A0A087XI49_POEFO Loading...

Zinc finger and BTB domain containing 37

AlphaFold DB , UniProt , Accession A0A087XI49, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 527 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	41.8	Very low	55.8	Low	245 Å²	245	152.1 Å²	152.1	100%	1.207	81%	0.808	S	S	*	*				0	113.4	0	-84.2	-178.3	167.2	0	0	107.8
2	E	52.2	Low	56.4	Low	198 Å²	198	148.6 Å²	148.6	93%	0.925	80%	0.8	S	S	*	*			trans	-82.2	114.6	174.1	-63	161.6	133.5	0	0	108.8
3	R	50.3	Low	57.3	Low	240 Å²	240	145.8 Å²	145.8	91%	0.906	79%	0.785	S	S	*	*			trans	-143.8	92.3	161.6	-74.1	-163.8	174.2	168	-0.5	109	G5	R3-G5 PolarHBondContact O-N 2.9Å
4	S	52.8	Low	58.5	Low	121 Å²	121	144.1 Å²	144.1	85%	0.846	77%	0.767	S	S	*	*			trans	-66.1	83.2	165.6	50.8	0	0	0	0	109.4	S6	S4-S6 PolarHBondContact O-N 3.31Å
5	G	49.7	Very low	59.6	Low	69 Å²	69	139.3 Å²	139.3	71%	0.711	75%	0.75	S	S	*	*			trans	-71.7	94.1	179.1	0	0	0	0	0	111.4	R3 I7	R3-G5 PolarHBondContact O-N 2.9Å; G5-I7 PolarHBondContact O-N 3.04Å
6	S	60.3	Low	60.6	Low	114 Å²	114	134.8 Å²	134.8	80%	0.797	73%	0.725	S	S	*	*			trans	-70.3	112.4	171.2	52.5	0	0	0	0	110.2	S4 Q8	S4-S6 PolarHBondContact O-N 3.31Å; S6-Q8 PolarHBondContact O-N 3.32Å
7	I	60	Low	61.7	Low	149 Å²	149	131.6 Å²	131.6	76%	0.764	72%	0.715	S	S	*	*			trans	-79.3	106.9	170.5	-55.9	176.2	0	0	0	107.6	G5 L9	G5-I7 PolarHBondContact O-N 3.04Å; I7-L9 HydrophobicContact CG2-CD2 4.17Å; I7-L9 HydrophobicContact CG2-CG 4.17Å
8	Q	54.1	Low	62.9	Low	149 Å²	149	127.7 Å²	127.7	70%	0.696	70%	0.696	S	S	*	*			trans	-86.7	127.2	170.1	-176.5	171.2	-25.4	0	0	109.2	S6 D10	S6-Q8 PolarHBondContact O-N 3.32Å; Q8-D10 PolarHBondContact NE2-OD1 3.15Å; Q8-D10 PolarHBondContact NE2-OD2 2.6Å
9	L	61.3	Low	64	Low	143 Å²	143	123 Å²	123	75%	0.749	67%	0.67	S	S	*	*			trans	-115	92.7	177.8	-68.8	173.8	0	0	0	109	I7 I11	I7-L9 HydrophobicContact CG2-CD2 4.17Å; I7-L9 HydrophobicContact CG2-CG 4.17Å; L9-I11 PolarHBondContact O-N 3.24Å
10	D	60.8	Low	64.9	Low	129 Å²	129	120.9 Å²	120.9	69%	0.69	67%	0.665	S	S	*	*			trans	-79.2	102.4	176.1	-66.5	-30.6	0	0	0	109.8	Q8	Q8-D10 PolarHBondContact NE2-OD1 3.15Å; Q8-D10 PolarHBondContact NE2-OD2 2.6Å
11	I	70.3	Confident	65.8	Low	116 Å²	116	119.9 Å²	119.9	60%	0.595	66%	0.656	S	S	*	*			trans	-80.4	119.8	174.9	-60.4	174.3	0	0	0	108.4	L9 F14	L9-I11 PolarHBondContact O-N 3.24Å; I11-F14 HydrophobicContact CB-CB 4.13Å; I11-F14 HydrophobicContact CG2-CB 4.18Å; I11-F14 WeakPolarHBondContact O-CB 3.29Å; I11-F14 PolarHBondContact O-N 3.22Å
