A0A093JR73_STRCA Loading...

Heme oxygenase

AlphaFold DB , UniProt , Accession A0A093JR73, Species STRCA (Struthio camelus australis), Gene n/a, Length 313 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	26.9	Very low	31.8	Very low	240 Å²	240	149.1 Å²	149.1	100%	1.182	84%	0.839	S	S	*	*				0	143.5	0	-79.8	-172.2	154.9	0	0	108
2	P	45.7	Very low	31.9	Very low	120 Å²	120	153.3 Å²	153.3	78%	0.779	85%	0.847	S	S	*	*				-136	170.5	-58.1	32.1	-13.1	0	0	0	112
3	S	30.6	Very low	32.1	Very low	109 Å²	109	155.1 Å²	155.1	76%	0.762	85%	0.845	S	S	*	*			trans	173.8	99	138.9	-167.2	0	0	0	0	107.9
4	V	32.4	Very low	32.2	Very low	116 Å²	116	149.1 Å²	149.1	70%	0.703	84%	0.838	S	S	*	*				59.3	93.6	87.3	-175.2	0	0	0	0	110.7
5	M	34.7	Very low	32.2	Very low	179 Å²	179	149.5 Å²	149.5	88%	0.882	83%	0.83	S	S	*	*				70.5	119	102.9	-70.7	-169.8	168.3	0	0	114.7
6	E	31	Very low	32.3	Very low	195 Å²	195	149.5 Å²	149.5	91%	0.911	83%	0.828	S	S	*	*				-159.7	109.4	128.1	-119.1	167.8	179.3	0	0	109.2
7	G	27.4	Very low	32.8	Very low	78 Å²	78	147.5 Å²	147.5	80%	0.804	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84.2	117.6	168.2	0	0	0	0	0	108
8	S	29.8	Very low	33	Very low	122 Å²	122	148 Å²	148	85%	0.853	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-81.5	126.9	173	-172.3	0	0	0	0	109.6	R10	S8-R10 PolarHBondContact O-N 3.21Å
9	E	31.8	Very low	33.7	Very low	187 Å²	187	145.3 Å²	145.3	87%	0.874	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57	120.1	178.4	-64.9	170.7	141.2	0	0	110.6	G11	E9-G11 PolarHBondContact O-N 3.01Å
10	R	31	Very low	34	Very low	237 Å²	237	147.3 Å²	147.3	89%	0.894	79%	0.787	S	S	*	*			trans	-80.5	101.2	169.9	-166.2	173.4	-173.4	-170.9	0	107.3	S8	S8-R10 PolarHBondContact O-N 3.21Å
11	G	28.6	Very low	34.9	Very low	57 Å²	57	143 Å²	143	59%	0.588	76%	0.762	S	S	*	*			trans	-55.6	135.6	167.5	0	0	0	0	0	110.3	E9 E13	E9-G11 PolarHBondContact O-N 3.01Å; G11-E13 VanDerWaalsContact C-N 3.33Å; G11-E13 PolarHBondContact O-N 2.92Å
12	E	33.2	Very low	36	Very low	199 Å²	199	136 Å²	136	93%	0.93	73%	0.732	S	S	*	*			trans	-65.2	95	168.9	-72.7	177.6	158.7	0	0	108.1	G14	E12-G14 PolarHBondContact O-N 2.68Å
13	E	34.3	Very low	36.3	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	73%	0.731	S	S	*	*			trans	-63.1	121.6	165.7	-71.4	175.8	164.3	0	0	107.8	G11 E15	G11-E13 VanDerWaalsContact C-N 3.33Å; G11-E13 PolarHBondContact O-N 2.92Å; E13-E15 PolarHBondContact O-N 3.06Å
14	G	32.8	Very low	37.5	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	72%	0.719	S	S	*	*			trans	-54.3	129.7	176.1	0	0	0	0	0	110.3	E12 N16	E12-G14 PolarHBondContact O-N 2.68Å; G14-N16 PolarHBondContact O-N 3.14Å
15	E	32.6	Very low	38.6	Very low	154 Å²	154	139.4 Å²	139.4	72%	0.72	73%	0.727	S	S	*	*			trans	-54.7	106.6	176.3	-69.8	-178.7	154.6	0	0	109.2	E13 F17	E13-E15 PolarHBondContact O-N 3.06Å; E15-F17 HydrophobicContact CB-CD2 4.4Å; E15-F17 HydrophobicContact CB-CE1 4.5Å; E15-F17 HydrophobicContact CB-CE2 3.88Å; E15-F17 HydrophobicContact CB-CZ 3.93Å; E15-F17 WeakPolarHBondContact O-CD2 2.99Å; E15-F17 PolarHBondContact O-N 2.8Å; E15-F17 VanDerWaalsContact O-N 3.11Å; E15-F17 VanDerWaalsContact OE2-CZ 3.3Å; E15-F17 WeakPolarHBondContact OE2-CZ 3.25Å
16	N	34	Very low	39.9	Very low	150 Å²	150	138 Å²	138	80%	0.802	72%	0.723	S	S	*	*			trans	-73.2	99.5	171.4	-158.5	24.7	0	0	0	106.3	G14 H18	G14-N16 PolarHBondContact O-N 3.14Å; N16-H18 VanDerWaalsContact C-N 3.27Å; N16-H18 PolarHBondContact O-N 3.24Å
17	F	41.5	Very low	41.9	Very low	115 Å²	115	130.7 Å²	130.7	50%	0.504	69%	0.691	S	S	.	*			trans	-72.9	82.1	-177.5	-72.9	-80.4	0	0	0	110.1	E15 Y19	E15-F17 HydrophobicContact CB-CD2 4.4Å; E15-F17 HydrophobicContact CB-CE1 4.5Å; E15-F17 HydrophobicContact CB-CE2 3.88Å; E15-F17 HydrophobicContact CB-CZ 3.93Å; E15-F17 WeakPolarHBondContact O-CD2 2.99Å; E15-F17 PolarHBondContact O-N 2.8Å; E15-F17 VanDerWaalsContact O-N 3.11Å; E15-F17 VanDerWaalsContact OE2-CZ 3.3Å; E15-F17 WeakPolarHBondContact OE2-CZ 3.25Å; F17-Y19 PolarHBondContact O-N 3.41Å
18	H	35.7	Very low	44.4	Very low	157 Å²	157	129.9 Å²	129.9	73%	0.727	67%	0.673	S	S	*	*			trans	-77.5	107.7	171.9	-149.7	-70.6	0	0	0	108.3	N16 E20	N16-H18 VanDerWaalsContact C-N 3.27Å; N16-H18 PolarHBondContact O-N 3.24Å; H18-E20 PolarHBondContact O-N 3.11Å
19	Y	46.3	Very low	46.7	Very low	96 Å²	96	129.1 Å²	129.1	38%	0.376	67%	0.665	S	S	.	*			trans	-71.4	109.6	170.1	-66.7	-84.5	0	0	0	108.3	F17 E21 S161 V165	F17-Y19 PolarHBondContact O-N 3.41Å; Y19-E21 PolarHBondContact O-N 3Å; Y19-E21 VanDerWaalsContact O-N 3.15Å; Y19-S161 VanDerWaalsContact CE1-O 3.27Å; Y19-S161 WeakPolarHBondContact CE1-O 3.43Å; Y19-V165 HydrophobicContact CE1-CG2 4.46Å; Y19-V165 WeakPolarHBondContact OH-CG2 3.4Å
20	E	39.3	Very low	49.4	Very low	186 Å²	186	124.5 Å²	124.5	87%	0.869	65%	0.65	S	S	*	*			trans	-74.7	100.2	170.3	-75.9	-175.8	170.4	0	0	109.1	H18	H18-E20 PolarHBondContact O-N 3.11Å
21	E	53.5	Low	52.4	Low	56 Å²	56	113.7 Å²	113.7	26%	0.262	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-78.3	119.5	163.4	-104.2	-178.1	179.2	0	0	109.4	Y19 E23 K37 K198 R202	Y19-E21 PolarHBondContact O-N 3Å; Y19-E21 VanDerWaalsContact O-N 3.15Å; E21-E23 PolarHBondContact O-N 2.91Å; E21-K37 IonicContact OE2-NZ 2.85Å; E21-K37 PolarHBondContact OE2-NZ 3.08Å; E21-K198 IonicContact OE1-NZ 3.34Å; E21-R202 IonicContact OE1-CZ 3.52Å; E21-R202 IonicContact OE1-NH1 3.62Å; E21-R202 IonicContact OE1-NH2 2.73Å; E21-R202 PolarHBondContact OE1-NH2 3.44Å; E21-R202 IonicContact OE2-NH2 3.43Å
22	T	49.3	Very low	55.7	Low	93 Å²	93	111 Å²	111	57%	0.571	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-64.7	119.3	168.8	43.5	0	0	0	0	109.5	D24 Q195	T22-D24 PolarHBondContact O-N 2.83Å; T22-Q195 PolarHBondContact OG1-NE2 2.78Å
23	E	52.8	Low	58.7	Low	160 Å²	160	101.6 Å²	101.6	75%	0.748	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-62.3	130.1	172.9	-66.6	-176.4	167.1	0	0	109.2	E21	E21-E23 PolarHBondContact O-N 2.91Å
24	D	55.6	Low	61.6	Low	96 Å²	96	96.1 Å²	96.1	51%	0.513	51%	0.514	S	S	.	.			trans	-91.9	101.7	171.6	-172.4	-1.8	0	0	0	107	T22 N26 V27	T22-D24 PolarHBondContact O-N 2.83Å; D24-N26 PolarHBondContact O-N 3.44Å; D24-V27 HydrophobicContact CB-CG2 3.94Å; D24-V27 PolarHBondContact O-N 2.75Å
25	D	55	Low	64.7	Low	162 Å²	162	95.5 Å²	95.5	87%	0.866	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-4	-172.4	-73.6	-34.1	0	0	0	114.7
26	N	63.2	Low	67.8	Low	148 Å²	148	88.2 Å²	88.2	79%	0.791	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	10.9	-173.8	-152.5	12.2	0	0	0	114.6	D24	D24-N26 PolarHBondContact O-N 3.44Å
27	V	71.7	Confident	70.8	Confident	42 Å²	42	84.6 Å²	84.6	26%	0.255	44%	0.436	S	S	.	.			trans	-94.7	125.4	-178.9	-175	0	0	0	0	111.2	D24 S31 E34	D24-V27 HydrophobicContact CB-CG2 3.94Å; D24-V27 PolarHBondContact O-N 2.75Å; V27-S31 WeakPolarHBondContact CG1-OG 3.22Å; V27-E34 HydrophobicContact CB-CG 4.38Å; V27-E34 HydrophobicContact CG1-CG 3.58Å
28	S	81.2	Confident	73.4	Confident	61 Å²	61	85.4 Å²	85.4	43%	0.427	44%	0.442	S	S	.	.			trans	-62.4	138.1	175.9	176.7	0	0	0	0	111	T30 S31	S28-T30 PolarHBondContact O-N 2.87Å; S28-T30 PolarHBondContact OG-N 3.09Å; S28-T30 PolarHBondContact OG-OG1 2.94Å; S28-S31 WeakPolarHBondContact O-CB 3.45Å; S28-S31 PolarHBondContact O-N 3.49Å; S28-S31 PolarHBondContact O-OG 3.41Å
29	P	78.4	Confident	76.3	Confident	106 Å²	106	79.6 Å²	79.6	69%	0.688	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.5	176.2	26.5	-35.3	0	0	0	113.5
30	T	87.2	Confident	78.8	Confident	90 Å²	90	75.2 Å²	75.2	55%	0.552	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	6.2	175.2	60.4	0	0	0	0	113.4	S28 K215	S28-T30 PolarHBondContact O-N 2.87Å; S28-T30 PolarHBondContact OG-N 3.09Å; S28-T30 PolarHBondContact OG-OG1 2.94Å; T30-K215 PolarHBondContact O-NZ 2.9Å; T30-K215 VanDerWaalsContact O-NZ 3.12Å
31	S	94.7	Very high	81.4	Confident	11 Å²	11	71.5 Å²	71.5	8%	0.077	39%	0.389	C	S	.	.	S	Bend	trans	-67.7	152.5	173.3	74.7	0	0	0	0	110.5	V27 S28 S33 E34 L35 N206	V27-S31 WeakPolarHBondContact CG1-OG 3.22Å; S28-S31 WeakPolarHBondContact O-CB 3.45Å; S28-S31 PolarHBondContact O-N 3.49Å; S28-S31 PolarHBondContact O-OG 3.41Å; S31-S33 VanDerWaalsContact C-N 3.3Å; S31-S33 PolarHBondContact O-N 2.86Å; S31-S33 PolarHBondContact OG-OG 2.69Å; S31-E34 PolarHBondContact O-N 2.92Å; S31-E34 WeakPolarHBondContact OG-CG 3.46Å; S31-E34 PolarHBondContact OG-N 3.29Å; S31-L35 VanDerWaalsContact O-CG 3.27Å; S31-L35 WeakPolarHBondContact O-CG 3.27Å; S31-L35 PolarHBondContact O-N 3.26Å; S31-L35 VanDerWaalsContact O-N 3.08Å; S31-N206 WeakPolarHBondContact CB-OD1 3.36Å
32	L	96.9	Very high	83.5	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.005	41%	0.409	C	S	.	.	H	α-helix	trans	-64.8	-36.8	-177.1	178.9	59.9	0	0	0	111.5	E34 L35 L36 V149 M205 N206 L208 L210 K215 I218	L32-E34 PolarHBondContact O-N 2.96Å; L32-L35 PolarHBondContact O-N 3.07Å; L32-L36 HydrophobicContact CD1-CD1 4.06Å; L32-L36 HydrophobicContact CD1-CG 4.13Å; L32-L36 HydrophobicContact CG-CD1 3.92Å; L32-L36 HydrophobicContact CG-CG 4.45Å; L32-L36 WeakPolarHBondContact O-CB 3.4Å; L32-L36 WeakPolarHBondContact O-CG 3.33Å; L32-L36 PolarHBondContact O-N 3.28Å; L32-V149 HydrophobicContact CD2-CG2 4.39Å; L32-M205 HydrophobicContact CD2-CB 4.34Å; L32-N206 PolarHBondContact N-OD1 3.03Å; L32-N206 VanDerWaalsContact N-OD1 3.08Å; L32-L208 HydrophobicContact CD2-CD1 4.32Å; L32-L210 HydrophobicContact CD2-CD1 3.84Å; L32-K215 HydrophobicContact CD1-CB 4.3Å; L32-K215 HydrophobicContact CD1-CG 4.23Å; L32-I218 HydrophobicContact CD1-CB 4.25Å; L32-I218 HydrophobicContact CD1-CD1 4.33Å; L32-I218 HydrophobicContact CD1-CG2 3.84Å; L32-I218 HydrophobicContact CD2-CD1 4.19Å
33	S	96.4	Very high	85.6	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.007	39%	0.386	C	S	.	.	H	α-helix	trans	-61.8	-43.4	178.8	63.5	0	0	0	0	112.7	S31 K37 N206	S31-S33 VanDerWaalsContact C-N 3.3Å; S31-S33 PolarHBondContact O-N 2.86Å; S31-S33 PolarHBondContact OG-OG 2.69Å; S33-K37 WeakPolarHBondContact O-CB 3.48Å; S33-K37 PolarHBondContact O-N 3.22Å; S33-N206 WeakPolarHBondContact CB-OD1 3.35Å; S33-N206 PolarHBondContact N-OD1 2.68Å; S33-N206 PolarHBondContact OG-ND2 3.3Å; S33-N206 PolarHBondContact OG-OD1 3.01Å
34	E	96.1	Very high	87.5	Confident	61 Å²	61	68.1 Å²	68.1	29%	0.285	37%	0.368	S	S	.	.	H	α-helix	trans	-71.6	-40.4	178.8	-65.7	-49.6	123.5	0	0	111.7	V27 S31 L32 L36 K37 E38	V27-E34 HydrophobicContact CB-CG 4.38Å; V27-E34 HydrophobicContact CG1-CG 3.58Å; S31-E34 PolarHBondContact O-N 2.92Å; S31-E34 WeakPolarHBondContact OG-CG 3.46Å; S31-E34 PolarHBondContact OG-N 3.29Å; L32-E34 PolarHBondContact O-N 2.96Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3.48Å; E34-K37 PolarHBondContact O-N 3.33Å; E34-E38 WeakPolarHBondContact O-CB 3.46Å; E34-E38 PolarHBondContact O-N 3.06Å
35	L	97.9	Very high	89.2	Confident	60 Å²	60	66.8 Å²	66.8	31%	0.314	36%	0.36	S	S	.	.	H	α-helix	trans	-61.4	-40.2	175.3	-70	174	0	0	0	112.1	S31 L32 G39 K215 V219	S31-L35 VanDerWaalsContact O-CG 3.27Å; S31-L35 WeakPolarHBondContact O-CG 3.27Å; S31-L35 PolarHBondContact O-N 3.26Å; S31-L35 VanDerWaalsContact O-N 3.08Å; L32-L35 PolarHBondContact O-N 3.07Å; L35-G39 WeakPolarHBondContact O-CA 3.33Å; L35-G39 PolarHBondContact O-N 3.36Å; L35-K215 HydrophobicContact CD1-CB 4.04Å; L35-K215 HydrophobicContact CD1-CD 4Å; L35-V219 HydrophobicContact CB-CG2 3.95Å
36	L	98	Very high	90.9	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-46.2	173.8	-83.4	168.2	0	0	0	111.6	L32 E34 T40 Y153 M205 I218 V219 A222	L32-L36 HydrophobicContact CD1-CD1 4.06Å; L32-L36 HydrophobicContact CD1-CG 4.13Å; L32-L36 HydrophobicContact CG-CD1 3.92Å; L32-L36 HydrophobicContact CG-CG 4.45Å; L32-L36 WeakPolarHBondContact O-CB 3.4Å; L32-L36 WeakPolarHBondContact O-CG 3.33Å; L32-L36 PolarHBondContact O-N 3.28Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3.48Å; L36-T40 WeakPolarHBondContact O-CB 3.28Å; L36-T40 WeakPolarHBondContact O-CG2 3.36Å; L36-T40 PolarHBondContact O-N 3.5Å; L36-T40 PolarHBondContact O-OG1 3.48Å; L36-Y153 HydrophobicContact CB-CD1 4.23Å; L36-Y153 HydrophobicContact CB-CE1 3.8Å; L36-Y153 HydrophobicContact CB-CE2 4.3Å; L36-Y153 HydrophobicContact CD1-CD1 4.04Å; L36-Y153 HydrophobicContact CD1-CD2 4.06Å; L36-Y153 HydrophobicContact CD1-CE1 4.43Å; L36-Y153 HydrophobicContact CD1-CE2 4.44Å; L36-Y153 HydrophobicContact CD1-CG 3.85Å; L36-Y153 HydrophobicContact CD2-CD1 4Å; L36-Y153 HydrophobicContact CD2-CE1 4.24Å; L36-Y153 HydrophobicContact CG-CD1 4.34Å; L36-Y153 HydrophobicContact CG-CE1 4.4Å; L36-M205 HydrophobicContact CD1-SD 4.05Å; L36-I218 HydrophobicContact CD1-CG2 4.28Å; L36-I218 HydrophobicContact CD2-CG2 4.04Å; L36-I218 HydrophobicContact CG-CG2 4.37Å; L36-V219 HydrophobicContact CD2-CG2 4.29Å; L36-V219 HydrophobicContact CG-CG2 4.4Å; L36-A222 HydrophobicContact CD2-CB 3.46Å; L36-A222 VanDerWaalsContact CD2-CB 3.46Å
37	K	95.5	Very high	92.2	Very high	74 Å²	74	58.2 Å²	58.2	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-59	-55.4	179.1	179.1	174.7	175.6	165.3	0	111.4	E21 S33 E34 K41	E21-K37 IonicContact OE2-NZ 2.85Å; E21-K37 PolarHBondContact OE2-NZ 3.08Å; S33-K37 WeakPolarHBondContact O-CB 3.48Å; S33-K37 PolarHBondContact O-N 3.22Å; E34-K37 PolarHBondContact O-N 3.33Å; K37-K41 PolarHBondContact O-N 3.04Å
38	E	96.4	Very high	93	Very high	132 Å²	132	59.8 Å²	59.8	62%	0.617	32%	0.317	S	S	*	.	H	α-helix	trans	-68.7	-47.6	-178.3	-175.8	58.2	-155.9	0	0	111.1	E34 T40 K41	E34-E38 WeakPolarHBondContact O-CB 3.46Å; E34-E38 PolarHBondContact O-N 3.06Å; E38-T40 PolarHBondContact O-N 2.97Å; E38-K41 WeakPolarHBondContact O-CB 3.35Å; E38-K41 PolarHBondContact O-N 3.45Å
39	G	97.3	Very high	93.4	Very high	36 Å²	36	61.1 Å²	61.1	37%	0.371	32%	0.319	S	S	.	.	H	α-helix	trans	-68.8	-15	-176.2	0	0	0	0	0	114.9	L35 N223	L35-G39 WeakPolarHBondContact O-CA 3.33Å; L35-G39 PolarHBondContact O-N 3.36Å; G39-N223 PolarHBondContact O-ND2 3.13Å; G39-N223 PolarHBondContact O-OD1 3.33Å
40	T	97.3	Very high	94	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.025	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	3.8	174.8	64.3	0	0	0	0	114.1	L36 E38 E42 S43 H44 A222 F226	L36-T40 WeakPolarHBondContact O-CB 3.28Å; L36-T40 WeakPolarHBondContact O-CG2 3.36Å; L36-T40 PolarHBondContact O-N 3.5Å; L36-T40 PolarHBondContact O-OG1 3.48Å; E38-T40 PolarHBondContact O-N 2.97Å; T40-E42 PolarHBondContact O-N 3.12Å; T40-S43 WeakPolarHBondContact O-CB 3.48Å; T40-S43 PolarHBondContact O-N 3.49Å; T40-S43 VanDerWaalsContact O-N 3.1Å; T40-H44 WeakPolarHBondContact O-CB 3.43Å; T40-H44 PolarHBondContact O-N 3.07Å; T40-A222 HydrophobicContact CG2-CB 3.62Å; T40-F226 HydrophobicContact CG2-CD2 4.23Å; T40-F226 HydrophobicContact CG2-CE2 4.03Å
41	K	95.6	Very high	94.2	Very high	108 Å²	108	57.6 Å²	57.6	47%	0.47	29%	0.288	S	S	.	.	H	α-helix	trans	-53.7	-49.5	-177	-175.6	179	179	179.4	0	113.1	K37 E38 S43 H44 D45	K37-K41 PolarHBondContact O-N 3.04Å; E38-K41 WeakPolarHBondContact O-CB 3.35Å; E38-K41 PolarHBondContact O-N 3.45Å; K41-S43 VanDerWaalsContact C-N 3.34Å; K41-S43 PolarHBondContact O-N 3.37Å; K41-H44 WeakPolarHBondContact O-CB 3.48Å; K41-H44 PolarHBondContact O-N 3.03Å; K41-D45 WeakPolarHBondContact O-CB 3.4Å; K41-D45 VanDerWaalsContact O-CG 3.23Å; K41-D45 PolarHBondContact O-N 3.49Å
42	E	96.1	Very high	94.1	Very high	148 Å²	148	58 Å²	58	69%	0.692	29%	0.288	S	S	*	.	H	α-helix	trans	-63.6	-39.6	178.8	-64.3	-173.8	168.7	0	0	112.5	T40 H44 D45 H46	T40-E42 PolarHBondContact O-N 3.12Å; E42-H44 VanDerWaalsContact C-N 3.35Å; E42-D45 PolarHBondContact O-N 3.22Å; E42-H46 WeakPolarHBondContact O-CB 3.1Å; E42-H46 VanDerWaalsContact O-CG 3.27Å; E42-H46 PolarHBondContact O-N 3.4Å; E42-H46 PolarHBondContact O-ND1 2.86Å
43	S	94.8	Very high	93.8	Very high	13 Å²	13	59 Å²	59	9%	0.091	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-38.1	176.9	-74.1	0	0	0	0	112.1	T40 K41 A47 N223	T40-S43 WeakPolarHBondContact O-CB 3.48Å; T40-S43 PolarHBondContact O-N 3.49Å; T40-S43 VanDerWaalsContact O-N 3.1Å; K41-S43 VanDerWaalsContact C-N 3.34Å; K41-S43 PolarHBondContact O-N 3.37Å; S43-A47 WeakPolarHBondContact O-CB 3.28Å; S43-A47 PolarHBondContact O-N 3.12Å; S43-N223 WeakPolarHBondContact CB-OD1 3.45Å; S43-N223 PolarHBondContact OG-OD1 2.96Å
44	H	92.3	Very high	93.6	Very high	77 Å²	77	62.9 Å²	62.9	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-51.4	173	176.8	-85.6	0	0	0	110.9	T40 K41 E42 H46 A47 E48 F226	T40-H44 WeakPolarHBondContact O-CB 3.43Å; T40-H44 PolarHBondContact O-N 3.07Å; K41-H44 WeakPolarHBondContact O-CB 3.48Å; K41-H44 PolarHBondContact O-N 3.03Å; E42-H44 VanDerWaalsContact C-N 3.35Å; H44-H46 VanDerWaalsContact C-N 3.29Å; H44-H46 PolarHBondContact O-N 3.24Å; H44-A47 PolarHBondContact O-N 3.38Å; H44-E48 IonicContact CE1-OE1 2.84Å; H44-E48 PolarHBondContact CE1-OE1 3.38Å; H44-E48 IonicContact CE1-OE2 3.68Å; H44-E48 PolarHBondContact CE1-OE2 2.92Å; H44-E48 IonicContact ND1-OE2 3.96Å; H44-E48 IonicContact NE2-OE1 3.35Å; H44-E48 PolarHBondContact NE2-OE1 3.41Å; H44-E48 PolarHBondContact O-N 3.42Å; H44-F226 HydrophobicContact CB-CE1 4.14Å; H44-F226 HydrophobicContact CB-CZ 4.17Å
45	D	91.6	Very high	93.5	Very high	67 Å²	67	61.4 Å²	61.4	36%	0.358	31%	0.305	S	S	.	.	H	α-helix	trans	-57.9	-42.3	179.1	-69.6	-10.2	0	0	0	111.1	K41 E42 N49	K41-D45 WeakPolarHBondContact O-CB 3.4Å; K41-D45 VanDerWaalsContact O-CG 3.23Å; K41-D45 PolarHBondContact O-N 3.49Å; E42-D45 PolarHBondContact O-N 3.22Å; D45-N49 WeakPolarHBondContact O-CB 3.3Å; D45-N49 PolarHBondContact O-N 3.02Å; D45-N49 PolarHBondContact O-ND2 3.41Å
46	H	91.1	Very high	93.3	Very high	118 Å²	118	59 Å²	59	55%	0.546	29%	0.292	S	S	.	.	H	α-helix	trans	-64.8	-41.8	174.8	-72.7	156.1	0	0	0	113.1	E42 H44 N49 S50 M230	E42-H46 WeakPolarHBondContact O-CB 3.1Å; E42-H46 VanDerWaalsContact O-CG 3.27Å; E42-H46 PolarHBondContact O-N 3.4Å; E42-H46 PolarHBondContact O-ND1 2.86Å; H44-H46 VanDerWaalsContact C-N 3.29Å; H44-H46 PolarHBondContact O-N 3.24Å; H46-N49 CarbonylContact O-C 3.55Å; H46-N49 PolarHBondContact O-N 3.29Å; H46-S50 PolarHBondContact O-N 3.19Å; H46-M230 HydrophobicContact CB-SD 4.02Å
47	A	89.9	Confident	93	Very high	12 Å²	12	62 Å²	62	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-63.1	-47.1	178.7	0	0	0	0	0	111.5	S43 H44 N49 S50 V53 F226 M230	S43-A47 WeakPolarHBondContact O-CB 3.28Å; S43-A47 PolarHBondContact O-N 3.12Å; H44-A47 PolarHBondContact O-N 3.38Å; A47-N49 VanDerWaalsContact C-N 3.27Å; A47-N49 PolarHBondContact O-N 3.49Å; A47-S50 VanDerWaalsContact O-CB 3.31Å; A47-S50 WeakPolarHBondContact O-CB 3.43Å; A47-S50 PolarHBondContact O-N 3.05Å; A47-S50 PolarHBondContact O-OG 3.41Å; A47-V53 WeakPolarHBondContact O-CG2 3.39Å; A47-F226 HydrophobicContact CB-CD1 4.2Å; A47-M230 HydrophobicContact CB-CG 4.37Å
48	E	88.2	Confident	92.9	Very high	76 Å²	76	64.9 Å²	64.9	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-63.5	-33.8	176.1	-70	-166.5	147.7	0	0	112.5	H44 S50	H44-E48 IonicContact CE1-OE1 2.84Å; H44-E48 PolarHBondContact CE1-OE1 3.38Å; H44-E48 IonicContact CE1-OE2 3.68Å; H44-E48 PolarHBondContact CE1-OE2 2.92Å; H44-E48 IonicContact ND1-OE2 3.96Å; H44-E48 IonicContact NE2-OE1 3.35Å; H44-E48 PolarHBondContact NE2-OE1 3.41Å; H44-E48 PolarHBondContact O-N 3.42Å; E48-S50 VanDerWaalsContact C-N 3.32Å
49	N	89.6	Confident	92.8	Very high	88 Å²	88	59.6 Å²	59.6	47%	0.471	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.7	179.2	-80.1	-74.5	0	0	0	114.9	D45 H46 A47 K54	D45-N49 WeakPolarHBondContact O-CB 3.3Å; D45-N49 PolarHBondContact O-N 3.02Å; D45-N49 PolarHBondContact O-ND2 3.41Å; H46-N49 CarbonylContact O-C 3.55Å; H46-N49 PolarHBondContact O-N 3.29Å; A47-N49 VanDerWaalsContact C-N 3.27Å; A47-N49 PolarHBondContact O-N 3.49Å; N49-K54 WeakPolarHBondContact O-CD 3.42Å; N49-K54 WeakPolarHBondContact O-CE 3.3Å; N49-K54 PolarHBondContact O-NZ 3.47Å; N49-K54 WeakPolarHBondContact OD1-CE 3.48Å; N49-K54 PolarHBondContact OD1-NZ 2.78Å
50	S	91.5	Very high	92.6	Very high	18 Å²	18	64 Å²	64	13%	0.126	31%	0.312	C	S	.	.	S	Bend	trans	-60.4	148.2	175.7	70.4	0	0	0	0	111.1	H46 A47 E48 F52 V53 K54	H46-S50 PolarHBondContact O-N 3.19Å; A47-S50 VanDerWaalsContact O-CB 3.31Å; A47-S50 WeakPolarHBondContact O-CB 3.43Å; A47-S50 PolarHBondContact O-N 3.05Å; A47-S50 PolarHBondContact O-OG 3.41Å; E48-S50 VanDerWaalsContact C-N 3.32Å; S50-F52 VanDerWaalsContact C-N 3.3Å; S50-F52 PolarHBondContact O-N 3.23Å; S50-V53 PolarHBondContact O-N 3.34Å; S50-V53 WeakPolarHBondContact OG-CB 3.43Å; S50-V53 VanDerWaalsContact OG-CG2 3.25Å; S50-V53 WeakPolarHBondContact OG-CG2 3.28Å; S50-V53 PolarHBondContact OG-N 2.81Å; S50-K54 PolarHBondContact O-N 3.16Å
51	K	90.9	Very high	92.4	Very high	104 Å²	104	64.8 Å²	64.8	45%	0.452	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-44.7	-179	-176.1	-175.1	166.4	-58.8	0	111.3	V53 K54 D55 D237	K51-V53 PolarHBondContact O-N 2.91Å; K51-K54 PolarHBondContact O-N 3.1Å; K51-D55 IonicContact NZ-OD2 2.87Å; K51-D55 PolarHBondContact NZ-OD2 3.22Å; K51-D55 WeakPolarHBondContact O-CB 3.43Å; K51-D55 VanDerWaalsContact O-CG 3.29Å; K51-D55 PolarHBondContact O-N 2.92Å; K51-D237 IonicContact NZ-OD1 3.61Å; K51-D237 PolarHBondContact NZ-OD1 3.07Å; K51-D237 IonicContact NZ-OD2 3.59Å
52	F	91.7	Very high	92.3	Very high	20 Å²	20	63.3 Å²	63.3	9%	0.088	31%	0.309	C	S	.	.	H	α-helix	trans	-54.7	-49.8	177.8	-179.3	-94.9	0	0	0	112.3	S50 D55 F56 I61 V65 A69 F233 L236	S50-F52 VanDerWaalsContact C-N 3.3Å; S50-F52 PolarHBondContact O-N 3.23Å; F52-D55 PolarHBondContact O-N 3.25Å; F52-F56 VanDerWaalsContact O-CB 3.29Å; F52-F56 WeakPolarHBondContact O-CB 3.37Å; F52-F56 PolarHBondContact O-N 2.82Å; F52-I61 HydrophobicContact CE2-CD1 3.86Å; F52-I61 HydrophobicContact CZ-CD1 4.15Å; F52-V65 HydrophobicContact CE2-CG1 3.73Å; F52-A69 HydrophobicContact CZ-CB 4.24Å; F52-F233 HydrophobicContact CB-CB 3.97Å; F52-F233 HydrophobicContact CD1-CB 4.11Å; F52-F233 AromaticContact CD1-CD1 3.56Å; F52-F233 HydrophobicContact CD1-CD1 3.56Å; F52-F233 HydrophobicContact CD1-CE1 4.15Å; F52-F233 AromaticContact CD1-CG 3.89Å; F52-F233 HydrophobicContact CD1-CG 3.89Å; F52-F233 AromaticContact CE1-CD1 3.76Å; F52-F233 HydrophobicContact CE1-CD1 3.76Å; F52-F233 HydrophobicContact CE1-CE1 4.09Å; F52-F233 HydrophobicContact CG-CB 4.13Å; F52-F233 HydrophobicContact CG-CD1 4.35Å; F52-F233 HydrophobicContact CG-CG 4.42Å; F52-L236 HydrophobicContact CD2-CB 4.06Å; F52-L236 HydrophobicContact CE2-CB 3.74Å; F52-L236 HydrophobicContact CE2-CD1 4.14Å; F52-L236 HydrophobicContact CZ-CB 4.43Å; F52-L236 HydrophobicContact CZ-CD1 3.98Å
53	V	91.4	Very high	92.3	Very high	23 Å²	23	61.3 Å²	61.3	14%	0.139	30%	0.298	C	S	.	.	H	α-helix	trans	-67.5	-42.7	-179	173.9	0	0	0	0	111.3	A47 S50 K51 D55 F56 L57 F233	A47-V53 WeakPolarHBondContact O-CG2 3.39Å; S50-V53 PolarHBondContact O-N 3.34Å; S50-V53 WeakPolarHBondContact OG-CB 3.43Å; S50-V53 VanDerWaalsContact OG-CG2 3.25Å; S50-V53 WeakPolarHBondContact OG-CG2 3.28Å; S50-V53 PolarHBondContact OG-N 2.81Å; K51-V53 PolarHBondContact O-N 2.91Å; V53-D55 PolarHBondContact O-N 2.94Å; V53-F56 PolarHBondContact O-N 3.31Å; V53-L57 HydrophobicContact CG1-CD1 3.97Å; V53-L57 HydrophobicContact CG1-CG 4.35Å; V53-L57 WeakPolarHBondContact O-CG 3.45Å; V53-L57 PolarHBondContact O-N 3.47Å; V53-F233 HydrophobicContact CG2-CD2 4.2Å; V53-F233 HydrophobicContact CG2-CE2 3.97Å; V53-F233 HydrophobicContact CG2-CZ 4.36Å
54	K	93.2	Very high	92.3	Very high	81 Å²	81	64.1 Å²	64.1	35%	0.352	31%	0.31	S	S	.	.	H	α-helix	trans	-60	-45.8	176.3	-78.4	175.3	169.4	151.6	0	112.5	N49 S50 K51 L57 K58	N49-K54 WeakPolarHBondContact O-CD 3.42Å; N49-K54 WeakPolarHBondContact O-CE 3.3Å; N49-K54 PolarHBondContact O-NZ 3.47Å; N49-K54 WeakPolarHBondContact OD1-CE 3.48Å; N49-K54 PolarHBondContact OD1-NZ 2.78Å; S50-K54 PolarHBondContact O-N 3.16Å; K51-K54 PolarHBondContact O-N 3.1Å; K54-L57 PolarHBondContact O-N 3.39Å; K54-K58 VanDerWaalsContact O-CG 3.29Å; K54-K58 WeakPolarHBondContact O-CG 3.42Å; K54-K58 PolarHBondContact O-N 3.06Å; K54-K58 VanDerWaalsContact O-N 3.13Å
