A0A061ICQ0_CRIGR Loading...

NAD(P)(+)--arginine ADP-ribosyltransferase

AlphaFold DB , UniProt , Accession A0A061ICQ0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Art5, Length 309 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	55.6	Low	55.1	Low	201 Å²	201	127.1 Å²	127.1	99%	0.99	67%	0.666	S	S	*	*				0	-40.7	0	-86.7	171.5	59.2	0	0	113.2	L3	M1-L3 PolarHBondContact O-N 3.47Å
2	I	58.8	Low	54.9	Low	154 Å²	154	122.6 Å²	122.6	79%	0.79	65%	0.651	S	S	*	*	H	α-helix	trans	-74.2	-21.4	-171.9	-53.1	179.6	0	0	0	114.2
3	L	53	Low	54.5	Low	144 Å²	144	122.2 Å²	122.2	75%	0.754	65%	0.649	S	S	*	*	H	α-helix	trans	-83.3	-31.2	-176.9	-159.8	70.4	0	0	0	113.6	M1 L7	M1-L3 PolarHBondContact O-N 3.47Å; L3-L7 PolarHBondContact O-N 3.06Å
4	E	52.8	Low	54.1	Low	160 Å²	160	117.2 Å²	117.2	75%	0.748	64%	0.641	S	S	*	*	H	α-helix	trans	-72.5	-40.4	179.1	-64.6	-104.8	142.1	0	0	110.9	L6 L7 M8	E4-L6 VanDerWaalsContact C-N 3.31Å; E4-L6 PolarHBondContact O-N 3.46Å; E4-L7 PolarHBondContact O-N 3.1Å; E4-M8 PolarHBondContact O-N 2.99Å
5	D	55	Low	53.8	Low	109 Å²	109	117.9 Å²	117.9	58%	0.583	64%	0.642	S	S	*	*	H	α-helix	trans	-66	-33.5	177.1	-68.2	-29.6	0	0	0	112	V9	D5-V9 WeakPolarHBondContact O-CG2 3.22Å; D5-V9 PolarHBondContact O-N 2.7Å
6	L	54.1	Low	53.2	Low	105 Å²	105	120.6 Å²	120.6	55%	0.55	65%	0.649	S	S	.	*	H	α-helix	trans	-70.9	-35.1	178.5	-163.2	72.1	0	0	0	112	E4 V9 L10	E4-L6 VanDerWaalsContact C-N 3.31Å; E4-L6 PolarHBondContact O-N 3.46Å; L6-V9 PolarHBondContact O-N 3.41Å; L6-L10 HydrophobicContact CG-CD1 4.38Å; L6-L10 PolarHBondContact O-N 3.44Å; L6-L10 VanDerWaalsContact O-N 3.11Å
7	L	55.1	Low	52.8	Low	133 Å²	133	120.8 Å²	120.8	70%	0.696	66%	0.655	S	S	*	*	H	α-helix	trans	-71.6	-34.4	179.2	-150.1	76.5	0	0	0	111.9	L3 E4 S11	L3-L7 PolarHBondContact O-N 3.06Å; E4-L7 PolarHBondContact O-N 3.1Å; L7-S11 WeakPolarHBondContact O-CB 3.26Å; L7-S11 PolarHBondContact O-N 3.36Å
8	M	55.8	Low	52.6	Low	124 Å²	124	122.1 Å²	122.1	61%	0.611	66%	0.661	S	S	*	*	H	α-helix	trans	-67.4	-39.1	172.9	-84.4	-73	-69.3	0	0	112.5	E4 S11 C12	E4-M8 PolarHBondContact O-N 2.99Å; M8-S11 PolarHBondContact O-N 3.24Å; M8-C12 WeakPolarHBondContact O-CB 3.22Å; M8-C12 PolarHBondContact O-N 3.46Å; M8-C12 PolarHBondContact O-SG 3.48Å
9	V	56.3	Low	52.3	Low	83 Å²	83	127.6 Å²	127.6	50%	0.503	67%	0.672	S	S	.	*	H	α-helix	trans	-68.9	-38.7	177.2	172.4	0	0	0	0	111.6	D5 L6 C12 L13	D5-V9 WeakPolarHBondContact O-CG2 3.22Å; D5-V9 PolarHBondContact O-N 2.7Å; L6-V9 PolarHBondContact O-N 3.41Å; V9-C12 PolarHBondContact O-N 3.3Å; V9-L13 HydrophobicContact CG1-CD1 3.62Å; V9-L13 HydrophobicContact CG1-CG 4.5Å; V9-L13 WeakPolarHBondContact O-CB 3.38Å; V9-L13 WeakPolarHBondContact O-CD1 3.41Å; V9-L13 WeakPolarHBondContact O-CG 3.47Å; V9-L13 PolarHBondContact O-N 3.36Å
10	L	55.1	Low	51.9	Low	111 Å²	111	130.2 Å²	130.2	58%	0.581	68%	0.677	S	S	*	*	H	α-helix	trans	-67.5	-35.7	173.5	-91.4	146.4	0	0	0	113	L6 G14	L6-L10 HydrophobicContact CG-CD1 4.38Å; L6-L10 PolarHBondContact O-N 3.44Å; L6-L10 VanDerWaalsContact O-N 3.11Å; L10-G14 PolarHBondContact O-N 2.83Å
11	S	54.3	Low	52.1	Low	74 Å²	74	130 Å²	130	52%	0.517	68%	0.681	S	S	.	*	H	α-helix	trans	-65.6	-40.9	173	-177.4	0	0	0	0	112.2	L7 M8	L7-S11 WeakPolarHBondContact O-CB 3.26Å; L7-S11 PolarHBondContact O-N 3.36Å; M8-S11 PolarHBondContact O-N 3.24Å
12	C	52.8	Low	52.6	Low	73 Å²	73	128.5 Å²	128.5	49%	0.493	67%	0.672	S	S	.	*	H	α-helix	trans	-72.2	-34.7	176.1	-68.6	0	0	0	0	113.1	M8 V9 H16	M8-C12 WeakPolarHBondContact O-CB 3.22Å; M8-C12 PolarHBondContact O-N 3.46Å; M8-C12 PolarHBondContact O-SG 3.48Å; V9-C12 PolarHBondContact O-N 3.3Å; C12-H16 PolarHBondContact O-CD2 2.86Å; C12-H16 VanDerWaalsContact O-CD2 3.27Å
13	L	50.3	Low	53.7	Low	118 Å²	118	125.1 Å²	125.1	62%	0.618	67%	0.667	S	S	*	*	H	α-helix	trans	-75.1	-26.9	175.4	-76.1	159.4	0	0	0	112.8	V9 L15	V9-L13 HydrophobicContact CG1-CD1 3.62Å; V9-L13 HydrophobicContact CG1-CG 4.5Å; V9-L13 WeakPolarHBondContact O-CB 3.38Å; V9-L13 WeakPolarHBondContact O-CD1 3.41Å; V9-L13 WeakPolarHBondContact O-CG 3.47Å; V9-L13 PolarHBondContact O-N 3.36Å; L13-L15 PolarHBondContact O-N 2.87Å
14	G	48.2	Very low	55.3	Low	52 Å²	52	120.8 Å²	120.8	54%	0.536	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.3	-14.9	174.9	0	0	0	0	0	114.7	L10	L10-G14 PolarHBondContact O-N 2.83Å
15	L	49.5	Very low	57.3	Low	127 Å²	127	116.8 Å²	116.8	67%	0.665	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-5.6	179.8	-105.7	75.9	0	0	0	114.7	L13	L13-L15 PolarHBondContact O-N 2.87Å
16	H	45.2	Very low	59.2	Low	162 Å²	162	116.3 Å²	116.3	75%	0.75	63%	0.63	S	S	*	*	S	Bend	trans	-98.9	-0.7	-176.8	-80	-61.5	0	0	0	115.6	C12 L18	C12-H16 PolarHBondContact O-CD2 2.86Å; C12-H16 VanDerWaalsContact O-CD2 3.27Å; H16-L18 VanDerWaalsContact C-N 3.32Å
17	T	45.3	Very low	61.2	Low	123 Å²	123	115 Å²	115	76%	0.755	62%	0.624	S	S	*	*			trans	-99.6	41.2	164.7	56	0	0	0	0	111.5	W19	T17-W19 PolarHBondContact O-N 2.82Å
18	L	49.1	Very low	63.1	Low	145 Å²	145	112.1 Å²	112.1	76%	0.759	61%	0.612	S	S	*	*			trans	-62.9	92.5	152	-86.5	157.9	0	0	0	106.7	H16 K20	H16-L18 VanDerWaalsContact C-N 3.32Å; L18-K20 PolarHBondContact O-N 2.96Å
19	W	47.1	Very low	65.1	Low	227 Å²	227	106.7 Å²	106.7	86%	0.86	59%	0.586	S	S	*	*			trans	-50.1	98.4	160.3	-169.3	-58.9	0	0	0	105.8	T17 V21	T17-W19 PolarHBondContact O-N 2.82Å; W19-V21 VanDerWaalsContact C-N 3.26Å; W19-V21 PolarHBondContact O-N 3.16Å
20	K	44.3	Very low	67	Low	179 Å²	179	104.8 Å²	104.8	78%	0.778	58%	0.577	S	S	*	*			trans	-61.1	100.4	170.6	-86.9	-177.7	176.4	178	0	105.1	L18 Q22	L18-K20 PolarHBondContact O-N 2.96Å; K20-Q22 PolarHBondContact O-N 3.47Å
21	V	57	Low	68.9	Low	126 Å²	126	103.3 Å²	103.3	76%	0.764	57%	0.569	S	S	*	*			trans	-63.6	94.1	166.9	178.2	0	0	0	0	104.7	W19 A23	W19-V21 VanDerWaalsContact C-N 3.26Å; W19-V21 PolarHBondContact O-N 3.16Å; V21-A23 PolarHBondContact O-N 2.99Å; V21-A23 VanDerWaalsContact O-N 3.12Å
22	Q	64.5	Low	70.9	Confident	170 Å²	170	101.6 Å²	101.6	79%	0.794	56%	0.555	S	S	*	*			trans	-67.2	112.6	176.4	-165.8	110.9	4.1	0	0	106.2	K20 V24	K20-Q22 PolarHBondContact O-N 3.47Å; Q22-V24 PolarHBondContact O-N 3.37Å
23	A	82.1	Confident	72.8	Confident	83 Å²	83	101.5 Å²	101.5	69%	0.686	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-59	131.2	176.7	0	0	0	0	0	109.4	V21 P25	V21-A23 PolarHBondContact O-N 2.99Å; V21-A23 VanDerWaalsContact O-N 3.12Å; A23-P25 WeakPolarHBondContact O-CD 3.28Å
24	V	88.4	Confident	74.9	Confident	52 Å²	52	99.8 Å²	99.8	32%	0.315	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-65.9	124.1	174.6	-177.9	0	0	0	0	108.2	Q22 H167 A198	Q22-V24 PolarHBondContact O-N 3.37Å; V24-H167 VanDerWaalsContact CG1-CD2 3.44Å; V24-H167 WeakPolarHBondContact CG1-CD2 3.38Å; V24-A198 HydrophobicContact CG1-CB 4.09Å
25	P	93.9	Very high	77.2	Confident	76 Å²	76	97.4 Å²	97.4	49%	0.494	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-66.7	141.6	-178.2	9.8	-9.1	0	0	0	111.7	A23 S165 L166 H167	A23-P25 WeakPolarHBondContact O-CD 3.28Å; P25-S165 WeakPolarHBondContact CD-O 3.48Å; P25-L166 HydrophobicContact CB-CD2 4.21Å; P25-L166 HydrophobicContact CG-CD2 3.85Å; P25-H167 PolarHBondContact O-N 3.19Å
26	I	94.8	Very high	79.5	Confident	100 Å²	100	91.3 Å²	91.3	51%	0.513	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	129.3	174.3	-60.7	170.8	0	0	0	109.3	H167 E169	I26-H167 CarbonylContact C-O 3.43Å; I26-H167 VanDerWaalsContact CA-O 3.28Å; I26-H167 WeakPolarHBondContact CA-O 3.36Å; I26-H167 HydrophobicContact CG1-CB 3.96Å; I26-E169 HydrophobicContact CG2-CB 4.18Å; I26-E169 HydrophobicContact CG2-CG 3.89Å
27	L	95.4	Very high	82	Confident	78 Å²	78	83.6 Å²	83.6	41%	0.408	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	110.3	175.7	-178.9	56.6	0	0	0	109.4	L29 L166 H167 F168 E169	L27-L29 PolarHBondContact O-N 3.3Å; L27-L166 HydrophobicContact CD2-CD1 4.13Å; L27-H167 PolarHBondContact N-O 3.13Å; L27-F168 HydrophobicContact CB-CD1 4.21Å; L27-F168 HydrophobicContact CB-CE1 4.28Å; L27-F168 HydrophobicContact CD2-CD1 4.12Å; L27-F168 HydrophobicContact CD2-CE1 3.41Å; L27-F168 VanDerWaalsContact CD2-CE1 3.41Å; L27-F168 HydrophobicContact CD2-CZ 3.87Å; L27-F168 HydrophobicContact CG-CD1 4.16Å; L27-F168 HydrophobicContact CG-CE1 3.94Å; L27-F168 WeakPolarHBondContact O-CA 3.25Å; L27-E169 PolarHBondContact O-N 3.26Å
28	P	96.6	Very high	84.5	Confident	71 Å²	71	77.8 Å²	77.8	46%	0.461	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	132.8	179	25.9	-34.5	0	0	0	111.3	E169	P28-E169 CarbonylContact C-O 3.54Å; P28-E169 VanDerWaalsContact CA-O 3.3Å; P28-E169 WeakPolarHBondContact CA-O 3.49Å
29	L	97.4	Very high	86.8	Confident	10 Å²	10	71.3 Å²	71.3	5%	0.052	38%	0.384	C	S	.	.			trans	-66.8	140.2	172.5	-65.7	166.7	0	0	0	110.3	L27 F168 E169 P170 V177 F201 V245	L27-L29 PolarHBondContact O-N 3.3Å; L29-F168 HydrophobicContact CD1-CB 4.5Å; L29-F168 HydrophobicContact CD2-CB 4.04Å; L29-F168 HydrophobicContact CD2-CD1 3.63Å; L29-F168 HydrophobicContact CD2-CE1 4.48Å; L29-F168 HydrophobicContact CD2-CG 4.22Å; L29-F168 HydrophobicContact CG-CB 4.14Å; L29-F168 HydrophobicContact CG-CD1 4.37Å; L29-E169 PolarHBondContact N-O 2.94Å; L29-P170 HydrophobicContact CD1-CB 4.19Å; L29-V177 HydrophobicContact CB-CB 4.17Å; L29-V177 HydrophobicContact CB-CG1 3.68Å; L29-F201 HydrophobicContact CD1-CE1 4.46Å; L29-F201 HydrophobicContact CD2-CE1 4.3Å; L29-F201 HydrophobicContact CD2-CZ 4.4Å; L29-V245 HydrophobicContact CD1-CG1 3.86Å
30	S	95.9	Very high	89.1	Confident	44 Å²	44	60.5 Å²	60.5	31%	0.308	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-155.1	-175.8	-176.7	74.1	0	0	0	0	111.6	V32 V177 R178	S30-V32 VanDerWaalsContact C-N 3.3Å; S30-V32 PolarHBondContact OG-N 3.28Å; S30-V177 WeakPolarHBondContact O-CA 3.45Å; S30-R178 PolarHBondContact O-N 3.14Å
31	L	95.3	Very high	91.6	Very high	80 Å²	80	56.1 Å²	56.1	42%	0.419	33%	0.331	S	S	.	.			trans	-83.3	-1.7	173.4	-68.9	173.6	0	0	0	114	F176 R178	L31-F176 HydrophobicContact CD2-CB 4.27Å; L31-R178 HydrophobicContact CD2-CG 4.22Å
32	V	95.2	Very high	93.4	Very high	38 Å²	38	54.3 Å²	54.3	23%	0.23	34%	0.338	C	S	.	.			trans	46.7	64.5	171.6	-68.4	0	0	0	0	114.2	S30 D34 T35 R178 G180	S30-V32 VanDerWaalsContact C-N 3.3Å; S30-V32 PolarHBondContact OG-N 3.28Å; V32-D34 PolarHBondContact O-N 2.87Å; V32-T35 WeakPolarHBondContact CB-OG1 3.26Å; V32-T35 WeakPolarHBondContact CG2-OG1 2.98Å; V32-T35 WeakPolarHBondContact O-CB 3.22Å; V32-T35 PolarHBondContact O-N 2.92Å; V32-T35 VanDerWaalsContact O-N 3.07Å; V32-T35 PolarHBondContact O-OG1 3.5Å; V32-T35 VanDerWaalsContact O-OG1 3.12Å; V32-R178 HydrophobicContact CG2-CB 3.67Å; V32-G180 VanDerWaalsContact CG2-CA 3.49Å
33	P	93.1	Very high	95	Very high	70 Å²	70	46.6 Å²	46.6	46%	0.455	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-10	-171.6	29.5	-37.7	0	0	0	115.1	K266	P33-K266 VanDerWaalsContact O-CE 3.28Å; P33-K266 WeakPolarHBondContact O-CE 3.32Å; P33-K266 PolarHBondContact O-NZ 2.96Å
34	D	94.6	Very high	95.7	Very high	83 Å²	83	43.9 Å²	43.9	44%	0.444	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	7.2	178.1	-63.4	-34.2	0	0	0	113	V32 R116 G119 K266	V32-D34 PolarHBondContact O-N 2.87Å; D34-R116 CarbonylContact C-O 3.51Å; D34-G119 CarbonylContact O-C 3.51Å; D34-G119 WeakPolarHBondContact O-CA 3.43Å; D34-G119 PolarHBondContact O-N 3.27Å; D34-K266 IonicContact OD1-NZ 2.9Å; D34-K266 PolarHBondContact OD1-NZ 2.84Å
35	T	96.8	Very high	96	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	30%	0.302	C	S	.	.	S	Bend	trans	-68	132.5	169.8	-62.3	0	0	0	0	110.7	V32 D37 V115 G180 P227	V32-T35 WeakPolarHBondContact CB-OG1 3.26Å; V32-T35 WeakPolarHBondContact CG2-OG1 2.98Å; V32-T35 WeakPolarHBondContact O-CB 3.22Å; V32-T35 PolarHBondContact O-N 2.92Å; V32-T35 VanDerWaalsContact O-N 3.07Å; V32-T35 PolarHBondContact O-OG1 3.5Å; V32-T35 VanDerWaalsContact O-OG1 3.12Å; T35-D37 HydrophobicContact CG2-CB 4.06Å; T35-D37 PolarHBondContact O-N 3.41Å; T35-V115 CarbonylContact C-O 3.55Å; T35-V115 VanDerWaalsContact CA-O 3.31Å; T35-V115 WeakPolarHBondContact CA-O 3.34Å; T35-V115 HydrophobicContact CG2-CG1 3.92Å; T35-G180 VanDerWaalsContact CG2-O 3.3Å; T35-G180 WeakPolarHBondContact CG2-O 3.35Å; T35-G180 WeakPolarHBondContact OG1-CA 3.29Å; T35-G180 PolarHBondContact OG1-O 3.01Å; T35-P227 HydrophobicContact CG2-CB 3.95Å
36	F	98.3	Very high	96.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.301	C	S	.	.			trans	-77	108.7	164.3	-177.7	-110.4	0	0	0	108.8	D38 V115 Y125 F129 H135 F257 A260	F36-D38 HydrophobicContact CE1-CB 4.02Å; F36-D38 HydrophobicContact CE2-CB 3.99Å; F36-D38 HydrophobicContact CZ-CB 3.52Å; F36-V115 PolarHBondContact N-O 3.25Å; F36-V115 WeakPolarHBondContact O-CG1 3.38Å; F36-Y125 HydrophobicContact CD1-CD2 4.21Å; F36-Y125 AromaticContact CD1-CE2 3.99Å; F36-Y125 HydrophobicContact CD1-CE2 3.99Å; F36-Y125 AromaticContact CD2-CD2 3.54Å; F36-Y125 HydrophobicContact CD2-CD2 3.54Å; F36-Y125 AromaticContact CD2-CE2 3.93Å; F36-Y125 HydrophobicContact CD2-CE2 3.93Å; F36-Y125 HydrophobicContact CD2-CG 4.13Å; F36-Y125 HydrophobicContact CE1-CD2 4.05Å; F36-Y125 AromaticContact CE1-CE2 3.44Å; F36-Y125 HydrophobicContact CE1-CE2 3.44Å; F36-Y125 VanDerWaalsContact CE1-CE2 3.44Å; F36-Y125 HydrophobicContact CE2-CD1 4.32Å; F36-Y125 AromaticContact CE2-CD2 3.36Å; F36-Y125 HydrophobicContact CE2-CD2 3.36Å; F36-Y125 HydrophobicContact CE2-CE1 4.34Å; F36-Y125 AromaticContact CE2-CE2 3.39Å; F36-Y125 HydrophobicContact CE2-CE2 3.39Å; F36-Y125 AromaticContact CE2-CG 3.85Å; F36-Y125 HydrophobicContact CE2-CG 3.85Å; F36-Y125 AromaticContact CE2-CZ 3.89Å; F36-Y125 AromaticContact CG-CD2 3.97Å; F36-Y125 HydrophobicContact CG-CD2 3.97Å; F36-Y125 HydrophobicContact CG-CE2 4.22Å; F36-Y125 AromaticContact CZ-CD2 3.64Å; F36-Y125 HydrophobicContact CZ-CD2 3.64Å; F36-Y125 HydrophobicContact CZ-CE1 4.32Å; F36-Y125 AromaticContact CZ-CE2 3.11Å; F36-Y125 HydrophobicContact CZ-CE2 3.11Å; F36-Y125 HydrophobicContact CZ-CG 4.41Å; F36-Y125 AromaticContact CZ-CZ 3.5Å; F36-F129 HydrophobicContact CB-CE2 4.12Å; F36-F129 HydrophobicContact CD1-CE1 4.01Å; F36-F129 HydrophobicContact CD1-CE2 4.01Å; F36-F129 AromaticContact CD1-CZ 3.69Å; F36-F129 HydrophobicContact CD1-CZ 3.69Å; F36-F129 HydrophobicContact CE1-CE1 4.22Å; F36-F129 HydrophobicContact CE1-CZ 4.33Å; F36-F129 HydrophobicContact CG-CE2 4.31Å; F36-F129 HydrophobicContact CG-CZ 4.44Å; F36-H135 AromaticContact CD1-CD2 3.83Å; F36-H135 AromaticContact CD1-CE1 3.83Å; F36-H135 AromaticContact CD1-NE2 3.71Å; F36-H135 AromaticContact CE1-CE1 3.63Å; F36-H135 AromaticContact CE1-CG 3.86Å; F36-H135 AromaticContact CE1-ND1 3.53Å; F36-H135 AromaticContact CE1-NE2 3.98Å; F36-F257 HydrophobicContact CD2-CB 4.46Å; F36-F257 HydrophobicContact CD2-CD1 4.33Å; F36-F257 AromaticContact CD2-CD2 3.99Å; F36-F257 HydrophobicContact CD2-CD2 3.99Å; F36-F257 HydrophobicContact CD2-CE2 4.29Å; F36-F257 AromaticContact CD2-CG 4Å; F36-F257 HydrophobicContact CD2-CG 4Å; F36-F257 HydrophobicContact CE2-CB 4.15Å; F36-F257 HydrophobicContact CE2-CD1 4.16Å; F36-F257 HydrophobicContact CE2-CD2 4.45Å; F36-F257 AromaticContact CE2-CG 4Å; F36-F257 HydrophobicContact CE2-CG 4Å; F36-A260 HydrophobicContact CE2-CB 3.77Å; F36-A260 HydrophobicContact CZ-CB 4.22Å
37	D	97.6	Very high	96.4	Very high	0 Å²	0	46 Å²	46	0%	0	28%	0.276	C	S	.	.			trans	-128.4	29.1	-163.9	61.3	6.5	0	0	0	114	T35 A39 R178 H228 S255 H256 F257	T35-D37 HydrophobicContact CG2-CB 4.06Å; T35-D37 PolarHBondContact O-N 3.41Å; D37-A39 PolarHBondContact O-N 3.08Å; D37-R178 IonicContact OD2-CZ 2.78Å; D37-R178 VanDerWaalsContact OD2-CZ 3.26Å; D37-R178 IonicContact OD2-NH1 3.16Å; D37-R178 PolarHBondContact OD2-NH1 3.33Å; D37-R178 IonicContact OD2-NH2 3.83Å; D37-R178 PolarHBondContact OD2-NH2 3.34Å; D37-H228 HydrophobicContact CB-CB 4.34Å; D37-S255 VanDerWaalsContact O-CB 3.31Å; D37-S255 WeakPolarHBondContact O-CB 3.33Å; D37-S255 PolarHBondContact O-OG 2.87Å; D37-S255 WeakPolarHBondContact OD2-CA 3.28Å; D37-H256 VanDerWaalsContact CG-N 3.28Å; D37-H256 PolarHBondContact OD1-N 3.41Å; D37-H256 IonicContact OD2-CD2 3.94Å; D37-H256 PolarHBondContact OD2-N 3.22Å; D37-F257 PolarHBondContact OD1-N 3.2Å
38	D	97.9	Very high	96.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.264	C	S	.	.			trans	-57.6	122.9	-178.1	-159.6	-24.3	0	0	0	111.4	F36 Y40 F257 N258 C259 A260	F36-D38 HydrophobicContact CE1-CB 4.02Å; F36-D38 HydrophobicContact CE2-CB 3.99Å; F36-D38 HydrophobicContact CZ-CB 3.52Å; D38-Y40 HydrophobicContact CB-CD1 4.46Å; D38-Y40 HydrophobicContact CB-CE1 4.06Å; D38-Y40 HydrophobicContact CB-CE2 4.23Å; D38-Y40 WeakPolarHBondContact O-CE2 3.31Å; D38-Y40 PolarHBondContact OD1-N 2.82Å; D38-F257 HydrophobicContact CB-CB 4.06Å; D38-N258 VanDerWaalsContact OD1-CA 3.32Å; D38-N258 WeakPolarHBondContact OD1-CA 3.44Å; D38-C259 VanDerWaalsContact CG-N 3.26Å; D38-C259 PolarHBondContact OD1-N 2.91Å; D38-C259 WeakPolarHBondContact OD2-CA 3.48Å; D38-C259 PolarHBondContact OD2-N 2.87Å; D38-A260 PolarHBondContact OD2-N 3.3Å
39	A	95.8	Very high	96.5	Very high	9 Å²	9	47 Å²	47	7%	0.074	27%	0.274	C	S	.	.			trans	-97.5	-3	177.5	0	0	0	0	0	112.6	D37 V41 Q143	D37-A39 PolarHBondContact O-N 3.08Å; A39-V41 HydrophobicContact CB-CG2 3.94Å; A39-V41 PolarHBondContact O-N 2.81Å; A39-Q143 PolarHBondContact O-NE2 3.29Å
40	Y	97.4	Very high	96.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.29	C	S	.	.			trans	54.6	34.2	177	-50.4	-76	0	0	0	114.3	D38 G42 C43 S44 M47 H135 F136 T139	D38-Y40 HydrophobicContact CB-CD1 4.46Å; D38-Y40 HydrophobicContact CB-CE1 4.06Å; D38-Y40 HydrophobicContact CB-CE2 4.23Å; D38-Y40 WeakPolarHBondContact O-CE2 3.31Å; D38-Y40 PolarHBondContact OD1-N 2.82Å; Y40-G42 PolarHBondContact O-N 3.48Å; Y40-C43 PolarHBondContact O-N 2.8Å; Y40-S44 PolarHBondContact O-N 3.45Å; Y40-S44 PolarHBondContact O-OG 2.95Å; Y40-M47 HydrophobicContact CD1-CG 3.75Å; Y40-M47 HydrophobicContact CE1-CE 4.02Å; Y40-M47 HydrophobicContact CE1-CG 4.15Å; Y40-M47 HydrophobicContact CE1-SD 4.43Å; Y40-H135 AromaticContact CE2-CE1 3.95Å; Y40-H135 AromaticContact CE2-ND1 3.63Å; Y40-H135 AromaticContact CZ-ND1 3.62Å; Y40-H135 PolarHBondContact OH-ND1 3.08Å; Y40-F136 AromaticContact CD1-CD2 3.85Å; Y40-F136 HydrophobicContact CD1-CD2 3.85Å; Y40-F136 HydrophobicContact CD1-CE2 4.43Å; Y40-F136 AromaticContact CD2-CD2 3.74Å; Y40-F136 HydrophobicContact CD2-CD2 3.74Å; Y40-F136 HydrophobicContact CD2-CE2 4.39Å; Y40-F136 HydrophobicContact CE1-CB 4.31Å; Y40-F136 AromaticContact CE1-CD2 3.91Å; Y40-F136 HydrophobicContact CE1-CD2 3.91Å; Y40-F136 HydrophobicContact CE2-CB 4.11Å; Y40-F136 AromaticContact CE2-CD2 3.84Å; Y40-F136 HydrophobicContact CE2-CD2 3.84Å; Y40-F136 HydrophobicContact CE2-CG 4.48Å; Y40-F136 AromaticContact CG-CD2 3.72Å; Y40-F136 HydrophobicContact CG-CD2 3.72Å; Y40-F136 HydrophobicContact CG-CE2 4.13Å; Y40-F136 AromaticContact CZ-CD2 3.89Å; Y40-F136 PolarHBondContact OH-N 3.3Å; Y40-T139 HydrophobicContact CD2-CG2 3.9Å; Y40-T139 HydrophobicContact CE2-CG2 4.07Å
41	V	94.9	Very high	96.6	Very high	87 Å²	87	48.7 Å²	48.7	53%	0.527	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	120.5	-179.1	-178.9	0	0	0	0	108.7	A39 C43 N258	A39-V41 HydrophobicContact CB-CG2 3.94Å; A39-V41 PolarHBondContact O-N 2.81Å; V41-C43 VanDerWaalsContact C-N 3.3Å; V41-C43 PolarHBondContact O-N 3.22Å; V41-N258 WeakPolarHBondContact CB-OD1 3.39Å; V41-N258 PolarHBondContact N-OD1 3.15Å; V41-N258 PolarHBondContact O-ND2 3.17Å; V41-N258 PolarHBondContact O-OD1 2Å
42	G	96	Very high	96.8	Very high	88 Å²	88	46.5 Å²	46.5	91%	0.907	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	-1.6	178.6	0	0	0	0	0	115.6	Y40	Y40-G42 PolarHBondContact O-N 3.48Å
43	C	97.7	Very high	96.9	Very high	9 Å²	9	50.1 Å²	50.1	6%	0.061	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134	15.8	-178.4	65.9	0	0	0	0	114.1	Y40 V41 E45 E46 M47 C259 L262	Y40-C43 PolarHBondContact O-N 2.8Å; V41-C43 VanDerWaalsContact C-N 3.3Å; V41-C43 PolarHBondContact O-N 3.22Å; C43-E45 VanDerWaalsContact C-N 3.27Å; C43-E45 PolarHBondContact O-N 3.08Å; C43-E46 PolarHBondContact O-N 2.9Å; C43-M47 WeakPolarHBondContact O-CB 2.89Å; C43-M47 WeakPolarHBondContact O-CG 2.85Å; C43-M47 PolarHBondContact O-N 3.08Å; C43-C259 HydrophobicContact CB-CB 3.79Å; C43-C259 WeakPolarHBondContact CB-SG 3.06Å; C43-C259 VanDerWaalsContact SG-CA 3.59Å; C43-C259 WeakPolarHBondContact SG-CB 3.11Å; C43-C259 CovalentContact SG-SG 2.01Å; C43-C259 PolarHBondContact SG-SG 3.23Å; C43-L262 HydrophobicContact CB-CD1 3.71Å
44	S	96.2	Very high	97.2	Very high	25 Å²	25	47.1 Å²	47.1	18%	0.175	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-37.2	-178.9	-66.6	0	0	0	0	112.5	Y40 D48 F136	Y40-S44 PolarHBondContact O-N 3.45Å; Y40-S44 PolarHBondContact O-OG 2.95Å; S44-D48 VanDerWaalsContact O-CB 3.25Å; S44-D48 WeakPolarHBondContact O-CB 3.44Å; S44-D48 PolarHBondContact O-N 3.24Å; S44-F136 WeakPolarHBondContact O-CZ 3.2Å
45	E	96.2	Very high	97.4	Very high	171 Å²	171	43.7 Å²	43.7	80%	0.799	25%	0.251	S	S	*	.	H	α-helix	trans	-68.7	-48.2	177.9	-64.7	-178.4	173.3	0	0	111.8	C43 M47 D48 E49	C43-E45 VanDerWaalsContact C-N 3.27Å; C43-E45 PolarHBondContact O-N 3.08Å; E45-M47 VanDerWaalsContact C-N 3.33Å; E45-M47 PolarHBondContact O-N 3.38Å; E45-D48 WeakPolarHBondContact O-CB 3.12Å; E45-D48 PolarHBondContact O-N 2.73Å; E45-D48 VanDerWaalsContact O-N 3.16Å; E45-E49 PolarHBondContact O-N 2.79Å
46	E	98.2	Very high	97.4	Very high	101 Å²	101	50.3 Å²	50.3	47%	0.472	28%	0.279	S	S	.	.	H	α-helix	trans	-63.5	-39.4	177.7	-171.7	-178.8	175.6	0	0	111.9	C43 D48 E49 K50 L262	C43-E46 PolarHBondContact O-N 2.9Å; E46-D48 VanDerWaalsContact C-N 3.32Å; E46-D48 PolarHBondContact O-N 3.38Å; E46-E49 PolarHBondContact O-N 2.74Å; E46-K50 PolarHBondContact O-N 2.9Å; E46-L262 HydrophobicContact CB-CD1 3.87Å; E46-L262 HydrophobicContact CG-CD1 3.75Å; E46-L262 HydrophobicContact CG-CD2 3.93Å; E46-L262 HydrophobicContact CG-CG 4.47Å
47	M	98.1	Very high	97.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-39.1	174.1	-83.4	-57.9	-57.2	0	0	112.3	Y40 C43 E45 E49 K50 A51 F136 Y261 L262	Y40-M47 HydrophobicContact CD1-CG 3.75Å; Y40-M47 HydrophobicContact CE1-CE 4.02Å; Y40-M47 HydrophobicContact CE1-CG 4.15Å; Y40-M47 HydrophobicContact CE1-SD 4.43Å; C43-M47 WeakPolarHBondContact O-CB 2.89Å; C43-M47 WeakPolarHBondContact O-CG 2.85Å; C43-M47 PolarHBondContact O-N 3.08Å; E45-M47 VanDerWaalsContact C-N 3.33Å; E45-M47 PolarHBondContact O-N 3.38Å; M47-E49 VanDerWaalsContact C-N 3.31Å; M47-E49 PolarHBondContact O-N 2.92Å; M47-K50 PolarHBondContact O-N 3.18Å; M47-K50 VanDerWaalsContact O-N 3.1Å; M47-A51 VanDerWaalsContact O-CB 3.29Å; M47-A51 WeakPolarHBondContact O-CB 3.35Å; M47-A51 PolarHBondContact O-N 2.87Å; M47-F136 HydrophobicContact CB-CD2 3.78Å; M47-F136 HydrophobicContact CB-CE1 4.35Å; M47-F136 HydrophobicContact CB-CE2 3.47Å; M47-F136 VanDerWaalsContact CB-CE2 3.47Å; M47-F136 HydrophobicContact CB-CG 4.35Å; M47-F136 HydrophobicContact CB-CZ 3.78Å; M47-F136 HydrophobicContact CE-CB 4.37Å; M47-F136 HydrophobicContact CE-CD2 4.46Å; M47-F136 HydrophobicContact CE-CG 4.36Å; M47-F136 HydrophobicContact CG-CD2 4.33Å; M47-F136 HydrophobicContact CG-CE2 4.34Å; M47-Y261 HydrophobicContact CE-CD1 4.32Å; M47-Y261 HydrophobicContact CE-CG 4.44Å; M47-Y261 HydrophobicContact SD-CD1 4.09Å; M47-Y261 HydrophobicContact SD-CG 4.41Å; M47-L262 HydrophobicContact CG-CD1 3.68Å; M47-L262 HydrophobicContact CG-CG 4.2Å; M47-L262 HydrophobicContact SD-CD1 3.76Å; M47-L262 HydrophobicContact SD-CD2 4.02Å; M47-L262 HydrophobicContact SD-CG 3.57Å; M47-L262 VanDerWaalsContact SD-CG 3.57Å
