A0A3Q0KI05_SCHMA Loading...

Solute carrier family 33 (Acetyl-CoA transporter, putative)

AlphaFold DB , UniProt , Accession A0A3Q0KI05, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 694 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	30.6	Very low	28.4	Very low	245 Å²	245	160.8 Å²	160.8	100%	1.207	88%	0.882	S	S	*	*				0	118.1	0	-79.5	178.5	172.6	0	0	108.8
2	A	28	Very low	28.3	Very low	109 Å²	109	160.7 Å²	160.7	90%	0.901	88%	0.88	S	S	*	*			trans	-63.9	134.2	-174.2	0	0	0	0	0	112.6
3	K	31.7	Very low	28.4	Very low	213 Å²	213	154.9 Å²	154.9	93%	0.926	86%	0.858	S	S	*	*			trans	-111.2	127.6	163.7	-93.9	-176.4	176.6	179.8	0	109.8
4	K	31.1	Very low	28.7	Very low	209 Å²	209	152.1 Å²	152.1	91%	0.909	86%	0.855	S	S	*	*			trans	-68	129.4	-168.2	-155.1	170.3	-177.6	178.9	0	110.7	S6	K4-S6 PolarHBondContact O-N 3.4Å
5	K	28.7	Very low	29.3	Very low	210 Å²	210	147.9 Å²	147.9	91%	0.913	85%	0.847	S	S	*	*			trans	-70.1	116.7	171.6	-77.2	177	172.8	179.7	0	109.4
6	S	29.7	Very low	29.4	Very low	117 Å²	117	146.3 Å²	146.3	82%	0.818	84%	0.835	S	S	*	*			trans	-100.2	108.4	161.3	54.7	0	0	0	0	108.3	K4 L8	K4-S6 PolarHBondContact O-N 3.4Å; S6-L8 PolarHBondContact O-N 3.41Å
7	S	26.3	Very low	29.6	Very low	119 Å²	119	145.6 Å²	145.6	83%	0.832	82%	0.823	S	S	*	*			trans	-68.7	111	175.4	44.5	0	0	0	0	110.7
8	L	25.6	Very low	29.6	Very low	161 Å²	161	140.7 Å²	140.7	84%	0.843	81%	0.809	S	S	*	*			trans	-100.1	124.1	163.7	-157.8	80.4	0	0	0	107.9	S6 T10	S6-L8 PolarHBondContact O-N 3.41Å; L8-T10 PolarHBondContact O-N 3.46Å
9	V	26.5	Very low	29.7	Very low	137 Å²	137	143.4 Å²	143.4	83%	0.83	81%	0.806	S	S	*	*			trans	-55.6	114.7	-177.4	176	0	0	0	0	109.7
10	T	27.6	Very low	29.9	Very low	131 Å²	131	141.9 Å²	141.9	80%	0.804	80%	0.795	S	S	*	*			trans	-97.9	113.5	176.2	8.8	0	0	0	0	108.3	L8	L8-T10 PolarHBondContact O-N 3.46Å
11	T	26.2	Very low	30.1	Very low	118 Å²	118	141.4 Å²	141.4	72%	0.724	79%	0.791	S	S	*	*			trans	-68.9	139.2	170.1	42.8	0	0	0	0	110.8	S13	T11-S13 PolarHBondContact O-N 3.19Å
12	D	27.5	Very low	30.2	Very low	159 Å²	159	138 Å²	138	85%	0.85	77%	0.769	S	S	*	*	S	Bend	trans	-25.6	103.9	179.6	-65.5	-45.5	0	0	0	116
13	S	30.1	Very low	30.5	Very low	86 Å²	86	141.5 Å²	141.5	60%	0.601	76%	0.764	S	S	*	*			trans	-145.9	50.5	161	44.1	0	0	0	0	109.8	T11 A15 N16	T11-S13 PolarHBondContact O-N 3.19Å; S13-A15 PolarHBondContact O-N 3.32Å; S13-A15 VanDerWaalsContact O-N 3.07Å; S13-N16 PolarHBondContact O-N 3.5Å
14	S	32.7	Very low	30.8	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	5.6	179.5	46.3	0	0	0	0	114.9
15	A	36.7	Very low	31.3	Very low	89 Å²	89	136.9 Å²	136.9	74%	0.736	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-23	175.2	0	0	0	0	0	114.3	S13	S13-A15 PolarHBondContact O-N 3.32Å; S13-A15 VanDerWaalsContact O-N 3.07Å
16	N	32.1	Very low	32	Very low	121 Å²	121	136.3 Å²	136.3	65%	0.647	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-17.6	-173.9	-88.4	-7.1	0	0	0	115	S13 G18 Y19	S13-N16 PolarHBondContact O-N 3.5Å; N16-G18 VanDerWaalsContact C-N 3.29Å; N16-G18 PolarHBondContact O-N 3.48Å; N16-Y19 PolarHBondContact O-N 2.7Å
17	Q	31.3	Very low	33	Very low	136 Å²	136	137.8 Å²	137.8	64%	0.636	74%	0.742	S	S	*	*	H	α-helix	trans	-72.1	-25.3	179.2	-146.4	73.3	23.3	0	0	112.6	Y19	Q17-Y19 VanDerWaalsContact C-N 3.3Å; Q17-Y19 PolarHBondContact O-N 3.2Å
18	G	30.9	Very low	34.4	Very low	56 Å²	56	137.5 Å²	137.5	58%	0.577	74%	0.738	S	S	*	*	H	α-helix	trans	-74	-16.4	177.4	0	0	0	0	0	114.7	N16	N16-G18 VanDerWaalsContact C-N 3.29Å; N16-G18 PolarHBondContact O-N 3.48Å
19	Y	31.4	Very low	36.5	Very low	193 Å²	193	134.3 Å²	134.3	76%	0.757	73%	0.728	S	S	*	*	H	α-helix	trans	-93.9	-24.4	-176	-151.9	-98.1	0	0	0	113.1	N16 Q17	N16-Y19 PolarHBondContact O-N 2.7Å; Q17-Y19 VanDerWaalsContact C-N 3.3Å; Q17-Y19 PolarHBondContact O-N 3.2Å
20	I	32.7	Very low	39.2	Very low	113 Å²	113	128.4 Å²	128.4	58%	0.579	69%	0.692	S	S	*	*	H	α-helix	trans	-84.1	-31.2	179.7	-59.6	-177.8	0	0	0	111.5	K22	I20-K22 VanDerWaalsContact C-N 3.29Å; I20-K22 PolarHBondContact O-N 3.24Å
21	D	33.7	Very low	42.1	Very low	131 Å²	131	129.2 Å²	129.2	70%	0.701	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-6.5	-178.9	-84.3	-16.3	0	0	0	114.9
22	K	33.8	Very low	45.2	Very low	175 Å²	175	127.8 Å²	127.8	76%	0.761	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	3.2	178.8	-88.7	-171.5	178.2	179.8	0	115.8	I20	I20-K22 VanDerWaalsContact C-N 3.29Å; I20-K22 PolarHBondContact O-N 3.24Å
23	K	34.9	Very low	48.2	Very low	182 Å²	182	121.7 Å²	121.7	79%	0.791	65%	0.646	S	S	*	*	S	Bend	trans	-116	5.8	-179.2	-134.2	-179	-175.5	-179.5	0	115.8	D25	K23-D25 PolarHBondContact O-N 3.45Å
24	F	37.1	Very low	51.1	Low	190 Å²	190	119.1 Å²	119.1	83%	0.833	63%	0.625	S	S	*	*			trans	-85.3	52.6	152.1	-77	-80.3	0	0	0	109.2	K26	F24-K26 VanDerWaalsContact C-N 3.35Å; F24-K26 PolarHBondContact O-N 3.33Å
25	D	42	Very low	54	Low	134 Å²	134	116.3 Å²	116.3	72%	0.717	61%	0.605	S	S	*	*			trans	-54.8	110.6	156	-81.8	-32	0	0	0	105	K23 E27	K23-D25 PolarHBondContact O-N 3.45Å; D25-E27 PolarHBondContact O-N 3.09Å
26	K	42.3	Very low	56.7	Low	198 Å²	198	113.6 Å²	113.6	86%	0.861	58%	0.578	S	S	*	*			trans	-47.3	108.4	173.6	-82.8	176	173.8	173.3	0	106.6	F24 P28	F24-K26 VanDerWaalsContact C-N 3.35Å; F24-K26 PolarHBondContact O-N 3.33Å; K26-P28 VanDerWaalsContact O-N 3.16Å
27	E	51.7	Low	59.6	Low	148 Å²	148	107.9 Å²	107.9	69%	0.692	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-46.9	128	173.6	-80.1	-177.5	146.5	0	0	107.3	D25 S29	D25-E27 PolarHBondContact O-N 3.09Å; E27-S29 PolarHBondContact O-N 3.19Å; E27-S29 VanDerWaalsContact O-N 3.07Å
28	P	54.9	Low	62.6	Low	114 Å²	114	103.7 Å²	103.7	74%	0.74	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-54.8	123.3	-174.6	19.1	-30	0	0	0	108.5	K26 D30	K26-P28 VanDerWaalsContact O-N 3.16Å; P28-D30 PolarHBondContact O-N 3.34Å
29	S	71.4	Confident	65.8	Low	93 Å²	93	104.8 Å²	104.8	65%	0.65	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-61.5	118.4	-176.3	75.9	0	0	0	0	109.1	E27 F31	E27-S29 PolarHBondContact O-N 3.19Å; E27-S29 VanDerWaalsContact O-N 3.07Å; S29-F31 PolarHBondContact O-N 3.25Å
30	D	83.1	Confident	68.9	Low	13 Å²	13	95.6 Å²	95.6	7%	0.07	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-6.1	177	-79.4	-35.6	0	0	0	113.3	P28 C32 N33 I34 L175 S176 N179	P28-D30 PolarHBondContact O-N 3.34Å; D30-C32 VanDerWaalsContact C-N 3.3Å; D30-C32 PolarHBondContact O-N 3.4Å; D30-N33 CarbonylContact O-C 3.44Å; D30-N33 WeakPolarHBondContact O-CA 3.44Å; D30-N33 WeakPolarHBondContact O-CB 3.46Å; D30-N33 PolarHBondContact O-N 3.15Å; D30-N33 PolarHBondContact OD1-ND2 2.6Å; D30-I34 HydrophobicContact CB-CD1 4.15Å; D30-I34 HydrophobicContact CB-CG1 4.38Å; D30-I34 WeakPolarHBondContact O-CG1 3.43Å; D30-I34 PolarHBondContact O-N 3.32Å; D30-L175 HydrophobicContact CB-CD2 4.28Å; D30-S176 PolarHBondContact OD1-N 2.71Å; D30-S176 WeakPolarHBondContact OD2-CB 3.37Å; D30-S176 PolarHBondContact OD2-N 3.1Å; D30-S176 PolarHBondContact OD2-OG 3.03Å; D30-N179 WeakPolarHBondContact OD2-CB 3.18Å; D30-N179 PolarHBondContact OD2-ND2 2.97Å
31	F	88.1	Confident	71.9	Confident	149 Å²	149	90.2 Å²	90.2	65%	0.654	45%	0.454	S	S	*	.	H	α-helix	trans	-49.1	-48.3	-178.9	-178.2	-101.4	0	0	0	112.9	S29 N33 I34 C35	S29-F31 PolarHBondContact O-N 3.25Å; F31-N33 VanDerWaalsContact C-N 3.33Å; F31-N33 PolarHBondContact O-N 3.49Å; F31-I34 PolarHBondContact O-N 3.25Å; F31-C35 PolarHBondContact O-N 2.89Å; F31-C35 PolarHBondContact O-SG 3.16Å
32	C	90.5	Very high	74.9	Confident	87 Å²	87	85.1 Å²	85.1	59%	0.588	43%	0.427	S	S	*	.	H	α-helix	trans	-64.1	-37.9	178.1	-174.7	0	0	0	0	112.3	D30 C35 L36	D30-C32 VanDerWaalsContact C-N 3.3Å; D30-C32 PolarHBondContact O-N 3.4Å; C32-C35 PolarHBondContact O-N 3.41Å; C32-L36 WeakPolarHBondContact O-CB 3.29Å; C32-L36 PolarHBondContact O-N 2.82Å
33	N	90.8	Very high	78	Confident	31 Å²	31	76.8 Å²	76.8	17%	0.166	39%	0.391	C	S	.	.	H	α-helix	trans	-67.4	-42.1	176.6	-67.2	-26	0	0	0	111.6	D30 F31 L36 L37 M174 L175 K250	D30-N33 CarbonylContact O-C 3.44Å; D30-N33 WeakPolarHBondContact O-CA 3.44Å; D30-N33 WeakPolarHBondContact O-CB 3.46Å; D30-N33 PolarHBondContact O-N 3.15Å; D30-N33 PolarHBondContact OD1-ND2 2.6Å; F31-N33 VanDerWaalsContact C-N 3.33Å; F31-N33 PolarHBondContact O-N 3.49Å; N33-L36 PolarHBondContact O-N 3.16Å; N33-L37 WeakPolarHBondContact O-CB 3.36Å; N33-L37 VanDerWaalsContact O-CG 3.28Å; N33-L37 WeakPolarHBondContact O-CG 3.46Å; N33-L37 PolarHBondContact O-N 3.11Å; N33-M174 HydrophobicContact CB-CG 3.72Å; N33-M174 HydrophobicContact CB-SD 3.73Å; N33-M174 PolarHBondContact ND2-O 2.85Å; N33-L175 HydrophobicContact CB-CD2 4.39Å; N33-K250 PolarHBondContact OD1-NZ 3.19Å
34	I	90.7	Very high	80.8	Confident	33 Å²	33	68.1 Å²	68.1	17%	0.169	35%	0.353	C	S	.	.	H	α-helix	trans	-61.5	-48.5	175.3	-69.4	169.5	0	0	0	110	D30 F31 L36 L37 I38 L175	D30-I34 HydrophobicContact CB-CD1 4.15Å; D30-I34 HydrophobicContact CB-CG1 4.38Å; D30-I34 WeakPolarHBondContact O-CG1 3.43Å; D30-I34 PolarHBondContact O-N 3.32Å; F31-I34 PolarHBondContact O-N 3.25Å; I34-L36 VanDerWaalsContact C-N 3.33Å; I34-L36 PolarHBondContact O-N 3.41Å; I34-L37 PolarHBondContact O-N 2.78Å; I34-I38 HydrophobicContact CG2-CD1 3.86Å; I34-I38 WeakPolarHBondContact O-CG1 3.23Å; I34-I38 PolarHBondContact O-N 2.89Å; I34-L175 HydrophobicContact CD1-CD2 4.38Å; I34-L175 HydrophobicContact CG1-CD2 3.54Å
35	C	93.3	Very high	83.6	Confident	57 Å²	57	59.1 Å²	59.1	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-59.3	-44	176.5	-69.2	0	0	0	0	112	F31 C32 F39	F31-C35 PolarHBondContact O-N 2.89Å; F31-C35 PolarHBondContact O-SG 3.16Å; C32-C35 PolarHBondContact O-N 3.41Å; C35-F39 WeakPolarHBondContact O-CB 3.36Å; C35-F39 PolarHBondContact O-N 3.48Å
36	L	94.4	Very high	86.3	Confident	32 Å²	32	52.7 Å²	52.7	17%	0.168	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-43.7	176.8	177.8	61.3	0	0	0	111.8	C32 N33 I34 F39 L40 M174 V246 K250	C32-L36 WeakPolarHBondContact O-CB 3.29Å; C32-L36 PolarHBondContact O-N 2.82Å; N33-L36 PolarHBondContact O-N 3.16Å; I34-L36 VanDerWaalsContact C-N 3.33Å; I34-L36 PolarHBondContact O-N 3.41Å; L36-F39 PolarHBondContact O-N 2.92Å; L36-L40 HydrophobicContact CD1-CD1 4.35Å; L36-L40 HydrophobicContact CD1-CG 4.24Å; L36-L40 HydrophobicContact CG-CD1 4.18Å; L36-L40 HydrophobicContact CG-CG 4.49Å; L36-L40 VanDerWaalsContact O-CG 3.32Å; L36-L40 WeakPolarHBondContact O-CG 3.27Å; L36-L40 PolarHBondContact O-N 2.76Å; L36-M174 HydrophobicContact CD2-CE 4.18Å; L36-M174 HydrophobicContact CD2-SD 4.16Å; L36-V246 HydrophobicContact CD1-CG2 3.96Å; L36-K250 HydrophobicContact CD2-CB 4.26Å; L36-K250 HydrophobicContact CD2-CD 3.78Å; L36-K250 HydrophobicContact CD2-CG 3.83Å
37	L	92.7	Very high	88.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-49.2	177.7	-76.7	170.2	0	0	0	111.3	N33 I34 F39 L40 Y41 V167 A171 M174 L175 C186	N33-L37 WeakPolarHBondContact O-CB 3.36Å; N33-L37 VanDerWaalsContact O-CG 3.28Å; N33-L37 WeakPolarHBondContact O-CG 3.46Å; N33-L37 PolarHBondContact O-N 3.11Å; I34-L37 PolarHBondContact O-N 2.78Å; L37-F39 VanDerWaalsContact C-N 3.26Å; L37-F39 PolarHBondContact O-N 3.32Å; L37-L40 PolarHBondContact O-N 3.25Å; L37-L40 VanDerWaalsContact O-N 3.17Å; L37-Y41 HydrophobicContact CB-CE2 4.38Å; L37-Y41 WeakPolarHBondContact O-CD2 3.16Å; L37-Y41 PolarHBondContact O-N 3.21Å; L37-V167 HydrophobicContact CD2-CG1 4Å; L37-A171 HydrophobicContact CD1-CB 3.95Å; L37-A171 HydrophobicContact CD2-CB 3.92Å; L37-M174 HydrophobicContact CD1-SD 4.4Å; L37-M174 HydrophobicContact CD2-CE 4.07Å; L37-M174 HydrophobicContact CD2-SD 4.28Å; L37-M174 HydrophobicContact CG-CE 4.39Å; L37-M174 HydrophobicContact CG-SD 3.97Å; L37-L175 HydrophobicContact CD1-CD1 3.97Å; L37-L175 HydrophobicContact CD1-CD2 3.92Å; L37-L175 HydrophobicContact CD1-CG 3.81Å; L37-C186 HydrophobicContact CB-CB 4.23Å
38	I	94.6	Very high	91	Very high	48 Å²	48	37 Å²	37	25%	0.246	21%	0.209	C	C	.	.	H	α-helix	trans	-55.9	-45.4	175.8	-68.8	168.9	0	0	0	109.9	I34 L40 Y41 I42 C186	I34-I38 HydrophobicContact CG2-CD1 3.86Å; I34-I38 WeakPolarHBondContact O-CG1 3.23Å; I34-I38 PolarHBondContact O-N 2.89Å; I38-L40 PolarHBondContact O-N 3.17Å; I38-Y41 PolarHBondContact O-N 3.1Å; I38-I42 HydrophobicContact CG2-CD1 3.96Å; I38-I42 HydrophobicContact CG2-CG1 4.4Å; I38-I42 VanDerWaalsContact O-CG1 3.29Å; I38-I42 WeakPolarHBondContact O-CG1 3.44Å; I38-I42 PolarHBondContact O-N 2.68Å; I38-C186 HydrophobicContact CG1-CB 3.91Å
39	F	96.9	Very high	92.9	Very high	79 Å²	79	31.6 Å²	31.6	35%	0.346	17%	0.174	S	C	.	.	H	α-helix	trans	-61.9	-42.6	177.9	177.9	-107.3	0	0	0	113.3	C35 L36 L37 Y41 I42 L43 A242	C35-F39 WeakPolarHBondContact O-CB 3.36Å; C35-F39 PolarHBondContact O-N 3.48Å; L36-F39 PolarHBondContact O-N 2.92Å; L37-F39 VanDerWaalsContact C-N 3.26Å; L37-F39 PolarHBondContact O-N 3.32Å; F39-Y41 VanDerWaalsContact C-N 3.32Å; F39-Y41 PolarHBondContact O-N 3.44Å; F39-I42 WeakPolarHBondContact O-CB 3.44Å; F39-I42 PolarHBondContact O-N 2.83Å; F39-L43 HydrophobicContact CD1-CD1 4.31Å; F39-L43 HydrophobicContact CE1-CD1 3.71Å; F39-L43 HydrophobicContact CE1-CG 4.3Å; F39-L43 HydrophobicContact CE2-CG 4.5Å; F39-L43 HydrophobicContact CZ-CD1 3.94Å; F39-L43 HydrophobicContact CZ-CD2 4.32Å; F39-L43 HydrophobicContact CZ-CG 4.18Å; F39-L43 PolarHBondContact O-N 3.05Å; F39-A242 HydrophobicContact CE1-CB 3.84Å; F39-A242 HydrophobicContact CZ-CB 3.89Å
40	L	96.8	Very high	94.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.5	-37.9	176	-69.8	173.1	0	0	0	112.1	L36 L37 I38 L43 Q44 L105 Q163 V167 W170 V246	L36-L40 HydrophobicContact CD1-CD1 4.35Å; L36-L40 HydrophobicContact CD1-CG 4.24Å; L36-L40 HydrophobicContact CG-CD1 4.18Å; L36-L40 HydrophobicContact CG-CG 4.49Å; L36-L40 VanDerWaalsContact O-CG 3.32Å; L36-L40 WeakPolarHBondContact O-CG 3.27Å; L36-L40 PolarHBondContact O-N 2.76Å; L37-L40 PolarHBondContact O-N 3.25Å; L37-L40 VanDerWaalsContact O-N 3.17Å; I38-L40 PolarHBondContact O-N 3.17Å; L40-L43 PolarHBondContact O-N 3.42Å; L40-Q44 PolarHBondContact O-N 2.74Å; L40-Q44 VanDerWaalsContact O-N 3.12Å; L40-L105 HydrophobicContact CD1-CD2 4.28Å; L40-L105 HydrophobicContact CD2-CD2 4.33Å; L40-Q163 PolarHBondContact O-NE2 3.06Å; L40-V167 HydrophobicContact CB-CG1 4Å; L40-V167 HydrophobicContact CB-CG2 4.13Å; L40-V167 HydrophobicContact CD1-CG1 4.38Å; L40-V167 HydrophobicContact CD1-CG2 4.4Å; L40-W170 HydrophobicContact CD1-CE3 3.86Å; L40-W170 HydrophobicContact CD1-CZ3 3.67Å; L40-V246 HydrophobicContact CD2-CG2 4.32Å
41	Y	95.7	Very high	94.8	Very high	1 Å²	1	26.6 Å²	26.6	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-71.4	-32.9	174.3	-70.7	-57	0	0	0	112.9	L37 I38 F39 L43 Q44 G45 V167 D168 C186 N187 G190 Q191	L37-Y41 HydrophobicContact CB-CE2 4.38Å; L37-Y41 WeakPolarHBondContact O-CD2 3.16Å; L37-Y41 PolarHBondContact O-N 3.21Å; I38-Y41 PolarHBondContact O-N 3.1Å; F39-Y41 VanDerWaalsContact C-N 3.32Å; F39-Y41 PolarHBondContact O-N 3.44Å; Y41-L43 VanDerWaalsContact C-N 3.34Å; Y41-Q44 PolarHBondContact O-N 3.27Å; Y41-G45 PolarHBondContact O-N 3.02Å; Y41-V167 HydrophobicContact CD1-CB 4.46Å; Y41-V167 HydrophobicContact CD1-CG1 3.97Å; Y41-V167 HydrophobicContact CD2-CG1 4.3Å; Y41-V167 HydrophobicContact CE1-CB 3.89Å; Y41-V167 HydrophobicContact CE1-CG1 3.5Å; Y41-V167 HydrophobicContact CE2-CG1 3.9Å; Y41-V167 HydrophobicContact CG-CG1 4.34Å; Y41-V167 VanDerWaalsContact CZ-CG1 3.47Å; Y41-D168 WeakPolarHBondContact OH-CA 3.49Å; Y41-D168 PolarHBondContact OH-N 3.34Å; Y41-D168 PolarHBondContact OH-OD1 2.62Å; Y41-C186 VanDerWaalsContact CD2-C 3.42Å; Y41-C186 HydrophobicContact CD2-CB 4.07Å; Y41-C186 VanDerWaalsContact CD2-O 3.32Å; Y41-C186 WeakPolarHBondContact CD2-O 3.28Å; Y41-C186 HydrophobicContact CE2-CB 3.96Å; Y41-N187 HydrophobicContact CD1-CB 4.25Å; Y41-N187 VanDerWaalsContact CD2-CA 3.42Å; Y41-N187 HydrophobicContact CD2-CB 4.23Å; Y41-N187 HydrophobicContact CE1-CB 3.87Å; Y41-N187 WeakPolarHBondContact CE1-ND2 3.39Å; Y41-N187 VanDerWaalsContact CE2-CA 3.49Å; Y41-N187 HydrophobicContact CE2-CB 3.82Å; Y41-N187 HydrophobicContact CG-CB 4.42Å; Y41-G190 CarbonylContact O-C 3.6Å; Y41-Q191 HydrophobicContact CD1-CG 4.33Å
42	I	97.9	Very high	95.1	Very high	24 Å²	24	20.7 Å²	20.7	12%	0.123	12%	0.117	C	C	.	.	H	α-helix	trans	-59.2	-48.2	169.4	-69.7	166.3	0	0	0	109.9	I38 F39 Q44 G45 I46 G190 L193 G194 I197	I38-I42 HydrophobicContact CG2-CD1 3.96Å; I38-I42 HydrophobicContact CG2-CG1 4.4Å; I38-I42 VanDerWaalsContact O-CG1 3.29Å; I38-I42 WeakPolarHBondContact O-CG1 3.44Å; I38-I42 PolarHBondContact O-N 2.68Å; F39-I42 WeakPolarHBondContact O-CB 3.44Å; F39-I42 PolarHBondContact O-N 2.83Å; I42-Q44 VanDerWaalsContact C-N 3.27Å; I42-Q44 PolarHBondContact O-N 3.32Å; I42-G45 PolarHBondContact O-N 3.18Å; I42-G45 VanDerWaalsContact O-N 3.1Å; I42-I46 HydrophobicContact CG2-CD1 4.07Å; I42-I46 WeakPolarHBondContact O-CG1 3.39Å; I42-I46 PolarHBondContact O-N 3.13Å; I42-G190 VanDerWaalsContact CA-O 3.23Å; I42-G190 WeakPolarHBondContact CA-O 3.36Å; I42-G190 WeakPolarHBondContact CG1-O 3.46Å; I42-G190 PolarHBondContact N-O 3.47Å; I42-L193 HydrophobicContact CD1-CD2 3.69Å; I42-L193 HydrophobicContact CD1-CG 4.34Å; I42-L193 HydrophobicContact CG1-CB 4.23Å; I42-L193 HydrophobicContact CG1-CD2 4.13Å; I42-L193 HydrophobicContact CG1-CG 4.32Å; I42-G194 VanDerWaalsContact O-CA 3.31Å; I42-G194 WeakPolarHBondContact O-CA 3.43Å; I42-I197 HydrophobicContact CG2-CD1 4.11Å
43	L	97.7	Very high	95.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-57.4	-42.7	177.3	-70.6	178.4	0	0	0	111.3	F39 L40 Y41 G45 I46 P47 W235 V238 F239 A242	F39-L43 HydrophobicContact CD1-CD1 4.31Å; F39-L43 HydrophobicContact CE1-CD1 3.71Å; F39-L43 HydrophobicContact CE1-CG 4.3Å; F39-L43 HydrophobicContact CE2-CG 4.5Å; F39-L43 HydrophobicContact CZ-CD1 3.94Å; F39-L43 HydrophobicContact CZ-CD2 4.32Å; F39-L43 HydrophobicContact CZ-CG 4.18Å; F39-L43 PolarHBondContact O-N 3.05Å; L40-L43 PolarHBondContact O-N 3.42Å; Y41-L43 VanDerWaalsContact C-N 3.34Å; L43-G45 PolarHBondContact O-N 2.67Å; L43-I46 HydrophobicContact CD2-CD1 4.49Å; L43-I46 PolarHBondContact O-N 3.18Å; L43-P47 WeakPolarHBondContact O-CD 3.35Å; L43-W235 HydrophobicContact CD2-CZ3 4.32Å; L43-V238 HydrophobicContact CD2-CG1 4.35Å; L43-F239 HydrophobicContact CB-CE1 3.98Å; L43-F239 HydrophobicContact CB-CZ 4.03Å; L43-F239 HydrophobicContact CD2-CD2 4.32Å; L43-F239 HydrophobicContact CD2-CE2 4.22Å; L43-F239 HydrophobicContact CD2-CZ 4.39Å; L43-F239 WeakPolarHBondContact O-CZ 3.46Å; L43-A242 HydrophobicContact CD1-CB 3.8Å
44	Q	94.7	Very high	95.6	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.3	-39.5	175.3	178.2	-166.7	-32.2	0	0	113.7	L40 Y41 I42 I46 P47 A160 D164	L40-Q44 PolarHBondContact O-N 2.74Å; L40-Q44 VanDerWaalsContact O-N 3.12Å; Y41-Q44 PolarHBondContact O-N 3.27Å; I42-Q44 VanDerWaalsContact C-N 3.27Å; I42-Q44 PolarHBondContact O-N 3.32Å; Q44-I46 VanDerWaalsContact C-N 3.26Å; Q44-I46 PolarHBondContact O-N 3.16Å; Q44-P47 WeakPolarHBondContact O-CD 3.34Å; Q44-A160 HydrophobicContact CG-CB 4.4Å; Q44-D164 VanDerWaalsContact CD-CB 3.44Å; Q44-D164 VanDerWaalsContact CD-OD1 3.28Å; Q44-D164 HydrophobicContact CG-CB 4.49Å; Q44-D164 PolarHBondContact NE2-OD1 3.03Å; Q44-D164 VanDerWaalsContact OE1-CA 3.28Å; Q44-D164 PolarHBondContact OE1-OD1 3.4Å
45	G	96	Very high	95.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.2	-28.5	-179.3	0	0	0	0	0	113.1	Y41 I42 L43 L48 G49 G194 H195	Y41-G45 PolarHBondContact O-N 3.02Å; I42-G45 PolarHBondContact O-N 3.18Å; I42-G45 VanDerWaalsContact O-N 3.1Å; L43-G45 PolarHBondContact O-N 2.67Å; G45-L48 WeakPolarHBondContact O-CB 3.48Å; G45-L48 PolarHBondContact O-N 3.39Å; G45-G49 PolarHBondContact O-N 3.22Å; G45-G194 CarbonylContact C-O 3.54Å; G45-G194 CarbonylContact O-C 3.53Å; G45-H195 VanDerWaalsContact O-CA 3.32Å; G45-H195 WeakPolarHBondContact O-CA 3.35Å; G45-H195 PolarHBondContact O-N 3.17Å
46	I	97.8	Very high	96	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.6	-52.6	-176.5	-70.8	161.4	0	0	0	112.6	I42 L43 Q44 L48 G49 L50 G194 I197 W235	I42-I46 HydrophobicContact CG2-CD1 4.07Å; I42-I46 WeakPolarHBondContact O-CG1 3.39Å; I42-I46 PolarHBondContact O-N 3.13Å; L43-I46 HydrophobicContact CD2-CD1 4.49Å; L43-I46 PolarHBondContact O-N 3.18Å; Q44-I46 VanDerWaalsContact C-N 3.26Å; Q44-I46 PolarHBondContact O-N 3.16Å; I46-L48 PolarHBondContact O-N 3.35Å; I46-G49 PolarHBondContact O-N 3.31Å; I46-G49 VanDerWaalsContact O-N 3.15Å; I46-L50 HydrophobicContact CG2-CD1 3.91Å; I46-L50 HydrophobicContact CG2-CG 4.31Å; I46-L50 WeakPolarHBondContact O-CB 3.49Å; I46-L50 VanDerWaalsContact O-CG 3.3Å; I46-L50 WeakPolarHBondContact O-CG 3.35Å; I46-L50 PolarHBondContact O-N 3.12Å; I46-G194 WeakPolarHBondContact CA-O 3.43Å; I46-G194 WeakPolarHBondContact CG1-O 3.39Å; I46-G194 PolarHBondContact N-O 3.3Å; I46-I197 HydrophobicContact CD1-CG2 4.29Å; I46-I197 HydrophobicContact CG1-CB 4.33Å; I46-I197 HydrophobicContact CG1-CG2 4.13Å; I46-W235 HydrophobicContact CD1-CD2 3.86Å; I46-W235 HydrophobicContact CD1-CE3 3.51Å; I46-W235 HydrophobicContact CD1-CH2 3.38Å; I46-W235 HydrophobicContact CD1-CZ2 3.76Å; I46-W235 HydrophobicContact CD1-CZ3 3.23Å; I46-W235 HydrophobicContact CG2-CB 4.47Å; I46-W235 HydrophobicContact CG2-CD2 3.99Å; I46-W235 HydrophobicContact CG2-CE3 4.48Å; I46-W235 HydrophobicContact CG2-CG 3.94Å
47	P	96.9	Very high	95.9	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-53.8	-36.7	171.7	-28.7	34	0	0	0	114.2	L43 Q44 S51 L112 A160 F239	L43-P47 WeakPolarHBondContact O-CD 3.35Å; Q44-P47 WeakPolarHBondContact O-CD 3.34Å; P47-S51 WeakPolarHBondContact O-CB 3.32Å; P47-S51 PolarHBondContact O-N 3.47Å; P47-S51 PolarHBondContact O-OG 3Å; P47-L112 HydrophobicContact CG-CD2 4.07Å; P47-A160 HydrophobicContact CB-CB 4.18Å; P47-A160 HydrophobicContact CG-CB 4.47Å; P47-F239 HydrophobicContact CG-CE2 4.42Å; P47-F239 HydrophobicContact CG-CZ 3.85Å
48	L	95.2	Very high	96	Very high	17 Å²	17	13.3 Å²	13.3	9%	0.089	7%	0.066	C	C	.	.	H	α-helix	trans	-70	-41.1	177.5	-58.4	177.4	0	0	0	111.5	G45 I46 S51 S52 F80 T157	G45-L48 WeakPolarHBondContact O-CB 3.48Å; G45-L48 PolarHBondContact O-N 3.39Å; I46-L48 PolarHBondContact O-N 3.35Å; L48-S51 PolarHBondContact O-N 3.39Å; L48-S52 PolarHBondContact O-N 3.33Å; L48-S52 VanDerWaalsContact O-N 3.09Å; L48-S52 PolarHBondContact O-OG 3.02Å; L48-F80 HydrophobicContact CD1-CD2 4.13Å; L48-F80 HydrophobicContact CD1-CE1 4.43Å; L48-F80 HydrophobicContact CD1-CE2 3.71Å; L48-F80 HydrophobicContact CD1-CZ 3.87Å; L48-F80 HydrophobicContact CD2-CD2 3.87Å; L48-F80 HydrophobicContact CD2-CE2 4.3Å; L48-F80 HydrophobicContact CD2-CG 4.2Å; L48-T157 HydrophobicContact CD2-CG2 4.09Å
49	G	96.6	Very high	96	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-63.8	-45	173.3	0	0	0	0	0	112.2	G45 I46 S51 S52 A53 H195 G198 F199	G45-G49 PolarHBondContact O-N 3.22Å; I46-G49 PolarHBondContact O-N 3.31Å; I46-G49 VanDerWaalsContact O-N 3.15Å; G49-S51 VanDerWaalsContact C-N 3.31Å; G49-S51 PolarHBondContact O-N 2.91Å; G49-S52 WeakPolarHBondContact O-CA 3.38Å; G49-S52 WeakPolarHBondContact O-CB 3.28Å; G49-S52 PolarHBondContact O-N 2.93Å; G49-A53 PolarHBondContact O-N 2.97Å; G49-H195 WeakPolarHBondContact CA-O 3.4Å; G49-G198 VanDerWaalsContact C-C 3.49Å; G49-G198 CarbonylContact C-O 3.6Å; G49-F199 WeakPolarHBondContact O-CB 3.48Å
50	L	97.4	Very high	95.5	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-57.9	-44.3	174.9	-73.7	169.5	0	0	0	111.6	I46 S52 A53 V54 L116 F153 G198 L202 F228 F231 L232	I46-L50 HydrophobicContact CG2-CD1 3.91Å; I46-L50 HydrophobicContact CG2-CG 4.31Å; I46-L50 WeakPolarHBondContact O-CB 3.49Å; I46-L50 VanDerWaalsContact O-CG 3.3Å; I46-L50 WeakPolarHBondContact O-CG 3.35Å; I46-L50 PolarHBondContact O-N 3.12Å; L50-S52 PolarHBondContact O-N 2.96Å; L50-A53 WeakPolarHBondContact O-CB 3.23Å; L50-A53 PolarHBondContact O-N 3.32Å; L50-V54 PolarHBondContact O-N 3.28Å; L50-L116 HydrophobicContact CD1-CD2 3.69Å; L50-F153 HydrophobicContact CB-CE1 4.15Å; L50-G198 PolarHBondContact N-O 3.04Å; L50-L202 HydrophobicContact CD2-CD2 3.78Å; L50-F228 HydrophobicContact CD2-CE2 4.2Å; L50-F231 HydrophobicContact CD2-CD1 3.72Å; L50-F231 HydrophobicContact CD2-CE1 3.73Å; L50-L232 HydrophobicContact CD1-CD2 3.8Å; L50-L232 HydrophobicContact CD2-CD2 4.04Å; L50-L232 HydrophobicContact CG-CD2 4.47Å
51	S	96.1	Very high	95	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.4	-33.6	175.2	-56.3	0	0	0	0	111.5	P47 L48 G49 A53 P55 F73 F153	P47-S51 WeakPolarHBondContact O-CB 3.32Å; P47-S51 PolarHBondContact O-N 3.47Å; P47-S51 PolarHBondContact O-OG 3Å; L48-S51 PolarHBondContact O-N 3.39Å; G49-S51 VanDerWaalsContact C-N 3.31Å; G49-S51 PolarHBondContact O-N 2.91Å; S51-A53 VanDerWaalsContact C-N 3.35Å; S51-P55 VanDerWaalsContact O-CD 3.25Å; S51-P55 WeakPolarHBondContact O-CD 3.4Å; S51-F73 WeakPolarHBondContact O-CE1 3.4Å; S51-F153 WeakPolarHBondContact OG-CD1 3.34Å
52	S	94.3	Very high	94.1	Very high	25 Å²	25	15.5 Å²	15.5	18%	0.175	9%	0.091	C	C	.	.	H	α-helix	trans	-77.8	-23.2	-179.1	-54	0	0	0	0	112.6	L48 G49 L50 F77 H195	L48-S52 PolarHBondContact O-N 3.33Å; L48-S52 VanDerWaalsContact O-N 3.09Å; L48-S52 PolarHBondContact O-OG 3.02Å; G49-S52 WeakPolarHBondContact O-CA 3.38Å; G49-S52 WeakPolarHBondContact O-CB 3.28Å; G49-S52 PolarHBondContact O-N 2.93Å; L50-S52 PolarHBondContact O-N 2.96Å; S52-F77 WeakPolarHBondContact OG-CZ 3.41Å; S52-H195 PolarHBondContact OG-CE1 3.47Å
53	A	96.2	Very high	93	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-72.2	-33	175.4	0	0	0	0	0	113.4	G49 L50 S51 Y56 L57 F199 L202 M203	G49-A53 PolarHBondContact O-N 2.97Å; L50-A53 WeakPolarHBondContact O-CB 3.23Å; L50-A53 PolarHBondContact O-N 3.32Å; S51-A53 VanDerWaalsContact C-N 3.35Å; A53-Y56 PolarHBondContact O-N 3.05Å; A53-L57 PolarHBondContact O-N 3.26Å; A53-F199 HydrophobicContact CB-CD2 3.75Å; A53-F199 HydrophobicContact CB-CE2 4.34Å; A53-L202 HydrophobicContact CB-CD2 3.68Å; A53-M203 HydrophobicContact CB-CE 3.9Å; A53-M203 HydrophobicContact CB-SD 4.5Å
54	V	96.2	Very high	92.3	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.012	11%	0.112	C	C	.	.	H	α-helix	trans	-59.6	-47.3	-174	172.2	0	0	0	0	112.1	L50 Y56 L57 L58 F73 F153 F228	L50-V54 PolarHBondContact O-N 3.28Å; V54-Y56 VanDerWaalsContact C-N 3.28Å; V54-Y56 PolarHBondContact O-N 2.92Å; V54-L57 PolarHBondContact O-N 2.96Å; V54-L57 VanDerWaalsContact O-N 3.14Å; V54-L58 HydrophobicContact CG1-CD1 3.77Å; V54-L58 HydrophobicContact CG1-CG 4Å; V54-L58 WeakPolarHBondContact O-CG 3.2Å; V54-L58 PolarHBondContact O-N 3.05Å; V54-F73 HydrophobicContact CB-CD1 4.27Å; V54-F73 HydrophobicContact CB-CE1 3.54Å; V54-F73 HydrophobicContact CB-CE2 4.2Å; V54-F73 HydrophobicContact CB-CZ 3.49Å; V54-F73 VanDerWaalsContact CB-CZ 3.49Å; V54-F73 HydrophobicContact CG1-CD1 3.99Å; V54-F73 HydrophobicContact CG1-CD2 4.05Å; V54-F73 HydrophobicContact CG1-CE1 3.68Å; V54-F73 HydrophobicContact CG1-CE2 3.71Å; V54-F73 HydrophobicContact CG1-CG 4.18Å; V54-F73 HydrophobicContact CG1-CZ 3.52Å; V54-F73 HydrophobicContact CG2-CE1 4.25Å; V54-F73 HydrophobicContact CG2-CE2 4.38Å; V54-F73 HydrophobicContact CG2-CZ 3.73Å; V54-F153 HydrophobicContact CG2-CD1 4.49Å; V54-F153 HydrophobicContact CG2-CE1 3.89Å; V54-F153 HydrophobicContact CG2-CE2 4.13Å; V54-F153 HydrophobicContact CG2-CZ 3.69Å; V54-F228 HydrophobicContact CG2-CE1 4.39Å; V54-F228 HydrophobicContact CG2-CZ 3.95Å
55	P	95.8	Very high	91.5	Very high	22 Å²	22	21.8 Å²	21.8	14%	0.143	13%	0.125	C	C	.	.	H	α-helix	trans	-55.8	-40.9	176.1	-30.1	36.8	0	0	0	114.3	S51 L58 Q59 Q70 F73 L387	S51-P55 VanDerWaalsContact O-CD 3.25Å; S51-P55 WeakPolarHBondContact O-CD 3.4Å; P55-L58 PolarHBondContact O-N 2.83Å; P55-Q59 VanDerWaalsContact O-CB 3.28Å; P55-Q59 WeakPolarHBondContact O-CB 3.5Å; P55-Q59 PolarHBondContact O-N 2.63Å; P55-Q70 PolarHBondContact O-NE2 2.93Å; P55-F73 HydrophobicContact CG-CD1 4.12Å; P55-F73 HydrophobicContact CG-CE1 4.36Å; P55-L387 HydrophobicContact CB-CD2 4.2Å
56	Y	95.3	Very high	91.2	Very high	55 Å²	55	24.1 Å²	24.1	22%	0.216	14%	0.137	C	C	.	.	H	α-helix	trans	-67.2	-39.3	179	-79.3	-118.8	0	0	0	111.6	A53 V54 S60 F199 L387 I390 R396 L399 V400	A53-Y56 PolarHBondContact O-N 3.05Å; V54-Y56 VanDerWaalsContact C-N 3.28Å; V54-Y56 PolarHBondContact O-N 2.92Å; Y56-S60 PolarHBondContact O-N 3.06Å; Y56-F199 HydrophobicContact CD1-CE2 4.25Å; Y56-F199 AromaticContact CD1-CZ 3.97Å; Y56-F199 HydrophobicContact CD1-CZ 3.97Å; Y56-F199 HydrophobicContact CD2-CE2 4.08Å; Y56-F199 AromaticContact CD2-CZ 3.91Å; Y56-F199 HydrophobicContact CD2-CZ 3.91Å; Y56-F199 AromaticContact CE1-CZ 3.9Å; Y56-F199 HydrophobicContact CE1-CZ 3.9Å; Y56-F199 HydrophobicContact CE2-CE2 4.48Å; Y56-F199 AromaticContact CE2-CZ 3.86Å; Y56-F199 HydrophobicContact CE2-CZ 3.86Å; Y56-F199 AromaticContact CG-CE2 3.99Å; Y56-F199 HydrophobicContact CG-CE2 3.99Å; Y56-F199 AromaticContact CG-CZ 4Å; Y56-F199 HydrophobicContact CG-CZ 4Å; Y56-F199 AromaticContact CZ-CZ 3.86Å; Y56-L387 HydrophobicContact CD2-CD2 4.26Å; Y56-L387 HydrophobicContact CE2-CD2 4.38Å; Y56-I390 HydrophobicContact CD1-CD1 3.53Å; Y56-I390 HydrophobicContact CE1-CD1 4.01Å; Y56-I390 HydrophobicContact CG-CD1 4.03Å; Y56-R396 HydrophobicContact CD1-CB 4.46Å; Y56-L399 HydrophobicContact CE1-CD2 3.81Å; Y56-L399 HydrophobicContact CE1-CG 4.28Å; Y56-V400 HydrophobicContact CD1-CG2 3.95Å; Y56-V400 HydrophobicContact CE1-CG2 4.05Å
57	L	93.8	Very high	90.9	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-65.8	-48	175.6	-173.3	64.3	0	0	0	111.1	A53 V54 Q59 S60 L127 L138 F228	A53-L57 PolarHBondContact O-N 3.26Å; V54-L57 PolarHBondContact O-N 2.96Å; V54-L57 VanDerWaalsContact O-N 3.14Å; L57-Q59 VanDerWaalsContact C-N 3.28Å; L57-Q59 PolarHBondContact O-N 3.47Å; L57-S60 PolarHBondContact O-N 2.93Å; L57-S60 VanDerWaalsContact O-N 3.17Å; L57-S60 PolarHBondContact O-OG 3.3Å; L57-L127 HydrophobicContact CD2-CD1 3.92Å; L57-L138 HydrophobicContact CG-CD2 4.18Å; L57-F228 HydrophobicContact CD2-CD1 3.95Å; L57-F228 HydrophobicContact CD2-CE1 4.25Å; L57-F228 HydrophobicContact CD2-CG 4.47Å
58	L	94.2	Very high	90.6	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-35.3	178.2	-68.1	179.6	0	0	0	112.5	V54 P55 S60 S64 A65 L127 L138 V144 I146	V54-L58 HydrophobicContact CG1-CD1 3.77Å; V54-L58 HydrophobicContact CG1-CG 4Å; V54-L58 WeakPolarHBondContact O-CG 3.2Å; V54-L58 PolarHBondContact O-N 3.05Å; P55-L58 PolarHBondContact O-N 2.83Å; L58-S60 VanDerWaalsContact C-N 3.29Å; L58-S60 PolarHBondContact O-N 3.13Å; L58-S64 CarbonylContact O-C 3.58Å; L58-S64 VanDerWaalsContact O-C 3.24Å; L58-S64 WeakPolarHBondContact O-CB 3.44Å; L58-S64 PolarHBondContact O-OG 3.13Å; L58-A65 PolarHBondContact O-N 2.94Å; L58-L127 HydrophobicContact CD2-CD2 3.91Å; L58-L138 HydrophobicContact CD2-CD2 4.08Å; L58-V144 HydrophobicContact CD2-CG1 3.78Å; L58-V144 HydrophobicContact CD2-CG2 4.37Å; L58-I146 HydrophobicContact CD1-CD1 3.6Å
59	Q	94.1	Very high	90.5	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.019	17%	0.165	C	C	.	.	H	α-helix	trans	-74.6	-20.3	179.3	-163.3	64.7	24.9	0	0	113.2	P55 L57 D61 Y67 L387 I390	P55-Q59 VanDerWaalsContact O-CB 3.28Å; P55-Q59 WeakPolarHBondContact O-CB 3.5Å; P55-Q59 PolarHBondContact O-N 2.63Å; L57-Q59 VanDerWaalsContact C-N 3.28Å; L57-Q59 PolarHBondContact O-N 3.47Å; Q59-D61 VanDerWaalsContact C-N 3.33Å; Q59-D61 PolarHBondContact O-N 2.95Å; Q59-Y67 PolarHBondContact NE2-OH 3.45Å; Q59-L387 HydrophobicContact CB-CD2 4.05Å; Q59-L387 HydrophobicContact CG-CB 3.89Å; Q59-L387 HydrophobicContact CG-CD2 4.22Å; Q59-L387 VanDerWaalsContact CG-O 3.24Å; Q59-L387 WeakPolarHBondContact CG-O 3.29Å; Q59-I390 HydrophobicContact CB-CB 4.42Å; Q59-I390 HydrophobicContact CB-CG2 4.07Å; Q59-I390 HydrophobicContact CG-CB 3.93Å; Q59-I390 HydrophobicContact CG-CG2 3.93Å
60	S	87.4	Confident	90.4	Very high	37 Å²	37	29.6 Å²	29.6	26%	0.259	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-13.4	-173.1	68.6	0	0	0	0	115.4	Y56 L57 L58 R396	Y56-S60 PolarHBondContact O-N 3.06Å; L57-S60 PolarHBondContact O-N 2.93Å; L57-S60 VanDerWaalsContact O-N 3.17Å; L57-S60 PolarHBondContact O-OG 3.3Å; L58-S60 VanDerWaalsContact C-N 3.29Å; L58-S60 PolarHBondContact O-N 3.13Å; S60-R396 VanDerWaalsContact CB-NH1 3.3Å; S60-R396 PolarHBondContact OG-NH1 2.99Å
61	D	85	Confident	90.3	Very high	19 Å²	19	29.8 Å²	29.8	10%	0.102	17%	0.167	C	C	.	.	S	Bend	trans	-114.3	125.2	175	-168.4	-45.8	0	0	0	109.8	Q59 K63 S64 A65 P137 L138	Q59-D61 VanDerWaalsContact C-N 3.33Å; Q59-D61 PolarHBondContact O-N 2.95Å; D61-K63 PolarHBondContact O-N 3.46Å; D61-K63 WeakPolarHBondContact OD1-CB 3.33Å; D61-K63 PolarHBondContact OD1-N 3.4Å; D61-S64 PolarHBondContact O-N 2.92Å; D61-S64 PolarHBondContact O-OG 3.44Å; D61-A65 WeakPolarHBondContact O-CB 3.35Å; D61-A65 PolarHBondContact O-N 2.99Å; D61-P137 VanDerWaalsContact OD2-CA 3.25Å; D61-P137 WeakPolarHBondContact OD2-CA 3.48Å; D61-P137 WeakPolarHBondContact OD2-CB 3.47Å; D61-L138 HydrophobicContact CB-CB 4.1Å; D61-L138 HydrophobicContact CB-CD1 4.39Å; D61-L138 PolarHBondContact OD2-N 2.69Å
62	P	76.8	Confident	90.3	Very high	113 Å²	113	31.4 Å²	31.4	73%	0.734	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.1	177.7	-26.5	34.5	0	0	0	114.5
63	K	76.1	Confident	90.5	Very high	114 Å²	114	30.2 Å²	30.2	50%	0.496	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-25.6	178.4	-66.5	-178.3	179.6	-179.9	0	113.2	D61	D61-K63 PolarHBondContact O-N 3.46Å; D61-K63 WeakPolarHBondContact OD1-CB 3.33Å; D61-K63 PolarHBondContact OD1-N 3.4Å
64	S	81.5	Confident	90.5	Very high	9 Å²	9	30.9 Å²	30.9	6%	0.063	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-15.4	-179.6	58.8	0	0	0	0	114.3	L58 D61 N66	L58-S64 CarbonylContact O-C 3.58Å; L58-S64 VanDerWaalsContact O-C 3.24Å; L58-S64 WeakPolarHBondContact O-CB 3.44Å; L58-S64 PolarHBondContact O-OG 3.13Å; D61-S64 PolarHBondContact O-N 2.92Å; D61-S64 PolarHBondContact O-OG 3.44Å; S64-N66 PolarHBondContact O-N 3.17Å
65	A	79.6	Confident	90.4	Very high	33 Å²	33	34.9 Å²	34.9	27%	0.273	19%	0.194	S	C	.	.			trans	-66	88.1	178.7	0	0	0	0	0	111.2	L58 D61	L58-A65 PolarHBondContact O-N 2.94Å; D61-A65 WeakPolarHBondContact O-CB 3.35Å; D61-A65 PolarHBondContact O-N 2.99Å
66	N	88.1	Confident	90.5	Very high	50 Å²	50	33.8 Å²	33.8	27%	0.267	19%	0.187	S	C	.	.			trans	-138.6	120.2	175.9	178.3	-6.9	0	0	0	109.9	S64 Q68 S69 Q70	S64-N66 PolarHBondContact O-N 3.17Å; N66-Q68 VanDerWaalsContact C-N 3.3Å; N66-Q68 PolarHBondContact O-N 3.43Å; N66-Q68 WeakPolarHBondContact OD1-CB 3.25Å; N66-Q68 PolarHBondContact OD1-N 3.3Å; N66-S69 WeakPolarHBondContact O-CB 3.27Å; N66-S69 PolarHBondContact O-N 2.81Å; N66-S69 VanDerWaalsContact O-N 3.11Å; N66-Q70 WeakPolarHBondContact O-CG 3.4Å; N66-Q70 PolarHBondContact O-N 3.49Å; N66-Q70 VanDerWaalsContact O-N 3.07Å
67	Y	92.5	Very high	90.4	Very high	3 Å²	3	33.5 Å²	33.5	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-66	-28.4	-178	-69.6	-79.1	0	0	0	113.9	Q59 S69 Q70 A71 I384 L387 K388 E391 L548 V551	Q59-Y67 PolarHBondContact NE2-OH 3.45Å; Y67-S69 VanDerWaalsContact C-N 3.31Å; Y67-S69 PolarHBondContact O-N 2.96Å; Y67-Q70 CarbonylContact O-C 3.38Å; Y67-Q70 WeakPolarHBondContact O-CB 3.41Å; Y67-Q70 PolarHBondContact O-N 2.88Å; Y67-A71 WeakPolarHBondContact O-CB 3.43Å; Y67-A71 PolarHBondContact O-N 3.49Å; Y67-I384 HydrophobicContact CE1-CG2 3.92Å; Y67-L387 HydrophobicContact CE1-CB 3.97Å; Y67-L387 HydrophobicContact CE1-CD1 4.09Å; Y67-K388 VanDerWaalsContact OH-CD 3.3Å; Y67-K388 WeakPolarHBondContact OH-CD 3.35Å; Y67-K388 WeakPolarHBondContact OH-CE 3.39Å; Y67-K388 WeakPolarHBondContact OH-CG 3.4Å; Y67-E391 WeakPolarHBondContact CE2-OE2 3.41Å; Y67-E391 PolarHBondContact OH-OE2 3.27Å; Y67-L548 CarbonylContact C-O 3.57Å; Y67-L548 WeakPolarHBondContact CB-O 3.35Å; Y67-L548 HydrophobicContact CD1-CD2 3.98Å; Y67-V551 HydrophobicContact CD1-CB 4.37Å; Y67-V551 HydrophobicContact CD1-CG1 4.32Å; Y67-V551 HydrophobicContact CD1-CG2 4.19Å; Y67-V551 HydrophobicContact CD2-CB 4.16Å; Y67-V551 HydrophobicContact CD2-CG1 3.54Å; Y67-V551 HydrophobicContact CE2-CG1 3.95Å; Y67-V551 HydrophobicContact CG-CB 3.86Å; Y67-V551 HydrophobicContact CG-CG1 3.74Å; Y67-V551 HydrophobicContact CG-CG2 4.19Å
68	Q	90.6	Very high	90.4	Very high	97 Å²	97	36 Å²	36	45%	0.453	20%	0.196	S	C	.	.	H	α-helix	trans	-65.8	-37.9	173.2	-169.3	64.8	12.2	0	0	111.5	N66 A71 A72 S549	N66-Q68 VanDerWaalsContact C-N 3.3Å; N66-Q68 PolarHBondContact O-N 3.43Å; N66-Q68 WeakPolarHBondContact OD1-CB 3.25Å; N66-Q68 PolarHBondContact OD1-N 3.3Å; Q68-A71 PolarHBondContact O-N 3.4Å; Q68-A72 PolarHBondContact O-N 3.02Å; Q68-S549 PolarHBondContact OE1-O 3Å
69	S	92.4	Very high	90.3	Very high	29 Å²	29	36 Å²	36	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-39.7	172.3	-64.6	0	0	0	0	111.2	N66 Y67 A71 A72 F73 I146	N66-S69 WeakPolarHBondContact O-CB 3.27Å; N66-S69 PolarHBondContact O-N 2.81Å; N66-S69 VanDerWaalsContact O-N 3.11Å; Y67-S69 VanDerWaalsContact C-N 3.31Å; Y67-S69 PolarHBondContact O-N 2.96Å; S69-A71 VanDerWaalsContact C-N 3.35Å; S69-A72 PolarHBondContact O-N 3.49Å; S69-F73 WeakPolarHBondContact O-CB 3.3Å; S69-F73 PolarHBondContact O-N 3.26Å; S69-I146 VanDerWaalsContact O-CG1 3.25Å; S69-I146 WeakPolarHBondContact O-CG1 3.11Å
70	Q	94.7	Very high	90.1	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.014	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-41.5	174.5	-59.6	-70.9	6.1	0	0	111.7	P55 N66 Y67 F73 S74 L387 L548	P55-Q70 PolarHBondContact O-NE2 2.93Å; N66-Q70 WeakPolarHBondContact O-CG 3.4Å; N66-Q70 PolarHBondContact O-N 3.49Å; N66-Q70 VanDerWaalsContact O-N 3.07Å; Y67-Q70 CarbonylContact O-C 3.38Å; Y67-Q70 WeakPolarHBondContact O-CB 3.41Å; Y67-Q70 PolarHBondContact O-N 2.88Å; Q70-F73 PolarHBondContact O-N 2.96Å; Q70-S74 WeakPolarHBondContact O-CB 3.5Å; Q70-S74 PolarHBondContact O-N 2.83Å; Q70-L387 HydrophobicContact CG-CD1 4.34Å; Q70-L548 HydrophobicContact CB-CD1 4.5Å; Q70-L548 HydrophobicContact CB-CD2 4.16Å
71	A	96.2	Very high	90.3	Very high	3 Å²	3	35.8 Å²	35.8	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-45.8	174.7	0	0	0	0	0	111.1	Y67 Q68 S69 F73 S74 F75 L548	Y67-A71 WeakPolarHBondContact O-CB 3.43Å; Y67-A71 PolarHBondContact O-N 3.49Å; Q68-A71 PolarHBondContact O-N 3.4Å; S69-A71 VanDerWaalsContact C-N 3.35Å; A71-F73 VanDerWaalsContact C-N 3.33Å; A71-F73 PolarHBondContact O-N 2.78Å; A71-S74 WeakPolarHBondContact O-CB 3.28Å; A71-S74 PolarHBondContact O-N 3.5Å; A71-S74 PolarHBondContact O-OG 3.5Å; A71-F75 WeakPolarHBondContact O-CD2 3.06Å; A71-L548 HydrophobicContact CB-CB 3.76Å
72	A	96.1	Very high	90.5	Very high	34 Å²	34	38 Å²	38	28%	0.281	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-44.6	174.1	0	0	0	0	0	111.6	Q68 S69 S74 F75 I146 T150	Q68-A72 PolarHBondContact O-N 3.02Å; S69-A72 PolarHBondContact O-N 3.49Å; A72-S74 VanDerWaalsContact C-N 3.33Å; A72-S74 PolarHBondContact O-N 3.18Å; A72-F75 WeakPolarHBondContact O-CB 3.33Å; A72-F75 WeakPolarHBondContact O-CD2 3.33Å; A72-F75 PolarHBondContact O-N 3.42Å; A72-I146 HydrophobicContact CB-CG1 4.31Å; A72-I146 HydrophobicContact CB-CG2 4.42Å; A72-T150 WeakPolarHBondContact O-CG2 3.4Å; A72-T150 PolarHBondContact O-OG1 2.99Å
73	F	97.1	Very high	91.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68.7	-30.2	178.4	-172.4	-96.7	0	0	0	113.4	S51 V54 P55 S69 Q70 A71 F75 A76 I146 L149 T150 F153	S51-F73 WeakPolarHBondContact O-CE1 3.4Å; V54-F73 HydrophobicContact CB-CD1 4.27Å; V54-F73 HydrophobicContact CB-CE1 3.54Å; V54-F73 HydrophobicContact CB-CE2 4.2Å; V54-F73 HydrophobicContact CB-CZ 3.49Å; V54-F73 VanDerWaalsContact CB-CZ 3.49Å; V54-F73 HydrophobicContact CG1-CD1 3.99Å; V54-F73 HydrophobicContact CG1-CD2 4.05Å; V54-F73 HydrophobicContact CG1-CE1 3.68Å; V54-F73 HydrophobicContact CG1-CE2 3.71Å; V54-F73 HydrophobicContact CG1-CG 4.18Å; V54-F73 HydrophobicContact CG1-CZ 3.52Å; V54-F73 HydrophobicContact CG2-CE1 4.25Å; V54-F73 HydrophobicContact CG2-CE2 4.38Å; V54-F73 HydrophobicContact CG2-CZ 3.73Å; P55-F73 HydrophobicContact CG-CD1 4.12Å; P55-F73 HydrophobicContact CG-CE1 4.36Å; S69-F73 WeakPolarHBondContact O-CB 3.3Å; S69-F73 PolarHBondContact O-N 3.26Å; Q70-F73 PolarHBondContact O-N 2.96Å; A71-F73 VanDerWaalsContact C-N 3.33Å; A71-F73 PolarHBondContact O-N 2.78Å; F73-F75 PolarHBondContact O-N 3.27Å; F73-A76 HydrophobicContact CE2-CB 4.43Å; F73-A76 HydrophobicContact CZ-CB 4.34Å; F73-A76 WeakPolarHBondContact O-CB 3.22Å; F73-A76 PolarHBondContact O-N 3.26Å; F73-I146 HydrophobicContact CB-CD1 3.79Å; F73-I146 HydrophobicContact CB-CG1 4.24Å; F73-I146 HydrophobicContact CD2-CD1 4.28Å; F73-I146 HydrophobicContact CG-CD1 4.36Å; F73-L149 HydrophobicContact CD2-CB 4.18Å; F73-L149 HydrophobicContact CE2-CB 4.15Å; F73-T150 WeakPolarHBondContact CA-OG1 3.44Å; F73-F153 HydrophobicContact CE2-CB 3.85Å; F73-F153 AromaticContact CE2-CD2 3.96Å; F73-F153 HydrophobicContact CE2-CD2 3.96Å; F73-F153 AromaticContact CE2-CG 3.88Å; F73-F153 HydrophobicContact CE2-CG 3.88Å; F73-F153 HydrophobicContact CZ-CB 3.83Å; F73-F153 HydrophobicContact CZ-CD1 4Å; F73-F153 HydrophobicContact CZ-CD2 4.15Å; F73-F153 AromaticContact CZ-CG 3.72Å; F73-F153 HydrophobicContact CZ-CG 3.72Å
74	S	96.1	Very high	91.5	Very high	16 Å²	16	29 Å²	29	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-58.4	-23.7	178.5	77.9	0	0	0	0	113.4	Q70 A71 A72 A76 F77 T545	Q70-S74 WeakPolarHBondContact O-CB 3.5Å; Q70-S74 PolarHBondContact O-N 2.83Å; A71-S74 WeakPolarHBondContact O-CB 3.28Å; A71-S74 PolarHBondContact O-N 3.5Å; A71-S74 PolarHBondContact O-OG 3.5Å; A72-S74 VanDerWaalsContact C-N 3.33Å; A72-S74 PolarHBondContact O-N 3.18Å; S74-A76 PolarHBondContact O-N 3.11Å; S74-F77 PolarHBondContact O-N 3.04Å; S74-F77 VanDerWaalsContact O-N 3.13Å; S74-T545 WeakPolarHBondContact OG-CA 3Å; S74-T545 WeakPolarHBondContact OG-CB 3.37Å; S74-T545 WeakPolarHBondContact OG-CG2 3.5Å; S74-T545 PolarHBondContact OG-OG1 2.98Å
75	F	95.8	Very high	91.8	Very high	85 Å²	85	31.5 Å²	31.5	37%	0.373	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-59.5	-25	171.8	-76.8	-82.1	0	0	0	113.2	A71 A72 F73 F77 W78 T150 F154 T545	A71-F75 WeakPolarHBondContact O-CD2 3.06Å; A72-F75 WeakPolarHBondContact O-CB 3.33Å; A72-F75 WeakPolarHBondContact O-CD2 3.33Å; A72-F75 PolarHBondContact O-N 3.42Å; F73-F75 PolarHBondContact O-N 3.27Å; F75-F77 PolarHBondContact O-N 2.92Å; F75-F77 VanDerWaalsContact O-N 3.1Å; F75-W78 AromaticContact CD1-CD2 3.78Å; F75-W78 HydrophobicContact CD1-CD2 3.78Å; F75-W78 AromaticContact CD1-CE2 3.61Å; F75-W78 HydrophobicContact CD1-CE3 4.16Å; F75-W78 HydrophobicContact CD1-CG 4.24Å; F75-W78 HydrophobicContact CD1-CH2 4.26Å; F75-W78 AromaticContact CD1-CZ2 3.87Å; F75-W78 HydrophobicContact CD1-CZ2 3.87Å; F75-W78 HydrophobicContact CD1-CZ3 4.39Å; F75-W78 AromaticContact CD1-NE1 3.93Å; F75-W78 HydrophobicContact CE1-CD2 4.16Å; F75-W78 AromaticContact CE1-CE2 3.72Å; F75-W78 HydrophobicContact CE1-CE3 4.3Å; F75-W78 AromaticContact CE1-CH2 3.64Å; F75-W78 HydrophobicContact CE1-CH2 3.64Å; F75-W78 AromaticContact CE1-CZ2 3.45Å; F75-W78 HydrophobicContact CE1-CZ2 3.45Å; F75-W78 VanDerWaalsContact CE1-CZ2 3.45Å; F75-W78 HydrophobicContact CE1-CZ3 4.07Å; F75-W78 HydrophobicContact CZ-CZ2 4.22Å; F75-W78 WeakPolarHBondContact O-CB 3.28Å; F75-W78 PolarHBondContact O-N 3.49Å; F75-W78 VanDerWaalsContact O-N 3.07Å; F75-T150 HydrophobicContact CB-CG2 4.14Å; F75-F154 WeakPolarHBondContact O-CD2 3.28Å; F75-T545 HydrophobicContact CD2-CG2 4.13Å; F75-T545 HydrophobicContact CE1-CG2 4.34Å; F75-T545 HydrophobicContact CE2-CG2 3.56Å; F75-T545 HydrophobicContact CZ-CG2 3.68Å
76	A	96.4	Very high	92.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-58.4	-23.5	175.9	0	0	0	0	0	113	F73 S74 F153 T157	F73-A76 HydrophobicContact CE2-CB 4.43Å; F73-A76 HydrophobicContact CZ-CB 4.34Å; F73-A76 WeakPolarHBondContact O-CB 3.22Å; F73-A76 PolarHBondContact O-N 3.26Å; S74-A76 PolarHBondContact O-N 3.11Å; A76-F153 HydrophobicContact CB-CB 3.8Å; A76-T157 WeakPolarHBondContact O-CB 3.44Å; A76-T157 WeakPolarHBondContact O-CG2 3.48Å; A76-T157 PolarHBondContact O-OG1 3.02Å
77	F	93.2	Very high	92.2	Very high	49 Å²	49	29.8 Å²	29.8	22%	0.215	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-86.7	-17.2	178.6	-74	-82.7	0	0	0	114.5	S52 S74 F75 P79 F80	S52-F77 WeakPolarHBondContact OG-CZ 3.41Å; S74-F77 PolarHBondContact O-N 3.04Å; S74-F77 VanDerWaalsContact O-N 3.13Å; F75-F77 PolarHBondContact O-N 2.92Å; F75-F77 VanDerWaalsContact O-N 3.1Å; F77-P79 VanDerWaalsContact C-CD 3.41Å; F77-F80 WeakPolarHBondContact O-CB 3.47Å; F77-F80 PolarHBondContact O-N 3.42Å; F77-F80 VanDerWaalsContact O-N 3.08Å
78	W	93.9	Very high	91.6	Very high	56 Å²	56	30 Å²	30	21%	0.212	16%	0.161	C	C	.	.	H	α-helix	trans	-57.5	-37.6	-173.2	-78.4	38.3	0	0	0	114.7	F75 F80 S81 L82 L542 T545	F75-W78 AromaticContact CD1-CD2 3.78Å; F75-W78 HydrophobicContact CD1-CD2 3.78Å; F75-W78 AromaticContact CD1-CE2 3.61Å; F75-W78 HydrophobicContact CD1-CE3 4.16Å; F75-W78 HydrophobicContact CD1-CG 4.24Å; F75-W78 HydrophobicContact CD1-CH2 4.26Å; F75-W78 AromaticContact CD1-CZ2 3.87Å; F75-W78 HydrophobicContact CD1-CZ2 3.87Å; F75-W78 HydrophobicContact CD1-CZ3 4.39Å; F75-W78 AromaticContact CD1-NE1 3.93Å; F75-W78 HydrophobicContact CE1-CD2 4.16Å; F75-W78 AromaticContact CE1-CE2 3.72Å; F75-W78 HydrophobicContact CE1-CE3 4.3Å; F75-W78 AromaticContact CE1-CH2 3.64Å; F75-W78 HydrophobicContact CE1-CH2 3.64Å; F75-W78 AromaticContact CE1-CZ2 3.45Å; F75-W78 HydrophobicContact CE1-CZ2 3.45Å; F75-W78 VanDerWaalsContact CE1-CZ2 3.45Å; F75-W78 HydrophobicContact CE1-CZ3 4.07Å; F75-W78 HydrophobicContact CZ-CZ2 4.22Å; F75-W78 WeakPolarHBondContact O-CB 3.28Å; F75-W78 PolarHBondContact O-N 3.49Å; F75-W78 VanDerWaalsContact O-N 3.07Å; W78-F80 PolarHBondContact O-N 3.39Å; W78-S81 PolarHBondContact O-N 2.83Å; W78-S81 VanDerWaalsContact O-N 3.11Å; W78-L82 HydrophobicContact CB-CD1 4.45Å; W78-L82 HydrophobicContact CE3-CD1 4.24Å; W78-L82 WeakPolarHBondContact O-CB 3.48Å; W78-L82 WeakPolarHBondContact O-CG 3.5Å; W78-L82 PolarHBondContact O-N 3.01Å; W78-L542 HydrophobicContact CH2-CD1 3.79Å; W78-L542 HydrophobicContact CZ2-CD1 3.87Å; W78-T545 HydrophobicContact CZ2-CG2 4.4Å; W78-T545 PolarHBondContact NE1-OG1 3.29Å; W78-T545 VanDerWaalsContact NE1-OG1 3.12Å
79	P	93.7	Very high	91.5	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.019	15%	0.153	C	C	.	.	H	α-helix	trans	-54.9	-37.6	176.2	-29.1	37.4	0	0	0	113.4	F77 S81 L82 K83 W86 F154 T157 F158	F77-P79 VanDerWaalsContact C-CD 3.41Å; P79-S81 VanDerWaalsContact C-N 3.34Å; P79-S81 PolarHBondContact O-N 2.84Å; P79-L82 CarbonylContact O-C 3.24Å; P79-L82 PolarHBondContact O-N 3.06Å; P79-K83 PolarHBondContact O-N 3.02Å; P79-W86 HydrophobicContact CB-CH2 3.98Å; P79-W86 WeakPolarHBondContact O-CH2 3.44Å; P79-F154 HydrophobicContact CG-CD1 4.02Å; P79-F154 HydrophobicContact CG-CD2 3.59Å; P79-F154 HydrophobicContact CG-CE1 3.8Å; P79-F154 HydrophobicContact CG-CE2 3.37Å; P79-F154 HydrophobicContact CG-CG 3.91Å; P79-F154 HydrophobicContact CG-CZ 3.49Å; P79-F154 VanDerWaalsContact CG-CZ 3.49Å; P79-T157 HydrophobicContact CB-CG2 4.27Å; P79-F158 HydrophobicContact CB-CB 3.82Å; P79-F158 HydrophobicContact CB-CD2 4.18Å; P79-F158 HydrophobicContact CG-CB 4.09Å
80	F	89.8	Confident	91.2	Very high	32 Å²	32	26.8 Å²	26.8	14%	0.14	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-40.6	179.5	-161.1	-99.6	0	0	0	112.1	L48 F77 W78 L82 T157 A161 D164	L48-F80 HydrophobicContact CD1-CD2 4.13Å; L48-F80 HydrophobicContact CD1-CE1 4.43Å; L48-F80 HydrophobicContact CD1-CE2 3.71Å; L48-F80 HydrophobicContact CD1-CZ 3.87Å; L48-F80 HydrophobicContact CD2-CD2 3.87Å; L48-F80 HydrophobicContact CD2-CE2 4.3Å; L48-F80 HydrophobicContact CD2-CG 4.2Å; F77-F80 WeakPolarHBondContact O-CB 3.47Å; F77-F80 PolarHBondContact O-N 3.42Å; F77-F80 VanDerWaalsContact O-N 3.08Å; W78-F80 PolarHBondContact O-N 3.39Å; F80-L82 VanDerWaalsContact C-N 3.35Å; F80-T157 HydrophobicContact CB-CG2 3.68Å; F80-A161 HydrophobicContact CB-CB 4.5Å; F80-A161 HydrophobicContact CD2-CB 3.89Å; F80-D164 HydrophobicContact CE2-CB 4.39Å
81	S	90.1	Very high	90.4	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.028	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-36.1	175.9	-59.4	0	0	0	0	111.9	W78 P79 T534 N537 S541	W78-S81 PolarHBondContact O-N 2.83Å; W78-S81 VanDerWaalsContact O-N 3.11Å; P79-S81 VanDerWaalsContact C-N 3.34Å; P79-S81 PolarHBondContact O-N 2.84Å; S81-T534 WeakPolarHBondContact O-CB 3.45Å; S81-T534 WeakPolarHBondContact O-CG2 3.32Å; S81-T534 PolarHBondContact O-OG1 3.25Å; S81-T534 VanDerWaalsContact O-OG1 3.04Å; S81-N537 WeakPolarHBondContact OG-CB 3.37Å; S81-S541 PolarHBondContact OG-OG 3.22Å
82	L	90.7	Very high	89.7	Confident	65 Å²	65	31.7 Å²	31.7	34%	0.34	17%	0.174	S	C	.	.	H	α-helix	trans	-93.5	7.9	-173.9	-62.1	175.2	0	0	0	114.4	W78 P79 F80 L84 A85 W86 L538	W78-L82 HydrophobicContact CB-CD1 4.45Å; W78-L82 HydrophobicContact CE3-CD1 4.24Å; W78-L82 WeakPolarHBondContact O-CB 3.48Å; W78-L82 WeakPolarHBondContact O-CG 3.5Å; W78-L82 PolarHBondContact O-N 3.01Å; P79-L82 CarbonylContact O-C 3.24Å; P79-L82 PolarHBondContact O-N 3.06Å; F80-L82 VanDerWaalsContact C-N 3.35Å; L82-L84 PolarHBondContact O-N 3.36Å; L82-A85 VanDerWaalsContact O-CB 3.25Å; L82-A85 WeakPolarHBondContact O-CB 3.48Å; L82-A85 PolarHBondContact O-N 2.88Å; L82-W86 HydrophobicContact CB-CZ3 4.34Å; L82-W86 WeakPolarHBondContact O-CZ3 3.33Å; L82-L538 HydrophobicContact CD2-CD1 4.05Å; L82-L538 HydrophobicContact CD2-CD2 4.33Å
83	K	88.4	Confident	89.1	Confident	12 Å²	12	34.8 Å²	34.8	5%	0.052	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-53.7	-27.4	-173.7	74.4	176.5	-176.4	161.2	0	114.6	P79 A85 W86 A87 A161 D164 I165 D168	P79-K83 PolarHBondContact O-N 3.02Å; K83-A85 PolarHBondContact O-N 3.34Å; K83-A85 VanDerWaalsContact O-N 3.12Å; K83-W86 HydrophobicContact CB-CH2 4.35Å; K83-W86 HydrophobicContact CB-CZ2 4.09Å; K83-W86 PolarHBondContact O-N 2.74Å; K83-A87 PolarHBondContact O-N 3.27Å; K83-A161 HydrophobicContact CB-CB 4.05Å; K83-D164 IonicContact NZ-OD2 2.71Å; K83-D164 PolarHBondContact NZ-OD2 2.99Å; K83-I165 HydrophobicContact CB-CD1 3.94Å; K83-I165 HydrophobicContact CB-CG1 4.43Å; K83-I165 HydrophobicContact CD-CG1 4.15Å; K83-I165 HydrophobicContact CG-CD1 4.43Å; K83-I165 HydrophobicContact CG-CG1 4.44Å; K83-D168 IonicContact NZ-OD2 3.69Å
84	L	84.6	Confident	88.6	Confident	25 Å²	25	39.5 Å²	39.5	13%	0.131	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-53.3	-31.1	172.5	-170.3	76.4	0	0	0	113.1	L82 W86 P88 M355 T530 L531 T534	L82-L84 PolarHBondContact O-N 3.36Å; L84-W86 VanDerWaalsContact C-N 3.25Å; L84-W86 PolarHBondContact O-N 3.01Å; L84-P88 WeakPolarHBondContact O-CD 3.16Å; L84-M355 HydrophobicContact CD1-SD 3.48Å; L84-M355 WeakPolarHBondContact CD1-SD 3.45Å; L84-M355 HydrophobicContact CG-SD 3.99Å; L84-T530 HydrophobicContact CD1-CG2 3.88Å; L84-L531 HydrophobicContact CD1-CB 4.32Å; L84-L531 HydrophobicContact CD2-CB 4.27Å; L84-L531 HydrophobicContact CD2-CD1 3.42Å; L84-L531 VanDerWaalsContact CD2-CD1 3.42Å; L84-L531 HydrophobicContact CD2-CG 4.45Å; L84-T534 HydrophobicContact CB-CG2 4.02Å; L84-T534 HydrophobicContact CD2-CG2 4.31Å
85	A	87.2	Confident	88.1	Confident	63 Å²	63	40.9 Å²	40.9	52%	0.521	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-62.6	-30	-176.3	0	0	0	0	0	113.1	L82 K83 Y352	L82-A85 VanDerWaalsContact O-CB 3.25Å; L82-A85 WeakPolarHBondContact O-CB 3.48Å; L82-A85 PolarHBondContact O-N 2.88Å; K83-A85 PolarHBondContact O-N 3.34Å; K83-A85 VanDerWaalsContact O-N 3.12Å; A85-Y352 PolarHBondContact O-OH 3.32Å