12	P	62.7	Low	68	Low	110 Å²	110	110.3 Å²	110.3	71%	0.714	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	143.9	177.9	26	-34.2	0	0	0	111	F14	P12-F14 PolarHBondContact O-N 2.82Å
13	D	68.4	Low	69.7	Low	112 Å²	112	102.5 Å²	102.5	60%	0.599	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.8	12	178.3	-72.8	-65.5	0	0	0	117.5	S15 N16 S17	D13-S15 PolarHBondContact O-N 2.69Å; D13-N16 HydrophobicContact CB-CB 4.31Å; D13-N16 WeakPolarHBondContact O-CA 3.49Å; D13-N16 WeakPolarHBondContact O-CB 3.4Å; D13-N16 PolarHBondContact O-N 2.91Å; D13-N16 PolarHBondContact OD1-ND2 3.08Å; D13-S17 PolarHBondContact O-N 3.48Å
14	F	74.6	Confident	71.4	Confident	122 Å²	122	96 Å²	96	54%	0.535	55%	0.554	S	S	.	*	H	α-helix	trans	-52.1	-43	173.8	-178.5	-105	0	0	0	112	I11 P12 N16 S17 V18	I11-F14 HydrophobicContact CB-CB 4.13Å; I11-F14 HydrophobicContact CG2-CB 4.18Å; I11-F14 WeakPolarHBondContact O-CB 3.29Å; I11-F14 PolarHBondContact O-N 3.22Å; P12-F14 PolarHBondContact O-N 2.82Å; F14-N16 VanDerWaalsContact C-N 3.27Å; F14-N16 PolarHBondContact O-N 2.69Å; F14-S17 PolarHBondContact O-N 2.96Å; F14-V18 HydrophobicContact CD1-CG2 4.23Å; F14-V18 HydrophobicContact CD2-CG2 4.45Å; F14-V18 HydrophobicContact CE1-CG2 3.84Å; F14-V18 HydrophobicContact CE2-CG2 4.08Å; F14-V18 HydrophobicContact CZ-CG2 3.76Å; F14-V18 WeakPolarHBondContact O-CG2 3.42Å; F14-V18 PolarHBondContact O-N 2.69Å
15	S	74.8	Confident	73.1	Confident	73 Å²	73	90.9 Å²	90.9	51%	0.51	52%	0.516	S	S	.	.	H	α-helix	trans	-70	-14.6	176.6	-45.8	0	0	0	0	114.8	D13 R223	D13-S15 PolarHBondContact O-N 2.69Å; S15-R223 VanDerWaalsContact C-NH1 3.33Å; S15-R223 PolarHBondContact O-NH1 2.96Å
16	N	75.3	Confident	75	Confident	67 Å²	67	89.1 Å²	89.1	36%	0.358	49%	0.488	S	S	.	.	H	α-helix	trans	-85.7	-44.3	169.2	-84.4	-47.2	0	0	0	110.2	D13 F14 V18 L19 S20 R223	D13-N16 HydrophobicContact CB-CB 4.31Å; D13-N16 WeakPolarHBondContact O-CA 3.49Å; D13-N16 WeakPolarHBondContact O-CB 3.4Å; D13-N16 PolarHBondContact O-N 2.91Å; D13-N16 PolarHBondContact OD1-ND2 3.08Å; F14-N16 VanDerWaalsContact C-N 3.27Å; F14-N16 PolarHBondContact O-N 2.69Å; N16-V18 PolarHBondContact O-N 2.98Å; N16-L19 PolarHBondContact O-N 3.26Å; N16-S20 WeakPolarHBondContact O-CB 3.2Å; N16-S20 PolarHBondContact O-N 3.19Å; N16-R223 WeakPolarHBondContact OD1-CD 3.27Å; N16-R223 PolarHBondContact OD1-NH1 2.86Å
