobicContact CB-CD1 3.68Å; L87-L124 HydrophobicContact CB-CD2 3.78Å; L87-L124 HydrophobicContact CB-CG 4.35Å; L87-L124 HydrophobicContact CD1-CD2 3.76Å; L87-L124 HydrophobicContact CG-CD2 4.44Å
88	I	97.5	Very high	95.5	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-45.6	174.3	-69.6	164.9	0	0	0	110.4	S84 D85 L90 T91 E92 G93 L124 F125 L382 T385	S84-I88 VanDerWaalsContact O-CG1 3.26Å; S84-I88 WeakPolarHBondContact O-CG1 3.33Å; S84-I88 PolarHBondContact O-N 3.24Å; D85-I88 PolarHBondContact O-N 3.23Å; I88-L90 VanDerWaalsContact C-N 3.29Å; I88-L90 PolarHBondContact O-N 3.18Å; I88-T91 PolarHBondContact O-N 2.93Å; I88-E92 WeakPolarHBondContact O-CA 3.45Å; I88-E92 WeakPolarHBondContact O-CB 3.21Å; I88-E92 PolarHBondContact O-N 3.01Å; I88-G93 PolarHBondContact O-N 2.84Å; I88-L124 HydrophobicContact CG1-CB 3.71Å; I88-F125 HydrophobicContact CD1-CD1 3.98Å; I88-F125 HydrophobicContact CD1-CE1 4.31Å; I88-F125 HydrophobicContact CD1-CG 4.39Å; I88-F125 HydrophobicContact CG2-CD1 4.3Å; I88-F125 HydrophobicContact CG2-CE1 3.66Å; I88-F125 HydrophobicContact CG2-CE2 4.02Å; I88-F125 HydrophobicContact CG2-CZ 3.51Å; I88-L382 HydrophobicContact CG2-CD2 3.75Å; I88-T385 HydrophobicContact CB-CG2 4.18Å; I88-T385 HydrophobicContact CD1-CG2 3.94Å; I88-T385 HydrophobicContact CG2-CG2 3.98Å
89	L	97.1	Very high	95.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.	I	π-helix	trans	-63.8	-37.9	177.1	-70.7	169.9	0	0	0	111.7	F54 D85 F86 G93 I94 L382	F54-L89 HydrophobicContact CE1-CB 4.5Å; F54-L89 HydrophobicContact CE2-CB 4.23Å; F54-L89 HydrophobicContact CZ-CB 4.2Å; D85-L89 WeakPolarHBondContact O-CG 3.45Å; D85-L89 PolarHBondContact O-N 2.73Å; F86-L89 PolarHBondContact O-N 2.86Å; L89-G93 CarbonylContact O-C 3.58Å; L89-G93 WeakPolarHBondContact O-CA 3.43Å; L89-G93 PolarHBondContact O-N 3.41Å; L89-G93 VanDerWaalsContact O-N 3.11Å; L89-I94 PolarHBondContact O-N 3.49Å; L89-L382 HydrophobicContact CD2-CB 4.49Å; L89-L382 HydrophobicContact CD2-CD2 4.38Å
90	L	96.8	Very high	94.9	Very high	76 Å²	76	25.5 Å²	25.5	40%	0.398	13%	0.133	S	C	.	.	I	π-helix	trans	-65.6	-47.1	175.7	-171.6	74.9	0	0	0	112.7	F54 F86 L87 I88 I94	F54-L90 HydrophobicContact CE1-CB 4.29Å; F54-L90 HydrophobicContact CE1-CD1 4.18Å; F54-L90 HydrophobicContact CZ-CB 4.13Å; F54-L90 HydrophobicContact CZ-CD1 4.02Å; F86-L90 HydrophobicContact CE1-CD2 4.41Å; F86-L90 WeakPolarHBondContact O-CB 3.38Å; F86-L90 PolarHBondContact O-N 2.87Å; L87-L90 HydrophobicContact CD2-CD2 4.38Å; L87-L90 WeakPolarHBondContact O-CB 2.95Å; L87-L90 PolarHBondContact O-N 3.26Å; I88-L90 VanDerWaalsContact C-N 3.29Å; I88-L90 PolarHBondContact O-N 3.18Å; L90-I94 HydrophobicContact CD1-CD1 3.71Å; L90-I94 WeakPolarHBondContact O-CB 3.19Å
91	T	96.7	Very high	94.5	Very high	28 Å²	28	31 Å²	31	17%	0.172	15%	0.152	C	C	.	.	I	π-helix	trans	-81.7	-51.9	-176.4	57.9	0	0	0	0	111.6	L87 I88 W95 H117 L124	L87-T91 WeakPolarHBondContact O-CG2 3.37Å; L87-T91 PolarHBondContact O-N 3.35Å; L87-T91 PolarHBondContact O-OG1 3.35Å; I88-T91 PolarHBondContact O-N 2.93Å; T91-W95 WeakPolarHBondContact O-CB 3.15Å; T91-W95 PolarHBondContact O-N 3.48Å; T91-H117 PolarHBondContact O-CE1 3.01Å; T91-H117 VanDerWaalsContact O-CE1 3.32Å; T91-H117 PolarHBondContact O-NE2 3.36Å; T91-L124 HydrophobicContact CG2-CD1 4.01Å
92	E	95.7	Very high	94.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.178	C	C	.	.	I	π-helix	trans	-92.8	-40.9	-172	-69	-90	120	0	0	112.6	I88 W95 M96 R107 H117 S121 F125 R378	I88-E92 WeakPolarHBondContact O-CA 3.45Å; I88-E92 WeakPolarHBondContact O-CB 3.21Å; I88-E92 PolarHBondContact O-N 3.01Å; E92-W95 PolarHBondContact O-N 3.46Å; E92-M96 WeakPolarHBondContact O-CB 3.37Å; E92-M96 WeakPolarHBondContact O-CG 3.29Å; E92-M96 PolarHBondContact O-N 2.94Å; E92-R107 IonicContact OE1-CZ 3.44Å; E92-R107 IonicContact OE1-NH2 2.78Å; E92-R107 PolarHBondContact OE1-NH2 3.5Å; E92-H117 IonicContact OE1-CE1 3.3Å; E92-S121 VanDerWaalsContact CD-CB 3.46Å; E92-S121 VanDerWaalsContact CG-CB 3.44Å; E92-S121 WeakPolarHBondContact OE1-CB 3.48Å; E92-S121 PolarHBondContact OE1-OG 3.15Å; E92-F125 HydrophobicContact CB-CE2 4.22Å; E92-F125 HydrophobicContact CG-CD2 4.4Å; E92-F125 HydrophobicContact CG-CE2 3.62Å; E92-F125 HydrophobicContact CG-CZ 4.4Å; E92-R378 IonicContact OE2-CZ 3.94Å; E92-R378 IonicContact OE2-NE 2.67Å; E92-R378 PolarHBondContact OE2-NE 3.34Å; E92-R378 VanDerWaalsContact OE2-NE 3.13Å; E92-R378 IonicContact OE2-NH2 3.02Å; E92-R378 PolarHBondContact OE2-NH2 3.5Å; E92-R378 VanDerWaalsContact OE2-NH2 3.13Å
93	G	94.9	Very high	94	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-60.8	-55.4	178.2	0	0	0	0	0	111.1	I50 I88 L89 W95 M96 L97	I50-G93 VanDerWaalsContact CD1-C 3.46Å; I50-G93 WeakPolarHBondContact CD1-O 3.4Å; I88-G93 PolarHBondContact O-N 2.84Å; L89-G93 CarbonylContact O-C 3.58Å; L89-G93 WeakPolarHBondContact O-CA 3.43Å; L89-G93 PolarHBondContact O-N 3.41Å; L89-G93 VanDerWaalsContact O-N 3.11Å; G93-W95 VanDerWaalsContact C-N 3.35Å; G93-W95 PolarHBondContact O-N 3.48Å; G93-M96 PolarHBondContact O-N 2.92Å; G93-L97 WeakPolarHBondContact O-CB 3.42Å; G93-L97 PolarHBondContact O-N 2.85Å
94	I	95.2	Very high	93.9	Very high	59 Å²	59	47.2 Å²	47.2	30%	0.303	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-42.1	178.5	-59.9	-175.5	0	0	0	111.3	F54 L89 L90 L97 L98	F54-I94 HydrophobicContact CE2-CD1 4.13Å; F54-I94 HydrophobicContact CE2-CG1 3.99Å; F54-I94 HydrophobicContact CZ-CD1 3.84Å; F54-I94 HydrophobicContact CZ-CG1 4.08Å; L89-I94 PolarHBondContact O-N 3.49Å; L90-I94 HydrophobicContact CD1-CD1 3.71Å; L90-I94 WeakPolarHBondContact O-CB 3.19Å; I94-L97 WeakPolarHBondContact O-CB 3.24Å; I94-L97 PolarHBondContact O-N 3.31Å; I94-L98 HydrophobicContact CG2-CD1 3.89Å; I94-L98 HydrophobicContact CG2-CG 4.17Å; I94-L98 WeakPolarHBondContact O-CG 3.39Å; I94-L98 PolarHBondContact O-N 2.87Å
95	W	95.1	Very high	93.7	Very high	3 Å²	3	47.8 Å²	47.8	1%	0.011	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-50.7	176.8	164.3	65	0	0	0	112.3	T91 E92 G93 L97 L98 K99 D105 I106 R107 H117 Y375	T91-W95 WeakPolarHBondContact O-CB 3.15Å; T91-W95 PolarHBondContact O-N 3.48Å; E92-W95 PolarHBondContact O-N 3.46Å; G93-W95 VanDerWaalsContact C-N 3.35Å; G93-W95 PolarHBondContact O-N 3.48Å; W95-L97 PolarHBondContact O-N 3.43Å; W95-L98 PolarHBondContact O-N 3.23Å; W95-K99 HydrophobicContact CZ2-CD 3.83Å; W95-K99 WeakPolarHBondContact O-CB 3.38Å; W95-K99 PolarHBondContact O-N 2.99Å; W95-D105 VanDerWaalsContact NE1-CG 3.27Å; W95-D105 PolarHBondContact NE1-OD1 2.91Å; W95-D105 PolarHBondContact NE1-OD2 3.25Å; W95-I106 HydrophobicContact CB-CD1 4.31Å; W95-R107 VanDerWaalsContact CE2-CZ 3.5Å; W95-R107 VanDerWaalsContact CZ2-CZ 3.44Å; W95-H117 AromaticContact CG-CE1 3.65Å; W95-Y375 AromaticContact CH2-CE1 3.55Å; W95-Y375 HydrophobicContact CH2-CE1 3.55Å; W95-Y375 HydrophobicContact CZ2-CE1 4.22Å; W95-Y375 HydrophobicContact CZ3-CE1 4.14Å
96	M	92.4	Very high	93.7	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-42.4	176.3	-77.4	-170	-68.8	0	0	110.3	L46 E92 G93 L98 K99 I100 Y375 R378 L382	L46-M96 HydrophobicContact CD1-CE 4.43Å; L46-M96 HydrophobicContact CD2-CB 3.94Å; E92-M96 WeakPolarHBondContact O-CB 3.37Å; E92-M96 WeakPolarHBondContact O-CG 3.29Å; E92-M96 PolarHBondContact O-N 2.94Å; G93-M96 PolarHBondContact O-N 2.92Å; M96-L98 PolarHBondContact O-N 3.45Å; M96-K99 PolarHBondContact O-N 3.32Å; M96-I100 HydrophobicContact CB-CD1 4.29Å; M96-I100 WeakPolarHBondContact O-CB 3.33Å; M96-I100 WeakPolarHBondContact O-CD1 2.96Å; M96-I100 WeakPolarHBondContact O-CG1 2.77Å; M96-I100 PolarHBondContact O-N 3.49Å; M96-Y375 HydrophobicContact CG-CD1 4.5Å; M96-Y375 HydrophobicContact SD-CD1 4.44Å; M96-R378 HydrophobicContact SD-CG 4.38Å; M96-L382 HydrophobicContact CE-CD1 3.24Å; M96-L382 HydrophobicContact CE-CD2 4.29Å; M96-L382 HydrophobicContact CE-CG 3.83Å
97	L	92	Very high	93.6	Very high	36 Å²	36	47.4 Å²	47.4	19%	0.188	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-45.2	177.7	-172.7	69.1	0	0	0	111.8	L46 P47 I50 G93 I94 W95 I100 W101	L46-L97 HydrophobicContact CD2-CB 4.13Å; L46-L97 HydrophobicContact CD2-CD1 4.16Å; L46-L97 HydrophobicContact CG-CD1 4.41Å; P47-L97 HydrophobicContact CG-CD1 3.95Å; I50-L97 HydrophobicContact CD1-CB 3.8Å; I50-L97 HydrophobicContact CD1-CD1 4.47Å; I50-L97 HydrophobicContact CD1-CD2 4.23Å; I50-L97 HydrophobicContact CD1-CG 4.4Å; G93-L97 WeakPolarHBondContact O-CB 3.42Å; G93-L97 PolarHBondContact O-N 2.85Å; I94-L97 WeakPolarHBondContact O-CB 3.24Å; I94-L97 PolarHBondContact O-N 3.31Å; W95-L97 PolarHBondContact O-N 3.43Å; L97-I100 PolarHBondContact O-N 3.3Å; L97-W101 HydrophobicContact CD1-CD2 3.98Å; L97-W101 HydrophobicContact CD1-CG 3.97Å; L97-W101 HydrophobicContact CD1-CZ2 4.45Å; L97-W101 HydrophobicContact CG-CG 4.42Å; L97-W101 VanDerWaalsContact O-CB 3.27Å; L97-W101 WeakPolarHBondContact O-CB 3.26Å; L97-W101 PolarHBondContact O-N 3.2Å
98	L	93.2	Very high	93.5	Very high	49 Å²	49	46.4 Å²	46.4	26%	0.257	21%	0.214	S	C	.	.	H	α-helix	trans	-63.9	-48.4	178.2	-72.1	171.8	0	0	0	112.3	I94 W95 M96 I100 Y102 K103 I104 I106	I94-L98 HydrophobicContact CG2-CD1 3.89Å; I94-L98 HydrophobicContact CG2-CG 4.17Å; I94-L98 WeakPolarHBondContact O-CG 3.39Å; I94-L98 PolarHBondContact O-N 2.87Å; W95-L98 PolarHBondContact O-N 3.23Å; M96-L98 PolarHBondContact O-N 3.45Å; L98-I100 PolarHBondContact O-N 3.28Å; L98-Y102 HydrophobicContact CD2-CD2 3.89Å; L98-Y102 HydrophobicContact CD2-CE2 4.28Å; L98-Y102 PolarHBondContact O-N 2.95Å; L98-K103 PolarHBondContact O-N 3.45Å; L98-I104 CarbonylContact C-O 3.58Å; L98-I104 VanDerWaalsContact C-O 3.24Å; L98-I104 PolarHBondContact O-N 3.27Å; L98-I106 HydrophobicContact CD1-CG2 3.96Å
99	K	90	Very high	93.4	Very high	44 Å²	44	54 Å²	54	19%	0.191	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-35.7	178.4	-174	167.7	-165.3	153.6	0	111.2	W95 M96 K103 I104 D105 Y375	W95-K99 HydrophobicContact CZ2-CD 3.83Å; W95-K99 WeakPolarHBondContact O-CB 3.38Å; W95-K99 PolarHBondContact O-N 2.99Å; M96-K99 PolarHBondContact O-N 3.32Å; K99-K103 WeakPolarHBondContact O-CA 3.32Å; K99-K103 PolarHBondContact O-N 2.93Å; K99-I104 WeakPolarHBondContact CA-O 3.45Å; K99-I104 PolarHBondContact N-O 3.01Å; K99-I104 VanDerWaalsContact N-O 3.09Å; K99-D105 HydrophobicContact CD-CB 4.32Å; K99-D105 VanDerWaalsContact CD-OD2 3.28Å; K99-D105 WeakPolarHBondContact CD-OD2 3.45Å; K99-D105 VanDerWaalsContact CE-OD2 3.25Å; K99-D105 WeakPolarHBondContact CE-OD2 3.36Å; K99-D105 HydrophobicContact CG-CB 4.41Å; K99-D105 IonicContact NZ-OD2 2.77Å; K99-D105 PolarHBondContact NZ-OD2 3.18Å; K99-Y375 HydrophobicContact CD-CE1 4.29Å; K99-Y375 WeakPolarHBondContact CD-OH 3.36Å; K99-Y375 WeakPolarHBondContact CE-OH 3.5Å; K99-Y375 PolarHBondContact NZ-OH 3.37Å
100	I	84.9	Confident	93.4	Very high	32 Å²	32	57.5 Å²	57.5	16%	0.164	26%	0.262	C	S	.	.	H	α-helix	trans	-84.6	-52.5	-174.8	-73.5	171.9	0	0	0	112.3	L42 L46 M96 L97 L98	L42-I100 HydrophobicContact CB-CG2 3.25Å; L42-I100 HydrophobicContact CD1-CG2 3.45Å; L42-I100 VanDerWaalsContact CD1-CG2 3.45Å; L42-I100 HydrophobicContact CD2-CB 3.78Å; L42-I100 HydrophobicContact CD2-CD1 3.18Å; L42-I100 HydrophobicContact CD2-CG1 3.45Å; L42-I100 VanDerWaalsContact CD2-CG1 3.45Å; L42-I100 HydrophobicContact CD2-CG2 2.98Å; L42-I100 HydrophobicContact CG-CB 4.4Å; L42-I100 HydrophobicContact CG-CG2 3.18Å; L46-I100 HydrophobicContact CD2-CD1 3.65Å; M96-I100 HydrophobicContact CB-CD1 4.29Å; M96-I100 WeakPolarHBondContact O-CB 3.33Å; M96-I100 WeakPolarHBondContact O-CD1 2.96Å; M96-I100 WeakPolarHBondContact O-CG1 2.77Å; M96-I100 PolarHBondContact O-N 3.49Å; L97-I100 PolarHBondContact O-N 3.3Å; L98-I100 PolarHBondContact O-N 3.28Å
101	W	89.2	Confident	93.4	Very high	129 Å²	129	57.7 Å²	57.7	49%	0.489	26%	0.264	S	S	.	.	H	α-helix	trans	-75.8	-42.1	-172.3	-84.4	35.3	0	0	0	111.6	L42 P47 L97	L42-W101 PolarHBondContact O-NE1 3.38Å; P47-W101 HydrophobicContact CB-CZ2 4.31Å; P47-W101 HydrophobicContact CG-CH2 4.29Å; P47-W101 HydrophobicContact CG-CZ2 3.4Å; P47-W101 VanDerWaalsContact CG-CZ2 3.4Å; L97-W101 HydrophobicContact CD1-CD2 3.98Å; L97-W101 HydrophobicContact CD1-CG 3.97Å; L97-W101 HydrophobicContact CD1-CZ2 4.45Å; L97-W101 HydrophobicContact CG-CG 4.42Å; L97-W101 VanDerWaalsContact O-CB 3.27Å; L97-W101 WeakPolarHBondContact O-CB 3.26Å; L97-W101 PolarHBondContact O-N 3.2Å
102	Y	90.7	Very high	93.5	Very high	144 Å²	144	64.4 Å²	64.4	57%	0.565	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-4.9	-172.7	-60.8	-79.9	0	0	0	112.8	L98 I104	L98-Y102 HydrophobicContact CD2-CD2 3.89Å; L98-Y102 HydrophobicContact CD2-CE2 4.28Å; L98-Y102 PolarHBondContact O-N 2.95Å; Y102-I104 PolarHBondContact O-N 3.45Å
103	K	89.8	Confident	93.5	Very high	195 Å²	195	66.7 Å²	66.7	85%	0.848	30%	0.298	S	S	*	.			trans	55.4	28.7	-169.9	-56.9	-179.1	177.5	-177.3	0	112.1	L98 K99	L98-K103 PolarHBondContact O-N 3.45Å; K99-K103 WeakPolarHBondContact O-CA 3.32Å; K99-K103 PolarHBondContact O-N 2.93Å
104	I	93.1	Very high	93.7	Very high	64 Å²	64	66.7 Å²	66.7	33%	0.328	30%	0.298	S	S	.	.			trans	-105.6	109.9	178	-63.2	171.7	0	0	0	107.2	L98 K99 Y102 Y109	L98-I104 CarbonylContact C-O 3.58Å; L98-I104 VanDerWaalsContact C-O 3.24Å; L98-I104 PolarHBondContact O-N 3.27Å; K99-I104 WeakPolarHBondContact CA-O 3.45Å; K99-I104 PolarHBondContact N-O 3.01Å; K99-I104 VanDerWaalsContact N-O 3.09Å; Y102-I104 PolarHBondContact O-N 3.45Å; I104-Y109 HydrophobicContact CG2-CE2 3.88Å; I104-Y109 WeakPolarHBondContact CG2-OH 3.24Å
105	D	93.9	Very high	93.8	Very high	12 Å²	12	66.3 Å²	66.3	6%	0.064	30%	0.296	C	S	.	.			trans	-91.6	117.5	164.4	-163.8	-28.2	0	0	0	108.9	W95 K99 R107 D108	W95-D105 VanDerWaalsContact NE1-CG 3.27Å; W95-D105 PolarHBondContact NE1-OD1 2.91Å; W95-D105 PolarHBondContact NE1-OD2 3.25Å; K99-D105 HydrophobicContact CD-CB 4.32Å; K99-D105 VanDerWaalsContact CD-OD2 3.28Å; K99-D105 WeakPolarHBondContact CD-OD2 3.45Å; K99-D105 VanDerWaalsContact CE-OD2 3.25Å; K99-D105 WeakPolarHBondContact CE-OD2 3.36Å; K99-D105 HydrophobicContact CG-CB 4.41Å; K99-D105 IonicContact NZ-OD2 2.77Å; K99-D105 PolarHBondContact NZ-OD2 3.18Å; D105-R107 PolarHBondContact O-N 3.26Å; D105-R107 WeakPolarHBondContact OD1-CB 3.13Å; D105-R107 WeakPolarHBondContact OD1-CG 3.33Å; D105-R107 PolarHBondContact OD1-N 3.09Å; D105-D108 HydrophobicContact CB-CB 4.35Å; D105-D108 WeakPolarHBondContact CB-OD2 3.48Å; D105-D108 PolarHBondContact O-N 3.44Å
106	I	94.7	Very high	93.9	Very high	44 Å²	44	71.6 Å²	71.6	23%	0.226	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-62.3	-30.3	176.5	64.3	-173.8	0	0	0	111.4	W95 L98 D108 Y109 L113	W95-I106 HydrophobicContact CB-CD1 4.31Å; L98-I106 HydrophobicContact CD1-CG2 3.96Å; I106-D108 PolarHBondContact O-N 2.92Å; I106-Y109 VanDerWaalsContact O-CD2 3.29Å; I106-Y109 WeakPolarHBondContact O-CD2 3.23Å; I106-Y109 PolarHBondContact O-N 2.86Å; I106-L113 VanDerWaalsContact C-CD2 3.41Å; I106-L113 HydrophobicContact CB-CD2 3.88Å; I106-L113 HydrophobicContact CG1-CD2 3.95Å; I106-L113 WeakPolarHBondContact O-CD2 3.2Å
107	R	95.8	Very high	94.2	Very high	16 Å²	16	72.3 Å²	72.3	6%	0.06	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-64.2	-28.4	-177.1	-60.9	175.1	177.2	172.7	1.7	112.6	E92 W95 D105 Y109 C114 H117 C188	E92-R107 IonicContact OE1-CZ 3.44Å; E92-R107 IonicContact OE1-NH2 2.78Å; E92-R107 PolarHBondContact OE1-NH2 3.5Å; W95-R107 VanDerWaalsContact CE2-CZ 3.5Å; W95-R107 VanDerWaalsContact CZ2-CZ 3.44Å; D105-R107 PolarHBondContact O-N 3.26Å; D105-R107 WeakPolarHBondContact OD1-CB 3.13Å; D105-R107 WeakPolarHBondContact OD1-CG 3.33Å; D105-R107 PolarHBondContact OD1-N 3.09Å; R107-Y109 VanDerWaalsContact C-N 3.28Å; R107-Y109 PolarHBondContact O-N 3.29Å; R107-C114 HydrophobicContact CB-CB 4.47Å; R107-C114 WeakPolarHBondContact O-CB 3.27Å; R107-H117 HydrophobicContact CG-CB 4.23Å; R107-H117 PolarHBondContact NE-ND1 3.31Å; R107-H117 PolarHBondContact NH2-CE1 3.29Å; R107-H117 PolarHBondContact NH2-ND1 2.9Å; R107-C188 HydrophobicContact CB-CB 3.55Å
108	D	95.3	Very high	94.4	Very high	42 Å²	42	70.7 Å²	70.7	23%	0.225	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-79.7	-10.9	-172	-60.3	-10.2	0	0	0	112.5	D105 I106 D186 C188	D105-D108 HydrophobicContact CB-CB 4.35Å; D105-D108 WeakPolarHBondContact CB-OD2 3.48Å; D105-D108 PolarHBondContact O-N 3.44Å; I106-D108 PolarHBondContact O-N 2.92Å; D108-D186 WeakPolarHBondContact CB-O 3.46Å; D108-C188 PolarHBondContact OD1-N 3.17Å
109	Y	95.7	Very high	94.6	Very high	161 Å²	161	69.1 Å²	69.1	63%	0.631	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-67.7	-39.6	-178.6	-76.7	-70.6	0	0	0	114.1	I104 I106 R107	I104-Y109 HydrophobicContact CG2-CE2 3.88Å; I104-Y109 WeakPolarHBondContact CG2-OH 3.24Å; I106-Y109 VanDerWaalsContact O-CD2 3.29Å; I106-Y109 WeakPolarHBondContact O-CD2 3.23Å; I106-Y109 PolarHBondContact O-N 2.86Å; R107-Y109 VanDerWaalsContact C-N 3.28Å; R107-Y109 PolarHBondContact O-N 3.29Å
110	N	96.4	Very high	95	Very high	72 Å²	72	68.7 Å²	68.7	39%	0.385	31%	0.31	S	S	.	.			trans	-159.7	154.6	178	66.5	58.1	0	0	0	112.2	W112 L113 C114	N110-W112 VanDerWaalsContact C-N 3.27Å; N110-W112 PolarHBondContact O-N 3.13Å; N110-W112 PolarHBondContact OD1-N 3.06Å; N110-L113 PolarHBondContact O-N 2.92Å; N110-L113 WeakPolarHBondContact OD1-CB 3.4Å; N110-L113 PolarHBondContact OD1-N 3.06Å; N110-C114 PolarHBondContact O-N 3.41Å
111	N	97.3	Very high	95.6	Very high	80 Å²	80	67.2 Å²	67.2	43%	0.428	30%	0.302	S	S	.	.	H	α-helix	trans	-55.8	-39.4	-179.8	-73.2	-13.5	0	0	0	113.3	L113 I115 V183	N111-L113 PolarHBondContact O-N 3.45Å; N111-I115 WeakPolarHBondContact O-CB 3.41Å; N111-I115 WeakPolarHBondContact O-CD1 3.28Å; N111-I115 VanDerWaalsContact O-CG1 3.28Å; N111-I115 WeakPolarHBondContact O-CG1 3.46Å; N111-I115 PolarHBondContact O-N 3.04Å; N111-V183 VanDerWaalsContact OD1-CB 3.23Å; N111-V183 WeakPolarHBondContact OD1-CB 3.34Å; N111-V183 WeakPolarHBondContact OD1-CG2 3.26Å; N111-V183 PolarHBondContact OD1-N 3.39Å
112	W	97.7	Very high	95.9	Very high	169 Å²	169	61.2 Å²	61.2	64%	0.64	28%	0.28	S	S	*	.	H	α-helix	trans	-65.1	-40	-178.7	179.7	83.7	0	0	0	112	N110 I115 F116	N110-W112 VanDerWaalsContact C-N 3.27Å; N110-W112 PolarHBondContact O-N 3.13Å; N110-W112 PolarHBondContact OD1-N 3.06Å; W112-I115 PolarHBondContact O-N 2.93Å; W112-F116 HydrophobicContact CH2-CD1 4.48Å; W112-F116 HydrophobicContact CH2-CG 4.33Å; W112-F116 HydrophobicContact CZ2-CB 4.47Å; W112-F116 HydrophobicContact CZ2-CD2 4.44Å; W112-F116 HydrophobicContact CZ2-CG 4.37Å; W112-F116 WeakPolarHBondContact O-CB 3.5Å; W112-F116 PolarHBondContact O-N 3.35Å
113	L	97.2	Very high	96.3	Very high	48 Å²	48	57 Å²	57	25%	0.251	26%	0.264	S	S	.	.	H	α-helix	trans	-76.8	-36.1	-178.7	-158.9	131	0	0	0	111.2	I106 N110 N111 H117	I106-L113 VanDerWaalsContact C-CD2 3.41Å; I106-L113 HydrophobicContact CB-CD2 3.88Å; I106-L113 HydrophobicContact CG1-CD2 3.95Å; I106-L113 WeakPolarHBondContact O-CD2 3.2Å; N110-L113 PolarHBondContact O-N 2.92Å; N110-L113 WeakPolarHBondContact OD1-CB 3.4Å; N110-L113 PolarHBondContact OD1-N 3.06Å; N111-L113 PolarHBondContact O-N 3.45Å; L113-H117 WeakPolarHBondContact O-CB 3.43Å; L113-H117 PolarHBondContact O-N 3.48Å
114	C	97.7	Very high	96.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-53.7	-54.8	166.3	169.8	0	0	0	0	111.1	R107 N110 T118 V183 C188	R107-C114 HydrophobicContact CB-CB 4.47Å; R107-C114 WeakPolarHBondContact O-CB 3.27Å; N110-C114 PolarHBondContact O-N 3.41Å; C114-T118 WeakPolarHBondContact O-CB 3.48Å; C114-T118 PolarHBondContact O-N 3.07Å; C114-T118 VanDerWaalsContact O-N 3.1Å; C114-T118 PolarHBondContact O-OG1 2.99Å; C114-V183 HydrophobicContact CB-CG2 3.89Å; C114-C188 WeakPolarHBondContact CA-SG 3.41Å; C114-C188 HydrophobicContact CB-CB 3.77Å; C114-C188 WeakPolarHBondContact CB-SG 3.31Å; C114-C188 WeakPolarHBondContact SG-CB 3.45Å; C114-C188 CovalentContact SG-SG 2.03Å; C114-C188 PolarHBondContact SG-SG 3.06Å
115	I	97.7	Very high	96.9	Very high	51 Å²	51	45.8 Å²	45.8	26%	0.262	21%	0.213	S	C	.	.	H	α-helix	trans	-61.1	-52.8	179.2	-73	165.1	0	0	0	110.9	N111 W112 S119 P178 W181	N111-I115 WeakPolarHBondContact O-CB 3.41Å; N111-I115 WeakPolarHBondContact O-CD1 3.28Å; N111-I115 VanDerWaalsContact O-CG1 3.28Å; N111-I115 WeakPolarHBondContact O-CG1 3.46Å; N111-I115 PolarHBondContact O-N 3.04Å; W112-I115 PolarHBondContact O-N 2.93Å; I115-S119 WeakPolarHBondContact O-CB 3.47Å; I115-S119 PolarHBondContact O-N 3.46Å; I115-S119 PolarHBondContact O-OG 3.05Å; I115-P178 HydrophobicContact CG2-CB 3.79Å; I115-W181 WeakPolarHBondContact CG1-O 3.26Å
116	F	97.9	Very high	97.1	Very high	114 Å²	114	45.3 Å²	45.3	50%	0.5	21%	0.21	S	C	.	.	H	α-helix	trans	-64.8	-49.2	-174.3	176.3	-99.4	0	0	0	111.8	W112 S120	W112-F116 HydrophobicContact CH2-CD1 4.48Å; W112-F116 HydrophobicContact CH2-CG 4.33Å; W112-F116 HydrophobicContact CZ2-CB 4.47Å; W112-F116 HydrophobicContact CZ2-CD2 4.44Å; W112-F116 HydrophobicContact CZ2-CG 4.37Å; W112-F116 WeakPolarHBondContact O-CB 3.5Å; W112-F116 PolarHBondContact O-N 3.35Å; F116-S120 WeakPolarHBondContact O-CB 3.46Å; F116-S120 PolarHBondContact O-N 2.89Å
117	H	97.8	Very high	97.2	Very high	16 Å²	16	44.7 Å²	44.7	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-64.3	-49.8	-178	-174.4	-80	0	0	0	110.9	T91 E92 W95 R107 L113 S119 S120 S121	T91-H117 PolarHBondContact O-CE1 3.01Å; T91-H117 VanDerWaalsContact O-CE1 3.32Å; T91-H117 PolarHBondContact O-NE2 3.36Å; E92-H117 IonicContact OE1-CE1 3.3Å; W95-H117 AromaticContact CG-CE1 3.65Å; R107-H117 HydrophobicContact CG-CB 4.23Å; R107-H117 PolarHBondContact NE-ND1 3.31Å; R107-H117 PolarHBondContact NH2-CE1 3.29Å; R107-H117 PolarHBondContact NH2-ND1 2.9Å; L113-H117 WeakPolarHBondContact O-CB 3.43Å; L113-H117 PolarHBondContact O-N 3.48Å; H117-S119 PolarHBondContact O-N 3.16Å; H117-S120 PolarHBondContact O-N 2.9Å; H117-S121 VanDerWaalsContact O-CB 3.26Å; H117-S121 WeakPolarHBondContact O-CB 3.25Å; H117-S121 PolarHBondContact O-N 3.03Å; H117-S121 PolarHBondContact O-OG 2.93Å; H117-S121 VanDerWaalsContact O-OG 3.06Å
118	T	96.7	Very high	97.3	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-41.1	-178.8	-52.8	0	0	0	0	111.8	C114 S121 N122 Y177 W181	C114-T118 WeakPolarHBondContact O-CB 3.48Å; C114-T118 PolarHBondContact O-N 3.07Å; C114-T118 VanDerWaalsContact O-N 3.1Å; C114-T118 PolarHBondContact O-OG1 2.99Å; T118-S121 PolarHBondContact O-OG 3.22Å; T118-N122 WeakPolarHBondContact O-CB 3.36Å; T118-N122 PolarHBondContact O-N 2.67Å; T118-N122 PolarHBondContact O-ND2 3.48Å; T118-Y177 HydrophobicContact CG2-CD1 3.43Å; T118-Y177 VanDerWaalsContact CG2-CD1 3.43Å; T118-Y177 HydrophobicContact CG2-CE1 3.78Å; T118-Y177 HydrophobicContact CG2-CG 4.31Å; T118-W181 HydrophobicContact CG2-CD2 4.05Å; T118-W181 HydrophobicContact CG2-CE3 3.98Å; T118-W181 HydrophobicContact CG2-CH2 4.43Å; T118-W181 HydrophobicContact CG2-CZ2 4.49Å; T118-W181 HydrophobicContact CG2-CZ3 4.17Å
119	S	97.7	Very high	97.4	Very high	16 Å²	16	42.2 Å²	42.2	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-69.1	-46.7	177.5	-54.7	0	0	0	0	111.5	I115 H117 Y123 Y177 P178	I115-S119 WeakPolarHBondContact O-CB 3.47Å; I115-S119 PolarHBondContact O-N 3.46Å; I115-S119 PolarHBondContact O-OG 3.05Å; H117-S119 PolarHBondContact O-N 3.16Å; S119-Y123 VanDerWaalsContact O-CB 3.24Å; S119-Y123 WeakPolarHBondContact O-CB 3.31Å; S119-Y123 PolarHBondContact O-N 3.31Å; S119-Y177 WeakPolarHBondContact OG-CB 3.32Å; S119-P178 WeakPolarHBondContact OG-CD 3.43Å
120	S	97.8	Very high	97.5	Very high	36 Å²	36	36.6 Å²	36.6	25%	0.252	17%	0.172	S	C	.	.	H	α-helix	trans	-64.7	-42.5	-178.6	-176.8	0	0	0	0	111.4	F116 H117 Y123 L124	F116-S120 WeakPolarHBondContact O-CB 3.46Å; F116-S120 PolarHBondContact O-N 2.89Å; H117-S120 PolarHBondContact O-N 2.9Å; S120-Y123 PolarHBondContact O-N 2.87Å; S120-L124 VanDerWaalsContact O-CG 3.24Å; S120-L124 WeakPolarHBondContact O-CG 3.44Å; S120-L124 PolarHBondContact O-N 2.86Å
121	S	97	Very high	97.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.9	-43.5	-177.3	68.5	0	0	0	0	112.6	E92 H117 T118 L124 F125	E92-S121 VanDerWaalsContact CD-CB 3.46Å; E92-S121 VanDerWaalsContact CG-CB 3.44Å; E92-S121 WeakPolarHBondContact OE1-CB 3.48Å; E92-S121 PolarHBondContact OE1-OG 3.15Å; H117-S121 VanDerWaalsContact O-CB 3.26Å; H117-S121 WeakPolarHBondContact O-CB 3.25Å; H117-S121 PolarHBondContact O-N 3.03Å; H117-S121 PolarHBondContact O-OG 2.93Å; H117-S121 VanDerWaalsContact O-OG 3.06Å; T118-S121 PolarHBondContact O-OG 3.22Å; S121-L124 PolarHBondContact O-N 3.26Å; S121-F125 WeakPolarHBondContact O-CD2 3.42Å; S121-F125 PolarHBondContact O-N 2.97Å
122	N	97.2	Very high	97.5	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-65	-42.3	173.8	-74	-60.9	0	0	0	110.9	T118 L124 F125 Y126 I174 Y177 R378	T118-N122 WeakPolarHBondContact O-CB 3.36Å; T118-N122 PolarHBondContact O-N 2.67Å; T118-N122 PolarHBondContact O-ND2 3.48Å; N122-L124 VanDerWaalsContact C-N 3.28Å; N122-L124 PolarHBondContact O-N 3.12Å; N122-F125 WeakPolarHBondContact O-CB 3.4Å; N122-F125 PolarHBondContact O-N 3.34Å; N122-F125 VanDerWaalsContact O-N 3.09Å; N122-Y126 WeakPolarHBondContact O-CD2 3.31Å; N122-Y126 PolarHBondContact O-N 2.94Å; N122-I174 HydrophobicContact CB-CD1 3.76Å; N122-Y177 HydrophobicContact CB-CD2 4.34Å; N122-Y177 HydrophobicContact CB-CE2 3.79Å; N122-Y177 WeakPolarHBondContact ND2-CE1 3.39Å; N122-Y177 PolarHBondContact ND2-OH 2.95Å; N122-R378 PolarHBondContact OD1-NH2 3.4Å