86	W	90.7	Very high	87.4	Confident	38 Å²	38	42.1 Å²	42.1	14%	0.144	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-1.7	177.6	65.1	95.5	0	0	0	114.4	P79 L82 K83 L84 P88 I89 V90 F158 A161 T162	P79-W86 HydrophobicContact CB-CH2 3.98Å; P79-W86 WeakPolarHBondContact O-CH2 3.44Å; L82-W86 HydrophobicContact CB-CZ3 4.34Å; L82-W86 WeakPolarHBondContact O-CZ3 3.33Å; K83-W86 HydrophobicContact CB-CH2 4.35Å; K83-W86 HydrophobicContact CB-CZ2 4.09Å; K83-W86 PolarHBondContact O-N 2.74Å; L84-W86 VanDerWaalsContact C-N 3.25Å; L84-W86 PolarHBondContact O-N 3.01Å; W86-P88 VanDerWaalsContact C-CD 3.5Å; W86-I89 HydrophobicContact CB-CD1 4.27Å; W86-I89 VanDerWaalsContact O-CB 3.31Å; W86-I89 WeakPolarHBondContact O-CB 3.47Å; W86-I89 PolarHBondContact O-N 3.36Å; W86-V90 PolarHBondContact O-N 3.34Å; W86-F158 AromaticContact CD2-CE2 3.89Å; W86-F158 HydrophobicContact CD2-CE2 3.89Å; W86-F158 HydrophobicContact CD2-CZ 4.49Å; W86-F158 AromaticContact CE2-CE2 3.61Å; W86-F158 HydrophobicContact CE3-CE2 4.1Å; W86-F158 AromaticContact CH2-CD2 3.66Å; W86-F158 HydrophobicContact CH2-CD2 3.66Å; W86-F158 AromaticContact CH2-CE2 3.77Å; W86-F158 HydrophobicContact CH2-CE2 3.77Å; W86-F158 AromaticContact CZ2-CD2 3.57Å; W86-F158 HydrophobicContact CZ2-CD2 3.57Å; W86-F158 AromaticContact CZ2-CE2 3.56Å; W86-F158 HydrophobicContact CZ2-CE2 3.56Å; W86-F158 HydrophobicContact CZ2-CG 4.47Å; W86-F158 HydrophobicContact CZ2-CZ 4.45Å; W86-F158 HydrophobicContact CZ3-CD2 4.29Å; W86-F158 HydrophobicContact CZ3-CE2 4.06Å; W86-A161 HydrophobicContact CZ2-CB 3.97Å; W86-T162 PolarHBondContact NE1-OG1 2.92Å
87	A	85.1	Confident	86.9	Confident	9 Å²	9	53.3 Å²	53.3	7%	0.074	28%	0.275	C	S	.	.	H	α-helix	trans	-51.2	-44.9	177	0	0	0	0	0	114.1	K83 I89 V90 D91 I165	K83-A87 PolarHBondContact O-N 3.27Å; A87-I89 PolarHBondContact O-N 3.03Å; A87-V90 WeakPolarHBondContact O-CB 2.84Å; A87-V90 PolarHBondContact O-N 3.34Å; A87-V90 VanDerWaalsContact O-N 3.15Å; A87-D91 PolarHBondContact O-N 3.07Å; A87-D91 VanDerWaalsContact O-N 3.09Å; A87-I165 HydrophobicContact CB-CD1 3.72Å; A87-I165 HydrophobicContact CB-CG1 3.96Å; A87-I165 HydrophobicContact CB-CG2 3.98Å
88	P	81.7	Confident	86.6	Confident	6 Å²	6	55.4 Å²	55.4	4%	0.039	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-29.2	176.6	-23.6	34.3	0	0	0	114.1	L84 W86 D91 S92 L348 T351 Y352 M355	L84-P88 WeakPolarHBondContact O-CD 3.16Å; W86-P88 VanDerWaalsContact C-CD 3.5Å; P88-D91 PolarHBondContact O-N 3.45Å; P88-S92 VanDerWaalsContact O-CB 3.28Å; P88-S92 WeakPolarHBondContact O-CB 3.08Å; P88-S92 PolarHBondContact O-N 2.91Å; P88-S92 PolarHBondContact O-OG 3.36Å; P88-L348 HydrophobicContact CB-CD1 3.5Å; P88-L348 VanDerWaalsContact CB-CD1 3.5Å; P88-L348 WeakPolarHBondContact O-CD1 3.45Å; P88-T351 HydrophobicContact CB-CG2 4.03Å; P88-T351 HydrophobicContact CG-CG2 4.12Å; P88-Y352 HydrophobicContact CB-CD2 4.14Å; P88-Y352 HydrophobicContact CB-CE2 3.75Å; P88-Y352 HydrophobicContact CG-CD1 4.22Å; P88-Y352 HydrophobicContact CG-CD2 4.3Å; P88-Y352 HydrophobicContact CG-CE1 3.86Å; P88-Y352 HydrophobicContact CG-CE2 3.96Å; P88-Y352 HydrophobicContact CG-CG 4.42Å; P88-M355 HydrophobicContact CB-CE 4.49Å; P88-M355 HydrophobicContact CG-CE 3.18Å; P88-M355 HydrophobicContact CG-SD 4.16Å
89	I	87	Confident	86.2	Confident	58 Å²	58	53.4 Å²	53.4	30%	0.297	28%	0.284	S	S	.	.	H	α-helix	trans	-68	-45.7	177.5	-60.1	173.2	0	0	0	109.3	W86 A87 D91 S92 L93 L348 Y352	W86-I89 HydrophobicContact CB-CD1 4.27Å; W86-I89 VanDerWaalsContact O-CB 3.31Å; W86-I89 WeakPolarHBondContact O-CB 3.47Å; W86-I89 PolarHBondContact O-N 3.36Å; A87-I89 PolarHBondContact O-N 3.03Å; I89-D91 VanDerWaalsContact C-N 3.25Å; I89-D91 PolarHBondContact O-N 3.06Å; I89-S92 PolarHBondContact O-N 3.41Å; I89-S92 PolarHBondContact O-OG 3.12Å; I89-L93 HydrophobicContact CG2-CD1 3.62Å; I89-L93 HydrophobicContact CG2-CG 4.18Å; I89-L93 PolarHBondContact O-N 2.8Å; I89-L348 HydrophobicContact CG1-CD1 4.37Å; I89-Y352 HydrophobicContact CG1-CE2 4.44Å
90	V	86.1	Confident	85.8	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-36	177.8	178.8	0	0	0	0	111.3	W86 A87 W104 T162 I165 V166	W86-V90 PolarHBondContact O-N 3.34Å; A87-V90 WeakPolarHBondContact O-CB 2.84Å; A87-V90 PolarHBondContact O-N 3.34Å; A87-V90 VanDerWaalsContact O-N 3.15Å; V90-W104 HydrophobicContact CG1-CB 4.26Å; V90-W104 HydrophobicContact CG1-CD2 4.14Å; V90-W104 HydrophobicContact CG1-CG 3.88Å; V90-W104 VanDerWaalsContact O-CD1 3.24Å; V90-W104 PolarHBondContact O-NE1 3.07Å; V90-T162 HydrophobicContact CG2-CG2 3.91Å; V90-I165 HydrophobicContact CB-CG2 4Å; V90-I165 HydrophobicContact CG1-CB 4.48Å; V90-I165 HydrophobicContact CG1-CG2 3.88Å; V90-V166 HydrophobicContact CG1-CG2 3.42Å; V90-V166 VanDerWaalsContact CG1-CG2 3.42Å
91	D	79.1	Confident	85.8	Confident	64 Å²	64	54.8 Å²	54.8	34%	0.342	29%	0.288	S	S	.	.	H	α-helix	trans	-77.1	-30.9	178.3	-78.7	-38.5	0	0	0	114.2	A87 P88 I89 R101	A87-D91 PolarHBondContact O-N 3.07Å; A87-D91 VanDerWaalsContact O-N 3.09Å; P88-D91 PolarHBondContact O-N 3.45Å; I89-D91 VanDerWaalsContact C-N 3.25Å; I89-D91 PolarHBondContact O-N 3.06Å; D91-R101 IonicContact OD1-CZ 3.22Å; D91-R101 IonicContact OD1-NH1 3.85Å; D91-R101 PolarHBondContact OD1-NH1 2.66Å; D91-R101 IonicContact OD1-NH2 2.79Å
92	S	80.5	Confident	85.9	Confident	45 Å²	45	55.6 Å²	55.6	32%	0.315	29%	0.291	S	S	.	.	H	α-helix	trans	-95.5	-33.1	-171.7	58.9	0	0	0	0	114.6	P88 I89 L348	P88-S92 VanDerWaalsContact O-CB 3.28Å; P88-S92 WeakPolarHBondContact O-CB 3.08Å; P88-S92 PolarHBondContact O-N 2.91Å; P88-S92 PolarHBondContact O-OG 3.36Å; I89-S92 PolarHBondContact O-N 3.41Å; I89-S92 PolarHBondContact O-OG 3.12Å; S92-L348 WeakPolarHBondContact OG-CD1 3.44Å
93	L	83.5	Confident	86.1	Confident	99 Å²	99	54 Å²	54	52%	0.518	28%	0.284	S	S	.	.			trans	-93.4	112.4	-178.9	-61.6	-175.6	0	0	0	109.6	I89 W104	I89-L93 HydrophobicContact CG2-CD1 3.62Å; I89-L93 HydrophobicContact CG2-CG 4.18Å; I89-L93 PolarHBondContact O-N 2.8Å; L93-W104 HydrophobicContact CB-CZ2 4.21Å; L93-W104 PolarHBondContact O-NE1 3.04Å
94	Y	87.3	Confident	86.3	Confident	99 Å²	99	56.7 Å²	56.7	39%	0.388	29%	0.294	S	S	.	.			trans	-152.6	161.8	175.1	63.9	-85.7	0	0	0	113.1	R100	Y94-R100 HydrophobicContact CD1-CB 4.26Å; Y94-R100 HydrophobicContact CD1-CG 3.8Å; Y94-R100 HydrophobicContact CD2-CB 3.92Å; Y94-R100 HydrophobicContact CD2-CG 4.37Å; Y94-R100 HydrophobicContact CE1-CG 4.28Å; Y94-R100 HydrophobicContact CE2-CB 4.31Å; Y94-R100 HydrophobicContact CG-CB 3.9Å; Y94-R100 HydrophobicContact CG-CG 3.87Å
95	S	86.5	Confident	86.9	Confident	45 Å²	45	55.5 Å²	55.5	32%	0.315	29%	0.288	S	S	.	.			trans	-94.3	122.8	173.7	-179.6	0	0	0	0	110.2	R97 I98 G99 T103	S95-R97 PolarHBondContact O-N 3.15Å; S95-I98 PolarHBondContact O-N 3.08Å; S95-G99 PolarHBondContact O-N 3.05Å; S95-T103 PolarHBondContact N-OG1 3.48Å; S95-T103 VanDerWaalsContact N-OG1 3.09Å; S95-T103 PolarHBondContact O-OG1 2.85Å
96	S	80.7	Confident	87.3	Confident	111 Å²	111	54.1 Å²	54.1	78%	0.776	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.9	177.5	58.1	0	0	0	0	113.5
97	R	86	Confident	87.6	Confident	235 Å²	235	55.9 Å²	55.9	89%	0.887	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-36.1	178.5	-66.1	-176.6	-176.9	174.3	1.2	113.2	S95	S95-R97 PolarHBondContact O-N 3.15Å
98	I	85.2	Confident	88.2	Confident	92 Å²	92	56.2 Å²	56.2	47%	0.472	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-32.8	-173.8	-58	178	0	0	0	110.6	S95 K102	S95-I98 PolarHBondContact O-N 3.08Å; I98-K102 HydrophobicContact CG2-CB 3.58Å; I98-K102 HydrophobicContact CG2-CD 4.47Å
99	G	86	Confident	88.9	Confident	15 Å²	15	56 Å²	56	16%	0.155	29%	0.286	C	S	.	.			trans	106.5	154.2	-172	0	0	0	0	0	111.4	S95 R101 T103 E252	S95-G99 PolarHBondContact O-N 3.05Å; G99-R101 PolarHBondContact O-N 3.29Å; G99-T103 WeakPolarHBondContact O-CB 3.29Å; G99-T103 PolarHBondContact O-N 3.17Å; G99-T103 VanDerWaalsContact O-N 3.09Å; G99-T103 PolarHBondContact O-OG1 3.19Å; G99-E252 VanDerWaalsContact C-OE2 3.26Å; G99-E252 VanDerWaalsContact CA-OE2 3.28Å; G99-E252 WeakPolarHBondContact CA-OE2 3.29Å
100	R	85.3	Confident	89.5	Confident	44 Å²	44	56.8 Å²	56.8	17%	0.166	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-47	-171.1	-180	174	60.5	-162.7	-0.8	111.5	Y94 E252 E345	Y94-R100 HydrophobicContact CD1-CB 4.26Å; Y94-R100 HydrophobicContact CD1-CG 3.8Å; Y94-R100 HydrophobicContact CD2-CB 3.92Å; Y94-R100 HydrophobicContact CD2-CG 4.37Å; Y94-R100 HydrophobicContact CE1-CG 4.28Å; Y94-R100 HydrophobicContact CE2-CB 4.31Å; Y94-R100 HydrophobicContact CG-CB 3.9Å; Y94-R100 HydrophobicContact CG-CG 3.87Å; R100-E252 PolarHBondContact N-OE1 2.88Å; R100-E252 PolarHBondContact N-OE2 3.49Å; R100-E345 IonicContact NH1-OE1 3.65Å
101	R	90.1	Very high	90.1	Very high	19 Å²	19	58.4 Å²	58.4	7%	0.072	30%	0.299	C	S	.	.	H	α-helix	trans	-78.8	-44.6	-174.6	-55.6	-55.8	-178.4	-162.1	5	111.5	D91 G99 T103 W104 L105 V166 G169 W170 E252	D91-R101 IonicContact OD1-CZ 3.22Å; D91-R101 IonicContact OD1-NH1 3.85Å; D91-R101 PolarHBondContact OD1-NH1 2.66Å; D91-R101 IonicContact OD1-NH2 2.79Å; G99-R101 PolarHBondContact O-N 3.29Å; R101-T103 VanDerWaalsContact C-N 3.26Å; R101-T103 PolarHBondContact O-N 3.44Å; R101-W104 PolarHBondContact O-N 3.42Å; R101-L105 WeakPolarHBondContact O-CB 3.42Å; R101-L105 PolarHBondContact O-N 3.5Å; R101-V166 HydrophobicContact CB-CG1 4.15Å; R101-V166 VanDerWaalsContact O-CG1 3.28Å; R101-V166 WeakPolarHBondContact O-CG1 3.09Å; R101-G169 PolarHBondContact NE-O 3.15Å; R101-G169 PolarHBondContact NH2-O 3.28Å; R101-G169 VanDerWaalsContact NH2-O 3.1Å; R101-W170 HydrophobicContact CB-CB 4.09Å; R101-W170 HydrophobicContact CB-CD2 4.09Å; R101-W170 HydrophobicContact CB-CG 3.8Å; R101-W170 HydrophobicContact CG-CB 3.84Å; R101-W170 HydrophobicContact CG-CG 3.8Å; R101-E252 PolarHBondContact N-OE1 3.21Å; R101-E252 PolarHBondContact N-OE2 3.27Å
102	K	92.2	Very high	91	Very high	22 Å²	22	55.3 Å²	55.3	10%	0.096	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-30.3	178.1	-79	-170.8	167.5	-160.1	0	114.2	I98 W104 I106 G247 K250 E252	I98-K102 HydrophobicContact CG2-CB 3.58Å; I98-K102 HydrophobicContact CG2-CD 4.47Å; K102-W104 PolarHBondContact O-N 2.92Å; K102-I106 HydrophobicContact CB-CD1 4.13Å; K102-I106 HydrophobicContact CD-CD1 4.2Å; K102-I106 HydrophobicContact CG-CD1 4.23Å; K102-I106 PolarHBondContact O-N 3.37Å; K102-G247 PolarHBondContact NZ-O 2.92Å; K102-K250 WeakPolarHBondContact CE-O 3.41Å; K102-K250 PolarHBondContact NZ-O 3.08Å; K102-E252 PolarHBondContact N-OE2 2.87Å; K102-E252 VanDerWaalsContact N-OE2 3.16Å
103	T	94.3	Very high	91.8	Very high	31 Å²	31	53.2 Å²	53.2	19%	0.19	27%	0.268	C	S	.	.	H	α-helix	trans	-54.5	-37.2	177.8	-65.7	0	0	0	0	111.7	S95 G99 R101 P107	S95-T103 PolarHBondContact N-OG1 3.48Å; S95-T103 VanDerWaalsContact N-OG1 3.09Å; S95-T103 PolarHBondContact O-OG1 2.85Å; G99-T103 WeakPolarHBondContact O-CB 3.29Å; G99-T103 PolarHBondContact O-N 3.17Å; G99-T103 VanDerWaalsContact O-N 3.09Å; G99-T103 PolarHBondContact O-OG1 3.19Å; R101-T103 VanDerWaalsContact C-N 3.26Å; R101-T103 PolarHBondContact O-N 3.44Å; T103-P107 VanDerWaalsContact O-CD 3.24Å; T103-P107 WeakPolarHBondContact O-CD 3.17Å; T103-P107 VanDerWaalsContact O-CG 3.31Å; T103-P107 WeakPolarHBondContact O-CG 3.44Å
104	W	94.2	Very high	92.5	Very high	69 Å²	69	52.7 Å²	52.7	26%	0.261	27%	0.265	S	S	.	.	H	α-helix	trans	-98.5	-39.8	179	-72.3	98.8	0	0	0	113.3	V90 L93 R101 K102 I106 P107 I108 T162 V166	V90-W104 HydrophobicContact CG1-CB 4.26Å; V90-W104 HydrophobicContact CG1-CD2 4.14Å; V90-W104 HydrophobicContact CG1-CG 3.88Å; V90-W104 VanDerWaalsContact O-CD1 3.24Å; V90-W104 PolarHBondContact O-NE1 3.07Å; L93-W104 HydrophobicContact CB-CZ2 4.21Å; L93-W104 PolarHBondContact O-NE1 3.04Å; R101-W104 PolarHBondContact O-N 3.42Å; K102-W104 PolarHBondContact O-N 2.92Å; W104-I106 PolarHBondContact O-N 3.43Å; W104-P107 WeakPolarHBondContact O-CD 3.38Å; W104-I108 HydrophobicContact CE3-CG1 4.44Å; W104-I108 VanDerWaalsContact O-CB 3.26Å; W104-I108 WeakPolarHBondContact O-CB 3.34Å; W104-I108 WeakPolarHBondContact O-CG1 3.39Å; W104-I108 PolarHBondContact O-N 3.12Å; W104-I108 VanDerWaalsContact O-N 3.11Å; W104-T162 HydrophobicContact CE3-CG2 4.4Å; W104-V166 HydrophobicContact CB-CG1 4.45Å; W104-V166 HydrophobicContact CB-CG2 3.43Å; W104-V166 VanDerWaalsContact CB-CG2 3.43Å; W104-V166 HydrophobicContact CG-CG2 4.31Å
105	L	95.3	Very high	93	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.6	-48.7	-174.2	-176.4	66.9	0	0	0	112.3	L40 R101 I108 Q109 Q163 V166 V167 W170 V246	L40-L105 HydrophobicContact CD1-CD2 4.28Å; L40-L105 HydrophobicContact CD2-CD2 4.33Å; R101-L105 WeakPolarHBondContact O-CB 3.42Å; R101-L105 PolarHBondContact O-N 3.5Å; L105-I108 PolarHBondContact O-N 3.28Å; L105-Q109 HydrophobicContact CD1-CG 3.97Å; L105-Q109 HydrophobicContact CG-CG 4.43Å; L105-Q109 WeakPolarHBondContact O-CB 3.38Å; L105-Q109 PolarHBondContact O-N 2.96Å; L105-Q163 HydrophobicContact CD1-CG 3.89Å; L105-V166 HydrophobicContact CB-CG1 3.88Å; L105-V167 HydrophobicContact CD1-CG2 3.86Å; L105-W170 HydrophobicContact CD2-CE3 3.7Å; L105-W170 HydrophobicContact CD2-CH2 4.11Å; L105-W170 HydrophobicContact CD2-CZ3 3.21Å; L105-V246 HydrophobicContact CD2-CG1 4.19Å
106	I	96.5	Very high	93.6	Very high	33 Å²	33	47.2 Å²	47.2	17%	0.169	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-52.5	-173.2	-65.4	171.7	0	0	0	110.8	K102 W104 I108 Y110 T243	K102-I106 HydrophobicContact CB-CD1 4.13Å; K102-I106 HydrophobicContact CD-CD1 4.2Å; K102-I106 HydrophobicContact CG-CD1 4.23Å; K102-I106 PolarHBondContact O-N 3.37Å; W104-I106 PolarHBondContact O-N 3.43Å; I106-I108 VanDerWaalsContact C-N 3.34Å; I106-I108 PolarHBondContact O-N 3.42Å; I106-Y110 HydrophobicContact CG2-CD2 3.69Å; I106-Y110 HydrophobicContact CG2-CE2 3.5Å; I106-Y110 VanDerWaalsContact CG2-CE2 3.5Å; I106-Y110 VanDerWaalsContact O-CD2 3.24Å; I106-Y110 WeakPolarHBondContact O-CD2 3.48Å; I106-Y110 PolarHBondContact O-N 3.16Å; I106-Y110 VanDerWaalsContact O-N 3.09Å; I106-T243 HydrophobicContact CB-CG2 4.38Å; I106-T243 HydrophobicContact CG2-CG2 4Å; I106-T243 WeakPolarHBondContact O-CG2 3.44Å
107	P	97.2	Very high	94.4	Very high	75 Å²	75	43.6 Å²	43.6	49%	0.487	21%	0.211	S	C	.	.	H	α-helix	trans	-60.8	-40.1	176.9	-25.7	36.4	0	0	0	113.6	T103 W104 Y110 A111	T103-P107 VanDerWaalsContact O-CD 3.24Å; T103-P107 WeakPolarHBondContact O-CD 3.17Å; T103-P107 VanDerWaalsContact O-CG 3.31Å; T103-P107 WeakPolarHBondContact O-CG 3.44Å; W104-P107 WeakPolarHBondContact O-CD 3.38Å; P107-Y110 PolarHBondContact O-N 2.97Å; P107-A111 WeakPolarHBondContact O-CB 3.31Å; P107-A111 PolarHBondContact O-N 3.23Å
108	I	97.7	Very high	95	Very high	17 Å²	17	36.2 Å²	36.2	9%	0.087	19%	0.188	C	C	.	.	H	α-helix	trans	-68.9	-42.4	-177.5	-67.2	-68.2	0	0	0	111.6	W104 L105 I106 A111 L112 L159 T162 Q163	W104-I108 HydrophobicContact CE3-CG1 4.44Å; W104-I108 VanDerWaalsContact O-CB 3.26Å; W104-I108 WeakPolarHBondContact O-CB 3.34Å; W104-I108 WeakPolarHBondContact O-CG1 3.39Å; W104-I108 PolarHBondContact O-N 3.12Å; W104-I108 VanDerWaalsContact O-N 3.11Å; L105-I108 PolarHBondContact O-N 3.28Å; I106-I108 VanDerWaalsContact C-N 3.34Å; I106-I108 PolarHBondContact O-N 3.42Å; I108-A111 PolarHBondContact O-N 3.49Å; I108-L112 HydrophobicContact CG2-CD1 4.32Å; I108-L112 PolarHBondContact O-N 2.87Å; I108-L159 HydrophobicContact CD1-CD2 3.62Å; I108-L159 HydrophobicContact CG2-CB 4.17Å; I108-L159 HydrophobicContact CG2-CD2 4.34Å; I108-L159 WeakPolarHBondContact CG2-O 3.28Å; I108-T162 HydrophobicContact CD1-CG2 3.81Å; I108-T162 HydrophobicContact CG1-CG2 3.9Å; I108-Q163 HydrophobicContact CG2-CB 4.08Å
109	Q	97.2	Very high	95.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-70.1	-34.9	176.9	-72.9	-174.8	-47.9	0	0	112.7	L105 L112 G113 Q163 F239 T243	L105-Q109 HydrophobicContact CD1-CG 3.97Å; L105-Q109 HydrophobicContact CG-CG 4.43Å; L105-Q109 WeakPolarHBondContact O-CB 3.38Å; L105-Q109 PolarHBondContact O-N 2.96Å; Q109-L112 WeakPolarHBondContact O-CB 3.33Å; Q109-L112 PolarHBondContact O-N 2.91Å; Q109-G113 PolarHBondContact O-N 3.32Å; Q109-Q163 HydrophobicContact CG-CG 4.48Å; Q109-Q163 VanDerWaalsContact NE2-NE2 3.14Å; Q109-F239 HydrophobicContact CB-CD1 4.49Å; Q109-T243 HydrophobicContact CB-CG2 3.95Å; Q109-T243 WeakPolarHBondContact CB-OG1 3.3Å
110	Y	98.5	Very high	96.2	Very high	76 Å²	76	31.5 Å²	31.5	30%	0.298	16%	0.161	S	C	.	.	H	α-helix	trans	-62.3	-44.3	169.1	-80.9	-52.2	0	0	0	111.4	I106 P107 L112 G113 I114 L240 T243 T244	I106-Y110 HydrophobicContact CG2-CD2 3.69Å; I106-Y110 HydrophobicContact CG2-CE2 3.5Å; I106-Y110 VanDerWaalsContact CG2-CE2 3.5Å; I106-Y110 VanDerWaalsContact O-CD2 3.24Å; I106-Y110 WeakPolarHBondContact O-CD2 3.48Å; I106-Y110 PolarHBondContact O-N 3.16Å; I106-Y110 VanDerWaalsContact O-N 3.09Å; P107-Y110 PolarHBondContact O-N 2.97Å; Y110-L112 VanDerWaalsContact C-N 3.31Å; Y110-L112 PolarHBondContact O-N 2.66Å; Y110-G113 PolarHBondContact O-N 3.5Å; Y110-I114 WeakPolarHBondContact O-CB 3.46Å; Y110-I114 VanDerWaalsContact O-CG1 3.28Å; Y110-I114 WeakPolarHBondContact O-CG1 3.45Å; Y110-I114 PolarHBondContact O-N 2.93Å; Y110-L240 HydrophobicContact CD1-CD2 3.69Å; Y110-L240 HydrophobicContact CE1-CD2 4.4Å; Y110-T243 HydrophobicContact CD1-CG2 4.01Å; Y110-T243 HydrophobicContact CD2-CG2 3.64Å; Y110-T243 HydrophobicContact CE1-CG2 3.97Å; Y110-T243 HydrophobicContact CE2-CG2 3.61Å; Y110-T243 HydrophobicContact CG-CG2 3.84Å; Y110-T244 WeakPolarHBondContact OH-CA 3.43Å; Y110-T244 PolarHBondContact OH-OG1 3.07Å
111	A	98.2	Very high	96.8	Very high	35 Å²	35	35.9 Å²	35.9	29%	0.289	19%	0.187	S	C	.	.	H	α-helix	trans	-61.4	-38.5	175.9	0	0	0	0	0	112	P107 I108 N115 L159	P107-A111 WeakPolarHBondContact O-CB 3.31Å; P107-A111 PolarHBondContact O-N 3.23Å; I108-A111 PolarHBondContact O-N 3.49Å; A111-N115 WeakPolarHBondContact O-CB 3.14Å; A111-N115 PolarHBondContact O-N 2.9Å; A111-L159 HydrophobicContact CB-CD1 3.84Å; A111-L159 HydrophobicContact CB-CD2 3.92Å
112	L	97.9	Very high	97.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-50.4	172.8	-82.2	164.5	0	0	0	111.5	P47 I108 Q109 Y110 I114 N115 L116 L156 L159 F239	P47-L112 HydrophobicContact CG-CD2 4.07Å; I108-L112 HydrophobicContact CG2-CD1 4.32Å; I108-L112 PolarHBondContact O-N 2.87Å; Q109-L112 WeakPolarHBondContact O-CB 3.33Å; Q109-L112 PolarHBondContact O-N 2.91Å; Y110-L112 VanDerWaalsContact C-N 3.31Å; Y110-L112 PolarHBondContact O-N 2.66Å; L112-I114 PolarHBondContact O-N 2.98Å; L112-N115 PolarHBondContact O-N 3.39Å; L112-L116 WeakPolarHBondContact O-CG 3.49Å; L112-L116 PolarHBondContact O-N 2.93Å; L112-L156 HydrophobicContact CD2-CD2 4.04Å; L112-L156 WeakPolarHBondContact CD2-O 3.47Å; L112-L159 HydrophobicContact CD1-CB 4.26Å; L112-L159 HydrophobicContact CD2-CB 3.58Å; L112-L159 HydrophobicContact CD2-CD1 4.27Å; L112-L159 HydrophobicContact CG-CB 3.62Å; L112-L159 HydrophobicContact CG-CD1 4.25Å; L112-F239 HydrophobicContact CB-CD1 3.83Å; L112-F239 HydrophobicContact CB-CE1 3.81Å; L112-F239 HydrophobicContact CB-CZ 4.48Å; L112-F239 HydrophobicContact CD1-CD1 4.45Å; L112-F239 HydrophobicContact CD1-CE1 3.77Å; L112-F239 HydrophobicContact CD1-CZ 4.49Å; L112-F239 HydrophobicContact CG-CE1 4.33Å
113	G	98.4	Very high	97.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-46.8	178.3	0	0	0	0	0	112.5	Q109 Y110 L116 L117 G236	Q109-G113 PolarHBondContact O-N 3.32Å; Y110-G113 PolarHBondContact O-N 3.5Å; G113-L116 PolarHBondContact O-N 3.27Å; G113-L117 WeakPolarHBondContact O-CG 3.5Å; G113-L117 PolarHBondContact O-N 2.91Å; G113-L117 VanDerWaalsContact O-N 3.08Å; G113-G236 WeakPolarHBondContact O-CA 3.46Å
114	I	98.3	Very high	97.5	Very high	88 Å²	88	39.5 Å²	39.5	45%	0.451	20%	0.2	S	C	.	.	H	α-helix	trans	-63.5	-43.6	177.4	-66.6	165.9	0	0	0	111.2	Y110 L112 L116 L117 I118 L240	Y110-I114 WeakPolarHBondContact O-CB 3.46Å; Y110-I114 VanDerWaalsContact O-CG1 3.28Å; Y110-I114 WeakPolarHBondContact O-CG1 3.45Å; Y110-I114 PolarHBondContact O-N 2.93Å; L112-I114 PolarHBondContact O-N 2.98Å; I114-L116 PolarHBondContact O-N 3.01Å; I114-L117 WeakPolarHBondContact O-CB 3.39Å; I114-L117 PolarHBondContact O-N 2.97Å; I114-I118 HydrophobicContact CG2-CD1 3.89Å; I114-I118 HydrophobicContact CG2-CG1 4.44Å; I114-I118 WeakPolarHBondContact O-CG1 3.32Å; I114-I118 PolarHBondContact O-N 3.21Å; I114-L240 HydrophobicContact CG1-CD2 4.14Å
115	N	97.6	Very high	97.5	Very high	30 Å²	30	40.9 Å²	40.9	16%	0.16	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-42	179.1	-166.8	-18.9	0	0	0	111.1	A111 L112 L117 I118 I119 L156	A111-N115 WeakPolarHBondContact O-CB 3.14Å; A111-N115 PolarHBondContact O-N 2.9Å; L112-N115 PolarHBondContact O-N 3.39Å; N115-L117 VanDerWaalsContact C-N 3.32Å; N115-L117 PolarHBondContact O-N 2.91Å; N115-I118 PolarHBondContact O-N 2.97Å; N115-I119 VanDerWaalsContact O-CG1 3.26Å; N115-I119 WeakPolarHBondContact O-CG1 3.48Å; N115-I119 PolarHBondContact O-N 3.45Å; N115-I119 VanDerWaalsContact OD1-CD1 3.23Å; N115-I119 WeakPolarHBondContact OD1-CD1 3.26Å; N115-L156 HydrophobicContact CB-CD2 3.82Å
116	L	98.5	Very high	97.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-41.3	172.5	-73.4	171.3	0	0	0	112.5	L50 L112 G113 I114 I119 A120 L156 L232 W235 F239	L50-L116 HydrophobicContact CD1-CD2 3.69Å; L112-L116 WeakPolarHBondContact O-CG 3.49Å; L112-L116 PolarHBondContact O-N 2.93Å; G113-L116 PolarHBondContact O-N 3.27Å; I114-L116 PolarHBondContact O-N 3.01Å; L116-I119 PolarHBondContact O-N 3.05Å; L116-A120 WeakPolarHBondContact O-CB 3.47Å; L116-A120 PolarHBondContact O-N 3.5Å; L116-L156 HydrophobicContact CD2-CD1 3.86Å; L116-L156 HydrophobicContact CD2-CD2 3.92Å; L116-L156 HydrophobicContact CG-CD2 3.88Å; L116-L232 HydrophobicContact CD2-CD2 3.67Å; L116-W235 HydrophobicContact CD1-CB 4.11Å; L116-F239 HydrophobicContact CD1-CD2 3.62Å; L116-F239 HydrophobicContact CD1-CE2 3.69Å; L116-F239 HydrophobicContact CD1-CG 4.4Å
117	L	98.6	Very high	97.6	Very high	35 Å²	35	40.6 Å²	40.6	18%	0.183	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-42.3	175.7	-66.8	174.3	0	0	0	112.1	G113 I114 N115 A120 L121 Y233 I237 L240	G113-L117 WeakPolarHBondContact O-CG 3.5Å; G113-L117 PolarHBondContact O-N 2.91Å; G113-L117 VanDerWaalsContact O-N 3.08Å; I114-L117 WeakPolarHBondContact O-CB 3.39Å; I114-L117 PolarHBondContact O-N 2.97Å; N115-L117 VanDerWaalsContact C-N 3.32Å; N115-L117 PolarHBondContact O-N 2.91Å; L117-A120 WeakPolarHBondContact O-CB 3.47Å; L117-A120 PolarHBondContact O-N 3.48Å; L117-L121 WeakPolarHBondContact O-CG 3.27Å; L117-L121 PolarHBondContact O-N 2.98Å; L117-L121 VanDerWaalsContact O-N 3.15Å; L117-Y233 HydrophobicContact CD2-CD2 3.56Å; L117-Y233 HydrophobicContact CD2-CE2 3.86Å; L117-Y233 HydrophobicContact CD2-CG 4.21Å; L117-I237 HydrophobicContact CD1-CD1 4.3Å; L117-I237 HydrophobicContact CD2-CD1 4.02Å; L117-I237 HydrophobicContact CD2-CG1 4.27Å; L117-L240 HydrophobicContact CD1-CD1 3.81Å
118	I	98.2	Very high	97.4	Very high	79 Å²	79	37 Å²	37	41%	0.405	18%	0.183	S	C	.	.	H	α-helix	trans	-61.3	-46.4	175.5	-68.6	168.1	0	0	0	110.1	I114 N115 A120 L121 Y122	I114-I118 HydrophobicContact CG2-CD1 3.89Å; I114-I118 HydrophobicContact CG2-CG1 4.44Å; I114-I118 WeakPolarHBondContact O-CG1 3.32Å; I114-I118 PolarHBondContact O-N 3.21Å; N115-I118 PolarHBondContact O-N 2.97Å; I118-A120 VanDerWaalsContact C-N 3.33Å; I118-A120 PolarHBondContact O-N 3.48Å; I118-L121 PolarHBondContact O-N 3.32Å; I118-Y122 HydrophobicContact CG2-CD2 4.02Å; I118-Y122 HydrophobicContact CG2-CE2 4.2Å; I118-Y122 VanDerWaalsContact O-CD2 3.26Å; I118-Y122 WeakPolarHBondContact O-CD2 3.27Å; I118-Y122 PolarHBondContact O-N 3.36Å
119	I	98.4	Very high	97.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-43.6	177.4	-64.1	166.2	0	0	0	109.8	N115 L116 L121 Y122 V123 W126 A152 F153 L156 L232	N115-I119 VanDerWaalsContact O-CG1 3.26Å; N115-I119 WeakPolarHBondContact O-CG1 3.48Å; N115-I119 PolarHBondContact O-N 3.45Å; N115-I119 VanDerWaalsContact OD1-CD1 3.23Å; N115-I119 WeakPolarHBondContact OD1-CD1 3.26Å; L116-I119 PolarHBondContact O-N 3.05Å; I119-L121 PolarHBondContact O-N 3.02Å; I119-Y122 PolarHBondContact O-N 3.24Å; I119-Y122 VanDerWaalsContact O-N 3.1Å; I119-V123 HydrophobicContact CG2-CB 4.05Å; I119-V123 HydrophobicContact CG2-CG2 4.35Å; I119-V123 WeakPolarHBondContact O-CA 3.31Å; I119-V123 WeakPolarHBondContact O-CB 3.5Å; I119-V123 WeakPolarHBondContact O-CG1 3.2Å; I119-V123 PolarHBondContact O-N 3.39Å; I119-W126 HydrophobicContact CB-CZ3 4.49Å; I119-W126 HydrophobicContact CG1-CH2 4.49Å; I119-W126 HydrophobicContact CG1-CZ3 4.18Å; I119-W126 HydrophobicContact CG2-CZ3 4.23Å; I119-A152 HydrophobicContact CD1-CB 3.9Å; I119-A152 HydrophobicContact CG1-CB 3.81Å; I119-F153 HydrophobicContact CG2-CE2 3.99Å; I119-F153 HydrophobicContact CG2-CZ 4.44Å; I119-L156 HydrophobicContact CD1-CD1 3.32Å; I119-L156 HydrophobicContact CD1-CD2 4.19Å; I119-L156 HydrophobicContact CD1-CG 3.61Å; I119-L232 HydrophobicContact CG2-CD1 3.73Å; I119-L232 HydrophobicContact CG2-CD2 4.49Å
120	A	98.2	Very high	97	Very high	9 Å²	9	38.6 Å²	38.6	7%	0.074	19%	0.193	C	C	.	.	H	α-helix	trans	-55	-37.3	177.5	0	0	0	0	0	113.1	L116 L117 I118 S229 L232	L116-A120 WeakPolarHBondContact O-CB 3.47Å; L116-A120 PolarHBondContact O-N 3.5Å; L117-A120 WeakPolarHBondContact O-CB 3.47Å; L117-A120 PolarHBondContact O-N 3.48Å; I118-A120 VanDerWaalsContact C-N 3.33Å; I118-A120 PolarHBondContact O-N 3.48Å; A120-S229 WeakPolarHBondContact CB-O 3.35Å; A120-S229 VanDerWaalsContact O-CB 3.29Å; A120-S229 WeakPolarHBondContact O-CB 3.41Å; A120-L232 HydrophobicContact CB-CB 3.81Å
121	L	97.4	Very high	96.5	Very high	135 Å²	135	41.4 Å²	41.4	71%	0.707	22%	0.22	S	C	*	.	H	α-helix	trans	-69.9	-36.3	178.6	-68.2	169.3	0	0	0	113.1	L117 I118 I119	L117-L121 WeakPolarHBondContact O-CG 3.27Å; L117-L121 PolarHBondContact O-N 2.98Å; L117-L121 VanDerWaalsContact O-N 3.15Å; I118-L121 PolarHBondContact O-N 3.32Å; I119-L121 PolarHBondContact O-N 3.02Å
122	Y	97.3	Very high	96.1	Very high	113 Å²	113	46.2 Å²	46.2	44%	0.443	24%	0.241	S	C	.	.	H	α-helix	trans	-109.4	-12	-170.8	-64.8	-69.4	0	0	0	114.9	I118 I119 N124 Q125 W126	I118-Y122 HydrophobicContact CG2-CD2 4.02Å; I118-Y122 HydrophobicContact CG2-CE2 4.2Å; I118-Y122 VanDerWaalsContact O-CD2 3.26Å; I118-Y122 WeakPolarHBondContact O-CD2 3.27Å; I118-Y122 PolarHBondContact O-N 3.36Å; I119-Y122 PolarHBondContact O-N 3.24Å; I119-Y122 VanDerWaalsContact O-N 3.1Å; Y122-N124 PolarHBondContact O-N 3.37Å; Y122-Q125 WeakPolarHBondContact O-CA 3.23Å; Y122-Q125 WeakPolarHBondContact O-CB 3.42Å; Y122-Q125 PolarHBondContact O-N 3.5Å; Y122-Q125 VanDerWaalsContact O-N 3.11Å; Y122-W126 HydrophobicContact CD2-CZ2 4.18Å; Y122-W126 AromaticContact CG-CZ2 3.97Å; Y122-W126 HydrophobicContact CG-CZ2 3.97Å; Y122-W126 PolarHBondContact O-N 2.96Å
123	V	97.3	Very high	95.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-40.6	-170.9	66.8	0	0	0	0	112.9	I119 Q125 W126 L127 L149 F228 L232	I119-V123 HydrophobicContact CG2-CB 4.05Å; I119-V123 HydrophobicContact CG2-CG2 4.35Å; I119-V123 WeakPolarHBondContact O-CA 3.31Å; I119-V123 WeakPolarHBondContact O-CB 3.5Å; I119-V123 WeakPolarHBondContact O-CG1 3.2Å; I119-V123 PolarHBondContact O-N 3.39Å; V123-Q125 VanDerWaalsContact C-N 3.3Å; V123-Q125 PolarHBondContact O-N 3.24Å; V123-W126 PolarHBondContact O-N 3.31Å; V123-L127 HydrophobicContact CG2-CD1 3.96Å; V123-L127 HydrophobicContact CG2-CG 4.27Å; V123-L127 WeakPolarHBondContact O-CB 3.42Å; V123-L127 VanDerWaalsContact O-CG 3.26Å; V123-L127 WeakPolarHBondContact O-CG 3.29Å; V123-L127 PolarHBondContact O-N 3.42Å; V123-L149 HydrophobicContact CG2-CD2 4.18Å; V123-F228 HydrophobicContact CG1-CD1 4.39Å; V123-F228 HydrophobicContact CG2-CD1 3.58Å; V123-F228 HydrophobicContact CG2-CE1 3.43Å; V123-F228 VanDerWaalsContact CG2-CE1 3.43Å; V123-F228 HydrophobicContact CG2-CZ 4.46Å; V123-L232 HydrophobicContact CB-CD1 4.27Å; V123-L232 HydrophobicContact CG1-CD1 3.92Å; V123-L232 HydrophobicContact CG2-CD1 4.33Å
124	N	96.3	Very high	95.5	Very high	35 Å²	35	50.8 Å²	50.8	19%	0.187	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-38.6	177.9	-67.8	-36.1	0	0	0	111.2	Y122 L127 G128 R129 S229	Y122-N124 PolarHBondContact O-N 3.37Å; N124-L127 PolarHBondContact O-N 3.39Å; N124-G128 PolarHBondContact O-N 3.39Å; N124-R129 HydrophobicContact CB-CB 4.47Å; N124-R129 PolarHBondContact O-N 2.71Å; N124-R129 PolarHBondContact OD1-NH1 3.49Å; N124-S229 VanDerWaalsContact ND2-CB 3.35Å; N124-S229 WeakPolarHBondContact ND2-CB 3.44Å; N124-S229 PolarHBondContact ND2-OG 2.99Å
125	Q	95.7	Very high	95.2	Very high	98 Å²	98	49.1 Å²	49.1	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-50	172.2	-173.8	-172.9	10.8	0	0	110.1	Y122 V123 L127 G128 H142	Y122-Q125 WeakPolarHBondContact O-CA 3.23Å; Y122-Q125 WeakPolarHBondContact O-CB 3.42Å; Y122-Q125 PolarHBondContact O-N 3.5Å; Y122-Q125 VanDerWaalsContact O-N 3.11Å; V123-Q125 VanDerWaalsContact C-N 3.3Å; V123-Q125 PolarHBondContact O-N 3.24Å; Q125-L127 VanDerWaalsContact C-N 3.26Å; Q125-L127 PolarHBondContact O-N 3.41Å; Q125-G128 WeakPolarHBondContact O-CA 3.43Å; Q125-G128 PolarHBondContact O-N 3.03Å; Q125-H142 PolarHBondContact O-CE1 3.15Å; Q125-H142 PolarHBondContact O-NE2 3.01Å
126	W	96.7	Very high	94.8	Very high	26 Å²	26	48 Å²	48	10%	0.098	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-31.8	-179	-60.2	-17.5	0	0	0	113.4	I119 Y122 V123 G128 N145 R148 L149 A152	I119-W126 HydrophobicContact CB-CZ3 4.49Å; I119-W126 HydrophobicContact CG1-CH2 4.49Å; I119-W126 HydrophobicContact CG1-CZ3 4.18Å; I119-W126 HydrophobicContact CG2-CZ3 4.23Å; Y122-W126 HydrophobicContact CD2-CZ2 4.18Å; Y122-W126 AromaticContact CG-CZ2 3.97Å; Y122-W126 HydrophobicContact CG-CZ2 3.97Å; Y122-W126 PolarHBondContact O-N 2.96Å; V123-W126 PolarHBondContact O-N 3.31Å; W126-G128 PolarHBondContact O-N 2.93Å; W126-N145 PolarHBondContact O-N 3.44Å; W126-R148 HydrophobicContact CD2-CB 4.04Å; W126-R148 HydrophobicContact CG-CB 4.17Å; W126-L149 HydrophobicContact CB-CD2 4.22Å; W126-L149 HydrophobicContact CB-CG 4.07Å; W126-L149 HydrophobicContact CE3-CD2 3.92Å; W126-L149 HydrophobicContact CE3-CG 4.38Å; W126-A152 HydrophobicContact CH2-CB 3.89Å; W126-A152 HydrophobicContact CZ3-CB 3.64Å
127	L	95.6	Very high	94.3	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.4	172.2	-68.2	173.3	0	0	0	113.4	L57 L58 V123 N124 Q125 R129 L138 G139 V144 L149 F228	L57-L127 HydrophobicContact CD2-CD1 3.92Å; L58-L127 HydrophobicContact CD2-CD2 3.91Å; V123-L127 HydrophobicContact CG2-CD1 3.96Å; V123-L127 HydrophobicContact CG2-CG 4.27Å; V123-L127 WeakPolarHBondContact O-CB 3.42Å; V123-L127 VanDerWaalsContact O-CG 3.26Å; V123-L127 WeakPolarHBondContact O-CG 3.29Å; V123-L127 PolarHBondContact O-N 3.42Å; N124-L127 PolarHBondContact O-N 3.39Å; Q125-L127 VanDerWaalsContact C-N 3.26Å; Q125-L127 PolarHBondContact O-N 3.41Å; L127-R129 VanDerWaalsContact C-N 3.29Å; L127-R129 HydrophobicContact CB-CG 4.33Å; L127-R129 PolarHBondContact O-N 3.49Å; L127-L138 HydrophobicContact CB-CG 4.45Å; L127-L138 HydrophobicContact CD2-CD2 3.92Å; L127-G139 PolarHBondContact O-N 3.41Å; L127-V144 HydrophobicContact CD2-CG1 4.4Å; L127-L149 HydrophobicContact CD2-CD1 3.89Å; L127-F228 HydrophobicContact CD1-CD1 3.93Å; L127-F228 HydrophobicContact CD1-CE1 4.34Å
128	G	93.5	Very high	94	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	24.6	179	0	0	0	0	0	113.9	N124 Q125 W126 V140 V141	N124-G128 PolarHBondContact O-N 3.39Å; Q125-G128 WeakPolarHBondContact O-CA 3.43Å; Q125-G128 PolarHBondContact O-N 3.03Å; W126-G128 PolarHBondContact O-N 2.93Å; G128-V140 PolarHBondContact O-N 3.14Å; G128-V141 PolarHBondContact O-N 2.96Å
129	R	93.7	Very high	93.6	Very high	9 Å²	9	47 Å²	47	3%	0.034	25%	0.254	C	S	.	.			trans	-72.9	156.5	175.5	-71.6	179.6	168.3	156.2	-8	110.9	N124 L127 P134 G136 V141 E206	N124-R129 HydrophobicContact CB-CB 4.47Å; N124-R129 PolarHBondContact O-N 2.71Å; N124-R129 PolarHBondContact OD1-NH1 3.49Å; L127-R129 VanDerWaalsContact C-N 3.29Å; L127-R129 HydrophobicContact CB-CG 4.33Å; L127-R129 PolarHBondContact O-N 3.49Å; R129-P134 VanDerWaalsContact CD-O 3.26Å; R129-P134 WeakPolarHBondContact CD-O 3.49Å; R129-P134 PolarHBondContact NE-O 3.31Å; R129-P134 PolarHBondContact NH1-O 3.17Å; R129-G136 PolarHBondContact NE-O 3.33Å; R129-V141 WeakPolarHBondContact O-CG2 3.37Å; R129-E206 IonicContact NH2-OE1 2.99Å; R129-E206 PolarHBondContact NH2-OE1 3.4Å
130	T	92.4	Very high	93	Very high	40 Å²	40	49.9 Å²	49.9	25%	0.245	27%	0.272	C	S	.	.			trans	-73	142.2	172.8	67.6	0	0	0	0	109.9	D132 N133 V140 V141	T130-D132 WeakPolarHBondContact CB-OD1 3.27Å; T130-D132 PolarHBondContact O-N 3.4Å; T130-D132 VanDerWaalsContact O-N 3.16Å; T130-D132 PolarHBondContact OG1-OD1 2.87Å; T130-N133 CarbonylContact O-C 3.47Å; T130-N133 PolarHBondContact O-N 3.41Å; T130-N133 VanDerWaalsContact O-N 3.15Å; T130-N133 WeakPolarHBondContact OG1-CB 3.22Å; T130-N133 PolarHBondContact OG1-N 2.9Å; T130-V140 HydrophobicContact CG2-CB 4.43Å; T130-V140 HydrophobicContact CG2-CG1 3.93Å; T130-V141 HydrophobicContact CG2-CG2 4Å
131	P	89.5	Confident	92.6	Very high	135 Å²	135	53.6 Å²	53.6	88%	0.877	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.2	-175.2	-25.8	35.2	0	0	0	114.7
132	D	89.6	Confident	92.3	Very high	136 Å²	136	50.1 Å²	50.1	73%	0.727	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-19.3	-179.7	59.7	-32.7	0	0	0	113.8	T130	T130-D132 WeakPolarHBondContact CB-OD1 3.27Å; T130-D132 PolarHBondContact O-N 3.4Å; T130-D132 VanDerWaalsContact O-N 3.16Å; T130-D132 PolarHBondContact OG1-OD1 2.87Å
133	N	90.9	Very high	91.9	Very high	64 Å²	64	50 Å²	50	34%	0.342	29%	0.287	S	S	.	.			trans	-128.1	86	-177.9	-172	-0.7	0	0	0	112.3	T130 W135 G136	T130-N133 CarbonylContact O-C 3.47Å; T130-N133 PolarHBondContact O-N 3.41Å; T130-N133 VanDerWaalsContact O-N 3.15Å; T130-N133 WeakPolarHBondContact OG1-CB 3.22Å; T130-N133 PolarHBondContact OG1-N 2.9Å; N133-W135 PolarHBondContact O-N 3.43Å; N133-W135 PolarHBondContact OD1-N 3.41Å; N133-G136 WeakPolarHBondContact ND2-CA 3.09Å; N133-G136 PolarHBondContact O-N 3.16Å; N133-G136 PolarHBondContact OD1-N 3.03Å
134	P	92.3	Very high	91.7	Very high	33 Å²	33	51.4 Å²	51.4	21%	0.214	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-10.9	-179.2	30.1	-35.4	0	0	0	114.5	R129 T227	R129-P134 VanDerWaalsContact CD-O 3.26Å; R129-P134 WeakPolarHBondContact CD-O 3.49Å; R129-P134 PolarHBondContact NE-O 3.31Å; R129-P134 PolarHBondContact NH1-O 3.17Å; P134-T227 HydrophobicContact CB-CG2 3.61Å; P134-T227 HydrophobicContact CG-CG2 3.51Å
135	W	92.1	Very high	91.7	Very high	53 Å²	53	51.8 Å²	51.8	20%	0.201	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-0.9	169.5	-67.7	-83.6	0	0	0	112.9	N133 E223 G224 T227	N133-W135 PolarHBondContact O-N 3.43Å; N133-W135 PolarHBondContact OD1-N 3.41Å; W135-E223 HydrophobicContact CD2-CB 4.18Å; W135-E223 HydrophobicContact CD2-CG 4.32Å; W135-E223 HydrophobicContact CE3-CB 4.04Å; W135-E223 HydrophobicContact CE3-CG 3.72Å; W135-E223 HydrophobicContact CH2-CB 4.34Å; W135-E223 HydrophobicContact CH2-CG 4.46Å; W135-E223 HydrophobicContact CZ2-CB 4.48Å; W135-E223 HydrophobicContact CZ3-CB 4.13Å; W135-E223 HydrophobicContact CZ3-CG 3.81Å; W135-G224 VanDerWaalsContact CZ2-O 3.32Å; W135-G224 WeakPolarHBondContact CZ2-O 3.47Å; W135-G224 VanDerWaalsContact NE1-N 3.17Å; W135-T227 HydrophobicContact CD2-CG2 3.8Å; W135-T227 VanDerWaalsContact CE2-CG2 3.41Å; W135-T227 HydrophobicContact CE3-CG2 4Å; W135-T227 HydrophobicContact CH2-CG2 3.55Å; W135-T227 HydrophobicContact CZ2-CG2 3.3Å; W135-T227 HydrophobicContact CZ3-CG2 3.88Å
136	G	88.6	Confident	91.7	Very high	6 Å²	6	48.1 Å²	48.1	6%	0.062	28%	0.28	C	S	.	.	S	Bend	trans	-67.1	171.9	-175.4	0	0	0	0	0	114	R129 N133	R129-G136 PolarHBondContact NE-O 3.33Å; N133-G136 WeakPolarHBondContact ND2-CA 3.09Å; N133-G136 PolarHBondContact O-N 3.16Å; N133-G136 PolarHBondContact OD1-N 3.03Å
137	P	89	Confident	91.6	Very high	71 Å²	71	50.7 Å²	50.7	46%	0.461	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-58.6	152.9	178.4	16.9	-22.9	0	0	0	112.2	D61 V140	D61-P137 VanDerWaalsContact OD2-CA 3.25Å; D61-P137 WeakPolarHBondContact OD2-CA 3.48Å; D61-P137 WeakPolarHBondContact OD2-CB 3.47Å; P137-V140 HydrophobicContact CB-CG2 3.86Å; P137-V140 HydrophobicContact CG-CG2 3.71Å; P137-V140 VanDerWaalsContact O-CG2 3.32Å; P137-V140 WeakPolarHBondContact O-CG2 3.4Å
138	L	92	Very high	91.7	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.026	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	151.9	-176.9	-75.8	69.8	0	0	0	110.4	L57 L58 D61 L127 V140 V144	L57-L138 HydrophobicContact CG-CD2 4.18Å; L58-L138 HydrophobicContact CD2-CD2 4.08Å; D61-L138 HydrophobicContact CB-CB 4.1Å; D61-L138 HydrophobicContact CB-CD1 4.39Å; D61-L138 PolarHBondContact OD2-N 2.69Å; L127-L138 HydrophobicContact CB-CG 4.45Å; L127-L138 HydrophobicContact CD2-CD2 3.92Å; L138-V140 VanDerWaalsContact C-N 3.29Å; L138-V140 PolarHBondContact O-N 3.39Å; L138-V144 HydrophobicContact CB-CG2 4.34Å
139	G	88.5	Confident	91.9	Very high	16 Å²	16	56.7 Å²	56.7	17%	0.165	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	22.4	174.2	0	0	0	0	0	115.1	L127 H142	L127-G139 PolarHBondContact O-N 3.41Å; G139-H142 CarbonylContact C-O 3.54Å; G139-H142 VanDerWaalsContact CA-O 3.23Å; G139-H142 WeakPolarHBondContact CA-O 3.31Å
140	V	87.5	Confident	92.1	Very high	62 Å²	62	57.1 Å²	57.1	38%	0.376	33%	0.328	S	S	.	.	S	Bend	trans	-79.9	-51.6	-175.8	176.9	0	0	0	0	111.7	G128 T130 P137 L138	G128-V140 PolarHBondContact O-N 3.14Å; T130-V140 HydrophobicContact CG2-CB 4.43Å; T130-V140 HydrophobicContact CG2-CG1 3.93Å; P137-V140 HydrophobicContact CB-CG2 3.86Å; P137-V140 HydrophobicContact CG-CG2 3.71Å; P137-V140 VanDerWaalsContact O-CG2 3.32Å; P137-V140 WeakPolarHBondContact O-CG2 3.4Å; L138-V140 VanDerWaalsContact C-N 3.29Å; L138-V140 PolarHBondContact O-N 3.39Å
141	V	89.6	Confident	92.3	Very high	87 Å²	87	60.3 Å²	60.3	53%	0.527	35%	0.347	S	S	.	.	S	Bend	trans	-74.2	-41.3	-178.2	178.7	0	0	0	0	110.6	G128 R129 T130	G128-V141 PolarHBondContact O-N 2.96Å; R129-V141 WeakPolarHBondContact O-CG2 3.37Å; T130-V141 HydrophobicContact CG2-CG2 4Å
142	H	89.7	Confident	92.7	Very high	62 Å²	62	54.5 Å²	54.5	29%	0.287	31%	0.31	S	S	.	.	S	Bend	trans	-156.4	161.4	174.8	58.7	70.5	0	0	0	108.8	Q125 G139	Q125-H142 PolarHBondContact O-CE1 3.15Å; Q125-H142 PolarHBondContact O-NE2 3.01Å; G139-H142 CarbonylContact C-O 3.54Å; G139-H142 VanDerWaalsContact CA-O 3.23Å; G139-H142 WeakPolarHBondContact CA-O 3.31Å
143	P	89.3	Confident	93.1	Very high	111 Å²	111	48 Å²	48	72%	0.721	28%	0.276	S	S	*	.			trans	-54	146.7	174.9	-24.8	34.4	0	0	0	111.8	N145	P143-N145 PolarHBondContact O-N 3.5Å
144	V	93.5	Very high	93.4	Very high	28 Å²	28	49.1 Å²	49.1	17%	0.17	28%	0.278	C	S	.	.			trans	-56	125.3	178.3	175.9	0	0	0	0	109.8	L58 L127 L138 I146 L149	L58-V144 HydrophobicContact CD2-CG1 3.78Å; L58-V144 HydrophobicContact CD2-CG2 4.37Å; L127-V144 HydrophobicContact CD2-CG1 4.4Å; L138-V144 HydrophobicContact CB-CG2 4.34Å; V144-I146 VanDerWaalsContact C-N 3.3Å; V144-I146 PolarHBondContact O-N 3.21Å; V144-L149 HydrophobicContact CG1-CD1 3.69Å
145	N	95.5	Very high	93.6	Very high	44 Å²	44	48.5 Å²	48.5	24%	0.235	28%	0.277	C	S	.	.			trans	-83.6	78.7	179.4	-162.2	-42.8	0	0	0	110.4	W126 P143 S147 R148 L149	W126-N145 PolarHBondContact O-N 3.44Å; P143-N145 PolarHBondContact O-N 3.5Å; N145-S147 VanDerWaalsContact C-N 3.26Å; N145-S147 PolarHBondContact O-N 3.39Å; N145-R148 PolarHBondContact ND2-NE 3.45Å; N145-R148 PolarHBondContact O-N 2.95Å; N145-R148 WeakPolarHBondContact OD1-CG 3.48Å; N145-R148 PolarHBondContact OD1-N 2.96Å; N145-L149 PolarHBondContact O-N 3.08Å
146	I	95.3	Very high	93.8	Very high	21 Å²	21	46 Å²	46	11%	0.108	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-33.5	-174.9	-161.2	63.6	0	0	0	112.7	L58 S69 A72 F73 V144 L149 T150	L58-I146 HydrophobicContact CD1-CD1 3.6Å; S69-I146 VanDerWaalsContact O-CG1 3.25Å; S69-I146 WeakPolarHBondContact O-CG1 3.11Å; A72-I146 HydrophobicContact CB-CG1 4.31Å; A72-I146 HydrophobicContact CB-CG2 4.42Å; F73-I146 HydrophobicContact CB-CD1 3.79Å; F73-I146 HydrophobicContact CB-CG1 4.24Å; F73-I146 HydrophobicContact CD2-CD1 4.28Å; F73-I146 HydrophobicContact CG-CD1 4.36Å; V144-I146 VanDerWaalsContact C-N 3.3Å; V144-I146 PolarHBondContact O-N 3.21Å; I146-L149 PolarHBondContact O-N 3Å; I146-T150 WeakPolarHBondContact O-CB 3.25Å; I146-T150 PolarHBondContact O-N 3.48Å; I146-T150 PolarHBondContact O-OG1 2.88Å
147	S	96.4	Very high	94.2	Very high	79 Å²	79	45.7 Å²	45.7	55%	0.552	27%	0.265	S	S	*	.	H	α-helix	trans	-64.8	-44.6	-179.8	-50.7	0	0	0	0	111.8	N145 T150 V151	N145-S147 VanDerWaalsContact C-N 3.26Å; N145-S147 PolarHBondContact O-N 3.39Å; S147-T150 PolarHBondContact O-N 3.41Å; S147-V151 WeakPolarHBondContact O-CG2 3.16Å; S147-V151 PolarHBondContact O-N 3.43Å
148	R	97.2	Very high	94.5	Very high	129 Å²	129	46.1 Å²	46.1	49%	0.487	26%	0.259	S	S	.	.	H	α-helix	trans	-65.8	-42.4	177.1	-70.5	179.9	-174.3	170.5	1.5	111.8	W126 N145 V151 A152	W126-R148 HydrophobicContact CD2-CB 4.04Å; W126-R148 HydrophobicContact CG-CB 4.17Å; N145-R148 PolarHBondContact ND2-NE 3.45Å; N145-R148 PolarHBondContact O-N 2.95Å; N145-R148 WeakPolarHBondContact OD1-CG 3.48Å; N145-R148 PolarHBondContact OD1-N 2.96Å; R148-V151 PolarHBondContact O-N 3.18Å; R148-A152 WeakPolarHBondContact O-CB 3.45Å; R148-A152 PolarHBondContact O-N 3.47Å
149	L	97.1	Very high	94.8	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-48.3	173.5	-74.9	166.1	0	0	0	111.1	F73 V123 W126 L127 V144 N145 I146 V151 A152 F153	F73-L149 HydrophobicContact CD2-CB 4.18Å; F73-L149 HydrophobicContact CE2-CB 4.15Å; V123-L149 HydrophobicContact CG2-CD2 4.18Å; W126-L149 HydrophobicContact CB-CD2 4.22Å; W126-L149 HydrophobicContact CB-CG 4.07Å; W126-L149 HydrophobicContact CE3-CD2 3.92Å; W126-L149 HydrophobicContact CE3-CG 4.38Å; L127-L149 HydrophobicContact CD2-CD1 3.89Å; V144-L149 HydrophobicContact CG1-CD1 3.69Å; N145-L149 PolarHBondContact O-N 3.08Å; I146-L149 PolarHBondContact O-N 3Å; L149-V151 PolarHBondContact O-N 2.93Å; L149-A152 PolarHBondContact O-N 2.84Å; L149-F153 HydrophobicContact CD2-CE2 4.31Å; L149-F153 WeakPolarHBondContact O-CB 3.28Å; L149-F153 WeakPolarHBondContact O-CD2 3.31Å; L149-F153 PolarHBondContact O-N 3.01Å
150	T	97.6	Very high	95.1	Very high	18 Å²	18	46.2 Å²	46.2	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-48.4	180	-54.6	0	0	0	0	111.1	A72 F73 F75 I146 S147 A152 F154	A72-T150 WeakPolarHBondContact O-CG2 3.4Å; A72-T150 PolarHBondContact O-OG1 2.99Å; F73-T150 WeakPolarHBondContact CA-OG1 3.44Å; F75-T150 HydrophobicContact CB-CG2 4.14Å; I146-T150 WeakPolarHBondContact O-CB 3.25Å; I146-T150 PolarHBondContact O-N 3.48Å; I146-T150 PolarHBondContact O-OG1 2.88Å; S147-T150 PolarHBondContact O-N 3.41Å; T150-A152 PolarHBondContact O-N 3.21Å; T150-F154 WeakPolarHBondContact O-CB 3.33Å; T150-F154 PolarHBondContact O-N 3.28Å
151	V	97.5	Very high	95.4	Very high	107 Å²	107	43.3 Å²	43.3	65%	0.648	24%	0.238	S	C	*	.	H	α-helix	trans	-63.1	-42.5	179.9	170.6	0	0	0	0	111.6	S147 R148 L149 F154 G155	S147-V151 WeakPolarHBondContact O-CG2 3.16Å; S147-V151 PolarHBondContact O-N 3.43Å; R148-V151 PolarHBondContact O-N 3.18Å; L149-V151 PolarHBondContact O-N 2.93Å; V151-F154 PolarHBondContact O-N 3.5Å; V151-G155 PolarHBondContact O-N 3.05Å
152	A	97.2	Very high	95.6	Very high	12 Å²	12	39.3 Å²	39.3	10%	0.099	21%	0.214	C	C	.	.	H	α-helix	trans	-66.3	-46.8	-179.2	0	0	0	0	0	112	I119 W126 R148 L149 T150 G155 L156	I119-A152 HydrophobicContact CD1-CB 3.9Å; I119-A152 HydrophobicContact CG1-CB 3.81Å; W126-A152 HydrophobicContact CH2-CB 3.89Å; W126-A152 HydrophobicContact CZ3-CB 3.64Å; R148-A152 WeakPolarHBondContact O-CB 3.45Å; R148-A152 PolarHBondContact O-N 3.47Å; L149-A152 PolarHBondContact O-N 2.84Å; T150-A152 PolarHBondContact O-N 3.21Å; A152-G155 PolarHBondContact O-N 2.7Å; A152-L156 PolarHBondContact O-N 3.49Å
153	F	97.7	Very high	95.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-72.3	-30.3	177.5	-81.9	-98.7	0	0	0	112.9	L50 S51 V54 F73 A76 I119 L149 G155 L156 T157 F228	L50-F153 HydrophobicContact CB-CE1 4.15Å; S51-F153 WeakPolarHBondContact OG-CD1 3.34Å; V54-F153 HydrophobicContact CG2-CD1 4.49Å; V54-F153 HydrophobicContact CG2-CE1 3.89Å; V54-F153 HydrophobicContact CG2-CE2 4.13Å; V54-F153 HydrophobicContact CG2-CZ 3.69Å; F73-F153 HydrophobicContact CE2-CB 3.85Å; F73-F153 AromaticContact CE2-CD2 3.96Å; F73-F153 HydrophobicContact CE2-CD2 3.96Å; F73-F153 AromaticContact CE2-CG 3.88Å; F73-F153 HydrophobicContact CE2-CG 3.88Å; F73-F153 HydrophobicContact CZ-CB 3.83Å; F73-F153 HydrophobicContact CZ-CD1 4Å; F73-F153 HydrophobicContact CZ-CD2 4.15Å; F73-F153 AromaticContact CZ-CG 3.72Å; F73-F153 HydrophobicContact CZ-CG 3.72Å; A76-F153 HydrophobicContact CB-CB 3.8Å; I119-F153 HydrophobicContact CG2-CE2 3.99Å; I119-F153 HydrophobicContact CG2-CZ 4.44Å; L149-F153 HydrophobicContact CD2-CE2 4.31Å; L149-F153 WeakPolarHBondContact O-CB 3.28Å; L149-F153 WeakPolarHBondContact O-CD2 3.31Å; L149-F153 PolarHBondContact O-N 3.01Å; F153-G155 VanDerWaalsContact C-N 3.3Å; F153-G155 PolarHBondContact O-N 2.84Å; F153-L156 HydrophobicContact CD1-CD1 4.05Å; F153-L156 HydrophobicContact CE1-CD1 4.18Å; F153-L156 HydrophobicContact CG-CD1 4.41Å; F153-L156 PolarHBondContact O-N 3.4Å; F153-T157 WeakPolarHBondContact O-CB 3.25Å; F153-T157 PolarHBondContact O-N 3.34Å; F153-T157 PolarHBondContact O-OG1 3.09Å; F153-T157 VanDerWaalsContact O-OG1 3.12Å; F153-F228 AromaticContact CZ-CZ 3.92Å; F153-F228 HydrophobicContact CZ-CZ 3.92Å
154	F	97.3	Very high	96	Very high	88 Å²	88	31.2 Å²	31.2	39%	0.386	17%	0.167	S	C	.	.	H	α-helix	trans	-58.9	-44.9	167.9	-178	-79.8	0	0	0	110.5	F75 P79 T150 V151 T157 F158	F75-F154 WeakPolarHBondContact O-CD2 3.28Å; P79-F154 HydrophobicContact CG-CD1 4.02Å; P79-F154 HydrophobicContact CG-CD2 3.59Å; P79-F154 HydrophobicContact CG-CE1 3.8Å; P79-F154 HydrophobicContact CG-CE2 3.37Å; P79-F154 HydrophobicContact CG-CG 3.91Å; P79-F154 HydrophobicContact CG-CZ 3.49Å; P79-F154 VanDerWaalsContact CG-CZ 3.49Å; T150-F154 WeakPolarHBondContact O-CB 3.33Å; T150-F154 PolarHBondContact O-N 3.28Å; V151-F154 PolarHBondContact O-N 3.5Å; F154-T157 PolarHBondContact O-N 3.18Å; F154-F158 VanDerWaalsContact O-CB 3.28Å; F154-F158 WeakPolarHBondContact O-CB 3.14Å; F154-F158 PolarHBondContact O-N 3.32Å
155	G	96.7	Very high	95.7	Very high	19 Å²	19	30.4 Å²	30.4	20%	0.196	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-45.7	173.7	0	0	0	0	0	112.5	V151 A152 F153 F158 L159	V151-G155 PolarHBondContact O-N 3.05Å; A152-G155 PolarHBondContact O-N 2.7Å; F153-G155 VanDerWaalsContact C-N 3.3Å; F153-G155 PolarHBondContact O-N 2.84Å; G155-F158 PolarHBondContact O-N 3.45Å; G155-L159 VanDerWaalsContact O-CG 3.25Å; G155-L159 WeakPolarHBondContact O-CG 3.29Å; G155-L159 PolarHBondContact O-N 3.2Å; G155-L159 VanDerWaalsContact O-N 3.08Å
156	L	96.9	Very high	95.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59	-49.6	175	-74.8	179.3	0	0	0	112.1	L112 N115 L116 I119 A152 F153 F158 L159 A160	L112-L156 HydrophobicContact CD2-CD2 4.04Å; L112-L156 WeakPolarHBondContact CD2-O 3.47Å; N115-L156 HydrophobicContact CB-CD2 3.82Å; L116-L156 HydrophobicContact CD2-CD1 3.86Å; L116-L156 HydrophobicContact CD2-CD2 3.92Å; L116-L156 HydrophobicContact CG-CD2 3.88Å; I119-L156 HydrophobicContact CD1-CD1 3.32Å; I119-L156 HydrophobicContact CD1-CD2 4.19Å; I119-L156 HydrophobicContact CD1-CG 3.61Å; A152-L156 PolarHBondContact O-N 3.49Å; F153-L156 HydrophobicContact CD1-CD1 4.05Å; F153-L156 HydrophobicContact CE1-CD1 4.18Å; F153-L156 HydrophobicContact CG-CD1 4.41Å; F153-L156 PolarHBondContact O-N 3.4Å; L156-F158 PolarHBondContact O-N 3.2Å; L156-L159 PolarHBondContact O-N 3.48Å; L156-A160 WeakPolarHBondContact O-CB 3.34Å; L156-A160 PolarHBondContact O-N 2.96Å
157	T	95.7	Very high	95.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-67.2	-36.6	-178.3	-60.1	0	0	0	0	112.2	L48 A76 P79 F80 F153 F154 L159 A160 A161	L48-T157 HydrophobicContact CD2-CG2 4.09Å; A76-T157 WeakPolarHBondContact O-CB 3.44Å; A76-T157 WeakPolarHBondContact O-CG2 3.48Å; A76-T157 PolarHBondContact O-OG1 3.02Å; P79-T157 HydrophobicContact CB-CG2 4.27Å; F80-T157 HydrophobicContact CB-CG2 3.68Å; F153-T157 WeakPolarHBondContact O-CB 3.25Å; F153-T157 PolarHBondContact O-N 3.34Å; F153-T157 PolarHBondContact O-OG1 3.09Å; F153-T157 VanDerWaalsContact O-OG1 3.12Å; F154-T157 PolarHBondContact O-N 3.18Å; T157-L159 VanDerWaalsContact C-N 3.35Å; T157-A160 PolarHBondContact O-N 2.79Å; T157-A161 WeakPolarHBondContact O-CB 3.13Å; T157-A161 PolarHBondContact O-N 3.14Å
158	F	96.4	Very high	94.7	Very high	80 Å²	80	25.9 Å²	25.9	35%	0.351	13%	0.132	S	C	.	.	H	α-helix	trans	-60.7	-44.7	173.9	177	-93.4	0	0	0	111.8	P79 W86 F154 G155 L156 A161 T162	P79-F158 HydrophobicContact CB-CB 3.82Å; P79-F158 HydrophobicContact CB-CD2 4.18Å; P79-F158 HydrophobicContact CG-CB 4.09Å; W86-F158 AromaticContact CD2-CE2 3.89Å; W86-F158 HydrophobicContact CD2-CE2 3.89Å; W86-F158 HydrophobicContact CD2-CZ 4.49Å; W86-F158 AromaticContact CE2-CE2 3.61Å; W86-F158 HydrophobicContact CE3-CE2 4.1Å; W86-F158 AromaticContact CH2-CD2 3.66Å; W86-F158 HydrophobicContact CH2-CD2 3.66Å; W86-F158 AromaticContact CH2-CE2 3.77Å; W86-F158 HydrophobicContact CH2-CE2 3.77Å; W86-F158 AromaticContact CZ2-CD2 3.57Å; W86-F158 HydrophobicContact CZ2-CD2 3.57Å; W86-F158 AromaticContact CZ2-CE2 3.56Å; W86-F158 HydrophobicContact CZ2-CE2 3.56Å; W86-F158 HydrophobicContact CZ2-CG 4.47Å; W86-F158 HydrophobicContact CZ2-CZ 4.45Å; W86-F158 HydrophobicContact CZ3-CD2 4.29Å; W86-F158 HydrophobicContact CZ3-CE2 4.06Å; F154-F158 VanDerWaalsContact O-CB 3.28Å; F154-F158 WeakPolarHBondContact O-CB 3.14Å; F154-F158 PolarHBondContact O-N 3.32Å; G155-F158 PolarHBondContact O-N 3.45Å; L156-F158 PolarHBondContact O-N 3.2Å; F158-A161 PolarHBondContact O-N 3.42Å; F158-T162 PolarHBondContact O-N 3.1Å; F158-T162 PolarHBondContact O-OG1 3.3Å
159	L	97.7	Very high	93.9	Very high	24 Å²	24	20.1 Å²	20.1	13%	0.126	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-42.5	176.4	-66	169	0	0	0	111.4	I108 A111 L112 G155 L156 T157 A161 T162 Q163	I108-L159 HydrophobicContact CD1-CD2 3.62Å; I108-L159 HydrophobicContact CG2-CB 4.17Å; I108-L159 HydrophobicContact CG2-CD2 4.34Å; I108-L159 WeakPolarHBondContact CG2-O 3.28Å; A111-L159 HydrophobicContact CB-CD1 3.84Å; A111-L159 HydrophobicContact CB-CD2 3.92Å; L112-L159 HydrophobicContact CD1-CB 4.26Å; L112-L159 HydrophobicContact CD2-CB 3.58Å; L112-L159 HydrophobicContact CD2-CD1 4.27Å; L112-L159 HydrophobicContact CG-CB 3.62Å; L112-L159 HydrophobicContact CG-CD1 4.25Å; G155-L159 VanDerWaalsContact O-CG 3.25Å; G155-L159 WeakPolarHBondContact O-CG 3.29Å; G155-L159 PolarHBondContact O-N 3.2Å; G155-L159 VanDerWaalsContact O-N 3.08Å; L156-L159 PolarHBondContact O-N 3.48Å; T157-L159 VanDerWaalsContact C-N 3.35Å; L159-A161 PolarHBondContact O-N 2.9Å; L159-T162 WeakPolarHBondContact O-CB 3.31Å; L159-T162 PolarHBondContact O-N 2.98Å; L159-Q163 PolarHBondContact O-N 3.37Å
160	A	96.3	Very high	93.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.8	-41.2	176.6	0	0	0	0	0	112.2	Q44 P47 L156 T157 T162 Q163 D164	Q44-A160 HydrophobicContact CG-CB 4.4Å; P47-A160 HydrophobicContact CB-CB 4.18Å; P47-A160 HydrophobicContact CG-CB 4.47Å; L156-A160 WeakPolarHBondContact O-CB 3.34Å; L156-A160 PolarHBondContact O-N 2.96Å; T157-A160 PolarHBondContact O-N 2.79Å; A160-T162 VanDerWaalsContact C-N 3.31Å; A160-T162 PolarHBondContact O-N 2.87Å; A160-Q163 WeakPolarHBondContact O-CB 3.33Å; A160-Q163 PolarHBondContact O-N 3.42Å; A160-D164 PolarHBondContact O-N 3.38Å
161	A	93.5	Very high	92.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-37.2	174.6	0	0	0	0	0	112.3	F80 K83 W86 T157 F158 L159 D164 I165	F80-A161 HydrophobicContact CB-CB 4.5Å; F80-A161 HydrophobicContact CD2-CB 3.89Å; K83-A161 HydrophobicContact CB-CB 4.05Å; W86-A161 HydrophobicContact CZ2-CB 3.97Å; T157-A161 WeakPolarHBondContact O-CB 3.13Å; T157-A161 PolarHBondContact O-N 3.14Å; F158-A161 PolarHBondContact O-N 3.42Å; L159-A161 PolarHBondContact O-N 2.9Å; A161-D164 WeakPolarHBondContact O-CB 3.25Å; A161-D164 PolarHBondContact O-N 3.42Å; A161-I165 WeakPolarHBondContact O-CG1 3.15Å; A161-I165 PolarHBondContact O-N 3.25Å
162	T	94	Very high	91.8	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.018	10%	0.104	C	C	.	.	H	α-helix	trans	-68.7	-41.4	174.6	-54.7	0	0	0	0	111.2	W86 V90 W104 I108 F158 L159 A160 D164 I165 V166	W86-T162 PolarHBondContact NE1-OG1 2.92Å; V90-T162 HydrophobicContact CG2-CG2 3.91Å; W104-T162 HydrophobicContact CE3-CG2 4.4Å; I108-T162 HydrophobicContact CD1-CG2 3.81Å; I108-T162 HydrophobicContact CG1-CG2 3.9Å; F158-T162 PolarHBondContact O-N 3.1Å; F158-T162 PolarHBondContact O-OG1 3.3Å; L159-T162 WeakPolarHBondContact O-CB 3.31Å; L159-T162 PolarHBondContact O-N 2.98Å; A160-T162 VanDerWaalsContact C-N 3.31Å; A160-T162 PolarHBondContact O-N 2.87Å; T162-D164 VanDerWaalsContact C-N 3.32Å; T162-D164 PolarHBondContact O-N 3.33Å; T162-I165 PolarHBondContact O-N 3.5Å; T162-V166 WeakPolarHBondContact O-CG2 3.36Å; T162-V166 PolarHBondContact O-N 3.17Å