55	D	93.4	Very high	92.6	Very high	31 Å²	31	60.7 Å²	60.7	17%	0.166	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-41.7	179.1	-70.3	-6.2	0	0	0	110.4	K51 F52 V53 L57 K58 G59 Q60	K51-D55 IonicContact NZ-OD2 2.87Å; K51-D55 PolarHBondContact NZ-OD2 3.22Å; K51-D55 WeakPolarHBondContact O-CB 3.43Å; K51-D55 VanDerWaalsContact O-CG 3.29Å; K51-D55 PolarHBondContact O-N 2.92Å; F52-D55 PolarHBondContact O-N 3.25Å; V53-D55 PolarHBondContact O-N 2.94Å; D55-L57 PolarHBondContact O-N 2.92Å; D55-K58 PolarHBondContact O-N 3.26Å; D55-G59 PolarHBondContact O-N 3.48Å; D55-Q60 HydrophobicContact CB-CB 4.21Å; D55-Q60 WeakPolarHBondContact O-CA 3.39Å; D55-Q60 WeakPolarHBondContact O-CB 3.45Å; D55-Q60 PolarHBondContact O-N 3.43Å
56	F	93.1	Very high	92.8	Very high	10 Å²	10	57.8 Å²	57.8	4%	0.044	28%	0.279	C	S	.	.	H	α-helix	trans	-56.8	-52.2	174.3	-175.5	-91	0	0	0	111.6	F52 V53 K58 G59 I61 F66 L166 V169 A170	F52-F56 VanDerWaalsContact O-CB 3.29Å; F52-F56 WeakPolarHBondContact O-CB 3.37Å; F52-F56 PolarHBondContact O-N 2.82Å; V53-F56 PolarHBondContact O-N 3.31Å; F56-K58 PolarHBondContact O-N 3.06Å; F56-G59 WeakPolarHBondContact O-CA 3.37Å; F56-G59 PolarHBondContact O-N 3.12Å; F56-I61 HydrophobicContact CD2-CB 3.94Å; F56-I61 HydrophobicContact CD2-CD1 4.14Å; F56-I61 HydrophobicContact CD2-CG1 3.87Å; F56-I61 HydrophobicContact CD2-CG2 3.92Å; F56-I61 HydrophobicContact CE2-CG1 4.39Å; F56-I61 HydrophobicContact CE2-CG2 4.11Å; F56-F66 AromaticContact CE2-CD2 3.73Å; F56-F66 HydrophobicContact CE2-CD2 3.73Å; F56-F66 AromaticContact CE2-CE2 3.82Å; F56-F66 HydrophobicContact CE2-CE2 3.82Å; F56-F66 HydrophobicContact CZ-CD2 4.46Å; F56-F66 HydrophobicContact CZ-CE2 4.1Å; F56-L166 HydrophobicContact CD1-CD2 3.47Å; F56-L166 VanDerWaalsContact CD1-CD2 3.47Å; F56-L166 HydrophobicContact CE1-CB 3.79Å; F56-L166 HydrophobicContact CE1-CD2 3.34Å; F56-L166 HydrophobicContact CE1-CG 4.13Å; F56-L166 HydrophobicContact CZ-CB 4.42Å; F56-V169 HydrophobicContact CD1-CG1 4.28Å; F56-V169 HydrophobicContact CE1-CB 4.32Å; F56-V169 HydrophobicContact CE1-CG1 4.13Å; F56-V169 WeakPolarHBondContact O-CG1 3.34Å; F56-A170 HydrophobicContact CE2-CB 4.5Å; F56-A170 HydrophobicContact CZ-CB 3.97Å
57	L	92	Very high	93.2	Very high	61 Å²	61	53.2 Å²	53.2	32%	0.319	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-32.6	179.8	-71.8	172.8	0	0	0	113	V53 K54 D55 G59 V165 L166	V53-L57 HydrophobicContact CG1-CD1 3.97Å; V53-L57 HydrophobicContact CG1-CG 4.35Å; V53-L57 WeakPolarHBondContact O-CG 3.45Å; V53-L57 PolarHBondContact O-N 3.47Å; K54-L57 PolarHBondContact O-N 3.39Å; D55-L57 PolarHBondContact O-N 2.92Å; L57-G59 PolarHBondContact O-N 3.28Å; L57-V165 HydrophobicContact CD2-CG1 4.12Å; L57-L166 HydrophobicContact CD2-CD2 3.77Å
58	K	93.9	Very high	93.5	Very high	136 Å²	136	55.6 Å²	55.6	59%	0.591	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.9	172.1	-68.9	171.1	-174.6	175.2	0	113.5	K54 D55 F56 Q60	K54-K58 VanDerWaalsContact O-CG 3.29Å; K54-K58 WeakPolarHBondContact O-CG 3.42Å; K54-K58 PolarHBondContact O-N 3.06Å; K54-K58 VanDerWaalsContact O-N 3.13Å; D55-K58 PolarHBondContact O-N 3.26Å; F56-K58 PolarHBondContact O-N 3.06Å; K58-Q60 VanDerWaalsContact C-N 3.3Å; K58-Q60 HydrophobicContact CB-CG 4.06Å
59	G	92.9	Very high	94	Very high	21 Å²	21	52.8 Å²	52.8	22%	0.216	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	15.9	-174.5	0	0	0	0	0	113.7	D55 F56 L57 I61 A173	D55-G59 PolarHBondContact O-N 3.48Å; F56-G59 WeakPolarHBondContact O-CA 3.37Å; F56-G59 PolarHBondContact O-N 3.12Å; L57-G59 PolarHBondContact O-N 3.28Å; G59-I61 VanDerWaalsContact C-N 3.32Å; G59-I61 PolarHBondContact O-N 3.19Å; G59-A173 WeakPolarHBondContact O-CB 3.2Å
60	Q	93.6	Very high	94.4	Very high	128 Å²	128	48.7 Å²	48.7	60%	0.598	24%	0.236	S	C	*	.			trans	-92.8	61.2	-179.3	-61.9	-179.3	-16	0	0	110.3	D55 K58	D55-Q60 HydrophobicContact CB-CB 4.21Å; D55-Q60 WeakPolarHBondContact O-CA 3.39Å; D55-Q60 WeakPolarHBondContact O-CB 3.45Å; D55-Q60 PolarHBondContact O-N 3.43Å; K58-Q60 VanDerWaalsContact C-N 3.3Å; K58-Q60 HydrophobicContact CB-CG 4.06Å
61	I	93.9	Very high	94.8	Very high	21 Å²	21	48.1 Å²	48.1	11%	0.108	23%	0.232	C	C	.	.			trans	-125.9	129.3	-179.2	-169.3	76.3	0	0	0	110.3	F52 F56 G59 V65 F66 A173 L174	F52-I61 HydrophobicContact CE2-CD1 3.86Å; F52-I61 HydrophobicContact CZ-CD1 4.15Å; F56-I61 HydrophobicContact CD2-CB 3.94Å; F56-I61 HydrophobicContact CD2-CD1 4.14Å; F56-I61 HydrophobicContact CD2-CG1 3.87Å; F56-I61 HydrophobicContact CD2-CG2 3.92Å; F56-I61 HydrophobicContact CE2-CG1 4.39Å; F56-I61 HydrophobicContact CE2-CG2 4.11Å; G59-I61 VanDerWaalsContact C-N 3.32Å; G59-I61 PolarHBondContact O-N 3.19Å; I61-V65 HydrophobicContact CD1-CB 4.13Å; I61-V65 HydrophobicContact CD1-CG1 3.78Å; I61-F66 HydrophobicContact CG1-CB 4.26Å; I61-A173 HydrophobicContact CG2-CB 4.07Å; I61-L174 HydrophobicContact CG2-CD2 4.07Å; I61-L174 HydrophobicContact CG2-CG 4.33Å
62	K	93.8	Very high	95.2	Very high	76 Å²	76	43.5 Å²	43.5	33%	0.33	21%	0.213	S	C	.	.			trans	-76.3	140.9	173.5	-65.3	175.8	-177.8	169.4	0	109.4	E64 V65 F66 G240 L243	K62-E64 VanDerWaalsContact C-N 3.29Å; K62-E64 PolarHBondContact O-N 3.08Å; K62-V65 HydrophobicContact CB-CB 4.44Å; K62-V65 HydrophobicContact CB-CG2 4.01Å; K62-V65 PolarHBondContact O-N 3.47Å; K62-F66 PolarHBondContact O-N 3.22Å; K62-G240 PolarHBondContact NZ-O 3.34Å; K62-L243 HydrophobicContact CD-CB 4.28Å; K62-L243 PolarHBondContact NZ-O 3.32Å
63	K	95.4	Very high	95.5	Very high	106 Å²	106	43.6 Å²	43.6	46%	0.461	21%	0.214	S	C	.	.	H	α-helix	trans	-54.2	-44.2	179.7	-172.8	179.2	179.1	-178.5	0	112.4	V65 F66 K67 L174	K63-V65 VanDerWaalsContact C-N 3.33Å; K63-V65 PolarHBondContact O-N 3.41Å; K63-F66 WeakPolarHBondContact O-CB 3.48Å; K63-F66 PolarHBondContact O-N 3.01Å; K63-K67 HydrophobicContact CG-CD 4.34Å; K63-K67 WeakPolarHBondContact O-CG 3.46Å; K63-K67 PolarHBondContact O-N 3.36Å; K63-L174 HydrophobicContact CB-CD2 4.02Å
64	E	95.9	Very high	95.8	Very high	73 Å²	73	44.2 Å²	44.2	34%	0.341	22%	0.215	S	C	.	.	H	α-helix	trans	-63.8	-35.9	178.7	-67.6	-53.8	128	0	0	113	K62 K67 L68 L243	K62-E64 VanDerWaalsContact C-N 3.29Å; K62-E64 PolarHBondContact O-N 3.08Å; E64-K67 PolarHBondContact O-N 3.25Å; E64-K67 WeakPolarHBondContact OE1-CD 2.99Å; E64-K67 IonicContact OE1-NZ 2.68Å; E64-K67 PolarHBondContact OE1-NZ 3.2Å; E64-K67 IonicContact OE2-NZ 2.92Å; E64-K67 PolarHBondContact OE2-NZ 3.33Å; E64-L68 WeakPolarHBondContact O-CG 3.45Å; E64-L68 PolarHBondContact O-N 3.02Å; E64-L243 HydrophobicContact CB-CD1 4Å
65	V	96.8	Very high	96.1	Very high	5 Å²	5	43 Å²	43	3%	0.03	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-40.5	174.5	-179	0	0	0	0	110.7	F52 I61 K62 K63 K67 L68 A69 L236 G240 L243	F52-V65 HydrophobicContact CE2-CG1 3.73Å; I61-V65 HydrophobicContact CD1-CB 4.13Å; I61-V65 HydrophobicContact CD1-CG1 3.78Å; K62-V65 HydrophobicContact CB-CB 4.44Å; K62-V65 HydrophobicContact CB-CG2 4.01Å; K62-V65 PolarHBondContact O-N 3.47Å; K63-V65 VanDerWaalsContact C-N 3.33Å; K63-V65 PolarHBondContact O-N 3.41Å; V65-K67 VanDerWaalsContact C-N 3.34Å; V65-K67 PolarHBondContact O-N 3.46Å; V65-L68 PolarHBondContact O-N 3.37Å; V65-A69 WeakPolarHBondContact O-CB 3.25Å; V65-A69 PolarHBondContact O-N 3.15Å; V65-L236 HydrophobicContact CG1-CB 4.3Å; V65-G240 VanDerWaalsContact CG2-CA 3.45Å; V65-L243 HydrophobicContact CG2-CD1 3.78Å
66	F	97.4	Very high	96.4	Very high	5 Å²	5	41.8 Å²	41.8	2%	0.022	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-40.9	175.3	-175.5	-100.6	0	0	0	112.4	F56 I61 K62 K63 A69 T70 F115 A170 L174 I183 Y186	F56-F66 AromaticContact CE2-CD2 3.73Å; F56-F66 HydrophobicContact CE2-CD2 3.73Å; F56-F66 AromaticContact CE2-CE2 3.82Å; F56-F66 HydrophobicContact CE2-CE2 3.82Å; F56-F66 HydrophobicContact CZ-CD2 4.46Å; F56-F66 HydrophobicContact CZ-CE2 4.1Å; I61-F66 HydrophobicContact CG1-CB 4.26Å; K62-F66 PolarHBondContact O-N 3.22Å; K63-F66 WeakPolarHBondContact O-CB 3.48Å; K63-F66 PolarHBondContact O-N 3.01Å; F66-A69 WeakPolarHBondContact O-CB 3.34Å; F66-A69 PolarHBondContact O-N 2.83Å; F66-T70 PolarHBondContact O-N 3.43Å; F66-T70 PolarHBondContact O-OG1 2.91Å; F66-F115 HydrophobicContact CD1-CE1 4.36Å; F66-F115 AromaticContact CD1-CE2 3.91Å; F66-F115 HydrophobicContact CD1-CE2 3.91Å; F66-F115 AromaticContact CD1-CZ 3.6Å; F66-F115 HydrophobicContact CD1-CZ 3.6Å; F66-F115 AromaticContact CE1-CE2 3.64Å; F66-F115 HydrophobicContact CE1-CE2 3.64Å; F66-F115 AromaticContact CE1-CZ 3.49Å; F66-F115 HydrophobicContact CE1-CZ 3.49Å; F66-F115 VanDerWaalsContact CE1-CZ 3.49Å; F66-A170 HydrophobicContact CE2-CB 3.87Å; F66-A170 HydrophobicContact CZ-CB 3.93Å; F66-L174 HydrophobicContact CB-CD1 3.55Å; F66-L174 HydrophobicContact CD1-CD1 3.34Å; F66-L174 HydrophobicContact CD2-CD1 3.86Å; F66-L174 HydrophobicContact CE1-CD1 3.93Å; F66-L174 HydrophobicContact CE2-CD1 4.38Å; F66-L174 HydrophobicContact CG-CD1 3.28Å; F66-L174 HydrophobicContact CZ-CD1 4.4Å; F66-I183 HydrophobicContact CE1-CG2 4.48Å; F66-I183 HydrophobicContact CZ-CG2 4.1Å; F66-Y186 HydrophobicContact CE2-CE2 4.43Å; F66-Y186 HydrophobicContact CZ-CE2 4.09Å
67	K	97.9	Very high	96.7	Very high	23 Å²	23	41.3 Å²	41.3	10%	0.1	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-48	174.3	-70.8	171.1	60.9	-156.2	0	111.2	K63 E64 V65 A69 T70 V71 F115 Y116	K63-K67 HydrophobicContact CG-CD 4.34Å; K63-K67 WeakPolarHBondContact O-CG 3.46Å; K63-K67 PolarHBondContact O-N 3.36Å; E64-K67 PolarHBondContact O-N 3.25Å; E64-K67 WeakPolarHBondContact OE1-CD 2.99Å; E64-K67 IonicContact OE1-NZ 2.68Å; E64-K67 PolarHBondContact OE1-NZ 3.2Å; E64-K67 IonicContact OE2-NZ 2.92Å; E64-K67 PolarHBondContact OE2-NZ 3.33Å; V65-K67 VanDerWaalsContact C-N 3.34Å; V65-K67 PolarHBondContact O-N 3.46Å; K67-A69 PolarHBondContact O-N 2.52Å; K67-T70 WeakPolarHBondContact O-CB 3.32Å; K67-T70 PolarHBondContact O-N 3.05Å; K67-T70 VanDerWaalsContact O-N 3.12Å; K67-V71 WeakPolarHBondContact O-CG2 3.29Å; K67-V71 PolarHBondContact O-N 3.4Å; K67-F115 HydrophobicContact CD-CB 4.24Å; K67-F115 HydrophobicContact CD-CD1 4.06Å; K67-F115 HydrophobicContact CD-CG 4.37Å; K67-F115 WeakPolarHBondContact CE-O 3.33Å; K67-F115 HydrophobicContact CG-CB 3.87Å; K67-F115 HydrophobicContact CG-CD1 3.57Å; K67-F115 HydrophobicContact CG-CD2 4.33Å; K67-F115 HydrophobicContact CG-CE1 4.21Å; K67-F115 HydrophobicContact CG-CG 3.67Å; K67-Y116 HydrophobicContact CB-CE2 3.97Å; K67-Y116 WeakPolarHBondContact CB-OH 3.48Å; K67-Y116 HydrophobicContact CG-CE2 4.47Å
68	L	98.1	Very high	97	Very high	61 Å²	61	39.3 Å²	39.3	32%	0.319	19%	0.192	S	C	.	.	H	α-helix	trans	-62.8	-39.4	176.3	-68.2	173.2	0	0	0	112.8	E64 V65 T70 V71 A72 L236 I239	E64-L68 WeakPolarHBondContact O-CG 3.45Å; E64-L68 PolarHBondContact O-N 3.02Å; V65-L68 PolarHBondContact O-N 3.37Å; L68-T70 VanDerWaalsContact C-N 3.28Å; L68-T70 PolarHBondContact O-N 3.17Å; L68-V71 WeakPolarHBondContact O-CB 3.29Å; L68-V71 PolarHBondContact O-N 2.83Å; L68-A72 PolarHBondContact O-N 3.46Å; L68-L236 HydrophobicContact CB-CD2 3.62Å; L68-I239 HydrophobicContact CD1-CD1 4.35Å; L68-I239 HydrophobicContact CD1-CG2 3.75Å
69	A	97.9	Very high	97.2	Very high	17 Å²	17	33 Å²	33	14%	0.14	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-40.7	173.1	0	0	0	0	0	111.3	F52 V65 F66 K67 V71 A72 L73 L236	F52-A69 HydrophobicContact CZ-CB 4.24Å; V65-A69 WeakPolarHBondContact O-CB 3.25Å; V65-A69 PolarHBondContact O-N 3.15Å; F66-A69 WeakPolarHBondContact O-CB 3.34Å; F66-A69 PolarHBondContact O-N 2.83Å; K67-A69 PolarHBondContact O-N 2.52Å; A69-V71 VanDerWaalsContact C-N 3.35Å; A69-A72 WeakPolarHBondContact O-CB 3.34Å; A69-A72 PolarHBondContact O-N 3.48Å; A69-L73 WeakPolarHBondContact O-CG 3.48Å; A69-L73 PolarHBondContact O-N 2.89Å; A69-L236 HydrophobicContact CB-CD1 3.72Å
70	T	98.4	Very high	97.5	Very high	3 Å²	3	32 Å²	32	2%	0.018	16%	0.155	C	C	.	.	H	α-helix	trans	-66.5	-36.8	176.9	-47	0	0	0	0	111.3	F66 K67 L68 L73 Y74 L108 D111 M112	F66-T70 PolarHBondContact O-N 3.43Å; F66-T70 PolarHBondContact O-OG1 2.91Å; K67-T70 WeakPolarHBondContact O-CB 3.32Å; K67-T70 PolarHBondContact O-N 3.05Å; K67-T70 VanDerWaalsContact O-N 3.12Å; L68-T70 VanDerWaalsContact C-N 3.28Å; L68-T70 PolarHBondContact O-N 3.17Å; T70-L73 PolarHBondContact O-N 3.37Å; T70-Y74 PolarHBondContact O-N 3.39Å; T70-L108 HydrophobicContact CG2-CD2 3.86Å; T70-D111 HydrophobicContact CG2-CB 3.96Å; T70-M112 HydrophobicContact CG2-CE 3.21Å
71	V	98.8	Very high	97.8	Very high	5 Å²	5	26 Å²	26	3%	0.03	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-44.6	171.7	172.4	0	0	0	0	111.3	K67 L68 A69 L73 Y74 F75 M112 Y116 I124	K67-V71 WeakPolarHBondContact O-CG2 3.29Å; K67-V71 PolarHBondContact O-N 3.4Å; L68-V71 WeakPolarHBondContact O-CB 3.29Å; L68-V71 PolarHBondContact O-N 2.83Å; A69-V71 VanDerWaalsContact C-N 3.35Å; V71-L73 VanDerWaalsContact C-N 3.3Å; V71-L73 PolarHBondContact O-N 3.44Å; V71-Y74 WeakPolarHBondContact O-CB 3.34Å; V71-Y74 PolarHBondContact O-N 2.93Å; V71-Y74 VanDerWaalsContact O-N 3.16Å; V71-F75 HydrophobicContact CG1-CD2 3.76Å; V71-F75 HydrophobicContact CG1-CE2 3.56Å; V71-F75 VanDerWaalsContact O-CD2 3.3Å; V71-F75 WeakPolarHBondContact O-CD2 3.37Å; V71-F75 PolarHBondContact O-N 3.02Å; V71-F75 VanDerWaalsContact O-N 3.1Å; V71-M112 HydrophobicContact CG2-CE 4.22Å; V71-M112 HydrophobicContact CG2-SD 3.69Å; V71-Y116 HydrophobicContact CG2-CE2 3.74Å; V71-Y116 WeakPolarHBondContact CG2-OH 3.47Å; V71-I124 HydrophobicContact CG1-CB 3.99Å; V71-I124 HydrophobicContact CG1-CD1 4.39Å; V71-I124 HydrophobicContact CG1-CG2 4.48Å; V71-I124 HydrophobicContact CG2-CB 3.99Å; V71-I124 HydrophobicContact CG2-CG2 3.56Å
72	A	98.8	Very high	98	Very high	7 Å²	7	29.2 Å²	29.2	6%	0.058	14%	0.141	C	C	.	.	H	α-helix	trans	-60.6	-41.4	177.3	0	0	0	0	0	111.7	L68 A69 T76 T130 V232	L68-A72 PolarHBondContact O-N 3.46Å; A69-A72 WeakPolarHBondContact O-CB 3.34Å; A69-A72 PolarHBondContact O-N 3.48Å; A72-T76 VanDerWaalsContact O-CB 3.32Å; A72-T76 WeakPolarHBondContact O-CB 3.28Å; A72-T76 PolarHBondContact O-N 3.27Å; A72-T76 PolarHBondContact O-OG1 2.97Å; A72-T130 HydrophobicContact CB-CG2 4.17Å; A72-T130 VanDerWaalsContact CB-OG1 3.3Å; A72-T130 WeakPolarHBondContact CB-OG1 3.31Å; A72-T130 WeakPolarHBondContact O-CG2 3.33Å; A72-V232 HydrophobicContact CB-CG1 3.82Å
73	L	98.8	Very high	98.2	Very high	22 Å²	22	25.6 Å²	25.6	12%	0.115	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-47.3	172.2	-66.9	171.8	0	0	0	111.3	A69 T70 V71 F75 T76 Y77 L108 F185	A69-L73 WeakPolarHBondContact O-CG 3.48Å; A69-L73 PolarHBondContact O-N 2.89Å; T70-L73 PolarHBondContact O-N 3.37Å; V71-L73 VanDerWaalsContact C-N 3.3Å; V71-L73 PolarHBondContact O-N 3.44Å; L73-F75 VanDerWaalsContact C-N 3.35Å; L73-F75 PolarHBondContact O-N 2.94Å; L73-T76 PolarHBondContact O-N 3.44Å; L73-Y77 HydrophobicContact CB-CD2 4.4Å; L73-Y77 HydrophobicContact CD2-CD2 4.35Å; L73-Y77 HydrophobicContact CD2-CE2 3.8Å; L73-Y77 VanDerWaalsContact O-CD2 3.3Å; L73-Y77 WeakPolarHBondContact O-CD2 3.37Å; L73-Y77 PolarHBondContact O-N 3.31Å; L73-L108 HydrophobicContact CB-CD1 4.23Å; L73-L108 HydrophobicContact CB-CD2 3.74Å; L73-F185 HydrophobicContact CD1-CD1 4.05Å; L73-F185 HydrophobicContact CD1-CD2 4.5Å; L73-F185 HydrophobicContact CD1-CE1 3.87Å; L73-F185 HydrophobicContact CD1-CE2 4.31Å; L73-F185 HydrophobicContact CD1-CG 4.38Å; L73-F185 HydrophobicContact CD1-CZ 4.01Å; L73-F185 HydrophobicContact CD2-CE2 4.44Å; L73-F185 HydrophobicContact CD2-CZ 4.1Å
74	Y	98.9	Very high	98.4	Very high	37 Å²	37	20.6 Å²	20.6	15%	0.145	10%	0.104	C	C	.	.	H	α-helix	trans	-52.5	-50.7	178.7	170.2	-101.8	0	0	0	112.2	T70 V71 S78 R105 L108 V109 M112 W120 I124	T70-Y74 PolarHBondContact O-N 3.39Å; V71-Y74 WeakPolarHBondContact O-CB 3.34Å; V71-Y74 PolarHBondContact O-N 2.93Å; V71-Y74 VanDerWaalsContact O-N 3.16Å; Y74-S78 WeakPolarHBondContact CE2-OG 3.37Å; Y74-S78 WeakPolarHBondContact O-CB 2.96Å; Y74-S78 PolarHBondContact O-N 3.48Å; Y74-S78 PolarHBondContact O-OG 3.02Å; Y74-R105 HydrophobicContact CE2-CG 4.4Å; Y74-L108 HydrophobicContact CD2-CB 4.18Å; Y74-V109 HydrophobicContact CE2-CG2 3.95Å; Y74-M112 HydrophobicContact CG-CG 4.37Å; Y74-W120 HydrophobicContact CD1-CZ3 4.11Å; Y74-W120 HydrophobicContact CD2-CH2 4.31Å; Y74-W120 HydrophobicContact CD2-CZ3 4.41Å; Y74-W120 AromaticContact CE1-CH2 3.96Å; Y74-W120 HydrophobicContact CE1-CH2 3.96Å; Y74-W120 AromaticContact CE1-CZ3 3.69Å; Y74-W120 HydrophobicContact CE1-CZ3 3.69Å; Y74-W120 AromaticContact CE2-CH2 3.61Å; Y74-W120 HydrophobicContact CE2-CH2 3.61Å; Y74-W120 HydrophobicContact CE2-CZ3 4.04Å; Y74-W120 HydrophobicContact CG-CZ3 4.46Å; Y74-W120 AromaticContact CZ-CH2 3.42Å; Y74-W120 VanDerWaalsContact CZ-CH2 3.42Å; Y74-W120 AromaticContact CZ-CZ3 3.66Å; Y74-W120 WeakPolarHBondContact OH-CH2 3.43Å; Y74-I124 HydrophobicContact CD1-CD1 3.68Å; Y74-I124 HydrophobicContact CE1-CD1 3.89Å
75	F	98.9	Very high	98.5	Very high	55 Å²	55	19.7 Å²	19.7	24%	0.241	10%	0.101	C	C	.	.	H	α-helix	trans	-67	-44.1	178.9	-74.9	-68.6	0	0	0	112.4	V71 L73 S78 A79 I124 C126 T130 V134	V71-F75 HydrophobicContact CG1-CD2 3.76Å; V71-F75 HydrophobicContact CG1-CE2 3.56Å; V71-F75 VanDerWaalsContact O-CD2 3.3Å; V71-F75 WeakPolarHBondContact O-CD2 3.37Å; V71-F75 PolarHBondContact O-N 3.02Å; V71-F75 VanDerWaalsContact O-N 3.1Å; L73-F75 VanDerWaalsContact C-N 3.35Å; L73-F75 PolarHBondContact O-N 2.94Å; F75-S78 PolarHBondContact O-N 3.47Å; F75-A79 PolarHBondContact O-N 3.23Å; F75-I124 HydrophobicContact CE2-CD1 3.8Å; F75-I124 HydrophobicContact CE2-CG1 4.33Å; F75-I124 HydrophobicContact CZ-CD1 3.77Å; F75-I124 HydrophobicContact CZ-CG1 4.21Å; F75-C126 HydrophobicContact CD1-CB 4.08Å; F75-C126 HydrophobicContact CD2-CB 3.68Å; F75-C126 HydrophobicContact CE1-CB 4.11Å; F75-C126 HydrophobicContact CE2-CB 3.71Å; F75-C126 HydrophobicContact CG-CB 3.89Å; F75-C126 HydrophobicContact CZ-CB 3.93Å; F75-T130 HydrophobicContact CB-CG2 3.88Å; F75-V134 HydrophobicContact CB-CG2 4.1Å
76	T	98.9	Very high	98.6	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-60.3	-49.3	-179.9	-59.1	0	0	0	0	111.8	A72 L73 A79 L80 Y133 I137	A72-T76 VanDerWaalsContact O-CB 3.32Å; A72-T76 WeakPolarHBondContact O-CB 3.28Å; A72-T76 PolarHBondContact O-N 3.27Å; A72-T76 PolarHBondContact O-OG1 2.97Å; L73-T76 PolarHBondContact O-N 3.44Å; T76-A79 PolarHBondContact O-N 3.34Å; T76-L80 WeakPolarHBondContact O-CB 3.3Å; T76-L80 PolarHBondContact O-N 3.04Å; T76-Y133 HydrophobicContact CG2-CD1 3.62Å; T76-Y133 HydrophobicContact CG2-CE1 3.47Å; T76-Y133 VanDerWaalsContact CG2-CE1 3.47Å; T76-Y133 HydrophobicContact CG2-CG 4.49Å; T76-I137 HydrophobicContact CG2-CD1 3.88Å
77	Y	98.9	Very high	98.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-73	-33.2	-179.8	-79.9	-99.7	0	0	0	112.1	L73 A79 L80 E81 R104 L108 R155 Y156 D159 F185	L73-Y77 HydrophobicContact CB-CD2 4.4Å; L73-Y77 HydrophobicContact CD2-CD2 4.35Å; L73-Y77 HydrophobicContact CD2-CE2 3.8Å; L73-Y77 VanDerWaalsContact O-CD2 3.3Å; L73-Y77 WeakPolarHBondContact O-CD2 3.37Å; L73-Y77 PolarHBondContact O-N 3.31Å; Y77-A79 VanDerWaalsContact C-N 3.31Å; Y77-A79 PolarHBondContact O-N 3Å; Y77-L80 PolarHBondContact O-N 3.35Å; Y77-E81 VanDerWaalsContact O-CB 3.23Å; Y77-E81 WeakPolarHBondContact O-CB 3.49Å; Y77-E81 WeakPolarHBondContact O-CG 3.49Å; Y77-E81 PolarHBondContact O-N 3.2Å; Y77-R104 HydrophobicContact CD1-CB 3.54Å; Y77-R104 HydrophobicContact CD1-CG 3.57Å; Y77-R104 HydrophobicContact CE1-CB 3.94Å; Y77-R104 HydrophobicContact CE1-CG 3.42Å; Y77-R104 VanDerWaalsContact CE1-CG 3.42Å; Y77-R104 HydrophobicContact CG-CB 4Å; Y77-R104 HydrophobicContact CG-CG 4.41Å; Y77-L108 HydrophobicContact CD2-CD1 4.12Å; Y77-L108 HydrophobicContact CG-CD1 4.05Å; Y77-R155 HydrophobicContact CE1-CB 4.35Å; Y77-R155 VanDerWaalsContact OH-CZ 3.28Å; Y77-R155 PolarHBondContact OH-NE 3.03Å; Y77-R155 PolarHBondContact OH-NH2 3.27Å; Y77-Y156 AromaticContact CD1-CE1 3.91Å; Y77-Y156 HydrophobicContact CD1-CE1 3.91Å; Y77-Y156 AromaticContact CE1-CD1 3.96Å; Y77-Y156 HydrophobicContact CE1-CD1 3.96Å; Y77-Y156 AromaticContact CE1-CE1 3.51Å; Y77-Y156 HydrophobicContact CE1-CE1 3.51Å; Y77-D159 PolarHBondContact OH-OD1 3.29Å; Y77-D159 VanDerWaalsContact OH-OD1 3.05Å; Y77-D159 PolarHBondContact OH-OD2 3.42Å; Y77-F185 HydrophobicContact CD2-CE2 4.16Å; Y77-F185 HydrophobicContact CE1-CE2 4.18Å; Y77-F185 AromaticContact CE2-CE2 3.67Å; Y77-F185 HydrophobicContact CE2-CE2 3.67Å; Y77-F185 AromaticContact CE2-CZ 4Å; Y77-F185 HydrophobicContact CE2-CZ 4Å; Y77-F185 AromaticContact CZ-CE2 3.66Å; Y77-F185 AromaticContact CZ-CZ 3.9Å
78	S	98.9	Very high	98.7	Very high	19 Å²	19	28.9 Å²	28.9	13%	0.133	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-44.3	173.5	-64.5	0	0	0	0	111.5	Y74 F75 E82	Y74-S78 WeakPolarHBondContact CE2-OG 3.37Å; Y74-S78 WeakPolarHBondContact O-CB 2.96Å; Y74-S78 PolarHBondContact O-N 3.48Å; Y74-S78 PolarHBondContact O-OG 3.02Å; F75-S78 PolarHBondContact O-N 3.47Å; S78-E82 VanDerWaalsContact O-CB 3.3Å; S78-E82 WeakPolarHBondContact O-CB 3.47Å; S78-E82 PolarHBondContact O-N 3.45Å
79	A	98.9	Very high	98.8	Very high	3 Å²	3	32.4 Å²	32.4	3%	0.025	16%	0.157	C	C	.	.	H	α-helix	trans	-67.6	-45.2	175.9	0	0	0	0	0	112	F75 T76 Y77 E81 E82 E83 V134 I137	F75-A79 PolarHBondContact O-N 3.23Å; T76-A79 PolarHBondContact O-N 3.34Å; Y77-A79 VanDerWaalsContact C-N 3.31Å; Y77-A79 PolarHBondContact O-N 3Å; A79-E81 PolarHBondContact O-N 3.38Å; A79-E82 PolarHBondContact O-N 2.73Å; A79-E83 WeakPolarHBondContact O-CG 3.19Å; A79-E83 PolarHBondContact O-N 3.38Å; A79-V134 HydrophobicContact CB-CB 4.3Å; A79-V134 HydrophobicContact CB-CG1 3.83Å; A79-V134 HydrophobicContact CB-CG2 4.15Å; A79-I137 HydrophobicContact CB-CB 4.41Å; A79-I137 HydrophobicContact CB-CG2 4.03Å
80	L	98.9	Very high	98.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.5	-48.9	-179.8	-179.9	59	0	0	0	111.2	T76 Y77 E83 M84 I137 L148 H151 R155 Y156	T76-L80 WeakPolarHBondContact O-CB 3.3Å; T76-L80 PolarHBondContact O-N 3.04Å; Y77-L80 PolarHBondContact O-N 3.35Å; L80-E83 PolarHBondContact O-N 2.87Å; L80-M84 HydrophobicContact CD1-CG 4.41Å; L80-M84 HydrophobicContact CD1-SD 4.33Å; L80-M84 HydrophobicContact CG-CG 4.49Å; L80-M84 HydrophobicContact CG-SD 3.93Å; L80-M84 WeakPolarHBondContact O-CG 3.19Å; L80-M84 PolarHBondContact O-N 3.12Å; L80-I137 HydrophobicContact CB-CD1 4.41Å; L80-I137 HydrophobicContact CB-CG2 4.23Å; L80-I137 HydrophobicContact CD1-CG2 4.38Å; L80-L148 HydrophobicContact CD1-CD1 3.94Å; L80-H151 HydrophobicContact CD1-CB 3.81Å; L80-R155 HydrophobicContact CD2-CB 4.24Å; L80-R155 HydrophobicContact CD2-CG 4.27Å; L80-Y156 HydrophobicContact CD2-CE2 4.03Å
81	E	98.9	Very high	98.7	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	19%	0.194	C	C	.	.	H	α-helix	trans	-70.3	-33.4	-178.2	-67.2	170.2	-154.4	0	0	112.2	Y77 A79 E83 M84 D85 H103 R104 R105 Y156	Y77-E81 VanDerWaalsContact O-CB 3.23Å; Y77-E81 WeakPolarHBondContact O-CB 3.49Å; Y77-E81 WeakPolarHBondContact O-CG 3.49Å; Y77-E81 PolarHBondContact O-N 3.2Å; A79-E81 PolarHBondContact O-N 3.38Å; E81-E83 VanDerWaalsContact C-N 3.35Å; E81-M84 PolarHBondContact O-N 3.05Å; E81-D85 WeakPolarHBondContact O-CB 3.29Å; E81-D85 VanDerWaalsContact O-CG 3.29Å; E81-D85 PolarHBondContact O-N 3.39Å; E81-H103 HydrophobicContact CG-CB 4.26Å; E81-H103 WeakPolarHBondContact OE2-CB 3.31Å; E81-H103 IonicContact OE2-CG 2.78Å; E81-H103 IonicContact OE2-ND1 3.58Å; E81-R104 WeakPolarHBondContact OE1-CA 3.28Å; E81-R104 PolarHBondContact OE1-N 2.72Å; E81-R105 PolarHBondContact OE1-N 3.2Å; E81-R105 WeakPolarHBondContact OE2-CB 3.32Å; E81-R105 PolarHBondContact OE2-N 2.88Å; E81-Y156 WeakPolarHBondContact CG-OH 3.4Å
82	E	98.9	Very high	98.6	Very high	90 Å²	90	40.4 Å²	40.4	42%	0.421	20%	0.204	S	C	.	.	H	α-helix	trans	-59.8	-45.9	170	-177.6	-175	156.1	0	0	111.3	S78 A79 D85 R86 H138	S78-E82 VanDerWaalsContact O-CB 3.3Å; S78-E82 WeakPolarHBondContact O-CB 3.47Å; S78-E82 PolarHBondContact O-N 3.45Å; A79-E82 PolarHBondContact O-N 2.73Å; E82-D85 PolarHBondContact O-N 2.96Å; E82-R86 PolarHBondContact O-N 3.31Å; E82-R86 IonicContact OE1-NH2 3.73Å; E82-R86 PolarHBondContact OE1-NH2 3.25Å; E82-R86 VanDerWaalsContact OE1-NH2 3.15Å; E82-H138 IonicContact OE2-CE1 3.57Å