123	Y	98.3	Very high	97.5	Very high	56 Å²	56	21.8 Å²	21.8	22%	0.22	11%	0.105	C	C	.	.	H	α-helix	trans	-55.3	-42.6	174.3	177.3	-93.1	0	0	0	112.5	S119 S120 F125 Y126 W127 S167 L170 I171 I174	S119-Y123 VanDerWaalsContact O-CB 3.24Å; S119-Y123 WeakPolarHBondContact O-CB 3.31Å; S119-Y123 PolarHBondContact O-N 3.31Å; S120-Y123 PolarHBondContact O-N 2.87Å; Y123-F125 PolarHBondContact O-N 2.64Å; Y123-Y126 PolarHBondContact O-N 3.35Å; Y123-W127 HydrophobicContact CE1-CB 4.38Å; Y123-W127 WeakPolarHBondContact O-CB 3.37Å; Y123-W127 PolarHBondContact O-N 3.3Å; Y123-S167 WeakPolarHBondContact OH-CA 3.41Å; Y123-S167 VanDerWaalsContact OH-CB 3.26Å; Y123-S167 WeakPolarHBondContact OH-CB 3.01Å; Y123-L170 HydrophobicContact CE2-CB 4.08Å; Y123-I171 HydrophobicContact CE2-CG1 4.35Å; Y123-I174 HydrophobicContact CD2-CG1 4.33Å
124	L	98	Very high	97.5	Very high	15 Å²	15	21.2 Å²	21.2	8%	0.079	10%	0.102	C	C	.	.	H	α-helix	trans	-64.3	-38.1	177.7	-70.9	166.9	0	0	0	112.7	S84 L87 I88 T91 S120 S121 N122 W127 S128	S84-L124 PolarHBondContact OG-O 3.34Å; S84-L124 VanDerWaalsContact OG-O 3.11Å; L87-L124 HydrophobicContact CB-CD1 3.68Å; L87-L124 HydrophobicContact CB-CD2 3.78Å; L87-L124 HydrophobicContact CB-CG 4.35Å; L87-L124 HydrophobicContact CD1-CD2 3.76Å; L87-L124 HydrophobicContact CG-CD2 4.44Å; I88-L124 HydrophobicContact CG1-CB 3.71Å; T91-L124 HydrophobicContact CG2-CD1 4.01Å; S120-L124 VanDerWaalsContact O-CG 3.24Å; S120-L124 WeakPolarHBondContact O-CG 3.44Å; S120-L124 PolarHBondContact O-N 2.86Å; S121-L124 PolarHBondContact O-N 3.26Å; N122-L124 VanDerWaalsContact C-N 3.28Å; N122-L124 PolarHBondContact O-N 3.12Å; L124-W127 PolarHBondContact O-N 3.02Å; L124-S128 PolarHBondContact O-N 3.38Å
125	F	97.2	Very high	97.4	Very high	8 Å²	8	21.4 Å²	21.4	4%	0.035	10%	0.103	C	C	.	.	H	α-helix	trans	-63.3	-43.7	173.6	-87.8	-64.8	0	0	0	112.5	I88 E92 S121 N122 Y123 A129 W207 C381 L382	I88-F125 HydrophobicContact CD1-CD1 3.98Å; I88-F125 HydrophobicContact CD1-CE1 4.31Å; I88-F125 HydrophobicContact CD1-CG 4.39Å; I88-F125 HydrophobicContact CG2-CD1 4.3Å; I88-F125 HydrophobicContact CG2-CE1 3.66Å; I88-F125 HydrophobicContact CG2-CE2 4.02Å; I88-F125 HydrophobicContact CG2-CZ 3.51Å; E92-F125 HydrophobicContact CB-CE2 4.22Å; E92-F125 HydrophobicContact CG-CD2 4.4Å; E92-F125 HydrophobicContact CG-CE2 3.62Å; E92-F125 HydrophobicContact CG-CZ 4.4Å; S121-F125 WeakPolarHBondContact O-CD2 3.42Å; S121-F125 PolarHBondContact O-N 2.97Å; N122-F125 WeakPolarHBondContact O-CB 3.4Å; N122-F125 PolarHBondContact O-N 3.34Å; N122-F125 VanDerWaalsContact O-N 3.09Å; Y123-F125 PolarHBondContact O-N 2.64Å; F125-A129 WeakPolarHBondContact O-CB 3.07Å; F125-A129 PolarHBondContact O-N 3.04Å; F125-W207 HydrophobicContact CD1-CZ2 4.4Å; F125-W207 PolarHBondContact O-NE1 3.41Å; F125-C381 HydrophobicContact CE1-CB 4.21Å; F125-L382 HydrophobicContact CZ-CD2 4.16Å
126	Y	98	Very high	97.3	Very high	1 Å²	1	19 Å²	19	0%	0.004	9%	0.091	C	C	.	.	H	α-helix	trans	-61.8	-47.4	173.1	-82	-116	0	0	0	110.8	N122 Y123 S128 A129 Y130 L170 P173 I174 D203 F206 W207	N122-Y126 WeakPolarHBondContact O-CD2 3.31Å; N122-Y126 PolarHBondContact O-N 2.94Å; Y123-Y126 PolarHBondContact O-N 3.35Å; Y126-S128 PolarHBondContact O-N 3.06Å; Y126-A129 PolarHBondContact O-N 3.18Å; Y126-Y130 VanDerWaalsContact O-CD2 3.27Å; Y126-Y130 WeakPolarHBondContact O-CD2 3.34Å; Y126-Y130 PolarHBondContact O-N 3.36Å; Y126-L170 HydrophobicContact CD1-CD2 4.15Å; Y126-P173 HydrophobicContact CD1-CB 4.44Å; Y126-P173 HydrophobicContact CD1-CG 3.87Å; Y126-P173 HydrophobicContact CE1-CB 3.61Å; Y126-P173 HydrophobicContact CE1-CG 3.54Å; Y126-I174 HydrophobicContact CD2-CD1 3.69Å; Y126-I174 HydrophobicContact CE2-CD1 3.64Å; Y126-I174 HydrophobicContact CG-CD1 4.11Å; Y126-D203 VanDerWaalsContact CE2-OD1 3.3Å; Y126-D203 WeakPolarHBondContact CE2-OD1 3.33Å; Y126-D203 VanDerWaalsContact OH-CA 3.28Å; Y126-D203 WeakPolarHBondContact OH-CA 3.25Å; Y126-D203 PolarHBondContact OH-N 2.82Å; Y126-D203 PolarHBondContact OH-OD1 3.13Å; Y126-F206 HydrophobicContact CE1-CB 3.64Å; Y126-W207 HydrophobicContact CD1-CB 4.11Å; Y126-W207 HydrophobicContact CD2-CB 3.71Å; Y126-W207 AromaticContact CD2-CD1 3.9Å; Y126-W207 HydrophobicContact CD2-CG 4.03Å; Y126-W207 HydrophobicContact CE1-CB 3.83Å; Y126-W207 HydrophobicContact CE2-CB 3.47Å; Y126-W207 VanDerWaalsContact CE2-CB 3.47Å; Y126-W207 HydrophobicContact CE2-CG 4.08Å; Y126-W207 HydrophobicContact CG-CB 4.08Å
127	W	98.1	Very high	97.2	Very high	32 Å²	32	17.5 Å²	17.5	12%	0.121	9%	0.087	C	C	.	.	H	α-helix	trans	-56	-52.6	178.6	-178	-99.6	0	0	0	111.8	S80 Y123 L124 A129 Y130 M131 Q163 S167 L170	S80-W127 PolarHBondContact OG-NE1 3.19Å; S80-W127 VanDerWaalsContact OG-NE1 3.13Å; Y123-W127 HydrophobicContact CE1-CB 4.38Å; Y123-W127 WeakPolarHBondContact O-CB 3.37Å; Y123-W127 PolarHBondContact O-N 3.3Å; L124-W127 PolarHBondContact O-N 3.02Å; W127-A129 PolarHBondContact O-N 3.22Å; W127-Y130 PolarHBondContact O-N 2.87Å; W127-M131 HydrophobicContact CD2-CE 3.86Å; W127-M131 HydrophobicContact CD2-CG 4.23Å; W127-M131 HydrophobicContact CE3-CE 3.7Å; W127-M131 HydrophobicContact CG-CG 4.38Å; W127-M131 HydrophobicContact CH2-CE 3.28Å; W127-M131 HydrophobicContact CH2-SD 4.14Å; W127-M131 HydrophobicContact CZ2-CE 3.47Å; W127-M131 VanDerWaalsContact CZ2-CE 3.47Å; W127-M131 HydrophobicContact CZ2-CG 4.28Å; W127-M131 HydrophobicContact CZ2-SD 3.76Å; W127-M131 HydrophobicContact CZ3-CE 3.33Å; W127-M131 VanDerWaalsContact O-CG 3.24Å; W127-M131 WeakPolarHBondContact O-CG 3.36Å; W127-M131 PolarHBondContact O-N 3.26Å; W127-Q163 HydrophobicContact CH2-CB 4.09Å; W127-Q163 WeakPolarHBondContact CH2-O 3.45Å; W127-S167 WeakPolarHBondContact CH2-OG 3.25Å; W127-S167 VanDerWaalsContact CZ3-CA 3.48Å; W127-S167 WeakPolarHBondContact CZ3-OG 3.21Å; W127-L170 HydrophobicContact CE3-CD1 4.15Å
128	S	97.2	Very high	97	Very high	6 Å²	6	17.8 Å²	17.8	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-57.7	-47.6	179.2	-169.1	0	0	0	0	111.9	S84 D85 L124 Y126 Y130 M131 Q132	S84-S128 WeakPolarHBondContact OG-CB 3.45Å; S84-S128 PolarHBondContact OG-N 3.37Å; D85-S128 PolarHBondContact OD1-OG 3.23Å; D85-S128 VanDerWaalsContact OD1-OG 3.06Å; L124-S128 PolarHBondContact O-N 3.38Å; Y126-S128 PolarHBondContact O-N 3.06Å; S128-Y130 PolarHBondContact O-N 2.78Å; S128-M131 PolarHBondContact O-N 3.26Å; S128-Q132 PolarHBondContact O-N 3.31Å
129	A	97.5	Very high	96.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58.3	-45.2	179.6	0	0	0	0	0	112.5	F125 Y126 W127 Q132 C133 P211 Y344	F125-A129 WeakPolarHBondContact O-CB 3.07Å; F125-A129 PolarHBondContact O-N 3.04Å; Y126-A129 PolarHBondContact O-N 3.18Å; W127-A129 PolarHBondContact O-N 3.22Å; A129-Q132 PolarHBondContact O-N 2.97Å; A129-C133 PolarHBondContact O-N 2.93Å; A129-C133 PolarHBondContact O-SG 3.34Å; A129-P211 HydrophobicContact CB-CB 4.15Å; A129-P211 HydrophobicContact CB-CG 4.13Å; A129-Y344 HydrophobicContact CB-CE2 4.11Å; A129-Y344 VanDerWaalsContact CB-OH 3.26Å; A129-Y344 WeakPolarHBondContact CB-OH 3.27Å
130	Y	98.2	Very high	96.6	Very high	42 Å²	42	17.8 Å²	17.8	17%	0.165	9%	0.087	C	C	.	.	H	α-helix	trans	-74	-35.8	-179.9	-82.8	-103.7	0	0	0	112.6	Y126 W127 S128 Q132 C133 L134 I166 L170 F206 P211	Y126-Y130 VanDerWaalsContact O-CD2 3.27Å; Y126-Y130 WeakPolarHBondContact O-CD2 3.34Å; Y126-Y130 PolarHBondContact O-N 3.36Å; W127-Y130 PolarHBondContact O-N 2.87Å; S128-Y130 PolarHBondContact O-N 2.78Å; Y130-Q132 VanDerWaalsContact C-N 3.27Å; Y130-Q132 PolarHBondContact O-N 3.4Å; Y130-C133 WeakPolarHBondContact O-CB 3.3Å; Y130-C133 PolarHBondContact O-N 3.48Å; Y130-L134 WeakPolarHBondContact O-CD1 3.48Å; Y130-L134 VanDerWaalsContact O-CG 3.22Å; Y130-L134 WeakPolarHBondContact O-CG 3.42Å; Y130-L134 PolarHBondContact O-N 2.89Å; Y130-I166 HydrophobicContact CD1-CG2 4.39Å; Y130-L170 HydrophobicContact CD1-CD2 4.12Å; Y130-L170 HydrophobicContact CD2-CD1 4.23Å; Y130-L170 HydrophobicContact CD2-CD2 3.54Å; Y130-L170 HydrophobicContact CE1-CD2 4.11Å; Y130-L170 HydrophobicContact CE2-CD2 3.5Å; Y130-L170 HydrophobicContact CG-CD1 4.14Å; Y130-L170 HydrophobicContact CG-CD2 3.84Å; Y130-F206 WeakPolarHBondContact CE2-O 3.5Å; Y130-F206 PolarHBondContact OH-O 3.48Å; Y130-P211 HydrophobicContact CD2-CG 4.18Å; Y130-P211 HydrophobicContact CE2-CG 3.8Å
131	M	97.1	Very high	96.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.5	-40.8	171.7	-67.5	-61.2	118.5	0	0	111.2	W77 S80 I81 W127 S128 L134 L135 Q163 I166	W77-M131 HydrophobicContact CE3-SD 3.73Å; W77-M131 HydrophobicContact CZ3-CE 4.3Å; W77-M131 HydrophobicContact CZ3-SD 3.6Å; S80-M131 WeakPolarHBondContact OG-CG 3.29Å; S80-M131 PolarHBondContact OG-SD 2.91Å; I81-M131 HydrophobicContact CD1-CB 4.43Å; I81-M131 HydrophobicContact CG1-CB 3.65Å; W127-M131 HydrophobicContact CD2-CE 3.86Å; W127-M131 HydrophobicContact CD2-CG 4.23Å; W127-M131 HydrophobicContact CE3-CE 3.7Å; W127-M131 HydrophobicContact CG-CG 4.38Å; W127-M131 HydrophobicContact CH2-CE 3.28Å; W127-M131 HydrophobicContact CH2-SD 4.14Å; W127-M131 HydrophobicContact CZ2-CE 3.47Å; W127-M131 VanDerWaalsContact CZ2-CE 3.47Å; W127-M131 HydrophobicContact CZ2-CG 4.28Å; W127-M131 HydrophobicContact CZ2-SD 3.76Å; W127-M131 HydrophobicContact CZ3-CE 3.33Å; W127-M131 VanDerWaalsContact O-CG 3.24Å; W127-M131 WeakPolarHBondContact O-CG 3.36Å; W127-M131 PolarHBondContact O-N 3.26Å; S128-M131 PolarHBondContact O-N 3.26Å; M131-L134 HydrophobicContact CE-CD1 4.11Å; M131-L135 WeakPolarHBondContact O-CB 3.32Å; M131-L135 PolarHBondContact O-N 3.21Å; M131-Q163 HydrophobicContact CE-CG 4.25Å; M131-Q163 HydrophobicContact SD-CG 4.03Å; M131-I166 HydrophobicContact CE-CG2 4.41Å
132	Q	96.3	Very high	95.9	Very high	5 Å²	5	21.6 Å²	21.6	2%	0.023	10%	0.099	C	C	.	.	H	α-helix	trans	-68.5	-36.8	175.5	-168.1	172.7	-19	0	0	112.9	I81 S128 A129 Y130 S136 M215 M340 N341	I81-Q132 HydrophobicContact CD1-CB 4.33Å; S128-Q132 PolarHBondContact O-N 3.31Å; A129-Q132 PolarHBondContact O-N 2.97Å; Y130-Q132 VanDerWaalsContact C-N 3.27Å; Y130-Q132 PolarHBondContact O-N 3.4Å; Q132-S136 WeakPolarHBondContact O-CB 3.43Å; Q132-S136 PolarHBondContact O-N 2.95Å; Q132-S136 PolarHBondContact O-OG 2.92Å; Q132-M215 HydrophobicContact CB-SD 4.15Å; Q132-M215 HydrophobicContact CG-SD 3.63Å; Q132-M340 VanDerWaalsContact NE2-C 3.28Å; Q132-M340 PolarHBondContact NE2-O 3.3Å; Q132-M340 VanDerWaalsContact NE2-O 3.15Å; Q132-N341 PolarHBondContact NE2-OD1 3.31Å
133	C	97.3	Very high	95.6	Very high	5 Å²	5	22 Å²	22	3%	0.034	10%	0.102	C	C	.	.	H	α-helix	trans	-61.8	-49.2	172.8	-71.7	0	0	0	0	112.3	A129 Y130 L135 S136 I137 P211 V214	A129-C133 PolarHBondContact O-N 2.93Å; A129-C133 PolarHBondContact O-SG 3.34Å; Y130-C133 WeakPolarHBondContact O-CB 3.3Å; Y130-C133 PolarHBondContact O-N 3.48Å; C133-L135 VanDerWaalsContact C-N 3.32Å; C133-L135 PolarHBondContact O-N 2.95Å; C133-S136 CarbonylContact O-C 3.59Å; C133-S136 WeakPolarHBondContact O-CA 3.48Å; C133-S136 WeakPolarHBondContact O-CB 3.43Å; C133-S136 PolarHBondContact O-N 3.48Å; C133-I137 WeakPolarHBondContact O-CG1 3.41Å; C133-I137 PolarHBondContact O-N 3Å; C133-P211 WeakPolarHBondContact SG-CA 3.22Å; C133-P211 WeakPolarHBondContact SG-CB 3.34Å; C133-V214 HydrophobicContact CB-CG1 4.08Å
134	L	96.6	Very high	95.2	Very high	36 Å²	36	22.9 Å²	22.9	19%	0.188	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-41.3	-179.5	-66.7	162.2	0	0	0	111.5	W77 Y130 M131 S136 I137 Q138 I166	W77-L134 HydrophobicContact CE3-CB 4.36Å; W77-L134 HydrophobicContact CH2-CB 3.87Å; W77-L134 HydrophobicContact CH2-CD1 3.63Å; W77-L134 HydrophobicContact CH2-CG 4.28Å; W77-L134 HydrophobicContact CZ2-CB 4.26Å; W77-L134 HydrophobicContact CZ3-CB 3.91Å; W77-L134 HydrophobicContact CZ3-CD1 3.49Å; W77-L134 VanDerWaalsContact CZ3-CD1 3.49Å; W77-L134 HydrophobicContact CZ3-CG 4.35Å; Y130-L134 WeakPolarHBondContact O-CD1 3.48Å; Y130-L134 VanDerWaalsContact O-CG 3.22Å; Y130-L134 WeakPolarHBondContact O-CG 3.42Å; Y130-L134 PolarHBondContact O-N 2.89Å; M131-L134 HydrophobicContact CE-CD1 4.11Å; L134-S136 VanDerWaalsContact C-N 3.27Å; L134-S136 PolarHBondContact O-N 3.4Å; L134-I137 PolarHBondContact O-N 3.3Å; L134-Q138 WeakPolarHBondContact O-CB 3.33Å; L134-Q138 PolarHBondContact O-N 3.16Å; L134-I166 HydrophobicContact CD1-CD1 3.27Å; L134-I166 HydrophobicContact CD2-CD1 3.55Å; L134-I166 HydrophobicContact CG-CD1 3.94Å
135	L	95	Very high	94.8	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-57.8	-42.8	172.1	175.1	59.3	0	0	0	111.3	L74 W77 L78 I81 M131 C133 R139 L337	L74-L135 HydrophobicContact CD1-CD1 3.22Å; W77-L135 HydrophobicContact CB-CB 4.39Å; W77-L135 HydrophobicContact CB-CD1 4.23Å; L78-L135 HydrophobicContact CD2-CD2 3.72Å; I81-L135 HydrophobicContact CD1-CD2 3.74Å; M131-L135 WeakPolarHBondContact O-CB 3.32Å; M131-L135 PolarHBondContact O-N 3.21Å; C133-L135 VanDerWaalsContact C-N 3.32Å; C133-L135 PolarHBondContact O-N 2.95Å; L135-R139 HydrophobicContact CD1-CG 4.26Å; L135-R139 WeakPolarHBondContact O-CB 3.4Å; L135-R139 VanDerWaalsContact O-CG 3.23Å; L135-R139 WeakPolarHBondContact O-CG 3.26Å; L135-R139 PolarHBondContact O-N 3.35Å; L135-L337 HydrophobicContact CD2-CD1 3.8Å; L135-L337 HydrophobicContact CG-CD1 3.8Å
136	S	96	Very high	94	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65	-43.9	176.8	-63.6	0	0	0	0	112.9	Q132 C133 L134 R139 C140 N341	Q132-S136 WeakPolarHBondContact O-CB 3.43Å; Q132-S136 PolarHBondContact O-N 2.95Å; Q132-S136 PolarHBondContact O-OG 2.92Å; C133-S136 CarbonylContact O-C 3.59Å; C133-S136 WeakPolarHBondContact O-CA 3.48Å; C133-S136 WeakPolarHBondContact O-CB 3.43Å; C133-S136 PolarHBondContact O-N 3.48Å; L134-S136 VanDerWaalsContact C-N 3.27Å; L134-S136 PolarHBondContact O-N 3.4Å; S136-R139 PolarHBondContact O-N 3.1Å; S136-C140 WeakPolarHBondContact O-CB 3.38Å; S136-C140 PolarHBondContact O-N 2.9Å; S136-N341 PolarHBondContact OG-ND2 2.85Å; S136-N341 PolarHBondContact OG-OD1 3.4Å
137	I	96	Very high	93	Very high	83 Å²	83	38.5 Å²	38.5	43%	0.426	19%	0.19	S	C	.	.	H	α-helix	trans	-61.7	-49.1	176	-68.4	167.4	0	0	0	110.4	C133 L134 R139 C140 Y141 V214	C133-I137 WeakPolarHBondContact O-CG1 3.41Å; C133-I137 PolarHBondContact O-N 3Å; L134-I137 PolarHBondContact O-N 3.3Å; I137-R139 PolarHBondContact O-N 3.47Å; I137-C140 WeakPolarHBondContact O-CB 3.29Å; I137-C140 PolarHBondContact O-N 3.38Å; I137-Y141 WeakPolarHBondContact O-CB 3.42Å; I137-Y141 PolarHBondContact O-N 3.02Å; I137-V214 HydrophobicContact CD1-CG1 3.75Å; I137-V214 HydrophobicContact CG1-CG1 3.79Å
138	Q	93.1	Very high	91.7	Very high	22 Å²	22	43.3 Å²	43.3	10%	0.103	21%	0.214	C	C	.	.	H	α-helix	trans	-58	-41.2	178.8	-174.3	-173	9.1	0	0	111	L134 L142 I154	L134-Q138 WeakPolarHBondContact O-CB 3.33Å; L134-Q138 PolarHBondContact O-N 3.16Å; Q138-L142 HydrophobicContact CG-CD1 4.38Å; Q138-L142 WeakPolarHBondContact O-CG 3.47Å; Q138-L142 PolarHBondContact O-N 3.32Å; Q138-I154 HydrophobicContact CG-CD1 4.33Å
139	R	91.8	Very high	90.1	Very high	9 Å²	9	45 Å²	45	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-71.1	-40.5	178.6	-71.8	-70.7	170.4	-164.9	-0.8	112.6	L74 L135 S136 I137 Y141 L142 V143 I222 L337	L74-R139 VanDerWaalsContact CG-NH2 3.27Å; L135-R139 HydrophobicContact CD1-CG 4.26Å; L135-R139 WeakPolarHBondContact O-CB 3.4Å; L135-R139 VanDerWaalsContact O-CG 3.23Å; L135-R139 WeakPolarHBondContact O-CG 3.26Å; L135-R139 PolarHBondContact O-N 3.35Å; S136-R139 PolarHBondContact O-N 3.1Å; I137-R139 PolarHBondContact O-N 3.47Å; R139-Y141 VanDerWaalsContact C-N 3.32Å; R139-Y141 PolarHBondContact O-N 3.02Å; R139-L142 PolarHBondContact O-N 3.42Å; R139-V143 WeakPolarHBondContact O-CG2 3.27Å; R139-V143 PolarHBondContact O-N 3.49Å; R139-I222 HydrophobicContact CB-CD1 4.22Å; R139-L337 HydrophobicContact CB-CD2 3.48Å; R139-L337 VanDerWaalsContact CB-CD2 3.48Å; R139-L337 HydrophobicContact CG-CD2 3.62Å
140	C	94.3	Very high	88.3	Confident	10 Å²	10	53 Å²	53	7%	0.068	26%	0.259	C	S	.	.	H	α-helix	trans	-56.9	-48.2	173	-175.3	0	0	0	0	110.8	S136 I137 L142 V143 L144 C218 I222	S136-C140 WeakPolarHBondContact O-CB 3.38Å; S136-C140 PolarHBondContact O-N 2.9Å; I137-C140 WeakPolarHBondContact O-CB 3.29Å; I137-C140 PolarHBondContact O-N 3.38Å; C140-L142 PolarHBondContact O-N 2.92Å; C140-V143 PolarHBondContact O-N 3.15Å; C140-L144 WeakPolarHBondContact O-CG 3.28Å; C140-L144 PolarHBondContact O-N 2.87Å; C140-C218 HydrophobicContact CB-CB 4.07Å; C140-I222 HydrophobicContact CB-CD1 4.29Å; C140-I222 HydrophobicContact CB-CG1 4.28Å
141	Y	92.1	Very high	86.5	Confident	78 Å²	78	56.3 Å²	56.3	31%	0.306	29%	0.288	S	S	.	.	H	α-helix	trans	-58.9	-46.6	177.3	-177	-98.4	0	0	0	112.6	I137 R139 V143 L144 Y145 V149	I137-Y141 WeakPolarHBondContact O-CB 3.42Å; I137-Y141 PolarHBondContact O-N 3.02Å; R139-Y141 VanDerWaalsContact C-N 3.32Å; R139-Y141 PolarHBondContact O-N 3.02Å; Y141-V143 VanDerWaalsContact C-N 3.3Å; Y141-V143 PolarHBondContact O-N 3.46Å; Y141-L144 PolarHBondContact O-N 2.82Å; Y141-Y145 AromaticContact CD2-CD2 3.82Å; Y141-Y145 HydrophobicContact CD2-CD2 3.82Å; Y141-Y145 HydrophobicContact CD2-CE2 4.25Å; Y141-Y145 AromaticContact CE2-CD2 3.74Å; Y141-Y145 HydrophobicContact CE2-CD2 3.74Å; Y141-Y145 HydrophobicContact CE2-CE2 4.19Å; Y141-Y145 HydrophobicContact CE2-CG 4.49Å; Y141-Y145 HydrophobicContact CG-CD2 4.5Å; Y141-Y145 PolarHBondContact O-N 3.41Å; Y141-V149 HydrophobicContact CD1-CG2 4.02Å; Y141-V149 HydrophobicContact CE1-CG2 3.55Å
142	L	89.3	Confident	85	Confident	38 Å²	38	65 Å²	65	20%	0.199	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-34.8	177.1	-74.4	169.6	0	0	0	113.1	Q138 R139 C140 V149	Q138-L142 HydrophobicContact CG-CD1 4.38Å; Q138-L142 WeakPolarHBondContact O-CG 3.47Å; Q138-L142 PolarHBondContact O-N 3.32Å; R139-L142 PolarHBondContact O-N 3.42Å; C140-L142 PolarHBondContact O-N 2.92Å; L142-V149 HydrophobicContact CD2-CB 4.17Å; L142-V149 HydrophobicContact CD2-CG1 3.94Å; L142-V149 HydrophobicContact CD2-CG2 3.89Å
143	V	89.6	Confident	83.7	Confident	12 Å²	12	73.1 Å²	73.1	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-71.4	-41.3	178.1	170	0	0	0	0	110.9	R139 C140 Y141 I222 N225 R229	R139-V143 WeakPolarHBondContact O-CG2 3.27Å; R139-V143 PolarHBondContact O-N 3.49Å; C140-V143 PolarHBondContact O-N 3.15Å; Y141-V143 VanDerWaalsContact C-N 3.3Å; Y141-V143 PolarHBondContact O-N 3.46Å; V143-I222 HydrophobicContact CG2-CG1 4.33Å; V143-N225 HydrophobicContact CG1-CB 3.51Å; V143-R229 PolarHBondContact O-NH2 2.89Å
144	L	90.8	Very high	82.9	Confident	75 Å²	75	74.7 Å²	74.7	39%	0.393	36%	0.364	S	S	.	.	H	α-helix	trans	-69.7	-41.2	179.9	-73.7	168.4	0	0	0	112.8	C140 Y141 P146 I221 N225	C140-L144 WeakPolarHBondContact O-CG 3.28Å; C140-L144 PolarHBondContact O-N 2.87Å; Y141-L144 PolarHBondContact O-N 2.82Å; L144-P146 VanDerWaalsContact O-CD 3.24Å; L144-P146 WeakPolarHBondContact O-CD 3.27Å; L144-I221 HydrophobicContact CD1-CG2 4.06Å; L144-I221 HydrophobicContact CD2-CG2 3.86Å; L144-I221 HydrophobicContact CG-CG2 4.05Å; L144-N225 WeakPolarHBondContact CD2-ND2 3.26Å
145	Y	88.7	Confident	82.6	Confident	106 Å²	106	75.5 Å²	75.5	42%	0.416	37%	0.372	S	S	.	.			trans	-121.3	56.8	-170.9	-60.4	-78.2	0	0	0	113.5	Y141 L147 Q148 V149	Y141-Y145 AromaticContact CD2-CD2 3.82Å; Y141-Y145 HydrophobicContact CD2-CD2 3.82Å; Y141-Y145 HydrophobicContact CD2-CE2 4.25Å; Y141-Y145 AromaticContact CE2-CD2 3.74Å; Y141-Y145 HydrophobicContact CE2-CD2 3.74Å; Y141-Y145 HydrophobicContact CE2-CE2 4.19Å; Y141-Y145 HydrophobicContact CE2-CG 4.49Å; Y141-Y145 HydrophobicContact CG-CD2 4.5Å; Y141-Y145 PolarHBondContact O-N 3.41Å; Y145-L147 PolarHBondContact O-N 3.15Å; Y145-Q148 PolarHBondContact O-N 3.3Å; Y145-V149 WeakPolarHBondContact O-CG2 3.49Å; Y145-V149 PolarHBondContact O-N 2.96Å
146	P	82.1	Confident	82.3	Confident	79 Å²	79	79.1 Å²	79.1	51%	0.513	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.6	-171.8	27.2	-37.4	0	0	0	114.1	L144	L144-P146 VanDerWaalsContact O-CD 3.24Å; L144-P146 WeakPolarHBondContact O-CD 3.27Å
147	L	75.4	Confident	82.2	Confident	167 Å²	167	82.7 Å²	82.7	87%	0.874	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-22.5	-175.6	-62.7	176.8	0	0	0	114	Y145	Y145-L147 PolarHBondContact O-N 3.15Å
148	Q	72.5	Confident	82.1	Confident	133 Å²	133	83.8 Å²	83.8	62%	0.621	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.9	-175.7	-68.2	-178.2	-9.7	0	0	113	Y145 K150	Y145-Q148 PolarHBondContact O-N 3.3Å; Q148-K150 PolarHBondContact O-N 3.46Å
149	V	63.1	Low	82.1	Confident	40 Å²	40	83 Å²	83	24%	0.242	42%	0.415	C	S	.	.			trans	-74.9	74.6	174.6	-167.4	0	0	0	0	109	Y141 L142 Y145 S151	Y141-V149 HydrophobicContact CD1-CG2 4.02Å; Y141-V149 HydrophobicContact CE1-CG2 3.55Å; L142-V149 HydrophobicContact CD2-CB 4.17Å; L142-V149 HydrophobicContact CD2-CG1 3.94Å; L142-V149 HydrophobicContact CD2-CG2 3.89Å; Y145-V149 WeakPolarHBondContact O-CG2 3.49Å; Y145-V149 PolarHBondContact O-N 2.96Å; V149-S151 PolarHBondContact O-N 3.24Å; V149-S151 VanDerWaalsContact O-N 3.13Å
150	K	60	Low	82.2	Confident	168 Å²	168	86 Å²	86	73%	0.73	43%	0.431	S	S	*	.			trans	-52	121.8	158.3	-70.8	-177	177.9	177.9	0	105.3	Q148 K152 W153	Q148-K150 PolarHBondContact O-N 3.46Å; K150-K152 PolarHBondContact O-N 3.45Å; K150-W153 PolarHBondContact O-N 3.46Å
151	S	60.2	Low	82.3	Confident	112 Å²	112	89.5 Å²	89.5	78%	0.783	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-13.6	-173.4	57.1	0	0	0	0	115.6	V149	V149-S151 PolarHBondContact O-N 3.24Å; V149-S151 VanDerWaalsContact O-N 3.13Å
152	K	65.6	Low	82.5	Confident	182 Å²	182	91.8 Å²	91.8	79%	0.791	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-17.5	177.3	-65.6	-171.3	175.9	-174.3	0	115.6	K150 I154	K150-K152 PolarHBondContact O-N 3.45Å; K152-I154 PolarHBondContact O-N 3.26Å; K152-I154 VanDerWaalsContact O-N 3.12Å
153	W	67.3	Low	82.8	Confident	177 Å²	177	91.1 Å²	91.1	67%	0.67	45%	0.453	S	S	*	.	S	Bend	trans	-65.5	-24.2	-166.2	-126.9	67.7	0	0	0	114.1	K150	K150-W153 PolarHBondContact O-N 3.46Å
154	I	81.4	Confident	83.2	Confident	38 Å²	38	94.8 Å²	94.8	20%	0.195	47%	0.471	C	S	.	.	S	Bend	trans	-128.9	87.2	-178.4	-60.6	178.3	0	0	0	107.7	N73 Q138 K152 L159	N73-I154 PolarHBondContact ND2-O 3.36Å; N73-I154 PolarHBondContact OD1-O 2.82Å; Q138-I154 HydrophobicContact CG-CD1 4.33Å; K152-I154 PolarHBondContact O-N 3.26Å; K152-I154 VanDerWaalsContact O-N 3.12Å; I154-L159 HydrophobicContact CG2-CD1 3.45Å; I154-L159 VanDerWaalsContact CG2-CD1 3.45Å; I154-L159 HydrophobicContact CG2-CD2 3.21Å; I154-L159 HydrophobicContact CG2-CG 3.18Å
155	S	89.5	Confident	83.5	Confident	52 Å²	52	95 Å²	95	36%	0.364	47%	0.472	S	S	.	.			trans	-68.8	146.5	166.7	61.3	0	0	0	0	109.2	S157 K158 L159	S155-S157 PolarHBondContact O-N 3.4Å; S155-K158 PolarHBondContact O-N 3.04Å; S155-K158 VanDerWaalsContact OG-CG 3.3Å; S155-K158 WeakPolarHBondContact OG-CG 3.37Å; S155-K158 PolarHBondContact OG-N 3.27Å; S155-L159 PolarHBondContact O-N 3.02Å
156	L	90.2	Very high	83.9	Confident	80 Å²	80	91.3 Å²	91.3	42%	0.419	46%	0.459	S	S	.	.	H	α-helix	trans	-54.5	-39.5	178.8	-172.2	71.4	0	0	0	111.9	I76 K158 L159 I160	I76-L156 HydrophobicContact CB-CD1 4.31Å; I76-L156 HydrophobicContact CD1-CD1 3.95Å; I76-L156 HydrophobicContact CG2-CD1 4.43Å; L156-K158 PolarHBondContact O-N 3.1Å; L156-L159 WeakPolarHBondContact O-CB 3.32Å; L156-L159 PolarHBondContact O-N 2.96Å; L156-I160 HydrophobicContact CG-CD1 4.38Å; L156-I160 WeakPolarHBondContact O-CG1 3.07Å; L156-I160 PolarHBondContact O-N 2.93Å; L156-I160 VanDerWaalsContact O-N 3.08Å
157	S	93.1	Very high	84.7	Confident	76 Å²	76	88.8 Å²	88.8	53%	0.531	44%	0.443	S	S	.	.	H	α-helix	trans	-59.3	-42.6	175.9	169.2	0	0	0	0	112.5	S155 L159 I160 I161	S155-S157 PolarHBondContact O-N 3.4Å; S157-L159 VanDerWaalsContact C-N 3.33Å; S157-L159 PolarHBondContact O-N 2.96Å; S157-I160 PolarHBondContact O-N 3.34Å; S157-I161 VanDerWaalsContact O-CG1 3.32Å; S157-I161 WeakPolarHBondContact O-CG1 3.33Å; S157-I161 PolarHBondContact O-N 3.21Å
158	K	93.4	Very high	85.7	Confident	106 Å²	106	85.8 Å²	85.8	46%	0.461	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-37	176.4	-74.5	178.7	179.8	-173	0	112.2	S155 L156 I161 Y162	S155-K158 PolarHBondContact O-N 3.04Å; S155-K158 VanDerWaalsContact OG-CG 3.3Å; S155-K158 WeakPolarHBondContact OG-CG 3.37Å; S155-K158 PolarHBondContact OG-N 3.27Å; L156-K158 PolarHBondContact O-N 3.1Å; K158-I161 PolarHBondContact O-N 3.16Å; K158-Y162 HydrophobicContact CB-CE2 4.24Å; K158-Y162 WeakPolarHBondContact O-CD2 3.16Å; K158-Y162 PolarHBondContact O-N 3.14Å