163	Q	94.4	Very high	90.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.5	-44.2	173	179.9	-178	-13.5	0	0	111.2	L40 L105 I108 Q109 L159 A160 I165 V166 V167	L40-Q163 PolarHBondContact O-NE2 3.06Å; L105-Q163 HydrophobicContact CD1-CG 3.89Å; I108-Q163 HydrophobicContact CG2-CB 4.08Å; Q109-Q163 HydrophobicContact CG-CG 4.48Å; Q109-Q163 VanDerWaalsContact NE2-NE2 3.14Å; L159-Q163 PolarHBondContact O-N 3.37Å; A160-Q163 WeakPolarHBondContact O-CB 3.33Å; A160-Q163 PolarHBondContact O-N 3.42Å; Q163-I165 PolarHBondContact O-N 3.34Å; Q163-V166 PolarHBondContact O-N 3.38Å; Q163-V166 VanDerWaalsContact O-N 3.09Å; Q163-V167 HydrophobicContact CG-CG2 3.9Å; Q163-V167 VanDerWaalsContact O-CG2 3.31Å; Q163-V167 WeakPolarHBondContact O-CG2 3.35Å; Q163-V167 PolarHBondContact O-N 3.41Å
164	D	91.4	Very high	90.1	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-55.2	-49.8	178.2	-163.2	37.9	0	0	0	111.8	Q44 F80 K83 A160 A161 T162 V166 V167 D168 N187 Q191	Q44-D164 VanDerWaalsContact CD-CB 3.44Å; Q44-D164 VanDerWaalsContact CD-OD1 3.28Å; Q44-D164 HydrophobicContact CG-CB 4.49Å; Q44-D164 PolarHBondContact NE2-OD1 3.03Å; Q44-D164 VanDerWaalsContact OE1-CA 3.28Å; Q44-D164 PolarHBondContact OE1-OD1 3.4Å; F80-D164 HydrophobicContact CE2-CB 4.39Å; K83-D164 IonicContact NZ-OD2 2.71Å; K83-D164 PolarHBondContact NZ-OD2 2.99Å; A160-D164 PolarHBondContact O-N 3.38Å; A161-D164 WeakPolarHBondContact O-CB 3.25Å; A161-D164 PolarHBondContact O-N 3.42Å; T162-D164 VanDerWaalsContact C-N 3.32Å; T162-D164 PolarHBondContact O-N 3.33Å; D164-V166 VanDerWaalsContact C-N 3.27Å; D164-V166 PolarHBondContact O-N 2.88Å; D164-V167 PolarHBondContact O-N 3.12Å; D164-D168 VanDerWaalsContact O-CB 3.26Å; D164-D168 WeakPolarHBondContact O-CB 3.24Å; D164-D168 VanDerWaalsContact O-CG 3.26Å; D164-D168 PolarHBondContact O-N 2.74Å; D164-N187 PolarHBondContact OD1-ND2 3.42Å; D164-Q191 PolarHBondContact OD1-NE2 3.4Å
165	I	87.5	Confident	89.2	Confident	11 Å²	11	19 Å²	19	6%	0.056	11%	0.105	C	C	.	.	H	α-helix	trans	-54.5	-45.5	176.2	-65.2	157.4	0	0	0	110.8	K83 A87 V90 A161 T162 Q163 G169	K83-I165 HydrophobicContact CB-CD1 3.94Å; K83-I165 HydrophobicContact CB-CG1 4.43Å; K83-I165 HydrophobicContact CD-CG1 4.15Å; K83-I165 HydrophobicContact CG-CD1 4.43Å; K83-I165 HydrophobicContact CG-CG1 4.44Å; A87-I165 HydrophobicContact CB-CD1 3.72Å; A87-I165 HydrophobicContact CB-CG1 3.96Å; A87-I165 HydrophobicContact CB-CG2 3.98Å; V90-I165 HydrophobicContact CB-CG2 4Å; V90-I165 HydrophobicContact CG1-CB 4.48Å; V90-I165 HydrophobicContact CG1-CG2 3.88Å; A161-I165 WeakPolarHBondContact O-CG1 3.15Å; A161-I165 PolarHBondContact O-N 3.25Å; T162-I165 PolarHBondContact O-N 3.5Å; Q163-I165 PolarHBondContact O-N 3.34Å; I165-G169 PolarHBondContact O-N 2.96Å; I165-G169 VanDerWaalsContact O-N 3.13Å
166	V	90.4	Very high	88.5	Confident	2 Å²	2	19.8 Å²	19.8	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-68.2	-46.3	-178.2	179.9	0	0	0	0	111.7	V90 R101 W104 L105 T162 Q163 D164 G169 W170	V90-V166 HydrophobicContact CG1-CG2 3.42Å; V90-V166 VanDerWaalsContact CG1-CG2 3.42Å; R101-V166 HydrophobicContact CB-CG1 4.15Å; R101-V166 VanDerWaalsContact O-CG1 3.28Å; R101-V166 WeakPolarHBondContact O-CG1 3.09Å; W104-V166 HydrophobicContact CB-CG1 4.45Å; W104-V166 HydrophobicContact CB-CG2 3.43Å; W104-V166 VanDerWaalsContact CB-CG2 3.43Å; W104-V166 HydrophobicContact CG-CG2 4.31Å; L105-V166 HydrophobicContact CB-CG1 3.88Å; T162-V166 WeakPolarHBondContact O-CG2 3.36Å; T162-V166 PolarHBondContact O-N 3.17Å; Q163-V166 PolarHBondContact O-N 3.38Å; Q163-V166 VanDerWaalsContact O-N 3.09Å; D164-V166 VanDerWaalsContact C-N 3.27Å; D164-V166 PolarHBondContact O-N 2.88Å; V166-G169 CarbonylContact O-C 3.55Å; V166-G169 PolarHBondContact O-N 3.08Å; V166-W170 WeakPolarHBondContact O-CB 3.09Å; V166-W170 PolarHBondContact O-N 3.37Å
167	V	91.2	Very high	87.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-71.2	-39.4	-176	-177.9	0	0	0	0	110.6	L37 L40 Y41 L105 Q163 D164 G169 W170 A171	L37-V167 HydrophobicContact CD2-CG1 4Å; L40-V167 HydrophobicContact CB-CG1 4Å; L40-V167 HydrophobicContact CB-CG2 4.13Å; L40-V167 HydrophobicContact CD1-CG1 4.38Å; L40-V167 HydrophobicContact CD1-CG2 4.4Å; Y41-V167 HydrophobicContact CD1-CB 4.46Å; Y41-V167 HydrophobicContact CD1-CG1 3.97Å; Y41-V167 HydrophobicContact CD2-CG1 4.3Å; Y41-V167 HydrophobicContact CE1-CB 3.89Å; Y41-V167 HydrophobicContact CE1-CG1 3.5Å; Y41-V167 HydrophobicContact CE2-CG1 3.9Å; Y41-V167 HydrophobicContact CG-CG1 4.34Å; Y41-V167 VanDerWaalsContact CZ-CG1 3.47Å; L105-V167 HydrophobicContact CD1-CG2 3.86Å; Q163-V167 HydrophobicContact CG-CG2 3.9Å; Q163-V167 VanDerWaalsContact O-CG2 3.31Å; Q163-V167 WeakPolarHBondContact O-CG2 3.35Å; Q163-V167 PolarHBondContact O-N 3.41Å; D164-V167 PolarHBondContact O-N 3.12Å; V167-G169 VanDerWaalsContact C-N 3.32Å; V167-G169 PolarHBondContact O-N 3.22Å; V167-W170 PolarHBondContact O-N 2.97Å; V167-A171 PolarHBondContact O-N 3.04Å
168	D	85.6	Confident	86.6	Confident	48 Å²	48	38.8 Å²	38.8	26%	0.257	19%	0.185	S	C	.	.	H	α-helix	trans	-55.8	-49.3	171	-77.8	-16.4	0	0	0	110.4	Y41 K83 D164 W170 A171 N187	Y41-D168 WeakPolarHBondContact OH-CA 3.49Å; Y41-D168 PolarHBondContact OH-N 3.34Å; Y41-D168 PolarHBondContact OH-OD1 2.62Å; K83-D168 IonicContact NZ-OD2 3.69Å; D164-D168 VanDerWaalsContact O-CB 3.26Å; D164-D168 WeakPolarHBondContact O-CB 3.24Å; D164-D168 VanDerWaalsContact O-CG 3.26Å; D164-D168 PolarHBondContact O-N 2.74Å; D168-W170 VanDerWaalsContact C-N 3.28Å; D168-W170 PolarHBondContact O-N 3.22Å; D168-A171 PolarHBondContact O-N 3.01Å; D168-N187 PolarHBondContact OD1-ND2 3.06Å
169	G	79.5	Confident	85.6	Confident	8 Å²	8	36.9 Å²	36.9	8%	0.082	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-25.5	176.3	0	0	0	0	0	114	R101 I165 V166 V167	R101-G169 PolarHBondContact NE-O 3.15Å; R101-G169 PolarHBondContact NH2-O 3.28Å; R101-G169 VanDerWaalsContact NH2-O 3.1Å; I165-G169 PolarHBondContact O-N 2.96Å; I165-G169 VanDerWaalsContact O-N 3.13Å; V166-G169 CarbonylContact O-C 3.55Å; V166-G169 PolarHBondContact O-N 3.08Å; V167-G169 VanDerWaalsContact C-N 3.32Å; V167-G169 PolarHBondContact O-N 3.22Å
170	W	86.2	Confident	84.5	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-79.3	-37	177.8	-158.7	10.9	0	0	0	111.5	L40 R101 L105 V166 V167 D168 L172 T173 M174 V246 K250	L40-W170 HydrophobicContact CD1-CE3 3.86Å; L40-W170 HydrophobicContact CD1-CZ3 3.67Å; R101-W170 HydrophobicContact CB-CB 4.09Å; R101-W170 HydrophobicContact CB-CD2 4.09Å; R101-W170 HydrophobicContact CB-CG 3.8Å; R101-W170 HydrophobicContact CG-CB 3.84Å; R101-W170 HydrophobicContact CG-CG 3.8Å; L105-W170 HydrophobicContact CD2-CE3 3.7Å; L105-W170 HydrophobicContact CD2-CH2 4.11Å; L105-W170 HydrophobicContact CD2-CZ3 3.21Å; V166-W170 WeakPolarHBondContact O-CB 3.09Å; V166-W170 PolarHBondContact O-N 3.37Å; V167-W170 PolarHBondContact O-N 2.97Å; D168-W170 VanDerWaalsContact C-N 3.28Å; D168-W170 PolarHBondContact O-N 3.22Å; W170-L172 VanDerWaalsContact C-N 3.25Å; W170-L172 PolarHBondContact O-N 3.36Å; W170-T173 PolarHBondContact O-N 3.01Å; W170-T173 PolarHBondContact O-OG1 3.24Å; W170-M174 HydrophobicContact CD2-CE 3.25Å; W170-M174 HydrophobicContact CE3-CE 3.56Å; W170-M174 HydrophobicContact CG-CE 3.71Å; W170-M174 HydrophobicContact CH2-CE 4.04Å; W170-M174 HydrophobicContact CZ2-CE 3.76Å; W170-M174 HydrophobicContact CZ3-CE 3.91Å; W170-M174 WeakPolarHBondContact O-CB 3.49Å; W170-M174 PolarHBondContact O-N 3.12Å; W170-V246 HydrophobicContact CH2-CG1 3.96Å; W170-V246 HydrophobicContact CZ3-CG1 4.14Å; W170-K250 HydrophobicContact CH2-CB 4.37Å; W170-K250 HydrophobicContact CH2-CG 3.59Å; W170-K250 HydrophobicContact CZ2-CG 3.57Å
171	A	83.5	Confident	83.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.2	-40.7	178.4	0	0	0	0	0	112.5	L37 V167 D168 T173 M174 L175 A183	L37-A171 HydrophobicContact CD1-CB 3.95Å; L37-A171 HydrophobicContact CD2-CB 3.92Å; V167-A171 PolarHBondContact O-N 3.04Å; D168-A171 PolarHBondContact O-N 3.01Å; A171-T173 PolarHBondContact O-N 3.27Å; A171-M174 PolarHBondContact O-N 3.48Å; A171-L175 PolarHBondContact O-N 3.09Å; A171-L175 VanDerWaalsContact O-N 3.16Å; A171-A183 HydrophobicContact CB-CB 3.89Å
172	L	77.9	Confident	82.3	Confident	108 Å²	108	46.9 Å²	46.9	57%	0.565	23%	0.234	S	C	*	.	H	α-helix	trans	-63.6	-24.7	177.9	-61.2	179.4	0	0	0	114.3	W170 L180	W170-L172 VanDerWaalsContact C-N 3.25Å; W170-L172 PolarHBondContact O-N 3.36Å; L172-L180 HydrophobicContact CD2-CD2 4.18Å
173	T	79.8	Confident	81.4	Confident	65 Å²	65	47.5 Å²	47.5	40%	0.399	24%	0.239	S	C	.	.	H	α-helix	trans	-104.5	-17.6	179.7	55.7	0	0	0	0	113.2	W170 A171	W170-T173 PolarHBondContact O-N 3.01Å; W170-T173 PolarHBondContact O-OG1 3.24Å; A171-T173 PolarHBondContact O-N 3.27Å
174	M	80.6	Confident	80.3	Confident	13 Å²	13	51.2 Å²	51.2	6%	0.064	27%	0.265	C	S	.	.	H	α-helix	trans	-89.5	-30.8	-177.3	-160.5	-171.8	-61.8	0	0	112.2	N33 L36 L37 W170 A171	N33-M174 HydrophobicContact CB-CG 3.72Å; N33-M174 HydrophobicContact CB-SD 3.73Å; N33-M174 PolarHBondContact ND2-O 2.85Å; L36-M174 HydrophobicContact CD2-CE 4.18Å; L36-M174 HydrophobicContact CD2-SD 4.16Å; L37-M174 HydrophobicContact CD1-SD 4.4Å; L37-M174 HydrophobicContact CD2-CE 4.07Å; L37-M174 HydrophobicContact CD2-SD 4.28Å; L37-M174 HydrophobicContact CG-CE 4.39Å; L37-M174 HydrophobicContact CG-SD 3.97Å; W170-M174 HydrophobicContact CD2-CE 3.25Å; W170-M174 HydrophobicContact CE3-CE 3.56Å; W170-M174 HydrophobicContact CG-CE 3.71Å; W170-M174 HydrophobicContact CH2-CE 4.04Å; W170-M174 HydrophobicContact CZ2-CE 3.76Å; W170-M174 HydrophobicContact CZ3-CE 3.91Å; W170-M174 WeakPolarHBondContact O-CB 3.49Å; W170-M174 PolarHBondContact O-N 3.12Å; A171-M174 PolarHBondContact O-N 3.48Å
175	L	78.8	Confident	79.6	Confident	10 Å²	10	53.9 Å²	53.9	5%	0.052	28%	0.281	C	S	.	.	S	Bend	trans	-90.2	143.2	178.6	-62	173.6	0	0	0	110.7	D30 N33 I34 L37 A171 W182 A183	D30-L175 HydrophobicContact CB-CD2 4.28Å; N33-L175 HydrophobicContact CB-CD2 4.39Å; I34-L175 HydrophobicContact CD1-CD2 4.38Å; I34-L175 HydrophobicContact CG1-CD2 3.54Å; L37-L175 HydrophobicContact CD1-CD1 3.97Å; L37-L175 HydrophobicContact CD1-CD2 3.92Å; L37-L175 HydrophobicContact CD1-CG 3.81Å; A171-L175 PolarHBondContact O-N 3.09Å; A171-L175 VanDerWaalsContact O-N 3.16Å; L175-W182 HydrophobicContact CD1-CB 4.47Å; L175-A183 HydrophobicContact CD1-CB 4.04Å
176	S	82.1	Confident	79.4	Confident	37 Å²	37	53.4 Å²	53.4	26%	0.259	28%	0.279	S	S	.	.			trans	-63.5	157	168.5	70.1	0	0	0	0	111.1	D30 K178 N179 L180	D30-S176 PolarHBondContact OD1-N 2.71Å; D30-S176 WeakPolarHBondContact OD2-CB 3.37Å; D30-S176 PolarHBondContact OD2-N 3.1Å; D30-S176 PolarHBondContact OD2-OG 3.03Å; S176-K178 PolarHBondContact O-N 2.97Å; S176-K178 VanDerWaalsContact O-N 3.16Å; S176-N179 CarbonylContact O-C 3.55Å; S176-N179 PolarHBondContact O-N 3.25Å; S176-N179 PolarHBondContact OG-ND2 2.89Å; S176-L180 PolarHBondContact O-N 3.16Å; S176-L180 VanDerWaalsContact O-N 3.12Å
177	R	74.8	Confident	79.1	Confident	223 Å²	223	54.7 Å²	54.7	84%	0.842	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-53.9	-39.2	-178.2	-71.2	-177.8	-179.6	-95.9	3.2	113.1	N179 L180	R177-N179 PolarHBondContact O-N 3.41Å; R177-L180 HydrophobicContact CB-CD1 4.32Å; R177-L180 HydrophobicContact CG-CD1 4.31Å; R177-L180 PolarHBondContact O-N 3.04Å
178	K	76.2	Confident	78.7	Confident	175 Å²	175	58.6 Å²	58.6	76%	0.761	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-63.1	-28.5	178.1	-174.9	177.4	177.7	-180	0	113	S176	S176-K178 PolarHBondContact O-N 2.97Å; S176-K178 VanDerWaalsContact O-N 3.16Å
179	N	77.1	Confident	78.7	Confident	41 Å²	41	60 Å²	60	22%	0.219	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-107.4	5.6	-175.4	-65.6	-33.9	0	0	0	113.7	D30 S176 R177 G181 W182	D30-N179 WeakPolarHBondContact OD2-CB 3.18Å; D30-N179 PolarHBondContact OD2-ND2 2.97Å; S176-N179 CarbonylContact O-C 3.55Å; S176-N179 PolarHBondContact O-N 3.25Å; S176-N179 PolarHBondContact OG-ND2 2.89Å; R177-N179 PolarHBondContact O-N 3.41Å; N179-G181 PolarHBondContact O-N 3.4Å; N179-G181 VanDerWaalsContact O-N 3.12Å; N179-W182 WeakPolarHBondContact O-CB 3.46Å; N179-W182 PolarHBondContact O-N 3.26Å
180	L	73.4	Confident	79.3	Confident	59 Å²	59	59.6 Å²	59.6	31%	0.309	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-32.2	179.4	-81.6	167	0	0	0	113.2	L172 S176 R177 W182 A183	L172-L180 HydrophobicContact CD2-CD2 4.18Å; S176-L180 PolarHBondContact O-N 3.16Å; S176-L180 VanDerWaalsContact O-N 3.12Å; R177-L180 HydrophobicContact CB-CD1 4.32Å; R177-L180 HydrophobicContact CG-CD1 4.31Å; R177-L180 PolarHBondContact O-N 3.04Å; L180-W182 PolarHBondContact O-N 3.34Å; L180-W182 VanDerWaalsContact O-N 3.15Å; L180-A183 VanDerWaalsContact O-CB 3.28Å; L180-A183 WeakPolarHBondContact O-CB 3.4Å; L180-A183 PolarHBondContact O-N 3.35Å
181	G	68.7	Low	79.6	Confident	49 Å²	49	60.7 Å²	60.7	51%	0.505	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.1	176.1	0	0	0	0	0	114.1	N179 A183 S184	N179-G181 PolarHBondContact O-N 3.4Å; N179-G181 VanDerWaalsContact O-N 3.12Å; G181-A183 VanDerWaalsContact C-N 3.26Å; G181-A183 PolarHBondContact O-N 2.92Å; G181-S184 PolarHBondContact O-OG 3.45Å
182	W	74.8	Confident	79.9	Confident	126 Å²	126	64 Å²	64	48%	0.477	34%	0.341	S	S	.	.	H	α-helix	trans	-73	-13.6	177.3	-69.2	99.3	0	0	0	114	L175 N179 L180 S184 T185 C186	L175-W182 HydrophobicContact CD1-CB 4.47Å; N179-W182 WeakPolarHBondContact O-CB 3.46Å; N179-W182 PolarHBondContact O-N 3.26Å; L180-W182 PolarHBondContact O-N 3.34Å; L180-W182 VanDerWaalsContact O-N 3.15Å; W182-S184 PolarHBondContact O-N 2.88Å; W182-T185 HydrophobicContact CE3-CG2 4.05Å; W182-T185 HydrophobicContact CZ3-CG2 4.17Å; W182-T185 PolarHBondContact O-N 3.41Å; W182-C186 PolarHBondContact O-N 3.49Å; W182-C186 PolarHBondContact O-SG 3.22Å
183	A	74.7	Confident	80.6	Confident	15 Å²	15	62.5 Å²	62.5	12%	0.124	33%	0.334	C	S	.	.	H	α-helix	trans	-57.2	-48.5	-178.4	0	0	0	0	0	112.2	A171 L175 L180 G181 T185 C186 N187	A171-A183 HydrophobicContact CB-CB 3.89Å; L175-A183 HydrophobicContact CD1-CB 4.04Å; L180-A183 VanDerWaalsContact O-CB 3.28Å; L180-A183 WeakPolarHBondContact O-CB 3.4Å; L180-A183 PolarHBondContact O-N 3.35Å; G181-A183 VanDerWaalsContact C-N 3.26Å; G181-A183 PolarHBondContact O-N 2.92Å; A183-T185 PolarHBondContact O-N 2.83Å; A183-C186 PolarHBondContact O-N 2.94Å; A183-N187 PolarHBondContact O-N 2.85Å; A183-N187 VanDerWaalsContact O-N 3.1Å
184	S	71.6	Confident	81.5	Confident	78 Å²	78	59.4 Å²	59.4	55%	0.545	32%	0.315	S	S	.	.	H	α-helix	trans	-65.3	-37.8	178.5	65.9	0	0	0	0	112.7	G181 W182 N187 T188	G181-S184 PolarHBondContact O-OG 3.45Å; W182-S184 PolarHBondContact O-N 2.88Å; S184-N187 PolarHBondContact O-N 3.44Å; S184-T188 PolarHBondContact O-N 2.96Å; S184-T188 PolarHBondContact O-OG1 3.39Å
185	T	78.3	Confident	82.1	Confident	59 Å²	59	61.6 Å²	61.6	36%	0.362	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-44.7	175.7	-51.2	0	0	0	0	111.1	W182 A183 N187 T188 V189	W182-T185 HydrophobicContact CE3-CG2 4.05Å; W182-T185 HydrophobicContact CZ3-CG2 4.17Å; W182-T185 PolarHBondContact O-N 3.41Å; A183-T185 PolarHBondContact O-N 2.83Å; T185-N187 VanDerWaalsContact C-N 3.32Å; T185-N187 PolarHBondContact O-N 2.86Å; T185-T188 PolarHBondContact O-N 3.12Å; T185-V189 HydrophobicContact CG2-CG2 4.21Å; T185-V189 WeakPolarHBondContact O-CB 3.48Å; T185-V189 VanDerWaalsContact O-CG2 3.3Å; T185-V189 WeakPolarHBondContact O-CG2 3.42Å; T185-V189 PolarHBondContact O-N 3.48Å
186	C	83.2	Confident	82.9	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-60.6	-43.1	177.1	-65.5	0	0	0	0	111.5	L37 I38 Y41 W182 A183 G190	L37-C186 HydrophobicContact CB-CB 4.23Å; I38-C186 HydrophobicContact CG1-CB 3.91Å; Y41-C186 VanDerWaalsContact CD2-C 3.42Å; Y41-C186 HydrophobicContact CD2-CB 4.07Å; Y41-C186 VanDerWaalsContact CD2-O 3.32Å; Y41-C186 WeakPolarHBondContact CD2-O 3.28Å; Y41-C186 HydrophobicContact CE2-CB 3.96Å; W182-C186 PolarHBondContact O-N 3.49Å; W182-C186 PolarHBondContact O-SG 3.22Å; A183-C186 PolarHBondContact O-N 2.94Å; C186-G190 WeakPolarHBondContact O-CA 3.24Å; C186-G190 PolarHBondContact O-N 3.5Å
187	N	83.8	Confident	83.6	Confident	28 Å²	28	63 Å²	63	15%	0.15	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-57.2	176.4	-179.6	-68.6	0	0	0	110.7	Y41 D164 D168 A183 S184 T185 V189 G190 Q191	Y41-N187 HydrophobicContact CD1-CB 4.25Å; Y41-N187 VanDerWaalsContact CD2-CA 3.42Å; Y41-N187 HydrophobicContact CD2-CB 4.23Å; Y41-N187 HydrophobicContact CE1-CB 3.87Å; Y41-N187 WeakPolarHBondContact CE1-ND2 3.39Å; Y41-N187 VanDerWaalsContact CE2-CA 3.49Å; Y41-N187 HydrophobicContact CE2-CB 3.82Å; Y41-N187 HydrophobicContact CG-CB 4.42Å; D164-N187 PolarHBondContact OD1-ND2 3.42Å; D168-N187 PolarHBondContact OD1-ND2 3.06Å; A183-N187 PolarHBondContact O-N 2.85Å; A183-N187 VanDerWaalsContact O-N 3.1Å; S184-N187 PolarHBondContact O-N 3.44Å; T185-N187 VanDerWaalsContact C-N 3.32Å; T185-N187 PolarHBondContact O-N 2.86Å; N187-V189 PolarHBondContact O-N 2.55Å; N187-G190 PolarHBondContact O-N 3.32Å; N187-Q191 VanDerWaalsContact CG-NE2 3.27Å; N187-Q191 PolarHBondContact ND2-NE2 3.15Å; N187-Q191 WeakPolarHBondContact O-CB 3.31Å; N187-Q191 WeakPolarHBondContact O-CG 3.45Å; N187-Q191 PolarHBondContact O-N 2.88Å; N187-Q191 PolarHBondContact OD1-NE2 3.12Å
188	T	81.7	Confident	84.6	Confident	83 Å²	83	52.4 Å²	52.4	51%	0.509	29%	0.289	S	S	.	.	H	α-helix	trans	-56.9	-51.2	-177.9	-54.8	0	0	0	0	111.7	S184 T185 T192	S184-T188 PolarHBondContact O-N 2.96Å; S184-T188 PolarHBondContact O-OG1 3.39Å; T185-T188 PolarHBondContact O-N 3.12Å; T188-T192 VanDerWaalsContact O-CB 3.26Å; T188-T192 WeakPolarHBondContact O-CB 3.5Å; T188-T192 PolarHBondContact O-N 3.48Å; T188-T192 VanDerWaalsContact O-N 3.08Å; T188-T192 PolarHBondContact O-OG1 2.9Å
189	V	86.3	Confident	85.6	Confident	76 Å²	76	45.3 Å²	45.3	46%	0.461	26%	0.258	S	S	.	.	H	α-helix	trans	-66.6	-48	-177.1	171.4	0	0	0	0	110.8	T185 N187 T192 L193	T185-V189 HydrophobicContact CG2-CG2 4.21Å; T185-V189 WeakPolarHBondContact O-CB 3.48Å; T185-V189 VanDerWaalsContact O-CG2 3.3Å; T185-V189 WeakPolarHBondContact O-CG2 3.42Å; T185-V189 PolarHBondContact O-N 3.48Å; N187-V189 PolarHBondContact O-N 2.55Å; V189-T192 PolarHBondContact O-N 3.1Å; V189-L193 WeakPolarHBondContact O-CB 3.5Å; V189-L193 PolarHBondContact O-N 3.41Å
190	G	92.5	Very high	86.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-48.9	-176.5	0	0	0	0	0	112	Y41 I42 C186 N187 T192 L193 G194	Y41-G190 CarbonylContact O-C 3.6Å; I42-G190 VanDerWaalsContact CA-O 3.23Å; I42-G190 WeakPolarHBondContact CA-O 3.36Å; I42-G190 WeakPolarHBondContact CG1-O 3.46Å; I42-G190 PolarHBondContact N-O 3.47Å; C186-G190 WeakPolarHBondContact O-CA 3.24Å; C186-G190 PolarHBondContact O-N 3.5Å; N187-G190 PolarHBondContact O-N 3.32Å; G190-T192 PolarHBondContact O-N 3.33Å; G190-L193 PolarHBondContact O-N 3.42Å; G190-G194 PolarHBondContact O-N 3.49Å
191	Q	91.6	Very high	87.4	Confident	27 Å²	27	44.3 Å²	44.3	13%	0.126	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-43.2	177.9	-72.9	-164.5	59	0	0	112.4	Y41 D164 N187 L193 G194 H195	Y41-Q191 HydrophobicContact CD1-CG 4.33Å; D164-Q191 PolarHBondContact OD1-NE2 3.4Å; N187-Q191 VanDerWaalsContact CG-NE2 3.27Å; N187-Q191 PolarHBondContact ND2-NE2 3.15Å; N187-Q191 WeakPolarHBondContact O-CB 3.31Å; N187-Q191 WeakPolarHBondContact O-CG 3.45Å; N187-Q191 PolarHBondContact O-N 2.88Å; N187-Q191 PolarHBondContact OD1-NE2 3.12Å; Q191-L193 PolarHBondContact O-N 3.14Å; Q191-G194 PolarHBondContact O-N 3.4Å; Q191-H195 WeakPolarHBondContact O-CB 3.32Å; Q191-H195 PolarHBondContact O-N 3Å
192	T	90.2	Very high	88.7	Confident	69 Å²	69	42 Å²	42	42%	0.423	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-48	177.7	-58.3	0	0	0	0	110.8	T188 V189 G190 G194 H195 L196	T188-T192 VanDerWaalsContact O-CB 3.26Å; T188-T192 WeakPolarHBondContact O-CB 3.5Å; T188-T192 PolarHBondContact O-N 3.48Å; T188-T192 VanDerWaalsContact O-N 3.08Å; T188-T192 PolarHBondContact O-OG1 2.9Å; V189-T192 PolarHBondContact O-N 3.1Å; G190-T192 PolarHBondContact O-N 3.33Å; T192-G194 PolarHBondContact O-N 2.95Å; T192-H195 PolarHBondContact O-N 3.21Å; T192-L196 HydrophobicContact CG2-CD1 4.33Å; T192-L196 VanDerWaalsContact O-CG 3.32Å; T192-L196 WeakPolarHBondContact O-CG 3.3Å; T192-L196 PolarHBondContact O-N 2.92Å
193	L	93.5	Very high	89.6	Confident	77 Å²	77	36 Å²	36	40%	0.403	21%	0.209	S	C	.	.	H	α-helix	trans	-64.1	-41.6	178.3	-177.3	59.2	0	0	0	111.7	I42 V189 G190 Q191 H195 L196 I197	I42-L193 HydrophobicContact CD1-CD2 3.69Å; I42-L193 HydrophobicContact CD1-CG 4.34Å; I42-L193 HydrophobicContact CG1-CB 4.23Å; I42-L193 HydrophobicContact CG1-CD2 4.13Å; I42-L193 HydrophobicContact CG1-CG 4.32Å; V189-L193 WeakPolarHBondContact O-CB 3.5Å; V189-L193 PolarHBondContact O-N 3.41Å; G190-L193 PolarHBondContact O-N 3.42Å; Q191-L193 PolarHBondContact O-N 3.14Å; L193-H195 PolarHBondContact O-N 3.44Å; L193-L196 PolarHBondContact O-N 3.36Å; L193-I197 HydrophobicContact CD1-CD1 4.3Å; L193-I197 HydrophobicContact CG-CD1 4.05Å; L193-I197 VanDerWaalsContact O-CG1 3.26Å; L193-I197 WeakPolarHBondContact O-CG1 3.36Å; L193-I197 PolarHBondContact O-N 3.45Å
194	G	97.1	Very high	90.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.2	-43.8	173.9	0	0	0	0	0	112.7	I42 G45 I46 G190 Q191 T192 I197 G198	I42-G194 VanDerWaalsContact O-CA 3.31Å; I42-G194 WeakPolarHBondContact O-CA 3.43Å; G45-G194 CarbonylContact C-O 3.54Å; G45-G194 CarbonylContact O-C 3.53Å; I46-G194 WeakPolarHBondContact CA-O 3.43Å; I46-G194 WeakPolarHBondContact CG1-O 3.39Å; I46-G194 PolarHBondContact N-O 3.3Å; G190-G194 PolarHBondContact O-N 3.49Å; Q191-G194 PolarHBondContact O-N 3.4Å; T192-G194 PolarHBondContact O-N 2.95Å; G194-I197 PolarHBondContact O-N 3.21Å; G194-G198 PolarHBondContact O-N 3.24Å
195	H	95	Very high	91.6	Very high	59 Å²	59	34.6 Å²	34.6	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-61.6	-45.9	176.2	-179.8	99.9	0	0	0	111.2	G45 G49 S52 Q191 T192 L193 I197 G198 F199	G45-H195 VanDerWaalsContact O-CA 3.32Å; G45-H195 WeakPolarHBondContact O-CA 3.35Å; G45-H195 PolarHBondContact O-N 3.17Å; G49-H195 WeakPolarHBondContact CA-O 3.4Å; S52-H195 PolarHBondContact OG-CE1 3.47Å; Q191-H195 WeakPolarHBondContact O-CB 3.32Å; Q191-H195 PolarHBondContact O-N 3Å; T192-H195 PolarHBondContact O-N 3.21Å; L193-H195 PolarHBondContact O-N 3.44Å; H195-I197 VanDerWaalsContact C-N 3.33Å; H195-I197 PolarHBondContact O-N 2.85Å; H195-G198 PolarHBondContact O-N 2.94Å; H195-F199 AromaticContact NE2-CD1 3.86Å; H195-F199 VanDerWaalsContact O-CB 3.24Å; H195-F199 WeakPolarHBondContact O-CB 3.37Å; H195-F199 PolarHBondContact O-N 3.48Å
196	L	94.3	Very high	92.3	Very high	38 Å²	38	31.9 Å²	31.9	20%	0.199	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-41.8	175.8	-69	173.6	0	0	0	112	T192 L193 V200 V201 L407	T192-L196 HydrophobicContact CG2-CD1 4.33Å; T192-L196 VanDerWaalsContact O-CG 3.32Å; T192-L196 WeakPolarHBondContact O-CG 3.3Å; T192-L196 PolarHBondContact O-N 2.92Å; L193-L196 PolarHBondContact O-N 3.36Å; L196-V200 HydrophobicContact CB-CG2 4.46Å; L196-V200 HydrophobicContact CD2-CG2 3.65Å; L196-V200 WeakPolarHBondContact O-CA 3.38Å; L196-V200 WeakPolarHBondContact O-CB 3.47Å; L196-V200 PolarHBondContact O-N 2.81Å; L196-V201 PolarHBondContact O-N 3.26Å; L196-L407 HydrophobicContact CD1-CD1 3.53Å; L196-L407 HydrophobicContact CD1-CD2 4.2Å; L196-L407 HydrophobicContact CD2-CD1 3.69Å; L196-L407 HydrophobicContact CD2-CD2 4.08Å; L196-L407 HydrophobicContact CD2-CG 4.45Å; L196-L407 HydrophobicContact CG-CD1 4.27Å
197	I	96.4	Very high	92.8	Very high	39 Å²	39	31.9 Å²	31.9	20%	0.2	18%	0.178	C	C	.	.	I	π-helix	trans	-63.7	-48.6	175.1	-69.8	166	0	0	0	110.5	I42 I46 L193 G194 H195 F199 V201 F231 W235	I42-I197 HydrophobicContact CG2-CD1 4.11Å; I46-I197 HydrophobicContact CD1-CG2 4.29Å; I46-I197 HydrophobicContact CG1-CB 4.33Å; I46-I197 HydrophobicContact CG1-CG2 4.13Å; L193-I197 HydrophobicContact CD1-CD1 4.3Å; L193-I197 HydrophobicContact CG-CD1 4.05Å; L193-I197 VanDerWaalsContact O-CG1 3.26Å; L193-I197 WeakPolarHBondContact O-CG1 3.36Å; L193-I197 PolarHBondContact O-N 3.45Å; G194-I197 PolarHBondContact O-N 3.21Å; H195-I197 VanDerWaalsContact C-N 3.33Å; H195-I197 PolarHBondContact O-N 2.85Å; I197-F199 VanDerWaalsContact C-N 3.3Å; I197-F199 PolarHBondContact O-N 3.17Å; I197-V201 WeakPolarHBondContact O-CB 3.34Å; I197-F231 WeakPolarHBondContact O-CZ 3.27Å; I197-W235 HydrophobicContact CG2-CH2 4.04Å; I197-W235 HydrophobicContact CG2-CZ2 3.29Å
198	G	96.9	Very high	93.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	I	π-helix	trans	-66.5	-29	-178.7	0	0	0	0	0	114	G49 L50 G194 H195 L202	G49-G198 VanDerWaalsContact C-C 3.49Å; G49-G198 CarbonylContact C-O 3.6Å; L50-G198 PolarHBondContact N-O 3.04Å; G194-G198 PolarHBondContact O-N 3.24Å; H195-G198 PolarHBondContact O-N 2.94Å; G198-L202 WeakPolarHBondContact O-CB 3.28Å
199	F	96.2	Very high	93.4	Very high	26 Å²	26	30.5 Å²	30.5	11%	0.114	17%	0.169	C	C	.	.	I	π-helix	trans	-103.7	-64.9	-176.7	-179.6	-147.6	0	0	0	112.7	G49 A53 Y56 H195 I197 M203 V400	G49-F199 WeakPolarHBondContact O-CB 3.48Å; A53-F199 HydrophobicContact CB-CD2 3.75Å; A53-F199 HydrophobicContact CB-CE2 4.34Å; Y56-F199 HydrophobicContact CD1-CE2 4.25Å; Y56-F199 AromaticContact CD1-CZ 3.97Å; Y56-F199 HydrophobicContact CD1-CZ 3.97Å; Y56-F199 HydrophobicContact CD2-CE2 4.08Å; Y56-F199 AromaticContact CD2-CZ 3.91Å; Y56-F199 HydrophobicContact CD2-CZ 3.91Å; Y56-F199 AromaticContact CE1-CZ 3.9Å; Y56-F199 HydrophobicContact CE1-CZ 3.9Å; Y56-F199 HydrophobicContact CE2-CE2 4.48Å; Y56-F199 AromaticContact CE2-CZ 3.86Å; Y56-F199 HydrophobicContact CE2-CZ 3.86Å; Y56-F199 AromaticContact CG-CE2 3.99Å; Y56-F199 HydrophobicContact CG-CE2 3.99Å; Y56-F199 AromaticContact CG-CZ 4Å; Y56-F199 HydrophobicContact CG-CZ 4Å; Y56-F199 AromaticContact CZ-CZ 3.86Å; H195-F199 AromaticContact NE2-CD1 3.86Å; H195-F199 VanDerWaalsContact O-CB 3.24Å; H195-F199 WeakPolarHBondContact O-CB 3.37Å; H195-F199 PolarHBondContact O-N 3.48Å; I197-F199 VanDerWaalsContact C-N 3.3Å; I197-F199 PolarHBondContact O-N 3.17Å; F199-M203 HydrophobicContact CD2-CG 3.87Å; F199-M203 HydrophobicContact CE2-CG 3.82Å; F199-M203 HydrophobicContact CE2-SD 4.49Å; F199-M203 WeakPolarHBondContact O-CB 3.1Å; F199-M203 WeakPolarHBondContact O-CG 3.42Å; F199-M203 PolarHBondContact O-N 3.03Å; F199-V400 HydrophobicContact CE1-CG2 4.26Å; F199-V400 HydrophobicContact CE2-CG2 3.9Å; F199-V400 HydrophobicContact CZ-CG2 3.61Å
200	V	94.5	Very high	93.5	Very high	21 Å²	21	28 Å²	28	13%	0.127	15%	0.153	C	C	.	.	I	π-helix	trans	-66.2	-52.4	-172.6	177.2	0	0	0	0	111.3	L196 L202 M203 C204 V400 V404	L196-V200 HydrophobicContact CB-CG2 4.46Å; L196-V200 HydrophobicContact CD2-CG2 3.65Å; L196-V200 WeakPolarHBondContact O-CA 3.38Å; L196-V200 WeakPolarHBondContact O-CB 3.47Å; L196-V200 PolarHBondContact O-N 2.81Å; V200-L202 VanDerWaalsContact C-N 3.28Å; V200-L202 PolarHBondContact O-N 3.09Å; V200-M203 PolarHBondContact O-N 3.06Å; V200-C204 PolarHBondContact O-N 3.32Å; V200-C204 PolarHBondContact O-SG 3.29Å; V200-C204 VanDerWaalsContact O-SG 3.39Å; V200-V400 HydrophobicContact CB-CG1 4.01Å; V200-V400 HydrophobicContact CG1-CG1 3.95Å; V200-V400 HydrophobicContact CG2-CG1 3.83Å; V200-V404 HydrophobicContact CB-CG2 4.13Å; V200-V404 HydrophobicContact CG1-CG2 3.27Å; V200-V404 HydrophobicContact CG2-CG2 3.74Å
201	V	94.9	Very high	93.4	Very high	58 Å²	58	28 Å²	28	35%	0.352	15%	0.153	S	C	.	.	I	π-helix	trans	-62.9	-41.4	-177.2	178.3	0	0	0	0	109.6	L196 I197 C204 L205 F231	L196-V201 PolarHBondContact O-N 3.26Å; I197-V201 WeakPolarHBondContact O-CB 3.34Å; V201-C204 PolarHBondContact O-N 3.11Å; V201-L205 HydrophobicContact CG1-CD1 3.58Å; V201-L205 HydrophobicContact CG1-CG 3.92Å; V201-L205 WeakPolarHBondContact O-CB 3.39Å; V201-L205 WeakPolarHBondContact O-CG 3.39Å; V201-L205 PolarHBondContact O-N 3.42Å; V201-F231 HydrophobicContact CG1-CE2 4.26Å
202	L	96	Very high	93.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.3	-52.3	172.5	171	61	0	0	0	112	L50 A53 G198 V200 C204 L205 E206 F228 F231	L50-L202 HydrophobicContact CD2-CD2 3.78Å; A53-L202 HydrophobicContact CB-CD2 3.68Å; G198-L202 WeakPolarHBondContact O-CB 3.28Å; V200-L202 VanDerWaalsContact C-N 3.28Å; V200-L202 PolarHBondContact O-N 3.09Å; L202-C204 VanDerWaalsContact C-N 3.32Å; L202-C204 PolarHBondContact O-N 2.89Å; L202-L205 PolarHBondContact O-N 2.55Å; L202-E206 HydrophobicContact CD1-CB 4.2Å; L202-E206 WeakPolarHBondContact O-CB 3.42Å; L202-E206 PolarHBondContact O-N 3.1Å; L202-F228 HydrophobicContact CD1-CD2 3.79Å; L202-F228 HydrophobicContact CD2-CD2 3.56Å; L202-F228 HydrophobicContact CD2-CE2 3.47Å; L202-F228 VanDerWaalsContact CD2-CE2 3.47Å; L202-F228 HydrophobicContact CG-CD2 4.3Å; L202-F231 HydrophobicContact CB-CD1 4.13Å; L202-F231 HydrophobicContact CB-CE1 3.91Å; L202-F231 HydrophobicContact CB-CE2 4.38Å; L202-F231 HydrophobicContact CB-CG 4.44Å; L202-F231 HydrophobicContact CB-CZ 4.04Å; L202-F231 HydrophobicContact CD1-CB 3.83Å; L202-F231 HydrophobicContact CD1-CD1 3.92Å; L202-F231 HydrophobicContact CD1-CD2 4.33Å; L202-F231 HydrophobicContact CD1-CG 3.78Å; L202-F231 HydrophobicContact CD2-CD1 4.47Å; L202-F231 HydrophobicContact CG-CD1 4.38Å
203	M	93.9	Very high	93.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-38.1	-177.6	-68.5	-69.6	92.3	0	0	112.6	A53 F199 V200 S207 R396 V400	A53-M203 HydrophobicContact CB-CE 3.9Å; A53-M203 HydrophobicContact CB-SD 4.5Å; F199-M203 HydrophobicContact CD2-CG 3.87Å; F199-M203 HydrophobicContact CE2-CG 3.82Å; F199-M203 HydrophobicContact CE2-SD 4.49Å; F199-M203 WeakPolarHBondContact O-CB 3.1Å; F199-M203 WeakPolarHBondContact O-CG 3.42Å; F199-M203 PolarHBondContact O-N 3.03Å; V200-M203 PolarHBondContact O-N 3.06Å; M203-S207 VanDerWaalsContact O-CB 3.27Å; M203-S207 WeakPolarHBondContact O-CB 3.26Å; M203-S207 PolarHBondContact O-N 2.92Å; M203-R396 HydrophobicContact SD-CG 4.43Å; M203-V400 HydrophobicContact CB-CB 4.48Å; M203-V400 HydrophobicContact CB-CG1 4.22Å; M203-V400 HydrophobicContact CB-CG2 4.25Å; M203-V400 HydrophobicContact CG-CG2 4.09Å
204	C	92.8	Very high	93	Very high	23 Å²	23	34.2 Å²	34.2	16%	0.155	17%	0.169	C	C	.	.	H	α-helix	trans	-69.5	-43.7	176.5	-69.7	0	0	0	0	112.5	V200 V201 L202 I210	V200-C204 PolarHBondContact O-N 3.32Å; V200-C204 PolarHBondContact O-SG 3.29Å; V200-C204 VanDerWaalsContact O-SG 3.39Å; V201-C204 PolarHBondContact O-N 3.11Å; L202-C204 VanDerWaalsContact C-N 3.32Å; L202-C204 PolarHBondContact O-N 2.89Å; C204-I210 HydrophobicContact CB-CG2 4.34Å
205	L	93.9	Very high	92.6	Very high	39 Å²	39	38.1 Å²	38.1	20%	0.204	19%	0.189	C	C	.	.	H	α-helix	trans	-79.3	-26.4	-176.4	-62.3	-173.8	0	0	0	113.2	V201 L202 S211 I215 L225 I226	V201-L205 HydrophobicContact CG1-CD1 3.58Å; V201-L205 HydrophobicContact CG1-CG 3.92Å; V201-L205 WeakPolarHBondContact O-CB 3.39Å; V201-L205 WeakPolarHBondContact O-CG 3.39Å; V201-L205 PolarHBondContact O-N 3.42Å; L202-L205 PolarHBondContact O-N 2.55Å; L205-S211 PolarHBondContact O-OG 2.86Å; L205-I215 HydrophobicContact CD2-CD1 3.85Å; L205-L225 HydrophobicContact CD2-CB 4.45Å; L205-L225 HydrophobicContact CD2-CD2 3.78Å; L205-L225 PolarHBondContact O-N 3.28Å; L205-I226 HydrophobicContact CB-CG2 3.54Å; L205-I226 HydrophobicContact CD1-CG2 4.21Å; L205-I226 PolarHBondContact O-N 3.13Å; L205-I226 VanDerWaalsContact O-N 3.15Å
206	E	94.2	Very high	92.3	Very high	3 Å²	3	37.9 Å²	37.9	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-80.3	-25.5	175.7	-168.5	-94.1	-178.1	0	0	112.2	R129 L202 P208 I226 R396	R129-E206 IonicContact NH2-OE1 2.99Å; R129-E206 PolarHBondContact NH2-OE1 3.4Å; L202-E206 HydrophobicContact CD1-CB 4.2Å; L202-E206 WeakPolarHBondContact O-CB 3.42Å; L202-E206 PolarHBondContact O-N 3.1Å; E206-P208 VanDerWaalsContact O-CD 3.29Å; E206-P208 WeakPolarHBondContact O-CD 3.41Å; E206-I226 WeakPolarHBondContact CA-O 3.49Å; E206-R396 IonicContact OE1-NH2 3.91Å; E206-R396 IonicContact OE2-CZ 3.55Å; E206-R396 IonicContact OE2-NE 3.7Å; E206-R396 IonicContact OE2-NH2 2.65Å; E206-R396 PolarHBondContact OE2-NH2 3.06Å
207	S	92.4	Very high	92.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.007	22%	0.22	C	C	.	.			trans	-66.7	121.3	176.6	163.4	0	0	0	0	112.4	M203 D209 I210 S211	M203-S207 VanDerWaalsContact O-CB 3.27Å; M203-S207 WeakPolarHBondContact O-CB 3.26Å; M203-S207 PolarHBondContact O-N 2.92Å; S207-D209 PolarHBondContact O-N 3.33Å; S207-D209 PolarHBondContact OG-N 3.37Å; S207-I210 PolarHBondContact OG-N 2.91Å; S207-I210 VanDerWaalsContact OG-N 3.16Å; S207-S211 VanDerWaalsContact O-CB 3.32Å; S207-S211 WeakPolarHBondContact O-CB 3.38Å; S207-S211 PolarHBondContact O-N 3.05Å; S207-S211 VanDerWaalsContact O-N 3.13Å; S207-S211 PolarHBondContact O-OG 3.26Å
208	P	90.9	Very high	91.9	Very high	36 Å²	36	47.9 Å²	47.9	23%	0.234	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-37.7	170.2	-23	35	0	0	0	113.4	E206 N212 G222	E206-P208 VanDerWaalsContact O-CD 3.29Å; E206-P208 WeakPolarHBondContact O-CD 3.41Å; P208-N212 VanDerWaalsContact O-CB 3.27Å; P208-N212 WeakPolarHBondContact O-CB 3.35Å; P208-N212 PolarHBondContact O-N 3Å; P208-N212 PolarHBondContact O-ND2 3.48Å; P208-G222 VanDerWaalsContact CG-O 3.31Å; P208-G222 WeakPolarHBondContact CG-O 3.42Å
209	D	87	Confident	91.5	Very high	47 Å²	47	52.5 Å²	52.5	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-60.9	-57	-179.2	-175.1	69.5	0	0	0	110.9	S207 S211 N212 K213	S207-D209 PolarHBondContact O-N 3.33Å; S207-D209 PolarHBondContact OG-N 3.37Å; D209-S211 PolarHBondContact O-N 3.45Å; D209-N212 PolarHBondContact O-N 3.22Å; D209-K213 WeakPolarHBondContact O-CB 3.49Å; D209-K213 PolarHBondContact O-N 2.7Å
210	I	89.2	Confident	91.2	Very high	24 Å²	24	54 Å²	54	12%	0.123	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-47	178.7	-60.8	-63.3	0	0	0	112.2	C204 S207 N212 K213 Y214 I215 E397	C204-I210 HydrophobicContact CB-CG2 4.34Å; S207-I210 PolarHBondContact OG-N 2.91Å; S207-I210 VanDerWaalsContact OG-N 3.16Å; I210-N212 PolarHBondContact O-N 2.63Å; I210-K213 PolarHBondContact O-N 3.44Å; I210-Y214 HydrophobicContact CD1-CD2 3.89Å; I210-Y214 HydrophobicContact CD1-CE2 3.82Å; I210-Y214 HydrophobicContact CG2-CD2 4.3Å; I210-Y214 PolarHBondContact O-N 3.06Å; I210-I215 HydrophobicContact CG2-CD1 4.35Å; I210-E397 HydrophobicContact CD1-CG 4.29Å; I210-E397 HydrophobicContact CG1-CB 4.07Å; I210-E397 HydrophobicContact CG1-CG 3.75Å
211	S	89.8	Confident	90.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.314	C	S	.	.	I	π-helix	trans	-62.2	-44.4	-176.7	-62	0	0	0	0	111.7	L205 S207 D209 I215 R216 L225	L205-S211 PolarHBondContact O-OG 2.86Å; S207-S211 VanDerWaalsContact O-CB 3.32Å; S207-S211 WeakPolarHBondContact O-CB 3.38Å; S207-S211 PolarHBondContact O-N 3.05Å; S207-S211 VanDerWaalsContact O-N 3.13Å; S207-S211 PolarHBondContact O-OG 3.26Å; D209-S211 PolarHBondContact O-N 3.45Å; S211-I215 WeakPolarHBondContact O-CB 3.38Å; S211-I215 PolarHBondContact O-N 3.09Å; S211-R216 WeakPolarHBondContact O-CB 3.49Å; S211-R216 PolarHBondContact O-N 3.09Å; S211-L225 PolarHBondContact OG-N 3.22Å
212	N	90.7	Very high	90.3	Very high	26 Å²	26	60.2 Å²	60.2	14%	0.139	32%	0.321	C	S	.	.	I	π-helix	trans	-81.1	-26	-177.1	-69.9	-50.5	0	0	0	114	P208 D209 I210 R216 P219 V220 E223	P208-N212 VanDerWaalsContact O-CB 3.27Å; P208-N212 WeakPolarHBondContact O-CB 3.35Å; P208-N212 PolarHBondContact O-N 3Å; P208-N212 PolarHBondContact O-ND2 3.48Å; D209-N212 PolarHBondContact O-N 3.22Å; I210-N212 PolarHBondContact O-N 2.63Å; N212-R216 WeakPolarHBondContact OD1-CD 3.3Å; N212-R216 PolarHBondContact OD1-NH1 3.07Å; N212-P219 HydrophobicContact CB-CB 4.06Å; N212-P219 WeakPolarHBondContact OD1-CA 3.1Å; N212-V220 VanDerWaalsContact CG-O 3.28Å; N212-V220 PolarHBondContact ND2-O 3.33Å; N212-V220 PolarHBondContact OD1-N 3.3Å; N212-V220 PolarHBondContact OD1-O 3Å; N212-V220 VanDerWaalsContact OD1-O 3.1Å; N212-E223 PolarHBondContact ND2-O 3.16Å; N212-E223 VanDerWaalsContact ND2-O 3.15Å
213	K	88	Confident	90.1	Very high	129 Å²	129	63.9 Å²	63.9	56%	0.561	34%	0.337	S	S	*	.	I	π-helix	trans	-89.6	-35.1	-177.8	-171.9	171.4	-178.8	177.8	0	114	D209 I210	D209-K213 WeakPolarHBondContact O-CB 3.49Å; D209-K213 PolarHBondContact O-N 2.7Å; I210-K213 PolarHBondContact O-N 3.44Å
214	Y	89	Confident	90.1	Very high	148 Å²	148	63.8 Å²	63.8	58%	0.58	34%	0.337	S	S	*	.	I	π-helix	trans	-119.7	-21	-170.3	-58.3	-71.9	0	0	0	114.4	I210	I210-Y214 HydrophobicContact CD1-CD2 3.89Å; I210-Y214 HydrophobicContact CD1-CE2 3.82Å; I210-Y214 HydrophobicContact CG2-CD2 4.3Å; I210-Y214 PolarHBondContact O-N 3.06Å
215	I	89.1	Confident	90.1	Very high	81 Å²	81	66.7 Å²	66.7	42%	0.415	35%	0.351	S	S	.	.	I	π-helix	trans	-110.3	-51.1	-172.5	-54.1	179.4	0	0	0	111.7	L205 I210 S211 L225	L205-I215 HydrophobicContact CD2-CD1 3.85Å; I210-I215 HydrophobicContact CG2-CD1 4.35Å; S211-I215 WeakPolarHBondContact O-CB 3.38Å; S211-I215 PolarHBondContact O-N 3.09Å; I215-L225 HydrophobicContact CG2-CD2 4.36Å
216	R	88.9	Confident	90.2	Very high	55 Å²	55	66.8 Å²	66.8	21%	0.208	35%	0.351	C	S	.	.			trans	-78.7	136.8	-178.1	-73.9	-177.5	174.7	141.5	-2.7	111.1	S211 N212 E223 G224	S211-R216 WeakPolarHBondContact O-CB 3.49Å; S211-R216 PolarHBondContact O-N 3.09Å; N212-R216 WeakPolarHBondContact OD1-CD 3.3Å; N212-R216 PolarHBondContact OD1-NH1 3.07Å; R216-E223 PolarHBondContact NH1-O 2.98Å; R216-G224 PolarHBondContact NH2-O 3.09Å
217	L	90.5	Very high	90.3	Very high	176 Å²	176	67.6 Å²	67.6	92%	0.921	36%	0.356	S	S	*	.	S	Bend	trans	-72.5	-38.2	168	-66.7	169.5	0	0	0	111.4
218	T	90.3	Very high	90.5	Very high	111 Å²	111	67.7 Å²	67.7	68%	0.681	36%	0.357	S	S	*	.	S	Bend	trans	-114.9	108.4	176	51.9	0	0	0	0	109.3
219	P	88.8	Confident	90.8	Very high	96 Å²	96	66.8 Å²	66.8	62%	0.623	35%	0.351	S	S	*	.			trans	-57.4	139.3	177.8	-27.8	36.8	0	0	0	112.6	N212	N212-P219 HydrophobicContact CB-CB 4.06Å; N212-P219 WeakPolarHBondContact OD1-CA 3.1Å
220	V	89.7	Confident	91.3	Very high	58 Å²	58	65.6 Å²	65.6	35%	0.352	35%	0.35	S	S	.	.			trans	-116.8	113.8	167.2	-175.8	0	0	0	0	107.2	N212 E223	N212-V220 VanDerWaalsContact CG-O 3.28Å; N212-V220 PolarHBondContact ND2-O 3.33Å; N212-V220 PolarHBondContact OD1-N 3.3Å; N212-V220 PolarHBondContact OD1-O 3Å; N212-V220 VanDerWaalsContact OD1-O 3.1Å; V220-E223 HydrophobicContact CG1-CB 4.22Å; V220-E223 HydrophobicContact CG1-CG 4.14Å; V220-E223 PolarHBondContact O-N 3.46Å
221	E	86	Confident	91.7	Very high	162 Å²	162	64.8 Å²	64.8	76%	0.757	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	137.2	-172.6	-168.5	174.7	-179	0	0	111.9	E223	E221-E223 PolarHBondContact O-N 3Å; E221-E223 VanDerWaalsContact O-N 3.09Å
222	G	86.2	Confident	92.1	Very high	48 Å²	48	64.8 Å²	64.8	50%	0.495	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-9.5	176.2	0	0	0	0	0	116.4	P208	P208-G222 VanDerWaalsContact CG-O 3.31Å; P208-G222 WeakPolarHBondContact CG-O 3.42Å
223	E	91.6	Very high	92.5	Very high	76 Å²	76	70 Å²	70	36%	0.355	36%	0.364	S	S	.	.			trans	-109.2	133.8	-174.7	-61.6	-171.2	174.3	0	0	113.2	W135 N212 R216 V220 E221	W135-E223 HydrophobicContact CD2-CB 4.18Å; W135-E223 HydrophobicContact CD2-CG 4.32Å; W135-E223 HydrophobicContact CE3-CB 4.04Å; W135-E223 HydrophobicContact CE3-CG 3.72Å; W135-E223 HydrophobicContact CH2-CB 4.34Å; W135-E223 HydrophobicContact CH2-CG 4.46Å; W135-E223 HydrophobicContact CZ2-CB 4.48Å; W135-E223 HydrophobicContact CZ3-CB 4.13Å; W135-E223 HydrophobicContact CZ3-CG 3.81Å; N212-E223 PolarHBondContact ND2-O 3.16Å; N212-E223 VanDerWaalsContact ND2-O 3.15Å; R216-E223 PolarHBondContact NH1-O 2.98Å; V220-E223 HydrophobicContact CG1-CB 4.22Å; V220-E223 HydrophobicContact CG1-CG 4.14Å; V220-E223 PolarHBondContact O-N 3.46Å; E221-E223 PolarHBondContact O-N 3Å; E221-E223 VanDerWaalsContact O-N 3.09Å
224	G	92.7	Very high	93	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.359	C	S	.	.			trans	-75.5	178.8	163.5	0	0	0	0	0	112.4	W135 R216	W135-G224 VanDerWaalsContact CZ2-O 3.32Å; W135-G224 WeakPolarHBondContact CZ2-O 3.47Å; W135-G224 VanDerWaalsContact NE1-N 3.17Å; R216-G224 PolarHBondContact NH2-O 3.09Å
225	L	93.7	Very high	93.4	Very high	84 Å²	84	63.3 Å²	63.3	44%	0.44	34%	0.337	S	S	.	.	S	Bend	trans	-72.5	-38.4	175.7	-168.9	71	0	0	0	112	L205 S211 I215	L205-L225 HydrophobicContact CD2-CB 4.45Å; L205-L225 HydrophobicContact CD2-CD2 3.78Å; L205-L225 PolarHBondContact O-N 3.28Å; S211-L225 PolarHBondContact OG-N 3.22Å; I215-L225 HydrophobicContact CG2-CD2 4.36Å
226	I	95.5	Very high	93.9	Very high	42 Å²	42	59.4 Å²	59.4	22%	0.215	32%	0.317	C	S	.	.	S	Bend	trans	-137.8	138.2	178.6	-162	169.2	0	0	0	110	L205 E206 F231	L205-I226 HydrophobicContact CB-CG2 3.54Å; L205-I226 HydrophobicContact CD1-CG2 4.21Å; L205-I226 PolarHBondContact O-N 3.13Å; L205-I226 VanDerWaalsContact O-N 3.15Å; E206-I226 WeakPolarHBondContact CA-O 3.49Å; I226-F231 HydrophobicContact CD1-CB 4.1Å; I226-F231 HydrophobicContact CD1-CD2 4.32Å; I226-F231 HydrophobicContact CG1-CB 4.4Å; I226-F231 HydrophobicContact CG2-CB 4.25Å; I226-F231 HydrophobicContact CG2-CD2 4.1Å
227	T	96.2	Very high	94.3	Very high	20 Å²	20	59.8 Å²	59.8	12%	0.123	32%	0.323	C	S	.	.			trans	-72.4	156.9	172.6	57.5	0	0	0	0	110.2	P134 W135 S229 G230 F231	P134-T227 HydrophobicContact CB-CG2 3.61Å; P134-T227 HydrophobicContact CG-CG2 3.51Å; W135-T227 HydrophobicContact CD2-CG2 3.8Å; W135-T227 VanDerWaalsContact CE2-CG2 3.41Å; W135-T227 HydrophobicContact CE3-CG2 4Å; W135-T227 HydrophobicContact CH2-CG2 3.55Å; W135-T227 HydrophobicContact CZ2-CG2 3.3Å; W135-T227 HydrophobicContact CZ3-CG2 3.88Å; T227-S229 VanDerWaalsContact C-N 3.27Å; T227-S229 PolarHBondContact O-N 3.36Å; T227-S229 PolarHBondContact OG1-OG 3.21Å; T227-S229 VanDerWaalsContact OG1-OG 3.05Å; T227-G230 PolarHBondContact O-N 3.11Å; T227-G230 PolarHBondContact OG1-N 3.06Å; T227-F231 PolarHBondContact O-N 2.86Å
228	F	96.4	Very high	94.7	Very high	3 Å²	3	53.1 Å²	53.1	1%	0.013	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-43.1	173.6	-177.4	-145.4	0	0	0	112.2	L50 V54 L57 V123 L127 F153 L202 G230 F231 L232	L50-F228 HydrophobicContact CD2-CE2 4.2Å; V54-F228 HydrophobicContact CG2-CE1 4.39Å; V54-F228 HydrophobicContact CG2-CZ 3.95Å; L57-F228 HydrophobicContact CD2-CD1 3.95Å; L57-F228 HydrophobicContact CD2-CE1 4.25Å; L57-F228 HydrophobicContact CD2-CG 4.47Å; V123-F228 HydrophobicContact CG1-CD1 4.39Å; V123-F228 HydrophobicContact CG2-CD1 3.58Å; V123-F228 HydrophobicContact CG2-CE1 3.43Å; V123-F228 VanDerWaalsContact CG2-CE1 3.43Å; V123-F228 HydrophobicContact CG2-CZ 4.46Å; L127-F228 HydrophobicContact CD1-CD1 3.93Å; L127-F228 HydrophobicContact CD1-CE1 4.34Å; F153-F228 AromaticContact CZ-CZ 3.92Å; F153-F228 HydrophobicContact CZ-CZ 3.92Å; L202-F228 HydrophobicContact CD1-CD2 3.79Å; L202-F228 HydrophobicContact CD2-CD2 3.56Å; L202-F228 HydrophobicContact CD2-CE2 3.47Å; L202-F228 VanDerWaalsContact CD2-CE2 3.47Å; L202-F228 HydrophobicContact CG-CD2 4.3Å; F228-G230 PolarHBondContact O-N 3.44Å; F228-F231 PolarHBondContact O-N 3.05Å; F228-L232 HydrophobicContact CD1-CD1 4.38Å; F228-L232 HydrophobicContact CD2-CD1 4.08Å; F228-L232 HydrophobicContact CD2-CG 4.28Å; F228-L232 HydrophobicContact CE1-CD1 4.25Å; F228-L232 HydrophobicContact CE2-CD1 3.93Å; F228-L232 HydrophobicContact CE2-CD2 4.41Å; F228-L232 HydrophobicContact CE2-CG 4.11Å; F228-L232 HydrophobicContact CG-CD1 4.33Å; F228-L232 HydrophobicContact CZ-CD1 4.04Å; F228-L232 WeakPolarHBondContact O-CG 3.36Å; F228-L232 PolarHBondContact O-N 3.26Å; F228-L232 VanDerWaalsContact O-N 3.08Å
229	S	97.4	Very high	95.1	Very high	16 Å²	16	47.9 Å²	47.9	11%	0.112	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-42.2	172.8	50.1	0	0	0	0	112.7	A120 N124 T227 F231 L232 Y233	A120-S229 WeakPolarHBondContact CB-O 3.35Å; A120-S229 VanDerWaalsContact O-CB 3.29Å; A120-S229 WeakPolarHBondContact O-CB 3.41Å; N124-S229 VanDerWaalsContact ND2-CB 3.35Å; N124-S229 WeakPolarHBondContact ND2-CB 3.44Å; N124-S229 PolarHBondContact ND2-OG 2.99Å; T227-S229 VanDerWaalsContact C-N 3.27Å; T227-S229 PolarHBondContact O-N 3.36Å; T227-S229 PolarHBondContact OG1-OG 3.21Å; T227-S229 VanDerWaalsContact OG1-OG 3.05Å; S229-F231 VanDerWaalsContact C-N 3.34Å; S229-F231 PolarHBondContact O-N 3.37Å; S229-L232 PolarHBondContact O-N 2.98Å; S229-Y233 WeakPolarHBondContact O-CB 3.3Å; S229-Y233 PolarHBondContact O-N 3.24Å
230	G	97.5	Very high	95.6	Very high	22 Å²	22	45.3 Å²	45.3	23%	0.227	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-39.2	178.1	0	0	0	0	0	112.5	T227 F228 Y233 F234	T227-G230 PolarHBondContact O-N 3.11Å; T227-G230 PolarHBondContact OG1-N 3.06Å; F228-G230 PolarHBondContact O-N 3.44Å; G230-Y233 PolarHBondContact O-N 3.44Å; G230-F234 WeakPolarHBondContact O-CB 3.43Å; G230-F234 PolarHBondContact O-N 2.57Å
231	F	98.2	Very high	96	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-42.7	176.8	-168.8	-92.3	0	0	0	112	L50 I197 V201 L202 I226 T227 F228 S229 F234 W235	L50-F231 HydrophobicContact CD2-CD1 3.72Å; L50-F231 HydrophobicContact CD2-CE1 3.73Å; I197-F231 WeakPolarHBondContact O-CZ 3.27Å; V201-F231 HydrophobicContact CG1-CE2 4.26Å; L202-F231 HydrophobicContact CB-CD1 4.13Å; L202-F231 HydrophobicContact CB-CE1 3.91Å; L202-F231 HydrophobicContact CB-CE2 4.38Å; L202-F231 HydrophobicContact CB-CG 4.44Å; L202-F231 HydrophobicContact CB-CZ 4.04Å; L202-F231 HydrophobicContact CD1-CB 3.83Å; L202-F231 HydrophobicContact CD1-CD1 3.92Å; L202-F231 HydrophobicContact CD1-CD2 4.33Å; L202-F231 HydrophobicContact CD1-CG 3.78Å; L202-F231 HydrophobicContact CD2-CD1 4.47Å; L202-F231 HydrophobicContact CG-CD1 4.38Å; I226-F231 HydrophobicContact CD1-CB 4.1Å; I226-F231 HydrophobicContact CD1-CD2 4.32Å; I226-F231 HydrophobicContact CG1-CB 4.4Å; I226-F231 HydrophobicContact CG2-CB 4.25Å; I226-F231 HydrophobicContact CG2-CD2 4.1Å; T227-F231 PolarHBondContact O-N 2.86Å; F228-F231 PolarHBondContact O-N 3.05Å; S229-F231 VanDerWaalsContact C-N 3.34Å; S229-F231 PolarHBondContact O-N 3.37Å; F231-F234 PolarHBondContact O-N 2.86Å; F231-W235 AromaticContact CD1-CD1 3.6Å; F231-W235 AromaticContact CD1-NE1 3.97Å; F231-W235 AromaticContact CE1-CD1 3.28Å; F231-W235 AromaticContact CE1-NE1 3.27Å; F231-W235 VanDerWaalsContact CE1-NE1 3.27Å; F231-W235 AromaticContact CE2-NE1 3.66Å; F231-W235 AromaticContact CZ-CD1 3.64Å; F231-W235 AromaticContact CZ-NE1 3.09Å; F231-W235 VanDerWaalsContact O-CD1 3.32Å; F231-W235 PolarHBondContact O-N 3.42Å; F231-W235 VanDerWaalsContact O-N 3.12Å
232	L	98.5	Very high	96.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-43.8	173.5	-71.9	162.6	0	0	0	111.8	L50 L116 I119 A120 V123 F228 S229 W235 G236	L50-L232 HydrophobicContact CD1-CD2 3.8Å; L50-L232 HydrophobicContact CD2-CD2 4.04Å; L50-L232 HydrophobicContact CG-CD2 4.47Å; L116-L232 HydrophobicContact CD2-CD2 3.67Å; I119-L232 HydrophobicContact CG2-CD1 3.73Å; I119-L232 HydrophobicContact CG2-CD2 4.49Å; A120-L232 HydrophobicContact CB-CB 3.81Å; V123-L232 HydrophobicContact CB-CD1 4.27Å; V123-L232 HydrophobicContact CG1-CD1 3.92Å; V123-L232 HydrophobicContact CG2-CD1 4.33Å; F228-L232 HydrophobicContact CD1-CD1 4.38Å; F228-L232 HydrophobicContact CD2-CD1 4.08Å; F228-L232 HydrophobicContact CD2-CG 4.28Å; F228-L232 HydrophobicContact CE1-CD1 4.25Å; F228-L232 HydrophobicContact CE2-CD1 3.93Å; F228-L232 HydrophobicContact CE2-CD2 4.41Å; F228-L232 HydrophobicContact CE2-CG 4.11Å; F228-L232 HydrophobicContact CG-CD1 4.33Å; F228-L232 HydrophobicContact CZ-CD1 4.04Å; F228-L232 WeakPolarHBondContact O-CG 3.36Å; F228-L232 PolarHBondContact O-N 3.26Å; F228-L232 VanDerWaalsContact O-N 3.08Å; S229-L232 PolarHBondContact O-N 2.98Å; L232-W235 PolarHBondContact O-N 3.43Å; L232-G236 PolarHBondContact O-N 2.85Å
233	Y	98.5	Very high	97	Very high	134 Å²	134	36.6 Å²	36.6	53%	0.525	19%	0.187	S	C	.	.	H	α-helix	trans	-59.6	-49	177	177.9	-91.8	0	0	0	111.3	L117 S229 G230 W235 G236 I237	L117-Y233 HydrophobicContact CD2-CD2 3.56Å; L117-Y233 HydrophobicContact CD2-CE2 3.86Å; L117-Y233 HydrophobicContact CD2-CG 4.21Å; S229-Y233 WeakPolarHBondContact O-CB 3.3Å; S229-Y233 PolarHBondContact O-N 3.24Å; G230-Y233 PolarHBondContact O-N 3.44Å; Y233-W235 PolarHBondContact O-N 3.28Å; Y233-G236 PolarHBondContact O-N 2.88Å; Y233-I237 HydrophobicContact CD1-CG1 4.42Å; Y233-I237 HydrophobicContact CE1-CG1 3.97Å; Y233-I237 PolarHBondContact O-N 2.96Å; Y233-I237 VanDerWaalsContact O-N 3.07Å
234	F	98.4	Very high	97.3	Very high	106 Å²	106	35.9 Å²	35.9	47%	0.465	19%	0.188	S	C	.	.	H	α-helix	trans	-54.6	-52.1	177.8	170	-99.3	0	0	0	111.6	G230 F231 G236 I237 V238	G230-F234 WeakPolarHBondContact O-CB 3.43Å; G230-F234 PolarHBondContact O-N 2.57Å; F231-F234 PolarHBondContact O-N 2.86Å; F234-G236 VanDerWaalsContact C-N 3.34Å; F234-G236 PolarHBondContact O-N 3.45Å; F234-I237 PolarHBondContact O-N 3.48Å; F234-V238 HydrophobicContact CD1-CG2 4.35Å; F234-V238 HydrophobicContact CD2-CG2 4.47Å; F234-V238 HydrophobicContact CE1-CG2 3.89Å; F234-V238 HydrophobicContact CE2-CG2 4.03Å; F234-V238 HydrophobicContact CZ-CG2 3.72Å; F234-V238 WeakPolarHBondContact O-CG2 3.41Å; F234-V238 PolarHBondContact O-N 3.36Å
235	W	98.2	Very high	97.5	Very high	31 Å²	31	40.2 Å²	40.2	12%	0.117	21%	0.21	C	C	.	.	H	α-helix	trans	-65.9	-37	178.7	-77.7	110.1	0	0	0	112.5	L43 I46 L116 I197 F231 L232 Y233 I237 V238 F239	L43-W235 HydrophobicContact CD2-CZ3 4.32Å; I46-W235 HydrophobicContact CD1-CD2 3.86Å; I46-W235 HydrophobicContact CD1-CE3 3.51Å; I46-W235 HydrophobicContact CD1-CH2 3.38Å; I46-W235 HydrophobicContact CD1-CZ2 3.76Å; I46-W235 HydrophobicContact CD1-CZ3 3.23Å; I46-W235 HydrophobicContact CG2-CB 4.47Å; I46-W235 HydrophobicContact CG2-CD2 3.99Å; I46-W235 HydrophobicContact CG2-CE3 4.48Å; I46-W235 HydrophobicContact CG2-CG 3.94Å; L116-W235 HydrophobicContact CD1-CB 4.11Å; I197-W235 HydrophobicContact CG2-CH2 4.04Å; I197-W235 HydrophobicContact CG2-CZ2 3.29Å; F231-W235 AromaticContact CD1-CD1 3.6Å; F231-W235 AromaticContact CD1-NE1 3.97Å; F231-W235 AromaticContact CE1-CD1 3.28Å; F231-W235 AromaticContact CE1-NE1 3.27Å; F231-W235 VanDerWaalsContact CE1-NE1 3.27Å; F231-W235 AromaticContact CE2-NE1 3.66Å; F231-W235 AromaticContact CZ-CD1 3.64Å; F231-W235 AromaticContact CZ-NE1 3.09Å; F231-W235 VanDerWaalsContact O-CD1 3.32Å; F231-W235 PolarHBondContact O-N 3.42Å; F231-W235 VanDerWaalsContact O-N 3.12Å; L232-W235 PolarHBondContact O-N 3.43Å; Y233-W235 PolarHBondContact O-N 3.28Å; W235-I237 VanDerWaalsContact C-N 3.29Å; W235-I237 PolarHBondContact O-N 3.05Å; W235-V238 HydrophobicContact CE3-CB 3.86Å; W235-V238 HydrophobicContact CE3-CG1 3.8Å; W235-V238 HydrophobicContact CE3-CG2 4.3Å; W235-V238 HydrophobicContact CZ3-CB 4.19Å; W235-V238 HydrophobicContact CZ3-CG1 3.66Å; W235-V238 PolarHBondContact O-N 3.13Å; W235-V238 VanDerWaalsContact O-N 3.11Å; W235-F239 VanDerWaalsContact O-CD2 3.28Å; W235-F239 WeakPolarHBondContact O-CD2 3.1Å; W235-F239 PolarHBondContact O-N 2.81Å
236	G	98.5	Very high	97.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-50.2	-50.1	171.7	0	0	0	0	0	112	G113 L232 Y233 F234 F239 L240	G113-G236 WeakPolarHBondContact O-CA 3.46Å; L232-G236 PolarHBondContact O-N 2.85Å; Y233-G236 PolarHBondContact O-N 2.88Å; F234-G236 VanDerWaalsContact C-N 3.34Å; F234-G236 PolarHBondContact O-N 3.45Å; G236-F239 PolarHBondContact O-N 2.88Å; G236-L240 WeakPolarHBondContact O-CG 3.42Å; G236-L240 PolarHBondContact O-N 3.19Å
237	I	98.6	Very high	97.4	Very high	63 Å²	63	35.6 Å²	35.6	32%	0.323	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-45	176.1	-60	-57.5	0	0	0	112.1	L117 Y233 F234 W235 F239 L240 V241	L117-I237 HydrophobicContact CD1-CD1 4.3Å; L117-I237 HydrophobicContact CD2-CD1 4.02Å; L117-I237 HydrophobicContact CD2-CG1 4.27Å; Y233-I237 HydrophobicContact CD1-CG1 4.42Å; Y233-I237 HydrophobicContact CE1-CG1 3.97Å; Y233-I237 PolarHBondContact O-N 2.96Å; Y233-I237 VanDerWaalsContact O-N 3.07Å; F234-I237 PolarHBondContact O-N 3.48Å; W235-I237 VanDerWaalsContact C-N 3.29Å; W235-I237 PolarHBondContact O-N 3.05Å; I237-F239 VanDerWaalsContact C-N 3.28Å; I237-F239 PolarHBondContact O-N 3.03Å; I237-L240 PolarHBondContact O-N 3.06Å; I237-L240 VanDerWaalsContact O-N 3.13Å; I237-V241 HydrophobicContact CG2-CG2 4.21Å; I237-V241 WeakPolarHBondContact O-CG2 3.36Å; I237-V241 PolarHBondContact O-N 3.46Å