48	D	96.3	Very high	97.5	Very high	28 Å²	28	55.2 Å²	55.2	15%	0.15	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-36.7	179.5	-175.7	73.3	0	0	0	111.9	S44 E45 E46 K50 A51 R90 F136	S44-D48 VanDerWaalsContact O-CB 3.25Å; S44-D48 WeakPolarHBondContact O-CB 3.44Å; S44-D48 PolarHBondContact O-N 3.24Å; E45-D48 WeakPolarHBondContact O-CB 3.12Å; E45-D48 PolarHBondContact O-N 2.73Å; E45-D48 VanDerWaalsContact O-N 3.16Å; E46-D48 VanDerWaalsContact C-N 3.32Å; E46-D48 PolarHBondContact O-N 3.38Å; D48-K50 VanDerWaalsContact C-N 3.27Å; D48-K50 PolarHBondContact O-N 2.87Å; D48-A51 PolarHBondContact O-N 2.87Å; D48-R90 IonicContact OD1-NH1 3.15Å; D48-R90 IonicContact OD2-CZ 3.69Å; D48-R90 IonicContact OD2-NH1 3.57Å; D48-R90 PolarHBondContact OD2-NH1 2.59Å; D48-R90 IonicContact OD2-NH2 2.84Å; D48-R90 PolarHBondContact OD2-NH2 2.87Å; D48-R90 VanDerWaalsContact OD2-NH2 3.16Å; D48-F136 HydrophobicContact CB-CE1 4.02Å; D48-F136 HydrophobicContact CB-CZ 3.96Å
49	E	97.3	Very high	97.5	Very high	144 Å²	144	56.6 Å²	56.6	67%	0.673	31%	0.309	S	S	*	.	H	α-helix	trans	-61.5	-32.5	172.4	-66.3	-176.7	178.3	0	0	113.2	E45 E46 M47	E45-E49 PolarHBondContact O-N 2.79Å; E46-E49 PolarHBondContact O-N 2.74Å; M47-E49 VanDerWaalsContact C-N 3.31Å; M47-E49 PolarHBondContact O-N 2.92Å
50	K	98.2	Very high	97.6	Very high	89 Å²	89	59.9 Å²	59.9	39%	0.387	34%	0.336	S	S	.	.	H	α-helix	trans	-89.7	-29.9	179.5	-55	-53.4	179.3	-164.8	0	113	E46 M47 D48 G52 L53 L54 Y261 L262	E46-K50 PolarHBondContact O-N 2.9Å; M47-K50 PolarHBondContact O-N 3.18Å; M47-K50 VanDerWaalsContact O-N 3.1Å; D48-K50 VanDerWaalsContact C-N 3.27Å; D48-K50 PolarHBondContact O-N 2.87Å; K50-G52 PolarHBondContact O-N 2.81Å; K50-L53 PolarHBondContact O-N 2.91Å; K50-L53 VanDerWaalsContact O-N 3.14Å; K50-L54 HydrophobicContact CB-CD1 4.48Å; K50-L54 PolarHBondContact O-N 3.37Å; K50-L54 VanDerWaalsContact O-N 3.07Å; K50-Y261 HydrophobicContact CB-CE1 4.07Å; K50-Y261 HydrophobicContact CG-CE1 4.3Å; K50-L262 HydrophobicContact CG-CD2 4.27Å
51	A	98.1	Very high	97.7	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60	-33.6	-170.1	0	0	0	0	0	112.9	M47 D48 L55 A133 F136 Y137	M47-A51 VanDerWaalsContact O-CB 3.29Å; M47-A51 WeakPolarHBondContact O-CB 3.35Å; M47-A51 PolarHBondContact O-N 2.87Å; D48-A51 PolarHBondContact O-N 2.87Å; A51-L55 VanDerWaalsContact O-CB 3.28Å; A51-L55 WeakPolarHBondContact O-CB 3.08Å; A51-L55 PolarHBondContact O-N 2.01Å; A51-A133 HydrophobicContact CB-CB 4.42Å; A51-A133 WeakPolarHBondContact O-CB 3.41Å; A51-F136 HydrophobicContact CB-CD1 3.58Å; A51-F136 HydrophobicContact CB-CE1 3.89Å; A51-Y137 HydrophobicContact CB-CE1 3.91Å; A51-Y137 HydrophobicContact CB-CE2 3.98Å; A51-Y137 VanDerWaalsContact CB-CZ 3.49Å; A51-Y137 WeakPolarHBondContact CB-OH 3.18Å
52	G	98.1	Very high	97.8	Very high	33 Å²	33	66.4 Å²	66.4	34%	0.34	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-42.3	177.1	0	0	0	0	0	113.8	K50 K56 Y137	K50-G52 PolarHBondContact O-N 2.81Å; G52-K56 WeakPolarHBondContact O-CG 3.33Å; G52-K56 PolarHBondContact O-N 2.95Å; G52-Y137 PolarHBondContact N-OH 3.24Å
53	L	98.4	Very high	97.9	Very high	114 Å²	114	65.8 Å²	65.8	60%	0.597	33%	0.332	S	S	*	.	H	α-helix	trans	-72.5	-43.9	176.3	-71.6	176	0	0	0	111.1	K50 L55 K56 E57	K50-L53 PolarHBondContact O-N 2.91Å; K50-L53 VanDerWaalsContact O-N 3.14Å; L53-L55 VanDerWaalsContact C-N 3.32Å; L53-L55 PolarHBondContact O-N 2.78Å; L53-K56 WeakPolarHBondContact O-CB 3.34Å; L53-K56 PolarHBondContact O-N 3.36Å; L53-K56 VanDerWaalsContact O-N 3.14Å; L53-E57 PolarHBondContact O-N 2.9Å; L53-E57 VanDerWaalsContact O-N 3.07Å
54	L	98.4	Very high	97.8	Very high	8 Å²	8	67.3 Å²	67.3	4%	0.042	34%	0.34	C	S	.	.	H	α-helix	trans	-55	-47.9	176	-80.7	176.4	0	0	0	112	K50 K56 E57 E58 K132 A133 Y261	K50-L54 HydrophobicContact CB-CD1 4.48Å; K50-L54 PolarHBondContact O-N 3.37Å; K50-L54 VanDerWaalsContact O-N 3.07Å; L54-K56 VanDerWaalsContact C-N 3.29Å; L54-K56 PolarHBondContact O-N 2.8Å; L54-E57 WeakPolarHBondContact O-CB 3.23Å; L54-E57 PolarHBondContact O-N 2.89Å; L54-E57 VanDerWaalsContact O-N 3.08Å; L54-E58 VanDerWaalsContact O-CG 3.26Å; L54-E58 WeakPolarHBondContact O-CG 3.1Å; L54-E58 PolarHBondContact O-N 2.95Å; L54-K132 HydrophobicContact CD1-CB 4.23Å; L54-K132 HydrophobicContact CD2-CD 4.33Å; L54-A133 HydrophobicContact CB-CB 3.78Å; L54-Y261 HydrophobicContact CD1-CD1 3.95Å; L54-Y261 HydrophobicContact CD1-CD2 4.22Å; L54-Y261 HydrophobicContact CD1-CE1 3.71Å; L54-Y261 HydrophobicContact CD1-CE2 3.99Å; L54-Y261 HydrophobicContact CD1-CG 4.19Å; L54-Y261 HydrophobicContact CD2-CE1 4.38Å; L54-Y261 HydrophobicContact CD2-CE2 3.67Å; L54-Y261 WeakPolarHBondContact CD2-OH 3.49Å; L54-Y261 HydrophobicContact CG-CE1 4.25Å; L54-Y261 HydrophobicContact CG-CE2 4.33Å
55	L	98.7	Very high	97.9	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.052	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-39.5	179.3	-178.2	66.2	0	0	0	112.2	A51 L53 E57 E58 M59 W69 A133 Y137	A51-L55 VanDerWaalsContact O-CB 3.28Å; A51-L55 WeakPolarHBondContact O-CB 3.08Å; A51-L55 PolarHBondContact O-N 2.01Å; L53-L55 VanDerWaalsContact C-N 3.32Å; L53-L55 PolarHBondContact O-N 2.78Å; L55-E57 VanDerWaalsContact C-N 3.33Å; L55-E57 PolarHBondContact O-N 2.9Å; L55-E58 PolarHBondContact O-N 2.96Å; L55-M59 HydrophobicContact CD1-CG 4.39Å; L55-M59 HydrophobicContact CG-CE 4.13Å; L55-M59 HydrophobicContact CG-SD 4.4Å; L55-M59 WeakPolarHBondContact O-CB 3.32Å; L55-M59 WeakPolarHBondContact O-CG 3.36Å; L55-M59 PolarHBondContact O-N 2.83Å; L55-W69 HydrophobicContact CD1-CD2 4.23Å; L55-W69 HydrophobicContact CD1-CE3 3.95Å; L55-W69 HydrophobicContact CD1-CH2 4.45Å; L55-W69 HydrophobicContact CD1-CZ3 4.07Å; L55-W69 HydrophobicContact CD2-CD2 3.9Å; L55-W69 VanDerWaalsContact CD2-CE2 3.41Å; L55-W69 HydrophobicContact CD2-CE3 4.2Å; L55-W69 HydrophobicContact CD2-CH2 3.66Å; L55-W69 HydrophobicContact CD2-CZ2 3.29Å; L55-W69 HydrophobicContact CD2-CZ3 4.09Å; L55-A133 HydrophobicContact CB-CB 3.74Å; L55-A133 HydrophobicContact CD1-CB 4.44Å; L55-Y137 HydrophobicContact CB-CE2 4.36Å; L55-Y137 HydrophobicContact CD2-CE2 3.99Å
56	K	98.6	Very high	98.1	Very high	141 Å²	141	62.9 Å²	62.9	61%	0.613	31%	0.312	S	S	*	.	H	α-helix	trans	-62	-41.9	175	-71.3	177	-178.7	-179.8	0	111.6	G52 L53 L54 M59 A60	G52-K56 WeakPolarHBondContact O-CG 3.33Å; G52-K56 PolarHBondContact O-N 2.95Å; L53-K56 WeakPolarHBondContact O-CB 3.34Å; L53-K56 PolarHBondContact O-N 3.36Å; L53-K56 VanDerWaalsContact O-N 3.14Å; L54-K56 VanDerWaalsContact C-N 3.29Å; L54-K56 PolarHBondContact O-N 2.8Å; K56-M59 HydrophobicContact CG-CE 4.47Å; K56-A60 WeakPolarHBondContact O-CB 3.42Å; K56-A60 PolarHBondContact O-N 3.22Å
57	E	98.4	Very high	98.1	Very high	88 Å²	88	63.3 Å²	63.3	41%	0.411	31%	0.314	S	S	.	.	H	α-helix	trans	-66	-39.3	175.6	-67.2	-179.2	-162.3	0	0	112.5	L53 L54 L55 A60 R61	L53-E57 PolarHBondContact O-N 2.9Å; L53-E57 VanDerWaalsContact O-N 3.07Å; L54-E57 WeakPolarHBondContact O-CB 3.23Å; L54-E57 PolarHBondContact O-N 2.89Å; L54-E57 VanDerWaalsContact O-N 3.08Å; L55-E57 VanDerWaalsContact C-N 3.33Å; L55-E57 PolarHBondContact O-N 2.9Å; E57-A60 PolarHBondContact O-N 3.43Å; E57-R61 WeakPolarHBondContact O-CG 2.87Å; E57-R61 PolarHBondContact O-N 3.27Å; E57-R61 IonicContact OE2-NH1 3.96Å
58	E	98.5	Very high	98.1	Very high	14 Å²	14	63.5 Å²	63.5	7%	0.065	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-49.9	176.8	-68.8	172.6	-172.9	0	0	110.7	L54 L55 A60 R61 H62 L65 P130 K132 A133 L134	L54-E58 VanDerWaalsContact O-CG 3.26Å; L54-E58 WeakPolarHBondContact O-CG 3.1Å; L54-E58 PolarHBondContact O-N 2.95Å; L55-E58 PolarHBondContact O-N 2.96Å; E58-A60 VanDerWaalsContact C-N 3.3Å; E58-A60 PolarHBondContact O-N 3.49Å; E58-R61 CarbonylContact O-C 3.5Å; E58-R61 PolarHBondContact O-N 2.92Å; E58-R61 VanDerWaalsContact O-N 3.11Å; E58-H62 VanDerWaalsContact O-CB 3.28Å; E58-H62 WeakPolarHBondContact O-CB 3.38Å; E58-H62 PolarHBondContact O-N 2.9Å; E58-L65 HydrophobicContact CB-CD2 3.65Å; E58-P130 VanDerWaalsContact CG-O 3.27Å; E58-P130 WeakPolarHBondContact CG-O 2.97Å; E58-K132 VanDerWaalsContact OE1-CA 3.23Å; E58-K132 WeakPolarHBondContact OE1-CA 3.39Å; E58-K132 VanDerWaalsContact OE1-CB 3.25Å; E58-K132 WeakPolarHBondContact OE1-CB 3.41Å; E58-K132 PolarHBondContact OE1-N 3.49Å; E58-A133 PolarHBondContact OE1-N 3.03Å; E58-A133 PolarHBondContact OE2-N 3.34Å; E58-L134 PolarHBondContact OE2-N 3.36Å
59	M	98.6	Very high	98.2	Very high	29 Å²	29	62.7 Å²	62.7	14%	0.143	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-35.2	176	-71.1	-172.1	-56.9	0	0	112.8	L55 K56 R61 L65 R66 W69	L55-M59 HydrophobicContact CD1-CG 4.39Å; L55-M59 HydrophobicContact CG-CE 4.13Å; L55-M59 HydrophobicContact CG-SD 4.4Å; L55-M59 WeakPolarHBondContact O-CB 3.32Å; L55-M59 WeakPolarHBondContact O-CG 3.36Å; L55-M59 PolarHBondContact O-N 2.83Å; K56-M59 HydrophobicContact CG-CE 4.47Å; M59-R61 PolarHBondContact O-N 3Å; M59-L65 HydrophobicContact CG-CD2 4.32Å; M59-L65 HydrophobicContact CG-CG 4.06Å; M59-R66 HydrophobicContact CB-CB 3.88Å; M59-R66 HydrophobicContact CB-CG 4.25Å; M59-R66 HydrophobicContact CG-CB 4.25Å; M59-W69 HydrophobicContact SD-CB 3.74Å; M59-W69 HydrophobicContact SD-CG 3.69Å
60	A	98.4	Very high	98.2	Very high	78 Å²	78	61 Å²	61	65%	0.645	30%	0.303	S	S	*	.	H	α-helix	trans	-66.4	-28.2	176.7	0	0	0	0	0	112.8	K56 E57 E58	K56-A60 WeakPolarHBondContact O-CB 3.42Å; K56-A60 PolarHBondContact O-N 3.22Å; E57-A60 PolarHBondContact O-N 3.43Å; E58-A60 VanDerWaalsContact C-N 3.3Å; E58-A60 PolarHBondContact O-N 3.49Å
61	R	97.4	Very high	98.2	Very high	195 Å²	195	59.3 Å²	59.3	74%	0.736	31%	0.305	S	S	*	.	H	α-helix	trans	-101.2	-12.1	-178.4	-65.6	177.6	-178.6	137.2	2.9	113.6	E57 E58 M59	E57-R61 WeakPolarHBondContact O-CG 2.87Å; E57-R61 PolarHBondContact O-N 3.27Å; E57-R61 IonicContact OE2-NH1 3.96Å; E58-R61 CarbonylContact O-C 3.5Å; E58-R61 PolarHBondContact O-N 2.92Å; E58-R61 VanDerWaalsContact O-N 3.11Å; M59-R61 PolarHBondContact O-N 3Å
62	H	98.1	Very high	98.2	Very high	29 Å²	29	59.7 Å²	59.7	13%	0.134	31%	0.308	C	S	.	.			trans	-131.6	93.2	-175.5	-162.5	-47.5	0	0	0	110.6	E58 L64 L65 R66 E110 F131	E58-H62 VanDerWaalsContact O-CB 3.28Å; E58-H62 WeakPolarHBondContact O-CB 3.38Å; E58-H62 PolarHBondContact O-N 2.9Å; H62-L64 VanDerWaalsContact C-N 3.31Å; H62-L64 PolarHBondContact O-N 3.07Å; H62-L65 HydrophobicContact CB-CB 3.91Å; H62-L65 PolarHBondContact ND1-N 2.8Å; H62-L65 WeakPolarHBondContact O-CB 3.28Å; H62-L65 PolarHBondContact O-N 2.91Å; H62-R66 PolarHBondContact O-N 3.18Å; H62-R66 VanDerWaalsContact O-N 3.08Å; H62-E110 IonicContact CD2-OE2 3.45Å; H62-E110 IonicContact CE1-OE2 2.88Å; H62-E110 PolarHBondContact CE1-OE2 3.33Å; H62-E110 IonicContact NE2-OE2 2.91Å; H62-E110 PolarHBondContact NE2-OE2 2.84Å; H62-F131 AromaticContact CD2-CE1 3.61Å; H62-F131 AromaticContact CD2-CZ 3.71Å; H62-F131 AromaticContact NE2-CE1 3.85Å; H62-F131 AromaticContact NE2-CZ 3.59Å
63	P	97.1	Very high	98.2	Very high	75 Å²	75	62.8 Å²	62.8	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-56.9	-40.3	-175	-27.7	35.4	0	0	0	114	R66 E67	P63-R66 WeakPolarHBondContact O-CB 3.21Å; P63-R66 PolarHBondContact O-N 2.82Å; P63-E67 WeakPolarHBondContact O-CG 3.37Å; P63-E67 PolarHBondContact O-N 2.6Å
64	L	97.5	Very high	98.1	Very high	42 Å²	42	63.7 Å²	63.7	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-68.2	-37	-179.4	178.9	65.3	0	0	0	111.8	H62 S68 N105 L107	H62-L64 VanDerWaalsContact C-N 3.31Å; H62-L64 PolarHBondContact O-N 3.07Å; L64-S68 VanDerWaalsContact O-CB 3.25Å; L64-S68 WeakPolarHBondContact O-CB 3.28Å; L64-S68 PolarHBondContact O-N 3.24Å; L64-S68 PolarHBondContact O-OG 3.27Å; L64-N105 HydrophobicContact CD1-CB 3.84Å; L64-N105 HydrophobicContact CD2-CB 4.43Å; L64-L107 HydrophobicContact CD2-CB 4.16Å; L64-L107 HydrophobicContact CG-CB 4.39Å
65	L	98.4	Very high	98	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-45.8	171.6	175.4	60.4	0	0	0	111.2	E58 M59 H62 S68 W69 V99 L107 F131 L134	E58-L65 HydrophobicContact CB-CD2 3.65Å; M59-L65 HydrophobicContact CG-CD2 4.32Å; M59-L65 HydrophobicContact CG-CG 4.06Å; H62-L65 HydrophobicContact CB-CB 3.91Å; H62-L65 PolarHBondContact ND1-N 2.8Å; H62-L65 WeakPolarHBondContact O-CB 3.28Å; H62-L65 PolarHBondContact O-N 2.91Å; L65-S68 PolarHBondContact O-N 3.28Å; L65-W69 WeakPolarHBondContact O-CB 3.46Å; L65-W69 PolarHBondContact O-N 3.47Å; L65-V99 HydrophobicContact CD1-CG1 4.36Å; L65-L107 HydrophobicContact CB-CD1 4.12Å; L65-L107 HydrophobicContact CB-CD2 4.39Å; L65-L107 HydrophobicContact CD1-CD2 3.82Å; L65-F131 HydrophobicContact CD2-CD1 4.22Å; L65-F131 HydrophobicContact CD2-CE1 4.39Å; L65-L134 HydrophobicContact CD1-CD2 3.93Å
66	R	98.5	Very high	98	Very high	103 Å²	103	64.8 Å²	64.8	39%	0.389	33%	0.325	S	S	.	.	H	α-helix	trans	-58	-53.6	178.3	-179	-178.3	61.6	-164	-3.5	111.4	M59 H62 P63 S68 W69 E70	M59-R66 HydrophobicContact CB-CB 3.88Å; M59-R66 HydrophobicContact CB-CG 4.25Å; M59-R66 HydrophobicContact CG-CB 4.25Å; H62-R66 PolarHBondContact O-N 3.18Å; H62-R66 VanDerWaalsContact O-N 3.08Å; P63-R66 WeakPolarHBondContact O-CB 3.21Å; P63-R66 PolarHBondContact O-N 2.82Å; R66-S68 VanDerWaalsContact C-N 3.34Å; R66-S68 PolarHBondContact O-N 2.89Å; R66-W69 PolarHBondContact O-N 2.89Å; R66-E70 HydrophobicContact CG-CG 4.41Å; R66-E70 VanDerWaalsContact CG-OE1 3.26Å; R66-E70 WeakPolarHBondContact CG-OE1 3.32Å; R66-E70 WeakPolarHBondContact O-CB 3.3Å; R66-E70 WeakPolarHBondContact O-CG 3.35Å; R66-E70 PolarHBondContact O-N 2.7Å
67	E	98	Very high	97.9	Very high	109 Å²	109	61.8 Å²	61.8	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-60.3	-44.4	-179.3	-71.4	168.2	-163	0	0	111.5	P63 W69 A71	P63-E67 WeakPolarHBondContact O-CG 3.37Å; P63-E67 PolarHBondContact O-N 2.6Å; E67-W69 PolarHBondContact O-N 2.85Å; E67-A71 WeakPolarHBondContact O-CB 3.47Å; E67-A71 PolarHBondContact O-N 3.39Å; E67-A71 VanDerWaalsContact O-N 3.08Å
68	S	98.1	Very high	97.6	Very high	5 Å²	5	64.1 Å²	64.1	4%	0.035	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-41.3	177.8	-59.1	0	0	0	0	112.2	L64 L65 R66 A72 N105	L64-S68 VanDerWaalsContact O-CB 3.25Å; L64-S68 WeakPolarHBondContact O-CB 3.28Å; L64-S68 PolarHBondContact O-N 3.24Å; L64-S68 PolarHBondContact O-OG 3.27Å; L65-S68 PolarHBondContact O-N 3.28Å; R66-S68 VanDerWaalsContact C-N 3.34Å; R66-S68 PolarHBondContact O-N 2.89Å; S68-A72 WeakPolarHBondContact O-CB 3.49Å; S68-A72 PolarHBondContact O-N 3.26Å; S68-N105 PolarHBondContact OG-ND2 2.77Å
69	W	98.6	Very high	97.3	Very high	10 Å²	10	67.7 Å²	67.7	4%	0.038	34%	0.336	C	S	.	.	H	α-helix	trans	-69	-44	-179.3	-171.1	-81	0	0	0	111.9	L55 M59 L65 R66 E67 A72 Q73 Q92 I95 A96 V99 L134 Y137	L55-W69 HydrophobicContact CD1-CD2 4.23Å; L55-W69 HydrophobicContact CD1-CE3 3.95Å; L55-W69 HydrophobicContact CD1-CH2 4.45Å; L55-W69 HydrophobicContact CD1-CZ3 4.07Å; L55-W69 HydrophobicContact CD2-CD2 3.9Å; L55-W69 VanDerWaalsContact CD2-CE2 3.41Å; L55-W69 HydrophobicContact CD2-CE3 4.2Å; L55-W69 HydrophobicContact CD2-CH2 3.66Å; L55-W69 HydrophobicContact CD2-CZ2 3.29Å; L55-W69 HydrophobicContact CD2-CZ3 4.09Å; M59-W69 HydrophobicContact SD-CB 3.74Å; M59-W69 HydrophobicContact SD-CG 3.69Å; L65-W69 WeakPolarHBondContact O-CB 3.46Å; L65-W69 PolarHBondContact O-N 3.47Å; R66-W69 PolarHBondContact O-N 2.89Å; E67-W69 PolarHBondContact O-N 2.85Å; W69-A72 PolarHBondContact O-N 2.86Å; W69-Q73 WeakPolarHBondContact O-CB 3.41Å; W69-Q73 PolarHBondContact O-N 2.83Å; W69-Q92 HydrophobicContact CH2-CB 4.36Å; W69-Q92 HydrophobicContact CZ2-CB 4.36Å; W69-Q92 HydrophobicContact CZ2-CG 4.42Å; W69-I95 HydrophobicContact CD2-CG2 3.62Å; W69-I95 VanDerWaalsContact CE2-CG2 3.44Å; W69-I95 HydrophobicContact CE3-CG2 3.91Å; W69-I95 HydrophobicContact CG-CG2 4.19Å; W69-I95 HydrophobicContact CH2-CB 4.16Å; W69-I95 HydrophobicContact CH2-CG2 3.89Å; W69-I95 HydrophobicContact CZ2-CB 3.98Å; W69-I95 HydrophobicContact CZ2-CG2 3.59Å; W69-I95 HydrophobicContact CZ3-CG2 4.04Å; W69-A96 HydrophobicContact CH2-CB 4.31Å; W69-A96 HydrophobicContact CZ3-CB 4.08Å; W69-V99 HydrophobicContact CB-CG2 4.39Å; W69-V99 HydrophobicContact CE3-CG2 3.94Å; W69-L134 HydrophobicContact CE3-CD1 4.49Å; W69-L134 HydrophobicContact CZ3-CD1 4.04Å; W69-Y137 HydrophobicContact CH2-CD2 4.03Å; W69-Y137 HydrophobicContact CH2-CE2 4.43Å
70	E	98.3	Very high	97	Very high	110 Å²	110	70.8 Å²	70.8	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-46.2	176.9	-73	170.6	177.9	0	0	111.2	R66 Q73 E74	R66-E70 HydrophobicContact CG-CG 4.41Å; R66-E70 VanDerWaalsContact CG-OE1 3.26Å; R66-E70 WeakPolarHBondContact CG-OE1 3.32Å; R66-E70 WeakPolarHBondContact O-CB 3.3Å; R66-E70 WeakPolarHBondContact O-CG 3.35Å; R66-E70 PolarHBondContact O-N 2.7Å; E70-Q73 PolarHBondContact O-N 3.32Å; E70-E74 PolarHBondContact O-N 3.45Å; E70-E74 VanDerWaalsContact O-N 3.12Å
71	A	97.8	Very high	96.7	Very high	52 Å²	52	74 Å²	74	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-42.2	175.9	0	0	0	0	0	112.4	E67 Q73 E74 A75	E67-A71 WeakPolarHBondContact O-CB 3.47Å; E67-A71 PolarHBondContact O-N 3.39Å; E67-A71 VanDerWaalsContact O-N 3.08Å; A71-Q73 VanDerWaalsContact C-N 3.32Å; A71-Q73 PolarHBondContact O-N 2.94Å; A71-E74 PolarHBondContact O-N 3.01Å; A71-A75 PolarHBondContact O-N 2.72Å
72	A	98.2	Very high	96.5	Very high	9 Å²	9	71.7 Å²	71.7	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-33.3	176.9	0	0	0	0	0	112.3	S68 W69 A75 W76 I95 M98 V99	S68-A72 WeakPolarHBondContact O-CB 3.49Å; S68-A72 PolarHBondContact O-N 3.26Å; W69-A72 PolarHBondContact O-N 2.86Å; A72-A75 PolarHBondContact O-N 3.3Å; A72-W76 VanDerWaalsContact O-CB 3.29Å; A72-W76 WeakPolarHBondContact O-CB 3.4Å; A72-W76 PolarHBondContact O-N 3.01Å; A72-I95 HydrophobicContact CB-CG2 3.8Å; A72-M98 HydrophobicContact CB-CB 3.82Å; A72-V99 HydrophobicContact CB-CG2 3.62Å
73	Q	98.3	Very high	96.3	Very high	98 Å²	98	72 Å²	72	46%	0.458	35%	0.349	S	S	.	.	H	α-helix	trans	-66.2	-41.6	175.1	-177.4	173.2	-18.2	0	0	111.9	W69 E70 A71 W76 E77 I95	W69-Q73 WeakPolarHBondContact O-CB 3.41Å; W69-Q73 PolarHBondContact O-N 2.83Å; E70-Q73 PolarHBondContact O-N 3.32Å; A71-Q73 VanDerWaalsContact C-N 3.32Å; A71-Q73 PolarHBondContact O-N 2.94Å; Q73-W76 WeakPolarHBondContact O-CB 3.34Å; Q73-W76 PolarHBondContact O-N 2.83Å; Q73-E77 PolarHBondContact O-N 3.13Å; Q73-I95 HydrophobicContact CB-CD1 4.01Å; Q73-I95 HydrophobicContact CG-CD1 4.03Å
74	E	97.2	Very high	96	Very high	133 Å²	133	75.5 Å²	75.5	62%	0.621	37%	0.37	S	S	*	.	H	α-helix	trans	-62.3	-48.4	173.3	-174.5	177.4	-174.1	0	0	111.1	E70 A71 W76 E77 H78	E70-E74 PolarHBondContact O-N 3.45Å; E70-E74 VanDerWaalsContact O-N 3.12Å; A71-E74 PolarHBondContact O-N 3.01Å; E74-W76 VanDerWaalsContact C-N 3.27Å; E74-W76 PolarHBondContact O-N 3.06Å; E74-E77 PolarHBondContact O-N 3.27Å; E74-H78 PolarHBondContact O-CD2 2.77Å
75	A	96.2	Very high	95.9	Very high	32 Å²	32	76.2 Å²	76.2	26%	0.264	37%	0.374	S	S	.	.	H	α-helix	trans	-60.1	-37.1	177	0	0	0	0	0	112.7	A71 A72 H78 R79 M98	A71-A75 PolarHBondContact O-N 2.72Å; A72-A75 PolarHBondContact O-N 3.3Å; A75-H78 PolarHBondContact O-N 3.29Å; A75-R79 WeakPolarHBondContact O-CG 3.27Å; A75-R79 PolarHBondContact O-N 2.83Å; A75-R79 VanDerWaalsContact O-N 3.14Å; A75-M98 HydrophobicContact CB-SD 4.36Å
76	W	97.4	Very high	95.6	Very high	9 Å²	9	78.2 Å²	78.2	3%	0.034	39%	0.387	C	S	.	.	H	α-helix	trans	-60.6	-46.5	176.9	174.7	-97.8	0	0	0	112.4	A72 Q73 E74 H78 R79 R80 L83 L85 F89 A91 I95 M98 L214	A72-W76 VanDerWaalsContact O-CB 3.29Å; A72-W76 WeakPolarHBondContact O-CB 3.4Å; A72-W76 PolarHBondContact O-N 3.01Å; Q73-W76 WeakPolarHBondContact O-CB 3.34Å; Q73-W76 PolarHBondContact O-N 2.83Å; E74-W76 VanDerWaalsContact C-N 3.27Å; E74-W76 PolarHBondContact O-N 3.06Å; W76-H78 PolarHBondContact O-N 2.84Å; W76-R79 PolarHBondContact O-N 2.9Å; W76-R80 HydrophobicContact CD2-CB 4.2Å; W76-R80 HydrophobicContact CZ2-CB 3.92Å; W76-R80 VanDerWaalsContact O-CB 3.32Å; W76-R80 WeakPolarHBondContact O-CB 3.45Å; W76-R80 PolarHBondContact O-N 2.86Å; W76-L83 HydrophobicContact CH2-CD1 4.15Å; W76-L83 HydrophobicContact CZ3-CD1 3.77Å; W76-L85 HydrophobicContact CH2-CD1 3.58Å; W76-L85 HydrophobicContact CZ2-CD1 4.04Å; W76-F89 HydrophobicContact CH2-CE1 4.07Å; W76-A91 HydrophobicContact CZ2-CB 4.29Å; W76-A91 VanDerWaalsContact NE1-CB 3.34Å; W76-I95 HydrophobicContact CB-CD1 4.29Å; W76-I95 HydrophobicContact CB-CG1 3.73Å; W76-I95 HydrophobicContact CD2-CG1 4.32Å; W76-I95 HydrophobicContact CG-CD1 4.25Å; W76-I95 HydrophobicContact CG-CG1 3.86Å; W76-M98 HydrophobicContact CB-SD 4.19Å; W76-M98 HydrophobicContact CE3-CE 3.75Å; W76-M98 HydrophobicContact CE3-SD 4.28Å; W76-M98 HydrophobicContact CZ3-CE 4.39Å; W76-L214 HydrophobicContact CH2-CD2 4.32Å; W76-L214 HydrophobicContact CZ3-CD2 3.56Å
77	E	96.4	Very high	95.4	Very high	77 Å²	77	79.2 Å²	79.2	36%	0.36	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-34.1	-178.2	-72.6	-60.6	124.9	0	0	112.3	Q73 E74 R80	Q73-E77 PolarHBondContact O-N 3.13Å; E74-E77 PolarHBondContact O-N 3.27Å; E77-R80 VanDerWaalsContact CD-NH1 3.3Å; E77-R80 IonicContact OE1-CZ 3.27Å; E77-R80 IonicContact OE1-NE 3.09Å; E77-R80 IonicContact OE1-NH1 2.75Å; E77-R80 PolarHBondContact OE1-NH1 3.2Å; E77-R80 IonicContact OE2-CZ 4Å; E77-R80 IonicContact OE2-NE 3.21Å; E77-R80 PolarHBondContact OE2-NE 2.75Å; E77-R80 IonicContact OE2-NH1 2.9Å; E77-R80 PolarHBondContact OE2-NH1 3.27Å; E77-R80 IonicContact OE2-NH2 3.24Å; E77-R80 PolarHBondContact OE2-NH2 3.43Å; E77-R80 VanDerWaalsContact OE2-NH2 3.15Å
78	H	92.8	Very high	95.1	Very high	138 Å²	138	76.7 Å²	76.7	64%	0.639	41%	0.409	S	S	*	.	H	α-helix	trans	-74.7	-34	174.7	-68.4	-63.4	0	0	0	113.7	E74 A75 W76	E74-H78 PolarHBondContact O-CD2 2.77Å; A75-H78 PolarHBondContact O-N 3.29Å; W76-H78 PolarHBondContact O-N 2.84Å
79	R	92.2	Very high	95	Very high	88 Å²	88	77.6 Å²	77.6	33%	0.332	41%	0.413	S	S	.	.	H	α-helix	trans	-92.7	-30	-172.2	-67.9	178.6	-175.3	-165.5	3	114	A75 W76 H81 M82 M98 S215	A75-R79 WeakPolarHBondContact O-CG 3.27Å; A75-R79 PolarHBondContact O-N 2.83Å; A75-R79 VanDerWaalsContact O-N 3.14Å; W76-R79 PolarHBondContact O-N 2.9Å; R79-H81 PolarHBondContact O-N 3.12Å; R79-M82 HydrophobicContact CB-CE 4.4Å; R79-M82 HydrophobicContact CG-CE 4.35Å; R79-M82 WeakPolarHBondContact O-CB 3.32Å; R79-M82 PolarHBondContact O-N 3.25Å; R79-M98 HydrophobicContact CB-CE 4.4Å; R79-S215 PolarHBondContact NH1-O 2.86Å; R79-S215 VanDerWaalsContact NH1-O 3.14Å
80	R	92.9	Very high	94.9	Very high	95 Å²	95	83.3 Å²	83.3	36%	0.358	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-55.1	-33.5	-168.9	69.8	-178.4	-170.5	179.6	1.5	114.3	W76 E77 M82 L83	W76-R80 HydrophobicContact CD2-CB 4.2Å; W76-R80 HydrophobicContact CZ2-CB 3.92Å; W76-R80 VanDerWaalsContact O-CB 3.32Å; W76-R80 WeakPolarHBondContact O-CB 3.45Å; W76-R80 PolarHBondContact O-N 2.86Å; E77-R80 VanDerWaalsContact CD-NH1 3.3Å; E77-R80 IonicContact OE1-CZ 3.27Å; E77-R80 IonicContact OE1-NE 3.09Å; E77-R80 IonicContact OE1-NH1 2.75Å; E77-R80 PolarHBondContact OE1-NH1 3.2Å; E77-R80 IonicContact OE2-CZ 4Å; E77-R80 IonicContact OE2-NE 3.21Å; E77-R80 PolarHBondContact OE2-NE 2.75Å; E77-R80 IonicContact OE2-NH1 2.9Å; E77-R80 PolarHBondContact OE2-NH1 3.27Å; E77-R80 IonicContact OE2-NH2 3.24Å; E77-R80 PolarHBondContact OE2-NH2 3.43Å; E77-R80 VanDerWaalsContact OE2-NH2 3.15Å; R80-M82 PolarHBondContact O-N 3.07Å; R80-L83 PolarHBondContact O-N 2.82Å