83	E	98.9	Very high	98.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-73.6	-28.5	-179.6	-66.7	-54.3	147.6	0	0	112.9	A79 L80 E81 R86 N87 I137 H138 G141 Q142 L148	A79-E83 WeakPolarHBondContact O-CG 3.19Å; A79-E83 PolarHBondContact O-N 3.38Å; L80-E83 PolarHBondContact O-N 2.87Å; E81-E83 VanDerWaalsContact C-N 3.35Å; E83-R86 IonicContact OE1-CZ 2.87Å; E83-R86 IonicContact OE1-NE 3.57Å; E83-R86 PolarHBondContact OE1-NE 2.85Å; E83-R86 IonicContact OE1-NH2 3.38Å; E83-R86 PolarHBondContact OE1-NH2 3.09Å; E83-R86 WeakPolarHBondContact OE2-CD 3.3Å; E83-R86 IonicContact OE2-CZ 2.75Å; E83-R86 IonicContact OE2-NE 3.68Å; E83-R86 PolarHBondContact OE2-NE 3.09Å; E83-R86 IonicContact OE2-NH2 2.73Å; E83-N87 WeakPolarHBondContact O-CB 3.3Å; E83-N87 PolarHBondContact O-N 3.45Å; E83-N87 VanDerWaalsContact O-N 3.11Å; E83-N87 PolarHBondContact O-ND2 2.78Å; E83-I137 HydrophobicContact CB-CG2 4.47Å; E83-I137 HydrophobicContact CG-CG2 4.19Å; E83-H138 IonicContact OE1-CE1 3.89Å; E83-H138 IonicContact OE1-CG 2.73Å; E83-H138 IonicContact OE1-ND1 3.59Å; E83-H138 PolarHBondContact OE1-ND1 3.15Å; E83-G141 VanDerWaalsContact OE2-C 3.24Å; E83-G141 VanDerWaalsContact OE2-CA 3.28Å; E83-G141 WeakPolarHBondContact OE2-CA 3.2Å; E83-Q142 PolarHBondContact OE1-NE2 2.87Å; E83-Q142 VanDerWaalsContact OE1-NE2 3.12Å; E83-L148 HydrophobicContact CB-CD1 4.2Å
84	M	98.8	Very high	98.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-46	168.1	-69.5	171.7	62.8	0	0	111.2	L80 E81 R86 N87 K88 F93 Y97 L148 Y156	L80-M84 HydrophobicContact CD1-CG 4.41Å; L80-M84 HydrophobicContact CD1-SD 4.33Å; L80-M84 HydrophobicContact CG-CG 4.49Å; L80-M84 HydrophobicContact CG-SD 3.93Å; L80-M84 WeakPolarHBondContact O-CG 3.19Å; L80-M84 PolarHBondContact O-N 3.12Å; E81-M84 PolarHBondContact O-N 3.05Å; M84-R86 VanDerWaalsContact C-N 3.29Å; M84-R86 PolarHBondContact O-N 2.84Å; M84-N87 CarbonylContact O-C 3.56Å; M84-N87 PolarHBondContact O-N 3.41Å; M84-N87 VanDerWaalsContact O-N 3.13Å; M84-K88 WeakPolarHBondContact O-CA 3.18Å; M84-K88 PolarHBondContact O-N 3.01Å; M84-F93 HydrophobicContact CB-CE1 3.85Å; M84-F93 HydrophobicContact CB-CZ 4.18Å; M84-F93 HydrophobicContact CE-CE1 4.19Å; M84-F93 HydrophobicContact CE-CZ 3.86Å; M84-F93 HydrophobicContact CG-CE1 3.72Å; M84-F93 HydrophobicContact CG-CE2 4.47Å; M84-F93 HydrophobicContact CG-CZ 3.51Å; M84-F93 HydrophobicContact SD-CZ 4.21Å; M84-Y97 HydrophobicContact CB-CD2 4.4Å; M84-Y97 HydrophobicContact CB-CE2 4.44Å; M84-L148 HydrophobicContact CG-CD2 4.25Å; M84-Y156 HydrophobicContact CE-CE2 3.81Å; M84-Y156 HydrophobicContact SD-CE2 3.61Å; M84-Y156 PolarHBondContact SD-OH 2.68Å
85	D	98.8	Very high	98.5	Very high	54 Å²	54	41.3 Å²	41.3	29%	0.289	22%	0.219	S	C	.	.	H	α-helix	trans	-61.7	-38	175.8	-76.6	-18.6	0	0	0	111.5	E81 E82 N87 K88 Y97 H103	E81-D85 WeakPolarHBondContact O-CB 3.29Å; E81-D85 VanDerWaalsContact O-CG 3.29Å; E81-D85 PolarHBondContact O-N 3.39Å; E82-D85 PolarHBondContact O-N 2.96Å; D85-N87 VanDerWaalsContact C-N 3.31Å; D85-N87 PolarHBondContact O-N 2.93Å; D85-K88 WeakPolarHBondContact O-CD 3.42Å; D85-K88 WeakPolarHBondContact O-CG 3.4Å; D85-Y97 WeakPolarHBondContact OD1-CE2 3.38Å; D85-Y97 PolarHBondContact OD1-OH 3.44Å; D85-H103 IonicContact OD1-CE1 3.84Å
86	R	98.8	Very high	98.5	Very high	124 Å²	124	38.7 Å²	38.7	47%	0.468	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-38.8	173.7	-170.8	-169.4	-52.2	-67.6	-6.2	112.1	E82 E83 M84	E82-R86 PolarHBondContact O-N 3.31Å; E82-R86 IonicContact OE1-NH2 3.73Å; E82-R86 PolarHBondContact OE1-NH2 3.25Å; E82-R86 VanDerWaalsContact OE1-NH2 3.15Å; E83-R86 IonicContact OE1-CZ 2.87Å; E83-R86 IonicContact OE1-NE 3.57Å; E83-R86 PolarHBondContact OE1-NE 2.85Å; E83-R86 IonicContact OE1-NH2 3.38Å; E83-R86 PolarHBondContact OE1-NH2 3.09Å; E83-R86 WeakPolarHBondContact OE2-CD 3.3Å; E83-R86 IonicContact OE2-CZ 2.75Å; E83-R86 IonicContact OE2-NE 3.68Å; E83-R86 PolarHBondContact OE2-NE 3.09Å; E83-R86 IonicContact OE2-NH2 2.73Å; M84-R86 VanDerWaalsContact C-N 3.29Å; M84-R86 PolarHBondContact O-N 2.84Å
87	N	98.8	Very high	98.5	Very high	13 Å²	13	41.5 Å²	41.5	7%	0.07	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	12.1	-174.4	-72.2	-77.3	0	0	0	114.2	E83 M84 D85 D89 N90 F93 G141 P145 L148	E83-N87 WeakPolarHBondContact O-CB 3.3Å; E83-N87 PolarHBondContact O-N 3.45Å; E83-N87 VanDerWaalsContact O-N 3.11Å; E83-N87 PolarHBondContact O-ND2 2.78Å; M84-N87 CarbonylContact O-C 3.56Å; M84-N87 PolarHBondContact O-N 3.41Å; M84-N87 VanDerWaalsContact O-N 3.13Å; D85-N87 VanDerWaalsContact C-N 3.31Å; D85-N87 PolarHBondContact O-N 2.93Å; N87-D89 PolarHBondContact O-N 3.43Å; N87-D89 VanDerWaalsContact O-N 3.13Å; N87-N90 HydrophobicContact CB-CB 4.14Å; N87-N90 VanDerWaalsContact O-CB 3.29Å; N87-N90 WeakPolarHBondContact O-CB 3.4Å; N87-N90 PolarHBondContact O-N 3.43Å; N87-N90 PolarHBondContact OD1-ND2 3.05Å; N87-F93 HydrophobicContact CB-CB 4.4Å; N87-F93 HydrophobicContact CB-CD1 4.44Å; N87-G141 PolarHBondContact ND2-O 2.98Å; N87-P145 VanDerWaalsContact OD1-CB 3.22Å; N87-P145 WeakPolarHBondContact OD1-CB 3.42Å; N87-L148 HydrophobicContact CB-CD2 4.09Å
88	K	98.6	Very high	98.5	Very high	90 Å²	90	42.9 Å²	42.9	39%	0.391	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.5	-174.7	70.9	-175.2	-178.6	-179	0	114.5	M84 D85 A94 Y97	M84-K88 WeakPolarHBondContact O-CA 3.18Å; M84-K88 PolarHBondContact O-N 3.01Å; D85-K88 WeakPolarHBondContact O-CD 3.42Å; D85-K88 WeakPolarHBondContact O-CG 3.4Å; K88-A94 WeakPolarHBondContact O-CA 3.43Å; K88-A94 WeakPolarHBondContact O-CB 3.45Å; K88-Y97 HydrophobicContact CB-CD1 3.79Å; K88-Y97 HydrophobicContact CB-CD2 3.89Å; K88-Y97 HydrophobicContact CB-CE1 3.72Å; K88-Y97 HydrophobicContact CB-CE2 3.84Å; K88-Y97 HydrophobicContact CB-CG 3.86Å; K88-Y97 HydrophobicContact CD-CE1 4.23Å
89	D	98.3	Very high	98.4	Very high	135 Å²	135	43.8 Å²	43.8	72%	0.722	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-2	179.5	-60.4	-51.7	0	0	0	112.2	N87 P91	N87-D89 PolarHBondContact O-N 3.43Å; N87-D89 VanDerWaalsContact O-N 3.13Å; D89-P91 WeakPolarHBondContact O-CD 3.38Å
90	N	97.9	Very high	98.4	Very high	46 Å²	46	49.7 Å²	49.7	25%	0.246	26%	0.259	C	S	.	.			trans	-77.1	121.1	179.4	-171.4	-17.5	0	0	0	109.6	N87 V92 F93 A94 P145	N87-N90 HydrophobicContact CB-CB 4.14Å; N87-N90 VanDerWaalsContact O-CB 3.29Å; N87-N90 WeakPolarHBondContact O-CB 3.4Å; N87-N90 PolarHBondContact O-N 3.43Å; N87-N90 PolarHBondContact OD1-ND2 3.05Å; N90-V92 PolarHBondContact O-N 3.06Å; N90-V92 WeakPolarHBondContact OD1-CG2 3.49Å; N90-V92 PolarHBondContact OD1-N 3.46Å; N90-F93 PolarHBondContact O-N 2.86Å; N90-A94 WeakPolarHBondContact O-CB 3.49Å; N90-A94 PolarHBondContact O-N 2.97Å; N90-P145 WeakPolarHBondContact ND2-CG 3.32Å
91	P	97.2	Very high	98.4	Very high	104 Å²	104	52.2 Å²	52.2	68%	0.675	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.1	-174.8	-28.4	35.6	0	0	0	115.2	D89 F93	D89-P91 WeakPolarHBondContact O-CD 3.38Å; P91-F93 PolarHBondContact O-N 2.95Å
92	V	96.3	Very high	98.4	Very high	42 Å²	42	52.1 Å²	52.1	26%	0.255	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-12.8	179.2	-51.2	0	0	0	0	113.4	N90 P145 E146	N90-V92 PolarHBondContact O-N 3.06Å; N90-V92 WeakPolarHBondContact OD1-CG2 3.49Å; N90-V92 PolarHBondContact OD1-N 3.46Å; V92-P145 HydrophobicContact CG2-CB 4.26Å; V92-P145 HydrophobicContact CG2-CG 4.46Å; V92-E146 HydrophobicContact CB-CB 4.28Å; V92-E146 HydrophobicContact CG2-CB 4.25Å
93	F	98.2	Very high	98.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	-31.6	-177.8	-172.7	-98.5	0	0	0	114.2	M84 N87 N90 P91 P95 L96 Y97 L148 A152	M84-F93 HydrophobicContact CB-CE1 3.85Å; M84-F93 HydrophobicContact CB-CZ 4.18Å; M84-F93 HydrophobicContact CE-CE1 4.19Å; M84-F93 HydrophobicContact CE-CZ 3.86Å; M84-F93 HydrophobicContact CG-CE1 3.72Å; M84-F93 HydrophobicContact CG-CE2 4.47Å; M84-F93 HydrophobicContact CG-CZ 3.51Å; M84-F93 HydrophobicContact SD-CZ 4.21Å; N87-F93 HydrophobicContact CB-CB 4.4Å; N87-F93 HydrophobicContact CB-CD1 4.44Å; N90-F93 PolarHBondContact O-N 2.86Å; P91-F93 PolarHBondContact O-N 2.95Å; F93-P95 VanDerWaalsContact C-N 3.28Å; F93-P95 WeakPolarHBondContact O-CD 3.32Å; F93-L96 HydrophobicContact CE2-CB 4.22Å; F93-L96 HydrophobicContact CE2-CD1 4.48Å; F93-L96 HydrophobicContact CZ-CB 4.31Å; F93-L96 WeakPolarHBondContact O-CB 3.36Å; F93-L96 PolarHBondContact O-N 3.33Å; F93-Y97 HydrophobicContact CE1-CD2 4.37Å; F93-L148 HydrophobicContact CD1-CD2 4.23Å; F93-L148 HydrophobicContact CD2-CB 4.03Å; F93-L148 HydrophobicContact CD2-CD2 3.93Å; F93-L148 HydrophobicContact CD2-CG 4Å; F93-L148 HydrophobicContact CE1-CD2 4.33Å; F93-L148 HydrophobicContact CE2-CB 4.33Å; F93-L148 HydrophobicContact CE2-CD2 4.03Å; F93-L148 HydrophobicContact CE2-CG 3.9Å; F93-L148 HydrophobicContact CG-CD2 4.05Å; F93-L148 HydrophobicContact CZ-CD2 4.25Å; F93-L148 HydrophobicContact CZ-CG 4.45Å; F93-A152 HydrophobicContact CE2-CB 4.19Å; F93-A152 HydrophobicContact CZ-CB 4.43Å
94	A	98.3	Very high	98.4	Very high	36 Å²	36	50 Å²	50	30%	0.298	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-45.1	-39.2	-174.4	0	0	0	0	0	115.3	K88 N90 L96 Y97	K88-A94 WeakPolarHBondContact O-CA 3.43Å; K88-A94 WeakPolarHBondContact O-CB 3.45Å; N90-A94 WeakPolarHBondContact O-CB 3.49Å; N90-A94 PolarHBondContact O-N 2.97Å; A94-L96 PolarHBondContact O-N 3.03Å; A94-Y97 WeakPolarHBondContact O-CB 3.48Å; A94-Y97 PolarHBondContact O-N 3.22Å; A94-Y97 VanDerWaalsContact O-N 3.15Å
95	P	98.3	Very high	98.3	Very high	49 Å²	49	54.2 Å²	54.2	32%	0.318	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-62	-13.5	176.7	-26.5	38.6	0	0	0	115.7	F93 F98 R204 L208	F93-P95 VanDerWaalsContact C-N 3.28Å; F93-P95 WeakPolarHBondContact O-CD 3.32Å; P95-F98 WeakPolarHBondContact O-CE2 3.34Å; P95-R204 WeakPolarHBondContact O-CB 3.22Å; P95-L208 HydrophobicContact CB-CD2 4.22Å; P95-L208 HydrophobicContact CG-CD2 3.78Å
96	L	98.4	Very high	98.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-107.9	4.3	-178.7	-56.1	178	0	0	0	113.2	F93 A94 F98 V149 Y201 R204 M205 L208	F93-L96 HydrophobicContact CE2-CB 4.22Å; F93-L96 HydrophobicContact CE2-CD1 4.48Å; F93-L96 HydrophobicContact CZ-CB 4.31Å; F93-L96 WeakPolarHBondContact O-CB 3.36Å; F93-L96 PolarHBondContact O-N 3.33Å; A94-L96 PolarHBondContact O-N 3.03Å; L96-F98 WeakPolarHBondContact O-CD2 3.26Å; L96-F98 PolarHBondContact O-N 2.88Å; L96-F98 VanDerWaalsContact O-N 3.13Å; L96-V149 HydrophobicContact CD1-CB 3.76Å; L96-V149 HydrophobicContact CD1-CG2 3.31Å; L96-Y201 HydrophobicContact CB-CE2 4.27Å; L96-Y201 HydrophobicContact CD2-CD1 4.45Å; L96-Y201 HydrophobicContact CD2-CE1 4.13Å; L96-Y201 HydrophobicContact CD2-CE2 4.2Å; L96-R204 HydrophobicContact CD2-CB 3.66Å; L96-M205 HydrophobicContact CD1-CG 3.92Å; L96-M205 HydrophobicContact CD2-CB 4.37Å; L96-M205 HydrophobicContact CD2-CG 3.55Å; L96-M205 HydrophobicContact CG-CG 4.4Å; L96-L208 HydrophobicContact CD1-CD1 4.05Å
97	Y	98.7	Very high	98.3	Very high	65 Å²	65	53.7 Å²	53.7	26%	0.255	28%	0.28	S	S	.	.			trans	-81.1	94.5	-179	-173.5	-114.3	0	0	0	111.1	M84 D85 K88 F93 A94 P99	M84-Y97 HydrophobicContact CB-CD2 4.4Å; M84-Y97 HydrophobicContact CB-CE2 4.44Å; D85-Y97 WeakPolarHBondContact OD1-CE2 3.38Å; D85-Y97 PolarHBondContact OD1-OH 3.44Å; K88-Y97 HydrophobicContact CB-CD1 3.79Å; K88-Y97 HydrophobicContact CB-CD2 3.89Å; K88-Y97 HydrophobicContact CB-CE1 3.72Å; K88-Y97 HydrophobicContact CB-CE2 3.84Å; K88-Y97 HydrophobicContact CB-CG 3.86Å; K88-Y97 HydrophobicContact CD-CE1 4.23Å; F93-Y97 HydrophobicContact CE1-CD2 4.37Å; A94-Y97 WeakPolarHBondContact O-CB 3.48Å; A94-Y97 PolarHBondContact O-N 3.22Å; A94-Y97 VanDerWaalsContact O-N 3.15Å; Y97-P99 VanDerWaalsContact C-CD 3.43Å; Y97-P99 HydrophobicContact CD1-CG 4.19Å; Y97-P99 HydrophobicContact CE1-CB 4.45Å; Y97-P99 HydrophobicContact CE1-CG 3.67Å; Y97-P99 HydrophobicContact CE2-CB 4.33Å; Y97-P99 HydrophobicContact CE2-CG 4.35Å; Y97-P99 WeakPolarHBondContact O-CD 3.48Å
98	F	98.7	Very high	98.3	Very high	29 Å²	29	53.1 Å²	53.1	13%	0.127	28%	0.277	C	S	.	.			trans	-119.2	67.8	179.7	-66.6	-80.4	0	0	0	111.5	P95 L96 L100 E101 L102 F197 L200 Y201 R204	P95-F98 WeakPolarHBondContact O-CE2 3.34Å; L96-F98 WeakPolarHBondContact O-CD2 3.26Å; L96-F98 PolarHBondContact O-N 2.88Å; L96-F98 VanDerWaalsContact O-N 3.13Å; F98-L100 PolarHBondContact O-N 3.29Å; F98-E101 HydrophobicContact CB-CB 4.3Å; F98-E101 PolarHBondContact O-N 3.37Å; F98-L102 HydrophobicContact CB-CD1 4.05Å; F98-L102 HydrophobicContact CB-CG 4.11Å; F98-L102 WeakPolarHBondContact O-CB 3.47Å; F98-L102 PolarHBondContact O-N 2.78Å; F98-F197 HydrophobicContact CB-CZ 4.05Å; F98-F197 HydrophobicContact CD1-CE2 4.33Å; F98-F197 HydrophobicContact CD1-CZ 4.07Å; F98-F197 HydrophobicContact CD2-CZ 4.31Å; F98-F197 AromaticContact CG-CZ 3.89Å; F98-F197 HydrophobicContact CG-CZ 3.89Å; F98-L200 HydrophobicContact CE1-CD2 4.48Å; F98-Y201 HydrophobicContact CD2-CD2 4Å; F98-Y201 HydrophobicContact CD2-CE2 4.11Å; F98-Y201 HydrophobicContact CE2-CD2 4.14Å; F98-Y201 HydrophobicContact CE2-CE2 4.49Å; F98-R204 HydrophobicContact CE2-CG 4.33Å; F98-R204 HydrophobicContact CZ-CG 4.12Å
99	P	98.5	Very high	98.3	Very high	38 Å²	38	50.7 Å²	50.7	25%	0.247	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-40.6	-171.4	26.2	-35.8	0	0	0	113.1	Y97 E101 H103	Y97-P99 VanDerWaalsContact C-CD 3.43Å; Y97-P99 HydrophobicContact CD1-CG 4.19Å; Y97-P99 HydrophobicContact CE1-CB 4.45Å; Y97-P99 HydrophobicContact CE1-CG 3.67Å; Y97-P99 HydrophobicContact CE2-CB 4.33Å; Y97-P99 HydrophobicContact CE2-CG 4.35Å; Y97-P99 WeakPolarHBondContact O-CD 3.48Å; P99-E101 VanDerWaalsContact C-N 3.32Å; P99-E101 PolarHBondContact O-N 2.75Å; P99-H103 WeakPolarHBondContact O-CB 3.39Å; P99-H103 PolarHBondContact O-N 3.01Å; P99-H103 VanDerWaalsContact O-N 3.12Å
100	L	98.3	Very high	98.3	Very high	126 Å²	126	49.1 Å²	49.1	66%	0.66	26%	0.256	S	S	*	.	H	α-helix	trans	-67.3	-38.1	-178.5	-63	177.8	0	0	0	111.3	F98 N190	F98-L100 PolarHBondContact O-N 3.29Å; L100-N190 WeakPolarHBondContact O-CB 3.46Å; L100-N190 PolarHBondContact O-ND2 2.9Å
101	E	98.6	Very high	98.4	Very high	54 Å²	54	47 Å²	47	25%	0.252	25%	0.245	S	C	.	.	H	α-helix	trans	-82.1	-42.5	-175.6	-58	89.2	162	0	0	112	F98 P99 R104 F188 N190 I191 F197	F98-E101 HydrophobicContact CB-CB 4.3Å; F98-E101 PolarHBondContact O-N 3.37Å; P99-E101 VanDerWaalsContact C-N 3.32Å; P99-E101 PolarHBondContact O-N 2.75Å; E101-R104 PolarHBondContact O-NH2 3.39Å; E101-F188 WeakPolarHBondContact O-CD1 3.35Å; E101-N190 HydrophobicContact CG-CB 4.34Å; E101-I191 HydrophobicContact CB-CD1 4.04Å; E101-I191 HydrophobicContact CB-CG1 3.84Å; E101-I191 HydrophobicContact CG-CG1 4.41Å; E101-F197 HydrophobicContact CB-CE2 3.66Å; E101-F197 HydrophobicContact CB-CZ 3.7Å; E101-F197 HydrophobicContact CG-CE2 3.77Å; E101-F197 HydrophobicContact CG-CZ 4.26Å
102	L	98.6	Very high	98.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-107.8	-30.6	-167.4	-67.9	-178.7	0	0	0	115.5	F98 R104 Y156 L160 F188 I191 F197 Y201	F98-L102 HydrophobicContact CB-CD1 4.05Å; F98-L102 HydrophobicContact CB-CG 4.11Å; F98-L102 WeakPolarHBondContact O-CB 3.47Å; F98-L102 PolarHBondContact O-N 2.78Å; L102-R104 PolarHBondContact O-N 2.98Å; L102-R104 PolarHBondContact O-NE 3.25Å; L102-Y156 HydrophobicContact CB-CD1 3.89Å; L102-Y156 HydrophobicContact CB-CD2 4.43Å; L102-Y156 HydrophobicContact CB-CE1 3.91Å; L102-Y156 HydrophobicContact CB-CE2 4.47Å; L102-Y156 HydrophobicContact CB-CG 4.15Å; L102-Y156 HydrophobicContact CD1-CD2 4.03Å; L102-Y156 HydrophobicContact CD1-CG 4.01Å; L102-Y156 HydrophobicContact CD2-CD1 4.29Å; L102-Y156 HydrophobicContact CD2-CG 4.26Å; L102-Y156 HydrophobicContact CG-CD1 4.49Å; L102-Y156 HydrophobicContact CG-CG 4.39Å; L102-Y156 WeakPolarHBondContact O-CE1 3.41Å; L102-L160 HydrophobicContact CD2-CD1 4.01Å; L102-F188 HydrophobicContact CD2-CD1 4.48Å; L102-F188 HydrophobicContact CD2-CE1 4.15Å; L102-I191 HydrophobicContact CD2-CD1 3.99Å; L102-F197 HydrophobicContact CD1-CE1 3.96Å; L102-F197 HydrophobicContact CD1-CZ 4.32Å; L102-F197 HydrophobicContact CD2-CD1 4.34Å; L102-F197 HydrophobicContact CD2-CE1 3.62Å; L102-F197 HydrophobicContact CD2-CZ 4.23Å; L102-F197 HydrophobicContact CG-CE1 3.8Å; L102-F197 HydrophobicContact CG-CZ 4.01Å; L102-Y201 HydrophobicContact CD1-CD2 3.95Å; L102-Y201 HydrophobicContact CD1-CE2 3.61Å
103	H	98.8	Very high	98.5	Very high	32 Å²	32	44.5 Å²	44.5	15%	0.148	22%	0.221	C	C	.	.			trans	-59.4	135.1	-173.5	-73.8	-166.5	0	0	0	111.1	E81 D85 P99	E81-H103 HydrophobicContact CG-CB 4.26Å; E81-H103 WeakPolarHBondContact OE2-CB 3.31Å; E81-H103 IonicContact OE2-CG 2.78Å; E81-H103 IonicContact OE2-ND1 3.58Å; D85-H103 IonicContact OD1-CE1 3.84Å; P99-H103 WeakPolarHBondContact O-CB 3.39Å; P99-H103 PolarHBondContact O-N 3.01Å; P99-H103 VanDerWaalsContact O-N 3.12Å
104	R	98.8	Very high	98.5	Very high	12 Å²	12	48.6 Å²	48.6	5%	0.045	24%	0.238	C	C	.	.			trans	-110.6	-17.1	-175.5	-59.4	-60.6	84.1	-174.4	-2.2	112.7	Y77 E81 E101 L102 E106 A107 L108 Y156 F185 I187 F188	Y77-R104 HydrophobicContact CD1-CB 3.54Å; Y77-R104 HydrophobicContact CD1-CG 3.57Å; Y77-R104 HydrophobicContact CE1-CB 3.94Å; Y77-R104 HydrophobicContact CE1-CG 3.42Å; Y77-R104 VanDerWaalsContact CE1-CG 3.42Å; Y77-R104 HydrophobicContact CG-CB 4Å; Y77-R104 HydrophobicContact CG-CG 4.41Å; E81-R104 WeakPolarHBondContact OE1-CA 3.28Å; E81-R104 PolarHBondContact OE1-N 2.72Å; E101-R104 PolarHBondContact O-NH2 3.39Å; L102-R104 PolarHBondContact O-N 2.98Å; L102-R104 PolarHBondContact O-NE 3.25Å; R104-E106 VanDerWaalsContact C-N 3.3Å; R104-E106 PolarHBondContact O-N 2.96Å; R104-A107 WeakPolarHBondContact O-CB 3.35Å; R104-A107 PolarHBondContact O-N 3.39Å; R104-L108 HydrophobicContact CB-CD1 3.86Å; R104-L108 WeakPolarHBondContact O-CB 3.21Å; R104-L108 WeakPolarHBondContact O-CG 3.4Å; R104-L108 PolarHBondContact O-N 3.19Å; R104-Y156 HydrophobicContact CG-CE1 4.19Å; R104-F185 HydrophobicContact CB-CD2 3.83Å; R104-F185 HydrophobicContact CB-CE2 3.9Å; R104-F185 WeakPolarHBondContact CD-O 3.38Å; R104-F185 HydrophobicContact CG-CD2 3.93Å; R104-F185 HydrophobicContact CG-CE2 3.67Å; R104-F185 PolarHBondContact NH1-O 2.96Å; R104-I187 PolarHBondContact NH1-O 3.17Å; R104-F188 VanDerWaalsContact NH1-CE1 3.28Å; R104-F188 VanDerWaalsContact NH1-CG 3.28Å
105	R	98.6	Very high	98.5	Very high	90 Å²	90	47.9 Å²	47.9	34%	0.34	23%	0.228	S	C	.	.	H	α-helix	trans	-52.1	-45.6	-176.1	-178.4	178.3	69.5	-173.9	-4	112.9	Y74 E81 L108 V109	Y74-R105 HydrophobicContact CE2-CG 4.4Å; E81-R105 PolarHBondContact OE1-N 3.2Å; E81-R105 WeakPolarHBondContact OE2-CB 3.32Å; E81-R105 PolarHBondContact OE2-N 2.88Å; R105-L108 PolarHBondContact O-N 3.17Å; R105-V109 WeakPolarHBondContact O-CG2 3.46Å; R105-V109 PolarHBondContact O-N 3.41Å
106	E	98.4	Very high	98.5	Very high	152 Å²	152	47.2 Å²	47.2	71%	0.71	22%	0.219	S	C	*	.	H	α-helix	trans	-66.3	-39	179.9	-65.3	-174	172.5	0	0	112.7	R104 V109 K110	R104-E106 VanDerWaalsContact C-N 3.3Å; R104-E106 PolarHBondContact O-N 2.96Å; E106-V109 PolarHBondContact O-N 2.88Å; E106-K110 PolarHBondContact O-N 2.91Å
107	A	98.5	Very high	98.4	Very high	15 Å²	15	48.5 Å²	48.5	12%	0.124	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-41.5	174.2	0	0	0	0	0	111.4	R104 V109 K110 D111 Q184	R104-A107 WeakPolarHBondContact O-CB 3.35Å; R104-A107 PolarHBondContact O-N 3.39Å; A107-V109 VanDerWaalsContact C-N 3.32Å; A107-V109 PolarHBondContact O-N 2.75Å; A107-K110 WeakPolarHBondContact O-CB 3.32Å; A107-K110 PolarHBondContact O-N 3.29Å; A107-D111 PolarHBondContact O-N 2.88Å; A107-D111 VanDerWaalsContact O-N 3.09Å; A107-Q184 HydrophobicContact CB-CB 4.03Å
108	L	98.8	Very high	98.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-34.4	176.3	-76.8	157.3	0	0	0	112.2	T70 L73 Y74 Y77 R104 R105 D111 M112 F185	T70-L108 HydrophobicContact CG2-CD2 3.86Å; L73-L108 HydrophobicContact CB-CD1 4.23Å; L73-L108 HydrophobicContact CB-CD2 3.74Å; Y74-L108 HydrophobicContact CD2-CB 4.18Å; Y77-L108 HydrophobicContact CD2-CD1 4.12Å; Y77-L108 HydrophobicContact CG-CD1 4.05Å; R104-L108 HydrophobicContact CB-CD1 3.86Å; R104-L108 WeakPolarHBondContact O-CB 3.21Å; R104-L108 WeakPolarHBondContact O-CG 3.4Å; R104-L108 PolarHBondContact O-N 3.19Å; R105-L108 PolarHBondContact O-N 3.17Å; L108-D111 PolarHBondContact O-N 3.03Å; L108-M112 VanDerWaalsContact O-CG 3.28Å; L108-M112 WeakPolarHBondContact O-CG 3.47Å; L108-M112 PolarHBondContact O-N 3.47Å; L108-F185 HydrophobicContact CD1-CD2 3.73Å; L108-F185 HydrophobicContact CD1-CE2 4.13Å; L108-F185 HydrophobicContact CD2-CB 3.97Å; L108-F185 HydrophobicContact CD2-CD2 3.74Å; L108-F185 HydrophobicContact CD2-CG 4.05Å; L108-F185 HydrophobicContact CG-CB 4.24Å; L108-F185 HydrophobicContact CG-CD2 3.69Å; L108-F185 HydrophobicContact CG-CG 4.35Å
109	V	98.7	Very high	98.2	Very high	39 Å²	39	56.4 Å²	56.4	24%	0.236	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-46	172.4	167.9	0	0	0	0	111	Y74 R105 E106 A107 D111 M112 E113 W120	Y74-V109 HydrophobicContact CE2-CG2 3.95Å; R105-V109 WeakPolarHBondContact O-CG2 3.46Å; R105-V109 PolarHBondContact O-N 3.41Å; E106-V109 PolarHBondContact O-N 2.88Å; A107-V109 VanDerWaalsContact C-N 3.32Å; A107-V109 PolarHBondContact O-N 2.75Å; V109-D111 VanDerWaalsContact C-N 3.29Å; V109-D111 PolarHBondContact O-N 3Å; V109-M112 WeakPolarHBondContact O-CB 3.23Å; V109-M112 PolarHBondContact O-N 3.08Å; V109-E113 WeakPolarHBondContact O-CG 3.21Å; V109-E113 PolarHBondContact O-N 3.45Å; V109-W120 HydrophobicContact CB-CZ2 4.34Å; V109-W120 HydrophobicContact CG1-CZ2 3.93Å; V109-W120 HydrophobicContact CG2-CH2 4.12Å; V109-W120 HydrophobicContact CG2-CZ2 3.91Å
110	K	98.6	Very high	98.2	Very high	102 Å²	102	55 Å²	55	44%	0.443	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-40.3	175.9	-63.4	172.5	179.7	175.5	0	111.7	E106 A107 E113 Y114 Q184	E106-K110 PolarHBondContact O-N 2.91Å; A107-K110 WeakPolarHBondContact O-CB 3.32Å; A107-K110 PolarHBondContact O-N 3.29Å; K110-E113 PolarHBondContact O-N 2.97Å; K110-Y114 PolarHBondContact O-N 3.25Å; K110-Q184 HydrophobicContact CB-CB 4.43Å; K110-Q184 HydrophobicContact CB-CG 4.09Å; K110-Q184 HydrophobicContact CD-CB 4.5Å; K110-Q184 HydrophobicContact CD-CG 4.14Å
111	D	98.5	Very high	98.1	Very high	1 Å²	1	56 Å²	56	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-67.9	-37.7	177.4	-67.3	-22	0	0	0	112	T70 A107 L108 V109 Y114 F115 G182 I183 Q184 F185	T70-D111 HydrophobicContact CG2-CB 3.96Å; A107-D111 PolarHBondContact O-N 2.88Å; A107-D111 VanDerWaalsContact O-N 3.09Å; L108-D111 PolarHBondContact O-N 3.03Å; V109-D111 VanDerWaalsContact C-N 3.29Å; V109-D111 PolarHBondContact O-N 3Å; D111-Y114 PolarHBondContact O-N 3.42Å; D111-F115 WeakPolarHBondContact O-CD2 3.19Å; D111-F115 PolarHBondContact O-N 3.03Å; D111-G182 VanDerWaalsContact OD1-CA 3.28Å; D111-G182 WeakPolarHBondContact OD1-CA 3.33Å; D111-G182 PolarHBondContact OD1-N 2.77Å; D111-I183 PolarHBondContact OD1-N 2.96Å; D111-Q184 VanDerWaalsContact CG-N 3.33Å; D111-Q184 VanDerWaalsContact OD1-CB 3.3Å; D111-Q184 WeakPolarHBondContact OD1-CB 3.48Å; D111-Q184 WeakPolarHBondContact OD1-CG 3.22Å; D111-Q184 PolarHBondContact OD1-N 3.44Å; D111-Q184 PolarHBondContact OD2-N 3.43Å; D111-Q184 VanDerWaalsContact OD2-N 3.09Å; D111-F185 WeakPolarHBondContact OD2-CB 3.45Å; D111-F185 PolarHBondContact OD2-N 3.37Å
112	M	98.6	Very high	98	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-45.7	172.6	-68	-60.6	85.5	0	0	111.9	T70 V71 Y74 L108 V109 Y114 F115 Y116 W120 I124	T70-M112 HydrophobicContact CG2-CE 3.21Å; V71-M112 HydrophobicContact CG2-CE 4.22Å; V71-M112 HydrophobicContact CG2-SD 3.69Å; Y74-M112 HydrophobicContact CG-CG 4.37Å; L108-M112 VanDerWaalsContact O-CG 3.28Å; L108-M112 WeakPolarHBondContact O-CG 3.47Å; L108-M112 PolarHBondContact O-N 3.47Å; V109-M112 WeakPolarHBondContact O-CB 3.23Å; V109-M112 PolarHBondContact O-N 3.08Å; M112-Y114 VanDerWaalsContact C-N 3.3Å; M112-Y114 PolarHBondContact O-N 3.26Å; M112-F115 PolarHBondContact O-N 3.3Å; M112-Y116 HydrophobicContact CE-CD2 4.39Å; M112-Y116 HydrophobicContact CE-CE2 4.17Å; M112-Y116 WeakPolarHBondContact O-CB 3.19Å; M112-Y116 PolarHBondContact O-N 2.97Å; M112-Y116 HydrophobicContact SD-CD2 4.18Å; M112-Y116 HydrophobicContact SD-CE2 4.16Å; M112-W120 HydrophobicContact CB-CB 4.14Å; M112-W120 HydrophobicContact CB-CD2 3.53Å; M112-W120 HydrophobicContact CB-CE3 3.6Å; M112-W120 HydrophobicContact CB-CG 3.8Å; M112-W120 HydrophobicContact CB-CZ3 4.17Å; M112-W120 HydrophobicContact CG-CD2 4.2Å; M112-W120 HydrophobicContact CG-CE3 3.74Å; M112-W120 HydrophobicContact CG-CZ3 3.93Å; M112-I124 HydrophobicContact SD-CD1 4.47Å; M112-I124 HydrophobicContact SD-CG2 4.13Å