238	V	98.2	Very high	97.2	Very high	36 Å²	36	39.5 Å²	39.5	22%	0.218	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-41.5	178.9	172.8	0	0	0	0	111.3	L43 F234 W235 V241 A242	L43-V238 HydrophobicContact CD2-CG1 4.35Å; F234-V238 HydrophobicContact CD1-CG2 4.35Å; F234-V238 HydrophobicContact CD2-CG2 4.47Å; F234-V238 HydrophobicContact CE1-CG2 3.89Å; F234-V238 HydrophobicContact CE2-CG2 4.03Å; F234-V238 HydrophobicContact CZ-CG2 3.72Å; F234-V238 WeakPolarHBondContact O-CG2 3.41Å; F234-V238 PolarHBondContact O-N 3.36Å; W235-V238 HydrophobicContact CE3-CB 3.86Å; W235-V238 HydrophobicContact CE3-CG1 3.8Å; W235-V238 HydrophobicContact CE3-CG2 4.3Å; W235-V238 HydrophobicContact CZ3-CB 4.19Å; W235-V238 HydrophobicContact CZ3-CG1 3.66Å; W235-V238 PolarHBondContact O-N 3.13Å; W235-V238 VanDerWaalsContact O-N 3.11Å; V238-V241 PolarHBondContact O-N 2.93Å; V238-A242 WeakPolarHBondContact O-CB 3.43Å; V238-A242 PolarHBondContact O-N 2.76Å
239	F	98.4	Very high	97	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-46.8	174.7	-92.6	-94	0	0	0	111.9	L43 P47 Q109 L112 L116 W235 G236 I237 V241 A242 T243	L43-F239 HydrophobicContact CB-CE1 3.98Å; L43-F239 HydrophobicContact CB-CZ 4.03Å; L43-F239 HydrophobicContact CD2-CD2 4.32Å; L43-F239 HydrophobicContact CD2-CE2 4.22Å; L43-F239 HydrophobicContact CD2-CZ 4.39Å; L43-F239 WeakPolarHBondContact O-CZ 3.46Å; P47-F239 HydrophobicContact CG-CE2 4.42Å; P47-F239 HydrophobicContact CG-CZ 3.85Å; Q109-F239 HydrophobicContact CB-CD1 4.49Å; L112-F239 HydrophobicContact CB-CD1 3.83Å; L112-F239 HydrophobicContact CB-CE1 3.81Å; L112-F239 HydrophobicContact CB-CZ 4.48Å; L112-F239 HydrophobicContact CD1-CD1 4.45Å; L112-F239 HydrophobicContact CD1-CE1 3.77Å; L112-F239 HydrophobicContact CD1-CZ 4.49Å; L112-F239 HydrophobicContact CG-CE1 4.33Å; L116-F239 HydrophobicContact CD1-CD2 3.62Å; L116-F239 HydrophobicContact CD1-CE2 3.69Å; L116-F239 HydrophobicContact CD1-CG 4.4Å; W235-F239 VanDerWaalsContact O-CD2 3.28Å; W235-F239 WeakPolarHBondContact O-CD2 3.1Å; W235-F239 PolarHBondContact O-N 2.81Å; G236-F239 PolarHBondContact O-N 2.88Å; I237-F239 VanDerWaalsContact C-N 3.28Å; I237-F239 PolarHBondContact O-N 3.03Å; F239-V241 PolarHBondContact O-N 3.16Å; F239-A242 PolarHBondContact O-N 2.85Å; F239-T243 VanDerWaalsContact O-CB 3.29Å; F239-T243 WeakPolarHBondContact O-CB 3.43Å; F239-T243 PolarHBondContact O-N 2.77Å; F239-T243 PolarHBondContact O-OG1 3.49Å
240	L	98.4	Very high	96.6	Very high	43 Å²	43	48 Å²	48	23%	0.225	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-44.4	178.9	-59.9	-179.4	0	0	0	112	Y110 I114 L117 G236 I237 T244	Y110-L240 HydrophobicContact CD1-CD2 3.69Å; Y110-L240 HydrophobicContact CE1-CD2 4.4Å; I114-L240 HydrophobicContact CG1-CD2 4.14Å; L117-L240 HydrophobicContact CD1-CD1 3.81Å; G236-L240 WeakPolarHBondContact O-CG 3.42Å; G236-L240 PolarHBondContact O-N 3.19Å; I237-L240 PolarHBondContact O-N 3.06Å; I237-L240 VanDerWaalsContact O-N 3.13Å; L240-T244 WeakPolarHBondContact O-CB 3.24Å; L240-T244 PolarHBondContact O-N 3.14Å; L240-T244 VanDerWaalsContact O-N 3.1Å; L240-T244 PolarHBondContact O-OG1 2.85Å
241	V	98.3	Very high	96.1	Very high	79 Å²	79	55.5 Å²	55.5	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-51.5	178.4	173.9	0	0	0	0	110.3	I237 V238 F239 T243 T244 L245	I237-V241 HydrophobicContact CG2-CG2 4.21Å; I237-V241 WeakPolarHBondContact O-CG2 3.36Å; I237-V241 PolarHBondContact O-N 3.46Å; V238-V241 PolarHBondContact O-N 2.93Å; F239-V241 PolarHBondContact O-N 3.16Å; V241-T243 VanDerWaalsContact C-N 3.32Å; V241-T243 PolarHBondContact O-N 3.41Å; V241-T244 PolarHBondContact O-N 3.37Å; V241-T244 VanDerWaalsContact O-N 3.15Å; V241-L245 HydrophobicContact CG1-CD1 4.01Å; V241-L245 HydrophobicContact CG1-CG 4.38Å; V241-L245 WeakPolarHBondContact O-CG 3.49Å; V241-L245 PolarHBondContact O-N 3.07Å
242	A	97	Very high	95.2	Very high	6 Å²	6	57.2 Å²	57.2	5%	0.05	29%	0.285	C	S	.	.	H	α-helix	trans	-57	-44.9	179.2	0	0	0	0	0	112	F39 L43 V238 F239 T244 L245 V246	F39-A242 HydrophobicContact CE1-CB 3.84Å; F39-A242 HydrophobicContact CZ-CB 3.89Å; L43-A242 HydrophobicContact CD1-CB 3.8Å; V238-A242 WeakPolarHBondContact O-CB 3.43Å; V238-A242 PolarHBondContact O-N 2.76Å; F239-A242 PolarHBondContact O-N 2.85Å; A242-T244 VanDerWaalsContact C-N 3.33Å; A242-T244 PolarHBondContact O-N 2.81Å; A242-L245 PolarHBondContact O-N 3.1Å; A242-V246 WeakPolarHBondContact O-CG2 3.39Å; A242-V246 PolarHBondContact O-N 3.44Å
243	T	97.2	Very high	93.9	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-44	177.9	-53.5	0	0	0	0	111.3	I106 Q109 Y110 F239 V241 V246 G247	I106-T243 HydrophobicContact CB-CG2 4.38Å; I106-T243 HydrophobicContact CG2-CG2 4Å; I106-T243 WeakPolarHBondContact O-CG2 3.44Å; Q109-T243 HydrophobicContact CB-CG2 3.95Å; Q109-T243 WeakPolarHBondContact CB-OG1 3.3Å; Y110-T243 HydrophobicContact CD1-CG2 4.01Å; Y110-T243 HydrophobicContact CD2-CG2 3.64Å; Y110-T243 HydrophobicContact CE1-CG2 3.97Å; Y110-T243 HydrophobicContact CE2-CG2 3.61Å; Y110-T243 HydrophobicContact CG-CG2 3.84Å; F239-T243 VanDerWaalsContact O-CB 3.29Å; F239-T243 WeakPolarHBondContact O-CB 3.43Å; F239-T243 PolarHBondContact O-N 2.77Å; F239-T243 PolarHBondContact O-OG1 3.49Å; V241-T243 VanDerWaalsContact C-N 3.32Å; V241-T243 PolarHBondContact O-N 3.41Å; T243-V246 PolarHBondContact O-N 3.34Å; T243-G247 PolarHBondContact O-N 3.29Å
244	T	97.1	Very high	92	Very high	61 Å²	61	59.6 Å²	59.6	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-44	178.7	-53	0	0	0	0	111	Y110 L240 V241 A242 G247 V248	Y110-T244 WeakPolarHBondContact OH-CA 3.43Å; Y110-T244 PolarHBondContact OH-OG1 3.07Å; L240-T244 WeakPolarHBondContact O-CB 3.24Å; L240-T244 PolarHBondContact O-N 3.14Å; L240-T244 VanDerWaalsContact O-N 3.1Å; L240-T244 PolarHBondContact O-OG1 2.85Å; V241-T244 PolarHBondContact O-N 3.37Å; V241-T244 VanDerWaalsContact O-N 3.15Å; A242-T244 VanDerWaalsContact C-N 3.33Å; A242-T244 PolarHBondContact O-N 2.81Å; T244-G247 PolarHBondContact O-N 3.46Å; T244-V248 VanDerWaalsContact O-CG2 3.31Å; T244-V248 WeakPolarHBondContact O-CG2 3.3Å; T244-V248 PolarHBondContact O-N 3.4Å
245	L	96.4	Very high	89.6	Confident	90 Å²	90	59.1 Å²	59.1	47%	0.471	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-46.7	176.8	-65.9	174.6	0	0	0	111.8	V241 A242 G247 V248 F249	V241-L245 HydrophobicContact CG1-CD1 4.01Å; V241-L245 HydrophobicContact CG1-CG 4.38Å; V241-L245 WeakPolarHBondContact O-CG 3.49Å; V241-L245 PolarHBondContact O-N 3.07Å; A242-L245 PolarHBondContact O-N 3.1Å; L245-G247 VanDerWaalsContact C-N 3.34Å; L245-G247 PolarHBondContact O-N 3.15Å; L245-V248 PolarHBondContact O-N 3.45Å; L245-F249 HydrophobicContact CB-CD2 4.33Å; L245-F249 HydrophobicContact CD2-CD2 4.07Å; L245-F249 HydrophobicContact CD2-CE2 3.66Å; L245-F249 WeakPolarHBondContact O-CB 3.32Å; L245-F249 VanDerWaalsContact O-CD2 3.29Å; L245-F249 WeakPolarHBondContact O-CD2 3.05Å; L245-F249 PolarHBondContact O-N 3.16Å
246	V	94.3	Very high	86.8	Confident	8 Å²	8	63.4 Å²	63.4	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-63.6	-41.4	177.3	173.8	0	0	0	0	111.1	L36 L40 L105 W170 A242 T243 V248 K250	L36-V246 HydrophobicContact CD1-CG2 3.96Å; L40-V246 HydrophobicContact CD2-CG2 4.32Å; L105-V246 HydrophobicContact CD2-CG1 4.19Å; W170-V246 HydrophobicContact CH2-CG1 3.96Å; W170-V246 HydrophobicContact CZ3-CG1 4.14Å; A242-V246 WeakPolarHBondContact O-CG2 3.39Å; A242-V246 PolarHBondContact O-N 3.44Å; T243-V246 PolarHBondContact O-N 3.34Å; V246-V248 PolarHBondContact O-N 3.4Å; V246-K250 HydrophobicContact CG1-CB 4.39Å; V246-K250 WeakPolarHBondContact O-CB 3.38Å; V246-K250 PolarHBondContact O-N 3.04Å
247	G	93	Very high	83.5	Confident	22 Å²	22	68.2 Å²	68.2	23%	0.227	37%	0.365	C	S	.	.	H	α-helix	trans	-58	-47	177.4	0	0	0	0	0	112.7	K102 T243 T244 L245	K102-G247 PolarHBondContact NZ-O 2.92Å; T243-G247 PolarHBondContact O-N 3.29Å; T244-G247 PolarHBondContact O-N 3.46Å; L245-G247 VanDerWaalsContact C-N 3.34Å; L245-G247 PolarHBondContact O-N 3.15Å
248	V	92.7	Very high	80.5	Confident	101 Å²	101	68.7 Å²	68.7	61%	0.612	37%	0.373	S	S	*	.	H	α-helix	trans	-76.8	-48.6	-177.3	173.4	0	0	0	0	112.5	T244 L245 V246	T244-V248 VanDerWaalsContact O-CG2 3.31Å; T244-V248 WeakPolarHBondContact O-CG2 3.3Å; T244-V248 PolarHBondContact O-N 3.4Å; L245-V248 PolarHBondContact O-N 3.45Å; V246-V248 PolarHBondContact O-N 3.4Å
249	F	91.8	Very high	77.4	Confident	157 Å²	157	70.8 Å²	70.8	69%	0.689	39%	0.386	S	S	*	.	H	α-helix	trans	-92.8	-33.7	-165.8	-67.8	-66.9	0	0	0	114.7	L245	L245-F249 HydrophobicContact CB-CD2 4.33Å; L245-F249 HydrophobicContact CD2-CD2 4.07Å; L245-F249 HydrophobicContact CD2-CE2 3.66Å; L245-F249 WeakPolarHBondContact O-CB 3.32Å; L245-F249 VanDerWaalsContact O-CD2 3.29Å; L245-F249 WeakPolarHBondContact O-CD2 3.05Å; L245-F249 PolarHBondContact O-N 3.16Å
250	K	90.1	Very high	73.9	Confident	42 Å²	42	75.3 Å²	75.3	18%	0.183	41%	0.409	C	S	.	.			trans	-88.2	114.1	-176	179.7	60.8	175.1	179.1	0	110	N33 L36 K102 W170 V246	N33-K250 PolarHBondContact OD1-NZ 3.19Å; L36-K250 HydrophobicContact CD2-CB 4.26Å; L36-K250 HydrophobicContact CD2-CD 3.78Å; L36-K250 HydrophobicContact CD2-CG 3.83Å; K102-K250 WeakPolarHBondContact CE-O 3.41Å; K102-K250 PolarHBondContact NZ-O 3.08Å; W170-K250 HydrophobicContact CH2-CB 4.37Å; W170-K250 HydrophobicContact CH2-CG 3.59Å; W170-K250 HydrophobicContact CZ2-CG 3.57Å; V246-K250 HydrophobicContact CG1-CB 4.39Å; V246-K250 WeakPolarHBondContact O-CB 3.38Å; V246-K250 PolarHBondContact O-N 3.04Å
251	K	85.4	Confident	70.7	Confident	179 Å²	179	78 Å²	78	78%	0.778	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-86.1	148	171.9	-67.1	-177.9	179.9	178.3	0	111.4
252	E	80.2	Confident	67.6	Low	43 Å²	43	77.5 Å²	77.5	20%	0.201	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-92.7	137.1	174.9	-164.4	169.4	163.2	0	0	109.5	G99 R100 R101 K102	G99-E252 VanDerWaalsContact C-OE2 3.26Å; G99-E252 VanDerWaalsContact CA-OE2 3.28Å; G99-E252 WeakPolarHBondContact CA-OE2 3.29Å; R100-E252 PolarHBondContact N-OE1 2.88Å; R100-E252 PolarHBondContact N-OE2 3.49Å; R101-E252 PolarHBondContact N-OE1 3.21Å; R101-E252 PolarHBondContact N-OE2 3.27Å; K102-E252 PolarHBondContact N-OE2 2.87Å; K102-E252 VanDerWaalsContact N-OE2 3.16Å
253	V	70.4	Confident	64.5	Low	100 Å²	100	79.7 Å²	79.7	61%	0.606	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-77.7	125.2	177.6	-178.3	0	0	0	0	108.2	H255	V253-H255 PolarHBondContact O-N 3.04Å
254	P	59.1	Low	61.2	Low	85 Å²	85	87 Å²	87	55%	0.552	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-64.3	129.8	177.9	23.1	-29.8	0	0	0	110.4	N256 L257	P254-N256 PolarHBondContact O-N 2.91Å; P254-L257 HydrophobicContact CG-CB 4.41Å; P254-L257 PolarHBondContact O-N 2.97Å
255	H	48.5	Very low	58.2	Low	95 Å²	95	88.2 Å²	88.2	44%	0.44	50%	0.495	S	S	.	.	H	α-helix	trans	-54.7	-28.8	-176.3	-165.2	-88.2	0	0	0	113.4	V253 L257 S258	V253-H255 PolarHBondContact O-N 3.04Å; H255-L257 VanDerWaalsContact C-N 3.27Å; H255-L257 PolarHBondContact O-N 2.87Å; H255-S258 PolarHBondContact O-OG 2.93Å
256	N	38.3	Very low	55.1	Low	122 Å²	122	89.6 Å²	89.6	65%	0.652	50%	0.502	S	S	*	.	H	α-helix	trans	-67.5	-25.7	-179.6	-64.4	-5.8	0	0	0	113	P254 V259 I260	P254-N256 PolarHBondContact O-N 2.91Å; N256-V259 PolarHBondContact O-N 3.24Å; N256-I260 WeakPolarHBondContact O-CG1 3.31Å; N256-I260 PolarHBondContact O-N 3.43Å
257	L	30.4	Very low	51.9	Low	101 Å²	101	96.4 Å²	96.4	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-77.6	-29	-174.7	-158.1	72.7	0	0	0	112.7	P254 H255 V259 I260 S261	P254-L257 HydrophobicContact CG-CB 4.41Å; P254-L257 PolarHBondContact O-N 2.97Å; H255-L257 VanDerWaalsContact C-N 3.27Å; H255-L257 PolarHBondContact O-N 2.87Å; L257-V259 VanDerWaalsContact C-N 3.29Å; L257-V259 PolarHBondContact O-N 3.19Å; L257-I260 PolarHBondContact O-N 3.27Å; L257-S261 PolarHBondContact O-N 3.23Å
258	S	35.1	Very low	48.7	Very low	72 Å²	72	103.1 Å²	103.1	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-70.5	-27.7	175.4	57.8	0	0	0	0	112.4	H255 S262	H255-S258 PolarHBondContact O-OG 2.93Å; S258-S262 PolarHBondContact O-OG 2.86Å
259	V	32.9	Very low	45.7	Very low	81 Å²	81	105.2 Å²	105.2	49%	0.491	57%	0.571	S	S	.	*	H	α-helix	trans	-74.6	-35.7	174.7	-176.2	0	0	0	0	111.2	N256 L257 S262 A263	N256-V259 PolarHBondContact O-N 3.24Å; L257-V259 VanDerWaalsContact C-N 3.29Å; L257-V259 PolarHBondContact O-N 3.19Å; V259-S262 PolarHBondContact O-N 3.28Å; V259-S262 PolarHBondContact O-OG 3.17Å; V259-A263 PolarHBondContact O-N 3.39Å
260	I	25.9	Very low	42.6	Very low	94 Å²	94	104.6 Å²	104.6	48%	0.482	58%	0.575	S	S	.	*	H	α-helix	trans	-73.3	-34.7	-178.9	-63.1	165.2	0	0	0	111.7	N256 L257 S262 A263 H264	N256-I260 WeakPolarHBondContact O-CG1 3.31Å; N256-I260 PolarHBondContact O-N 3.43Å; L257-I260 PolarHBondContact O-N 3.27Å; I260-S262 VanDerWaalsContact C-N 3.26Å; I260-S262 PolarHBondContact O-N 3.32Å; I260-A263 CarbonylContact O-C 3.59Å; I260-A263 PolarHBondContact O-N 3.26Å; I260-H264 PolarHBondContact O-N 3.18Å
261	S	31.3	Very low	39.6	Very low	99 Å²	99	111.3 Å²	111.3	69%	0.692	61%	0.607	S	S	*	*	H	α-helix	trans	-65.1	-28.4	173.2	-82.8	0	0	0	0	113.3	L257	L257-S261 PolarHBondContact O-N 3.23Å
262	S	32.3	Very low	36.8	Very low	69 Å²	69	107.7 Å²	107.7	48%	0.483	60%	0.604	S	S	.	*	H	α-helix	trans	-79.5	-25	168.1	42.6	0	0	0	0	113.4	S258 V259 I260 S265	S258-S262 PolarHBondContact O-OG 2.86Å; V259-S262 PolarHBondContact O-N 3.28Å; V259-S262 PolarHBondContact O-OG 3.17Å; I260-S262 VanDerWaalsContact C-N 3.26Å; I260-S262 PolarHBondContact O-N 3.32Å; S262-S265 PolarHBondContact O-OG 3.41Å
263	A	31.5	Very low	34.2	Very low	53 Å²	53	113.7 Å²	113.7	44%	0.438	64%	0.638	S	S	.	*	H	α-helix	trans	-79	-23.6	175.5	0	0	0	0	0	112.7	V259 I260 S265 N266	V259-A263 PolarHBondContact O-N 3.39Å; I260-A263 CarbonylContact O-C 3.59Å; I260-A263 PolarHBondContact O-N 3.26Å; A263-S265 PolarHBondContact O-N 2.89Å; A263-N266 PolarHBondContact O-N 3.48Å
264	H	28.1	Very low	31.9	Very low	153 Å²	153	111.9 Å²	111.9	71%	0.708	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-6.1	177.9	-133.1	57.3	0	0	0	113.8	I260 N266	I260-H264 PolarHBondContact O-N 3.18Å; H264-N266 VanDerWaalsContact C-N 3.28Å
265	S	35.1	Very low	30.2	Very low	86 Å²	86	113.1 Å²	113.1	60%	0.601	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-9.6	162.9	62.8	0	0	0	0	113.3	S262 A263	S262-S265 PolarHBondContact O-OG 3.41Å; A263-S265 PolarHBondContact O-N 2.89Å
266	N	30.7	Very low	29	Very low	119 Å²	119	114 Å²	114	64%	0.636	66%	0.662	S	S	*	*	S	Bend	trans	-111.4	13.5	-175.4	-65.2	4.5	0	0	0	113.3	A263 H264	A263-N266 PolarHBondContact O-N 3.48Å; H264-N266 VanDerWaalsContact C-N 3.28Å
267	H	26.2	Very low	28.3	Very low	152 Å²	152	114 Å²	114	70%	0.704	66%	0.66	S	S	*	*			trans	-105.5	30	175	-141.7	-61.8	0	0	0	113.3
268	L	26.9	Very low	27.9	Very low	162 Å²	162	119.3 Å²	119.3	85%	0.848	68%	0.675	S	S	*	*			trans	-108.7	34	163.9	-85.7	163.3	0	0	0	110.9
269	D	28.6	Very low	27.4	Very low	146 Å²	146	122.4 Å²	122.4	78%	0.781	69%	0.685	S	S	*	*			trans	-128.5	66.5	171.7	-73.6	-36.6	0	0	0	109.9
270	D	28.2	Very low	27.1	Very low	144 Å²	144	124.6 Å²	124.6	77%	0.77	69%	0.694	S	S	*	*			trans	-147.6	52.9	149.4	-150.7	11.3	0	0	0	110.5
271	H	27.3	Very low	27.8	Very low	183 Å²	183	126.1 Å²	126.1	85%	0.847	71%	0.71	S	S	*	*	S	Bend	trans	-135.7	95.4	157	-85.1	-61.1	0	0	0	108.6	N273	H271-N273 PolarHBondContact O-N 3.49Å
272	S	26.6	Very low	28.1	Very low	103 Å²	103	127 Å²	127	72%	0.72	71%	0.711	S	S	*	*			trans	-32.8	131.3	161.7	53.3	0	0	0	0	113.1
273	N	24.4	Very low	27.8	Very low	169 Å²	169	126.2 Å²	126.2	90%	0.904	71%	0.714	S	S	*	*			trans	64.7	75.5	164.6	-64.1	-14.6	0	0	0	116.8	H271	H271-N273 PolarHBondContact O-N 3.49Å
274	G	23.2	Very low	27.7	Very low	61 Å²	61	130.9 Å²	130.9	63%	0.629	73%	0.732	S	S	*	*			trans	-142.2	98.7	161.5	0	0	0	0	0	111.2	V276	G274-V276 PolarHBondContact O-N 3.17Å; G274-V276 VanDerWaalsContact O-N 3.16Å
275	S	23.5	Very low	27.6	Very low	112 Å²	112	129 Å²	129	78%	0.783	73%	0.73	S	S	*	*			trans	-62.1	111	171.6	52.5	0	0	0	0	110.2	I277	S275-I277 PolarHBondContact O-N 2.92Å
276	V	23.1	Very low	27.3	Very low	114 Å²	114	133.9 Å²	133.9	69%	0.691	74%	0.744	S	S	*	*			trans	-79.2	112	177.3	179.8	0	0	0	0	109.2	G274 Y278	G274-V276 PolarHBondContact O-N 3.17Å; G274-V276 VanDerWaalsContact O-N 3.16Å; V276-Y278 HydrophobicContact CG1-CE2 4.24Å
277	I	22.6	Very low	27	Very low	122 Å²	122	139.5 Å²	139.5	63%	0.626	76%	0.756	S	S	*	*			trans	-93	116.6	175.2	-62.7	173.1	0	0	0	108	S275 L279	S275-I277 PolarHBondContact O-N 2.92Å; I277-L279 PolarHBondContact O-N 3.12Å
278	Y	23.3	Very low	27	Very low	212 Å²	212	141.7 Å²	141.7	83%	0.831	77%	0.767	S	S	*	*			trans	-77.9	113.1	175.2	-69.2	-91.2	0	0	0	110.1	V276	V276-Y278 HydrophobicContact CG1-CE2 4.24Å
279	L	22.8	Very low	26.8	Very low	136 Å²	136	141.6 Å²	141.6	71%	0.712	77%	0.766	S	S	*	*			trans	-86.9	113.1	174.3	-80	154.9	0	0	0	109.6	I277	I277-L279 PolarHBondContact O-N 3.12Å
280	N	28	Very low	26.4	Very low	127 Å²	127	140.2 Å²	140.2	68%	0.679	77%	0.768	S	S	*	*			trans	-70.7	152.8	165.5	-130.3	-8.8	0	0	0	109.2	T282 G283	N280-T282 PolarHBondContact O-N 3.35Å; N280-G283 PolarHBondContact O-N 3.2Å; N280-G283 VanDerWaalsContact O-N 3.15Å
281	P	40.8	Very low	26.2	Very low	126 Å²	126	138.3 Å²	138.3	82%	0.818	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-4.6	-169	-21.5	31.1	0	0	0	116.2
282	T	36.6	Very low	25.9	Very low	118 Å²	118	135.5 Å²	135.5	72%	0.724	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	52.7	173.6	57.8	0	0	0	0	111.3	N280 N284	N280-T282 PolarHBondContact O-N 3.35Å; T282-N284 PolarHBondContact O-N 2.55Å
283	G	27.4	Very low	25.8	Very low	53 Å²	53	141.8 Å²	141.8	55%	0.546	78%	0.775	S	S	.	*			trans	52.2	5.7	145.5	0	0	0	0	0	121.4	N280	N280-G283 PolarHBondContact O-N 3.2Å; N280-G283 VanDerWaalsContact O-N 3.15Å
284	N	27.8	Very low	25.7	Very low	151 Å²	151	140.4 Å²	140.4	81%	0.807	77%	0.767	S	S	*	*			trans	-115.5	125.8	-174.8	-74.1	-11	0	0	0	111.3	T282 E286	T282-N284 PolarHBondContact O-N 2.55Å; N284-E286 PolarHBondContact O-N 2.9Å
285	V	27.3	Very low	25.5	Very low	112 Å²	112	147.7 Å²	147.7	68%	0.679	78%	0.776	S	S	*	*			trans	-82.6	106.2	-176.7	177.6	0	0	0	0	109.5
286	E	27.4	Very low	25.5	Very low	190 Å²	190	150.1 Å²	150.1	89%	0.888	78%	0.779	S	S	*	*			trans	-94.1	108.3	168.3	-107.6	176.1	165	0	0	110.4	N284 Q288	N284-E286 PolarHBondContact O-N 2.9Å; E286-Q288 PolarHBondContact O-N 3.27Å
287	R	26.3	Very low	25.4	Very low	237 Å²	237	149.4 Å²	149.4	89%	0.894	78%	0.778	S	S	*	*			trans	-65.4	106	172.1	-79.6	178.8	178.3	168.1	-0.5	109.6	L289	R287-L289 PolarHBondContact O-N 3.26Å
288	Q	24.1	Very low	25.3	Very low	197 Å²	197	152.2 Å²	152.2	92%	0.921	79%	0.789	S	S	*	*			trans	-80.1	112.8	167	-78.8	-168.5	-31.3	0	0	110.7	E286	E286-Q288 PolarHBondContact O-N 3.27Å
289	L	23.7	Very low	25.2	Very low	161 Å²	161	148.2 Å²	148.2	84%	0.843	79%	0.786	S	S	*	*			trans	-72.1	120.3	169.9	-127.3	90.8	0	0	0	109.2	R287 S291	R287-L289 PolarHBondContact O-N 3.26Å; L289-S291 PolarHBondContact O-N 3.04Å
290	S	20.7	Very low	25.2	Very low	117 Å²	117	148.2 Å²	148.2	82%	0.818	79%	0.787	S	S	*	*			trans	-59.8	120.8	165.9	51.5	0	0	0	0	110.9
291	S	23.8	Very low	24.8	Very low	103 Å²	103	148.6 Å²	148.6	72%	0.72	79%	0.794	S	S	*	*			trans	-142.3	111.6	156.9	85.2	0	0	0	0	110.8	L289	L289-S291 PolarHBondContact O-N 3.04Å
292	S	21.5	Very low	24	Very low	124 Å²	124	148.3 Å²	148.3	87%	0.867	79%	0.79	S	S	*	*			trans	-54.3	127.7	166.6	-51.3	0	0	0	0	110.3
293	R	24.6	Very low	23.3	Very low	236 Å²	236	150 Å²	150	89%	0.891	80%	0.795	S	S	*	*			trans	-136.9	99.1	164.2	-146.5	175.7	-114.1	173.3	-1.7	111.2
294	N	20.5	Very low	23.1	Very low	140 Å²	140	156.1 Å²	156.1	75%	0.749	81%	0.806	S	S	*	*			trans	-60.5	141.4	161	-87.4	-37.2	0	0	0	111
295	R	20.8	Very low	22.8	Very low	213 Å²	213	158.2 Å²	158.2	80%	0.804	81%	0.811	S	S	*	*			trans	66.4	118.4	145.3	-121.4	-179.3	-77.5	-129.8	-0.8	118.7
296	I	23.1	Very low	22.6	Very low	164 Å²	164	159.7 Å²	159.7	84%	0.841	81%	0.814	S	S	*	*			trans	-168.4	98.6	136	-81.6	136.1	0	0	0	104.3
297	S	21.5	Very low	22.3	Very low	98 Å²	98	155.4 Å²	155.4	69%	0.685	81%	0.805	S	S	*	*				51.5	104.6	92.3	-61.6	0	0	0	0	115.5
298	Q	19.7	Very low	22.1	Very low	182 Å²	182	150.2 Å²	150.2	85%	0.85	80%	0.804	S	S	*	*			trans	22.7	123.2	144.5	-64.6	177.1	-8	0	0	118.5
299	T	21	Very low	22	Very low	127 Å²	127	148.9 Å²	148.9	78%	0.779	80%	0.797	S	S	*	*				-178.6	140.4	117	22.3	0	0	0	0	113.2
300	N	22.2	Very low	21.9	Very low	136 Å²	136	146.5 Å²	146.5	73%	0.727	79%	0.794	S	S	*	*			trans	75.6	90.4	149	-59.8	-8.6	0	0	0	120.3	V302	N300-V302 PolarHBondContact O-N 3.33Å
301	T	20.5	Very low	22	Very low	135 Å²	135	147.6 Å²	147.6	83%	0.828	80%	0.796	S	S	*	*			trans	-39.2	120	138.1	43	0	0	0	0	112.6
302	V	24	Very low	21.8	Very low	120 Å²	120	155 Å²	155	73%	0.727	81%	0.808	S	S	*	*			trans	-133.1	106.4	155.4	175.8	0	0	0	0	107.2	N300 K304	N300-V302 PolarHBondContact O-N 3.33Å; V302-K304 PolarHBondContact O-N 2.85Å
303	D	21.5	Very low	22	Very low	155 Å²	155	154.5 Å²	154.5	83%	0.829	81%	0.805	S	S	*	*			trans	-56.3	119.7	167.3	-71	-51.8	0	0	0	110
304	K	23.8	Very low	21.8	Very low	180 Å²	180	154.8 Å²	154.8	78%	0.783	81%	0.806	S	S	*	*			trans	-125.2	96.6	158.7	-90.9	-173.7	174.9	178	0	108.9	V302 I306	V302-K304 PolarHBondContact O-N 2.85Å; K304-I306 PolarHBondContact O-N 3.45Å
305	Q	20.6	Very low	22	Very low	195 Å²	195	153.4 Å²	153.4	91%	0.911	81%	0.807	S	S	*	*			trans	-50.8	114.6	157.4	-75.7	169.7	-68.9	0	0	108.8
306	I	23.8	Very low	22	Very low	144 Å²	144	154.4 Å²	154.4	74%	0.738	81%	0.811	S	S	*	*			trans	-105.7	100.8	166.5	-64	175.2	0	0	0	106.6	K304 C308	K304-I306 PolarHBondContact O-N 3.45Å; I306-C308 PolarHBondContact O-N 2.73Å
307	S	21	Very low	22.1	Very low	99 Å²	99	153 Å²	153	69%	0.692	81%	0.81	S	S	*	*			trans	-67.5	115	164.7	43.5	0	0	0	0	109.4	E309	S307-E309 PolarHBondContact O-N 3.41Å; S307-E309 VanDerWaalsContact O-N 3.16Å
308	C	21.5	Very low	22.6	Very low	129 Å²	129	153.7 Å²	153.7	87%	0.872	81%	0.812	S	S	*	*			trans	-79.1	92.4	173.9	-68.9	0	0	0	0	110	I306	I306-C308 PolarHBondContact O-N 2.73Å
309	E	22.1	Very low	22.8	Very low	169 Å²	169	150.2 Å²	150.2	79%	0.79	81%	0.808	S	S	*	*			trans	-76.6	136.5	169.3	-154.3	95.7	-147.3	0	0	110.3	S307	S307-E309 PolarHBondContact O-N 3.41Å; S307-E309 VanDerWaalsContact O-N 3.16Å
310	S	22.3	Very low	23	Very low	111 Å²	111	152.8 Å²	152.8	78%	0.776	81%	0.811	S	S	*	*			trans	-68.1	130.3	-172.7	69.9	0	0	0	0	112.9
311	T	23	Very low	23.1	Very low	140 Å²	140	152.7 Å²	152.7	86%	0.859	82%	0.815	S	S	*	*			trans	-130.4	112.6	159.9	8	0	0	0	0	110.5	S313	T311-S313 PolarHBondContact O-N 3.07Å
312	R	20.2	Very low	23.3	Very low	258 Å²	258	150.9 Å²	150.9	97%	0.974	81%	0.808	S	S	*	*			trans	-53.6	119.6	169.6	-91.9	167.9	162.5	164.3	-3.9	110.7
313	S	24.7	Very low	23.4	Very low	114 Å²	114	151.5 Å²	151.5	80%	0.797	81%	0.807	S	S	*	*			trans	-132.1	118	152.3	58.9	0	0	0	0	109.8	T311	T311-S313 PolarHBondContact O-N 3.07Å
314	R	20	Very low	23.7	Very low	242 Å²	242	150 Å²	150	91%	0.913	80%	0.804	S	S	*	*			trans	-91	107.5	-173.4	-169.6	-177.7	-165.8	179.7	3.5	107.6
315	S	25.4	Very low	23.7	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	81%	0.805	S	S	*	*			trans	-135.9	113.2	167.2	56.6	0	0	0	0	110.1
316	R	20.3	Very low	23.9	Very low	234 Å²	234	146.6 Å²	146.6	88%	0.883	79%	0.792	S	S	*	*			trans	-70.5	127.3	172.4	-74.2	169.4	162.2	163.7	-7.2	109.7
317	T	26	Very low	23.9	Very low	134 Å²	134	150.7 Å²	150.7	82%	0.822	80%	0.798	S	S	*	*			trans	-158.6	152.7	150.2	32.2	0	0	0	0	109.7
318	P	31.6	Very low	24.2	Very low	114 Å²	114	151.6 Å²	151.6	74%	0.74	79%	0.794	S	S	*	*			trans	-90.9	152.4	-138.5	33.7	-34.4	0	0	0	115	H320	P318-H320 PolarHBondContact O-N 2.89Å; P318-H320 VanDerWaalsContact O-N 3.12Å
319	S	23.8	Very low	24.5	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	79%	0.788	S	S	*	*			trans	-45.5	100.4	173.2	51.5	0	0	0	0	114.3
320	H	23.9	Very low	24.6	Very low	181 Å²	181	152.8 Å²	152.8	84%	0.838	79%	0.79	S	S	*	*			trans	-104.3	96.6	146.2	-96.4	-79.7	0	0	0	107.4	P318 S322	P318-H320 PolarHBondContact O-N 2.89Å; P318-H320 VanDerWaalsContact O-N 3.12Å; H320-S322 PolarHBondContact O-N 3.21Å
321	T	25	Very low	24.7	Very low	133 Å²	133	154.5 Å²	154.5	82%	0.816	79%	0.789	S	S	*	*			trans	-70.4	76	168.7	48.9	0	0	0	0	108.7	N323	T321-N323 PolarHBondContact O-N 3.13Å
322	S	25.3	Very low	24.8	Very low	97 Å²	97	151.4 Å²	151.4	68%	0.678	77%	0.773	S	S	*	*			trans	-86.4	96.4	168.2	65.2	0	0	0	0	108.9	H320 V324	H320-S322 PolarHBondContact O-N 3.21Å; S322-V324 PolarHBondContact O-N 3.26Å
323	N	26.3	Very low	25.4	Very low	133 Å²	133	144.5 Å²	144.5	71%	0.711	76%	0.762	S	S	*	*			trans	32.4	84.7	149	-61.9	-15.3	0	0	0	116.5	T321 W325	T321-N323 PolarHBondContact O-N 3.13Å; N323-W325 PolarHBondContact O-N 3.3Å
324	V	27.6	Very low	25.5	Very low	125 Å²	125	146.1 Å²	146.1	76%	0.758	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-67.4	4	171.5	176	0	0	0	0	112.9	S322 S326	S322-V324 PolarHBondContact O-N 3.26Å; V324-S326 VanDerWaalsContact C-N 3.25Å; V324-S326 PolarHBondContact O-N 2.8Å
325	W	22.9	Very low	25.9	Very low	210 Å²	210	143 Å²	143	80%	0.795	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-74.8	0.9	-177.2	-76.3	96.3	0	0	0	115.6	N323	N323-W325 PolarHBondContact O-N 3.3Å
326	S	25.7	Very low	25.9	Very low	93 Å²	93	146.5 Å²	146.5	65%	0.65	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-103.3	5.4	-178.6	63.2	0	0	0	0	116	V324 I328	V324-S326 VanDerWaalsContact C-N 3.25Å; V324-S326 PolarHBondContact O-N 2.8Å; S326-I328 PolarHBondContact O-N 3.42Å
327	R	22.4	Very low	26.3	Very low	229 Å²	229	141.9 Å²	141.9	86%	0.864	75%	0.754	S	S	*	*			trans	-82.1	38.1	170.8	-76.5	-168.2	-177.3	175.5	1.6	113.5	I329	R327-I329 PolarHBondContact O-N 3.49Å
328	I	28.1	Very low	26.2	Very low	119 Å²	119	142.8 Å²	142.8	61%	0.61	75%	0.753	S	S	*	*	S	Bend	trans	-78.4	97.4	163.3	-62.2	174.7	0	0	0	105.4	S326 E330	S326-I328 PolarHBondContact O-N 3.42Å; I328-E330 PolarHBondContact O-N 3.19Å
329	I	27.8	Very low	26	Very low	144 Å²	144	142.7 Å²	142.7	74%	0.738	75%	0.75	S	S	*	*			trans	33.3	78	164.8	-49.9	175.7	0	0	0	112.2	R327 I331	R327-I329 PolarHBondContact O-N 3.49Å; I329-I331 VanDerWaalsContact C-N 3.32Å; I329-I331 HydrophobicContact CG2-CG1 4.3Å; I329-I331 PolarHBondContact O-N 3.44Å
330	E	23.2	Very low	26.1	Very low	178 Å²	178	143.4 Å²	143.4	83%	0.832	75%	0.75	S	S	*	*			trans	-62.5	102.5	158.7	-91.1	176.4	162.3	0	0	106.6	I328 S332	I328-E330 PolarHBondContact O-N 3.19Å; E330-S332 PolarHBondContact O-N 3.31Å
331	I	26.3	Very low	26.2	Very low	148 Å²	148	142.7 Å²	142.7	76%	0.759	75%	0.747	S	S	*	*			trans	-60.5	116	164.9	-62.3	169.6	0	0	0	105.1	I329	I329-I331 VanDerWaalsContact C-N 3.32Å; I329-I331 HydrophobicContact CG2-CG1 4.3Å; I329-I331 PolarHBondContact O-N 3.44Å
332	S	24.1	Very low	26.4	Very low	74 Å²	74	141.8 Å²	141.8	52%	0.517	74%	0.744	S	S	.	*			trans	-54	126.7	176	177.9	0	0	0	0	108.7	E330 D334	E330-S332 PolarHBondContact O-N 3.31Å; S332-D334 PolarHBondContact O-N 3.39Å; S332-D334 VanDerWaalsContact O-N 3.13Å
333	P	33.1	Very low	26.8	Very low	114 Å²	114	144.7 Å²	144.7	74%	0.74	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-0.1	-177.7	27.6	-32.4	0	0	0	113.6	E335	P333-E335 VanDerWaalsContact C-N 3.3Å; P333-E335 PolarHBondContact O-N 2.97Å
334	D	27.2	Very low	27.5	Very low	148 Å²	148	146.2 Å²	146.2	79%	0.791	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	7.8	-175.4	-63.4	-29.9	0	0	0	114.2	S332	S332-D334 PolarHBondContact O-N 3.39Å; S332-D334 VanDerWaalsContact O-N 3.13Å
335	E	28.1	Very low	28.7	Very low	175 Å²	175	145.8 Å²	145.8	82%	0.818	74%	0.741	S	S	*	*			trans	-111.4	68.8	169.5	-145.2	164	-164.1	0	0	109.1	P333 L337	P333-E335 VanDerWaalsContact C-N 3.3Å; P333-E335 PolarHBondContact O-N 2.97Å; E335-L337 PolarHBondContact O-N 3.34Å
336	E	24.6	Very low	30.5	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.864	73%	0.729	S	S	*	*			trans	-58.8	84	157.7	-84	-175.8	158.5	0	0	107.7	N338	E336-N338 PolarHBondContact O-N 3.36Å
337	L	29.1	Very low	32.6	Very low	137 Å²	137	138.8 Å²	138.8	72%	0.717	72%	0.716	S	S	*	*			trans	-50.5	122.3	162.6	-167.8	74.4	0	0	0	105.8	E335 V339	E335-L337 PolarHBondContact O-N 3.34Å; L337-V339 HydrophobicContact CB-CG2 4.15Å; L337-V339 HydrophobicContact CD2-CG2 4.06Å; L337-V339 HydrophobicContact CG-CG2 4.27Å; L337-V339 WeakPolarHBondContact O-CG2 3.24Å; L337-V339 PolarHBondContact O-N 3.14Å
338	N	23.8	Very low	35.2	Very low	153 Å²	153	130.8 Å²	130.8	82%	0.818	69%	0.69	S	S	*	*			trans	-59.1	80.8	172.2	-97.5	-28.7	0	0	0	109.2	E336 T340	E336-N338 PolarHBondContact O-N 3.36Å; N338-T340 PolarHBondContact O-N 3.26Å
339	V	28.3	Very low	37.5	Very low	111 Å²	111	131.7 Å²	131.7	67%	0.673	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	71.7	176.5	-177.7	0	0	0	0	107.3	L337	L337-V339 HydrophobicContact CB-CG2 4.15Å; L337-V339 HydrophobicContact CD2-CG2 4.06Å; L337-V339 HydrophobicContact CG-CG2 4.27Å; L337-V339 WeakPolarHBondContact O-CG2 3.24Å; L337-V339 PolarHBondContact O-N 3.14Å
340	T	25	Very low	39.7	Very low	124 Å²	124	128 Å²	128	76%	0.761	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	-1.8	165.1	37.1	0	0	0	0	113.9	N338	N338-T340 PolarHBondContact O-N 3.26Å
341	E	26.8	Very low	42.2	Very low	166 Å²	166	121.1 Å²	121.1	78%	0.776	64%	0.64	S	S	*	*	S	Bend	trans	-87.2	119.7	165.9	-72.4	-169.3	167.2	0	0	109.5	N343	E341-N343 PolarHBondContact O-N 3.08Å
342	P	27.9	Very low	44.9	Very low	115 Å²	115	116.8 Å²	116.8	75%	0.747	62%	0.615	S	S	*	*			trans	-58.8	120	173.3	24.9	-30.4	0	0	0	106.4	K344	P342-K344 PolarHBondContact O-N 3.28Å
343	N	35.4	Very low	47.7	Very low	157 Å²	157	118.4 Å²	118.4	84%	0.84	61%	0.609	S	S	*	*			trans	-51.9	87.1	177.5	-73.9	-35.3	0	0	0	109.3	E341 E345	E341-N343 PolarHBondContact O-N 3.08Å; N343-E345 PolarHBondContact O-N 2.9Å
344	K	40	Very low	49.8	Very low	166 Å²	166	114.4 Å²	114.4	72%	0.722	58%	0.58	S	S	*	*			trans	-64.8	112.3	174.4	-118.9	178.8	177.7	178.6	0	104.1	P342 L346	P342-K344 PolarHBondContact O-N 3.28Å; K344-L346 PolarHBondContact O-N 3.18Å
345	E	53.2	Low	52.3	Low	115 Å²	115	107.9 Å²	107.9	54%	0.537	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-50.1	117.1	176.8	-65.3	-171.1	150.8	0	0	107.8	R100 N343 S347	R100-E345 IonicContact NH1-OE1 3.65Å; N343-E345 PolarHBondContact O-N 2.9Å; E345-S347 PolarHBondContact O-N 3.05Å
346	L	60	Low	54.9	Low	101 Å²	101	104.4 Å²	104.4	53%	0.529	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-54	129.8	177.6	-78.4	134.1	0	0	0	108.2	K344 E350	K344-L346 PolarHBondContact O-N 3.18Å; L346-E350 HydrophobicContact CB-CB 4.34Å; L346-E350 HydrophobicContact CD2-CB 3.76Å
347	S	71	Confident	57.9	Low	55 Å²	55	95.9 Å²	95.9	39%	0.385	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-61.3	151.5	174	68.1	0	0	0	0	109.8	E345 F349 E350 T351	E345-S347 PolarHBondContact O-N 3.05Å; S347-F349 PolarHBondContact O-N 3.21Å; S347-E350 WeakPolarHBondContact CB-OE2 2.79Å; S347-E350 PolarHBondContact N-OE2 3.11Å; S347-E350 WeakPolarHBondContact O-CA 3.26Å; S347-E350 WeakPolarHBondContact O-CB 3.47Å; S347-E350 PolarHBondContact O-N 3.4Å; S347-E350 VanDerWaalsContact OG-CG 3.25Å; S347-E350 WeakPolarHBondContact OG-CG 3.11Å; S347-E350 PolarHBondContact OG-N 2.97Å; S347-E350 PolarHBondContact OG-OE2 3.4Å; S347-T351 PolarHBondContact O-N 3.22Å; S347-T351 PolarHBondContact O-OG1 2.63Å
348	L	76.2	Confident	60.6	Low	62 Å²	62	89.4 Å²	89.4	33%	0.325	46%	0.459	S	S	.	.	H	α-helix	trans	-45.9	-43.7	179.5	176.8	59.9	0	0	0	112.8	P88 I89 S92 T351 Y352	P88-L348 HydrophobicContact CB-CD1 3.5Å; P88-L348 VanDerWaalsContact CB-CD1 3.5Å; P88-L348 WeakPolarHBondContact O-CD1 3.45Å; I89-L348 HydrophobicContact CG1-CD1 4.37Å; S92-L348 WeakPolarHBondContact OG-CD1 3.44Å; L348-T351 PolarHBondContact O-N 3.25Å; L348-Y352 HydrophobicContact CD1-CD2 3.87Å; L348-Y352 HydrophobicContact CD1-CE2 3.55Å; L348-Y352 HydrophobicContact CG-CD2 4.13Å; L348-Y352 HydrophobicContact CG-CE2 4.07Å; L348-Y352 WeakPolarHBondContact O-CD2 3.28Å; L348-Y352 PolarHBondContact O-N 3.29Å; L348-Y352 VanDerWaalsContact O-N 3.11Å
349	F	75.8	Confident	63.5	Low	137 Å²	137	84.8 Å²	84.8	60%	0.601	44%	0.438	S	S	*	.	H	α-helix	trans	-67	-37.1	179.6	-176	-99.2	0	0	0	112.7	S347 R353	S347-F349 PolarHBondContact O-N 3.21Å; F349-R353 VanDerWaalsContact O-CB 3.27Å; F349-R353 WeakPolarHBondContact O-CB 3.49Å; F349-R353 PolarHBondContact O-N 2.6Å
350	E	75.6	Confident	66.4	Low	66 Å²	66	87.9 Å²	87.9	31%	0.308	44%	0.443	S	S	.	.	H	α-helix	trans	-67.5	-40.2	175.6	-70.9	163.5	153.8	0	0	111.4	L346 S347 R353 F354	L346-E350 HydrophobicContact CB-CB 4.34Å; L346-E350 HydrophobicContact CD2-CB 3.76Å; S347-E350 WeakPolarHBondContact CB-OE2 2.79Å; S347-E350 PolarHBondContact N-OE2 3.11Å; S347-E350 WeakPolarHBondContact O-CA 3.26Å; S347-E350 WeakPolarHBondContact O-CB 3.47Å; S347-E350 PolarHBondContact O-N 3.4Å; S347-E350 VanDerWaalsContact OG-CG 3.25Å; S347-E350 WeakPolarHBondContact OG-CG 3.11Å; S347-E350 PolarHBondContact OG-N 2.97Å; S347-E350 PolarHBondContact OG-OE2 3.4Å; E350-R353 PolarHBondContact O-N 2.94Å; E350-F354 VanDerWaalsContact O-CB 3.3Å; E350-F354 WeakPolarHBondContact O-CB 3.28Å; E350-F354 PolarHBondContact O-N 2.99Å
351	T	74.9	Confident	69.6	Low	34 Å²	34	83.5 Å²	83.5	21%	0.209	42%	0.415	C	S	.	.	H	α-helix	trans	-60.4	-47.9	174.9	-53.7	0	0	0	0	111.5	P88 S347 L348 R353 F354 M355	P88-T351 HydrophobicContact CB-CG2 4.03Å; P88-T351 HydrophobicContact CG-CG2 4.12Å; S347-T351 PolarHBondContact O-N 3.22Å; S347-T351 PolarHBondContact O-OG1 2.63Å; L348-T351 PolarHBondContact O-N 3.25Å; T351-R353 PolarHBondContact O-N 3.5Å; T351-F354 PolarHBondContact O-N 2.83Å; T351-M355 WeakPolarHBondContact O-CG 3.44Å; T351-M355 PolarHBondContact O-N 3.48Å
352	Y	82.8	Confident	72.8	Confident	58 Å²	58	82.8 Å²	82.8	23%	0.227	41%	0.409	C	S	.	.	H	α-helix	trans	-61.8	-43.6	174.4	-85.2	-69.8	0	0	0	112.6	A85 P88 I89 L348 F354 M355 L356	A85-Y352 PolarHBondContact O-OH 3.32Å; P88-Y352 HydrophobicContact CB-CD2 4.14Å; P88-Y352 HydrophobicContact CB-CE2 3.75Å; P88-Y352 HydrophobicContact CG-CD1 4.22Å; P88-Y352 HydrophobicContact CG-CD2 4.3Å; P88-Y352 HydrophobicContact CG-CE1 3.86Å; P88-Y352 HydrophobicContact CG-CE2 3.96Å; P88-Y352 HydrophobicContact CG-CG 4.42Å; I89-Y352 HydrophobicContact CG1-CE2 4.44Å; L348-Y352 HydrophobicContact CD1-CD2 3.87Å; L348-Y352 HydrophobicContact CD1-CE2 3.55Å; L348-Y352 HydrophobicContact CG-CD2 4.13Å; L348-Y352 HydrophobicContact CG-CE2 4.07Å; L348-Y352 WeakPolarHBondContact O-CD2 3.28Å; L348-Y352 PolarHBondContact O-N 3.29Å; L348-Y352 VanDerWaalsContact O-N 3.11Å; Y352-F354 VanDerWaalsContact C-N 3.29Å; Y352-F354 PolarHBondContact O-N 3.03Å; Y352-M355 HydrophobicContact CD1-CE 3.54Å; Y352-M355 HydrophobicContact CE1-CE 3.91Å; Y352-M355 HydrophobicContact CG-CE 4.17Å; Y352-M355 PolarHBondContact O-N 2.85Å; Y352-L356 WeakPolarHBondContact O-CB 3.38Å; Y352-L356 VanDerWaalsContact O-CG 3.28Å; Y352-L356 WeakPolarHBondContact O-CG 3.44Å; Y352-L356 PolarHBondContact O-N 2.87Å
353	R	82.3	Confident	75.9	Confident	108 Å²	108	78.2 Å²	78.2	41%	0.408	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-40	178.5	-178.1	179	-179.1	166.9	2.2	111.7	F349 E350 T351 G357	F349-R353 VanDerWaalsContact O-CB 3.27Å; F349-R353 WeakPolarHBondContact O-CB 3.49Å; F349-R353 PolarHBondContact O-N 2.6Å; E350-R353 PolarHBondContact O-N 2.94Å; T351-R353 PolarHBondContact O-N 3.5Å; R353-G357 PolarHBondContact O-N 3.45Å
354	F	77.4	Confident	78.7	Confident	30 Å²	30	70.9 Å²	70.9	13%	0.132	34%	0.34	C	S	.	.	H	α-helix	trans	-65.2	-48.1	177.7	-171.8	-91.3	0	0	0	111.2	E350 T351 Y352 L356 G357 I358 V524 F669	E350-F354 VanDerWaalsContact O-CB 3.3Å; E350-F354 WeakPolarHBondContact O-CB 3.28Å; E350-F354 PolarHBondContact O-N 2.99Å; T351-F354 PolarHBondContact O-N 2.83Å; Y352-F354 VanDerWaalsContact C-N 3.29Å; Y352-F354 PolarHBondContact O-N 3.03Å; F354-L356 PolarHBondContact O-N 3.26Å; F354-G357 WeakPolarHBondContact O-CA 3.37Å; F354-G357 PolarHBondContact O-N 3.39Å; F354-I358 HydrophobicContact CD1-CD1 3.88Å; F354-I358 HydrophobicContact CD1-CG1 4.48Å; F354-I358 HydrophobicContact CE1-CD1 3.55Å; F354-I358 HydrophobicContact CE1-CG1 4.17Å; F354-I358 HydrophobicContact CZ-CD1 4.45Å; F354-I358 PolarHBondContact O-N 3.47Å; F354-V524 HydrophobicContact CD1-CG1 4.24Å; F354-V524 HydrophobicContact CE1-CB 3.71Å; F354-V524 HydrophobicContact CE1-CG1 3.61Å; F354-V524 HydrophobicContact CE1-CG2 3.51Å; F354-V524 HydrophobicContact CZ-CB 4.08Å; F354-V524 HydrophobicContact CZ-CG1 3.89Å; F354-V524 HydrophobicContact CZ-CG2 3.47Å; F354-V524 VanDerWaalsContact CZ-CG2 3.47Å; F354-F669 AromaticContact CD2-CD1 3.67Å; F354-F669 HydrophobicContact CD2-CD1 3.67Å; F354-F669 HydrophobicContact CD2-CE1 4.05Å; F354-F669 AromaticContact CE2-CD1 3.68Å; F354-F669 HydrophobicContact CE2-CD1 3.68Å; F354-F669 HydrophobicContact CE2-CE1 4.44Å; F354-F669 WeakPolarHBondContact CE2-O 3.16Å; F354-F669 HydrophobicContact CG-CD1 4.3Å; F354-F669 HydrophobicContact CZ-CD1 4.31Å
355	M	79.8	Confident	81.2	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.049	33%	0.331	C	S	.	.	H	α-helix	trans	-57.9	-47.7	174.5	-70.3	-169.9	-56.8	0	0	112.6	L84 P88 T351 Y352 G357 I358 C359 T527	L84-M355 HydrophobicContact CD1-SD 3.48Å; L84-M355 WeakPolarHBondContact CD1-SD 3.45Å; L84-M355 HydrophobicContact CG-SD 3.99Å; P88-M355 HydrophobicContact CB-CE 4.49Å; P88-M355 HydrophobicContact CG-CE 3.18Å; P88-M355 HydrophobicContact CG-SD 4.16Å; T351-M355 WeakPolarHBondContact O-CG 3.44Å; T351-M355 PolarHBondContact O-N 3.48Å; Y352-M355 HydrophobicContact CD1-CE 3.54Å; Y352-M355 HydrophobicContact CE1-CE 3.91Å; Y352-M355 HydrophobicContact CG-CE 4.17Å; Y352-M355 PolarHBondContact O-N 2.85Å; M355-G357 PolarHBondContact O-N 3.2Å; M355-I358 PolarHBondContact O-N 3.48Å; M355-I358 VanDerWaalsContact O-N 3.13Å; M355-C359 PolarHBondContact O-N 2.66Å; M355-C359 VanDerWaalsContact O-N 3.12Å; M355-C359 PolarHBondContact O-SG 3.1Å; M355-C359 VanDerWaalsContact O-SG 3.36Å; M355-T527 HydrophobicContact CG-CG2 3.3Å; M355-T527 HydrophobicContact SD-CG2 3.52Å; M355-T527 VanDerWaalsContact SD-CG2 3.52Å
356	L	83.9	Confident	83.3	Confident	103 Å²	103	63.7 Å²	63.7	54%	0.539	31%	0.311	S	S	.	.	H	α-helix	trans	-63.7	-26	175.8	-70.3	172.6	0	0	0	112.4	Y352 F354 K360	Y352-L356 WeakPolarHBondContact O-CB 3.38Å; Y352-L356 VanDerWaalsContact O-CG 3.28Å; Y352-L356 WeakPolarHBondContact O-CG 3.44Å; Y352-L356 PolarHBondContact O-N 2.87Å; F354-L356 PolarHBondContact O-N 3.26Å; L356-K360 WeakPolarHBondContact O-CG 3.41Å
357	G	86.7	Confident	85	Confident	5 Å²	5	58.9 Å²	58.9	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-46.5	171.5	0	0	0	0	0	112.3	R353 F354 M355 C359 K360	R353-G357 PolarHBondContact O-N 3.45Å; F354-G357 WeakPolarHBondContact O-CA 3.37Å; F354-G357 PolarHBondContact O-N 3.39Å; M355-G357 PolarHBondContact O-N 3.2Å; G357-C359 PolarHBondContact O-N 3.45Å; G357-K360 WeakPolarHBondContact O-CB 3.21Å; G357-K360 PolarHBondContact O-N 3.07Å; G357-K360 VanDerWaalsContact O-N 3.13Å
358	I	84.9	Confident	86.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-43.4	177	-60.8	162.7	0	0	0	110.9	F354 M355 K360 L361 I364 Y528 L531 F669	F354-I358 HydrophobicContact CD1-CD1 3.88Å; F354-I358 HydrophobicContact CD1-CG1 4.48Å; F354-I358 HydrophobicContact CE1-CD1 3.55Å; F354-I358 HydrophobicContact CE1-CG1 4.17Å; F354-I358 HydrophobicContact CZ-CD1 4.45Å; F354-I358 PolarHBondContact O-N 3.47Å; M355-I358 PolarHBondContact O-N 3.48Å; M355-I358 VanDerWaalsContact O-N 3.13Å; I358-K360 PolarHBondContact O-N 3.36Å; I358-L361 HydrophobicContact CG2-CD1 4.42Å; I358-L361 WeakPolarHBondContact O-CB 3.31Å; I358-L361 PolarHBondContact O-N 3.08Å; I358-I364 HydrophobicContact CG2-CG1 4.22Å; I358-I364 HydrophobicContact CG2-CG2 4.49Å; I358-Y528 HydrophobicContact CB-CE2 4.4Å; I358-Y528 HydrophobicContact CD1-CD2 3.51Å; I358-Y528 HydrophobicContact CD1-CE2 3.89Å; I358-Y528 HydrophobicContact CD1-CG 4.3Å; I358-Y528 HydrophobicContact CG1-CD2 4.11Å; I358-Y528 HydrophobicContact CG1-CE2 3.95Å; I358-Y528 HydrophobicContact CG2-CD2 4.09Å; I358-Y528 HydrophobicContact CG2-CE1 4.27Å; I358-Y528 HydrophobicContact CG2-CE2 3.5Å; I358-Y528 VanDerWaalsContact CG2-CE2 3.5Å; I358-L531 HydrophobicContact CB-CD2 3.78Å; I358-L531 HydrophobicContact CG2-CD2 3.42Å; I358-L531 VanDerWaalsContact CG2-CD2 3.42Å; I358-F669 HydrophobicContact CG1-CB 3.88Å
359	C	86.2	Confident	87	Confident	56 Å²	56	59.4 Å²	59.4	38%	0.378	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.9	177.6	-62.5	0	0	0	0	113.9	M355 G357 L531	M355-C359 PolarHBondContact O-N 2.66Å; M355-C359 VanDerWaalsContact O-N 3.12Å; M355-C359 PolarHBondContact O-SG 3.1Å; M355-C359 VanDerWaalsContact O-SG 3.36Å; G357-C359 PolarHBondContact O-N 3.45Å; C359-L531 WeakPolarHBondContact SG-CD1 3.47Å
360	K	88.9	Confident	88	Confident	176 Å²	176	52.9 Å²	52.9	77%	0.765	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-9.1	178.3	-69.9	174.4	-177.3	-174.1	0	113.4	L356 G357 I358 K362	L356-K360 WeakPolarHBondContact O-CG 3.41Å; G357-K360 WeakPolarHBondContact O-CB 3.21Å; G357-K360 PolarHBondContact O-N 3.07Å; G357-K360 VanDerWaalsContact O-N 3.13Å; I358-K360 PolarHBondContact O-N 3.36Å; K360-K362 PolarHBondContact O-N 2.82Å
361	L	91.2	Very high	89	Confident	33 Å²	33	49.8 Å²	49.8	17%	0.173	24%	0.241	C	C	.	.			trans	-66.3	123.7	175.8	-64.9	177.4	0	0	0	109.4	I358 P363 I364 L365 F667 F669	I358-L361 HydrophobicContact CG2-CD1 4.42Å; I358-L361 WeakPolarHBondContact O-CB 3.31Å; I358-L361 PolarHBondContact O-N 3.08Å; L361-P363 HydrophobicContact CB-CG 4.46Å; L361-I364 HydrophobicContact CB-CB 4.12Å; L361-I364 HydrophobicContact CB-CG1 3.98Å; L361-I364 HydrophobicContact CD1-CG1 4.3Å; L361-I364 WeakPolarHBondContact O-CB 3.28Å; L361-I364 PolarHBondContact O-N 2.93Å; L361-L365 PolarHBondContact O-N 3.01Å; L361-F667 VanDerWaalsContact CD1-O 3.23Å; L361-F667 WeakPolarHBondContact CD1-O 3.36Å; L361-F669 HydrophobicContact CD1-CB 4.19Å; L361-F669 HydrophobicContact CD2-CD2 4.45Å
362	K	93.9	Very high	90	Very high	151 Å²	151	50.4 Å²	50.4	66%	0.657	24%	0.241	S	C	*	.	H	α-helix	trans	-51.7	-46.7	178.1	-171.9	176	-179.9	-179	0	113.8	K360 I364 L365 Q366	K360-K362 PolarHBondContact O-N 2.82Å; K362-I364 VanDerWaalsContact C-N 3.28Å; K362-I364 PolarHBondContact O-N 3.5Å; K362-L365 PolarHBondContact O-N 3.12Å; K362-Q366 WeakPolarHBondContact O-CG 3.36Å; K362-Q366 PolarHBondContact O-N 3.42Å
363	P	94.3	Very high	90.7	Very high	18 Å²	18	48.7 Å²	48.7	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-32.9	178.5	25	-34.5	0	0	0	112.5	L361 Q366 Y367 L659 A666 F667	L361-P363 HydrophobicContact CB-CG 4.46Å; P363-Q366 PolarHBondContact O-N 2.94Å; P363-Y367 WeakPolarHBondContact O-CB 3.42Å; P363-Y367 PolarHBondContact O-N 2.94Å; P363-L659 HydrophobicContact CB-CD2 3.85Å; P363-L659 VanDerWaalsContact O-CD2 3.28Å; P363-L659 WeakPolarHBondContact O-CD2 3.37Å; P363-A666 VanDerWaalsContact CG-O 3.27Å; P363-A666 WeakPolarHBondContact CG-O 3.11Å; P363-F667 HydrophobicContact CB-CD1 4.04Å; P363-F667 HydrophobicContact CB-CE1 3.65Å; P363-F667 HydrophobicContact CB-CZ 4.2Å; P363-F667 HydrophobicContact CG-CD1 4.17Å; P363-F667 HydrophobicContact CG-CE1 4.27Å
364	I	92.7	Very high	91.4	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-67.8	-43.9	174.5	-65.4	-67.8	0	0	0	111.1	I358 L361 K362 Q366 Y367 V368 I519 Y528 L532 F667	I358-I364 HydrophobicContact CG2-CG1 4.22Å; I358-I364 HydrophobicContact CG2-CG2 4.49Å; L361-I364 HydrophobicContact CB-CB 4.12Å; L361-I364 HydrophobicContact CB-CG1 3.98Å; L361-I364 HydrophobicContact CD1-CG1 4.3Å; L361-I364 WeakPolarHBondContact O-CB 3.28Å; L361-I364 PolarHBondContact O-N 2.93Å; K362-I364 VanDerWaalsContact C-N 3.28Å; K362-I364 PolarHBondContact O-N 3.5Å; I364-Q366 VanDerWaalsContact C-N 3.33Å; I364-Q366 PolarHBondContact O-N 3.13Å; I364-Y367 PolarHBondContact O-N 3.26Å; I364-V368 HydrophobicContact CG2-CG2 4.32Å; I364-V368 VanDerWaalsContact O-CG2 3.3Å; I364-V368 WeakPolarHBondContact O-CG2 3.44Å; I364-V368 PolarHBondContact O-N 3.42Å; I364-I519 HydrophobicContact CD1-CD1 3.83Å; I364-Y528 HydrophobicContact CD1-CE1 3.84Å; I364-Y528 WeakPolarHBondContact CD1-OH 3.39Å; I364-Y528 WeakPolarHBondContact CG1-OH 3.36Å; I364-L532 HydrophobicContact CD1-CD2 4.06Å; I364-F667 HydrophobicContact CD1-CD1 3.95Å; I364-F667 HydrophobicContact CG1-CD1 4.38Å
365	L	94.2	Very high	92.3	Very high	102 Å²	102	44 Å²	44	53%	0.534	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-41.5	175.7	-174.5	61.7	0	0	0	111.8	L361 K362 Y367 V368 M369	L361-L365 PolarHBondContact O-N 3.01Å; K362-L365 PolarHBondContact O-N 3.12Å; L365-Y367 VanDerWaalsContact C-N 3.33Å; L365-Y367 PolarHBondContact O-N 2.72Å; L365-V368 PolarHBondContact O-N 3.16Å; L365-M369 WeakPolarHBondContact O-CB 3.05Å; L365-M369 WeakPolarHBondContact O-CG 3.32Å; L365-M369 PolarHBondContact O-N 2.62Å
366	Q	95.7	Very high	93.1	Very high	27 Å²	27	45 Å²	45	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-41.8	174.3	-74.3	174.2	-34.7	0	0	112	K362 P363 I364 M369 L370 Y655 H658 L659	K362-Q366 WeakPolarHBondContact O-CG 3.36Å; K362-Q366 PolarHBondContact O-N 3.42Å; P363-Q366 PolarHBondContact O-N 2.94Å; I364-Q366 VanDerWaalsContact C-N 3.33Å; I364-Q366 PolarHBondContact O-N 3.13Å; Q366-M369 PolarHBondContact O-N 2.93Å; Q366-L370 WeakPolarHBondContact O-CB 3.46Å; Q366-L370 PolarHBondContact O-N 2.98Å; Q366-Y655 HydrophobicContact CB-CD2 4Å; Q366-Y655 HydrophobicContact CB-CE2 4.07Å; Q366-Y655 HydrophobicContact CG-CD2 4.33Å; Q366-Y655 HydrophobicContact CG-CE2 3.98Å; Q366-H658 PolarHBondContact OE1-CD2 3.34Å; Q366-L659 HydrophobicContact CB-CD1 4.49Å; Q366-L659 HydrophobicContact CB-CD2 4.29Å
367	Y	95.8	Very high	93.8	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-46.3	177.3	-179.2	-115.9	0	0	0	112.3	P363 I364 L365 M369 L370 L371 L427 Q512 F515 H516 L532 L659	P363-Y367 WeakPolarHBondContact O-CB 3.42Å; P363-Y367 PolarHBondContact O-N 2.94Å; I364-Y367 PolarHBondContact O-N 3.26Å; L365-Y367 VanDerWaalsContact C-N 3.33Å; L365-Y367 PolarHBondContact O-N 2.72Å; Y367-M369 VanDerWaalsContact C-N 3.31Å; Y367-M369 PolarHBondContact O-N 2.8Å; Y367-L370 WeakPolarHBondContact O-CB 3.47Å; Y367-L370 PolarHBondContact O-N 2.86Å; Y367-L370 VanDerWaalsContact O-N 3.15Å; Y367-L371 HydrophobicContact CD1-CD1 4.15Å; Y367-L371 HydrophobicContact CE1-CD1 3.59Å; Y367-L371 HydrophobicContact CE1-CG 4.13Å; Y367-L371 HydrophobicContact CE2-CD2 4.21Å; Y367-L371 HydrophobicContact CE2-CG 4.25Å; Y367-L371 WeakPolarHBondContact O-CG 3.23Å; Y367-L371 PolarHBondContact O-N 2.9Å; Y367-L427 HydrophobicContact CE2-CD2 4.14Å; Y367-Q512 VanDerWaalsContact OH-CG 3.27Å; Y367-Q512 WeakPolarHBondContact OH-CG 3.46Å; Y367-F515 HydrophobicContact CD1-CE1 4.33Å; Y367-F515 AromaticContact CD2-CD1 3.96Å; Y367-F515 HydrophobicContact CD2-CD1 3.96Å; Y367-F515 AromaticContact CD2-CE1 3.56Å; Y367-F515 HydrophobicContact CD2-CE1 3.56Å; Y367-F515 HydrophobicContact CD2-CZ 4.5Å; Y367-F515 HydrophobicContact CE1-CD1 4.16Å; Y367-F515 HydrophobicContact CE1-CE1 4.34Å; Y367-F515 AromaticContact CE2-CD1 3.46Å; Y367-F515 HydrophobicContact CE2-CD1 3.46Å; Y367-F515 VanDerWaalsContact CE2-CD1 3.46Å; Y367-F515 AromaticContact CE2-CE1 3.59Å; Y367-F515 HydrophobicContact CE2-CE1 3.59Å; Y367-F515 HydrophobicContact CE2-CG 4.48Å; Y367-F515 HydrophobicContact CG-CD1 4.49Å; Y367-F515 AromaticContact CG-CE1 3.94Å; Y367-F515 HydrophobicContact CG-CE1 3.94Å; Y367-F515 AromaticContact CZ-CD1 3.57Å; Y367-F515 AromaticContact CZ-CE1 3.98Å; Y367-H516 AromaticContact CE1-CD2 3.62Å; Y367-H516 AromaticContact CE1-NE2 3.47Å; Y367-H516 WeakPolarHBondContact CE1-NE2 3.37Å; Y367-H516 AromaticContact CZ-CD2 3.74Å; Y367-H516 AromaticContact CZ-NE2 3.68Å; Y367-H516 PolarHBondContact OH-CD2 2.88Å; Y367-H516 PolarHBondContact OH-NE2 3.49Å; Y367-L532 HydrophobicContact CD1-CD2 4.12Å; Y367-L532 HydrophobicContact CE1-CD2 4.22Å; Y367-L659 HydrophobicContact CD2-CD1 4.03Å; Y367-L659 HydrophobicContact CG-CD1 4.45Å
368	V	94.6	Very high	94.3	Very high	32 Å²	32	40.1 Å²	40.1	19%	0.194	20%	0.198	C	C	.	.	H	α-helix	trans	-58	-46.4	174.6	173.5	0	0	0	0	110	I364 L365 L370 L371 F372 A535	I364-V368 HydrophobicContact CG2-CG2 4.32Å; I364-V368 VanDerWaalsContact O-CG2 3.3Å; I364-V368 WeakPolarHBondContact O-CG2 3.44Å; I364-V368 PolarHBondContact O-N 3.42Å; L365-V368 PolarHBondContact O-N 3.16Å; V368-L370 VanDerWaalsContact C-N 3.33Å; V368-L370 PolarHBondContact O-N 3.35Å; V368-L371 WeakPolarHBondContact O-CB 3.35Å; V368-L371 PolarHBondContact O-N 3.3Å; V368-L371 VanDerWaalsContact O-N 3.14Å; V368-F372 HydrophobicContact CG1-CD2 3.8Å; V368-F372 HydrophobicContact CG1-CE2 3.75Å; V368-F372 WeakPolarHBondContact O-CD2 3.31Å; V368-F372 PolarHBondContact O-N 3.27Å; V368-A535 HydrophobicContact CG1-CB 4.38Å; V368-A535 HydrophobicContact CG2-CB 3.86Å
369	M	95.5	Very high	94.9	Very high	95 Å²	95	40.1 Å²	40.1	47%	0.468	20%	0.198	S	C	.	.	H	α-helix	trans	-60.3	-40.6	176.3	-70.5	-63.6	-75.7	0	0	112.7	L365 Q366 Y367 L371 F372 I373	L365-M369 WeakPolarHBondContact O-CB 3.05Å; L365-M369 WeakPolarHBondContact O-CG 3.32Å; L365-M369 PolarHBondContact O-N 2.62Å; Q366-M369 PolarHBondContact O-N 2.93Å; Y367-M369 VanDerWaalsContact C-N 3.31Å; Y367-M369 PolarHBondContact O-N 2.8Å; M369-L371 VanDerWaalsContact C-N 3.34Å; M369-L371 PolarHBondContact O-N 3.21Å; M369-F372 PolarHBondContact O-N 3.01Å; M369-I373 WeakPolarHBondContact O-CB 3.4Å; M369-I373 WeakPolarHBondContact O-CG1 3.36Å; M369-I373 PolarHBondContact O-N 3.11Å
370	L	96.8	Very high	95.4	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-45.7	173.9	176.6	156.6	0	0	0	111.2	Q366 Y367 V368 A374 Y430 A656 L659	Q366-L370 WeakPolarHBondContact O-CB 3.46Å; Q366-L370 PolarHBondContact O-N 2.98Å; Y367-L370 WeakPolarHBondContact O-CB 3.47Å; Y367-L370 PolarHBondContact O-N 2.86Å; Y367-L370 VanDerWaalsContact O-N 3.15Å; V368-L370 VanDerWaalsContact C-N 3.33Å; V368-L370 PolarHBondContact O-N 3.35Å; L370-A374 VanDerWaalsContact O-CB 3.26Å; L370-A374 WeakPolarHBondContact O-CB 3.42Å; L370-A374 PolarHBondContact O-N 2.64Å; L370-Y430 HydrophobicContact CD2-CE1 4.16Å; L370-A656 HydrophobicContact CD1-CB 3.95Å; L370-L659 HydrophobicContact CD1-CD1 4.4Å
371	L	96.4	Very high	95.7	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-48.3	178.4	-68.8	178.3	0	0	0	111.7	Y367 V368 M369 A374 K375 Q512 A536 A539	Y367-L371 HydrophobicContact CD1-CD1 4.15Å; Y367-L371 HydrophobicContact CE1-CD1 3.59Å; Y367-L371 HydrophobicContact CE1-CG 4.13Å; Y367-L371 HydrophobicContact CE2-CD2 4.21Å; Y367-L371 HydrophobicContact CE2-CG 4.25Å; Y367-L371 WeakPolarHBondContact O-CG 3.23Å; Y367-L371 PolarHBondContact O-N 2.9Å; V368-L371 WeakPolarHBondContact O-CB 3.35Å; V368-L371 PolarHBondContact O-N 3.3Å; V368-L371 VanDerWaalsContact O-N 3.14Å; M369-L371 VanDerWaalsContact C-N 3.34Å; M369-L371 PolarHBondContact O-N 3.21Å; L371-A374 PolarHBondContact O-N 3.05Å; L371-K375 WeakPolarHBondContact O-CB 3.49Å; L371-K375 WeakPolarHBondContact O-CG 3.39Å; L371-K375 PolarHBondContact O-N 3.18Å; L371-Q512 HydrophobicContact CD2-CG 4.01Å; L371-A536 HydrophobicContact CD1-CB 4.13Å; L371-A539 HydrophobicContact CB-CB 4.17Å
372	F	96.4	Very high	95.9	Very high	47 Å²	47	31.2 Å²	31.2	21%	0.206	16%	0.157	C	C	.	.	H	α-helix	trans	-60.8	-49.1	179.4	-88.2	-96.7	0	0	0	112.1	V368 M369 A374 K375 V376 L538 A539 L542	V368-F372 HydrophobicContact CG1-CD2 3.8Å; V368-F372 HydrophobicContact CG1-CE2 3.75Å; V368-F372 WeakPolarHBondContact O-CD2 3.31Å; V368-F372 PolarHBondContact O-N 3.27Å; M369-F372 PolarHBondContact O-N 3.01Å; F372-A374 PolarHBondContact O-N 3.17Å; F372-K375 PolarHBondContact O-N 3.48Å; F372-V376 VanDerWaalsContact O-CG2 3.31Å; F372-V376 WeakPolarHBondContact O-CG2 3.25Å; F372-V376 PolarHBondContact O-N 3.48Å; F372-V376 VanDerWaalsContact O-N 3.14Å; F372-L538 HydrophobicContact CZ-CB 4.23Å; F372-L538 HydrophobicContact CZ-CD2 4.08Å; F372-L538 HydrophobicContact CZ-CG 3.89Å; F372-A539 HydrophobicContact CD1-CB 4.21Å; F372-A539 HydrophobicContact CD2-CB 3.67Å; F372-A539 HydrophobicContact CE1-CB 4.36Å; F372-A539 HydrophobicContact CE2-CB 3.84Å; F372-A539 HydrophobicContact CG-CB 3.89Å; F372-A539 HydrophobicContact CZ-CB 4.19Å; F372-L542 HydrophobicContact CE1-CD2 3.99Å