81	H	91.9	Very high	94.9	Very high	144 Å²	144	79.5 Å²	79.5	67%	0.667	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-70.7	-16.7	-178.3	-63.7	-71.2	0	0	0	113.3	R79	R79-H81 PolarHBondContact O-N 3.12Å
82	M	92.4	Very high	94.9	Very high	147 Å²	147	80.4 Å²	80.4	72%	0.724	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-96.8	-3.1	177.6	-60.1	-179.4	-74.3	0	0	112.7	R79 R80	R79-M82 HydrophobicContact CB-CE 4.4Å; R79-M82 HydrophobicContact CG-CE 4.35Å; R79-M82 WeakPolarHBondContact O-CB 3.32Å; R79-M82 PolarHBondContact O-N 3.25Å; R80-M82 PolarHBondContact O-N 3.07Å
83	L	93.6	Very high	94.9	Very high	35 Å²	35	80.1 Å²	80.1	18%	0.183	41%	0.414	C	S	.	.			trans	-99.2	137.9	-174.8	-60.3	176.3	0	0	0	111	W76 R80 L85 A213 L214	W76-L83 HydrophobicContact CH2-CD1 4.15Å; W76-L83 HydrophobicContact CZ3-CD1 3.77Å; R80-L83 PolarHBondContact O-N 2.82Å; L83-L85 HydrophobicContact CB-CD1 4.3Å; L83-L85 HydrophobicContact CB-CD2 4.11Å; L83-L85 HydrophobicContact CB-CG 3.98Å; L83-L85 HydrophobicContact CD1-CD2 4.45Å; L83-A213 HydrophobicContact CD2-CB 3.98Å; L83-A213 WeakPolarHBondContact CD2-O 3.29Å; L83-L214 HydrophobicContact CD1-CD2 3.58Å
84	T	92.1	Very high	94.9	Very high	150 Å²	150	75.5 Å²	75.5	92%	0.92	39%	0.393	S	S	*	.			trans	-97.8	114.4	165	-58.1	0	0	0	0	107.8
85	L	93.8	Very high	95	Very high	57 Å²	57	69.5 Å²	69.5	30%	0.298	37%	0.365	S	S	.	.			trans	-116.6	145.2	-172.5	-61	168.2	0	0	0	110.7	W76 L83 F89 L214	W76-L85 HydrophobicContact CH2-CD1 3.58Å; W76-L85 HydrophobicContact CZ2-CD1 4.04Å; L83-L85 HydrophobicContact CB-CD1 4.3Å; L83-L85 HydrophobicContact CB-CD2 4.11Å; L83-L85 HydrophobicContact CB-CG 3.98Å; L83-L85 HydrophobicContact CD1-CD2 4.45Å; L85-F89 HydrophobicContact CB-CB 4.09Å; L85-F89 HydrophobicContact CB-CD1 4.25Å; L85-F89 HydrophobicContact CB-CG 4.31Å; L85-F89 HydrophobicContact CD1-CD1 3.91Å; L85-F89 HydrophobicContact CD1-CE1 4.38Å; L85-F89 HydrophobicContact CD2-CD1 3.89Å; L85-F89 HydrophobicContact CD2-CE1 3.97Å; L85-F89 HydrophobicContact CD2-CG 4.37Å; L85-F89 HydrophobicContact CG-CD1 4.23Å; L85-L214 HydrophobicContact CD2-CD2 4.38Å
86	P	93.9	Very high	95.1	Very high	42 Å²	42	68 Å²	68	27%	0.273	35%	0.352	S	S	.	.			trans	-69.1	159	-179.7	26.9	-31.7	0	0	0	111.8	G88 F89 L144 L145	P86-G88 PolarHBondContact O-N 2.66Å; P86-F89 HydrophobicContact CG-CB 4.08Å; P86-F89 HydrophobicContact CG-CD2 4.13Å; P86-F89 HydrophobicContact CG-CG 4.45Å; P86-F89 WeakPolarHBondContact O-CB 3.5Å; P86-F89 PolarHBondContact O-N 3.03Å; P86-F89 VanDerWaalsContact O-N 3.09Å; P86-L144 HydrophobicContact CG-CB 4.35Å; P86-L144 VanDerWaalsContact CG-O 3.24Å; P86-L144 WeakPolarHBondContact CG-O 3.37Å; P86-L145 HydrophobicContact CG-CD2 4.24Å
87	P	92.5	Very high	95.2	Very high	124 Å²	124	67.5 Å²	67.5	81%	0.805	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	137.5	175.4	-25.7	34.7	0	0	0	112.4	F89	P87-F89 PolarHBondContact O-N 2.89Å
88	G	92.9	Very high	95.2	Very high	55 Å²	55	64 Å²	64	57%	0.567	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-2.4	-178.5	0	0	0	0	0	114.9	P86 R90	P86-G88 PolarHBondContact O-N 2.66Å; G88-R90 PolarHBondContact O-N 2.95Å
89	F	96.1	Very high	95.5	Very high	24 Å²	24	57.5 Å²	57.5	11%	0.105	30%	0.304	C	S	.	.			trans	-73.9	124.9	172	-159.1	-79.9	0	0	0	110.9	W76 L85 P86 P87 H93 I97 A141 L144 L145 L214	W76-F89 HydrophobicContact CH2-CE1 4.07Å; L85-F89 HydrophobicContact CB-CB 4.09Å; L85-F89 HydrophobicContact CB-CD1 4.25Å; L85-F89 HydrophobicContact CB-CG 4.31Å; L85-F89 HydrophobicContact CD1-CD1 3.91Å; L85-F89 HydrophobicContact CD1-CE1 4.38Å; L85-F89 HydrophobicContact CD2-CD1 3.89Å; L85-F89 HydrophobicContact CD2-CE1 3.97Å; L85-F89 HydrophobicContact CD2-CG 4.37Å; L85-F89 HydrophobicContact CG-CD1 4.23Å; P86-F89 HydrophobicContact CG-CB 4.08Å; P86-F89 HydrophobicContact CG-CD2 4.13Å; P86-F89 HydrophobicContact CG-CG 4.45Å; P86-F89 WeakPolarHBondContact O-CB 3.5Å; P86-F89 PolarHBondContact O-N 3.03Å; P86-F89 VanDerWaalsContact O-N 3.09Å; P87-F89 PolarHBondContact O-N 2.89Å; F89-H93 HydrophobicContact CD1-CB 4.11Å; F89-H93 HydrophobicContact CD2-CB 4.18Å; F89-H93 HydrophobicContact CE1-CB 3.67Å; F89-H93 HydrophobicContact CE2-CB 3.7Å; F89-H93 HydrophobicContact CG-CB 4.37Å; F89-H93 HydrophobicContact CZ-CB 3.45Å; F89-H93 VanDerWaalsContact CZ-CB 3.45Å; F89-I97 HydrophobicContact CZ-CD1 4.33Å; F89-A141 HydrophobicContact CE2-CB 4.05Å; F89-A141 HydrophobicContact CZ-CB 4.35Å; F89-L144 HydrophobicContact CB-CD1 4.47Å; F89-L144 HydrophobicContact CD2-CB 3.97Å; F89-L144 HydrophobicContact CD2-CD1 4.23Å; F89-L145 HydrophobicContact CD2-CD2 4.13Å; F89-L145 HydrophobicContact CD2-CG 4.07Å; F89-L145 HydrophobicContact CE2-CD1 3.71Å; F89-L145 HydrophobicContact CE2-CD2 3.82Å; F89-L145 HydrophobicContact CE2-CG 3.53Å; F89-L145 HydrophobicContact CZ-CD1 4.18Å; F89-L145 HydrophobicContact CZ-CD2 4.47Å; F89-L145 HydrophobicContact CZ-CG 4.38Å; F89-L214 HydrophobicContact CZ-CD1 3.93Å
90	R	96.1	Very high	95.8	Very high	130 Å²	130	53.6 Å²	53.6	49%	0.491	29%	0.29	S	S	.	.			trans	-114.5	165	-176.2	-57.5	-174.9	-175.5	-176.8	11.7	110.8	D48 G88 Q92 H93 G94	D48-R90 IonicContact OD1-NH1 3.15Å; D48-R90 IonicContact OD2-CZ 3.69Å; D48-R90 IonicContact OD2-NH1 3.57Å; D48-R90 PolarHBondContact OD2-NH1 2.59Å; D48-R90 IonicContact OD2-NH2 2.84Å; D48-R90 PolarHBondContact OD2-NH2 2.87Å; D48-R90 VanDerWaalsContact OD2-NH2 3.16Å; G88-R90 PolarHBondContact O-N 2.95Å; R90-Q92 VanDerWaalsContact C-N 3.25Å; R90-Q92 PolarHBondContact O-N 3.07Å; R90-H93 PolarHBondContact N-ND1 3.32Å; R90-H93 WeakPolarHBondContact O-CB 3.49Å; R90-H93 PolarHBondContact O-N 3.15Å; R90-H93 VanDerWaalsContact O-N 3.08Å; R90-G94 PolarHBondContact O-N 3.12Å
91	A	97.6	Very high	96.1	Very high	31 Å²	31	49.4 Å²	49.4	26%	0.256	27%	0.274	S	S	.	.	H	α-helix	trans	-53.6	-42.1	-179.8	0	0	0	0	0	112.8	W76 H93 G94 I95	W76-A91 HydrophobicContact CZ2-CB 4.29Å; W76-A91 VanDerWaalsContact NE1-CB 3.34Å; A91-H93 VanDerWaalsContact C-N 3.26Å; A91-H93 PolarHBondContact O-N 2.89Å; A91-G94 PolarHBondContact O-N 3.35Å; A91-G94 VanDerWaalsContact O-N 3.1Å; A91-I95 HydrophobicContact CB-CD1 4.35Å; A91-I95 VanDerWaalsContact O-CG1 3.29Å; A91-I95 WeakPolarHBondContact O-CG1 3.31Å; A91-I95 PolarHBondContact O-N 3.35Å
92	Q	98.4	Very high	96.2	Very high	70 Å²	70	44.1 Å²	44.1	33%	0.327	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-33.9	-179	-61.8	80.6	-3.3	0	0	112.6	W69 R90 A96 Y137	W69-Q92 HydrophobicContact CH2-CB 4.36Å; W69-Q92 HydrophobicContact CZ2-CB 4.36Å; W69-Q92 HydrophobicContact CZ2-CG 4.42Å; R90-Q92 VanDerWaalsContact C-N 3.25Å; R90-Q92 PolarHBondContact O-N 3.07Å; Q92-A96 VanDerWaalsContact O-CB 3.25Å; Q92-A96 WeakPolarHBondContact O-CB 3.4Å; Q92-A96 PolarHBondContact O-N 3.06Å; Q92-Y137 HydrophobicContact CB-CD1 3.68Å; Q92-Y137 HydrophobicContact CB-CD2 4.26Å; Q92-Y137 HydrophobicContact CB-CE1 3.54Å; Q92-Y137 HydrophobicContact CB-CE2 4.14Å; Q92-Y137 HydrophobicContact CB-CG 4.04Å; Q92-Y137 HydrophobicContact CG-CE1 4.03Å; Q92-Y137 HydrophobicContact CG-CE2 4.4Å
93	H	98.4	Very high	96.1	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.019	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-44.7	175.7	-56.8	151.2	0	0	0	111.3	F89 R90 A91 I97 Y137 R140 A141 L144	F89-H93 HydrophobicContact CD1-CB 4.11Å; F89-H93 HydrophobicContact CD2-CB 4.18Å; F89-H93 HydrophobicContact CE1-CB 3.67Å; F89-H93 HydrophobicContact CE2-CB 3.7Å; F89-H93 HydrophobicContact CG-CB 4.37Å; F89-H93 HydrophobicContact CZ-CB 3.45Å; F89-H93 VanDerWaalsContact CZ-CB 3.45Å; R90-H93 PolarHBondContact N-ND1 3.32Å; R90-H93 WeakPolarHBondContact O-CB 3.49Å; R90-H93 PolarHBondContact O-N 3.15Å; R90-H93 VanDerWaalsContact O-N 3.08Å; A91-H93 VanDerWaalsContact C-N 3.26Å; A91-H93 PolarHBondContact O-N 2.89Å; H93-I97 PolarHBondContact O-N 3.34Å; H93-Y137 AromaticContact CD2-CD1 3.88Å; H93-R140 WeakPolarHBondContact NE2-CG 3.47Å; H93-A141 HydrophobicContact CB-CB 3.68Å; H93-L144 WeakPolarHBondContact ND1-CD1 3.2Å
94	G	98.2	Very high	95.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.6	-42.6	178.9	0	0	0	0	0	112.6	R90 A91 A96 I97 M98	R90-G94 PolarHBondContact O-N 3.12Å; A91-G94 PolarHBondContact O-N 3.35Å; A91-G94 VanDerWaalsContact O-N 3.1Å; G94-A96 VanDerWaalsContact C-N 3.35Å; G94-A96 PolarHBondContact O-N 2.84Å; G94-I97 PolarHBondContact O-N 3.16Å; G94-M98 WeakPolarHBondContact O-CG 3.15Å; G94-M98 PolarHBondContact O-N 3.43Å
95	I	98.7	Very high	95.9	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.036	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-43.9	175.1	-65.5	165.2	0	0	0	110.3	W69 A72 Q73 W76 A91 I97 M98 V99	W69-I95 HydrophobicContact CD2-CG2 3.62Å; W69-I95 VanDerWaalsContact CE2-CG2 3.44Å; W69-I95 HydrophobicContact CE3-CG2 3.91Å; W69-I95 HydrophobicContact CG-CG2 4.19Å; W69-I95 HydrophobicContact CH2-CB 4.16Å; W69-I95 HydrophobicContact CH2-CG2 3.89Å; W69-I95 HydrophobicContact CZ2-CB 3.98Å; W69-I95 HydrophobicContact CZ2-CG2 3.59Å; W69-I95 HydrophobicContact CZ3-CG2 4.04Å; A72-I95 HydrophobicContact CB-CG2 3.8Å; Q73-I95 HydrophobicContact CB-CD1 4.01Å; Q73-I95 HydrophobicContact CG-CD1 4.03Å; W76-I95 HydrophobicContact CB-CD1 4.29Å; W76-I95 HydrophobicContact CB-CG1 3.73Å; W76-I95 HydrophobicContact CD2-CG1 4.32Å; W76-I95 HydrophobicContact CG-CD1 4.25Å; W76-I95 HydrophobicContact CG-CG1 3.86Å; A91-I95 HydrophobicContact CB-CD1 4.35Å; A91-I95 VanDerWaalsContact O-CG1 3.29Å; A91-I95 WeakPolarHBondContact O-CG1 3.31Å; A91-I95 PolarHBondContact O-N 3.35Å; I95-I97 VanDerWaalsContact C-N 3.27Å; I95-I97 PolarHBondContact O-N 3.41Å; I95-M98 PolarHBondContact O-N 2.87Å; I95-M98 VanDerWaalsContact O-N 3.14Å; I95-V99 HydrophobicContact CG2-CG2 4.21Å; I95-V99 WeakPolarHBondContact O-CB 3.34Å; I95-V99 VanDerWaalsContact O-CG2 3.27Å; I95-V99 WeakPolarHBondContact O-CG2 3.3Å; I95-V99 PolarHBondContact O-N 2.99Å
96	A	98.8	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-37.6	176.5	0	0	0	0	0	112.8	W69 Q92 G94 Y100 L134	W69-A96 HydrophobicContact CH2-CB 4.31Å; W69-A96 HydrophobicContact CZ3-CB 4.08Å; Q92-A96 VanDerWaalsContact O-CB 3.25Å; Q92-A96 WeakPolarHBondContact O-CB 3.4Å; Q92-A96 PolarHBondContact O-N 3.06Å; G94-A96 VanDerWaalsContact C-N 3.35Å; G94-A96 PolarHBondContact O-N 2.84Å; A96-Y100 WeakPolarHBondContact O-CB 3.26Å; A96-Y100 PolarHBondContact O-N 3.29Å; A96-L134 HydrophobicContact CB-CD1 3.99Å
97	I	98.7	Very high	96.1	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-47.6	173.4	-71.2	167.6	0	0	0	110.9	F89 H93 G94 I95 V99 Y100 T101 L138 A141 L145 I211 L214	F89-I97 HydrophobicContact CZ-CD1 4.33Å; H93-I97 PolarHBondContact O-N 3.34Å; G94-I97 PolarHBondContact O-N 3.16Å; I95-I97 VanDerWaalsContact C-N 3.27Å; I95-I97 PolarHBondContact O-N 3.41Å; I97-V99 VanDerWaalsContact C-N 3.27Å; I97-V99 PolarHBondContact O-N 3.36Å; I97-Y100 PolarHBondContact O-N 3.03Å; I97-Y100 VanDerWaalsContact O-N 3.1Å; I97-T101 HydrophobicContact CG2-CG2 4.16Å; I97-T101 WeakPolarHBondContact O-CG2 3.18Å; I97-T101 PolarHBondContact O-N 2.81Å; I97-T101 PolarHBondContact O-OG1 2.94Å; I97-T101 VanDerWaalsContact O-OG1 3.1Å; I97-L138 HydrophobicContact CG1-CD1 3.86Å; I97-A141 HydrophobicContact CD1-CB 3.65Å; I97-A141 HydrophobicContact CG1-CB 4.06Å; I97-L145 HydrophobicContact CD1-CD1 3.44Å; I97-L145 VanDerWaalsContact CD1-CD1 3.44Å; I97-I211 HydrophobicContact CD1-CG2 3.93Å; I97-I211 HydrophobicContact CG1-CG2 4.47Å; I97-I211 HydrophobicContact CG2-CB 3.96Å; I97-I211 HydrophobicContact CG2-CD1 3.9Å; I97-I211 HydrophobicContact CG2-CG2 4.28Å; I97-L214 HydrophobicContact CB-CB 4.32Å; I97-L214 HydrophobicContact CD1-CD1 3.69Å; I97-L214 HydrophobicContact CG2-CB 3.65Å
98	M	98.3	Very high	96.3	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-57.8	-42.2	176.9	-71.6	177	-180	0	0	111.6	A72 A75 W76 R79 G94 I95 T101 N102 L214 V216	A72-M98 HydrophobicContact CB-CB 3.82Å; A75-M98 HydrophobicContact CB-SD 4.36Å; W76-M98 HydrophobicContact CB-SD 4.19Å; W76-M98 HydrophobicContact CE3-CE 3.75Å; W76-M98 HydrophobicContact CE3-SD 4.28Å; W76-M98 HydrophobicContact CZ3-CE 4.39Å; R79-M98 HydrophobicContact CB-CE 4.4Å; G94-M98 WeakPolarHBondContact O-CG 3.15Å; G94-M98 PolarHBondContact O-N 3.43Å; I95-M98 PolarHBondContact O-N 2.87Å; I95-M98 VanDerWaalsContact O-N 3.14Å; M98-T101 PolarHBondContact O-N 3.4Å; M98-T101 PolarHBondContact O-OG1 2.87Å; M98-N102 PolarHBondContact O-N 3.19Å; M98-L214 WeakPolarHBondContact CG-O 3.28Å; M98-V216 HydrophobicContact CB-CG2 4.45Å; M98-V216 WeakPolarHBondContact O-CG2 3.48Å
99	V	98.6	Very high	96.5	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-45.7	174.4	170.7	0	0	0	0	111.3	L65 W69 A72 I95 I97 N102 L107 L134	L65-V99 HydrophobicContact CD1-CG1 4.36Å; W69-V99 HydrophobicContact CB-CG2 4.39Å; W69-V99 HydrophobicContact CE3-CG2 3.94Å; A72-V99 HydrophobicContact CB-CG2 3.62Å; I95-V99 HydrophobicContact CG2-CG2 4.21Å; I95-V99 WeakPolarHBondContact O-CB 3.34Å; I95-V99 VanDerWaalsContact O-CG2 3.27Å; I95-V99 WeakPolarHBondContact O-CG2 3.3Å; I95-V99 PolarHBondContact O-N 2.99Å; I97-V99 VanDerWaalsContact C-N 3.27Å; I97-V99 PolarHBondContact O-N 3.36Å; V99-N102 PolarHBondContact O-N 2.8Å; V99-L107 HydrophobicContact CG1-CD2 3.33Å; V99-L107 HydrophobicContact CG1-CG 4.46Å; V99-L134 HydrophobicContact CG1-CD1 4.26Å
100	Y	98.6	Very high	96.6	Very high	6 Å²	6	39.8 Å²	39.8	2%	0.024	20%	0.202	C	C	.	.	H	α-helix	trans	-66.5	-40.7	-179.9	178.5	-90.6	0	0	0	112.9	A96 I97 N102 Y108 L111 N112 L138 F182 S184 L224	A96-Y100 WeakPolarHBondContact O-CB 3.26Å; A96-Y100 PolarHBondContact O-N 3.29Å; I97-Y100 PolarHBondContact O-N 3.03Å; I97-Y100 VanDerWaalsContact O-N 3.1Å; Y100-N102 VanDerWaalsContact C-N 3.28Å; Y100-N102 PolarHBondContact O-N 2.72Å; Y100-Y108 WeakPolarHBondContact O-CB 3.27Å; Y100-L111 HydrophobicContact CD2-CD2 3.94Å; Y100-L111 HydrophobicContact CE2-CD2 4.4Å; Y100-N112 PolarHBondContact OH-ND2 2.79Å; Y100-L138 HydrophobicContact CD2-CD2 3.58Å; Y100-L138 HydrophobicContact CE2-CD2 4.21Å; Y100-L138 HydrophobicContact CG-CD1 4.42Å; Y100-L138 HydrophobicContact CG-CD2 3.88Å; Y100-F182 HydrophobicContact CE2-CB 3.8Å; Y100-F182 PolarHBondContact OH-O 3.45Å; Y100-S184 VanDerWaalsContact CE1-OG 3.25Å; Y100-S184 WeakPolarHBondContact CE1-OG 3.44Å; Y100-S184 PolarHBondContact OH-OG 2.95Å; Y100-L224 HydrophobicContact CD1-CD1 4.2Å; Y100-L224 HydrophobicContact CD1-CD2 3.59Å; Y100-L224 HydrophobicContact CE1-CD1 3.34Å; Y100-L224 HydrophobicContact CE1-CD2 3.61Å; Y100-L224 HydrophobicContact CE1-CG 4.13Å; Y100-L224 HydrophobicContact CG-CD2 4.21Å
101	T	97.8	Very high	96.7	Very high	6 Å²	6	33.7 Å²	33.7	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-79.2	-8.6	-178.2	59.6	0	0	0	0	113.9	I97 M98 S103 I211 S215 V216 F217 E222	I97-T101 HydrophobicContact CG2-CG2 4.16Å; I97-T101 WeakPolarHBondContact O-CG2 3.18Å; I97-T101 PolarHBondContact O-N 2.81Å; I97-T101 PolarHBondContact O-OG1 2.94Å; I97-T101 VanDerWaalsContact O-OG1 3.1Å; M98-T101 PolarHBondContact O-N 3.4Å; M98-T101 PolarHBondContact O-OG1 2.87Å; T101-S103 VanDerWaalsContact C-N 3.33Å; T101-S103 PolarHBondContact O-N 2.01Å; T101-I211 HydrophobicContact CG2-CD1 3.55Å; T101-S215 WeakPolarHBondContact CB-OG 3.48Å; T101-S215 WeakPolarHBondContact OG1-CA 3.36Å; T101-V216 PolarHBondContact OG1-N 2.98Å; T101-F217 WeakPolarHBondContact O-CD2 3.21Å; T101-E222 WeakPolarHBondContact CG2-OE2 3.17Å
102	N	95.7	Very high	96.7	Very high	33 Å²	33	32.4 Å²	32.4	18%	0.176	17%	0.168	C	C	.	.			trans	-74.8	84.7	179.6	-168.3	-2.1	0	0	0	111.8	M98 V99 Y100 S104 N105 V216	M98-N102 PolarHBondContact O-N 3.19Å; V99-N102 PolarHBondContact O-N 2.8Å; Y100-N102 VanDerWaalsContact C-N 3.28Å; Y100-N102 PolarHBondContact O-N 2.72Å; N102-S104 PolarHBondContact O-N 2.93Å; N102-S104 WeakPolarHBondContact OD1-CB 3.09Å; N102-S104 PolarHBondContact OD1-N 2.99Å; N102-S104 VanDerWaalsContact OD1-N 3.14Å; N102-S104 PolarHBondContact OD1-OG 2.95Å; N102-N105 PolarHBondContact O-N 2.87Å; N102-V216 HydrophobicContact CB-CG2 4.07Å
103	S	88.7	Confident	96.7	Very high	58 Å²	58	32.4 Å²	32.4	41%	0.406	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-0.9	175.3	66.7	0	0	0	0	114.6	T101 N105 F217	T101-S103 VanDerWaalsContact C-N 3.33Å; T101-S103 PolarHBondContact O-N 2.01Å; S103-N105 PolarHBondContact O-N 3.29Å; S103-F217 WeakPolarHBondContact OG-CE2 3.38Å
104	S	89.4	Confident	96.7	Very high	97 Å²	97	32.9 Å²	32.9	68%	0.678	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-7.7	171.7	-55	0	0	0	0	112.7	N102	N102-S104 PolarHBondContact O-N 2.93Å; N102-S104 WeakPolarHBondContact OD1-CB 3.09Å; N102-S104 PolarHBondContact OD1-N 2.99Å; N102-S104 VanDerWaalsContact OD1-N 3.14Å; N102-S104 PolarHBondContact OD1-OG 2.95Å
105	N	91.9	Very high	96.7	Very high	30 Å²	30	32.9 Å²	32.9	16%	0.16	17%	0.172	C	C	.	.	S	Bend	trans	-139.8	179	172.3	71.7	56.1	0	0	0	112.5	L64 S68 N102 S103 L107	L64-N105 HydrophobicContact CD1-CB 3.84Å; L64-N105 HydrophobicContact CD2-CB 4.43Å; S68-N105 PolarHBondContact OG-ND2 2.77Å; N102-N105 PolarHBondContact O-N 2.87Å; S103-N105 PolarHBondContact O-N 3.29Å; N105-L107 WeakPolarHBondContact OD1-CB 3.31Å; N105-L107 PolarHBondContact OD1-N 2.9Å
106	T	95.1	Very high	96.6	Very high	75 Å²	75	36.4 Å²	36.4	46%	0.46	19%	0.185	S	C	.	.	S	Bend	trans	-92.8	4.3	-172.7	53.2	0	0	0	0	114.7	Y108 W109 E110	T106-Y108 PolarHBondContact O-N 3.3Å; T106-W109 WeakPolarHBondContact O-CA 3.29Å; T106-W109 WeakPolarHBondContact O-CB 3.21Å; T106-W109 PolarHBondContact O-N 3.01Å; T106-E110 PolarHBondContact O-N 3.21Å; T106-E110 PolarHBondContact OG1-OE1 3.37Å
107	L	97.1	Very high	96.5	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-38.3	-168.6	-172.6	66.3	0	0	0	113.1	L64 L65 V99 N105 W109 E110 L111 F131	L64-L107 HydrophobicContact CD2-CB 4.16Å; L64-L107 HydrophobicContact CG-CB 4.39Å; L65-L107 HydrophobicContact CB-CD1 4.12Å; L65-L107 HydrophobicContact CB-CD2 4.39Å; L65-L107 HydrophobicContact CD1-CD2 3.82Å; V99-L107 HydrophobicContact CG1-CD2 3.33Å; V99-L107 HydrophobicContact CG1-CG 4.46Å; N105-L107 WeakPolarHBondContact OD1-CB 3.31Å; N105-L107 PolarHBondContact OD1-N 2.9Å; L107-W109 PolarHBondContact O-N 2.91Å; L107-E110 PolarHBondContact O-N 3.38Å; L107-L111 WeakPolarHBondContact O-CB 3.46Å; L107-L111 PolarHBondContact O-N 3.01Å; L107-F131 HydrophobicContact CD1-CE1 3.83Å; L107-F131 HydrophobicContact CD1-CZ 4.01Å
108	Y	96.7	Very high	96.3	Very high	90 Å²	90	41.2 Å²	41.2	35%	0.353	22%	0.217	S	C	.	.	H	α-helix	trans	-60.4	-36.8	174.1	84.2	-89	0	0	0	111.4	Y100 T106 N112	Y100-Y108 WeakPolarHBondContact O-CB 3.27Å; T106-Y108 PolarHBondContact O-N 3.3Å; Y108-N112 VanDerWaalsContact O-CB 3.24Å; Y108-N112 WeakPolarHBondContact O-CB 3.39Å; Y108-N112 PolarHBondContact O-N 3.3Å; Y108-N112 PolarHBondContact O-ND2 3.33Å; Y108-N112 VanDerWaalsContact O-ND2 3.13Å
109	W	96.8	Very high	96.1	Very high	140 Å²	140	41 Å²	41	53%	0.53	22%	0.216	S	C	.	.	H	α-helix	trans	-70.2	-42.8	177.6	172.9	91.2	0	0	0	110.9	T106 L107 N112 Q113	T106-W109 WeakPolarHBondContact O-CA 3.29Å; T106-W109 WeakPolarHBondContact O-CB 3.21Å; T106-W109 PolarHBondContact O-N 3.01Å; L107-W109 PolarHBondContact O-N 2.91Å; W109-N112 PolarHBondContact O-N 3.42Å; W109-Q113 WeakPolarHBondContact O-CB 3.43Å; W109-Q113 PolarHBondContact O-N 3.11Å
110	E	98.2	Very high	96	Very high	52 Å²	52	42.2 Å²	42.2	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-44.4	175.7	-68.9	-178.3	-144.8	0	0	112.1	H62 T106 L107 Q113 A114 F131	H62-E110 IonicContact CD2-OE2 3.45Å; H62-E110 IonicContact CE1-OE2 2.88Å; H62-E110 PolarHBondContact CE1-OE2 3.33Å; H62-E110 IonicContact NE2-OE2 2.91Å; H62-E110 PolarHBondContact NE2-OE2 2.84Å; T106-E110 PolarHBondContact O-N 3.21Å; T106-E110 PolarHBondContact OG1-OE1 3.37Å; L107-E110 PolarHBondContact O-N 3.38Å; E110-Q113 PolarHBondContact O-N 3.2Å; E110-A114 WeakPolarHBondContact O-CB 3.31Å; E110-A114 PolarHBondContact O-N 3.15Å; E110-F131 HydrophobicContact CB-CE2 4.08Å; E110-F131 HydrophobicContact CB-CZ 4.01Å
111	L	98.4	Very high	95.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-51.5	174.3	175.6	65.2	0	0	0	110.5	Y100 L107 Q113 A114 V115 F131 L134 L138 F182	Y100-L111 HydrophobicContact CD2-CD2 3.94Å; Y100-L111 HydrophobicContact CE2-CD2 4.4Å; L107-L111 WeakPolarHBondContact O-CB 3.46Å; L107-L111 PolarHBondContact O-N 3.01Å; L111-Q113 VanDerWaalsContact C-N 3.26Å; L111-Q113 PolarHBondContact O-N 2.79Å; L111-A114 PolarHBondContact O-N 3.43Å; L111-A114 VanDerWaalsContact O-N 3.14Å; L111-V115 HydrophobicContact CD1-CG2 4.07Å; L111-V115 HydrophobicContact CG-CG2 4.34Å; L111-V115 VanDerWaalsContact O-CG2 3.3Å; L111-V115 WeakPolarHBondContact O-CG2 3.43Å; L111-V115 PolarHBondContact O-N 2.79Å; L111-F131 HydrophobicContact CB-CD2 4.21Å; L111-F131 HydrophobicContact CB-CE2 4.38Å; L111-F131 HydrophobicContact CD1-CB 3.51Å; L111-F131 HydrophobicContact CD1-CD2 3.75Å; L111-F131 HydrophobicContact CD1-CG 3.81Å; L111-L134 HydrophobicContact CD1-CD2 4.37Å; L111-L134 HydrophobicContact CD2-CD2 4.12Å; L111-L134 HydrophobicContact CD2-CG 4.31Å; L111-L138 HydrophobicContact CD2-CD2 3.86Å; L111-F182 HydrophobicContact CD2-CD2 4.24Å; L111-F182 HydrophobicContact CD2-CE2 4.47Å
112	N	98.4	Very high	95.9	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-33.8	-179	-78.2	-26.3	0	0	0	112.5	Y100 Y108 W109 R116 Q181 F182	Y100-N112 PolarHBondContact OH-ND2 2.79Å; Y108-N112 VanDerWaalsContact O-CB 3.24Å; Y108-N112 WeakPolarHBondContact O-CB 3.39Å; Y108-N112 PolarHBondContact O-N 3.3Å; Y108-N112 PolarHBondContact O-ND2 3.33Å; Y108-N112 VanDerWaalsContact O-ND2 3.13Å; W109-N112 PolarHBondContact O-N 3.42Å; N112-R116 WeakPolarHBondContact O-CB 3.42Å; N112-R116 WeakPolarHBondContact O-CG 3.44Å; N112-R116 PolarHBondContact O-N 3.25Å; N112-R116 PolarHBondContact O-NE 3.49Å; N112-Q181 HydrophobicContact CB-CB 4.1Å; N112-Q181 PolarHBondContact ND2-NE2 2.88Å; N112-Q181 VanDerWaalsContact ND2-NE2 3.2Å; N112-F182 PolarHBondContact ND2-O 3.11Å; N112-F182 PolarHBondContact OD1-N 3.38Å; N112-F182 PolarHBondContact OD1-O 3.44Å; N112-F182 VanDerWaalsContact OD1-O 3.07Å
113	Q	97.8	Very high	96	Very high	70 Å²	70	50 Å²	50	33%	0.327	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-48.8	171.8	179.9	64.7	37	0	0	111.4	W109 E110 L111 V115 R116 T117	W109-Q113 WeakPolarHBondContact O-CB 3.43Å; W109-Q113 PolarHBondContact O-N 3.11Å; E110-Q113 PolarHBondContact O-N 3.2Å; L111-Q113 VanDerWaalsContact C-N 3.26Å; L111-Q113 PolarHBondContact O-N 2.79Å; Q113-V115 VanDerWaalsContact C-N 3.3Å; Q113-V115 PolarHBondContact O-N 3.49Å; Q113-R116 PolarHBondContact O-N 2.95Å; Q113-T117 PolarHBondContact O-N 3.34Å; Q113-T117 PolarHBondContact O-OG1 3Å