159	L	93.1	Very high	87	Confident	5 Å²	5	84.1 Å²	84.1	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-62	-44.3	175.2	-70.8	178.3	0	0	0	112.3	N73 I76 W77 I154 S155 L156 S157 I161 Y162 Q163	N73-L159 HydrophobicContact CB-CD1 3.66Å; I76-L159 HydrophobicContact CG2-CB 4.42Å; I76-L159 HydrophobicContact CG2-CD1 3.84Å; W77-L159 HydrophobicContact CZ2-CD2 3.54Å; I154-L159 HydrophobicContact CG2-CD1 3.45Å; I154-L159 VanDerWaalsContact CG2-CD1 3.45Å; I154-L159 HydrophobicContact CG2-CD2 3.21Å; I154-L159 HydrophobicContact CG2-CG 3.18Å; S155-L159 PolarHBondContact O-N 3.02Å; L156-L159 WeakPolarHBondContact O-CB 3.32Å; L156-L159 PolarHBondContact O-N 2.96Å; S157-L159 VanDerWaalsContact C-N 3.33Å; S157-L159 PolarHBondContact O-N 2.96Å; L159-I161 VanDerWaalsContact C-N 3.31Å; L159-I161 PolarHBondContact O-N 3.08Å; L159-Y162 PolarHBondContact O-N 3.24Å; L159-Q163 WeakPolarHBondContact O-CG 3.26Å; L159-Q163 PolarHBondContact O-N 3.45Å
160	I	95.2	Very high	88.6	Confident	73 Å²	73	82.5 Å²	82.5	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176.1	-66.4	166.3	0	0	0	110.1	I76 L156 S157 Y162 Q163 I164	I76-I160 HydrophobicContact CD1-CD1 4.17Å; I76-I160 HydrophobicContact CD1-CG1 3.45Å; I76-I160 VanDerWaalsContact CD1-CG1 3.45Å; L156-I160 HydrophobicContact CG-CD1 4.38Å; L156-I160 WeakPolarHBondContact O-CG1 3.07Å; L156-I160 PolarHBondContact O-N 2.93Å; L156-I160 VanDerWaalsContact O-N 3.08Å; S157-I160 PolarHBondContact O-N 3.34Å; I160-Y162 PolarHBondContact O-N 3.4Å; I160-Q163 WeakPolarHBondContact O-CB 3.39Å; I160-Q163 PolarHBondContact O-N 3.33Å; I160-I164 HydrophobicContact CG2-CD1 3.91Å; I160-I164 WeakPolarHBondContact O-CG1 3.29Å; I160-I164 PolarHBondContact O-N 3.22Å
161	I	96.4	Very high	90.4	Very high	83 Å²	83	78.8 Å²	78.8	43%	0.426	40%	0.399	S	S	.	.	H	α-helix	trans	-59.3	-45.8	175.7	-67.7	164.9	0	0	0	110.9	S157 K158 L159 Q163 I164 I165	S157-I161 VanDerWaalsContact O-CG1 3.32Å; S157-I161 WeakPolarHBondContact O-CG1 3.33Å; S157-I161 PolarHBondContact O-N 3.21Å; K158-I161 PolarHBondContact O-N 3.16Å; L159-I161 VanDerWaalsContact C-N 3.31Å; L159-I161 PolarHBondContact O-N 3.08Å; I161-Q163 VanDerWaalsContact C-N 3.33Å; I161-Q163 PolarHBondContact O-N 2.86Å; I161-I164 PolarHBondContact O-N 3.07Å; I161-I165 HydrophobicContact CG2-CD1 3.76Å; I161-I165 HydrophobicContact CG2-CG1 4.39Å; I161-I165 VanDerWaalsContact O-CG1 3.31Å; I161-I165 WeakPolarHBondContact O-CG1 3.45Å; I161-I165 PolarHBondContact O-N 3.41Å
162	Y	95.1	Very high	92.2	Very high	125 Å²	125	79 Å²	79	49%	0.49	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-39.5	176.4	-67.7	-47.8	0	0	0	112.7	K158 L159 I160 I165 I166	K158-Y162 HydrophobicContact CB-CE2 4.24Å; K158-Y162 WeakPolarHBondContact O-CD2 3.16Å; K158-Y162 PolarHBondContact O-N 3.14Å; L159-Y162 PolarHBondContact O-N 3.24Å; I160-Y162 PolarHBondContact O-N 3.4Å; Y162-I165 PolarHBondContact O-N 3.48Å; Y162-I166 WeakPolarHBondContact O-CB 3.28Å; Y162-I166 VanDerWaalsContact O-CG1 3.29Å; Y162-I166 WeakPolarHBondContact O-CG1 3.3Å; Y162-I166 PolarHBondContact O-N 3.49Å
163	Q	96.3	Very high	93.7	Very high	24 Å²	24	71 Å²	71	11%	0.112	36%	0.356	C	S	.	.	H	α-helix	trans	-60.2	-47.1	174.5	-77.1	-176	2.5	0	0	111.2	W77 W127 M131 L159 I160 I161 I166 S167	W77-Q163 HydrophobicContact CE3-CG 4.16Å; W77-Q163 HydrophobicContact CH2-CG 3.81Å; W77-Q163 HydrophobicContact CZ3-CG 3.41Å; W77-Q163 VanDerWaalsContact CZ3-CG 3.41Å; W127-Q163 HydrophobicContact CH2-CB 4.09Å; W127-Q163 WeakPolarHBondContact CH2-O 3.45Å; M131-Q163 HydrophobicContact CE-CG 4.25Å; M131-Q163 HydrophobicContact SD-CG 4.03Å; L159-Q163 WeakPolarHBondContact O-CG 3.26Å; L159-Q163 PolarHBondContact O-N 3.45Å; I160-Q163 WeakPolarHBondContact O-CB 3.39Å; I160-Q163 PolarHBondContact O-N 3.33Å; I161-Q163 VanDerWaalsContact C-N 3.33Å; I161-Q163 PolarHBondContact O-N 2.86Å; Q163-I166 PolarHBondContact O-N 3.41Å; Q163-S167 PolarHBondContact O-N 3.25Å; Q163-S167 PolarHBondContact O-OG 3.29Å
164	I	97.3	Very high	95.1	Very high	89 Å²	89	63 Å²	63	46%	0.456	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-45.8	178.1	-66.7	165.7	0	0	0	111.4	I160 I161 I166 S167 I168	I160-I164 HydrophobicContact CG2-CD1 3.91Å; I160-I164 WeakPolarHBondContact O-CG1 3.29Å; I160-I164 PolarHBondContact O-N 3.22Å; I161-I164 PolarHBondContact O-N 3.07Å; I164-I166 VanDerWaalsContact C-N 3.28Å; I164-I166 PolarHBondContact O-N 2.94Å; I164-S167 VanDerWaalsContact O-CB 3.29Å; I164-S167 WeakPolarHBondContact O-CB 3.34Å; I164-S167 PolarHBondContact O-N 3.18Å; I164-I168 HydrophobicContact CG2-CD1 3.97Å; I164-I168 WeakPolarHBondContact O-CG1 3.23Å; I164-I168 PolarHBondContact O-N 2.96Å
165	I	98	Very high	95.8	Very high	81 Å²	81	65.6 Å²	65.6	42%	0.415	34%	0.341	S	S	.	.	H	α-helix	trans	-58.3	-45	178.2	-69.9	167.4	0	0	0	110.1	I161 Y162 I168 L169	I161-I165 HydrophobicContact CG2-CD1 3.76Å; I161-I165 HydrophobicContact CG2-CG1 4.39Å; I161-I165 VanDerWaalsContact O-CG1 3.31Å; I161-I165 WeakPolarHBondContact O-CG1 3.45Å; I161-I165 PolarHBondContact O-N 3.41Å; Y162-I165 PolarHBondContact O-N 3.48Å; I165-I168 PolarHBondContact O-N 3.25Å; I165-L169 HydrophobicContact CG2-CD1 3.99Å; I165-L169 HydrophobicContact CG2-CG 4.47Å; I165-L169 WeakPolarHBondContact O-CG 3.41Å; I165-L169 PolarHBondContact O-N 2.81Å
166	I	97.3	Very high	96.2	Very high	28 Å²	28	63.9 Å²	63.9	14%	0.144	33%	0.328	C	S	.	.	H	α-helix	trans	-69.4	-36.8	179.5	-67.6	170.9	0	0	0	110.9	Y130 M131 L134 Y162 Q163 I164 I168 L169 L170	Y130-I166 HydrophobicContact CD1-CG2 4.39Å; M131-I166 HydrophobicContact CE-CG2 4.41Å; L134-I166 HydrophobicContact CD1-CD1 3.27Å; L134-I166 HydrophobicContact CD2-CD1 3.55Å; L134-I166 HydrophobicContact CG-CD1 3.94Å; Y162-I166 WeakPolarHBondContact O-CB 3.28Å; Y162-I166 VanDerWaalsContact O-CG1 3.29Å; Y162-I166 WeakPolarHBondContact O-CG1 3.3Å; Y162-I166 PolarHBondContact O-N 3.49Å; Q163-I166 PolarHBondContact O-N 3.41Å; I164-I166 VanDerWaalsContact C-N 3.28Å; I164-I166 PolarHBondContact O-N 2.94Å; I166-I168 VanDerWaalsContact C-N 3.26Å; I166-I168 PolarHBondContact O-N 3.31Å; I166-L169 PolarHBondContact O-N 3.38Å; I166-L170 HydrophobicContact CG2-CD1 3.93Å; I166-L170 HydrophobicContact CG2-CG 4.19Å; I166-L170 VanDerWaalsContact O-CG 3.23Å; I166-L170 WeakPolarHBondContact O-CG 3.35Å; I166-L170 PolarHBondContact O-N 3.47Å
167	S	97.5	Very high	96.5	Very high	26 Å²	26	60.4 Å²	60.4	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-53	-48.7	172.3	-55.9	0	0	0	0	110.7	Y123 W127 Q163 I164 L170	Y123-S167 WeakPolarHBondContact OH-CA 3.41Å; Y123-S167 VanDerWaalsContact OH-CB 3.26Å; Y123-S167 WeakPolarHBondContact OH-CB 3.01Å; W127-S167 WeakPolarHBondContact CH2-OG 3.25Å; W127-S167 VanDerWaalsContact CZ3-CA 3.48Å; W127-S167 WeakPolarHBondContact CZ3-OG 3.21Å; Q163-S167 PolarHBondContact O-N 3.25Å; Q163-S167 PolarHBondContact O-OG 3.29Å; I164-S167 VanDerWaalsContact O-CB 3.29Å; I164-S167 WeakPolarHBondContact O-CB 3.34Å; I164-S167 PolarHBondContact O-N 3.18Å; S167-L170 PolarHBondContact O-N 3.16Å
168	I	98.1	Very high	96.7	Very high	104 Å²	104	59.3 Å²	59.3	53%	0.533	30%	0.301	S	S	.	.	H	α-helix	trans	-67.7	-44.1	-177.7	-64.8	165.9	0	0	0	110.6	I164 I165 I166 L170 I171	I164-I168 HydrophobicContact CG2-CD1 3.97Å; I164-I168 WeakPolarHBondContact O-CG1 3.23Å; I164-I168 PolarHBondContact O-N 2.96Å; I165-I168 PolarHBondContact O-N 3.25Å; I166-I168 VanDerWaalsContact C-N 3.26Å; I166-I168 PolarHBondContact O-N 3.31Å; I168-L170 VanDerWaalsContact C-N 3.27Å; I168-L170 PolarHBondContact O-N 3.13Å; I168-I171 WeakPolarHBondContact O-CB 3.32Å; I168-I171 PolarHBondContact O-N 2.8Å; I168-I171 VanDerWaalsContact O-N 3.12Å
169	L	98	Very high	96.9	Very high	98 Å²	98	59.3 Å²	59.3	51%	0.513	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-34.5	178.5	-72.1	173.1	0	0	0	112.6	I165 I166 I171 I172 P173	I165-L169 HydrophobicContact CG2-CD1 3.99Å; I165-L169 HydrophobicContact CG2-CG 4.47Å; I165-L169 WeakPolarHBondContact O-CG 3.41Å; I165-L169 PolarHBondContact O-N 2.81Å; I166-L169 PolarHBondContact O-N 3.38Å; L169-I171 PolarHBondContact O-N 3.29Å; L169-I172 HydrophobicContact CD2-CD1 4.39Å; L169-I172 WeakPolarHBondContact O-CB 3.34Å; L169-I172 PolarHBondContact O-N 2.93Å; L169-P173 WeakPolarHBondContact O-CD 3.49Å
170	L	97.9	Very high	97.1	Very high	5 Å²	5	63.8 Å²	63.8	3%	0.026	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.2	177.9	-67.6	174.7	0	0	0	113.8	Y123 Y126 W127 Y130 I166 S167 I168 I172 P173 I174	Y123-L170 HydrophobicContact CE2-CB 4.08Å; Y126-L170 HydrophobicContact CD1-CD2 4.15Å; W127-L170 HydrophobicContact CE3-CD1 4.15Å; Y130-L170 HydrophobicContact CD1-CD2 4.12Å; Y130-L170 HydrophobicContact CD2-CD1 4.23Å; Y130-L170 HydrophobicContact CD2-CD2 3.54Å; Y130-L170 HydrophobicContact CE1-CD2 4.11Å; Y130-L170 HydrophobicContact CE2-CD2 3.5Å; Y130-L170 HydrophobicContact CG-CD1 4.14Å; Y130-L170 HydrophobicContact CG-CD2 3.84Å; I166-L170 HydrophobicContact CG2-CD1 3.93Å; I166-L170 HydrophobicContact CG2-CG 4.19Å; I166-L170 VanDerWaalsContact O-CG 3.23Å; I166-L170 WeakPolarHBondContact O-CG 3.35Å; I166-L170 PolarHBondContact O-N 3.47Å; S167-L170 PolarHBondContact O-N 3.16Å; I168-L170 VanDerWaalsContact C-N 3.27Å; I168-L170 PolarHBondContact O-N 3.13Å; L170-I172 VanDerWaalsContact C-N 3.27Å; L170-I172 PolarHBondContact O-N 3.47Å; L170-P173 WeakPolarHBondContact O-CD 3.37Å; L170-P173 WeakPolarHBondContact O-CG 3.43Å; L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.39Å
171	I	97.7	Very high	97.2	Very high	90 Å²	90	61.8 Å²	61.8	46%	0.462	31%	0.31	S	S	.	.	H	α-helix	trans	-67.4	-32.3	171.9	-61.4	172.1	0	0	0	110.7	Y123 I168 L169 I174 L175	Y123-I171 HydrophobicContact CE2-CG1 4.35Å; I168-I171 WeakPolarHBondContact O-CB 3.32Å; I168-I171 PolarHBondContact O-N 2.8Å; I168-I171 VanDerWaalsContact O-N 3.12Å; L169-I171 PolarHBondContact O-N 3.29Å; I171-I174 CarbonylContact O-C 3.24Å; I171-I174 PolarHBondContact O-N 3.46Å; I171-I174 VanDerWaalsContact O-N 3.13Å; I171-L175 PolarHBondContact O-N 3.36Å
172	I	97.4	Very high	97.3	Very high	118 Å²	118	61.5 Å²	61.5	61%	0.605	31%	0.307	S	S	*	.	H	α-helix	trans	-57.9	-54.8	-176.6	-60	172.5	0	0	0	112.2	L169 L170 I174 L175	L169-I172 HydrophobicContact CD2-CD1 4.39Å; L169-I172 WeakPolarHBondContact O-CB 3.34Å; L169-I172 PolarHBondContact O-N 2.93Å; L170-I172 VanDerWaalsContact C-N 3.27Å; L170-I172 PolarHBondContact O-N 3.47Å; I172-I174 PolarHBondContact O-N 3.11Å; I172-L175 VanDerWaalsContact O-CB 3.26Å; I172-L175 WeakPolarHBondContact O-CB 3.39Å; I172-L175 PolarHBondContact O-N 3.45Å
173	P	97	Very high	97.4	Very high	12 Å²	12	57.1 Å²	57.1	8%	0.078	29%	0.293	C	S	.	.	H	α-helix	trans	-69.3	-18.1	178.1	28.3	-37.2	0	0	0	113.7	Y126 L169 L170 P176 F206	Y126-P173 HydrophobicContact CD1-CB 4.44Å; Y126-P173 HydrophobicContact CD1-CG 3.87Å; Y126-P173 HydrophobicContact CE1-CB 3.61Å; Y126-P173 HydrophobicContact CE1-CG 3.54Å; L169-P173 WeakPolarHBondContact O-CD 3.49Å; L170-P173 WeakPolarHBondContact O-CD 3.37Å; L170-P173 WeakPolarHBondContact O-CG 3.43Å; P173-P176 VanDerWaalsContact O-CD 3.32Å; P173-P176 WeakPolarHBondContact O-CD 3.07Å; P173-F206 HydrophobicContact CB-CB 3.99Å; P173-F206 HydrophobicContact CB-CD2 3.94Å; P173-F206 HydrophobicContact CB-CG 3.97Å; P173-F206 HydrophobicContact CG-CB 4.38Å
174	I	97.3	Very high	97.3	Very high	10 Å²	10	58.4 Å²	58.4	5%	0.051	30%	0.3	C	S	.	.	H	α-helix	trans	-84.1	-20.4	177.3	-62.9	-62.4	0	0	0	112.2	N122 Y123 Y126 L170 I171 I172 P176 Y177 P178	N122-I174 HydrophobicContact CB-CD1 3.76Å; Y123-I174 HydrophobicContact CD2-CG1 4.33Å; Y126-I174 HydrophobicContact CD2-CD1 3.69Å; Y126-I174 HydrophobicContact CE2-CD1 3.64Å; Y126-I174 HydrophobicContact CG-CD1 4.11Å; L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.39Å; I171-I174 CarbonylContact O-C 3.24Å; I171-I174 PolarHBondContact O-N 3.46Å; I171-I174 VanDerWaalsContact O-N 3.13Å; I172-I174 PolarHBondContact O-N 3.11Å; I174-P176 VanDerWaalsContact C-N 3.28Å; I174-P176 WeakPolarHBondContact O-CD 3.49Å; I174-P176 VanDerWaalsContact O-N 3.09Å; I174-Y177 HydrophobicContact CD1-CD2 4.27Å; I174-Y177 HydrophobicContact CD1-CE2 4.15Å; I174-Y177 HydrophobicContact CG2-CD2 4.18Å; I174-Y177 WeakPolarHBondContact O-CB 3.35Å; I174-Y177 WeakPolarHBondContact O-CD2 3.38Å; I174-Y177 PolarHBondContact O-N 3.13Å; I174-P178 WeakPolarHBondContact O-CD 3.41Å
175	L	97.2	Very high	97.1	Very high	92 Å²	92	61.7 Å²	61.7	48%	0.482	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-33.9	-177.1	-164.9	109.7	0	0	0	115.5	I171 I172 Y177 P178 L179	I171-L175 PolarHBondContact O-N 3.36Å; I172-L175 VanDerWaalsContact O-CB 3.26Å; I172-L175 WeakPolarHBondContact O-CB 3.39Å; I172-L175 PolarHBondContact O-N 3.45Å; L175-Y177 PolarHBondContact O-N 2.93Å; L175-P178 WeakPolarHBondContact O-CD 3.31Å; L175-P178 WeakPolarHBondContact O-CG 3.46Å; L175-L179 HydrophobicContact CD2-CD1 3.4Å; L175-L179 VanDerWaalsContact CD2-CD1 3.4Å; L175-L179 HydrophobicContact CD2-CG 4.49Å; L175-L179 HydrophobicContact CG-CD1 3.75Å; L175-L179 HydrophobicContact CG-CG 4.36Å; L175-L179 VanDerWaalsContact O-CG 3.31Å; L175-L179 WeakPolarHBondContact O-CG 3.28Å; L175-L179 PolarHBondContact O-N 2.78Å
176	P	97	Very high	96.9	Very high	16 Å²	16	64.3 Å²	64.3	10%	0.104	33%	0.334	C	S	.	.	H	α-helix	trans	-60.9	-29.2	175.2	-26.7	37.6	0	0	0	114.5	P173 I174 Y180 T199	P173-P176 VanDerWaalsContact O-CD 3.32Å; P173-P176 WeakPolarHBondContact O-CD 3.07Å; I174-P176 VanDerWaalsContact C-N 3.28Å; I174-P176 WeakPolarHBondContact O-CD 3.49Å; I174-P176 VanDerWaalsContact O-N 3.09Å; P176-Y180 HydrophobicContact CB-CD2 4.31Å; P176-Y180 WeakPolarHBondContact O-CB 3.34Å; P176-Y180 WeakPolarHBondContact O-CD2 3.35Å; P176-Y180 PolarHBondContact O-N 2.84Å; P176-Y180 VanDerWaalsContact O-N 3.15Å; P176-T199 HydrophobicContact CB-CG2 3.58Å
177	Y	96.8	Very high	96.6	Very high	7 Å²	7	64.4 Å²	64.4	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-59.3	179.3	-67.3	-76.2	0	0	0	113	T118 S119 N122 I174 L175 L179 Y180 W181 D203	T118-Y177 HydrophobicContact CG2-CD1 3.43Å; T118-Y177 VanDerWaalsContact CG2-CD1 3.43Å; T118-Y177 HydrophobicContact CG2-CE1 3.78Å; T118-Y177 HydrophobicContact CG2-CG 4.31Å; S119-Y177 WeakPolarHBondContact OG-CB 3.32Å; N122-Y177 HydrophobicContact CB-CD2 4.34Å; N122-Y177 HydrophobicContact CB-CE2 3.79Å; N122-Y177 WeakPolarHBondContact ND2-CE1 3.39Å; N122-Y177 PolarHBondContact ND2-OH 2.95Å; I174-Y177 HydrophobicContact CD1-CD2 4.27Å; I174-Y177 HydrophobicContact CD1-CE2 4.15Å; I174-Y177 HydrophobicContact CG2-CD2 4.18Å; I174-Y177 WeakPolarHBondContact O-CB 3.35Å; I174-Y177 WeakPolarHBondContact O-CD2 3.38Å; I174-Y177 PolarHBondContact O-N 3.13Å; L175-Y177 PolarHBondContact O-N 2.93Å; Y177-L179 PolarHBondContact O-N 3.49Å; Y177-Y180 PolarHBondContact O-N 3.2Å; Y177-W181 AromaticContact CD1-CD1 3.75Å; Y177-W181 HydrophobicContact CD1-CD2 4.17Å; Y177-W181 AromaticContact CD1-CE2 3.6Å; Y177-W181 HydrophobicContact CD1-CG 4.23Å; Y177-W181 HydrophobicContact CD1-CZ2 4.1Å; Y177-W181 AromaticContact CD1-NE1 3.3Å; Y177-W181 VanDerWaalsContact CD1-NE1 3.3Å; Y177-W181 AromaticContact CE1-CE2 3.82Å; Y177-W181 AromaticContact CE1-CZ2 3.83Å; Y177-W181 HydrophobicContact CE1-CZ2 3.83Å; Y177-W181 AromaticContact CE1-NE1 3.77Å; Y177-W181 VanDerWaalsContact O-CB 3.29Å; Y177-W181 WeakPolarHBondContact O-CB 3.39Å; Y177-W181 PolarHBondContact O-N 3.28Å; Y177-W181 VanDerWaalsContact O-N 3.08Å; Y177-D203 VanDerWaalsContact OH-CG 3.31Å; Y177-D203 PolarHBondContact OH-OD1 3.29Å; Y177-D203 PolarHBondContact OH-OD2 3.08Å
178	P	97.5	Very high	96.5	Very high	54 Å²	54	63.4 Å²	63.4	35%	0.351	33%	0.328	S	S	.	.	H	α-helix	trans	-68.4	-19.3	-178.2	28.8	-37	0	0	0	114.3	I115 S119 I174 L175	I115-P178 HydrophobicContact CG2-CB 3.79Å; S119-P178 WeakPolarHBondContact OG-CD 3.43Å; I174-P178 WeakPolarHBondContact O-CD 3.41Å; L175-P178 WeakPolarHBondContact O-CD 3.31Å; L175-P178 WeakPolarHBondContact O-CG 3.46Å
179	L	97.5	Very high	96.3	Very high	105 Å²	105	61.6 Å²	61.6	55%	0.55	32%	0.319	S	S	.	.	H	α-helix	trans	-85.2	-32.5	-179.8	-68.8	-179.7	0	0	0	113.6	L175 Y177	L175-L179 HydrophobicContact CD2-CD1 3.4Å; L175-L179 VanDerWaalsContact CD2-CD1 3.4Å; L175-L179 HydrophobicContact CD2-CG 4.49Å; L175-L179 HydrophobicContact CG-CD1 3.75Å; L175-L179 HydrophobicContact CG-CG 4.36Å; L175-L179 VanDerWaalsContact O-CG 3.31Å; L175-L179 WeakPolarHBondContact O-CG 3.28Å; L175-L179 PolarHBondContact O-N 2.78Å; Y177-L179 PolarHBondContact O-N 3.49Å
180	Y	97.4	Very high	96.1	Very high	100 Å²	100	57.8 Å²	57.8	39%	0.392	30%	0.3	S	S	.	.	H	α-helix	trans	-129.3	-1.1	-166.3	-57.5	-65.8	0	0	0	115.5	P176 Y177 P190 V191 I195	P176-Y180 HydrophobicContact CB-CD2 4.31Å; P176-Y180 WeakPolarHBondContact O-CB 3.34Å; P176-Y180 WeakPolarHBondContact O-CD2 3.35Å; P176-Y180 PolarHBondContact O-N 2.84Å; P176-Y180 VanDerWaalsContact O-N 3.15Å; Y177-Y180 PolarHBondContact O-N 3.2Å; Y180-P190 WeakPolarHBondContact O-CA 3.35Å; Y180-V191 WeakPolarHBondContact O-CG2 3.49Å; Y180-V191 PolarHBondContact O-N 3.1Å; Y180-I195 HydrophobicContact CD1-CD1 3.6Å; Y180-I195 HydrophobicContact CD2-CG2 3.84Å; Y180-I195 HydrophobicContact CE1-CD1 4.16Å; Y180-I195 HydrophobicContact CG-CD1 3.8Å; Y180-I195 HydrophobicContact CG-CG1 4.4Å; Y180-I195 HydrophobicContact CG-CG2 3.79Å
181	W	96.9	Very high	96	Very high	30 Å²	30	61.2 Å²	61.2	11%	0.114	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	133.7	173.5	-73.4	61.7	0	0	0	110.5	I115 T118 Y177 C188	I115-W181 WeakPolarHBondContact CG1-O 3.26Å; T118-W181 HydrophobicContact CG2-CD2 4.05Å; T118-W181 HydrophobicContact CG2-CE3 3.98Å; T118-W181 HydrophobicContact CG2-CH2 4.43Å; T118-W181 HydrophobicContact CG2-CZ2 4.49Å; T118-W181 HydrophobicContact CG2-CZ3 4.17Å; Y177-W181 AromaticContact CD1-CD1 3.75Å; Y177-W181 HydrophobicContact CD1-CD2 4.17Å; Y177-W181 AromaticContact CD1-CE2 3.6Å; Y177-W181 HydrophobicContact CD1-CG 4.23Å; Y177-W181 HydrophobicContact CD1-CZ2 4.1Å; Y177-W181 AromaticContact CD1-NE1 3.3Å; Y177-W181 VanDerWaalsContact CD1-NE1 3.3Å; Y177-W181 AromaticContact CE1-CE2 3.82Å; Y177-W181 AromaticContact CE1-CZ2 3.83Å; Y177-W181 HydrophobicContact CE1-CZ2 3.83Å; Y177-W181 AromaticContact CE1-NE1 3.77Å; Y177-W181 VanDerWaalsContact O-CB 3.29Å; Y177-W181 WeakPolarHBondContact O-CB 3.39Å; Y177-W181 PolarHBondContact O-N 3.28Å; Y177-W181 VanDerWaalsContact O-N 3.08Å; W181-C188 VanDerWaalsContact CZ3-O 3.23Å; W181-C188 WeakPolarHBondContact CZ3-O 3.3Å
182	Q	97.5	Very high	95.8	Very high	78 Å²	78	60.8 Å²	60.8	36%	0.364	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	165.4	177.6	62.3	-178.9	19.9	0	0	109.5	I184 D189 V191	Q182-I184 HydrophobicContact CG-CD1 3.84Å; Q182-I184 HydrophobicContact CG-CG1 3.64Å; Q182-I184 PolarHBondContact O-N 3.34Å; Q182-D189 PolarHBondContact N-O 3Å; Q182-D189 VanDerWaalsContact N-O 3.13Å; Q182-D189 PolarHBondContact O-N 2.61Å; Q182-V191 HydrophobicContact CG-CG2 4.06Å
183	V	97.2	Very high	95.6	Very high	32 Å²	32	60.6 Å²	60.6	19%	0.194	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.6	174.1	-176.7	0	0	0	0	108.4	N111 C114 D187	N111-V183 VanDerWaalsContact OD1-CB 3.23Å; N111-V183 WeakPolarHBondContact OD1-CB 3.34Å; N111-V183 WeakPolarHBondContact OD1-CG2 3.26Å; N111-V183 PolarHBondContact OD1-N 3.39Å; C114-V183 HydrophobicContact CB-CG2 3.89Å; V183-D187 WeakPolarHBondContact CA-O 3.42Å
184	I	95.2	Very high	95.4	Very high	52 Å²	52	68.1 Å²	68.1	27%	0.267	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.8	178.7	-50.8	177.9	0	0	0	107.1	Q182 D186 D187	Q182-I184 HydrophobicContact CG-CD1 3.84Å; Q182-I184 HydrophobicContact CG-CG1 3.64Å; Q182-I184 PolarHBondContact O-N 3.34Å; I184-D186 VanDerWaalsContact C-N 3.27Å; I184-D186 PolarHBondContact O-N 3.32Å; I184-D187 PolarHBondContact N-O 3.45Å; I184-D187 PolarHBondContact O-N 3.01Å
185	N	93.4	Very high	95.3	Very high	157 Å²	157	68.9 Å²	68.9	84%	0.84	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	43.5	-177.4	-52.2	-40.9	0	0	0	113.2	D187	N185-D187 PolarHBondContact O-N 3.38Å
186	D	92.3	Very high	95.1	Very high	136 Å²	136	66.6 Å²	66.6	73%	0.727	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	17.5	-179.3	-52.2	-44.8	0	0	0	115.5	D108 I184	D108-D186 WeakPolarHBondContact CB-O 3.46Å; I184-D186 VanDerWaalsContact C-N 3.27Å; I184-D186 PolarHBondContact O-N 3.32Å
187	D	92.8	Very high	95	Very high	30 Å²	30	69 Å²	69	16%	0.16	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.7	170.1	-153.3	-9.7	0	0	0	108.9	V183 I184 N185 D189 K371	V183-D187 WeakPolarHBondContact CA-O 3.42Å; I184-D187 PolarHBondContact N-O 3.45Å; I184-D187 PolarHBondContact O-N 3.01Å; N185-D187 PolarHBondContact O-N 3.38Å; D187-D189 PolarHBondContact O-N 2.7Å; D187-D189 VanDerWaalsContact O-N 3.15Å; D187-K371 IonicContact OD2-NZ 2.84Å; D187-K371 PolarHBondContact OD2-NZ 3.11Å
188	C	94.9	Very high	94.9	Very high	6 Å²	6	72.9 Å²	72.9	4%	0.041	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	96.2	174.8	173.2	0	0	0	0	110.1	R107 D108 C114 W181	R107-C188 HydrophobicContact CB-CB 3.55Å; D108-C188 PolarHBondContact OD1-N 3.17Å; C114-C188 WeakPolarHBondContact CA-SG 3.41Å; C114-C188 HydrophobicContact CB-CB 3.77Å; C114-C188 WeakPolarHBondContact CB-SG 3.31Å; C114-C188 WeakPolarHBondContact SG-CB 3.45Å; C114-C188 CovalentContact SG-SG 2.03Å; C114-C188 PolarHBondContact SG-SG 3.06Å; W181-C188 VanDerWaalsContact CZ3-O 3.23Å; W181-C188 WeakPolarHBondContact CZ3-O 3.3Å
189	D	93.8	Very high	94.8	Very high	66 Å²	66	70.4 Å²	70.4	35%	0.353	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	158.5	-171.9	-85.2	-32.7	0	0	0	112.3	Q182 D187	Q182-D189 PolarHBondContact N-O 3Å; Q182-D189 VanDerWaalsContact N-O 3.13Å; Q182-D189 PolarHBondContact O-N 2.61Å; D187-D189 PolarHBondContact O-N 2.7Å; D187-D189 VanDerWaalsContact O-N 3.15Å
190	P	94.6	Very high	94.7	Very high	18 Å²	18	65.6 Å²	65.6	12%	0.117	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	147.2	171.7	29	-33.2	0	0	0	111.5	Y180 N192 I195 F196	Y180-P190 WeakPolarHBondContact O-CA 3.35Å; P190-N192 PolarHBondContact O-N 3.36Å; P190-I195 HydrophobicContact CB-CB 4.48Å; P190-I195 HydrophobicContact CB-CG2 4.23Å; P190-F196 HydrophobicContact CB-CB 4.47Å; P190-F196 HydrophobicContact CG-CB 3.65Å; P190-F196 HydrophobicContact CG-CD2 3.92Å; P190-F196 HydrophobicContact CG-CG 4.17Å
191	V	94.9	Very high	94.6	Very high	77 Å²	77	63.5 Å²	63.5	47%	0.467	32%	0.32	S	S	.	.	S	Bend	trans	-54.9	-30	-179.3	176.2	0	0	0	0	113.7	Y180 Q182 I195	Y180-V191 WeakPolarHBondContact O-CG2 3.49Å; Y180-V191 PolarHBondContact O-N 3.1Å; Q182-V191 HydrophobicContact CG-CG2 4.06Å; V191-I195 HydrophobicContact CB-CD1 4.26Å
192	N	94	Very high	94.6	Very high	81 Å²	81	63 Å²	63	43%	0.433	32%	0.321	S	S	.	.	S	Bend	trans	-148.4	146.3	-177.9	-168.9	-38.3	0	0	0	110.8	P190 K194 I195 F196	P190-N192 PolarHBondContact O-N 3.36Å; N192-K194 PolarHBondContact O-N 3.39Å; N192-K194 PolarHBondContact OD1-N 3.26Å; N192-I195 HydrophobicContact CB-CD1 4.05Å; N192-I195 HydrophobicContact CB-CG1 4.32Å; N192-I195 WeakPolarHBondContact O-CB 3.14Å; N192-I195 PolarHBondContact O-N 3.36Å; N192-F196 PolarHBondContact O-N 3.22Å; N192-F196 VanDerWaalsContact O-N 3.15Å
193	E	91.6	Very high	94.6	Very high	114 Å²	114	59.6 Å²	59.6	53%	0.533	31%	0.305	S	S	.	.	H	α-helix	trans	-54.9	-35.6	174.1	-164.6	-164.3	149.2	0	0	112.9	I195 F196 R197	E193-I195 PolarHBondContact O-N 3.17Å; E193-F196 VanDerWaalsContact O-CB 3.31Å; E193-F196 WeakPolarHBondContact O-CB 3.34Å; E193-F196 PolarHBondContact O-N 2.9Å; E193-F196 VanDerWaalsContact O-N 3.12Å; E193-R197 PolarHBondContact O-N 3.23Å; E193-R197 IonicContact OE1-CZ 3.19Å; E193-R197 IonicContact OE1-NE 2.65Å; E193-R197 PolarHBondContact OE1-NE 3.31Å; E193-R197 IonicContact OE1-NH2 3.78Å; E193-R197 PolarHBondContact OE1-NH2 3.48Å
194	K	94.3	Very high	94.6	Very high	169 Å²	169	58.2 Å²	58.2	74%	0.735	30%	0.297	S	S	*	.	H	α-helix	trans	-59.6	-37	175.7	-68.4	-176	-179.5	179.5	0	112.3	N192 L198	N192-K194 PolarHBondContact O-N 3.39Å; N192-K194 PolarHBondContact OD1-N 3.26Å; K194-L198 WeakPolarHBondContact O-CB 3.21Å; K194-L198 PolarHBondContact O-N 3.03Å
195	I	94.6	Very high	94.8	Very high	27 Å²	27	58.9 Å²	58.9	14%	0.138	30%	0.3	C	S	.	.	H	α-helix	trans	-72.3	-39.6	177.9	-63.8	166.9	0	0	0	109.6	Y180 P190 V191 N192 E193 R197 L198 T199	Y180-I195 HydrophobicContact CD1-CD1 3.6Å; Y180-I195 HydrophobicContact CD2-CG2 3.84Å; Y180-I195 HydrophobicContact CE1-CD1 4.16Å; Y180-I195 HydrophobicContact CG-CD1 3.8Å; Y180-I195 HydrophobicContact CG-CG1 4.4Å; Y180-I195 HydrophobicContact CG-CG2 3.79Å; P190-I195 HydrophobicContact CB-CB 4.48Å; P190-I195 HydrophobicContact CB-CG2 4.23Å; V191-I195 HydrophobicContact CB-CD1 4.26Å; N192-I195 HydrophobicContact CB-CD1 4.05Å; N192-I195 HydrophobicContact CB-CG1 4.32Å; N192-I195 WeakPolarHBondContact O-CB 3.14Å; N192-I195 PolarHBondContact O-N 3.36Å; E193-I195 PolarHBondContact O-N 3.17Å; I195-R197 PolarHBondContact O-N 3.03Å; I195-L198 WeakPolarHBondContact O-CB 3.24Å; I195-L198 PolarHBondContact O-N 2.93Å; I195-T199 HydrophobicContact CG2-CG2 4.3Å; I195-T199 WeakPolarHBondContact O-CG2 3.24Å; I195-T199 PolarHBondContact O-N 3.41Å; I195-T199 PolarHBondContact O-OG1 3.36Å