373	I	97.2	Very high	95.9	Very high	21 Å²	21	25 Å²	25	11%	0.108	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-45.4	-179.9	-69.3	170.6	0	0	0	110.8	M369 C377 F643 T647 I651 I652	M369-I373 WeakPolarHBondContact O-CB 3.4Å; M369-I373 WeakPolarHBondContact O-CG1 3.36Å; M369-I373 PolarHBondContact O-N 3.11Å; I373-C377 PolarHBondContact O-SG 2.97Å; I373-F643 HydrophobicContact CG2-CE1 3.9Å; I373-F643 HydrophobicContact CG2-CZ 4.15Å; I373-T647 HydrophobicContact CG2-CG2 3.9Å; I373-I651 HydrophobicContact CD1-CB 4.4Å; I373-I651 HydrophobicContact CD1-CD1 3.94Å; I373-I651 HydrophobicContact CD1-CG2 3.67Å; I373-I652 HydrophobicContact CG2-CD1 4.05Å; I373-I652 HydrophobicContact CG2-CG1 3.9Å
374	A	97.1	Very high	96.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.5	-43.6	-179.6	0	0	0	0	0	111.9	L370 L371 F372 V376 C377 F378 Y430 F434 I652	L370-A374 VanDerWaalsContact O-CB 3.26Å; L370-A374 WeakPolarHBondContact O-CB 3.42Å; L370-A374 PolarHBondContact O-N 2.64Å; L371-A374 PolarHBondContact O-N 3.05Å; F372-A374 PolarHBondContact O-N 3.17Å; A374-V376 PolarHBondContact O-N 3.48Å; A374-C377 WeakPolarHBondContact O-CB 3.03Å; A374-C377 PolarHBondContact O-N 3.41Å; A374-F378 WeakPolarHBondContact O-CD2 3.39Å; A374-F378 WeakPolarHBondContact O-CE2 3.26Å; A374-Y430 HydrophobicContact CB-CE1 4.06Å; A374-F434 HydrophobicContact CB-CD2 4.38Å; A374-F434 HydrophobicContact CB-CE2 4.01Å; A374-I652 HydrophobicContact CB-CD1 4.43Å
375	K	96.1	Very high	96.2	Very high	40 Å²	40	24.9 Å²	24.9	17%	0.174	13%	0.134	C	C	.	.	H	α-helix	trans	-65.9	-36.8	-178.5	-71.6	-73.4	-175.3	166.8	0	113.2	L371 F372 C377 F378 C379 A539	L371-K375 WeakPolarHBondContact O-CB 3.49Å; L371-K375 WeakPolarHBondContact O-CG 3.39Å; L371-K375 PolarHBondContact O-N 3.18Å; F372-K375 PolarHBondContact O-N 3.48Å; K375-C377 PolarHBondContact O-N 3.03Å; K375-F378 PolarHBondContact O-N 3.48Å; K375-C379 PolarHBondContact O-N 3.08Å; K375-A539 HydrophobicContact CB-CB 4.48Å; K375-A539 WeakPolarHBondContact CB-O 3.39Å; K375-A539 HydrophobicContact CG-CB 4.13Å
376	V	97.1	Very high	96.3	Very high	32 Å²	32	20.6 Å²	20.6	19%	0.194	11%	0.114	C	C	.	.	H	α-helix	trans	-54.9	-38	174.3	166.7	0	0	0	0	111.7	F372 A374 F378 C379 P543 F547 C640 F643	F372-V376 VanDerWaalsContact O-CG2 3.31Å; F372-V376 WeakPolarHBondContact O-CG2 3.25Å; F372-V376 PolarHBondContact O-N 3.48Å; F372-V376 VanDerWaalsContact O-N 3.14Å; A374-V376 PolarHBondContact O-N 3.48Å; V376-F378 PolarHBondContact O-N 2.91Å; V376-C379 WeakPolarHBondContact O-CB 3.19Å; V376-C379 PolarHBondContact O-N 3.41Å; V376-P543 HydrophobicContact CG2-CB 4.08Å; V376-P543 HydrophobicContact CG2-CG 3.77Å; V376-F547 HydrophobicContact CG1-CE2 4.05Å; V376-F547 HydrophobicContact CG1-CZ 3.99Å; V376-C640 PolarHBondContact O-SG 2.7Å; V376-F643 HydrophobicContact CB-CE1 4.16Å; V376-F643 HydrophobicContact CG1-CD1 3.95Å; V376-F643 HydrophobicContact CG1-CE1 3.87Å
377	C	97.6	Very high	96.3	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.02	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.4	-176.4	-57.7	0	0	0	0	114	I373 A374 K375 F434 L438 G644	I373-C377 PolarHBondContact O-SG 2.97Å; A374-C377 WeakPolarHBondContact O-CB 3.03Å; A374-C377 PolarHBondContact O-N 3.41Å; K375-C377 PolarHBondContact O-N 3.03Å; C377-F434 HydrophobicContact CB-CE2 4.27Å; C377-F434 HydrophobicContact CB-CZ 3.96Å; C377-L438 HydrophobicContact CB-CD1 4.11Å; C377-G644 WeakPolarHBondContact SG-CA 3.24Å
378	F	97.4	Very high	96.3	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.009	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-3.9	-177.5	-51.2	-67.4	0	0	0	113.1	A374 K375 V376 A381 D382 F434 R437 L438 A441 M508	A374-F378 WeakPolarHBondContact O-CD2 3.39Å; A374-F378 WeakPolarHBondContact O-CE2 3.26Å; K375-F378 PolarHBondContact O-N 3.48Å; V376-F378 PolarHBondContact O-N 2.91Å; F378-A381 PolarHBondContact O-N 2.91Å; F378-A381 VanDerWaalsContact O-N 3.12Å; F378-D382 PolarHBondContact O-N 3.05Å; F378-F434 AromaticContact CE2-CD2 3.7Å; F378-F434 HydrophobicContact CE2-CD2 3.7Å; F378-F434 AromaticContact CE2-CE2 3.52Å; F378-F434 HydrophobicContact CE2-CE2 3.52Å; F378-F434 HydrophobicContact CE2-CZ 4.41Å; F378-F434 AromaticContact CZ-CD2 3.47Å; F378-F434 HydrophobicContact CZ-CD2 3.47Å; F378-F434 VanDerWaalsContact CZ-CD2 3.47Å; F378-F434 AromaticContact CZ-CE2 3.45Å; F378-F434 HydrophobicContact CZ-CE2 3.45Å; F378-F434 VanDerWaalsContact CZ-CE2 3.45Å; F378-F434 HydrophobicContact CZ-CG 4.06Å; F378-F434 HydrophobicContact CZ-CZ 4.05Å; F378-R437 HydrophobicContact CD1-CB 4.47Å; F378-R437 HydrophobicContact CD1-CG 3.77Å; F378-R437 HydrophobicContact CE1-CB 3.77Å; F378-R437 HydrophobicContact CE1-CG 3.55Å; F378-R437 HydrophobicContact CZ-CB 4.22Å; F378-R437 HydrophobicContact CZ-CG 4.2Å; F378-L438 HydrophobicContact CE1-CB 4Å; F378-L438 HydrophobicContact CE1-CD1 4.34Å; F378-A441 HydrophobicContact CD1-CB 4.28Å; F378-M508 HydrophobicContact CE2-CE 3.77Å; F378-M508 HydrophobicContact CE2-SD 4.28Å; F378-M508 HydrophobicContact CZ-CE 4.16Å; F378-M508 HydrophobicContact CZ-SD 4.25Å
379	C	96.8	Very high	96.3	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.007	10%	0.102	C	C	.	.	H	α-helix	trans	-55.8	-47.2	-169.8	-176.9	0	0	0	0	113.8	K375 V376 A381 D382 A383 P543 N544 F547	K375-C379 PolarHBondContact O-N 3.08Å; V376-C379 WeakPolarHBondContact O-CB 3.19Å; V376-C379 PolarHBondContact O-N 3.41Å; C379-A381 VanDerWaalsContact C-N 3.33Å; C379-A381 PolarHBondContact O-N 3.36Å; C379-D382 PolarHBondContact O-N 2.95Å; C379-A383 WeakPolarHBondContact O-CB 3.33Å; C379-A383 PolarHBondContact O-N 3.39Å; C379-P543 HydrophobicContact CB-CB 4.24Å; C379-P543 PolarHBondContact SG-O 3.41Å; C379-N544 VanDerWaalsContact SG-CA 3.58Å; C379-N544 PolarHBondContact SG-OD1 3.22Å; C379-F547 HydrophobicContact CB-CD2 4Å; C379-F547 HydrophobicContact CB-CE2 4.28Å; C379-F547 HydrophobicContact CB-CG 4.2Å; C379-F547 VanDerWaalsContact SG-CD2 3.54Å
380	P	97.2	Very high	96.2	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.013	8%	0.082	C	C	.	.	H	α-helix	trans	-63.6	-39.4	178.7	-23	34.6	0	0	0	112.9	I384 S385 F547 F633 E636 V637 C640	P380-I384 HydrophobicContact CB-CD1 4.41Å; P380-I384 WeakPolarHBondContact O-CA 3.46Å; P380-I384 WeakPolarHBondContact O-CB 3.36Å; P380-I384 PolarHBondContact O-N 2.98Å; P380-S385 PolarHBondContact O-N 2.86Å; P380-F547 HydrophobicContact CG-CD1 3.78Å; P380-F547 HydrophobicContact CG-CE1 3.98Å; P380-F633 HydrophobicContact CB-CD2 4.26Å; P380-F633 HydrophobicContact CB-CE2 4.06Å; P380-E636 HydrophobicContact CB-CB 4.37Å; P380-E636 HydrophobicContact CG-CB 3.91Å; P380-V637 HydrophobicContact CB-CG2 3.66Å; P380-V637 HydrophobicContact CG-CG2 4.4Å; P380-C640 VanDerWaalsContact CD-SG 3.53Å; P380-C640 HydrophobicContact CG-CB 4.32Å
381	A	96.1	Very high	95.9	Very high	10 Å²	10	17.6 Å²	17.6	8%	0.083	10%	0.097	C	C	.	.	H	α-helix	trans	-66	-42.7	177.2	0	0	0	0	0	111.4	F378 C379 S385 A441	F378-A381 PolarHBondContact O-N 2.91Å; F378-A381 VanDerWaalsContact O-N 3.12Å; C379-A381 VanDerWaalsContact C-N 3.33Å; C379-A381 PolarHBondContact O-N 3.36Å; A381-S385 WeakPolarHBondContact O-CB 3.39Å; A381-S385 PolarHBondContact O-OG 3.3Å; A381-A441 HydrophobicContact CB-CB 3.73Å
382	D	95	Very high	95.5	Very high	65 Å²	65	19.2 Å²	19.2	35%	0.348	11%	0.105	S	C	.	.	H	α-helix	trans	-76.9	-38.6	-176.7	-70.5	-10.9	0	0	0	112.9	F378 C379 R437 Y501	F378-D382 PolarHBondContact O-N 3.05Å; C379-D382 PolarHBondContact O-N 2.95Å; D382-R437 IonicContact OD1-NH2 2.57Å; D382-R437 PolarHBondContact OD1-NH2 3.27Å; D382-R437 IonicContact OD2-NH2 3.78Å; D382-R437 PolarHBondContact OD2-NH2 2.98Å; D382-Y501 WeakPolarHBondContact OD1-CE1 3.44Å; D382-Y501 PolarHBondContact OD1-OH 2.97Å
383	A	94.7	Very high	95.2	Very high	20 Å²	20	18.6 Å²	18.6	17%	0.165	11%	0.111	C	C	.	.	H	α-helix	trans	-101	-26	-171.1	0	0	0	0	0	114.8	C379 N544	C379-A383 WeakPolarHBondContact O-CB 3.33Å; C379-A383 PolarHBondContact O-N 3.39Å; A383-N544 HydrophobicContact CB-CB 4.15Å
384	I	96.9	Very high	94.9	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-36.8	-166.5	-55.6	169.1	0	0	0	112.1	Y67 P380 G386 L387 K388 F547 L548 V551 F633 E636	Y67-I384 HydrophobicContact CE1-CG2 3.92Å; P380-I384 HydrophobicContact CB-CD1 4.41Å; P380-I384 WeakPolarHBondContact O-CA 3.46Å; P380-I384 WeakPolarHBondContact O-CB 3.36Å; P380-I384 PolarHBondContact O-N 2.98Å; I384-G386 VanDerWaalsContact C-N 3.34Å; I384-G386 PolarHBondContact O-N 3.19Å; I384-L387 WeakPolarHBondContact O-CA 2.92Å; I384-L387 WeakPolarHBondContact O-CB 3.35Å; I384-L387 PolarHBondContact O-N 3.38Å; I384-K388 HydrophobicContact CG2-CG 3.83Å; I384-K388 PolarHBondContact O-N 2.9Å; I384-F547 HydrophobicContact CD1-CB 4.11Å; I384-L548 HydrophobicContact CG1-CD2 3.95Å; I384-V551 HydrophobicContact CD1-CG2 3.56Å; I384-V551 HydrophobicContact CG1-CG2 4.33Å; I384-V551 HydrophobicContact CG2-CG2 4.26Å; I384-F633 HydrophobicContact CB-CD2 3.84Å; I384-F633 HydrophobicContact CB-CE2 4.16Å; I384-F633 HydrophobicContact CG2-CB 4.25Å; I384-F633 HydrophobicContact CG2-CD2 3.46Å; I384-F633 VanDerWaalsContact CG2-CD2 3.46Å; I384-F633 HydrophobicContact CG2-CE2 4.17Å; I384-F633 HydrophobicContact CG2-CG 4.14Å; I384-E636 WeakPolarHBondContact CD1-OE2 3Å
385	S	96.4	Very high	94.6	Very high	21 Å²	21	18.9 Å²	18.9	15%	0.147	12%	0.115	C	C	.	.	H	α-helix	trans	-55	-44.6	-173	74	0	0	0	0	113.7	P380 A381 L387 K388 L389	P380-S385 PolarHBondContact O-N 2.86Å; A381-S385 WeakPolarHBondContact O-CB 3.39Å; A381-S385 PolarHBondContact O-OG 3.3Å; S385-L387 VanDerWaalsContact C-N 3.34Å; S385-L387 PolarHBondContact O-N 3.36Å; S385-K388 PolarHBondContact O-N 2.97Å; S385-L389 WeakPolarHBondContact O-CG 3.34Å; S385-L389 PolarHBondContact O-N 3.48Å
386	G	95.1	Very high	94.4	Very high	11 Å²	11	18.7 Å²	18.7	11%	0.113	11%	0.113	C	C	.	.	H	α-helix	trans	-62.6	-40.5	176.9	0	0	0	0	0	112.5	I384 L389 I390 L399	I384-G386 VanDerWaalsContact C-N 3.34Å; I384-G386 PolarHBondContact O-N 3.19Å; G386-L389 PolarHBondContact O-N 2.99Å; G386-I390 WeakPolarHBondContact O-CG1 3.35Å; G386-I390 PolarHBondContact O-N 3.47Å; G386-L399 WeakPolarHBondContact O-CD2 3.43Å
387	L	96	Very high	94.1	Very high	8 Å²	8	18 Å²	18	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-67	-39.2	176	-58.1	-176.2	0	0	0	111.4	P55 Y56 Q59 Y67 Q70 I384 S385 L389 I390 E391 L548	P55-L387 HydrophobicContact CB-CD2 4.2Å; Y56-L387 HydrophobicContact CD2-CD2 4.26Å; Y56-L387 HydrophobicContact CE2-CD2 4.38Å; Q59-L387 HydrophobicContact CB-CD2 4.05Å; Q59-L387 HydrophobicContact CG-CB 3.89Å; Q59-L387 HydrophobicContact CG-CD2 4.22Å; Q59-L387 VanDerWaalsContact CG-O 3.24Å; Q59-L387 WeakPolarHBondContact CG-O 3.29Å; Y67-L387 HydrophobicContact CE1-CB 3.97Å; Y67-L387 HydrophobicContact CE1-CD1 4.09Å; Q70-L387 HydrophobicContact CG-CD1 4.34Å; I384-L387 WeakPolarHBondContact O-CA 2.92Å; I384-L387 WeakPolarHBondContact O-CB 3.35Å; I384-L387 PolarHBondContact O-N 3.38Å; S385-L387 VanDerWaalsContact C-N 3.34Å; S385-L387 PolarHBondContact O-N 3.36Å; L387-L389 VanDerWaalsContact C-N 3.34Å; L387-L389 PolarHBondContact O-N 2.81Å; L387-I390 PolarHBondContact O-N 2.59Å; L387-E391 PolarHBondContact O-N 3.07Å; L387-L548 HydrophobicContact CD1-CD2 4.08Å
388	K	95.1	Very high	93.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-37.6	175.6	-79.3	-73.4	169.8	-168.6	0	112.2	Y67 I384 S385 I390 E391 Q392 I448 D631 F633	Y67-K388 VanDerWaalsContact OH-CD 3.3Å; Y67-K388 WeakPolarHBondContact OH-CD 3.35Å; Y67-K388 WeakPolarHBondContact OH-CE 3.39Å; Y67-K388 WeakPolarHBondContact OH-CG 3.4Å; I384-K388 HydrophobicContact CG2-CG 3.83Å; I384-K388 PolarHBondContact O-N 2.9Å; S385-K388 PolarHBondContact O-N 2.97Å; K388-I390 VanDerWaalsContact C-N 3.31Å; K388-I390 PolarHBondContact O-N 3.35Å; K388-E391 WeakPolarHBondContact CD-OE2 3.41Å; K388-E391 WeakPolarHBondContact CE-OE2 3.25Å; K388-E391 IonicContact NZ-OE1 3.62Å; K388-E391 IonicContact NZ-OE2 2.64Å; K388-E391 PolarHBondContact NZ-OE2 3.29Å; K388-E391 WeakPolarHBondContact O-CB 3.37Å; K388-E391 PolarHBondContact O-N 3.42Å; K388-Q392 VanDerWaalsContact O-CG 3.31Å; K388-Q392 WeakPolarHBondContact O-CG 3.29Å; K388-Q392 PolarHBondContact O-N 2.62Å; K388-I448 HydrophobicContact CB-CD1 3.88Å; K388-I448 HydrophobicContact CB-CG1 4.44Å; K388-I448 HydrophobicContact CB-CG2 3.98Å; K388-D631 WeakPolarHBondContact CE-OD1 3.33Å; K388-D631 WeakPolarHBondContact CE-OD2 3.41Å; K388-D631 VanDerWaalsContact NZ-CG 3.27Å; K388-D631 IonicContact NZ-OD1 2.75Å; K388-D631 PolarHBondContact NZ-OD1 3.45Å; K388-D631 IonicContact NZ-OD2 2.79Å; K388-D631 PolarHBondContact NZ-OD2 3.16Å; K388-F633 HydrophobicContact CD-CB 4.24Å; K388-F633 HydrophobicContact CD-CG 4.47Å; K388-F633 HydrophobicContact CG-CB 4.16Å; K388-F633 HydrophobicContact CG-CD1 4.15Å; K388-F633 HydrophobicContact CG-CD2 4.34Å; K388-F633 HydrophobicContact CG-CG 3.95Å
389	L	94.7	Very high	93.6	Very high	6 Å²	6	21 Å²	21	3%	0.031	12%	0.121	C	C	.	.	H	α-helix	trans	-62.9	-39.5	173.4	-71.7	166.1	0	0	0	112.1	S385 G386 L387 Q392 G393 L394 L399 I448 F490 M494	S385-L389 WeakPolarHBondContact O-CG 3.34Å; S385-L389 PolarHBondContact O-N 3.48Å; G386-L389 PolarHBondContact O-N 2.99Å; L387-L389 VanDerWaalsContact C-N 3.34Å; L387-L389 PolarHBondContact O-N 2.81Å; L389-Q392 CarbonylContact O-C 3.58Å; L389-Q392 PolarHBondContact O-N 3.46Å; L389-G393 PolarHBondContact O-N 3.07Å; L389-L394 HydrophobicContact CB-CB 4.32Å; L389-L394 HydrophobicContact CB-CD2 3.96Å; L389-L394 HydrophobicContact CD1-CD2 4.49Å; L389-L394 WeakPolarHBondContact O-CB 3.24Å; L389-L394 PolarHBondContact O-N 3.41Å; L389-L399 HydrophobicContact CD1-CD1 4.33Å; L389-I448 HydrophobicContact CD2-CG1 3.87Å; L389-I448 HydrophobicContact CG-CG1 3.99Å; L389-F490 HydrophobicContact CD2-CZ 4Å; L389-M494 HydrophobicContact CD1-CE 3.36Å; L389-M494 HydrophobicContact CD1-SD 3.63Å; L389-M494 HydrophobicContact CD2-SD 3.84Å; L389-M494 HydrophobicContact CG-SD 4.41Å
390	I	93.3	Very high	93.4	Very high	10 Å²	10	21.3 Å²	21.3	5%	0.051	12%	0.122	C	C	.	.	H	α-helix	trans	-65.8	-41.4	174.3	-62.7	167.5	0	0	0	110.7	Y56 Q59 G386 L387 K388 Q392 G393 L394 R396 L399	Y56-I390 HydrophobicContact CD1-CD1 3.53Å; Y56-I390 HydrophobicContact CE1-CD1 4.01Å; Y56-I390 HydrophobicContact CG-CD1 4.03Å; Q59-I390 HydrophobicContact CB-CB 4.42Å; Q59-I390 HydrophobicContact CB-CG2 4.07Å; Q59-I390 HydrophobicContact CG-CB 3.93Å; Q59-I390 HydrophobicContact CG-CG2 3.93Å; G386-I390 WeakPolarHBondContact O-CG1 3.35Å; G386-I390 PolarHBondContact O-N 3.47Å; L387-I390 PolarHBondContact O-N 2.59Å; K388-I390 VanDerWaalsContact C-N 3.31Å; K388-I390 PolarHBondContact O-N 3.35Å; I390-Q392 PolarHBondContact O-N 3.29Å; I390-G393 WeakPolarHBondContact O-CA 3.47Å; I390-G393 PolarHBondContact O-N 3.47Å; I390-L394 WeakPolarHBondContact CA-O 3.46Å; I390-R396 HydrophobicContact CD1-CB 3.95Å; I390-R396 HydrophobicContact CG1-CB 4.36Å; I390-L399 HydrophobicContact CD1-CD2 4.21Å; I390-L399 HydrophobicContact CG1-CD2 4.13Å
391	E	90.4	Very high	93	Very high	69 Å²	69	27.2 Å²	27.2	32%	0.322	15%	0.148	S	C	.	.	H	α-helix	trans	-58.9	-38.5	173.1	-164.9	-175.3	151.2	0	0	111.5	Y67 L387 K388 G393	Y67-E391 WeakPolarHBondContact CE2-OE2 3.41Å; Y67-E391 PolarHBondContact OH-OE2 3.27Å; L387-E391 PolarHBondContact O-N 3.07Å; K388-E391 WeakPolarHBondContact CD-OE2 3.41Å; K388-E391 WeakPolarHBondContact CE-OE2 3.25Å; K388-E391 IonicContact NZ-OE1 3.62Å; K388-E391 IonicContact NZ-OE2 2.64Å; K388-E391 PolarHBondContact NZ-OE2 3.29Å; K388-E391 WeakPolarHBondContact O-CB 3.37Å; K388-E391 PolarHBondContact O-N 3.42Å; E391-G393 PolarHBondContact O-N 2.88Å; E391-G393 VanDerWaalsContact O-N 3.09Å
392	Q	89.7	Confident	92.8	Very high	36 Å²	36	27.1 Å²	27.1	17%	0.168	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	2.9	171.9	-63.4	-51.8	-33.4	0	0	112.9	K388 L389 I390 I448 A451 P452 K455 F486	K388-Q392 VanDerWaalsContact O-CG 3.31Å; K388-Q392 WeakPolarHBondContact O-CG 3.29Å; K388-Q392 PolarHBondContact O-N 2.62Å; L389-Q392 CarbonylContact O-C 3.58Å; L389-Q392 PolarHBondContact O-N 3.46Å; I390-Q392 PolarHBondContact O-N 3.29Å; Q392-I448 HydrophobicContact CG-CG2 4.17Å; Q392-A451 HydrophobicContact CB-CB 4.25Å; Q392-A451 HydrophobicContact CG-CB 4.36Å; Q392-P452 VanDerWaalsContact OE1-CG 3.28Å; Q392-K455 WeakPolarHBondContact O-CE 3.15Å; Q392-K455 PolarHBondContact O-NZ 3.43Å; Q392-F486 WeakPolarHBondContact O-CZ 3.36Å
393	G	88.5	Confident	92.5	Very high	33 Å²	33	25.7 Å²	25.7	34%	0.34	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	8.4	174.7	0	0	0	0	0	114.7	L389 I390 E391 P395	L389-G393 PolarHBondContact O-N 3.07Å; I390-G393 WeakPolarHBondContact O-CA 3.47Å; I390-G393 PolarHBondContact O-N 3.47Å; E391-G393 PolarHBondContact O-N 2.88Å; E391-G393 VanDerWaalsContact O-N 3.09Å; G393-P395 WeakPolarHBondContact O-CD 3.44Å
394	L	91.2	Very high	92.2	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.152	C	C	.	.			trans	-66.1	124.9	170.6	-173.2	69.2	0	0	0	108.8	L389 I390 R396 L399 F486 Y491	L389-L394 HydrophobicContact CB-CB 4.32Å; L389-L394 HydrophobicContact CB-CD2 3.96Å; L389-L394 HydrophobicContact CD1-CD2 4.49Å; L389-L394 WeakPolarHBondContact O-CB 3.24Å; L389-L394 PolarHBondContact O-N 3.41Å; I390-L394 WeakPolarHBondContact CA-O 3.46Å; L394-R396 PolarHBondContact O-N 3.02Å; L394-L399 HydrophobicContact CD2-CB 4.07Å; L394-L399 HydrophobicContact CD2-CD1 4.2Å; L394-F486 HydrophobicContact CB-CE2 4.23Å; L394-F486 HydrophobicContact CB-CZ 4.47Å; L394-F486 HydrophobicContact CD1-CD2 3.97Å; L394-F486 HydrophobicContact CD1-CE2 4.25Å; L394-F486 HydrophobicContact CD1-CG 4.33Å; L394-Y491 HydrophobicContact CD1-CE1 3.72Å
395	P	91.1	Very high	91.9	Very high	26 Å²	26	31.7 Å²	31.7	17%	0.169	18%	0.177	C	C	.	.			trans	-61.4	131.9	179.6	-21.8	32.5	0	0	0	111.6	G393 E397 K398 L399	G393-P395 WeakPolarHBondContact O-CD 3.44Å; P395-E397 VanDerWaalsContact C-N 3.27Å; P395-E397 HydrophobicContact CB-CG 4.43Å; P395-E397 WeakPolarHBondContact CB-OE1 3.25Å; P395-E397 PolarHBondContact O-N 2.99Å; P395-K398 HydrophobicContact CB-CB 4.49Å; P395-K398 HydrophobicContact CB-CD 4.25Å; P395-K398 HydrophobicContact CB-CG 4.19Å; P395-K398 HydrophobicContact CG-CD 4.01Å; P395-K398 HydrophobicContact CG-CG 4.49Å; P395-K398 PolarHBondContact O-N 3.19Å; P395-L399 PolarHBondContact O-N 2.93Å
396	R	92.1	Very high	91.6	Very high	35 Å²	35	31.3 Å²	31.3	13%	0.132	17%	0.173	C	C	.	.	H	α-helix	trans	-57.1	-40.6	-173.7	62.4	178.3	179.5	-76.7	-11.9	112.1	Y56 S60 M203 E206 I390 L394 K398 L399 V400	Y56-R396 HydrophobicContact CD1-CB 4.46Å; S60-R396 VanDerWaalsContact CB-NH1 3.3Å; S60-R396 PolarHBondContact OG-NH1 2.99Å; M203-R396 HydrophobicContact SD-CG 4.43Å; E206-R396 IonicContact OE1-NH2 3.91Å; E206-R396 IonicContact OE2-CZ 3.55Å; E206-R396 IonicContact OE2-NE 3.7Å; E206-R396 IonicContact OE2-NH2 2.65Å; E206-R396 PolarHBondContact OE2-NH2 3.06Å; I390-R396 HydrophobicContact CD1-CB 3.95Å; I390-R396 HydrophobicContact CG1-CB 4.36Å; L394-R396 PolarHBondContact O-N 3.02Å; R396-K398 VanDerWaalsContact C-N 3.31Å; R396-K398 PolarHBondContact O-N 3.16Å; R396-L399 PolarHBondContact O-N 3.38Å; R396-V400 VanDerWaalsContact O-CG2 3.26Å; R396-V400 WeakPolarHBondContact O-CG2 3.42Å; R396-V400 PolarHBondContact O-N 3.49Å
397	E	90.9	Very high	91.2	Very high	17 Å²	17	32.5 Å²	32.5	8%	0.079	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-33.6	179.7	61.7	-82.8	-171.8	0	0	112.4	I210 P395 F401	I210-E397 HydrophobicContact CD1-CG 4.29Å; I210-E397 HydrophobicContact CG1-CB 4.07Å; I210-E397 HydrophobicContact CG1-CG 3.75Å; P395-E397 VanDerWaalsContact C-N 3.27Å; P395-E397 HydrophobicContact CB-CG 4.43Å; P395-E397 WeakPolarHBondContact CB-OE1 3.25Å; P395-E397 PolarHBondContact O-N 2.99Å; E397-F401 WeakPolarHBondContact O-CB 3.49Å; E397-F401 PolarHBondContact O-N 3.09Å
398	K	90.9	Very high	90.8	Very high	55 Å²	55	35.7 Å²	35.7	24%	0.239	20%	0.198	C	C	.	.	H	α-helix	trans	-72.9	-39.4	176.6	-67.2	-174.5	-175.9	171	0	111.4	P395 R396 V400 F401 I402 Y491	P395-K398 HydrophobicContact CB-CB 4.49Å; P395-K398 HydrophobicContact CB-CD 4.25Å; P395-K398 HydrophobicContact CB-CG 4.19Å; P395-K398 HydrophobicContact CG-CD 4.01Å; P395-K398 HydrophobicContact CG-CG 4.49Å; P395-K398 PolarHBondContact O-N 3.19Å; R396-K398 VanDerWaalsContact C-N 3.31Å; R396-K398 PolarHBondContact O-N 3.16Å; K398-V400 VanDerWaalsContact C-N 3.33Å; K398-F401 PolarHBondContact O-N 2.94Å; K398-I402 WeakPolarHBondContact O-CG1 3.08Å; K398-I402 PolarHBondContact O-N 3.47Å; K398-Y491 HydrophobicContact CB-CE1 4.28Å; K398-Y491 HydrophobicContact CD-CE1 4.11Å; K398-Y491 WeakPolarHBondContact CD-OH 3.23Å
399	L	92.9	Very high	90.5	Very high	14 Å²	14	38.3 Å²	38.3	7%	0.073	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-44	173.8	-178.6	59.8	0	0	0	111.1	Y56 G386 L389 I390 L394 P395 R396 F401 I402 G403 M494	Y56-L399 HydrophobicContact CE1-CD2 3.81Å; Y56-L399 HydrophobicContact CE1-CG 4.28Å; G386-L399 WeakPolarHBondContact O-CD2 3.43Å; L389-L399 HydrophobicContact CD1-CD1 4.33Å; I390-L399 HydrophobicContact CD1-CD2 4.21Å; I390-L399 HydrophobicContact CG1-CD2 4.13Å; L394-L399 HydrophobicContact CD2-CB 4.07Å; L394-L399 HydrophobicContact CD2-CD1 4.2Å; P395-L399 PolarHBondContact O-N 2.93Å; R396-L399 PolarHBondContact O-N 3.38Å; L399-F401 VanDerWaalsContact C-N 3.34Å; L399-F401 PolarHBondContact O-N 3.08Å; L399-I402 WeakPolarHBondContact O-CB 3.32Å; L399-I402 PolarHBondContact O-N 2.89Å; L399-G403 PolarHBondContact O-N 3.42Å; L399-G403 VanDerWaalsContact O-N 3.17Å; L399-M494 HydrophobicContact CD1-CE 4.39Å
400	V	92.4	Very high	90	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-42.6	175.4	171.3	0	0	0	0	111.3	Y56 F199 V200 M203 R396 K398 I402 G403 V404	Y56-V400 HydrophobicContact CD1-CG2 3.95Å; Y56-V400 HydrophobicContact CE1-CG2 4.05Å; F199-V400 HydrophobicContact CE1-CG2 4.26Å; F199-V400 HydrophobicContact CE2-CG2 3.9Å; F199-V400 HydrophobicContact CZ-CG2 3.61Å; V200-V400 HydrophobicContact CB-CG1 4.01Å; V200-V400 HydrophobicContact CG1-CG1 3.95Å; V200-V400 HydrophobicContact CG2-CG1 3.83Å; M203-V400 HydrophobicContact CB-CB 4.48Å; M203-V400 HydrophobicContact CB-CG1 4.22Å; M203-V400 HydrophobicContact CB-CG2 4.25Å; M203-V400 HydrophobicContact CG-CG2 4.09Å; R396-V400 VanDerWaalsContact O-CG2 3.26Å; R396-V400 WeakPolarHBondContact O-CG2 3.42Å; R396-V400 PolarHBondContact O-N 3.49Å; K398-V400 VanDerWaalsContact C-N 3.33Å; V400-I402 VanDerWaalsContact C-N 3.33Å; V400-I402 PolarHBondContact O-N 3.4Å; V400-G403 WeakPolarHBondContact O-CA 3.25Å; V400-G403 PolarHBondContact O-N 3.35Å; V400-G403 VanDerWaalsContact O-N 3.09Å; V400-V404 WeakPolarHBondContact O-CG2 3.24Å; V400-V404 PolarHBondContact O-N 3.43Å
401	F	89.5	Confident	89.5	Confident	126 Å²	126	45.9 Å²	45.9	55%	0.553	25%	0.253	S	S	*	.	H	α-helix	trans	-62.6	-36.6	176.2	-169.4	-96.4	0	0	0	113	E397 K398 L399 G403 V404 L405	E397-F401 WeakPolarHBondContact O-CB 3.49Å; E397-F401 PolarHBondContact O-N 3.09Å; K398-F401 PolarHBondContact O-N 2.94Å; L399-F401 VanDerWaalsContact C-N 3.34Å; L399-F401 PolarHBondContact O-N 3.08Å; F401-G403 VanDerWaalsContact C-N 3.32Å; F401-G403 PolarHBondContact O-N 3.48Å; F401-V404 WeakPolarHBondContact O-CB 3.43Å; F401-V404 PolarHBondContact O-N 3.22Å; F401-L405 PolarHBondContact O-N 3.08Å
402	I	91.5	Very high	89.3	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-42.6	171.9	-68.4	164.9	0	0	0	110.7	K398 L399 V400 V404 L405 L406 Y491 I495 L498	K398-I402 WeakPolarHBondContact O-CG1 3.08Å; K398-I402 PolarHBondContact O-N 3.47Å; L399-I402 WeakPolarHBondContact O-CB 3.32Å; L399-I402 PolarHBondContact O-N 2.89Å; V400-I402 VanDerWaalsContact C-N 3.33Å; V400-I402 PolarHBondContact O-N 3.4Å; I402-V404 VanDerWaalsContact C-N 3.31Å; I402-V404 PolarHBondContact O-N 3.02Å; I402-L405 WeakPolarHBondContact O-CB 3.44Å; I402-L405 PolarHBondContact O-N 3.01Å; I402-L406 WeakPolarHBondContact O-CG 3.34Å; I402-L406 PolarHBondContact O-N 3.29Å; I402-Y491 HydrophobicContact CD1-CD1 4.13Å; I402-I495 HydrophobicContact CB-CG1 4.49Å; I402-I495 HydrophobicContact CD1-CG1 4.36Å; I402-I495 HydrophobicContact CG1-CD1 4.41Å; I402-I495 HydrophobicContact CG1-CG1 4.01Å; I402-I495 HydrophobicContact CG2-CG1 3.79Å; I402-L498 HydrophobicContact CG2-CD1 3.7Å
403	G	88.6	Confident	89.2	Confident	35 Å²	35	46.1 Å²	46.1	36%	0.361	26%	0.257	S	S	.	.	H	α-helix	trans	-57.7	-44.1	174.4	0	0	0	0	0	112.3	L399 V400 F401 L405 L406 L407	L399-G403 PolarHBondContact O-N 3.42Å; L399-G403 VanDerWaalsContact O-N 3.17Å; V400-G403 WeakPolarHBondContact O-CA 3.25Å; V400-G403 PolarHBondContact O-N 3.35Å; V400-G403 VanDerWaalsContact O-N 3.09Å; F401-G403 VanDerWaalsContact C-N 3.32Å; F401-G403 PolarHBondContact O-N 3.48Å; G403-L405 VanDerWaalsContact C-N 3.31Å; G403-L405 PolarHBondContact O-N 2.85Å; G403-L406 PolarHBondContact O-N 3.2Å; G403-L407 PolarHBondContact O-N 2.9Å
404	V	90	Very high	89	Confident	46 Å²	46	46.1 Å²	46.1	28%	0.279	25%	0.251	S	S	.	.	H	α-helix	trans	-59.3	-41.7	175.7	177.5	0	0	0	0	112	V200 V400 F401 I402 L406 L407	V200-V404 HydrophobicContact CB-CG2 4.13Å; V200-V404 HydrophobicContact CG1-CG2 3.27Å; V200-V404 HydrophobicContact CG2-CG2 3.74Å; V400-V404 WeakPolarHBondContact O-CG2 3.24Å; V400-V404 PolarHBondContact O-N 3.43Å; F401-V404 WeakPolarHBondContact O-CB 3.43Å; F401-V404 PolarHBondContact O-N 3.22Å; I402-V404 VanDerWaalsContact C-N 3.31Å; I402-V404 PolarHBondContact O-N 3.02Å; V404-L406 PolarHBondContact O-N 3.48Å; V404-L407 HydrophobicContact CB-CD1 4.37Å; V404-L407 HydrophobicContact CG1-CD1 4.16Å; V404-L407 WeakPolarHBondContact O-CB 3.4Å; V404-L407 PolarHBondContact O-N 3.38Å; V404-L407 VanDerWaalsContact O-N 3.09Å
405	L	89.6	Confident	88.6	Confident	100 Å²	100	51.3 Å²	51.3	52%	0.524	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-25.8	178	-175.7	63.9	0	0	0	112.5	F401 I402 G403 P408 I495	F401-L405 PolarHBondContact O-N 3.08Å; I402-L405 WeakPolarHBondContact O-CB 3.44Å; I402-L405 PolarHBondContact O-N 3.01Å; G403-L405 VanDerWaalsContact C-N 3.31Å; G403-L405 PolarHBondContact O-N 2.85Å; L405-P408 WeakPolarHBondContact O-CD 3.06Å; L405-I495 HydrophobicContact CD2-CD1 4.04Å; L405-I495 HydrophobicContact CD2-CG2 4.37Å
406	L	90.5	Very high	88.4	Confident	13 Å²	13	55.9 Å²	55.9	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-88.4	-10.1	177.8	-60.8	178.2	0	0	0	113.6	I402 G403 V404 L409 E410 L498 A499	I402-L406 WeakPolarHBondContact O-CG 3.34Å; I402-L406 PolarHBondContact O-N 3.29Å; G403-L406 PolarHBondContact O-N 3.2Å; V404-L406 PolarHBondContact O-N 3.48Å; L406-L409 WeakPolarHBondContact O-CA 3.05Å; L406-L409 VanDerWaalsContact O-CB 3.25Å; L406-L409 WeakPolarHBondContact O-CB 3.15Å; L406-L409 PolarHBondContact O-N 2.85Å; L406-E410 PolarHBondContact O-N 3.48Å; L406-E410 VanDerWaalsContact O-N 3.07Å; L406-L498 HydrophobicContact CD1-CB 3.58Å; L406-A499 HydrophobicContact CD2-CB 3.71Å
407	L	85.9	Confident	88	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.188	30%	0.302	C	S	.	.	H	α-helix	trans	-57.5	-41.7	178.1	-68.4	170.4	0	0	0	114.3	L196 G403 V404 L409 E410 V411	L196-L407 HydrophobicContact CD1-CD1 3.53Å; L196-L407 HydrophobicContact CD1-CD2 4.2Å; L196-L407 HydrophobicContact CD2-CD1 3.69Å; L196-L407 HydrophobicContact CD2-CD2 4.08Å; L196-L407 HydrophobicContact CD2-CG 4.45Å; L196-L407 HydrophobicContact CG-CD1 4.27Å; G403-L407 PolarHBondContact O-N 2.9Å; V404-L407 HydrophobicContact CB-CD1 4.37Å; V404-L407 HydrophobicContact CG1-CD1 4.16Å; V404-L407 WeakPolarHBondContact O-CB 3.4Å; V404-L407 PolarHBondContact O-N 3.38Å; V404-L407 VanDerWaalsContact O-N 3.09Å; L407-L409 PolarHBondContact O-N 3.02Å; L407-E410 PolarHBondContact O-N 3.26Å; L407-E410 VanDerWaalsContact O-N 3.11Å; L407-V411 WeakPolarHBondContact O-CG2 3.06Å; L407-V411 PolarHBondContact O-N 3.41Å
408	P	88.1	Confident	87.4	Confident	76 Å²	76	57.2 Å²	57.2	49%	0.494	31%	0.312	S	S	.	.	H	α-helix	trans	-58.6	-36.4	175.1	-24.3	35.3	0	0	0	112.2	L405 V411 I412	L405-P408 WeakPolarHBondContact O-CD 3.06Å; P408-V411 PolarHBondContact O-N 3.45Å; P408-I412 HydrophobicContact CB-CD1 4.44Å; P408-I412 VanDerWaalsContact O-CB 3.24Å; P408-I412 WeakPolarHBondContact O-CB 2.97Å; P408-I412 WeakPolarHBondContact O-CD1 3.5Å; P408-I412 WeakPolarHBondContact O-CG1 3.19Å; P408-I412 PolarHBondContact O-N 2.87Å
409	L	88.8	Confident	86.8	Confident	55 Å²	55	62.5 Å²	62.5	29%	0.288	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-45.3	175	178.7	67	0	0	0	110.6	L406 L407 V411 I412 L413 A499 T502 V503	L406-L409 WeakPolarHBondContact O-CA 3.05Å; L406-L409 VanDerWaalsContact O-CB 3.25Å; L406-L409 WeakPolarHBondContact O-CB 3.15Å; L406-L409 PolarHBondContact O-N 2.85Å; L407-L409 PolarHBondContact O-N 3.02Å; L409-V411 VanDerWaalsContact C-N 3.27Å; L409-V411 PolarHBondContact O-N 2.78Å; L409-I412 PolarHBondContact O-N 3.2Å; L409-L413 WeakPolarHBondContact O-CB 3.46Å; L409-L413 PolarHBondContact O-N 3.04Å; L409-A499 HydrophobicContact CD2-CB 4.18Å; L409-T502 HydrophobicContact CD2-CG2 4.45Å; L409-V503 HydrophobicContact CD1-CG2 4.37Å; L409-V503 HydrophobicContact CD2-CG2 4.17Å
410	E	85	Confident	86	Confident	79 Å²	79	65.7 Å²	65.7	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-63.9	-29.1	178	-68	-180	-175.9	0	0	113.6	L406 L407 P414 T502	L406-E410 PolarHBondContact O-N 3.48Å; L406-E410 VanDerWaalsContact O-N 3.07Å; L407-E410 PolarHBondContact O-N 3.26Å; L407-E410 VanDerWaalsContact O-N 3.11Å; E410-P414 WeakPolarHBondContact O-CD 3.42Å; E410-P414 WeakPolarHBondContact O-CG 3.45Å; E410-T502 HydrophobicContact CG-CG2 3.49Å; E410-T502 VanDerWaalsContact CG-CG2 3.49Å
411	V	82.2	Confident	85.3	Confident	96 Å²	96	65.5 Å²	65.5	58%	0.582	36%	0.357	S	S	*	.	H	α-helix	trans	-84.7	-42.9	177	174.8	0	0	0	0	111.9	L407 P408 L409	L407-V411 WeakPolarHBondContact O-CG2 3.06Å; L407-V411 PolarHBondContact O-N 3.41Å; P408-V411 PolarHBondContact O-N 3.45Å; L409-V411 VanDerWaalsContact C-N 3.27Å; L409-V411 PolarHBondContact O-N 2.78Å
412	I	86.8	Confident	84.6	Confident	90 Å²	90	64.2 Å²	64.2	46%	0.462	36%	0.356	S	S	.	.	H	α-helix	trans	-74.2	-40.7	-176.3	-68.2	166.9	0	0	0	111	P408 L409 L415 L416	P408-I412 HydrophobicContact CB-CD1 4.44Å; P408-I412 VanDerWaalsContact O-CB 3.24Å; P408-I412 WeakPolarHBondContact O-CB 2.97Å; P408-I412 WeakPolarHBondContact O-CD1 3.5Å; P408-I412 WeakPolarHBondContact O-CG1 3.19Å; P408-I412 PolarHBondContact O-N 2.87Å; L409-I412 PolarHBondContact O-N 3.2Å; I412-L415 WeakPolarHBondContact O-CB 3.32Å; I412-L415 PolarHBondContact O-N 3.12Å; I412-L416 HydrophobicContact CG2-CD1 3.77Å; I412-L416 HydrophobicContact CG2-CG 4.05Å; I412-L416 PolarHBondContact O-N 2.87Å
413	L	87.3	Confident	84	Confident	20 Å²	20	65 Å²	65	11%	0.105	37%	0.365	C	S	.	.	H	α-helix	trans	-58.5	-47.7	-173.5	-177.9	66.7	0	0	0	112.8	L409 L415 L416 I417 V503 T506	L409-L413 WeakPolarHBondContact O-CB 3.46Å; L409-L413 PolarHBondContact O-N 3.04Å; L413-L415 VanDerWaalsContact C-N 3.27Å; L413-L415 PolarHBondContact O-N 2.87Å; L413-L416 PolarHBondContact O-N 3Å; L413-L416 VanDerWaalsContact O-N 3.08Å; L413-I417 HydrophobicContact CD1-CG2 3.95Å; L413-I417 HydrophobicContact CG-CD1 4.18Å; L413-I417 WeakPolarHBondContact O-CG1 3.49Å; L413-I417 PolarHBondContact O-N 3.33Å; L413-V503 HydrophobicContact CD2-CB 4.09Å; L413-V503 HydrophobicContact CD2-CG1 4.02Å; L413-V503 HydrophobicContact CD2-CG2 4.08Å; L413-T506 HydrophobicContact CB-CG2 4.39Å; L413-T506 HydrophobicContact CD2-CG2 3.77Å; L413-T506 HydrophobicContact CG-CG2 4.18Å
414	P	83.2	Confident	83.7	Confident	33 Å²	33	68.3 Å²	68.3	21%	0.214	38%	0.381	C	S	.	.	H	α-helix	trans	-52.2	-44.2	172.5	-20.8	25.5	0	0	0	112.9	E410 L416 I417 T418 T506 I510	E410-P414 WeakPolarHBondContact O-CD 3.42Å; E410-P414 WeakPolarHBondContact O-CG 3.45Å; P414-L416 PolarHBondContact O-N 3.12Å; P414-I417 PolarHBondContact O-N 3.29Å; P414-T418 VanDerWaalsContact O-CB 3.24Å; P414-T418 WeakPolarHBondContact O-CB 3.44Å; P414-T418 PolarHBondContact O-N 3.44Å; P414-T418 PolarHBondContact O-OG1 3.5Å; P414-T506 HydrophobicContact CG-CG2 4.08Å; P414-I510 HydrophobicContact CB-CD1 3.61Å; P414-I510 HydrophobicContact CB-CG1 4.15Å; P414-I510 HydrophobicContact CG-CD1 3.81Å; P414-I510 HydrophobicContact CG-CG1 4.38Å
415	L	83.9	Confident	83.7	Confident	111 Å²	111	73.2 Å²	73.2	58%	0.581	39%	0.394	S	S	*	.	H	α-helix	trans	-62.3	-33	-179.1	-58.8	175.7	0	0	0	112.5	I412 L413	I412-L415 WeakPolarHBondContact O-CB 3.32Å; I412-L415 PolarHBondContact O-N 3.12Å; L413-L415 VanDerWaalsContact C-N 3.27Å; L413-L415 PolarHBondContact O-N 2.87Å
416	L	86.2	Confident	83.7	Confident	121 Å²	121	68.8 Å²	68.8	63%	0.634	37%	0.371	S	S	*	.	H	α-helix	trans	-78.6	-39.3	179.6	-63.7	178.2	0	0	0	112.8	I412 L413 P414	I412-L416 HydrophobicContact CG2-CD1 3.77Å; I412-L416 HydrophobicContact CG2-CG 4.05Å; I412-L416 PolarHBondContact O-N 2.87Å; L413-L416 PolarHBondContact O-N 3Å; L413-L416 VanDerWaalsContact O-N 3.08Å; P414-L416 PolarHBondContact O-N 3.12Å
417	I	83.5	Confident	83.9	Confident	33 Å²	33	68.1 Å²	68.1	17%	0.169	37%	0.367	C	S	.	.	H	α-helix	trans	-97.1	-14.5	-171.8	70.1	178.7	0	0	0	114.1	L413 P414 Q419 V420 T421 V507 I510	L413-I417 HydrophobicContact CD1-CG2 3.95Å; L413-I417 HydrophobicContact CG-CD1 4.18Å; L413-I417 WeakPolarHBondContact O-CG1 3.49Å; L413-I417 PolarHBondContact O-N 3.33Å; P414-I417 PolarHBondContact O-N 3.29Å; I417-Q419 PolarHBondContact O-N 3.39Å; I417-Q419 VanDerWaalsContact O-N 3.08Å; I417-V420 WeakPolarHBondContact O-CA 3.46Å; I417-V420 WeakPolarHBondContact O-CB 3.49Å; I417-V420 PolarHBondContact O-N 3.49Å; I417-T421 HydrophobicContact CB-CG2 4.47Å; I417-T421 HydrophobicContact CD1-CG2 4.44Å; I417-T421 HydrophobicContact CG1-CG2 4.32Å; I417-T421 PolarHBondContact O-N 3.28Å; I417-T421 PolarHBondContact O-OG1 3.44Å; I417-V507 HydrophobicContact CD1-CB 4.29Å; I417-V507 HydrophobicContact CD1-CG2 3.55Å; I417-I510 HydrophobicContact CD1-CD1 3.63Å; I417-I510 HydrophobicContact CG1-CD1 3.88Å
418	T	78	Confident	84.3	Confident	48 Å²	48	72 Å²	72	29%	0.294	38%	0.383	S	S	.	.	H	α-helix	trans	-52	-37	-178.3	-69.7	0	0	0	0	112.5	P414 V420 T421 N422	P414-T418 VanDerWaalsContact O-CB 3.24Å; P414-T418 WeakPolarHBondContact O-CB 3.44Å; P414-T418 PolarHBondContact O-N 3.44Å; P414-T418 PolarHBondContact O-OG1 3.5Å; T418-V420 VanDerWaalsContact C-N 3.29Å; T418-V420 PolarHBondContact O-N 3.17Å; T418-T421 VanDerWaalsContact CA-OG1 3.31Å; T418-T421 WeakPolarHBondContact CA-OG1 3.32Å; T418-T421 PolarHBondContact O-N 3.38Å; T418-T421 PolarHBondContact O-OG1 2.87Å; T418-N422 WeakPolarHBondContact CG2-ND2 3.31Å; T418-N422 WeakPolarHBondContact O-CB 3.37Å; T418-N422 PolarHBondContact O-N 3.27Å; T418-N422 VanDerWaalsContact O-N 3.1Å; T418-N422 PolarHBondContact O-ND2 3.31Å
419	Q	77.8	Confident	84.6	Confident	166 Å²	166	71.7 Å²	71.7	78%	0.776	37%	0.372	S	S	*	.	H	α-helix	trans	-63.3	-35.7	178.4	-62.7	-176.2	-3.4	0	0	112.7	I417	I417-Q419 PolarHBondContact O-N 3.39Å; I417-Q419 VanDerWaalsContact O-N 3.08Å
420	V	77.6	Confident	84.9	Confident	81 Å²	81	69.2 Å²	69.2	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-79.9	-38	178.5	-178.7	0	0	0	0	110.4	I417 T418 N422 Y429	I417-V420 WeakPolarHBondContact O-CA 3.46Å; I417-V420 WeakPolarHBondContact O-CB 3.49Å; I417-V420 PolarHBondContact O-N 3.49Å; T418-V420 VanDerWaalsContact C-N 3.29Å; T418-V420 PolarHBondContact O-N 3.17Å; V420-N422 VanDerWaalsContact C-N 3.32Å; V420-N422 PolarHBondContact O-N 2.96Å; V420-Y429 HydrophobicContact CG1-CD1 4.45Å; V420-Y429 HydrophobicContact CG1-CE1 3.64Å; V420-Y429 WeakPolarHBondContact O-CE2 3.44Å; V420-Y429 VanDerWaalsContact O-CZ 3.3Å; V420-Y429 PolarHBondContact O-OH 2.9Å
421	T	78	Confident	85.4	Confident	3 Å²	3	66 Å²	66	2%	0.018	34%	0.344	C	S	.	.	H	α-helix	trans	-85.3	6	-176.3	61.5	0	0	0	0	114.2	I417 T418 L426 I510 T511	I417-T421 HydrophobicContact CB-CG2 4.47Å; I417-T421 HydrophobicContact CD1-CG2 4.44Å; I417-T421 HydrophobicContact CG1-CG2 4.32Å; I417-T421 PolarHBondContact O-N 3.28Å; I417-T421 PolarHBondContact O-OG1 3.44Å; T418-T421 VanDerWaalsContact CA-OG1 3.31Å; T418-T421 WeakPolarHBondContact CA-OG1 3.32Å; T418-T421 PolarHBondContact O-N 3.38Å; T418-T421 PolarHBondContact O-OG1 2.87Å; T421-L426 WeakPolarHBondContact O-CD2 3.41Å; T421-I510 WeakPolarHBondContact OG1-CG2 3.28Å; T421-T511 HydrophobicContact CG2-CG2 3.86Å
422	N	74.2	Confident	86	Confident	99 Å²	99	69.1 Å²	69.1	53%	0.529	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	15.3	174.2	-75	-11.8	0	0	0	113.2	T418 V420 S514	T418-N422 WeakPolarHBondContact CG2-ND2 3.31Å; T418-N422 WeakPolarHBondContact O-CB 3.37Å; T418-N422 PolarHBondContact O-N 3.27Å; T418-N422 VanDerWaalsContact O-N 3.1Å; T418-N422 PolarHBondContact O-ND2 3.31Å; V420-N422 VanDerWaalsContact C-N 3.32Å; V420-N422 PolarHBondContact O-N 2.96Å; N422-S514 PolarHBondContact OD1-OG 2.88Å
423	G	78.8	Confident	86.5	Confident	24 Å²	24	64.8 Å²	64.8	25%	0.247	32%	0.324	C	S	.	.	S	Bend	trans	-71.9	174	176.4	0	0	0	0	0	113.9	R425 L426	G423-R425 VanDerWaalsContact C-N 3.26Å; G423-R425 PolarHBondContact O-N 3.23Å; G423-L426 WeakPolarHBondContact O-CD2 3.46Å; G423-L426 WeakPolarHBondContact O-CG 3.29Å
424	P	81.7	Confident	87	Confident	105 Å²	105	63.9 Å²	63.9	68%	0.682	32%	0.319	S	S	*	.	S	Bend	trans	-66.1	-25.7	-177.7	25.5	-34.4	0	0	0	113.9	K518	P424-K518 PolarHBondContact O-NZ 3.09Å
425	R	89.7	Confident	87.7	Confident	149 Å²	149	66.1 Å²	66.1	56%	0.562	33%	0.329	S	S	*	.			trans	-111.5	85.6	-178.8	-62.3	-173.1	-176.1	-173.7	2.2	110.5	G423 K428 D660	G423-R425 VanDerWaalsContact C-N 3.26Å; G423-R425 PolarHBondContact O-N 3.23Å; R425-K428 HydrophobicContact CB-CB 4.19Å; R425-D660 VanDerWaalsContact C-OD2 3.23Å; R425-D660 WeakPolarHBondContact CA-OD2 3.23Å; R425-D660 HydrophobicContact CB-CB 4.4Å; R425-D660 HydrophobicContact CG-CB 4.43Å
426	L	90.4	Very high	88.3	Confident	6 Å²	6	62.8 Å²	62.8	3%	0.031	31%	0.314	C	S	.	.			trans	-79.7	-42.1	-172	-59.5	172.8	0	0	0	111	T421 G423 K428 Y429 F515 K518 D660	T421-L426 WeakPolarHBondContact O-CD2 3.41Å; G423-L426 WeakPolarHBondContact O-CD2 3.46Å; G423-L426 WeakPolarHBondContact O-CG 3.29Å; L426-K428 PolarHBondContact O-N 3.42Å; L426-Y429 PolarHBondContact O-N 3.06Å; L426-Y429 VanDerWaalsContact O-N 3.14Å; L426-F515 HydrophobicContact CB-CB 4.41Å; L426-F515 HydrophobicContact CB-CD2 4.34Å; L426-F515 HydrophobicContact CD1-CB 4.11Å; L426-F515 HydrophobicContact CD1-CD2 4.22Å; L426-K518 HydrophobicContact CD1-CB 4Å; L426-K518 HydrophobicContact CD1-CD 3.7Å; L426-K518 HydrophobicContact CD1-CG 4.45Å; L426-K518 HydrophobicContact CG-CD 4.5Å; L426-D660 PolarHBondContact N-OD1 3.48Å; L426-D660 PolarHBondContact N-OD2 2.88Å
427	L	94.4	Very high	88.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70.7	-19.7	-178.2	-57.9	176.8	0	0	0	112.4	Y367 Y429 Y430 T431 F515 A656 L659 D660	Y367-L427 HydrophobicContact CE2-CD2 4.14Å; L427-Y429 VanDerWaalsContact C-N 3.29Å; L427-Y429 PolarHBondContact O-N 2.84Å; L427-Y430 WeakPolarHBondContact O-CB 3.38Å; L427-Y430 PolarHBondContact O-N 2.75Å; L427-T431 WeakPolarHBondContact O-CG2 3.38Å; L427-T431 PolarHBondContact O-N 3.15Å; L427-T431 PolarHBondContact O-OG1 2.86Å; L427-F515 HydrophobicContact CD1-CD2 4.11Å; L427-F515 HydrophobicContact CD1-CE1 4.22Å; L427-F515 HydrophobicContact CD1-CE2 3.75Å; L427-F515 HydrophobicContact CD1-CZ 3.82Å; L427-F515 HydrophobicContact CD2-CB 4.24Å; L427-F515 HydrophobicContact CD2-CD1 4.25Å; L427-F515 HydrophobicContact CD2-CD2 4.11Å; L427-F515 HydrophobicContact CD2-CG 3.94Å; L427-F515 HydrophobicContact CG-CD2 3.84Å; L427-F515 HydrophobicContact CG-CE2 3.98Å; L427-F515 HydrophobicContact CG-CG 4.19Å; L427-F515 HydrophobicContact CG-CZ 4.45Å; L427-A656 HydrophobicContact CB-CB 3.87Å; L427-L659 HydrophobicContact CD1-CB 3.68Å; L427-L659 HydrophobicContact CD1-CD1 4.22Å; L427-D660 WeakPolarHBondContact CA-OD2 3.32Å; L427-D660 WeakPolarHBondContact CB-OD2 3.31Å; L427-D660 PolarHBondContact N-OD1 3.45Å; L427-D660 PolarHBondContact N-OD2 3.13Å
428	K	94.3	Very high	89.6	Confident	116 Å²	116	55.9 Å²	55.9	50%	0.504	28%	0.277	S	S	.	.	H	α-helix	trans	-53.4	-46.1	166.6	-176.3	-177.6	176.3	-174.9	0	112	R425 L426 T431 W432 D660	R425-K428 HydrophobicContact CB-CB 4.19Å; L426-K428 PolarHBondContact O-N 3.42Å; K428-T431 PolarHBondContact O-N 3.43Å; K428-T431 PolarHBondContact O-OG1 3.36Å; K428-W432 WeakPolarHBondContact O-CB 3.13Å; K428-W432 PolarHBondContact O-N 3.09Å; K428-D660 PolarHBondContact N-OD2 3.11Å
429	Y	93.9	Very high	90.5	Very high	70 Å²	70	58.9 Å²	58.9	28%	0.275	29%	0.291	S	S	.	.	H	α-helix	trans	-71.7	-33.4	179.1	-61.4	-70.5	0	0	0	112.1	V420 L426 L427 W432 A433	V420-Y429 HydrophobicContact CG1-CD1 4.45Å; V420-Y429 HydrophobicContact CG1-CE1 3.64Å; V420-Y429 WeakPolarHBondContact O-CE2 3.44Å; V420-Y429 VanDerWaalsContact O-CZ 3.3Å; V420-Y429 PolarHBondContact O-OH 2.9Å; L426-Y429 PolarHBondContact O-N 3.06Å; L426-Y429 VanDerWaalsContact O-N 3.14Å; L427-Y429 VanDerWaalsContact C-N 3.29Å; L427-Y429 PolarHBondContact O-N 2.84Å; Y429-W432 PolarHBondContact O-N 3.48Å; Y429-A433 PolarHBondContact O-N 3.32Å
430	Y	95.3	Very high	91.4	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-50.7	171.6	-170.9	-83.5	0	0	0	111.2	L370 A374 L427 W432 A433 F434 M508 T511 Q512	L370-Y430 HydrophobicContact CD2-CE1 4.16Å; A374-Y430 HydrophobicContact CB-CE1 4.06Å; L427-Y430 WeakPolarHBondContact O-CB 3.38Å; L427-Y430 PolarHBondContact O-N 2.75Å; Y430-W432 PolarHBondContact O-N 3.18Å; Y430-A433 PolarHBondContact O-N 2.8Å; Y430-F434 PolarHBondContact O-N 3.26Å; Y430-M508 HydrophobicContact CD1-CE 4.03Å; Y430-M508 HydrophobicContact CD2-CB 3.9Å; Y430-M508 HydrophobicContact CD2-CE 4.36Å; Y430-M508 HydrophobicContact CD2-CG 4.28Å; Y430-M508 VanDerWaalsContact CD2-O 3.29Å; Y430-M508 WeakPolarHBondContact CD2-O 3.43Å; Y430-M508 HydrophobicContact CE1-CE 3.43Å; Y430-M508 VanDerWaalsContact CE1-CE 3.43Å; Y430-M508 HydrophobicContact CE2-CB 3.84Å; Y430-M508 HydrophobicContact CE2-CE 3.82Å; Y430-M508 HydrophobicContact CE2-CG 4.39Å; Y430-M508 WeakPolarHBondContact CE2-O 3.46Å; Y430-M508 HydrophobicContact CG-CE 4.45Å; Y430-T511 WeakPolarHBondContact CD2-OG1 3.46Å; Y430-Q512 HydrophobicContact CE2-CB 4.41Å
431	T	96.8	Very high	92.4	Very high	10 Å²	10	48.2 Å²	48.2	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-31.8	178.2	58.6	0	0	0	0	113.5	L427 K428 F434 F648 I652 L653 A656	L427-T431 WeakPolarHBondContact O-CG2 3.38Å; L427-T431 PolarHBondContact O-N 3.15Å; L427-T431 PolarHBondContact O-OG1 2.86Å; K428-T431 PolarHBondContact O-N 3.43Å; K428-T431 PolarHBondContact O-OG1 3.36Å; T431-F434 WeakPolarHBondContact O-CB 3.35Å; T431-F434 PolarHBondContact O-N 3.19Å; T431-F648 WeakPolarHBondContact O-CE2 3.42Å; T431-I652 HydrophobicContact CG2-CG2 4.18Å; T431-L653 HydrophobicContact CG2-CD1 4.34Å; T431-A656 HydrophobicContact CG2-CB 3.39Å
432	W	95.1	Very high	93.3	Very high	162 Å²	162	49.4 Å²	49.4	61%	0.614	25%	0.245	S	C	*	.	H	α-helix	trans	-64.7	-42.8	174	176.5	85.8	0	0	0	112.1	K428 Y429 Y430 F434 P436 F504	K428-W432 WeakPolarHBondContact O-CB 3.13Å; K428-W432 PolarHBondContact O-N 3.09Å; Y429-W432 PolarHBondContact O-N 3.48Å; Y430-W432 PolarHBondContact O-N 3.18Å; W432-F434 VanDerWaalsContact C-N 3.32Å; W432-P436 WeakPolarHBondContact O-CD 3.42Å; W432-F504 AromaticContact CH2-CE1 3.82Å; W432-F504 HydrophobicContact CH2-CE1 3.82Å; W432-F504 HydrophobicContact CZ3-CD1 4.13Å; W432-F504 AromaticContact CZ3-CE1 3.82Å; W432-F504 HydrophobicContact CZ3-CE1 3.82Å
433	A	96.9	Very high	94.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-75.3	-21.7	178.3	0	0	0	0	0	113.3	Y429 Y430 P436 R437 F504 V507 M508	Y429-A433 PolarHBondContact O-N 3.32Å; Y430-A433 PolarHBondContact O-N 2.8Å; A433-P436 WeakPolarHBondContact O-CD 3.4Å; A433-R437 VanDerWaalsContact O-CB 3.3Å; A433-R437 WeakPolarHBondContact O-CB 3.34Å; A433-R437 PolarHBondContact O-N 3.1Å; A433-R437 VanDerWaalsContact O-N 3.1Å; A433-F504 HydrophobicContact CB-CB 4.36Å; A433-F504 HydrophobicContact CB-CD1 4.07Å; A433-V507 HydrophobicContact CB-CB 3.96Å; A433-V507 HydrophobicContact CB-CG1 3.73Å; A433-M508 HydrophobicContact CB-CG 3.73Å
434	F	98.2	Very high	95.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.5	-53.3	-177.9	-179.1	-84.5	0	0	0	113	A374 C377 F378 Y430 T431 W432 R437 L438 M508 F648 I652	A374-F434 HydrophobicContact CB-CD2 4.38Å; A374-F434 HydrophobicContact CB-CE2 4.01Å; C377-F434 HydrophobicContact CB-CE2 4.27Å; C377-F434 HydrophobicContact CB-CZ 3.96Å; F378-F434 AromaticContact CE2-CD2 3.7Å; F378-F434 HydrophobicContact CE2-CD2 3.7Å; F378-F434 AromaticContact CE2-CE2 3.52Å; F378-F434 HydrophobicContact CE2-CE2 3.52Å; F378-F434 HydrophobicContact CE2-CZ 4.41Å; F378-F434 AromaticContact CZ-CD2 3.47Å; F378-F434 HydrophobicContact CZ-CD2 3.47Å; F378-F434 VanDerWaalsContact CZ-CD2 3.47Å; F378-F434 AromaticContact CZ-CE2 3.45Å; F378-F434 HydrophobicContact CZ-CE2 3.45Å; F378-F434 VanDerWaalsContact CZ-CE2 3.45Å; F378-F434 HydrophobicContact CZ-CG 4.06Å; F378-F434 HydrophobicContact CZ-CZ 4.05Å; Y430-F434 PolarHBondContact O-N 3.26Å; T431-F434 WeakPolarHBondContact O-CB 3.35Å; T431-F434 PolarHBondContact O-N 3.19Å; W432-F434 VanDerWaalsContact C-N 3.32Å; F434-R437 PolarHBondContact O-N 2.92Å; F434-L438 HydrophobicContact CE1-CB 4.48Å; F434-L438 HydrophobicContact CE1-CD2 3.98Å; F434-L438 WeakPolarHBondContact O-CB 3.32Å; F434-L438 PolarHBondContact O-N 3.01Å; F434-M508 HydrophobicContact CB-CE 4.39Å; F434-M508 HydrophobicContact CD2-CE 3.91Å; F434-F648 HydrophobicContact CB-CD2 4.41Å; F434-F648 HydrophobicContact CB-CE2 4.09Å; F434-F648 HydrophobicContact CD1-CB 4.42Å; F434-F648 AromaticContact CD1-CD2 3.24Å; F434-F648 HydrophobicContact CD1-CD2 3.24Å; F434-F648 AromaticContact CD1-CE2 3.7Å; F434-F648 HydrophobicContact CD1-CE2 3.7Å; F434-F648 HydrophobicContact CD1-CG 4.08Å; F434-F648 HydrophobicContact CE1-CB 3.97Å; F434-F648 AromaticContact CE1-CD2 3.63Å; F434-F648 HydrophobicContact CE1-CD2 3.63Å; F434-F648 HydrophobicContact CE1-CG 4.13Å; F434-F648 AromaticContact CG-CD2 3.93Å; F434-F648 HydrophobicContact CG-CD2 3.93Å; F434-F648 HydrophobicContact CG-CE2 4.12Å; F434-I652 HydrophobicContact CD2-CD1 4.24Å; F434-I652 HydrophobicContact CE1-CD1 4.08Å; F434-I652 HydrophobicContact CE2-CD1 3.51Å; F434-I652 HydrophobicContact CZ-CD1 3.41Å; F434-I652 VanDerWaalsContact CZ-CD1 3.41Å
435	L	96.5	Very high	95.8	Very high	81 Å²	81	44.2 Å²	44.2	42%	0.424	21%	0.206	S	C	.	.	H	α-helix	trans	-68.5	-44.3	-172.8	-174.3	66.7	0	0	0	113	R437 L438 L439 L645	L435-R437 VanDerWaalsContact C-N 3.33Å; L435-R437 PolarHBondContact O-N 3.43Å; L435-L438 PolarHBondContact O-N 3.19Å; L435-L439 PolarHBondContact O-N 3.24Å; L435-L645 HydrophobicContact CD1-CD2 4.29Å
436	P	97.7	Very high	96.1	Very high	40 Å²	40	39.6 Å²	39.6	26%	0.26	20%	0.196	S	C	.	.	H	α-helix	trans	-58.9	-41.5	170.6	-25	34.9	0	0	0	112.9	W432 A433 L438 L439 L440 F504	W432-P436 WeakPolarHBondContact O-CD 3.42Å; A433-P436 WeakPolarHBondContact O-CD 3.4Å; P436-L438 VanDerWaalsContact C-N 3.31Å; P436-L438 PolarHBondContact O-N 3.16Å; P436-L439 PolarHBondContact O-N 3.26Å; P436-L440 WeakPolarHBondContact O-CD1 3.36Å; P436-L440 VanDerWaalsContact O-CG 3.3Å; P436-L440 WeakPolarHBondContact O-CG 3.31Å; P436-L440 PolarHBondContact O-N 3.47Å; P436-F504 HydrophobicContact CB-CD1 3.78Å; P436-F504 HydrophobicContact CB-CD2 4.04Å; P436-F504 HydrophobicContact CB-CE1 3.52Å; P436-F504 HydrophobicContact CB-CE2 3.79Å; P436-F504 HydrophobicContact CB-CG 4.03Å; P436-F504 HydrophobicContact CB-CZ 3.52Å; P436-F504 HydrophobicContact CG-CD1 4.22Å; P436-F504 HydrophobicContact CG-CE1 3.81Å; P436-F504 HydrophobicContact CG-CZ 4.17Å
437	R	97.9	Very high	96.4	Very high	8 Å²	8	40.2 Å²	40.2	3%	0.03	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-39.3	175	-171.2	-176.4	173.1	162.8	0.5	111.6	F378 D382 A433 F434 L435 L440 A441 Y501 F504 S505 M508	F378-R437 HydrophobicContact CD1-CB 4.47Å; F378-R437 HydrophobicContact CD1-CG 3.77Å; F378-R437 HydrophobicContact CE1-CB 3.77Å; F378-R437 HydrophobicContact CE1-CG 3.55Å; F378-R437 HydrophobicContact CZ-CB 4.22Å; F378-R437 HydrophobicContact CZ-CG 4.2Å; D382-R437 IonicContact OD1-NH2 2.57Å; D382-R437 PolarHBondContact OD1-NH2 3.27Å; D382-R437 IonicContact OD2-NH2 3.78Å; D382-R437 PolarHBondContact OD2-NH2 2.98Å; A433-R437 VanDerWaalsContact O-CB 3.3Å; A433-R437 WeakPolarHBondContact O-CB 3.34Å; A433-R437 PolarHBondContact O-N 3.1Å; A433-R437 VanDerWaalsContact O-N 3.1Å; F434-R437 PolarHBondContact O-N 2.92Å; L435-R437 VanDerWaalsContact C-N 3.33Å; L435-R437 PolarHBondContact O-N 3.43Å; R437-L440 PolarHBondContact O-N 2.86Å; R437-A441 WeakPolarHBondContact O-CB 3.34Å; R437-A441 PolarHBondContact O-N 3.31Å; R437-Y501 HydrophobicContact CG-CD2 4.18Å; R437-Y501 HydrophobicContact CG-CE2 3.62Å; R437-Y501 PolarHBondContact NE-OH 3.4Å; R437-Y501 PolarHBondContact NH2-OH 3.23Å; R437-F504 HydrophobicContact CB-CB 3.89Å; R437-F504 HydrophobicContact CG-CB 4.49Å; R437-S505 VanDerWaalsContact CZ-OG 3.23Å; R437-S505 PolarHBondContact NH1-OG 3.45Å; R437-S505 PolarHBondContact NH2-OG 2.8Å; R437-M508 HydrophobicContact CB-SD 4.34Å; R437-M508 WeakPolarHBondContact CD-SD 3.38Å
438	L	98.1	Very high	96.4	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-43.7	-179.7	-177.5	62.3	0	0	0	110.5	C377 F378 F434 L435 P436 L440 A441 T442 L641 L645	C377-L438 HydrophobicContact CB-CD1 4.11Å; F378-L438 HydrophobicContact CE1-CB 4Å; F378-L438 HydrophobicContact CE1-CD1 4.34Å; F434-L438 HydrophobicContact CE1-CB 4.48Å; F434-L438 HydrophobicContact CE1-CD2 3.98Å; F434-L438 WeakPolarHBondContact O-CB 3.32Å; F434-L438 PolarHBondContact O-N 3.01Å; L435-L438 PolarHBondContact O-N 3.19Å; P436-L438 VanDerWaalsContact C-N 3.31Å; P436-L438 PolarHBondContact O-N 3.16Å; L438-L440 PolarHBondContact O-N 3.5Å; L438-A441 WeakPolarHBondContact O-CB 3.46Å; L438-A441 PolarHBondContact O-N 2.86Å; L438-T442 WeakPolarHBondContact O-CG2 3.36Å; L438-T442 PolarHBondContact O-N 2.94Å; L438-L641 HydrophobicContact CD2-CD1 4.22Å; L438-L641 HydrophobicContact CG-CD1 4.1Å; L438-L645 HydrophobicContact CD2-CD2 4.49Å
439	L	97	Very high	96.5	Very high	111 Å²	111	40.7 Å²	40.7	58%	0.581	20%	0.198	S	C	*	.	H	α-helix	trans	-58.8	-48.3	173.1	-177.5	69.8	0	0	0	111	L435 P436 A441 T442 L443	L435-L439 PolarHBondContact O-N 3.24Å; P436-L439 PolarHBondContact O-N 3.26Å; L439-A441 VanDerWaalsContact C-N 3.33Å; L439-A441 PolarHBondContact O-N 3.5Å; L439-T442 PolarHBondContact O-N 2.61Å; L439-T442 VanDerWaalsContact O-N 3.13Å; L439-T442 PolarHBondContact O-OG1 3.01Å; L439-L443 PolarHBondContact O-N 2.81Å
440	L	97.5	Very high	96.5	Very high	18 Å²	18	42.1 Å²	42.1	9%	0.094	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-37.9	178.5	-69.2	158.5	0	0	0	111.9	P436 R437 L438 T442 L443 H497 I500 Y501 F504	P436-L440 WeakPolarHBondContact O-CD1 3.36Å; P436-L440 VanDerWaalsContact O-CG 3.3Å; P436-L440 WeakPolarHBondContact O-CG 3.31Å; P436-L440 PolarHBondContact O-N 3.47Å; R437-L440 PolarHBondContact O-N 2.86Å; L438-L440 PolarHBondContact O-N 3.5Å; L440-T442 PolarHBondContact O-N 2.92Å; L440-L443 HydrophobicContact CD2-CD1 4.24Å; L440-L443 WeakPolarHBondContact O-CB 3.44Å; L440-L443 PolarHBondContact O-N 3.18Å; L440-H497 PolarHBondContact O-CE1 2.96Å; L440-I500 HydrophobicContact CD1-CB 4.47Å; L440-I500 HydrophobicContact CD1-CG2 3.63Å; L440-I500 HydrophobicContact CD2-CB 4.34Å; L440-I500 HydrophobicContact CD2-CG2 3.89Å; L440-I500 HydrophobicContact CG-CG2 4.43Å; L440-Y501 HydrophobicContact CB-CD2 3.78Å; L440-F504 HydrophobicContact CD1-CD2 3.44Å; L440-F504 VanDerWaalsContact CD1-CD2 3.44Å; L440-F504 HydrophobicContact CD1-CE2 3.72Å