114	A	98.3	Very high	96.3	Very high	14 Å²	14	51.1 Å²	51.1	12%	0.116	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-39	178.3	0	0	0	0	0	111.8	E110 L111 T117 G118 F129 P130 F131	E110-A114 WeakPolarHBondContact O-CB 3.31Å; E110-A114 PolarHBondContact O-N 3.15Å; L111-A114 PolarHBondContact O-N 3.43Å; L111-A114 VanDerWaalsContact O-N 3.14Å; A114-T117 PolarHBondContact O-N 2.88Å; A114-G118 VanDerWaalsContact O-CA 3.25Å; A114-G118 WeakPolarHBondContact O-CA 3.09Å; A114-G118 PolarHBondContact O-N 3.31Å; A114-F129 HydrophobicContact CB-CD2 4.1Å; A114-F129 HydrophobicContact CB-CE2 3.89Å; A114-F129 WeakPolarHBondContact O-CE2 3.28Å; A114-P130 HydrophobicContact CB-CG 4.45Å; A114-F131 HydrophobicContact CB-CD2 3.85Å; A114-F131 HydrophobicContact CB-CE2 4.13Å
115	V	98.5	Very high	96.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-42.7	176.2	172.8	0	0	0	0	111.3	T35 F36 L111 Q113 T117 F129 Q181 F182 P227	T35-V115 CarbonylContact C-O 3.55Å; T35-V115 VanDerWaalsContact CA-O 3.31Å; T35-V115 WeakPolarHBondContact CA-O 3.34Å; T35-V115 HydrophobicContact CG2-CG1 3.92Å; F36-V115 PolarHBondContact N-O 3.25Å; F36-V115 WeakPolarHBondContact O-CG1 3.38Å; L111-V115 HydrophobicContact CD1-CG2 4.07Å; L111-V115 HydrophobicContact CG-CG2 4.34Å; L111-V115 VanDerWaalsContact O-CG2 3.3Å; L111-V115 WeakPolarHBondContact O-CG2 3.43Å; L111-V115 PolarHBondContact O-N 2.79Å; Q113-V115 VanDerWaalsContact C-N 3.3Å; Q113-V115 PolarHBondContact O-N 3.49Å; V115-T117 VanDerWaalsContact C-N 3.29Å; V115-T117 PolarHBondContact O-N 3.05Å; V115-F129 HydrophobicContact CG2-CE2 4.1Å; V115-F129 HydrophobicContact CG2-CZ 3.95Å; V115-Q181 HydrophobicContact CG1-CB 4.32Å; V115-F182 HydrophobicContact CG2-CD2 4.38Å; V115-F182 HydrophobicContact CG2-CE2 4.32Å; V115-P227 HydrophobicContact CG1-CB 4.19Å; V115-P227 HydrophobicContact CG1-CG 4.5Å
116	R	97	Very high	97	Very high	81 Å²	81	48.2 Å²	48.2	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-60.8	-33.5	179.1	-86.6	-178.7	-82.8	118	-0.9	114.1	D34 N112 Q113 G180 Q181	D34-R116 CarbonylContact C-O 3.51Å; N112-R116 WeakPolarHBondContact O-CB 3.42Å; N112-R116 WeakPolarHBondContact O-CG 3.44Å; N112-R116 PolarHBondContact O-N 3.25Å; N112-R116 PolarHBondContact O-NE 3.49Å; Q113-R116 PolarHBondContact O-N 2.95Å; R116-G180 WeakPolarHBondContact CA-O 3.31Å; R116-G180 WeakPolarHBondContact CG-O 3.48Å; R116-Q181 VanDerWaalsContact CD-OE1 3.29Å; R116-Q181 HydrophobicContact CG-CB 4.1Å; R116-Q181 HydrophobicContact CG-CG 4.33Å
117	T	95.6	Very high	97.1	Very high	88 Å²	88	53 Å²	53	54%	0.54	25%	0.251	S	S	.	.	H	α-helix	trans	-119.3	-11	-169.8	63	0	0	0	0	114.5	Q113 A114 V115 G119	Q113-T117 PolarHBondContact O-N 3.34Å; Q113-T117 PolarHBondContact O-OG1 3Å; A114-T117 PolarHBondContact O-N 2.88Å; V115-T117 VanDerWaalsContact C-N 3.29Å; V115-T117 PolarHBondContact O-N 3.05Å; T117-G119 VanDerWaalsContact C-N 3.32Å; T117-G119 PolarHBondContact O-N 3.5Å
118	G	95.2	Very high	97	Very high	12 Å²	12	59.1 Å²	59.1	12%	0.124	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.7	-173.5	0	0	0	0	0	115.2	A114	A114-G118 VanDerWaalsContact O-CA 3.25Å; A114-G118 WeakPolarHBondContact O-CA 3.09Å; A114-G118 PolarHBondContact O-N 3.31Å
119	G	95.1	Very high	97.1	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	16.7	-176.2	0	0	0	0	0	114.8	D34 T117 S121 F257 K266	D34-G119 CarbonylContact O-C 3.51Å; D34-G119 WeakPolarHBondContact O-CA 3.43Å; D34-G119 PolarHBondContact O-N 3.27Å; T117-G119 VanDerWaalsContact C-N 3.32Å; T117-G119 PolarHBondContact O-N 3.5Å; G119-S121 PolarHBondContact O-N 3.35Å; G119-F257 WeakPolarHBondContact O-CE2 3.26Å; G119-F257 VanDerWaalsContact O-CZ 3.29Å; G119-F257 WeakPolarHBondContact O-CZ 3.28Å; G119-K266 VanDerWaalsContact O-CD 3.31Å; G119-K266 WeakPolarHBondContact O-CD 3.22Å; G119-K266 WeakPolarHBondContact O-CE 3.44Å; G119-K266 PolarHBondContact O-NZ 3.34Å
120	G	95.7	Very high	97.1	Very high	26 Å²	26	51 Å²	51	27%	0.268	26%	0.255	S	S	.	.	S	Bend	trans	-59.6	-42.2	179.8	0	0	0	0	0	113.6	K266	G120-K266 VanDerWaalsContact O-CD 3.27Å; G120-K266 WeakPolarHBondContact O-CD 3.18Å; G120-K266 PolarHBondContact O-NZ 3.48Å
121	S	97.1	Very high	97.1	Very high	37 Å²	37	48.7 Å²	48.7	26%	0.259	24%	0.244	S	C	.	.			trans	-160.3	166.6	174.7	71.5	0	0	0	0	110.4	G119 E123 L124 Y125	G119-S121 PolarHBondContact O-N 3.35Å; S121-E123 VanDerWaalsContact C-N 3.3Å; S121-E123 PolarHBondContact O-N 3.45Å; S121-L124 PolarHBondContact O-N 2.75Å; S121-L124 WeakPolarHBondContact OG-CG 3.46Å; S121-L124 PolarHBondContact OG-N 2.99Å; S121-L124 VanDerWaalsContact OG-N 3.15Å; S121-Y125 WeakPolarHBondContact O-CB 3.32Å; S121-Y125 PolarHBondContact O-N 2.83Å
122	R	97.5	Very high	97.1	Very high	57 Å²	57	49.8 Å²	49.8	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-38.7	174.4	-168	-165	170.2	-115.1	-8.4	111.8	L124 Y125 M126 A260 G264 E265	R122-L124 PolarHBondContact O-N 3.09Å; R122-Y125 WeakPolarHBondContact O-CB 3.3Å; R122-Y125 PolarHBondContact O-N 2.8Å; R122-M126 HydrophobicContact CG-CG 4.36Å; R122-M126 WeakPolarHBondContact O-CB 3.24Å; R122-M126 VanDerWaalsContact O-CG 3.3Å; R122-M126 WeakPolarHBondContact O-CG 3.27Å; R122-M126 PolarHBondContact O-N 3.28Å; R122-A260 PolarHBondContact NE-O 3.05Å; R122-G264 VanDerWaalsContact CD-O 3.25Å; R122-G264 WeakPolarHBondContact CD-O 3.35Å; R122-E265 WeakPolarHBondContact CB-OE2 3.33Å; R122-E265 VanDerWaalsContact CD-CD 3.44Å; R122-E265 WeakPolarHBondContact CD-OE1 3.47Å; R122-E265 IonicContact NE-OE1 3.1Å; R122-E265 IonicContact NH1-OE1 3.98Å
123	E	97.1	Very high	97.1	Very high	115 Å²	115	49.6 Å²	49.6	54%	0.537	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-47	176.4	-179.6	177	-166.4	0	0	111.7	S121 Y125 M126 R127	S121-E123 VanDerWaalsContact C-N 3.3Å; S121-E123 PolarHBondContact O-N 3.45Å; E123-Y125 VanDerWaalsContact C-N 3.34Å; E123-Y125 PolarHBondContact O-N 2.79Å; E123-M126 PolarHBondContact O-N 2.85Å; E123-R127 WeakPolarHBondContact O-CG 3.27Å; E123-R127 PolarHBondContact O-N 3.21Å; E123-R127 IonicContact OE1-CZ 3.63Å; E123-R127 IonicContact OE1-NE 2.91Å; E123-R127 PolarHBondContact OE1-NE 3.3Å; E123-R127 VanDerWaalsContact OE1-NE 3.09Å; E123-R127 IonicContact OE1-NH2 3.26Å; E123-R127 PolarHBondContact OE1-NH2 3.26Å
124	L	95.9	Very high	97.2	Very high	81 Å²	81	46.4 Å²	46.4	42%	0.424	23%	0.233	S	C	.	.	H	α-helix	trans	-62.8	-42.9	178	-72	174.3	0	0	0	111.3	S121 R122 R127 H128	S121-L124 PolarHBondContact O-N 2.75Å; S121-L124 WeakPolarHBondContact OG-CG 3.46Å; S121-L124 PolarHBondContact OG-N 2.99Å; S121-L124 VanDerWaalsContact OG-N 3.15Å; R122-L124 PolarHBondContact O-N 3.09Å; L124-R127 PolarHBondContact O-N 2.92Å; L124-H128 WeakPolarHBondContact O-CB 3.32Å; L124-H128 PolarHBondContact O-N 3.04Å
125	Y	97.8	Very high	97.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.4	-51.2	172.9	163.9	-101.8	0	0	0	111.6	F36 S121 R122 E123 R127 F129 K132 A260	F36-Y125 HydrophobicContact CD1-CD2 4.21Å; F36-Y125 AromaticContact CD1-CE2 3.99Å; F36-Y125 HydrophobicContact CD1-CE2 3.99Å; F36-Y125 AromaticContact CD2-CD2 3.54Å; F36-Y125 HydrophobicContact CD2-CD2 3.54Å; F36-Y125 AromaticContact CD2-CE2 3.93Å; F36-Y125 HydrophobicContact CD2-CE2 3.93Å; F36-Y125 HydrophobicContact CD2-CG 4.13Å; F36-Y125 HydrophobicContact CE1-CD2 4.05Å; F36-Y125 AromaticContact CE1-CE2 3.44Å; F36-Y125 HydrophobicContact CE1-CE2 3.44Å; F36-Y125 VanDerWaalsContact CE1-CE2 3.44Å; F36-Y125 HydrophobicContact CE2-CD1 4.32Å; F36-Y125 AromaticContact CE2-CD2 3.36Å; F36-Y125 HydrophobicContact CE2-CD2 3.36Å; F36-Y125 HydrophobicContact CE2-CE1 4.34Å; F36-Y125 AromaticContact CE2-CE2 3.39Å; F36-Y125 HydrophobicContact CE2-CE2 3.39Å; F36-Y125 AromaticContact CE2-CG 3.85Å; F36-Y125 HydrophobicContact CE2-CG 3.85Å; F36-Y125 AromaticContact CE2-CZ 3.89Å; F36-Y125 AromaticContact CG-CD2 3.97Å; F36-Y125 HydrophobicContact CG-CD2 3.97Å; F36-Y125 HydrophobicContact CG-CE2 4.22Å; F36-Y125 AromaticContact CZ-CD2 3.64Å; F36-Y125 HydrophobicContact CZ-CD2 3.64Å; F36-Y125 HydrophobicContact CZ-CE1 4.32Å; F36-Y125 AromaticContact CZ-CE2 3.11Å; F36-Y125 HydrophobicContact CZ-CE2 3.11Å; F36-Y125 HydrophobicContact CZ-CG 4.41Å; F36-Y125 AromaticContact CZ-CZ 3.5Å; S121-Y125 WeakPolarHBondContact O-CB 3.32Å; S121-Y125 PolarHBondContact O-N 2.83Å; R122-Y125 WeakPolarHBondContact O-CB 3.3Å; R122-Y125 PolarHBondContact O-N 2.8Å; E123-Y125 VanDerWaalsContact C-N 3.34Å; E123-Y125 PolarHBondContact O-N 2.79Å; Y125-R127 VanDerWaalsContact C-N 3.35Å; Y125-R127 PolarHBondContact O-N 3.35Å; Y125-F129 HydrophobicContact CD2-CB 3.59Å; Y125-F129 AromaticContact CD2-CD1 3.9Å; Y125-F129 HydrophobicContact CD2-CD1 3.9Å; Y125-F129 HydrophobicContact CD2-CD2 4.39Å; Y125-F129 AromaticContact CD2-CG 3.72Å; Y125-F129 HydrophobicContact CD2-CG 3.72Å; Y125-F129 HydrophobicContact CE2-CB 4.05Å; Y125-F129 AromaticContact CE2-CD1 3.54Å; Y125-F129 HydrophobicContact CE2-CD1 3.54Å; Y125-F129 HydrophobicContact CE2-CE1 4.12Å; Y125-F129 AromaticContact CE2-CG 3.89Å; Y125-F129 HydrophobicContact CE2-CG 3.89Å; Y125-F129 HydrophobicContact CG-CB 4.39Å; Y125-F129 WeakPolarHBondContact O-CB 3.33Å; Y125-F129 PolarHBondContact O-N 3.43Å; Y125-F129 VanDerWaalsContact O-N 3.11Å; Y125-K132 HydrophobicContact CE2-CG 4.06Å; Y125-K132 PolarHBondContact O-NZ 3.38Å; Y125-A260 HydrophobicContact CD1-CB 3.97Å; Y125-A260 HydrophobicContact CE1-CB 3.84Å
126	M	97.9	Very high	97.2	Very high	66 Å²	66	45.8 Å²	45.8	33%	0.325	23%	0.228	S	C	.	.	H	α-helix	trans	-61	-44.3	-177.8	-72.3	-58.9	-70.9	0	0	111.6	R122 E123 K132 Y261	R122-M126 HydrophobicContact CG-CG 4.36Å; R122-M126 WeakPolarHBondContact O-CB 3.24Å; R122-M126 VanDerWaalsContact O-CG 3.3Å; R122-M126 WeakPolarHBondContact O-CG 3.27Å; R122-M126 PolarHBondContact O-N 3.28Å; E123-M126 PolarHBondContact O-N 2.85Å; M126-K132 PolarHBondContact O-NZ 2.89Å; M126-Y261 HydrophobicContact CE-CD2 3.93Å; M126-Y261 HydrophobicContact CE-CE2 3.93Å; M126-Y261 HydrophobicContact SD-CD2 3.84Å; M126-Y261 HydrophobicContact SD-CE2 4.42Å
127	R	96.2	Very high	97.3	Very high	175 Å²	175	42.2 Å²	42.2	66%	0.66	22%	0.215	S	C	*	.	H	α-helix	trans	-78.5	-40	-175.7	-68.6	-172.7	-171.6	-138.1	9.6	114.5	E123 L124 Y125	E123-R127 WeakPolarHBondContact O-CG 3.27Å; E123-R127 PolarHBondContact O-N 3.21Å; E123-R127 IonicContact OE1-CZ 3.63Å; E123-R127 IonicContact OE1-NE 2.91Å; E123-R127 PolarHBondContact OE1-NE 3.3Å; E123-R127 VanDerWaalsContact OE1-NE 3.09Å; E123-R127 IonicContact OE1-NH2 3.26Å; E123-R127 PolarHBondContact OE1-NH2 3.26Å; L124-R127 PolarHBondContact O-N 2.92Å; Y125-R127 VanDerWaalsContact C-N 3.35Å; Y125-R127 PolarHBondContact O-N 3.35Å
128	H	96.1	Very high	97.5	Very high	131 Å²	131	38 Å²	38	61%	0.606	19%	0.189	S	C	*	.	H	α-helix	trans	-119.3	-17.3	-164.3	-54.7	107.1	0	0	0	114.7	L124 P130	L124-H128 WeakPolarHBondContact O-CB 3.32Å; L124-H128 PolarHBondContact O-N 3.04Å; H128-P130 VanDerWaalsContact O-CD 3.25Å; H128-P130 WeakPolarHBondContact O-CD 3.43Å
129	F	97.9	Very high	97.6	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.018	18%	0.183	C	C	.	.			trans	-76.5	114.8	179.9	-168.9	-96.7	0	0	0	110.6	F36 A114 V115 Y125 F131 K132 H135	F36-F129 HydrophobicContact CB-CE2 4.12Å; F36-F129 HydrophobicContact CD1-CE1 4.01Å; F36-F129 HydrophobicContact CD1-CE2 4.01Å; F36-F129 AromaticContact CD1-CZ 3.69Å; F36-F129 HydrophobicContact CD1-CZ 3.69Å; F36-F129 HydrophobicContact CE1-CE1 4.22Å; F36-F129 HydrophobicContact CE1-CZ 4.33Å; F36-F129 HydrophobicContact CG-CE2 4.31Å; F36-F129 HydrophobicContact CG-CZ 4.44Å; A114-F129 HydrophobicContact CB-CD2 4.1Å; A114-F129 HydrophobicContact CB-CE2 3.89Å; A114-F129 WeakPolarHBondContact O-CE2 3.28Å; V115-F129 HydrophobicContact CG2-CE2 4.1Å; V115-F129 HydrophobicContact CG2-CZ 3.95Å; Y125-F129 HydrophobicContact CD2-CB 3.59Å; Y125-F129 AromaticContact CD2-CD1 3.9Å; Y125-F129 HydrophobicContact CD2-CD1 3.9Å; Y125-F129 HydrophobicContact CD2-CD2 4.39Å; Y125-F129 AromaticContact CD2-CG 3.72Å; Y125-F129 HydrophobicContact CD2-CG 3.72Å; Y125-F129 HydrophobicContact CE2-CB 4.05Å; Y125-F129 AromaticContact CE2-CD1 3.54Å; Y125-F129 HydrophobicContact CE2-CD1 3.54Å; Y125-F129 HydrophobicContact CE2-CE1 4.12Å; Y125-F129 AromaticContact CE2-CG 3.89Å; Y125-F129 HydrophobicContact CE2-CG 3.89Å; Y125-F129 HydrophobicContact CG-CB 4.39Å; Y125-F129 WeakPolarHBondContact O-CB 3.33Å; Y125-F129 PolarHBondContact O-N 3.43Å; Y125-F129 VanDerWaalsContact O-N 3.11Å; F129-F131 HydrophobicContact CE1-CB 4.05Å; F129-F131 VanDerWaalsContact CE1-O 3.25Å; F129-F131 WeakPolarHBondContact CE1-O 2.93Å; F129-F131 HydrophobicContact CZ-CB 4.41Å; F129-K132 HydrophobicContact CD1-CG 3.99Å; F129-K132 PolarHBondContact O-NZ 3.33Å; F129-H135 HydrophobicContact CE1-CB 4Å; F129-H135 HydrophobicContact CZ-CB 4.14Å
130	P	97.6	Very high	97.7	Very high	56 Å²	56	41 Å²	41	36%	0.364	20%	0.197	S	C	.	.	S	Bend	trans	-91	-3.4	-168	34.3	-31	0	0	0	114.1	E58 A114 H128	E58-P130 VanDerWaalsContact CG-O 3.27Å; E58-P130 WeakPolarHBondContact CG-O 2.97Å; A114-P130 HydrophobicContact CB-CG 4.45Å; H128-P130 VanDerWaalsContact O-CD 3.25Å; H128-P130 WeakPolarHBondContact O-CD 3.43Å
131	F	98.4	Very high	97.8	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.013	18%	0.184	C	C	.	.			trans	-125.6	43.8	-169.4	-57.4	-59.7	0	0	0	113	H62 L65 L107 E110 L111 A114 F129 L134 H135	H62-F131 AromaticContact CD2-CE1 3.61Å; H62-F131 AromaticContact CD2-CZ 3.71Å; H62-F131 AromaticContact NE2-CE1 3.85Å; H62-F131 AromaticContact NE2-CZ 3.59Å; L65-F131 HydrophobicContact CD2-CD1 4.22Å; L65-F131 HydrophobicContact CD2-CE1 4.39Å; L107-F131 HydrophobicContact CD1-CE1 3.83Å; L107-F131 HydrophobicContact CD1-CZ 4.01Å; E110-F131 HydrophobicContact CB-CE2 4.08Å; E110-F131 HydrophobicContact CB-CZ 4.01Å; L111-F131 HydrophobicContact CB-CD2 4.21Å; L111-F131 HydrophobicContact CB-CE2 4.38Å; L111-F131 HydrophobicContact CD1-CB 3.51Å; L111-F131 HydrophobicContact CD1-CD2 3.75Å; L111-F131 HydrophobicContact CD1-CG 3.81Å; A114-F131 HydrophobicContact CB-CD2 3.85Å; A114-F131 HydrophobicContact CB-CE2 4.13Å; F129-F131 HydrophobicContact CE1-CB 4.05Å; F129-F131 VanDerWaalsContact CE1-O 3.25Å; F129-F131 WeakPolarHBondContact CE1-O 2.93Å; F129-F131 HydrophobicContact CZ-CB 4.41Å; F131-L134 HydrophobicContact CB-CB 4.22Å; F131-L134 HydrophobicContact CD1-CD2 4.12Å; F131-L134 HydrophobicContact CG-CD2 4.48Å; F131-H135 WeakPolarHBondContact O-CB 3.28Å; F131-H135 PolarHBondContact O-N 2.88Å
132	K	98.6	Very high	97.8	Very high	25 Å²	25	38.2 Å²	38.2	11%	0.109	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-48.6	-175.7	-57	179.3	168.7	67.4	0	111.8	L54 E58 Y125 M126 F129 F136 Y261	L54-K132 HydrophobicContact CD1-CB 4.23Å; L54-K132 HydrophobicContact CD2-CD 4.33Å; E58-K132 VanDerWaalsContact OE1-CA 3.23Å; E58-K132 WeakPolarHBondContact OE1-CA 3.39Å; E58-K132 VanDerWaalsContact OE1-CB 3.25Å; E58-K132 WeakPolarHBondContact OE1-CB 3.41Å; E58-K132 PolarHBondContact OE1-N 3.49Å; Y125-K132 HydrophobicContact CE2-CG 4.06Å; Y125-K132 PolarHBondContact O-NZ 3.38Å; M126-K132 PolarHBondContact O-NZ 2.89Å; F129-K132 HydrophobicContact CD1-CG 3.99Å; F129-K132 PolarHBondContact O-NZ 3.33Å; K132-F136 WeakPolarHBondContact O-CB 3.37Å; K132-F136 PolarHBondContact O-N 2.85Å; K132-Y261 HydrophobicContact CD-CD2 3.73Å; K132-Y261 HydrophobicContact CD-CE2 3.94Å
133	A	98.8	Very high	97.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-74.3	-43.5	178.8	0	0	0	0	0	111.8	A51 L54 L55 E58 H135 F136 Y137	A51-A133 HydrophobicContact CB-CB 4.42Å; A51-A133 WeakPolarHBondContact O-CB 3.41Å; L54-A133 HydrophobicContact CB-CB 3.78Å; L55-A133 HydrophobicContact CB-CB 3.74Å; L55-A133 HydrophobicContact CD1-CB 4.44Å; E58-A133 PolarHBondContact OE1-N 3.03Å; E58-A133 PolarHBondContact OE2-N 3.34Å; A133-H135 VanDerWaalsContact C-N 3.34Å; A133-H135 PolarHBondContact O-N 3.05Å; A133-F136 WeakPolarHBondContact O-CB 3.45Å; A133-F136 PolarHBondContact O-N 3.42Å; A133-F136 VanDerWaalsContact O-N 3.17Å; A133-Y137 HydrophobicContact CB-CD2 4.43Å; A133-Y137 HydrophobicContact CB-CE2 4.2Å; A133-Y137 WeakPolarHBondContact O-CD2 3.42Å; A133-Y137 PolarHBondContact O-N 3.05Å
134	L	98.7	Very high	97.6	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-44.5	177	179.3	63.7	0	0	0	111.7	E58 L65 W69 A96 V99 L111 F131 F136 Y137 L138	E58-L134 PolarHBondContact OE2-N 3.36Å; L65-L134 HydrophobicContact CD1-CD2 3.93Å; W69-L134 HydrophobicContact CE3-CD1 4.49Å; W69-L134 HydrophobicContact CZ3-CD1 4.04Å; A96-L134 HydrophobicContact CB-CD1 3.99Å; V99-L134 HydrophobicContact CG1-CD1 4.26Å; L111-L134 HydrophobicContact CD1-CD2 4.37Å; L111-L134 HydrophobicContact CD2-CD2 4.12Å; L111-L134 HydrophobicContact CD2-CG 4.31Å; F131-L134 HydrophobicContact CB-CB 4.22Å; F131-L134 HydrophobicContact CD1-CD2 4.12Å; F131-L134 HydrophobicContact CG-CD2 4.48Å; L134-F136 PolarHBondContact O-N 3.45Å; L134-Y137 PolarHBondContact O-N 2.96Å; L134-L138 WeakPolarHBondContact O-CB 3.35Å; L134-L138 PolarHBondContact O-N 3.48Å
135	H	98.8	Very high	97.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-44.9	174.2	178.8	-79.8	0	0	0	111.8	F36 Y40 F129 F131 A133 T139 F182	F36-H135 AromaticContact CD1-CD2 3.83Å; F36-H135 AromaticContact CD1-CE1 3.83Å; F36-H135 AromaticContact CD1-NE2 3.71Å; F36-H135 AromaticContact CE1-CE1 3.63Å; F36-H135 AromaticContact CE1-CG 3.86Å; F36-H135 AromaticContact CE1-ND1 3.53Å; F36-H135 AromaticContact CE1-NE2 3.98Å; Y40-H135 AromaticContact CE2-CE1 3.95Å; Y40-H135 AromaticContact CE2-ND1 3.63Å; Y40-H135 AromaticContact CZ-ND1 3.62Å; Y40-H135 PolarHBondContact OH-ND1 3.08Å; F129-H135 HydrophobicContact CE1-CB 4Å; F129-H135 HydrophobicContact CZ-CB 4.14Å; F131-H135 WeakPolarHBondContact O-CB 3.28Å; F131-H135 PolarHBondContact O-N 2.88Å; A133-H135 VanDerWaalsContact C-N 3.34Å; A133-H135 PolarHBondContact O-N 3.05Å; H135-T139 PolarHBondContact CE1-OG1 2.83Å; H135-T139 VanDerWaalsContact O-CB 3.31Å; H135-T139 WeakPolarHBondContact O-CB 3.43Å; H135-T139 PolarHBondContact O-N 2.82Å; H135-T139 PolarHBondContact O-OG1 3.19Å; H135-F182 AromaticContact CD2-CE2 3.54Å; H135-F182 AromaticContact CD2-CZ 3.94Å; H135-F182 AromaticContact NE2-CE2 3.95Å
136	F	98.8	Very high	97	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-53.7	177.4	168.9	-106.6	0	0	0	111.9	Y40 S44 M47 D48 A51 K132 A133 L134 L138 T139 R140	Y40-F136 AromaticContact CD1-CD2 3.85Å; Y40-F136 HydrophobicContact CD1-CD2 3.85Å; Y40-F136 HydrophobicContact CD1-CE2 4.43Å; Y40-F136 AromaticContact CD2-CD2 3.74Å; Y40-F136 HydrophobicContact CD2-CD2 3.74Å; Y40-F136 HydrophobicContact CD2-CE2 4.39Å; Y40-F136 HydrophobicContact CE1-CB 4.31Å; Y40-F136 AromaticContact CE1-CD2 3.91Å; Y40-F136 HydrophobicContact CE1-CD2 3.91Å; Y40-F136 HydrophobicContact CE2-CB 4.11Å; Y40-F136 AromaticContact CE2-CD2 3.84Å; Y40-F136 HydrophobicContact CE2-CD2 3.84Å; Y40-F136 HydrophobicContact CE2-CG 4.48Å; Y40-F136 AromaticContact CG-CD2 3.72Å; Y40-F136 HydrophobicContact CG-CD2 3.72Å; Y40-F136 HydrophobicContact CG-CE2 4.13Å; Y40-F136 AromaticContact CZ-CD2 3.89Å; Y40-F136 PolarHBondContact OH-N 3.3Å; S44-F136 WeakPolarHBondContact O-CZ 3.2Å; M47-F136 HydrophobicContact CB-CD2 3.78Å; M47-F136 HydrophobicContact CB-CE1 4.35Å; M47-F136 HydrophobicContact CB-CE2 3.47Å; M47-F136 VanDerWaalsContact CB-CE2 3.47Å; M47-F136 HydrophobicContact CB-CG 4.35Å; M47-F136 HydrophobicContact CB-CZ 3.78Å; M47-F136 HydrophobicContact CE-CB 4.37Å; M47-F136 HydrophobicContact CE-CD2 4.46Å; M47-F136 HydrophobicContact CE-CG 4.36Å; M47-F136 HydrophobicContact CG-CD2 4.33Å; M47-F136 HydrophobicContact CG-CE2 4.34Å; D48-F136 HydrophobicContact CB-CE1 4.02Å; D48-F136 HydrophobicContact CB-CZ 3.96Å; A51-F136 HydrophobicContact CB-CD1 3.58Å; A51-F136 HydrophobicContact CB-CE1 3.89Å; K132-F136 WeakPolarHBondContact O-CB 3.37Å; K132-F136 PolarHBondContact O-N 2.85Å; A133-F136 WeakPolarHBondContact O-CB 3.45Å; A133-F136 PolarHBondContact O-N 3.42Å; A133-F136 VanDerWaalsContact O-N 3.17Å; L134-F136 PolarHBondContact O-N 3.45Å; F136-L138 VanDerWaalsContact C-N 3.32Å; F136-L138 PolarHBondContact O-N 2.86Å; F136-T139 PolarHBondContact O-N 2.94Å; F136-R140 WeakPolarHBondContact O-CB 3.47Å; F136-R140 PolarHBondContact O-N 2.6Å
137	Y	98.9	Very high	95.6	Very high	7 Å²	7	39 Å²	39	3%	0.027	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-40.8	-178.9	-70.8	-51.4	0	0	0	112.1	A51 G52 L55 W69 Q92 H93 A133 L134 R140 A141	A51-Y137 HydrophobicContact CB-CE1 3.91Å; A51-Y137 HydrophobicContact CB-CE2 3.98Å; A51-Y137 VanDerWaalsContact CB-CZ 3.49Å; A51-Y137 WeakPolarHBondContact CB-OH 3.18Å; G52-Y137 PolarHBondContact N-OH 3.24Å; L55-Y137 HydrophobicContact CB-CE2 4.36Å; L55-Y137 HydrophobicContact CD2-CE2 3.99Å; W69-Y137 HydrophobicContact CH2-CD2 4.03Å; W69-Y137 HydrophobicContact CH2-CE2 4.43Å; Q92-Y137 HydrophobicContact CB-CD1 3.68Å; Q92-Y137 HydrophobicContact CB-CD2 4.26Å; Q92-Y137 HydrophobicContact CB-CE1 3.54Å; Q92-Y137 HydrophobicContact CB-CE2 4.14Å; Q92-Y137 HydrophobicContact CB-CG 4.04Å; Q92-Y137 HydrophobicContact CG-CE1 4.03Å; Q92-Y137 HydrophobicContact CG-CE2 4.4Å; H93-Y137 AromaticContact CD2-CD1 3.88Å; A133-Y137 HydrophobicContact CB-CD2 4.43Å; A133-Y137 HydrophobicContact CB-CE2 4.2Å; A133-Y137 WeakPolarHBondContact O-CD2 3.42Å; A133-Y137 PolarHBondContact O-N 3.05Å; L134-Y137 PolarHBondContact O-N 2.96Å; Y137-R140 PolarHBondContact O-N 3.17Å; Y137-A141 VanDerWaalsContact O-CB 3.24Å; Y137-A141 WeakPolarHBondContact O-CB 3.24Å; Y137-A141 PolarHBondContact O-N 3.04Å
138	L	98.6	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.5	-45.6	177.9	-168.8	61.1	0	0	0	111.4	I97 Y100 L111 L134 F136 R140 A141 L142 F182 L224	I97-L138 HydrophobicContact CG1-CD1 3.86Å; Y100-L138 HydrophobicContact CD2-CD2 3.58Å; Y100-L138 HydrophobicContact CE2-CD2 4.21Å; Y100-L138 HydrophobicContact CG-CD1 4.42Å; Y100-L138 HydrophobicContact CG-CD2 3.88Å; L111-L138 HydrophobicContact CD2-CD2 3.86Å; L134-L138 WeakPolarHBondContact O-CB 3.35Å; L134-L138 PolarHBondContact O-N 3.48Å; F136-L138 VanDerWaalsContact C-N 3.32Å; F136-L138 PolarHBondContact O-N 2.86Å; L138-R140 VanDerWaalsContact C-N 3.33Å; L138-R140 PolarHBondContact O-N 3.29Å; L138-A141 WeakPolarHBondContact O-CB 3.25Å; L138-A141 PolarHBondContact O-N 3.33Å; L138-L142 WeakPolarHBondContact O-CG 3.32Å; L138-L142 PolarHBondContact O-N 2.95Å; L138-L142 VanDerWaalsContact O-N 3.08Å; L138-F182 HydrophobicContact CB-CE1 4.28Å; L138-F182 HydrophobicContact CB-CZ 4.08Å; L138-F182 HydrophobicContact CD2-CB 4.44Å; L138-F182 HydrophobicContact CD2-CD1 3.8Å; L138-F182 HydrophobicContact CD2-CD2 3.76Å; L138-F182 HydrophobicContact CD2-CE1 3.88Å; L138-F182 HydrophobicContact CD2-CE2 3.84Å; L138-F182 HydrophobicContact CD2-CG 3.73Å; L138-F182 HydrophobicContact CD2-CZ 3.9Å; L138-F182 HydrophobicContact CG-CD1 4.07Å; L138-F182 HydrophobicContact CG-CE1 3.81Å; L138-F182 HydrophobicContact CG-CE2 4.46Å; L138-F182 HydrophobicContact CG-CG 4.49Å; L138-F182 HydrophobicContact CG-CZ 4.02Å; L138-L224 HydrophobicContact CD1-CD2 3.86Å; L138-L224 HydrophobicContact CD2-CD2 4.28Å; L138-L224 HydrophobicContact CG-CD2 4.26Å