196	F	93.4	Very high	95	Very high	44 Å²	44	55.3 Å²	55.3	19%	0.193	28%	0.277	C	S	.	.	H	α-helix	trans	-56.8	-48.6	173.6	-176.2	-114.8	0	0	0	112	P190 N192 E193 L198 T199 T200 L358 H370	P190-F196 HydrophobicContact CB-CB 4.47Å; P190-F196 HydrophobicContact CG-CB 3.65Å; P190-F196 HydrophobicContact CG-CD2 3.92Å; P190-F196 HydrophobicContact CG-CG 4.17Å; N192-F196 PolarHBondContact O-N 3.22Å; N192-F196 VanDerWaalsContact O-N 3.15Å; E193-F196 VanDerWaalsContact O-CB 3.31Å; E193-F196 WeakPolarHBondContact O-CB 3.34Å; E193-F196 PolarHBondContact O-N 2.9Å; E193-F196 VanDerWaalsContact O-N 3.12Å; F196-L198 VanDerWaalsContact C-N 3.34Å; F196-L198 PolarHBondContact O-N 3.5Å; F196-T199 WeakPolarHBondContact CA-OG1 3.32Å; F196-T199 PolarHBondContact O-N 3.5Å; F196-T199 PolarHBondContact O-OG1 3.48Å; F196-T200 HydrophobicContact CD2-CG2 4.39Å; F196-T200 HydrophobicContact CE1-CG2 4.21Å; F196-T200 HydrophobicContact CE2-CG2 4Å; F196-T200 HydrophobicContact CZ-CG2 3.9Å; F196-T200 WeakPolarHBondContact O-CG2 3.47Å; F196-T200 PolarHBondContact O-N 2.93Å; F196-T200 PolarHBondContact O-OG1 3.3Å; F196-L358 HydrophobicContact CE1-CD2 3.89Å; F196-L358 HydrophobicContact CZ-CD2 4.37Å; F196-H370 AromaticContact CE1-CE1 3.83Å; F196-H370 AromaticContact CE1-NE2 3.96Å; F196-H370 AromaticContact CZ-CE1 3.55Å; F196-H370 AromaticContact CZ-NE2 3.45Å; F196-H370 WeakPolarHBondContact CZ-NE2 3.41Å
197	R	93.7	Very high	95.2	Very high	67 Å²	67	49 Å²	49	25%	0.253	24%	0.243	S	C	.	.	H	α-helix	trans	-60.3	-43.2	175	-67.3	-169.3	-170.9	-147.9	3.1	111.7	E193 I195 T199 T200 L201 N359 D363	E193-R197 PolarHBondContact O-N 3.23Å; E193-R197 IonicContact OE1-CZ 3.19Å; E193-R197 IonicContact OE1-NE 2.65Å; E193-R197 PolarHBondContact OE1-NE 3.31Å; E193-R197 IonicContact OE1-NH2 3.78Å; E193-R197 PolarHBondContact OE1-NH2 3.48Å; I195-R197 PolarHBondContact O-N 3.03Å; R197-T199 PolarHBondContact O-N 3.47Å; R197-T200 PolarHBondContact O-N 3.37Å; R197-T200 PolarHBondContact O-OG1 3.12Å; R197-T200 VanDerWaalsContact O-OG1 3.05Å; R197-L201 VanDerWaalsContact O-CB 3.24Å; R197-L201 WeakPolarHBondContact O-CB 3.34Å; R197-L201 PolarHBondContact O-N 3.33Å; R197-N359 PolarHBondContact O-OD1 2.88Å; R197-N359 VanDerWaalsContact O-OD1 3.14Å; R197-D363 PolarHBondContact NH2-O 3.24Å
198	L	95.2	Very high	95.4	Very high	87 Å²	87	47.5 Å²	47.5	46%	0.455	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-46.1	174.6	-178.9	63.7	0	0	0	112	K194 I195 F196 L201 C202	K194-L198 WeakPolarHBondContact O-CB 3.21Å; K194-L198 PolarHBondContact O-N 3.03Å; I195-L198 WeakPolarHBondContact O-CB 3.24Å; I195-L198 PolarHBondContact O-N 2.93Å; F196-L198 VanDerWaalsContact C-N 3.34Å; F196-L198 PolarHBondContact O-N 3.5Å; L198-L201 PolarHBondContact O-N 3.39Å; L198-C202 PolarHBondContact O-N 2.91Å; L198-C202 PolarHBondContact O-SG 3.02Å; L198-C202 VanDerWaalsContact O-SG 3.34Å
199	T	95.7	Very high	95.5	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-44.2	179.7	56.1	0	0	0	0	112.3	P176 I195 F196 R197 L201 C202 D203	P176-T199 HydrophobicContact CB-CG2 3.58Å; I195-T199 HydrophobicContact CG2-CG2 4.3Å; I195-T199 WeakPolarHBondContact O-CG2 3.24Å; I195-T199 PolarHBondContact O-N 3.41Å; I195-T199 PolarHBondContact O-OG1 3.36Å; F196-T199 WeakPolarHBondContact CA-OG1 3.32Å; F196-T199 PolarHBondContact O-N 3.5Å; F196-T199 PolarHBondContact O-OG1 3.48Å; R197-T199 PolarHBondContact O-N 3.47Å; T199-L201 VanDerWaalsContact C-N 3.33Å; T199-L201 PolarHBondContact O-N 2.97Å; T199-C202 WeakPolarHBondContact O-CB 3.35Å; T199-C202 PolarHBondContact O-N 2.88Å; T199-D203 PolarHBondContact O-N 3.44Å
200	T	95.5	Very high	95.7	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-69.3	-32.1	178.7	56.3	0	0	0	0	112	F196 R197 D203 L204 F355 L358 N359	F196-T200 HydrophobicContact CD2-CG2 4.39Å; F196-T200 HydrophobicContact CE1-CG2 4.21Å; F196-T200 HydrophobicContact CE2-CG2 4Å; F196-T200 HydrophobicContact CZ-CG2 3.9Å; F196-T200 WeakPolarHBondContact O-CG2 3.47Å; F196-T200 PolarHBondContact O-N 2.93Å; F196-T200 PolarHBondContact O-OG1 3.3Å; R197-T200 PolarHBondContact O-N 3.37Å; R197-T200 PolarHBondContact O-OG1 3.12Å; R197-T200 VanDerWaalsContact O-OG1 3.05Å; T200-D203 PolarHBondContact O-N 2.94Å; T200-L204 VanDerWaalsContact O-CB 3.3Å; T200-L204 WeakPolarHBondContact O-CB 3.26Å; T200-L204 PolarHBondContact O-N 3.41Å; T200-F355 HydrophobicContact CG2-CD1 4.45Å; T200-F355 HydrophobicContact CG2-CE1 4.23Å; T200-L358 HydrophobicContact CG2-CD2 4.35Å; T200-N359 PolarHBondContact OG1-ND2 3.02Å; T200-N359 PolarHBondContact OG1-OD1 2.7Å
201	L	96.1	Very high	95.9	Very high	55 Å²	55	50.8 Å²	50.8	29%	0.288	25%	0.25	S	S	.	.	H	α-helix	trans	-67.3	-42	171.6	-176.3	65.7	0	0	0	111.6	R197 L198 T199 L204 I205 F360	R197-L201 VanDerWaalsContact O-CB 3.24Å; R197-L201 WeakPolarHBondContact O-CB 3.34Å; R197-L201 PolarHBondContact O-N 3.33Å; L198-L201 PolarHBondContact O-N 3.39Å; T199-L201 VanDerWaalsContact C-N 3.33Å; T199-L201 PolarHBondContact O-N 2.97Å; L201-L204 HydrophobicContact CD1-CD2 4.43Å; L201-L204 PolarHBondContact O-N 3.26Å; L201-I205 HydrophobicContact CD1-CD1 4.08Å; L201-I205 HydrophobicContact CG-CD1 4.05Å; L201-I205 WeakPolarHBondContact O-CG1 3.47Å; L201-I205 PolarHBondContact O-N 3.34Å; L201-F360 HydrophobicContact CD1-CE2 4.32Å; L201-F360 HydrophobicContact CD1-CZ 3.93Å
202	C	96.9	Very high	96	Very high	21 Å²	21	48.6 Å²	48.6	14%	0.142	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-46.3	172.9	-74.7	0	0	0	0	111.2	L198 T199 I205 F206	L198-C202 PolarHBondContact O-N 2.91Å; L198-C202 PolarHBondContact O-SG 3.02Å; L198-C202 VanDerWaalsContact O-SG 3.34Å; T199-C202 WeakPolarHBondContact O-CB 3.35Å; T199-C202 PolarHBondContact O-N 2.88Å; C202-I205 PolarHBondContact O-N 3.08Å; C202-F206 HydrophobicContact CB-CD2 4.46Å; C202-F206 WeakPolarHBondContact O-CB 3.16Å; C202-F206 PolarHBondContact O-N 3.47Å
203	D	96.9	Very high	96.2	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.027	25%	0.246	C	C	.	.	I	π-helix	trans	-61.5	-45.4	175.8	-71.4	-18.3	0	0	0	112.5	Y126 Y177 T199 T200 I205 W207 G208 F355	Y126-D203 VanDerWaalsContact CE2-OD1 3.3Å; Y126-D203 WeakPolarHBondContact CE2-OD1 3.33Å; Y126-D203 VanDerWaalsContact OH-CA 3.28Å; Y126-D203 WeakPolarHBondContact OH-CA 3.25Å; Y126-D203 PolarHBondContact OH-N 2.82Å; Y126-D203 PolarHBondContact OH-OD1 3.13Å; Y177-D203 VanDerWaalsContact OH-CG 3.31Å; Y177-D203 PolarHBondContact OH-OD1 3.29Å; Y177-D203 PolarHBondContact OH-OD2 3.08Å; T199-D203 PolarHBondContact O-N 3.44Å; T200-D203 PolarHBondContact O-N 2.94Å; D203-I205 VanDerWaalsContact C-N 3.28Å; D203-I205 PolarHBondContact O-N 3.33Å; D203-W207 WeakPolarHBondContact O-CA 3.23Å; D203-W207 WeakPolarHBondContact O-CB 3.29Å; D203-W207 PolarHBondContact O-N 3.36Å; D203-W207 VanDerWaalsContact O-N 3.12Å; D203-G208 PolarHBondContact O-N 2.97Å; D203-F355 HydrophobicContact CB-CD2 4.32Å; D203-F355 HydrophobicContact CB-CE2 3.82Å
204	L	97.6	Very high	96.5	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.021	23%	0.23	C	C	.	.	I	π-helix	trans	-55.4	-45.7	176.8	176.1	60.9	0	0	0	111	T200 L201 G208 L209 L352 F355 L356 F360	T200-L204 VanDerWaalsContact O-CB 3.3Å; T200-L204 WeakPolarHBondContact O-CB 3.26Å; T200-L204 PolarHBondContact O-N 3.41Å; L201-L204 HydrophobicContact CD1-CD2 4.43Å; L201-L204 PolarHBondContact O-N 3.26Å; L204-G208 CarbonylContact O-C 3.55Å; L204-G208 WeakPolarHBondContact O-CA 3.39Å; L204-G208 PolarHBondContact O-N 2.89Å; L204-L209 HydrophobicContact CD1-CD1 4.37Å; L204-L209 HydrophobicContact CD1-CG 4.24Å; L204-L209 HydrophobicContact CG-CD1 4.16Å; L204-L209 HydrophobicContact CG-CG 4.45Å; L204-L209 WeakPolarHBondContact O-CG 3.39Å; L204-L209 PolarHBondContact O-N 2.94Å; L204-L352 HydrophobicContact CD1-CB 4.11Å; L204-L352 HydrophobicContact CD1-CD2 4.17Å; L204-F355 HydrophobicContact CB-CB 4.19Å; L204-F355 HydrophobicContact CB-CD2 4.47Å; L204-F355 HydrophobicContact CD1-CB 4.22Å; L204-L356 HydrophobicContact CD2-CB 4.38Å; L204-F360 HydrophobicContact CD2-CE2 4.06Å
205	I	97.8	Very high	96.6	Very high	65 Å²	65	39.7 Å²	39.7	33%	0.333	20%	0.195	S	C	.	.	I	π-helix	trans	-78.6	-59.6	-176	-63.9	169.2	0	0	0	111.6	L201 C202 D203 L209 I210	L201-I205 HydrophobicContact CD1-CD1 4.08Å; L201-I205 HydrophobicContact CG-CD1 4.05Å; L201-I205 WeakPolarHBondContact O-CG1 3.47Å; L201-I205 PolarHBondContact O-N 3.34Å; C202-I205 PolarHBondContact O-N 3.08Å; D203-I205 VanDerWaalsContact C-N 3.28Å; D203-I205 PolarHBondContact O-N 3.33Å; I205-L209 PolarHBondContact O-N 2.91Å; I205-I210 HydrophobicContact CG2-CD1 4.08Å; I205-I210 HydrophobicContact CG2-CG1 4.49Å; I205-I210 WeakPolarHBondContact O-CG1 3.14Å; I205-I210 PolarHBondContact O-N 3.34Å
206	F	98	Very high	96.8	Very high	82 Å²	82	41.6 Å²	41.6	36%	0.36	21%	0.209	S	C	.	.	I	π-helix	trans	-82.2	-36.6	-165.9	-72	-75	0	0	0	113.3	Y126 Y130 P173 C202 I210 P211	Y126-F206 HydrophobicContact CE1-CB 3.64Å; Y130-F206 WeakPolarHBondContact CE2-O 3.5Å; Y130-F206 PolarHBondContact OH-O 3.48Å; P173-F206 HydrophobicContact CB-CB 3.99Å; P173-F206 HydrophobicContact CB-CD2 3.94Å; P173-F206 HydrophobicContact CB-CG 3.97Å; P173-F206 HydrophobicContact CG-CB 4.38Å; C202-F206 HydrophobicContact CB-CD2 4.46Å; C202-F206 WeakPolarHBondContact O-CB 3.16Å; C202-F206 PolarHBondContact O-N 3.47Å; F206-I210 HydrophobicContact CD1-CD1 3.97Å; F206-I210 HydrophobicContact CE1-CD1 4.34Å; F206-P211 VanDerWaalsContact O-CD 3.28Å; F206-P211 WeakPolarHBondContact O-CD 3.16Å
207	W	97.2	Very high	97	Very high	3 Å²	3	42.2 Å²	42.2	1%	0.011	22%	0.216	C	C	.	.	I	π-helix	trans	-89.8	-35.2	176.1	169.1	77.1	0	0	0	112.5	F125 Y126 D203 P211 Y344 V348 L351 L352 F355	F125-W207 HydrophobicContact CD1-CZ2 4.4Å; F125-W207 PolarHBondContact O-NE1 3.41Å; Y126-W207 HydrophobicContact CD1-CB 4.11Å; Y126-W207 HydrophobicContact CD2-CB 3.71Å; Y126-W207 AromaticContact CD2-CD1 3.9Å; Y126-W207 HydrophobicContact CD2-CG 4.03Å; Y126-W207 HydrophobicContact CE1-CB 3.83Å; Y126-W207 HydrophobicContact CE2-CB 3.47Å; Y126-W207 VanDerWaalsContact CE2-CB 3.47Å; Y126-W207 HydrophobicContact CE2-CG 4.08Å; Y126-W207 HydrophobicContact CG-CB 4.08Å; D203-W207 WeakPolarHBondContact O-CA 3.23Å; D203-W207 WeakPolarHBondContact O-CB 3.29Å; D203-W207 PolarHBondContact O-N 3.36Å; D203-W207 VanDerWaalsContact O-N 3.12Å; W207-P211 WeakPolarHBondContact O-CD 3.44Å; W207-P211 VanDerWaalsContact O-CG 3.25Å; W207-P211 WeakPolarHBondContact O-CG 3.34Å; W207-Y344 PolarHBondContact O-OH 2.69Å; W207-V348 HydrophobicContact CH2-CB 4.45Å; W207-V348 HydrophobicContact CH2-CG1 3.66Å; W207-V348 HydrophobicContact CH2-CG2 4.21Å; W207-V348 HydrophobicContact CZ2-CG1 4.12Å; W207-V348 HydrophobicContact CZ2-CG2 4.08Å; W207-V348 HydrophobicContact CZ3-CG1 4.02Å; W207-L351 HydrophobicContact CH2-CD2 3.69Å; W207-L351 HydrophobicContact CZ3-CD2 3.79Å; W207-L351 HydrophobicContact CZ3-CG 4.36Å; W207-L352 HydrophobicContact CE3-CD2 4.07Å; W207-L352 HydrophobicContact CZ3-CD2 3.78Å; W207-F355 HydrophobicContact CZ3-CE2 4.42Å
208	G	96.8	Very high	97.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	I	π-helix	trans	-89.4	-80.9	-177.1	0	0	0	0	0	114.9	D203 L204 I210 P211 V212	D203-G208 PolarHBondContact O-N 2.97Å; L204-G208 CarbonylContact O-C 3.55Å; L204-G208 WeakPolarHBondContact O-CA 3.39Å; L204-G208 PolarHBondContact O-N 2.89Å; G208-I210 PolarHBondContact O-N 3.47Å; G208-P211 WeakPolarHBondContact O-CD 3.34Å; G208-V212 WeakPolarHBondContact O-CB 3.49Å; G208-V212 VanDerWaalsContact O-CG2 3.25Å; G208-V212 WeakPolarHBondContact O-CG2 3.45Å; G208-V212 PolarHBondContact O-N 3.02Å
209	L	97.4	Very high	97.2	Very high	90 Å²	90	36.3 Å²	36.3	47%	0.471	19%	0.191	S	C	.	.	I	π-helix	trans	-62.6	-45.9	-165.9	-69.6	174.5	0	0	0	112.7	L204 I205 F213	L204-L209 HydrophobicContact CD1-CD1 4.37Å; L204-L209 HydrophobicContact CD1-CG 4.24Å; L204-L209 HydrophobicContact CG-CD1 4.16Å; L204-L209 HydrophobicContact CG-CG 4.45Å; L204-L209 WeakPolarHBondContact O-CG 3.39Å; L204-L209 PolarHBondContact O-N 2.94Å; I205-L209 PolarHBondContact O-N 2.91Å; L209-F213 WeakPolarHBondContact O-CB 3.24Å; L209-F213 PolarHBondContact O-N 3.28Å
210	I	97.9	Very high	97.3	Very high	68 Å²	68	38 Å²	38	35%	0.349	21%	0.21	S	C	.	.	H	α-helix	trans	-61.3	-54.9	-179.4	-69.9	171.6	0	0	0	110.6	I205 F206 G208 V212 F213 V214	I205-I210 HydrophobicContact CG2-CD1 4.08Å; I205-I210 HydrophobicContact CG2-CG1 4.49Å; I205-I210 WeakPolarHBondContact O-CG1 3.14Å; I205-I210 PolarHBondContact O-N 3.34Å; F206-I210 HydrophobicContact CD1-CD1 3.97Å; F206-I210 HydrophobicContact CE1-CD1 4.34Å; G208-I210 PolarHBondContact O-N 3.47Å; I210-V212 PolarHBondContact O-N 3.11Å; I210-F213 PolarHBondContact O-N 3.32Å; I210-V214 WeakPolarHBondContact O-CG2 3.44Å; I210-V214 PolarHBondContact O-N 3.46Å
211	P	97.9	Very high	97.4	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.2	-46.5	176.7	-33.3	41.7	0	0	0	114.5	A129 Y130 C133 F206 W207 G208 F213 V214 M215	A129-P211 HydrophobicContact CB-CB 4.15Å; A129-P211 HydrophobicContact CB-CG 4.13Å; Y130-P211 HydrophobicContact CD2-CG 4.18Å; Y130-P211 HydrophobicContact CE2-CG 3.8Å; C133-P211 WeakPolarHBondContact SG-CA 3.22Å; C133-P211 WeakPolarHBondContact SG-CB 3.34Å; F206-P211 VanDerWaalsContact O-CD 3.28Å; F206-P211 WeakPolarHBondContact O-CD 3.16Å; W207-P211 WeakPolarHBondContact O-CD 3.44Å; W207-P211 VanDerWaalsContact O-CG 3.25Å; W207-P211 WeakPolarHBondContact O-CG 3.34Å; G208-P211 WeakPolarHBondContact O-CD 3.34Å; P211-F213 VanDerWaalsContact C-N 3.33Å; P211-F213 PolarHBondContact O-N 3.07Å; P211-V214 PolarHBondContact O-N 3.09Å; P211-M215 HydrophobicContact CB-CE 3.8Å; P211-M215 WeakPolarHBondContact O-CB 3.3Å; P211-M215 VanDerWaalsContact O-CE 3.31Å; P211-M215 WeakPolarHBondContact O-CE 3.44Å; P211-M215 WeakPolarHBondContact O-CG 3.44Å; P211-M215 PolarHBondContact O-N 3.22Å
212	V	97.5	Very high	97.3	Very high	31 Å²	31	38.4 Å²	38.4	19%	0.188	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-43.5	179.5	169.8	0	0	0	0	111	G208 I210 M215 T216 Y344 M345 L352	G208-V212 WeakPolarHBondContact O-CB 3.49Å; G208-V212 VanDerWaalsContact O-CG2 3.25Å; G208-V212 WeakPolarHBondContact O-CG2 3.45Å; G208-V212 PolarHBondContact O-N 3.02Å; I210-V212 PolarHBondContact O-N 3.11Å; V212-M215 PolarHBondContact O-N 3.23Å; V212-T216 VanDerWaalsContact O-CB 3.24Å; V212-T216 WeakPolarHBondContact O-CB 3.23Å; V212-T216 PolarHBondContact O-N 2.84Å; V212-T216 PolarHBondContact O-OG1 2.84Å; V212-Y344 HydrophobicContact CG2-CE1 3.93Å; V212-M345 HydrophobicContact CG1-CG 4.31Å; V212-L352 HydrophobicContact CG2-CD1 4.01Å
213	F	98.1	Very high	97.2	Very high	144 Å²	144	39.6 Å²	39.6	63%	0.632	22%	0.219	S	C	*	.	H	α-helix	trans	-62.1	-47.5	177.7	179.6	-98.6	0	0	0	112.1	L209 I210 P211 T216 T217	L209-F213 WeakPolarHBondContact O-CB 3.24Å; L209-F213 PolarHBondContact O-N 3.28Å; I210-F213 PolarHBondContact O-N 3.32Å; P211-F213 VanDerWaalsContact C-N 3.33Å; P211-F213 PolarHBondContact O-N 3.07Å; F213-T216 PolarHBondContact O-N 3.46Å; F213-T217 HydrophobicContact CD1-CG2 4.45Å; F213-T217 HydrophobicContact CD2-CG2 4.43Å; F213-T217 HydrophobicContact CE1-CG2 4.11Å; F213-T217 HydrophobicContact CE2-CG2 4.08Å; F213-T217 HydrophobicContact CZ-CG2 3.92Å; F213-T217 WeakPolarHBondContact O-CB 3.47Å; F213-T217 VanDerWaalsContact O-CG2 3.31Å; F213-T217 WeakPolarHBondContact O-CG2 3.19Å; F213-T217 PolarHBondContact O-N 3.49Å; F213-T217 PolarHBondContact O-OG1 3.15Å
214	V	98.1	Very high	97.2	Very high	33 Å²	33	48.5 Å²	48.5	20%	0.2	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-45.5	178.6	170.9	0	0	0	0	111.3	C133 I137 I210 P211 T217 C218	C133-V214 HydrophobicContact CB-CG1 4.08Å; I137-V214 HydrophobicContact CD1-CG1 3.75Å; I137-V214 HydrophobicContact CG1-CG1 3.79Å; I210-V214 WeakPolarHBondContact O-CG2 3.44Å; I210-V214 PolarHBondContact O-N 3.46Å; P211-V214 PolarHBondContact O-N 3.09Å; V214-T217 PolarHBondContact O-OG1 3.44Å; V214-C218 WeakPolarHBondContact O-CB 3.35Å; V214-C218 PolarHBondContact O-N 2.9Å; V214-C218 PolarHBondContact O-SG 2.96Å
215	M	97.2	Very high	96.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-42	178.2	-76.6	-175.7	-81.6	0	0	112.1	Q132 P211 V212 C218 T219 Y344	Q132-M215 HydrophobicContact CB-SD 4.15Å; Q132-M215 HydrophobicContact CG-SD 3.63Å; P211-M215 HydrophobicContact CB-CE 3.8Å; P211-M215 WeakPolarHBondContact O-CB 3.3Å; P211-M215 VanDerWaalsContact O-CE 3.31Å; P211-M215 WeakPolarHBondContact O-CE 3.44Å; P211-M215 WeakPolarHBondContact O-CG 3.44Å; P211-M215 PolarHBondContact O-N 3.22Å; V212-M215 PolarHBondContact O-N 3.23Å; M215-C218 PolarHBondContact O-N 3.29Å; M215-T219 WeakPolarHBondContact O-CB 3.36Å; M215-T219 PolarHBondContact O-N 2.91Å; M215-T219 PolarHBondContact O-OG1 3.43Å; M215-Y344 HydrophobicContact CE-CD1 3.25Å; M215-Y344 HydrophobicContact CE-CD2 4.49Å; M215-Y344 HydrophobicContact CE-CE1 3.15Å; M215-Y344 HydrophobicContact CE-CE2 4.4Å; M215-Y344 HydrophobicContact CE-CG 3.97Å; M215-Y344 HydrophobicContact SD-CD1 4.05Å; M215-Y344 HydrophobicContact SD-CE1 4.47Å; M215-Y344 HydrophobicContact SD-CG 4.34Å
216	T	97.6	Very high	96.5	Very high	68 Å²	68	49.5 Å²	49.5	42%	0.417	26%	0.258	S	S	.	.	H	α-helix	trans	-62.1	-48.4	178.6	-58.5	0	0	0	0	111	V212 F213 T219 G220 M345	V212-T216 VanDerWaalsContact O-CB 3.24Å; V212-T216 WeakPolarHBondContact O-CB 3.23Å; V212-T216 PolarHBondContact O-N 2.84Å; V212-T216 PolarHBondContact O-OG1 2.84Å; F213-T216 PolarHBondContact O-N 3.46Å; T216-T219 PolarHBondContact O-N 3.31Å; T216-G220 PolarHBondContact O-N 3.25Å; T216-M345 PolarHBondContact OG1-SD 3.42Å
217	T	98.1	Very high	96.2	Very high	56 Å²	56	50.8 Å²	50.8	34%	0.344	27%	0.268	S	S	.	.	H	α-helix	trans	-63.2	-46.5	179.3	51.4	0	0	0	0	111.5	F213 V214 T219 G220 I221	F213-T217 HydrophobicContact CD1-CG2 4.45Å; F213-T217 HydrophobicContact CD2-CG2 4.43Å; F213-T217 HydrophobicContact CE1-CG2 4.11Å; F213-T217 HydrophobicContact CE2-CG2 4.08Å; F213-T217 HydrophobicContact CZ-CG2 3.92Å; F213-T217 WeakPolarHBondContact O-CB 3.47Å; F213-T217 VanDerWaalsContact O-CG2 3.31Å; F213-T217 WeakPolarHBondContact O-CG2 3.19Å; F213-T217 PolarHBondContact O-N 3.49Å; F213-T217 PolarHBondContact O-OG1 3.15Å; V214-T217 PolarHBondContact O-OG1 3.44Å; T217-T219 PolarHBondContact O-N 3.22Å; T217-G220 PolarHBondContact O-N 3.17Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.47Å; T217-I221 PolarHBondContact O-N 3.46Å
218	C	97.5	Very high	96	Very high	10 Å²	10	53.4 Å²	53.4	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-46.3	175.3	-70.5	0	0	0	0	112	C140 V214 M215 G220 I221 I222	C140-C218 HydrophobicContact CB-CB 4.07Å; V214-C218 WeakPolarHBondContact O-CB 3.35Å; V214-C218 PolarHBondContact O-N 2.9Å; V214-C218 PolarHBondContact O-SG 2.96Å; M215-C218 PolarHBondContact O-N 3.29Å; C218-G220 PolarHBondContact O-N 2.81Å; C218-I221 PolarHBondContact O-N 2.97Å; C218-I222 WeakPolarHBondContact O-CB 3.32Å; C218-I222 WeakPolarHBondContact O-CD1 3.43Å; C218-I222 WeakPolarHBondContact O-CG1 3.23Å; C218-I222 PolarHBondContact O-N 3.41Å
219	T	96.4	Very high	95.5	Very high	20 Å²	20	58.6 Å²	58.6	12%	0.123	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-46	178.4	-60.5	0	0	0	0	110.7	M215 T216 T217 I221 I222 C223 L338 N341	M215-T219 WeakPolarHBondContact O-CB 3.36Å; M215-T219 PolarHBondContact O-N 2.91Å; M215-T219 PolarHBondContact O-OG1 3.43Å; T216-T219 PolarHBondContact O-N 3.31Å; T217-T219 PolarHBondContact O-N 3.22Å; T219-I221 PolarHBondContact O-N 3.41Å; T219-I222 PolarHBondContact O-N 3.49Å; T219-C223 WeakPolarHBondContact O-CB 3.38Å; T219-C223 PolarHBondContact O-N 3Å; T219-C223 PolarHBondContact O-SG 3.26Å; T219-L338 HydrophobicContact CG2-CD2 3.43Å; T219-L338 VanDerWaalsContact CG2-CD2 3.43Å; T219-N341 PolarHBondContact OG1-ND2 3.4Å
220	G	97.1	Very high	94.9	Very high	40 Å²	40	59 Å²	59	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-45.1	177	0	0	0	0	0	113	T216 T217 C218 C223 R224	T216-G220 PolarHBondContact O-N 3.25Å; T217-G220 PolarHBondContact O-N 3.17Å; C218-G220 PolarHBondContact O-N 2.81Å; G220-C223 PolarHBondContact O-N 2.84Å; G220-R224 WeakPolarHBondContact O-CB 3.37Å; G220-R224 PolarHBondContact O-N 3.16Å
221	I	97.2	Very high	94.5	Very high	67 Å²	67	62.9 Å²	62.9	34%	0.344	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-45.6	177.2	-66.7	165.3	0	0	0	111.1	L144 T217 C218 T219 R224 N225	L144-I221 HydrophobicContact CD1-CG2 4.06Å; L144-I221 HydrophobicContact CD2-CG2 3.86Å; L144-I221 HydrophobicContact CG-CG2 4.05Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.47Å; T217-I221 PolarHBondContact O-N 3.46Å; C218-I221 PolarHBondContact O-N 2.97Å; T219-I221 PolarHBondContact O-N 3.41Å; I221-R224 PolarHBondContact O-N 3.1Å; I221-N225 WeakPolarHBondContact O-CB 3.43Å; I221-N225 PolarHBondContact O-N 3.03Å; I221-N225 PolarHBondContact O-ND2 2.87Å
222	I	94.8	Very high	93.7	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-50.8	177.7	-71.4	167.8	0	0	0	110.2	R139 C140 V143 C218 T219 R224 N225 L226 T334 L337 L338	R139-I222 HydrophobicContact CB-CD1 4.22Å; C140-I222 HydrophobicContact CB-CD1 4.29Å; C140-I222 HydrophobicContact CB-CG1 4.28Å; V143-I222 HydrophobicContact CG2-CG1 4.33Å; C218-I222 WeakPolarHBondContact O-CB 3.32Å; C218-I222 WeakPolarHBondContact O-CD1 3.43Å; C218-I222 WeakPolarHBondContact O-CG1 3.23Å; C218-I222 PolarHBondContact O-N 3.41Å; T219-I222 PolarHBondContact O-N 3.49Å; I222-R224 PolarHBondContact O-N 3.29Å; I222-N225 PolarHBondContact O-N 2.72Å; I222-L226 HydrophobicContact CG2-CD1 4.01Å; I222-L226 HydrophobicContact CG2-CG 4.38Å; I222-L226 WeakPolarHBondContact O-CG 3.41Å; I222-L226 PolarHBondContact O-N 3.46Å; I222-T334 HydrophobicContact CG2-CG2 3.23Å; I222-L337 HydrophobicContact CD1-CD2 4.29Å; I222-L338 HydrophobicContact CB-CD2 4.37Å; I222-L338 HydrophobicContact CG2-CD1 4.44Å; I222-L338 HydrophobicContact CG2-CD2 4.01Å; I222-L338 HydrophobicContact CG2-CG 4.46Å
223	C	94.6	Very high	93	Very high	45 Å²	45	70 Å²	70	30%	0.304	36%	0.359	S	S	.	.	H	α-helix	trans	-57.6	-46.9	178.1	-75.9	0	0	0	0	111.8	T219 G220 N225 L226 L227	T219-C223 WeakPolarHBondContact O-CB 3.38Å; T219-C223 PolarHBondContact O-N 3Å; T219-C223 PolarHBondContact O-SG 3.26Å; G220-C223 PolarHBondContact O-N 2.84Å; C223-N225 VanDerWaalsContact C-N 3.33Å; C223-N225 PolarHBondContact O-N 2.83Å; C223-L226 PolarHBondContact O-N 2.85Å; C223-L227 WeakPolarHBondContact O-CB 3.46Å; C223-L227 VanDerWaalsContact O-CG 3.27Å; C223-L227 WeakPolarHBondContact O-CG 3.42Å; C223-L227 PolarHBondContact O-N 3.3Å
224	R	95.8	Very high	92.3	Very high	192 Å²	192	70.2 Å²	70.2	73%	0.725	36%	0.36	S	S	*	.	H	α-helix	trans	-59.4	-42.3	177.8	-176.8	178.5	176.3	178.9	-0.7	112.2	G220 I221 I222 T228	G220-R224 WeakPolarHBondContact O-CB 3.37Å; G220-R224 PolarHBondContact O-N 3.16Å; I221-R224 PolarHBondContact O-N 3.1Å; I222-R224 PolarHBondContact O-N 3.29Å; R224-T228 WeakPolarHBondContact O-CB 3.39Å; R224-T228 PolarHBondContact O-N 3.49Å; R224-T228 PolarHBondContact O-OG1 3.47Å
225	N	92.6	Very high	91.7	Very high	41 Å²	41	75.6 Å²	75.6	22%	0.219	38%	0.38	C	S	.	.	H	α-helix	trans	-68.8	-41.4	178	-85.7	-37.8	0	0	0	112.6	V143 L144 I221 I222 C223 T228 R229	V143-N225 HydrophobicContact CG1-CB 3.51Å; L144-N225 WeakPolarHBondContact CD2-ND2 3.26Å; I221-N225 WeakPolarHBondContact O-CB 3.43Å; I221-N225 PolarHBondContact O-N 3.03Å; I221-N225 PolarHBondContact O-ND2 2.87Å; I222-N225 PolarHBondContact O-N 2.72Å; C223-N225 VanDerWaalsContact C-N 3.33Å; C223-N225 PolarHBondContact O-N 2.83Å; N225-T228 PolarHBondContact O-N 2.95Å; N225-R229 WeakPolarHBondContact O-CG 3.48Å; N225-R229 PolarHBondContact O-N 2.83Å
226	L	89.8	Confident	91	Very high	50 Å²	50	79.2 Å²	79.2	26%	0.262	40%	0.403	S	S	.	.	H	α-helix	trans	-62.4	-44.5	175.3	-70.8	177.5	0	0	0	111.6	I222 C223 T228 R229 N230 T334 L338	I222-L226 HydrophobicContact CG2-CD1 4.01Å; I222-L226 HydrophobicContact CG2-CG 4.38Å; I222-L226 WeakPolarHBondContact O-CG 3.41Å; I222-L226 PolarHBondContact O-N 3.46Å; C223-L226 PolarHBondContact O-N 2.85Å; L226-T228 VanDerWaalsContact C-N 3.34Å; L226-T228 PolarHBondContact O-N 3.09Å; L226-R229 PolarHBondContact O-N 3.23Å; L226-N230 WeakPolarHBondContact O-CB 3.34Å; L226-N230 VanDerWaalsContact O-CG 3.27Å; L226-N230 PolarHBondContact O-N 3.23Å; L226-N230 PolarHBondContact O-ND2 3.49Å; L226-T334 HydrophobicContact CD1-CG2 3.8Å; L226-L338 HydrophobicContact CD1-CD1 4.21Å
227	L	91.2	Very high	90.1	Very high	109 Å²	109	81.3 Å²	81.3	57%	0.571	41%	0.41	S	S	*	.	H	α-helix	trans	-61.5	-43.3	176.4	-71.6	173	0	0	0	111.7	C223 N230 K231	C223-L227 WeakPolarHBondContact O-CB 3.46Å; C223-L227 VanDerWaalsContact O-CG 3.27Å; C223-L227 WeakPolarHBondContact O-CG 3.42Å; C223-L227 PolarHBondContact O-N 3.3Å; L227-N230 PolarHBondContact O-N 2.74Å; L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 2.85Å