441	A	97.7	Very high	96.4	Very high	5 Å²	5	42 Å²	42	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-55.7	-40.3	174.1	0	0	0	0	0	111.2	F378 A381 R437 L438 L439 L443 S444 Y501	F378-A441 HydrophobicContact CD1-CB 4.28Å; A381-A441 HydrophobicContact CB-CB 3.73Å; R437-A441 WeakPolarHBondContact O-CB 3.34Å; R437-A441 PolarHBondContact O-N 3.31Å; L438-A441 WeakPolarHBondContact O-CB 3.46Å; L438-A441 PolarHBondContact O-N 2.86Å; L439-A441 VanDerWaalsContact C-N 3.33Å; L439-A441 PolarHBondContact O-N 3.5Å; A441-L443 VanDerWaalsContact C-N 3.34Å; A441-L443 PolarHBondContact O-N 3.37Å; A441-S444 WeakPolarHBondContact O-CB 3.25Å; A441-S444 PolarHBondContact O-N 2.97Å; A441-S444 PolarHBondContact O-OG 3.01Å; A441-Y501 HydrophobicContact CB-CE2 4.06Å
442	T	96.8	Very high	96.1	Very high	28 Å²	28	43.9 Å²	43.9	17%	0.172	22%	0.218	C	C	.	.	H	α-helix	trans	-70.4	-27.5	176.3	67.6	0	0	0	0	113.9	L438 L439 L440 S444 V445 P446 V637 L641	L438-T442 WeakPolarHBondContact O-CG2 3.36Å; L438-T442 PolarHBondContact O-N 2.94Å; L439-T442 PolarHBondContact O-N 2.61Å; L439-T442 VanDerWaalsContact O-N 3.13Å; L439-T442 PolarHBondContact O-OG1 3.01Å; L440-T442 PolarHBondContact O-N 2.92Å; T442-S444 PolarHBondContact O-N 3.01Å; T442-V445 WeakPolarHBondContact O-CB 3.48Å; T442-V445 PolarHBondContact O-N 3.17Å; T442-P446 WeakPolarHBondContact O-CD 3.19Å; T442-V637 HydrophobicContact CG2-CG1 4.17Å; T442-L641 HydrophobicContact CG2-CB 3.91Å; T442-L641 HydrophobicContact CG2-CD1 3.75Å; T442-L641 HydrophobicContact CG2-CD2 3.86Å; T442-L641 HydrophobicContact CG2-CG 4.02Å
443	L	96.2	Very high	95.9	Very high	78 Å²	78	44.6 Å²	44.6	41%	0.408	22%	0.222	S	C	.	.	H	α-helix	trans	-69.5	-9.2	175.6	-65.7	-178.5	0	0	0	113.2	L439 L440 A441 V445 P446 L447	L439-L443 PolarHBondContact O-N 2.81Å; L440-L443 HydrophobicContact CD2-CD1 4.24Å; L440-L443 WeakPolarHBondContact O-CB 3.44Å; L440-L443 PolarHBondContact O-N 3.18Å; A441-L443 VanDerWaalsContact C-N 3.34Å; A441-L443 PolarHBondContact O-N 3.37Å; L443-V445 PolarHBondContact O-N 2.83Å; L443-P446 HydrophobicContact CD2-CG 4.38Å; L443-P446 WeakPolarHBondContact O-CD 3.34Å; L443-P446 WeakPolarHBondContact O-CG 3.4Å; L443-L447 WeakPolarHBondContact O-CB 3.37Å; L443-L447 PolarHBondContact O-N 3.38Å
444	S	95.1	Very high	95.7	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-27.6	167.5	68.2	0	0	0	0	112.4	A441 T442 L447 I448	A441-S444 WeakPolarHBondContact O-CB 3.25Å; A441-S444 PolarHBondContact O-N 2.97Å; A441-S444 PolarHBondContact O-OG 3.01Å; T442-S444 PolarHBondContact O-N 3.01Å; S444-L447 WeakPolarHBondContact O-CB 3.31Å; S444-L447 PolarHBondContact O-N 3.4Å; S444-I448 WeakPolarHBondContact O-CB 3.44Å; S444-I448 WeakPolarHBondContact O-CD1 3.39Å; S444-I448 VanDerWaalsContact O-CG1 3.31Å; S444-I448 WeakPolarHBondContact O-CG1 3.16Å; S444-I448 PolarHBondContact O-N 3.03Å
445	V	97.1	Very high	95.2	Very high	38 Å²	38	51.3 Å²	51.3	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-60.4	178.8	172.3	0	0	0	0	112.1	T442 L443 L447 I448 Y449 F633 Y634 V637	T442-V445 WeakPolarHBondContact O-CB 3.48Å; T442-V445 PolarHBondContact O-N 3.17Å; L443-V445 PolarHBondContact O-N 2.83Å; V445-L447 PolarHBondContact O-N 3.34Å; V445-I448 PolarHBondContact O-N 2.99Å; V445-Y449 VanDerWaalsContact O-CB 3.23Å; V445-Y449 WeakPolarHBondContact O-CB 3.36Å; V445-Y449 PolarHBondContact O-N 3.03Å; V445-F633 HydrophobicContact CG2-CE1 4.47Å; V445-Y634 HydrophobicContact CB-CD1 4.23Å; V445-Y634 HydrophobicContact CB-CE1 4.5Å; V445-Y634 HydrophobicContact CG1-CD1 3.61Å; V445-Y634 HydrophobicContact CG1-CE1 3.93Å; V445-Y634 HydrophobicContact CG1-CG 4.41Å; V445-Y634 HydrophobicContact CG2-CD1 4.05Å; V445-V637 HydrophobicContact CG2-CB 3.83Å; V445-V637 HydrophobicContact CG2-CG1 3.59Å; V445-V637 HydrophobicContact CG2-CG2 4.01Å
446	P	95.9	Very high	94.7	Very high	52 Å²	52	50.8 Å²	50.8	34%	0.338	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-34.3	177.8	24.1	-34.1	0	0	0	111.9	T442 L443 I448 Y449 F450	T442-P446 WeakPolarHBondContact O-CD 3.19Å; L443-P446 HydrophobicContact CD2-CG 4.38Å; L443-P446 WeakPolarHBondContact O-CD 3.34Å; L443-P446 WeakPolarHBondContact O-CG 3.4Å; P446-I448 PolarHBondContact O-N 3.25Å; P446-Y449 PolarHBondContact O-N 3Å; P446-F450 HydrophobicContact CB-CD2 4.05Å; P446-F450 HydrophobicContact CB-CE2 4.12Å; P446-F450 WeakPolarHBondContact O-CB 3.4Å; P446-F450 WeakPolarHBondContact O-CD2 3.5Å; P446-F450 PolarHBondContact O-N 2.87Å
447	L	95.5	Very high	93.3	Very high	18 Å²	18	52.5 Å²	52.5	9%	0.094	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-46.3	177.3	-176.6	61.1	0	0	0	112.1	L443 S444 V445 A451 F490 I493 M494 H497	L443-L447 WeakPolarHBondContact O-CB 3.37Å; L443-L447 PolarHBondContact O-N 3.38Å; S444-L447 WeakPolarHBondContact O-CB 3.31Å; S444-L447 PolarHBondContact O-N 3.4Å; V445-L447 PolarHBondContact O-N 3.34Å; L447-A451 PolarHBondContact O-N 3.28Å; L447-F490 HydrophobicContact CD1-CE2 3.9Å; L447-F490 HydrophobicContact CD1-CZ 4.37Å; L447-I493 HydrophobicContact CD1-CG2 3.82Å; L447-M494 HydrophobicContact CD1-CG 4.13Å; L447-M494 HydrophobicContact CD1-SD 3.69Å; L447-M494 HydrophobicContact CD2-CE 4.17Å; L447-M494 HydrophobicContact CD2-SD 3.42Å; L447-M494 WeakPolarHBondContact CD2-SD 3.29Å; L447-M494 HydrophobicContact CG-SD 3.59Å; L447-M494 VanDerWaalsContact CG-SD 3.59Å; L447-H497 HydrophobicContact CD2-CB 4.31Å
448	I	95.8	Very high	91.3	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-76.1	-44.8	179.1	-69	162.8	0	0	0	111	K388 L389 Q392 S444 V445 P446 F450 A451 F633 Y634	K388-I448 HydrophobicContact CB-CD1 3.88Å; K388-I448 HydrophobicContact CB-CG1 4.44Å; K388-I448 HydrophobicContact CB-CG2 3.98Å; L389-I448 HydrophobicContact CD2-CG1 3.87Å; L389-I448 HydrophobicContact CG-CG1 3.99Å; Q392-I448 HydrophobicContact CG-CG2 4.17Å; S444-I448 WeakPolarHBondContact O-CB 3.44Å; S444-I448 WeakPolarHBondContact O-CD1 3.39Å; S444-I448 VanDerWaalsContact O-CG1 3.31Å; S444-I448 WeakPolarHBondContact O-CG1 3.16Å; S444-I448 PolarHBondContact O-N 3.03Å; V445-I448 PolarHBondContact O-N 2.99Å; P446-I448 PolarHBondContact O-N 3.25Å; I448-F450 VanDerWaalsContact C-N 3.31Å; I448-F450 PolarHBondContact O-N 3.05Å; I448-A451 VanDerWaalsContact O-CB 3.25Å; I448-A451 WeakPolarHBondContact O-CB 3.19Å; I448-A451 PolarHBondContact O-N 3.11Å; I448-A451 VanDerWaalsContact O-N 3.13Å; I448-F633 HydrophobicContact CD1-CD1 4.34Å; I448-F633 HydrophobicContact CD1-CE1 3.41Å; I448-F633 VanDerWaalsContact CD1-CE1 3.41Å; I448-F633 HydrophobicContact CD1-CZ 3.53Å; I448-Y634 HydrophobicContact CG2-CE1 4.44Å
449	Y	94.8	Very high	88.7	Confident	125 Å²	125	61.6 Å²	61.6	49%	0.49	31%	0.307	S	S	.	.	H	α-helix	trans	-59	-41.7	-178.8	-179.5	-93.3	0	0	0	112.2	V445 P446 P452 Y634	V445-Y449 VanDerWaalsContact O-CB 3.23Å; V445-Y449 WeakPolarHBondContact O-CB 3.36Å; V445-Y449 PolarHBondContact O-N 3.03Å; P446-Y449 PolarHBondContact O-N 3Å; Y449-P452 WeakPolarHBondContact O-CD 3.23Å; Y449-Y634 WeakPolarHBondContact CA-OH 3.37Å; Y449-Y634 HydrophobicContact CD2-CE2 4.23Å; Y449-Y634 PolarHBondContact N-OH 3.2Å
450	F	94.7	Very high	86	Confident	101 Å²	101	62 Å²	62	44%	0.443	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.7	179.1	-66	-63.2	0	0	0	114	P446 I448 P452 Y453 F454	P446-F450 HydrophobicContact CB-CD2 4.05Å; P446-F450 HydrophobicContact CB-CE2 4.12Å; P446-F450 WeakPolarHBondContact O-CB 3.4Å; P446-F450 WeakPolarHBondContact O-CD2 3.5Å; P446-F450 PolarHBondContact O-N 2.87Å; I448-F450 VanDerWaalsContact C-N 3.31Å; I448-F450 PolarHBondContact O-N 3.05Å; F450-P452 VanDerWaalsContact C-CD 3.42Å; F450-P452 VanDerWaalsContact C-N 3.34Å; F450-Y453 HydrophobicContact CB-CD2 4.43Å; F450-Y453 AromaticContact CD1-CD2 3.98Å; F450-Y453 HydrophobicContact CD1-CD2 3.98Å; F450-Y453 HydrophobicContact CD1-CE2 4.02Å; F450-Y453 WeakPolarHBondContact O-CB 3.44Å; F450-Y453 PolarHBondContact O-N 3.45Å; F450-Y453 VanDerWaalsContact O-N 3.08Å; F450-F454 HydrophobicContact CB-CE2 4.22Å; F450-F454 VanDerWaalsContact O-CD2 3.26Å; F450-F454 WeakPolarHBondContact O-CD2 3.31Å
451	A	93.7	Very high	83	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-51.9	-43.4	-178.7	0	0	0	0	0	113.6	Q392 L447 I448 Y453 F454 F486 F490	Q392-A451 HydrophobicContact CB-CB 4.25Å; Q392-A451 HydrophobicContact CG-CB 4.36Å; L447-A451 PolarHBondContact O-N 3.28Å; I448-A451 VanDerWaalsContact O-CB 3.25Å; I448-A451 WeakPolarHBondContact O-CB 3.19Å; I448-A451 PolarHBondContact O-N 3.11Å; I448-A451 VanDerWaalsContact O-N 3.13Å; A451-Y453 PolarHBondContact O-N 3.29Å; A451-Y453 VanDerWaalsContact O-N 3.14Å; A451-F454 PolarHBondContact O-N 3.07Å; A451-F486 HydrophobicContact CB-CE1 4.17Å; A451-F486 VanDerWaalsContact O-CE1 3.28Å; A451-F486 WeakPolarHBondContact O-CE1 3.4Å; A451-F490 HydrophobicContact CB-CE1 4.47Å; A451-F490 HydrophobicContact CB-CE2 3.86Å; A451-F490 HydrophobicContact CB-CZ 3.59Å
452	P	89.8	Confident	80.2	Confident	51 Å²	51	71.6 Å²	71.6	33%	0.331	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-56.4	-31.3	179.1	-28.3	38.1	0	0	0	114.8	Q392 Y449 F450 F454 K455	Q392-P452 VanDerWaalsContact OE1-CG 3.28Å; Y449-P452 WeakPolarHBondContact O-CD 3.23Å; F450-P452 VanDerWaalsContact C-CD 3.42Å; F450-P452 VanDerWaalsContact C-N 3.34Å; P452-F454 PolarHBondContact O-N 3.42Å; P452-K455 WeakPolarHBondContact O-CB 3.16Å; P452-K455 WeakPolarHBondContact O-CG 3.28Å; P452-K455 PolarHBondContact O-N 2.98Å
453	Y	90.7	Very high	77.2	Confident	176 Å²	176	77.1 Å²	77.1	69%	0.69	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-71.3	-16.8	-179.5	-64.9	-84.3	0	0	0	113.4	F450 A451	F450-Y453 HydrophobicContact CB-CD2 4.43Å; F450-Y453 AromaticContact CD1-CD2 3.98Å; F450-Y453 HydrophobicContact CD1-CD2 3.98Å; F450-Y453 HydrophobicContact CD1-CE2 4.02Å; F450-Y453 WeakPolarHBondContact O-CB 3.44Å; F450-Y453 PolarHBondContact O-N 3.45Å; F450-Y453 VanDerWaalsContact O-N 3.08Å; A451-Y453 PolarHBondContact O-N 3.29Å; A451-Y453 VanDerWaalsContact O-N 3.14Å
454	F	92.5	Very high	74.6	Confident	55 Å²	55	79.5 Å²	79.5	24%	0.241	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-95	1	176.7	-63.6	-83.7	0	0	0	113.2	F450 A451 P452 I456 F486 S487 L489 F490 I493	F450-F454 HydrophobicContact CB-CE2 4.22Å; F450-F454 VanDerWaalsContact O-CD2 3.26Å; F450-F454 WeakPolarHBondContact O-CD2 3.31Å; A451-F454 PolarHBondContact O-N 3.07Å; P452-F454 PolarHBondContact O-N 3.42Å; F454-I456 PolarHBondContact O-N 3.43Å; F454-F486 HydrophobicContact CB-CD1 4.15Å; F454-F486 CarbonylContact O-C 3.55Å; F454-F486 WeakPolarHBondContact O-CA 3.45Å; F454-S487 PolarHBondContact O-N 3.31Å; F454-L489 HydrophobicContact CE1-CD2 4.17Å; F454-F490 HydrophobicContact CB-CB 3.68Å; F454-F490 HydrophobicContact CB-CD2 4.04Å; F454-F490 HydrophobicContact CB-CG 3.92Å; F454-F490 HydrophobicContact CD1-CB 3.99Å; F454-F490 HydrophobicContact CD2-CB 4.37Å; F454-F490 AromaticContact CD2-CD2 3.51Å; F454-F490 HydrophobicContact CD2-CD2 3.51Å; F454-F490 HydrophobicContact CD2-CE2 4.17Å; F454-F490 HydrophobicContact CD2-CG 4.24Å; F454-F490 HydrophobicContact CE2-CD2 4.06Å; F454-F490 HydrophobicContact CG-CB 3.76Å; F454-F490 AromaticContact CG-CD2 3.79Å; F454-F490 HydrophobicContact CG-CD2 3.79Å; F454-F490 HydrophobicContact CG-CG 4.05Å; F454-I493 HydrophobicContact CZ-CD1 4.48Å
455	K	89	Confident	71.6	Confident	86 Å²	86	89.2 Å²	89.2	37%	0.374	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.3	176.3	-70.4	178.9	178.2	-178.2	0	110.6	Q392 P452 S485 F486	Q392-K455 WeakPolarHBondContact O-CE 3.15Å; Q392-K455 PolarHBondContact O-NZ 3.43Å; P452-K455 WeakPolarHBondContact O-CB 3.16Å; P452-K455 WeakPolarHBondContact O-CG 3.28Å; P452-K455 PolarHBondContact O-N 2.98Å; K455-S485 CarbonylContact C-O 3.57Å; K455-S485 WeakPolarHBondContact CA-O 3.49Å; K455-F486 HydrophobicContact CD-CZ 4.46Å; K455-F486 HydrophobicContact CG-CD1 4.39Å; K455-F486 HydrophobicContact CG-CE1 3.85Å; K455-F486 HydrophobicContact CG-CE2 4.21Å; K455-F486 HydrophobicContact CG-CZ 3.75Å
456	I	84.5	Confident	68.7	Low	71 Å²	71	93.9 Å²	93.9	36%	0.364	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	108	172.2	-56.8	172.5	0	0	0	106.4	F454 S485	F454-I456 PolarHBondContact O-N 3.43Å; I456-S485 PolarHBondContact N-O 3.44Å; I456-S485 PolarHBondContact O-N 3.41Å; I456-S485 VanDerWaalsContact O-N 3.11Å; I456-S485 PolarHBondContact O-OG 2.95Å
457	S	69	Low	65.8	Low	76 Å²	76	97.8 Å²	97.8	53%	0.531	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	102.3	172.5	178.5	0	0	0	0	109	Q459	S457-Q459 PolarHBondContact O-N 3.45Å
458	N	55.5	Low	62.9	Low	89 Å²	89	105 Å²	105	48%	0.476	51%	0.512	S	S	.	.			trans	-81.8	102.9	167.7	-69.4	-16.6	0	0	0	108.1	I460	N458-I460 VanDerWaalsContact C-N 3.26Å; N458-I460 HydrophobicContact CB-CG1 4.25Å; N458-I460 PolarHBondContact O-N 3.5Å
459	Q	43.6	Very low	60	Low	111 Å²	111	110.5 Å²	110.5	52%	0.519	55%	0.545	S	S	.	.			trans	-71.6	86.2	165.1	-67.7	-69.8	-23.6	0	0	107.4	S457 H461	S457-Q459 PolarHBondContact O-N 3.45Å; Q459-H461 VanDerWaalsContact C-N 3.32Å; Q459-H461 PolarHBondContact O-N 3.26Å
460	I	41.7	Very low	57.2	Low	120 Å²	120	112.7 Å²	112.7	62%	0.615	56%	0.564	S	S	*	*			trans	-77.9	91.5	170.8	-59.2	178.5	0	0	0	106.5	N458 S462	N458-I460 VanDerWaalsContact C-N 3.26Å; N458-I460 HydrophobicContact CB-CG1 4.25Å; N458-I460 PolarHBondContact O-N 3.5Å; I460-S462 PolarHBondContact O-N 2.84Å; I460-S462 VanDerWaalsContact O-N 3.07Å
461	H	34.1	Very low	54.4	Low	134 Å²	134	117 Å²	117	62%	0.62	59%	0.586	S	S	*	*			trans	-70.3	94.7	162.3	-78.7	-43.2	0	0	0	108.2	Q459 I463	Q459-H461 VanDerWaalsContact C-N 3.32Å; Q459-H461 PolarHBondContact O-N 3.26Å; H461-I463 VanDerWaalsContact C-N 3.25Å; H461-I463 HydrophobicContact CB-CG1 4.43Å; H461-I463 PolarHBondContact O-N 3.49Å
462	S	38.1	Very low	51.6	Low	91 Å²	91	126.4 Å²	126.4	64%	0.636	63%	0.63	S	S	*	*			trans	-72.6	87.1	162.4	58.3	0	0	0	0	108.4	I460 I464	I460-S462 PolarHBondContact O-N 2.84Å; I460-S462 VanDerWaalsContact O-N 3.07Å; S462-I464 VanDerWaalsContact C-N 3.3Å; S462-I464 PolarHBondContact O-N 2.93Å
463	I	35.1	Very low	49	Very low	143 Å²	143	129.4 Å²	129.4	73%	0.733	65%	0.652	S	S	*	*			trans	-69.9	93.6	166.4	-58.7	174.3	0	0	0	106.6	H461 R465	H461-I463 VanDerWaalsContact C-N 3.25Å; H461-I463 HydrophobicContact CB-CG1 4.43Å; H461-I463 PolarHBondContact O-N 3.49Å; I463-R465 VanDerWaalsContact C-N 3.31Å; I463-R465 PolarHBondContact O-N 2.88Å
464	I	40.3	Very low	46.2	Very low	128 Å²	128	125.1 Å²	125.1	66%	0.656	65%	0.653	S	S	*	*			trans	-70.2	95.7	165.5	-61.1	176.7	0	0	0	106.2	S462 N466	S462-I464 VanDerWaalsContact C-N 3.3Å; S462-I464 PolarHBondContact O-N 2.93Å; I464-N466 VanDerWaalsContact C-N 3.28Å; I464-N466 VanDerWaalsContact CG2-OD1 3.28Å; I464-N466 WeakPolarHBondContact CG2-OD1 3.49Å; I464-N466 PolarHBondContact O-N 3.38Å
465	R	32.5	Very low	43.4	Very low	208 Å²	208	128.6 Å²	128.6	79%	0.785	68%	0.681	S	S	*	*			trans	-72.7	85.2	172.5	-175.2	-179.4	-67.1	173.2	-0.6	108.6	I463 N467	I463-R465 VanDerWaalsContact C-N 3.31Å; I463-R465 PolarHBondContact O-N 2.88Å; R465-N467 PolarHBondContact O-N 3.38Å; R465-N467 VanDerWaalsContact O-N 3.15Å
466	N	37.1	Very low	40.7	Very low	136 Å²	136	132 Å²	132	73%	0.727	70%	0.702	S	S	*	*			trans	-76.8	95.8	165.7	-74.7	-16	0	0	0	108.4	I464 H468	I464-N466 VanDerWaalsContact C-N 3.28Å; I464-N466 VanDerWaalsContact CG2-OD1 3.28Å; I464-N466 WeakPolarHBondContact CG2-OD1 3.49Å; I464-N466 PolarHBondContact O-N 3.38Å; N466-H468 PolarHBondContact O-N 3.44Å
467	N	35.1	Very low	38.2	Very low	134 Å²	134	136.4 Å²	136.4	72%	0.717	73%	0.725	S	S	*	*			trans	-70.2	84.4	158.8	-84.3	-0.4	0	0	0	107.6	R465	R465-N467 PolarHBondContact O-N 3.38Å; R465-N467 VanDerWaalsContact O-N 3.15Å
468	H	34.4	Very low	36.2	Very low	170 Å²	170	139.6 Å²	139.6	79%	0.787	73%	0.732	S	S	*	*			trans	-154.6	105.9	155.5	-101.3	-69.4	0	0	0	110.7	N466	N466-H468 PolarHBondContact O-N 3.44Å
469	T	33.3	Very low	35	Very low	116 Å²	116	139.8 Å²	139.8	71%	0.712	74%	0.74	S	S	*	*			trans	15.7	117	144.5	51.8	0	0	0	0	118.6	E471	T469-E471 PolarHBondContact O-N 2.84Å
470	L	35.9	Very low	34.3	Very low	170 Å²	170	137.9 Å²	137.9	89%	0.89	74%	0.736	S	S	*	*			trans	30.2	86.8	136.4	-72.2	153.8	0	0	0	115.3
471	E	36.8	Very low	34.2	Very low	193 Å²	193	136.2 Å²	136.2	90%	0.902	73%	0.732	S	S	*	*			trans	-166.3	135.4	132	-106.9	161.6	-171.9	0	0	110.6	T469 S473	T469-E471 PolarHBondContact O-N 2.84Å; E471-S473 PolarHBondContact O-N 2.98Å
472	E	34.9	Very low	34.6	Very low	196 Å²	196	133.7 Å²	133.7	92%	0.916	73%	0.726	S	S	*	*			trans	-52	107.9	-173.2	-163.4	167.4	-152.9	0	0	113
473	S	34.8	Very low	35.2	Very low	114 Å²	114	135 Å²	135	80%	0.797	72%	0.722	S	S	*	*			trans	-159.1	111.6	170.8	-76.1	0	0	0	0	113.1	E471	E471-S473 PolarHBondContact O-N 2.98Å
474	A	32.8	Very low	36.6	Very low	86 Å²	86	130.5 Å²	130.5	71%	0.711	71%	0.706	S	S	*	*			trans	51.4	139.8	150.9	0	0	0	0	0	121.1	I476	A474-I476 PolarHBondContact O-N 2.88Å
475	P	32.1	Very low	38.5	Very low	129 Å²	129	125.9 Å²	125.9	84%	0.838	68%	0.684	S	S	*	*			trans	-65.6	124	-178.6	27.4	-32.2	0	0	0	110.7	L477	P475-L477 PolarHBondContact O-N 3.29Å; P475-L477 VanDerWaalsContact O-N 3.09Å
476	I	32.9	Very low	41.2	Very low	158 Å²	158	116.3 Å²	116.3	81%	0.81	65%	0.649	S	S	*	*			trans	-61.3	108.9	175.7	-51.4	163	0	0	0	107.1	A474 E478	A474-I476 PolarHBondContact O-N 2.88Å; I476-E478 VanDerWaalsContact C-N 3.33Å; I476-E478 PolarHBondContact O-N 3.29Å
477	L	32.1	Very low	43.8	Very low	163 Å²	163	111.6 Å²	111.6	85%	0.853	63%	0.627	S	S	*	*			trans	-70	95	169.9	-179.8	66.9	0	0	0	107.5	P475 S479	P475-L477 PolarHBondContact O-N 3.29Å; P475-L477 VanDerWaalsContact O-N 3.09Å; L477-S479 PolarHBondContact O-N 2.9Å
478	E	28.2	Very low	46.5	Very low	143 Å²	143	115.7 Å²	115.7	67%	0.668	63%	0.632	S	S	*	*			trans	-60.1	101.8	170.8	-73	179.6	151.9	0	0	109.2	I476 T480	I476-E478 VanDerWaalsContact C-N 3.33Å; I476-E478 PolarHBondContact O-N 3.29Å; E478-T480 VanDerWaalsContact C-N 3.26Å; E478-T480 PolarHBondContact O-N 3.26Å
479	S	30	Very low	49.3	Very low	92 Å²	92	112.8 Å²	112.8	64%	0.643	62%	0.622	S	S	*	*			trans	-75.6	83.3	167.4	58.2	0	0	0	0	108.5	L477 T481	L477-S479 PolarHBondContact O-N 2.9Å; S479-T481 VanDerWaalsContact C-N 3.33Å; S479-T481 PolarHBondContact O-N 2.77Å
480	T	29	Very low	52.2	Low	72 Å²	72	107.3 Å²	107.3	44%	0.442	59%	0.588	S	S	.	*			trans	-70.7	90.3	169.7	-39.6	0	0	0	0	108.7	E478 T482	E478-T480 VanDerWaalsContact C-N 3.26Å; E478-T480 PolarHBondContact O-N 3.26Å; T480-T482 HydrophobicContact CG2-CG2 3.71Å; T480-T482 PolarHBondContact O-N 3.42Å
481	T	38.2	Very low	55	Low	85 Å²	85	100.3 Å²	100.3	52%	0.521	55%	0.55	S	S	.	.			trans	-72	85.3	165.2	36.3	0	0	0	0	108.2	S479 H483	S479-T481 VanDerWaalsContact C-N 3.33Å; S479-T481 PolarHBondContact O-N 2.77Å; T481-H483 VanDerWaalsContact C-N 3.29Å; T481-H483 PolarHBondContact O-CD2 2.74Å; T481-H483 PolarHBondContact O-N 3.1Å
482	T	42.1	Very low	57.8	Low	81 Å²	81	92.7 Å²	92.7	50%	0.497	52%	0.524	S	S	.	.			trans	-68.6	88.7	172.6	45.4	0	0	0	0	109	T480 A484	T480-T482 HydrophobicContact CG2-CG2 3.71Å; T480-T482 PolarHBondContact O-N 3.42Å; T482-A484 PolarHBondContact O-N 3.15Å
483	H	52.4	Low	60.7	Low	119 Å²	119	86.9 Å²	86.9	55%	0.551	50%	0.498	S	S	*	.			trans	-71.3	87.4	167.5	-73.6	-83.8	0	0	0	108.5	T481 S485	T481-H483 VanDerWaalsContact C-N 3.29Å; T481-H483 PolarHBondContact O-CD2 2.74Å; T481-H483 PolarHBondContact O-N 3.1Å; H483-S485 PolarHBondContact O-N 3.44Å; H483-S485 VanDerWaalsContact O-N 3.13Å
484	A	63.2	Low	63.5	Low	48 Å²	48	81.5 Å²	81.5	40%	0.397	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	113.1	169.1	0	0	0	0	0	108.3	T482	T482-A484 PolarHBondContact O-N 3.15Å
485	S	80.2	Confident	66.5	Low	30 Å²	30	79.7 Å²	79.7	21%	0.21	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	168.3	174.2	65.2	0	0	0	0	109.6	K455 I456 H483	K455-S485 CarbonylContact C-O 3.57Å; K455-S485 WeakPolarHBondContact CA-O 3.49Å; I456-S485 PolarHBondContact N-O 3.44Å; I456-S485 PolarHBondContact O-N 3.41Å; I456-S485 VanDerWaalsContact O-N 3.11Å; I456-S485 PolarHBondContact O-OG 2.95Å; H483-S485 PolarHBondContact O-N 3.44Å; H483-S485 VanDerWaalsContact O-N 3.13Å
486	F	90	Very high	69.5	Low	7 Å²	7	77.3 Å²	77.3	3%	0.031	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	152.3	176.9	-76.3	-106.4	0	0	0	109.2	Q392 L394 A451 F454 K455 F490 Y491	Q392-F486 WeakPolarHBondContact O-CZ 3.36Å; L394-F486 HydrophobicContact CB-CE2 4.23Å; L394-F486 HydrophobicContact CB-CZ 4.47Å; L394-F486 HydrophobicContact CD1-CD2 3.97Å; L394-F486 HydrophobicContact CD1-CE2 4.25Å; L394-F486 HydrophobicContact CD1-CG 4.33Å; A451-F486 HydrophobicContact CB-CE1 4.17Å; A451-F486 VanDerWaalsContact O-CE1 3.28Å; A451-F486 WeakPolarHBondContact O-CE1 3.4Å; F454-F486 HydrophobicContact CB-CD1 4.15Å; F454-F486 CarbonylContact O-C 3.55Å; F454-F486 WeakPolarHBondContact O-CA 3.45Å; K455-F486 HydrophobicContact CD-CZ 4.46Å; K455-F486 HydrophobicContact CG-CD1 4.39Å; K455-F486 HydrophobicContact CG-CE1 3.85Å; K455-F486 HydrophobicContact CG-CE2 4.21Å; K455-F486 HydrophobicContact CG-CZ 3.75Å; F486-F490 HydrophobicContact CB-CD1 4Å; F486-F490 AromaticContact CD1-CD1 3.46Å; F486-F490 HydrophobicContact CD1-CD1 3.46Å; F486-F490 VanDerWaalsContact CD1-CD1 3.46Å; F486-F490 AromaticContact CD1-CE1 3.67Å; F486-F490 HydrophobicContact CD1-CE1 3.67Å; F486-F490 HydrophobicContact CD1-CG 4.09Å; F486-F490 HydrophobicContact CD1-CZ 4.45Å; F486-F490 HydrophobicContact CE1-CD1 4.22Å; F486-F490 AromaticContact CE1-CE1 3.97Å; F486-F490 HydrophobicContact CE1-CE1 3.97Å; F486-F490 HydrophobicContact CE1-CZ 4.46Å; F486-F490 AromaticContact CG-CD1 3.99Å; F486-F490 HydrophobicContact CG-CD1 3.99Å; F486-F490 HydrophobicContact CG-CE1 4.37Å; F486-Y491 HydrophobicContact CB-CD2 4.41Å; F486-Y491 HydrophobicContact CB-CE2 3.72Å; F486-Y491 VanDerWaalsContact O-CE2 3.32Å; F486-Y491 WeakPolarHBondContact O-CE2 3.36Å
487	S	91.6	Very high	72.6	Confident	38 Å²	38	71.1 Å²	71.1	27%	0.266	39%	0.391	S	S	.	.			trans	-59.1	142.1	172.9	178.6	0	0	0	0	111.8	F454 L489 F490 Y491	F454-S487 PolarHBondContact O-N 3.31Å; S487-L489 PolarHBondContact O-N 2.96Å; S487-L489 VanDerWaalsContact O-N 3.16Å; S487-L489 PolarHBondContact OG-N 3.47Å; S487-F490 WeakPolarHBondContact O-CB 3.31Å; S487-F490 PolarHBondContact O-N 3Å; S487-Y491 WeakPolarHBondContact O-CD2 3.34Å; S487-Y491 PolarHBondContact O-N 3.33Å
488	W	91.1	Very high	75.6	Confident	219 Å²	219	65.2 Å²	65.2	83%	0.83	36%	0.36	S	S	*	.	H	α-helix	trans	-55.2	-30.9	173.2	-73.7	112.5	0	0	0	113.1	F490 Y491 G492	W488-F490 VanDerWaalsContact C-N 3.3Å; W488-F490 PolarHBondContact O-N 3.22Å; W488-Y491 HydrophobicContact CE3-CD2 4.18Å; W488-Y491 PolarHBondContact O-N 3.47Å; W488-G492 PolarHBondContact O-N 3.5Å
489	L	93.5	Very high	78.8	Confident	110 Å²	110	59.5 Å²	59.5	58%	0.576	34%	0.337	S	S	*	.	H	α-helix	trans	-59.5	-42.6	173.9	-180	64	0	0	0	111.5	F454 S487 G492 I493	F454-L489 HydrophobicContact CE1-CD2 4.17Å; S487-L489 PolarHBondContact O-N 2.96Å; S487-L489 VanDerWaalsContact O-N 3.16Å; S487-L489 PolarHBondContact OG-N 3.47Å; L489-G492 PolarHBondContact O-N 3.3Å; L489-I493 HydrophobicContact CD1-CD1 4.44Å; L489-I493 HydrophobicContact CG-CD1 4.09Å; L489-I493 WeakPolarHBondContact O-CG1 3.35Å; L489-I493 PolarHBondContact O-N 2.97Å
490	F	94.7	Very high	81.9	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-43.5	178.7	-177.7	-105.5	0	0	0	111.5	L389 L447 A451 F454 F486 S487 W488 G492 I493 M494	L389-F490 HydrophobicContact CD2-CZ 4Å; L447-F490 HydrophobicContact CD1-CE2 3.9Å; L447-F490 HydrophobicContact CD1-CZ 4.37Å; A451-F490 HydrophobicContact CB-CE1 4.47Å; A451-F490 HydrophobicContact CB-CE2 3.86Å; A451-F490 HydrophobicContact CB-CZ 3.59Å; F454-F490 HydrophobicContact CB-CB 3.68Å; F454-F490 HydrophobicContact CB-CD2 4.04Å; F454-F490 HydrophobicContact CB-CG 3.92Å; F454-F490 HydrophobicContact CD1-CB 3.99Å; F454-F490 HydrophobicContact CD2-CB 4.37Å; F454-F490 AromaticContact CD2-CD2 3.51Å; F454-F490 HydrophobicContact CD2-CD2 3.51Å; F454-F490 HydrophobicContact CD2-CE2 4.17Å; F454-F490 HydrophobicContact CD2-CG 4.24Å; F454-F490 HydrophobicContact CE2-CD2 4.06Å; F454-F490 HydrophobicContact CG-CB 3.76Å; F454-F490 AromaticContact CG-CD2 3.79Å; F454-F490 HydrophobicContact CG-CD2 3.79Å; F454-F490 HydrophobicContact CG-CG 4.05Å; F486-F490 HydrophobicContact CB-CD1 4Å; F486-F490 AromaticContact CD1-CD1 3.46Å; F486-F490 HydrophobicContact CD1-CD1 3.46Å; F486-F490 VanDerWaalsContact CD1-CD1 3.46Å; F486-F490 AromaticContact CD1-CE1 3.67Å; F486-F490 HydrophobicContact CD1-CE1 3.67Å; F486-F490 HydrophobicContact CD1-CG 4.09Å; F486-F490 HydrophobicContact CD1-CZ 4.45Å; F486-F490 HydrophobicContact CE1-CD1 4.22Å; F486-F490 AromaticContact CE1-CE1 3.97Å; F486-F490 HydrophobicContact CE1-CE1 3.97Å; F486-F490 HydrophobicContact CE1-CZ 4.46Å; F486-F490 AromaticContact CG-CD1 3.99Å; F486-F490 HydrophobicContact CG-CD1 3.99Å; F486-F490 HydrophobicContact CG-CE1 4.37Å; S487-F490 WeakPolarHBondContact O-CB 3.31Å; S487-F490 PolarHBondContact O-N 3Å; W488-F490 VanDerWaalsContact C-N 3.3Å; W488-F490 PolarHBondContact O-N 3.22Å; F490-G492 VanDerWaalsContact C-N 3.3Å; F490-G492 PolarHBondContact O-N 3.33Å; F490-I493 PolarHBondContact O-N 3.35Å; F490-M494 HydrophobicContact CD1-CG 4.09Å; F490-M494 HydrophobicContact CE1-CG 3.73Å; F490-M494 HydrophobicContact CE1-SD 4.24Å; F490-M494 HydrophobicContact CE2-CG 4.4Å; F490-M494 HydrophobicContact CZ-CG 3.9Å; F490-M494 HydrophobicContact CZ-SD 3.99Å; F490-M494 WeakPolarHBondContact O-CB 3.49Å; F490-M494 WeakPolarHBondContact O-CG 3.35Å; F490-M494 PolarHBondContact O-N 2.92Å
491	Y	94.2	Very high	85.1	Confident	22 Å²	22	56.7 Å²	56.7	9%	0.086	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-41	172.8	-69.7	-73.3	0	0	0	112	L394 K398 I402 F486 S487 W488 M494 I495	L394-Y491 HydrophobicContact CD1-CE1 3.72Å; K398-Y491 HydrophobicContact CB-CE1 4.28Å; K398-Y491 HydrophobicContact CD-CE1 4.11Å; K398-Y491 WeakPolarHBondContact CD-OH 3.23Å; I402-Y491 HydrophobicContact CD1-CD1 4.13Å; F486-Y491 HydrophobicContact CB-CD2 4.41Å; F486-Y491 HydrophobicContact CB-CE2 3.72Å; F486-Y491 VanDerWaalsContact O-CE2 3.32Å; F486-Y491 WeakPolarHBondContact O-CE2 3.36Å; S487-Y491 WeakPolarHBondContact O-CD2 3.34Å; S487-Y491 PolarHBondContact O-N 3.33Å; W488-Y491 HydrophobicContact CE3-CD2 4.18Å; W488-Y491 PolarHBondContact O-N 3.47Å; Y491-M494 WeakPolarHBondContact O-CB 3.29Å; Y491-M494 PolarHBondContact O-N 3.35Å; Y491-I495 WeakPolarHBondContact O-CB 3.39Å; Y491-I495 WeakPolarHBondContact O-CD1 3.33Å; Y491-I495 VanDerWaalsContact O-CG1 3.23Å; Y491-I495 WeakPolarHBondContact O-CG1 3.33Å; Y491-I495 PolarHBondContact O-N 2.61Å
492	G	95.2	Very high	87.8	Confident	34 Å²	34	53.5 Å²	53.5	35%	0.351	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-46.4	174.6	0	0	0	0	0	112.8	W488 L489 F490 I495 C496	W488-G492 PolarHBondContact O-N 3.5Å; L489-G492 PolarHBondContact O-N 3.3Å; F490-G492 VanDerWaalsContact C-N 3.3Å; F490-G492 PolarHBondContact O-N 3.33Å; G492-I495 PolarHBondContact O-N 3.48Å; G492-C496 WeakPolarHBondContact O-CB 3.46Å; G492-C496 PolarHBondContact O-N 2.9Å; G492-C496 PolarHBondContact O-SG 3.49Å
493	I	95.9	Very high	90.3	Very high	73 Å²	73	51.8 Å²	51.8	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-46.9	176.5	-66.2	165.7	0	0	0	110.6	L447 F454 L489 F490 C496 H497	L447-I493 HydrophobicContact CD1-CG2 3.82Å; F454-I493 HydrophobicContact CZ-CD1 4.48Å; L489-I493 HydrophobicContact CD1-CD1 4.44Å; L489-I493 HydrophobicContact CG-CD1 4.09Å; L489-I493 WeakPolarHBondContact O-CG1 3.35Å; L489-I493 PolarHBondContact O-N 2.97Å; F490-I493 PolarHBondContact O-N 3.35Å; I493-C496 PolarHBondContact O-N 3.48Å; I493-H497 VanDerWaalsContact O-CB 3.31Å; I493-H497 WeakPolarHBondContact O-CB 3.43Å; I493-H497 PolarHBondContact O-N 3.36Å
494	M	94.9	Very high	92.3	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-55.8	-51.8	176.4	-82.2	-68.9	-36.3	0	0	112	L389 L399 L447 F490 Y491 H497 L498	L389-M494 HydrophobicContact CD1-CE 3.36Å; L389-M494 HydrophobicContact CD1-SD 3.63Å; L389-M494 HydrophobicContact CD2-SD 3.84Å; L389-M494 HydrophobicContact CG-SD 4.41Å; L399-M494 HydrophobicContact CD1-CE 4.39Å; L447-M494 HydrophobicContact CD1-CG 4.13Å; L447-M494 HydrophobicContact CD1-SD 3.69Å; L447-M494 HydrophobicContact CD2-CE 4.17Å; L447-M494 HydrophobicContact CD2-SD 3.42Å; L447-M494 WeakPolarHBondContact CD2-SD 3.29Å; L447-M494 HydrophobicContact CG-SD 3.59Å; L447-M494 VanDerWaalsContact CG-SD 3.59Å; F490-M494 HydrophobicContact CD1-CG 4.09Å; F490-M494 HydrophobicContact CE1-CG 3.73Å; F490-M494 HydrophobicContact CE1-SD 4.24Å; F490-M494 HydrophobicContact CE2-CG 4.4Å; F490-M494 HydrophobicContact CZ-CG 3.9Å; F490-M494 HydrophobicContact CZ-SD 3.99Å; F490-M494 WeakPolarHBondContact O-CB 3.49Å; F490-M494 WeakPolarHBondContact O-CG 3.35Å; F490-M494 PolarHBondContact O-N 2.92Å; Y491-M494 WeakPolarHBondContact O-CB 3.29Å; Y491-M494 PolarHBondContact O-N 3.35Å; M494-H497 PolarHBondContact O-N 2.92Å; M494-L498 HydrophobicContact CE-CD1 3.65Å; M494-L498 HydrophobicContact CE-CG 4.13Å; M494-L498 WeakPolarHBondContact O-CB 3.37Å; M494-L498 WeakPolarHBondContact O-CG 3.28Å; M494-L498 PolarHBondContact O-N 3.3Å
495	I	95.5	Very high	93.8	Very high	49 Å²	49	47 Å²	47	25%	0.251	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-45.7	-179.6	-69.9	163.3	0	0	0	110.4	I402 L405 Y491 G492 L498 A499	I402-I495 HydrophobicContact CB-CG1 4.49Å; I402-I495 HydrophobicContact CD1-CG1 4.36Å; I402-I495 HydrophobicContact CG1-CD1 4.41Å; I402-I495 HydrophobicContact CG1-CG1 4.01Å; I402-I495 HydrophobicContact CG2-CG1 3.79Å; L405-I495 HydrophobicContact CD2-CD1 4.04Å; L405-I495 HydrophobicContact CD2-CG2 4.37Å; Y491-I495 WeakPolarHBondContact O-CB 3.39Å; Y491-I495 WeakPolarHBondContact O-CD1 3.33Å; Y491-I495 VanDerWaalsContact O-CG1 3.23Å; Y491-I495 WeakPolarHBondContact O-CG1 3.33Å; Y491-I495 PolarHBondContact O-N 2.61Å; G492-I495 PolarHBondContact O-N 3.48Å; I495-L498 PolarHBondContact O-N 2.67Å; I495-A499 WeakPolarHBondContact O-CB 3.13Å; I495-A499 PolarHBondContact O-N 3.41Å
496	C	96	Very high	94.3	Very high	78 Å²	78	46.3 Å²	46.3	53%	0.527	25%	0.247	S	C	.	.	H	α-helix	trans	-61.4	-46.9	177.7	-73.6	0	0	0	0	112	G492 I493 A499 I500	G492-C496 WeakPolarHBondContact O-CB 3.46Å; G492-C496 PolarHBondContact O-N 2.9Å; G492-C496 PolarHBondContact O-SG 3.49Å; I493-C496 PolarHBondContact O-N 3.48Å; C496-A499 PolarHBondContact O-N 3.11Å; C496-I500 VanDerWaalsContact O-CG1 3.25Å; C496-I500 WeakPolarHBondContact O-CG1 3.4Å; C496-I500 PolarHBondContact O-N 3.46Å; C496-I500 VanDerWaalsContact O-N 3.08Å
497	H	96.3	Very high	94.5	Very high	28 Å²	28	46.6 Å²	46.6	13%	0.13	25%	0.249	C	C	.	.	H	α-helix	trans	-59.1	-51.3	177.8	172.2	81.4	0	0	0	111.6	L440 L447 I493 M494 I500 Y501	L440-H497 PolarHBondContact O-CE1 2.96Å; L447-H497 HydrophobicContact CD2-CB 4.31Å; I493-H497 VanDerWaalsContact O-CB 3.31Å; I493-H497 WeakPolarHBondContact O-CB 3.43Å; I493-H497 PolarHBondContact O-N 3.36Å; M494-H497 PolarHBondContact O-N 2.92Å; H497-I500 PolarHBondContact O-N 3.28Å; H497-Y501 WeakPolarHBondContact O-CB 3.25Å; H497-Y501 PolarHBondContact O-N 2.83Å
498	L	95	Very high	94.6	Very high	39 Å²	39	45 Å²	45	20%	0.204	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-41.4	179.8	-71.7	173.2	0	0	0	111.7	I402 L406 M494 I495 I500 Y501 T502	I402-L498 HydrophobicContact CG2-CD1 3.7Å; L406-L498 HydrophobicContact CD1-CB 3.58Å; M494-L498 HydrophobicContact CE-CD1 3.65Å; M494-L498 HydrophobicContact CE-CG 4.13Å; M494-L498 WeakPolarHBondContact O-CB 3.37Å; M494-L498 WeakPolarHBondContact O-CG 3.28Å; M494-L498 PolarHBondContact O-N 3.3Å; I495-L498 PolarHBondContact O-N 2.67Å; L498-I500 PolarHBondContact O-N 2.82Å; L498-Y501 PolarHBondContact O-N 2.96Å; L498-T502 VanDerWaalsContact O-CB 3.29Å; L498-T502 WeakPolarHBondContact O-CB 3.47Å; L498-T502 PolarHBondContact O-N 3.34Å; L498-T502 PolarHBondContact O-OG1 2.83Å
499	A	95.5	Very high	94.6	Very high	23 Å²	23	40.1 Å²	40.1	19%	0.19	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-47.6	176.9	0	0	0	0	0	111.7	L406 L409 I495 C496 T502 V503	L406-A499 HydrophobicContact CD2-CB 3.71Å; L409-A499 HydrophobicContact CD2-CB 4.18Å; I495-A499 WeakPolarHBondContact O-CB 3.13Å; I495-A499 PolarHBondContact O-N 3.41Å; C496-A499 PolarHBondContact O-N 3.11Å; A499-T502 PolarHBondContact O-N 3.48Å; A499-V503 WeakPolarHBondContact O-CG2 3.38Å; A499-V503 PolarHBondContact O-N 2.91Å; A499-V503 VanDerWaalsContact O-N 3.14Å
500	I	96.1	Very high	94.3	Very high	86 Å²	86	35.6 Å²	35.6	44%	0.441	20%	0.199	S	C	.	.	H	α-helix	trans	-67.1	-42.2	179.2	-59.3	166.3	0	0	0	110.4	L440 C496 H497 L498 T502 V503 F504	L440-I500 HydrophobicContact CD1-CB 4.47Å; L440-I500 HydrophobicContact CD1-CG2 3.63Å; L440-I500 HydrophobicContact CD2-CB 4.34Å; L440-I500 HydrophobicContact CD2-CG2 3.89Å; L440-I500 HydrophobicContact CG-CG2 4.43Å; C496-I500 VanDerWaalsContact O-CG1 3.25Å; C496-I500 WeakPolarHBondContact O-CG1 3.4Å; C496-I500 PolarHBondContact O-N 3.46Å; C496-I500 VanDerWaalsContact O-N 3.08Å; H497-I500 PolarHBondContact O-N 3.28Å; L498-I500 PolarHBondContact O-N 2.82Å; I500-T502 VanDerWaalsContact C-N 3.34Å; I500-T502 PolarHBondContact O-N 3.47Å; I500-V503 PolarHBondContact O-N 3.36Å; I500-F504 HydrophobicContact CG2-CD2 4.34Å; I500-F504 HydrophobicContact CG2-CE2 3.89Å; I500-F504 VanDerWaalsContact O-CD2 3.32Å; I500-F504 WeakPolarHBondContact O-CD2 3.25Å
501	Y	96.4	Very high	94.1	Very high	20 Å²	20	35.6 Å²	35.6	8%	0.078	20%	0.199	C	C	.	.	H	α-helix	trans	-58.7	-45.6	175.6	-174.2	-98.8	0	0	0	111.9	D382 R437 L440 A441 H497 L498 V503 F504 S505	D382-Y501 WeakPolarHBondContact OD1-CE1 3.44Å; D382-Y501 PolarHBondContact OD1-OH 2.97Å; R437-Y501 HydrophobicContact CG-CD2 4.18Å; R437-Y501 HydrophobicContact CG-CE2 3.62Å; R437-Y501 PolarHBondContact NE-OH 3.4Å; R437-Y501 PolarHBondContact NH2-OH 3.23Å; L440-Y501 HydrophobicContact CB-CD2 3.78Å; A441-Y501 HydrophobicContact CB-CE2 4.06Å; H497-Y501 WeakPolarHBondContact O-CB 3.25Å; H497-Y501 PolarHBondContact O-N 2.83Å; L498-Y501 PolarHBondContact O-N 2.96Å; Y501-V503 VanDerWaalsContact C-N 3.3Å; Y501-V503 PolarHBondContact O-N 3.07Å; Y501-F504 PolarHBondContact O-N 2.91Å; Y501-S505 WeakPolarHBondContact O-CB 3.3Å; Y501-S505 PolarHBondContact O-N 3.44Å
502	T	94	Very high	94	Very high	17 Å²	17	35 Å²	35	10%	0.104	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-36.2	178.1	-68.1	0	0	0	0	112.1	L409 E410 L498 A499 I500 S505 T506	L409-T502 HydrophobicContact CD2-CG2 4.45Å; E410-T502 HydrophobicContact CG-CG2 3.49Å; E410-T502 VanDerWaalsContact CG-CG2 3.49Å; L498-T502 VanDerWaalsContact O-CB 3.29Å; L498-T502 WeakPolarHBondContact O-CB 3.47Å; L498-T502 PolarHBondContact O-N 3.34Å; L498-T502 PolarHBondContact O-OG1 2.83Å; A499-T502 PolarHBondContact O-N 3.48Å; I500-T502 VanDerWaalsContact C-N 3.34Å; I500-T502 PolarHBondContact O-N 3.47Å; T502-S505 PolarHBondContact O-N 3.18Å; T502-T506 VanDerWaalsContact O-CB 3.24Å; T502-T506 WeakPolarHBondContact O-CB 3.35Å; T502-T506 PolarHBondContact O-N 3.28Å; T502-T506 PolarHBondContact O-OG1 2.83Å
503	V	94.2	Very high	93.5	Very high	45 Å²	45	36.1 Å²	36.1	27%	0.273	20%	0.197	S	C	.	.	H	α-helix	trans	-58.2	-54	176.9	169.9	0	0	0	0	111.2	L409 L413 A499 I500 Y501 T506 V507	L409-V503 HydrophobicContact CD1-CG2 4.37Å; L409-V503 HydrophobicContact CD2-CG2 4.17Å; L413-V503 HydrophobicContact CD2-CB 4.09Å; L413-V503 HydrophobicContact CD2-CG1 4.02Å; L413-V503 HydrophobicContact CD2-CG2 4.08Å; A499-V503 WeakPolarHBondContact O-CG2 3.38Å; A499-V503 PolarHBondContact O-N 2.91Å; A499-V503 VanDerWaalsContact O-N 3.14Å; I500-V503 PolarHBondContact O-N 3.36Å; Y501-V503 VanDerWaalsContact C-N 3.3Å; Y501-V503 PolarHBondContact O-N 3.07Å; V503-T506 PolarHBondContact O-N 3Å; V503-V507 VanDerWaalsContact O-CG2 3.32Å; V503-V507 WeakPolarHBondContact O-CG2 3.4Å; V503-V507 PolarHBondContact O-N 3.37Å
504	F	95.9	Very high	92.9	Very high	35 Å²	35	33.9 Å²	33.9	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-35.4	-179.2	-64.5	-73.9	0	0	0	112.2	W432 A433 P436 R437 L440 I500 Y501 T506 V507 M508	W432-F504 AromaticContact CH2-CE1 3.82Å; W432-F504 HydrophobicContact CH2-CE1 3.82Å; W432-F504 HydrophobicContact CZ3-CD1 4.13Å; W432-F504 AromaticContact CZ3-CE1 3.82Å; W432-F504 HydrophobicContact CZ3-CE1 3.82Å; A433-F504 HydrophobicContact CB-CB 4.36Å; A433-F504 HydrophobicContact CB-CD1 4.07Å; P436-F504 HydrophobicContact CB-CD1 3.78Å; P436-F504 HydrophobicContact CB-CD2 4.04Å; P436-F504 HydrophobicContact CB-CE1 3.52Å; P436-F504 HydrophobicContact CB-CE2 3.79Å; P436-F504 HydrophobicContact CB-CG 4.03Å; P436-F504 HydrophobicContact CB-CZ 3.52Å; P436-F504 HydrophobicContact CG-CD1 4.22Å; P436-F504 HydrophobicContact CG-CE1 3.81Å; P436-F504 HydrophobicContact CG-CZ 4.17Å; R437-F504 HydrophobicContact CB-CB 3.89Å; R437-F504 HydrophobicContact CG-CB 4.49Å; L440-F504 HydrophobicContact CD1-CD2 3.44Å; L440-F504 VanDerWaalsContact CD1-CD2 3.44Å; L440-F504 HydrophobicContact CD1-CE2 3.72Å; I500-F504 HydrophobicContact CG2-CD2 4.34Å; I500-F504 HydrophobicContact CG2-CE2 3.89Å; I500-F504 VanDerWaalsContact O-CD2 3.32Å; I500-F504 WeakPolarHBondContact O-CD2 3.25Å; Y501-F504 PolarHBondContact O-N 2.91Å; F504-T506 VanDerWaalsContact C-N 3.31Å; F504-T506 PolarHBondContact O-N 2.98Å; F504-V507 PolarHBondContact O-N 2.93Å; F504-M508 WeakPolarHBondContact O-CG 3.38Å; F504-M508 PolarHBondContact O-N 3.25Å; F504-M508 VanDerWaalsContact O-N 3.11Å
505	S	94.4	Very high	92.7	Very high	32 Å²	32	33.9 Å²	33.9	22%	0.224	19%	0.188	C	C	.	.	H	α-helix	trans	-59.1	-44.4	173.5	-173.3	0	0	0	0	112	R437 Y501 T502 M508 F509	R437-S505 VanDerWaalsContact CZ-OG 3.23Å; R437-S505 PolarHBondContact NH1-OG 3.45Å; R437-S505 PolarHBondContact NH2-OG 2.8Å; Y501-S505 WeakPolarHBondContact O-CB 3.3Å; Y501-S505 PolarHBondContact O-N 3.44Å; T502-S505 PolarHBondContact O-N 3.18Å; S505-M508 PolarHBondContact O-N 2.84Å; S505-F509 PolarHBondContact O-N 2.79Å
506	T	91.3	Very high	92.3	Very high	15 Å²	15	31.5 Å²	31.5	9%	0.092	18%	0.176	C	C	.	.	H	α-helix	trans	-66.1	-42	179.2	-60.4	0	0	0	0	111.9	L413 P414 T502 V503 F504 M508 F509 I510	L413-T506 HydrophobicContact CB-CG2 4.39Å; L413-T506 HydrophobicContact CD2-CG2 3.77Å; L413-T506 HydrophobicContact CG-CG2 4.18Å; P414-T506 HydrophobicContact CG-CG2 4.08Å; T502-T506 VanDerWaalsContact O-CB 3.24Å; T502-T506 WeakPolarHBondContact O-CB 3.35Å; T502-T506 PolarHBondContact O-N 3.28Å; T502-T506 PolarHBondContact O-OG1 2.83Å; V503-T506 PolarHBondContact O-N 3Å; F504-T506 VanDerWaalsContact C-N 3.31Å; F504-T506 PolarHBondContact O-N 2.98Å; T506-M508 VanDerWaalsContact C-N 3.33Å; T506-M508 PolarHBondContact O-N 3.19Å; T506-F509 PolarHBondContact O-N 3.34Å; T506-I510 HydrophobicContact CG2-CD1 3.56Å; T506-I510 HydrophobicContact CG2-CG1 4.31Å; T506-I510 WeakPolarHBondContact O-CD1 3.45Å; T506-I510 WeakPolarHBondContact O-CG1 3.41Å; T506-I510 PolarHBondContact O-N 2.93Å
507	V	92.6	Very high	91.6	Very high	13 Å²	13	30.6 Å²	30.6	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-57.8	-46.5	174.7	173.8	0	0	0	0	110.8	I417 A433 V503 F504 F509 T511	I417-V507 HydrophobicContact CD1-CB 4.29Å; I417-V507 HydrophobicContact CD1-CG2 3.55Å; A433-V507 HydrophobicContact CB-CB 3.96Å; A433-V507 HydrophobicContact CB-CG1 3.73Å; V503-V507 VanDerWaalsContact O-CG2 3.32Å; V503-V507 WeakPolarHBondContact O-CG2 3.4Å; V503-V507 PolarHBondContact O-N 3.37Å; F504-V507 PolarHBondContact O-N 2.93Å; V507-F509 VanDerWaalsContact C-N 3.34Å; V507-F509 PolarHBondContact O-N 3.43Å; V507-T511 HydrophobicContact CG1-CG2 4.48Å; V507-T511 WeakPolarHBondContact O-CB 3.47Å; V507-T511 WeakPolarHBondContact O-CG2 3.24Å; V507-T511 PolarHBondContact O-N 2.64Å; V507-T511 VanDerWaalsContact O-N 3.09Å; V507-T511 PolarHBondContact O-OG1 3.1Å
508	M	94.1	Very high	91	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-40	176.7	-67.8	179.1	72.3	0	0	111.9	F378 Y430 A433 F434 R437 F504 S505 T506 T511 Q512	F378-M508 HydrophobicContact CE2-CE 3.77Å; F378-M508 HydrophobicContact CE2-SD 4.28Å; F378-M508 HydrophobicContact CZ-CE 4.16Å; F378-M508 HydrophobicContact CZ-SD 4.25Å; Y430-M508 HydrophobicContact CD1-CE 4.03Å; Y430-M508 HydrophobicContact CD2-CB 3.9Å; Y430-M508 HydrophobicContact CD2-CE 4.36Å; Y430-M508 HydrophobicContact CD2-CG 4.28Å; Y430-M508 VanDerWaalsContact CD2-O 3.29Å; Y430-M508 WeakPolarHBondContact CD2-O 3.43Å; Y430-M508 HydrophobicContact CE1-CE 3.43Å; Y430-M508 VanDerWaalsContact CE1-CE 3.43Å; Y430-M508 HydrophobicContact CE2-CB 3.84Å; Y430-M508 HydrophobicContact CE2-CE 3.82Å; Y430-M508 HydrophobicContact CE2-CG 4.39Å; Y430-M508 WeakPolarHBondContact CE2-O 3.46Å; Y430-M508 HydrophobicContact CG-CE 4.45Å; A433-M508 HydrophobicContact CB-CG 3.73Å; F434-M508 HydrophobicContact CB-CE 4.39Å; F434-M508 HydrophobicContact CD2-CE 3.91Å; R437-M508 HydrophobicContact CB-SD 4.34Å; R437-M508 WeakPolarHBondContact CD-SD 3.38Å; F504-M508 WeakPolarHBondContact O-CG 3.38Å; F504-M508 PolarHBondContact O-N 3.25Å; F504-M508 VanDerWaalsContact O-N 3.11Å; S505-M508 PolarHBondContact O-N 2.84Å; T506-M508 VanDerWaalsContact C-N 3.33Å; T506-M508 PolarHBondContact O-N 3.19Å; M508-T511 WeakPolarHBondContact CA-OG1 3.38Å; M508-T511 PolarHBondContact O-OG1 3.22Å; M508-Q512 WeakPolarHBondContact O-CB 3.36Å; M508-Q512 PolarHBondContact O-N 2.79Å; M508-Q512 VanDerWaalsContact O-N 3.09Å
509	F	91.1	Very high	90.5	Very high	118 Å²	118	30.7 Å²	30.7	52%	0.518	17%	0.172	S	C	.	.	H	α-helix	trans	-65	-49.3	178.2	175.1	-105.4	0	0	0	112.6	S505 T506 V507 T511 Q512 V513	S505-F509 PolarHBondContact O-N 2.79Å; T506-F509 PolarHBondContact O-N 3.34Å; V507-F509 VanDerWaalsContact C-N 3.34Å; V507-F509 PolarHBondContact O-N 3.43Å; F509-T511 PolarHBondContact O-N 3.29Å; F509-Q512 WeakPolarHBondContact O-CB 3.19Å; F509-Q512 PolarHBondContact O-N 3.32Å; F509-V513 HydrophobicContact CD2-CG2 4.38Å; F509-V513 HydrophobicContact CE1-CG2 4.14Å; F509-V513 HydrophobicContact CE2-CG2 3.91Å; F509-V513 HydrophobicContact CZ-CG2 3.78Å; F509-V513 WeakPolarHBondContact O-CG2 3.26Å; F509-V513 PolarHBondContact O-N 2.88Å
510	I	87.7	Confident	89.6	Confident	15 Å²	15	30.3 Å²	30.3	8%	0.077	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-45.4	-179.8	-68.3	154.3	0	0	0	110.7	P414 I417 T421 T506 Q512 V513 S514	P414-I510 HydrophobicContact CB-CD1 3.61Å; P414-I510 HydrophobicContact CB-CG1 4.15Å; P414-I510 HydrophobicContact CG-CD1 3.81Å; P414-I510 HydrophobicContact CG-CG1 4.38Å; I417-I510 HydrophobicContact CD1-CD1 3.63Å; I417-I510 HydrophobicContact CG1-CD1 3.88Å; T421-I510 WeakPolarHBondContact OG1-CG2 3.28Å; T506-I510 HydrophobicContact CG2-CD1 3.56Å; T506-I510 HydrophobicContact CG2-CG1 4.31Å; T506-I510 WeakPolarHBondContact O-CD1 3.45Å; T506-I510 WeakPolarHBondContact O-CG1 3.41Å; T506-I510 PolarHBondContact O-N 2.93Å; I510-Q512 VanDerWaalsContact C-N 3.25Å; I510-Q512 PolarHBondContact O-N 2.97Å; I510-V513 PolarHBondContact O-N 3.33Å; I510-S514 WeakPolarHBondContact O-CB 3.3Å; I510-S514 PolarHBondContact O-N 2.75Å; I510-S514 PolarHBondContact O-OG 3.25Å
511	T	90.6	Very high	88.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.9	-34.7	179.3	51.4	0	0	0	0	111.9	T421 Y430 V507 M508 F509 F515	T421-T511 HydrophobicContact CG2-CG2 3.86Å; Y430-T511 WeakPolarHBondContact CD2-OG1 3.46Å; V507-T511 HydrophobicContact CG1-CG2 4.48Å; V507-T511 WeakPolarHBondContact O-CB 3.47Å; V507-T511 WeakPolarHBondContact O-CG2 3.24Å; V507-T511 PolarHBondContact O-N 2.64Å; V507-T511 VanDerWaalsContact O-N 3.09Å; V507-T511 PolarHBondContact O-OG1 3.1Å; M508-T511 WeakPolarHBondContact CA-OG1 3.38Å; M508-T511 PolarHBondContact O-OG1 3.22Å; F509-T511 PolarHBondContact O-N 3.29Å; T511-F515 VanDerWaalsContact O-CB 3.23Å; T511-F515 WeakPolarHBondContact O-CB 3.39Å; T511-F515 PolarHBondContact O-N 3.46Å
512	Q	91.4	Very high	86.2	Confident	11 Å²	11	32.9 Å²	32.9	5%	0.051	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-50.8	172.4	-168.5	-167	-73.7	0	0	111.8	Y367 L371 Y430 M508 F509 I510 S514 F515 H516 A536	Y367-Q512 VanDerWaalsContact OH-CG 3.27Å; Y367-Q512 WeakPolarHBondContact OH-CG 3.46Å; L371-Q512 HydrophobicContact CD2-CG 4.01Å; Y430-Q512 HydrophobicContact CE2-CB 4.41Å; M508-Q512 WeakPolarHBondContact O-CB 3.36Å; M508-Q512 PolarHBondContact O-N 2.79Å; M508-Q512 VanDerWaalsContact O-N 3.09Å; F509-Q512 WeakPolarHBondContact O-CB 3.19Å; F509-Q512 PolarHBondContact O-N 3.32Å; I510-Q512 VanDerWaalsContact C-N 3.25Å; I510-Q512 PolarHBondContact O-N 2.97Å; Q512-S514 PolarHBondContact O-N 2.79Å; Q512-F515 PolarHBondContact O-N 3.24Å; Q512-H516 PolarHBondContact O-CD2 3.46Å; Q512-H516 PolarHBondContact O-N 3.37Å; Q512-A536 VanDerWaalsContact NE2-CB 3.28Å
513	V	85	Confident	84.3	Confident	56 Å²	56	36.3 Å²	36.3	34%	0.339	22%	0.221	S	C	.	.	H	α-helix	trans	-62.7	-43.9	179.6	174.1	0	0	0	0	111.3	F509 I510 F515 H516 A517	F509-V513 HydrophobicContact CD2-CG2 4.38Å; F509-V513 HydrophobicContact CE1-CG2 4.14Å; F509-V513 HydrophobicContact CE2-CG2 3.91Å; F509-V513 HydrophobicContact CZ-CG2 3.78Å; F509-V513 WeakPolarHBondContact O-CG2 3.26Å; F509-V513 PolarHBondContact O-N 2.88Å; I510-V513 PolarHBondContact O-N 3.33Å; V513-F515 VanDerWaalsContact C-N 3.3Å; V513-F515 PolarHBondContact O-N 3.49Å; V513-H516 WeakPolarHBondContact O-CB 3.21Å; V513-H516 PolarHBondContact O-N 2.99Å; V513-A517 PolarHBondContact O-N 3.42Å
514	S	84.1	Confident	82.7	Confident	26 Å²	26	35.6 Å²	35.6	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-38.7	174.7	-66.3	0	0	0	0	111.7	N422 I510 Q512 A517 K518	N422-S514 PolarHBondContact OD1-OG 2.88Å; I510-S514 WeakPolarHBondContact O-CB 3.3Å; I510-S514 PolarHBondContact O-N 2.75Å; I510-S514 PolarHBondContact O-OG 3.25Å; Q512-S514 PolarHBondContact O-N 2.79Å; S514-A517 PolarHBondContact O-N 3.06Å; S514-K518 WeakPolarHBondContact O-CB 3.41Å; S514-K518 PolarHBondContact O-N 3.49Å
515	F	89.4	Confident	80.9	Confident	1 Å²	1	35 Å²	35	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-42.5	176.3	-172.8	-100.3	0	0	0	111.5	Y367 L426 L427 T511 Q512 V513 A517 K518 I519 L659 F667	Y367-F515 HydrophobicContact CD1-CE1 4.33Å; Y367-F515 AromaticContact CD2-CD1 3.96Å; Y367-F515 HydrophobicContact CD2-CD1 3.96Å; Y367-F515 AromaticContact CD2-CE1 3.56Å; Y367-F515 HydrophobicContact CD2-CE1 3.56Å; Y367-F515 HydrophobicContact CD2-CZ 4.5Å; Y367-F515 HydrophobicContact CE1-CD1 4.16Å; Y367-F515 HydrophobicContact CE1-CE1 4.34Å; Y367-F515 AromaticContact CE2-CD1 3.46Å; Y367-F515 HydrophobicContact CE2-CD1 3.46Å; Y367-F515 VanDerWaalsContact CE2-CD1 3.46Å; Y367-F515 AromaticContact CE2-CE1 3.59Å; Y367-F515 HydrophobicContact CE2-CE1 3.59Å; Y367-F515 HydrophobicContact CE2-CG 4.48Å; Y367-F515 HydrophobicContact CG-CD1 4.49Å; Y367-F515 AromaticContact CG-CE1 3.94Å; Y367-F515 HydrophobicContact CG-CE1 3.94Å; Y367-F515 AromaticContact CZ-CD1 3.57Å; Y367-F515 AromaticContact CZ-CE1 3.98Å; L426-F515 HydrophobicContact CB-CB 4.41Å; L426-F515 HydrophobicContact CB-CD2 4.34Å; L426-F515 HydrophobicContact CD1-CB 4.11Å; L426-F515 HydrophobicContact CD1-CD2 4.22Å; L427-F515 HydrophobicContact CD1-CD2 4.11Å; L427-F515 HydrophobicContact CD1-CE1 4.22Å; L427-F515 HydrophobicContact CD1-CE2 3.75Å; L427-F515 HydrophobicContact CD1-CZ 3.82Å; L427-F515 HydrophobicContact CD2-CB 4.24Å; L427-F515 HydrophobicContact CD2-CD1 4.25Å; L427-F515 HydrophobicContact CD2-CD2 4.11Å; L427-F515 HydrophobicContact CD2-CG 3.94Å; L427-F515 HydrophobicContact CG-CD2 3.84Å; L427-F515 HydrophobicContact CG-CE2 3.98Å; L427-F515 HydrophobicContact CG-CG 4.19Å; L427-F515 HydrophobicContact CG-CZ 4.45Å; T511-F515 VanDerWaalsContact O-CB 3.23Å; T511-F515 WeakPolarHBondContact O-CB 3.39Å; T511-F515 PolarHBondContact O-N 3.46Å; Q512-F515 PolarHBondContact O-N 3.24Å; V513-F515 VanDerWaalsContact C-N 3.3Å; V513-F515 PolarHBondContact O-N 3.49Å; F515-A517 VanDerWaalsContact C-N 3.3Å; F515-A517 PolarHBondContact O-N 2.99Å; F515-K518 PolarHBondContact O-N 3.26Å; F515-K518 VanDerWaalsContact O-N 3.16Å; F515-I519 HydrophobicContact CD1-CD1 4.11Å; F515-I519 HydrophobicContact CD1-CG2 4.36Å; F515-I519 HydrophobicContact CD2-CG2 4.41Å; F515-I519 HydrophobicContact CE1-CD1 3.71Å; F515-I519 HydrophobicContact CE1-CG1 4.44Å; F515-I519 HydrophobicContact CE1-CG2 3.91Å; F515-I519 HydrophobicContact CE2-CG2 3.94Å; F515-I519 HydrophobicContact CZ-CD1 4.44Å; F515-I519 HydrophobicContact CZ-CG2 3.67Å; F515-I519 WeakPolarHBondContact O-CG1 3.48Å; F515-I519 PolarHBondContact O-N 3.21Å; F515-L659 HydrophobicContact CZ-CB 4.16Å; F515-F667 HydrophobicContact CZ-CE1 4.36Å; F515-F667 HydrophobicContact CZ-CZ 4.16Å
516	H	87	Confident	79.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.8	-45.5	173.8	-68	-171.2	0	0	0	111.6	Y367 Q512 V513 K518 S520 M529 L532 N533	Y367-H516 AromaticContact CE1-CD2 3.62Å; Y367-H516 AromaticContact CE1-NE2 3.47Å; Y367-H516 WeakPolarHBondContact CE1-NE2 3.37Å; Y367-H516 AromaticContact CZ-CD2 3.74Å; Y367-H516 AromaticContact CZ-NE2 3.68Å; Y367-H516 PolarHBondContact OH-CD2 2.88Å; Y367-H516 PolarHBondContact OH-NE2 3.49Å; Q512-H516 PolarHBondContact O-CD2 3.46Å; Q512-H516 PolarHBondContact O-N 3.37Å; V513-H516 WeakPolarHBondContact O-CB 3.21Å; V513-H516 PolarHBondContact O-N 2.99Å; H516-K518 PolarHBondContact O-N 3.21Å; H516-S520 WeakPolarHBondContact O-CB 3.26Å; H516-S520 PolarHBondContact O-N 3.25Å; H516-S520 VanDerWaalsContact O-N 3.12Å; H516-S520 PolarHBondContact O-OG 3.42Å; H516-M529 HydrophobicContact CB-CE 4.21Å; H516-M529 HydrophobicContact CB-SD 3.47Å; H516-M529 WeakPolarHBondContact CB-SD 3.41Å; H516-L532 HydrophobicContact CB-CB 4.42Å; H516-L532 HydrophobicContact CB-CD1 3.8Å; H516-L532 PolarHBondContact CE1-O 3.09Å; H516-N533 PolarHBondContact CE1-OD1 3.17Å; H516-N533 PolarHBondContact ND1-OD1 3.22Å
517	A	82	Confident	78.4	Confident	58 Å²	58	37.2 Å²	37.2	48%	0.479	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-40.1	177.4	0	0	0	0	0	112.2	V513 S514 F515 M529	V513-A517 PolarHBondContact O-N 3.42Å; S514-A517 PolarHBondContact O-N 3.06Å; F515-A517 VanDerWaalsContact C-N 3.3Å; F515-A517 PolarHBondContact O-N 2.99Å; A517-M529 HydrophobicContact CB-CE 4.04Å
518	K	83	Confident	77.4	Confident	64 Å²	64	36.6 Å²	36.6	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	-63.5	-43.2	179.2	-178.2	-173.7	172.7	-166	0	112.8	P424 L426 S514 F515 H516	P424-K518 PolarHBondContact O-NZ 3.09Å; L426-K518 HydrophobicContact CD1-CB 4Å; L426-K518 HydrophobicContact CD1-CD 3.7Å; L426-K518 HydrophobicContact CD1-CG 4.45Å; L426-K518 HydrophobicContact CG-CD 4.5Å; S514-K518 WeakPolarHBondContact O-CB 3.41Å; S514-K518 PolarHBondContact O-N 3.49Å; F515-K518 PolarHBondContact O-N 3.26Å; F515-K518 VanDerWaalsContact O-N 3.16Å; H516-K518 PolarHBondContact O-N 3.21Å
519	I	84.6	Confident	76.4	Confident	5 Å²	5	39 Å²	39	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-89.7	-11.6	-174.1	68.9	170.6	0	0	0	113.9	I364 F515 D521 Y528 L532 F667	I364-I519 HydrophobicContact CD1-CD1 3.83Å; F515-I519 HydrophobicContact CD1-CD1 4.11Å; F515-I519 HydrophobicContact CD1-CG2 4.36Å; F515-I519 HydrophobicContact CD2-CG2 4.41Å; F515-I519 HydrophobicContact CE1-CD1 3.71Å; F515-I519 HydrophobicContact CE1-CG1 4.44Å; F515-I519 HydrophobicContact CE1-CG2 3.91Å; F515-I519 HydrophobicContact CE2-CG2 3.94Å; F515-I519 HydrophobicContact CZ-CD1 4.44Å; F515-I519 HydrophobicContact CZ-CG2 3.67Å; F515-I519 WeakPolarHBondContact O-CG1 3.48Å; F515-I519 PolarHBondContact O-N 3.21Å; I519-D521 PolarHBondContact O-N 3.46Å; I519-Y528 HydrophobicContact CD1-CE1 4.3Å; I519-Y528 HydrophobicContact CG1-CE1 4.22Å; I519-L532 HydrophobicContact CD1-CD1 3.65Å; I519-L532 HydrophobicContact CD1-CD2 4.16Å; I519-L532 HydrophobicContact CG1-CD1 3.74Å; I519-F667 HydrophobicContact CB-CB 4.11Å; I519-F667 HydrophobicContact CB-CD1 4.01Å; I519-F667 HydrophobicContact CB-CD2 4.2Å; I519-F667 HydrophobicContact CB-CE1 4.46Å; I519-F667 HydrophobicContact CB-CG 3.85Å; I519-F667 HydrophobicContact CD1-CD1 4.08Å; I519-F667 HydrophobicContact CD1-CE1 4.31Å; I519-F667 HydrophobicContact CG2-CD1 4.05Å; I519-F667 HydrophobicContact CG2-CD2 3.91Å; I519-F667 HydrophobicContact CG2-CE1 4.02Å; I519-F667 HydrophobicContact CG2-CE2 3.89Å; I519-F667 HydrophobicContact CG2-CG 3.98Å; I519-F667 HydrophobicContact CG2-CZ 3.96Å