139	T	98.4	Very high	91.7	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-58.2	-47.2	175.4	-57.5	0	0	0	0	111	Y40 H135 F136 L142 Q143 F182	Y40-T139 HydrophobicContact CD2-CG2 3.9Å; Y40-T139 HydrophobicContact CE2-CG2 4.07Å; H135-T139 PolarHBondContact CE1-OG1 2.83Å; H135-T139 VanDerWaalsContact O-CB 3.31Å; H135-T139 WeakPolarHBondContact O-CB 3.43Å; H135-T139 PolarHBondContact O-N 2.82Å; H135-T139 PolarHBondContact O-OG1 3.19Å; F136-T139 PolarHBondContact O-N 2.94Å; T139-L142 PolarHBondContact O-N 3.28Å; T139-Q143 VanDerWaalsContact O-CG 3.32Å; T139-Q143 WeakPolarHBondContact O-CG 3.49Å; T139-Q143 PolarHBondContact O-N 3.45Å; T139-F182 WeakPolarHBondContact OG1-CZ 3.18Å
140	R	97.9	Very high	90	Very high	74 Å²	74	32.1 Å²	32.1	28%	0.279	17%	0.172	S	C	.	.	H	α-helix	trans	-67.2	-37.8	-179.2	-173.4	56.9	-179.7	163.6	1.3	112.1	H93 F136 Y137 L138 Q143 L144	H93-R140 WeakPolarHBondContact NE2-CG 3.47Å; F136-R140 WeakPolarHBondContact O-CB 3.47Å; F136-R140 PolarHBondContact O-N 2.6Å; Y137-R140 PolarHBondContact O-N 3.17Å; L138-R140 VanDerWaalsContact C-N 3.33Å; L138-R140 PolarHBondContact O-N 3.29Å; R140-Q143 PolarHBondContact O-N 3.38Å; R140-L144 HydrophobicContact CG-CD1 4Å; R140-L144 HydrophobicContact CG-CG 4.46Å; R140-L144 WeakPolarHBondContact O-CB 3.39Å; R140-L144 VanDerWaalsContact O-CG 3.3Å; R140-L144 WeakPolarHBondContact O-CG 3.25Å; R140-L144 PolarHBondContact O-N 3.17Å
141	A	97.9	Very high	88.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-48.8	174.8	0	0	0	0	0	111.2	F89 H93 I97 Y137 L138 Q143 L144 L145	F89-A141 HydrophobicContact CE2-CB 4.05Å; F89-A141 HydrophobicContact CZ-CB 4.35Å; H93-A141 HydrophobicContact CB-CB 3.68Å; I97-A141 HydrophobicContact CD1-CB 3.65Å; I97-A141 HydrophobicContact CG1-CB 4.06Å; Y137-A141 VanDerWaalsContact O-CB 3.24Å; Y137-A141 WeakPolarHBondContact O-CB 3.24Å; Y137-A141 PolarHBondContact O-N 3.04Å; L138-A141 WeakPolarHBondContact O-CB 3.25Å; L138-A141 PolarHBondContact O-N 3.33Å; A141-Q143 PolarHBondContact O-N 3.31Å; A141-L144 PolarHBondContact O-N 3.17Å; A141-L145 WeakPolarHBondContact O-CB 3.32Å; A141-L145 VanDerWaalsContact O-CG 3.32Å; A141-L145 WeakPolarHBondContact O-CG 3.46Å; A141-L145 PolarHBondContact O-N 3.48Å
142	L	97.1	Very high	87	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-41.7	178.2	-61.9	180	0	0	0	112.1	L138 T139 L144 L145 R146 F182 A209 I211 L224 P226	L138-L142 WeakPolarHBondContact O-CG 3.32Å; L138-L142 PolarHBondContact O-N 2.95Å; L138-L142 VanDerWaalsContact O-N 3.08Å; T139-L142 PolarHBondContact O-N 3.28Å; L142-L144 VanDerWaalsContact C-N 3.28Å; L142-L144 PolarHBondContact O-N 3.48Å; L142-L145 PolarHBondContact O-N 2.74Å; L142-R146 VanDerWaalsContact O-CB 3.24Å; L142-R146 WeakPolarHBondContact O-CB 3.43Å; L142-R146 PolarHBondContact O-N 2.78Å; L142-F182 HydrophobicContact CD1-CD1 3.8Å; L142-F182 HydrophobicContact CD1-CE1 3.83Å; L142-A209 HydrophobicContact CB-CB 4.49Å; L142-A209 HydrophobicContact CD2-CB 3.77Å; L142-I211 HydrophobicContact CD2-CG2 4.05Å; L142-L224 HydrophobicContact CD1-CD2 4.14Å; L142-L224 HydrophobicContact CD1-CG 3.96Å; L142-L224 HydrophobicContact CD2-CB 3.85Å; L142-L224 HydrophobicContact CD2-CD2 4.04Å; L142-L224 HydrophobicContact CD2-CG 4.06Å; L142-P226 HydrophobicContact CD1-CB 4.24Å
143	Q	95	Very high	84.9	Confident	49 Å²	49	43.5 Å²	43.5	23%	0.229	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-37.2	176.4	-72.2	172.7	-5.5	0	0	113.2	A39 T139 R140 A141	A39-Q143 PolarHBondContact O-NE2 3.29Å; T139-Q143 VanDerWaalsContact O-CG 3.32Å; T139-Q143 WeakPolarHBondContact O-CG 3.49Å; T139-Q143 PolarHBondContact O-N 3.45Å; R140-Q143 PolarHBondContact O-N 3.38Å; A141-Q143 PolarHBondContact O-N 3.31Å
144	L	95.2	Very high	83.4	Confident	28 Å²	28	45.3 Å²	45.3	15%	0.147	24%	0.242	C	C	.	.	H	α-helix	trans	-79.4	-37.1	-179.5	-71.3	170.2	0	0	0	112.7	P86 F89 H93 R140 A141 L142	P86-L144 HydrophobicContact CG-CB 4.35Å; P86-L144 VanDerWaalsContact CG-O 3.24Å; P86-L144 WeakPolarHBondContact CG-O 3.37Å; F89-L144 HydrophobicContact CB-CD1 4.47Å; F89-L144 HydrophobicContact CD2-CB 3.97Å; F89-L144 HydrophobicContact CD2-CD1 4.23Å; H93-L144 WeakPolarHBondContact ND1-CD1 3.2Å; R140-L144 HydrophobicContact CG-CD1 4Å; R140-L144 HydrophobicContact CG-CG 4.46Å; R140-L144 WeakPolarHBondContact O-CB 3.39Å; R140-L144 VanDerWaalsContact O-CG 3.3Å; R140-L144 WeakPolarHBondContact O-CG 3.25Å; R140-L144 PolarHBondContact O-N 3.17Å; A141-L144 PolarHBondContact O-N 3.17Å; L142-L144 VanDerWaalsContact C-N 3.28Å; L142-L144 PolarHBondContact O-N 3.48Å
145	L	93.4	Very high	82	Confident	41 Å²	41	51.1 Å²	51.1	22%	0.215	27%	0.273	C	S	.	.	H	α-helix	trans	-78.6	-24.1	178.4	-70.2	168.2	0	0	0	113.1	P86 F89 I97 A141 L142 D147 A209 I211 L214	P86-L145 HydrophobicContact CG-CD2 4.24Å; F89-L145 HydrophobicContact CD2-CD2 4.13Å; F89-L145 HydrophobicContact CD2-CG 4.07Å; F89-L145 HydrophobicContact CE2-CD1 3.71Å; F89-L145 HydrophobicContact CE2-CD2 3.82Å; F89-L145 HydrophobicContact CE2-CG 3.53Å; F89-L145 HydrophobicContact CZ-CD1 4.18Å; F89-L145 HydrophobicContact CZ-CD2 4.47Å; F89-L145 HydrophobicContact CZ-CG 4.38Å; I97-L145 HydrophobicContact CD1-CD1 3.44Å; I97-L145 VanDerWaalsContact CD1-CD1 3.44Å; A141-L145 WeakPolarHBondContact O-CB 3.32Å; A141-L145 VanDerWaalsContact O-CG 3.32Å; A141-L145 WeakPolarHBondContact O-CG 3.46Å; A141-L145 PolarHBondContact O-N 3.48Å; L142-L145 PolarHBondContact O-N 2.74Å; L145-D147 PolarHBondContact O-N 2.92Å; L145-D147 VanDerWaalsContact O-N 3.16Å; L145-A209 HydrophobicContact CB-CB 3.92Å; L145-I211 HydrophobicContact CD1-CG2 4.1Å; L145-L214 HydrophobicContact CD1-CD1 3.55Å; L145-L214 HydrophobicContact CD2-CD1 4.11Å; L145-L214 HydrophobicContact CG-CD1 4.46Å
146	R	86.3	Confident	81.3	Confident	82 Å²	82	52.3 Å²	52.3	31%	0.309	29%	0.286	S	S	.	.	S	Bend	trans	-57.1	123.6	177.6	-176.4	-172	66.6	-179.6	-1.7	109	L142 T148 F207	L142-R146 VanDerWaalsContact O-CB 3.24Å; L142-R146 WeakPolarHBondContact O-CB 3.43Å; L142-R146 PolarHBondContact O-N 2.78Å; R146-T148 PolarHBondContact O-N 3.36Å; R146-F207 VanDerWaalsContact NH1-CE1 3.29Å
147	D	68.6	Low	80.8	Confident	137 Å²	137	57.1 Å²	57.1	73%	0.733	31%	0.308	S	S	*	.			trans	-62.7	131.2	177.1	-134.2	-14.6	0	0	0	109.5	L145 G149 G150	L145-D147 PolarHBondContact O-N 2.92Å; L145-D147 VanDerWaalsContact O-N 3.16Å; D147-G149 PolarHBondContact O-N 2.57Å; D147-G150 PolarHBondContact O-N 2.97Å
148	T	57.2	Low	80.7	Confident	131 Å²	131	59.1 Å²	59.1	80%	0.804	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-6.5	-171.1	53.1	0	0	0	0	114.2	R146	R146-T148 PolarHBondContact O-N 3.36Å
149	G	53.7	Low	80.6	Confident	10 Å²	10	59.1 Å²	59.1	10%	0.103	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-22.1	177	0	0	0	0	0	115.6	D147 C151 S152 R153	D147-G149 PolarHBondContact O-N 2.57Å; G149-C151 PolarHBondContact O-N 2.99Å; G149-S152 WeakPolarHBondContact O-CA 3.49Å; G149-S152 VanDerWaalsContact O-CB 3.22Å; G149-S152 WeakPolarHBondContact O-CB 3.44Å; G149-S152 PolarHBondContact O-N 3.26Å; G149-R153 PolarHBondContact O-N 2.82Å
150	G	63	Low	80.6	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	41.6	-138.1	-173.6	0	0	0	0	0	112.8	D147 S152	D147-G150 PolarHBondContact O-N 2.97Å; G150-S152 VanDerWaalsContact C-N 3.29Å
151	C	69.3	Low	80.7	Confident	30 Å²	30	60.3 Å²	60.3	20%	0.203	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	10.4	163.2	-70.4	0	0	0	0	113.7	G149 R153 G154 G156 C206 N251	G149-C151 PolarHBondContact O-N 2.99Å; C151-R153 PolarHBondContact O-N 3.3Å; C151-G154 CarbonylContact C-O 3.55Å; C151-G154 VanDerWaalsContact CA-O 3.26Å; C151-G154 WeakPolarHBondContact CA-O 3.41Å; C151-G156 WeakPolarHBondContact SG-CA 3.47Å; C151-G156 PolarHBondContact SG-N 3.37Å; C151-C206 HydrophobicContact CB-CB 3.89Å; C151-C206 WeakPolarHBondContact CB-SG 3.27Å; C151-C206 WeakPolarHBondContact SG-CB 3.29Å; C151-C206 CovalentContact SG-SG 2Å; C151-C206 PolarHBondContact SG-SG 3.5Å; C151-N251 HydrophobicContact CB-CB 4.44Å
152	S	62.6	Low	80.7	Confident	76 Å²	76	60.5 Å²	60.5	53%	0.531	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-16.6	177.2	-49.8	0	0	0	0	112.5	G149 G150	G149-S152 WeakPolarHBondContact O-CA 3.49Å; G149-S152 VanDerWaalsContact O-CB 3.22Å; G149-S152 WeakPolarHBondContact O-CB 3.44Å; G149-S152 PolarHBondContact O-N 3.26Å; G150-S152 VanDerWaalsContact C-N 3.29Å
153	R	55	Low	80.7	Confident	216 Å²	216	60.9 Å²	60.9	82%	0.815	33%	0.331	S	S	*	.	S	Bend	trans	-113.5	0.1	179.9	-73.2	-174.1	165.1	170.4	-3.5	114.7	G149 C151	G149-R153 PolarHBondContact O-N 2.82Å; C151-R153 PolarHBondContact O-N 3.3Å
154	G	66	Low	80.7	Confident	39 Å²	39	60.6 Å²	60.6	40%	0.402	34%	0.341	S	S	.	.	S	Bend	trans	170.1	-175.3	-178.3	0	0	0	0	0	111.8	C151 G156	C151-G154 CarbonylContact C-O 3.55Å; C151-G154 VanDerWaalsContact CA-O 3.26Å; C151-G154 WeakPolarHBondContact CA-O 3.41Å; G154-G156 PolarHBondContact O-N 3.07Å
155	D	70.8	Confident	80.6	Confident	124 Å²	124	63 Å²	63	66%	0.663	36%	0.361	S	S	*	.	S	Bend	trans	-73.7	14.9	-173.3	-60.5	-32.8	0	0	0	113.8	R204	D155-R204 WeakPolarHBondContact O-CD 3.18Å; D155-R204 WeakPolarHBondContact O-CG 3.24Å; D155-R204 PolarHBondContact O-NH1 2.88Å
156	G	82.5	Confident	80.7	Confident	26 Å²	26	63.3 Å²	63.3	27%	0.268	36%	0.362	S	S	.	.			trans	73	177.2	-174.1	0	0	0	0	0	114.2	C151 G154 R204 T205	C151-G156 WeakPolarHBondContact SG-CA 3.47Å; C151-G156 PolarHBondContact SG-N 3.37Å; G154-G156 PolarHBondContact O-N 3.07Å; G156-R204 PolarHBondContact O-NH1 3.47Å; G156-T205 WeakPolarHBondContact CA-O 3.47Å
157	E	89.9	Confident	81.2	Confident	102 Å²	102	60.4 Å²	60.4	48%	0.477	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.8	-174.5	-167.1	61.1	-117.9	0	0	111.2	V159 L187 R204 T205	E157-V159 HydrophobicContact CG-CG1 4.02Å; E157-L187 HydrophobicContact CG-CD2 3.6Å; E157-L187 VanDerWaalsContact OE1-CD2 3.27Å; E157-L187 WeakPolarHBondContact OE1-CD2 3.09Å; E157-R204 CarbonylContact O-C 3.52Å; E157-R204 VanDerWaalsContact O-CA 3.32Å; E157-R204 WeakPolarHBondContact O-CA 3.49Å; E157-T205 HydrophobicContact CB-CG2 4.22Å; E157-T205 PolarHBondContact N-O 3.43Å; E157-T205 PolarHBondContact O-N 3.4Å
158	V	95.4	Very high	82.6	Confident	49 Å²	49	55.6 Å²	55.6	30%	0.297	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122.1	178.6	179.5	0	0	0	0	109.3	F160 L203	V158-F160 HydrophobicContact CG1-CE1 4.49Å; V158-F160 HydrophobicContact CG1-CE2 4.31Å; V158-F160 HydrophobicContact CG1-CZ 3.93Å; V158-L203 WeakPolarHBondContact CA-O 3.48Å
159	V	97.8	Very high	84.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160.2	-174.6	-60.2	0	0	0	0	111.2	E157 S185 S186 L187 L203 T205 V223 I225	E157-V159 HydrophobicContact CG-CG1 4.02Å; V159-S185 WeakPolarHBondContact CB-OG 3.25Å; V159-S185 VanDerWaalsContact CG2-OG 3.27Å; V159-S185 WeakPolarHBondContact CG2-OG 3.28Å; V159-S186 CarbonylContact C-O 3.53Å; V159-S186 WeakPolarHBondContact CA-O 3.3Å; V159-L187 HydrophobicContact CG1-CD2 4.02Å; V159-L203 HydrophobicContact CG2-CB 3.82Å; V159-L203 HydrophobicContact CG2-CD1 4.16Å; V159-L203 PolarHBondContact N-O 3.42Å; V159-L203 PolarHBondContact O-N 2.81Å; V159-T205 HydrophobicContact CG1-CG2 4.36Å; V159-T205 HydrophobicContact CG2-CG2 3.97Å; V159-V223 HydrophobicContact CG1-CB 3.73Å; V159-V223 HydrophobicContact CG1-CG1 3.99Å; V159-V223 HydrophobicContact CG1-CG2 3.77Å; V159-I225 HydrophobicContact CG2-CD1 4.15Å
160	F	98.7	Very high	86.5	Confident	33 Å²	33	51.7 Å²	51.7	15%	0.145	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.2	-173.1	-55.6	-80.4	0	0	0	111.5	V158 S185 S186 E189 A192 F200 F201	V158-F160 HydrophobicContact CG1-CE1 4.49Å; V158-F160 HydrophobicContact CG1-CE2 4.31Å; V158-F160 HydrophobicContact CG1-CZ 3.93Å; F160-S185 CarbonylContact O-C 3.54Å; F160-S185 VanDerWaalsContact O-CA 3.28Å; F160-S185 WeakPolarHBondContact O-CA 3.31Å; F160-S185 WeakPolarHBondContact O-CB 3.04Å; F160-S186 PolarHBondContact N-O 3.41Å; F160-S186 PolarHBondContact O-N 2.92Å; F160-E189 HydrophobicContact CD1-CB 4.32Å; F160-E189 HydrophobicContact CD2-CB 3.85Å; F160-E189 HydrophobicContact CE1-CB 4.46Å; F160-E189 HydrophobicContact CE2-CB 4.03Å; F160-E189 HydrophobicContact CG-CB 4Å; F160-E189 HydrophobicContact CZ-CB 4.32Å; F160-A192 HydrophobicContact CB-CB 3.43Å; F160-A192 VanDerWaalsContact CB-CB 3.43Å; F160-A192 WeakPolarHBondContact O-CB 3.5Å; F160-F200 HydrophobicContact CB-CE2 4.32Å; F160-F200 HydrophobicContact CB-CZ 3.75Å; F160-F200 AromaticContact CD1-CE1 3.8Å; F160-F200 HydrophobicContact CD1-CE1 3.8Å; F160-F200 AromaticContact CD1-CZ 3.74Å; F160-F200 HydrophobicContact CD1-CZ 3.74Å; F160-F200 HydrophobicContact CG-CZ 4.05Å; F160-F201 WeakPolarHBondContact CA-O 3.37Å
161	R	98.5	Very high	88.1	Confident	66 Å²	66	58 Å²	58	25%	0.249	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	119.7	175.4	175.1	179.6	177.9	75.3	5.5	111.1	V163 T183 S184 F201 L203	R161-V163 HydrophobicContact CG-CG2 4.27Å; R161-T183 VanDerWaalsContact CD-CG2 3.41Å; R161-S184 WeakPolarHBondContact CD-O 3.41Å; R161-S184 PolarHBondContact NH1-O 3.38Å; R161-F201 HydrophobicContact CB-CB 4.24Å; R161-F201 PolarHBondContact N-O 3.48Å; R161-F201 PolarHBondContact O-N 3.1Å; R161-L203 HydrophobicContact CB-CD1 4.2Å
162	G	97.9	Very high	89.3	Confident	4 Å²	4	64.9 Å²	64.9	4%	0.041	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	143.7	166.5	0	0	0	0	0	111.9	A192 G196	G162-A192 VanDerWaalsContact CA-O 3.24Å; G162-A192 WeakPolarHBondContact CA-O 3.32Å; G162-A192 PolarHBondContact N-O 3.41Å; G162-A192 VanDerWaalsContact N-O 3.15Å; G162-G196 VanDerWaalsContact CA-O 3.32Å; G162-G196 WeakPolarHBondContact CA-O 3.42Å
163	V	97.2	Very high	91	Very high	12 Å²	12	66.3 Å²	66.3	7%	0.073	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	122.6	172.8	-176.5	0	0	0	0	108.6	R161 L166 F168 A198 T199 F201	R161-V163 HydrophobicContact CG-CG2 4.27Å; V163-L166 HydrophobicContact CG1-CB 4.25Å; V163-F168 HydrophobicContact CG1-CE2 4.18Å; V163-F168 HydrophobicContact CG2-CE2 4.3Å; V163-A198 WeakPolarHBondContact O-CA 3.36Å; V163-A198 VanDerWaalsContact O-CB 3.29Å; V163-A198 WeakPolarHBondContact O-CB 3.46Å; V163-A198 PolarHBondContact O-N 3.23Å; V163-T199 PolarHBondContact N-O 3.47Å; V163-T199 PolarHBondContact O-N 3.05Å; V163-F201 HydrophobicContact CG2-CD2 4.34Å; V163-F201 HydrophobicContact CG2-CE2 4.07Å
164	G	95.4	Very high	93	Very high	43 Å²	43	58.1 Å²	58.1	44%	0.443	32%	0.322	S	S	.	.	S	Bend	trans	-88.3	-16.5	-178.7	0	0	0	0	0	115.7	A198	G164-A198 WeakPolarHBondContact O-CB 3.25Å
165	S	93.4	Very high	94.5	Very high	79 Å²	79	57.8 Å²	57.8	55%	0.552	31%	0.311	S	S	*	.	S	Bend	trans	-111.8	-7.9	-165	56.6	0	0	0	0	115.6	P25	P25-S165 WeakPolarHBondContact CD-O 3.48Å
166	L	95.4	Very high	95.7	Very high	47 Å²	47	57.1 Å²	57.1	25%	0.246	30%	0.302	C	S	.	.			trans	-143.7	144.1	-171.9	-68.5	169.9	0	0	0	111.3	P25 L27 V163 F168 T199	P25-L166 HydrophobicContact CB-CD2 4.21Å; P25-L166 HydrophobicContact CG-CD2 3.85Å; L27-L166 HydrophobicContact CD2-CD1 4.13Å; V163-L166 HydrophobicContact CG1-CB 4.25Å; L166-F168 HydrophobicContact CB-CD2 4.14Å; L166-F168 HydrophobicContact CB-CE2 3.74Å; L166-F168 HydrophobicContact CB-CZ 4.37Å; L166-F168 HydrophobicContact CD1-CE2 4.02Å; L166-F168 HydrophobicContact CD1-CZ 3.89Å; L166-T199 PolarHBondContact O-OG1 3.33Å
167	H	97.1	Very high	96.5	Very high	20 Å²	20	56 Å²	56	9%	0.093	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	105.2	166.1	-75	-178.1	0	0	0	109	V24 P25 I26 L27 A198 T199 A241 R243	V24-H167 VanDerWaalsContact CG1-CD2 3.44Å; V24-H167 WeakPolarHBondContact CG1-CD2 3.38Å; P25-H167 PolarHBondContact O-N 3.19Å; I26-H167 CarbonylContact C-O 3.43Å; I26-H167 VanDerWaalsContact CA-O 3.28Å; I26-H167 WeakPolarHBondContact CA-O 3.36Å; I26-H167 HydrophobicContact CG1-CB 3.96Å; L27-H167 PolarHBondContact N-O 3.13Å; H167-A198 PolarHBondContact CD2-O 3.27Å; H167-T199 VanDerWaalsContact CA-OG1 3.28Å; H167-T199 WeakPolarHBondContact CA-OG1 3.5Å; H167-A241 PolarHBondContact CE1-O 3.34Å; H167-A241 PolarHBondContact NE2-O 2.84Å; H167-R243 HydrophobicContact CB-CG 3.92Å
168	F	97	Very high	96.8	Very high	37 Å²	37	51.4 Å²	51.4	16%	0.162	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.4	172.1	-68	-95.8	0	0	0	110	L27 L29 V163 L166 T199 F201	L27-F168 HydrophobicContact CB-CD1 4.21Å; L27-F168 HydrophobicContact CB-CE1 4.28Å; L27-F168 HydrophobicContact CD2-CD1 4.12Å; L27-F168 HydrophobicContact CD2-CE1 3.41Å; L27-F168 VanDerWaalsContact CD2-CE1 3.41Å; L27-F168 HydrophobicContact CD2-CZ 3.87Å; L27-F168 HydrophobicContact CG-CD1 4.16Å; L27-F168 HydrophobicContact CG-CE1 3.94Å; L27-F168 WeakPolarHBondContact O-CA 3.25Å; L29-F168 HydrophobicContact CD1-CB 4.5Å; L29-F168 HydrophobicContact CD2-CB 4.04Å; L29-F168 HydrophobicContact CD2-CD1 3.63Å; L29-F168 HydrophobicContact CD2-CE1 4.48Å; L29-F168 HydrophobicContact CD2-CG 4.22Å; L29-F168 HydrophobicContact CG-CB 4.14Å; L29-F168 HydrophobicContact CG-CD1 4.37Å; V163-F168 HydrophobicContact CG1-CE2 4.18Å; V163-F168 HydrophobicContact CG2-CE2 4.3Å; L166-F168 HydrophobicContact CB-CD2 4.14Å; L166-F168 HydrophobicContact CB-CE2 3.74Å; L166-F168 HydrophobicContact CB-CZ 4.37Å; L166-F168 HydrophobicContact CD1-CE2 4.02Å; L166-F168 HydrophobicContact CD1-CZ 3.89Å; F168-T199 HydrophobicContact CB-CG2 4.06Å; F168-T199 HydrophobicContact CD2-CG2 4.18Å; F168-T199 PolarHBondContact N-OG1 3.28Å; F168-F201 HydrophobicContact CB-CE1 4.34Å; F168-F201 HydrophobicContact CB-CE2 4.38Å; F168-F201 HydrophobicContact CB-CZ 3.59Å; F168-F201 HydrophobicContact CD1-CZ 4.2Å; F168-F201 AromaticContact CD2-CE2 3.73Å; F168-F201 HydrophobicContact CD2-CE2 3.73Å; F168-F201 AromaticContact CD2-CZ 3.66Å; F168-F201 HydrophobicContact CD2-CZ 3.66Å; F168-F201 HydrophobicContact CE2-CE2 4.22Å; F168-F201 HydrophobicContact CE2-CZ 4.35Å; F168-F201 HydrophobicContact CG-CE2 4.14Å; F168-F201 AromaticContact CG-CZ 3.56Å; F168-F201 HydrophobicContact CG-CZ 3.56Å
169	E	96.7	Very high	96.9	Very high	41 Å²	41	50.4 Å²	50.4	19%	0.192	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.9	-179.3	-60.6	-168.2	167.1	0	0	109.5	I26 L27 P28 L29 F236 R243	I26-E169 HydrophobicContact CG2-CB 4.18Å; I26-E169 HydrophobicContact CG2-CG 3.89Å; L27-E169 PolarHBondContact O-N 3.26Å; P28-E169 CarbonylContact C-O 3.54Å; P28-E169 VanDerWaalsContact CA-O 3.3Å; P28-E169 WeakPolarHBondContact CA-O 3.49Å; L29-E169 PolarHBondContact N-O 2.94Å; E169-F236 HydrophobicContact CB-CE2 4.33Å; E169-F236 HydrophobicContact CB-CZ 4.13Å; E169-F236 HydrophobicContact CG-CE2 4.07Å; E169-F236 HydrophobicContact CG-CZ 3.77Å; E169-R243 IonicContact OE1-CZ 3.55Å; E169-R243 IonicContact OE1-NE 3.82Å; E169-R243 PolarHBondContact OE1-NE 3.01Å; E169-R243 IonicContact OE1-NH2 3.19Å
170	P	96.7	Very high	96.7	Very high	18 Å²	18	50.5 Å²	50.5	12%	0.117	26%	0.262	C	S	.	.			trans	-72.2	151.6	171.3	31.3	-31.9	0	0	0	109.8	L29 V233 F236	L29-P170 HydrophobicContact CD1-CB 4.19Å; P170-V233 HydrophobicContact CB-CB 4.33Å; P170-V233 HydrophobicContact CB-CG1 3.65Å; P170-V233 HydrophobicContact CB-CG2 3.95Å; P170-V233 HydrophobicContact CG-CG1 3.81Å; P170-F236 HydrophobicContact CG-CB 3.72Å; P170-F236 HydrophobicContact CG-CD1 4.36Å; P170-F236 HydrophobicContact CG-CD2 3.88Å; P170-F236 HydrophobicContact CG-CG 3.72Å
171	K	95.6	Very high	96.6	Very high	155 Å²	155	50 Å²	50	67%	0.674	26%	0.26	S	S	*	.	S	Bend	trans	-66.4	-47	171.6	-65.3	178.4	-177.7	179	0	110	D175	K171-D175 WeakPolarHBondContact CB-OD2 3.37Å
172	R	96.1	Very high	96.6	Very high	176 Å²	176	46.9 Å²	46.9	66%	0.664	25%	0.248	S	C	*	.	S	Bend	trans	-149.2	159.1	175	-60.4	174.3	-61.5	-173.9	7.1	111.1	D175	R172-D175 IonicContact CZ-OD1 2.71Å; R172-D175 PolarHBondContact N-OD2 2.84Å; R172-D175 IonicContact NE-OD1 3.6Å; R172-D175 IonicContact NE-OD2 3.16Å; R172-D175 IonicContact NH2-OD1 2.57Å; R172-D175 PolarHBondContact NH2-OD1 3.42Å; R172-D175 VanDerWaalsContact NH2-OD1 3.16Å; R172-D175 PolarHBondContact O-N 3.38Å
173	L	97.6	Very high	96.7	Very high	106 Å²	106	46.8 Å²	46.8	56%	0.555	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	143.2	164	-59.1	-178.2	0	0	0	109.5	D175 V233 F236	L173-D175 VanDerWaalsContact C-N 3.32Å; L173-V233 HydrophobicContact CD2-CG1 3.92Å; L173-F236 HydrophobicContact CD2-CB 3.97Å
174	G	97	Very high	96.7	Very high	43 Å²	43	47.6 Å²	47.6	44%	0.443	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-3.1	-176.3	0	0	0	0	0	115	L232 V233	G174-L232 WeakPolarHBondContact O-CD1 3.37Å; G174-V233 PolarHBondContact N-O 3.32Å
175	D	96.9	Very high	96.9	Very high	33 Å²	33	45.9 Å²	45.9	18%	0.176	23%	0.234	C	C	.	.			trans	-72.8	148.5	172.8	-71.5	-23.6	0	0	0	110.7	K171 R172 L173 V233	K171-D175 WeakPolarHBondContact CB-OD2 3.37Å; R172-D175 IonicContact CZ-OD1 2.71Å; R172-D175 PolarHBondContact N-OD2 2.84Å; R172-D175 IonicContact NE-OD1 3.6Å; R172-D175 IonicContact NE-OD2 3.16Å; R172-D175 IonicContact NH2-OD1 2.57Å; R172-D175 PolarHBondContact NH2-OD1 3.42Å; R172-D175 VanDerWaalsContact NH2-OD1 3.16Å; R172-D175 PolarHBondContact O-N 3.38Å; L173-D175 VanDerWaalsContact C-N 3.32Å; D175-V233 WeakPolarHBondContact O-CG2 3.49Å; D175-V233 PolarHBondContact O-N 3.48Å
176	F	97.5	Very high	97.1	Very high	110 Å²	110	42.3 Å²	42.3	48%	0.482	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	134.3	170.4	-66.7	-75.1	0	0	0	111	L31 V230 F231 L232	L31-F176 HydrophobicContact CD2-CB 4.27Å; F176-V230 HydrophobicContact CB-CG1 4Å; F176-V230 HydrophobicContact CD1-CG1 3.87Å; F176-V230 HydrophobicContact CG-CG1 4.28Å; F176-F231 CarbonylContact C-O 3.56Å; F176-F231 VanDerWaalsContact CA-O 3.28Å; F176-F231 WeakPolarHBondContact CA-O 3.35Å; F176-L232 HydrophobicContact CD1-CB 4.43Å; F176-L232 HydrophobicContact CD1-CD1 4.26Å; F176-L232 HydrophobicContact CE1-CB 4.26Å; F176-L232 HydrophobicContact CE1-CD1 3.95Å; F176-L232 HydrophobicContact CZ-CD1 4.19Å
177	V	98	Very high	97.2	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.018	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	159.9	-176.3	-57.2	0	0	0	0	110.6	L29 S30 F231 V233 L247	L29-V177 HydrophobicContact CB-CB 4.17Å; L29-V177 HydrophobicContact CB-CG1 3.68Å; S30-V177 WeakPolarHBondContact O-CA 3.45Å; V177-F231 HydrophobicContact CG2-CB 4.11Å; V177-F231 PolarHBondContact N-O 2.97Å; V177-F231 PolarHBondContact O-N 2.95Å; V177-V233 HydrophobicContact CB-CG2 4.49Å; V177-V233 HydrophobicContact CG1-CG2 3.7Å; V177-V233 HydrophobicContact CG2-CG2 3.92Å; V177-L247 HydrophobicContact CG2-CD1 4.31Å; V177-L247 HydrophobicContact CG2-CD2 3.84Å
178	R	97.5	Very high	97.2	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.015	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.8	172.1	-69.5	173.7	57	-167	-2.5	109.1	S30 L31 V32 D37 P227 V230 C254	S30-R178 PolarHBondContact O-N 3.14Å; L31-R178 HydrophobicContact CD2-CG 4.22Å; V32-R178 HydrophobicContact CG2-CB 3.67Å; D37-R178 IonicContact OD2-CZ 2.78Å; D37-R178 VanDerWaalsContact OD2-CZ 3.26Å; D37-R178 IonicContact OD2-NH1 3.16Å; D37-R178 PolarHBondContact OD2-NH1 3.33Å; D37-R178 IonicContact OD2-NH2 3.83Å; D37-R178 PolarHBondContact OD2-NH2 3.34Å; R178-P227 PolarHBondContact NE-O 2.91Å; R178-P227 PolarHBondContact NH2-O 2.86Å; R178-V230 HydrophobicContact CG-CG2 3.96Å; R178-C254 PolarHBondContact NH1-O 3.37Å; R178-C254 PolarHBondContact NH2-O 3.11Å