228	T	91.8	Very high	89.4	Confident	57 Å²	57	85 Å²	85	35%	0.35	42%	0.423	S	S	.	.	H	α-helix	trans	-61.7	-47.4	177	-59	0	0	0	0	111.3	R224 N225 L226 N230 K231 F232	R224-T228 WeakPolarHBondContact O-CB 3.39Å; R224-T228 PolarHBondContact O-N 3.49Å; R224-T228 PolarHBondContact O-OG1 3.47Å; N225-T228 PolarHBondContact O-N 2.95Å; L226-T228 VanDerWaalsContact C-N 3.34Å; L226-T228 PolarHBondContact O-N 3.09Å; T228-N230 PolarHBondContact O-N 2.99Å; T228-K231 WeakPolarHBondContact O-CB 3.47Å; T228-K231 PolarHBondContact O-N 3.37Å; T228-F232 HydrophobicContact CG2-CD2 3.91Å; T228-F232 HydrophobicContact CG2-CE2 3.53Å; T228-F232 WeakPolarHBondContact O-CD2 3.14Å; T228-F232 PolarHBondContact O-N 3.02Å; T228-F232 VanDerWaalsContact O-N 3.14Å
229	R	86.5	Confident	88.6	Confident	110 Å²	110	87 Å²	87	42%	0.415	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-41.5	176.8	-74.8	-177.1	177	162.4	9.1	112.7	V143 N225 L226 K231 F232 A233	V143-R229 PolarHBondContact O-NH2 2.89Å; N225-R229 WeakPolarHBondContact O-CG 3.48Å; N225-R229 PolarHBondContact O-N 2.83Å; L226-R229 PolarHBondContact O-N 3.23Å; R229-K231 VanDerWaalsContact C-N 3.31Å; R229-K231 PolarHBondContact O-N 2.97Å; R229-F232 PolarHBondContact O-N 3.44Å; R229-A233 WeakPolarHBondContact O-CB 3.37Å; R229-A233 PolarHBondContact O-N 3.14Å
230	N	85.6	Confident	87.6	Confident	97 Å²	97	90.3 Å²	90.3	52%	0.519	46%	0.455	S	S	.	.	H	α-helix	trans	-63.9	-36.7	177.1	-74.7	-15.1	0	0	0	112.2	L226 L227 T228 K234	L226-N230 WeakPolarHBondContact O-CB 3.34Å; L226-N230 VanDerWaalsContact O-CG 3.27Å; L226-N230 PolarHBondContact O-N 3.23Å; L226-N230 PolarHBondContact O-ND2 3.49Å; L227-N230 PolarHBondContact O-N 2.74Å; T228-N230 PolarHBondContact O-N 2.99Å; N230-K234 WeakPolarHBondContact O-CB 3.28Å; N230-K234 WeakPolarHBondContact O-CG 3.15Å; N230-K234 PolarHBondContact O-N 3.24Å
231	K	89	Confident	86.7	Confident	150 Å²	150	92.2 Å²	92.2	65%	0.652	46%	0.458	S	S	*	.	H	α-helix	trans	-63	-42.6	173.5	-73.9	177.8	-179.9	-176.1	0	111.6	L227 T228 R229 K235	L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 2.85Å; T228-K231 WeakPolarHBondContact O-CB 3.47Å; T228-K231 PolarHBondContact O-N 3.37Å; R229-K231 VanDerWaalsContact C-N 3.31Å; R229-K231 PolarHBondContact O-N 2.97Å; K231-K235 WeakPolarHBondContact O-CG 3.18Å; K231-K235 PolarHBondContact O-N 3.29Å
232	F	82.4	Confident	85.8	Confident	132 Å²	132	96.2 Å²	96.2	58%	0.579	47%	0.473	S	S	*	.	H	α-helix	trans	-67.6	-45.7	176.7	-75.1	-68	0	0	0	112.5	T228 R229 K234 K235 T236	T228-F232 HydrophobicContact CG2-CD2 3.91Å; T228-F232 HydrophobicContact CG2-CE2 3.53Å; T228-F232 WeakPolarHBondContact O-CD2 3.14Å; T228-F232 PolarHBondContact O-N 3.02Å; T228-F232 VanDerWaalsContact O-N 3.14Å; R229-F232 PolarHBondContact O-N 3.44Å; F232-K234 VanDerWaalsContact C-N 3.34Å; F232-K234 PolarHBondContact O-N 3.21Å; F232-K235 PolarHBondContact O-N 2.82Å; F232-K235 VanDerWaalsContact O-N 3.13Å; F232-T236 PolarHBondContact O-N 3.44Å; F232-T236 PolarHBondContact O-OG1 3.2Å
233	A	82.7	Confident	85	Confident	49 Å²	49	101.3 Å²	101.3	41%	0.405	50%	0.499	S	S	.	.	H	α-helix	trans	-59.8	-42.7	179	0	0	0	0	0	112.3	R229 K235 T236 I237	R229-A233 WeakPolarHBondContact O-CB 3.37Å; R229-A233 PolarHBondContact O-N 3.14Å; A233-K235 PolarHBondContact O-N 3.05Å; A233-T236 PolarHBondContact O-N 3.47Å; A233-I237 WeakPolarHBondContact O-CG1 3.42Å; A233-I237 PolarHBondContact O-N 3.14Å
234	K	83.2	Confident	83.9	Confident	149 Å²	149	104.5 Å²	104.5	65%	0.648	51%	0.513	S	S	*	.	H	α-helix	trans	-62.4	-40.4	175.4	-75.2	-175.1	179	-172.5	0	112.3	N230 F232 I237 Q238	N230-K234 WeakPolarHBondContact O-CB 3.28Å; N230-K234 WeakPolarHBondContact O-CG 3.15Å; N230-K234 PolarHBondContact O-N 3.24Å; F232-K234 VanDerWaalsContact C-N 3.34Å; F232-K234 PolarHBondContact O-N 3.21Å; K234-I237 PolarHBondContact O-N 2.94Å; K234-Q238 WeakPolarHBondContact O-CG 3.08Å; K234-Q238 PolarHBondContact O-N 2.9Å
235	K	85.5	Confident	82.8	Confident	145 Å²	145	101.6 Å²	101.6	63%	0.63	51%	0.508	S	S	*	.	H	α-helix	trans	-64.3	-42.9	176.6	-74.9	-178.7	177.7	-171.4	0	112.1	K231 F232 A233 Q238 S239	K231-K235 WeakPolarHBondContact O-CG 3.18Å; K231-K235 PolarHBondContact O-N 3.29Å; F232-K235 PolarHBondContact O-N 2.82Å; F232-K235 VanDerWaalsContact O-N 3.13Å; A233-K235 PolarHBondContact O-N 3.05Å; K235-Q238 PolarHBondContact O-N 3.42Å; K235-S239 PolarHBondContact O-N 3.28Å; K235-S239 PolarHBondContact O-OG 2.63Å
236	T	81.2	Confident	81.6	Confident	77 Å²	77	106.2 Å²	106.2	47%	0.472	53%	0.528	S	S	.	.	H	α-helix	trans	-65.9	-38.6	177.9	-52.9	0	0	0	0	112.5	F232 A233 S239 N240	F232-T236 PolarHBondContact O-N 3.44Å; F232-T236 PolarHBondContact O-OG1 3.2Å; A233-T236 PolarHBondContact O-N 3.47Å; T236-S239 WeakPolarHBondContact CA-OG 3.43Å; T236-S239 PolarHBondContact O-N 2.95Å; T236-S239 PolarHBondContact O-OG 3.17Å; T236-N240 PolarHBondContact O-N 3.49Å; T236-N240 VanDerWaalsContact O-N 3.16Å
237	I	80	Confident	80.3	Confident	112 Å²	112	106.6 Å²	106.6	57%	0.574	53%	0.534	S	S	*	.	H	α-helix	trans	-65.2	-43.7	175.1	-66.5	166.8	0	0	0	110	A233 K234 S239 N240 V241	A233-I237 WeakPolarHBondContact O-CG1 3.42Å; A233-I237 PolarHBondContact O-N 3.14Å; K234-I237 PolarHBondContact O-N 2.94Å; I237-S239 PolarHBondContact O-N 3.45Å; I237-N240 PolarHBondContact O-N 3.34Å; I237-V241 WeakPolarHBondContact O-CG2 3.33Å; I237-V241 PolarHBondContact O-N 2.73Å; I237-V241 VanDerWaalsContact O-N 3.13Å
238	Q	82.6	Confident	78.9	Confident	132 Å²	132	105.7 Å²	105.7	62%	0.617	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-36.7	177.9	-75.6	-179.2	-10.6	0	0	113.3	K234 K235 K242	K234-Q238 WeakPolarHBondContact O-CG 3.08Å; K234-Q238 PolarHBondContact O-N 2.9Å; K235-Q238 PolarHBondContact O-N 3.42Å; Q238-K242 PolarHBondContact O-N 2.98Å
239	S	81.5	Confident	77.4	Confident	53 Å²	53	112.6 Å²	112.6	37%	0.371	56%	0.558	S	S	.	*	H	α-helix	trans	-67.4	-40.8	176.7	60.4	0	0	0	0	112.1	K235 T236 I237 K242 I243	K235-S239 PolarHBondContact O-N 3.28Å; K235-S239 PolarHBondContact O-OG 2.63Å; T236-S239 WeakPolarHBondContact CA-OG 3.43Å; T236-S239 PolarHBondContact O-N 2.95Å; T236-S239 PolarHBondContact O-OG 3.17Å; I237-S239 PolarHBondContact O-N 3.45Å; S239-K242 PolarHBondContact O-N 3.33Å; S239-I243 WeakPolarHBondContact O-CG1 3.13Å; S239-I243 PolarHBondContact O-N 3.3Å; S239-I243 VanDerWaalsContact O-N 3.15Å
240	N	74	Confident	76.2	Confident	90 Å²	90	116.1 Å²	116.1	48%	0.481	57%	0.573	S	S	.	*	H	α-helix	trans	-68.9	-35.3	179.9	-70.6	-5.3	0	0	0	112.4	T236 I237 K242 I243 N244	T236-N240 PolarHBondContact O-N 3.49Å; T236-N240 VanDerWaalsContact O-N 3.16Å; I237-N240 PolarHBondContact O-N 3.34Å; N240-K242 VanDerWaalsContact C-N 3.34Å; N240-I243 PolarHBondContact O-N 3.45Å; N240-N244 PolarHBondContact O-N 3.41Å
241	V	79	Confident	75	Confident	80 Å²	80	121.9 Å²	121.9	49%	0.485	59%	0.589	S	S	.	*	H	α-helix	trans	-64.8	-38.6	174.9	173.1	0	0	0	0	111.3	I237 Q245	I237-V241 WeakPolarHBondContact O-CG2 3.33Å; I237-V241 PolarHBondContact O-N 2.73Å; I237-V241 VanDerWaalsContact O-N 3.13Å; V241-Q245 PolarHBondContact O-N 2.75Å
242	K	78.4	Confident	73.6	Confident	151 Å²	151	120.3 Å²	120.3	66%	0.657	60%	0.597	S	S	*	*	H	α-helix	trans	-67.5	-37.8	176.5	-73	-176	177.5	-171.9	0	113	Q238 S239 N240 Q245 H246	Q238-K242 PolarHBondContact O-N 2.98Å; S239-K242 PolarHBondContact O-N 3.33Å; N240-K242 VanDerWaalsContact C-N 3.34Å; K242-Q245 PolarHBondContact O-N 3.01Å; K242-H246 PolarHBondContact O-N 3.39Å
243	I	78	Confident	72.2	Confident	107 Å²	107	118.8 Å²	118.8	55%	0.549	60%	0.603	S	S	.	*	H	α-helix	trans	-65.4	-42.4	178.3	-67.1	166.5	0	0	0	110.7	S239 N240 Q245 H246 S247	S239-I243 WeakPolarHBondContact O-CG1 3.13Å; S239-I243 PolarHBondContact O-N 3.3Å; S239-I243 VanDerWaalsContact O-N 3.15Å; N240-I243 PolarHBondContact O-N 3.45Å; I243-Q245 VanDerWaalsContact C-N 3.32Å; I243-Q245 PolarHBondContact O-N 2.96Å; I243-H246 PolarHBondContact O-N 2.93Å; I243-S247 PolarHBondContact O-N 2.9Å; I243-S247 VanDerWaalsContact O-N 3.12Å; I243-S247 PolarHBondContact O-OG 3.3Å
244	N	71	Confident	71	Confident	111 Å²	111	125.1 Å²	125.1	59%	0.594	62%	0.623	S	S	*	*	H	α-helix	trans	-68.4	-28.4	179.8	-72.7	-7.9	0	0	0	113.5	N240 S247	N240-N244 PolarHBondContact O-N 3.41Å; N244-S247 WeakPolarHBondContact CA-OG 3.38Å; N244-S247 PolarHBondContact O-OG 3.15Å; N244-S247 VanDerWaalsContact O-OG 3.1Å
245	Q	73	Confident	69.7	Low	132 Å²	132	122.8 Å²	122.8	62%	0.617	62%	0.624	S	S	*	*	H	α-helix	trans	-71.7	-33.4	173.6	-76.5	-178.7	-21.4	0	0	112.3	V241 K242 I243	V241-Q245 PolarHBondContact O-N 2.75Å; K242-Q245 PolarHBondContact O-N 3.01Å; I243-Q245 VanDerWaalsContact C-N 3.32Å; I243-Q245 PolarHBondContact O-N 2.96Å
246	H	67.3	Low	68.2	Low	137 Å²	137	122.3 Å²	122.3	63%	0.634	63%	0.633	S	S	*	*	H	α-helix	trans	-78	-28.7	178.4	-124.7	-72.6	0	0	0	112.9	K242 I243	K242-H246 PolarHBondContact O-N 3.39Å; I243-H246 PolarHBondContact O-N 2.93Å
247	S	62.7	Low	67.2	Low	58 Å²	58	128 Å²	128	41%	0.406	65%	0.652	S	S	.	*	H	α-helix	trans	-75.6	-23.1	179.2	57.4	0	0	0	0	114.2	I243 N244 Y249	I243-S247 PolarHBondContact O-N 2.9Å; I243-S247 VanDerWaalsContact O-N 3.12Å; I243-S247 PolarHBondContact O-OG 3.3Å; N244-S247 WeakPolarHBondContact CA-OG 3.38Å; N244-S247 PolarHBondContact O-OG 3.15Å; N244-S247 VanDerWaalsContact O-OG 3.1Å; S247-Y249 VanDerWaalsContact C-N 3.29Å; S247-Y249 PolarHBondContact O-N 3.14Å
248	S	60.7	Low	66	Low	90 Å²	90	126.5 Å²	126.5	63%	0.629	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-12.3	-180	86.1	0	0	0	0	113.9
249	Y	61.2	Low	65.1	Low	202 Å²	202	128.7 Å²	128.7	79%	0.792	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-13.3	178.6	-94.6	-85.2	0	0	0	114.3	S247	S247-Y249 VanDerWaalsContact C-N 3.29Å; S247-Y249 PolarHBondContact O-N 3.14Å
250	Y	62.2	Low	64	Low	184 Å²	184	133.1 Å²	133.1	72%	0.722	68%	0.682	S	S	*	*	S	Bend	trans	-106.2	5.7	-175.2	-81.4	-81.6	0	0	0	115.5
251	Y	60.1	Low	63.3	Low	218 Å²	218	135.2 Å²	135.2	86%	0.855	69%	0.694	S	S	*	*			trans	-98	18.1	-177.1	-105.7	-79.8	0	0	0	115.9
252	S	58.3	Low	62.2	Low	118 Å²	118	139.6 Å²	139.6	83%	0.825	71%	0.713	S	S	*	*	S	Bend	trans	-108	16.9	-178.6	-169.6	0	0	0	0	115.7
253	S	54.7	Low	61.2	Low	99 Å²	99	138.7 Å²	138.7	69%	0.692	73%	0.725	S	S	*	*			trans	-139	86.8	174.1	47.1	0	0	0	0	112.2
254	H	56.7	Low	60	Low	182 Å²	182	142.9 Å²	142.9	84%	0.843	74%	0.739	S	S	*	*			trans	-59.2	130.7	153.4	-87.5	-70.3	0	0	0	108.6
255	P	54.8	Low	59.2	Low	100 Å²	100	142.6 Å²	142.6	65%	0.649	75%	0.745	S	S	*	*				-131.7	136	105.1	33	-21.4	0	0	0	111.3	K257	P255-K257 PolarHBondContact O-N 3.06Å
256	T	56	Low	58	Low	136 Å²	136	142.9 Å²	142.9	83%	0.834	75%	0.751	S	S	*	*			trans	-27.2	103.9	160.6	44.9	0	0	0	0	113.2
257	K	58.4	Low	57.4	Low	197 Å²	197	147.8 Å²	147.8	86%	0.857	77%	0.766	S	S	*	*			trans	-119.7	121.5	162.7	-91.1	-175.8	174.9	179.8	0	109.5	P255	P255-K257 PolarHBondContact O-N 3.06Å
258	S	56.3	Low	56.9	Low	80 Å²	80	151.5 Å²	151.5	56%	0.559	78%	0.78	S	S	*	*			trans	-21.6	126.7	168.3	170.4	0	0	0	0	115.2	N260	S258-N260 PolarHBondContact O-N 3.29Å; S258-N260 PolarHBondContact OG-N 3.05Å
259	M	61.8	Low	56.4	Low	178 Å²	178	154.7 Å²	154.7	88%	0.877	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	6.2	176.1	-102.9	-164	83.3	0	0	114.6
260	N	60.3	Low	55.7	Low	145 Å²	145	152.3 Å²	152.3	78%	0.775	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-1.1	-172.3	-77.7	-5	0	0	0	116.2	S258	S258-N260 PolarHBondContact O-N 3.29Å; S258-N260 PolarHBondContact OG-N 3.05Å
261	D	58	Low	55.2	Low	135 Å²	135	149.2 Å²	149.2	72%	0.722	79%	0.792	S	S	*	*	S	Bend	trans	-112.5	5.2	-175.2	-69.4	-39.5	0	0	0	115.7	C263	D261-C263 VanDerWaalsContact C-N 3.32Å; D261-C263 PolarHBondContact O-N 3.49Å
262	L	56.7	Low	54.5	Low	171 Å²	171	147.1 Å²	147.1	90%	0.895	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	17.2	-173.9	-110.8	128.6	0	0	0	115.6
263	C	58	Low	54.2	Low	132 Å²	132	149 Å²	149	89%	0.892	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	13.4	177	-139.7	0	0	0	0	114.5	D261	D261-C263 VanDerWaalsContact C-N 3.32Å; D261-C263 PolarHBondContact O-N 3.49Å
264	K	52.4	Low	53.8	Low	196 Å²	196	151.4 Å²	151.4	85%	0.852	79%	0.789	S	S	*	*			trans	-142.4	85.2	177.6	-96.6	178.8	170.9	177.2	0	111.1
265	S	52.8	Low	54	Low	104 Å²	104	149.9 Å²	149.9	73%	0.727	79%	0.785	S	S	*	*			trans	-158.4	94.8	157.4	-167	0	0	0	0	111.3
266	N	49.3	Very low	53.8	Low	138 Å²	138	152.8 Å²	152.8	74%	0.738	79%	0.79	S	S	*	*			trans	47.7	88.3	131.4	-56.5	-15.9	0	0	0	118.1
267	Y	53.4	Low	53.9	Low	240 Å²	240	151.7 Å²	151.7	94%	0.941	79%	0.788	S	S	*	*			trans	-87.1	93.2	138.9	-78.5	-86.4	0	0	0	107.6
268	L	53.4	Low	53.7	Low	136 Å²	136	150.7 Å²	150.7	71%	0.712	79%	0.786	S	S	*	*			trans	-84.6	110.7	156	-123.3	105	0	0	0	105.1
269	E	50	Low	53.2	Low	158 Å²	158	156.4 Å²	156.4	74%	0.738	80%	0.801	S	S	*	*				72.8	95.3	92.9	-151.8	171.8	-154.4	0	0	111.6
270	D	45.4	Very low	52.8	Low	152 Å²	152	157.8 Å²	157.8	81%	0.813	80%	0.802	S	S	*	*			trans	160.9	101.8	131.2	-87.8	-19.9	0	0	0	112.5
271	S	51.9	Low	52	Low	119 Å²	119	156.1 Å²	156.1	83%	0.832	80%	0.802	S	S	*	*				169.7	106.2	127.9	41.7	0	0	0	0	109.8	I273	S271-I273 PolarHBondContact O-N 3.46Å
272	E	45.1	Very low	51.7	Low	174 Å²	174	155.8 Å²	155.8	81%	0.813	81%	0.809	S	S	*	*			trans	-56.5	122.5	168.8	-71.6	172.8	121.5	0	0	111.6
273	I	53.8	Low	51.1	Low	156 Å²	156	157.3 Å²	157.3	80%	0.8	80%	0.802	S	S	*	*			trans	-132.3	96	144.2	-60.7	-177	0	0	0	107.2	S271 I275	S271-I273 PolarHBondContact O-N 3.46Å; I273-I275 HydrophobicContact CG2-CG1 4.46Å; I273-I275 PolarHBondContact O-N 2.99Å
274	H	45.3	Very low	50.8	Low	150 Å²	150	157 Å²	157	69%	0.694	80%	0.802	S	S	*	*			trans	-60.7	114.8	168	-111.4	-84.5	0	0	0	110.3
275	I	61.5	Low	50.5	Low	150 Å²	150	153.9 Å²	153.9	77%	0.769	79%	0.79	S	S	*	*			trans	-127.1	103	154.4	-63.7	-179.1	0	0	0	108.1	I273	I273-I275 HydrophobicContact CG2-CG1 4.46Å; I273-I275 PolarHBondContact O-N 2.99Å
276	H	49.8	Very low	50.2	Low	161 Å²	161	153.9 Å²	153.9	75%	0.745	79%	0.79	S	S	*	*			trans	-64.9	123.2	169	-122.3	-75.5	0	0	0	109.5
277	S	57.5	Low	50	Low	113 Å²	113	154 Å²	154	79%	0.79	79%	0.79	S	S	*	*			trans	-143.7	108.9	161.7	167.9	0	0	0	0	108.3
278	E	54.2	Low	49.6	Very low	176 Å²	176	149 Å²	149	82%	0.822	78%	0.778	S	S	*	*			trans	-60	146.4	-172.6	-72.5	175	124.6	0	0	115
279	K	46	Very low	49.2	Very low	200 Å²	200	146.8 Å²	146.8	87%	0.87	77%	0.774	S	S	*	*			trans	-54.1	130.3	162.7	-76.2	167.9	170.1	170.7	0	111.4
280	K	53.6	Low	49.1	Very low	207 Å²	207	145.6 Å²	145.6	90%	0.9	77%	0.773	S	S	*	*			trans	-128.1	108.2	141.7	-94.3	-176.5	179	175.8	0	110.2
281	S	44.7	Very low	49.3	Very low	110 Å²	110	146 Å²	146	77%	0.769	77%	0.77	S	S	*	*			trans	-65.2	127.8	163.6	176	0	0	0	0	109.3
282	C	50.8	Low	49.4	Very low	128 Å²	128	147.9 Å²	147.9	87%	0.865	77%	0.766	S	S	*	*			trans	-130.4	107.4	161.1	-95.3	0	0	0	0	108.5
283	R	44.8	Very low	49.7	Very low	203 Å²	203	145 Å²	145	77%	0.766	76%	0.756	S	S	*	*			trans	-80.9	118	168.3	-176.8	-178.8	177.2	163.9	-3	106.5	E285	R283-E285 HydrophobicContact CG-CG 4.41Å; R283-E285 IonicContact CZ-OE1 3.13Å; R283-E285 VanDerWaalsContact CZ-OE1 3.3Å; R283-E285 IonicContact NE-OE1 3.85Å; R283-E285 PolarHBondContact NE-OE1 3.48Å; R283-E285 IonicContact NH2-OE1 3.59Å; R283-E285 PolarHBondContact NH2-OE1 2.88Å
284	S	51.2	Low	49.8	Very low	125 Å²	125	144.3 Å²	144.3	87%	0.874	75%	0.752	S	S	*	*			trans	-112	106.6	163.4	-73.8	0	0	0	0	108.1
285	E	46.6	Very low	50.1	Low	131 Å²	131	141.8 Å²	141.8	61%	0.612	75%	0.749	S	S	*	*			trans	-77.1	167.2	167.1	-78.5	168.5	170.4	0	0	110.7	R283	R283-E285 HydrophobicContact CG-CG 4.41Å; R283-E285 IonicContact CZ-OE1 3.13Å; R283-E285 VanDerWaalsContact CZ-OE1 3.3Å; R283-E285 IonicContact NE-OE1 3.85Å; R283-E285 PolarHBondContact NE-OE1 3.48Å; R283-E285 IonicContact NH2-OE1 3.59Å; R283-E285 PolarHBondContact NH2-OE1 2.88Å
286	S	45.4	Very low	49.4	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	75%	0.748	S	S	*	*			trans	84	134.7	146.8	96	0	0	0	0	113.8
287	L	45.7	Very low	49.6	Very low	140 Å²	140	139.6 Å²	139.6	73%	0.733	75%	0.754	S	S	*	*			cis	-177.1	155.8	17.6	-104.7	152.9	0	0	0	108.2
288	I	44.6	Very low	49.3	Very low	136 Å²	136	141 Å²	141	70%	0.697	75%	0.753	S	S	*	*			trans	72.1	106.4	139.3	-66.6	167.7	0	0	0	116.6
289	S	45.6	Very low	49.4	Very low	90 Å²	90	137.3 Å²	137.3	63%	0.629	75%	0.747	S	S	*	*				102.6	146.5	56	81.3	0	0	0	0	113
290	N	46.9	Very low	50	Low	132 Å²	132	136.5 Å²	136.5	71%	0.706	75%	0.746	S	S	*	*			trans	116	96.9	160.7	-58.5	-0.5	0	0	0	112.5
291	Q	51	Low	50.1	Low	160 Å²	160	133 Å²	133	75%	0.748	74%	0.742	S	S	*	*				73.4	116.5	73.7	-165.9	173.5	19.8	0	0	108.8
292	E	52.7	Low	50.6	Low	160 Å²	160	135 Å²	135	75%	0.748	75%	0.749	S	S	*	*				-175.4	120.9	80.7	-143.4	161.2	-177	0	0	109.2
293	N	52.7	Low	50.8	Low	113 Å²	113	139.6 Å²	139.6	60%	0.604	75%	0.748	S	S	*	*				78.3	118.6	108.8	-70.3	-9.7	0	0	0	116.7
294	I	55.8	Low	51.3	Low	141 Å²	141	133.3 Å²	133.3	72%	0.723	74%	0.736	S	S	*	*				122.6	146.8	74.6	-88.9	172.9	0	0	0	107.8
295	P	50.4	Low	51.7	Low	98 Å²	98	136.5 Å²	136.5	64%	0.636	74%	0.739	S	S	*	*			cis	-141.5	167.4	-42.1	45.5	-25.7	0	0	0	114.7
296	T	47.1	Very low	52.4	Low	121 Å²	121	137.1 Å²	137.1	74%	0.742	75%	0.746	S	S	*	*			trans	13.7	128.4	148.2	58	0	0	0	0	122.6
297	T	53.3	Low	53	Low	143 Å²	143	137.6 Å²	137.6	88%	0.877	74%	0.741	S	S	*	*			trans	-146.1	136.4	131.4	-34.2	0	0	0	0	111.3
298	N	52.8	Low	53.4	Low	142 Å²	142	139.5 Å²	139.5	76%	0.759	74%	0.744	S	S	*	*			trans	-63.8	147.2	-172	-62	-38.8	0	0	0	114.2
299	S	56.6	Low	53.9	Low	100 Å²	100	143.5 Å²	143.5	70%	0.699	75%	0.75	S	S	*	*				160	128.3	110.2	50	0	0	0	0	112.9
300	H	57.7	Low	54.4	Low	182 Å²	182	142.1 Å²	142.1	84%	0.843	74%	0.744	S	S	*	*			trans	33.6	102.6	144.3	-65.6	-79.4	0	0	0	119.3
301	T	56.3	Low	54.9	Low	134 Å²	134	139.8 Å²	139.8	82%	0.822	73%	0.734	S	S	*	*			trans	-156.4	103.1	131.7	-7.2	0	0	0	0	111.1	R303	T301-R303 PolarHBondContact O-N 3.16Å
302	V	55.1	Low	55.1	Low	151 Å²	151	136.3 Å²	136.3	92%	0.915	72%	0.724	S	S	*	*			trans	-68.3	102.4	162.4	173.4	0	0	0	0	106.8
303	R	55.1	Low	55.3	Low	225 Å²	225	132.7 Å²	132.7	85%	0.849	71%	0.713	S	S	*	*			trans	-152.6	115.9	169.3	-149.5	170.9	-173.8	166.6	1.4	111.6	T301	T301-R303 PolarHBondContact O-N 3.16Å
304	S	55.4	Low	55.4	Low	72 Å²	72	131.2 Å²	131.2	50%	0.503	71%	0.709	S	S	.	*			trans	67.1	95.1	154.9	-167.8	0	0	0	0	118.6	N306 D307	S304-N306 PolarHBondContact O-N 3.03Å; S304-D307 PolarHBondContact OG-OD2 3.45Å
305	M	59.3	Low	55.6	Low	191 Å²	191	128.4 Å²	128.4	94%	0.941	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	15.8	163.2	-93.9	-177.1	82.5	0	0	113.9
306	N	61	Low	56.1	Low	144 Å²	144	127.3 Å²	127.3	77%	0.77	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-2.2	-178.9	-79.5	-11.5	0	0	0	115.4	S304	S304-N306 PolarHBondContact O-N 3.03Å
307	D	58.6	Low	56.8	Low	114 Å²	114	125.8 Å²	125.8	61%	0.61	68%	0.68	S	S	*	*	S	Bend	trans	-91.8	-5.4	-179	-77.4	-46.8	0	0	0	115.2	S304 R309 T311	S304-D307 PolarHBondContact OG-OD2 3.45Å; D307-R309 VanDerWaalsContact C-N 3.32Å; D307-R309 PolarHBondContact O-N 3.25Å; D307-T311 PolarHBondContact O-OG1 2.91Å
308	F	54.3	Low	57.3	Low	181 Å²	181	124 Å²	124	79%	0.794	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10	-178.7	-144.3	-99.3	0	0	0	114.1
309	R	54.1	Low	57.8	Low	219 Å²	219	122.6 Å²	122.6	83%	0.826	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-13.7	179.6	-147.4	174	-167.9	175.8	3.4	113.7	D307	D307-R309 VanDerWaalsContact C-N 3.32Å; D307-R309 PolarHBondContact O-N 3.25Å
310	A	57.2	Low	58	Low	61 Å²	61	123.1 Å²	123.1	50%	0.504	65%	0.649	S	S	.	*	S	Bend	trans	-86.6	-18.7	175.2	0	0	0	0	0	113.1	T313 T314	A310-T313 PolarHBondContact O-OG1 3.31Å; A310-T314 PolarHBondContact O-OG1 3.07Å
311	T	56	Low	58.2	Low	83 Å²	83	120.1 Å²	120.1	51%	0.509	63%	0.633	S	S	.	*	H	α-helix	trans	-82.7	-18.4	-178.8	-22.5	0	0	0	0	112.9	D307 T314	D307-T311 PolarHBondContact O-OG1 2.91Å; T311-T314 PolarHBondContact O-OG1 3.34Å
312	T	55.8	Low	58.1	Low	87 Å²	87	122.9 Å²	122.9	53%	0.534	63%	0.629	S	S	.	*	H	α-helix	trans	-86.8	-18.6	178.9	9	0	0	0	0	113.7	T315	T312-T315 PolarHBondContact O-OG1 3.44Å
313	T	55.7	Low	58.2	Low	84 Å²	84	123 Å²	123	52%	0.515	62%	0.617	S	S	.	*	H	α-helix	trans	-86	-22	175.8	46	0	0	0	0	113.1	A310 T316 T317	A310-T313 PolarHBondContact O-OG1 3.31Å; T313-T316 PolarHBondContact O-OG1 2.91Å; T313-T316 VanDerWaalsContact O-OG1 3.09Å; T313-T317 PolarHBondContact O-OG1 2.93Å
314	T	56.4	Low	58	Low	83 Å²	83	119.4 Å²	119.4	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-75.5	-31.3	176.8	35.7	0	0	0	0	112.9	A310 T311 E318	A310-T314 PolarHBondContact O-OG1 3.07Å; T311-T314 PolarHBondContact O-OG1 3.34Å; T314-E318 PolarHBondContact O-N 3.42Å
315	T	58.5	Low	58	Low	81 Å²	81	120.7 Å²	120.7	50%	0.497	61%	0.605	S	S	.	*	H	α-helix	trans	-72.6	-34.7	179	59.1	0	0	0	0	113.3	T312 L319	T312-T315 PolarHBondContact O-OG1 3.44Å; T315-L319 PolarHBondContact O-N 2.95Å
316	T	61.1	Low	57.9	Low	75 Å²	75	114.8 Å²	114.8	46%	0.46	58%	0.582	S	S	.	*	H	α-helix	trans	-71.1	-33.2	176.6	53.5	0	0	0	0	112	T313 N320	T313-T316 PolarHBondContact O-OG1 2.91Å; T313-T316 VanDerWaalsContact O-OG1 3.09Å; T316-N320 WeakPolarHBondContact O-CB 3.29Å; T316-N320 PolarHBondContact O-N 3.28Å; T316-N320 PolarHBondContact O-ND2 3.28Å
317	T	62.4	Low	57.9	Low	89 Å²	89	114.2 Å²	114.2	55%	0.546	58%	0.575	S	S	.	*	H	α-helix	trans	-68.9	-41.6	178.1	-46.8	0	0	0	0	111.7	T313 N320 K321	T313-T317 PolarHBondContact O-OG1 2.93Å; T317-N320 PolarHBondContact O-N 3.27Å; T317-K321 WeakPolarHBondContact O-CB 3.35Å; T317-K321 PolarHBondContact O-N 2.94Å
318	E	64.1	Low	57.9	Low	106 Å²	106	111.1 Å²	111.1	50%	0.495	56%	0.558	S	S	.	*	H	α-helix	trans	-69.6	-35.8	176.5	-79	-66.3	134.9	0	0	113.1	T314 K321 R322	T314-E318 PolarHBondContact O-N 3.42Å; E318-K321 PolarHBondContact O-N 3.16Å; E318-K321 IonicContact OE1-NZ 3.13Å; E318-R322 PolarHBondContact O-N 2.92Å
319	L	62.4	Low	58.4	Low	113 Å²	113	104.5 Å²	104.5	59%	0.592	53%	0.534	S	S	*	.	H	α-helix	trans	-66.7	-41.3	174.1	-80.1	165.9	0	0	0	112.3	T315 K321 R322 K323	T315-L319 PolarHBondContact O-N 2.95Å; L319-K321 VanDerWaalsContact C-N 3.34Å; L319-R322 PolarHBondContact O-N 2.88Å; L319-K323 PolarHBondContact O-N 2.87Å; L319-K323 VanDerWaalsContact O-N 3.11Å
320	N	61.3	Low	59.1	Low	110 Å²	110	97.7 Å²	97.7	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-66	-38	174.6	-75.9	-21.4	0	0	0	111.7	T316 T317 K323 Y324	T316-N320 WeakPolarHBondContact O-CB 3.29Å; T316-N320 PolarHBondContact O-N 3.28Å; T316-N320 PolarHBondContact O-ND2 3.28Å; T317-N320 PolarHBondContact O-N 3.27Å; N320-K323 PolarHBondContact O-N 3.08Å; N320-Y324 PolarHBondContact O-N 3.41Å
321	K	61.3	Low	59.9	Low	120 Å²	120	98.5 Å²	98.5	52%	0.522	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-41.7	175.6	-165	176.1	-179.9	-176.9	0	112.3	T317 E318 L319 Y324 I325	T317-K321 WeakPolarHBondContact O-CB 3.35Å; T317-K321 PolarHBondContact O-N 2.94Å; E318-K321 PolarHBondContact O-N 3.16Å; E318-K321 IonicContact OE1-NZ 3.13Å; L319-K321 VanDerWaalsContact C-N 3.34Å; K321-Y324 PolarHBondContact O-N 3.41Å; K321-I325 HydrophobicContact CG-CD1 4.27Å; K321-I325 WeakPolarHBondContact O-CD1 3.17Å; K321-I325 VanDerWaalsContact O-CG1 3.27Å; K321-I325 WeakPolarHBondContact O-CG1 3.47Å; K321-I325 PolarHBondContact O-N 2.94Å; K321-I325 VanDerWaalsContact O-N 3.13Å
322	R	54.8	Low	61	Low	192 Å²	192	99.2 Å²	99.2	73%	0.725	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-41.8	174.4	-84.6	-171.7	-177.4	-179.7	2.2	112.8	E318 L319 S326	E318-R322 PolarHBondContact O-N 2.92Å; L319-R322 PolarHBondContact O-N 2.88Å; R322-S326 PolarHBondContact O-N 2.85Å
323	K	56.9	Low	62.4	Low	152 Å²	152	95.8 Å²	95.8	66%	0.661	49%	0.487	S	S	*	.	H	α-helix	trans	-61.2	-45.6	176	-83.1	-176.5	176.9	177.4	0	111.5	L319 N320 I325 S326 Q327	L319-K323 PolarHBondContact O-N 2.87Å; L319-K323 VanDerWaalsContact O-N 3.11Å; N320-K323 PolarHBondContact O-N 3.08Å; K323-I325 PolarHBondContact O-N 2.86Å; K323-S326 PolarHBondContact O-N 2.81Å; K323-S326 PolarHBondContact O-OG 2.85Å; K323-Q327 PolarHBondContact O-N 3.23Å
324	Y	51.4	Low	63.9	Low	150 Å²	150	92.1 Å²	92.1	59%	0.588	46%	0.464	S	S	*	.	H	α-helix	trans	-61.9	-43.2	-179.4	-163.7	-91.4	0	0	0	112.8	N320 K321 S326 Q327 D328	N320-Y324 PolarHBondContact O-N 3.41Å; K321-Y324 PolarHBondContact O-N 3.41Å; Y324-S326 VanDerWaalsContact C-N 3.31Å; Y324-S326 PolarHBondContact O-N 2.81Å; Y324-Q327 PolarHBondContact O-N 3.45Å; Y324-D328 WeakPolarHBondContact CE1-OD2 3.26Å; Y324-D328 PolarHBondContact O-N 2.66Å
325	I	55	Low	65.3	Low	100 Å²	100	91.1 Å²	91.1	51%	0.513	46%	0.459	S	S	.	.	H	α-helix	trans	-61.5	-38.7	179.7	-67.9	164.3	0	0	0	112	K321 K323	K321-I325 HydrophobicContact CG-CD1 4.27Å; K321-I325 WeakPolarHBondContact O-CD1 3.17Å; K321-I325 VanDerWaalsContact O-CG1 3.27Å; K321-I325 WeakPolarHBondContact O-CG1 3.47Å; K321-I325 PolarHBondContact O-N 2.94Å; K321-I325 VanDerWaalsContact O-N 3.13Å; K323-I325 PolarHBondContact O-N 2.86Å
326	S	57.3	Low	66.8	Low	66 Å²	66	87.7 Å²	87.7	46%	0.462	44%	0.438	S	S	.	.	H	α-helix	trans	-66.6	-41.7	179.2	69.7	0	0	0	0	111.7	R322 K323 Y324 S329 H330	R322-S326 PolarHBondContact O-N 2.85Å; K323-S326 PolarHBondContact O-N 2.81Å; K323-S326 PolarHBondContact O-OG 2.85Å; Y324-S326 VanDerWaalsContact C-N 3.31Å; Y324-S326 PolarHBondContact O-N 2.81Å; S326-S329 PolarHBondContact O-N 2.99Å; S326-S329 PolarHBondContact O-OG 3.4Å; S326-H330 PolarHBondContact O-CD2 3.1Å; S326-H330 VanDerWaalsContact O-CD2 3.24Å