113	E	98.3	Very high	97.9	Very high	94 Å²	94	66.8 Å²	66.8	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-58.7	-43.1	176.7	-73	171.3	175.6	0	0	111.2	V109 K110 F115 G117	V109-E113 WeakPolarHBondContact O-CG 3.21Å; V109-E113 PolarHBondContact O-N 3.45Å; K110-E113 PolarHBondContact O-N 2.97Å; E113-F115 PolarHBondContact O-N 3.49Å; E113-G117 VanDerWaalsContact O-CA 3.22Å; E113-G117 WeakPolarHBondContact O-CA 3.26Å; E113-G117 PolarHBondContact O-N 3.5Å
114	Y	98.1	Very high	97.9	Very high	87 Å²	87	66 Å²	66	34%	0.341	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-43.6	176.2	178.8	-95	0	0	0	112.8	K110 D111 M112 L176 P177 E181 G182	K110-Y114 PolarHBondContact O-N 3.25Å; D111-Y114 PolarHBondContact O-N 3.42Å; M112-Y114 VanDerWaalsContact C-N 3.3Å; M112-Y114 PolarHBondContact O-N 3.26Å; Y114-L176 HydrophobicContact CE1-CD2 3.68Å; Y114-P177 HydrophobicContact CE2-CG 4.29Å; Y114-P177 WeakPolarHBondContact OH-CD 3.43Å; Y114-E181 HydrophobicContact CD2-CB 3.5Å; Y114-E181 HydrophobicContact CE2-CB 3.65Å; Y114-E181 HydrophobicContact CG-CB 4.26Å; Y114-G182 VanDerWaalsContact CD1-CA 3.44Å
115	F	97.8	Very high	97.8	Very high	20 Å²	20	73.5 Å²	73.5	9%	0.088	34%	0.344	C	S	.	.	H	α-helix	trans	-85	-29.6	-174.4	-76.3	-55.9	0	0	0	115.3	F66 K67 D111 M112 E113 L176 G182	F66-F115 HydrophobicContact CD1-CE1 4.36Å; F66-F115 AromaticContact CD1-CE2 3.91Å; F66-F115 HydrophobicContact CD1-CE2 3.91Å; F66-F115 AromaticContact CD1-CZ 3.6Å; F66-F115 HydrophobicContact CD1-CZ 3.6Å; F66-F115 AromaticContact CE1-CE2 3.64Å; F66-F115 HydrophobicContact CE1-CE2 3.64Å; F66-F115 AromaticContact CE1-CZ 3.49Å; F66-F115 HydrophobicContact CE1-CZ 3.49Å; F66-F115 VanDerWaalsContact CE1-CZ 3.49Å; K67-F115 HydrophobicContact CD-CB 4.24Å; K67-F115 HydrophobicContact CD-CD1 4.06Å; K67-F115 HydrophobicContact CD-CG 4.37Å; K67-F115 WeakPolarHBondContact CE-O 3.33Å; K67-F115 HydrophobicContact CG-CB 3.87Å; K67-F115 HydrophobicContact CG-CD1 3.57Å; K67-F115 HydrophobicContact CG-CD2 4.33Å; K67-F115 HydrophobicContact CG-CE1 4.21Å; K67-F115 HydrophobicContact CG-CG 3.67Å; D111-F115 WeakPolarHBondContact O-CD2 3.19Å; D111-F115 PolarHBondContact O-N 3.03Å; M112-F115 PolarHBondContact O-N 3.3Å; E113-F115 PolarHBondContact O-N 3.49Å; F115-L176 HydrophobicContact CE1-CD2 4.13Å; F115-L176 HydrophobicContact CZ-CD1 4.46Å; F115-L176 HydrophobicContact CZ-CD2 4.23Å; F115-G182 WeakPolarHBondContact CE2-O 3.44Å; F115-G182 WeakPolarHBondContact CZ-O 3.44Å
116	Y	97.6	Very high	97.7	Very high	35 Å²	35	71.1 Å²	71.1	14%	0.137	34%	0.341	C	S	.	.	H	α-helix	trans	-122.6	-10.9	-170.1	-67.1	-89.7	0	0	0	113.6	K67 V71 M112 K123 I124	K67-Y116 HydrophobicContact CB-CE2 3.97Å; K67-Y116 WeakPolarHBondContact CB-OH 3.48Å; K67-Y116 HydrophobicContact CG-CE2 4.47Å; V71-Y116 HydrophobicContact CG2-CE2 3.74Å; V71-Y116 WeakPolarHBondContact CG2-OH 3.47Å; M112-Y116 HydrophobicContact CE-CD2 4.39Å; M112-Y116 HydrophobicContact CE-CE2 4.17Å; M112-Y116 WeakPolarHBondContact O-CB 3.19Å; M112-Y116 PolarHBondContact O-N 2.97Å; M112-Y116 HydrophobicContact SD-CD2 4.18Å; M112-Y116 HydrophobicContact SD-CE2 4.16Å; Y116-K123 HydrophobicContact CD1-CB 4.11Å; Y116-K123 VanDerWaalsContact O-CD 3.25Å; Y116-K123 WeakPolarHBondContact O-CD 3.44Å; Y116-K123 PolarHBondContact O-NZ 2.93Å; Y116-I124 HydrophobicContact CD1-CG2 4.19Å; Y116-I124 HydrophobicContact CD2-CG2 4.08Å; Y116-I124 HydrophobicContact CE1-CG2 4.16Å; Y116-I124 HydrophobicContact CE2-CG2 4.06Å; Y116-I124 HydrophobicContact CG-CG2 4.14Å
117	G	97.9	Very high	97.7	Very high	28 Å²	28	65.7 Å²	65.7	29%	0.289	32%	0.32	S	S	.	.			trans	89.5	-178.5	-177.8	0	0	0	0	0	113.5	E113 D119 W120	E113-G117 VanDerWaalsContact O-CA 3.22Å; E113-G117 WeakPolarHBondContact O-CA 3.26Å; E113-G117 PolarHBondContact O-N 3.5Å; G117-D119 PolarHBondContact O-N 2.89Å; G117-W120 VanDerWaalsContact O-CB 3.27Å; G117-W120 WeakPolarHBondContact O-CB 3.37Å; G117-W120 VanDerWaalsContact O-CD1 3.28Å; G117-W120 PolarHBondContact O-N 3.37Å; G117-W120 VanDerWaalsContact O-N 3.08Å
118	E	95.7	Very high	97.7	Very high	191 Å²	191	70.4 Å²	70.4	89%	0.893	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.4	-177.2	-64.2	-178.6	173.9	0	0	113.3	W120	E118-W120 VanDerWaalsContact C-N 3.27Å; E118-W120 PolarHBondContact O-N 2.86Å
119	D	96.5	Very high	97.7	Very high	69 Å²	69	70.9 Å²	70.9	37%	0.369	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	20	177.6	62.4	-33.6	0	0	0	113.2	G117 K121 E122 K123	G117-D119 PolarHBondContact O-N 2.89Å; D119-K121 PolarHBondContact O-N 3.2Å; D119-E122 PolarHBondContact O-N 3Å; D119-K123 IonicContact OD1-NZ 3.44Å; D119-K123 PolarHBondContact OD1-NZ 3.1Å; D119-K123 WeakPolarHBondContact OD2-CE 3.41Å; D119-K123 IonicContact OD2-NZ 3.94Å; D119-K123 PolarHBondContact OD2-NZ 3.28Å
120	W	98.1	Very high	97.7	Very high	7 Å²	7	69 Å²	69	3%	0.027	33%	0.332	C	S	.	.	H	α-helix	trans	-51.7	-35.3	-175.9	63.1	-91.4	0	0	0	114	Y74 V109 M112 G117 E118 E122 K123 I124	Y74-W120 HydrophobicContact CD1-CZ3 4.11Å; Y74-W120 HydrophobicContact CD2-CH2 4.31Å; Y74-W120 HydrophobicContact CD2-CZ3 4.41Å; Y74-W120 AromaticContact CE1-CH2 3.96Å; Y74-W120 HydrophobicContact CE1-CH2 3.96Å; Y74-W120 AromaticContact CE1-CZ3 3.69Å; Y74-W120 HydrophobicContact CE1-CZ3 3.69Å; Y74-W120 AromaticContact CE2-CH2 3.61Å; Y74-W120 HydrophobicContact CE2-CH2 3.61Å; Y74-W120 HydrophobicContact CE2-CZ3 4.04Å; Y74-W120 HydrophobicContact CG-CZ3 4.46Å; Y74-W120 AromaticContact CZ-CH2 3.42Å; Y74-W120 VanDerWaalsContact CZ-CH2 3.42Å; Y74-W120 AromaticContact CZ-CZ3 3.66Å; Y74-W120 WeakPolarHBondContact OH-CH2 3.43Å; V109-W120 HydrophobicContact CB-CZ2 4.34Å; V109-W120 HydrophobicContact CG1-CZ2 3.93Å; V109-W120 HydrophobicContact CG2-CH2 4.12Å; V109-W120 HydrophobicContact CG2-CZ2 3.91Å; M112-W120 HydrophobicContact CB-CB 4.14Å; M112-W120 HydrophobicContact CB-CD2 3.53Å; M112-W120 HydrophobicContact CB-CE3 3.6Å; M112-W120 HydrophobicContact CB-CG 3.8Å; M112-W120 HydrophobicContact CB-CZ3 4.17Å; M112-W120 HydrophobicContact CG-CD2 4.2Å; M112-W120 HydrophobicContact CG-CE3 3.74Å; M112-W120 HydrophobicContact CG-CZ3 3.93Å; G117-W120 VanDerWaalsContact O-CB 3.27Å; G117-W120 WeakPolarHBondContact O-CB 3.37Å; G117-W120 VanDerWaalsContact O-CD1 3.28Å; G117-W120 PolarHBondContact O-N 3.37Å; G117-W120 VanDerWaalsContact O-N 3.08Å; E118-W120 VanDerWaalsContact C-N 3.27Å; E118-W120 PolarHBondContact O-N 2.86Å; W120-E122 PolarHBondContact O-N 2.91Å; W120-K123 PolarHBondContact O-N 2.79Å; W120-I124 HydrophobicContact CE3-CD1 3.65Å; W120-I124 HydrophobicContact CE3-CG1 4.13Å; W120-I124 HydrophobicContact CZ3-CD1 3.52Å; W120-I124 HydrophobicContact CZ3-CG1 4.39Å; W120-I124 WeakPolarHBondContact O-CG2 3.4Å; W120-I124 PolarHBondContact O-N 2.66Å; W120-I124 VanDerWaalsContact O-N 3.11Å
121	K	97.4	Very high	97.7	Very high	148 Å²	148	68.7 Å²	68.7	64%	0.643	33%	0.331	S	S	*	.	H	α-helix	trans	-59.3	-30.6	179.9	-69.9	-175.2	-179.7	177.6	0	113.3	D119 K123	D119-K121 PolarHBondContact O-N 3.2Å; K121-K123 VanDerWaalsContact C-N 3.34Å
122	E	96.8	Very high	97.7	Very high	174 Å²	174	73.4 Å²	73.4	81%	0.813	35%	0.352	S	S	*	.	H	α-helix	trans	-82.8	-17.2	179.2	-60.2	179.8	-169.3	0	0	112.2	D119 W120	D119-E122 PolarHBondContact O-N 3Å; W120-E122 PolarHBondContact O-N 2.91Å
123	K	96.5	Very high	97.7	Very high	106 Å²	106	73.4 Å²	73.4	46%	0.461	35%	0.353	S	S	.	.	H	α-helix	trans	-97.9	-24.3	-174.4	-69.5	168.2	165.7	162	0	113.6	Y116 D119 W120 K121	Y116-K123 HydrophobicContact CD1-CB 4.11Å; Y116-K123 VanDerWaalsContact O-CD 3.25Å; Y116-K123 WeakPolarHBondContact O-CD 3.44Å; Y116-K123 PolarHBondContact O-NZ 2.93Å; D119-K123 IonicContact OD1-NZ 3.44Å; D119-K123 PolarHBondContact OD1-NZ 3.1Å; D119-K123 WeakPolarHBondContact OD2-CE 3.41Å; D119-K123 IonicContact OD2-NZ 3.94Å; D119-K123 PolarHBondContact OD2-NZ 3.28Å; W120-K123 PolarHBondContact O-N 2.79Å; K121-K123 VanDerWaalsContact C-N 3.34Å
124	I	97.5	Very high	97.7	Very high	16 Å²	16	69.9 Å²	69.9	8%	0.082	34%	0.337	C	S	.	.			trans	-92.2	147.9	-177.2	67.7	161.3	0	0	0	111.3	V71 Y74 F75 M112 Y116 W120	V71-I124 HydrophobicContact CG1-CB 3.99Å; V71-I124 HydrophobicContact CG1-CD1 4.39Å; V71-I124 HydrophobicContact CG1-CG2 4.48Å; V71-I124 HydrophobicContact CG2-CB 3.99Å; V71-I124 HydrophobicContact CG2-CG2 3.56Å; Y74-I124 HydrophobicContact CD1-CD1 3.68Å; Y74-I124 HydrophobicContact CE1-CD1 3.89Å; F75-I124 HydrophobicContact CE2-CD1 3.8Å; F75-I124 HydrophobicContact CE2-CG1 4.33Å; F75-I124 HydrophobicContact CZ-CD1 3.77Å; F75-I124 HydrophobicContact CZ-CG1 4.21Å; M112-I124 HydrophobicContact SD-CD1 4.47Å; M112-I124 HydrophobicContact SD-CG2 4.13Å; Y116-I124 HydrophobicContact CD1-CG2 4.19Å; Y116-I124 HydrophobicContact CD2-CG2 4.08Å; Y116-I124 HydrophobicContact CE1-CG2 4.16Å; Y116-I124 HydrophobicContact CE2-CG2 4.06Å; Y116-I124 HydrophobicContact CG-CG2 4.14Å; W120-I124 HydrophobicContact CE3-CD1 3.65Å; W120-I124 HydrophobicContact CE3-CG1 4.13Å; W120-I124 HydrophobicContact CZ3-CD1 3.52Å; W120-I124 HydrophobicContact CZ3-CG1 4.39Å; W120-I124 WeakPolarHBondContact O-CG2 3.4Å; W120-I124 PolarHBondContact O-N 2.66Å; W120-I124 VanDerWaalsContact O-N 3.11Å
125	Q	96.4	Very high	97.8	Very high	169 Å²	169	69.7 Å²	69.7	79%	0.79	34%	0.342	S	S	*	.			trans	-135	141.4	173.1	-66.9	-173	-15.7	0	0	109.4	S127	Q125-S127 PolarHBondContact O-N 3.03Å
126	C	97.9	Very high	97.8	Very high	41 Å²	41	69.9 Å²	69.9	28%	0.277	34%	0.342	S	S	.	.			trans	-74.2	122.5	174.5	-168.4	0	0	0	0	108.6	F75 T130	F75-C126 HydrophobicContact CD1-CB 4.08Å; F75-C126 HydrophobicContact CD2-CB 3.68Å; F75-C126 HydrophobicContact CE1-CB 4.11Å; F75-C126 HydrophobicContact CE2-CB 3.71Å; F75-C126 HydrophobicContact CG-CB 3.89Å; F75-C126 HydrophobicContact CZ-CB 3.93Å; C126-T130 VanDerWaalsContact SG-CG2 3.59Å
127	S	97.7	Very high	97.9	Very high	37 Å²	37	68.2 Å²	68.2	26%	0.259	34%	0.336	S	S	.	.			trans	-71.5	163.3	177.8	72.1	0	0	0	0	111.7	Q125 A129 T130 K131 E235	Q125-S127 PolarHBondContact O-N 3.03Å; S127-A129 PolarHBondContact O-N 3.24Å; S127-T130 PolarHBondContact O-N 2.91Å; S127-T130 WeakPolarHBondContact OG-CB 3.38Å; S127-T130 PolarHBondContact OG-N 3.49Å; S127-T130 PolarHBondContact OG-OG1 2.91Å; S127-K131 VanDerWaalsContact O-CB 3.28Å; S127-K131 WeakPolarHBondContact O-CB 3.13Å; S127-K131 PolarHBondContact O-N 3.47Å; S127-E235 WeakPolarHBondContact CB-OE2 3.18Å; S127-E235 PolarHBondContact OG-OE2 3.13Å
128	E	98.2	Very high	97.9	Very high	114 Å²	114	69 Å²	69	53%	0.533	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-41.9	-177.2	-68.6	-60.5	130.9	0	0	111.9	T130 K131 H132 E235	E128-T130 VanDerWaalsContact C-N 3.35Å; E128-T130 PolarHBondContact O-N 3.39Å; E128-K131 PolarHBondContact O-N 3.34Å; E128-H132 PolarHBondContact O-N 2.85Å; E128-H132 VanDerWaalsContact O-N 3.08Å; E128-E235 PolarHBondContact N-OE1 3.37Å
129	A	98.4	Very high	98.1	Very high	11 Å²	11	63.3 Å²	63.3	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-41.3	175.8	0	0	0	0	0	112.1	S127 Y133 Q231 V232 E235	S127-A129 PolarHBondContact O-N 3.24Å; A129-Y133 PolarHBondContact O-N 3.23Å; A129-Q231 HydrophobicContact CB-CB 4.36Å; A129-V232 HydrophobicContact CB-CG2 4.03Å; A129-E235 HydrophobicContact CB-CB 4.1Å; A129-E235 HydrophobicContact CB-CG 4.48Å; A129-E235 WeakPolarHBondContact CB-OE2 3.45Å; A129-E235 PolarHBondContact N-OE1 2.6Å
130	T	98.8	Very high	98.2	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.9	-41.3	177.2	-54.9	0	0	0	0	111.1	A72 F75 C126 S127 E128 H132 Y133 V134	A72-T130 HydrophobicContact CB-CG2 4.17Å; A72-T130 VanDerWaalsContact CB-OG1 3.3Å; A72-T130 WeakPolarHBondContact CB-OG1 3.31Å; A72-T130 WeakPolarHBondContact O-CG2 3.33Å; F75-T130 HydrophobicContact CB-CG2 3.88Å; C126-T130 VanDerWaalsContact SG-CG2 3.59Å; S127-T130 PolarHBondContact O-N 2.91Å; S127-T130 WeakPolarHBondContact OG-CB 3.38Å; S127-T130 PolarHBondContact OG-N 3.49Å; S127-T130 PolarHBondContact OG-OG1 2.91Å; E128-T130 VanDerWaalsContact C-N 3.35Å; E128-T130 PolarHBondContact O-N 3.39Å; T130-H132 PolarHBondContact O-N 2.91Å; T130-Y133 WeakPolarHBondContact O-CB 3.19Å; T130-Y133 PolarHBondContact O-N 3Å; T130-V134 HydrophobicContact CG2-CG2 4.31Å; T130-V134 WeakPolarHBondContact O-CG2 3.42Å; T130-V134 PolarHBondContact O-N 3.42Å
131	K	98.8	Very high	98.2	Very high	94 Å²	94	59.8 Å²	59.8	41%	0.409	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-44.6	179.1	-175.2	180	178	-175.5	0	111.8	S127 E128 Y133 V134 D135	S127-K131 VanDerWaalsContact O-CB 3.28Å; S127-K131 WeakPolarHBondContact O-CB 3.13Å; S127-K131 PolarHBondContact O-N 3.47Å; E128-K131 PolarHBondContact O-N 3.34Å; K131-Y133 PolarHBondContact O-N 2.86Å; K131-V134 PolarHBondContact O-N 2.58Å; K131-D135 WeakPolarHBondContact O-CB 3.44Å; K131-D135 PolarHBondContact O-N 3.07Å
132	H	98.8	Very high	98.3	Very high	100 Å²	100	57.2 Å²	57.2	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-57.4	-36.9	173.8	-69.6	156.2	0	0	0	112.7	E128 T130 R136 F228	E128-H132 PolarHBondContact O-N 2.85Å; E128-H132 VanDerWaalsContact O-N 3.08Å; T130-H132 PolarHBondContact O-N 2.91Å; H132-R136 PolarHBondContact O-N 3.48Å; H132-F228 HydrophobicContact CB-CD1 4.39Å; H132-F228 HydrophobicContact CB-CE1 4.09Å
133	Y	98.9	Very high	98.4	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-70.2	-47.6	177.6	-165.7	-168.8	0	0	0	111.7	T76 A129 T130 K131 D135 R136 I137 H151 A225 F228	T76-Y133 HydrophobicContact CG2-CD1 3.62Å; T76-Y133 HydrophobicContact CG2-CE1 3.47Å; T76-Y133 VanDerWaalsContact CG2-CE1 3.47Å; T76-Y133 HydrophobicContact CG2-CG 4.49Å; A129-Y133 PolarHBondContact O-N 3.23Å; T130-Y133 WeakPolarHBondContact O-CB 3.19Å; T130-Y133 PolarHBondContact O-N 3Å; K131-Y133 PolarHBondContact O-N 2.86Å; Y133-D135 VanDerWaalsContact C-N 3.32Å; Y133-D135 PolarHBondContact O-N 3.37Å; Y133-R136 PolarHBondContact O-N 3.45Å; Y133-R136 VanDerWaalsContact O-N 3.17Å; Y133-I137 HydrophobicContact CD2-CD1 3.87Å; Y133-I137 HydrophobicContact CD2-CG1 4.01Å; Y133-I137 HydrophobicContact CE1-CD1 4.43Å; Y133-I137 HydrophobicContact CE2-CD1 3.79Å; Y133-I137 HydrophobicContact CE2-CG1 3.88Å; Y133-I137 HydrophobicContact CG-CD1 4.23Å; Y133-I137 WeakPolarHBondContact O-CG1 3.43Å; Y133-I137 PolarHBondContact O-N 3.11Å; Y133-H151 AromaticContact CE2-CE1 3.78Å; Y133-H151 AromaticContact CE2-ND1 3.45Å; Y133-H151 WeakPolarHBondContact CE2-ND1 3.46Å; Y133-H151 AromaticContact CZ-ND1 3.99Å; Y133-A225 HydrophobicContact CE2-CB 4.4Å; Y133-F228 HydrophobicContact CD1-CB 3.87Å; Y133-F228 HydrophobicContact CD2-CB 3.5Å; Y133-F228 HydrophobicContact CD2-CD1 4.42Å; Y133-F228 AromaticContact CD2-CD2 3.58Å; Y133-F228 HydrophobicContact CD2-CD2 3.58Å; Y133-F228 HydrophobicContact CD2-CE2 4.42Å; Y133-F228 AromaticContact CD2-CG 3.59Å; Y133-F228 HydrophobicContact CD2-CG 3.59Å; Y133-F228 HydrophobicContact CE1-CB 4.32Å; Y133-F228 HydrophobicContact CE2-CB 3.98Å; Y133-F228 AromaticContact CE2-CD2 3.96Å; Y133-F228 HydrophobicContact CE2-CD2 3.96Å; Y133-F228 HydrophobicContact CE2-CG 4.25Å; Y133-F228 HydrophobicContact CG-CB 3.45Å; Y133-F228 VanDerWaalsContact CG-CB 3.45Å; Y133-F228 HydrophobicContact CG-CD2 4.35Å; Y133-F228 AromaticContact CG-CG 3.89Å; Y133-F228 HydrophobicContact CG-CG 3.89Å
134	V	98.9	Very high	98.5	Very high	19 Å²	19	52 Å²	52	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-55	-46.8	175.1	165	0	0	0	0	111.2	F75 A79 T130 K131 R136 I137 H138	F75-V134 HydrophobicContact CB-CG2 4.1Å; A79-V134 HydrophobicContact CB-CB 4.3Å; A79-V134 HydrophobicContact CB-CG1 3.83Å; A79-V134 HydrophobicContact CB-CG2 4.15Å; T130-V134 HydrophobicContact CG2-CG2 4.31Å; T130-V134 WeakPolarHBondContact O-CG2 3.42Å; T130-V134 PolarHBondContact O-N 3.42Å; K131-V134 PolarHBondContact O-N 2.58Å; V134-R136 VanDerWaalsContact C-N 3.32Å; V134-R136 PolarHBondContact O-N 3.34Å; V134-I137 PolarHBondContact O-N 3.41Å; V134-H138 PolarHBondContact O-CD2 3Å; V134-H138 VanDerWaalsContact O-CD2 3.29Å; V134-H138 PolarHBondContact O-N 3.25Å
135	D	98.9	Very high	98.5	Very high	83 Å²	83	52.4 Å²	52.4	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-41.1	179.1	-70.3	-16.5	0	0	0	111.3	K131 Y133 H139	K131-D135 WeakPolarHBondContact O-CB 3.44Å; K131-D135 PolarHBondContact O-N 3.07Å; Y133-D135 VanDerWaalsContact C-N 3.32Å; Y133-D135 PolarHBondContact O-N 3.37Å; D135-H139 WeakPolarHBondContact O-CB 3.28Å; D135-H139 PolarHBondContact O-N 2.66Å
136	R	98.9	Very high	98.6	Very high	25 Å²	25	46.3 Å²	46.3	9%	0.094	23%	0.23	C	C	.	.	H	α-helix	trans	-67.1	-40.9	175.7	-179.1	58.3	178.1	164.2	11.5	112	H132 Y133 V134 H139 V140 E144 E221 R224 F228	H132-R136 PolarHBondContact O-N 3.48Å; Y133-R136 PolarHBondContact O-N 3.45Å; Y133-R136 VanDerWaalsContact O-N 3.17Å; V134-R136 VanDerWaalsContact C-N 3.32Å; V134-R136 PolarHBondContact O-N 3.34Å; R136-H139 PolarHBondContact NH1-CD2 3.44Å; R136-H139 PolarHBondContact NH1-NE2 3.32Å; R136-H139 PolarHBondContact O-N 3.34Å; R136-V140 HydrophobicContact CG-CG2 4.32Å; R136-V140 VanDerWaalsContact CZ-CG2 3.49Å; R136-V140 WeakPolarHBondContact O-CG2 3.49Å; R136-V140 PolarHBondContact O-N 3.25Å; R136-E144 IonicContact CZ-OE2 3.33Å; R136-E144 IonicContact NH1-OE1 3.43Å; R136-E144 IonicContact NH1-OE2 3.75Å; R136-E144 IonicContact NH2-OE2 3.07Å; R136-E144 PolarHBondContact NH2-OE2 2.9Å; R136-E221 IonicContact CZ-OE1 3.76Å; R136-E221 IonicContact CZ-OE2 2.66Å; R136-E221 IonicContact NE-OE1 3.47Å; R136-E221 PolarHBondContact NE-OE1 3.03Å; R136-E221 IonicContact NE-OE2 3.58Å; R136-E221 IonicContact NH2-OE1 3.58Å; R136-E221 PolarHBondContact NH2-OE1 2.82Å; R136-E221 IonicContact NH2-OE2 3.78Å; R136-E221 PolarHBondContact NH2-OE2 2.91Å; R136-R224 VanDerWaalsContact CZ-NH1 3.3Å; R136-F228 HydrophobicContact CB-CE2 3.78Å; R136-F228 HydrophobicContact CB-CZ 3.77Å; R136-F228 HydrophobicContact CG-CE2 3.74Å; R136-F228 HydrophobicContact CG-CZ 4.09Å
137	I	98.9	Very high	98.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-48.6	177.5	-71.3	165.7	0	0	0	110.1	T76 A79 L80 E83 Y133 V134 H139 V140 G141	T76-I137 HydrophobicContact CG2-CD1 3.88Å; A79-I137 HydrophobicContact CB-CB 4.41Å; A79-I137 HydrophobicContact CB-CG2 4.03Å; L80-I137 HydrophobicContact CB-CD1 4.41Å; L80-I137 HydrophobicContact CB-CG2 4.23Å; L80-I137 HydrophobicContact CD1-CG2 4.38Å; E83-I137 HydrophobicContact CB-CG2 4.47Å; E83-I137 HydrophobicContact CG-CG2 4.19Å; Y133-I137 HydrophobicContact CD2-CD1 3.87Å; Y133-I137 HydrophobicContact CD2-CG1 4.01Å; Y133-I137 HydrophobicContact CE1-CD1 4.43Å; Y133-I137 HydrophobicContact CE2-CD1 3.79Å; Y133-I137 HydrophobicContact CE2-CG1 3.88Å; Y133-I137 HydrophobicContact CG-CD1 4.23Å; Y133-I137 WeakPolarHBondContact O-CG1 3.43Å; Y133-I137 PolarHBondContact O-N 3.11Å; V134-I137 PolarHBondContact O-N 3.41Å; I137-H139 PolarHBondContact O-N 2.87Å; I137-V140 PolarHBondContact O-N 3.06Å; I137-G141 PolarHBondContact O-N 2.98Å
138	H	98.9	Very high	98.7	Very high	44 Å²	44	42.8 Å²	42.8	20%	0.204	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-44.3	175.4	-75.5	-55.7	0	0	0	112.3	E82 E83 V134 V140 G141 Q142	E82-H138 IonicContact OE2-CE1 3.57Å; E83-H138 IonicContact OE1-CE1 3.89Å; E83-H138 IonicContact OE1-CG 2.73Å; E83-H138 IonicContact OE1-ND1 3.59Å; E83-H138 PolarHBondContact OE1-ND1 3.15Å; V134-H138 PolarHBondContact O-CD2 3Å; V134-H138 VanDerWaalsContact O-CD2 3.29Å; V134-H138 PolarHBondContact O-N 3.25Å; H138-V140 VanDerWaalsContact C-N 3.35Å; H138-V140 PolarHBondContact O-N 3.49Å; H138-G141 PolarHBondContact O-N 2.84Å; H138-Q142 VanDerWaalsContact O-CB 3.29Å; H138-Q142 WeakPolarHBondContact O-CB 3.39Å; H138-Q142 WeakPolarHBondContact O-CG 2.97Å; H138-Q142 PolarHBondContact O-N 3.21Å
139	H	98.9	Very high	98.7	Very high	72 Å²	72	37.4 Å²	37.4	33%	0.333	18%	0.18	S	C	.	.	H	α-helix	trans	-57.2	-48.7	176	177.5	97.7	0	0	0	111.5	D135 R136 I137 Q142 H143 E144	D135-H139 WeakPolarHBondContact O-CB 3.28Å; D135-H139 PolarHBondContact O-N 2.66Å; R136-H139 PolarHBondContact NH1-CD2 3.44Å; R136-H139 PolarHBondContact NH1-NE2 3.32Å; R136-H139 PolarHBondContact O-N 3.34Å; I137-H139 PolarHBondContact O-N 2.87Å; H139-Q142 PolarHBondContact O-N 3.11Å; H139-H143 AromaticContact ND1-ND1 3.94Å; H139-H143 WeakPolarHBondContact O-CB 3.34Å; H139-H143 PolarHBondContact O-N 3.35Å; H139-H143 PolarHBondContact O-ND1 3.39Å; H139-E144 IonicContact CD2-OE1 3.82Å; H139-E144 IonicContact CE1-OE1 3.15Å; H139-E144 IonicContact NE2-OE1 2.87Å; H139-E144 PolarHBondContact NE2-OE1 3.3Å
140	V	98.9	Very high	98.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-50.4	179.9	165.2	0	0	0	0	110.9	R136 I137 H138 Q142 H143 E144 P145 L147 L148	R136-V140 HydrophobicContact CG-CG2 4.32Å; R136-V140 VanDerWaalsContact CZ-CG2 3.49Å; R136-V140 WeakPolarHBondContact O-CG2 3.49Å; R136-V140 PolarHBondContact O-N 3.25Å; I137-V140 PolarHBondContact O-N 3.06Å; H138-V140 VanDerWaalsContact C-N 3.35Å; H138-V140 PolarHBondContact O-N 3.49Å; V140-Q142 PolarHBondContact O-N 3.22Å; V140-H143 PolarHBondContact O-N 3.24Å; V140-E144 CarbonylContact O-C 2.99Å; V140-E144 WeakPolarHBondContact O-CA 3.29Å; V140-E144 PolarHBondContact O-N 2.92Å; V140-P145 VanDerWaalsContact O-N 3.17Å; V140-L147 HydrophobicContact CG1-CB 3.93Å; V140-L148 HydrophobicContact CG1-CB 4.14Å; V140-L148 HydrophobicContact CG1-CD1 4.4Å
141	G	98.8	Very high	98.8	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-60.7	-31.9	179.9	0	0	0	0	0	114.2	E83 N87 I137 H138	E83-G141 VanDerWaalsContact OE2-C 3.24Å; E83-G141 VanDerWaalsContact OE2-CA 3.28Å; E83-G141 WeakPolarHBondContact OE2-CA 3.2Å; N87-G141 PolarHBondContact ND2-O 2.98Å; I137-G141 PolarHBondContact O-N 2.98Å; H138-G141 PolarHBondContact O-N 2.84Å
142	Q	98.8	Very high	98.8	Very high	94 Å²	94	32.4 Å²	32.4	44%	0.439	16%	0.157	S	C	.	.	H	α-helix	trans	-90.9	-30.4	-176.6	-67.1	166.8	25.1	0	0	113.8	E83 H138 H139 V140	E83-Q142 PolarHBondContact OE1-NE2 2.87Å; E83-Q142 VanDerWaalsContact OE1-NE2 3.12Å; H138-Q142 VanDerWaalsContact O-CB 3.29Å; H138-Q142 WeakPolarHBondContact O-CB 3.39Å; H138-Q142 WeakPolarHBondContact O-CG 2.97Å; H138-Q142 PolarHBondContact O-N 3.21Å; H139-Q142 PolarHBondContact O-N 3.11Å; V140-Q142 PolarHBondContact O-N 3.22Å
143	H	98.7	Very high	98.7	Very high	122 Å²	122	28.7 Å²	28.7	57%	0.565	14%	0.139	S	C	*	.	H	α-helix	trans	-125.1	-24.5	-168.4	-52.1	90.2	0	0	0	114.4	H139 V140	H139-H143 AromaticContact ND1-ND1 3.94Å; H139-H143 WeakPolarHBondContact O-CB 3.34Å; H139-H143 PolarHBondContact O-N 3.35Å; H139-H143 PolarHBondContact O-ND1 3.39Å; V140-H143 PolarHBondContact O-N 3.24Å
144	E	98.6	Very high	98.7	Very high	48 Å²	48	29.3 Å²	29.3	22%	0.224	14%	0.142	C	C	.	.			trans	-136.6	53.3	-175.5	-64.2	166.2	-144.8	0	0	110.5	R136 H139 V140 E146 L147	R136-E144 IonicContact CZ-OE2 3.33Å; R136-E144 IonicContact NH1-OE1 3.43Å; R136-E144 IonicContact NH1-OE2 3.75Å; R136-E144 IonicContact NH2-OE2 3.07Å; R136-E144 PolarHBondContact NH2-OE2 2.9Å; H139-E144 IonicContact CD2-OE1 3.82Å; H139-E144 IonicContact CE1-OE1 3.15Å; H139-E144 IonicContact NE2-OE1 2.87Å; H139-E144 PolarHBondContact NE2-OE1 3.3Å; V140-E144 CarbonylContact O-C 2.99Å; V140-E144 WeakPolarHBondContact O-CA 3.29Å; V140-E144 PolarHBondContact O-N 2.92Å; E144-E146 PolarHBondContact O-N 3.24Å; E144-L147 HydrophobicContact CB-CD1 4.05Å; E144-L147 HydrophobicContact CB-CG 4.18Å; E144-L147 WeakPolarHBondContact O-CB 3.48Å; E144-L147 PolarHBondContact O-N 3.25Å; E144-L147 WeakPolarHBondContact OE2-CD1 3.46Å