179	L	96.9	Very high	97.3	Very high	29 Å²	29	44.9 Å²	44.9	15%	0.152	22%	0.224	C	C	.	.			trans	-82.6	-19.9	-177.8	-59.8	168.3	0	0	0	112.7	Q181 T183 L203 I225 F231 L247	L179-Q181 VanDerWaalsContact C-N 3.27Å; L179-Q181 PolarHBondContact O-N 3.37Å; L179-T183 VanDerWaalsContact CB-OG1 3.28Å; L179-T183 WeakPolarHBondContact CB-OG1 3.31Å; L179-T183 HydrophobicContact CD1-CG2 3.82Å; L179-L203 HydrophobicContact CD1-CD2 3.91Å; L179-L203 HydrophobicContact CD2-CD2 4.45Å; L179-I225 HydrophobicContact CD1-CD1 4.36Å; L179-I225 HydrophobicContact CD1-CG2 4.12Å; L179-F231 HydrophobicContact CD1-CD2 4.43Å; L179-F231 HydrophobicContact CD1-CE2 3.75Å; L179-F231 HydrophobicContact CD1-CZ 4.24Å; L179-F231 HydrophobicContact CG-CD2 4.38Å; L179-F231 HydrophobicContact CG-CE2 4.12Å; L179-L247 HydrophobicContact CD2-CD1 4.15Å
180	G	93.3	Very high	97.3	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.01	25%	0.247	C	C	.	.			trans	74.5	11.5	168.4	0	0	0	0	0	116.3	V32 T35 R116	V32-G180 VanDerWaalsContact CG2-CA 3.49Å; T35-G180 VanDerWaalsContact CG2-O 3.3Å; T35-G180 WeakPolarHBondContact CG2-O 3.35Å; T35-G180 WeakPolarHBondContact OG1-CA 3.29Å; T35-G180 PolarHBondContact OG1-O 3.01Å; R116-G180 WeakPolarHBondContact CA-O 3.31Å; R116-G180 WeakPolarHBondContact CG-O 3.48Å
181	Q	97.5	Very high	97.4	Very high	23 Å²	23	49.1 Å²	49.1	11%	0.107	25%	0.252	C	S	.	.	S	Bend	trans	-164.5	170.1	177.5	50	167	87	0	0	109.6	N112 V115 R116 L179 T183 P227	N112-Q181 HydrophobicContact CB-CB 4.1Å; N112-Q181 PolarHBondContact ND2-NE2 2.88Å; N112-Q181 VanDerWaalsContact ND2-NE2 3.2Å; V115-Q181 HydrophobicContact CG1-CB 4.32Å; R116-Q181 VanDerWaalsContact CD-OE1 3.29Å; R116-Q181 HydrophobicContact CG-CB 4.1Å; R116-Q181 HydrophobicContact CG-CG 4.33Å; L179-Q181 VanDerWaalsContact C-N 3.27Å; L179-Q181 PolarHBondContact O-N 3.37Å; Q181-T183 PolarHBondContact O-N 2.85Å; Q181-T183 PolarHBondContact O-OG1 2.99Å; Q181-T183 VanDerWaalsContact O-OG1 3.11Å; Q181-P227 WeakPolarHBondContact O-CA 3.35Å
182	F	98.7	Very high	97.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.			trans	-57.9	129.9	159.9	-63.4	-81.5	0	0	0	108.6	Y100 L111 N112 V115 H135 L138 T139 L142 L224 I225	Y100-F182 HydrophobicContact CE2-CB 3.8Å; Y100-F182 PolarHBondContact OH-O 3.45Å; L111-F182 HydrophobicContact CD2-CD2 4.24Å; L111-F182 HydrophobicContact CD2-CE2 4.47Å; N112-F182 PolarHBondContact ND2-O 3.11Å; N112-F182 PolarHBondContact OD1-N 3.38Å; N112-F182 PolarHBondContact OD1-O 3.44Å; N112-F182 VanDerWaalsContact OD1-O 3.07Å; V115-F182 HydrophobicContact CG2-CD2 4.38Å; V115-F182 HydrophobicContact CG2-CE2 4.32Å; H135-F182 AromaticContact CD2-CE2 3.54Å; H135-F182 AromaticContact CD2-CZ 3.94Å; H135-F182 AromaticContact NE2-CE2 3.95Å; L138-F182 HydrophobicContact CB-CE1 4.28Å; L138-F182 HydrophobicContact CB-CZ 4.08Å; L138-F182 HydrophobicContact CD2-CB 4.44Å; L138-F182 HydrophobicContact CD2-CD1 3.8Å; L138-F182 HydrophobicContact CD2-CD2 3.76Å; L138-F182 HydrophobicContact CD2-CE1 3.88Å; L138-F182 HydrophobicContact CD2-CE2 3.84Å; L138-F182 HydrophobicContact CD2-CG 3.73Å; L138-F182 HydrophobicContact CD2-CZ 3.9Å; L138-F182 HydrophobicContact CG-CD1 4.07Å; L138-F182 HydrophobicContact CG-CE1 3.81Å; L138-F182 HydrophobicContact CG-CE2 4.46Å; L138-F182 HydrophobicContact CG-CG 4.49Å; L138-F182 HydrophobicContact CG-CZ 4.02Å; T139-F182 WeakPolarHBondContact OG1-CZ 3.18Å; L142-F182 HydrophobicContact CD1-CD1 3.8Å; L142-F182 HydrophobicContact CD1-CE1 3.83Å; F182-L224 HydrophobicContact CB-CD1 4.06Å; F182-I225 WeakPolarHBondContact CA-O 3.27Å
183	T	98.4	Very high	97.6	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	107.3	-173.5	-56.9	0	0	0	0	110.2	R161 L179 Q181 I225	R161-T183 VanDerWaalsContact CD-CG2 3.41Å; L179-T183 VanDerWaalsContact CB-OG1 3.28Å; L179-T183 WeakPolarHBondContact CB-OG1 3.31Å; L179-T183 HydrophobicContact CD1-CG2 3.82Å; Q181-T183 PolarHBondContact O-N 2.85Å; Q181-T183 PolarHBondContact O-OG1 2.99Å; Q181-T183 VanDerWaalsContact O-OG1 3.11Å; T183-I225 PolarHBondContact N-O 3.23Å; T183-I225 PolarHBondContact O-N 3.38Å
184	S	98.3	Very high	97.5	Very high	28 Å²	28	36.8 Å²	36.8	20%	0.196	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	133.6	170.9	-57.9	0	0	0	0	110.4	Y100 R161 E222	Y100-S184 VanDerWaalsContact CE1-OG 3.25Å; Y100-S184 WeakPolarHBondContact CE1-OG 3.44Å; Y100-S184 PolarHBondContact OH-OG 2.95Å; R161-S184 WeakPolarHBondContact CD-O 3.41Å; R161-S184 PolarHBondContact NH1-O 3.38Å; S184-E222 WeakPolarHBondContact CB-OE1 3.25Å; S184-E222 PolarHBondContact OG-OE1 3.43Å
185	S	98.4	Very high	97.4	Very high	7 Å²	7	40.1 Å²	40.1	5%	0.049	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	163.7	174.3	62.5	0	0	0	0	108.8	V159 F160 E222 V223	V159-S185 WeakPolarHBondContact CB-OG 3.25Å; V159-S185 VanDerWaalsContact CG2-OG 3.27Å; V159-S185 WeakPolarHBondContact CG2-OG 3.28Å; F160-S185 CarbonylContact O-C 3.54Å; F160-S185 VanDerWaalsContact O-CA 3.28Å; F160-S185 WeakPolarHBondContact O-CA 3.31Å; F160-S185 WeakPolarHBondContact O-CB 3.04Å; S185-E222 CarbonylContact O-C 3.57Å; S185-E222 VanDerWaalsContact O-CA 3.29Å; S185-E222 WeakPolarHBondContact O-CA 3.38Å; S185-V223 PolarHBondContact N-O 3.24Å; S185-V223 PolarHBondContact O-N 3.37Å; S185-V223 PolarHBondContact OG-O 3.27Å
186	S	98.5	Very high	97.3	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.028	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146	-179.5	-175.9	0	0	0	0	111	V159 F160 D188 E220	V159-S186 CarbonylContact C-O 3.53Å; V159-S186 WeakPolarHBondContact CA-O 3.3Å; F160-S186 PolarHBondContact N-O 3.41Å; F160-S186 PolarHBondContact O-N 2.92Å; S186-D188 WeakPolarHBondContact CB-O 3.3Å; S186-D188 PolarHBondContact O-N 3Å; S186-D188 PolarHBondContact OG-N 3.01Å; S186-D188 PolarHBondContact OG-O 3.41Å; S186-E220 VanDerWaalsContact CB-O 3.31Å; S186-E220 WeakPolarHBondContact CB-O 3.44Å; S186-E220 PolarHBondContact OG-O 3.19Å
187	L	97.4	Very high	97	Very high	34 Å²	34	39.6 Å²	39.6	18%	0.178	22%	0.224	C	C	.	.	S	Bend	trans	-67.1	-16.5	164	-67.4	174	0	0	0	112.4	E157 V159 L210 R221 V223	E157-L187 HydrophobicContact CG-CD2 3.6Å; E157-L187 VanDerWaalsContact OE1-CD2 3.27Å; E157-L187 WeakPolarHBondContact OE1-CD2 3.09Å; V159-L187 HydrophobicContact CG1-CD2 4.02Å; L187-L210 HydrophobicContact CD1-CD1 3.78Å; L187-L210 HydrophobicContact CD1-CD2 4.49Å; L187-R221 HydrophobicContact CB-CB 4.14Å; L187-R221 PolarHBondContact N-O 3.33Å; L187-V223 HydrophobicContact CD1-CG2 4.49Å; L187-V223 HydrophobicContact CD2-CG2 3.97Å; L187-V223 HydrophobicContact CG-CG2 3.9Å
188	D	98.1	Very high	96.9	Very high	51 Å²	51	39.7 Å²	39.7	27%	0.273	23%	0.226	S	C	.	.			trans	-106.5	115.1	-179.7	-168.2	-35.5	0	0	0	110.6	S186 T190 V191 A192	S186-D188 WeakPolarHBondContact CB-O 3.3Å; S186-D188 PolarHBondContact O-N 3Å; S186-D188 PolarHBondContact OG-N 3.01Å; S186-D188 PolarHBondContact OG-O 3.41Å; D188-T190 PolarHBondContact O-N 3.27Å; D188-T190 WeakPolarHBondContact OD1-CA 3.3Å; D188-T190 WeakPolarHBondContact OD1-CB 3.13Å; D188-T190 PolarHBondContact OD1-N 3.5Å; D188-T190 PolarHBondContact OD1-OG1 2.89Å; D188-V191 HydrophobicContact CB-CB 4.02Å; D188-V191 HydrophobicContact CB-CG2 3.81Å; D188-V191 PolarHBondContact O-N 3.27Å; D188-V191 PolarHBondContact OD1-N 3.36Å; D188-A192 PolarHBondContact O-N 3.43Å
189	E	97.9	Very high	97	Very high	74 Å²	74	39.5 Å²	39.5	35%	0.346	23%	0.225	S	C	.	.	H	α-helix	trans	-58.9	-35.3	176.9	167.5	163	-178.5	0	0	112.4	F160 A192 R193 F200	F160-E189 HydrophobicContact CD1-CB 4.32Å; F160-E189 HydrophobicContact CD2-CB 3.85Å; F160-E189 HydrophobicContact CE1-CB 4.46Å; F160-E189 HydrophobicContact CE2-CB 4.03Å; F160-E189 HydrophobicContact CG-CB 4Å; F160-E189 HydrophobicContact CZ-CB 4.32Å; E189-A192 PolarHBondContact O-N 3.09Å; E189-R193 HydrophobicContact CG-CG 4.4Å; E189-R193 WeakPolarHBondContact O-CG 3.24Å; E189-R193 PolarHBondContact O-N 3.16Å; E189-R193 IonicContact OE1-CZ 3.85Å; E189-R193 VanDerWaalsContact OE1-CZ 3.24Å; E189-R193 IonicContact OE1-NE 2.72Å; E189-R193 PolarHBondContact OE1-NE 3.16Å; E189-R193 IonicContact OE1-NH2 3.65Å; E189-R193 PolarHBondContact OE1-NH2 2.57Å; E189-F200 HydrophobicContact CG-CE1 4.49Å; E189-F200 HydrophobicContact CG-CZ 3.78Å
190	T	97.9	Very high	97	Very high	112 Å²	112	38.4 Å²	38.4	69%	0.687	22%	0.219	S	C	*	.	H	α-helix	trans	-67.1	-44.3	-178.8	-48.7	0	0	0	0	110.6	D188 R193 G194	D188-T190 PolarHBondContact O-N 3.27Å; D188-T190 WeakPolarHBondContact OD1-CA 3.3Å; D188-T190 WeakPolarHBondContact OD1-CB 3.13Å; D188-T190 PolarHBondContact OD1-N 3.5Å; D188-T190 PolarHBondContact OD1-OG1 2.89Å; T190-R193 PolarHBondContact O-N 3.43Å; T190-G194 PolarHBondContact O-N 3.16Å
191	V	97.9	Very high	97.3	Very high	35 Å²	35	38.6 Å²	38.6	21%	0.212	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-50.7	172.4	169.5	0	0	0	0	109.7	D188 R193 G194 F195 E220	D188-V191 HydrophobicContact CB-CB 4.02Å; D188-V191 HydrophobicContact CB-CG2 3.81Å; D188-V191 PolarHBondContact O-N 3.27Å; D188-V191 PolarHBondContact OD1-N 3.36Å; V191-R193 VanDerWaalsContact C-N 3.3Å; V191-R193 PolarHBondContact O-N 3.17Å; V191-G194 PolarHBondContact O-N 3.4Å; V191-F195 HydrophobicContact CG1-CE2 3.89Å; V191-F195 VanDerWaalsContact O-CD2 3.28Å; V191-F195 WeakPolarHBondContact O-CD2 3.45Å; V191-E220 HydrophobicContact CG1-CB 4.09Å; V191-E220 HydrophobicContact CG1-CG 4.26Å
192	A	98.1	Very high	97.3	Very high	2 Å²	2	39 Å²	39	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-39	-179.1	0	0	0	0	0	113	F160 G162 D188 E189 G194 F195 F200	F160-A192 HydrophobicContact CB-CB 3.43Å; F160-A192 VanDerWaalsContact CB-CB 3.43Å; F160-A192 WeakPolarHBondContact O-CB 3.5Å; G162-A192 VanDerWaalsContact CA-O 3.24Å; G162-A192 WeakPolarHBondContact CA-O 3.32Å; G162-A192 PolarHBondContact N-O 3.41Å; G162-A192 VanDerWaalsContact N-O 3.15Å; D188-A192 PolarHBondContact O-N 3.43Å; E189-A192 PolarHBondContact O-N 3.09Å; A192-G194 PolarHBondContact O-N 3.45Å; A192-F195 PolarHBondContact O-N 3.25Å; A192-F200 HydrophobicContact CB-CE2 3.95Å; A192-F200 HydrophobicContact CB-CZ 4.45Å
193	R	96.9	Very high	97.3	Very high	106 Å²	106	39.1 Å²	39.1	40%	0.4	23%	0.226	S	C	.	.	H	α-helix	trans	-66	-26	176.2	-74.2	-175.1	-178.1	-83.5	-1.3	113	E189 T190 V191 F195 G196 F200	E189-R193 HydrophobicContact CG-CG 4.4Å; E189-R193 WeakPolarHBondContact O-CG 3.24Å; E189-R193 PolarHBondContact O-N 3.16Å; E189-R193 IonicContact OE1-CZ 3.85Å; E189-R193 VanDerWaalsContact OE1-CZ 3.24Å; E189-R193 IonicContact OE1-NE 2.72Å; E189-R193 PolarHBondContact OE1-NE 3.16Å; E189-R193 IonicContact OE1-NH2 3.65Å; E189-R193 PolarHBondContact OE1-NH2 2.57Å; T190-R193 PolarHBondContact O-N 3.43Å; V191-R193 VanDerWaalsContact C-N 3.3Å; V191-R193 PolarHBondContact O-N 3.17Å; R193-F195 PolarHBondContact O-N 2.96Å; R193-G196 PolarHBondContact O-N 3.22Å; R193-F200 HydrophobicContact CG-CD2 3.95Å; R193-F200 HydrophobicContact CG-CE2 3.48Å; R193-F200 VanDerWaalsContact CG-CE2 3.48Å; R193-F200 HydrophobicContact CG-CZ 4.16Å
194	G	96.6	Very high	97.2	Very high	70 Å²	70	42 Å²	42	72%	0.722	24%	0.236	S	C	*	.	H	α-helix	trans	-61.8	-26.7	174.1	0	0	0	0	0	114	T190 V191 A192 G196	T190-G194 PolarHBondContact O-N 3.16Å; V191-G194 PolarHBondContact O-N 3.4Å; A192-G194 PolarHBondContact O-N 3.45Å; G194-G196 VanDerWaalsContact C-N 3.34Å
195	F	95.1	Very high	97	Very high	114 Å²	114	40.8 Å²	40.8	50%	0.5	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-8.5	-180	-69.1	-83	0	0	0	114.5	V191 A192 R193 E220	V191-F195 HydrophobicContact CG1-CE2 3.89Å; V191-F195 VanDerWaalsContact O-CD2 3.28Å; V191-F195 WeakPolarHBondContact O-CD2 3.45Å; A192-F195 PolarHBondContact O-N 3.25Å; R193-F195 PolarHBondContact O-N 2.96Å; F195-E220 WeakPolarHBondContact CZ-OE1 3.25Å
196	G	94.1	Very high	96.8	Very high	17 Å²	17	40.8 Å²	40.8	18%	0.175	23%	0.228	C	C	.	.			trans	138.4	164	172.7	0	0	0	0	0	114.1	G162 R193 G194	G162-G196 VanDerWaalsContact CA-O 3.32Å; G162-G196 WeakPolarHBondContact CA-O 3.42Å; R193-G196 PolarHBondContact O-N 3.22Å; G194-G196 VanDerWaalsContact C-N 3.34Å
197	N	92.2	Very high	96.6	Very high	114 Å²	114	41 Å²	41	61%	0.61	23%	0.228	S	C	*	.	S	Bend	trans	-122.6	1.3	-169.9	69.5	-9.1	0	0	0	114.5	Q242	N197-Q242 WeakPolarHBondContact O-CB 3.29Å; N197-Q242 WeakPolarHBondContact O-CG 3.5Å; N197-Q242 PolarHBondContact O-NE2 3.1Å
198	A	96	Very high	96.5	Very high	6 Å²	6	40.1 Å²	40.1	5%	0.05	23%	0.227	C	C	.	.	S	Bend	trans	-69.2	-45.9	-178.2	0	0	0	0	0	111	V24 V163 G164 H167 R243	V24-A198 HydrophobicContact CG1-CB 4.09Å; V163-A198 WeakPolarHBondContact O-CA 3.36Å; V163-A198 VanDerWaalsContact O-CB 3.29Å; V163-A198 WeakPolarHBondContact O-CB 3.46Å; V163-A198 PolarHBondContact O-N 3.23Å; G164-A198 WeakPolarHBondContact O-CB 3.25Å; H167-A198 PolarHBondContact CD2-O 3.27Å; A198-R243 PolarHBondContact O-N 3.35Å
199	T	98.1	Very high	96.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.1	162.6	-56.2	0	0	0	0	110.1	V163 L166 H167 F168 F201 R243 V245	V163-T199 PolarHBondContact N-O 3.47Å; V163-T199 PolarHBondContact O-N 3.05Å; L166-T199 PolarHBondContact O-OG1 3.33Å; H167-T199 VanDerWaalsContact CA-OG1 3.28Å; H167-T199 WeakPolarHBondContact CA-OG1 3.5Å; F168-T199 HydrophobicContact CB-CG2 4.06Å; F168-T199 HydrophobicContact CD2-CG2 4.18Å; F168-T199 PolarHBondContact N-OG1 3.28Å; T199-F201 HydrophobicContact CG2-CD2 3.81Å; T199-F201 HydrophobicContact CG2-CE1 4.42Å; T199-F201 HydrophobicContact CG2-CE2 3.44Å; T199-F201 VanDerWaalsContact CG2-CE2 3.44Å; T199-F201 HydrophobicContact CG2-CG 4.46Å; T199-F201 HydrophobicContact CG2-CZ 3.79Å; T199-R243 CarbonylContact C-O 3.57Å; T199-R243 VanDerWaalsContact CA-O 3.26Å; T199-R243 WeakPolarHBondContact CA-O 3.11Å; T199-R243 HydrophobicContact CG2-CB 4.3Å; T199-V245 HydrophobicContact CG2-CG2 3.91Å
200	F	98.2	Very high	96.2	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.026	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.7	170.1	-169.7	-99.6	0	0	0	109.8	F160 E189 A192 R193 R243 I244 V245	F160-F200 HydrophobicContact CB-CE2 4.32Å; F160-F200 HydrophobicContact CB-CZ 3.75Å; F160-F200 AromaticContact CD1-CE1 3.8Å; F160-F200 HydrophobicContact CD1-CE1 3.8Å; F160-F200 AromaticContact CD1-CZ 3.74Å; F160-F200 HydrophobicContact CD1-CZ 3.74Å; F160-F200 HydrophobicContact CG-CZ 4.05Å; E189-F200 HydrophobicContact CG-CE1 4.49Å; E189-F200 HydrophobicContact CG-CZ 3.78Å; A192-F200 HydrophobicContact CB-CE2 3.95Å; A192-F200 HydrophobicContact CB-CZ 4.45Å; R193-F200 HydrophobicContact CG-CD2 3.95Å; R193-F200 HydrophobicContact CG-CE2 3.48Å; R193-F200 VanDerWaalsContact CG-CE2 3.48Å; R193-F200 HydrophobicContact CG-CZ 4.16Å; F200-R243 PolarHBondContact N-O 3.31Å; F200-I244 WeakPolarHBondContact O-CA 3.49Å; F200-V245 PolarHBondContact O-N 3.38Å
201	F	98.5	Very high	96.2	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.9	176.3	-67.5	-91.4	0	0	0	110.6	L29 F160 R161 V163 F168 T199 L203 V245 L247	L29-F201 HydrophobicContact CD1-CE1 4.46Å; L29-F201 HydrophobicContact CD2-CE1 4.3Å; L29-F201 HydrophobicContact CD2-CZ 4.4Å; F160-F201 WeakPolarHBondContact CA-O 3.37Å; R161-F201 HydrophobicContact CB-CB 4.24Å; R161-F201 PolarHBondContact N-O 3.48Å; R161-F201 PolarHBondContact O-N 3.1Å; V163-F201 HydrophobicContact CG2-CD2 4.34Å; V163-F201 HydrophobicContact CG2-CE2 4.07Å; F168-F201 HydrophobicContact CB-CE1 4.34Å; F168-F201 HydrophobicContact CB-CE2 4.38Å; F168-F201 HydrophobicContact CB-CZ 3.59Å; F168-F201 HydrophobicContact CD1-CZ 4.2Å; F168-F201 AromaticContact CD2-CE2 3.73Å; F168-F201 HydrophobicContact CD2-CE2 3.73Å; F168-F201 AromaticContact CD2-CZ 3.66Å; F168-F201 HydrophobicContact CD2-CZ 3.66Å; F168-F201 HydrophobicContact CE2-CE2 4.22Å; F168-F201 HydrophobicContact CE2-CZ 4.35Å; F168-F201 HydrophobicContact CG-CE2 4.14Å; F168-F201 AromaticContact CG-CZ 3.56Å; F168-F201 HydrophobicContact CG-CZ 3.56Å; T199-F201 HydrophobicContact CG2-CD2 3.81Å; T199-F201 HydrophobicContact CG2-CE1 4.42Å; T199-F201 HydrophobicContact CG2-CE2 3.44Å; T199-F201 VanDerWaalsContact CG2-CE2 3.44Å; T199-F201 HydrophobicContact CG2-CG 4.46Å; T199-F201 HydrophobicContact CG2-CZ 3.79Å; F201-L203 HydrophobicContact CB-CD1 3.55Å; F201-L203 HydrophobicContact CB-CG 4.02Å; F201-V245 WeakPolarHBondContact CA-O 3.39Å; F201-V245 HydrophobicContact CD1-CB 3.67Å; F201-V245 HydrophobicContact CD1-CG1 4.02Å; F201-V245 HydrophobicContact CD1-CG2 4.27Å; F201-V245 HydrophobicContact CE1-CB 3.82Å; F201-V245 HydrophobicContact CE1-CG1 3.97Å; F201-V245 HydrophobicContact CE1-CG2 4.01Å; F201-V245 HydrophobicContact CG-CB 4.49Å; F201-L247 HydrophobicContact CD1-CD1 3.87Å; F201-L247 HydrophobicContact CD1-CG 4.33Å; F201-L247 HydrophobicContact CE1-CD1 4.04Å
202	S	98.1	Very high	96.1	Very high	32 Å²	32	34.9 Å²	34.9	22%	0.224	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	114.7	159	176.9	0	0	0	0	107.6	V245 T246 L247	S202-V245 PolarHBondContact N-O 2.9Å; S202-T246 WeakPolarHBondContact O-CA 3.44Å; S202-L247 PolarHBondContact O-N 3.07Å
203	L	98	Very high	95.9	Very high	2 Å²	2	38 Å²	38	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.7	-176.6	-47.3	98.5	0	0	0	110.5	V158 V159 R161 L179 F201 I225 F231 L247	V158-L203 WeakPolarHBondContact CA-O 3.48Å; V159-L203 HydrophobicContact CG2-CB 3.82Å; V159-L203 HydrophobicContact CG2-CD1 4.16Å; V159-L203 PolarHBondContact N-O 3.42Å; V159-L203 PolarHBondContact O-N 2.81Å; R161-L203 HydrophobicContact CB-CD1 4.2Å; L179-L203 HydrophobicContact CD1-CD2 3.91Å; L179-L203 HydrophobicContact CD2-CD2 4.45Å; F201-L203 HydrophobicContact CB-CD1 3.55Å; F201-L203 HydrophobicContact CB-CG 4.02Å; L203-I225 HydrophobicContact CD2-CD1 4.2Å; L203-F231 HydrophobicContact CD2-CE1 4.39Å; L203-F231 HydrophobicContact CD2-CZ 4.42Å; L203-L247 CarbonylContact C-O 3.5Å; L203-L247 WeakPolarHBondContact CA-O 3.37Å; L203-L247 HydrophobicContact CD2-CB 4.35Å; L203-L247 HydrophobicContact CD2-CD1 3.99Å; L203-L247 HydrophobicContact CG-CB 4.43Å
204	R	96.1	Very high	95.9	Very high	63 Å²	63	33.1 Å²	33.1	24%	0.238	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	102.8	167.8	178.1	177.8	-79.4	-67	7.5	107.4	D155 G156 E157 L247 W248 S249	D155-R204 WeakPolarHBondContact O-CD 3.18Å; D155-R204 WeakPolarHBondContact O-CG 3.24Å; D155-R204 PolarHBondContact O-NH1 2.88Å; G156-R204 PolarHBondContact O-NH1 3.47Å; E157-R204 CarbonylContact O-C 3.52Å; E157-R204 VanDerWaalsContact O-CA 3.32Å; E157-R204 WeakPolarHBondContact O-CA 3.49Å; R204-L247 PolarHBondContact N-O 3.14Å; R204-W248 HydrophobicContact CB-CG 4.38Å; R204-S249 WeakPolarHBondContact O-CB 3.27Å; R204-S249 PolarHBondContact O-N 3.42Å
205	T	95.4	Very high	95.9	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.018	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.4	-172.1	175	0	0	0	0	112	G156 E157 V159 F207 G208 V223 I225 E229	G156-T205 WeakPolarHBondContact CA-O 3.47Å; E157-T205 HydrophobicContact CB-CG2 4.22Å; E157-T205 PolarHBondContact N-O 3.43Å; E157-T205 PolarHBondContact O-N 3.4Å; V159-T205 HydrophobicContact CG1-CG2 4.36Å; V159-T205 HydrophobicContact CG2-CG2 3.97Å; T205-F207 PolarHBondContact OG1-N 3.38Å; T205-G208 PolarHBondContact OG1-N 2.98Å; T205-V223 HydrophobicContact CG2-CG1 4.2Å; T205-I225 HydrophobicContact CG2-CD1 4.23Å; T205-I225 HydrophobicContact CG2-CG1 4.22Å; T205-E229 VanDerWaalsContact OG1-CD 3.32Å; T205-E229 PolarHBondContact OG1-OE1 3.5Å; T205-E229 PolarHBondContact OG1-OE2 3.08Å
206	C	93.5	Very high	95.9	Very high	7 Å²	7	26.6 Å²	26.6	5%	0.047	16%	0.157	C	C	.	.	S	Bend	trans	-104.5	-15.5	172.1	-50.5	0	0	0	0	112.5	C151 E229 S249	C151-C206 HydrophobicContact CB-CB 3.89Å; C151-C206 WeakPolarHBondContact CB-SG 3.27Å; C151-C206 WeakPolarHBondContact SG-CB 3.29Å; C151-C206 CovalentContact SG-SG 2Å; C151-C206 PolarHBondContact SG-SG 3.5Å; C206-E229 PolarHBondContact N-OE1 2.97Å; C206-S249 WeakPolarHBondContact SG-CB 3.42Å; C206-S249 PolarHBondContact SG-OG 2.87Å
207	F	93.7	Very high	96	Very high	9 Å²	9	27.9 Å²	27.9	4%	0.039	16%	0.158	C	C	.	.	S	Bend	trans	-116.5	-8.1	-173.4	-64.1	-98.3	0	0	0	113.4	R146 T205 P226 E229 T253 T275	R146-F207 VanDerWaalsContact NH1-CE1 3.29Å; T205-F207 PolarHBondContact OG1-N 3.38Å; F207-P226 HydrophobicContact CB-CG 3.83Å; F207-P226 VanDerWaalsContact O-CD 3.32Å; F207-P226 WeakPolarHBondContact O-CD 3.47Å; F207-E229 HydrophobicContact CB-CB 4.21Å; F207-E229 HydrophobicContact CB-CG 4.25Å; F207-E229 HydrophobicContact CD2-CB 4.29Å; F207-E229 HydrophobicContact CD2-CG 3.68Å; F207-E229 WeakPolarHBondContact CD2-OE1 3.48Å; F207-E229 HydrophobicContact CE2-CG 4.47Å; F207-E229 HydrophobicContact CG-CB 4.48Å; F207-E229 HydrophobicContact CG-CG 4.31Å; F207-E229 PolarHBondContact N-OE1 3.26Å; F207-T253 HydrophobicContact CD1-CG2 3.57Å; F207-T253 HydrophobicContact CD2-CG2 4.43Å; F207-T253 HydrophobicContact CE1-CG2 3.22Å; F207-T253 HydrophobicContact CE2-CG2 4.12Å; F207-T253 HydrophobicContact CG-CG2 4.19Å; F207-T253 HydrophobicContact CZ-CG2 3.53Å; F207-T275 HydrophobicContact CE1-CG2 3.87Å; F207-T275 HydrophobicContact CZ-CG2 3.74Å
208	G	95.5	Very high	96.2	Very high	16 Å²	16	24.9 Å²	24.9	17%	0.165	15%	0.145	C	C	.	.			trans	-63.9	143	170.7	0	0	0	0	0	111.7	T205 L224	T205-G208 PolarHBondContact OG1-N 2.98Å; G208-L224 VanDerWaalsContact CA-O 3.3Å; G208-L224 WeakPolarHBondContact CA-O 3.24Å
209	A	95.7	Very high	96.3	Very high	2 Å²	2	30.4 Å²	30.4	2%	0.017	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.4	174.7	0	0	0	0	0	110.2	L142 L145 I211 V223 L224	L142-A209 HydrophobicContact CB-CB 4.49Å; L142-A209 HydrophobicContact CD2-CB 3.77Å; L145-A209 HydrophobicContact CB-CB 3.92Å; A209-I211 PolarHBondContact O-N 2.78Å; A209-V223 WeakPolarHBondContact O-CA 3.38Å; A209-L224 PolarHBondContact N-O 3.35Å; A209-L224 PolarHBondContact O-N 2.88Å
210	L	95.4	Very high	96.2	Very high	93 Å²	93	32 Å²	32	49%	0.487	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	113.3	171.1	179.3	61.6	0	0	0	108.9	L187 Q212 V223	L187-L210 HydrophobicContact CD1-CD1 3.78Å; L187-L210 HydrophobicContact CD1-CD2 4.49Å; L210-Q212 HydrophobicContact CD1-CB 3.84Å; L210-Q212 HydrophobicContact CG-CB 4.21Å; L210-V223 HydrophobicContact CB-CG2 4.4Å; L210-V223 HydrophobicContact CD1-CG2 3.98Å
211	I	96.8	Very high	96.2	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.194	C	C	.	.			trans	-109.4	11.2	-176.6	57.9	164.2	0	0	0	112.8	I97 T101 L142 L145 A209 A213 L214 S215 E222 L224	I97-I211 HydrophobicContact CD1-CG2 3.93Å; I97-I211 HydrophobicContact CG1-CG2 4.47Å; I97-I211 HydrophobicContact CG2-CB 3.96Å; I97-I211 HydrophobicContact CG2-CD1 3.9Å; I97-I211 HydrophobicContact CG2-CG2 4.28Å; T101-I211 HydrophobicContact CG2-CD1 3.55Å; L142-I211 HydrophobicContact CD2-CG2 4.05Å; L145-I211 HydrophobicContact CD1-CG2 4.1Å; A209-I211 PolarHBondContact O-N 2.78Å; I211-A213 VanDerWaalsContact C-N 3.3Å; I211-A213 PolarHBondContact O-N 3.37Å; I211-A213 VanDerWaalsContact O-N 3.16Å; I211-L214 CarbonylContact O-C 3.47Å; I211-L214 WeakPolarHBondContact O-CA 3.36Å; I211-L214 PolarHBondContact O-N 2.78Å; I211-S215 PolarHBondContact O-N 2.88Å; I211-E222 HydrophobicContact CD1-CB 4.35Å; I211-E222 HydrophobicContact CD1-CG 4.01Å; I211-E222 HydrophobicContact CG1-CB 4.03Å; I211-E222 HydrophobicContact CG1-CG 4.09Å; I211-E222 VanDerWaalsContact CG1-O 3.31Å; I211-E222 WeakPolarHBondContact CG1-O 3.23Å; I211-E222 PolarHBondContact N-O 3.36Å; I211-L224 HydrophobicContact CD1-CB 3.69Å; I211-L224 HydrophobicContact CD1-CD2 4.11Å; I211-L224 HydrophobicContact CD1-CG 4.48Å; I211-L224 HydrophobicContact CG1-CB 4.17Å; I211-L224 HydrophobicContact CG2-CB 4.41Å