327	Q	61.9	Low	68.2	Low	132 Å²	132	84.3 Å²	84.3	62%	0.617	42%	0.417	S	S	*	.	H	α-helix	trans	-68.4	-38.3	-175.7	-167.1	169.2	-14.1	0	0	112.6	K323 Y324 S329 H330	K323-Q327 PolarHBondContact O-N 3.23Å; Y324-Q327 PolarHBondContact O-N 3.45Å; Q327-S329 VanDerWaalsContact C-N 3.27Å; Q327-S329 PolarHBondContact O-N 3.45Å; Q327-H330 PolarHBondContact O-N 3.46Å
328	D	58.3	Low	69.7	Low	50 Å²	50	81.5 Å²	81.5	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-63.2	-30.2	176.6	-84.3	-6.9	0	0	0	113.1	Y324 H330 T331 H332	Y324-D328 WeakPolarHBondContact CE1-OD2 3.26Å; Y324-D328 PolarHBondContact O-N 2.66Å; D328-H330 VanDerWaalsContact C-N 3.29Å; D328-H330 PolarHBondContact O-N 2.81Å; D328-T331 PolarHBondContact O-OG1 3.28Å; D328-H332 PolarHBondContact O-CD2 3.08Å; D328-H332 VanDerWaalsContact O-CD2 3.26Å
329	S	64.7	Low	71.1	Confident	41 Å²	41	79 Å²	79	29%	0.287	39%	0.392	S	S	.	.	H	α-helix	trans	-67.4	-33.1	178.8	73.2	0	0	0	0	112.2	S326 Q327 V333	S326-S329 PolarHBondContact O-N 2.99Å; S326-S329 PolarHBondContact O-OG 3.4Å; Q327-S329 VanDerWaalsContact C-N 3.27Å; Q327-S329 PolarHBondContact O-N 3.45Å; S329-V333 WeakPolarHBondContact O-CG2 3.48Å
330	H	69.1	Low	72.6	Confident	77 Å²	77	73.9 Å²	73.9	36%	0.356	37%	0.365	S	S	.	.	H	α-helix	trans	-76.2	-32.6	-177.7	-73.2	-80.9	0	0	0	112.8	S326 Q327 D328 T334	S326-H330 PolarHBondContact O-CD2 3.1Å; S326-H330 VanDerWaalsContact O-CD2 3.24Å; Q327-H330 PolarHBondContact O-N 3.46Å; D328-H330 VanDerWaalsContact C-N 3.29Å; D328-H330 PolarHBondContact O-N 2.81Å; H330-T334 PolarHBondContact O-N 3.31Å; H330-T334 PolarHBondContact O-OG1 2.82Å
331	T	74.2	Confident	74.2	Confident	78 Å²	78	68.7 Å²	68.7	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-69.9	-32.1	-177.8	50.4	0	0	0	0	112.5	D328 P335	D328-T331 PolarHBondContact O-OG1 3.28Å; T331-P335 WeakPolarHBondContact O-CD 3.47Å; T331-P335 WeakPolarHBondContact O-CG 2.92Å
332	H	79.2	Confident	75.8	Confident	98 Å²	98	69.7 Å²	69.7	45%	0.454	34%	0.342	S	S	.	.	H	α-helix	trans	-83.1	-32.9	178.5	-72.1	-70.6	0	0	0	114	D328 A395	D328-H332 PolarHBondContact O-CD2 3.08Å; D328-H332 VanDerWaalsContact O-CD2 3.26Å; H332-A395 PolarHBondContact ND1-O 3.06Å
333	V	83.5	Confident	77.8	Confident	14 Å²	14	61.9 Å²	61.9	9%	0.085	32%	0.315	C	S	.	.	H	α-helix	trans	-74.2	-30.5	-177.1	175.4	0	0	0	0	112.1	F70 L74 S329 L336 L337	F70-V333 HydrophobicContact CD1-CG2 4.06Å; F70-V333 HydrophobicContact CE1-CG2 3.94Å; L74-V333 HydrophobicContact CD1-CG1 4.5Å; L74-V333 HydrophobicContact CD2-CG1 3.79Å; L74-V333 HydrophobicContact CD2-CG2 4.06Å; S329-V333 WeakPolarHBondContact O-CG2 3.48Å; V333-L336 WeakPolarHBondContact O-CB 3.48Å; V333-L336 PolarHBondContact O-N 2.85Å; V333-L337 PolarHBondContact O-N 2.65Å; V333-L337 VanDerWaalsContact O-N 3.16Å
334	T	87.3	Confident	79.7	Confident	8 Å²	8	55 Å²	55	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-68.5	-48.5	-175.4	-50.2	0	0	0	0	112.5	I222 L226 H330 L336 L337 L338	I222-T334 HydrophobicContact CG2-CG2 3.23Å; L226-T334 HydrophobicContact CD1-CG2 3.8Å; H330-T334 PolarHBondContact O-N 3.31Å; H330-T334 PolarHBondContact O-OG1 2.82Å; T334-L336 VanDerWaalsContact C-N 3.29Å; T334-L336 PolarHBondContact O-N 2.8Å; T334-L337 PolarHBondContact O-N 3.03Å; T334-L338 WeakPolarHBondContact O-CG 3.4Å; T334-L338 PolarHBondContact O-N 3.44Å
335	P	87.4	Confident	81.8	Confident	61 Å²	61	49.7 Å²	49.7	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-58.3	-39.2	174.1	-25.3	35	0	0	0	113.5	T331 L337 L338 C339	T331-P335 WeakPolarHBondContact O-CD 3.47Å; T331-P335 WeakPolarHBondContact O-CG 2.92Å; P335-L337 PolarHBondContact O-N 3.44Å; P335-L338 PolarHBondContact O-N 2.95Å; P335-C339 PolarHBondContact O-N 2.98Å; P335-C339 PolarHBondContact O-SG 3.29Å; P335-C339 VanDerWaalsContact O-SG 3.34Å
336	L	88.9	Confident	83.8	Confident	9 Å²	9	47.6 Å²	47.6	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-54.8	-51.3	175.2	176.5	85.8	0	0	0	111.1	V333 T334 L338 C339 M340 F391 Y392 A395	V333-L336 WeakPolarHBondContact O-CB 3.48Å; V333-L336 PolarHBondContact O-N 2.85Å; T334-L336 VanDerWaalsContact C-N 3.29Å; T334-L336 PolarHBondContact O-N 2.8Å; L336-L338 VanDerWaalsContact C-N 3.34Å; L336-L338 PolarHBondContact O-N 3.34Å; L336-C339 PolarHBondContact O-N 3.28Å; L336-M340 HydrophobicContact CG-SD 4.21Å; L336-M340 WeakPolarHBondContact O-CG 3.36Å; L336-M340 PolarHBondContact O-N 2.83Å; L336-F391 HydrophobicContact CD1-CB 3.53Å; L336-F391 WeakPolarHBondContact CD1-O 3.35Å; L336-Y392 HydrophobicContact CD1-CD1 3.84Å; L336-Y392 HydrophobicContact CD1-CE1 4.42Å; L336-Y392 HydrophobicContact CD1-CG 4.41Å; L336-Y392 HydrophobicContact CD2-CD1 3.63Å; L336-Y392 HydrophobicContact CD2-CE1 3.68Å; L336-Y392 HydrophobicContact CG-CD1 4.3Å; L336-Y392 HydrophobicContact CG-CE1 4.48Å; L336-A395 HydrophobicContact CB-CB 3.94Å; L336-A395 HydrophobicContact CD1-CB 3.76Å; L336-A395 HydrophobicContact CG-CB 4.46Å
337	L	91.6	Very high	85.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-41	179.1	-179.7	67.4	0	0	0	111.9	L135 R139 I222 V333 T334 P335 C339 M340 N341	L135-L337 HydrophobicContact CD2-CD1 3.8Å; L135-L337 HydrophobicContact CG-CD1 3.8Å; R139-L337 HydrophobicContact CB-CD2 3.48Å; R139-L337 VanDerWaalsContact CB-CD2 3.48Å; R139-L337 HydrophobicContact CG-CD2 3.62Å; I222-L337 HydrophobicContact CD1-CD2 4.29Å; V333-L337 PolarHBondContact O-N 2.65Å; V333-L337 VanDerWaalsContact O-N 3.16Å; T334-L337 PolarHBondContact O-N 3.03Å; P335-L337 PolarHBondContact O-N 3.44Å; L337-C339 VanDerWaalsContact C-N 3.31Å; L337-C339 PolarHBondContact O-N 3.25Å; L337-M340 PolarHBondContact O-N 3.11Å; L337-N341 WeakPolarHBondContact O-CB 3.44Å; L337-N341 VanDerWaalsContact O-CG 3.31Å; L337-N341 PolarHBondContact O-N 3.13Å
338	L	93.1	Very high	87.3	Confident	31 Å²	31	38.5 Å²	38.5	16%	0.162	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-43	176.9	-65.4	174.1	0	0	0	111.2	T219 I222 L226 T334 P335 L336 F342	T219-L338 HydrophobicContact CG2-CD2 3.43Å; T219-L338 VanDerWaalsContact CG2-CD2 3.43Å; I222-L338 HydrophobicContact CB-CD2 4.37Å; I222-L338 HydrophobicContact CG2-CD1 4.44Å; I222-L338 HydrophobicContact CG2-CD2 4.01Å; I222-L338 HydrophobicContact CG2-CG 4.46Å; L226-L338 HydrophobicContact CD1-CD1 4.21Å; T334-L338 WeakPolarHBondContact O-CG 3.4Å; T334-L338 PolarHBondContact O-N 3.44Å; P335-L338 PolarHBondContact O-N 2.95Å; L336-L338 VanDerWaalsContact C-N 3.34Å; L336-L338 PolarHBondContact O-N 3.34Å; L338-F342 WeakPolarHBondContact O-CB 3.45Å; L338-F342 PolarHBondContact O-N 2.83Å
339	C	93.4	Very high	89.1	Confident	54 Å²	54	39 Å²	39	37%	0.365	22%	0.221	S	C	.	.	H	α-helix	trans	-64	-45.1	175.6	-69.1	0	0	0	0	112.1	P335 L336 L337 N341 F342 V343 F391	P335-C339 PolarHBondContact O-N 2.98Å; P335-C339 PolarHBondContact O-SG 3.29Å; P335-C339 VanDerWaalsContact O-SG 3.34Å; L336-C339 PolarHBondContact O-N 3.28Å; L337-C339 VanDerWaalsContact C-N 3.31Å; L337-C339 PolarHBondContact O-N 3.25Å; C339-N341 PolarHBondContact O-N 2.67Å; C339-F342 PolarHBondContact O-N 3.44Å; C339-V343 PolarHBondContact O-N 2.93Å; C339-F391 HydrophobicContact CB-CD1 3.59Å; C339-F391 HydrophobicContact CB-CD2 4.46Å; C339-F391 HydrophobicContact CB-CE1 3.63Å; C339-F391 HydrophobicContact CB-CE2 4.47Å; C339-F391 HydrophobicContact CB-CG 4.05Å; C339-F391 HydrophobicContact CB-CZ 4.09Å
340	M	93.7	Very high	90.7	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-45.4	177.3	-74.3	178.4	151.2	0	0	112.1	Q132 L336 L337 F342 V343 Y344 N388 F391 Y392	Q132-M340 VanDerWaalsContact NE2-C 3.28Å; Q132-M340 PolarHBondContact NE2-O 3.3Å; Q132-M340 VanDerWaalsContact NE2-O 3.15Å; L336-M340 HydrophobicContact CG-SD 4.21Å; L336-M340 WeakPolarHBondContact O-CG 3.36Å; L336-M340 PolarHBondContact O-N 2.83Å; L337-M340 PolarHBondContact O-N 3.11Å; M340-F342 VanDerWaalsContact C-N 3.35Å; M340-F342 PolarHBondContact O-N 3.41Å; M340-V343 PolarHBondContact O-N 3.05Å; M340-Y344 WeakPolarHBondContact O-CB 3.35Å; M340-Y344 PolarHBondContact O-N 3.13Å; M340-N388 HydrophobicContact CE-CB 3.62Å; M340-N388 WeakPolarHBondContact CE-O 3.41Å; M340-N388 WeakPolarHBondContact CE-OD1 3.41Å; M340-F391 HydrophobicContact CE-CB 4.35Å; M340-F391 HydrophobicContact CG-CB 4.37Å; M340-F391 HydrophobicContact CG-CD2 3.96Å; M340-F391 HydrophobicContact CG-CG 4.46Å; M340-Y392 HydrophobicContact CE-CD1 4.16Å; M340-Y392 HydrophobicContact CE-CD2 4.1Å; M340-Y392 HydrophobicContact CE-CE1 3.56Å; M340-Y392 HydrophobicContact CE-CE2 3.44Å; M340-Y392 VanDerWaalsContact CE-CE2 3.44Å; M340-Y392 HydrophobicContact CE-CG 4.4Å; M340-Y392 VanDerWaalsContact CE-OH 3.29Å; M340-Y392 WeakPolarHBondContact CE-OH 3.2Å; M340-Y392 HydrophobicContact SD-CE1 4.37Å
341	N	95.6	Very high	92	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-42.4	176.4	-71.4	-3.7	0	0	0	111.4	Q132 S136 T219 L337 C339 Y344 M345	Q132-N341 PolarHBondContact NE2-OD1 3.31Å; S136-N341 PolarHBondContact OG-ND2 2.85Å; S136-N341 PolarHBondContact OG-OD1 3.4Å; T219-N341 PolarHBondContact OG1-ND2 3.4Å; L337-N341 WeakPolarHBondContact O-CB 3.44Å; L337-N341 VanDerWaalsContact O-CG 3.31Å; L337-N341 PolarHBondContact O-N 3.13Å; C339-N341 PolarHBondContact O-N 2.67Å; N341-Y344 PolarHBondContact O-N 2.85Å; N341-M345 HydrophobicContact CB-CE 4.39Å; N341-M345 WeakPolarHBondContact O-CB 3.31Å; N341-M345 WeakPolarHBondContact O-CE 3.45Å; N341-M345 VanDerWaalsContact O-CG 3.27Å; N341-M345 WeakPolarHBondContact O-CG 3.5Å; N341-M345 PolarHBondContact O-N 3.4Å
342	F	95.5	Very high	93.1	Very high	141 Å²	141	31.8 Å²	31.8	62%	0.618	18%	0.181	S	C	*	.	H	α-helix	trans	-61.1	-46.4	177.5	-176.8	-97.4	0	0	0	112	L338 C339 M340 M345 A346	L338-F342 WeakPolarHBondContact O-CB 3.45Å; L338-F342 PolarHBondContact O-N 2.83Å; C339-F342 PolarHBondContact O-N 3.44Å; M340-F342 VanDerWaalsContact C-N 3.35Å; M340-F342 PolarHBondContact O-N 3.41Å; F342-M345 PolarHBondContact O-N 3.23Å; F342-A346 WeakPolarHBondContact O-CB 3.04Å; F342-A346 PolarHBondContact O-N 3.32Å
343	V	95.9	Very high	93.9	Very high	28 Å²	28	32.3 Å²	32.3	17%	0.17	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-40	177.9	174.6	0	0	0	0	112.1	C339 M340 M345 A346 S347 T387 F391	C339-V343 PolarHBondContact O-N 2.93Å; M340-V343 PolarHBondContact O-N 3.05Å; V343-M345 PolarHBondContact O-N 3.3Å; V343-A346 PolarHBondContact O-N 3.3Å; V343-S347 VanDerWaalsContact O-CB 3.32Å; V343-S347 WeakPolarHBondContact O-CB 3.22Å; V343-S347 PolarHBondContact O-N 2.89Å; V343-S347 PolarHBondContact O-OG 3.06Å; V343-T387 HydrophobicContact CG1-CG2 4.43Å; V343-T387 VanDerWaalsContact CG1-OG1 3.32Å; V343-T387 WeakPolarHBondContact CG1-OG1 3.25Å; V343-F391 HydrophobicContact CB-CE2 4.04Å; V343-F391 HydrophobicContact CB-CZ 4.37Å; V343-F391 HydrophobicContact CG2-CE2 3.51Å; V343-F391 HydrophobicContact CG2-CZ 3.36Å
344	Y	96.2	Very high	94.6	Very high	7 Å²	7	32 Å²	32	3%	0.027	18%	0.184	C	C	.	.	H	α-helix	trans	-56.3	-51.1	173.2	178.9	-83.7	0	0	0	110.9	A129 W207 V212 M215 M340 N341 A346 S347 V348	A129-Y344 HydrophobicContact CB-CE2 4.11Å; A129-Y344 VanDerWaalsContact CB-OH 3.26Å; A129-Y344 WeakPolarHBondContact CB-OH 3.27Å; W207-Y344 PolarHBondContact O-OH 2.69Å; V212-Y344 HydrophobicContact CG2-CE1 3.93Å; M215-Y344 HydrophobicContact CE-CD1 3.25Å; M215-Y344 HydrophobicContact CE-CD2 4.49Å; M215-Y344 HydrophobicContact CE-CE1 3.15Å; M215-Y344 HydrophobicContact CE-CE2 4.4Å; M215-Y344 HydrophobicContact CE-CG 3.97Å; M215-Y344 HydrophobicContact SD-CD1 4.05Å; M215-Y344 HydrophobicContact SD-CE1 4.47Å; M215-Y344 HydrophobicContact SD-CG 4.34Å; M340-Y344 WeakPolarHBondContact O-CB 3.35Å; M340-Y344 PolarHBondContact O-N 3.13Å; N341-Y344 PolarHBondContact O-N 2.85Å; Y344-A346 PolarHBondContact O-N 3.23Å; Y344-S347 WeakPolarHBondContact CA-OG 3.49Å; Y344-S347 PolarHBondContact O-N 3.15Å; Y344-S347 PolarHBondContact O-OG 3.12Å; Y344-V348 HydrophobicContact CD1-CG2 4.29Å; Y344-V348 HydrophobicContact CD2-CG2 4.19Å; Y344-V348 HydrophobicContact CE1-CB 4.23Å; Y344-V348 HydrophobicContact CE1-CG1 4.41Å; Y344-V348 HydrophobicContact CE1-CG2 3.95Å; Y344-V348 HydrophobicContact CE2-CG2 3.86Å; Y344-V348 HydrophobicContact CG-CG2 4.39Å; Y344-V348 WeakPolarHBondContact O-CB 3.22Å; Y344-V348 WeakPolarHBondContact O-CG2 3.41Å; Y344-V348 PolarHBondContact O-N 2.93Å
345	M	95.9	Very high	95	Very high	39 Å²	39	31.7 Å²	31.7	19%	0.192	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-44.8	178.9	-69.4	-178.6	-68.5	0	0	111.8	V212 T216 N341 F342 V343 S347 C349	V212-M345 HydrophobicContact CG1-CG 4.31Å; T216-M345 PolarHBondContact OG1-SD 3.42Å; N341-M345 HydrophobicContact CB-CE 4.39Å; N341-M345 WeakPolarHBondContact O-CB 3.31Å; N341-M345 WeakPolarHBondContact O-CE 3.45Å; N341-M345 VanDerWaalsContact O-CG 3.27Å; N341-M345 WeakPolarHBondContact O-CG 3.5Å; N341-M345 PolarHBondContact O-N 3.4Å; F342-M345 PolarHBondContact O-N 3.23Å; V343-M345 PolarHBondContact O-N 3.3Å; M345-S347 VanDerWaalsContact C-N 3.34Å; M345-S347 PolarHBondContact O-N 3.19Å; M345-C349 WeakPolarHBondContact O-CB 3.46Å; M345-C349 PolarHBondContact O-N 3.44Å
346	A	96.5	Very high	95.4	Very high	57 Å²	57	32.7 Å²	32.7	47%	0.471	18%	0.183	S	C	.	.	H	α-helix	trans	-65.4	-35.1	-179.8	0	0	0	0	0	113.1	F342 V343 Y344 P350	F342-A346 WeakPolarHBondContact O-CB 3.04Å; F342-A346 PolarHBondContact O-N 3.32Å; V343-A346 PolarHBondContact O-N 3.3Å; Y344-A346 PolarHBondContact O-N 3.23Å; A346-P350 WeakPolarHBondContact O-CD 3.19Å
347	S	96.4	Very high	95.8	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-81.3	-34.9	-179.1	51.7	0	0	0	0	113.5	V343 Y344 M345 F380 S384	V343-S347 VanDerWaalsContact O-CB 3.32Å; V343-S347 WeakPolarHBondContact O-CB 3.22Å; V343-S347 PolarHBondContact O-N 2.89Å; V343-S347 PolarHBondContact O-OG 3.06Å; Y344-S347 WeakPolarHBondContact CA-OG 3.49Å; Y344-S347 PolarHBondContact O-N 3.15Å; Y344-S347 PolarHBondContact O-OG 3.12Å; M345-S347 VanDerWaalsContact C-N 3.34Å; M345-S347 PolarHBondContact O-N 3.19Å; S347-F380 VanDerWaalsContact CB-O 3.23Å; S347-F380 WeakPolarHBondContact CB-O 3.21Å; S347-S384 WeakPolarHBondContact OG-CB 3.46Å
348	V	96.5	Very high	95.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-85.6	-32.7	-177.1	171	0	0	0	0	112.3	W207 Y344 L351 L352	W207-V348 HydrophobicContact CH2-CB 4.45Å; W207-V348 HydrophobicContact CH2-CG1 3.66Å; W207-V348 HydrophobicContact CH2-CG2 4.21Å; W207-V348 HydrophobicContact CZ2-CG1 4.12Å; W207-V348 HydrophobicContact CZ2-CG2 4.08Å; W207-V348 HydrophobicContact CZ3-CG1 4.02Å; Y344-V348 HydrophobicContact CD1-CG2 4.29Å; Y344-V348 HydrophobicContact CD2-CG2 4.19Å; Y344-V348 HydrophobicContact CE1-CB 4.23Å; Y344-V348 HydrophobicContact CE1-CG1 4.41Å; Y344-V348 HydrophobicContact CE1-CG2 3.95Å; Y344-V348 HydrophobicContact CE2-CG2 3.86Å; Y344-V348 HydrophobicContact CG-CG2 4.39Å; Y344-V348 WeakPolarHBondContact O-CB 3.22Å; Y344-V348 WeakPolarHBondContact O-CG2 3.41Å; Y344-V348 PolarHBondContact O-N 2.93Å; V348-L351 PolarHBondContact O-N 3.39Å; V348-L352 HydrophobicContact CG1-CD1 3.88Å; V348-L352 HydrophobicContact CG1-CD2 4.06Å; V348-L352 HydrophobicContact CG1-CG 3.76Å; V348-L352 PolarHBondContact O-N 3.19Å; V348-L352 VanDerWaalsContact O-N 3.15Å
349	C	96.9	Very high	95.9	Very high	59 Å²	59	37.1 Å²	37.1	40%	0.399	20%	0.201	S	C	.	.	H	α-helix	trans	-53	-43.8	-176	-174.5	0	0	0	0	114.6	M345 L351 L352 I353	M345-C349 WeakPolarHBondContact O-CB 3.46Å; M345-C349 PolarHBondContact O-N 3.44Å; C349-L351 VanDerWaalsContact C-N 3.29Å; C349-L351 PolarHBondContact O-N 2.89Å; C349-L352 PolarHBondContact O-N 2.8Å; C349-L352 VanDerWaalsContact O-N 3.14Å; C349-I353 WeakPolarHBondContact O-CG1 3.16Å; C349-I353 PolarHBondContact O-N 3.41Å
350	P	97.1	Very high	96	Very high	31 Å²	31	41.3 Å²	41.3	20%	0.201	21%	0.213	C	C	.	.	H	α-helix	trans	-56.3	-40.6	176.6	-26.6	36	0	0	0	113.5	A346 Y354 F377 F380	A346-P350 WeakPolarHBondContact O-CD 3.19Å; P350-Y354 WeakPolarHBondContact O-CB 3.1Å; P350-Y354 PolarHBondContact O-N 2.92Å; P350-F377 HydrophobicContact CB-CB 4.39Å; P350-F377 HydrophobicContact CB-CD1 3.55Å; P350-F377 HydrophobicContact CB-CE1 3.94Å; P350-F377 HydrophobicContact CB-CG 3.99Å; P350-F380 HydrophobicContact CB-CD2 4.39Å; P350-F380 HydrophobicContact CG-CD2 4.27Å
351	L	96.6	Very high	96.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.3	-35.9	178.3	-172.1	61.5	0	0	0	111.8	W207 V348 C349 Y354 F355 Y374 F377	W207-L351 HydrophobicContact CH2-CD2 3.69Å; W207-L351 HydrophobicContact CZ3-CD2 3.79Å; W207-L351 HydrophobicContact CZ3-CG 4.36Å; V348-L351 PolarHBondContact O-N 3.39Å; C349-L351 VanDerWaalsContact C-N 3.29Å; C349-L351 PolarHBondContact O-N 2.89Å; L351-Y354 HydrophobicContact CD1-CD1 4.2Å; L351-Y354 WeakPolarHBondContact O-CB 3.1Å; L351-Y354 PolarHBondContact O-N 2.92Å; L351-F355 HydrophobicContact CD1-CD1 4.37Å; L351-F355 HydrophobicContact CD1-CE1 3.88Å; L351-F355 HydrophobicContact CD1-CE2 4.42Å; L351-F355 HydrophobicContact CD1-CZ 3.91Å; L351-F355 HydrophobicContact CD2-CE2 4.18Å; L351-F355 HydrophobicContact CD2-CZ 4.11Å; L351-F355 HydrophobicContact CG-CD2 4.38Å; L351-F355 HydrophobicContact CG-CE1 4.32Å; L351-F355 HydrophobicContact CG-CE2 3.97Å; L351-F355 HydrophobicContact CG-CZ 3.94Å; L351-F355 WeakPolarHBondContact O-CG 3.09Å; L351-F355 PolarHBondContact O-N 2.78Å; L351-Y374 HydrophobicContact CD1-CD2 4.22Å; L351-Y374 HydrophobicContact CD1-CE2 4.5Å; L351-F377 HydrophobicContact CB-CB 3.91Å; L351-F377 HydrophobicContact CD1-CB 3.84Å; L351-F377 HydrophobicContact CG-CB 4.47Å
352	L	97.3	Very high	95.9	Very high	14 Å²	14	47.6 Å²	47.6	7%	0.073	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-42.5	175.9	-59.2	-172.9	0	0	0	112.4	L204 W207 V212 V348 C349 Y354 F355 L356	L204-L352 HydrophobicContact CD1-CB 4.11Å; L204-L352 HydrophobicContact CD1-CD2 4.17Å; W207-L352 HydrophobicContact CE3-CD2 4.07Å; W207-L352 HydrophobicContact CZ3-CD2 3.78Å; V212-L352 HydrophobicContact CG2-CD1 4.01Å; V348-L352 HydrophobicContact CG1-CD1 3.88Å; V348-L352 HydrophobicContact CG1-CD2 4.06Å; V348-L352 HydrophobicContact CG1-CG 3.76Å; V348-L352 PolarHBondContact O-N 3.19Å; V348-L352 VanDerWaalsContact O-N 3.15Å; C349-L352 PolarHBondContact O-N 2.8Å; C349-L352 VanDerWaalsContact O-N 3.14Å; L352-Y354 PolarHBondContact O-N 3.41Å; L352-F355 PolarHBondContact O-N 3.26Å; L352-L356 WeakPolarHBondContact O-CB 3.35Å; L352-L356 PolarHBondContact O-N 3.24Å
353	I	97.4	Very high	95.6	Very high	110 Å²	110	47.2 Å²	47.2	56%	0.564	25%	0.251	S	S	*	.	H	α-helix	trans	-59.7	-42.5	174.3	-67.5	168.3	0	0	0	109.6	C349 L356 Y357	C349-I353 WeakPolarHBondContact O-CG1 3.16Å; C349-I353 PolarHBondContact O-N 3.41Å; I353-L356 PolarHBondContact O-N 2.58Å; I353-Y357 WeakPolarHBondContact O-CB 3.33Å; I353-Y357 PolarHBondContact O-N 3.43Å
354	Y	96.5	Very high	95.2	Very high	7 Å²	7	51 Å²	51	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-45.6	176.9	-179.7	-109.1	0	0	0	113	P350 L351 L352 L356 Y357 L358 I365 H370 L373 F377	P350-Y354 WeakPolarHBondContact O-CB 3.1Å; P350-Y354 PolarHBondContact O-N 2.92Å; L351-Y354 HydrophobicContact CD1-CD1 4.2Å; L351-Y354 WeakPolarHBondContact O-CB 3.1Å; L351-Y354 PolarHBondContact O-N 2.92Å; L352-Y354 PolarHBondContact O-N 3.41Å; Y354-L356 VanDerWaalsContact C-N 3.33Å; Y354-L356 PolarHBondContact O-N 2.79Å; Y354-Y357 WeakPolarHBondContact O-CB 3.21Å; Y354-Y357 PolarHBondContact O-N 2.81Å; Y354-L358 WeakPolarHBondContact O-CB 3.05Å; Y354-L358 PolarHBondContact O-N 3.2Å; Y354-I365 HydrophobicContact CE2-CD1 4.4Å; Y354-H370 AromaticContact CZ-ND1 3.82Å; Y354-H370 WeakPolarHBondContact OH-CA 3.49Å; Y354-H370 PolarHBondContact OH-ND1 3.46Å; Y354-H370 PolarHBondContact OH-O 3.32Å; Y354-L373 HydrophobicContact CD2-CB 4.05Å; Y354-L373 HydrophobicContact CD2-CD1 4.22Å; Y354-L373 HydrophobicContact CE2-CB 3.61Å; Y354-L373 HydrophobicContact CE2-CD1 3.69Å; Y354-L373 HydrophobicContact CE2-CG 4.31Å; Y354-F377 HydrophobicContact CD1-CD2 4.47Å; Y354-F377 HydrophobicContact CD2-CD2 4.23Å; Y354-F377 HydrophobicContact CD2-CE2 4.05Å; Y354-F377 AromaticContact CG-CD2 3.83Å; Y354-F377 HydrophobicContact CG-CD2 3.83Å; Y354-F377 HydrophobicContact CG-CE2 4.08Å
355	F	96.4	Very high	94.8	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.009	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-35.6	175.7	-71.8	-18.2	0	0	0	113.1	T200 D203 L204 W207 L351 L352 L358 N359 Y374	T200-F355 HydrophobicContact CG2-CD1 4.45Å; T200-F355 HydrophobicContact CG2-CE1 4.23Å; D203-F355 HydrophobicContact CB-CD2 4.32Å; D203-F355 HydrophobicContact CB-CE2 3.82Å; L204-F355 HydrophobicContact CB-CB 4.19Å; L204-F355 HydrophobicContact CB-CD2 4.47Å; L204-F355 HydrophobicContact CD1-CB 4.22Å; W207-F355 HydrophobicContact CZ3-CE2 4.42Å; L351-F355 HydrophobicContact CD1-CD1 4.37Å; L351-F355 HydrophobicContact CD1-CE1 3.88Å; L351-F355 HydrophobicContact CD1-CE2 4.42Å; L351-F355 HydrophobicContact CD1-CZ 3.91Å; L351-F355 HydrophobicContact CD2-CE2 4.18Å; L351-F355 HydrophobicContact CD2-CZ 4.11Å; L351-F355 HydrophobicContact CG-CD2 4.38Å; L351-F355 HydrophobicContact CG-CE1 4.32Å; L351-F355 HydrophobicContact CG-CE2 3.97Å; L351-F355 HydrophobicContact CG-CZ 3.94Å; L351-F355 WeakPolarHBondContact O-CG 3.09Å; L351-F355 PolarHBondContact O-N 2.78Å; L352-F355 PolarHBondContact O-N 3.26Å; F355-L358 PolarHBondContact O-N 2.98Å; F355-N359 WeakPolarHBondContact O-CB 3.37Å; F355-N359 PolarHBondContact O-N 3.43Å; F355-N359 PolarHBondContact O-ND2 3.47Å; F355-Y374 HydrophobicContact CE1-CD2 4.06Å; F355-Y374 HydrophobicContact CE1-CE2 4.02Å; F355-Y374 HydrophobicContact CZ-CD2 4.47Å; F355-Y374 HydrophobicContact CZ-CE2 4.01Å
356	L	96.8	Very high	94.4	Very high	81 Å²	81	53.9 Å²	53.9	42%	0.424	30%	0.295	S	S	.	.	H	α-helix	trans	-64.1	-44.7	173.3	-174.4	149.7	0	0	0	110.8	L204 L352 I353 Y354 N359 F360 I361	L204-L356 HydrophobicContact CD2-CB 4.38Å; L352-L356 WeakPolarHBondContact O-CB 3.35Å; L352-L356 PolarHBondContact O-N 3.24Å; I353-L356 PolarHBondContact O-N 2.58Å; Y354-L356 VanDerWaalsContact C-N 3.33Å; Y354-L356 PolarHBondContact O-N 2.79Å; L356-N359 PolarHBondContact O-N 3.48Å; L356-F360 HydrophobicContact CG-CD2 4.05Å; L356-F360 WeakPolarHBondContact O-CB 3.16Å; L356-F360 WeakPolarHBondContact O-CD2 3.26Å; L356-F360 PolarHBondContact O-N 3.17Å; L356-I361 HydrophobicContact CD2-CD1 4.29Å
357	Y	96.1	Very high	93.8	Very high	96 Å²	96	55.5 Å²	55.5	38%	0.376	30%	0.296	S	S	.	.	H	α-helix	trans	-60.4	-46.5	175.8	179.5	-103.3	0	0	0	112.1	I353 Y354 N359 I361 V362	I353-Y357 WeakPolarHBondContact O-CB 3.33Å; I353-Y357 PolarHBondContact O-N 3.43Å; Y354-Y357 WeakPolarHBondContact O-CB 3.21Å; Y354-Y357 PolarHBondContact O-N 2.81Å; Y357-N359 PolarHBondContact O-N 2.97Å; Y357-I361 HydrophobicContact CD2-CB 3.82Å; Y357-I361 HydrophobicContact CD2-CD1 3.88Å; Y357-I361 HydrophobicContact CD2-CG1 4.39Å; Y357-I361 HydrophobicContact CD2-CG2 3.84Å; Y357-I361 HydrophobicContact CE2-CB 4.19Å; Y357-I361 HydrophobicContact CE2-CG2 3.73Å; Y357-I361 WeakPolarHBondContact O-CB 3.05Å; Y357-I361 PolarHBondContact O-N 3.43Å; Y357-V362 HydrophobicContact CD1-CG2 4.13Å; Y357-V362 HydrophobicContact CD2-CG2 4.37Å; Y357-V362 HydrophobicContact CE1-CB 4.2Å; Y357-V362 HydrophobicContact CE1-CG2 3.4Å; Y357-V362 VanDerWaalsContact CE1-CG2 3.4Å; Y357-V362 HydrophobicContact CE2-CG2 3.67Å; Y357-V362 PolarHBondContact O-N 3.27Å; Y357-V362 VanDerWaalsContact O-N 3.16Å; Y357-V362 WeakPolarHBondContact OH-CG2 3.18Å
358	L	93.9	Very high	93.1	Very high	16 Å²	16	59.2 Å²	59.2	8%	0.084	32%	0.315	C	S	.	.	H	α-helix	trans	-64.6	-38.1	180	-175.1	68.5	0	0	0	113.1	F196 T200 Y354 F355 I365	F196-L358 HydrophobicContact CE1-CD2 3.89Å; F196-L358 HydrophobicContact CZ-CD2 4.37Å; T200-L358 HydrophobicContact CG2-CD2 4.35Å; Y354-L358 WeakPolarHBondContact O-CB 3.05Å; Y354-L358 PolarHBondContact O-N 3.2Å; F355-L358 PolarHBondContact O-N 2.98Å; L358-I365 HydrophobicContact CD1-CG2 4.06Å
359	N	93.6	Very high	92.6	Very high	26 Å²	26	63.4 Å²	63.4	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-87	-27.2	-175.6	-80.3	-80.6	0	0	0	114.2	R197 T200 F355 L356 Y357	R197-N359 PolarHBondContact O-OD1 2.88Å; R197-N359 VanDerWaalsContact O-OD1 3.14Å; T200-N359 PolarHBondContact OG1-ND2 3.02Å; T200-N359 PolarHBondContact OG1-OD1 2.7Å; F355-N359 WeakPolarHBondContact O-CB 3.37Å; F355-N359 PolarHBondContact O-N 3.43Å; F355-N359 PolarHBondContact O-ND2 3.47Å; L356-N359 PolarHBondContact O-N 3.48Å; Y357-N359 PolarHBondContact O-N 2.97Å
360	F	95.4	Very high	92.2	Very high	141 Å²	141	61.8 Å²	61.8	62%	0.618	32%	0.322	S	S	*	.	H	α-helix	trans	-121.9	-18.4	-169.9	-61.4	-71.9	0	0	0	115.6	L201 L204 L356	L201-F360 HydrophobicContact CD1-CE2 4.32Å; L201-F360 HydrophobicContact CD1-CZ 3.93Å; L204-F360 HydrophobicContact CD2-CE2 4.06Å; L356-F360 HydrophobicContact CG-CD2 4.05Å; L356-F360 WeakPolarHBondContact O-CB 3.16Å; L356-F360 WeakPolarHBondContact O-CD2 3.26Å; L356-F360 PolarHBondContact O-N 3.17Å