520	S	77.4	Confident	75.6	Confident	16 Å²	16	34.7 Å²	34.7	11%	0.112	23%	0.234	C	C	.	.	S	Bend	trans	-73.1	120.1	179.7	-67.9	0	0	0	0	110.4	H516	H516-S520 WeakPolarHBondContact O-CB 3.26Å; H516-S520 PolarHBondContact O-N 3.25Å; H516-S520 VanDerWaalsContact O-N 3.12Å; H516-S520 PolarHBondContact O-OG 3.42Å
521	D	65.4	Low	75.3	Confident	30 Å²	30	34.7 Å²	34.7	16%	0.16	23%	0.234	C	C	.	.			trans	-62.5	124.7	176.7	-178.7	-28.4	0	0	0	110.8	I519 A523 V524 G525 T668	I519-D521 PolarHBondContact O-N 3.46Å; D521-A523 PolarHBondContact O-N 3.17Å; D521-A523 WeakPolarHBondContact OD1-CB 3.39Å; D521-A523 PolarHBondContact OD1-N 3Å; D521-V524 HydrophobicContact CB-CG2 3.93Å; D521-V524 CarbonylContact O-C 3.6Å; D521-V524 PolarHBondContact O-N 3.03Å; D521-V524 VanDerWaalsContact O-N 3.15Å; D521-G525 WeakPolarHBondContact O-CA 3.43Å; D521-G525 PolarHBondContact O-N 3.42Å; D521-T668 WeakPolarHBondContact OD2-CG2 3.32Å
522	P	55.3	Low	75.2	Confident	129 Å²	129	34.7 Å²	34.7	84%	0.838	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-54.9	-32.2	-179.7	-26.4	34.5	0	0	0	115	V524	P522-V524 PolarHBondContact O-N 3.13Å
523	A	53.6	Low	74.7	Confident	90 Å²	90	36.8 Å²	36.8	74%	0.744	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-67.8	-24.1	-177.7	0	0	0	0	0	113	D521	D521-A523 PolarHBondContact O-N 3.17Å; D521-A523 WeakPolarHBondContact OD1-CB 3.39Å; D521-A523 PolarHBondContact OD1-N 3Å
524	V	61.3	Low	74.8	Confident	29 Å²	29	34.7 Å²	34.7	18%	0.176	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-137.9	22.3	-174.4	-90.7	0	0	0	0	111.7	F354 D521 P522 G526 T527 Y528	F354-V524 HydrophobicContact CD1-CG1 4.24Å; F354-V524 HydrophobicContact CE1-CB 3.71Å; F354-V524 HydrophobicContact CE1-CG1 3.61Å; F354-V524 HydrophobicContact CE1-CG2 3.51Å; F354-V524 HydrophobicContact CZ-CB 4.08Å; F354-V524 HydrophobicContact CZ-CG1 3.89Å; F354-V524 HydrophobicContact CZ-CG2 3.47Å; F354-V524 VanDerWaalsContact CZ-CG2 3.47Å; D521-V524 HydrophobicContact CB-CG2 3.93Å; D521-V524 CarbonylContact O-C 3.6Å; D521-V524 PolarHBondContact O-N 3.03Å; D521-V524 VanDerWaalsContact O-N 3.15Å; P522-V524 PolarHBondContact O-N 3.13Å; V524-G526 PolarHBondContact O-N 3.31Å; V524-G526 VanDerWaalsContact O-N 3.08Å; V524-T527 PolarHBondContact O-N 3.35Å; V524-Y528 PolarHBondContact O-N 2.87Å
525	G	57.7	Low	75.1	Confident	22 Å²	22	34 Å²	34	23%	0.227	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-34.1	-165.3	0	0	0	0	0	113.9	D521 Y528 M529	D521-G525 WeakPolarHBondContact O-CA 3.43Å; D521-G525 PolarHBondContact O-N 3.42Å; G525-Y528 PolarHBondContact O-N 2.93Å; G525-M529 WeakPolarHBondContact O-CB 3.31Å; G525-M529 PolarHBondContact O-N 3.21Å
526	G	61.7	Low	75.2	Confident	50 Å²	50	34.1 Å²	34.1	52%	0.515	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-47.8	176.4	0	0	0	0	0	113	V524 T530	V524-G526 PolarHBondContact O-N 3.31Å; V524-G526 VanDerWaalsContact O-N 3.08Å; G526-T530 WeakPolarHBondContact O-CB 3.38Å; G526-T530 PolarHBondContact O-N 3.25Å; G526-T530 PolarHBondContact O-OG1 3.4Å
527	T	70.7	Confident	75.3	Confident	44 Å²	44	36.7 Å²	36.7	27%	0.27	24%	0.244	S	C	.	.	H	α-helix	trans	-68.2	-39.7	178.5	-54.1	0	0	0	0	111.3	M355 V524 T530 L531	M355-T527 HydrophobicContact CG-CG2 3.3Å; M355-T527 HydrophobicContact SD-CG2 3.52Å; M355-T527 VanDerWaalsContact SD-CG2 3.52Å; V524-T527 PolarHBondContact O-N 3.35Å; T527-T530 PolarHBondContact O-N 2.91Å; T527-L531 PolarHBondContact O-N 3.44Å
528	Y	72	Confident	75.8	Confident	1 Å²	1	35.9 Å²	35.9	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-48.9	178.4	-151.6	-68.8	0	0	0	111.7	I358 I364 I519 V524 G525 T530 L531 L532 F667	I358-Y528 HydrophobicContact CB-CE2 4.4Å; I358-Y528 HydrophobicContact CD1-CD2 3.51Å; I358-Y528 HydrophobicContact CD1-CE2 3.89Å; I358-Y528 HydrophobicContact CD1-CG 4.3Å; I358-Y528 HydrophobicContact CG1-CD2 4.11Å; I358-Y528 HydrophobicContact CG1-CE2 3.95Å; I358-Y528 HydrophobicContact CG2-CD2 4.09Å; I358-Y528 HydrophobicContact CG2-CE1 4.27Å; I358-Y528 HydrophobicContact CG2-CE2 3.5Å; I358-Y528 VanDerWaalsContact CG2-CE2 3.5Å; I364-Y528 HydrophobicContact CD1-CE1 3.84Å; I364-Y528 WeakPolarHBondContact CD1-OH 3.39Å; I364-Y528 WeakPolarHBondContact CG1-OH 3.36Å; I519-Y528 HydrophobicContact CD1-CE1 4.3Å; I519-Y528 HydrophobicContact CG1-CE1 4.22Å; V524-Y528 PolarHBondContact O-N 2.87Å; G525-Y528 PolarHBondContact O-N 2.93Å; Y528-T530 VanDerWaalsContact C-N 3.29Å; Y528-T530 PolarHBondContact O-N 3.5Å; Y528-L531 WeakPolarHBondContact O-CB 3.49Å; Y528-L531 PolarHBondContact O-N 3.2Å; Y528-L532 HydrophobicContact CD1-CD1 3.72Å; Y528-L532 HydrophobicContact CD1-CG 3.93Å; Y528-L532 HydrophobicContact CE1-CD1 3.79Å; Y528-L532 HydrophobicContact CE1-CD2 4.24Å; Y528-L532 HydrophobicContact CE1-CG 4.01Å; Y528-L532 WeakPolarHBondContact O-CG 3.48Å; Y528-L532 PolarHBondContact O-N 3.21Å; Y528-F667 VanDerWaalsContact CE2-O 3.32Å; Y528-F667 WeakPolarHBondContact CE2-O 3.14Å; Y528-F667 PolarHBondContact OH-O 3.16Å
529	M	73.1	Confident	76.4	Confident	54 Å²	54	32.9 Å²	32.9	27%	0.266	22%	0.218	S	C	.	.	H	α-helix	trans	-60.7	-40.5	176.4	-171.5	64.5	115.9	0	0	111.1	H516 A517 G525 L531 L532 N533	H516-M529 HydrophobicContact CB-CE 4.21Å; H516-M529 HydrophobicContact CB-SD 3.47Å; H516-M529 WeakPolarHBondContact CB-SD 3.41Å; A517-M529 HydrophobicContact CB-CE 4.04Å; G525-M529 WeakPolarHBondContact O-CB 3.31Å; G525-M529 PolarHBondContact O-N 3.21Å; M529-L531 PolarHBondContact O-N 3.45Å; M529-L532 PolarHBondContact O-N 2.86Å; M529-N533 VanDerWaalsContact O-CB 3.31Å; M529-N533 WeakPolarHBondContact O-CB 3.44Å; M529-N533 PolarHBondContact O-N 2.94Å; M529-N533 PolarHBondContact O-ND2 2.93Å
530	T	74.5	Confident	76.8	Confident	28 Å²	28	34.5 Å²	34.5	17%	0.172	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-45.6	174.9	-56.1	0	0	0	0	111.6	L84 G526 T527 Y528 L532 N533 T534	L84-T530 HydrophobicContact CD1-CG2 3.88Å; G526-T530 WeakPolarHBondContact O-CB 3.38Å; G526-T530 PolarHBondContact O-N 3.25Å; G526-T530 PolarHBondContact O-OG1 3.4Å; T527-T530 PolarHBondContact O-N 2.91Å; Y528-T530 VanDerWaalsContact C-N 3.29Å; Y528-T530 PolarHBondContact O-N 3.5Å; T530-L532 PolarHBondContact O-N 3.4Å; T530-N533 PolarHBondContact O-N 3.38Å; T530-T534 WeakPolarHBondContact O-CB 3.44Å; T530-T534 PolarHBondContact O-N 3.34Å; T530-T534 PolarHBondContact O-OG1 3.07Å
531	L	82.2	Confident	77.5	Confident	15 Å²	15	34.6 Å²	34.6	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-48.1	177.4	169.6	67.2	0	0	0	111.8	L84 I358 C359 T527 Y528 M529 T534 A535	L84-L531 HydrophobicContact CD1-CB 4.32Å; L84-L531 HydrophobicContact CD2-CB 4.27Å; L84-L531 HydrophobicContact CD2-CD1 3.42Å; L84-L531 VanDerWaalsContact CD2-CD1 3.42Å; L84-L531 HydrophobicContact CD2-CG 4.45Å; I358-L531 HydrophobicContact CB-CD2 3.78Å; I358-L531 HydrophobicContact CG2-CD2 3.42Å; I358-L531 VanDerWaalsContact CG2-CD2 3.42Å; C359-L531 WeakPolarHBondContact SG-CD1 3.47Å; T527-L531 PolarHBondContact O-N 3.44Å; Y528-L531 WeakPolarHBondContact O-CB 3.49Å; Y528-L531 PolarHBondContact O-N 3.2Å; M529-L531 PolarHBondContact O-N 3.45Å; L531-T534 WeakPolarHBondContact O-CB 3.49Å; L531-T534 PolarHBondContact O-N 3.43Å; L531-A535 PolarHBondContact O-N 2.87Å
532	L	87.3	Confident	78.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-41.7	-179.8	-66	178.6	0	0	0	112.2	I364 Y367 H516 I519 Y528 M529 T530 T534 A535 A536	I364-L532 HydrophobicContact CD1-CD2 4.06Å; Y367-L532 HydrophobicContact CD1-CD2 4.12Å; Y367-L532 HydrophobicContact CE1-CD2 4.22Å; H516-L532 HydrophobicContact CB-CB 4.42Å; H516-L532 HydrophobicContact CB-CD1 3.8Å; H516-L532 PolarHBondContact CE1-O 3.09Å; I519-L532 HydrophobicContact CD1-CD1 3.65Å; I519-L532 HydrophobicContact CD1-CD2 4.16Å; I519-L532 HydrophobicContact CG1-CD1 3.74Å; Y528-L532 HydrophobicContact CD1-CD1 3.72Å; Y528-L532 HydrophobicContact CD1-CG 3.93Å; Y528-L532 HydrophobicContact CE1-CD1 3.79Å; Y528-L532 HydrophobicContact CE1-CD2 4.24Å; Y528-L532 HydrophobicContact CE1-CG 4.01Å; Y528-L532 WeakPolarHBondContact O-CG 3.48Å; Y528-L532 PolarHBondContact O-N 3.21Å; M529-L532 PolarHBondContact O-N 2.86Å; T530-L532 PolarHBondContact O-N 3.4Å; L532-T534 VanDerWaalsContact C-N 3.34Å; L532-A535 PolarHBondContact O-N 3.43Å; L532-A536 PolarHBondContact O-N 2.98Å
533	N	81.7	Confident	80.8	Confident	54 Å²	54	31 Å²	31	29%	0.289	20%	0.203	S	C	.	.	H	α-helix	trans	-63.7	-40.4	174.8	-71.3	-13.9	0	0	0	111.4	H516 M529 T530 A535 A536 N537	H516-N533 PolarHBondContact CE1-OD1 3.17Å; H516-N533 PolarHBondContact ND1-OD1 3.22Å; M529-N533 VanDerWaalsContact O-CB 3.31Å; M529-N533 WeakPolarHBondContact O-CB 3.44Å; M529-N533 PolarHBondContact O-N 2.94Å; M529-N533 PolarHBondContact O-ND2 2.93Å; T530-N533 PolarHBondContact O-N 3.38Å; N533-A535 PolarHBondContact O-N 3.44Å; N533-A536 PolarHBondContact O-N 3.08Å; N533-N537 WeakPolarHBondContact O-CB 3.48Å; N533-N537 PolarHBondContact O-N 3.13Å; N533-N537 PolarHBondContact O-ND2 3.23Å
534	T	87	Confident	82.7	Confident	13 Å²	13	28.6 Å²	28.6	8%	0.08	18%	0.177	C	C	.	.	H	α-helix	trans	-58.6	-46	171.7	-85.7	0	0	0	0	111.3	S81 L84 T530 L531 L532 A536 N537 L538	S81-T534 WeakPolarHBondContact O-CB 3.45Å; S81-T534 WeakPolarHBondContact O-CG2 3.32Å; S81-T534 PolarHBondContact O-OG1 3.25Å; S81-T534 VanDerWaalsContact O-OG1 3.04Å; L84-T534 HydrophobicContact CB-CG2 4.02Å; L84-T534 HydrophobicContact CD2-CG2 4.31Å; T530-T534 WeakPolarHBondContact O-CB 3.44Å; T530-T534 PolarHBondContact O-N 3.34Å; T530-T534 PolarHBondContact O-OG1 3.07Å; L531-T534 WeakPolarHBondContact O-CB 3.49Å; L531-T534 PolarHBondContact O-N 3.43Å; L532-T534 VanDerWaalsContact C-N 3.34Å; T534-A536 PolarHBondContact O-N 2.96Å; T534-N537 PolarHBondContact O-N 3.32Å; T534-L538 VanDerWaalsContact O-CB 3.25Å; T534-L538 WeakPolarHBondContact O-CB 3.42Å; T534-L538 PolarHBondContact O-N 2.84Å
535	A	90.6	Very high	84.4	Confident	10 Å²	10	27.8 Å²	27.8	8%	0.083	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-43.5	177.3	0	0	0	0	0	112.2	V368 L531 L532 N533 L538 A539	V368-A535 HydrophobicContact CG1-CB 4.38Å; V368-A535 HydrophobicContact CG2-CB 3.86Å; L531-A535 PolarHBondContact O-N 2.87Å; L532-A535 PolarHBondContact O-N 3.43Å; N533-A535 PolarHBondContact O-N 3.44Å; A535-L538 PolarHBondContact O-N 2.87Å; A535-A539 VanDerWaalsContact O-CB 3.25Å; A535-A539 WeakPolarHBondContact O-CB 3.36Å; A535-A539 PolarHBondContact O-N 3.43Å
536	A	91.8	Very high	86.2	Confident	4 Å²	4	31 Å²	31	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-40.8	177.8	0	0	0	0	0	113.2	L371 Q512 L532 N533 T534 A539 T540	L371-A536 HydrophobicContact CD1-CB 4.13Å; Q512-A536 VanDerWaalsContact NE2-CB 3.28Å; L532-A536 PolarHBondContact O-N 2.98Å; N533-A536 PolarHBondContact O-N 3.08Å; T534-A536 PolarHBondContact O-N 2.96Å; A536-A539 PolarHBondContact O-N 2.87Å; A536-T540 PolarHBondContact O-N 3.24Å; A536-T540 PolarHBondContact O-OG1 3.21Å; A536-T540 VanDerWaalsContact O-OG1 3.1Å
537	N	89.2	Confident	87.9	Confident	54 Å²	54	29.7 Å²	29.7	29%	0.289	16%	0.164	S	C	.	.	H	α-helix	trans	-66	-44.6	176.2	-71.1	-13	0	0	0	110.5	S81 N533 T534 A539 T540 S541	S81-N537 WeakPolarHBondContact OG-CB 3.37Å; N533-N537 WeakPolarHBondContact O-CB 3.48Å; N533-N537 PolarHBondContact O-N 3.13Å; N533-N537 PolarHBondContact O-ND2 3.23Å; T534-N537 PolarHBondContact O-N 3.32Å; N537-A539 PolarHBondContact O-N 3.11Å; N537-T540 WeakPolarHBondContact O-CB 3.34Å; N537-T540 PolarHBondContact O-N 3.02Å; N537-S541 PolarHBondContact O-N 3.12Å; N537-S541 PolarHBondContact O-OG 3.47Å
538	L	92.6	Very high	89.2	Confident	42 Å²	42	28.2 Å²	28.2	22%	0.22	16%	0.155	C	C	.	.	H	α-helix	trans	-65	-39	177.3	-172.2	63	0	0	0	112.4	L82 F372 T534 A535 T540 S541 L542	L82-L538 HydrophobicContact CD2-CD1 4.05Å; L82-L538 HydrophobicContact CD2-CD2 4.33Å; F372-L538 HydrophobicContact CZ-CB 4.23Å; F372-L538 HydrophobicContact CZ-CD2 4.08Å; F372-L538 HydrophobicContact CZ-CG 3.89Å; T534-L538 VanDerWaalsContact O-CB 3.25Å; T534-L538 WeakPolarHBondContact O-CB 3.42Å; T534-L538 PolarHBondContact O-N 2.84Å; A535-L538 PolarHBondContact O-N 2.87Å; L538-T540 PolarHBondContact O-N 3.18Å; L538-T540 VanDerWaalsContact O-N 3.13Å; L538-S541 PolarHBondContact O-N 3.45Å; L538-L542 HydrophobicContact CD1-CB 4.45Å; L538-L542 WeakPolarHBondContact O-CB 3.47Å; L538-L542 PolarHBondContact O-N 3.23Å
539	A	94.5	Very high	90.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-17.7	172.9	0	0	0	0	0	113	L371 F372 K375 A535 A536 N537 P543	L371-A539 HydrophobicContact CB-CB 4.17Å; F372-A539 HydrophobicContact CD1-CB 4.21Å; F372-A539 HydrophobicContact CD2-CB 3.67Å; F372-A539 HydrophobicContact CE1-CB 4.36Å; F372-A539 HydrophobicContact CE2-CB 3.84Å; F372-A539 HydrophobicContact CG-CB 3.89Å; F372-A539 HydrophobicContact CZ-CB 4.19Å; K375-A539 HydrophobicContact CB-CB 4.48Å; K375-A539 WeakPolarHBondContact CB-O 3.39Å; K375-A539 HydrophobicContact CG-CB 4.13Å; A535-A539 VanDerWaalsContact O-CB 3.25Å; A535-A539 WeakPolarHBondContact O-CB 3.36Å; A535-A539 PolarHBondContact O-N 3.43Å; A536-A539 PolarHBondContact O-N 2.87Å; N537-A539 PolarHBondContact O-N 3.11Å; A539-P543 VanDerWaalsContact O-CD 3.28Å; A539-P543 WeakPolarHBondContact O-CD 3.25Å; A539-P543 VanDerWaalsContact O-CG 3.29Å; A539-P543 WeakPolarHBondContact O-CG 3.45Å
540	T	93.4	Very high	91.4	Very high	39 Å²	39	30.1 Å²	30.1	24%	0.239	17%	0.168	C	C	.	.	H	α-helix	trans	-96.1	-50.3	173.5	-52.2	0	0	0	0	111.1	A536 N537 L538 L542 N544	A536-T540 PolarHBondContact O-N 3.24Å; A536-T540 PolarHBondContact O-OG1 3.21Å; A536-T540 VanDerWaalsContact O-OG1 3.1Å; N537-T540 WeakPolarHBondContact O-CB 3.34Å; N537-T540 PolarHBondContact O-N 3.02Å; L538-T540 PolarHBondContact O-N 3.18Å; L538-T540 VanDerWaalsContact O-N 3.13Å; T540-L542 PolarHBondContact O-N 3.11Å; T540-N544 WeakPolarHBondContact O-CB 3.37Å; T540-N544 PolarHBondContact O-N 2.98Å; T540-N544 VanDerWaalsContact O-N 3.16Å; T540-N544 PolarHBondContact O-OD1 3.44Å
541	S	92.2	Very high	92.4	Very high	19 Å²	19	28.8 Å²	28.8	13%	0.133	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-43.2	-175.1	-54.5	0	0	0	0	113.5	S81 N537 L538 N544 T545	S81-S541 PolarHBondContact OG-OG 3.22Å; N537-S541 PolarHBondContact O-N 3.12Å; N537-S541 PolarHBondContact O-OG 3.47Å; L538-S541 PolarHBondContact O-N 3.45Å; S541-N544 PolarHBondContact O-N 3.15Å; S541-T545 PolarHBondContact O-N 3.33Å; S541-T545 VanDerWaalsContact O-N 3.08Å; S541-T545 PolarHBondContact O-OG1 2.86Å
542	L	94.5	Very high	92.9	Very high	77 Å²	77	29 Å²	29	40%	0.403	16%	0.161	S	C	.	.	H	α-helix	trans	-66.7	-50.7	-174.9	178.9	76.5	0	0	0	111.8	W78 F372 L538 T540 N544 T545 L546	W78-L542 HydrophobicContact CH2-CD1 3.79Å; W78-L542 HydrophobicContact CZ2-CD1 3.87Å; F372-L542 HydrophobicContact CE1-CD2 3.99Å; L538-L542 HydrophobicContact CD1-CB 4.45Å; L538-L542 WeakPolarHBondContact O-CB 3.47Å; L538-L542 PolarHBondContact O-N 3.23Å; T540-L542 PolarHBondContact O-N 3.11Å; L542-N544 VanDerWaalsContact C-N 3.34Å; L542-N544 PolarHBondContact O-N 2.85Å; L542-T545 PolarHBondContact O-N 3.32Å; L542-L546 PolarHBondContact O-N 3.33Å; L542-L546 VanDerWaalsContact O-N 3.15Å
543	P	95.2	Very high	93.2	Very high	7 Å²	7	33.6 Å²	33.6	5%	0.045	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-43.2	172.5	-27.2	37.8	0	0	0	112.5	V376 C379 A539 T545 L546 F547	V376-P543 HydrophobicContact CG2-CB 4.08Å; V376-P543 HydrophobicContact CG2-CG 3.77Å; C379-P543 HydrophobicContact CB-CB 4.24Å; C379-P543 PolarHBondContact SG-O 3.41Å; A539-P543 VanDerWaalsContact O-CD 3.28Å; A539-P543 WeakPolarHBondContact O-CD 3.25Å; A539-P543 VanDerWaalsContact O-CG 3.29Å; A539-P543 WeakPolarHBondContact O-CG 3.45Å; P543-T545 VanDerWaalsContact C-N 3.31Å; P543-T545 PolarHBondContact O-N 2.78Å; P543-L546 WeakPolarHBondContact O-CB 3.38Å; P543-L546 PolarHBondContact O-N 3.07Å; P543-F547 HydrophobicContact CB-CD2 4.3Å; P543-F547 HydrophobicContact CB-CE2 4.47Å; P543-F547 VanDerWaalsContact O-CD2 3.3Å; P543-F547 WeakPolarHBondContact O-CD2 3.44Å; P543-F547 PolarHBondContact O-N 3.33Å
544	N	94.7	Very high	93.8	Very high	38 Å²	38	33.7 Å²	33.7	20%	0.203	19%	0.19	C	C	.	.	H	α-helix	trans	-56.1	-46.2	-179.9	-72.9	6.3	0	0	0	112.1	C379 A383 T540 S541 L542 L546 L548	C379-N544 VanDerWaalsContact SG-CA 3.58Å; C379-N544 PolarHBondContact SG-OD1 3.22Å; A383-N544 HydrophobicContact CB-CB 4.15Å; T540-N544 WeakPolarHBondContact O-CB 3.37Å; T540-N544 PolarHBondContact O-N 2.98Å; T540-N544 VanDerWaalsContact O-N 3.16Å; T540-N544 PolarHBondContact O-OD1 3.44Å; S541-N544 PolarHBondContact O-N 3.15Å; L542-N544 VanDerWaalsContact C-N 3.34Å; L542-N544 PolarHBondContact O-N 2.85Å; N544-L546 VanDerWaalsContact C-N 3.35Å; N544-L546 PolarHBondContact O-N 3.18Å; N544-L548 VanDerWaalsContact O-CB 3.31Å; N544-L548 WeakPolarHBondContact O-CB 3.23Å; N544-L548 WeakPolarHBondContact O-CD1 3.34Å; N544-L548 VanDerWaalsContact O-CG 3.23Å; N544-L548 WeakPolarHBondContact O-CG 3.44Å; N544-L548 PolarHBondContact O-N 3.48Å
545	T	96	Very high	94.2	Very high	12 Å²	12	33.7 Å²	33.7	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-44.5	175.6	-59.3	0	0	0	0	111.8	S74 F75 W78 S541 L542 P543 S549	S74-T545 WeakPolarHBondContact OG-CA 3Å; S74-T545 WeakPolarHBondContact OG-CB 3.37Å; S74-T545 WeakPolarHBondContact OG-CG2 3.5Å; S74-T545 PolarHBondContact OG-OG1 2.98Å; F75-T545 HydrophobicContact CD2-CG2 4.13Å; F75-T545 HydrophobicContact CE1-CG2 4.34Å; F75-T545 HydrophobicContact CE2-CG2 3.56Å; F75-T545 HydrophobicContact CZ-CG2 3.68Å; W78-T545 HydrophobicContact CZ2-CG2 4.4Å; W78-T545 PolarHBondContact NE1-OG1 3.29Å; W78-T545 VanDerWaalsContact NE1-OG1 3.12Å; S541-T545 PolarHBondContact O-N 3.33Å; S541-T545 VanDerWaalsContact O-N 3.08Å; S541-T545 PolarHBondContact O-OG1 2.86Å; L542-T545 PolarHBondContact O-N 3.32Å; P543-T545 VanDerWaalsContact C-N 3.31Å; P543-T545 PolarHBondContact O-N 2.78Å; T545-S549 PolarHBondContact O-N 3.37Å
546	L	96.2	Very high	94.4	Very high	91 Å²	91	38 Å²	38	48%	0.476	21%	0.212	S	C	.	.	H	α-helix	trans	-63.6	-53.4	-179.7	176.2	62.2	0	0	0	111.8	L542 P543 N544 L548 S549 L550	L542-L546 PolarHBondContact O-N 3.33Å; L542-L546 VanDerWaalsContact O-N 3.15Å; P543-L546 WeakPolarHBondContact O-CB 3.38Å; P543-L546 PolarHBondContact O-N 3.07Å; N544-L546 VanDerWaalsContact C-N 3.35Å; N544-L546 PolarHBondContact O-N 3.18Å; L546-L548 PolarHBondContact O-N 2.91Å; L546-S549 PolarHBondContact O-N 2.89Å; L546-S549 PolarHBondContact O-OG 3.17Å; L546-L550 HydrophobicContact CD1-CD1 4.02Å; L546-L550 HydrophobicContact CD1-CG 4.23Å; L546-L550 HydrophobicContact CG-CD1 3.99Å; L546-L550 WeakPolarHBondContact O-CG 3.42Å; L546-L550 PolarHBondContact O-N 3.14Å; L546-L550 VanDerWaalsContact O-N 3.11Å
547	F	97.3	Very high	94.4	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.096	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-41.6	-177.1	-81	-98.8	0	0	0	111.4	V376 C379 P380 I384 P543 S549 L550 V551 E636 C640	V376-F547 HydrophobicContact CG1-CE2 4.05Å; V376-F547 HydrophobicContact CG1-CZ 3.99Å; C379-F547 HydrophobicContact CB-CD2 4Å; C379-F547 HydrophobicContact CB-CE2 4.28Å; C379-F547 HydrophobicContact CB-CG 4.2Å; C379-F547 VanDerWaalsContact SG-CD2 3.54Å; P380-F547 HydrophobicContact CG-CD1 3.78Å; P380-F547 HydrophobicContact CG-CE1 3.98Å; I384-F547 HydrophobicContact CD1-CB 4.11Å; P543-F547 HydrophobicContact CB-CD2 4.3Å; P543-F547 HydrophobicContact CB-CE2 4.47Å; P543-F547 VanDerWaalsContact O-CD2 3.3Å; P543-F547 WeakPolarHBondContact O-CD2 3.44Å; P543-F547 PolarHBondContact O-N 3.33Å; F547-S549 PolarHBondContact O-N 2.71Å; F547-L550 PolarHBondContact O-N 3Å; F547-V551 WeakPolarHBondContact O-CG2 3.38Å; F547-V551 PolarHBondContact O-N 2.65Å; F547-E636 HydrophobicContact CD1-CB 4.03Å; F547-E636 HydrophobicContact CD1-CG 3.96Å; F547-E636 WeakPolarHBondContact CD1-OE2 3.26Å; F547-E636 HydrophobicContact CE1-CB 4.26Å; F547-E636 HydrophobicContact CE1-CG 4.37Å; F547-C640 WeakPolarHBondContact CE1-SG 3.36Å; F547-C640 WeakPolarHBondContact CZ-SG 3.5Å
548	L	96.6	Very high	94.6	Very high	13 Å²	13	40.2 Å²	40.2	7%	0.068	22%	0.221	C	C	.	.	H	α-helix	trans	-55.7	-36.7	171.7	-74.6	167	0	0	0	112.6	Y67 Q70 A71 I384 L387 N544 L546 L550	Y67-L548 CarbonylContact C-O 3.57Å; Y67-L548 WeakPolarHBondContact CB-O 3.35Å; Y67-L548 HydrophobicContact CD1-CD2 3.98Å; Q70-L548 HydrophobicContact CB-CD1 4.5Å; Q70-L548 HydrophobicContact CB-CD2 4.16Å; A71-L548 HydrophobicContact CB-CB 3.76Å; I384-L548 HydrophobicContact CG1-CD2 3.95Å; L387-L548 HydrophobicContact CD1-CD2 4.08Å; N544-L548 VanDerWaalsContact O-CB 3.31Å; N544-L548 WeakPolarHBondContact O-CB 3.23Å; N544-L548 WeakPolarHBondContact O-CD1 3.34Å; N544-L548 VanDerWaalsContact O-CG 3.23Å; N544-L548 WeakPolarHBondContact O-CG 3.44Å; N544-L548 PolarHBondContact O-N 3.48Å; L546-L548 PolarHBondContact O-N 2.91Å; L548-L550 VanDerWaalsContact C-N 3.33Å
549	S	96.1	Very high	94.7	Very high	30 Å²	30	39.3 Å²	39.3	21%	0.21	22%	0.218	C	C	.	.	H	α-helix	trans	-76.3	-18.1	177.9	73.9	0	0	0	0	114.2	Q68 T545 L546 F547 P553	Q68-S549 PolarHBondContact OE1-O 3Å; T545-S549 PolarHBondContact O-N 3.37Å; L546-S549 PolarHBondContact O-N 2.89Å; L546-S549 PolarHBondContact O-OG 3.17Å; F547-S549 PolarHBondContact O-N 2.71Å; S549-P553 WeakPolarHBondContact O-CD 3.41Å; S549-P553 WeakPolarHBondContact O-CG 3.37Å
550	L	96.4	Very high	94.5	Very high	64 Å²	64	41.6 Å²	41.6	34%	0.335	23%	0.234	S	C	.	.	H	α-helix	trans	-90.2	-19.5	-179.1	-70.9	175.6	0	0	0	112.8	L546 F547 L548 E552 P553 L554 E636	L546-L550 HydrophobicContact CD1-CD1 4.02Å; L546-L550 HydrophobicContact CD1-CG 4.23Å; L546-L550 HydrophobicContact CG-CD1 3.99Å; L546-L550 WeakPolarHBondContact O-CG 3.42Å; L546-L550 PolarHBondContact O-N 3.14Å; L546-L550 VanDerWaalsContact O-N 3.11Å; F547-L550 PolarHBondContact O-N 3Å; L548-L550 VanDerWaalsContact C-N 3.33Å; L550-E552 PolarHBondContact O-N 2.96Å; L550-P553 WeakPolarHBondContact O-CD 3.39Å; L550-L554 HydrophobicContact CB-CD1 4.03Å; L550-L554 VanDerWaalsContact O-CB 3.25Å; L550-L554 WeakPolarHBondContact O-CB 3.27Å; L550-L554 WeakPolarHBondContact O-CG 3.47Å; L550-L554 PolarHBondContact O-N 3.17Å; L550-E636 VanDerWaalsContact CB-OE1 3.24Å; L550-E636 WeakPolarHBondContact CB-OE1 3.27Å
551	V	96.1	Very high	94.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55.2	-51.7	-179.5	179.8	0	0	0	0	111.2	Y67 I384 F547 L554 T555 E636	Y67-V551 HydrophobicContact CD1-CB 4.37Å; Y67-V551 HydrophobicContact CD1-CG1 4.32Å; Y67-V551 HydrophobicContact CD1-CG2 4.19Å; Y67-V551 HydrophobicContact CD2-CB 4.16Å; Y67-V551 HydrophobicContact CD2-CG1 3.54Å; Y67-V551 HydrophobicContact CE2-CG1 3.95Å; Y67-V551 HydrophobicContact CG-CB 3.86Å; Y67-V551 HydrophobicContact CG-CG1 3.74Å; Y67-V551 HydrophobicContact CG-CG2 4.19Å; I384-V551 HydrophobicContact CD1-CG2 3.56Å; I384-V551 HydrophobicContact CG1-CG2 4.33Å; I384-V551 HydrophobicContact CG2-CG2 4.26Å; F547-V551 WeakPolarHBondContact O-CG2 3.38Å; F547-V551 PolarHBondContact O-N 2.65Å; V551-L554 PolarHBondContact O-N 2.91Å; V551-T555 VanDerWaalsContact O-CB 3.31Å; V551-T555 WeakPolarHBondContact O-CB 3.47Å; V551-T555 PolarHBondContact O-N 3.43Å; V551-T555 PolarHBondContact O-OG1 3.07Å; V551-E636 WeakPolarHBondContact CA-OE1 3.45Å; V551-E636 PolarHBondContact N-OE1 3.26Å
552	E	92.1	Very high	94.4	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.098	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-49.2	-174	-163.4	67	-163.5	0	0	112.1	L550 L554 T555 R557	L550-E552 PolarHBondContact O-N 2.96Å; E552-L554 PolarHBondContact O-N 3.42Å; E552-T555 PolarHBondContact O-N 3.07Å; E552-R557 IonicContact OE1-CZ 3.74Å; E552-R557 VanDerWaalsContact OE1-CZ 3.22Å; E552-R557 IonicContact OE1-NH1 3.27Å; E552-R557 PolarHBondContact OE1-NH1 3.2Å; E552-R557 IonicContact OE1-NH2 3.56Å; E552-R557 PolarHBondContact OE1-NH2 3.39Å; E552-R557 IonicContact OE2-CZ 2.9Å; E552-R557 IonicContact OE2-NH1 3.03Å; E552-R557 IonicContact OE2-NH2 3.22Å; E552-R557 PolarHBondContact OE2-NH2 3.28Å
553	P	92.6	Very high	94.3	Very high	95 Å²	95	43.1 Å²	43.1	62%	0.617	26%	0.26	S	S	*	.	H	α-helix	trans	-58.8	-27.6	174.2	-25.3	34.8	0	0	0	114.8	S549 L550	S549-P553 WeakPolarHBondContact O-CD 3.41Å; S549-P553 WeakPolarHBondContact O-CG 3.37Å; L550-P553 WeakPolarHBondContact O-CD 3.39Å
554	L	95.9	Very high	94.1	Very high	56 Å²	56	45 Å²	45	29%	0.293	27%	0.269	S	S	.	.	H	α-helix	trans	-89.6	-8.8	177.4	-66.1	174.3	0	0	0	113.3	L550 V551 E552 V635 E636	L550-L554 HydrophobicContact CB-CD1 4.03Å; L550-L554 VanDerWaalsContact O-CB 3.25Å; L550-L554 WeakPolarHBondContact O-CB 3.27Å; L550-L554 WeakPolarHBondContact O-CG 3.47Å; L550-L554 PolarHBondContact O-N 3.17Å; V551-L554 PolarHBondContact O-N 2.91Å; E552-L554 PolarHBondContact O-N 3.42Å; L554-V635 HydrophobicContact CD1-CG1 4.41Å; L554-E636 HydrophobicContact CD1-CG 3.81Å
555	T	95.1	Very high	93.9	Very high	13 Å²	13	46.3 Å²	46.3	8%	0.08	28%	0.276	C	S	.	.			trans	-90.6	124.3	-179.4	-63.5	0	0	0	0	110.4	V551 E552 R557 T628 L630 G632	V551-T555 VanDerWaalsContact O-CB 3.31Å; V551-T555 WeakPolarHBondContact O-CB 3.47Å; V551-T555 PolarHBondContact O-N 3.43Å; V551-T555 PolarHBondContact O-OG1 3.07Å; E552-T555 PolarHBondContact O-N 3.07Å; T555-R557 HydrophobicContact CG2-CG 3.92Å; T555-T628 HydrophobicContact CG2-CG2 3.92Å; T555-L630 CarbonylContact C-O 3.56Å; T555-L630 WeakPolarHBondContact CA-O 3.47Å; T555-G632 PolarHBondContact OG1-N 3.4Å
556	L	93.5	Very high	93.6	Very high	101 Å²	101	49.7 Å²	49.7	53%	0.529	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120.2	175.5	-61.1	176.4	0	0	0	110	L629 L630	L556-L629 PolarHBondContact O-N 2.03Å; L556-L630 HydrophobicContact CB-CB 4.15Å; L556-L630 HydrophobicContact CD1-CB 4.31Å; L556-L630 HydrophobicContact CD1-CD2 4.2Å; L556-L630 HydrophobicContact CG-CB 4.4Å; L556-L630 PolarHBondContact N-O 3.05Å; L556-L630 PolarHBondContact O-N 3.29Å
557	R	92.8	Very high	93.2	Very high	50 Å²	50	45.4 Å²	45.4	19%	0.189	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.6	177.8	-60.1	177.3	-171.8	134.8	15.8	110.7	E552 T555 C610 E611 S627 T628	E552-R557 IonicContact OE1-CZ 3.74Å; E552-R557 VanDerWaalsContact OE1-CZ 3.22Å; E552-R557 IonicContact OE1-NH1 3.27Å; E552-R557 PolarHBondContact OE1-NH1 3.2Å; E552-R557 IonicContact OE1-NH2 3.56Å; E552-R557 PolarHBondContact OE1-NH2 3.39Å; E552-R557 IonicContact OE2-CZ 2.9Å; E552-R557 IonicContact OE2-NH1 3.03Å; E552-R557 IonicContact OE2-NH2 3.22Å; E552-R557 PolarHBondContact OE2-NH2 3.28Å; T555-R557 HydrophobicContact CG2-CG 3.92Å; R557-C610 HydrophobicContact CB-CB 3.83Å; R557-C610 WeakPolarHBondContact CD-O 3.23Å; R557-C610 PolarHBondContact NH1-O 3.45Å; R557-C610 VanDerWaalsContact NH1-O 3.1Å; R557-E611 PolarHBondContact NH1-O 3.24Å; R557-S627 WeakPolarHBondContact CA-O 3.32Å; R557-T628 HydrophobicContact CG-CG2 4.43Å
558	V	92.5	Very high	92.8	Very high	54 Å²	54	44.3 Å²	44.3	33%	0.327	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.2	175.5	-62.8	0	0	0	0	110.7	S560 S627 L629	V558-S560 PolarHBondContact O-N 3.39Å; V558-S627 PolarHBondContact N-O 3.05Å; V558-S627 PolarHBondContact O-N 3.45Å; V558-S627 PolarHBondContact O-OG 2.92Å; V558-L629 HydrophobicContact CB-CD1 4.36Å; V558-L629 HydrophobicContact CG1-CD1 3.6Å; V558-L629 HydrophobicContact CG1-CG 4.33Å; V558-L629 HydrophobicContact CG2-CD1 3.8Å; V558-L629 HydrophobicContact CG2-CD2 4.05Å; V558-L629 HydrophobicContact CG2-CG 3.79Å
559	C	94.1	Very high	92.4	Very high	24 Å²	24	48 Å²	48	16%	0.162	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	107.2	169.8	-173.7	0	0	0	0	109.8	L604 A608 C619	C559-L604 HydrophobicContact CB-CD2 4.32Å; C559-A608 HydrophobicContact CB-CB 4.03Å; C559-A608 WeakPolarHBondContact CB-O 3.5Å; C559-C619 WeakPolarHBondContact CA-SG 3.48Å; C559-C619 HydrophobicContact CB-CB 3.81Å; C559-C619 WeakPolarHBondContact CB-SG 3.19Å; C559-C619 WeakPolarHBondContact SG-CA 3.38Å; C559-C619 WeakPolarHBondContact SG-CB 3.41Å; C559-C619 CovalentContact SG-SG 2.03Å; C559-C619 PolarHBondContact SG-SG 3.31Å
560	S	92.1	Very high	91.8	Very high	47 Å²	47	49.3 Å²	49.3	33%	0.329	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.6	-177.3	-71.6	0	0	0	0	111.9	V558 A562 G624 T625 S627	V558-S560 PolarHBondContact O-N 3.39Å; S560-A562 VanDerWaalsContact C-N 3.25Å; S560-A562 PolarHBondContact O-N 2.93Å; S560-G624 CarbonylContact O-C 3.58Å; S560-G624 WeakPolarHBondContact O-CA 3.41Å; S560-T625 PolarHBondContact N-O 3.44Å; S560-T625 PolarHBondContact O-N 3.23Å; S560-T625 PolarHBondContact O-OG1 3.46Å; S560-S627 VanDerWaalsContact CB-OG 3.31Å; S560-S627 WeakPolarHBondContact CB-OG 3.2Å; S560-S627 PolarHBondContact OG-OG 2.89Å
561	G	91.1	Very high	91.3	Very high	77 Å²	77	47.2 Å²	47.2	79%	0.794	28%	0.277	S	S	*	.	S	Bend	trans	72.4	13.3	176.1	0	0	0	0	0	115.1
562	A	90.9	Very high	90.6	Very high	18 Å²	18	47.9 Å²	47.9	15%	0.149	28%	0.28	C	S	.	.			trans	-69.6	148.1	-179.8	0	0	0	0	0	113.4	S560 I564 L604 I622	S560-A562 VanDerWaalsContact C-N 3.25Å; S560-A562 PolarHBondContact O-N 2.93Å; A562-I564 PolarHBondContact O-N 2.92Å; A562-I564 VanDerWaalsContact O-N 3.1Å; A562-L604 HydrophobicContact CB-CD2 3.94Å; A562-I622 HydrophobicContact CB-CD1 3.68Å; A562-I622 HydrophobicContact CB-CG1 3.95Å
563	D	92.9	Very high	89.8	Confident	73 Å²	73	54.7 Å²	54.7	39%	0.39	31%	0.305	S	S	.	.			trans	-75.6	96.1	170.8	-175.7	-13.3	0	0	0	110.3	L565 K566 A567 I622	D563-L565 PolarHBondContact O-N 3.45Å; D563-L565 WeakPolarHBondContact OD1-CB 3.49Å; D563-L565 PolarHBondContact OD1-N 3.44Å; D563-K566 HydrophobicContact CB-CB 3.91Å; D563-K566 WeakPolarHBondContact O-CB 3.34Å; D563-K566 PolarHBondContact O-N 3.09Å; D563-K566 PolarHBondContact OD1-N 2.81Å; D563-K566 VanDerWaalsContact OD1-N 3.1Å; D563-A567 PolarHBondContact O-N 3.38Å; D563-I622 PolarHBondContact N-O 3.37Å
564	I	91.4	Very high	88.7	Confident	45 Å²	45	53.7 Å²	53.7	23%	0.231	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-33	-178.5	-57.2	156.6	0	0	0	111.3	A562 A567 G568 Y597 Q601 L604	A562-I564 PolarHBondContact O-N 2.92Å; A562-I564 VanDerWaalsContact O-N 3.1Å; I564-A567 PolarHBondContact O-N 3.36Å; I564-G568 PolarHBondContact O-N 3.34Å; I564-Y597 HydrophobicContact CB-CD1 4.12Å; I564-Y597 HydrophobicContact CB-CE1 4.23Å; I564-Y597 HydrophobicContact CG2-CD1 3.69Å; I564-Y597 HydrophobicContact CG2-CE1 4.3Å; I564-Q601 HydrophobicContact CG2-CG 4.31Å; I564-L604 HydrophobicContact CG1-CD1 4.11Å
565	L	89.7	Confident	87.1	Confident	67 Å²	67	54.7 Å²	54.7	35%	0.351	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-43.8	179.1	-176.1	72.7	0	0	0	110.2	D563 G568 L569 I596	D563-L565 PolarHBondContact O-N 3.45Å; D563-L565 WeakPolarHBondContact OD1-CB 3.49Å; D563-L565 PolarHBondContact OD1-N 3.44Å; L565-G568 PolarHBondContact O-N 3.02Å; L565-L569 HydrophobicContact CG-CD1 4.35Å; L565-L569 WeakPolarHBondContact O-CG 3.21Å; L565-L569 PolarHBondContact O-N 3.25Å; L565-I596 HydrophobicContact CD1-CB 4.39Å; L565-I596 HydrophobicContact CD1-CG2 3.69Å
566	K	89.9	Confident	85.3	Confident	83 Å²	83	56 Å²	56	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-43.8	174.7	-171.4	176.1	179.6	-172.3	0	111.6	D563 L569 L570 D621 I622	D563-K566 HydrophobicContact CB-CB 3.91Å; D563-K566 WeakPolarHBondContact O-CB 3.34Å; D563-K566 PolarHBondContact O-N 3.09Å; D563-K566 PolarHBondContact OD1-N 2.81Å; D563-K566 VanDerWaalsContact OD1-N 3.1Å; K566-L569 PolarHBondContact O-N 3.27Å; K566-L570 HydrophobicContact CG-CD1 4.32Å; K566-L570 VanDerWaalsContact O-CG 3.29Å; K566-L570 WeakPolarHBondContact O-CG 3.48Å; K566-L570 PolarHBondContact O-N 3.41Å; K566-D621 WeakPolarHBondContact CE-O 3.43Å; K566-D621 PolarHBondContact NZ-O 3.13Å; K566-I622 HydrophobicContact CD-CG2 4.45Å; K566-I622 HydrophobicContact CG-CG2 4.37Å
567	A	89	Confident	83.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.7	-44.9	174.9	0	0	0	0	0	112.3	D563 I564 L569 L570 S571 W603 L604 I622	D563-A567 PolarHBondContact O-N 3.38Å; I564-A567 PolarHBondContact O-N 3.36Å; A567-L569 PolarHBondContact O-N 3.26Å; A567-L570 WeakPolarHBondContact O-CB 3.4Å; A567-L570 PolarHBondContact O-N 3.06Å; A567-S571 PolarHBondContact O-N 2.89Å; A567-W603 HydrophobicContact CB-CD2 4.35Å; A567-W603 HydrophobicContact CB-CE3 3.82Å; A567-W603 HydrophobicContact CB-CZ3 4.41Å; A567-L604 HydrophobicContact CB-CG 4.35Å; A567-I622 HydrophobicContact CB-CD1 4.09Å
568	G	89.2	Confident	81.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-43.6	178.4	0	0	0	0	0	113	I564 L565 L570 S571 L572 I596 G600	I564-G568 PolarHBondContact O-N 3.34Å; L565-G568 PolarHBondContact O-N 3.02Å; G568-L570 VanDerWaalsContact C-N 3.34Å; G568-L570 PolarHBondContact O-N 3.02Å; G568-S571 WeakPolarHBondContact O-CB 3.44Å; G568-S571 PolarHBondContact O-N 3.29Å; G568-L572 WeakPolarHBondContact O-CG 3Å; G568-L572 PolarHBondContact O-N 2.69Å; G568-L572 VanDerWaalsContact O-N 3.12Å; G568-I596 WeakPolarHBondContact CA-O 3.31Å; G568-G600 VanDerWaalsContact CA-CA 3.49Å
569	L	86.9	Confident	79.4	Confident	91 Å²	91	61 Å²	61	48%	0.476	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-35.4	175.8	-69.5	172.5	0	0	0	112.7	L565 K566 A567 R573 I596	L565-L569 HydrophobicContact CG-CD1 4.35Å; L565-L569 WeakPolarHBondContact O-CG 3.21Å; L565-L569 PolarHBondContact O-N 3.25Å; K566-L569 PolarHBondContact O-N 3.27Å; A567-L569 PolarHBondContact O-N 3.26Å; L569-R573 WeakPolarHBondContact O-CB 3.42Å; L569-R573 PolarHBondContact O-N 3.14Å; L569-I596 HydrophobicContact CD2-CD1 4.33Å; L569-I596 HydrophobicContact CD2-CG2 4.4Å; L569-I596 HydrophobicContact CG-CG2 4.25Å
570	L	83.7	Confident	77.3	Confident	56 Å²	56	64.9 Å²	64.9	29%	0.293	36%	0.364	S	S	.	.	H	α-helix	trans	-65.4	-41.2	174.1	-76.3	166.4	0	0	0	111.8	K566 A567 G568 R573 T574 I622	K566-L570 HydrophobicContact CG-CD1 4.32Å; K566-L570 VanDerWaalsContact O-CG 3.29Å; K566-L570 WeakPolarHBondContact O-CG 3.48Å; K566-L570 PolarHBondContact O-N 3.41Å; A567-L570 WeakPolarHBondContact O-CB 3.4Å; A567-L570 PolarHBondContact O-N 3.06Å; G568-L570 VanDerWaalsContact C-N 3.34Å; G568-L570 PolarHBondContact O-N 3.02Å; L570-R573 PolarHBondContact O-N 3.08Å; L570-T574 PolarHBondContact O-N 3.03Å; L570-T574 PolarHBondContact O-OG1 2.94Å; L570-I622 HydrophobicContact CD1-CG2 3.7Å
571	S	85	Confident	75.3	Confident	21 Å²	21	69.3 Å²	69.3	15%	0.147	38%	0.384	C	S	.	.	H	α-helix	trans	-57.9	-52	174.6	-162.5	0	0	0	0	110.9	A567 G568 R573 T574 D575	A567-S571 PolarHBondContact O-N 2.89Å; G568-S571 WeakPolarHBondContact O-CB 3.44Å; G568-S571 PolarHBondContact O-N 3.29Å; S571-R573 VanDerWaalsContact C-N 3.34Å; S571-R573 PolarHBondContact O-N 3.33Å; S571-T574 WeakPolarHBondContact O-CB 3.01Å; S571-T574 PolarHBondContact O-N 3.33Å; S571-T574 VanDerWaalsContact O-N 3.08Å; S571-D575 PolarHBondContact O-N 3.16Å; S571-D575 VanDerWaalsContact O-N 3.16Å
572	L	82.8	Confident	73.3	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.073	38%	0.378	C	S	.	.	H	α-helix	trans	-64.6	-35.2	-177.9	-66.4	173.4	0	0	0	113.1	G568 T574 D575 S576 Y591 I596	G568-L572 WeakPolarHBondContact O-CG 3Å; G568-L572 PolarHBondContact O-N 2.69Å; G568-L572 VanDerWaalsContact O-N 3.12Å; L572-T574 VanDerWaalsContact C-N 3.3Å; L572-T574 PolarHBondContact O-N 3.34Å; L572-D575 PolarHBondContact O-N 3.38Å; L572-S576 WeakPolarHBondContact O-CB 3.46Å; L572-S576 PolarHBondContact O-N 2.86Å; L572-S576 PolarHBondContact O-OG 2.74Å; L572-Y591 HydrophobicContact CB-CE2 4.46Å; L572-Y591 HydrophobicContact CD1-CD1 3.98Å; L572-Y591 HydrophobicContact CD1-CD2 3.75Å; L572-Y591 HydrophobicContact CD1-CE1 4.29Å; L572-Y591 HydrophobicContact CD1-CE2 4.06Å; L572-Y591 HydrophobicContact CD1-CG 3.69Å; L572-Y591 HydrophobicContact CD2-CD1 3.93Å; L572-Y591 HydrophobicContact CD2-CE1 3.55Å; L572-Y591 HydrophobicContact CD2-CE2 4.29Å; L572-Y591 HydrophobicContact CD2-CG 4.45Å; L572-Y591 HydrophobicContact CG-CE1 4.49Å; L572-I596 HydrophobicContact CD1-CG1 3.94Å
573	R	75.5	Confident	70.9	Confident	163 Å²	163	76.4 Å²	76.4	62%	0.615	40%	0.402	S	S	*	.	H	α-helix	trans	-61.6	-41.7	173.9	-175.3	-179	-68.1	171.9	-1.4	111	L569 L570 S571 S576 I577	L569-R573 WeakPolarHBondContact O-CB 3.42Å; L569-R573 PolarHBondContact O-N 3.14Å; L570-R573 PolarHBondContact O-N 3.08Å; S571-R573 VanDerWaalsContact C-N 3.34Å; S571-R573 PolarHBondContact O-N 3.33Å; R573-S576 WeakPolarHBondContact CA-OG 3.08Å; R573-S576 PolarHBondContact O-N 3.11Å; R573-S576 PolarHBondContact O-OG 3.1Å; R573-I577 HydrophobicContact CG-CD1 4.31Å; R573-I577 WeakPolarHBondContact O-CG1 3.41Å; R573-I577 PolarHBondContact O-N 3.31Å
574	T	68.3	Low	68.6	Low	74 Å²	74	81.3 Å²	81.3	45%	0.454	43%	0.429	S	S	.	.	H	α-helix	trans	-65.8	-41.7	-178.6	-47.8	0	0	0	0	111.1	L570 S571 L572 I577 Q578	L570-T574 PolarHBondContact O-N 3.03Å; L570-T574 PolarHBondContact O-OG1 2.94Å; S571-T574 WeakPolarHBondContact O-CB 3.01Å; S571-T574 PolarHBondContact O-N 3.33Å; S571-T574 VanDerWaalsContact O-N 3.08Å; L572-T574 VanDerWaalsContact C-N 3.3Å; L572-T574 PolarHBondContact O-N 3.34Å; T574-I577 PolarHBondContact O-N 3.44Å; T574-Q578 PolarHBondContact O-N 3.22Å
575	D	62	Low	66.5	Low	77 Å²	77	85 Å²	85	41%	0.412	45%	0.447	S	S	.	.	H	α-helix	trans	-70.3	-35.8	177.1	-61.8	-27.2	0	0	0	112.5	S571 L572 I577 Q578 S579	S571-D575 PolarHBondContact O-N 3.16Å; S571-D575 VanDerWaalsContact O-N 3.16Å; L572-D575 PolarHBondContact O-N 3.38Å; D575-I577 VanDerWaalsContact C-N 3.34Å; D575-I577 PolarHBondContact O-N 3.34Å; D575-Q578 PolarHBondContact O-N 3.15Å; D575-S579 PolarHBondContact O-N 3.45Å; D575-S579 PolarHBondContact O-OG 2.98Å
576	S	57.1	Low	64.2	Low	42 Å²	42	88.2 Å²	88.2	29%	0.294	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-35.8	176.4	69.9	0	0	0	0	112.8	L572 R573 Q578 S579 V580	L572-S576 WeakPolarHBondContact O-CB 3.46Å; L572-S576 PolarHBondContact O-N 2.86Å; L572-S576 PolarHBondContact O-OG 2.74Å; R573-S576 WeakPolarHBondContact CA-OG 3.08Å; R573-S576 PolarHBondContact O-N 3.11Å; R573-S576 PolarHBondContact O-OG 3.1Å; S576-Q578 VanDerWaalsContact C-N 3.31Å; S576-Q578 PolarHBondContact O-N 3.19Å; S576-S579 WeakPolarHBondContact CA-OG 3.24Å; S576-S579 PolarHBondContact O-N 3.29Å; S576-S579 PolarHBondContact O-OG 2.85Å; S576-V580 VanDerWaalsContact O-CB 3.32Å; S576-V580 WeakPolarHBondContact O-CB 3.48Å; S576-V580 WeakPolarHBondContact O-CG2 3.35Å; S576-V580 PolarHBondContact O-N 3.41Å
577	I	55.2	Low	62.2	Low	108 Å²	108	91.3 Å²	91.3	55%	0.554	49%	0.486	S	S	*	.	H	α-helix	trans	-69	-32.2	176.3	-65.9	167.1	0	0	0	111	R573 T574 D575 N581	R573-I577 HydrophobicContact CG-CD1 4.31Å; R573-I577 WeakPolarHBondContact O-CG1 3.41Å; R573-I577 PolarHBondContact O-N 3.31Å; T574-I577 PolarHBondContact O-N 3.44Å; D575-I577 VanDerWaalsContact C-N 3.34Å; D575-I577 PolarHBondContact O-N 3.34Å; I577-N581 PolarHBondContact O-ND2 3.25Å
578	Q	51.4	Low	60.4	Low	141 Å²	141	97.3 Å²	97.3	66%	0.659	53%	0.525	S	S	*	.	H	α-helix	trans	-72.2	-39.4	173.9	-68.1	-173.9	-0.8	0	0	112.5	T574 D575 S576 T582	T574-Q578 PolarHBondContact O-N 3.22Å; D575-Q578 PolarHBondContact O-N 3.15Å; S576-Q578 VanDerWaalsContact C-N 3.31Å; S576-Q578 PolarHBondContact O-N 3.19Å; Q578-T582 PolarHBondContact O-OG1 2.87Å
579	S	49.3	Very low	58.8	Low	59 Å²	59	103 Å²	103	41%	0.413	55%	0.554	S	S	.	*	H	α-helix	trans	-81.2	-31.1	-178.1	52.6	0	0	0	0	114.5	D575 S576 N581 T582 M583	D575-S579 PolarHBondContact O-N 3.45Å; D575-S579 PolarHBondContact O-OG 2.98Å; S576-S579 WeakPolarHBondContact CA-OG 3.24Å; S576-S579 PolarHBondContact O-N 3.29Å; S576-S579 PolarHBondContact O-OG 2.85Å; S579-N581 PolarHBondContact O-N 2.89Å; S579-T582 PolarHBondContact O-N 3.28Å; S579-T582 PolarHBondContact O-OG1 3.2Å; S579-T582 VanDerWaalsContact O-OG1 3.13Å; S579-M583 PolarHBondContact O-N 3.43Å; S579-M583 VanDerWaalsContact O-N 3.11Å
580	V	50.4	Low	57.8	Low	107 Å²	107	107.7 Å²	107.7	65%	0.648	57%	0.573	S	S	*	*	H	α-helix	trans	-65.7	-29.7	176.1	170	0	0	0	0	111.6	S576 T582	S576-V580 VanDerWaalsContact O-CB 3.32Å; S576-V580 WeakPolarHBondContact O-CB 3.48Å; S576-V580 WeakPolarHBondContact O-CG2 3.35Å; S576-V580 PolarHBondContact O-N 3.41Å; V580-T582 PolarHBondContact O-N 3.49Å; V580-T582 VanDerWaalsContact O-N 3.15Å
581	N	50	Low	57.3	Low	139 Å²	139	109.3 Å²	109.3	74%	0.743	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-7.4	172	-73.8	-18.2	0	0	0	113.3	I577 S579	I577-N581 PolarHBondContact O-ND2 3.25Å; S579-N581 PolarHBondContact O-N 2.89Å
582	T	47.8	Very low	57.2	Low	111 Å²	111	111.5 Å²	111.5	68%	0.681	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	-15.2	-178.9	31.8	0	0	0	0	116.1	Q578 S579 V580	Q578-T582 PolarHBondContact O-OG1 2.87Å; S579-T582 PolarHBondContact O-N 3.28Å; S579-T582 PolarHBondContact O-OG1 3.2Å; S579-T582 VanDerWaalsContact O-OG1 3.13Å; V580-T582 PolarHBondContact O-N 3.49Å; V580-T582 VanDerWaalsContact O-N 3.15Å
583	M	41.9	Very low	57.3	Low	133 Å²	133	118.6 Å²	118.6	66%	0.655	62%	0.622	S	S	*	*			trans	-147.7	125.4	179.6	-68.3	-170.8	-170	0	0	116	S579 I585	S579-M583 PolarHBondContact O-N 3.43Å; S579-M583 VanDerWaalsContact O-N 3.11Å; M583-I585 HydrophobicContact CB-CD1 4.16Å; M583-I585 HydrophobicContact CB-CG1 4.15Å; M583-I585 PolarHBondContact O-N 2.77Å; M583-I585 HydrophobicContact SD-CD1 4.15Å
584	N	43.6	Very low	57.9	Low	176 Å²	176	117.1 Å²	117.1	94%	0.941	63%	0.626	S	S	*	*			trans	-66.4	98.5	161.2	-85.6	-19.5	0	0	0	110
585	I	47	Very low	58.7	Low	122 Å²	122	117 Å²	117	63%	0.626	62%	0.62	S	S	*	*			trans	-139.9	124.1	171	-55.6	178.9	0	0	0	111.1	M583 H587	M583-I585 HydrophobicContact CB-CD1 4.16Å; M583-I585 HydrophobicContact CB-CG1 4.15Å; M583-I585 PolarHBondContact O-N 2.77Å; M583-I585 HydrophobicContact SD-CD1 4.15Å; I585-H587 PolarHBondContact O-N 2.95Å
586	T	42.3	Very low	60	Low	135 Å²	135	114.2 Å²	114.2	83%	0.828	61%	0.605	S	S	*	*			trans	-96.3	46.4	-175.1	43.3	0	0	0	0	114
587	H	47.3	Very low	61.6	Low	149 Å²	149	117.5 Å²	117.5	69%	0.69	61%	0.612	S	S	*	*	S	Bend	trans	-125.9	124.7	169.1	-74.3	-68.8	0	0	0	110.6	I585 I589	I585-H587 PolarHBondContact O-N 2.95Å; H587-I589 PolarHBondContact O-N 3.5Å
588	P	51	Low	63.3	Low	126 Å²	126	120.3 Å²	120.3	82%	0.818	62%	0.616	S	S	*	*			trans	-63.6	111	174.2	15.8	-15.5	0	0	0	108.4	Q590	P588-Q590 PolarHBondContact O-N 3.04Å
589	I	56.2	Low	65.1	Low	118 Å²	118	114.8 Å²	114.8	61%	0.605	59%	0.59	S	S	*	*			trans	-65.7	105.5	177.7	-56	171.1	0	0	0	107.4	H587 Y591	H587-I589 PolarHBondContact O-N 3.5Å; I589-Y591 HydrophobicContact CB-CE2 4.02Å; I589-Y591 HydrophobicContact CG2-CD1 4.2Å; I589-Y591 HydrophobicContact CG2-CD2 4.04Å; I589-Y591 HydrophobicContact CG2-CE1 3.73Å; I589-Y591 HydrophobicContact CG2-CE2 3.58Å; I589-Y591 HydrophobicContact CG2-CG 4.34Å; I589-Y591 VanDerWaalsContact CG2-CZ 3.41Å; I589-Y591 PolarHBondContact O-N 3.49Å
590	Q	66.6	Low	67.2	Low	190 Å²	190	112 Å²	112	89%	0.888	57%	0.571	S	S	*	*			trans	-89.8	97.6	176.2	-173.1	163.7	-21.5	0	0	109.1	P588	P588-Q590 PolarHBondContact O-N 3.04Å
591	Y	73	Confident	69.1	Low	90 Å²	90	111.7 Å²	111.7	35%	0.353	56%	0.562	S	S	.	*			trans	-71	139.5	175	-62.6	-81.9	0	0	0	111	L572 I589 E595	L572-Y591 HydrophobicContact CB-CE2 4.46Å; L572-Y591 HydrophobicContact CD1-CD1 3.98Å; L572-Y591 HydrophobicContact CD1-CD2 3.75Å; L572-Y591 HydrophobicContact CD1-CE1 4.29Å; L572-Y591 HydrophobicContact CD1-CE2 4.06Å; L572-Y591 HydrophobicContact CD1-CG 3.69Å; L572-Y591 HydrophobicContact CD2-CD1 3.93Å; L572-Y591 HydrophobicContact CD2-CE1 3.55Å; L572-Y591 HydrophobicContact CD2-CE2 4.29Å; L572-Y591 HydrophobicContact CD2-CG 4.45Å; L572-Y591 HydrophobicContact CG-CE1 4.49Å; I589-Y591 HydrophobicContact CB-CE2 4.02Å; I589-Y591 HydrophobicContact CG2-CD1 4.2Å; I589-Y591 HydrophobicContact CG2-CD2 4.04Å; I589-Y591 HydrophobicContact CG2-CE1 3.73Å; I589-Y591 HydrophobicContact CG2-CE2 3.58Å; I589-Y591 HydrophobicContact CG2-CG 4.34Å; I589-Y591 VanDerWaalsContact CG2-CZ 3.41Å; I589-Y591 PolarHBondContact O-N 3.49Å; Y591-E595 HydrophobicContact CD1-CG 4.44Å
592	S	83.4	Confident	71.1	Confident	67 Å²	67	110 Å²	110	47%	0.469	55%	0.553	S	S	.	*			trans	-71.3	153.9	171.8	73.9	0	0	0	0	110.4	D594 E595 I596	S592-D594 VanDerWaalsContact C-N 3.28Å; S592-D594 PolarHBondContact O-N 2.91Å; S592-E595 PolarHBondContact O-N 3.39Å; S592-E595 VanDerWaalsContact OG-CB 3.32Å; S592-E595 WeakPolarHBondContact OG-CB 3.15Å; S592-E595 PolarHBondContact OG-N 2.95Å; S592-I596 WeakPolarHBondContact O-CG1 2.7Å; S592-I596 PolarHBondContact O-N 3.43Å; S592-I596 VanDerWaalsContact O-N 3.16Å
593	K	84.1	Confident	73.2	Confident	164 Å²	164	106.3 Å²	106.3	71%	0.713	53%	0.526	S	S	*	.	H	α-helix	trans	-57.6	-44.1	176.9	-74.6	-174.6	179	-179.9	0	111.4	E595 I596 Y597	K593-E595 VanDerWaalsContact C-N 3.26Å; K593-E595 PolarHBondContact O-N 3.44Å; K593-I596 PolarHBondContact O-N 3.03Å; K593-I596 VanDerWaalsContact O-N 3.12Å; K593-Y597 VanDerWaalsContact O-CD2 3.28Å; K593-Y597 WeakPolarHBondContact O-CD2 3.33Å; K593-Y597 PolarHBondContact O-N 3.26Å
594	D	87.1	Confident	75.6	Confident	131 Å²	131	100.9 Å²	100.9	70%	0.701	50%	0.5	S	S	*	.	H	α-helix	trans	-60.9	-37.7	-178.8	-58.7	-36.3	0	0	0	112	S592 Y597 R598	S592-D594 VanDerWaalsContact C-N 3.28Å; S592-D594 PolarHBondContact O-N 2.91Å; D594-Y597 PolarHBondContact O-N 3.33Å; D594-R598 WeakPolarHBondContact O-CB 3.5Å; D594-R598 PolarHBondContact O-N 3.36Å
595	E	87	Confident	77.8	Confident	71 Å²	71	96.1 Å²	96.1	33%	0.332	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-41.5	176.1	-172.8	57.7	-154.7	0	0	111.6	Y591 S592 K593 Y597 R598 N599	Y591-E595 HydrophobicContact CD1-CG 4.44Å; S592-E595 PolarHBondContact O-N 3.39Å; S592-E595 VanDerWaalsContact OG-CB 3.32Å; S592-E595 WeakPolarHBondContact OG-CB 3.15Å; S592-E595 PolarHBondContact OG-N 2.95Å; K593-E595 VanDerWaalsContact C-N 3.26Å; K593-E595 PolarHBondContact O-N 3.44Å; E595-Y597 PolarHBondContact O-N 3.39Å; E595-R598 PolarHBondContact O-N 3.08Å; E595-N599 WeakPolarHBondContact O-CB 3.28Å; E595-N599 PolarHBondContact O-N 2.88Å; E595-N599 PolarHBondContact O-ND2 2.9Å; E595-N599 PolarHBondContact OE1-ND2 3.06Å
596	I	87.9	Confident	79.8	Confident	19 Å²	19	93.8 Å²	93.8	10%	0.097	48%	0.48	C	S	.	.	H	α-helix	trans	-63.5	-43.7	175.9	-58.4	165.9	0	0	0	110.5	L565 G568 L569 L572 S592 K593 N599 G600	L565-I596 HydrophobicContact CD1-CB 4.39Å; L565-I596 HydrophobicContact CD1-CG2 3.69Å; G568-I596 WeakPolarHBondContact CA-O 3.31Å; L569-I596 HydrophobicContact CD2-CD1 4.33Å; L569-I596 HydrophobicContact CD2-CG2 4.4Å; L569-I596 HydrophobicContact CG-CG2 4.25Å; L572-I596 HydrophobicContact CD1-CG1 3.94Å; S592-I596 WeakPolarHBondContact O-CG1 2.7Å; S592-I596 PolarHBondContact O-N 3.43Å; S592-I596 VanDerWaalsContact O-N 3.16Å; K593-I596 PolarHBondContact O-N 3.03Å; K593-I596 VanDerWaalsContact O-N 3.12Å; I596-N599 PolarHBondContact O-N 2.91Å; I596-G600 PolarHBondContact O-N 3.5Å
597	Y	91.4	Very high	82.1	Confident	111 Å²	111	90.6 Å²	90.6	44%	0.435	46%	0.458	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.1	-88.6	-81.1	0	0	0	112.1	I564 K593 D594 E595 G600 Q601	I564-Y597 HydrophobicContact CB-CD1 4.12Å; I564-Y597 HydrophobicContact CB-CE1 4.23Å; I564-Y597 HydrophobicContact CG2-CD1 3.69Å; I564-Y597 HydrophobicContact CG2-CE1 4.3Å; K593-Y597 VanDerWaalsContact O-CD2 3.28Å; K593-Y597 WeakPolarHBondContact O-CD2 3.33Å; K593-Y597 PolarHBondContact O-N 3.26Å; D594-Y597 PolarHBondContact O-N 3.33Å; E595-Y597 PolarHBondContact O-N 3.39Å; Y597-G600 PolarHBondContact O-N 3.42Å; Y597-Q601 WeakPolarHBondContact O-CG 3.49Å; Y597-Q601 PolarHBondContact O-N 3.02Å
598	R	91.5	Very high	84.3	Confident	168 Å²	168	83.7 Å²	83.7	63%	0.634	43%	0.426	S	S	*	.	H	α-helix	trans	-63.2	-45.6	178.3	-169.3	-178.5	-174.2	-161.3	1.4	111.7	D594 E595 G600 Q601 L602	D594-R598 WeakPolarHBondContact O-CB 3.5Å; D594-R598 PolarHBondContact O-N 3.36Å; E595-R598 PolarHBondContact O-N 3.08Å; R598-G600 VanDerWaalsContact C-N 3.29Å; R598-G600 PolarHBondContact O-N 2.88Å; R598-Q601 PolarHBondContact O-N 3.09Å; R598-L602 WeakPolarHBondContact O-CG 3.26Å; R598-L602 PolarHBondContact O-N 2.96Å
599	N	89.4	Confident	86.1	Confident	24 Å²	24	79.7 Å²	79.7	13%	0.128	40%	0.4	C	S	.	.	H	α-helix	trans	-65.2	-34.5	176	-71.4	-36.5	0	0	0	111.8	E595 I596 L602 W603	E595-N599 WeakPolarHBondContact O-CB 3.28Å; E595-N599 PolarHBondContact O-N 2.88Å; E595-N599 PolarHBondContact O-ND2 2.9Å; E595-N599 PolarHBondContact OE1-ND2 3.06Å; I596-N599 PolarHBondContact O-N 2.91Å; N599-L602 PolarHBondContact O-N 3.42Å; N599-W603 VanDerWaalsContact O-CB 3.23Å; N599-W603 WeakPolarHBondContact O-CB 3.34Å; N599-W603 PolarHBondContact O-N 3.07Å
600	G	92	Very high	87.7	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.6	-43.2	173	0	0	0	0	0	113.1	G568 I596 Y597 R598 W603 L604	G568-G600 VanDerWaalsContact CA-CA 3.49Å; I596-G600 PolarHBondContact O-N 3.5Å; Y597-G600 PolarHBondContact O-N 3.42Å; R598-G600 VanDerWaalsContact C-N 3.29Å; R598-G600 PolarHBondContact O-N 2.88Å; G600-W603 PolarHBondContact O-N 3.26Å; G600-L604 WeakPolarHBondContact O-CB 3.38Å; G600-L604 VanDerWaalsContact O-CG 3.28Å; G600-L604 WeakPolarHBondContact O-CG 3.35Å; G600-L604 PolarHBondContact O-N 2.89Å
601	Q	91.9	Very high	88.5	Confident	101 Å²	101	70.5 Å²	70.5	47%	0.472	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.9	-69.9	-64.5	-32.9	0	0	112.5	I564 Y597 R598 L604 A605	I564-Q601 HydrophobicContact CG2-CG 4.31Å; Y597-Q601 WeakPolarHBondContact O-CG 3.49Å; Y597-Q601 PolarHBondContact O-N 3.02Å; R598-Q601 PolarHBondContact O-N 3.09Å; Q601-L604 PolarHBondContact O-N 2.96Å; Q601-A605 PolarHBondContact O-N 3.06Å; Q601-A605 VanDerWaalsContact O-N 3.07Å
602	L	90.7	Very high	88.9	Confident	105 Å²	105	69.4 Å²	69.4	55%	0.55	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-43.3	176	-70.5	171.6	0	0	0	111.5	R598 N599 L604 A605 S606	R598-L602 WeakPolarHBondContact O-CG 3.26Å; R598-L602 PolarHBondContact O-N 2.96Å; N599-L602 PolarHBondContact O-N 3.42Å; L602-L604 VanDerWaalsContact C-N 3.34Å; L602-L604 PolarHBondContact O-N 2.92Å; L602-A605 PolarHBondContact O-N 3.49Å; L602-S606 PolarHBondContact O-N 2.85Å; L602-S606 VanDerWaalsContact O-N 3.11Å; L602-S606 PolarHBondContact O-OG 2.85Å
603	W	92.3	Very high	88.8	Confident	32 Å²	32	69 Å²	69	12%	0.121	35%	0.351	C	S	.	.	H	α-helix	trans	-62	-41.8	177.2	-172.4	97.6	0	0	0	111.9	A567 N599 G600 A605 S606 N607 A608 A618 I622	A567-W603 HydrophobicContact CB-CD2 4.35Å; A567-W603 HydrophobicContact CB-CE3 3.82Å; A567-W603 HydrophobicContact CB-CZ3 4.41Å; N599-W603 VanDerWaalsContact O-CB 3.23Å; N599-W603 WeakPolarHBondContact O-CB 3.34Å; N599-W603 PolarHBondContact O-N 3.07Å; G600-W603 PolarHBondContact O-N 3.26Å; W603-A605 VanDerWaalsContact C-N 3.34Å; W603-A605 PolarHBondContact O-N 2.97Å; W603-S606 PolarHBondContact O-N 2.65Å; W603-S606 PolarHBondContact O-OG 3.38Å; W603-N607 HydrophobicContact CD2-CB 4.07Å; W603-N607 HydrophobicContact CE3-CB 4.25Å; W603-N607 HydrophobicContact CH2-CB 4.15Å; W603-N607 HydrophobicContact CZ2-CB 3.96Å; W603-N607 HydrophobicContact CZ3-CB 4.26Å; W603-N607 PolarHBondContact NE1-ND2 3.5Å; W603-N607 WeakPolarHBondContact O-CB 3.32Å; W603-N607 PolarHBondContact O-N 3.32Å; W603-A608 HydrophobicContact CZ3-CB 4.15Å; W603-A618 HydrophobicContact CH2-CB 4.13Å; W603-I622 HydrophobicContact CE3-CD1 4.3Å; W603-I622 HydrophobicContact CH2-CG2 4.25Å; W603-I622 HydrophobicContact CZ3-CD1 3.68Å; W603-I622 HydrophobicContact CZ3-CG2 4.22Å
604	L	91.8	Very high	88.8	Confident	20 Å²	20	69.5 Å²	69.5	11%	0.105	35%	0.354	C	S	.	.	H	α-helix	trans	-58.6	-47	174.5	-79.7	170.4	0	0	0	111.3	C559 A562 I564 A567 G600 Q601 L602 S606 A608 I622	C559-L604 HydrophobicContact CB-CD2 4.32Å; A562-L604 HydrophobicContact CB-CD2 3.94Å; I564-L604 HydrophobicContact CG1-CD1 4.11Å; A567-L604 HydrophobicContact CB-CG 4.35Å; G600-L604 WeakPolarHBondContact O-CB 3.38Å; G600-L604 VanDerWaalsContact O-CG 3.28Å; G600-L604 WeakPolarHBondContact O-CG 3.35Å; G600-L604 PolarHBondContact O-N 2.89Å; Q601-L604 PolarHBondContact O-N 2.96Å; L602-L604 VanDerWaalsContact C-N 3.34Å; L602-L604 PolarHBondContact O-N 2.92Å; L604-S606 VanDerWaalsContact C-N 3.26Å; L604-S606 PolarHBondContact O-N 2.99Å; L604-A608 HydrophobicContact CD2-CB 3.87Å; L604-A608 CarbonylContact O-C 3.4Å; L604-A608 WeakPolarHBondContact O-CA 3.26Å; L604-A608 PolarHBondContact O-N 2.95Å; L604-I622 HydrophobicContact CD2-CD1 3.2Å; L604-I622 HydrophobicContact CG-CD1 4.28Å