17	S	78.9	Confident	76.2	Confident	80 Å²	80	88.8 Å²	88.8	56%	0.559	48%	0.481	S	S	*	.	H	α-helix	trans	-57.8	-47.9	175.8	-175.2	0	0	0	0	112.5	D13 F14 L19 S20 H21	D13-S17 PolarHBondContact O-N 3.48Å; F14-S17 PolarHBondContact O-N 2.96Å; S17-L19 PolarHBondContact O-N 3.41Å; S17-S20 WeakPolarHBondContact O-CB 3.33Å; S17-S20 PolarHBondContact O-N 2.9Å; S17-H21 PolarHBondContact O-N 2.82Å
18	V	83.7	Confident	77.5	Confident	61 Å²	61	86.8 Å²	86.8	37%	0.37	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-44.4	178.2	170.5	0	0	0	0	112.3	F14 N16 H21 L22	F14-V18 HydrophobicContact CD1-CG2 4.23Å; F14-V18 HydrophobicContact CD2-CG2 4.45Å; F14-V18 HydrophobicContact CE1-CG2 3.84Å; F14-V18 HydrophobicContact CE2-CG2 4.08Å; F14-V18 HydrophobicContact CZ-CG2 3.76Å; F14-V18 WeakPolarHBondContact O-CG2 3.42Å; F14-V18 PolarHBondContact O-N 2.69Å; N16-V18 PolarHBondContact O-N 2.98Å; V18-H21 PolarHBondContact O-N 2.94Å; V18-L22 HydrophobicContact CG1-CD1 3.93Å; V18-L22 HydrophobicContact CG1-CG 4.48Å; V18-L22 WeakPolarHBondContact O-CB 3.44Å; V18-L22 WeakPolarHBondContact O-CG 3.38Å; V18-L22 PolarHBondContact O-N 3.31Å
19	L	83.9	Confident	79	Confident	39 Å²	39	81 Å²	81	20%	0.204	45%	0.448	C	S	.	.	H	α-helix	trans	-66.6	-39.3	177.9	-79.5	178.5	0	0	0	112.2	N16 S17 H21 L22 N23	N16-L19 PolarHBondContact O-N 3.26Å; S17-L19 PolarHBondContact O-N 3.41Å; L19-H21 PolarHBondContact O-N 3.45Å; L19-L22 HydrophobicContact CD2-CD1 4.42Å; L19-L22 PolarHBondContact O-N 3.37Å; L19-N23 PolarHBondContact O-N 3.21Å
20	S	82.4	Confident	80.1	Confident	81 Å²	81	81 Å²	81	57%	0.566	44%	0.439	S	S	*	.	H	α-helix	trans	-59	-45.7	174	-170	0	0	0	0	111.6	N16 S17 N23 Q24	N16-S20 WeakPolarHBondContact O-CB 3.2Å; N16-S20 PolarHBondContact O-N 3.19Å; S17-S20 WeakPolarHBondContact O-CB 3.33Å; S17-S20 PolarHBondContact O-N 2.9Å; S20-N23 WeakPolarHBondContact O-CB 3.47Å; S20-N23 PolarHBondContact O-N 3Å; S20-Q24 PolarHBondContact O-N 2.73Å
21	H	84.3	Confident	81.3	Confident	100 Å²	100	81.3 Å²	81.3	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-67.6	-38.7	177.2	-168.2	56.7	0	0	0	112.8	S17 V18 L19 N23 Q24 L25	S17-H21 PolarHBondContact O-N 2.82Å; V18-H21 PolarHBondContact O-N 2.94Å; L19-H21 PolarHBondContact O-N 3.45Å; H21-N23 VanDerWaalsContact C-N 3.27Å; H21-N23 PolarHBondContact O-N 2.99Å; H21-Q24 PolarHBondContact ND1-OE1 2.9Å; H21-Q24 WeakPolarHBondContact O-CB 3.49Å; H21-Q24 PolarHBondContact O-N 3.36Å; H21-L25 WeakPolarHBondContact O-CG 3.48Å; H21-L25 PolarHBondContact O-N 2.93Å