145	P	98.4	Very high	98.6	Very high	25 Å²	25	29.7 Å²	29.7	16%	0.162	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-62.7	-21.7	-167.4	27.3	-36.9	0	0	0	113.9	N87 N90 V92 V140 L147 L148	N87-P145 VanDerWaalsContact OD1-CB 3.22Å; N87-P145 WeakPolarHBondContact OD1-CB 3.42Å; N90-P145 WeakPolarHBondContact ND2-CG 3.32Å; V92-P145 HydrophobicContact CG2-CB 4.26Å; V92-P145 HydrophobicContact CG2-CG 4.46Å; V140-P145 VanDerWaalsContact O-N 3.17Å; P145-L147 PolarHBondContact O-N 3.48Å; P145-L148 VanDerWaalsContact O-CB 3.25Å; P145-L148 WeakPolarHBondContact O-CB 3.46Å; P145-L148 PolarHBondContact O-N 2.92Å; P145-L148 VanDerWaalsContact O-N 3.11Å
146	E	98.2	Very high	98.6	Very high	41 Å²	41	25.7 Å²	25.7	19%	0.192	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-62.8	-19.8	172.1	72.4	-82.1	-166.9	0	0	113.2	V92 E144 V149 T214 R217 I218	V92-E146 HydrophobicContact CB-CB 4.28Å; V92-E146 HydrophobicContact CG2-CB 4.25Å; E144-E146 PolarHBondContact O-N 3.24Å; E146-V149 WeakPolarHBondContact O-CG1 3.31Å; E146-T214 HydrophobicContact CB-CG2 4.17Å; E146-T214 HydrophobicContact CG-CG2 3.85Å; E146-R217 IonicContact OE1-CZ 3.73Å; E146-R217 VanDerWaalsContact OE1-CZ 3.26Å; E146-R217 IonicContact OE1-NH1 3.65Å; E146-R217 PolarHBondContact OE1-NH1 3.35Å; E146-R217 IonicContact OE1-NH2 2.93Å; E146-R217 PolarHBondContact OE1-NH2 2.64Å; E146-I218 WeakPolarHBondContact O-CD1 3.45Å; E146-I218 WeakPolarHBondContact O-CG1 3.25Å
147	L	98.9	Very high	98.4	Very high	4 Å²	4	25 Å²	25	2%	0.021	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-91.6	-8.4	176.5	-51.8	-173.8	0	0	0	113.1	V140 E144 P145 V149 A150 R217 I218 E221	V140-L147 HydrophobicContact CG1-CB 3.93Å; E144-L147 HydrophobicContact CB-CD1 4.05Å; E144-L147 HydrophobicContact CB-CG 4.18Å; E144-L147 WeakPolarHBondContact O-CB 3.48Å; E144-L147 PolarHBondContact O-N 3.25Å; E144-L147 WeakPolarHBondContact OE2-CD1 3.46Å; P145-L147 PolarHBondContact O-N 3.48Å; L147-V149 PolarHBondContact O-N 3.28Å; L147-A150 WeakPolarHBondContact O-CB 3.44Å; L147-A150 PolarHBondContact O-N 3.05Å; L147-R217 HydrophobicContact CD2-CB 3.76Å; L147-I218 HydrophobicContact CD2-CG1 3.81Å; L147-E221 HydrophobicContact CB-CB 4.35Å; L147-E221 HydrophobicContact CB-CG 4.13Å; L147-E221 HydrophobicContact CD1-CB 4.35Å; L147-E221 HydrophobicContact CD1-CG 4.36Å
148	L	98.8	Very high	98.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-31.6	-177.8	-173.7	61.2	0	0	0	112.3	L80 E83 M84 N87 F93 V140 P145 A150 H151 A152	L80-L148 HydrophobicContact CD1-CD1 3.94Å; E83-L148 HydrophobicContact CB-CD1 4.2Å; M84-L148 HydrophobicContact CG-CD2 4.25Å; N87-L148 HydrophobicContact CB-CD2 4.09Å; F93-L148 HydrophobicContact CD1-CD2 4.23Å; F93-L148 HydrophobicContact CD2-CB 4.03Å; F93-L148 HydrophobicContact CD2-CD2 3.93Å; F93-L148 HydrophobicContact CD2-CG 4Å; F93-L148 HydrophobicContact CE1-CD2 4.33Å; F93-L148 HydrophobicContact CE2-CB 4.33Å; F93-L148 HydrophobicContact CE2-CD2 4.03Å; F93-L148 HydrophobicContact CE2-CG 3.9Å; F93-L148 HydrophobicContact CG-CD2 4.05Å; F93-L148 HydrophobicContact CZ-CD2 4.25Å; F93-L148 HydrophobicContact CZ-CG 4.45Å; V140-L148 HydrophobicContact CG1-CB 4.14Å; V140-L148 HydrophobicContact CG1-CD1 4.4Å; P145-L148 VanDerWaalsContact O-CB 3.25Å; P145-L148 WeakPolarHBondContact O-CB 3.46Å; P145-L148 PolarHBondContact O-N 2.92Å; P145-L148 VanDerWaalsContact O-N 3.11Å; L148-A150 PolarHBondContact O-N 3.4Å; L148-H151 PolarHBondContact O-N 2.9Å; L148-A152 PolarHBondContact O-N 3.47Å; L148-A152 VanDerWaalsContact O-N 3.15Å
149	V	98.6	Very high	97.9	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-55.5	-33.2	173.3	57.2	0	0	0	0	112.6	L32 L96 E146 L147 H151 Y153 M205 I218	L32-V149 HydrophobicContact CD2-CG2 4.39Å; L96-V149 HydrophobicContact CD1-CB 3.76Å; L96-V149 HydrophobicContact CD1-CG2 3.31Å; E146-V149 WeakPolarHBondContact O-CG1 3.31Å; L147-V149 PolarHBondContact O-N 3.28Å; V149-H151 PolarHBondContact O-N 2.49Å; V149-Y153 WeakPolarHBondContact O-CB 3.4Å; V149-Y153 PolarHBondContact O-N 3.18Å; V149-M205 HydrophobicContact CG2-CG 4.09Å; V149-M205 HydrophobicContact CG2-SD 3.92Å; V149-I218 HydrophobicContact CG1-CD1 3.74Å; V149-I218 HydrophobicContact CG1-CG1 3.93Å; V149-I218 HydrophobicContact CG1-CG2 3.79Å
150	A	98.8	Very high	97.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.1	-46.7	178	0	0	0	0	0	111.7	L147 L148 T154 I218 E221 A222	L147-A150 WeakPolarHBondContact O-CB 3.44Å; L147-A150 PolarHBondContact O-N 3.05Å; L148-A150 PolarHBondContact O-N 3.4Å; A150-T154 WeakPolarHBondContact O-CB 3.42Å; A150-T154 PolarHBondContact O-N 3.35Å; A150-T154 PolarHBondContact O-OG1 3.39Å; A150-T154 VanDerWaalsContact O-OG1 3.09Å; A150-I218 HydrophobicContact CB-CG2 4.2Å; A150-I218 WeakPolarHBondContact CB-O 3.41Å; A150-E221 HydrophobicContact CB-CB 3.8Å; A150-E221 HydrophobicContact CB-CG 4Å; A150-A222 HydrophobicContact CB-CB 4Å
151	H	98.9	Very high	97	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.6	-44.9	179.8	-67	-67.5	0	0	0	112.1	L80 Y133 L148 V149 Y153 T154 R155 E221	L80-H151 HydrophobicContact CD1-CB 3.81Å; Y133-H151 AromaticContact CE2-CE1 3.78Å; Y133-H151 AromaticContact CE2-ND1 3.45Å; Y133-H151 WeakPolarHBondContact CE2-ND1 3.46Å; Y133-H151 AromaticContact CZ-ND1 3.99Å; L148-H151 PolarHBondContact O-N 2.9Å; V149-H151 PolarHBondContact O-N 2.49Å; H151-Y153 VanDerWaalsContact C-N 3.35Å; H151-Y153 PolarHBondContact O-N 2.93Å; H151-T154 PolarHBondContact O-N 2.71Å; H151-R155 WeakPolarHBondContact O-CB 3.42Å; H151-R155 PolarHBondContact O-N 2.83Å; H151-R155 VanDerWaalsContact O-N 3.09Å; H151-E221 IonicContact CE1-OE1 3.53Å; H151-E221 IonicContact NE2-OE1 3.9Å; H151-E221 PolarHBondContact NE2-OE1 2.88Å
152	A	98.7	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-44	176.5	0	0	0	0	0	111.5	F93 L148 Y156 Y201	F93-A152 HydrophobicContact CE2-CB 4.19Å; F93-A152 HydrophobicContact CZ-CB 4.43Å; L148-A152 PolarHBondContact O-N 3.47Å; L148-A152 VanDerWaalsContact O-N 3.15Å; A152-Y156 HydrophobicContact CB-CD2 4.01Å; A152-Y156 HydrophobicContact CB-CE2 4.16Å; A152-Y156 WeakPolarHBondContact O-CB 3.29Å; A152-Y156 VanDerWaalsContact O-CD2 3.23Å; A152-Y156 WeakPolarHBondContact O-CD2 3.13Å; A152-Y156 PolarHBondContact O-N 3.48Å; A152-Y201 WeakPolarHBondContact CB-OH 3.47Å
153	Y	98.3	Very high	95.3	Very high	22 Å²	22	20.8 Å²	20.8	9%	0.086	12%	0.119	C	C	.	.	I	π-helix	trans	-59.2	-55.8	175.2	170.9	-97.9	0	0	0	111.7	L36 V149 H151 R155 M157 M205	L36-Y153 HydrophobicContact CB-CD1 4.23Å; L36-Y153 HydrophobicContact CB-CE1 3.8Å; L36-Y153 HydrophobicContact CB-CE2 4.3Å; L36-Y153 HydrophobicContact CD1-CD1 4.04Å; L36-Y153 HydrophobicContact CD1-CD2 4.06Å; L36-Y153 HydrophobicContact CD1-CE1 4.43Å; L36-Y153 HydrophobicContact CD1-CE2 4.44Å; L36-Y153 HydrophobicContact CD1-CG 3.85Å; L36-Y153 HydrophobicContact CD2-CD1 4Å; L36-Y153 HydrophobicContact CD2-CE1 4.24Å; L36-Y153 HydrophobicContact CG-CD1 4.34Å; L36-Y153 HydrophobicContact CG-CE1 4.4Å; V149-Y153 WeakPolarHBondContact O-CB 3.4Å; V149-Y153 PolarHBondContact O-N 3.18Å; H151-Y153 VanDerWaalsContact C-N 3.35Å; H151-Y153 PolarHBondContact O-N 2.93Å; Y153-R155 VanDerWaalsContact C-N 3.25Å; Y153-R155 PolarHBondContact O-N 2.85Å; Y153-M157 HydrophobicContact CD2-CB 4.28Å; Y153-M157 HydrophobicContact CD2-CG 3.57Å; Y153-M157 HydrophobicContact CE2-CB 4.29Å; Y153-M157 HydrophobicContact CE2-CG 3.88Å; Y153-M157 HydrophobicContact CG-CG 4.35Å; Y153-M157 VanDerWaalsContact O-CB 3.25Å; Y153-M157 WeakPolarHBondContact O-CB 3.49Å; Y153-M157 WeakPolarHBondContact O-CG 3.35Å; Y153-M157 PolarHBondContact O-N 2.73Å; Y153-M157 VanDerWaalsContact O-N 3.12Å; Y153-M205 HydrophobicContact CD2-CE 3.66Å; Y153-M205 HydrophobicContact CD2-SD 3.78Å; Y153-M205 HydrophobicContact CE2-CE 3.98Å; Y153-M205 HydrophobicContact CG-SD 4.39Å
154	T	97.5	Very high	94.6	Very high	14 Å²	14	19.2 Å²	19.2	9%	0.086	11%	0.112	C	C	.	.	I	π-helix	trans	-58	-37.8	-176.4	-66.9	0	0	0	0	112.2	A150 H151 A225 F226	A150-T154 WeakPolarHBondContact O-CB 3.42Å; A150-T154 PolarHBondContact O-N 3.35Å; A150-T154 PolarHBondContact O-OG1 3.39Å; A150-T154 VanDerWaalsContact O-OG1 3.09Å; H151-T154 PolarHBondContact O-N 2.71Å; T154-A225 HydrophobicContact CG2-CB 3.95Å; T154-F226 HydrophobicContact CG2-CD1 4.31Å; T154-F226 HydrophobicContact CG2-CD2 3.93Å; T154-F226 HydrophobicContact CG2-CE1 4.26Å; T154-F226 HydrophobicContact CG2-CE2 3.85Å; T154-F226 HydrophobicContact CG2-CG 4.14Å; T154-F226 HydrophobicContact CG2-CZ 4.03Å
155	R	97.8	Very high	94.2	Very high	26 Å²	26	18.8 Å²	18.8	10%	0.098	11%	0.112	C	C	.	.	I	π-helix	trans	-80.5	-66	179.7	-70.4	-53.5	-49.4	175.4	13.9	112.1	Y77 L80 H151 Y153 M157 G158 D159 N229	Y77-R155 HydrophobicContact CE1-CB 4.35Å; Y77-R155 VanDerWaalsContact OH-CZ 3.28Å; Y77-R155 PolarHBondContact OH-NE 3.03Å; Y77-R155 PolarHBondContact OH-NH2 3.27Å; L80-R155 HydrophobicContact CD2-CB 4.24Å; L80-R155 HydrophobicContact CD2-CG 4.27Å; H151-R155 WeakPolarHBondContact O-CB 3.42Å; H151-R155 PolarHBondContact O-N 2.83Å; H151-R155 VanDerWaalsContact O-N 3.09Å; Y153-R155 VanDerWaalsContact C-N 3.25Å; Y153-R155 PolarHBondContact O-N 2.85Å; R155-M157 PolarHBondContact O-N 3.34Å; R155-G158 PolarHBondContact O-N 3.35Å; R155-D159 IonicContact NH2-OD1 3.8Å; R155-D159 PolarHBondContact NH2-OD1 3.42Å; R155-D159 PolarHBondContact O-N 3.38Å; R155-N229 PolarHBondContact NH1-OD1 3.09Å
156	Y	98.3	Very high	93.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	I	π-helix	trans	-67.4	-36.8	-169.5	-63.6	-58.6	0	0	0	113.7	Y77 L80 E81 M84 L102 R104 A152 G158 D159 L160	Y77-Y156 AromaticContact CD1-CE1 3.91Å; Y77-Y156 HydrophobicContact CD1-CE1 3.91Å; Y77-Y156 AromaticContact CE1-CD1 3.96Å; Y77-Y156 HydrophobicContact CE1-CD1 3.96Å; Y77-Y156 AromaticContact CE1-CE1 3.51Å; Y77-Y156 HydrophobicContact CE1-CE1 3.51Å; L80-Y156 HydrophobicContact CD2-CE2 4.03Å; E81-Y156 WeakPolarHBondContact CG-OH 3.4Å; M84-Y156 HydrophobicContact CE-CE2 3.81Å; M84-Y156 HydrophobicContact SD-CE2 3.61Å; M84-Y156 PolarHBondContact SD-OH 2.68Å; L102-Y156 HydrophobicContact CB-CD1 3.89Å; L102-Y156 HydrophobicContact CB-CD2 4.43Å; L102-Y156 HydrophobicContact CB-CE1 3.91Å; L102-Y156 HydrophobicContact CB-CE2 4.47Å; L102-Y156 HydrophobicContact CB-CG 4.15Å; L102-Y156 HydrophobicContact CD1-CD2 4.03Å; L102-Y156 HydrophobicContact CD1-CG 4.01Å; L102-Y156 HydrophobicContact CD2-CD1 4.29Å; L102-Y156 HydrophobicContact CD2-CG 4.26Å; L102-Y156 HydrophobicContact CG-CD1 4.49Å; L102-Y156 HydrophobicContact CG-CG 4.39Å; L102-Y156 WeakPolarHBondContact O-CE1 3.41Å; R104-Y156 HydrophobicContact CG-CE1 4.19Å; A152-Y156 HydrophobicContact CB-CD2 4.01Å; A152-Y156 HydrophobicContact CB-CE2 4.16Å; A152-Y156 WeakPolarHBondContact O-CB 3.29Å; A152-Y156 VanDerWaalsContact O-CD2 3.23Å; A152-Y156 WeakPolarHBondContact O-CD2 3.13Å; A152-Y156 PolarHBondContact O-N 3.48Å; Y156-G158 VanDerWaalsContact C-N 3.29Å; Y156-G158 PolarHBondContact O-N 2.84Å; Y156-D159 PolarHBondContact O-N 2.84Å; Y156-L160 WeakPolarHBondContact O-CG 3.36Å; Y156-L160 PolarHBondContact O-N 2.76Å
157	M	94.9	Very high	93.6	Very high	9 Å²	9	19.9 Å²	19.9	4%	0.044	11%	0.114	C	C	.	.	I	π-helix	trans	-70.1	-31.4	177.9	-60.8	-61.2	99	0	0	111.7	Y153 R155 L160 S161 K198 Y201	Y153-M157 HydrophobicContact CD2-CB 4.28Å; Y153-M157 HydrophobicContact CD2-CG 3.57Å; Y153-M157 HydrophobicContact CE2-CB 4.29Å; Y153-M157 HydrophobicContact CE2-CG 3.88Å; Y153-M157 HydrophobicContact CG-CG 4.35Å; Y153-M157 VanDerWaalsContact O-CB 3.25Å; Y153-M157 WeakPolarHBondContact O-CB 3.49Å; Y153-M157 WeakPolarHBondContact O-CG 3.35Å; Y153-M157 PolarHBondContact O-N 2.73Å; Y153-M157 VanDerWaalsContact O-N 3.12Å; R155-M157 PolarHBondContact O-N 3.34Å; M157-L160 HydrophobicContact CE-CD1 3.92Å; M157-S161 WeakPolarHBondContact O-CB 3.43Å; M157-S161 PolarHBondContact O-N 3.43Å; M157-S161 PolarHBondContact O-OG 2.73Å; M157-K198 HydrophobicContact SD-CB 4.37Å; M157-K198 HydrophobicContact SD-CG 3.98Å; M157-Y201 HydrophobicContact CE-CD1 3.57Å; M157-Y201 HydrophobicContact CE-CD2 3.91Å; M157-Y201 HydrophobicContact CE-CE1 4.02Å; M157-Y201 HydrophobicContact CE-CE2 4.33Å; M157-Y201 HydrophobicContact CE-CG 3.5Å; M157-Y201 HydrophobicContact CG-CD1 4.34Å; M157-Y201 HydrophobicContact SD-CD1 3.71Å; M157-Y201 HydrophobicContact SD-CE1 4.41Å; M157-Y201 HydrophobicContact SD-CG 4.02Å
158	G	92.1	Very high	93.3	Very high	40 Å²	40	26.7 Å²	26.7	41%	0.412	14%	0.144	S	C	.	.	H	α-helix	trans	-64.8	-48.4	170.5	0	0	0	0	0	111.6	R155 Y156 L160 S161 G162	R155-G158 PolarHBondContact O-N 3.35Å; Y156-G158 VanDerWaalsContact C-N 3.29Å; Y156-G158 PolarHBondContact O-N 2.84Å; G158-L160 VanDerWaalsContact C-N 3.32Å; G158-L160 PolarHBondContact O-N 3.1Å; G158-S161 PolarHBondContact O-N 3.08Å; G158-S161 VanDerWaalsContact O-N 3.07Å; G158-G162 PolarHBondContact O-N 3.25Å
159	D	95.5	Very high	93.1	Very high	14 Å²	14	27.3 Å²	27.3	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-41.6	179.8	-56.1	-34.8	0	0	0	112.2	Y77 R155 Y156 S161 G163 F185 F188	Y77-D159 PolarHBondContact OH-OD1 3.29Å; Y77-D159 VanDerWaalsContact OH-OD1 3.05Å; Y77-D159 PolarHBondContact OH-OD2 3.42Å; R155-D159 IonicContact NH2-OD1 3.8Å; R155-D159 PolarHBondContact NH2-OD1 3.42Å; R155-D159 PolarHBondContact O-N 3.38Å; Y156-D159 PolarHBondContact O-N 2.84Å; D159-S161 VanDerWaalsContact C-N 3.26Å; D159-S161 PolarHBondContact O-N 2.99Å; D159-G163 WeakPolarHBondContact O-CA 3.47Å; D159-G163 PolarHBondContact O-N 3.45Å; D159-F185 WeakPolarHBondContact OD1-CZ 3.35Å; D159-F188 HydrophobicContact CB-CE2 4.04Å; D159-F188 HydrophobicContact CB-CZ 3.62Å
160	L	94.1	Very high	92.9	Very high	16 Å²	16	27.3 Å²	27.3	8%	0.084	15%	0.148	C	C	.	.	H	α-helix	trans	-72.7	-15.8	178.7	-69.2	178.1	0	0	0	114	L102 Y156 M157 G158 F188 I191 A194 F197 K198	L102-L160 HydrophobicContact CD2-CD1 4.01Å; Y156-L160 WeakPolarHBondContact O-CG 3.36Å; Y156-L160 PolarHBondContact O-N 2.76Å; M157-L160 HydrophobicContact CE-CD1 3.92Å; G158-L160 VanDerWaalsContact C-N 3.32Å; G158-L160 PolarHBondContact O-N 3.1Å; L160-F188 HydrophobicContact CD2-CD1 3.81Å; L160-F188 HydrophobicContact CD2-CD2 3.97Å; L160-F188 HydrophobicContact CD2-CE1 3.92Å; L160-F188 HydrophobicContact CD2-CE2 4.07Å; L160-F188 HydrophobicContact CD2-CG 3.85Å; L160-F188 HydrophobicContact CD2-CZ 4.06Å; L160-F188 HydrophobicContact CG-CE1 4.47Å; L160-F188 HydrophobicContact CG-CZ 4.5Å; L160-I191 HydrophobicContact CD1-CD1 4.34Å; L160-I191 HydrophobicContact CD2-CD1 3.8Å; L160-A194 HydrophobicContact CD2-CB 4.43Å; L160-F197 HydrophobicContact CD1-CD1 3.71Å; L160-F197 HydrophobicContact CD1-CE1 4.33Å; L160-K198 HydrophobicContact CB-CD 4.03Å; L160-K198 HydrophobicContact CB-CG 3.98Å; L160-K198 HydrophobicContact CD1-CG 3.99Å
161	S	84.6	Confident	92.7	Very high	39 Å²	39	29.6 Å²	29.6	27%	0.273	16%	0.158	S	C	.	.	H	α-helix	trans	-96.7	-49.7	-179.1	-57.4	0	0	0	0	111.7	Y19 M157 G158 D159 K198	Y19-S161 VanDerWaalsContact CE1-O 3.27Å; Y19-S161 WeakPolarHBondContact CE1-O 3.43Å; M157-S161 WeakPolarHBondContact O-CB 3.43Å; M157-S161 PolarHBondContact O-N 3.43Å; M157-S161 PolarHBondContact O-OG 2.73Å; G158-S161 PolarHBondContact O-N 3.08Å; G158-S161 VanDerWaalsContact O-N 3.07Å; D159-S161 VanDerWaalsContact C-N 3.26Å; D159-S161 PolarHBondContact O-N 2.99Å; S161-K198 WeakPolarHBondContact OG-CD 3.4Å; S161-K198 PolarHBondContact OG-NZ 3.23Å
162	G	78.9	Confident	92.5	Very high	14 Å²	14	37.7 Å²	37.7	14%	0.144	19%	0.189	C	C	.	.	H	α-helix	trans	-102.6	-14.6	-176.8	0	0	0	0	0	115.1	G158 Q164 V165 L166	G158-G162 PolarHBondContact O-N 3.25Å; G162-Q164 VanDerWaalsContact C-N 3.3Å; G162-Q164 PolarHBondContact O-N 3.46Å; G162-V165 PolarHBondContact O-N 3.49Å; G162-L166 WeakPolarHBondContact O-CG 3.02Å; G162-L166 PolarHBondContact O-N 2.81Å
163	G	82.6	Confident	92.3	Very high	2 Å²	2	39 Å²	39	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-36.5	-168.4	0	0	0	0	0	114.2	D159 V165 L166 R167	D159-G163 WeakPolarHBondContact O-CA 3.47Å; D159-G163 PolarHBondContact O-N 3.45Å; G163-V165 PolarHBondContact O-N 3.19Å; G163-L166 PolarHBondContact O-N 2.96Å; G163-R167 WeakPolarHBondContact O-CB 3.25Å; G163-R167 PolarHBondContact O-N 3.24Å
164	Q	84.4	Confident	92.2	Very high	89 Å²	89	39.1 Å²	39.1	42%	0.416	20%	0.202	S	C	.	.	H	α-helix	trans	-68.8	-34.1	178.9	-62.7	-50.6	-47.2	0	0	113.1	G162 K168 Y186	G162-Q164 VanDerWaalsContact C-N 3.3Å; G162-Q164 PolarHBondContact O-N 3.46Å; Q164-K168 WeakPolarHBondContact O-CG 3.44Å; Q164-K168 PolarHBondContact O-N 3.08Å; Q164-Y186 PolarHBondContact NE2-O 3.46Å
165	V	89.3	Confident	92	Very high	39 Å²	39	46 Å²	46	24%	0.236	23%	0.231	C	C	.	.	H	α-helix	trans	-69.9	-49.5	174.2	176	0	0	0	0	109.2	Y19 L57 G162 G163 R167 K168 V169	Y19-V165 HydrophobicContact CE1-CG2 4.46Å; Y19-V165 WeakPolarHBondContact OH-CG2 3.4Å; L57-V165 HydrophobicContact CD2-CG1 4.12Å; G162-V165 PolarHBondContact O-N 3.49Å; G163-V165 PolarHBondContact O-N 3.19Å; V165-R167 VanDerWaalsContact C-N 3.27Å; V165-R167 PolarHBondContact O-N 3.26Å; V165-K168 PolarHBondContact O-N 3.31Å; V165-V169 HydrophobicContact CG1-CG2 4.36Å; V165-V169 WeakPolarHBondContact O-CG2 3.09Å; V165-V169 PolarHBondContact O-N 3.27Å
166	L	90.7	Very high	91.9	Very high	47 Å²	47	45.4 Å²	45.4	25%	0.246	23%	0.23	C	C	.	.	H	α-helix	trans	-58.7	-40.2	180	-62.8	175.5	0	0	0	112	F56 L57 G162 G163 V169 A170 Y186	F56-L166 HydrophobicContact CD1-CD2 3.47Å; F56-L166 VanDerWaalsContact CD1-CD2 3.47Å; F56-L166 HydrophobicContact CE1-CB 3.79Å; F56-L166 HydrophobicContact CE1-CD2 3.34Å; F56-L166 HydrophobicContact CE1-CG 4.13Å; F56-L166 HydrophobicContact CZ-CB 4.42Å; L57-L166 HydrophobicContact CD2-CD2 3.77Å; G162-L166 WeakPolarHBondContact O-CG 3.02Å; G162-L166 PolarHBondContact O-N 2.81Å; G163-L166 PolarHBondContact O-N 2.96Å; L166-V169 PolarHBondContact O-N 3.3Å; L166-A170 WeakPolarHBondContact O-CB 3.23Å; L166-A170 PolarHBondContact O-N 2.96Å; L166-Y186 HydrophobicContact CB-CD1 4.21Å; L166-Y186 HydrophobicContact CB-CE1 3.78Å; L166-Y186 HydrophobicContact CD1-CE1 4.19Å
167	R	93.2	Very high	91.6	Very high	41 Å²	41	47.3 Å²	47.3	16%	0.155	24%	0.242	C	C	.	.	H	α-helix	trans	-56.2	-52.5	174.4	-176.2	-175.8	153.3	-166.5	-10.2	112.5	G163 V165 V169 A170 Q171 E180 I183 Y186	G163-R167 WeakPolarHBondContact O-CB 3.25Å; G163-R167 PolarHBondContact O-N 3.24Å; V165-R167 VanDerWaalsContact C-N 3.27Å; V165-R167 PolarHBondContact O-N 3.26Å; R167-V169 VanDerWaalsContact C-N 3.3Å; R167-V169 PolarHBondContact O-N 2.96Å; R167-A170 PolarHBondContact O-N 3.04Å; R167-Q171 WeakPolarHBondContact O-CB 3.4Å; R167-Q171 PolarHBondContact O-N 3.41Å; R167-E180 IonicContact CZ-OE1 3.69Å; R167-E180 IonicContact NH2-OE1 2.61Å; R167-E180 PolarHBondContact NH2-OE1 3.01Å; R167-E180 IonicContact NH2-OE2 3.78Å; R167-I183 HydrophobicContact CG-CD1 3.92Å; R167-Y186 HydrophobicContact CB-CD2 4.38Å; R167-Y186 HydrophobicContact CB-CG 4.01Å
168	K	93.2	Very high	91.4	Very high	148 Å²	148	52 Å²	52	64%	0.643	28%	0.275	S	S	*	.	H	α-helix	trans	-62.9	-40.2	-179.8	-72.2	177.1	-178.6	177.9	0	111.4	Q164 V165 R172	Q164-K168 WeakPolarHBondContact O-CG 3.44Å; Q164-K168 PolarHBondContact O-N 3.08Å; V165-K168 PolarHBondContact O-N 3.31Å; K168-R172 WeakPolarHBondContact O-CB 3.16Å; K168-R172 PolarHBondContact O-N 3.3Å; K168-R172 VanDerWaalsContact O-N 3.09Å
169	V	94.4	Very high	91.4	Very high	13 Å²	13	54.2 Å²	54.2	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-48.1	178	173.1	0	0	0	0	110.8	F56 V165 L166 R167 Q171 R172 A173	F56-V169 HydrophobicContact CD1-CG1 4.28Å; F56-V169 HydrophobicContact CE1-CB 4.32Å; F56-V169 HydrophobicContact CE1-CG1 4.13Å; F56-V169 WeakPolarHBondContact O-CG1 3.34Å; V165-V169 HydrophobicContact CG1-CG2 4.36Å; V165-V169 WeakPolarHBondContact O-CG2 3.09Å; V165-V169 PolarHBondContact O-N 3.27Å; L166-V169 PolarHBondContact O-N 3.3Å; R167-V169 VanDerWaalsContact C-N 3.3Å; R167-V169 PolarHBondContact O-N 2.96Å; V169-Q171 PolarHBondContact O-N 3.42Å; V169-R172 PolarHBondContact O-N 2.91Å; V169-A173 WeakPolarHBondContact O-CB 3.44Å; V169-A173 PolarHBondContact O-N 3.38Å
170	A	94.7	Very high	91.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.3	-49.3	175.3	0	0	0	0	0	111.6	F56 F66 L166 R167 R172 A173 L174 I183	F56-A170 HydrophobicContact CE2-CB 4.5Å; F56-A170 HydrophobicContact CZ-CB 3.97Å; F66-A170 HydrophobicContact CE2-CB 3.87Å; F66-A170 HydrophobicContact CZ-CB 3.93Å; L166-A170 WeakPolarHBondContact O-CB 3.23Å; L166-A170 PolarHBondContact O-N 2.96Å; R167-A170 PolarHBondContact O-N 3.04Å; A170-R172 VanDerWaalsContact C-N 3.32Å; A170-R172 PolarHBondContact O-N 3.48Å; A170-A173 PolarHBondContact O-N 3.32Å; A170-L174 WeakPolarHBondContact O-CB 3.45Å; A170-L174 PolarHBondContact O-N 2.89Å; A170-I183 HydrophobicContact CB-CG2 3.97Å
171	Q	95.4	Very high	91.2	Very high	49 Å²	49	60.5 Å²	60.5	23%	0.229	31%	0.309	C	S	.	.	H	α-helix	trans	-57.7	-46.3	-178.4	-169.3	175	38.1	0	0	111.7	R167 V169 K175 L176 P177 I183	R167-Q171 WeakPolarHBondContact O-CB 3.4Å; R167-Q171 PolarHBondContact O-N 3.41Å; V169-Q171 PolarHBondContact O-N 3.42Å; Q171-K175 WeakPolarHBondContact O-CA 3.2Å; Q171-K175 PolarHBondContact O-N 3.42Å; Q171-L176 HydrophobicContact CG-CB 4.27Å; Q171-L176 PolarHBondContact O-N 3.32Å; Q171-P177 PolarHBondContact NE2-O 2.81Å; Q171-I183 HydrophobicContact CB-CD1 3.9Å; Q171-I183 HydrophobicContact CG-CD1 4.17Å
172	R	94.9	Very high	91.8	Very high	169 Å²	169	58.7 Å²	58.7	64%	0.638	30%	0.297	S	S	*	.	H	α-helix	trans	-67.9	-51.7	177.9	-178	-174.6	65.3	-179.3	-1.7	112.3	K168 V169 A170 L174 K175	K168-R172 WeakPolarHBondContact O-CB 3.16Å; K168-R172 PolarHBondContact O-N 3.3Å; K168-R172 VanDerWaalsContact O-N 3.09Å; V169-R172 PolarHBondContact O-N 2.91Å; A170-R172 VanDerWaalsContact C-N 3.32Å; A170-R172 PolarHBondContact O-N 3.48Å; R172-L174 VanDerWaalsContact C-N 3.34Å; R172-L174 PolarHBondContact O-N 2.76Å; R172-K175 PolarHBondContact O-N 3.02Å
173	A	94.7	Very high	92.6	Very high	29 Å²	29	58 Å²	58	24%	0.24	29%	0.29	C	S	.	.	H	α-helix	trans	-65.6	-37.5	-172.6	0	0	0	0	0	112.3	G59 I61 V169 A170	G59-A173 WeakPolarHBondContact O-CB 3.2Å; I61-A173 HydrophobicContact CG2-CB 4.07Å; V169-A173 WeakPolarHBondContact O-CB 3.44Å; V169-A173 PolarHBondContact O-N 3.38Å; A170-A173 PolarHBondContact O-N 3.32Å
174	L	94.3	Very high	93.4	Very high	24 Å²	24	59.3 Å²	59.3	13%	0.126	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	4	-176.2	-58.2	177.8	0	0	0	113.3	I61 K63 F66 A170 R172 L176	I61-L174 HydrophobicContact CG2-CD2 4.07Å; I61-L174 HydrophobicContact CG2-CG 4.33Å; K63-L174 HydrophobicContact CB-CD2 4.02Å; F66-L174 HydrophobicContact CB-CD1 3.55Å; F66-L174 HydrophobicContact CD1-CD1 3.34Å; F66-L174 HydrophobicContact CD2-CD1 3.86Å; F66-L174 HydrophobicContact CE1-CD1 3.93Å; F66-L174 HydrophobicContact CE2-CD1 4.38Å; F66-L174 HydrophobicContact CG-CD1 3.28Å; F66-L174 HydrophobicContact CZ-CD1 4.4Å; A170-L174 WeakPolarHBondContact O-CB 3.45Å; A170-L174 PolarHBondContact O-N 2.89Å; R172-L174 VanDerWaalsContact C-N 3.34Å; R172-L174 PolarHBondContact O-N 2.76Å; L174-L176 HydrophobicContact CB-CD1 4.33Å; L174-L176 HydrophobicContact CB-CD2 4.32Å; L174-L176 HydrophobicContact CB-CG 3.9Å; L174-L176 HydrophobicContact CD1-CD1 4.48Å; L174-L176 PolarHBondContact O-N 3.25Å
175	K	94.8	Very high	94	Very high	159 Å²	159	55.3 Å²	55.3	69%	0.691	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	42.5	-177.6	-57.3	173.8	-178.9	171.7	0	112.1	Q171 R172	Q171-K175 WeakPolarHBondContact O-CA 3.2Å; Q171-K175 PolarHBondContact O-N 3.42Å; R172-K175 PolarHBondContact O-N 3.02Å
176	L	94.6	Very high	94.4	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.068	27%	0.269	C	S	.	.			trans	-72.8	152.9	178.7	-62.7	175.2	0	0	0	110.7	Y114 F115 Q171 L174 I183	Y114-L176 HydrophobicContact CE1-CD2 3.68Å; F115-L176 HydrophobicContact CE1-CD2 4.13Å; F115-L176 HydrophobicContact CZ-CD1 4.46Å; F115-L176 HydrophobicContact CZ-CD2 4.23Å; Q171-L176 HydrophobicContact CG-CB 4.27Å; Q171-L176 PolarHBondContact O-N 3.32Å; L174-L176 HydrophobicContact CB-CD1 4.33Å; L174-L176 HydrophobicContact CB-CD2 4.32Å; L174-L176 HydrophobicContact CB-CG 3.9Å; L174-L176 HydrophobicContact CD1-CD1 4.48Å; L174-L176 PolarHBondContact O-N 3.25Å; L176-I183 HydrophobicContact CD1-CG2 3.48Å; L176-I183 VanDerWaalsContact CD1-CG2 3.48Å