361	I	94.5	Very high	91.6	Very high	111 Å²	111	63 Å²	63	57%	0.569	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-41.3	-171.2	-60	176.3	0	0	0	111.9	L356 Y357	L356-I361 HydrophobicContact CD2-CD1 4.29Å; Y357-I361 HydrophobicContact CD2-CB 3.82Å; Y357-I361 HydrophobicContact CD2-CD1 3.88Å; Y357-I361 HydrophobicContact CD2-CG1 4.39Å; Y357-I361 HydrophobicContact CD2-CG2 3.84Å; Y357-I361 HydrophobicContact CE2-CB 4.19Å; Y357-I361 HydrophobicContact CE2-CG2 3.73Å; Y357-I361 WeakPolarHBondContact O-CB 3.05Å; Y357-I361 PolarHBondContact O-N 3.43Å
362	V	92	Very high	91	Very high	26 Å²	26	64.7 Å²	64.7	16%	0.158	33%	0.332	C	S	.	.			trans	-112.6	126.3	-173.9	172.6	0	0	0	0	111.5	Y357 S364 I365	Y357-V362 HydrophobicContact CD1-CG2 4.13Å; Y357-V362 HydrophobicContact CD2-CG2 4.37Å; Y357-V362 HydrophobicContact CE1-CB 4.2Å; Y357-V362 HydrophobicContact CE1-CG2 3.4Å; Y357-V362 VanDerWaalsContact CE1-CG2 3.4Å; Y357-V362 HydrophobicContact CE2-CG2 3.67Å; Y357-V362 PolarHBondContact O-N 3.27Å; Y357-V362 VanDerWaalsContact O-N 3.16Å; Y357-V362 WeakPolarHBondContact OH-CG2 3.18Å; V362-S364 WeakPolarHBondContact CG1-O 3.45Å; V362-I365 HydrophobicContact CG1-CB 4.16Å
363	D	88.7	Confident	90.7	Very high	133 Å²	133	65.9 Å²	65.9	71%	0.711	34%	0.338	S	S	*	.	S	Bend	trans	-79.3	-32.7	174.4	-70.2	-38.6	0	0	0	112.9	R197	R197-D363 PolarHBondContact NH2-O 3.24Å
364	S	88.1	Confident	90.3	Very high	108 Å²	108	62.5 Å²	62.5	76%	0.755	32%	0.318	S	S	*	.			trans	-146.7	130.5	178.5	63.2	0	0	0	0	111.1	V362	V362-S364 WeakPolarHBondContact CG1-O 3.45Å
365	I	87	Confident	90	Very high	37 Å²	37	64.3 Å²	64.3	19%	0.19	33%	0.325	C	S	.	.			trans	-119.6	144.2	175.8	-167.3	169.8	0	0	0	108.2	Y354 L358 V362 N367 M369 H370 L373	Y354-I365 HydrophobicContact CE2-CD1 4.4Å; L358-I365 HydrophobicContact CD1-CG2 4.06Å; V362-I365 HydrophobicContact CG1-CB 4.16Å; I365-N367 PolarHBondContact O-N 3.24Å; I365-M369 HydrophobicContact CD1-CE 3.67Å; I365-M369 HydrophobicContact CG1-CE 3.33Å; I365-H370 HydrophobicContact CG2-CB 3.7Å; I365-L373 HydrophobicContact CD1-CD1 4.48Å
366	D	88.1	Confident	89.7	Confident	70 Å²	70	65.4 Å²	65.4	37%	0.374	33%	0.331	S	S	.	.			trans	-57.3	134	173	-179.9	81.7	0	0	0	110.1	N368 M369 H370	D366-N368 VanDerWaalsContact C-N 3.26Å; D366-N368 PolarHBondContact O-N 2.77Å; D366-N368 VanDerWaalsContact OD2-CB 3.26Å; D366-N368 WeakPolarHBondContact OD2-CB 3.23Å; D366-N368 PolarHBondContact OD2-N 2.88Å; D366-N368 PolarHBondContact OD2-ND2 3.04Å; D366-M369 HydrophobicContact CB-CB 4.21Å; D366-M369 PolarHBondContact O-N 3.41Å; D366-M369 VanDerWaalsContact O-N 3.16Å; D366-M369 PolarHBondContact OD2-N 3.13Å; D366-H370 PolarHBondContact O-N 2.82Å
367	N	84.4	Confident	89.6	Confident	91 Å²	91	63.6 Å²	63.6	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-36	-173.3	-168.2	15.5	0	0	0	112	I365 H370 K371	I365-N367 PolarHBondContact O-N 3.24Å; N367-H370 PolarHBondContact O-N 2.03Å; N367-K371 WeakPolarHBondContact O-CB 3.38Å; N367-K371 WeakPolarHBondContact O-CG 3.37Å; N367-K371 PolarHBondContact O-N 3.45Å; N367-K371 WeakPolarHBondContact OD1-CE 3.12Å
368	N	81.8	Confident	89.4	Confident	84 Å²	84	59 Å²	59	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-69.5	-42.9	178.8	-57.2	-54.2	0	0	0	110.7	D366 H370 K371 F372	D366-N368 VanDerWaalsContact C-N 3.26Å; D366-N368 PolarHBondContact O-N 2.77Å; D366-N368 VanDerWaalsContact OD2-CB 3.26Å; D366-N368 WeakPolarHBondContact OD2-CB 3.23Å; D366-N368 PolarHBondContact OD2-N 2.88Å; D366-N368 PolarHBondContact OD2-ND2 3.04Å; N368-H370 VanDerWaalsContact C-N 3.34Å; N368-K371 PolarHBondContact O-N 3.49Å; N368-F372 VanDerWaalsContact O-CB 3.31Å; N368-F372 WeakPolarHBondContact O-CB 3.47Å; N368-F372 PolarHBondContact O-N 3.15Å
369	M	85.4	Confident	89.4	Confident	89 Å²	89	58.3 Å²	58.3	44%	0.438	30%	0.298	S	S	.	.	H	α-helix	trans	-65.2	-38.4	176.1	-171.7	170.6	72.1	0	0	112	I365 D366 L373	I365-M369 HydrophobicContact CD1-CE 3.67Å; I365-M369 HydrophobicContact CG1-CE 3.33Å; D366-M369 HydrophobicContact CB-CB 4.21Å; D366-M369 PolarHBondContact O-N 3.41Å; D366-M369 VanDerWaalsContact O-N 3.16Å; D366-M369 PolarHBondContact OD2-N 3.13Å; M369-L373 HydrophobicContact CG-CD1 4.06Å; M369-L373 HydrophobicContact CG-CG 4.49Å; M369-L373 WeakPolarHBondContact O-CG 3.17Å; M369-L373 PolarHBondContact O-N 3.38Å
370	H	88.4	Confident	89.4	Confident	25 Å²	25	60.2 Å²	60.2	12%	0.116	31%	0.305	C	S	.	.	H	α-helix	trans	-59.8	-56.8	173.9	173.6	68.3	0	0	0	111.6	F196 Y354 I365 D366 N367 N368 F372 L373 Y374	F196-H370 AromaticContact CE1-CE1 3.83Å; F196-H370 AromaticContact CE1-NE2 3.96Å; F196-H370 AromaticContact CZ-CE1 3.55Å; F196-H370 AromaticContact CZ-NE2 3.45Å; F196-H370 WeakPolarHBondContact CZ-NE2 3.41Å; Y354-H370 AromaticContact CZ-ND1 3.82Å; Y354-H370 WeakPolarHBondContact OH-CA 3.49Å; Y354-H370 PolarHBondContact OH-ND1 3.46Å; Y354-H370 PolarHBondContact OH-O 3.32Å; I365-H370 HydrophobicContact CG2-CB 3.7Å; D366-H370 PolarHBondContact O-N 2.82Å; N367-H370 PolarHBondContact O-N 2.03Å; N368-H370 VanDerWaalsContact C-N 3.34Å; H370-F372 VanDerWaalsContact C-N 3.25Å; H370-F372 PolarHBondContact O-N 3.12Å; H370-L373 PolarHBondContact O-N 2.95Å; H370-Y374 VanDerWaalsContact O-CB 3.27Å; H370-Y374 WeakPolarHBondContact O-CB 3.19Å; H370-Y374 PolarHBondContact O-N 2.88Å
371	K	84.9	Confident	89.4	Confident	56 Å²	56	53.5 Å²	53.5	24%	0.243	28%	0.276	C	S	.	.	H	α-helix	trans	-53.8	-47	179.2	-75.3	-175.6	178.8	-164.6	0	109.8	D187 N367 N368 Y374 Y375	D187-K371 IonicContact OD2-NZ 2.84Å; D187-K371 PolarHBondContact OD2-NZ 3.11Å; N367-K371 WeakPolarHBondContact O-CB 3.38Å; N367-K371 WeakPolarHBondContact O-CG 3.37Å; N367-K371 PolarHBondContact O-N 3.45Å; N367-K371 WeakPolarHBondContact OD1-CE 3.12Å; N368-K371 PolarHBondContact O-N 3.49Å; K371-Y374 PolarHBondContact O-N 2.96Å; K371-Y375 HydrophobicContact CB-CD2 4.34Å; K371-Y375 HydrophobicContact CB-CE2 4.01Å; K371-Y375 WeakPolarHBondContact O-CD2 3.42Å; K371-Y375 PolarHBondContact O-N 3.04Å
372	F	84.5	Confident	89.4	Confident	36 Å²	36	48.2 Å²	48.2	16%	0.158	25%	0.249	C	C	.	.	H	α-helix	trans	-55.7	-59	177.3	-179.6	-116.8	0	0	0	114.4	Y34 L37 N368 H370 Y374 Y375 L376	Y34-F372 HydrophobicContact CD2-CB 3.62Å; Y34-F372 HydrophobicContact CD2-CD1 4.49Å; Y34-F372 AromaticContact CD2-CD2 3.33Å; Y34-F372 HydrophobicContact CD2-CD2 3.33Å; Y34-F372 AromaticContact CD2-CE2 3.97Å; Y34-F372 HydrophobicContact CD2-CE2 3.97Å; Y34-F372 AromaticContact CD2-CG 3.58Å; Y34-F372 HydrophobicContact CD2-CG 3.58Å; Y34-F372 HydrophobicContact CE2-CB 3.53Å; Y34-F372 AromaticContact CE2-CD2 3.52Å; Y34-F372 HydrophobicContact CE2-CD2 3.52Å; Y34-F372 HydrophobicContact CE2-CE2 4.45Å; Y34-F372 AromaticContact CE2-CG 3.85Å; Y34-F372 HydrophobicContact CE2-CG 3.85Å; L37-F372 HydrophobicContact CB-CE2 3.88Å; L37-F372 HydrophobicContact CB-CZ 3.7Å; L37-F372 HydrophobicContact CD2-CE1 4.15Å; L37-F372 HydrophobicContact CD2-CE2 3.6Å; L37-F372 HydrophobicContact CD2-CZ 3.14Å; L37-F372 HydrophobicContact CG-CE2 4.26Å; L37-F372 HydrophobicContact CG-CZ 3.94Å; N368-F372 VanDerWaalsContact O-CB 3.31Å; N368-F372 WeakPolarHBondContact O-CB 3.47Å; N368-F372 PolarHBondContact O-N 3.15Å; H370-F372 VanDerWaalsContact C-N 3.25Å; H370-F372 PolarHBondContact O-N 3.12Å; F372-Y374 VanDerWaalsContact C-N 3.27Å; F372-Y374 PolarHBondContact O-N 2.96Å; F372-Y375 PolarHBondContact O-N 2.87Å; F372-L376 HydrophobicContact CE1-CD2 4.43Å; F372-L376 VanDerWaalsContact O-CB 3.32Å; F372-L376 WeakPolarHBondContact O-CB 3.3Å; F372-L376 PolarHBondContact O-N 3.49Å
373	L	90	Very high	89.5	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.199	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-39.3	-175.8	-72.5	173.4	0	0	0	110.7	Y354 I365 M369 H370 L376 F377	Y354-L373 HydrophobicContact CD2-CB 4.05Å; Y354-L373 HydrophobicContact CD2-CD1 4.22Å; Y354-L373 HydrophobicContact CE2-CB 3.61Å; Y354-L373 HydrophobicContact CE2-CD1 3.69Å; Y354-L373 HydrophobicContact CE2-CG 4.31Å; I365-L373 HydrophobicContact CD1-CD1 4.48Å; M369-L373 HydrophobicContact CG-CD1 4.06Å; M369-L373 HydrophobicContact CG-CG 4.49Å; M369-L373 WeakPolarHBondContact O-CG 3.17Å; M369-L373 PolarHBondContact O-N 3.38Å; H370-L373 PolarHBondContact O-N 2.95Å; L373-L376 PolarHBondContact O-N 3.33Å; L373-F377 HydrophobicContact CB-CD2 4.43Å; L373-F377 HydrophobicContact CB-CE2 4.22Å; L373-F377 HydrophobicContact CD2-CE2 4.03Å; L373-F377 HydrophobicContact CD2-CZ 4.09Å; L373-F377 WeakPolarHBondContact O-CB 3.3Å; L373-F377 WeakPolarHBondContact O-CD2 3.41Å; L373-F377 WeakPolarHBondContact O-CG 3.25Å; L373-F377 PolarHBondContact O-N 3.22Å
374	Y	90.8	Very high	89.8	Confident	40 Å²	40	43.8 Å²	43.8	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-54.1	174.5	178.7	-101.8	0	0	0	111.3	L351 F355 H370 K371 F372 L376 F377 R378	L351-Y374 HydrophobicContact CD1-CD2 4.22Å; L351-Y374 HydrophobicContact CD1-CE2 4.5Å; F355-Y374 HydrophobicContact CE1-CD2 4.06Å; F355-Y374 HydrophobicContact CE1-CE2 4.02Å; F355-Y374 HydrophobicContact CZ-CD2 4.47Å; F355-Y374 HydrophobicContact CZ-CE2 4.01Å; H370-Y374 VanDerWaalsContact O-CB 3.27Å; H370-Y374 WeakPolarHBondContact O-CB 3.19Å; H370-Y374 PolarHBondContact O-N 2.88Å; K371-Y374 PolarHBondContact O-N 2.96Å; F372-Y374 VanDerWaalsContact C-N 3.27Å; F372-Y374 PolarHBondContact O-N 2.96Å; Y374-L376 VanDerWaalsContact C-N 3.34Å; Y374-L376 PolarHBondContact O-N 2.91Å; Y374-F377 PolarHBondContact O-N 2.94Å; Y374-R378 WeakPolarHBondContact O-CB 3.24Å; Y374-R378 PolarHBondContact O-N 2.71Å
375	Y	88.6	Confident	90	Very high	44 Å²	44	38.7 Å²	38.7	17%	0.173	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-41.1	179.2	-71.9	-59	0	0	0	112.4	W95 M96 K99 K371 F372 S379	W95-Y375 AromaticContact CH2-CE1 3.55Å; W95-Y375 HydrophobicContact CH2-CE1 3.55Å; W95-Y375 HydrophobicContact CZ2-CE1 4.22Å; W95-Y375 HydrophobicContact CZ3-CE1 4.14Å; M96-Y375 HydrophobicContact CG-CD1 4.5Å; M96-Y375 HydrophobicContact SD-CD1 4.44Å; K99-Y375 HydrophobicContact CD-CE1 4.29Å; K99-Y375 WeakPolarHBondContact CD-OH 3.36Å; K99-Y375 WeakPolarHBondContact CE-OH 3.5Å; K99-Y375 PolarHBondContact NZ-OH 3.37Å; K371-Y375 HydrophobicContact CB-CD2 4.34Å; K371-Y375 HydrophobicContact CB-CE2 4.01Å; K371-Y375 WeakPolarHBondContact O-CD2 3.42Å; K371-Y375 PolarHBondContact O-N 3.04Å; F372-Y375 PolarHBondContact O-N 2.87Å; Y375-S379 WeakPolarHBondContact O-CB 3.27Å; Y375-S379 PolarHBondContact O-N 2.93Å; Y375-S379 PolarHBondContact O-OG 3.43Å
376	L	90.7	Very high	90.3	Very high	25 Å²	25	37.3 Å²	37.3	13%	0.131	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-52.3	178.1	-179.2	63.8	0	0	0	111.1	L37 F41 F372 L373 Y374 S379 F380	L37-L376 HydrophobicContact CD2-CD1 4.08Å; L37-L376 HydrophobicContact CD2-CD2 4.01Å; F41-L376 HydrophobicContact CD2-CD1 3.7Å; F41-L376 HydrophobicContact CE2-CD1 3.82Å; F41-L376 HydrophobicContact CG-CD1 4.42Å; F372-L376 HydrophobicContact CE1-CD2 4.43Å; F372-L376 VanDerWaalsContact O-CB 3.32Å; F372-L376 WeakPolarHBondContact O-CB 3.3Å; F372-L376 PolarHBondContact O-N 3.49Å; L373-L376 PolarHBondContact O-N 3.33Å; Y374-L376 VanDerWaalsContact C-N 3.34Å; Y374-L376 PolarHBondContact O-N 2.91Å; L376-S379 PolarHBondContact O-N 3.39Å; L376-S379 PolarHBondContact O-OG 3.34Å; L376-F380 HydrophobicContact CD1-CE1 4.19Å; L376-F380 HydrophobicContact CD1-CZ 4.13Å; L376-F380 HydrophobicContact CG-CZ 4.46Å; L376-F380 PolarHBondContact O-N 2.95Å
377	F	94.1	Very high	90.5	Very high	43 Å²	43	35.2 Å²	35.2	19%	0.189	17%	0.172	C	C	.	.	H	α-helix	trans	-74.4	-32.5	-178.7	-60.8	-36.2	0	0	0	113.1	P350 L351 Y354 L373 Y374 S379 F380 C381	P350-F377 HydrophobicContact CB-CB 4.39Å; P350-F377 HydrophobicContact CB-CD1 3.55Å; P350-F377 HydrophobicContact CB-CE1 3.94Å; P350-F377 HydrophobicContact CB-CG 3.99Å; L351-F377 HydrophobicContact CB-CB 3.91Å; L351-F377 HydrophobicContact CD1-CB 3.84Å; L351-F377 HydrophobicContact CG-CB 4.47Å; Y354-F377 HydrophobicContact CD1-CD2 4.47Å; Y354-F377 HydrophobicContact CD2-CD2 4.23Å; Y354-F377 HydrophobicContact CD2-CE2 4.05Å; Y354-F377 AromaticContact CG-CD2 3.83Å; Y354-F377 HydrophobicContact CG-CD2 3.83Å; Y354-F377 HydrophobicContact CG-CE2 4.08Å; L373-F377 HydrophobicContact CB-CD2 4.43Å; L373-F377 HydrophobicContact CB-CE2 4.22Å; L373-F377 HydrophobicContact CD2-CE2 4.03Å; L373-F377 HydrophobicContact CD2-CZ 4.09Å; L373-F377 WeakPolarHBondContact O-CB 3.3Å; L373-F377 WeakPolarHBondContact O-CD2 3.41Å; L373-F377 WeakPolarHBondContact O-CG 3.25Å; L373-F377 PolarHBondContact O-N 3.22Å; Y374-F377 PolarHBondContact O-N 2.94Å; F377-S379 VanDerWaalsContact C-N 3.28Å; F377-S379 PolarHBondContact O-N 2.95Å; F377-F380 HydrophobicContact CD1-CD2 4.14Å; F377-F380 HydrophobicContact CD1-CE2 4.29Å; F377-F380 WeakPolarHBondContact O-CB 3.3Å; F377-F380 PolarHBondContact O-N 3.29Å; F377-C381 PolarHBondContact O-N 3.31Å; F377-C381 PolarHBondContact O-SG 3.37Å; F377-C381 VanDerWaalsContact O-SG 3.33Å
378	R	93.2	Very high	90.6	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-38.8	172.6	-172.5	65.8	167.5	-160.8	-10.1	111.3	E92 M96 N122 Y374 C381	E92-R378 IonicContact OE2-CZ 3.94Å; E92-R378 IonicContact OE2-NE 2.67Å; E92-R378 PolarHBondContact OE2-NE 3.34Å; E92-R378 VanDerWaalsContact OE2-NE 3.13Å; E92-R378 IonicContact OE2-NH2 3.02Å; E92-R378 PolarHBondContact OE2-NH2 3.5Å; E92-R378 VanDerWaalsContact OE2-NH2 3.13Å; M96-R378 HydrophobicContact SD-CG 4.38Å; N122-R378 PolarHBondContact OD1-NH2 3.4Å; Y374-R378 WeakPolarHBondContact O-CB 3.24Å; Y374-R378 PolarHBondContact O-N 2.71Å; R378-C381 VanDerWaalsContact O-CB 3.23Å; R378-C381 WeakPolarHBondContact O-CB 3.41Å; R378-C381 PolarHBondContact O-N 3.41Å
379	S	92.6	Very high	91	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.2	-34.1	176.5	78.5	0	0	0	0	113.4	F41 Y45 Y375 L376 F377 C381 L382	F41-S379 VanDerWaalsContact CE2-OG 3.3Å; F41-S379 WeakPolarHBondContact CE2-OG 3.37Å; F41-S379 WeakPolarHBondContact CZ-OG 2.79Å; Y45-S379 PolarHBondContact OH-O 3.49Å; Y375-S379 WeakPolarHBondContact O-CB 3.27Å; Y375-S379 PolarHBondContact O-N 2.93Å; Y375-S379 PolarHBondContact O-OG 3.43Å; L376-S379 PolarHBondContact O-N 3.39Å; L376-S379 PolarHBondContact O-OG 3.34Å; F377-S379 VanDerWaalsContact C-N 3.28Å; F377-S379 PolarHBondContact O-N 2.95Å; S379-C381 PolarHBondContact O-N 3.48Å; S379-L382 WeakPolarHBondContact O-CA 3.32Å; S379-L382 VanDerWaalsContact O-CB 3.22Å; S379-L382 WeakPolarHBondContact O-CB 3.22Å; S379-L382 PolarHBondContact O-N 3.04Å
380	F	94.5	Very high	91.2	Very high	66 Å²	66	29.4 Å²	29.4	29%	0.289	14%	0.138	S	C	.	.	H	α-helix	trans	-60.9	-33.1	172.9	-73	-8.8	0	0	0	111.2	S347 P350 L376 F377 L382 L383	S347-F380 VanDerWaalsContact CB-O 3.23Å; S347-F380 WeakPolarHBondContact CB-O 3.21Å; P350-F380 HydrophobicContact CB-CD2 4.39Å; P350-F380 HydrophobicContact CG-CD2 4.27Å; L376-F380 HydrophobicContact CD1-CE1 4.19Å; L376-F380 HydrophobicContact CD1-CZ 4.13Å; L376-F380 HydrophobicContact CG-CZ 4.46Å; L376-F380 PolarHBondContact O-N 2.95Å; F377-F380 HydrophobicContact CD1-CD2 4.14Å; F377-F380 HydrophobicContact CD1-CE2 4.29Å; F377-F380 WeakPolarHBondContact O-CB 3.3Å; F377-F380 PolarHBondContact O-N 3.29Å; F380-L382 PolarHBondContact O-N 2.85Å; F380-L383 HydrophobicContact CD1-CD1 4.38Å; F380-L383 WeakPolarHBondContact O-CB 3.47Å; F380-L383 PolarHBondContact O-N 2.84Å
381	C	95.7	Very high	91.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.6	-28.7	173.5	-57.1	0	0	0	0	112.1	F125 F377 R378 S379 L383 S384	F125-C381 HydrophobicContact CE1-CB 4.21Å; F377-C381 PolarHBondContact O-N 3.31Å; F377-C381 PolarHBondContact O-SG 3.37Å; F377-C381 VanDerWaalsContact O-SG 3.33Å; R378-C381 VanDerWaalsContact O-CB 3.23Å; R378-C381 WeakPolarHBondContact O-CB 3.41Å; R378-C381 PolarHBondContact O-N 3.41Å; S379-C381 PolarHBondContact O-N 3.48Å; C381-L383 PolarHBondContact O-N 2.88Å; C381-S384 WeakPolarHBondContact O-CB 3.43Å; C381-S384 PolarHBondContact O-N 3.35Å; C381-S384 VanDerWaalsContact O-N 3.17Å; C381-S384 PolarHBondContact O-OG 3.27Å
382	L	95.1	Very high	91	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.9	-17	173	-58.9	-174.7	0	0	0	113.5	L46 V49 I88 L89 M96 F125 S379 F380 S384 T385 C386	L46-L382 HydrophobicContact CD1-CD1 4.11Å; V49-L382 HydrophobicContact CG1-CB 3.94Å; I88-L382 HydrophobicContact CG2-CD2 3.75Å; L89-L382 HydrophobicContact CD2-CB 4.49Å; L89-L382 HydrophobicContact CD2-CD2 4.38Å; M96-L382 HydrophobicContact CE-CD1 3.24Å; M96-L382 HydrophobicContact CE-CD2 4.29Å; M96-L382 HydrophobicContact CE-CG 3.83Å; F125-L382 HydrophobicContact CZ-CD2 4.16Å; S379-L382 WeakPolarHBondContact O-CA 3.32Å; S379-L382 VanDerWaalsContact O-CB 3.22Å; S379-L382 WeakPolarHBondContact O-CB 3.22Å; S379-L382 PolarHBondContact O-N 3.04Å; F380-L382 PolarHBondContact O-N 2.85Å; L382-S384 PolarHBondContact O-N 3.39Å; L382-T385 PolarHBondContact O-N 3.35Å; L382-T385 PolarHBondContact O-OG1 3.3Å; L382-C386 WeakPolarHBondContact O-CB 3.23Å; L382-C386 PolarHBondContact O-N 2.72Å
383	L	93.7	Very high	90.8	Very high	56 Å²	56	27.3 Å²	27.3	29%	0.293	13%	0.131	S	C	.	.	H	α-helix	trans	-64.9	-32.5	172	-65.8	169.3	0	0	0	111.3	Y45 V49 F380 C381 T385 C386 T387	Y45-L383 HydrophobicContact CE2-CD2 4.19Å; Y45-L383 WeakPolarHBondContact OH-CD1 3.34Å; Y45-L383 WeakPolarHBondContact OH-CG 3.33Å; V49-L383 HydrophobicContact CG2-CD2 3.87Å; F380-L383 HydrophobicContact CD1-CD1 4.38Å; F380-L383 WeakPolarHBondContact O-CB 3.47Å; F380-L383 PolarHBondContact O-N 2.84Å; C381-L383 PolarHBondContact O-N 2.88Å; L383-T385 VanDerWaalsContact C-N 3.34Å; L383-T385 PolarHBondContact O-N 2.82Å; L383-C386 PolarHBondContact O-N 2.86Å; L383-T387 WeakPolarHBondContact O-CB 2.9Å; L383-T387 WeakPolarHBondContact O-CG2 3.43Å; L383-T387 PolarHBondContact O-N 2.88Å; L383-T387 PolarHBondContact O-OG1 3.37Å
384	S	93.6	Very high	90.4	Very high	10 Å²	10	30 Å²	30	7%	0.07	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-43.8	176	69.4	0	0	0	0	111.4	S347 C381 L382 T387 N388	S347-S384 WeakPolarHBondContact OG-CB 3.46Å; C381-S384 WeakPolarHBondContact O-CB 3.43Å; C381-S384 PolarHBondContact O-N 3.35Å; C381-S384 VanDerWaalsContact O-N 3.17Å; C381-S384 PolarHBondContact O-OG 3.27Å; L382-S384 PolarHBondContact O-N 3.39Å; S384-T387 PolarHBondContact O-OG1 3.24Å; S384-N388 PolarHBondContact O-ND2 3.21Å; S384-N388 PolarHBondContact O-OD1 2.65Å
385	T	92.9	Very high	89.6	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-71	-36.5	178.7	64.8	0	0	0	0	111.5	D85 I88 L382 L383	D85-T385 HydrophobicContact CB-CG2 4.1Å; I88-T385 HydrophobicContact CB-CG2 4.18Å; I88-T385 HydrophobicContact CD1-CG2 3.94Å; I88-T385 HydrophobicContact CG2-CG2 3.98Å; L382-T385 PolarHBondContact O-N 3.35Å; L382-T385 PolarHBondContact O-OG1 3.3Å; L383-T385 VanDerWaalsContact C-N 3.34Å; L383-T385 PolarHBondContact O-N 2.82Å
386	C	92.4	Very high	88.7	Confident	8 Å²	8	27.7 Å²	27.7	5%	0.054	15%	0.147	C	C	.	.	H	α-helix	trans	-75.3	-26.5	-179.3	-178.6	0	0	0	0	114.4	V49 G53 L382 L383 W389	V49-C386 HydrophobicContact CG1-CB 3.99Å; V49-C386 PolarHBondContact O-SG 3.13Å; G53-C386 PolarHBondContact N-SG 3.47Å; G53-C386 VanDerWaalsContact N-SG 3.44Å; L382-C386 WeakPolarHBondContact O-CB 3.23Å; L382-C386 PolarHBondContact O-N 2.72Å; L383-C386 PolarHBondContact O-N 2.86Å; C386-W389 PolarHBondContact O-NE1 3.09Å
387	T	92.7	Very high	88.2	Confident	26 Å²	26	33 Å²	33	16%	0.16	17%	0.17	C	C	.	.	H	α-helix	trans	-93	-14.6	-171.2	52	0	0	0	0	114.2	V343 L383 S384 W389 I390 F391	V343-T387 HydrophobicContact CG1-CG2 4.43Å; V343-T387 VanDerWaalsContact CG1-OG1 3.32Å; V343-T387 WeakPolarHBondContact CG1-OG1 3.25Å; L383-T387 WeakPolarHBondContact O-CB 2.9Å; L383-T387 WeakPolarHBondContact O-CG2 3.43Å; L383-T387 PolarHBondContact O-N 2.88Å; L383-T387 PolarHBondContact O-OG1 3.37Å; S384-T387 PolarHBondContact O-OG1 3.24Å; T387-W389 VanDerWaalsContact C-N 3.3Å; T387-W389 PolarHBondContact O-N 3.24Å; T387-I390 WeakPolarHBondContact O-CB 3.18Å; T387-I390 PolarHBondContact O-N 3.2Å; T387-F391 WeakPolarHBondContact O-CD2 3.17Å; T387-F391 PolarHBondContact O-N 3.18Å
388	N	87.9	Confident	87.1	Confident	7 Å²	7	37 Å²	37	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-57.3	-41	-174.7	-79.2	-19.8	0	0	0	113.1	D85 M340 S384 I390 F391 Y392	D85-N388 PolarHBondContact OD2-ND2 2.88Å; M340-N388 HydrophobicContact CE-CB 3.62Å; M340-N388 WeakPolarHBondContact CE-O 3.41Å; M340-N388 WeakPolarHBondContact CE-OD1 3.41Å; S384-N388 PolarHBondContact O-ND2 3.21Å; S384-N388 PolarHBondContact O-OD1 2.65Å; N388-I390 VanDerWaalsContact C-N 3.33Å; N388-I390 PolarHBondContact O-N 3.34Å; N388-F391 PolarHBondContact O-N 3.18Å; N388-Y392 HydrophobicContact CB-CE2 4.19Å; N388-Y392 WeakPolarHBondContact O-CD2 3.48Å; N388-Y392 WeakPolarHBondContact O-CE2 3.43Å; N388-Y392 PolarHBondContact O-N 2.83Å
389	W	88.9	Confident	86	Confident	66 Å²	66	37 Å²	37	25%	0.25	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-34.7	176.4	77.6	-87.7	0	0	0	114	G56 F59 C60 C386 T387 F391 Y392 C393	G56-W389 VanDerWaalsContact O-CB 3.29Å; G56-W389 WeakPolarHBondContact O-CB 3.47Å; F59-W389 HydrophobicContact CD1-CE3 4.49Å; C60-W389 HydrophobicContact CB-CB 4.06Å; C386-W389 PolarHBondContact O-NE1 3.09Å; T387-W389 VanDerWaalsContact C-N 3.3Å; T387-W389 PolarHBondContact O-N 3.24Å; W389-F391 VanDerWaalsContact C-N 3.31Å; W389-F391 PolarHBondContact O-N 2.9Å; W389-Y392 PolarHBondContact O-N 3.38Å; W389-C393 PolarHBondContact O-N 2.67Å; W389-C393 PolarHBondContact O-SG 2.88Å
390	I	90.7	Very high	85.4	Confident	69 Å²	69	42.5 Å²	42.5	35%	0.354	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-42.8	178	-57.4	176.7	0	0	0	109.4	T387 N388 Y392 C393 V394	T387-I390 WeakPolarHBondContact O-CB 3.18Å; T387-I390 PolarHBondContact O-N 3.2Å; N388-I390 VanDerWaalsContact C-N 3.33Å; N388-I390 PolarHBondContact O-N 3.34Å; I390-Y392 PolarHBondContact O-N 3.01Å; I390-C393 WeakPolarHBondContact O-CB 3.27Å; I390-C393 PolarHBondContact O-N 2.77Å; I390-V394 HydrophobicContact CG2-CG2 4.17Å; I390-V394 VanDerWaalsContact O-CG2 3.31Å; I390-V394 WeakPolarHBondContact O-CG2 3.28Å; I390-V394 PolarHBondContact O-N 3.45Å
391	F	87.4	Confident	84.8	Confident	39 Å²	39	42.7 Å²	42.7	17%	0.171	21%	0.212	C	C	.	.	H	α-helix	trans	-64.7	-41.4	178.4	-65.5	-52.7	0	0	0	112	L336 C339 M340 V343 T387 N388 W389 C393 V394 A395	L336-F391 HydrophobicContact CD1-CB 3.53Å; L336-F391 WeakPolarHBondContact CD1-O 3.35Å; C339-F391 HydrophobicContact CB-CD1 3.59Å; C339-F391 HydrophobicContact CB-CD2 4.46Å; C339-F391 HydrophobicContact CB-CE1 3.63Å; C339-F391 HydrophobicContact CB-CE2 4.47Å; C339-F391 HydrophobicContact CB-CG 4.05Å; C339-F391 HydrophobicContact CB-CZ 4.09Å; M340-F391 HydrophobicContact CE-CB 4.35Å; M340-F391 HydrophobicContact CG-CB 4.37Å; M340-F391 HydrophobicContact CG-CD2 3.96Å; M340-F391 HydrophobicContact CG-CG 4.46Å; V343-F391 HydrophobicContact CB-CE2 4.04Å; V343-F391 HydrophobicContact CB-CZ 4.37Å; V343-F391 HydrophobicContact CG2-CE2 3.51Å; V343-F391 HydrophobicContact CG2-CZ 3.36Å; T387-F391 WeakPolarHBondContact O-CD2 3.17Å; T387-F391 PolarHBondContact O-N 3.18Å; N388-F391 PolarHBondContact O-N 3.18Å; W389-F391 VanDerWaalsContact C-N 3.31Å; W389-F391 PolarHBondContact O-N 2.9Å; F391-C393 VanDerWaalsContact C-N 3.26Å; F391-C393 PolarHBondContact O-N 3.15Å; F391-V394 PolarHBondContact O-N 3.34Å; F391-A395 VanDerWaalsContact O-CB 3.31Å; F391-A395 WeakPolarHBondContact O-CB 3.18Å; F391-A395 PolarHBondContact O-N 3.46Å
392	Y	81.5	Confident	84	Confident	6 Å²	6	50.3 Å²	50.3	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-40.6	174.2	-60.8	-58.9	0	0	0	111.3	C60 L78 L336 M340 N388 W389 I390 F399	C60-Y392 HydrophobicContact CB-CD2 4.45Å; C60-Y392 WeakPolarHBondContact SG-CD2 3.41Å; C60-Y392 WeakPolarHBondContact SG-CE2 3.18Å; L78-Y392 HydrophobicContact CD1-CE1 4.1Å; L78-Y392 HydrophobicContact CD2-CE1 3.94Å; L78-Y392 WeakPolarHBondContact CD2-OH 3.44Å; L78-Y392 HydrophobicContact CG-CE1 4.46Å; L336-Y392 HydrophobicContact CD1-CD1 3.84Å; L336-Y392 HydrophobicContact CD1-CE1 4.42Å; L336-Y392 HydrophobicContact CD1-CG 4.41Å; L336-Y392 HydrophobicContact CD2-CD1 3.63Å; L336-Y392 HydrophobicContact CD2-CE1 3.68Å; L336-Y392 HydrophobicContact CG-CD1 4.3Å; L336-Y392 HydrophobicContact CG-CE1 4.48Å; M340-Y392 HydrophobicContact CE-CD1 4.16Å; M340-Y392 HydrophobicContact CE-CD2 4.1Å; M340-Y392 HydrophobicContact CE-CE1 3.56Å; M340-Y392 HydrophobicContact CE-CE2 3.44Å; M340-Y392 VanDerWaalsContact CE-CE2 3.44Å; M340-Y392 HydrophobicContact CE-CG 4.4Å; M340-Y392 VanDerWaalsContact CE-OH 3.29Å; M340-Y392 WeakPolarHBondContact CE-OH 3.2Å; M340-Y392 HydrophobicContact SD-CE1 4.37Å; N388-Y392 HydrophobicContact CB-CE2 4.19Å; N388-Y392 WeakPolarHBondContact O-CD2 3.48Å; N388-Y392 WeakPolarHBondContact O-CE2 3.43Å; N388-Y392 PolarHBondContact O-N 2.83Å; W389-Y392 PolarHBondContact O-N 3.38Å; I390-Y392 PolarHBondContact O-N 3.01Å; Y392-F399 VanDerWaalsContact O-CD2 3.25Å; Y392-F399 WeakPolarHBondContact O-CD2 3.4Å; Y392-F399 WeakPolarHBondContact O-CG 3.33Å