212	Q	95.7	Very high	96.2	Very high	65 Å²	65	36.6 Å²	36.6	30%	0.304	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-47.3	-47.1	-177.1	-178.5	174.9	21.6	0	0	113.8	L210 L214 S215 P218	L210-Q212 HydrophobicContact CD1-CB 3.84Å; L210-Q212 HydrophobicContact CG-CB 4.21Å; Q212-L214 PolarHBondContact O-N 2.67Å; Q212-S215 PolarHBondContact O-N 3.43Å; Q212-P218 HydrophobicContact CG-CB 4.15Å; Q212-P218 VanDerWaalsContact CG-O 3.27Å; Q212-P218 WeakPolarHBondContact CG-O 3.45Å; Q212-P218 PolarHBondContact NE2-O 2.98Å
213	A	94.9	Very high	96.2	Very high	68 Å²	68	35.2 Å²	35.2	56%	0.562	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-68.4	-18	-177.9	0	0	0	0	0	113.7	L83 I211	L83-A213 HydrophobicContact CD2-CB 3.98Å; L83-A213 WeakPolarHBondContact CD2-O 3.29Å; I211-A213 VanDerWaalsContact C-N 3.3Å; I211-A213 PolarHBondContact O-N 3.37Å; I211-A213 VanDerWaalsContact O-N 3.16Å
214	L	96.2	Very high	96.2	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.021	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-106.5	-11.6	-177.3	-68	164.8	0	0	0	112.6	W76 L83 L85 F89 I97 M98 L145 I211 Q212	W76-L214 HydrophobicContact CH2-CD2 4.32Å; W76-L214 HydrophobicContact CZ3-CD2 3.56Å; L83-L214 HydrophobicContact CD1-CD2 3.58Å; L85-L214 HydrophobicContact CD2-CD2 4.38Å; F89-L214 HydrophobicContact CZ-CD1 3.93Å; I97-L214 HydrophobicContact CB-CB 4.32Å; I97-L214 HydrophobicContact CD1-CD1 3.69Å; I97-L214 HydrophobicContact CG2-CB 3.65Å; M98-L214 WeakPolarHBondContact CG-O 3.28Å; L145-L214 HydrophobicContact CD1-CD1 3.55Å; L145-L214 HydrophobicContact CD2-CD1 4.11Å; L145-L214 HydrophobicContact CG-CD1 4.46Å; I211-L214 CarbonylContact O-C 3.47Å; I211-L214 WeakPolarHBondContact O-CA 3.36Å; I211-L214 PolarHBondContact O-N 2.78Å; Q212-L214 PolarHBondContact O-N 2.67Å
215	S	96.2	Very high	96.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-71.5	151.2	-177.5	-177.9	0	0	0	0	112.2	R79 T101 I211 Q212 F217	R79-S215 PolarHBondContact NH1-O 2.86Å; R79-S215 VanDerWaalsContact NH1-O 3.14Å; T101-S215 WeakPolarHBondContact CB-OG 3.48Å; T101-S215 WeakPolarHBondContact OG1-CA 3.36Å; I211-S215 PolarHBondContact O-N 2.88Å; Q212-S215 PolarHBondContact O-N 3.43Å; S215-F217 PolarHBondContact OG-N 3.24Å; S215-F217 PolarHBondContact OG-O 3.37Å
216	V	96.1	Very high	96.4	Very high	46 Å²	46	32.3 Å²	32.3	28%	0.279	17%	0.174	S	C	.	.	S	Bend	trans	-66.3	-28.9	165.7	177.6	0	0	0	0	111.1	M98 T101 N102 P218	M98-V216 HydrophobicContact CB-CG2 4.45Å; M98-V216 WeakPolarHBondContact O-CG2 3.48Å; T101-V216 PolarHBondContact OG1-N 2.98Å; N102-V216 HydrophobicContact CB-CG2 4.07Å; V216-P218 WeakPolarHBondContact O-CD 3.1Å
217	F	96.4	Very high	96.6	Very high	45 Å²	45	32 Å²	32	20%	0.197	17%	0.172	C	C	.	.			trans	-121.5	76.5	179.9	-56.3	-77.9	0	0	0	111.2	T101 S103 S215 E219 E220	T101-F217 WeakPolarHBondContact O-CD2 3.21Å; S103-F217 WeakPolarHBondContact OG-CE2 3.38Å; S215-F217 PolarHBondContact OG-N 3.24Å; S215-F217 PolarHBondContact OG-O 3.37Å; F217-E219 VanDerWaalsContact C-OE2 3.22Å; F217-E219 WeakPolarHBondContact CA-OE2 3.35Å; F217-E219 WeakPolarHBondContact CD1-OE1 3.33Å; F217-E219 PolarHBondContact O-N 3.34Å; F217-E219 VanDerWaalsContact O-N 3.15Å; F217-E220 HydrophobicContact CB-CB 4.5Å; F217-E220 HydrophobicContact CB-CG 3.8Å; F217-E220 WeakPolarHBondContact O-CB 3.2Å; F217-E220 PolarHBondContact O-N 2.71Å
218	P	96.1	Very high	96.7	Very high	51 Å²	51	32.1 Å²	32.1	33%	0.331	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-59.4	-24.4	-178.8	-24.3	35.1	0	0	0	114.5	Q212 V216 E220 R221	Q212-P218 HydrophobicContact CG-CB 4.15Å; Q212-P218 VanDerWaalsContact CG-O 3.27Å; Q212-P218 WeakPolarHBondContact CG-O 3.45Å; Q212-P218 PolarHBondContact NE2-O 2.98Å; V216-P218 WeakPolarHBondContact O-CD 3.1Å; P218-E220 PolarHBondContact O-N 3.03Å; P218-R221 PolarHBondContact O-N 3.45Å
219	E	97	Very high	96.7	Very high	121 Å²	121	31.4 Å²	31.4	57%	0.565	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-65	-22.6	175.5	68.5	-79.8	-168.7	0	0	113.1	F217 R221	F217-E219 VanDerWaalsContact C-OE2 3.22Å; F217-E219 WeakPolarHBondContact CA-OE2 3.35Å; F217-E219 WeakPolarHBondContact CD1-OE1 3.33Å; F217-E219 PolarHBondContact O-N 3.34Å; F217-E219 VanDerWaalsContact O-N 3.15Å; E219-R221 PolarHBondContact O-N 3.22Å
220	E	97.6	Very high	96.8	Very high	35 Å²	35	31.8 Å²	31.8	16%	0.164	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-72.2	-12.8	176.8	-66.2	-177.1	168	0	0	112.4	S186 V191 F195 F217 P218 E222	S186-E220 VanDerWaalsContact CB-O 3.31Å; S186-E220 WeakPolarHBondContact CB-O 3.44Å; S186-E220 PolarHBondContact OG-O 3.19Å; V191-E220 HydrophobicContact CG1-CB 4.09Å; V191-E220 HydrophobicContact CG1-CG 4.26Å; F195-E220 WeakPolarHBondContact CZ-OE1 3.25Å; F217-E220 HydrophobicContact CB-CB 4.5Å; F217-E220 HydrophobicContact CB-CG 3.8Å; F217-E220 WeakPolarHBondContact O-CB 3.2Å; F217-E220 PolarHBondContact O-N 2.71Å; P218-E220 PolarHBondContact O-N 3.03Å; E220-E222 PolarHBondContact O-N 3.11Å
221	R	97.5	Very high	96.9	Very high	99 Å²	99	27.3 Å²	27.3	37%	0.374	14%	0.144	S	C	.	.			trans	48.2	45.4	-180	-57.9	-178.5	65.4	-163.5	-3.3	111.7	L187 P218 E219 V223	L187-R221 HydrophobicContact CB-CB 4.14Å; L187-R221 PolarHBondContact N-O 3.33Å; P218-R221 PolarHBondContact O-N 3.45Å; E219-R221 PolarHBondContact O-N 3.22Å; R221-V223 PolarHBondContact O-N 3.07Å
222	E	98.2	Very high	97	Very high	7 Å²	7	29.9 Å²	29.9	3%	0.033	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.2	-167.5	-171.1	-179.5	178	0	0	112.2	T101 S184 S185 I211 E220	T101-E222 WeakPolarHBondContact CG2-OE2 3.17Å; S184-E222 WeakPolarHBondContact CB-OE1 3.25Å; S184-E222 PolarHBondContact OG-OE1 3.43Å; S185-E222 CarbonylContact O-C 3.57Å; S185-E222 VanDerWaalsContact O-CA 3.29Å; S185-E222 WeakPolarHBondContact O-CA 3.38Å; I211-E222 HydrophobicContact CD1-CB 4.35Å; I211-E222 HydrophobicContact CD1-CG 4.01Å; I211-E222 HydrophobicContact CG1-CB 4.03Å; I211-E222 HydrophobicContact CG1-CG 4.09Å; I211-E222 VanDerWaalsContact CG1-O 3.31Å; I211-E222 WeakPolarHBondContact CG1-O 3.23Å; I211-E222 PolarHBondContact N-O 3.36Å; E220-E222 PolarHBondContact O-N 3.11Å
223	V	97.8	Very high	97.1	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.012	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.2	164.2	175.5	0	0	0	0	107.5	V159 S185 L187 T205 A209 L210 R221	V159-V223 HydrophobicContact CG1-CB 3.73Å; V159-V223 HydrophobicContact CG1-CG1 3.99Å; V159-V223 HydrophobicContact CG1-CG2 3.77Å; S185-V223 PolarHBondContact N-O 3.24Å; S185-V223 PolarHBondContact O-N 3.37Å; S185-V223 PolarHBondContact OG-O 3.27Å; L187-V223 HydrophobicContact CD1-CG2 4.49Å; L187-V223 HydrophobicContact CD2-CG2 3.97Å; L187-V223 HydrophobicContact CG-CG2 3.9Å; T205-V223 HydrophobicContact CG2-CG1 4.2Å; A209-V223 WeakPolarHBondContact O-CA 3.38Å; L210-V223 HydrophobicContact CB-CG2 4.4Å; L210-V223 HydrophobicContact CD1-CG2 3.98Å; R221-V223 PolarHBondContact O-N 3.07Å
224	L	98.4	Very high	97.3	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.1	-178.2	-174.5	57	0	0	0	110.7	Y100 L138 L142 F182 G208 A209 I211	Y100-L224 HydrophobicContact CD1-CD1 4.2Å; Y100-L224 HydrophobicContact CD1-CD2 3.59Å; Y100-L224 HydrophobicContact CE1-CD1 3.34Å; Y100-L224 HydrophobicContact CE1-CD2 3.61Å; Y100-L224 HydrophobicContact CE1-CG 4.13Å; Y100-L224 HydrophobicContact CG-CD2 4.21Å; L138-L224 HydrophobicContact CD1-CD2 3.86Å; L138-L224 HydrophobicContact CD2-CD2 4.28Å; L138-L224 HydrophobicContact CG-CD2 4.26Å; L142-L224 HydrophobicContact CD1-CD2 4.14Å; L142-L224 HydrophobicContact CD1-CG 3.96Å; L142-L224 HydrophobicContact CD2-CB 3.85Å; L142-L224 HydrophobicContact CD2-CD2 4.04Å; L142-L224 HydrophobicContact CD2-CG 4.06Å; F182-L224 HydrophobicContact CB-CD1 4.06Å; G208-L224 VanDerWaalsContact CA-O 3.3Å; G208-L224 WeakPolarHBondContact CA-O 3.24Å; A209-L224 PolarHBondContact N-O 3.35Å; A209-L224 PolarHBondContact O-N 2.88Å; I211-L224 HydrophobicContact CD1-CB 3.69Å; I211-L224 HydrophobicContact CD1-CD2 4.11Å; I211-L224 HydrophobicContact CD1-CG 4.48Å; I211-L224 HydrophobicContact CG1-CB 4.17Å; I211-L224 HydrophobicContact CG2-CB 4.41Å
225	I	98.3	Very high	97.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130	-176.9	-61	170.9	0	0	0	110	V159 L179 F182 T183 L203 T205 E229 F231	V159-I225 HydrophobicContact CG2-CD1 4.15Å; L179-I225 HydrophobicContact CD1-CD1 4.36Å; L179-I225 HydrophobicContact CD1-CG2 4.12Å; F182-I225 WeakPolarHBondContact CA-O 3.27Å; T183-I225 PolarHBondContact N-O 3.23Å; T183-I225 PolarHBondContact O-N 3.38Å; L203-I225 HydrophobicContact CD2-CD1 4.2Å; T205-I225 HydrophobicContact CG2-CD1 4.23Å; T205-I225 HydrophobicContact CG2-CG1 4.22Å; I225-E229 HydrophobicContact CG2-CB 4.29Å; I225-E229 WeakPolarHBondContact CG2-OE2 3.36Å; I225-F231 HydrophobicContact CD1-CZ 4.36Å; I225-F231 HydrophobicContact CG2-CE2 4.19Å; I225-F231 HydrophobicContact CG2-CZ 3.95Å
226	P	97.4	Very high	97.4	Very high	7 Å²	7	29.7 Å²	29.7	5%	0.045	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-72.5	155.9	178.3	30.5	-35.5	0	0	0	112.7	L142 F207 H228 E229	L142-P226 HydrophobicContact CD1-CB 4.24Å; F207-P226 HydrophobicContact CB-CG 3.83Å; F207-P226 VanDerWaalsContact O-CD 3.32Å; F207-P226 WeakPolarHBondContact O-CD 3.47Å; P226-H228 PolarHBondContact O-N 2.87Å; P226-H228 VanDerWaalsContact O-N 3.13Å; P226-E229 PolarHBondContact O-N 3.1Å
227	P	97.4	Very high	97.4	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.6	-174.2	25.5	-35.3	0	0	0	115.2	T35 V115 R178 Q181	T35-P227 HydrophobicContact CG2-CB 3.95Å; V115-P227 HydrophobicContact CG1-CB 4.19Å; V115-P227 HydrophobicContact CG1-CG 4.5Å; R178-P227 PolarHBondContact NE-O 2.91Å; R178-P227 PolarHBondContact NH2-O 2.86Å; Q181-P227 WeakPolarHBondContact O-CA 3.35Å
228	H	95.8	Very high	97.3	Very high	11 Å²	11	35.4 Å²	35.4	5%	0.051	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	0	-173.9	50.6	-110.4	0	0	0	114.4	D37 P226 T253 C254 S255	D37-H228 HydrophobicContact CB-CB 4.34Å; P226-H228 PolarHBondContact O-N 2.87Å; P226-H228 VanDerWaalsContact O-N 3.13Å; H228-T253 CarbonylContact O-C 3.56Å; H228-T253 WeakPolarHBondContact O-CA 3.02Å; H228-T253 WeakPolarHBondContact O-CB 3.41Å; H228-C254 WeakPolarHBondContact CB-O 3.47Å; H228-C254 PolarHBondContact O-N 2.86Å; H228-S255 WeakPolarHBondContact CB-OG 3.46Å
229	E	96.9	Very high	96.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	134.2	173.4	-175.9	169.6	-162.6	0	0	111.3	T205 C206 F207 I225 P226 F231 S249	T205-E229 VanDerWaalsContact OG1-CD 3.32Å; T205-E229 PolarHBondContact OG1-OE1 3.5Å; T205-E229 PolarHBondContact OG1-OE2 3.08Å; C206-E229 PolarHBondContact N-OE1 2.97Å; F207-E229 HydrophobicContact CB-CB 4.21Å; F207-E229 HydrophobicContact CB-CG 4.25Å; F207-E229 HydrophobicContact CD2-CB 4.29Å; F207-E229 HydrophobicContact CD2-CG 3.68Å; F207-E229 WeakPolarHBondContact CD2-OE1 3.48Å; F207-E229 HydrophobicContact CE2-CG 4.47Å; F207-E229 HydrophobicContact CG-CB 4.48Å; F207-E229 HydrophobicContact CG-CG 4.31Å; F207-E229 PolarHBondContact N-OE1 3.26Å; I225-E229 HydrophobicContact CG2-CB 4.29Å; I225-E229 WeakPolarHBondContact CG2-OE2 3.36Å; P226-E229 PolarHBondContact O-N 3.1Å; E229-F231 HydrophobicContact CB-CE2 3.86Å; E229-F231 HydrophobicContact CB-CZ 4.16Å; E229-F231 HydrophobicContact CG-CD2 4.28Å; E229-F231 HydrophobicContact CG-CE1 4.23Å; E229-F231 HydrophobicContact CG-CE2 3.62Å; E229-F231 HydrophobicContact CG-CZ 3.6Å; E229-F231 VanDerWaalsContact OE2-CZ 3.27Å; E229-F231 WeakPolarHBondContact OE2-CZ 3.38Å; E229-S249 WeakPolarHBondContact OE1-CB 3.46Å; E229-S249 PolarHBondContact OE1-OG 2.9Å
230	V	97.1	Very high	96.5	Very high	10 Å²	10	34.7 Å²	34.7	6%	0.061	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.6	178.9	-180	0	0	0	0	110.1	F176 R178 S250 Q252 C254	F176-V230 HydrophobicContact CB-CG1 4Å; F176-V230 HydrophobicContact CD1-CG1 3.87Å; F176-V230 HydrophobicContact CG-CG1 4.28Å; R178-V230 HydrophobicContact CG-CG2 3.96Å; V230-S250 WeakPolarHBondContact CB-OG 3.37Å; V230-S250 WeakPolarHBondContact O-CB 3.34Å; V230-S250 PolarHBondContact O-N 3.3Å; V230-S250 PolarHBondContact O-OG 3.42Å; V230-Q252 PolarHBondContact N-O 3.08Å; V230-Q252 VanDerWaalsContact N-O 3.08Å; V230-C254 HydrophobicContact CG2-CB 3.32Å
231	F	97.8	Very high	96.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.5	179.7	-63.2	-90.3	0	0	0	111.6	F176 V177 L179 L203 I225 E229 L247 W248	F176-F231 CarbonylContact C-O 3.56Å; F176-F231 VanDerWaalsContact CA-O 3.28Å; F176-F231 WeakPolarHBondContact CA-O 3.35Å; V177-F231 HydrophobicContact CG2-CB 4.11Å; V177-F231 PolarHBondContact N-O 2.97Å; V177-F231 PolarHBondContact O-N 2.95Å; L179-F231 HydrophobicContact CD1-CD2 4.43Å; L179-F231 HydrophobicContact CD1-CE2 3.75Å; L179-F231 HydrophobicContact CD1-CZ 4.24Å; L179-F231 HydrophobicContact CG-CD2 4.38Å; L179-F231 HydrophobicContact CG-CE2 4.12Å; L203-F231 HydrophobicContact CD2-CE1 4.39Å; L203-F231 HydrophobicContact CD2-CZ 4.42Å; I225-F231 HydrophobicContact CD1-CZ 4.36Å; I225-F231 HydrophobicContact CG2-CE2 4.19Å; I225-F231 HydrophobicContact CG2-CZ 3.95Å; E229-F231 HydrophobicContact CB-CE2 3.86Å; E229-F231 HydrophobicContact CB-CZ 4.16Å; E229-F231 HydrophobicContact CG-CD2 4.28Å; E229-F231 HydrophobicContact CG-CE1 4.23Å; E229-F231 HydrophobicContact CG-CE2 3.62Å; E229-F231 HydrophobicContact CG-CZ 3.6Å; E229-F231 VanDerWaalsContact OE2-CZ 3.27Å; E229-F231 WeakPolarHBondContact OE2-CZ 3.38Å; F231-L247 HydrophobicContact CB-CB 3.99Å; F231-L247 HydrophobicContact CB-CD1 4.39Å; F231-L247 HydrophobicContact CD1-CB 3.99Å; F231-L247 HydrophobicContact CG-CB 4.17Å; F231-L247 HydrophobicContact CG-CD1 4.49Å; F231-W248 CarbonylContact C-O 3.37Å; F231-W248 WeakPolarHBondContact CA-O 3.42Å
232	L	97.8	Very high	96	Very high	55 Å²	55	33.3 Å²	33.3	29%	0.288	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	131.1	163.9	-176.3	68.2	0	0	0	109.4	G174 F176 T234 L247 W248	G174-L232 WeakPolarHBondContact O-CD1 3.37Å; F176-L232 HydrophobicContact CD1-CB 4.43Å; F176-L232 HydrophobicContact CD1-CD1 4.26Å; F176-L232 HydrophobicContact CE1-CB 4.26Å; F176-L232 HydrophobicContact CE1-CD1 3.95Å; F176-L232 HydrophobicContact CZ-CD1 4.19Å; L232-T234 HydrophobicContact CB-CG2 4.49Å; L232-T234 HydrophobicContact CD2-CG2 3.99Å; L232-T234 HydrophobicContact CG-CG2 4.14Å; L232-T234 PolarHBondContact O-N 3.2Å; L232-L247 WeakPolarHBondContact O-CA 3.33Å; L232-W248 PolarHBondContact N-O 3.14Å; L232-W248 PolarHBondContact O-N 3.07Å
233	V	98.5	Very high	95.9	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	108.4	170.9	-177.9	0	0	0	0	109.2	P170 L173 G174 D175 V177 L247	P170-V233 HydrophobicContact CB-CB 4.33Å; P170-V233 HydrophobicContact CB-CG1 3.65Å; P170-V233 HydrophobicContact CB-CG2 3.95Å; P170-V233 HydrophobicContact CG-CG1 3.81Å; L173-V233 HydrophobicContact CD2-CG1 3.92Å; G174-V233 PolarHBondContact N-O 3.32Å; D175-V233 WeakPolarHBondContact O-CG2 3.49Å; D175-V233 PolarHBondContact O-N 3.48Å; V177-V233 HydrophobicContact CB-CG2 4.49Å; V177-V233 HydrophobicContact CG1-CG2 3.7Å; V177-V233 HydrophobicContact CG2-CG2 3.92Å; V233-L247 HydrophobicContact CB-CD2 4.27Å; V233-L247 HydrophobicContact CG2-CD2 3.77Å
234	T	98	Very high	95.9	Very high	51 Å²	51	36.1 Å²	36.1	31%	0.313	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-20	-178.4	55.1	0	0	0	0	113.3	L232 T246 W248	L232-T234 HydrophobicContact CB-CG2 4.49Å; L232-T234 HydrophobicContact CD2-CG2 3.99Å; L232-T234 HydrophobicContact CG-CG2 4.14Å; L232-T234 PolarHBondContact O-N 3.2Å; T234-T246 PolarHBondContact N-O 3.14Å; T234-T246 WeakPolarHBondContact OG1-CG2 3.35Å; T234-T246 PolarHBondContact OG1-O 3.38Å; T234-W248 HydrophobicContact CG2-CB 3.87Å; T234-W248 HydrophobicContact CG2-CD2 3.8Å; T234-W248 HydrophobicContact CG2-CE3 4.17Å; T234-W248 HydrophobicContact CG2-CG 3.66Å
235	G	97.9	Very high	95.9	Very high	17 Å²	17	36.1 Å²	36.1	18%	0.175	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	146	179.9	0	0	0	0	0	112.8	T246	G235-T246 PolarHBondContact N-O 3.15Å; G235-T246 PolarHBondContact O-N 3Å
236	F	97.9	Very high	95.9	Very high	64 Å²	64	38 Å²	38	28%	0.281	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	127.9	171.1	177.5	-111.1	0	0	0	109.3	E169 P170 L173 Q238 R243 I244 V245	E169-F236 HydrophobicContact CB-CE2 4.33Å; E169-F236 HydrophobicContact CB-CZ 4.13Å; E169-F236 HydrophobicContact CG-CE2 4.07Å; E169-F236 HydrophobicContact CG-CZ 3.77Å; P170-F236 HydrophobicContact CG-CB 3.72Å; P170-F236 HydrophobicContact CG-CD1 4.36Å; P170-F236 HydrophobicContact CG-CD2 3.88Å; P170-F236 HydrophobicContact CG-CG 3.72Å; L173-F236 HydrophobicContact CD2-CB 3.97Å; F236-Q238 HydrophobicContact CE1-CG 3.89Å; F236-Q238 HydrophobicContact CZ-CG 3.85Å; F236-R243 HydrophobicContact CE2-CB 4.26Å; F236-I244 WeakPolarHBondContact CA-O 3.43Å; F236-V245 HydrophobicContact CD2-CG2 4.13Å; F236-V245 HydrophobicContact CE2-CG2 4.46Å
237	F	95.2	Very high	96	Very high	122 Å²	122	37.7 Å²	37.7	54%	0.535	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	145.5	178.1	-179.4	-104.9	0	0	0	110.5	D239 I244	F237-D239 HydrophobicContact CD1-CB 4.03Å; F237-D239 HydrophobicContact CE1-CB 3.64Å; F237-I244 HydrophobicContact CB-CB 4.41Å; F237-I244 HydrophobicContact CD1-CD1 4.24Å; F237-I244 PolarHBondContact N-O 3.29Å; F237-I244 PolarHBondContact O-N 3.19Å
238	Q	94.4	Very high	95.9	Very high	89 Å²	89	44 Å²	44	42%	0.416	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.2	174.2	-59.9	-168	-4.9	0	0	108.5	F236 R243	F236-Q238 HydrophobicContact CE1-CG 3.89Å; F236-Q238 HydrophobicContact CZ-CG 3.85Å; Q238-R243 VanDerWaalsContact CD-CZ 3.45Å
239	D	88.1	Confident	95.9	Very high	94 Å²	94	44.4 Å²	44.4	50%	0.503	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	87.6	175.6	-167.9	8.8	0	0	0	109.2	F237 A241 Q242 I244	F237-D239 HydrophobicContact CD1-CB 4.03Å; F237-D239 HydrophobicContact CE1-CB 3.64Å; D239-A241 PolarHBondContact O-N 3.1Å; D239-A241 VanDerWaalsContact O-N 3.07Å; D239-Q242 HydrophobicContact CB-CB 4.45Å; D239-Q242 PolarHBondContact N-O 3.14Å; D239-Q242 WeakPolarHBondContact O-CB 3.25Å; D239-Q242 PolarHBondContact O-N 3.2Å; D239-I244 HydrophobicContact CB-CD1 4.4Å
240	G	88.9	Confident	95.7	Very high	63 Å²	63	45.8 Å²	45.8	65%	0.649	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	-114.6	-169.8	0	0	0	0	0	111.8	R243	G240-R243 PolarHBondContact O-NH1 3.26Å
241	A	89.1	Confident	95.5	Very high	77 Å²	77	47.3 Å²	47.3	64%	0.636	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-20.2	177.3	0	0	0	0	0	113.3	H167 D239 R243	H167-A241 PolarHBondContact CE1-O 3.34Å; H167-A241 PolarHBondContact NE2-O 2.84Å; D239-A241 PolarHBondContact O-N 3.1Å; D239-A241 VanDerWaalsContact O-N 3.07Å; A241-R243 PolarHBondContact O-NH1 2.87Å
242	Q	94.8	Very high	95.2	Very high	27 Å²	27	50.9 Å²	50.9	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	146.5	-178.6	172.2	164.8	80	0	0	111.5	N197 D239 I244	N197-Q242 WeakPolarHBondContact O-CB 3.29Å; N197-Q242 WeakPolarHBondContact O-CG 3.5Å; N197-Q242 PolarHBondContact O-NE2 3.1Å; D239-Q242 HydrophobicContact CB-CB 4.45Å; D239-Q242 PolarHBondContact N-O 3.14Å; D239-Q242 WeakPolarHBondContact O-CB 3.25Å; D239-Q242 PolarHBondContact O-N 3.2Å; Q242-I244 HydrophobicContact CG-CG1 4.07Å
243	R	97.2	Very high	95	Very high	28 Å²	28	48.8 Å²	48.8	11%	0.106	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.3	168.1	-57.4	-56.5	176.2	-112.6	8.4	110	H167 E169 A198 T199 F200 F236 Q238 G240 A241	H167-R243 HydrophobicContact CB-CG 3.92Å; E169-R243 IonicContact OE1-CZ 3.55Å; E169-R243 IonicContact OE1-NE 3.82Å; E169-R243 PolarHBondContact OE1-NE 3.01Å; E169-R243 IonicContact OE1-NH2 3.19Å; A198-R243 PolarHBondContact O-N 3.35Å; T199-R243 CarbonylContact C-O 3.57Å; T199-R243 VanDerWaalsContact CA-O 3.26Å; T199-R243 WeakPolarHBondContact CA-O 3.11Å; T199-R243 HydrophobicContact CG2-CB 4.3Å; F200-R243 PolarHBondContact N-O 3.31Å; F236-R243 HydrophobicContact CE2-CB 4.26Å; Q238-R243 VanDerWaalsContact CD-CZ 3.45Å; G240-R243 PolarHBondContact O-NH1 3.26Å; A241-R243 PolarHBondContact O-NH1 2.87Å
244	I	97.8	Very high	94.8	Very high	41 Å²	41	49 Å²	49	21%	0.21	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.6	175.6	-55.6	-178.5	0	0	0	107.8	F200 F236 F237 D239 Q242	F200-I244 WeakPolarHBondContact O-CA 3.49Å; F236-I244 WeakPolarHBondContact CA-O 3.43Å; F237-I244 HydrophobicContact CB-CB 4.41Å; F237-I244 HydrophobicContact CD1-CD1 4.24Å; F237-I244 PolarHBondContact N-O 3.29Å; F237-I244 PolarHBondContact O-N 3.19Å; D239-I244 HydrophobicContact CB-CD1 4.4Å; Q242-I244 HydrophobicContact CG-CG1 4.07Å
245	V	98.3	Very high	94.7	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.3	-178.2	-170.1	0	0	0	0	109.2	L29 T199 F200 F201 S202 F236 L247	L29-V245 HydrophobicContact CD1-CG1 3.86Å; T199-V245 HydrophobicContact CG2-CG2 3.91Å; F200-V245 PolarHBondContact O-N 3.38Å; F201-V245 WeakPolarHBondContact CA-O 3.39Å; F201-V245 HydrophobicContact CD1-CB 3.67Å; F201-V245 HydrophobicContact CD1-CG1 4.02Å; F201-V245 HydrophobicContact CD1-CG2 4.27Å; F201-V245 HydrophobicContact CE1-CB 3.82Å; F201-V245 HydrophobicContact CE1-CG1 3.97Å; F201-V245 HydrophobicContact CE1-CG2 4.01Å; F201-V245 HydrophobicContact CG-CB 4.49Å; S202-V245 PolarHBondContact N-O 2.9Å; F236-V245 HydrophobicContact CD2-CG2 4.13Å; F236-V245 HydrophobicContact CE2-CG2 4.46Å; V245-L247 HydrophobicContact CG1-CD2 3.78Å; V245-L247 HydrophobicContact CG1-CG 3.99Å
246	T	98.4	Very high	94.6	Very high	39 Å²	39	47 Å²	47	24%	0.239	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.1	174	-48.1	0	0	0	0	109.9	S202 T234 G235	S202-T246 WeakPolarHBondContact O-CA 3.44Å; T234-T246 PolarHBondContact N-O 3.14Å; T234-T246 WeakPolarHBondContact OG1-CG2 3.35Å; T234-T246 PolarHBondContact OG1-O 3.38Å; G235-T246 PolarHBondContact N-O 3.15Å; G235-T246 PolarHBondContact O-N 3Å
247	L	98.3	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.7	-175.7	-63.5	-174.4	0	0	0	110.3	V177 L179 F201 S202 L203 R204 F231 L232 V233 V245	V177-L247 HydrophobicContact CG2-CD1 4.31Å; V177-L247 HydrophobicContact CG2-CD2 3.84Å; L179-L247 HydrophobicContact CD2-CD1 4.15Å; F201-L247 HydrophobicContact CD1-CD1 3.87Å; F201-L247 HydrophobicContact CD1-CG 4.33Å; F201-L247 HydrophobicContact CE1-CD1 4.04Å; S202-L247 PolarHBondContact O-N 3.07Å; L203-L247 CarbonylContact C-O 3.5Å; L203-L247 WeakPolarHBondContact CA-O 3.37Å; L203-L247 HydrophobicContact CD2-CB 4.35Å; L203-L247 HydrophobicContact CD2-CD1 3.99Å; L203-L247 HydrophobicContact CG-CB 4.43Å; R204-L247 PolarHBondContact N-O 3.14Å; F231-L247 HydrophobicContact CB-CB 3.99Å; F231-L247 HydrophobicContact CB-CD1 4.39Å; F231-L247 HydrophobicContact CD1-CB 3.99Å; F231-L247 HydrophobicContact CG-CB 4.17Å; F231-L247 HydrophobicContact CG-CD1 4.49Å; L232-L247 WeakPolarHBondContact O-CA 3.33Å; V233-L247 HydrophobicContact CB-CD2 4.27Å; V233-L247 HydrophobicContact CG2-CD2 3.77Å; V245-L247 HydrophobicContact CG1-CD2 3.78Å; V245-L247 HydrophobicContact CG1-CG 3.99Å