22	L	87.1	Confident	82.2	Confident	44 Å²	44	77.3 Å²	77.3	23%	0.23	42%	0.421	C	S	.	.	H	α-helix	trans	-62.2	-33.3	172.1	-73.4	169	0	0	0	112.4	V18 L19 L25 R26 H46 V49 Y88	V18-L22 HydrophobicContact CG1-CD1 3.93Å; V18-L22 HydrophobicContact CG1-CG 4.48Å; V18-L22 WeakPolarHBondContact O-CB 3.44Å; V18-L22 WeakPolarHBondContact O-CG 3.38Å; V18-L22 PolarHBondContact O-N 3.31Å; L19-L22 HydrophobicContact CD2-CD1 4.42Å; L19-L22 PolarHBondContact O-N 3.37Å; L22-L25 HydrophobicContact CD2-CD1 4.44Å; L22-R26 WeakPolarHBondContact O-CB 3.48Å; L22-R26 PolarHBondContact O-N 3.49Å; L22-H46 PolarHBondContact O-CE1 2.92Å; L22-V49 HydrophobicContact CD1-CG2 4.06Å; L22-Y88 HydrophobicContact CB-CD1 4.15Å; L22-Y88 HydrophobicContact CB-CE1 4.12Å
23	N	86.9	Confident	83.4	Confident	33 Å²	33	75.4 Å²	75.4	18%	0.176	41%	0.405	C	S	.	.	H	α-helix	trans	-68.4	-41.9	173	-164	31.7	0	0	0	111.5	L19 S20 H21 R26 V27 Y88	L19-N23 PolarHBondContact O-N 3.21Å; S20-N23 WeakPolarHBondContact O-CB 3.47Å; S20-N23 PolarHBondContact O-N 3Å; H21-N23 VanDerWaalsContact C-N 3.27Å; H21-N23 PolarHBondContact O-N 2.99Å; N23-R26 WeakPolarHBondContact O-CB 3.35Å; N23-R26 PolarHBondContact O-N 3.48Å; N23-R26 PolarHBondContact OD1-NE 3.13Å; N23-R26 PolarHBondContact OD1-NH2 2.83Å; N23-V27 WeakPolarHBondContact O-CG2 3.4Å; N23-V27 PolarHBondContact O-N 3.29Å; N23-Y88 HydrophobicContact CB-CD1 4.15Å; N23-Y88 HydrophobicContact CB-CG 4.4Å
24	Q	86.8	Confident	84.4	Confident	105 Å²	105	70.2 Å²	70.2	49%	0.491	38%	0.378	S	S	.	.	H	α-helix	trans	-61	-44.1	175.6	-169	-176.4	27.3	0	0	111.4	S20 H21 V27 Q28	S20-Q24 PolarHBondContact O-N 2.73Å; H21-Q24 PolarHBondContact ND1-OE1 2.9Å; H21-Q24 WeakPolarHBondContact O-CB 3.49Å; H21-Q24 PolarHBondContact O-N 3.36Å; Q24-V27 PolarHBondContact O-N 3.21Å; Q24-Q28 WeakPolarHBondContact O-CB 3.39Å; Q24-Q28 VanDerWaalsContact O-CG 3.31Å; Q24-Q28 WeakPolarHBondContact O-CG 3.38Å; Q24-Q28 PolarHBondContact O-N 3.23Å
25	L	88.4	Confident	85.1	Confident	12 Å²	12	66.1 Å²	66.1	6%	0.063	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-43.7	174.5	-71	166.4	0	0	0	111.8	H21 L22 V27 Q28 G29 R30 L31	H21-L25 WeakPolarHBondContact O-CG 3.48Å; H21-L25 PolarHBondContact O-N 2.93Å; L22-L25 HydrophobicContact CD2-CD1 4.44Å; L25-V27 PolarHBondContact O-N 3.41Å; L25-Q28 CarbonylContact O-C 3.59Å; L25-Q28 PolarHBondContact O-N 3.36Å; L25-G29 PolarHBondContact O-N 3.18Å; L25-R30 HydrophobicContact CD2-CB 3.99Å; L25-R30 PolarHBondContact O-N 2.93Å; L25-L31 HydrophobicContact CD1-CD1 4.28Å