177	P	92.6	Very high	94.6	Very high	39 Å²	39	53.3 Å²	53.3	25%	0.253	26%	0.263	S	S	.	.			trans	-65.9	156.5	-175	30.2	-38	0	0	0	111.7	Y114 Q171 T179 E180 E181	Y114-P177 HydrophobicContact CE2-CG 4.29Å; Y114-P177 WeakPolarHBondContact OH-CD 3.43Å; Q171-P177 PolarHBondContact NE2-O 2.81Å; P177-T179 WeakPolarHBondContact CB-OG1 3.48Å; P177-T179 WeakPolarHBondContact CG-OG1 3.44Å; P177-T179 PolarHBondContact O-N 3.48Å; P177-E180 PolarHBondContact O-N 2.99Å; P177-E181 HydrophobicContact CG-CB 4Å
178	S	90.8	Very high	94.7	Very high	107 Å²	107	52.2 Å²	52.2	75%	0.748	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-12.1	175.7	59.9	0	0	0	0	113.3	E180	S178-E180 PolarHBondContact O-N 2.97Å
179	T	91.2	Very high	94.8	Very high	87 Å²	87	52 Å²	52	53%	0.534	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-0.8	173.7	48.1	0	0	0	0	113.2	P177 E181	P177-T179 WeakPolarHBondContact CB-OG1 3.48Å; P177-T179 WeakPolarHBondContact CG-OG1 3.44Å; P177-T179 PolarHBondContact O-N 3.48Å; T179-E181 PolarHBondContact O-N 3.32Å; T179-E181 PolarHBondContact OG1-OE2 3.38Å
180	E	91.9	Very high	94.9	Very high	63 Å²	63	56.3 Å²	56.3	29%	0.294	28%	0.284	S	S	.	.			trans	69.5	12.1	173.6	-50.7	167.6	175.3	0	0	114.5	R167 P177 S178 I183 Q184 I187	R167-E180 IonicContact CZ-OE1 3.69Å; R167-E180 IonicContact NH2-OE1 2.61Å; R167-E180 PolarHBondContact NH2-OE1 3.01Å; R167-E180 IonicContact NH2-OE2 3.78Å; P177-E180 PolarHBondContact O-N 2.99Å; S178-E180 PolarHBondContact O-N 2.97Å; E180-I183 HydrophobicContact CB-CG1 4.32Å; E180-I183 VanDerWaalsContact O-CG1 3.26Å; E180-I183 WeakPolarHBondContact O-CG1 3.43Å; E180-I183 PolarHBondContact O-N 2.96Å; E180-Q184 PolarHBondContact O-NE2 2.89Å; E180-I187 HydrophobicContact CB-CD1 3.71Å; E180-I187 HydrophobicContact CG-CD1 4.2Å; E180-I187 WeakPolarHBondContact OE2-CD1 3.22Å
181	E	94.4	Very high	95	Very high	99 Å²	99	57.3 Å²	57.3	46%	0.463	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	133.8	172.5	-61.5	166.7	114.3	0	0	110.4	Y114 P177 T179	Y114-E181 HydrophobicContact CD2-CB 3.5Å; Y114-E181 HydrophobicContact CE2-CB 3.65Å; Y114-E181 HydrophobicContact CG-CB 4.26Å; P177-E181 HydrophobicContact CG-CB 4Å; T179-E181 PolarHBondContact O-N 3.32Å; T179-E181 PolarHBondContact OG1-OE2 3.38Å
182	G	96.2	Very high	94.9	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.01	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	4.1	-176.7	0	0	0	0	0	115.5	D111 Y114 F115	D111-G182 VanDerWaalsContact OD1-CA 3.28Å; D111-G182 WeakPolarHBondContact OD1-CA 3.33Å; D111-G182 PolarHBondContact OD1-N 2.77Å; Y114-G182 VanDerWaalsContact CD1-CA 3.44Å; F115-G182 WeakPolarHBondContact CE2-O 3.44Å; F115-G182 WeakPolarHBondContact CZ-O 3.44Å
183	I	97.2	Very high	94.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.308	C	S	.	.			trans	-139.5	24.6	175.7	50.3	177.4	0	0	0	112.8	F66 D111 R167 A170 Q171 L176 E180 F185 Y186	F66-I183 HydrophobicContact CE1-CG2 4.48Å; F66-I183 HydrophobicContact CZ-CG2 4.1Å; D111-I183 PolarHBondContact OD1-N 2.96Å; R167-I183 HydrophobicContact CG-CD1 3.92Å; A170-I183 HydrophobicContact CB-CG2 3.97Å; Q171-I183 HydrophobicContact CB-CD1 3.9Å; Q171-I183 HydrophobicContact CG-CD1 4.17Å; L176-I183 HydrophobicContact CD1-CG2 3.48Å; L176-I183 VanDerWaalsContact CD1-CG2 3.48Å; E180-I183 HydrophobicContact CB-CG1 4.32Å; E180-I183 VanDerWaalsContact O-CG1 3.26Å; E180-I183 WeakPolarHBondContact O-CG1 3.43Å; E180-I183 PolarHBondContact O-N 2.96Å; I183-F185 PolarHBondContact O-N 3.48Å; I183-Y186 HydrophobicContact CB-CD2 4Å; I183-Y186 HydrophobicContact CG2-CD2 4.17Å; I183-Y186 HydrophobicContact CG2-CE2 4.25Å; I183-Y186 PolarHBondContact O-N 3.13Å
184	Q	97.9	Very high	94.9	Very high	30 Å²	30	56.7 Å²	56.7	14%	0.14	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-60.5	-31.8	179.2	-63.7	-68.7	-64.4	0	0	112.1	A107 K110 D111 E180 Y186 I187	A107-Q184 HydrophobicContact CB-CB 4.03Å; K110-Q184 HydrophobicContact CB-CB 4.43Å; K110-Q184 HydrophobicContact CB-CG 4.09Å; K110-Q184 HydrophobicContact CD-CB 4.5Å; K110-Q184 HydrophobicContact CD-CG 4.14Å; D111-Q184 VanDerWaalsContact CG-N 3.33Å; D111-Q184 VanDerWaalsContact OD1-CB 3.3Å; D111-Q184 WeakPolarHBondContact OD1-CB 3.48Å; D111-Q184 WeakPolarHBondContact OD1-CG 3.22Å; D111-Q184 PolarHBondContact OD1-N 3.44Å; D111-Q184 PolarHBondContact OD2-N 3.43Å; D111-Q184 VanDerWaalsContact OD2-N 3.09Å; E180-Q184 PolarHBondContact O-NE2 2.89Å; Q184-Y186 PolarHBondContact O-N 2.89Å; Q184-Y186 VanDerWaalsContact O-N 3.11Å; Q184-I187 PolarHBondContact O-N 3.13Å
185	F	98.3	Very high	94.9	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.018	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-47.3	-40.3	174.3	170	-101.6	0	0	0	113.3	L73 Y77 R104 L108 D111 D159 I183 I187	L73-F185 HydrophobicContact CD1-CD1 4.05Å; L73-F185 HydrophobicContact CD1-CD2 4.5Å; L73-F185 HydrophobicContact CD1-CE1 3.87Å; L73-F185 HydrophobicContact CD1-CE2 4.31Å; L73-F185 HydrophobicContact CD1-CG 4.38Å; L73-F185 HydrophobicContact CD1-CZ 4.01Å; L73-F185 HydrophobicContact CD2-CE2 4.44Å; L73-F185 HydrophobicContact CD2-CZ 4.1Å; Y77-F185 HydrophobicContact CD2-CE2 4.16Å; Y77-F185 HydrophobicContact CE1-CE2 4.18Å; Y77-F185 AromaticContact CE2-CE2 3.67Å; Y77-F185 HydrophobicContact CE2-CE2 3.67Å; Y77-F185 AromaticContact CE2-CZ 4Å; Y77-F185 HydrophobicContact CE2-CZ 4Å; Y77-F185 AromaticContact CZ-CE2 3.66Å; Y77-F185 AromaticContact CZ-CZ 3.9Å; R104-F185 HydrophobicContact CB-CD2 3.83Å; R104-F185 HydrophobicContact CB-CE2 3.9Å; R104-F185 WeakPolarHBondContact CD-O 3.38Å; R104-F185 HydrophobicContact CG-CD2 3.93Å; R104-F185 HydrophobicContact CG-CE2 3.67Å; R104-F185 PolarHBondContact NH1-O 2.96Å; L108-F185 HydrophobicContact CD1-CD2 3.73Å; L108-F185 HydrophobicContact CD1-CE2 4.13Å; L108-F185 HydrophobicContact CD2-CB 3.97Å; L108-F185 HydrophobicContact CD2-CD2 3.74Å; L108-F185 HydrophobicContact CD2-CG 4.05Å; L108-F185 HydrophobicContact CG-CB 4.24Å; L108-F185 HydrophobicContact CG-CD2 3.69Å; L108-F185 HydrophobicContact CG-CG 4.35Å; D111-F185 WeakPolarHBondContact OD2-CB 3.45Å; D111-F185 PolarHBondContact OD2-N 3.37Å; D159-F185 WeakPolarHBondContact OD1-CZ 3.35Å; I183-F185 PolarHBondContact O-N 3.48Å; F185-I187 PolarHBondContact O-N 3.12Å
186	Y	96.6	Very high	94.9	Very high	21 Å²	21	56.2 Å²	56.2	8%	0.082	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-83.6	4.9	-175.7	-55.7	-79.9	0	0	0	114	F66 Q164 L166 R167 I183 Q184	F66-Y186 HydrophobicContact CE2-CE2 4.43Å; F66-Y186 HydrophobicContact CZ-CE2 4.09Å; Q164-Y186 PolarHBondContact NE2-O 3.46Å; L166-Y186 HydrophobicContact CB-CD1 4.21Å; L166-Y186 HydrophobicContact CB-CE1 3.78Å; L166-Y186 HydrophobicContact CD1-CE1 4.19Å; R167-Y186 HydrophobicContact CB-CD2 4.38Å; R167-Y186 HydrophobicContact CB-CG 4.01Å; I183-Y186 HydrophobicContact CB-CD2 4Å; I183-Y186 HydrophobicContact CG2-CD2 4.17Å; I183-Y186 HydrophobicContact CG2-CE2 4.25Å; I183-Y186 PolarHBondContact O-N 3.13Å; Q184-Y186 PolarHBondContact O-N 2.89Å; Q184-Y186 VanDerWaalsContact O-N 3.11Å
187	I	95.2	Very high	95.1	Very high	23 Å²	23	56.6 Å²	56.6	12%	0.118	31%	0.312	C	S	.	.			trans	-112.6	119.8	-174.5	-58	170	0	0	0	109.2	R104 E180 Q184 F185 E189	R104-I187 PolarHBondContact NH1-O 3.17Å; E180-I187 HydrophobicContact CB-CD1 3.71Å; E180-I187 HydrophobicContact CG-CD1 4.2Å; E180-I187 WeakPolarHBondContact OE2-CD1 3.22Å; Q184-I187 PolarHBondContact O-N 3.13Å; F185-I187 PolarHBondContact O-N 3.12Å; I187-E189 HydrophobicContact CG2-CG 3.99Å
188	F	96.4	Very high	95.3	Very high	19 Å²	19	55.3 Å²	55.3	8%	0.083	30%	0.302	C	S	.	.			trans	-108.2	80.9	179.8	-67.8	-100.5	0	0	0	109.1	E101 L102 R104 D159 L160 N190 I191	E101-F188 WeakPolarHBondContact O-CD1 3.35Å; L102-F188 HydrophobicContact CD2-CD1 4.48Å; L102-F188 HydrophobicContact CD2-CE1 4.15Å; R104-F188 VanDerWaalsContact NH1-CE1 3.28Å; R104-F188 VanDerWaalsContact NH1-CG 3.28Å; D159-F188 HydrophobicContact CB-CE2 4.04Å; D159-F188 HydrophobicContact CB-CZ 3.62Å; L160-F188 HydrophobicContact CD2-CD1 3.81Å; L160-F188 HydrophobicContact CD2-CD2 3.97Å; L160-F188 HydrophobicContact CD2-CE1 3.92Å; L160-F188 HydrophobicContact CD2-CE2 4.07Å; L160-F188 HydrophobicContact CD2-CG 3.85Å; L160-F188 HydrophobicContact CD2-CZ 4.06Å; L160-F188 HydrophobicContact CG-CE1 4.47Å; L160-F188 HydrophobicContact CG-CZ 4.5Å; F188-N190 PolarHBondContact O-N 3.45Å; F188-I191 HydrophobicContact CB-CB 4.03Å; F188-I191 HydrophobicContact CB-CD1 4.11Å; F188-I191 HydrophobicContact CB-CG1 4.26Å; F188-I191 HydrophobicContact CD1-CD1 3.81Å; F188-I191 HydrophobicContact CG-CD1 4.28Å; F188-I191 PolarHBondContact O-N 3.44Å; F188-I191 VanDerWaalsContact O-N 3.09Å
189	E	94.3	Very high	95.5	Very high	144 Å²	144	53.6 Å²	53.6	67%	0.673	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-30.1	-174.1	-62.8	-179.2	173.5	0	0	113.3	I187	I187-E189 HydrophobicContact CG2-CG 3.99Å
190	N	97.1	Very high	95.8	Very high	102 Å²	102	52.8 Å²	52.8	55%	0.545	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	10.4	-178.1	-63.5	-47.5	0	0	0	113.5	L100 E101 F188	L100-N190 WeakPolarHBondContact O-CB 3.46Å; L100-N190 PolarHBondContact O-ND2 2.9Å; E101-N190 HydrophobicContact CG-CB 4.34Å; F188-N190 PolarHBondContact O-N 3.45Å
191	I	96.6	Very high	96.1	Very high	21 Å²	21	49.8 Å²	49.8	11%	0.108	26%	0.26	C	S	.	.			trans	-123.1	106.9	175.8	-60.9	176.7	0	0	0	109.5	E101 L102 L160 F188 F197	E101-I191 HydrophobicContact CB-CD1 4.04Å; E101-I191 HydrophobicContact CB-CG1 3.84Å; E101-I191 HydrophobicContact CG-CG1 4.41Å; L102-I191 HydrophobicContact CD2-CD1 3.99Å; L160-I191 HydrophobicContact CD1-CD1 4.34Å; L160-I191 HydrophobicContact CD2-CD1 3.8Å; F188-I191 HydrophobicContact CB-CB 4.03Å; F188-I191 HydrophobicContact CB-CD1 4.11Å; F188-I191 HydrophobicContact CB-CG1 4.26Å; F188-I191 HydrophobicContact CD1-CD1 3.81Å; F188-I191 HydrophobicContact CG-CD1 4.28Å; F188-I191 PolarHBondContact O-N 3.44Å; F188-I191 VanDerWaalsContact O-N 3.09Å; I191-F197 HydrophobicContact CD1-CB 4.48Å; I191-F197 HydrophobicContact CD1-CD1 3.82Å; I191-F197 HydrophobicContact CD1-CD2 4.06Å; I191-F197 HydrophobicContact CD1-CE1 4.04Å; I191-F197 HydrophobicContact CD1-CE2 4.26Å; I191-F197 HydrophobicContact CD1-CG 3.83Å; I191-F197 HydrophobicContact CD1-CZ 4.25Å; I191-F197 HydrophobicContact CG1-CD2 3.99Å; I191-F197 HydrophobicContact CG1-CE2 4.29Å; I191-F197 HydrophobicContact CG1-CG 4.16Å; I191-F197 HydrophobicContact CG2-CB 3.73Å; I191-F197 HydrophobicContact CG2-CD2 4.41Å; I191-F197 HydrophobicContact CG2-CG 4.12Å
192	S	93.9	Very high	96.3	Very high	131 Å²	131	46.5 Å²	46.5	92%	0.916	24%	0.244	S	C	*	.	S	Bend	trans	-75.4	-32.4	179.3	57.9	0	0	0	0	113.5
193	N	94.9	Very high	96.3	Very high	65 Å²	65	49.2 Å²	49.2	35%	0.348	27%	0.266	S	S	.	.			trans	-138.8	107.3	178.9	-174	-46.9	0	0	0	110.5	Q195 Q196 F197	N193-Q195 VanDerWaalsContact C-N 3.32Å; N193-Q195 PolarHBondContact O-N 3.47Å; N193-Q195 PolarHBondContact OD1-N 3.38Å; N193-Q196 HydrophobicContact CB-CB 4.14Å; N193-Q196 HydrophobicContact CB-CG 4.19Å; N193-Q196 PolarHBondContact O-N 2.79Å; N193-Q196 PolarHBondContact OD1-N 3.33Å; N193-F197 PolarHBondContact O-N 2.56Å
194	A	93.8	Very high	96.4	Very high	38 Å²	38	55 Å²	55	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-37.7	-177.9	0	0	0	0	0	113	L160 F197 K198	L160-A194 HydrophobicContact CD2-CB 4.43Å; A194-F197 PolarHBondContact O-N 3.25Å; A194-K198 WeakPolarHBondContact O-CG 3.49Å; A194-K198 PolarHBondContact O-N 2.88Å
195	Q	93.6	Very high	96.3	Very high	50 Å²	50	53.7 Å²	53.7	23%	0.234	28%	0.282	C	S	.	.	H	α-helix	trans	-68	-44.9	-178.9	-175.1	62.6	8.6	0	0	111.7	T22 N193 F197 K198 Q199	T22-Q195 PolarHBondContact OG1-NE2 2.78Å; N193-Q195 VanDerWaalsContact C-N 3.32Å; N193-Q195 PolarHBondContact O-N 3.47Å; N193-Q195 PolarHBondContact OD1-N 3.38Å; Q195-F197 VanDerWaalsContact C-N 3.31Å; Q195-F197 PolarHBondContact O-N 3.07Å; Q195-K198 PolarHBondContact O-N 3.17Å; Q195-Q199 WeakPolarHBondContact O-CG 3.29Å; Q195-Q199 PolarHBondContact O-N 3.17Å
196	Q	96.4	Very high	96.3	Very high	123 Å²	123	56 Å²	56	58%	0.575	29%	0.294	S	S	*	.	H	α-helix	trans	-63.4	-39.1	175.8	-69.5	179.1	2.5	0	0	111.4	N193 Q199 L200	N193-Q196 HydrophobicContact CB-CB 4.14Å; N193-Q196 HydrophobicContact CB-CG 4.19Å; N193-Q196 PolarHBondContact O-N 2.79Å; N193-Q196 PolarHBondContact OD1-N 3.33Å; Q196-Q199 PolarHBondContact O-N 2.97Å; Q196-L200 PolarHBondContact O-N 3.15Å
197	F	97.6	Very high	96.2	Very high	21 Å²	21	58.6 Å²	58.6	9%	0.092	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-41.2	176.6	-166.6	-85	0	0	0	112.1	F98 E101 L102 L160 I191 N193 A194 Q195 Q199 L200 Y201	F98-F197 HydrophobicContact CB-CZ 4.05Å; F98-F197 HydrophobicContact CD1-CE2 4.33Å; F98-F197 HydrophobicContact CD1-CZ 4.07Å; F98-F197 HydrophobicContact CD2-CZ 4.31Å; F98-F197 AromaticContact CG-CZ 3.89Å; F98-F197 HydrophobicContact CG-CZ 3.89Å; E101-F197 HydrophobicContact CB-CE2 3.66Å; E101-F197 HydrophobicContact CB-CZ 3.7Å; E101-F197 HydrophobicContact CG-CE2 3.77Å; E101-F197 HydrophobicContact CG-CZ 4.26Å; L102-F197 HydrophobicContact CD1-CE1 3.96Å; L102-F197 HydrophobicContact CD1-CZ 4.32Å; L102-F197 HydrophobicContact CD2-CD1 4.34Å; L102-F197 HydrophobicContact CD2-CE1 3.62Å; L102-F197 HydrophobicContact CD2-CZ 4.23Å; L102-F197 HydrophobicContact CG-CE1 3.8Å; L102-F197 HydrophobicContact CG-CZ 4.01Å; L160-F197 HydrophobicContact CD1-CD1 3.71Å; L160-F197 HydrophobicContact CD1-CE1 4.33Å; I191-F197 HydrophobicContact CD1-CB 4.48Å; I191-F197 HydrophobicContact CD1-CD1 3.82Å; I191-F197 HydrophobicContact CD1-CD2 4.06Å; I191-F197 HydrophobicContact CD1-CE1 4.04Å; I191-F197 HydrophobicContact CD1-CE2 4.26Å; I191-F197 HydrophobicContact CD1-CG 3.83Å; I191-F197 HydrophobicContact CD1-CZ 4.25Å; I191-F197 HydrophobicContact CG1-CD2 3.99Å; I191-F197 HydrophobicContact CG1-CE2 4.29Å; I191-F197 HydrophobicContact CG1-CG 4.16Å; I191-F197 HydrophobicContact CG2-CB 3.73Å; I191-F197 HydrophobicContact CG2-CD2 4.41Å; I191-F197 HydrophobicContact CG2-CG 4.12Å; N193-F197 PolarHBondContact O-N 2.56Å; A194-F197 PolarHBondContact O-N 3.25Å; Q195-F197 VanDerWaalsContact C-N 3.31Å; Q195-F197 PolarHBondContact O-N 3.07Å; F197-Q199 VanDerWaalsContact C-N 3.33Å; F197-Q199 PolarHBondContact O-N 3.22Å; F197-L200 WeakPolarHBondContact O-CB 3.35Å; F197-L200 PolarHBondContact O-N 3.11Å; F197-Y201 HydrophobicContact CE1-CD2 4.27Å; F197-Y201 WeakPolarHBondContact O-CB 3.4Å; F197-Y201 PolarHBondContact O-N 3.48Å
198	K	96.1	Very high	96.2	Very high	13 Å²	13	58.2 Å²	58.2	6%	0.057	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-41.6	173.5	-74.5	-169.5	-64.6	170	0	112	E21 M157 L160 S161 A194 Q195 Y201 R202	E21-K198 IonicContact OE1-NZ 3.34Å; M157-K198 HydrophobicContact SD-CB 4.37Å; M157-K198 HydrophobicContact SD-CG 3.98Å; L160-K198 HydrophobicContact CB-CD 4.03Å; L160-K198 HydrophobicContact CB-CG 3.98Å; L160-K198 HydrophobicContact CD1-CG 3.99Å; S161-K198 WeakPolarHBondContact OG-CD 3.4Å; S161-K198 PolarHBondContact OG-NZ 3.23Å; A194-K198 WeakPolarHBondContact O-CG 3.49Å; A194-K198 PolarHBondContact O-N 2.88Å; Q195-K198 PolarHBondContact O-N 3.17Å; K198-Y201 PolarHBondContact O-N 2.85Å; K198-R202 WeakPolarHBondContact O-CG 3.44Å; K198-R202 PolarHBondContact O-N 3.33Å
199	Q	96.4	Very high	96.1	Very high	71 Å²	71	65.2 Å²	65.2	33%	0.332	36%	0.357	S	S	.	.	H	α-helix	trans	-62	-46	174.7	-72.8	172.6	-17.4	0	0	111.7	Q195 Q196 F197 Y201 R202 A203	Q195-Q199 WeakPolarHBondContact O-CG 3.29Å; Q195-Q199 PolarHBondContact O-N 3.17Å; Q196-Q199 PolarHBondContact O-N 2.97Å; F197-Q199 VanDerWaalsContact C-N 3.33Å; F197-Q199 PolarHBondContact O-N 3.22Å; Q199-Y201 PolarHBondContact O-N 3.4Å; Q199-R202 PolarHBondContact O-N 3.17Å; Q199-A203 PolarHBondContact O-N 2.94Å
200	L	97.6	Very high	96.1	Very high	69 Å²	69	59.6 Å²	59.6	36%	0.361	33%	0.331	S	S	.	.	H	α-helix	trans	-56.8	-48.6	173.6	172.4	64.2	0	0	0	111.4	F98 Q196 F197 R202 A203 R204	F98-L200 HydrophobicContact CE1-CD2 4.48Å; Q196-L200 PolarHBondContact O-N 3.15Å; F197-L200 WeakPolarHBondContact O-CB 3.35Å; F197-L200 PolarHBondContact O-N 3.11Å; L200-R202 VanDerWaalsContact C-N 3.35Å; L200-R202 PolarHBondContact O-N 2.93Å; L200-A203 WeakPolarHBondContact O-CB 3.41Å; L200-A203 PolarHBondContact O-N 3.36Å; L200-R204 HydrophobicContact CD1-CG 4.32Å; L200-R204 WeakPolarHBondContact O-CG 3.46Å; L200-R204 PolarHBondContact O-N 2.85Å
201	Y	98.1	Very high	96.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-43.4	-179.1	-164.2	-86.3	0	0	0	111.5	L96 F98 L102 A152 M157 F197 K198 Q199 R204 M205	L96-Y201 HydrophobicContact CB-CE2 4.27Å; L96-Y201 HydrophobicContact CD2-CD1 4.45Å; L96-Y201 HydrophobicContact CD2-CE1 4.13Å; L96-Y201 HydrophobicContact CD2-CE2 4.2Å; F98-Y201 HydrophobicContact CD2-CD2 4Å; F98-Y201 HydrophobicContact CD2-CE2 4.11Å; F98-Y201 HydrophobicContact CE2-CD2 4.14Å; F98-Y201 HydrophobicContact CE2-CE2 4.49Å; L102-Y201 HydrophobicContact CD1-CD2 3.95Å; L102-Y201 HydrophobicContact CD1-CE2 3.61Å; A152-Y201 WeakPolarHBondContact CB-OH 3.47Å; M157-Y201 HydrophobicContact CE-CD1 3.57Å; M157-Y201 HydrophobicContact CE-CD2 3.91Å; M157-Y201 HydrophobicContact CE-CE1 4.02Å; M157-Y201 HydrophobicContact CE-CE2 4.33Å; M157-Y201 HydrophobicContact CE-CG 3.5Å; M157-Y201 HydrophobicContact CG-CD1 4.34Å; M157-Y201 HydrophobicContact SD-CD1 3.71Å; M157-Y201 HydrophobicContact SD-CE1 4.41Å; M157-Y201 HydrophobicContact SD-CG 4.02Å; F197-Y201 HydrophobicContact CE1-CD2 4.27Å; F197-Y201 WeakPolarHBondContact O-CB 3.4Å; F197-Y201 PolarHBondContact O-N 3.48Å; K198-Y201 PolarHBondContact O-N 2.85Å; Q199-Y201 PolarHBondContact O-N 3.4Å; Y201-R204 PolarHBondContact O-N 2.93Å; Y201-M205 HydrophobicContact CD1-CE 4.09Å; Y201-M205 HydrophobicContact CD1-CG 3.99Å; Y201-M205 HydrophobicContact CD1-SD 3.94Å; Y201-M205 HydrophobicContact CE1-CE 4.38Å; Y201-M205 HydrophobicContact CE1-CG 3.84Å; Y201-M205 HydrophobicContact CE1-SD 3.66Å; Y201-M205 WeakPolarHBondContact O-CG 3.21Å; Y201-M205 PolarHBondContact O-N 3.09Å
202	R	97.4	Very high	96	Very high	30 Å²	30	65.7 Å²	65.7	11%	0.113	36%	0.357	C	S	.	.	H	α-helix	trans	-59.7	-45.9	173.1	-72.1	177.6	-175.3	122.3	11.5	112.5	E21 K198 Q199 L200 R204 M205 N206	E21-R202 IonicContact OE1-CZ 3.52Å; E21-R202 IonicContact OE1-NH1 3.62Å; E21-R202 IonicContact OE1-NH2 2.73Å; E21-R202 PolarHBondContact OE1-NH2 3.44Å; E21-R202 IonicContact OE2-NH2 3.43Å; K198-R202 WeakPolarHBondContact O-CG 3.44Å; K198-R202 PolarHBondContact O-N 3.33Å; Q199-R202 PolarHBondContact O-N 3.17Å; L200-R202 VanDerWaalsContact C-N 3.35Å; L200-R202 PolarHBondContact O-N 2.93Å; R202-R204 VanDerWaalsContact C-N 3.27Å; R202-R204 PolarHBondContact O-N 3.09Å; R202-M205 HydrophobicContact CB-CE 4.4Å; R202-M205 HydrophobicContact CG-CE 3.98Å; R202-M205 PolarHBondContact O-N 3.18Å; R202-N206 WeakPolarHBondContact O-CB 3.48Å; R202-N206 PolarHBondContact O-N 3.24Å; R202-N206 PolarHBondContact O-ND2 3.35Å
203	A	97.4	Very high	96.2	Very high	59 Å²	59	64 Å²	64	49%	0.488	34%	0.337	S	S	.	.	H	α-helix	trans	-59.8	-38.4	176.6	0	0	0	0	0	111.8	Q199 L200 N206 A207	Q199-A203 PolarHBondContact O-N 2.94Å; L200-A203 WeakPolarHBondContact O-CB 3.41Å; L200-A203 PolarHBondContact O-N 3.36Å; A203-N206 PolarHBondContact O-N 3.39Å; A203-A207 PolarHBondContact O-N 2.77Å
204	R	97.9	Very high	96.3	Very high	122 Å²	122	61.8 Å²	61.8	46%	0.46	33%	0.326	S	S	.	.	H	α-helix	trans	-67.5	-42.5	175	-65.8	-65.2	-179.4	-174.7	1.6	112.9	P95 L96 F98 L200 Y201 R202 N206 A207	P95-R204 WeakPolarHBondContact O-CB 3.22Å; L96-R204 HydrophobicContact CD2-CB 3.66Å; F98-R204 HydrophobicContact CE2-CG 4.33Å; F98-R204 HydrophobicContact CZ-CG 4.12Å; L200-R204 HydrophobicContact CD1-CG 4.32Å; L200-R204 WeakPolarHBondContact O-CG 3.46Å; L200-R204 PolarHBondContact O-N 2.85Å; Y201-R204 PolarHBondContact O-N 2.93Å; R202-R204 VanDerWaalsContact C-N 3.27Å; R202-R204 PolarHBondContact O-N 3.09Å; R204-N206 VanDerWaalsContact C-N 3.27Å; R204-N206 PolarHBondContact O-N 3.45Å; R204-A207 PolarHBondContact O-N 2.98Å
205	M	97.1	Very high	96.6	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-40.7	174.5	-70.6	-168.6	-59.7	0	0	111.3	L32 L36 L96 V149 Y153 Y201 R202 A207 L208	L32-M205 HydrophobicContact CD2-CB 4.34Å; L36-M205 HydrophobicContact CD1-SD 4.05Å; L96-M205 HydrophobicContact CD1-CG 3.92Å; L96-M205 HydrophobicContact CD2-CB 4.37Å; L96-M205 HydrophobicContact CD2-CG 3.55Å; L96-M205 HydrophobicContact CG-CG 4.4Å; V149-M205 HydrophobicContact CG2-CG 4.09Å; V149-M205 HydrophobicContact CG2-SD 3.92Å; Y153-M205 HydrophobicContact CD2-CE 3.66Å; Y153-M205 HydrophobicContact CD2-SD 3.78Å; Y153-M205 HydrophobicContact CE2-CE 3.98Å; Y153-M205 HydrophobicContact CG-SD 4.39Å; Y201-M205 HydrophobicContact CD1-CE 4.09Å; Y201-M205 HydrophobicContact CD1-CG 3.99Å; Y201-M205 HydrophobicContact CD1-SD 3.94Å; Y201-M205 HydrophobicContact CE1-CE 4.38Å; Y201-M205 HydrophobicContact CE1-CG 3.84Å; Y201-M205 HydrophobicContact CE1-SD 3.66Å; Y201-M205 WeakPolarHBondContact O-CG 3.21Å; Y201-M205 PolarHBondContact O-N 3.09Å; R202-M205 HydrophobicContact CB-CE 4.4Å; R202-M205 HydrophobicContact CG-CE 3.98Å; R202-M205 PolarHBondContact O-N 3.18Å; M205-A207 PolarHBondContact O-N 2.97Å; M205-L208 WeakPolarHBondContact O-CB 3.44Å; M205-L208 WeakPolarHBondContact O-CG 3.41Å; M205-L208 PolarHBondContact O-N 2.89Å
206	N	96.9	Very high	96.8	Very high	52 Å²	52	64.7 Å²	64.7	28%	0.278	33%	0.333	S	S	.	.	H	α-helix	trans	-70.2	-19	-179.4	-69.1	-19.3	0	0	0	113.7	S31 L32 S33 R202 A203 R204	S31-N206 WeakPolarHBondContact CB-OD1 3.36Å; L32-N206 PolarHBondContact N-OD1 3.03Å; L32-N206 VanDerWaalsContact N-OD1 3.08Å; S33-N206 WeakPolarHBondContact CB-OD1 3.35Å; S33-N206 PolarHBondContact N-OD1 2.68Å; S33-N206 PolarHBondContact OG-ND2 3.3Å; S33-N206 PolarHBondContact OG-OD1 3.01Å; R202-N206 WeakPolarHBondContact O-CB 3.48Å; R202-N206 PolarHBondContact O-N 3.24Å; R202-N206 PolarHBondContact O-ND2 3.35Å; A203-N206 PolarHBondContact O-N 3.39Å; R204-N206 VanDerWaalsContact C-N 3.27Å; R204-N206 PolarHBondContact O-N 3.45Å
207	A	95.9	Very high	96.9	Very high	76 Å²	76	62.5 Å²	62.5	63%	0.628	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-4.7	177	0	0	0	0	0	113.7	A203 R204 M205 D209	A203-A207 PolarHBondContact O-N 2.77Å; R204-A207 PolarHBondContact O-N 2.98Å; M205-A207 PolarHBondContact O-N 2.97Å; A207-D209 PolarHBondContact O-N 3.37Å
208	L	95.3	Very high	96.9	Very high	15 Å²	15	61.5 Å²	61.5	8%	0.079	32%	0.315	C	S	.	.	S	Bend	trans	-67.1	131	174.4	-65.3	173.7	0	0	0	110.4	L32 P95 L96 M205 L210	L32-L208 HydrophobicContact CD2-CD1 4.32Å; P95-L208 HydrophobicContact CB-CD2 4.22Å; P95-L208 HydrophobicContact CG-CD2 3.78Å; L96-L208 HydrophobicContact CD1-CD1 4.05Å; M205-L208 WeakPolarHBondContact O-CB 3.44Å; M205-L208 WeakPolarHBondContact O-CG 3.41Å; M205-L208 PolarHBondContact O-N 2.89Å; L208-L210 HydrophobicContact CB-CD1 3.71Å; L208-L210 HydrophobicContact CB-CG 3.77Å; L208-L210 HydrophobicContact CD1-CD1 4.09Å; L208-L210 PolarHBondContact O-N 3.46Å
209	D	94.3	Very high	97.1	Very high	167 Å²	167	62 Å²	62	89%	0.893	32%	0.319	S	S	*	.			trans	-78.1	88.7	176.9	-170.6	19.9	0	0	0	110.1	A207	A207-D209 PolarHBondContact O-N 3.37Å
210	L	94.9	Very high	97.2	Very high	26 Å²	26	64.3 Å²	64.3	14%	0.136	33%	0.33	C	S	.	.			trans	-127.9	133.8	-173.6	-58	172.3	0	0	0	111	L32 L208 T214 K215 I218	L32-L210 HydrophobicContact CD2-CD1 3.84Å; L208-L210 HydrophobicContact CB-CD1 3.71Å; L208-L210 HydrophobicContact CB-CG 3.77Å; L208-L210 HydrophobicContact CD1-CD1 4.09Å; L208-L210 PolarHBondContact O-N 3.46Å; L210-T214 HydrophobicContact CD2-CG2 3.89Å; L210-K215 HydrophobicContact CB-CG 4.08Å; L210-I218 HydrophobicContact CD1-CD1 3.61Å