605	A	89.4	Confident	88.9	Confident	76 Å²	76	64 Å²	64	63%	0.628	33%	0.325	S	S	*	.	H	α-helix	trans	-65.4	-28.3	-178.1	0	0	0	0	0	113.1	Q601 L602 W603 T609	Q601-A605 PolarHBondContact O-N 3.06Å; Q601-A605 VanDerWaalsContact O-N 3.07Å; L602-A605 PolarHBondContact O-N 3.49Å; W603-A605 VanDerWaalsContact C-N 3.34Å; W603-A605 PolarHBondContact O-N 2.97Å; A605-T609 VanDerWaalsContact O-CG2 3.27Å; A605-T609 WeakPolarHBondContact O-CG2 3.38Å
606	S	89.6	Confident	89	Confident	73 Å²	73	63.2 Å²	63.2	51%	0.51	32%	0.322	S	S	.	.	H	α-helix	trans	-95.1	-37.6	-179	65.8	0	0	0	0	114.2	L602 W603 L604	L602-S606 PolarHBondContact O-N 2.85Å; L602-S606 VanDerWaalsContact O-N 3.11Å; L602-S606 PolarHBondContact O-OG 2.85Å; W603-S606 PolarHBondContact O-N 2.65Å; W603-S606 PolarHBondContact O-OG 3.38Å; L604-S606 VanDerWaalsContact C-N 3.26Å; L604-S606 PolarHBondContact O-N 2.99Å
607	N	91.4	Very high	89	Confident	68 Å²	68	66.9 Å²	66.9	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-110	-21.8	-169.1	-65.5	-44.5	0	0	0	113.9	W603 T615 A618	W603-N607 HydrophobicContact CD2-CB 4.07Å; W603-N607 HydrophobicContact CE3-CB 4.25Å; W603-N607 HydrophobicContact CH2-CB 4.15Å; W603-N607 HydrophobicContact CZ2-CB 3.96Å; W603-N607 HydrophobicContact CZ3-CB 4.26Å; W603-N607 PolarHBondContact NE1-ND2 3.5Å; W603-N607 WeakPolarHBondContact O-CB 3.32Å; W603-N607 PolarHBondContact O-N 3.32Å; N607-T615 WeakPolarHBondContact O-CA 3.48Å; N607-A618 WeakPolarHBondContact O-CB 3.35Å
608	A	92.2	Very high	88.9	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.025	33%	0.325	C	S	.	.			trans	-116.5	42.7	-176.1	0	0	0	0	0	112.1	C559 W603 L604 C610 C619	C559-A608 HydrophobicContact CB-CB 4.03Å; C559-A608 WeakPolarHBondContact CB-O 3.5Å; W603-A608 HydrophobicContact CZ3-CB 4.15Å; L604-A608 HydrophobicContact CD2-CB 3.87Å; L604-A608 CarbonylContact O-C 3.4Å; L604-A608 WeakPolarHBondContact O-CA 3.26Å; L604-A608 PolarHBondContact O-N 2.95Å; A608-C610 PolarHBondContact O-N 3.24Å; A608-C619 HydrophobicContact CB-CB 4.08Å
609	T	89.6	Confident	89	Confident	43 Å²	43	54.4 Å²	54.4	26%	0.264	30%	0.295	S	S	.	.			trans	-71.2	-12.5	-178.3	61.2	0	0	0	0	114.3	A605 E611 T615	A605-T609 VanDerWaalsContact O-CG2 3.27Å; A605-T609 WeakPolarHBondContact O-CG2 3.38Å; T609-E611 PolarHBondContact O-N 3.38Å; T609-T615 WeakPolarHBondContact OG1-CG2 3.37Å
610	C	89.6	Confident	89.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	59.4	21.2	-176.5	-61.8	0	0	0	0	114.8	R557 A608 T615 I616 C626	R557-C610 HydrophobicContact CB-CB 3.83Å; R557-C610 WeakPolarHBondContact CD-O 3.23Å; R557-C610 PolarHBondContact NH1-O 3.45Å; R557-C610 VanDerWaalsContact NH1-O 3.1Å; A608-C610 PolarHBondContact O-N 3.24Å; C610-T615 PolarHBondContact N-OG1 2.94Å; C610-I616 HydrophobicContact CB-CG1 4.36Å; C610-C626 HydrophobicContact CB-CB 3.63Å; C610-C626 WeakPolarHBondContact CB-SG 3.43Å; C610-C626 WeakPolarHBondContact SG-CA 3.47Å; C610-C626 WeakPolarHBondContact SG-CB 3.42Å; C610-C626 CovalentContact SG-SG 2.03Å; C610-C626 PolarHBondContact SG-SG 3.34Å
611	E	83.9	Confident	89.1	Confident	114 Å²	114	61.4 Å²	61.4	53%	0.533	33%	0.332	S	S	.	.	S	Bend	trans	-78.1	-43	179.4	-174.3	-173.5	171.6	0	0	111.7	R557 T609 T615	R557-E611 PolarHBondContact NH1-O 3.24Å; T609-E611 PolarHBondContact O-N 3.38Å; E611-T615 PolarHBondContact N-OG1 2.93Å
612	N	81.5	Confident	89.1	Confident	68 Å²	68	56.6 Å²	56.6	36%	0.364	31%	0.309	S	S	.	.	S	Bend	trans	-131.4	165.7	-176.9	62	54.7	0	0	0	111.7	K614 T615 I616	N612-K614 PolarHBondContact O-N 3.45Å; N612-K614 VanDerWaalsContact O-N 3.07Å; N612-K614 WeakPolarHBondContact OD1-CB 3.15Å; N612-K614 PolarHBondContact OD1-N 3.27Å; N612-K614 VanDerWaalsContact OD1-N 3.15Å; N612-T615 PolarHBondContact N-OG1 3.16Å; N612-T615 PolarHBondContact O-N 3.44Å; N612-T615 PolarHBondContact O-OG1 3.13Å; N612-T615 WeakPolarHBondContact OD1-CG2 3.42Å; N612-T615 PolarHBondContact OD1-N 3.01Å; N612-T615 PolarHBondContact OD1-OG1 3.3Å; N612-I616 WeakPolarHBondContact O-CG1 3.26Å; N612-I616 PolarHBondContact O-N 3.03Å
613	S	80	Confident	89.1	Confident	58 Å²	58	55.6 Å²	55.6	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-50.8	-37.2	-178.1	177.6	0	0	0	0	113.7	I616 Q617	S613-I616 PolarHBondContact O-N 2.91Å; S613-Q617 WeakPolarHBondContact O-CB 3.39Å; S613-Q617 PolarHBondContact O-N 3.31Å
614	K	84.9	Confident	89.1	Confident	175 Å²	175	54.2 Å²	54.2	76%	0.761	31%	0.307	S	S	*	.	H	α-helix	trans	-65.3	-46.5	177	-177.5	-176.3	176.6	-174.1	0	111.7	N612 Q617 A618	N612-K614 PolarHBondContact O-N 3.45Å; N612-K614 VanDerWaalsContact O-N 3.07Å; N612-K614 WeakPolarHBondContact OD1-CB 3.15Å; N612-K614 PolarHBondContact OD1-N 3.27Å; N612-K614 VanDerWaalsContact OD1-N 3.15Å; K614-Q617 PolarHBondContact O-N 2.86Å; K614-A618 WeakPolarHBondContact O-CB 3.47Å; K614-A618 PolarHBondContact O-N 3.26Å
615	T	88.8	Confident	89.1	Confident	15 Å²	15	57.4 Å²	57.4	9%	0.092	33%	0.327	C	S	.	.	H	α-helix	trans	-73	-28.9	178.8	60.1	0	0	0	0	113	N607 T609 C610 E611 N612 C619	N607-T615 WeakPolarHBondContact O-CA 3.48Å; T609-T615 WeakPolarHBondContact OG1-CG2 3.37Å; C610-T615 PolarHBondContact N-OG1 2.94Å; E611-T615 PolarHBondContact N-OG1 2.93Å; N612-T615 PolarHBondContact N-OG1 3.16Å; N612-T615 PolarHBondContact O-N 3.44Å; N612-T615 PolarHBondContact O-OG1 3.13Å; N612-T615 WeakPolarHBondContact OD1-CG2 3.42Å; N612-T615 PolarHBondContact OD1-N 3.01Å; N612-T615 PolarHBondContact OD1-OG1 3.3Å; T615-C619 PolarHBondContact O-N 2.81Å; T615-C619 VanDerWaalsContact O-N 3.13Å
616	I	88.1	Confident	89.2	Confident	55 Å²	55	56.2 Å²	56.2	28%	0.282	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-48.4	171	-67.1	167.1	0	0	0	109.3	C610 N612 S613 A618 C619 L620	C610-I616 HydrophobicContact CB-CG1 4.36Å; N612-I616 WeakPolarHBondContact O-CG1 3.26Å; N612-I616 PolarHBondContact O-N 3.03Å; S613-I616 PolarHBondContact O-N 2.91Å; I616-A618 VanDerWaalsContact C-N 3.33Å; I616-A618 PolarHBondContact O-N 3.27Å; I616-C619 WeakPolarHBondContact O-CB 3.37Å; I616-C619 PolarHBondContact O-N 2.8Å; I616-C619 VanDerWaalsContact O-N 3.16Å; I616-L620 HydrophobicContact CG2-CD1 4.16Å; I616-L620 WeakPolarHBondContact O-CG 3.29Å; I616-L620 PolarHBondContact O-N 3.16Å
617	Q	87.9	Confident	89.2	Confident	95 Å²	95	54.3 Å²	54.3	44%	0.444	30%	0.301	S	S	.	.	H	α-helix	trans	-62.1	-41.8	177.5	-169.5	60.4	44.5	0	0	111.6	S613 K614 C619 L620 D621	S613-Q617 WeakPolarHBondContact O-CB 3.39Å; S613-Q617 PolarHBondContact O-N 3.31Å; K614-Q617 PolarHBondContact O-N 2.86Å; Q617-C619 VanDerWaalsContact C-N 3.26Å; Q617-C619 PolarHBondContact O-N 2.03Å; Q617-L620 PolarHBondContact O-N 3.22Å; Q617-L620 VanDerWaalsContact O-N 3.09Å; Q617-D621 PolarHBondContact NE2-OD1 3.42Å; Q617-D621 WeakPolarHBondContact O-CB 3.36Å; Q617-D621 PolarHBondContact O-N 3.5Å
618	A	90.7	Very high	89.2	Confident	17 Å²	17	54.2 Å²	54.2	14%	0.14	30%	0.303	C	S	.	.	H	α-helix	trans	-58.6	-36.8	175.3	0	0	0	0	0	112.9	W603 N607 K614 I616 I622	W603-A618 HydrophobicContact CH2-CB 4.13Å; N607-A618 WeakPolarHBondContact O-CB 3.35Å; K614-A618 WeakPolarHBondContact O-CB 3.47Å; K614-A618 PolarHBondContact O-N 3.26Å; I616-A618 VanDerWaalsContact C-N 3.33Å; I616-A618 PolarHBondContact O-N 3.27Å; A618-I622 WeakPolarHBondContact O-CG1 3.39Å
619	C	93.3	Very high	89.1	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.7	-44.2	172.9	177.2	0	0	0	0	112.1	C559 A608 T615 I616 Q617 D621 I622 G624	C559-C619 WeakPolarHBondContact CA-SG 3.48Å; C559-C619 HydrophobicContact CB-CB 3.81Å; C559-C619 WeakPolarHBondContact CB-SG 3.19Å; C559-C619 WeakPolarHBondContact SG-CA 3.38Å; C559-C619 WeakPolarHBondContact SG-CB 3.41Å; C559-C619 CovalentContact SG-SG 2.03Å; C559-C619 PolarHBondContact SG-SG 3.31Å; A608-C619 HydrophobicContact CB-CB 4.08Å; T615-C619 PolarHBondContact O-N 2.81Å; T615-C619 VanDerWaalsContact O-N 3.13Å; I616-C619 WeakPolarHBondContact O-CB 3.37Å; I616-C619 PolarHBondContact O-N 2.8Å; I616-C619 VanDerWaalsContact O-N 3.16Å; Q617-C619 VanDerWaalsContact C-N 3.26Å; Q617-C619 PolarHBondContact O-N 2.03Å; C619-D621 PolarHBondContact O-N 2.93Å; C619-I622 WeakPolarHBondContact O-CG1 3.34Å; C619-I622 PolarHBondContact O-N 3.25Å; C619-G624 WeakPolarHBondContact O-CA 3.23Å; C619-G624 PolarHBondContact O-N 3.18Å
620	L	91.7	Very high	89.3	Confident	83 Å²	83	61.4 Å²	61.4	44%	0.435	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-38.4	178.2	-66.1	171.4	0	0	0	112.1	I616 Q617 I622 S623	I616-L620 HydrophobicContact CG2-CD1 4.16Å; I616-L620 WeakPolarHBondContact O-CG 3.29Å; I616-L620 PolarHBondContact O-N 3.16Å; Q617-L620 PolarHBondContact O-N 3.22Å; Q617-L620 VanDerWaalsContact O-N 3.09Å; L620-I622 PolarHBondContact O-N 2.96Å; L620-S623 PolarHBondContact O-N 2.75Å
621	D	91.3	Very high	89.5	Confident	89 Å²	89	61.8 Å²	61.8	48%	0.476	34%	0.34	S	S	.	.	H	α-helix	trans	-62.6	-25	-178.5	-70	-14.7	0	0	0	112.6	K566 Q617 C619	K566-D621 WeakPolarHBondContact CE-O 3.43Å; K566-D621 PolarHBondContact NZ-O 3.13Å; Q617-D621 PolarHBondContact NE2-OD1 3.42Å; Q617-D621 WeakPolarHBondContact O-CB 3.36Å; Q617-D621 PolarHBondContact O-N 3.5Å; C619-D621 PolarHBondContact O-N 2.93Å
622	I	91.9	Very high	90.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	24.7	174.8	62.2	173.3	0	0	0	112.9	A562 D563 K566 A567 L570 W603 L604 A618 C619 L620 G624	A562-I622 HydrophobicContact CB-CD1 3.68Å; A562-I622 HydrophobicContact CB-CG1 3.95Å; D563-I622 PolarHBondContact N-O 3.37Å; K566-I622 HydrophobicContact CD-CG2 4.45Å; K566-I622 HydrophobicContact CG-CG2 4.37Å; A567-I622 HydrophobicContact CB-CD1 4.09Å; L570-I622 HydrophobicContact CD1-CG2 3.7Å; W603-I622 HydrophobicContact CE3-CD1 4.3Å; W603-I622 HydrophobicContact CH2-CG2 4.25Å; W603-I622 HydrophobicContact CZ3-CD1 3.68Å; W603-I622 HydrophobicContact CZ3-CG2 4.22Å; L604-I622 HydrophobicContact CD2-CD1 3.2Å; L604-I622 HydrophobicContact CG-CD1 4.28Å; A618-I622 WeakPolarHBondContact O-CG1 3.39Å; C619-I622 WeakPolarHBondContact O-CG1 3.34Å; C619-I622 PolarHBondContact O-N 3.25Å; L620-I622 PolarHBondContact O-N 2.96Å; I622-G624 PolarHBondContact O-N 2.97Å
623	S	91.5	Very high	90.8	Very high	84 Å²	84	53.1 Å²	53.1	59%	0.587	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	19.1	178.7	-48.8	0	0	0	0	114.3	L620	L620-S623 PolarHBondContact O-N 2.75Å
624	G	92.8	Very high	91.7	Very high	3 Å²	3	53 Å²	53	3%	0.031	29%	0.288	C	S	.	.			trans	-84.7	169.6	173.2	0	0	0	0	0	112.2	S560 C619 I622	S560-G624 CarbonylContact O-C 3.58Å; S560-G624 WeakPolarHBondContact O-CA 3.41Å; C619-G624 WeakPolarHBondContact O-CA 3.23Å; C619-G624 PolarHBondContact O-N 3.18Å; I622-G624 PolarHBondContact O-N 2.97Å
625	T	91.2	Very high	92.2	Very high	87 Å²	87	46.7 Å²	46.7	53%	0.534	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132	172.4	53.2	0	0	0	0	109.2	S560 S627	S560-T625 PolarHBondContact N-O 3.44Å; S560-T625 PolarHBondContact O-N 3.23Å; S560-T625 PolarHBondContact O-OG1 3.46Å; T625-S627 PolarHBondContact O-N 3.47Å
626	C	90.9	Very high	92.7	Very high	50 Å²	50	46 Å²	46	34%	0.338	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	128.3	176.3	-73.3	0	0	0	0	110	C610	C610-C626 HydrophobicContact CB-CB 3.63Å; C610-C626 WeakPolarHBondContact CB-SG 3.43Å; C610-C626 WeakPolarHBondContact SG-CA 3.47Å; C610-C626 WeakPolarHBondContact SG-CB 3.42Å; C610-C626 CovalentContact SG-SG 2.03Å; C610-C626 PolarHBondContact SG-SG 3.34Å
627	S	89.9	Confident	93.2	Very high	34 Å²	34	43.9 Å²	43.9	24%	0.238	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.7	-177.7	45.7	0	0	0	0	110	R557 V558 S560 T625	R557-S627 WeakPolarHBondContact CA-O 3.32Å; V558-S627 PolarHBondContact N-O 3.05Å; V558-S627 PolarHBondContact O-N 3.45Å; V558-S627 PolarHBondContact O-OG 2.92Å; S560-S627 VanDerWaalsContact CB-OG 3.31Å; S560-S627 WeakPolarHBondContact CB-OG 3.2Å; S560-S627 PolarHBondContact OG-OG 2.89Å; T625-S627 PolarHBondContact O-N 3.47Å
628	T	90.7	Very high	93.6	Very high	66 Å²	66	41.3 Å²	41.3	41%	0.405	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118	178.1	-55.8	0	0	0	0	109	T555 R557 D631	T555-T628 HydrophobicContact CG2-CG2 3.92Å; R557-T628 HydrophobicContact CG-CG2 4.43Å; T628-D631 HydrophobicContact CG2-CB 4.11Å
629	L	91.1	Very high	93.9	Very high	124 Å²	124	45.1 Å²	45.1	65%	0.649	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	-41.2	177.1	-64.6	178.6	0	0	0	111.6	L556 V558	L556-L629 PolarHBondContact O-N 2.03Å; V558-L629 HydrophobicContact CB-CD1 4.36Å; V558-L629 HydrophobicContact CG1-CD1 3.6Å; V558-L629 HydrophobicContact CG1-CG 4.33Å; V558-L629 HydrophobicContact CG2-CD1 3.8Å; V558-L629 HydrophobicContact CG2-CD2 4.05Å; V558-L629 HydrophobicContact CG2-CG 3.79Å
630	L	94.2	Very high	94.2	Very high	73 Å²	73	45.3 Å²	45.3	38%	0.382	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122	177.2	-179.3	65.5	0	0	0	107.9	T555 L556 V635	T555-L630 CarbonylContact C-O 3.56Å; T555-L630 WeakPolarHBondContact CA-O 3.47Å; L556-L630 HydrophobicContact CB-CB 4.15Å; L556-L630 HydrophobicContact CD1-CB 4.31Å; L556-L630 HydrophobicContact CD1-CD2 4.2Å; L556-L630 HydrophobicContact CG-CB 4.4Å; L556-L630 PolarHBondContact N-O 3.05Å; L556-L630 PolarHBondContact O-N 3.29Å; L630-V635 HydrophobicContact CD1-CG2 3.84Å; L630-V635 HydrophobicContact CD2-CG2 3.83Å; L630-V635 HydrophobicContact CG-CG2 3.86Å
631	D	94.1	Very high	94.4	Very high	8 Å²	8	44 Å²	44	4%	0.043	26%	0.26	C	S	.	.			trans	-90.9	125.2	175	-162.3	-50.7	0	0	0	109.4	K388 T628 F633 Y634 V635	K388-D631 WeakPolarHBondContact CE-OD1 3.33Å; K388-D631 WeakPolarHBondContact CE-OD2 3.41Å; K388-D631 VanDerWaalsContact NZ-CG 3.27Å; K388-D631 IonicContact NZ-OD1 2.75Å; K388-D631 PolarHBondContact NZ-OD1 3.45Å; K388-D631 IonicContact NZ-OD2 2.79Å; K388-D631 PolarHBondContact NZ-OD2 3.16Å; T628-D631 HydrophobicContact CG2-CB 4.11Å; D631-F633 PolarHBondContact O-N 2.94Å; D631-F633 VanDerWaalsContact O-N 3.17Å; D631-F633 VanDerWaalsContact OD1-CB 3.25Å; D631-F633 WeakPolarHBondContact OD1-CB 3.28Å; D631-F633 PolarHBondContact OD1-N 3.08Å; D631-Y634 HydrophobicContact CB-CD2 3.47Å; D631-Y634 VanDerWaalsContact CB-CD2 3.47Å; D631-Y634 HydrophobicContact CB-CE2 3.57Å; D631-Y634 HydrophobicContact CB-CG 4.27Å; D631-Y634 PolarHBondContact O-N 3.39Å; D631-V635 PolarHBondContact O-N 3.33Å
632	G	95.8	Very high	94.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-30.3	179.8	0	0	0	0	0	112.6	T555 Y634 V635 E636	T555-G632 PolarHBondContact OG1-N 3.4Å; G632-Y634 VanDerWaalsContact C-N 3.32Å; G632-Y634 PolarHBondContact O-N 3.47Å; G632-V635 WeakPolarHBondContact O-CB 3.02Å; G632-V635 PolarHBondContact O-N 3.36Å; G632-E636 WeakPolarHBondContact O-CG 3.41Å; G632-E636 PolarHBondContact O-N 2.94Å
633	F	97	Very high	95	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-42.6	174.2	167.9	-107.1	0	0	0	112.6	P380 I384 K388 V445 I448 D631 V635 E636 V637	P380-F633 HydrophobicContact CB-CD2 4.26Å; P380-F633 HydrophobicContact CB-CE2 4.06Å; I384-F633 HydrophobicContact CB-CD2 3.84Å; I384-F633 HydrophobicContact CB-CE2 4.16Å; I384-F633 HydrophobicContact CG2-CB 4.25Å; I384-F633 HydrophobicContact CG2-CD2 3.46Å; I384-F633 VanDerWaalsContact CG2-CD2 3.46Å; I384-F633 HydrophobicContact CG2-CE2 4.17Å; I384-F633 HydrophobicContact CG2-CG 4.14Å; K388-F633 HydrophobicContact CD-CB 4.24Å; K388-F633 HydrophobicContact CD-CG 4.47Å; K388-F633 HydrophobicContact CG-CB 4.16Å; K388-F633 HydrophobicContact CG-CD1 4.15Å; K388-F633 HydrophobicContact CG-CD2 4.34Å; K388-F633 HydrophobicContact CG-CG 3.95Å; V445-F633 HydrophobicContact CG2-CE1 4.47Å; I448-F633 HydrophobicContact CD1-CD1 4.34Å; I448-F633 HydrophobicContact CD1-CE1 3.41Å; I448-F633 VanDerWaalsContact CD1-CE1 3.41Å; I448-F633 HydrophobicContact CD1-CZ 3.53Å; D631-F633 PolarHBondContact O-N 2.94Å; D631-F633 VanDerWaalsContact O-N 3.17Å; D631-F633 VanDerWaalsContact OD1-CB 3.25Å; D631-F633 WeakPolarHBondContact OD1-CB 3.28Å; D631-F633 PolarHBondContact OD1-N 3.08Å; F633-V635 VanDerWaalsContact C-N 3.34Å; F633-E636 PolarHBondContact O-N 3.32Å; F633-V637 HydrophobicContact CD2-CG2 4.17Å; F633-V637 HydrophobicContact CE1-CG2 4.26Å; F633-V637 HydrophobicContact CE2-CG2 3.69Å; F633-V637 HydrophobicContact CZ-CG2 3.73Å; F633-V637 WeakPolarHBondContact O-CG2 3.45Å; F633-V637 PolarHBondContact O-N 3.36Å
634	Y	97.1	Very high	95.4	Very high	55 Å²	55	44.5 Å²	44.5	22%	0.216	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-36.7	179.6	-58	-43.5	0	0	0	111.7	V445 I448 Y449 D631 G632 G638	V445-Y634 HydrophobicContact CB-CD1 4.23Å; V445-Y634 HydrophobicContact CB-CE1 4.5Å; V445-Y634 HydrophobicContact CG1-CD1 3.61Å; V445-Y634 HydrophobicContact CG1-CE1 3.93Å; V445-Y634 HydrophobicContact CG1-CG 4.41Å; V445-Y634 HydrophobicContact CG2-CD1 4.05Å; I448-Y634 HydrophobicContact CG2-CE1 4.44Å; Y449-Y634 WeakPolarHBondContact CA-OH 3.37Å; Y449-Y634 HydrophobicContact CD2-CE2 4.23Å; Y449-Y634 PolarHBondContact N-OH 3.2Å; D631-Y634 HydrophobicContact CB-CD2 3.47Å; D631-Y634 VanDerWaalsContact CB-CD2 3.47Å; D631-Y634 HydrophobicContact CB-CE2 3.57Å; D631-Y634 HydrophobicContact CB-CG 4.27Å; D631-Y634 PolarHBondContact O-N 3.39Å; G632-Y634 VanDerWaalsContact C-N 3.32Å; G632-Y634 PolarHBondContact O-N 3.47Å; Y634-G638 PolarHBondContact O-N 3.12Å
635	V	97.3	Very high	95.6	Very high	42 Å²	42	48.7 Å²	48.7	26%	0.255	27%	0.273	S	S	.	.	H	α-helix	trans	-62.4	-48.3	174.5	-178.2	0	0	0	0	109.9	L554 L630 D631 G632 F633 V637 G638 L639	L554-V635 HydrophobicContact CD1-CG1 4.41Å; L630-V635 HydrophobicContact CD1-CG2 3.84Å; L630-V635 HydrophobicContact CD2-CG2 3.83Å; L630-V635 HydrophobicContact CG-CG2 3.86Å; D631-V635 PolarHBondContact O-N 3.33Å; G632-V635 WeakPolarHBondContact O-CB 3.02Å; G632-V635 PolarHBondContact O-N 3.36Å; F633-V635 VanDerWaalsContact C-N 3.34Å; V635-V637 PolarHBondContact O-N 2.83Å; V635-G638 PolarHBondContact O-N 2.97Å; V635-L639 HydrophobicContact CG1-CD1 4.11Å; V635-L639 HydrophobicContact CG1-CG 4.39Å; V635-L639 WeakPolarHBondContact O-CG 3.5Å; V635-L639 PolarHBondContact O-N 3.47Å
636	E	97.9	Very high	95.9	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-44.7	179.2	-74.6	178.1	-163.3	0	0	112.8	P380 I384 F547 L550 V551 L554 G632 F633 G638 L639 C640	P380-E636 HydrophobicContact CB-CB 4.37Å; P380-E636 HydrophobicContact CG-CB 3.91Å; I384-E636 WeakPolarHBondContact CD1-OE2 3Å; F547-E636 HydrophobicContact CD1-CB 4.03Å; F547-E636 HydrophobicContact CD1-CG 3.96Å; F547-E636 WeakPolarHBondContact CD1-OE2 3.26Å; F547-E636 HydrophobicContact CE1-CB 4.26Å; F547-E636 HydrophobicContact CE1-CG 4.37Å; L550-E636 VanDerWaalsContact CB-OE1 3.24Å; L550-E636 WeakPolarHBondContact CB-OE1 3.27Å; V551-E636 WeakPolarHBondContact CA-OE1 3.45Å; V551-E636 PolarHBondContact N-OE1 3.26Å; L554-E636 HydrophobicContact CD1-CG 3.81Å; G632-E636 WeakPolarHBondContact O-CG 3.41Å; G632-E636 PolarHBondContact O-N 2.94Å; F633-E636 PolarHBondContact O-N 3.32Å; E636-G638 VanDerWaalsContact C-N 3.29Å; E636-G638 PolarHBondContact O-N 3.28Å; E636-L639 PolarHBondContact O-N 3Å; E636-C640 WeakPolarHBondContact O-CB 3.49Å; E636-C640 PolarHBondContact O-N 3.03Å; E636-C640 PolarHBondContact O-SG 3.28Å
637	V	98	Very high	96.2	Very high	11 Å²	11	47 Å²	47	7%	0.067	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-42.7	174.8	174.9	0	0	0	0	110.8	P380 T442 V445 F633 V635 C640 L641	P380-V637 HydrophobicContact CB-CG2 3.66Å; P380-V637 HydrophobicContact CG-CG2 4.4Å; T442-V637 HydrophobicContact CG2-CG1 4.17Å; V445-V637 HydrophobicContact CG2-CB 3.83Å; V445-V637 HydrophobicContact CG2-CG1 3.59Å; V445-V637 HydrophobicContact CG2-CG2 4.01Å; F633-V637 HydrophobicContact CD2-CG2 4.17Å; F633-V637 HydrophobicContact CE1-CG2 4.26Å; F633-V637 HydrophobicContact CE2-CG2 3.69Å; F633-V637 HydrophobicContact CZ-CG2 3.73Å; F633-V637 WeakPolarHBondContact O-CG2 3.45Å; F633-V637 PolarHBondContact O-N 3.36Å; V635-V637 PolarHBondContact O-N 2.83Å; V637-C640 PolarHBondContact O-N 3.49Å; V637-L641 WeakPolarHBondContact O-CB 3.21Å; V637-L641 PolarHBondContact O-N 3.44Å
638	G	97.4	Very high	96.6	Very high	40 Å²	40	47.3 Å²	47.3	41%	0.412	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-44	176.3	0	0	0	0	0	112.9	Y634 V635 E636 L641 L642	Y634-G638 PolarHBondContact O-N 3.12Å; V635-G638 PolarHBondContact O-N 2.97Å; E636-G638 VanDerWaalsContact C-N 3.29Å; E636-G638 PolarHBondContact O-N 3.28Å; G638-L641 PolarHBondContact O-N 3.3Å; G638-L642 PolarHBondContact O-N 2.81Å
639	L	97.4	Very high	97	Very high	97 Å²	97	47.7 Å²	47.7	51%	0.508	26%	0.258	S	S	.	.	H	α-helix	trans	-64.3	-44	176.1	-69	175.4	0	0	0	111.8	V635 E636 L642 F643	V635-L639 HydrophobicContact CG1-CD1 4.11Å; V635-L639 HydrophobicContact CG1-CG 4.39Å; V635-L639 WeakPolarHBondContact O-CG 3.5Å; V635-L639 PolarHBondContact O-N 3.47Å; E636-L639 PolarHBondContact O-N 3Å; L639-L642 PolarHBondContact O-N 3.26Å; L639-F643 VanDerWaalsContact O-CB 3.24Å; L639-F643 WeakPolarHBondContact O-CB 3.2Å; L639-F643 PolarHBondContact O-N 2.99Å
640	C	98.1	Very high	97.2	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.027	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-37	176.6	-77.6	0	0	0	0	112.7	V376 P380 F547 E636 V637 G644	V376-C640 PolarHBondContact O-SG 2.7Å; P380-C640 VanDerWaalsContact CD-SG 3.53Å; P380-C640 HydrophobicContact CG-CB 4.32Å; F547-C640 WeakPolarHBondContact CE1-SG 3.36Å; F547-C640 WeakPolarHBondContact CZ-SG 3.5Å; E636-C640 WeakPolarHBondContact O-CB 3.49Å; E636-C640 PolarHBondContact O-N 3.03Å; E636-C640 PolarHBondContact O-SG 3.28Å; V637-C640 PolarHBondContact O-N 3.49Å; C640-G644 PolarHBondContact O-N 3.02Å
641	L	97.9	Very high	97.4	Very high	57 Å²	57	44.8 Å²	44.8	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-51.5	173.4	174.4	60.8	0	0	0	110.7	L438 T442 V637 G638 F643 G644 L645	L438-L641 HydrophobicContact CD2-CD1 4.22Å; L438-L641 HydrophobicContact CG-CD1 4.1Å; T442-L641 HydrophobicContact CG2-CB 3.91Å; T442-L641 HydrophobicContact CG2-CD1 3.75Å; T442-L641 HydrophobicContact CG2-CD2 3.86Å; T442-L641 HydrophobicContact CG2-CG 4.02Å; V637-L641 WeakPolarHBondContact O-CB 3.21Å; V637-L641 PolarHBondContact O-N 3.44Å; G638-L641 PolarHBondContact O-N 3.3Å; L641-F643 VanDerWaalsContact C-N 3.34Å; L641-F643 PolarHBondContact O-N 3.15Å; L641-G644 PolarHBondContact O-N 3.35Å; L641-L645 HydrophobicContact CD1-CD1 3.85Å; L641-L645 HydrophobicContact CD1-CG 3.97Å; L641-L645 HydrophobicContact CG-CD1 4.01Å; L641-L645 HydrophobicContact CG-CG 4.47Å; L641-L645 WeakPolarHBondContact O-CB 3.36Å; L641-L645 VanDerWaalsContact O-CG 3.31Å; L641-L645 WeakPolarHBondContact O-CG 3.41Å; L641-L645 PolarHBondContact O-N 3.12Å
642	L	97.8	Very high	97.5	Very high	103 Å²	103	44.4 Å²	44.4	54%	0.539	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-46.4	179.3	-178.9	63.2	0	0	0	110.9	G638 L639 G644 L645 I646	G638-L642 PolarHBondContact O-N 2.81Å; L639-L642 PolarHBondContact O-N 3.26Å; L642-G644 VanDerWaalsContact C-N 3.34Å; L642-G644 PolarHBondContact O-N 3.16Å; L642-L645 PolarHBondContact O-N 3.37Å; L642-I646 HydrophobicContact CD1-CD1 3.9Å; L642-I646 HydrophobicContact CD1-CG1 4.35Å; L642-I646 HydrophobicContact CG-CD1 3.85Å; L642-I646 WeakPolarHBondContact O-CB 3.38Å; L642-I646 VanDerWaalsContact O-CG1 3.27Å; L642-I646 WeakPolarHBondContact O-CG1 3.41Å; L642-I646 PolarHBondContact O-N 2.96Å
643	F	98.1	Very high	97.6	Very high	79 Å²	79	47.2 Å²	47.2	35%	0.346	26%	0.258	S	S	.	.	H	α-helix	trans	-58.8	-45	176.2	-177	-99.2	0	0	0	111.6	I373 V376 L639 L641 I646 T647	I373-F643 HydrophobicContact CG2-CE1 3.9Å; I373-F643 HydrophobicContact CG2-CZ 4.15Å; V376-F643 HydrophobicContact CB-CE1 4.16Å; V376-F643 HydrophobicContact CG1-CD1 3.95Å; V376-F643 HydrophobicContact CG1-CE1 3.87Å; L639-F643 VanDerWaalsContact O-CB 3.24Å; L639-F643 WeakPolarHBondContact O-CB 3.2Å; L639-F643 PolarHBondContact O-N 2.99Å; L641-F643 VanDerWaalsContact C-N 3.34Å; L641-F643 PolarHBondContact O-N 3.15Å; F643-I646 PolarHBondContact O-N 2.82Å; F643-T647 HydrophobicContact CD1-CG2 4.19Å; F643-T647 HydrophobicContact CD2-CG2 4.04Å; F643-T647 HydrophobicContact CE1-CG2 3.89Å; F643-T647 HydrophobicContact CE2-CG2 3.73Å; F643-T647 HydrophobicContact CG-CG2 4.26Å; F643-T647 HydrophobicContact CZ-CG2 3.66Å; F643-T647 VanDerWaalsContact O-CB 3.31Å; F643-T647 WeakPolarHBondContact O-CB 3.35Å; F643-T647 VanDerWaalsContact O-CG2 3.27Å; F643-T647 WeakPolarHBondContact O-CG2 3.38Å; F643-T647 PolarHBondContact O-N 3.46Å; F643-T647 PolarHBondContact O-OG1 3.05Å
644	G	97.9	Very high	97.6	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.7	-44.2	176.9	0	0	0	0	0	112.9	C377 C640 L641 L642 I646 T647 F648	C377-G644 WeakPolarHBondContact SG-CA 3.24Å; C640-G644 PolarHBondContact O-N 3.02Å; L641-G644 PolarHBondContact O-N 3.35Å; L642-G644 VanDerWaalsContact C-N 3.34Å; L642-G644 PolarHBondContact O-N 3.16Å; G644-I646 VanDerWaalsContact C-N 3.31Å; G644-I646 PolarHBondContact O-N 3.39Å; G644-T647 PolarHBondContact O-N 3.3Å; G644-F648 WeakPolarHBondContact O-CB 3.46Å; G644-F648 PolarHBondContact O-N 3.17Å
645	L	97.8	Very high	97.6	Very high	92 Å²	92	51.1 Å²	51.1	48%	0.482	28%	0.281	S	S	.	.	H	α-helix	trans	-65.3	-33.7	177.8	-70.9	175.5	0	0	0	112.7	L435 L438 L641 L642 P649	L435-L645 HydrophobicContact CD1-CD2 4.29Å; L438-L645 HydrophobicContact CD2-CD2 4.49Å; L641-L645 HydrophobicContact CD1-CD1 3.85Å; L641-L645 HydrophobicContact CD1-CG 3.97Å; L641-L645 HydrophobicContact CG-CD1 4.01Å; L641-L645 HydrophobicContact CG-CG 4.47Å; L641-L645 WeakPolarHBondContact O-CB 3.36Å; L641-L645 VanDerWaalsContact O-CG 3.31Å; L641-L645 WeakPolarHBondContact O-CG 3.41Å; L641-L645 PolarHBondContact O-N 3.12Å; L642-L645 PolarHBondContact O-N 3.37Å; L645-P649 WeakPolarHBondContact O-CD 3.32Å
646	I	98.1	Very high	97.5	Very high	95 Å²	95	49.1 Å²	49.1	49%	0.487	27%	0.269	S	S	.	.	H	α-helix	trans	-75.6	-50.1	175.9	-68.2	168.5	0	0	0	110.7	L642 F643 G644 F648 P649 T650	L642-I646 HydrophobicContact CD1-CD1 3.9Å; L642-I646 HydrophobicContact CD1-CG1 4.35Å; L642-I646 HydrophobicContact CG-CD1 3.85Å; L642-I646 WeakPolarHBondContact O-CB 3.38Å; L642-I646 VanDerWaalsContact O-CG1 3.27Å; L642-I646 WeakPolarHBondContact O-CG1 3.41Å; L642-I646 PolarHBondContact O-N 2.96Å; F643-I646 PolarHBondContact O-N 2.82Å; G644-I646 VanDerWaalsContact C-N 3.31Å; G644-I646 PolarHBondContact O-N 3.39Å; I646-F648 PolarHBondContact O-N 2.99Å; I646-P649 WeakPolarHBondContact O-CD 3.26Å; I646-T650 WeakPolarHBondContact O-CB 3.4Å; I646-T650 VanDerWaalsContact O-CG2 3.29Å; I646-T650 WeakPolarHBondContact O-CG2 3.44Å; I646-T650 PolarHBondContact O-OG1 3.39Å
647	T	98	Very high	97.4	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.043	29%	0.287	C	S	.	.	H	α-helix	trans	-75.1	-25.3	-172.7	56.7	0	0	0	0	113.3	I373 F643 G644 T650 I651 I652	I373-T647 HydrophobicContact CG2-CG2 3.9Å; F643-T647 HydrophobicContact CD1-CG2 4.19Å; F643-T647 HydrophobicContact CD2-CG2 4.04Å; F643-T647 HydrophobicContact CE1-CG2 3.89Å; F643-T647 HydrophobicContact CE2-CG2 3.73Å; F643-T647 HydrophobicContact CG-CG2 4.26Å; F643-T647 HydrophobicContact CZ-CG2 3.66Å; F643-T647 VanDerWaalsContact O-CB 3.31Å; F643-T647 WeakPolarHBondContact O-CB 3.35Å; F643-T647 VanDerWaalsContact O-CG2 3.27Å; F643-T647 WeakPolarHBondContact O-CG2 3.38Å; F643-T647 PolarHBondContact O-N 3.46Å; F643-T647 PolarHBondContact O-OG1 3.05Å; G644-T647 PolarHBondContact O-N 3.3Å; T647-T650 WeakPolarHBondContact CA-OG1 3.48Å; T647-T650 PolarHBondContact O-N 2.9Å; T647-I651 HydrophobicContact CG2-CD1 4.41Å; T647-I651 WeakPolarHBondContact O-CA 3.38Å; T647-I651 PolarHBondContact O-N 3.5Å; T647-I652 PolarHBondContact O-N 3.41Å
648	F	98.2	Very high	97.3	Very high	39 Å²	39	55.9 Å²	55.9	17%	0.171	30%	0.302	C	S	.	.	I	π-helix	trans	-58	-59.1	179.5	-180	-101	0	0	0	113.4	T431 F434 G644 I646 I652 L653	T431-F648 WeakPolarHBondContact O-CE2 3.42Å; F434-F648 HydrophobicContact CB-CD2 4.41Å; F434-F648 HydrophobicContact CB-CE2 4.09Å; F434-F648 HydrophobicContact CD1-CB 4.42Å; F434-F648 AromaticContact CD1-CD2 3.24Å; F434-F648 HydrophobicContact CD1-CD2 3.24Å; F434-F648 AromaticContact CD1-CE2 3.7Å; F434-F648 HydrophobicContact CD1-CE2 3.7Å; F434-F648 HydrophobicContact CD1-CG 4.08Å; F434-F648 HydrophobicContact CE1-CB 3.97Å; F434-F648 AromaticContact CE1-CD2 3.63Å; F434-F648 HydrophobicContact CE1-CD2 3.63Å; F434-F648 HydrophobicContact CE1-CG 4.13Å; F434-F648 AromaticContact CG-CD2 3.93Å; F434-F648 HydrophobicContact CG-CD2 3.93Å; F434-F648 HydrophobicContact CG-CE2 4.12Å; G644-F648 WeakPolarHBondContact O-CB 3.46Å; G644-F648 PolarHBondContact O-N 3.17Å; I646-F648 PolarHBondContact O-N 2.99Å; F648-I652 HydrophobicContact CD2-CB 4.41Å; F648-I652 HydrophobicContact CD2-CG2 4.38Å; F648-L653 VanDerWaalsContact O-CB 3.29Å; F648-L653 WeakPolarHBondContact O-CB 3.1Å; F648-L653 PolarHBondContact O-N 2.84Å
649	P	97.3	Very high	97.2	Very high	74 Å²	74	54 Å²	54	48%	0.481	28%	0.282	S	S	.	.	I	π-helix	trans	-73.5	-27.7	178.7	29.4	-35.3	0	0	0	113.4	L645 I646 P654	L645-P649 WeakPolarHBondContact O-CD 3.32Å; I646-P649 WeakPolarHBondContact O-CD 3.26Å; P649-P654 WeakPolarHBondContact O-CD 3.43Å; P649-P654 WeakPolarHBondContact O-CG 3.25Å
650	T	96.5	Very high	97	Very high	85 Å²	85	49.9 Å²	49.9	52%	0.521	26%	0.261	S	S	.	.	I	π-helix	trans	-87.5	-33.7	-172.1	57.2	0	0	0	0	113.9	I646 T647	I646-T650 WeakPolarHBondContact O-CB 3.4Å; I646-T650 VanDerWaalsContact O-CG2 3.29Å; I646-T650 WeakPolarHBondContact O-CG2 3.44Å; I646-T650 PolarHBondContact O-OG1 3.39Å; T647-T650 WeakPolarHBondContact CA-OG1 3.48Å; T647-T650 PolarHBondContact O-N 2.9Å
651	I	97	Very high	96.8	Very high	52 Å²	52	53.9 Å²	53.9	27%	0.267	29%	0.285	S	S	.	.	I	π-helix	trans	-128.4	-55.9	-173.1	-56.7	173.8	0	0	0	111.4	I373 T647 L653 P654 Y655	I373-I651 HydrophobicContact CD1-CB 4.4Å; I373-I651 HydrophobicContact CD1-CD1 3.94Å; I373-I651 HydrophobicContact CD1-CG2 3.67Å; T647-I651 HydrophobicContact CG2-CD1 4.41Å; T647-I651 WeakPolarHBondContact O-CA 3.38Å; T647-I651 PolarHBondContact O-N 3.5Å; I651-L653 PolarHBondContact O-N 2.94Å; I651-P654 WeakPolarHBondContact O-CD 3.29Å; I651-Y655 HydrophobicContact CG2-CD2 4.05Å; I651-Y655 HydrophobicContact CG2-CE2 4.12Å; I651-Y655 HydrophobicContact CG2-CG 4.31Å; I651-Y655 VanDerWaalsContact O-CB 3.28Å; I651-Y655 WeakPolarHBondContact O-CB 3.32Å; I651-Y655 PolarHBondContact O-N 3.47Å
652	I	97.7	Very high	96.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	I	π-helix	trans	-61.8	-52.6	-170.2	-57.2	177.2	0	0	0	110.6	I373 A374 T431 F434 T647 F648 A656	I373-I652 HydrophobicContact CG2-CD1 4.05Å; I373-I652 HydrophobicContact CG2-CG1 3.9Å; A374-I652 HydrophobicContact CB-CD1 4.43Å; T431-I652 HydrophobicContact CG2-CG2 4.18Å; F434-I652 HydrophobicContact CD2-CD1 4.24Å; F434-I652 HydrophobicContact CE1-CD1 4.08Å; F434-I652 HydrophobicContact CE2-CD1 3.51Å; F434-I652 HydrophobicContact CZ-CD1 3.41Å; F434-I652 VanDerWaalsContact CZ-CD1 3.41Å; T647-I652 PolarHBondContact O-N 3.41Å; F648-I652 HydrophobicContact CD2-CB 4.41Å; F648-I652 HydrophobicContact CD2-CG2 4.38Å; I652-A656 WeakPolarHBondContact O-CB 3.38Å; I652-A656 PolarHBondContact O-N 3.03Å
653	L	96.9	Very high	96.1	Very high	58 Å²	58	52.2 Å²	52.2	30%	0.304	28%	0.279	S	S	.	.	H	α-helix	trans	-66.6	-47.3	-177.8	-179.7	66.7	0	0	0	112.6	T431 F648 I651 Y655 A656 N657	T431-L653 HydrophobicContact CG2-CD1 4.34Å; F648-L653 VanDerWaalsContact O-CB 3.29Å; F648-L653 WeakPolarHBondContact O-CB 3.1Å; F648-L653 PolarHBondContact O-N 2.84Å; I651-L653 PolarHBondContact O-N 2.94Å; L653-Y655 PolarHBondContact O-N 3.13Å; L653-A656 PolarHBondContact O-N 3.09Å; L653-N657 WeakPolarHBondContact O-CB 3.36Å; L653-N657 VanDerWaalsContact O-CG 3.29Å; L653-N657 PolarHBondContact O-N 3.1Å; L653-N657 PolarHBondContact O-ND2 2.92Å
654	P	96.9	Very high	95.3	Very high	58 Å²	58	52.3 Å²	52.3	38%	0.377	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-44.4	175	-27.3	36.2	0	0	0	113.7	P649 I651 N657 H658	P649-P654 WeakPolarHBondContact O-CD 3.43Å; P649-P654 WeakPolarHBondContact O-CG 3.25Å; I651-P654 WeakPolarHBondContact O-CD 3.29Å; P654-N657 PolarHBondContact O-N 2.91Å; P654-H658 VanDerWaalsContact O-CB 3.29Å; P654-H658 WeakPolarHBondContact O-CB 3.13Å; P654-H658 PolarHBondContact O-N 3.19Å
655	Y	96.9	Very high	94.7	Very high	80 Å²	80	58.6 Å²	58.6	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-68.6	-43.3	-179.9	-80.2	18.8	0	0	0	111.3	Q366 I651 L653 N657 H658 L659	Q366-Y655 HydrophobicContact CB-CD2 4Å; Q366-Y655 HydrophobicContact CB-CE2 4.07Å; Q366-Y655 HydrophobicContact CG-CD2 4.33Å; Q366-Y655 HydrophobicContact CG-CE2 3.98Å; I651-Y655 HydrophobicContact CG2-CD2 4.05Å; I651-Y655 HydrophobicContact CG2-CE2 4.12Å; I651-Y655 HydrophobicContact CG2-CG 4.31Å; I651-Y655 VanDerWaalsContact O-CB 3.28Å; I651-Y655 WeakPolarHBondContact O-CB 3.32Å; I651-Y655 PolarHBondContact O-N 3.47Å; L653-Y655 PolarHBondContact O-N 3.13Å; Y655-N657 VanDerWaalsContact C-N 3.34Å; Y655-N657 PolarHBondContact O-N 2.87Å; Y655-H658 PolarHBondContact O-N 3.31Å; Y655-L659 WeakPolarHBondContact O-CB 3.32Å; Y655-L659 WeakPolarHBondContact O-CD1 3.42Å; Y655-L659 WeakPolarHBondContact O-CG 3.49Å; Y655-L659 PolarHBondContact O-N 2.99Å
656	A	96.9	Very high	94.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.3	-49.2	175.5	0	0	0	0	0	111.5	L370 L427 T431 I652 L653 H658 L659 D660	L370-A656 HydrophobicContact CD1-CB 3.95Å; L427-A656 HydrophobicContact CB-CB 3.87Å; T431-A656 HydrophobicContact CG2-CB 3.39Å; I652-A656 WeakPolarHBondContact O-CB 3.38Å; I652-A656 PolarHBondContact O-N 3.03Å; L653-A656 PolarHBondContact O-N 3.09Å; A656-H658 PolarHBondContact O-N 3.35Å; A656-L659 PolarHBondContact O-N 2.97Å; A656-D660 WeakPolarHBondContact O-CB 3.48Å; A656-D660 PolarHBondContact O-N 3.27Å
657	N	95.6	Very high	93.7	Very high	72 Å²	72	51.2 Å²	51.2	39%	0.385	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-39.9	179.1	-73	-30.5	0	0	0	112.4	L653 P654 Y655 T661	L653-N657 WeakPolarHBondContact O-CB 3.36Å; L653-N657 VanDerWaalsContact O-CG 3.29Å; L653-N657 PolarHBondContact O-N 3.1Å; L653-N657 PolarHBondContact O-ND2 2.92Å; P654-N657 PolarHBondContact O-N 2.91Å; Y655-N657 VanDerWaalsContact C-N 3.34Å; Y655-N657 PolarHBondContact O-N 2.87Å; N657-T661 WeakPolarHBondContact O-CG2 3.32Å; N657-T661 PolarHBondContact O-N 3.3Å; N657-T661 PolarHBondContact O-OG1 3.21Å
658	H	95.4	Very high	92.9	Very high	81 Å²	81	52.6 Å²	52.6	38%	0.375	29%	0.288	S	S	.	.	H	α-helix	trans	-66.6	-43.1	178.3	-179.4	66.7	0	0	0	112.3	Q366 P654 Y655 A656 T661 Q662	Q366-H658 PolarHBondContact OE1-CD2 3.34Å; P654-H658 VanDerWaalsContact O-CB 3.29Å; P654-H658 WeakPolarHBondContact O-CB 3.13Å; P654-H658 PolarHBondContact O-N 3.19Å; Y655-H658 PolarHBondContact O-N 3.31Å; A656-H658 PolarHBondContact O-N 3.35Å; H658-T661 PolarHBondContact O-N 2.95Å; H658-T661 PolarHBondContact O-OG1 3.43Å; H658-Q662 PolarHBondContact CE1-NE2 3.42Å; H658-Q662 WeakPolarHBondContact O-CG 3.46Å; H658-Q662 PolarHBondContact O-N 3.11Å
659	L	95.6	Very high	92.1	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-69.9	-37.7	-179.9	-69.6	168.1	0	0	0	111.9	P363 Q366 Y367 L370 L427 F515 Y655 A656 T661 Q662 F667	P363-L659 HydrophobicContact CB-CD2 3.85Å; P363-L659 VanDerWaalsContact O-CD2 3.28Å; P363-L659 WeakPolarHBondContact O-CD2 3.37Å; Q366-L659 HydrophobicContact CB-CD1 4.49Å; Q366-L659 HydrophobicContact CB-CD2 4.29Å; Y367-L659 HydrophobicContact CD2-CD1 4.03Å; Y367-L659 HydrophobicContact CG-CD1 4.45Å; L370-L659 HydrophobicContact CD1-CD1 4.4Å; L427-L659 HydrophobicContact CD1-CB 3.68Å; L427-L659 HydrophobicContact CD1-CD1 4.22Å; F515-L659 HydrophobicContact CZ-CB 4.16Å; Y655-L659 WeakPolarHBondContact O-CB 3.32Å; Y655-L659 WeakPolarHBondContact O-CD1 3.42Å; Y655-L659 WeakPolarHBondContact O-CG 3.49Å; Y655-L659 PolarHBondContact O-N 2.99Å; A656-L659 PolarHBondContact O-N 2.97Å; L659-T661 PolarHBondContact O-N 2.79Å; L659-Q662 PolarHBondContact O-N 3.15Å; L659-F667 HydrophobicContact CD2-CE1 4.18Å; L659-F667 HydrophobicContact CD2-CZ 4.28Å
660	D	93.4	Very high	91	Very high	10 Å²	10	59.5 Å²	59.5	5%	0.053	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-25.5	175.9	-98.3	-14.4	0	0	0	113.1	R425 L426 L427 K428 A656	R425-D660 VanDerWaalsContact C-OD2 3.23Å; R425-D660 WeakPolarHBondContact CA-OD2 3.23Å; R425-D660 HydrophobicContact CB-CB 4.4Å; R425-D660 HydrophobicContact CG-CB 4.43Å; L426-D660 PolarHBondContact N-OD1 3.48Å; L426-D660 PolarHBondContact N-OD2 2.88Å; L427-D660 WeakPolarHBondContact CA-OD2 3.32Å; L427-D660 WeakPolarHBondContact CB-OD2 3.31Å; L427-D660 PolarHBondContact N-OD1 3.45Å; L427-D660 PolarHBondContact N-OD2 3.13Å; K428-D660 PolarHBondContact N-OD2 3.11Å; A656-D660 WeakPolarHBondContact O-CB 3.48Å; A656-D660 PolarHBondContact O-N 3.27Å
661	T	92.4	Very high	89.6	Confident	88 Å²	88	58.1 Å²	58.1	54%	0.54	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-7.1	179.5	60.6	0	0	0	0	114.2	N657 H658 L659	N657-T661 WeakPolarHBondContact O-CG2 3.32Å; N657-T661 PolarHBondContact O-N 3.3Å; N657-T661 PolarHBondContact O-OG1 3.21Å; H658-T661 PolarHBondContact O-N 2.95Å; H658-T661 PolarHBondContact O-OG1 3.43Å; L659-T661 PolarHBondContact O-N 2.79Å
662	Q	91.9	Very high	87.8	Confident	51 Å²	51	58.6 Å²	58.6	24%	0.238	31%	0.305	C	S	.	.	S	Bend	trans	-69.6	140.9	176.8	-71.5	-50.7	-60.8	0	0	111.4	H658 L659 A666 F667	H658-Q662 PolarHBondContact CE1-NE2 3.42Å; H658-Q662 WeakPolarHBondContact O-CG 3.46Å; H658-Q662 PolarHBondContact O-N 3.11Å; L659-Q662 PolarHBondContact O-N 3.15Å; Q662-A666 HydrophobicContact CB-CB 4.22Å; Q662-F667 HydrophobicContact CB-CE2 3.6Å; Q662-F667 HydrophobicContact CB-CZ 3.88Å; Q662-F667 HydrophobicContact CG-CZ 4.44Å
663	P	89.4	Confident	85.7	Confident	74 Å²	74	63.5 Å²	63.5	48%	0.481	34%	0.339	S	S	.	.			trans	-72.3	154.6	171.7	35.8	-37.7	0	0	0	110.2	E665 A666	P663-E665 WeakPolarHBondContact CB-OE2 3.28Å; P663-E665 PolarHBondContact O-N 2.93Å; P663-A666 HydrophobicContact CG-CB 4.39Å; P663-A666 VanDerWaalsContact O-CB 3.28Å; P663-A666 WeakPolarHBondContact O-CB 3.46Å; P663-A666 PolarHBondContact O-N 2.86Å
664	N	82.3	Confident	83.4	Confident	81 Å²	81	64.4 Å²	64.4	43%	0.433	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-60.4	-30.9	-174.2	-75.1	-12.2	0	0	0	112.2	A666 F667	N664-A666 PolarHBondContact O-N 3.2Å; N664-F667 WeakPolarHBondContact O-CB 3.27Å; N664-F667 PolarHBondContact O-N 3.15Å
665	E	84.8	Confident	81	Confident	133 Å²	133	62.4 Å²	62.4	62%	0.621	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-61.4	-25.1	177.6	-60.8	80.4	-179.9	0	0	112.9	P663 F667 T668	P663-E665 WeakPolarHBondContact CB-OE2 3.28Å; P663-E665 PolarHBondContact O-N 2.93Å; E665-F667 PolarHBondContact O-N 3.35Å; E665-T668 PolarHBondContact O-N 3.49Å
666	A	87.4	Confident	78.6	Confident	29 Å²	29	62.9 Å²	62.9	24%	0.24	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-67	-22	175.8	0	0	0	0	0	112.6	P363 Q662 P663 N664	P363-A666 VanDerWaalsContact CG-O 3.27Å; P363-A666 WeakPolarHBondContact CG-O 3.11Å; Q662-A666 HydrophobicContact CB-CB 4.22Å; P663-A666 HydrophobicContact CG-CB 4.39Å; P663-A666 VanDerWaalsContact O-CB 3.28Å; P663-A666 WeakPolarHBondContact O-CB 3.46Å; P663-A666 PolarHBondContact O-N 2.86Å; N664-A666 PolarHBondContact O-N 3.2Å
667	F	86.7	Confident	76.2	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.009	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-96.5	-7.6	178.9	-58.8	-84.1	0	0	0	112.7	L361 P363 I364 F515 I519 Y528 L659 Q662 N664 E665	L361-F667 VanDerWaalsContact CD1-O 3.23Å; L361-F667 WeakPolarHBondContact CD1-O 3.36Å; P363-F667 HydrophobicContact CB-CD1 4.04Å; P363-F667 HydrophobicContact CB-CE1 3.65Å; P363-F667 HydrophobicContact CB-CZ 4.2Å; P363-F667 HydrophobicContact CG-CD1 4.17Å; P363-F667 HydrophobicContact CG-CE1 4.27Å; I364-F667 HydrophobicContact CD1-CD1 3.95Å; I364-F667 HydrophobicContact CG1-CD1 4.38Å; F515-F667 HydrophobicContact CZ-CE1 4.36Å; F515-F667 HydrophobicContact CZ-CZ 4.16Å; I519-F667 HydrophobicContact CB-CB 4.11Å; I519-F667 HydrophobicContact CB-CD1 4.01Å; I519-F667 HydrophobicContact CB-CD2 4.2Å; I519-F667 HydrophobicContact CB-CE1 4.46Å; I519-F667 HydrophobicContact CB-CG 3.85Å; I519-F667 HydrophobicContact CD1-CD1 4.08Å; I519-F667 HydrophobicContact CD1-CE1 4.31Å; I519-F667 HydrophobicContact CG2-CD1 4.05Å; I519-F667 HydrophobicContact CG2-CD2 3.91Å; I519-F667 HydrophobicContact CG2-CE1 4.02Å; I519-F667 HydrophobicContact CG2-CE2 3.89Å; I519-F667 HydrophobicContact CG2-CG 3.98Å; I519-F667 HydrophobicContact CG2-CZ 3.96Å; Y528-F667 VanDerWaalsContact CE2-O 3.32Å; Y528-F667 WeakPolarHBondContact CE2-O 3.14Å; Y528-F667 PolarHBondContact OH-O 3.16Å; L659-F667 HydrophobicContact CD2-CE1 4.18Å; L659-F667 HydrophobicContact CD2-CZ 4.28Å; Q662-F667 HydrophobicContact CB-CE2 3.6Å; Q662-F667 HydrophobicContact CB-CZ 3.88Å; Q662-F667 HydrophobicContact CG-CZ 4.44Å; N664-F667 WeakPolarHBondContact O-CB 3.27Å; N664-F667 PolarHBondContact O-N 3.15Å; E665-F667 PolarHBondContact O-N 3.35Å
668	T	82.5	Confident	73.7	Confident	37 Å²	37	71.6 Å²	71.6	23%	0.227	38%	0.384	C	S	.	.			trans	-85.9	125	-179.2	-62.5	0	0	0	0	111.5	D521 E665 R670	D521-T668 WeakPolarHBondContact OD2-CG2 3.32Å; E665-T668 PolarHBondContact O-N 3.49Å; T668-R670 HydrophobicContact CG2-CG 4.12Å
669	F	80.8	Confident	71.2	Confident	51 Å²	51	71.1 Å²	71.1	22%	0.224	38%	0.382	C	S	.	.			trans	-92.9	113.6	172.4	180	-103.7	0	0	0	110.6	F354 I358 L361 P671	F354-F669 AromaticContact CD2-CD1 3.67Å; F354-F669 HydrophobicContact CD2-CD1 3.67Å; F354-F669 HydrophobicContact CD2-CE1 4.05Å; F354-F669 AromaticContact CE2-CD1 3.68Å; F354-F669 HydrophobicContact CE2-CD1 3.68Å; F354-F669 HydrophobicContact CE2-CE1 4.44Å; F354-F669 WeakPolarHBondContact CE2-O 3.16Å; F354-F669 HydrophobicContact CG-CD1 4.3Å; F354-F669 HydrophobicContact CZ-CD1 4.31Å; I358-F669 HydrophobicContact CG1-CB 3.88Å; L361-F669 HydrophobicContact CD1-CB 4.19Å; L361-F669 HydrophobicContact CD2-CD2 4.45Å; F669-P671 HydrophobicContact CE1-CB 4.2Å
670	R	75.2	Confident	68.9	Low	206 Å²	206	76.4 Å²	76.4	78%	0.777	41%	0.407	S	S	*	.			trans	-101.3	112.5	172	-63.9	-172.7	-177.8	178.4	1	110.1	T668 S672	T668-R670 HydrophobicContact CG2-CG 4.12Å; R670-S672 PolarHBondContact O-N 3.02Å
671	P	67.1	Low	66.7	Low	56 Å²	56	78.9 Å²	78.9	36%	0.364	43%	0.425	S	S	.	.			trans	-61.4	137.9	175.3	22.9	-30.1	0	0	0	110.2	F669 S673 L676	F669-P671 HydrophobicContact CE1-CB 4.2Å; P671-S673 PolarHBondContact O-N 2.76Å; P671-L676 HydrophobicContact CB-CD1 4.11Å; P671-L676 HydrophobicContact CG-CD1 4.05Å
672	S	59.1	Low	64.4	Low	63 Å²	63	82.6 Å²	82.6	44%	0.441	43%	0.429	S	S	.	.			trans	-59.3	126	179.2	58.7	0	0	0	0	110.3	R670 S674 S675	R670-S672 PolarHBondContact O-N 3.02Å; S672-S674 PolarHBondContact O-N 2.68Å; S672-S674 VanDerWaalsContact O-N 3.09Å; S672-S675 WeakPolarHBondContact O-CB 3.42Å; S672-S675 PolarHBondContact O-N 3.04Å; S672-S675 PolarHBondContact O-OG 3.42Å; S672-S675 PolarHBondContact OG-OG 3.01Å
673	S	52.9	Low	62.3	Low	102 Å²	102	83 Å²	83	71%	0.713	44%	0.438	S	S	*	.	H	α-helix	trans	-51.6	-32.7	178.5	46.7	0	0	0	0	113.4	P671 S675 L676 A677	P671-S673 PolarHBondContact O-N 2.76Å; S673-S675 PolarHBondContact O-N 3.02Å; S673-L676 PolarHBondContact O-N 3.45Å; S673-A677 PolarHBondContact O-N 2.82Å; S673-A677 VanDerWaalsContact O-N 3.1Å
674	S	47.5	Very low	60.2	Low	78 Å²	78	83.5 Å²	83.5	55%	0.545	44%	0.436	S	S	.	.	H	α-helix	trans	-60.5	-24.2	174.3	61.5	0	0	0	0	114.2	S672 R678	S672-S674 PolarHBondContact O-N 2.68Å; S672-S674 VanDerWaalsContact O-N 3.09Å; S674-R678 PolarHBondContact O-N 3.46Å
675	S	47.8	Very low	58.6	Low	16 Å²	16	86.3 Å²	86.3	11%	0.112	44%	0.444	C	S	.	.	H	α-helix	trans	-85.6	-35.6	179.9	73.1	0	0	0	0	113.4	S672 S673 H679	S672-S675 WeakPolarHBondContact O-CB 3.42Å; S672-S675 PolarHBondContact O-N 3.04Å; S672-S675 PolarHBondContact O-OG 3.42Å; S672-S675 PolarHBondContact OG-OG 3.01Å; S673-S675 PolarHBondContact O-N 3.02Å; S675-H679 PolarHBondContact O-N 3.22Å
676	L	46	Very low	56.6	Low	90 Å²	90	85.4 Å²	85.4	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-66.3	-44.2	170.2	-87.7	93.2	0	0	0	110.2	P671 S673 R678 H679 Q680	P671-L676 HydrophobicContact CB-CD1 4.11Å; P671-L676 HydrophobicContact CG-CD1 4.05Å; S673-L676 PolarHBondContact O-N 3.45Å; L676-R678 PolarHBondContact O-N 3.1Å; L676-H679 PolarHBondContact O-N 2.69Å; L676-Q680 PolarHBondContact O-N 2.79Å
677	A	46	Very low	54.7	Low	53 Å²	53	89.7 Å²	89.7	44%	0.438	46%	0.459	S	S	.	.	H	α-helix	trans	-63.7	-41.2	-179.9	0	0	0	0	0	113.2	S673 H679 Q680 S681	S673-A677 PolarHBondContact O-N 2.82Å; S673-A677 VanDerWaalsContact O-N 3.1Å; A677-H679 VanDerWaalsContact C-N 3.26Å; A677-H679 PolarHBondContact O-N 2.86Å; A677-Q680 PolarHBondContact O-N 3.45Å; A677-S681 PolarHBondContact O-N 2.82Å
678	R	42.8	Very low	53	Low	202 Å²	202	93.7 Å²	93.7	76%	0.762	48%	0.483	S	S	*	.	H	α-helix	trans	-62.5	-32.8	176	-96.9	-175.1	-169.8	173.8	5.3	112.5	S674 L676 S681	S674-R678 PolarHBondContact O-N 3.46Å; L676-R678 PolarHBondContact O-N 3.1Å; R678-S681 PolarHBondContact O-OG 2.85Å
679	H	44.7	Very low	51.2	Low	71 Å²	71	99.1 Å²	99.1	33%	0.329	50%	0.504	S	S	.	.	H	α-helix	trans	-85.9	-33.1	179.2	-88.9	-77.4	0	0	0	113.8	S675 L676 A677 S681 R682 S683	S675-H679 PolarHBondContact O-N 3.22Å; L676-H679 PolarHBondContact O-N 2.69Å; A677-H679 VanDerWaalsContact C-N 3.26Å; A677-H679 PolarHBondContact O-N 2.86Å; H679-S681 PolarHBondContact O-N 3.1Å; H679-R682 CarbonylContact O-C 3.53Å; H679-R682 WeakPolarHBondContact O-CA 3.47Å; H679-R682 PolarHBondContact O-N 2.98Å; H679-S683 PolarHBondContact O-N 3.15Å
680	Q	45.8	Very low	49.5	Very low	112 Å²	112	103.7 Å²	103.7	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-51.7	-47.1	166.5	-88	166.3	-33.7	0	0	110.2	L676 A677 R682 S683 D684	L676-Q680 PolarHBondContact O-N 2.79Å; A677-Q680 PolarHBondContact O-N 3.45Å; Q680-R682 PolarHBondContact O-N 2.81Å; Q680-R682 VanDerWaalsContact O-N 3.11Å; Q680-S683 PolarHBondContact O-N 3.09Å; Q680-D684 WeakPolarHBondContact O-CB 3.48Å; Q680-D684 PolarHBondContact O-N 2.9Å
681	S	46.8	Very low	48.4	Very low	61 Å²	61	98.4 Å²	98.4	43%	0.427	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-24.1	176.3	84.4	0	0	0	0	115	A677 R678 H679 K685	A677-S681 PolarHBondContact O-N 2.82Å; R678-S681 PolarHBondContact O-OG 2.85Å; H679-S681 PolarHBondContact O-N 3.1Å; S681-K685 WeakPolarHBondContact O-CB 3.01Å; S681-K685 WeakPolarHBondContact O-CD 3.29Å; S681-K685 VanDerWaalsContact O-CG 3.23Å; S681-K685 WeakPolarHBondContact O-CG 3.39Å
682	R	45.2	Very low	47.6	Very low	166 Å²	166	106.7 Å²	106.7	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-90.3	-37.3	177.1	-90.1	-177.1	168.9	-179.5	-3.9	112.5	H679 Q680 K685 N686	H679-R682 CarbonylContact O-C 3.53Å; H679-R682 WeakPolarHBondContact O-CA 3.47Å; H679-R682 PolarHBondContact O-N 2.98Å; Q680-R682 PolarHBondContact O-N 2.81Å; Q680-R682 VanDerWaalsContact O-N 3.11Å; R682-K685 PolarHBondContact O-N 2.87Å; R682-N686 PolarHBondContact O-N 2.98Å
683	S	46.7	Very low	47	Very low	61 Å²	61	112.8 Å²	112.8	43%	0.427	56%	0.557	S	S	.	*	H	α-helix	trans	-64.2	-49	174.5	-171.4	0	0	0	0	109.6	H679 Q680 K685 N686 E687	H679-S683 PolarHBondContact O-N 3.15Å; Q680-S683 PolarHBondContact O-N 3.09Å; S683-K685 PolarHBondContact O-N 3.5Å; S683-N686 CarbonylContact O-C 3.56Å; S683-N686 PolarHBondContact O-N 3.49Å; S683-E687 PolarHBondContact O-N 2.97Å
684	D	47.2	Very low	46.3	Very low	83 Å²	83	116.2 Å²	116.2	44%	0.444	57%	0.567	S	S	.	*	H	α-helix	trans	-61.1	-35.3	177.9	-62.7	-13.6	0	0	0	111	Q680 T688	Q680-D684 WeakPolarHBondContact O-CB 3.48Å; Q680-D684 PolarHBondContact O-N 2.9Å; D684-T688 WeakPolarHBondContact O-CB 3.34Å; D684-T688 PolarHBondContact O-N 3.07Å; D684-T688 PolarHBondContact O-OG1 2.99Å
685	K	47.5	Very low	46.3	Very low	141 Å²	141	118.1 Å²	118.1	61%	0.613	57%	0.568	S	S	*	*	H	α-helix	trans	-68.6	-33.4	172.7	-85	-178.6	-178.7	-178.9	0	114	S681 R682 S683 T688 K689	S681-K685 WeakPolarHBondContact O-CB 3.01Å; S681-K685 WeakPolarHBondContact O-CD 3.29Å; S681-K685 VanDerWaalsContact O-CG 3.23Å; S681-K685 WeakPolarHBondContact O-CG 3.39Å; R682-K685 PolarHBondContact O-N 2.87Å; S683-K685 PolarHBondContact O-N 3.5Å; K685-T688 VanDerWaalsContact CA-OG1 3.29Å; K685-T688 WeakPolarHBondContact CA-OG1 3.46Å; K685-T688 PolarHBondContact O-OG1 2.96Å; K685-K689 WeakPolarHBondContact O-CB 3.41Å; K685-K689 WeakPolarHBondContact O-CG 3.38Å; K685-K689 PolarHBondContact O-N 3.31Å; K685-K689 VanDerWaalsContact O-N 3.12Å
686	N	43.6	Very low	46.2	Very low	114 Å²	114	123.5 Å²	123.5	61%	0.61	59%	0.592	S	S	*	*	H	α-helix	trans	-78.2	-36.3	176.9	-86.2	-6.8	0	0	0	111.3	R682 S683 K689 K690	R682-N686 PolarHBondContact O-N 2.98Å; S683-N686 CarbonylContact O-C 3.56Å; S683-N686 PolarHBondContact O-N 3.49Å; N686-K689 PolarHBondContact O-N 2.98Å; N686-K690 PolarHBondContact O-N 3.26Å
687	E	47.9	Very low	46.2	Very low	118 Å²	118	125.3 Å²	125.3	55%	0.551	60%	0.599	S	S	*	*	H	α-helix	trans	-66.5	-45	173.9	-133.8	167	-172.6	0	0	110.6	S683 K689 K690 T691	S683-E687 PolarHBondContact O-N 2.97Å; E687-K689 VanDerWaalsContact C-N 3.27Å; E687-K689 PolarHBondContact O-N 3.09Å; E687-K690 WeakPolarHBondContact O-CB 3.49Å; E687-K690 PolarHBondContact O-N 2.99Å; E687-T691 PolarHBondContact O-N 2.96Å; E687-T691 PolarHBondContact O-OG1 3.07Å
688	T	50.5	Low	46.2	Very low	86 Å²	86	129.6 Å²	129.6	53%	0.528	61%	0.608	S	S	.	*	H	α-helix	trans	-65.1	-25	171.9	37.6	0	0	0	0	114.1	D684 K685 T691 R692	D684-T688 WeakPolarHBondContact O-CB 3.34Å; D684-T688 PolarHBondContact O-N 3.07Å; D684-T688 PolarHBondContact O-OG1 2.99Å; K685-T688 VanDerWaalsContact CA-OG1 3.29Å; K685-T688 WeakPolarHBondContact CA-OG1 3.46Å; K685-T688 PolarHBondContact O-OG1 2.96Å; T688-T691 WeakPolarHBondContact CA-OG1 3.41Å; T688-T691 PolarHBondContact O-OG1 2.97Å; T688-R692 WeakPolarHBondContact O-CB 3.28Å; T688-R692 PolarHBondContact O-N 3Å
689	K	44.1	Very low	46.4	Very low	152 Å²	152	125.1 Å²	125.1	66%	0.661	60%	0.599	S	S	*	*	H	α-helix	trans	-76	-31.6	170	-88.3	-175.9	176.6	-177.2	0	112.6	K685 N686 E687 K693	K685-K689 WeakPolarHBondContact O-CB 3.41Å; K685-K689 WeakPolarHBondContact O-CG 3.38Å; K685-K689 PolarHBondContact O-N 3.31Å; K685-K689 VanDerWaalsContact O-N 3.12Å; N686-K689 PolarHBondContact O-N 2.98Å; E687-K689 VanDerWaalsContact C-N 3.27Å; E687-K689 PolarHBondContact O-N 3.09Å; K689-K693 PolarHBondContact O-N 3.31Å
690	K	44.8	Very low	46.5	Very low	147 Å²	147	128.7 Å²	128.7	64%	0.639	62%	0.617	S	S	*	*	H	α-helix	trans	-72.1	-46.3	178.1	-143.9	178.6	-178.1	-172.4	0	110.2	N686 E687 R692 K693 D694	N686-K690 PolarHBondContact O-N 3.26Å; E687-K690 WeakPolarHBondContact O-CB 3.49Å; E687-K690 PolarHBondContact O-N 2.99Å; K690-R692 PolarHBondContact O-N 3.15Å; K690-K693 PolarHBondContact O-N 3.42Å; K690-D694 PolarHBondContact O-N 2.95Å
691	T	52.4	Low	46.6	Very low	94 Å²	94	129.9 Å²	129.9	58%	0.577	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-7	174.1	49.6	0	0	0	0	115.2	E687 T688	E687-T691 PolarHBondContact O-N 2.96Å; E687-T691 PolarHBondContact O-OG1 3.07Å; T688-T691 WeakPolarHBondContact CA-OG1 3.41Å; T688-T691 PolarHBondContact O-OG1 2.97Å
692	R	50.8	Low	46.6	Very low	231 Å²	231	135.2 Å²	135.2	87%	0.872	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-12.9	167.6	-108.5	-176	174.8	179.8	-0.8	113.6	T688 K690	T688-R692 WeakPolarHBondContact O-CB 3.28Å; T688-R692 PolarHBondContact O-N 3Å; K690-R692 PolarHBondContact O-N 3.15Å
693	K	46.6	Very low	46.7	Very low	190 Å²	190	132.6 Å²	132.6	83%	0.826	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-33.9	177.4	-97.5	-169.5	171.2	-170.3	0	111.7	K689 K690	K689-K693 PolarHBondContact O-N 3.31Å; K690-K693 PolarHBondContact O-N 3.42Å
694	D	38.5	Very low	46.7	Very low	174 Å²	174	139.1 Å²	139.1	93%	0.93	66%	0.659	S	S	*	*			trans	-71.7	0	158.4	-56.4	-26.7	0	0	0	109.1	K690	K690-D694 PolarHBondContact O-N 2.95Å

Retrieved 694 of 694 residues in 242.5 ms (Link to these results)

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