26	R	90.4	Very high	85.9	Confident	32 Å²	32	62.7 Å²	62.7	12%	0.121	34%	0.338	C	S	.	.	H	α-helix	trans	-56.5	-50.1	175.1	-178.6	-168.8	67.2	98.7	-6.6	111.9	L22 N23 Q28 G29 R44 Y88	L22-R26 WeakPolarHBondContact O-CB 3.48Å; L22-R26 PolarHBondContact O-N 3.49Å; N23-R26 WeakPolarHBondContact O-CB 3.35Å; N23-R26 PolarHBondContact O-N 3.48Å; N23-R26 PolarHBondContact OD1-NE 3.13Å; N23-R26 PolarHBondContact OD1-NH2 2.83Å; R26-Q28 VanDerWaalsContact C-N 3.3Å; R26-Q28 PolarHBondContact O-N 3Å; R26-G29 WeakPolarHBondContact O-CA 3.42Å; R26-G29 PolarHBondContact O-N 2.98Å; R26-R44 VanDerWaalsContact CG-O 3.26Å; R26-R44 WeakPolarHBondContact CG-O 3.41Å; R26-Y88 HydrophobicContact CB-CD1 4.46Å; R26-Y88 HydrophobicContact CB-CE1 4.05Å; R26-Y88 HydrophobicContact CG-CE1 4.48Å
27	V	85.8	Confident	86.5	Confident	108 Å²	108	62.1 Å²	62.1	66%	0.655	34%	0.335	S	S	*	.	H	α-helix	trans	-65.9	-33.4	-179.8	172.7	0	0	0	0	111.6	N23 Q24 L25 G29	N23-V27 WeakPolarHBondContact O-CG2 3.4Å; N23-V27 PolarHBondContact O-N 3.29Å; Q24-V27 PolarHBondContact O-N 3.21Å; L25-V27 PolarHBondContact O-N 3.41Å; V27-G29 PolarHBondContact O-N 3.25Å
28	Q	87.3	Confident	87.1	Confident	107 Å²	107	58.3 Å²	58.3	50%	0.5	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.2	170.6	-68.2	176.1	4.5	0	0	113.7	Q24 L25 R26 R30	Q24-Q28 WeakPolarHBondContact O-CB 3.39Å; Q24-Q28 VanDerWaalsContact O-CG 3.31Å; Q24-Q28 WeakPolarHBondContact O-CG 3.38Å; Q24-Q28 PolarHBondContact O-N 3.23Å; L25-Q28 CarbonylContact O-C 3.59Å; L25-Q28 PolarHBondContact O-N 3.36Å; R26-Q28 VanDerWaalsContact C-N 3.3Å; R26-Q28 PolarHBondContact O-N 3Å; Q28-R30 HydrophobicContact CB-CB 4.48Å; Q28-R30 HydrophobicContact CB-CG 3.94Å; Q28-R30 PolarHBondContact O-N 2.96Å
29	G	84.6	Confident	87.3	Confident	26 Å²	26	60.4 Å²	60.4	27%	0.268	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	14	-175.2	0	0	0	0	0	114.8	L25 R26 V27	L25-G29 PolarHBondContact O-N 3.18Å; R26-G29 WeakPolarHBondContact O-CA 3.42Å; R26-G29 PolarHBondContact O-N 2.98Å; V27-G29 PolarHBondContact O-N 3.25Å
30	R	85.5	Confident	87.3	Confident	145 Å²	145	62.3 Å²	62.3	55%	0.547	34%	0.343	S	S	.	.			trans	-91	141	-175.1	-66.1	178.3	70.2	-154.9	-0.1	110.6	L25 Q28 C32 H46	L25-R30 HydrophobicContact CD2-CB 3.99Å; L25-R30 PolarHBondContact O-N 2.93Å; Q28-R30 HydrophobicContact CB-CB 4.48Å; Q28-R30 HydrophobicContact CB-CG 3.94Å; Q28-R30 PolarHBondContact O-N 2.96Å; R30-C32 PolarHBondContact O-N 3.44Å; R30-H46 PolarHBondContact O-NE2 3.17Å