211	D	95.6	Very high	97.2	Very high	95 Å²	95	61.2 Å²	61.2	51%	0.508	31%	0.313	S	S	.	.			trans	-71.9	167	170.7	72.6	22.6	0	0	0	112.1	N213 T214 K215	D211-N213 VanDerWaalsContact C-N 3.31Å; D211-N213 PolarHBondContact O-N 3.34Å; D211-N213 PolarHBondContact OD1-N 2.82Å; D211-T214 PolarHBondContact O-N 3.33Å; D211-T214 VanDerWaalsContact OD1-CB 3.25Å; D211-T214 WeakPolarHBondContact OD1-CB 3.47Å; D211-T214 PolarHBondContact OD1-N 2.99Å; D211-T214 PolarHBondContact OD1-OG1 3.39Å; D211-K215 WeakPolarHBondContact O-CG 3.34Å; D211-K215 PolarHBondContact O-N 2.88Å; D211-K215 VanDerWaalsContact O-N 3.12Å
212	K	95.8	Very high	97.3	Very high	156 Å²	156	61.2 Å²	61.2	68%	0.678	31%	0.313	S	S	*	.	H	α-helix	trans	-58.4	-42.9	-178.2	-174.3	-176.1	176.2	-159.8	0	112.3	T214 K215 E216	K212-T214 VanDerWaalsContact C-N 3.33Å; K212-T214 PolarHBondContact O-N 3.25Å; K212-K215 PolarHBondContact O-N 3.09Å; K212-E216 WeakPolarHBondContact CE-OE1 3.13Å; K212-E216 IonicContact NZ-OE1 3.71Å; K212-E216 WeakPolarHBondContact O-CG 3.46Å; K212-E216 PolarHBondContact O-N 3.49Å
213	N	97.4	Very high	97.3	Very high	94 Å²	94	61.1 Å²	61.1	50%	0.503	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-39.1	-178.1	178.2	59.2	0	0	0	111.6	D211 E216 R217	D211-N213 VanDerWaalsContact C-N 3.31Å; D211-N213 PolarHBondContact O-N 3.34Å; D211-N213 PolarHBondContact OD1-N 2.82Å; N213-E216 PolarHBondContact O-N 3.06Å; N213-R217 WeakPolarHBondContact O-CG 3.36Å; N213-R217 PolarHBondContact O-N 3.46Å
214	T	98	Very high	97.4	Very high	20 Å²	20	62 Å²	62	12%	0.123	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-41.3	177.8	-54.4	0	0	0	0	111	E146 L210 D211 K212 E216 R217 I218	E146-T214 HydrophobicContact CB-CG2 4.17Å; E146-T214 HydrophobicContact CG-CG2 3.85Å; L210-T214 HydrophobicContact CD2-CG2 3.89Å; D211-T214 PolarHBondContact O-N 3.33Å; D211-T214 VanDerWaalsContact OD1-CB 3.25Å; D211-T214 WeakPolarHBondContact OD1-CB 3.47Å; D211-T214 PolarHBondContact OD1-N 2.99Å; D211-T214 PolarHBondContact OD1-OG1 3.39Å; K212-T214 VanDerWaalsContact C-N 3.33Å; K212-T214 PolarHBondContact O-N 3.25Å; T214-E216 VanDerWaalsContact C-N 3.33Å; T214-E216 PolarHBondContact O-N 2.96Å; T214-R217 PolarHBondContact O-N 3.46Å; T214-I218 HydrophobicContact CG2-CD1 4.07Å; T214-I218 VanDerWaalsContact O-CG1 3.27Å; T214-I218 WeakPolarHBondContact O-CG1 3.27Å; T214-I218 PolarHBondContact O-N 3.16Å
215	K	98.3	Very high	97.4	Very high	46 Å²	46	56.1 Å²	56.1	20%	0.2	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-43.4	173.2	-67.4	178.4	177.7	-177.8	0	112	T30 L32 L35 L210 D211 K212 I218 V219	T30-K215 PolarHBondContact O-NZ 2.9Å; T30-K215 VanDerWaalsContact O-NZ 3.12Å; L32-K215 HydrophobicContact CD1-CB 4.3Å; L32-K215 HydrophobicContact CD1-CG 4.23Å; L35-K215 HydrophobicContact CD1-CB 4.04Å; L35-K215 HydrophobicContact CD1-CD 4Å; L210-K215 HydrophobicContact CB-CG 4.08Å; D211-K215 WeakPolarHBondContact O-CG 3.34Å; D211-K215 PolarHBondContact O-N 2.88Å; D211-K215 VanDerWaalsContact O-N 3.12Å; K212-K215 PolarHBondContact O-N 3.09Å; K215-I218 PolarHBondContact O-N 3.01Å; K215-V219 WeakPolarHBondContact O-CG2 3.47Å; K215-V219 PolarHBondContact O-N 3.47Å
216	E	98.1	Very high	97.5	Very high	103 Å²	103	57.1 Å²	57.1	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-45	176.4	-71.9	170.9	178.3	0	0	111.8	K212 N213 T214 I218 V219 E220	K212-E216 WeakPolarHBondContact CE-OE1 3.13Å; K212-E216 IonicContact NZ-OE1 3.71Å; K212-E216 WeakPolarHBondContact O-CG 3.46Å; K212-E216 PolarHBondContact O-N 3.49Å; N213-E216 PolarHBondContact O-N 3.06Å; T214-E216 VanDerWaalsContact C-N 3.33Å; T214-E216 PolarHBondContact O-N 2.96Å; E216-I218 VanDerWaalsContact C-N 3.32Å; E216-I218 PolarHBondContact O-N 2.95Å; E216-V219 PolarHBondContact O-N 3.23Å; E216-E220 PolarHBondContact O-N 3.38Å
217	R	98.8	Very high	97.5	Very high	76 Å²	76	60 Å²	60	29%	0.287	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-38.9	174.4	-71	170.4	61.4	-144	-3.2	112.7	E146 L147 N213 T214 E220 E221	E146-R217 IonicContact OE1-CZ 3.73Å; E146-R217 VanDerWaalsContact OE1-CZ 3.26Å; E146-R217 IonicContact OE1-NH1 3.65Å; E146-R217 PolarHBondContact OE1-NH1 3.35Å; E146-R217 IonicContact OE1-NH2 2.93Å; E146-R217 PolarHBondContact OE1-NH2 2.64Å; L147-R217 HydrophobicContact CD2-CB 3.76Å; N213-R217 WeakPolarHBondContact O-CG 3.36Å; N213-R217 PolarHBondContact O-N 3.46Å; T214-R217 PolarHBondContact O-N 3.46Å; R217-E220 PolarHBondContact O-N 3.44Å; R217-E221 WeakPolarHBondContact O-CB 3.47Å; R217-E221 PolarHBondContact O-N 3.1Å
218	I	98.8	Very high	97.7	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-43.1	176.2	-71.9	162.5	0	0	0	110.8	L32 L36 E146 L147 V149 A150 L210 T214 K215 E216 E221 A222	L32-I218 HydrophobicContact CD1-CB 4.25Å; L32-I218 HydrophobicContact CD1-CD1 4.33Å; L32-I218 HydrophobicContact CD1-CG2 3.84Å; L32-I218 HydrophobicContact CD2-CD1 4.19Å; L36-I218 HydrophobicContact CD1-CG2 4.28Å; L36-I218 HydrophobicContact CD2-CG2 4.04Å; L36-I218 HydrophobicContact CG-CG2 4.37Å; E146-I218 WeakPolarHBondContact O-CD1 3.45Å; E146-I218 WeakPolarHBondContact O-CG1 3.25Å; L147-I218 HydrophobicContact CD2-CG1 3.81Å; V149-I218 HydrophobicContact CG1-CD1 3.74Å; V149-I218 HydrophobicContact CG1-CG1 3.93Å; V149-I218 HydrophobicContact CG1-CG2 3.79Å; A150-I218 HydrophobicContact CB-CG2 4.2Å; A150-I218 WeakPolarHBondContact CB-O 3.41Å; L210-I218 HydrophobicContact CD1-CD1 3.61Å; T214-I218 HydrophobicContact CG2-CD1 4.07Å; T214-I218 VanDerWaalsContact O-CG1 3.27Å; T214-I218 WeakPolarHBondContact O-CG1 3.27Å; T214-I218 PolarHBondContact O-N 3.16Å; K215-I218 PolarHBondContact O-N 3.01Å; E216-I218 VanDerWaalsContact C-N 3.32Å; E216-I218 PolarHBondContact O-N 2.95Å; I218-E221 PolarHBondContact O-N 3.01Å; I218-A222 WeakPolarHBondContact O-CB 3.25Å; I218-A222 PolarHBondContact O-N 2.94Å
219	V	98.7	Very high	97.7	Very high	23 Å²	23	57.7 Å²	57.7	14%	0.139	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-41.2	176.6	174.2	0	0	0	0	111.3	L35 L36 K215 E216 A222 N223	L35-V219 HydrophobicContact CB-CG2 3.95Å; L36-V219 HydrophobicContact CD2-CG2 4.29Å; L36-V219 HydrophobicContact CG-CG2 4.4Å; K215-V219 WeakPolarHBondContact O-CG2 3.47Å; K215-V219 PolarHBondContact O-N 3.47Å; E216-V219 PolarHBondContact O-N 3.23Å; V219-A222 PolarHBondContact O-N 2.83Å; V219-N223 PolarHBondContact O-N 3.15Å; V219-N223 VanDerWaalsContact O-N 3.09Å; V219-N223 PolarHBondContact O-ND2 3.23Å
220	E	98.8	Very high	97.8	Very high	120 Å²	120	51.7 Å²	51.7	56%	0.561	24%	0.238	S	C	*	.	H	α-helix	trans	-62.4	-43.8	174.8	-173.6	179.1	178.7	0	0	111.6	E216 R217 A222 N223 R224	E216-E220 PolarHBondContact O-N 3.38Å; R217-E220 PolarHBondContact O-N 3.44Å; E220-A222 VanDerWaalsContact C-N 3.32Å; E220-A222 PolarHBondContact O-N 3.05Å; E220-N223 WeakPolarHBondContact O-CB 3.25Å; E220-N223 PolarHBondContact O-N 3.39Å; E220-R224 PolarHBondContact O-N 3.06Å
221	E	98.9	Very high	98	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.019	25%	0.251	C	S	.	.	H	α-helix	trans	-65.8	-35.5	177.3	-165.7	63.2	-151.7	0	0	111.9	R136 L147 A150 H151 R217 I218 N223 R224 A225	R136-E221 IonicContact CZ-OE1 3.76Å; R136-E221 IonicContact CZ-OE2 2.66Å; R136-E221 IonicContact NE-OE1 3.47Å; R136-E221 PolarHBondContact NE-OE1 3.03Å; R136-E221 IonicContact NE-OE2 3.58Å; R136-E221 IonicContact NH2-OE1 3.58Å; R136-E221 PolarHBondContact NH2-OE1 2.82Å; R136-E221 IonicContact NH2-OE2 3.78Å; R136-E221 PolarHBondContact NH2-OE2 2.91Å; L147-E221 HydrophobicContact CB-CB 4.35Å; L147-E221 HydrophobicContact CB-CG 4.13Å; L147-E221 HydrophobicContact CD1-CB 4.35Å; L147-E221 HydrophobicContact CD1-CG 4.36Å; A150-E221 HydrophobicContact CB-CB 3.8Å; A150-E221 HydrophobicContact CB-CG 4Å; H151-E221 IonicContact CE1-OE1 3.53Å; H151-E221 IonicContact NE2-OE1 3.9Å; H151-E221 PolarHBondContact NE2-OE1 2.88Å; R217-E221 WeakPolarHBondContact O-CB 3.47Å; R217-E221 PolarHBondContact O-N 3.1Å; I218-E221 PolarHBondContact O-N 3.01Å; E221-N223 VanDerWaalsContact C-N 3.33Å; E221-N223 PolarHBondContact O-N 3.29Å; E221-R224 CarbonylContact O-C 3.4Å; E221-R224 WeakPolarHBondContact O-CA 3.27Å; E221-R224 VanDerWaalsContact O-CB 3.31Å; E221-R224 WeakPolarHBondContact O-CB 3.44Å; E221-R224 PolarHBondContact O-N 3.13Å; E221-R224 IonicContact OE1-CZ 3.76Å; E221-R224 IonicContact OE1-NE 3.55Å; E221-R224 IonicContact OE1-NH1 2.79Å; E221-R224 WeakPolarHBondContact OE2-CD 3.41Å; E221-R224 IonicContact OE2-CZ 3.03Å; E221-R224 IonicContact OE2-NE 3.71Å; E221-R224 IonicContact OE2-NH1 3.81Å; E221-R224 PolarHBondContact OE2-NH1 2.92Å; E221-A225 PolarHBondContact O-N 3.36Å
222	A	98.8	Very high	98.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.1	-41.2	175.2	0	0	0	0	0	110.8	L36 T40 A150 I218 V219 E220 R224 A225 F226	L36-A222 HydrophobicContact CD2-CB 3.46Å; L36-A222 VanDerWaalsContact CD2-CB 3.46Å; T40-A222 HydrophobicContact CG2-CB 3.62Å; A150-A222 HydrophobicContact CB-CB 4Å; I218-A222 WeakPolarHBondContact O-CB 3.25Å; I218-A222 PolarHBondContact O-N 2.94Å; V219-A222 PolarHBondContact O-N 2.83Å; E220-A222 VanDerWaalsContact C-N 3.32Å; E220-A222 PolarHBondContact O-N 3.05Å; A222-R224 VanDerWaalsContact C-N 3.29Å; A222-R224 PolarHBondContact O-N 3.09Å; A222-A225 WeakPolarHBondContact O-CB 3.46Å; A222-A225 PolarHBondContact O-N 3Å; A222-A225 VanDerWaalsContact O-N 3.16Å; A222-F226 VanDerWaalsContact O-CD2 3.22Å; A222-F226 WeakPolarHBondContact O-CD2 3.42Å; A222-F226 PolarHBondContact O-N 3.49Å
223	N	98.8	Very high	98.1	Very high	28 Å²	28	45.2 Å²	45.2	15%	0.15	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-35.3	171.3	-80	-76.8	0	0	0	112.5	G39 S43 V219 E220 E221 F226 R227	G39-N223 PolarHBondContact O-ND2 3.13Å; G39-N223 PolarHBondContact O-OD1 3.33Å; S43-N223 WeakPolarHBondContact CB-OD1 3.45Å; S43-N223 PolarHBondContact OG-OD1 2.96Å; V219-N223 PolarHBondContact O-N 3.15Å; V219-N223 VanDerWaalsContact O-N 3.09Å; V219-N223 PolarHBondContact O-ND2 3.23Å; E220-N223 WeakPolarHBondContact O-CB 3.25Å; E220-N223 PolarHBondContact O-N 3.39Å; E221-N223 VanDerWaalsContact C-N 3.33Å; E221-N223 PolarHBondContact O-N 3.29Å; N223-F226 PolarHBondContact O-N 3.5Å; N223-R227 WeakPolarHBondContact O-CG 3.4Å; N223-R227 PolarHBondContact O-N 3.12Å; N223-R227 VanDerWaalsContact O-N 3.08Å; N223-R227 PolarHBondContact O-NH1 3.39Å
224	R	98.7	Very high	98	Very high	77 Å²	77	44.8 Å²	44.8	29%	0.291	20%	0.204	S	C	.	.	H	α-helix	trans	-64.8	-43.4	171.8	-70.2	170.7	71.1	-178.5	7.8	111.5	R136 E220 E221 A222 F226 R227 F228	R136-R224 VanDerWaalsContact CZ-NH1 3.3Å; E220-R224 PolarHBondContact O-N 3.06Å; E221-R224 CarbonylContact O-C 3.4Å; E221-R224 WeakPolarHBondContact O-CA 3.27Å; E221-R224 VanDerWaalsContact O-CB 3.31Å; E221-R224 WeakPolarHBondContact O-CB 3.44Å; E221-R224 PolarHBondContact O-N 3.13Å; E221-R224 IonicContact OE1-CZ 3.76Å; E221-R224 IonicContact OE1-NE 3.55Å; E221-R224 IonicContact OE1-NH1 2.79Å; E221-R224 WeakPolarHBondContact OE2-CD 3.41Å; E221-R224 IonicContact OE2-CZ 3.03Å; E221-R224 IonicContact OE2-NE 3.71Å; E221-R224 IonicContact OE2-NH1 3.81Å; E221-R224 PolarHBondContact OE2-NH1 2.92Å; A222-R224 VanDerWaalsContact C-N 3.29Å; A222-R224 PolarHBondContact O-N 3.09Å; R224-F226 VanDerWaalsContact C-N 3.33Å; R224-F226 PolarHBondContact O-N 3.17Å; R224-R227 WeakPolarHBondContact O-CB 3.37Å; R224-R227 PolarHBondContact O-N 3.34Å; R224-R227 VanDerWaalsContact O-N 3.08Å; R224-F228 HydrophobicContact CB-CE2 4.41Å; R224-F228 WeakPolarHBondContact O-CD2 3.34Å; R224-F228 PolarHBondContact O-N 3.03Å
225	A	98.7	Very high	98	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.1	-45.5	174.6	0	0	0	0	0	111.3	Y133 T154 E221 A222 R227 F228 N229	Y133-A225 HydrophobicContact CE2-CB 4.4Å; T154-A225 HydrophobicContact CG2-CB 3.95Å; E221-A225 PolarHBondContact O-N 3.36Å; A222-A225 WeakPolarHBondContact O-CB 3.46Å; A222-A225 PolarHBondContact O-N 3Å; A222-A225 VanDerWaalsContact O-N 3.16Å; A225-R227 VanDerWaalsContact C-N 3.34Å; A225-R227 PolarHBondContact O-N 2.82Å; A225-F228 PolarHBondContact O-N 3.35Å; A225-N229 PolarHBondContact O-N 2.83Å; A225-N229 VanDerWaalsContact O-N 3.1Å; A225-N229 PolarHBondContact O-ND2 2.84Å
226	F	97.7	Very high	97.9	Very high	21 Å²	21	44 Å²	44	9%	0.092	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-42.4	173.1	-83.4	-78.9	0	0	0	112.5	T40 H44 A47 T154 A222 N223 R224 F228 N229 M230	T40-F226 HydrophobicContact CG2-CD2 4.23Å; T40-F226 HydrophobicContact CG2-CE2 4.03Å; H44-F226 HydrophobicContact CB-CE1 4.14Å; H44-F226 HydrophobicContact CB-CZ 4.17Å; A47-F226 HydrophobicContact CB-CD1 4.2Å; T154-F226 HydrophobicContact CG2-CD1 4.31Å; T154-F226 HydrophobicContact CG2-CD2 3.93Å; T154-F226 HydrophobicContact CG2-CE1 4.26Å; T154-F226 HydrophobicContact CG2-CE2 3.85Å; T154-F226 HydrophobicContact CG2-CG 4.14Å; T154-F226 HydrophobicContact CG2-CZ 4.03Å; A222-F226 VanDerWaalsContact O-CD2 3.22Å; A222-F226 WeakPolarHBondContact O-CD2 3.42Å; A222-F226 PolarHBondContact O-N 3.49Å; N223-F226 PolarHBondContact O-N 3.5Å; R224-F226 VanDerWaalsContact C-N 3.33Å; R224-F226 PolarHBondContact O-N 3.17Å; F226-F228 PolarHBondContact O-N 3.47Å; F226-N229 WeakPolarHBondContact O-CB 3.2Å; F226-N229 PolarHBondContact O-N 3.17Å; F226-M230 WeakPolarHBondContact O-CG 3.43Å; F226-M230 PolarHBondContact O-N 3.44Å
227	R	98.3	Very high	97.7	Very high	112 Å²	112	40.7 Å²	40.7	42%	0.423	19%	0.185	S	C	.	.	H	α-helix	trans	-61	-41.3	175.9	-72.2	-169.6	-65.5	-88.2	17.3	113	N223 R224 A225 N229 M230 Q231	N223-R227 WeakPolarHBondContact O-CG 3.4Å; N223-R227 PolarHBondContact O-N 3.12Å; N223-R227 VanDerWaalsContact O-N 3.08Å; N223-R227 PolarHBondContact O-NH1 3.39Å; R224-R227 WeakPolarHBondContact O-CB 3.37Å; R224-R227 PolarHBondContact O-N 3.34Å; R224-R227 VanDerWaalsContact O-N 3.08Å; A225-R227 VanDerWaalsContact C-N 3.34Å; A225-R227 PolarHBondContact O-N 2.82Å; R227-N229 VanDerWaalsContact C-N 3.34Å; R227-N229 PolarHBondContact O-N 2.7Å; R227-M230 HydrophobicContact CB-CE 4.37Å; R227-M230 HydrophobicContact CG-CE 3.88Å; R227-M230 PolarHBondContact O-N 2.92Å; R227-Q231 WeakPolarHBondContact O-CG 3.46Å; R227-Q231 PolarHBondContact O-N 3.29Å
228	F	98.6	Very high	97.5	Very high	30 Å²	30	44 Å²	44	13%	0.132	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-41.7	174.4	-72.5	-62.8	0	0	0	112.1	H132 Y133 R136 R224 A225 F226 M230 Q231 V232	H132-F228 HydrophobicContact CB-CD1 4.39Å; H132-F228 HydrophobicContact CB-CE1 4.09Å; Y133-F228 HydrophobicContact CD1-CB 3.87Å; Y133-F228 HydrophobicContact CD2-CB 3.5Å; Y133-F228 HydrophobicContact CD2-CD1 4.42Å; Y133-F228 AromaticContact CD2-CD2 3.58Å; Y133-F228 HydrophobicContact CD2-CD2 3.58Å; Y133-F228 HydrophobicContact CD2-CE2 4.42Å; Y133-F228 AromaticContact CD2-CG 3.59Å; Y133-F228 HydrophobicContact CD2-CG 3.59Å; Y133-F228 HydrophobicContact CE1-CB 4.32Å; Y133-F228 HydrophobicContact CE2-CB 3.98Å; Y133-F228 AromaticContact CE2-CD2 3.96Å; Y133-F228 HydrophobicContact CE2-CD2 3.96Å; Y133-F228 HydrophobicContact CE2-CG 4.25Å; Y133-F228 HydrophobicContact CG-CB 3.45Å; Y133-F228 VanDerWaalsContact CG-CB 3.45Å; Y133-F228 HydrophobicContact CG-CD2 4.35Å; Y133-F228 AromaticContact CG-CG 3.89Å; Y133-F228 HydrophobicContact CG-CG 3.89Å; R136-F228 HydrophobicContact CB-CE2 3.78Å; R136-F228 HydrophobicContact CB-CZ 3.77Å; R136-F228 HydrophobicContact CG-CE2 3.74Å; R136-F228 HydrophobicContact CG-CZ 4.09Å; R224-F228 HydrophobicContact CB-CE2 4.41Å; R224-F228 WeakPolarHBondContact O-CD2 3.34Å; R224-F228 PolarHBondContact O-N 3.03Å; A225-F228 PolarHBondContact O-N 3.35Å; F226-F228 PolarHBondContact O-N 3.47Å; F228-M230 PolarHBondContact O-N 3.34Å; F228-Q231 PolarHBondContact O-N 2.9Å; F228-V232 WeakPolarHBondContact O-CG2 3.48Å; F228-V232 PolarHBondContact O-N 3.38Å; F228-V232 VanDerWaalsContact O-N 3.08Å
229	N	96.5	Very high	97.2	Very high	14 Å²	14	46.7 Å²	46.7	8%	0.075	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-43.8	175.5	-74.6	-84.6	0	0	0	111.8	R155 A225 F226 R227 Q231 V232 F233	R155-N229 PolarHBondContact NH1-OD1 3.09Å; A225-N229 PolarHBondContact O-N 2.83Å; A225-N229 VanDerWaalsContact O-N 3.1Å; A225-N229 PolarHBondContact O-ND2 2.84Å; F226-N229 WeakPolarHBondContact O-CB 3.2Å; F226-N229 PolarHBondContact O-N 3.17Å; R227-N229 VanDerWaalsContact C-N 3.34Å; R227-N229 PolarHBondContact O-N 2.7Å; N229-Q231 VanDerWaalsContact C-N 3.34Å; N229-Q231 PolarHBondContact O-N 2.74Å; N229-V232 PolarHBondContact O-N 3.3Å; N229-F233 HydrophobicContact CB-CE2 4.34Å; N229-F233 WeakPolarHBondContact O-CD2 3.3Å; N229-F233 VanDerWaalsContact O-CG 3.28Å; N229-F233 WeakPolarHBondContact O-CG 3.49Å; N229-F233 PolarHBondContact O-N 3.46Å
230	M	96.3	Very high	96.9	Very high	41 Å²	41	46.2 Å²	46.2	20%	0.202	22%	0.215	C	C	.	.	H	α-helix	trans	-62.3	-40.1	176.3	-68.9	-173.4	-67.4	0	0	112.1	H46 A47 F226 R227 F228 V232 F233 D234	H46-M230 HydrophobicContact CB-SD 4.02Å; A47-M230 HydrophobicContact CB-CG 4.37Å; F226-M230 WeakPolarHBondContact O-CG 3.43Å; F226-M230 PolarHBondContact O-N 3.44Å; R227-M230 HydrophobicContact CB-CE 4.37Å; R227-M230 HydrophobicContact CG-CE 3.88Å; R227-M230 PolarHBondContact O-N 2.92Å; F228-M230 PolarHBondContact O-N 3.34Å; M230-V232 VanDerWaalsContact C-N 3.32Å; M230-V232 PolarHBondContact O-N 2.98Å; M230-F233 PolarHBondContact O-N 3Å; M230-D234 WeakPolarHBondContact O-CB 3.49Å; M230-D234 VanDerWaalsContact O-CG 3.29Å; M230-D234 PolarHBondContact O-N 3.28Å
231	Q	98.1	Very high	96.4	Very high	88 Å²	88	47 Å²	47	41%	0.411	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-40.1	175.5	-72.4	171.8	-8.4	0	0	112.4	A129 R227 F228 N229 D234 E235	A129-Q231 HydrophobicContact CB-CB 4.36Å; R227-Q231 WeakPolarHBondContact O-CG 3.46Å; R227-Q231 PolarHBondContact O-N 3.29Å; F228-Q231 PolarHBondContact O-N 2.9Å; N229-Q231 VanDerWaalsContact C-N 3.34Å; N229-Q231 PolarHBondContact O-N 2.74Å; Q231-D234 PolarHBondContact O-N 3.07Å; Q231-E235 WeakPolarHBondContact O-CB 3.45Å; Q231-E235 PolarHBondContact O-N 3.29Å
232	V	98	Very high	96	Very high	11 Å²	11	51 Å²	51	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-44.7	174.1	172.7	0	0	0	0	110.7	A72 A129 F228 N229 M230 D234 E235 L236	A72-V232 HydrophobicContact CB-CG1 3.82Å; A129-V232 HydrophobicContact CB-CG2 4.03Å; F228-V232 WeakPolarHBondContact O-CG2 3.48Å; F228-V232 PolarHBondContact O-N 3.38Å; F228-V232 VanDerWaalsContact O-N 3.08Å; N229-V232 PolarHBondContact O-N 3.3Å; M230-V232 VanDerWaalsContact C-N 3.32Å; M230-V232 PolarHBondContact O-N 2.98Å; V232-D234 PolarHBondContact O-N 2.76Å; V232-E235 PolarHBondContact O-N 3.05Å; V232-L236 HydrophobicContact CG1-CD1 3.88Å; V232-L236 HydrophobicContact CG1-CG 4.41Å; V232-L236 VanDerWaalsContact O-CG 3.26Å; V232-L236 WeakPolarHBondContact O-CG 3.49Å; V232-L236 PolarHBondContact O-N 3.36Å
233	F	95.9	Very high	95.4	Very high	41 Å²	41	53.8 Å²	53.8	18%	0.18	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-42.3	176.4	-62.5	-27.3	0	0	0	112.7	F52 V53 N229 M230 E235 L236 D237	F52-F233 HydrophobicContact CB-CB 3.97Å; F52-F233 HydrophobicContact CD1-CB 4.11Å; F52-F233 AromaticContact CD1-CD1 3.56Å; F52-F233 HydrophobicContact CD1-CD1 3.56Å; F52-F233 HydrophobicContact CD1-CE1 4.15Å; F52-F233 AromaticContact CD1-CG 3.89Å; F52-F233 HydrophobicContact CD1-CG 3.89Å; F52-F233 AromaticContact CE1-CD1 3.76Å; F52-F233 HydrophobicContact CE1-CD1 3.76Å; F52-F233 HydrophobicContact CE1-CE1 4.09Å; F52-F233 HydrophobicContact CG-CB 4.13Å; F52-F233 HydrophobicContact CG-CD1 4.35Å; F52-F233 HydrophobicContact CG-CG 4.42Å; V53-F233 HydrophobicContact CG2-CD2 4.2Å; V53-F233 HydrophobicContact CG2-CE2 3.97Å; V53-F233 HydrophobicContact CG2-CZ 4.36Å; N229-F233 HydrophobicContact CB-CE2 4.34Å; N229-F233 WeakPolarHBondContact O-CD2 3.3Å; N229-F233 VanDerWaalsContact O-CG 3.28Å; N229-F233 WeakPolarHBondContact O-CG 3.49Å; N229-F233 PolarHBondContact O-N 3.46Å; M230-F233 PolarHBondContact O-N 3Å; F233-E235 VanDerWaalsContact C-N 3.35Å; F233-E235 PolarHBondContact O-N 3.21Å; F233-L236 PolarHBondContact O-N 3.43Å; F233-D237 WeakPolarHBondContact O-CB 3.36Å; F233-D237 PolarHBondContact O-N 3.41Å
234	D	96.3	Very high	94.3	Very high	86 Å²	86	58.2 Å²	58.2	46%	0.46	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-38.4	177.6	-72.8	-15.5	0	0	0	112.1	M230 Q231 V232 K238	M230-D234 WeakPolarHBondContact O-CB 3.49Å; M230-D234 VanDerWaalsContact O-CG 3.29Å; M230-D234 PolarHBondContact O-N 3.28Å; Q231-D234 PolarHBondContact O-N 3.07Å; V232-D234 PolarHBondContact O-N 2.76Å; D234-K238 WeakPolarHBondContact O-CD 3.43Å; D234-K238 VanDerWaalsContact O-CG 3.25Å; D234-K238 WeakPolarHBondContact O-CG 3.45Å; D234-K238 PolarHBondContact O-N 2.97Å; D234-K238 VanDerWaalsContact O-N 3.17Å
235	E	96.9	Very high	92.4	Very high	43 Å²	43	62.7 Å²	62.7	20%	0.201	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-46	174.4	-173.8	-175.9	-118.3	0	0	111.1	S127 E128 A129 Q231 V232 F233 K238 I239	S127-E235 WeakPolarHBondContact CB-OE2 3.18Å; S127-E235 PolarHBondContact OG-OE2 3.13Å; E128-E235 PolarHBondContact N-OE1 3.37Å; A129-E235 HydrophobicContact CB-CB 4.1Å; A129-E235 HydrophobicContact CB-CG 4.48Å; A129-E235 WeakPolarHBondContact CB-OE2 3.45Å; A129-E235 PolarHBondContact N-OE1 2.6Å; Q231-E235 WeakPolarHBondContact O-CB 3.45Å; Q231-E235 PolarHBondContact O-N 3.29Å; V232-E235 PolarHBondContact O-N 3.05Å; F233-E235 VanDerWaalsContact C-N 3.35Å; F233-E235 PolarHBondContact O-N 3.21Å; E235-K238 PolarHBondContact O-N 3.07Å; E235-I239 HydrophobicContact CG-CD1 4.17Å; E235-I239 WeakPolarHBondContact O-CG1 3.44Å; E235-I239 PolarHBondContact O-N 2.91Å
236	L	95.9	Very high	90.2	Very high	7 Å²	7	70.1 Å²	70.1	4%	0.037	35%	0.351	C	S	.	.	H	α-helix	trans	-64.9	-39.7	178.5	-68.7	169	0	0	0	112.7	F52 V65 L68 A69 V232 F233 I239 G240	F52-L236 HydrophobicContact CD2-CB 4.06Å; F52-L236 HydrophobicContact CE2-CB 3.74Å; F52-L236 HydrophobicContact CE2-CD1 4.14Å; F52-L236 HydrophobicContact CZ-CB 4.43Å; F52-L236 HydrophobicContact CZ-CD1 3.98Å; V65-L236 HydrophobicContact CG1-CB 4.3Å; L68-L236 HydrophobicContact CB-CD2 3.62Å; A69-L236 HydrophobicContact CB-CD1 3.72Å; V232-L236 HydrophobicContact CG1-CD1 3.88Å; V232-L236 HydrophobicContact CG1-CG 4.41Å; V232-L236 VanDerWaalsContact O-CG 3.26Å; V232-L236 WeakPolarHBondContact O-CG 3.49Å; V232-L236 PolarHBondContact O-N 3.36Å; F233-L236 PolarHBondContact O-N 3.43Å; L236-I239 PolarHBondContact O-N 3.48Å; L236-G240 PolarHBondContact O-N 3.41Å
237	D	94.1	Very high	87.5	Confident	32 Å²	32	73.7 Å²	73.7	17%	0.171	38%	0.384	C	S	.	.	H	α-helix	trans	-62.9	-45	176.3	-172.2	63	0	0	0	110.9	K51 F233 I239 G240 M241	K51-D237 IonicContact NZ-OD1 3.61Å; K51-D237 PolarHBondContact NZ-OD1 3.07Å; K51-D237 IonicContact NZ-OD2 3.59Å; F233-D237 WeakPolarHBondContact O-CB 3.36Å; F233-D237 PolarHBondContact O-N 3.41Å; D237-I239 PolarHBondContact O-N 2.82Å; D237-G240 PolarHBondContact O-N 3.1Å; D237-G240 VanDerWaalsContact O-N 3.15Å; D237-M241 WeakPolarHBondContact O-CG 3.45Å; D237-M241 PolarHBondContact O-N 3.33Å
238	K	94.4	Very high	85	Confident	146 Å²	146	75.5 Å²	75.5	64%	0.635	40%	0.397	S	S	*	.	H	α-helix	trans	-59.6	-44.4	175.2	-71.8	167.9	-170.8	168.5	0	112.2	D234 E235 M241 S242	D234-K238 WeakPolarHBondContact O-CD 3.43Å; D234-K238 VanDerWaalsContact O-CG 3.25Å; D234-K238 WeakPolarHBondContact O-CG 3.45Å; D234-K238 PolarHBondContact O-N 2.97Å; D234-K238 VanDerWaalsContact O-N 3.17Å; E235-K238 PolarHBondContact O-N 3.07Å; K238-M241 PolarHBondContact O-N 2.87Å; K238-S242 PolarHBondContact O-N 3.44Å
239	I	93.5	Very high	82.3	Confident	57 Å²	57	82.1 Å²	82.1	29%	0.292	43%	0.434	S	S	.	.	H	α-helix	trans	-62	-46.5	175.3	-66.4	165.5	0	0	0	109.7	L68 E235 L236 D237 M241 S242 L243	L68-I239 HydrophobicContact CD1-CD1 4.35Å; L68-I239 HydrophobicContact CD1-CG2 3.75Å; E235-I239 HydrophobicContact CG-CD1 4.17Å; E235-I239 WeakPolarHBondContact O-CG1 3.44Å; E235-I239 PolarHBondContact O-N 2.91Å; L236-I239 PolarHBondContact O-N 3.48Å; D237-I239 PolarHBondContact O-N 2.82Å; I239-M241 VanDerWaalsContact C-N 3.28Å; I239-M241 PolarHBondContact O-N 3.18Å; I239-S242 PolarHBondContact O-N 3.25Å; I239-S242 PolarHBondContact O-OG 3.11Å; I239-L243 HydrophobicContact CG2-CD1 4.31Å; I239-L243 HydrophobicContact CG2-CG 4.39Å; I239-L243 WeakPolarHBondContact O-CG 3.33Å; I239-L243 PolarHBondContact O-N 2.84Å; I239-L243 VanDerWaalsContact O-N 3.07Å