393	C	80.3	Confident	83.2	Confident	27 Å²	27	51.1 Å²	51.1	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-45.8	174.9	-68.3	0	0	0	0	113.9	W389 I390 F391 F399 R400	W389-C393 PolarHBondContact O-N 2.67Å; W389-C393 PolarHBondContact O-SG 2.88Å; I390-C393 WeakPolarHBondContact O-CB 3.27Å; I390-C393 PolarHBondContact O-N 2.77Å; F391-C393 VanDerWaalsContact C-N 3.26Å; F391-C393 PolarHBondContact O-N 3.15Å; C393-F399 VanDerWaalsContact CA-CE1 3.43Å; C393-F399 HydrophobicContact CB-CD1 4.39Å; C393-F399 HydrophobicContact CB-CE1 3.93Å; C393-F399 WeakPolarHBondContact SG-CE1 3.39Å; C393-R400 WeakPolarHBondContact O-CG 3.26Å
394	V	81.4	Confident	82.9	Confident	96 Å²	96	54.7 Å²	54.7	58%	0.582	26%	0.258	S	S	*	.	H	α-helix	trans	-73.8	-42.5	-173.9	171.9	0	0	0	0	111.4	I390 F391 G396 R400	I390-V394 HydrophobicContact CG2-CG2 4.17Å; I390-V394 VanDerWaalsContact O-CG2 3.31Å; I390-V394 WeakPolarHBondContact O-CG2 3.28Å; I390-V394 PolarHBondContact O-N 3.45Å; F391-V394 PolarHBondContact O-N 3.34Å; V394-G396 PolarHBondContact O-N 2.66Å; V394-R400 PolarHBondContact O-NH1 2.84Å; V394-R400 VanDerWaalsContact O-NH1 3.08Å
395	A	74.3	Confident	82.4	Confident	28 Å²	28	59.3 Å²	59.3	23%	0.231	28%	0.279	C	S	.	.	H	α-helix	trans	-70.7	-26.2	-169.9	0	0	0	0	0	114.4	H332 L336 F391	H332-A395 PolarHBondContact ND1-O 3.06Å; L336-A395 HydrophobicContact CB-CB 3.94Å; L336-A395 HydrophobicContact CD1-CB 3.76Å; L336-A395 HydrophobicContact CG-CB 4.46Å; F391-A395 VanDerWaalsContact O-CB 3.31Å; F391-A395 WeakPolarHBondContact O-CB 3.18Å; F391-A395 PolarHBondContact O-N 3.46Å
396	G	69.6	Low	81.8	Confident	6 Å²	6	61.7 Å²	61.7	6%	0.062	29%	0.291	C	S	.	.			trans	-108.8	111.3	-174.5	0	0	0	0	0	113.6	V394 K398 F399 R400	V394-G396 PolarHBondContact O-N 2.66Å; G396-K398 VanDerWaalsContact C-N 3.27Å; G396-K398 PolarHBondContact O-N 3.29Å; G396-F399 WeakPolarHBondContact O-CA 3Å; G396-F399 VanDerWaalsContact O-CB 3.26Å; G396-F399 WeakPolarHBondContact O-CB 3.09Å; G396-F399 PolarHBondContact O-N 3.33Å; G396-F399 VanDerWaalsContact O-N 3.1Å; G396-R400 WeakPolarHBondContact O-CG 3.38Å; G396-R400 PolarHBondContact O-N 3.33Å
397	K	79.1	Confident	81.4	Confident	138 Å²	138	65.5 Å²	65.5	60%	0.6	31%	0.311	S	S	*	.	H	α-helix	trans	-57.3	-47.4	161.8	-177.6	179.9	177.3	-179.2	0	110	F399 R400 D401	K397-F399 VanDerWaalsContact C-N 3.26Å; K397-F399 PolarHBondContact O-N 3.2Å; K397-R400 PolarHBondContact O-N 3.44Å; K397-R400 VanDerWaalsContact O-N 3.15Å; K397-D401 PolarHBondContact O-N 2.95Å
398	K	71.7	Confident	81	Confident	125 Å²	125	69.1 Å²	69.1	54%	0.543	33%	0.329	S	S	.	.	H	α-helix	trans	-58.9	-36.9	172.4	-70.4	-177.7	-179.4	171.3	0	112.3	M69 G396 D401 R402	M69-K398 HydrophobicContact SD-CB 4.18Å; G396-K398 VanDerWaalsContact C-N 3.27Å; G396-K398 PolarHBondContact O-N 3.29Å; K398-D401 PolarHBondContact O-N 2.76Å; K398-R402 WeakPolarHBondContact O-CB 2.89Å; K398-R402 VanDerWaalsContact O-CG 3.26Å; K398-R402 WeakPolarHBondContact O-CG 3.31Å; K398-R402 PolarHBondContact O-N 3.49Å
399	F	69.8	Low	80.6	Confident	3 Å²	3	72.6 Å²	72.6	1%	0.013	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-54.8	173.4	-179.2	-73	0	0	0	109.9	F59 F63 Y392 C393 G396 K397 D401 R402 T403	F59-F399 HydrophobicContact CE1-CE1 4.05Å; F59-F399 AromaticContact CE1-CZ 3.73Å; F59-F399 HydrophobicContact CE1-CZ 3.73Å; F59-F399 HydrophobicContact CZ-CE1 4.3Å; F59-F399 HydrophobicContact CZ-CZ 4.19Å; F63-F399 HydrophobicContact CB-CE2 4.37Å; F63-F399 AromaticContact CD1-CD2 3.74Å; F63-F399 HydrophobicContact CD1-CD2 3.74Å; F63-F399 AromaticContact CD1-CE2 3.22Å; F63-F399 HydrophobicContact CD1-CE2 3.22Å; F63-F399 HydrophobicContact CD1-CZ 4.15Å; F63-F399 AromaticContact CD2-CD2 3.94Å; F63-F399 HydrophobicContact CD2-CD2 3.94Å; F63-F399 HydrophobicContact CD2-CE1 4.49Å; F63-F399 AromaticContact CD2-CE2 3.54Å; F63-F399 HydrophobicContact CD2-CE2 3.54Å; F63-F399 AromaticContact CD2-CZ 3.84Å; F63-F399 HydrophobicContact CD2-CZ 3.84Å; F63-F399 AromaticContact CE1-CD2 3.17Å; F63-F399 HydrophobicContact CE1-CD2 3.17Å; F63-F399 AromaticContact CE1-CE2 3.22Å; F63-F399 HydrophobicContact CE1-CE2 3.22Å; F63-F399 HydrophobicContact CE1-CG 4.31Å; F63-F399 HydrophobicContact CE1-CZ 4.39Å; F63-F399 HydrophobicContact CE2-CB 4.48Å; F63-F399 HydrophobicContact CE2-CD1 4.4Å; F63-F399 AromaticContact CE2-CD2 3.38Å; F63-F399 HydrophobicContact CE2-CD2 3.38Å; F63-F399 HydrophobicContact CE2-CE1 4.5Å; F63-F399 AromaticContact CE2-CE2 3.51Å; F63-F399 HydrophobicContact CE2-CE2 3.51Å; F63-F399 AromaticContact CE2-CG 3.84Å; F63-F399 HydrophobicContact CE2-CG 3.84Å; F63-F399 HydrophobicContact CE2-CZ 4.08Å; F63-F399 HydrophobicContact CG-CD2 4.1Å; F63-F399 AromaticContact CG-CE2 3.4Å; F63-F399 HydrophobicContact CG-CE2 3.4Å; F63-F399 VanDerWaalsContact CG-CE2 3.4Å; F63-F399 AromaticContact CG-CZ 3.88Å; F63-F399 HydrophobicContact CG-CZ 3.88Å; F63-F399 HydrophobicContact CZ-CB 4.17Å; F63-F399 AromaticContact CZ-CD2 2.98Å; F63-F399 HydrophobicContact CZ-CD2 2.98Å; F63-F399 AromaticContact CZ-CE2 3.38Å; F63-F399 HydrophobicContact CZ-CE2 3.38Å; F63-F399 AromaticContact CZ-CG 3.72Å; F63-F399 HydrophobicContact CZ-CG 3.72Å; F63-F399 HydrophobicContact CZ-CZ 4.37Å; Y392-F399 VanDerWaalsContact O-CD2 3.25Å; Y392-F399 WeakPolarHBondContact O-CD2 3.4Å; Y392-F399 WeakPolarHBondContact O-CG 3.33Å; C393-F399 VanDerWaalsContact CA-CE1 3.43Å; C393-F399 HydrophobicContact CB-CD1 4.39Å; C393-F399 HydrophobicContact CB-CE1 3.93Å; C393-F399 WeakPolarHBondContact SG-CE1 3.39Å; G396-F399 WeakPolarHBondContact O-CA 3Å; G396-F399 VanDerWaalsContact O-CB 3.26Å; G396-F399 WeakPolarHBondContact O-CB 3.09Å; G396-F399 PolarHBondContact O-N 3.33Å; G396-F399 VanDerWaalsContact O-N 3.1Å; K397-F399 VanDerWaalsContact C-N 3.26Å; K397-F399 PolarHBondContact O-N 3.2Å; F399-D401 VanDerWaalsContact C-N 3.27Å; F399-D401 PolarHBondContact O-N 2.99Å; F399-R402 PolarHBondContact O-N 2.95Å; F399-R402 VanDerWaalsContact O-N 3.1Å; F399-T403 WeakPolarHBondContact CD1-OG1 3.2Å; F399-T403 WeakPolarHBondContact CE1-OG1 2.98Å; F399-T403 WeakPolarHBondContact O-CB 3.5Å; F399-T403 PolarHBondContact O-N 3.45Å; F399-T403 PolarHBondContact O-OG1 2.82Å; F399-T403 VanDerWaalsContact O-OG1 3.08Å
400	R	79.9	Confident	80.2	Confident	115 Å²	115	74.7 Å²	74.7	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-57.6	-40.9	179.2	-66	-168.8	-58.2	-94.5	7.4	112	C393 V394 G396 K397 T403 K404	C393-R400 WeakPolarHBondContact O-CG 3.26Å; V394-R400 PolarHBondContact O-NH1 2.84Å; V394-R400 VanDerWaalsContact O-NH1 3.08Å; G396-R400 WeakPolarHBondContact O-CG 3.38Å; G396-R400 PolarHBondContact O-N 3.33Å; K397-R400 PolarHBondContact O-N 3.44Å; K397-R400 VanDerWaalsContact O-N 3.15Å; R400-T403 PolarHBondContact O-N 3.33Å; R400-K404 WeakPolarHBondContact O-CB 3.15Å; R400-K404 VanDerWaalsContact O-CG 3.23Å; R400-K404 WeakPolarHBondContact O-CG 2.99Å; R400-K404 PolarHBondContact O-N 3.36Å
401	D	83.1	Confident	79.9	Confident	69 Å²	69	75.7 Å²	75.7	37%	0.369	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-41.8	178	-63.1	-22.9	0	0	0	111.5	K397 K398 F399 Q405	K397-D401 PolarHBondContact O-N 2.95Å; K398-D401 PolarHBondContact O-N 2.76Å; F399-D401 VanDerWaalsContact C-N 3.27Å; F399-D401 PolarHBondContact O-N 2.99Å; D401-Q405 WeakPolarHBondContact O-CG 3.05Å; D401-Q405 PolarHBondContact O-N 2.82Å
402	R	78.4	Confident	79.4	Confident	161 Å²	161	78.3 Å²	78.3	61%	0.608	40%	0.397	S	S	*	.	H	α-helix	trans	-70	-40.4	175.9	-72.2	-62.8	-169.6	176	5.7	112.9	F63 K398 F399 Q405 L406	F63-R402 HydrophobicContact CE2-CB 4.21Å; K398-R402 WeakPolarHBondContact O-CB 2.89Å; K398-R402 VanDerWaalsContact O-CG 3.26Å; K398-R402 WeakPolarHBondContact O-CG 3.31Å; K398-R402 PolarHBondContact O-N 3.49Å; F399-R402 PolarHBondContact O-N 2.95Å; F399-R402 VanDerWaalsContact O-N 3.1Å; R402-Q405 VanDerWaalsContact NH1-OE1 3.1Å; R402-Q405 WeakPolarHBondContact O-CB 3.11Å; R402-Q405 PolarHBondContact O-N 3.27Å; R402-L406 WeakPolarHBondContact O-CB 3.18Å; R402-L406 PolarHBondContact O-N 2.81Å
403	T	78.5	Confident	78.6	Confident	17 Å²	17	81.1 Å²	81.1	10%	0.104	42%	0.417	C	S	.	.	H	α-helix	trans	-62.6	-44.1	174.6	-65.6	0	0	0	0	110.9	F59 F399 R400 Q405 L406 L407	F59-T403 HydrophobicContact CE1-CG2 4.43Å; F59-T403 HydrophobicContact CE2-CG2 3.99Å; F59-T403 HydrophobicContact CZ-CG2 3.42Å; F59-T403 VanDerWaalsContact CZ-CG2 3.42Å; F399-T403 WeakPolarHBondContact CD1-OG1 3.2Å; F399-T403 WeakPolarHBondContact CE1-OG1 2.98Å; F399-T403 WeakPolarHBondContact O-CB 3.5Å; F399-T403 PolarHBondContact O-N 3.45Å; F399-T403 PolarHBondContact O-OG1 2.82Å; F399-T403 VanDerWaalsContact O-OG1 3.08Å; R400-T403 PolarHBondContact O-N 3.33Å; T403-Q405 VanDerWaalsContact C-N 3.33Å; T403-Q405 PolarHBondContact O-N 3.16Å; T403-L406 PolarHBondContact O-N 3.4Å; T403-L407 HydrophobicContact CG2-CD1 3.87Å; T403-L407 HydrophobicContact CG2-CG 4.36Å; T403-L407 WeakPolarHBondContact O-CB 3.29Å; T403-L407 WeakPolarHBondContact O-CG 3.39Å; T403-L407 PolarHBondContact O-N 3.21Å
404	K	86	Confident	77.6	Confident	130 Å²	130	87 Å²	87	57%	0.565	45%	0.447	S	S	*	.	H	α-helix	trans	-58.1	-45.9	171.7	-76.9	176.5	179.7	-172.8	0	111.1	R400 L406 L408	R400-K404 WeakPolarHBondContact O-CB 3.15Å; R400-K404 VanDerWaalsContact O-CG 3.23Å; R400-K404 WeakPolarHBondContact O-CG 2.99Å; R400-K404 PolarHBondContact O-N 3.36Å; K404-L406 VanDerWaalsContact C-N 3.35Å; K404-L406 PolarHBondContact O-N 3.23Å; K404-L408 WeakPolarHBondContact O-CB 3.23Å; K404-L408 WeakPolarHBondContact O-CG 3.46Å; K404-L408 PolarHBondContact O-N 3.27Å
405	Q	84.1	Confident	76.6	Confident	108 Å²	108	89.6 Å²	89.6	51%	0.505	45%	0.45	S	S	.	.	H	α-helix	trans	-60.1	-42.4	175.8	-75.2	174.7	-2.2	0	0	112.5	D401 R402 T403 S409	D401-Q405 WeakPolarHBondContact O-CG 3.05Å; D401-Q405 PolarHBondContact O-N 2.82Å; R402-Q405 VanDerWaalsContact NH1-OE1 3.1Å; R402-Q405 WeakPolarHBondContact O-CB 3.11Å; R402-Q405 PolarHBondContact O-N 3.27Å; T403-Q405 VanDerWaalsContact C-N 3.33Å; T403-Q405 PolarHBondContact O-N 3.16Å; Q405-S409 VanDerWaalsContact O-CB 3.3Å; Q405-S409 WeakPolarHBondContact O-CB 3.37Å; Q405-S409 PolarHBondContact O-N 3Å
406	L	80.1	Confident	75.9	Confident	52 Å²	52	92.2 Å²	92.2	27%	0.272	46%	0.46	S	S	.	.	H	α-helix	trans	-69.5	-44.6	-179.6	-170.2	144.1	0	0	0	111.7	R402 T403 K404 S409 L410	R402-L406 WeakPolarHBondContact O-CB 3.18Å; R402-L406 PolarHBondContact O-N 2.81Å; T403-L406 PolarHBondContact O-N 3.4Å; K404-L406 VanDerWaalsContact C-N 3.35Å; K404-L406 PolarHBondContact O-N 3.23Å; L406-S409 WeakPolarHBondContact O-CB 3.34Å; L406-S409 PolarHBondContact O-N 3.37Å; L406-L410 HydrophobicContact CD2-CD1 3.67Å; L406-L410 HydrophobicContact CD2-CG 4.37Å; L406-L410 WeakPolarHBondContact O-CG 3.26Å; L406-L410 PolarHBondContact O-N 3.38Å
407	L	83.4	Confident	75.3	Confident	88 Å²	88	94.7 Å²	94.7	46%	0.461	48%	0.476	S	S	.	.	H	α-helix	trans	-62.2	-44.9	173.8	-74.1	171	0	0	0	111.5	T403 S409 L410 C411	T403-L407 HydrophobicContact CG2-CD1 3.87Å; T403-L407 HydrophobicContact CG2-CG 4.36Å; T403-L407 WeakPolarHBondContact O-CB 3.29Å; T403-L407 WeakPolarHBondContact O-CG 3.39Å; T403-L407 PolarHBondContact O-N 3.21Å; L407-S409 VanDerWaalsContact C-N 3.29Å; L407-S409 PolarHBondContact O-N 3.12Å; L407-L410 PolarHBondContact O-N 2.92Å; L407-C411 WeakPolarHBondContact O-CB 3.29Å; L407-C411 PolarHBondContact O-N 3.4Å; L407-C411 PolarHBondContact O-SG 3Å
408	L	85.6	Confident	74.3	Confident	102 Å²	102	93.2 Å²	93.2	53%	0.534	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-38.1	174.6	-73.2	171	0	0	0	111.5	K404 N412	K404-L408 WeakPolarHBondContact O-CB 3.23Å; K404-L408 WeakPolarHBondContact O-CG 3.46Å; K404-L408 PolarHBondContact O-N 3.27Å; L408-N412 WeakPolarHBondContact O-CB 3.47Å; L408-N412 VanDerWaalsContact O-CG 3.23Å; L408-N412 PolarHBondContact O-N 3.33Å; L408-N412 PolarHBondContact O-ND2 2.85Å
409	S	79.4	Confident	74.1	Confident	80 Å²	80	90.4 Å²	90.4	56%	0.559	47%	0.467	S	S	*	.	H	α-helix	trans	-64.4	-41.4	175	-172.8	0	0	0	0	111.8	Q405 L406 L407 S413	Q405-S409 VanDerWaalsContact O-CB 3.3Å; Q405-S409 WeakPolarHBondContact O-CB 3.37Å; Q405-S409 PolarHBondContact O-N 3Å; L406-S409 WeakPolarHBondContact O-CB 3.34Å; L406-S409 PolarHBondContact O-N 3.37Å; L407-S409 VanDerWaalsContact C-N 3.29Å; L407-S409 PolarHBondContact O-N 3.12Å; S409-S413 WeakPolarHBondContact O-CB 3.5Å; S409-S413 PolarHBondContact O-N 2.87Å
410	L	79.4	Confident	74.1	Confident	110 Å²	110	96 Å²	96	58%	0.576	50%	0.496	S	S	*	.	H	α-helix	trans	-68.1	-43.9	176.6	-70.8	171.6	0	0	0	111.5	L406 L407 S413	L406-L410 HydrophobicContact CD2-CD1 3.67Å; L406-L410 HydrophobicContact CD2-CG 4.37Å; L406-L410 WeakPolarHBondContact O-CG 3.26Å; L406-L410 PolarHBondContact O-N 3.38Å; L407-L410 PolarHBondContact O-N 2.92Å; L410-S413 PolarHBondContact O-N 2.91Å
411	C	84	Confident	74	Confident	90 Å²	90	93.5 Å²	93.5	61%	0.608	49%	0.491	S	S	*	.	H	α-helix	trans	-67.1	-37.7	176.8	-66.9	0	0	0	0	112.7	L407	L407-C411 WeakPolarHBondContact O-CB 3.29Å; L407-C411 PolarHBondContact O-N 3.4Å; L407-C411 PolarHBondContact O-SG 3Å
412	N	78.1	Confident	73.9	Confident	94 Å²	94	99.4 Å²	99.4	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-81.9	-14.1	178.5	-71.8	-17.3	0	0	0	113.3	L408 N414 K415	L408-N412 WeakPolarHBondContact O-CB 3.47Å; L408-N412 VanDerWaalsContact O-CG 3.23Å; L408-N412 PolarHBondContact O-N 3.33Å; L408-N412 PolarHBondContact O-ND2 2.85Å; N412-N414 PolarHBondContact O-N 3.34Å; N412-N414 VanDerWaalsContact O-N 3.08Å; N412-K415 PolarHBondContact O-N 3.26Å
413	S	63.8	Low	74	Confident	64 Å²	64	97.4 Å²	97.4	45%	0.448	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-60	-20	176.2	-164.8	0	0	0	0	112.4	S409 L410 K415	S409-S413 WeakPolarHBondContact O-CB 3.5Å; S409-S413 PolarHBondContact O-N 2.87Å; L410-S413 PolarHBondContact O-N 2.91Å; S413-K415 VanDerWaalsContact C-N 3.26Å; S413-K415 PolarHBondContact O-N 3.37Å
414	N	60.7	Low	73.8	Confident	152 Å²	152	99.4 Å²	99.4	81%	0.813	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-80.6	-0.3	173.7	-67	-12.9	0	0	0	113.9	N412	N412-N414 PolarHBondContact O-N 3.34Å; N412-N414 VanDerWaalsContact O-N 3.08Å
415	K	60	Low	73.2	Confident	150 Å²	150	98.3 Å²	98.3	65%	0.652	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-112.6	29.7	174.1	-75.2	-170.3	178.3	-178.9	0	113.1	N412 S413 S417	N412-K415 PolarHBondContact O-N 3.26Å; S413-K415 VanDerWaalsContact C-N 3.26Å; S413-K415 PolarHBondContact O-N 3.37Å; K415-S417 PolarHBondContact O-N 3.11Å
416	I	58.8	Low	72.3	Confident	83 Å²	83	98.3 Å²	98.3	43%	0.426	54%	0.54	S	S	.	.			trans	-74.2	88.6	162.8	-59.6	172	0	0	0	106.7	L418 I428	I416-L418 HydrophobicContact CG2-CG 4.49Å; I416-L418 PolarHBondContact O-N 3.05Å; I416-I428 HydrophobicContact CG2-CG2 4.16Å
417	S	58	Low	71.7	Confident	58 Å²	58	98.7 Å²	98.7	41%	0.406	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	107.8	166.1	50.8	0	0	0	0	108.2	K415 V419	K415-S417 PolarHBondContact O-N 3.11Å; S417-V419 PolarHBondContact O-N 3.38Å
418	L	58.6	Low	70.8	Confident	106 Å²	106	98.3 Å²	98.3	56%	0.555	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	103.5	165.3	-75.5	159.4	0	0	0	107.1	I416 L426 I428	I416-L418 HydrophobicContact CG2-CG 4.49Å; I416-L418 PolarHBondContact O-N 3.05Å; L418-L426 HydrophobicContact CD2-CD1 4.02Å; L418-L426 HydrophobicContact CD2-CD2 3.34Å; L418-L426 HydrophobicContact CD2-CG 3.72Å; L418-I428 HydrophobicContact CD2-CG1 4.32Å
419	V	67	Low	69.7	Low	67 Å²	67	99.6 Å²	99.6	41%	0.406	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	113.5	173.6	-177.1	0	0	0	0	107.2	S417 N421 I427	S417-V419 PolarHBondContact O-N 3.38Å; V419-N421 PolarHBondContact O-N 2.99Å; V419-I427 PolarHBondContact N-O 3.03Å; V419-I427 PolarHBondContact O-N 3.15Å
420	I	68.3	Low	68.7	Low	119 Å²	119	104.2 Å²	104.2	61%	0.61	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	116.6	167.8	-58	176.3	0	0	0	105.9	F425	I420-F425 WeakPolarHBondContact CA-O 3.45Å
421	N	78.5	Confident	67.6	Low	63 Å²	63	103.9 Å²	103.9	34%	0.337	55%	0.55	S	S	.	*			trans	-65.3	156.4	171.6	-170.5	3.3	0	0	0	109.4	V419 N423 G424 F425 I427	V419-N421 PolarHBondContact O-N 2.99Å; N421-N423 PolarHBondContact O-N 3.16Å; N421-G424 PolarHBondContact O-N 3.45Å; N421-F425 HydrophobicContact CB-CB 4.48Å; N421-F425 PolarHBondContact N-O 3.01Å; N421-I427 HydrophobicContact CB-CD1 3.75Å; N421-I427 HydrophobicContact CB-CG1 4.27Å
422	E	81.3	Confident	66.3	Low	194 Å²	194	105 Å²	105	91%	0.907	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-23.3	177	-63.1	-177.4	168.9	0	0	113.1	G424	E422-G424 VanDerWaalsContact C-N 3.31Å; E422-G424 PolarHBondContact O-N 3.18Å
423	N	80.1	Confident	65.4	Low	118 Å²	118	110.1 Å²	110.1	63%	0.631	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	11	176	-64.2	-16	0	0	0	114.5	N421 F425	N421-N423 PolarHBondContact O-N 3.16Å; N423-F425 HydrophobicContact CB-CD2 3.6Å; N423-F425 HydrophobicContact CB-CE2 3.84Å; N423-F425 WeakPolarHBondContact O-CD2 3.36Å; N423-F425 PolarHBondContact O-N 3.44Å
424	G	75.5	Confident	65.1	Low	59 Å²	59	115.3 Å²	115.3	61%	0.608	59%	0.585	S	S	*	*	S	Bend	trans	74.6	5.5	-178.7	0	0	0	0	0	115.2	N421 E422	N421-G424 PolarHBondContact O-N 3.45Å; E422-G424 VanDerWaalsContact C-N 3.31Å; E422-G424 PolarHBondContact O-N 3.18Å
425	F	72.2	Confident	64.5	Low	108 Å²	108	118.1 Å²	118.1	47%	0.474	58%	0.584	S	S	.	*			trans	-81.4	125.6	177.2	-67	-77	0	0	0	111	I420 N421 N423 I427	I420-F425 WeakPolarHBondContact CA-O 3.45Å; N421-F425 HydrophobicContact CB-CB 4.48Å; N421-F425 PolarHBondContact N-O 3.01Å; N423-F425 HydrophobicContact CB-CD2 3.6Å; N423-F425 HydrophobicContact CB-CE2 3.84Å; N423-F425 WeakPolarHBondContact O-CD2 3.36Å; N423-F425 PolarHBondContact O-N 3.44Å; F425-I427 PolarHBondContact O-N 3.49Å; F425-I427 VanDerWaalsContact O-N 3.16Å
426	L	65.1	Low	63.6	Low	108 Å²	108	122.3 Å²	122.3	57%	0.565	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.2	100.8	173.2	-169.9	147.4	0	0	0	108.7	L418 I428	L418-L426 HydrophobicContact CD2-CD1 4.02Å; L418-L426 HydrophobicContact CD2-CD2 3.34Å; L418-L426 HydrophobicContact CD2-CG 3.72Å; L426-I428 HydrophobicContact CD2-CD1 4.43Å; L426-I428 HydrophobicContact CD2-CG1 3.91Å
427	I	67.8	Low	63.1	Low	60 Å²	60	123.1 Å²	123.1	31%	0.308	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.2	115.3	178.3	-58.1	-178.6	0	0	0	108.3	V419 N421 F425 K429	V419-I427 PolarHBondContact N-O 3.03Å; V419-I427 PolarHBondContact O-N 3.15Å; N421-I427 HydrophobicContact CB-CD1 3.75Å; N421-I427 HydrophobicContact CB-CG1 4.27Å; F425-I427 PolarHBondContact O-N 3.49Å; F425-I427 VanDerWaalsContact O-N 3.16Å; I427-K429 HydrophobicContact CG2-CG 4.3Å; I427-K429 PolarHBondContact O-N 3.01Å
428	I	65.1	Low	62.5	Low	80 Å²	80	126.5 Å²	126.5	41%	0.41	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82	98.8	170.3	-55.2	176.8	0	0	0	107.5	I416 L418 L426 Y430	I416-I428 HydrophobicContact CG2-CG2 4.16Å; L418-I428 HydrophobicContact CD2-CG1 4.32Å; L426-I428 HydrophobicContact CD2-CD1 4.43Å; L426-I428 HydrophobicContact CD2-CG1 3.91Å; I428-Y430 HydrophobicContact CB-CE2 4.33Å; I428-Y430 HydrophobicContact CG2-CD2 4.15Å; I428-Y430 HydrophobicContact CG2-CE1 4.36Å; I428-Y430 HydrophobicContact CG2-CE2 3.55Å; I428-Y430 PolarHBondContact O-N 3.11Å
429	K	61.8	Low	62.3	Low	128 Å²	128	126 Å²	126	56%	0.557	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.1	108.1	174.9	-101.8	-176.4	176.7	176	0	110	I427 T431	I427-K429 HydrophobicContact CG2-CG 4.3Å; I427-K429 PolarHBondContact O-N 3.01Å; K429-T431 PolarHBondContact O-N 3.36Å
430	Y	58.8	Low	61.5	Low	177 Å²	177	130.4 Å²	130.4	69%	0.694	66%	0.655	S	S	*	*			trans	-81.3	108	165.5	-64.3	-84.6	0	0	0	109	I428 D432	I428-Y430 HydrophobicContact CB-CE2 4.33Å; I428-Y430 HydrophobicContact CG2-CD2 4.15Å; I428-Y430 HydrophobicContact CG2-CE1 4.36Å; I428-Y430 HydrophobicContact CG2-CE2 3.55Å; I428-Y430 PolarHBondContact O-N 3.11Å; Y430-D432 VanDerWaalsContact C-N 3.26Å; Y430-D432 PolarHBondContact O-N 3.43Å; Y430-D432 VanDerWaalsContact O-N 3.09Å
431	T	55.9	Low	60.8	Low	104 Å²	104	131.6 Å²	131.6	64%	0.638	66%	0.661	S	S	*	*			trans	-83.7	68.8	173	48.1	0	0	0	0	110.2	K429	K429-T431 PolarHBondContact O-N 3.36Å
432	D	57.2	Low	59.7	Low	112 Å²	112	133 Å²	133	60%	0.599	68%	0.681	S	S	*	*			trans	-86.9	117.9	168.2	-163.5	-9	0	0	0	109.6	Y430 H434	Y430-D432 VanDerWaalsContact C-N 3.26Å; Y430-D432 PolarHBondContact O-N 3.43Å; Y430-D432 VanDerWaalsContact O-N 3.09Å; D432-H434 PolarHBondContact O-N 3.43Å
433	K	59.9	Low	58.2	Low	202 Å²	202	134.7 Å²	134.7	88%	0.878	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-5.6	-174.6	-107.2	-179.2	177.1	-177.4	0	114
434	H	57.7	Low	57.2	Low	174 Å²	174	134.2 Å²	134.2	81%	0.806	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.9	-2.5	-173	-88.4	-65.6	0	0	0	118	D432	D432-H434 PolarHBondContact O-N 3.43Å
435	R	47.9	Very low	56.4	Low	210 Å²	210	140.9 Å²	140.9	79%	0.792	69%	0.693	S	S	*	*			trans	-151.9	109.5	170.9	-90.1	-176.8	-177.8	174.4	-0.9	111.3	S437	R435-S437 PolarHBondContact O-N 3.28Å; R435-S437 VanDerWaalsContact O-N 3.08Å
436	Y	40.4	Very low	55.4	Low	239 Å²	239	139 Å²	139	94%	0.937	70%	0.704	S	S	*	*			trans	-69	98	157	-81.3	-88.9	0	0	0	108
437	S	48.1	Very low	55.1	Low	100 Å²	100	142.4 Å²	142.4	70%	0.699	72%	0.722	S	S	*	*			trans	-109.6	110.2	156.2	73.9	0	0	0	0	108.1	R435 S439	R435-S437 PolarHBondContact O-N 3.28Å; R435-S437 VanDerWaalsContact O-N 3.08Å; S437-S439 PolarHBondContact O-N 2.89Å
438	V	44.7	Very low	54.8	Low	129 Å²	129	144.7 Å²	144.7	78%	0.782	74%	0.743	S	S	*	*			trans	-72.9	104.5	168.9	179.9	0	0	0	0	106.7
439	S	55	Low	54.6	Low	96 Å²	96	145.8 Å²	145.8	67%	0.671	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-76.6	128.2	165.1	43.5	0	0	0	0	108.5	S437 I441	S437-S439 PolarHBondContact O-N 2.89Å; S439-I441 PolarHBondContact O-N 3.04Å
440	N	49.5	Very low	54.7	Low	158 Å²	158	145.7 Å²	145.7	85%	0.845	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-58.8	127.7	-179.7	-77.4	-34.9	0	0	0	111.1	A442	N440-A442 PolarHBondContact O-N 3.34Å
441	I	54.2	Low	55.1	Low	144 Å²	144	142.5 Å²	142.5	74%	0.738	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-61.2	122.7	173.7	-68.2	163	0	0	0	108.6	S439 R443	S439-I441 PolarHBondContact O-N 3.04Å; I441-R443 PolarHBondContact O-N 3.07Å; I441-R443 VanDerWaalsContact O-N 3.14Å
442	A	55.2	Low	55.1	Low	92 Å²	92	148.9 Å²	148.9	76%	0.76	80%	0.804	S	S	*	*			trans	-64.3	111.6	166.3	0	0	0	0	0	108.3	N440 T444	N440-A442 PolarHBondContact O-N 3.34Å; A442-T444 PolarHBondContact O-N 2.86Å; A442-T444 VanDerWaalsContact O-N 3.1Å
443	R	50.8	Low	55	Low	231 Å²	231	150.8 Å²	150.8	87%	0.872	82%	0.815	S	S	*	*			trans	-68.1	103.7	174.3	-161.7	178.4	-159.1	161.2	3.9	107.7	I441 K445	I441-R443 PolarHBondContact O-N 3.07Å; I441-R443 VanDerWaalsContact O-N 3.14Å; R443-K445 PolarHBondContact O-N 2.97Å
444	T	58.6	Low	54.8	Low	107 Å²	107	148.1 Å²	148.1	66%	0.656	81%	0.811	S	S	*	*			trans	-60.5	110.4	162.2	40.4	0	0	0	0	106.7	A442 G446	A442-T444 PolarHBondContact O-N 2.86Å; A442-T444 VanDerWaalsContact O-N 3.1Å; T444-G446 PolarHBondContact O-N 3.03Å
445	K	58.7	Low	54.6	Low	199 Å²	199	146.6 Å²	146.6	87%	0.865	81%	0.812	S	S	*	*			trans	-56.1	124.1	172	-85.1	179.7	172.8	-179.7	0	107.4	R443 L447	R443-K445 PolarHBondContact O-N 2.97Å; K445-L447 PolarHBondContact O-N 2.88Å
446	G	52.2	Low	55	Low	69 Å²	69	142.9 Å²	142.9	71%	0.711	81%	0.813	S	S	*	*			trans	-55.3	126.3	176.6	0	0	0	0	0	111	T444 S448	T444-G446 PolarHBondContact O-N 3.03Å; G446-S448 VanDerWaalsContact C-N 3.29Å; G446-S448 PolarHBondContact O-N 2.79Å; G446-S448 VanDerWaalsContact O-N 3.11Å
447	L	58.4	Low	55.9	Low	179 Å²	179	136.9 Å²	136.9	94%	0.937	81%	0.805	S	S	*	*			trans	-63.6	97.9	149.7	-86.4	143.5	0	0	0	106.3	K445 S449	K445-L447 PolarHBondContact O-N 2.88Å; L447-S449 PolarHBondContact O-N 3.13Å
448	S	60.6	Low	56.5	Low	108 Å²	108	139.3 Å²	139.3	76%	0.755	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-64.7	123.2	159.8	24.3	0	0	0	0	107.1	G446	G446-S448 VanDerWaalsContact C-N 3.29Å; G446-S448 PolarHBondContact O-N 2.79Å; G446-S448 VanDerWaalsContact O-N 3.11Å
449	S	61.1	Low	57.3	Low	103 Å²	103	140.1 Å²	140.1	72%	0.72	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-66	144.7	167.9	66.1	0	0	0	0	109.3	L447 S451	L447-S449 PolarHBondContact O-N 3.13Å; S449-S451 PolarHBondContact O-N 2.89Å
450	P	63	Low	57.5	Low	127 Å²	127	143.5 Å²	143.5	83%	0.825	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.7	119.4	165.7	30.7	-28	0	0	0	107.6	N452	P450-N452 PolarHBondContact O-N 3.36Å
451	S	68.2	Low	58.1	Low	110 Å²	110	142.3 Å²	142.3	77%	0.769	82%	0.824	S	S	*	*			trans	-73.1	114.8	160.7	50.8	0	0	0	0	108.6	S449	S449-S451 PolarHBondContact O-N 2.89Å
452	N	56.8	Low	58.5	Low	238 Å²	238	142.1 Å²	142.1	100%	1.273	83%	0.831	S	S	*	*			trans	-138.8	0	139.1	-101.9	-1.5	0	0	0	107.5	P450	P450-N452 PolarHBondContact O-N 3.36Å

Retrieved 452 of 452 residues in 474.9 ms (Link to these results)

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