31	L	85.8	Confident	87.6	Confident	135 Å²	135	63.2 Å²	63.2	71%	0.707	34%	0.339	S	S	*	.	S	Bend	trans	58.9	5	-179.6	-54.8	179.4	0	0	0	115.7	L25 D33 H46	L25-L31 HydrophobicContact CD1-CD1 4.28Å; L31-D33 PolarHBondContact O-N 3.25Å; L31-H46 PolarHBondContact O-CD2 2.96Å; L31-H46 VanDerWaalsContact O-CD2 3.25Å
32	C	88	Confident	87.9	Confident	31 Å²	31	62.4 Å²	62.4	21%	0.209	34%	0.344	C	S	.	.			trans	-65.4	117.1	171.6	-61.3	0	0	0	0	110.9	R30 R44 A45	R30-C32 PolarHBondContact O-N 3.44Å; C32-R44 HydrophobicContact CB-CB 3.99Å; C32-A45 CarbonylContact C-O 3.58Å; C32-A45 VanDerWaalsContact CA-O 3.24Å; C32-A45 WeakPolarHBondContact CA-O 3.42Å; C32-A45 WeakPolarHBondContact CB-O 3.31Å
33	D	88.4	Confident	88.2	Confident	71 Å²	71	61.2 Å²	61.2	38%	0.38	34%	0.337	S	S	.	.			trans	-103.5	5.8	-178.4	66.1	-23.5	0	0	0	113.1	L31 A45 H46 K47	L31-D33 PolarHBondContact O-N 3.25Å; D33-A45 PolarHBondContact N-O 3.02Å; D33-H46 WeakPolarHBondContact OD1-CA 3.48Å; D33-K47 VanDerWaalsContact O-CE 3.29Å; D33-K47 WeakPolarHBondContact O-CE 3.36Å; D33-K47 PolarHBondContact O-NZ 3.27Å; D33-K47 WeakPolarHBondContact OD1-CG 3.44Å; D33-K47 PolarHBondContact OD1-N 3Å; D33-K47 WeakPolarHBondContact OD2-CB 3.26Å; D33-K47 VanDerWaalsContact OD2-CD 3.31Å; D33-K47 WeakPolarHBondContact OD2-CD 3.31Å; D33-K47 WeakPolarHBondContact OD2-CG 3.48Å
34	I	89.1	Confident	88.4	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.015	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	147.2	172.4	-173.2	153.7	0	0	0	113.3	V36 A45 K47 L50 M61 S67 V69	I34-V36 HydrophobicContact CG1-CG2 4.32Å; I34-A45 HydrophobicContact CG2-CB 4.09Å; I34-A45 VanDerWaalsContact CG2-O 3.31Å; I34-A45 WeakPolarHBondContact CG2-O 3.48Å; I34-A45 PolarHBondContact N-O 3.46Å; I34-A45 PolarHBondContact O-N 3.31Å; I34-K47 HydrophobicContact CB-CG 3.8Å; I34-K47 HydrophobicContact CD1-CG 4.26Å; I34-K47 HydrophobicContact CG2-CG 3.75Å; I34-L50 HydrophobicContact CG2-CD1 4.07Å; I34-M61 HydrophobicContact CD1-CE 3.58Å; I34-M61 HydrophobicContact CD1-CG 4.38Å; I34-M61 HydrophobicContact CD1-SD 3.95Å; I34-S67 CarbonylContact C-O 3.48Å; I34-S67 WeakPolarHBondContact CA-O 3.24Å; I34-V69 HydrophobicContact CD1-CB 4.41Å; I34-V69 HydrophobicContact CD1-CG2 3.79Å
35	V	89.9	Confident	88.6	Confident	36 Å²	36	61.8 Å²	61.8	22%	0.218	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.4	166.2	-172.2	0	0	0	0	109.2	N37 F43 R44 S67 T68 V69	V35-N37 WeakPolarHBondContact CG1-OD1 3.39Å; V35-F43 CarbonylContact C-O 3.55Å; V35-F43 WeakPolarHBondContact CA-O 3.37Å; V35-R44 HydrophobicContact CG2-CG 4.47Å; V35-S67 PolarHBondContact N-O 2.91Å; V35-T68 CarbonylContact O-C 3.51Å; V35-T68 VanDerWaalsContact O-CA 3.26Å; V35-T68 WeakPolarHBondContact O-CA 3.31Å; V35-V69 PolarHBondContact O-N 2.89Å