240	G	91.6	Very high	79.8	Confident	12 Å²	12	84.5 Å²	84.5	12%	0.124	46%	0.462	C	S	.	.	H	α-helix	trans	-58.6	-35.9	179	0	0	0	0	0	114.1	K62 V65 L236 D237	K62-G240 PolarHBondContact NZ-O 3.34Å; V65-G240 VanDerWaalsContact CG2-CA 3.45Å; L236-G240 PolarHBondContact O-N 3.41Å; D237-G240 PolarHBondContact O-N 3.1Å; D237-G240 VanDerWaalsContact O-N 3.15Å
241	M	89.6	Confident	76.8	Confident	137 Å²	137	85.6 Å²	85.6	68%	0.675	48%	0.484	S	S	*	.	H	α-helix	trans	-68.6	-32.4	173.3	-69.1	176.5	69.1	0	0	112.9	D237 K238 I239	D237-M241 WeakPolarHBondContact O-CG 3.45Å; D237-M241 PolarHBondContact O-N 3.33Å; K238-M241 PolarHBondContact O-N 2.87Å; I239-M241 VanDerWaalsContact C-N 3.28Å; I239-M241 PolarHBondContact O-N 3.18Å
242	S	88.9	Confident	74	Confident	88 Å²	88	87.6 Å²	87.6	62%	0.615	50%	0.502	S	S	*	.	H	α-helix	trans	-80.6	-24.1	-179.6	74.3	0	0	0	0	114	K238 I239 T244	K238-S242 PolarHBondContact O-N 3.44Å; I239-S242 PolarHBondContact O-N 3.25Å; I239-S242 PolarHBondContact O-OG 3.11Å; S242-T244 PolarHBondContact O-N 3.31Å
243	L	87.3	Confident	71.1	Confident	59 Å²	59	92.5 Å²	92.5	31%	0.309	53%	0.534	S	S	.	.	S	Bend	trans	-68.8	118.2	176.6	-69.2	171.4	0	0	0	109.6	K62 E64 V65 I239	K62-L243 HydrophobicContact CD-CB 4.28Å; K62-L243 PolarHBondContact NZ-O 3.32Å; E64-L243 HydrophobicContact CB-CD1 4Å; V65-L243 HydrophobicContact CG2-CD1 3.78Å; I239-L243 HydrophobicContact CG2-CD1 4.31Å; I239-L243 HydrophobicContact CG2-CG 4.39Å; I239-L243 WeakPolarHBondContact O-CG 3.33Å; I239-L243 PolarHBondContact O-N 2.84Å; I239-L243 VanDerWaalsContact O-N 3.07Å
244	T	74.6	Confident	68.5	Low	120 Å²	120	98.4 Å²	98.4	74%	0.736	57%	0.566	S	S	*	*			trans	-59.1	144.9	167.1	45.7	0	0	0	0	109.5	S242 E246	S242-T244 PolarHBondContact O-N 3.31Å; T244-E246 PolarHBondContact O-N 2.93Å
245	E	59.2	Low	66.2	Low	172 Å²	172	100.5 Å²	100.5	80%	0.804	57%	0.573	S	S	*	*			trans	-60.8	101.8	170.7	-71.2	-176.5	165	0	0	108.5	A247	E245-A247 PolarHBondContact O-N 2.8Å
246	E	52.6	Low	64.1	Low	155 Å²	155	104.1 Å²	104.1	72%	0.724	59%	0.594	S	S	*	*			trans	-63	122.6	159.7	-71.6	-175	172.1	0	0	106.2	T244 Q248	T244-E246 PolarHBondContact O-N 2.93Å; E246-Q248 PolarHBondContact O-N 3.36Å
247	A	41.3	Very low	62.1	Low	97 Å²	97	107.1 Å²	107.1	80%	0.802	63%	0.626	S	S	*	*			trans	-50.4	112.7	175.2	0	0	0	0	0	107.6	E245 D249	E245-A247 PolarHBondContact O-N 2.8Å; A247-D249 PolarHBondContact O-N 3.41Å
248	Q	46.5	Very low	60.1	Low	149 Å²	149	114.4 Å²	114.4	70%	0.696	66%	0.656	S	S	*	*			trans	-52.5	114.5	173.7	-71.6	-180	-1.4	0	0	107.3	E246 G250 G251	E246-Q248 PolarHBondContact O-N 3.36Å; Q248-G250 PolarHBondContact O-N 2.84Å; Q248-G250 VanDerWaalsContact O-N 3.09Å; Q248-G251 PolarHBondContact O-N 3.2Å
249	D	41.2	Very low	58.2	Low	169 Å²	169	109 Å²	109	90%	0.904	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	119.1	178.2	-167.8	15.1	0	0	0	108.8	A247	A247-D249 PolarHBondContact O-N 3.41Å
250	G	43.6	Very low	56.2	Low	64 Å²	64	110.2 Å²	110.2	66%	0.66	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.8	26.6	174.7	0	0	0	0	0	118.5	Q248 V252	Q248-G250 PolarHBondContact O-N 2.84Å; Q248-G250 VanDerWaalsContact O-N 3.09Å; G250-V252 PolarHBondContact O-N 3.46Å
251	G	33.2	Very low	54.2	Low	65 Å²	65	114.3 Å²	114.3	67%	0.67	67%	0.668	S	S	*	*			trans	-60.7	103.2	172.6	0	0	0	0	0	114.1	Q248	Q248-G251 PolarHBondContact O-N 3.2Å
252	V	39.4	Very low	52.4	Low	129 Å²	129	117.9 Å²	117.9	78%	0.782	67%	0.674	S	S	*	*			trans	-62.9	134.5	151.6	179.7	0	0	0	0	106.7	G250 I254	G250-V252 PolarHBondContact O-N 3.46Å; V252-I254 PolarHBondContact O-N 3.35Å
253	P	36.7	Very low	50.6	Low	114 Å²	114	122 Å²	122	74%	0.74	68%	0.681	S	S	*	*			trans	-57.3	126.4	-174.9	-21.5	30.8	0	0	0	111.3	H255	P253-H255 PolarHBondContact O-N 3.44Å; P253-H255 VanDerWaalsContact O-N 3.1Å
254	I	42.4	Very low	48.4	Very low	166 Å²	166	121.1 Å²	121.1	85%	0.851	68%	0.679	S	S	*	*			trans	-63.7	110.7	163.5	-63.4	179.1	0	0	0	106.1	V252 D256	V252-I254 PolarHBondContact O-N 3.35Å; I254-D256 PolarHBondContact O-N 3.26Å
255	H	48.3	Very low	47.1	Very low	130 Å²	130	121 Å²	121	60%	0.602	68%	0.68	S	S	*	*			trans	-71.3	116.2	179.5	-143.5	-59.3	0	0	0	108.4	P253 G257	P253-H255 PolarHBondContact O-N 3.44Å; P253-H255 VanDerWaalsContact O-N 3.1Å; H255-G257 PolarHBondContact O-N 3.04Å
256	D	52	Low	46.3	Very low	119 Å²	119	122.7 Å²	122.7	64%	0.636	68%	0.68	S	S	*	*			trans	-70.9	15.6	-178.7	66.3	-6	0	0	0	114.8	I254 K258	I254-D256 PolarHBondContact O-N 3.26Å; D256-K258 PolarHBondContact O-N 3.46Å; D256-K258 PolarHBondContact OD1-N 3.39Å
257	G	54.3	Low	45.8	Very low	70 Å²	70	121 Å²	121	72%	0.722	67%	0.668	S	S	*	*	S	Bend	trans	60.4	8.5	-176.2	0	0	0	0	0	115.3	H255	H255-G257 PolarHBondContact O-N 3.04Å
258	K	51.9	Low	46	Very low	185 Å²	185	119.8 Å²	119.8	80%	0.804	66%	0.658	S	S	*	*			trans	-114.9	17.8	-173.7	-76.2	-177.4	177.5	176.8	0	114.8	D256	D256-K258 PolarHBondContact O-N 3.46Å; D256-K258 PolarHBondContact OD1-N 3.39Å
259	G	53.5	Low	45.7	Very low	33 Å²	33	118.7 Å²	118.7	34%	0.34	66%	0.657	S	S	.	*	S	Bend	trans	-93.2	147.8	171.1	0	0	0	0	0	113.2	L261	G259-L261 PolarHBondContact O-N 3.4Å
260	D	52.7	Low	45.6	Very low	81 Å²	81	118.6 Å²	118.6	43%	0.433	65%	0.649	S	S	.	*			trans	-56.5	107.7	172.1	-175	1.3	0	0	0	110	R262 K263	D260-R262 PolarHBondContact O-N 3.36Å; D260-R262 IonicContact OD1-CZ 2.77Å; D260-R262 PolarHBondContact OD1-N 3.33Å; D260-R262 IonicContact OD1-NE 2.85Å; D260-R262 PolarHBondContact OD1-NE 3.04Å; D260-R262 IonicContact OD1-NH2 3.26Å; D260-R262 IonicContact OD2-NE 3.36Å; D260-R262 IonicContact OD2-NH2 2.56Å; D260-K263 PolarHBondContact O-N 2.94Å
261	L	47.9	Very low	45.3	Very low	98 Å²	98	123.4 Å²	123.4	51%	0.513	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-53.6	-21	-177.3	-86.9	118.1	0	0	0	113.6	G259 K263 C264 Y267	G259-L261 PolarHBondContact O-N 3.4Å; L261-K263 PolarHBondContact O-N 3.27Å; L261-C264 PolarHBondContact O-N 3.23Å; L261-Y267 HydrophobicContact CD2-CD1 4.17Å; L261-Y267 HydrophobicContact CD2-CD2 3.68Å; L261-Y267 HydrophobicContact CD2-CE1 3.93Å; L261-Y267 HydrophobicContact CD2-CE2 3.42Å; L261-Y267 VanDerWaalsContact CD2-CE2 3.42Å; L261-Y267 HydrophobicContact CD2-CG 4.05Å; L261-Y267 WeakPolarHBondContact O-CB 3.35Å
262	R	52.4	Low	45.7	Very low	213 Å²	213	124 Å²	124	80%	0.804	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-71.6	-11	176.3	-68.2	175.5	-75.1	-171.5	-6	114.3	D260	D260-R262 PolarHBondContact O-N 3.36Å; D260-R262 IonicContact OD1-CZ 2.77Å; D260-R262 PolarHBondContact OD1-N 3.33Å; D260-R262 IonicContact OD1-NE 2.85Å; D260-R262 PolarHBondContact OD1-NE 3.04Å; D260-R262 IonicContact OD1-NH2 3.26Å; D260-R262 IonicContact OD2-NE 3.36Å; D260-R262 IonicContact OD2-NH2 2.56Å
263	K	51.9	Low	45.4	Very low	175 Å²	175	121 Å²	121	76%	0.761	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-104.5	0.9	176.7	-66.4	-173.8	178.8	180	0	113.6	D260 L261	D260-K263 PolarHBondContact O-N 2.94Å; L261-K263 PolarHBondContact O-N 3.27Å
264	C	41.5	Very low	45.3	Very low	40 Å²	40	123.6 Å²	123.6	27%	0.27	66%	0.66	S	S	.	*			trans	-80.7	120.7	175.8	-177.6	0	0	0	0	109.7	L261 Y266 Y267	L261-C264 PolarHBondContact O-N 3.23Å; C264-Y266 PolarHBondContact O-N 3.34Å; C264-Y267 PolarHBondContact O-N 2.95Å
265	P	46.3	Very low	44.8	Very low	116 Å²	116	120.5 Å²	120.5	75%	0.753	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-17.9	-177.3	21.9	-30.8	0	0	0	113.3
266	Y	43.4	Very low	44.1	Very low	209 Å²	209	117.7 Å²	117.7	82%	0.82	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-14.7	176.1	-122.2	-90.1	0	0	0	114.3	C264	C264-Y266 PolarHBondContact O-N 3.34Å
267	Y	41.9	Very low	43.6	Very low	118 Å²	118	118.2 Å²	118.2	46%	0.463	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	-16.7	-177.5	-131.6	-94.8	0	0	0	113.3	L261 C264 D269 K270	L261-Y267 HydrophobicContact CD2-CD1 4.17Å; L261-Y267 HydrophobicContact CD2-CD2 3.68Å; L261-Y267 HydrophobicContact CD2-CE1 3.93Å; L261-Y267 HydrophobicContact CD2-CE2 3.42Å; L261-Y267 VanDerWaalsContact CD2-CE2 3.42Å; L261-Y267 HydrophobicContact CD2-CG 4.05Å; L261-Y267 WeakPolarHBondContact O-CB 3.35Å; C264-Y267 PolarHBondContact O-N 2.95Å; Y267-D269 PolarHBondContact O-N 2.91Å; Y267-K270 PolarHBondContact O-N 3.22Å
268	A	44.3	Very low	42.8	Very low	72 Å²	72	118.9 Å²	118.9	60%	0.595	68%	0.683	S	S	*	*	S	Bend	trans	-63.6	-30.5	172.2	0	0	0	0	0	112.3
269	D	41.6	Very low	42.3	Very low	127 Å²	127	114 Å²	114	68%	0.679	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-77.8	-20.8	-179.6	-79.3	-16.6	0	0	0	113.7	Y267 L271 A272	Y267-D269 PolarHBondContact O-N 2.91Å; D269-L271 VanDerWaalsContact C-N 3.34Å; D269-L271 PolarHBondContact O-N 3.32Å; D269-A272 PolarHBondContact O-N 3.37Å
270	K	38.7	Very low	41.8	Very low	166 Å²	166	117.7 Å²	117.7	72%	0.722	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-84.2	-5.5	-174.9	-124	178	-175.3	178.7	0	114.7	Y267	Y267-K270 PolarHBondContact O-N 3.22Å
271	L	37.6	Very low	41.5	Very low	166 Å²	166	122.3 Å²	122.3	87%	0.869	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-95.8	-7.3	166.2	-76.4	166	0	0	0	112.8	D269 G273	D269-L271 VanDerWaalsContact C-N 3.34Å; D269-L271 PolarHBondContact O-N 3.32Å; L271-G273 VanDerWaalsContact C-N 3.35Å
272	A	41.1	Very low	41.4	Very low	78 Å²	78	125 Å²	125	65%	0.645	71%	0.711	S	S	*	*			trans	-99.5	38.7	173.4	0	0	0	0	0	111.6	D269 N274	D269-A272 PolarHBondContact O-N 3.37Å; A272-N274 PolarHBondContact O-N 3.12Å; A272-N274 VanDerWaalsContact O-N 3.1Å
273	G	32.7	Very low	41.2	Very low	66 Å²	66	118.3 Å²	118.3	68%	0.68	70%	0.701	S	S	*	*			trans	-81.1	80.5	174.3	0	0	0	0	0	112	L271	L271-G273 VanDerWaalsContact C-N 3.35Å
274	N	34.8	Very low	41.2	Very low	167 Å²	167	112.7 Å²	112.7	89%	0.893	69%	0.688	S	S	*	*			trans	-165.3	84.4	145.2	-118.3	4.6	0	0	0	113	A272	A272-N274 PolarHBondContact O-N 3.12Å; A272-N274 VanDerWaalsContact O-N 3.1Å
275	A	32	Very low	42	Very low	102 Å²	102	113.7 Å²	113.7	84%	0.843	69%	0.692	S	S	*	*			trans	-176.1	130.5	140.4	0	0	0	0	0	109.6
276	G	34.1	Very low	42.5	Very low	71 Å²	71	112.7 Å²	112.7	73%	0.732	68%	0.684	S	S	*	*			trans	-72.5	-162.9	179.7	0	0	0	0	0	115.1
277	P	40.7	Very low	43.2	Very low	129 Å²	129	107.8 Å²	107.8	84%	0.838	67%	0.672	S	S	*	*	P	Polyproline II helix		-80.8	143.3	-123.5	29.2	-29.8	0	0	0	114.6	C279	P277-C279 PolarHBondContact O-N 3.32Å
278	G	38	Very low	43.9	Very low	85 Å²	85	104.2 Å²	104.2	88%	0.876	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-52.7	118	-177.1	0	0	0	0	0	113.5
279	C	40.4	Very low	45	Very low	81 Å²	81	107.9 Å²	107.9	55%	0.547	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-75.3	135.2	-178.4	-170.1	0	0	0	0	111	P277 Y281 H282	P277-C279 PolarHBondContact O-N 3.32Å; C279-Y281 PolarHBondContact O-N 3.44Å; C279-H282 PolarHBondContact O-N 3.49Å
280	P	43.2	Very low	46.8	Very low	112 Å²	112	106.7 Å²	106.7	73%	0.727	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-5.5	178.6	23.7	-33.3	0	0	0	114.5	H282	P280-H282 VanDerWaalsContact C-N 3.34Å; P280-H282 PolarHBondContact O-N 2.92Å
281	Y	46.5	Very low	48.5	Very low	177 Å²	177	103.5 Å²	103.5	69%	0.694	66%	0.655	S	S	*	*	H	α-helix	trans	-62.2	-35.4	175.2	-108.7	-97.1	0	0	0	113.7	C279 A283 A284 V285	C279-Y281 PolarHBondContact O-N 3.44Å; Y281-A283 PolarHBondContact O-N 2.97Å; Y281-A284 PolarHBondContact O-N 2.89Å; Y281-V285 HydrophobicContact CD1-CG2 4.37Å; Y281-V285 WeakPolarHBondContact O-CB 3.47Å; Y281-V285 WeakPolarHBondContact O-CG2 3.37Å; Y281-V285 PolarHBondContact O-N 3.41Å
282	H	45.9	Very low	50.5	Low	155 Å²	155	101.6 Å²	101.6	72%	0.718	65%	0.645	S	S	*	*	H	α-helix	trans	-75.1	-31.1	-169.1	-132.4	-71.3	0	0	0	113.1	C279 P280 T286	C279-H282 PolarHBondContact O-N 3.49Å; P280-H282 VanDerWaalsContact C-N 3.34Å; P280-H282 PolarHBondContact O-N 2.92Å; H282-T286 PolarHBondContact O-N 2.61Å; H282-T286 PolarHBondContact O-OG1 2.91Å
283	A	48.6	Very low	52	Low	72 Å²	72	99.8 Å²	99.8	60%	0.595	63%	0.626	S	S	*	*	H	α-helix	trans	-75	-34.6	173.3	0	0	0	0	0	112.3	Y281 T286 L287	Y281-A283 PolarHBondContact O-N 2.97Å; A283-T286 PolarHBondContact O-OG1 3.05Å; A283-L287 PolarHBondContact O-N 2.88Å
284	A	51.7	Low	54	Low	58 Å²	58	101.9 Å²	101.9	48%	0.479	62%	0.618	S	S	.	*	H	α-helix	trans	-68.6	-37	175.7	0	0	0	0	0	112.1	Y281 L287 A288	Y281-A284 PolarHBondContact O-N 2.89Å; A284-L287 PolarHBondContact O-N 3.25Å; A284-A288 WeakPolarHBondContact O-CB 3.46Å; A284-A288 PolarHBondContact O-N 3.42Å
285	V	58.1	Low	56.1	Low	61 Å²	61	100 Å²	100	37%	0.37	61%	0.607	S	S	.	*	H	α-helix	trans	-71	-32	179.6	171.5	0	0	0	0	112.4	Y281 K289	Y281-V285 HydrophobicContact CD1-CG2 4.37Å; Y281-V285 WeakPolarHBondContact O-CB 3.47Å; Y281-V285 WeakPolarHBondContact O-CG2 3.37Å; Y281-V285 PolarHBondContact O-N 3.41Å; V285-K289 WeakPolarHBondContact O-CG 3.39Å; V285-K289 PolarHBondContact O-N 2.87Å
286	T	56.6	Low	58.3	Low	94 Å²	94	100 Å²	100	58%	0.577	59%	0.592	S	S	*	*	H	α-helix	trans	-72.3	-37	173.5	16.6	0	0	0	0	112.4	H282 A283 K289	H282-T286 PolarHBondContact O-N 2.61Å; H282-T286 PolarHBondContact O-OG1 2.91Å; A283-T286 PolarHBondContact O-OG1 3.05Å; T286-K289 PolarHBondContact O-N 3.27Å
287	L	57.8	Low	60.1	Low	107 Å²	107	101.2 Å²	101.2	56%	0.56	58%	0.581	S	S	*	*	H	α-helix	trans	-68.8	-39.1	176.2	-145.4	84	0	0	0	111.8	A283 A284 K289 Q290	A283-L287 PolarHBondContact O-N 2.88Å; A284-L287 PolarHBondContact O-N 3.25Å; L287-K289 PolarHBondContact O-N 3.04Å; L287-Q290 PolarHBondContact O-N 3.32Å
288	A	57.9	Low	61.8	Low	43 Å²	43	98.1 Å²	98.1	36%	0.355	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.2	-13.7	179.1	0	0	0	0	0	114.6	A284 Q294	A284-A288 WeakPolarHBondContact O-CB 3.46Å; A284-A288 PolarHBondContact O-N 3.42Å; A288-Q294 VanDerWaalsContact O-CG 3.28Å; A288-Q294 WeakPolarHBondContact O-CG 3.46Å; A288-Q294 PolarHBondContact O-NE2 2.96Å
289	K	66.4	Low	63.6	Low	149 Å²	149	96.7 Å²	96.7	65%	0.648	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-1.6	176	-73.8	179.6	-179.2	-175.7	0	113.3	V285 T286 L287	V285-K289 WeakPolarHBondContact O-CG 3.39Å; V285-K289 PolarHBondContact O-N 2.87Å; T286-K289 PolarHBondContact O-N 3.27Å; L287-K289 PolarHBondContact O-N 3.04Å
290	Q	79.4	Confident	65.1	Low	102 Å²	102	96.6 Å²	96.6	48%	0.477	55%	0.545	S	S	.	.	S	Bend	trans	-71.9	133	175.2	-69.6	-169.4	-24.8	0	0	110.7	L287 I292 V293 Q294	L287-Q290 PolarHBondContact O-N 3.32Å; Q290-I292 PolarHBondContact O-N 3.19Å; Q290-I292 VanDerWaalsContact O-N 3.14Å; Q290-V293 HydrophobicContact CB-CB 4.3Å; Q290-V293 HydrophobicContact CB-CG2 3.99Å; Q290-V293 PolarHBondContact O-N 2.86Å; Q290-Q294 PolarHBondContact O-N 2.92Å; Q290-Q294 VanDerWaalsContact O-N 3.07Å
291	P	75.2	Confident	66.8	Low	98 Å²	98	96 Å²	96	64%	0.636	54%	0.54	S	S	*	.	H	α-helix	trans	-56.6	-35.7	-175	-24.9	32.3	0	0	0	113.7	L295	P291-L295 PolarHBondContact O-N 3.25Å; P291-L295 VanDerWaalsContact O-N 3.12Å
292	I	79.6	Confident	68.3	Low	126 Å²	126	90.7 Å²	90.7	65%	0.646	53%	0.532	S	S	*	.	H	α-helix	trans	-68.9	-40.9	179.6	-63.1	171.1	0	0	0	110.8	Q290 L295 I296	Q290-I292 PolarHBondContact O-N 3.19Å; Q290-I292 VanDerWaalsContact O-N 3.14Å; I292-L295 PolarHBondContact O-N 3.39Å; I292-I296 HydrophobicContact CG2-CD1 4.11Å; I292-I296 WeakPolarHBondContact O-CG1 3.33Å; I292-I296 PolarHBondContact O-N 3.22Å; I292-I296 VanDerWaalsContact O-N 3.12Å
293	V	73.4	Confident	69.7	Low	41 Å²	41	88.1 Å²	88.1	25%	0.248	53%	0.527	C	S	.	.	H	α-helix	trans	-69.8	-36	179.5	179.3	0	0	0	0	110.8	Q290 I296 L297	Q290-V293 HydrophobicContact CB-CB 4.3Å; Q290-V293 HydrophobicContact CB-CG2 3.99Å; Q290-V293 PolarHBondContact O-N 2.86Å; V293-I296 PolarHBondContact O-N 3.43Å; V293-L297 HydrophobicContact CG1-CD1 4.04Å; V293-L297 WeakPolarHBondContact O-CB 3.12Å; V293-L297 PolarHBondContact O-N 3.35Å
294	Q	73	Confident	70.8	Confident	109 Å²	109	87.6 Å²	87.6	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-67	-37.8	174.4	-68.2	-167.3	-20.5	0	0	113	A288 Q290 L297 A298	A288-Q294 VanDerWaalsContact O-CG 3.28Å; A288-Q294 WeakPolarHBondContact O-CG 3.46Å; A288-Q294 PolarHBondContact O-NE2 2.96Å; Q290-Q294 PolarHBondContact O-N 2.92Å; Q290-Q294 VanDerWaalsContact O-N 3.07Å; Q294-L297 PolarHBondContact O-N 3.21Å; Q294-A298 WeakPolarHBondContact O-CB 3.33Å; Q294-A298 PolarHBondContact O-N 3.2Å
295	L	79.8	Confident	71.9	Confident	128 Å²	128	87.6 Å²	87.6	67%	0.67	52%	0.523	S	S	*	.	H	α-helix	trans	-63	-42.8	173.4	-95.6	158.9	0	0	0	112.1	P291 I292 A298 A299	P291-L295 PolarHBondContact O-N 3.25Å; P291-L295 VanDerWaalsContact O-N 3.12Å; I292-L295 PolarHBondContact O-N 3.39Å; L295-A298 PolarHBondContact O-N 3.49Å; L295-A299 WeakPolarHBondContact O-CB 3.49Å; L295-A299 PolarHBondContact O-N 3.34Å
296	I	77.8	Confident	72.6	Confident	102 Å²	102	86.7 Å²	86.7	52%	0.523	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-45.2	177.6	-66.5	166.2	0	0	0	110.7	I292 V293 A298 A299 C300	I292-I296 HydrophobicContact CG2-CD1 4.11Å; I292-I296 WeakPolarHBondContact O-CG1 3.33Å; I292-I296 PolarHBondContact O-N 3.22Å; I292-I296 VanDerWaalsContact O-N 3.12Å; V293-I296 PolarHBondContact O-N 3.43Å; I296-A298 PolarHBondContact O-N 2.95Å; I296-A299 PolarHBondContact O-N 3.01Å; I296-C300 PolarHBondContact O-N 2.89Å; I296-C300 PolarHBondContact O-SG 3.02Å
297	L	72.8	Confident	73.3	Confident	97 Å²	97	86.3 Å²	86.3	51%	0.508	52%	0.524	S	S	.	.	H	α-helix	trans	-61.9	-43.2	177.3	-84.4	159.7	0	0	0	112.2	V293 Q294 A299 C300 V301	V293-L297 HydrophobicContact CG1-CD1 4.04Å; V293-L297 WeakPolarHBondContact O-CB 3.12Å; V293-L297 PolarHBondContact O-N 3.35Å; Q294-L297 PolarHBondContact O-N 3.21Å; L297-A299 PolarHBondContact O-N 3.01Å; L297-C300 PolarHBondContact O-N 2.96Å; L297-V301 WeakPolarHBondContact O-CG2 3.44Å; L297-V301 PolarHBondContact O-N 3.44Å
298	A	75.1	Confident	73.7	Confident	63 Å²	63	83.9 Å²	83.9	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-63.6	-40.5	177.1	0	0	0	0	0	112.2	Q294 L295 I296 V301 A302	Q294-A298 WeakPolarHBondContact O-CB 3.33Å; Q294-A298 PolarHBondContact O-N 3.2Å; L295-A298 PolarHBondContact O-N 3.49Å; I296-A298 PolarHBondContact O-N 2.95Å; A298-V301 PolarHBondContact O-N 3.44Å; A298-A302 PolarHBondContact O-N 2.94Å
299	A	76.5	Confident	74	Confident	56 Å²	56	84.2 Å²	84.2	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-43.3	175.4	0	0	0	0	0	112	L295 I296 L297 V301 A302 V303	L295-A299 WeakPolarHBondContact O-CB 3.49Å; L295-A299 PolarHBondContact O-N 3.34Å; I296-A299 PolarHBondContact O-N 3.01Å; L297-A299 PolarHBondContact O-N 3.01Å; A299-V301 PolarHBondContact O-N 2.95Å; A299-A302 PolarHBondContact O-N 3.32Å; A299-V303 WeakPolarHBondContact O-CG2 3.42Å; A299-V303 PolarHBondContact O-N 3.08Å
300	C	71.6	Confident	73.8	Confident	78 Å²	78	87.4 Å²	87.4	53%	0.527	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-39.4	177.5	-70.2	0	0	0	0	112.8	I296 L297 V303 A304	I296-C300 PolarHBondContact O-N 2.89Å; I296-C300 PolarHBondContact O-SG 3.02Å; L297-C300 PolarHBondContact O-N 2.96Å; C300-V303 PolarHBondContact O-N 3.23Å; C300-A304 WeakPolarHBondContact O-CB 3.36Å; C300-A304 PolarHBondContact O-N 3.45Å
301	V	79.1	Confident	72.6	Confident	101 Å²	101	92.2 Å²	92.2	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-67.4	-40.1	176.9	172.6	0	0	0	0	111.3	L297 A298 A299 A304 A305	L297-V301 WeakPolarHBondContact O-CG2 3.44Å; L297-V301 PolarHBondContact O-N 3.44Å; A298-V301 PolarHBondContact O-N 3.44Å; A299-V301 PolarHBondContact O-N 2.95Å; V301-A304 PolarHBondContact O-N 3.38Å; V301-A305 VanDerWaalsContact O-CB 3.29Å; V301-A305 WeakPolarHBondContact O-CB 3.08Å; V301-A305 PolarHBondContact O-N 3.08Å
302	A	77.1	Confident	71.8	Confident	65 Å²	65	93.8 Å²	93.8	54%	0.537	55%	0.552	S	S	.	*	H	α-helix	trans	-64	-40.4	176	0	0	0	0	0	112.2	A298 A299 G306	A298-A302 PolarHBondContact O-N 2.94Å; A299-A302 PolarHBondContact O-N 3.32Å; A302-G306 PolarHBondContact O-N 3.12Å
303	V	76.8	Confident	70.3	Confident	100 Å²	100	98 Å²	98	61%	0.606	57%	0.572	S	S	*	*	H	α-helix	trans	-65.5	-46.1	175	172.4	0	0	0	0	111	A299 C300 A305 G306 V307	A299-V303 WeakPolarHBondContact O-CG2 3.42Å; A299-V303 PolarHBondContact O-N 3.08Å; C300-V303 PolarHBondContact O-N 3.23Å; V303-A305 PolarHBondContact O-N 3.42Å; V303-G306 PolarHBondContact O-N 2.82Å; V303-V307 HydrophobicContact CG1-CG2 4.47Å; V303-V307 WeakPolarHBondContact O-CG2 3.4Å; V303-V307 PolarHBondContact O-N 3.15Å
304	A	72.2	Confident	70.1	Confident	61 Å²	61	100.9 Å²	100.9	50%	0.504	59%	0.588	S	S	.	*	H	α-helix	trans	-63.9	-40.4	178.7	0	0	0	0	0	112.4	C300 V301 V307 A308	C300-A304 WeakPolarHBondContact O-CB 3.36Å; C300-A304 PolarHBondContact O-N 3.45Å; V301-A304 PolarHBondContact O-N 3.38Å; A304-V307 PolarHBondContact O-N 3.21Å; A304-A308 VanDerWaalsContact O-CB 3.31Å; A304-A308 WeakPolarHBondContact O-CB 3.5Å; A304-A308 PolarHBondContact O-N 3.03Å
305	A	74.8	Confident	70	Confident	58 Å²	58	100.4 Å²	100.4	48%	0.479	59%	0.592	S	S	.	*	H	α-helix	trans	-66.3	-38.5	175.2	0	0	0	0	0	112	V301 V303 A308 A309	V301-A305 VanDerWaalsContact O-CB 3.29Å; V301-A305 WeakPolarHBondContact O-CB 3.08Å; V301-A305 PolarHBondContact O-N 3.08Å; V303-A305 PolarHBondContact O-N 3.42Å; A305-A308 PolarHBondContact O-N 3.28Å; A305-A309 VanDerWaalsContact O-CB 3.29Å; A305-A309 WeakPolarHBondContact O-CB 3.1Å; A305-A309 PolarHBondContact O-N 2.81Å
306	G	72	Confident	69.4	Low	43 Å²	43	98.9 Å²	98.9	44%	0.443	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-43	174.1	0	0	0	0	0	112.9	A302 V303 A309 W310	A302-G306 PolarHBondContact O-N 3.12Å; V303-G306 PolarHBondContact O-N 2.82Å; G306-A309 PolarHBondContact O-N 2.91Å; G306-W310 WeakPolarHBondContact O-CB 3.47Å; G306-W310 PolarHBondContact O-N 2.85Å
307	V	71.4	Confident	68.9	Low	86 Å²	86	98.7 Å²	98.7	52%	0.521	59%	0.592	S	S	.	*	H	α-helix	trans	-66.8	-41.2	176.5	172.5	0	0	0	0	111.3	V303 A304 W310 Y311	V303-V307 HydrophobicContact CG1-CG2 4.47Å; V303-V307 WeakPolarHBondContact O-CG2 3.4Å; V303-V307 PolarHBondContact O-N 3.15Å; A304-V307 PolarHBondContact O-N 3.21Å; V307-W310 PolarHBondContact O-N 3.34Å; V307-Y311 PolarHBondContact O-N 2.91Å; V307-Y311 VanDerWaalsContact O-N 3.13Å
308	A	65.3	Low	68.7	Low	55 Å²	55	98.8 Å²	98.8	46%	0.455	60%	0.597	S	S	.	*	H	α-helix	trans	-66.3	-40	176.5	0	0	0	0	0	112.2	A304 A305 W310 Y311 V312	A304-A308 VanDerWaalsContact O-CB 3.31Å; A304-A308 WeakPolarHBondContact O-CB 3.5Å; A304-A308 PolarHBondContact O-N 3.03Å; A305-A308 PolarHBondContact O-N 3.28Å; A308-W310 VanDerWaalsContact C-N 3.34Å; A308-Y311 PolarHBondContact O-N 3.48Å; A308-V312 WeakPolarHBondContact O-CG2 3.27Å; A308-V312 PolarHBondContact O-N 3.24Å
309	A	65.5	Low	68.3	Low	51 Å²	51	101.2 Å²	101.2	42%	0.421	60%	0.602	S	S	.	*	H	α-helix	trans	-66.8	-33.6	175.7	0	0	0	0	0	112.6	A305 G306 Y311	A305-A309 VanDerWaalsContact O-CB 3.29Å; A305-A309 WeakPolarHBondContact O-CB 3.1Å; A305-A309 PolarHBondContact O-N 2.81Å; G306-A309 PolarHBondContact O-N 2.91Å; A309-Y311 VanDerWaalsContact C-N 3.32Å
310	W	61.7	Low	67.7	Low	215 Å²	215	104.4 Å²	104.4	81%	0.814	61%	0.612	S	S	*	*	H	α-helix	trans	-68.1	-30.1	173	-166.4	-75.7	0	0	0	112.9	G306 V307 A308 V312	G306-W310 WeakPolarHBondContact O-CB 3.47Å; G306-W310 PolarHBondContact O-N 2.85Å; V307-W310 PolarHBondContact O-N 3.34Å; A308-W310 VanDerWaalsContact C-N 3.34Å; W310-V312 VanDerWaalsContact C-N 3.35Å
311	Y	53	Low	67.4	Low	203 Å²	203	106.5 Å²	106.5	80%	0.796	62%	0.619	S	S	*	*	H	α-helix	trans	-81.6	-12.7	-178.6	-120	-85.9	0	0	0	114.2	V307 A308 A309	V307-Y311 PolarHBondContact O-N 2.91Å; V307-Y311 VanDerWaalsContact O-N 3.13Å; A308-Y311 PolarHBondContact O-N 3.48Å; A309-Y311 VanDerWaalsContact C-N 3.32Å
312	V	59.7	Low	66.4	Low	131 Å²	131	106.9 Å²	106.9	79%	0.794	62%	0.619	S	S	*	*	H	α-helix	trans	-110.3	-7.8	-174.4	178.3	0	0	0	0	112.4	A308 W310	A308-V312 WeakPolarHBondContact O-CG2 3.27Å; A308-V312 PolarHBondContact O-N 3.24Å; W310-V312 VanDerWaalsContact C-N 3.35Å
313	M	47.4	Very low	65.4	Low	215 Å²	215	110.7 Å²	110.7	100%	1.059	63%	0.627	S	S	*	*			trans	-98	0	166.3	-81.9	-172.2	-76.2	0	0	111

Retrieved 313 of 313 residues in 108 ms (Link to these results)

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