248	W	96.6	Very high	94.7	Very high	133 Å²	133	40.3 Å²	40.3	50%	0.504	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.5	174.8	-72.4	12.4	0	0	0	110.1	R204 F231 L232 T234 S250	R204-W248 HydrophobicContact CB-CG 4.38Å; F231-W248 CarbonylContact C-O 3.37Å; F231-W248 WeakPolarHBondContact CA-O 3.42Å; L232-W248 PolarHBondContact N-O 3.14Å; L232-W248 PolarHBondContact O-N 3.07Å; T234-W248 HydrophobicContact CG2-CB 3.87Å; T234-W248 HydrophobicContact CG2-CD2 3.8Å; T234-W248 HydrophobicContact CG2-CE3 4.17Å; T234-W248 HydrophobicContact CG2-CG 3.66Å; W248-S250 PolarHBondContact O-N 3.48Å
249	S	95.4	Very high	94.9	Very high	21 Å²	21	36.8 Å²	36.8	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	136.1	175.6	-175	0	0	0	0	110.4	R204 C206 E229 N251	R204-S249 WeakPolarHBondContact O-CB 3.27Å; R204-S249 PolarHBondContact O-N 3.42Å; C206-S249 WeakPolarHBondContact SG-CB 3.42Å; C206-S249 PolarHBondContact SG-OG 2.87Å; E229-S249 WeakPolarHBondContact OE1-CB 3.46Å; E229-S249 PolarHBondContact OE1-OG 2.9Å; S249-N251 PolarHBondContact O-N 3.19Å; S249-N251 PolarHBondContact OG-N 3.14Å
250	S	93.2	Very high	95.3	Very high	30 Å²	30	32.3 Å²	32.3	21%	0.21	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	4.5	173.4	61.7	0	0	0	0	112.8	V230 W248 Q252	V230-S250 WeakPolarHBondContact CB-OG 3.37Å; V230-S250 WeakPolarHBondContact O-CB 3.34Å; V230-S250 PolarHBondContact O-N 3.3Å; V230-S250 PolarHBondContact O-OG 3.42Å; W248-S250 PolarHBondContact O-N 3.48Å; S250-Q252 PolarHBondContact O-N 3.49Å
251	N	91.4	Very high	95.8	Very high	41 Å²	41	32.3 Å²	32.3	22%	0.219	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.8	28	-170.8	-166.3	28.5	0	0	0	112.9	C151 S249 T275	C151-N251 HydrophobicContact CB-CB 4.44Å; S249-N251 PolarHBondContact O-N 3.19Å; S249-N251 PolarHBondContact OG-N 3.14Å; N251-T275 PolarHBondContact ND2-OG1 3.44Å; N251-T275 VanDerWaalsContact ND2-OG1 3.15Å; N251-T275 PolarHBondContact OD1-OG1 3.5Å
252	Q	91.4	Very high	96.2	Very high	76 Å²	76	31 Å²	31	36%	0.355	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	147.8	178.5	-66.7	179.5	-11.2	0	0	110.4	V230 S250 T274	V230-Q252 PolarHBondContact N-O 3.08Å; V230-Q252 VanDerWaalsContact N-O 3.08Å; S250-Q252 PolarHBondContact O-N 3.49Å; Q252-T274 HydrophobicContact CG-CG2 4.15Å
253	T	93.3	Very high	96.4	Very high	11 Å²	11	31.5 Å²	31.5	7%	0.067	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	166.9	163.3	68.3	0	0	0	0	110.7	F207 H228 S272 S273	F207-T253 HydrophobicContact CD1-CG2 3.57Å; F207-T253 HydrophobicContact CD2-CG2 4.43Å; F207-T253 HydrophobicContact CE1-CG2 3.22Å; F207-T253 HydrophobicContact CE2-CG2 4.12Å; F207-T253 HydrophobicContact CG-CG2 4.19Å; F207-T253 HydrophobicContact CZ-CG2 3.53Å; H228-T253 CarbonylContact O-C 3.56Å; H228-T253 WeakPolarHBondContact O-CA 3.02Å; H228-T253 WeakPolarHBondContact O-CB 3.41Å; T253-S272 WeakPolarHBondContact O-CA 3.35Å; T253-S273 PolarHBondContact N-O 2.85Å; T253-S273 VanDerWaalsContact N-O 3.08Å; T253-S273 WeakPolarHBondContact OG1-CB 3.46Å
254	C	94.4	Very high	96.4	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.034	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	107.7	178.1	163.2	0	0	0	0	106.7	R178 H228 V230 C270	R178-C254 PolarHBondContact NH1-O 3.37Å; R178-C254 PolarHBondContact NH2-O 3.11Å; H228-C254 WeakPolarHBondContact CB-O 3.47Å; H228-C254 PolarHBondContact O-N 2.86Å; V230-C254 HydrophobicContact CG2-CB 3.32Å; C254-C270 HydrophobicContact CB-CB 3.93Å; C254-C270 WeakPolarHBondContact CB-SG 3.45Å; C254-C270 WeakPolarHBondContact SG-CB 3.2Å; C254-C270 CovalentContact SG-SG 2.01Å; C254-C270 PolarHBondContact SG-SG 2.91Å
255	S	95.8	Very high	96.4	Very high	10 Å²	10	34.7 Å²	34.7	7%	0.07	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.8	177.4	-67.7	0	0	0	0	111.1	D37 H228 F257 C270 V271	D37-S255 VanDerWaalsContact O-CB 3.31Å; D37-S255 WeakPolarHBondContact O-CB 3.33Å; D37-S255 PolarHBondContact O-OG 2.87Å; D37-S255 WeakPolarHBondContact OD2-CA 3.28Å; H228-S255 WeakPolarHBondContact CB-OG 3.46Å; S255-F257 WeakPolarHBondContact CB-O 3.44Å; S255-C270 WeakPolarHBondContact O-CA 3.4Å; S255-V271 PolarHBondContact N-O 3.43Å; S255-V271 PolarHBondContact O-N 3.24Å
256	H	96.6	Very high	96.3	Very high	16 Å²	16	37.4 Å²	37.4	7%	0.074	20%	0.197	C	C	.	.	S	Bend	trans	-84.7	-26.4	171	-75	-91.4	0	0	0	112.1	D37 K266 R267 C270	D37-H256 VanDerWaalsContact CG-N 3.28Å; D37-H256 PolarHBondContact OD1-N 3.41Å; D37-H256 IonicContact OD2-CD2 3.94Å; D37-H256 PolarHBondContact OD2-N 3.22Å; H256-K266 HydrophobicContact CB-CG 4.23Å; H256-R267 PolarHBondContact ND1-O 3.18Å; H256-R267 PolarHBondContact O-N 3.28Å; H256-C270 PolarHBondContact CE1-N 3.33Å
257	F	97.5	Very high	96.1	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	21%	0.208	C	C	.	.			trans	-105.5	145.7	176.8	-67.4	-89.5	0	0	0	111.6	F36 D37 D38 G119 S255 A260 K266	F36-F257 HydrophobicContact CD2-CB 4.46Å; F36-F257 HydrophobicContact CD2-CD1 4.33Å; F36-F257 AromaticContact CD2-CD2 3.99Å; F36-F257 HydrophobicContact CD2-CD2 3.99Å; F36-F257 HydrophobicContact CD2-CE2 4.29Å; F36-F257 AromaticContact CD2-CG 4Å; F36-F257 HydrophobicContact CD2-CG 4Å; F36-F257 HydrophobicContact CE2-CB 4.15Å; F36-F257 HydrophobicContact CE2-CD1 4.16Å; F36-F257 HydrophobicContact CE2-CD2 4.45Å; F36-F257 AromaticContact CE2-CG 4Å; F36-F257 HydrophobicContact CE2-CG 4Å; D37-F257 PolarHBondContact OD1-N 3.2Å; D38-F257 HydrophobicContact CB-CB 4.06Å; G119-F257 WeakPolarHBondContact O-CE2 3.26Å; G119-F257 VanDerWaalsContact O-CZ 3.29Å; G119-F257 WeakPolarHBondContact O-CZ 3.28Å; S255-F257 WeakPolarHBondContact CB-O 3.44Å; F257-A260 HydrophobicContact CB-CB 4.39Å; F257-A260 HydrophobicContact CD1-CB 3.79Å; F257-A260 HydrophobicContact CG-CB 4.48Å; F257-K266 HydrophobicContact CD1-CB 4.28Å; F257-K266 HydrophobicContact CE1-CB 3.61Å; F257-K266 HydrophobicContact CE1-CG 4.12Å; F257-K266 HydrophobicContact CE2-CB 4.3Å; F257-K266 HydrophobicContact CE2-CD 4.02Å; F257-K266 HydrophobicContact CE2-CG 3.86Å; F257-K266 HydrophobicContact CZ-CB 3.63Å; F257-K266 HydrophobicContact CZ-CD 3.77Å; F257-K266 HydrophobicContact CZ-CG 3.65Å
258	N	97.8	Very high	95.8	Very high	43 Å²	43	50.9 Å²	50.9	23%	0.23	25%	0.252	C	S	.	.	S	Bend	trans	-144.8	121.6	163.9	-170	55.8	0	0	0	108.8	D38 V41 A260 G264	D38-N258 VanDerWaalsContact OD1-CA 3.32Å; D38-N258 WeakPolarHBondContact OD1-CA 3.44Å; V41-N258 WeakPolarHBondContact CB-OD1 3.39Å; V41-N258 PolarHBondContact N-OD1 3.15Å; V41-N258 PolarHBondContact O-ND2 3.17Å; V41-N258 PolarHBondContact O-OD1 2Å; N258-A260 VanDerWaalsContact C-N 3.33Å; N258-A260 PolarHBondContact O-N 2.94Å; N258-G264 WeakPolarHBondContact O-CA 3.32Å
259	C	97.9	Very high	95.5	Very high	15 Å²	15	46.6 Å²	46.6	10%	0.101	25%	0.249	C	C	.	.	S	Bend	trans	58.6	41.8	178.1	-46.3	0	0	0	0	113	D38 C43 Y261 L262 G263 G264	D38-C259 VanDerWaalsContact CG-N 3.26Å; D38-C259 PolarHBondContact OD1-N 2.91Å; D38-C259 WeakPolarHBondContact OD2-CA 3.48Å; D38-C259 PolarHBondContact OD2-N 2.87Å; C43-C259 HydrophobicContact CB-CB 3.79Å; C43-C259 WeakPolarHBondContact CB-SG 3.06Å; C43-C259 VanDerWaalsContact SG-CA 3.59Å; C43-C259 WeakPolarHBondContact SG-CB 3.11Å; C43-C259 CovalentContact SG-SG 2.01Å; C43-C259 PolarHBondContact SG-SG 3.23Å; C259-Y261 VanDerWaalsContact C-N 3.32Å; C259-Y261 PolarHBondContact O-N 3.25Å; C259-L262 HydrophobicContact CB-CB 4.39Å; C259-L262 HydrophobicContact CB-CD1 4.39Å; C259-L262 PolarHBondContact O-N 3.27Å; C259-G263 PolarHBondContact O-N 3.07Å; C259-G264 PolarHBondContact O-N 2.86Å
260	A	98.1	Very high	95.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-59.9	-41.2	-169.3	0	0	0	0	0	113.2	F36 D38 R122 Y125 F257 N258 L262 G263 G264	F36-A260 HydrophobicContact CE2-CB 3.77Å; F36-A260 HydrophobicContact CZ-CB 4.22Å; D38-A260 PolarHBondContact OD2-N 3.3Å; R122-A260 PolarHBondContact NE-O 3.05Å; Y125-A260 HydrophobicContact CD1-CB 3.97Å; Y125-A260 HydrophobicContact CE1-CB 3.84Å; F257-A260 HydrophobicContact CB-CB 4.39Å; F257-A260 HydrophobicContact CD1-CB 3.79Å; F257-A260 HydrophobicContact CG-CB 4.48Å; N258-A260 VanDerWaalsContact C-N 3.33Å; N258-A260 PolarHBondContact O-N 2.94Å; A260-L262 PolarHBondContact O-N 2.84Å; A260-G263 PolarHBondContact O-N 3.25Å; A260-G264 WeakPolarHBondContact CA-O 3.29Å
261	Y	98.3	Very high	95.1	Very high	64 Å²	64	49.3 Å²	49.3	25%	0.251	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-61.3	-35.3	177	-173.5	-103.7	0	0	0	112.3	M47 K50 L54 M126 K132 C259 G263	M47-Y261 HydrophobicContact CE-CD1 4.32Å; M47-Y261 HydrophobicContact CE-CG 4.44Å; M47-Y261 HydrophobicContact SD-CD1 4.09Å; M47-Y261 HydrophobicContact SD-CG 4.41Å; K50-Y261 HydrophobicContact CB-CE1 4.07Å; K50-Y261 HydrophobicContact CG-CE1 4.3Å; L54-Y261 HydrophobicContact CD1-CD1 3.95Å; L54-Y261 HydrophobicContact CD1-CD2 4.22Å; L54-Y261 HydrophobicContact CD1-CE1 3.71Å; L54-Y261 HydrophobicContact CD1-CE2 3.99Å; L54-Y261 HydrophobicContact CD1-CG 4.19Å; L54-Y261 HydrophobicContact CD2-CE1 4.38Å; L54-Y261 HydrophobicContact CD2-CE2 3.67Å; L54-Y261 WeakPolarHBondContact CD2-OH 3.49Å; L54-Y261 HydrophobicContact CG-CE1 4.25Å; L54-Y261 HydrophobicContact CG-CE2 4.33Å; M126-Y261 HydrophobicContact CE-CD2 3.93Å; M126-Y261 HydrophobicContact CE-CE2 3.93Å; M126-Y261 HydrophobicContact SD-CD2 3.84Å; M126-Y261 HydrophobicContact SD-CE2 4.42Å; K132-Y261 HydrophobicContact CD-CD2 3.73Å; K132-Y261 HydrophobicContact CD-CE2 3.94Å; C259-Y261 VanDerWaalsContact C-N 3.32Å; C259-Y261 PolarHBondContact O-N 3.25Å; Y261-G263 VanDerWaalsContact C-N 3.27Å; Y261-G263 PolarHBondContact O-N 3.32Å
262	L	98.1	Very high	94.9	Very high	50 Å²	50	50.8 Å²	50.8	26%	0.262	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-84.6	5.8	-178.5	-57.2	172.2	0	0	0	113.7	C43 E46 M47 K50 C259 A260	C43-L262 HydrophobicContact CB-CD1 3.71Å; E46-L262 HydrophobicContact CB-CD1 3.87Å; E46-L262 HydrophobicContact CG-CD1 3.75Å; E46-L262 HydrophobicContact CG-CD2 3.93Å; E46-L262 HydrophobicContact CG-CG 4.47Å; M47-L262 HydrophobicContact CG-CD1 3.68Å; M47-L262 HydrophobicContact CG-CG 4.2Å; M47-L262 HydrophobicContact SD-CD1 3.76Å; M47-L262 HydrophobicContact SD-CD2 4.02Å; M47-L262 HydrophobicContact SD-CG 3.57Å; M47-L262 VanDerWaalsContact SD-CG 3.57Å; K50-L262 HydrophobicContact CG-CD2 4.27Å; C259-L262 HydrophobicContact CB-CB 4.39Å; C259-L262 HydrophobicContact CB-CD1 4.39Å; C259-L262 PolarHBondContact O-N 3.27Å; A260-L262 PolarHBondContact O-N 2.84Å
263	G	97.7	Very high	94.3	Very high	37 Å²	37	50.1 Å²	50.1	38%	0.381	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	116.4	-3.9	178.5	0	0	0	0	0	114.9	C259 A260 Y261 E265	C259-G263 PolarHBondContact O-N 3.07Å; A260-G263 PolarHBondContact O-N 3.25Å; Y261-G263 VanDerWaalsContact C-N 3.27Å; Y261-G263 PolarHBondContact O-N 3.32Å; G263-E265 PolarHBondContact O-N 3.39Å
264	G	97.6	Very high	93.3	Very high	19 Å²	19	53.2 Å²	53.2	20%	0.196	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-64.2	120.3	177.7	0	0	0	0	0	113	R122 N258 C259 A260	R122-G264 VanDerWaalsContact CD-O 3.25Å; R122-G264 WeakPolarHBondContact CD-O 3.35Å; N258-G264 WeakPolarHBondContact O-CA 3.32Å; C259-G264 PolarHBondContact O-N 2.86Å; A260-G264 WeakPolarHBondContact CA-O 3.29Å
265	E	97.6	Very high	91.5	Very high	116 Å²	116	54.9 Å²	54.9	54%	0.542	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-81.9	155	176.3	-68.3	-59.6	153.3	0	0	112.5	R122 G263 R267	R122-E265 WeakPolarHBondContact CB-OE2 3.33Å; R122-E265 VanDerWaalsContact CD-CD 3.44Å; R122-E265 WeakPolarHBondContact CD-OE1 3.47Å; R122-E265 IonicContact NE-OE1 3.1Å; R122-E265 IonicContact NH1-OE1 3.98Å; G263-E265 PolarHBondContact O-N 3.39Å; E265-R267 PolarHBondContact O-N 2.97Å
266	K	96.6	Very high	88.8	Confident	57 Å²	57	58.7 Å²	58.7	25%	0.248	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-64.7	126.4	173.4	-173.8	-178.9	-178.8	170.1	0	109.5	P33 D34 G119 G120 H256 F257	P33-K266 VanDerWaalsContact O-CE 3.28Å; P33-K266 WeakPolarHBondContact O-CE 3.32Å; P33-K266 PolarHBondContact O-NZ 2.96Å; D34-K266 IonicContact OD1-NZ 2.9Å; D34-K266 PolarHBondContact OD1-NZ 2.84Å; G119-K266 VanDerWaalsContact O-CD 3.31Å; G119-K266 WeakPolarHBondContact O-CD 3.22Å; G119-K266 WeakPolarHBondContact O-CE 3.44Å; G119-K266 PolarHBondContact O-NZ 3.34Å; G120-K266 VanDerWaalsContact O-CD 3.27Å; G120-K266 WeakPolarHBondContact O-CD 3.18Å; G120-K266 PolarHBondContact O-NZ 3.48Å; H256-K266 HydrophobicContact CB-CG 4.23Å; F257-K266 HydrophobicContact CD1-CB 4.28Å; F257-K266 HydrophobicContact CE1-CB 3.61Å; F257-K266 HydrophobicContact CE1-CG 4.12Å; F257-K266 HydrophobicContact CE2-CB 4.3Å; F257-K266 HydrophobicContact CE2-CD 4.02Å; F257-K266 HydrophobicContact CE2-CG 3.86Å; F257-K266 HydrophobicContact CZ-CB 3.63Å; F257-K266 HydrophobicContact CZ-CD 3.77Å; F257-K266 HydrophobicContact CZ-CG 3.65Å
267	R	95.6	Very high	86.1	Confident	124 Å²	124	61.6 Å²	61.6	47%	0.468	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-84	142.6	174.1	-60.6	-180	-173.7	-160.9	6	110.7	H256 E265 G269	H256-R267 PolarHBondContact ND1-O 3.18Å; H256-R267 PolarHBondContact O-N 3.28Å; E265-R267 PolarHBondContact O-N 2.97Å; R267-G269 VanDerWaalsContact CB-O 3.23Å; R267-G269 WeakPolarHBondContact CB-O 3.25Å
268	H	90.4	Very high	82.7	Confident	198 Å²	198	69 Å²	69	92%	0.917	40%	0.403	S	S	*	.	S	Bend	trans	-63.7	-42.3	177.9	-177	-82.6	0	0	0	112.2
269	G	90.6	Very high	79.7	Confident	44 Å²	44	72.4 Å²	72.4	45%	0.454	43%	0.427	S	S	.	.	S	Bend	trans	-103.1	147.7	168.7	0	0	0	0	0	110.3	R267	R267-G269 VanDerWaalsContact CB-O 3.23Å; R267-G269 WeakPolarHBondContact CB-O 3.25Å
270	C	88.5	Confident	76.7	Confident	43 Å²	43	80.9 Å²	80.9	29%	0.291	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-72.4	152.2	171.3	73.7	0	0	0	0	111	C254 S255 H256	C254-C270 HydrophobicContact CB-CB 3.93Å; C254-C270 WeakPolarHBondContact CB-SG 3.45Å; C254-C270 WeakPolarHBondContact SG-CB 3.2Å; C254-C270 CovalentContact SG-SG 2.01Å; C254-C270 PolarHBondContact SG-SG 2.91Å; S255-C270 WeakPolarHBondContact O-CA 3.4Å; H256-C270 PolarHBondContact CE1-N 3.33Å
271	V	90.9	Very high	73.7	Confident	64 Å²	64	86.4 Å²	86.4	39%	0.388	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.8	177.9	-178	0	0	0	0	107.2	S255	S255-V271 PolarHBondContact N-O 3.43Å; S255-V271 PolarHBondContact O-N 3.24Å
272	S	87.3	Confident	70.9	Confident	72 Å²	72	86.2 Å²	86.2	50%	0.503	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	136.8	176.7	-59.7	0	0	0	0	111.3	T253	T253-S272 WeakPolarHBondContact O-CA 3.35Å
273	S	80.6	Confident	68.4	Low	63 Å²	63	88.5 Å²	88.5	44%	0.441	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133	167.8	-174.6	0	0	0	0	108.9	T253	T253-S273 PolarHBondContact N-O 2.85Å; T253-S273 VanDerWaalsContact N-O 3.08Å; T253-S273 WeakPolarHBondContact OG1-CB 3.46Å
274	T	71.2	Confident	65.7	Low	76 Å²	76	91.3 Å²	91.3	47%	0.466	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	150.3	172.4	50	0	0	0	0	110	Q252 V276	Q252-T274 HydrophobicContact CG-CG2 4.15Å; T274-V276 PolarHBondContact O-N 2.98Å; T274-V276 VanDerWaalsContact O-N 3.08Å
275	T	56.8	Low	62.9	Low	39 Å²	39	95.3 Å²	95.3	24%	0.239	55%	0.546	C	S	.	.	S	Bend	trans	-65	-5.4	174.5	42.4	0	0	0	0	114.5	F207 N251 G277	F207-T275 HydrophobicContact CE1-CG2 3.87Å; F207-T275 HydrophobicContact CZ-CG2 3.74Å; N251-T275 PolarHBondContact ND2-OG1 3.44Å; N251-T275 VanDerWaalsContact ND2-OG1 3.15Å; N251-T275 PolarHBondContact OD1-OG1 3.5Å; T275-G277 PolarHBondContact O-N 3.08Å
276	V	38.6	Very low	60.1	Low	90 Å²	90	92.4 Å²	92.4	55%	0.545	54%	0.542	S	S	.	.			trans	-86.2	109.2	178	-175.9	0	0	0	0	109.7	T274 Q278	T274-V276 PolarHBondContact O-N 2.98Å; T274-V276 VanDerWaalsContact O-N 3.08Å; V276-Q278 HydrophobicContact CG1-CG 4.43Å; V276-Q278 PolarHBondContact O-N 3.3Å
277	G	40.2	Very low	57.5	Low	77 Å²	77	95.5 Å²	95.5	79%	0.794	56%	0.56	S	S	*	*			trans	-61.2	101.8	163.9	0	0	0	0	0	110.1	T275	T275-G277 PolarHBondContact O-N 3.08Å
278	Q	27.3	Very low	54.9	Low	159 Å²	159	93.1 Å²	93.1	74%	0.743	57%	0.567	S	S	*	*			trans	-133.2	148.8	151.5	-78.5	-157.3	-57.7	0	0	108.5	V276 E280	V276-Q278 HydrophobicContact CG1-CG 4.43Å; V276-Q278 PolarHBondContact O-N 3.3Å; Q278-E280 PolarHBondContact O-N 2.99Å
279	P	32.8	Very low	52.6	Low	113 Å²	113	91 Å²	91	73%	0.734	56%	0.562	S	S	*	*			trans	-60.5	140.2	-177.8	-10.7	25.4	0	0	0	109.3	L281	P279-L281 PolarHBondContact O-N 3.37Å
280	E	35.5	Very low	50.3	Low	193 Å²	193	99.6 Å²	99.6	90%	0.902	58%	0.581	S	S	*	*			trans	-52.9	110.2	170.8	-66	-175.9	154	0	0	109.1	Q278 S282	Q278-E280 PolarHBondContact O-N 2.99Å; E280-S282 PolarHBondContact O-N 2.97Å
281	L	35.4	Very low	48	Very low	116 Å²	116	101.2 Å²	101.2	61%	0.607	59%	0.592	S	S	*	*			trans	-65.3	126.8	161.4	-89.8	92.3	0	0	0	106.9	P279 E285	P279-L281 PolarHBondContact O-N 3.37Å; L281-E285 HydrophobicContact CB-CB 4.46Å; L281-E285 HydrophobicContact CD2-CB 3.83Å; L281-E285 VanDerWaalsContact CD2-OE2 3.22Å; L281-E285 WeakPolarHBondContact CD2-OE2 3.26Å; L281-E285 VanDerWaalsContact CG-OE2 3.26Å; L281-E285 WeakPolarHBondContact CG-OE2 3.41Å
282	S	39.1	Very low	45.6	Very low	61 Å²	61	102 Å²	102	43%	0.427	61%	0.613	S	S	.	*			trans	-60.6	149.1	-179.8	72	0	0	0	0	110.1	E280 T284 E285	E280-S282 PolarHBondContact O-N 2.97Å; S282-T284 PolarHBondContact O-N 3.24Å; S282-T284 PolarHBondContact OG-OG1 3.08Å; S282-E285 PolarHBondContact O-N 3.3Å
283	S	45.3	Very low	43.1	Very low	97 Å²	97	107.2 Å²	107.2	68%	0.678	63%	0.627	S	S	*	*	H	α-helix	trans	-51.7	-19	-178.2	50.7	0	0	0	0	114.9
284	T	42.6	Very low	40.8	Very low	97 Å²	97	110.4 Å²	110.4	60%	0.595	64%	0.644	S	S	*	*	H	α-helix	trans	-70.2	-36.1	172.5	15.3	0	0	0	0	114.2	S282 A288	S282-T284 PolarHBondContact O-N 3.24Å; S282-T284 PolarHBondContact OG-OG1 3.08Å; T284-A288 PolarHBondContact O-N 3.15Å
285	E	38.4	Very low	39	Very low	102 Å²	102	115.1 Å²	115.1	48%	0.477	66%	0.663	S	S	.	*	H	α-helix	trans	-79.5	-31.9	-177.3	-66.3	-179.8	137.9	0	0	112	L281 S282 L287 A288 L289	L281-E285 HydrophobicContact CB-CB 4.46Å; L281-E285 HydrophobicContact CD2-CB 3.83Å; L281-E285 VanDerWaalsContact CD2-OE2 3.22Å; L281-E285 WeakPolarHBondContact CD2-OE2 3.26Å; L281-E285 VanDerWaalsContact CG-OE2 3.26Å; L281-E285 WeakPolarHBondContact CG-OE2 3.41Å; S282-E285 PolarHBondContact O-N 3.3Å; E285-L287 VanDerWaalsContact C-N 3.26Å; E285-L287 PolarHBondContact O-N 2.75Å; E285-A288 PolarHBondContact O-N 2.91Å; E285-L289 PolarHBondContact O-N 2.88Å
286	A	38.6	Very low	37.7	Very low	56 Å²	56	121 Å²	121	46%	0.463	69%	0.692	S	S	.	*	H	α-helix	trans	-66.1	-27	173.6	0	0	0	0	0	113.3
287	L	42.5	Very low	37.3	Very low	122 Å²	122	124.7 Å²	124.7	64%	0.639	71%	0.708	S	S	*	*	H	α-helix	trans	-79.8	-29.8	176.7	-76	169.5	0	0	0	112.7	E285 L289 R290 S291	E285-L287 VanDerWaalsContact C-N 3.26Å; E285-L287 PolarHBondContact O-N 2.75Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-R290 PolarHBondContact O-N 3.45Å; L287-S291 PolarHBondContact O-N 3.14Å
288	A	40.4	Very low	36.9	Very low	74 Å²	74	125.4 Å²	125.4	61%	0.612	71%	0.706	S	S	*	*	H	α-helix	trans	-68.6	-32.8	176.1	0	0	0	0	0	112.4	T284 E285 R290	T284-A288 PolarHBondContact O-N 3.15Å; E285-A288 PolarHBondContact O-N 2.91Å; A288-R290 VanDerWaalsContact C-N 3.34Å
289	L	41.5	Very low	37.2	Very low	152 Å²	152	124.3 Å²	124.3	80%	0.796	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-17.6	176.5	-85.3	146	0	0	0	114.1	E285 L287	E285-L289 PolarHBondContact O-N 2.88Å; L287-L289 VanDerWaalsContact C-N 3.34Å
290	R	43.4	Very low	37	Very low	226 Å²	226	122.3 Å²	122.3	85%	0.853	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-19.1	178.1	-74	-173.1	176.1	-137.1	0.5	114	L287 A288 G292	L287-R290 PolarHBondContact O-N 3.45Å; A288-R290 VanDerWaalsContact C-N 3.34Å; R290-G292 PolarHBondContact O-N 3.42Å
291	S	40.1	Very low	36.7	Very low	76 Å²	76	121.7 Å²	121.7	53%	0.531	71%	0.71	S	S	.	*	S	Bend	trans	-92.4	95	171.6	-163.2	0	0	0	0	108.2	L287 K293	L287-S291 PolarHBondContact O-N 3.14Å; S291-K293 PolarHBondContact O-N 3.24Å
292	G	39.4	Very low	36.4	Very low	81 Å²	81	123.5 Å²	123.5	84%	0.835	72%	0.719	S	S	*	*			trans	-59.2	81.3	174.2	0	0	0	0	0	111.9	R290	R290-G292 PolarHBondContact O-N 3.42Å
293	K	34.6	Very low	36	Very low	182 Å²	182	129.1 Å²	129.1	79%	0.791	74%	0.739	S	S	*	*			trans	-104.2	101.4	163.6	-92.1	-179.7	174.7	177.1	0	107.4	S291 M295	S291-K293 PolarHBondContact O-N 3.24Å; K293-M295 PolarHBondContact O-N 3.22Å
294	T	33.9	Very low	35.4	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	75%	0.747	S	S	*	*			trans	-50.2	106	163.2	-46.2	0	0	0	0	108.6	L296	T294-L296 PolarHBondContact O-N 3.26Å; T294-L296 VanDerWaalsContact O-N 3.1Å
295	M	32.2	Very low	34.8	Very low	175 Å²	175	133.3 Å²	133.3	86%	0.862	76%	0.758	S	S	*	*			trans	-69.9	103.1	160.5	-90.2	-141.8	-87.3	0	0	106.9	K293 L297	K293-M295 PolarHBondContact O-N 3.22Å; M295-L297 PolarHBondContact O-N 3.06Å
296	L	30.4	Very low	34.5	Very low	164 Å²	164	140.2 Å²	140.2	86%	0.859	78%	0.78	S	S	*	*			trans	-58.5	104.4	162.1	-85.4	149.5	0	0	0	107.8	T294 A298	T294-L296 PolarHBondContact O-N 3.26Å; T294-L296 VanDerWaalsContact O-N 3.1Å; L296-A298 PolarHBondContact O-N 3.46Å
297	L	30.4	Very low	34.2	Very low	167 Å²	167	142.2 Å²	142.2	87%	0.874	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-68.5	118.7	164.7	-81.4	150.7	0	0	0	108	M295	M295-L297 PolarHBondContact O-N 3.06Å
298	A	31.7	Very low	33.8	Very low	91 Å²	91	139.7 Å²	139.7	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-66.2	139.7	170.3	0	0	0	0	0	109.9	L296 G300	L296-A298 PolarHBondContact O-N 3.46Å; A298-G300 PolarHBondContact O-N 3.39Å
299	P	32.7	Very low	34	Very low	136 Å²	136	146.1 Å²	146.1	88%	0.883	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-79.9	119.6	175.3	31.1	-29.5	0	0	0	109.5
300	G	29.8	Very low	33.6	Very low	72 Å²	72	145.8 Å²	145.8	74%	0.742	84%	0.838	S	S	*	*			trans	-139.2	90.2	178.5	0	0	0	0	0	111.6	A298	A298-G300 PolarHBondContact O-N 3.39Å
301	E	28.9	Very low	33.1	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	84%	0.837	S	S	*	*			trans	52.9	105.9	151.2	-58.3	-164.7	144.4	0	0	120.6	Q303	E301-Q303 PolarHBondContact O-N 3.12Å
302	L	28.7	Very low	32.7	Very low	153 Å²	153	145.2 Å²	145.2	80%	0.801	85%	0.854	S	S	*	*			trans	-60.8	122.7	150.4	-96.3	91.6	0	0	0	110	L304	L302-L304 HydrophobicContact CD2-CD1 4.01Å
303	Q	30.2	Very low	32.3	Very low	180 Å²	180	149 Å²	149	84%	0.841	86%	0.855	S	S	*	*			trans	-119.6	104	146.9	-80	-169.1	14	0	0	109.8	E301	E301-Q303 PolarHBondContact O-N 3.12Å
304	L	32.6	Very low	32.2	Very low	161 Å²	161	146.9 Å²	146.9	84%	0.843	86%	0.859	S	S	*	*			trans	-72.7	119.2	158.5	-87.1	146.3	0	0	0	107.9	L302	L302-L304 HydrophobicContact CD2-CD1 4.01Å
305	S	29.6	Very low	32	Very low	120 Å²	120	148.1 Å²	148.1	84%	0.839	86%	0.863	S	S	*	*			trans	-124.1	120	157.6	108.6	0	0	0	0	109
306	R	32.9	Very low	32	Very low	247 Å²	247	146.2 Å²	146.2	93%	0.932	86%	0.863	S	S	*	*			trans	-115	124.2	169.8	-179	-170.1	-160.3	-175	6.6	105.9
307	A	32.7	Very low	32.1	Very low	98 Å²	98	144.8 Å²	144.8	81%	0.81	86%	0.864	S	S	*	*			trans	-172.9	133.4	147.6	0	0	0	0	0	109.7
308	G	34.5	Very low	32.3	Very low	69 Å²	69	143 Å²	143	71%	0.711	86%	0.863	S	S	*	*			trans	-77.8	-143.2	178.8	0	0	0	0	0	113.5
309	P	43.2	Very low	32.4	Very low	209 Å²	209	147.7 Å²	147.7	100%	1.357	87%	0.873	S	S	*	*			cis	-88.2	0	20.1	2.3	16.7	0	0	0	115.2

Retrieved 309 of 309 residues in 61.3 ms (Link to these results)

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