36	V	90.3	Very high	88.6	Confident	1 Å²	1	62 Å²	62	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.8	174.5	-173.1	0	0	0	0	109.3	I34 V38 F43 L50 F57 V69 L71 F80	I34-V36 HydrophobicContact CG1-CG2 4.32Å; V36-V38 HydrophobicContact CG1-CG2 4.22Å; V36-F43 PolarHBondContact N-O 3.38Å; V36-F43 PolarHBondContact O-N 2.99Å; V36-L50 HydrophobicContact CG2-CD1 4.01Å; V36-F57 HydrophobicContact CG1-CZ 4.45Å; V36-F57 HydrophobicContact CG2-CZ 4.45Å; V36-V69 CarbonylContact C-O 3.55Å; V36-V69 WeakPolarHBondContact CA-O 3.32Å; V36-L71 HydrophobicContact CG1-CD1 3.67Å; V36-L71 HydrophobicContact CG1-CG 3.77Å; V36-F80 HydrophobicContact CB-CE1 4.01Å; V36-F80 HydrophobicContact CB-CZ 3.9Å; V36-F80 HydrophobicContact CG1-CE1 3.91Å; V36-F80 HydrophobicContact CG1-CE2 4.26Å; V36-F80 HydrophobicContact CG1-CZ 3.58Å; V36-F80 HydrophobicContact CG2-CZ 4.27Å
37	N	89.5	Confident	88.6	Confident	54 Å²	54	63 Å²	63	29%	0.289	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.4	-178	-69.4	-11.2	0	0	0	110.6	V35 Q41 S42 V69 S70 L71	V35-N37 WeakPolarHBondContact CG1-OD1 3.39Å; N37-Q41 CarbonylContact C-O 3.57Å; N37-Q41 VanDerWaalsContact CA-O 3.26Å; N37-Q41 WeakPolarHBondContact CA-O 3.43Å; N37-S42 WeakPolarHBondContact OD1-CB 3.39Å; N37-V69 PolarHBondContact N-O 3.29Å; N37-S70 CarbonylContact O-C 3.58Å; N37-S70 WeakPolarHBondContact O-CA 3.48Å; N37-L71 PolarHBondContact O-N 2.72Å
38	V	91.6	Very high	88.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	116.7	-179	-171.2	0	0	0	0	109	V36 G40 Q41 F43 L71 I74 P77 F80	V36-V38 HydrophobicContact CG1-CG2 4.22Å; V38-G40 PolarHBondContact O-N 2.96Å; V38-G40 VanDerWaalsContact O-N 3.12Å; V38-Q41 PolarHBondContact N-O 3.28Å; V38-Q41 PolarHBondContact O-N 3.21Å; V38-F43 HydrophobicContact CB-CE2 4.16Å; V38-F43 HydrophobicContact CG2-CD2 4.22Å; V38-F43 HydrophobicContact CG2-CE2 4.3Å; V38-L71 HydrophobicContact CG2-CB 4.21Å; V38-L71 HydrophobicContact CG2-CD1 4.32Å; V38-L71 HydrophobicContact CG2-CG 4.5Å; V38-I74 HydrophobicContact CG1-CB 3.88Å; V38-I74 HydrophobicContact CG1-CG2 3.96Å; V38-I74 WeakPolarHBondContact CG1-O 3.41Å; V38-P77 HydrophobicContact CG1-CB 4.38Å; V38-F80 HydrophobicContact CG1-CB 4.38Å; V38-F80 HydrophobicContact CG2-CB 4.12Å; V38-F80 HydrophobicContact CG2-CD1 3.63Å; V38-F80 HydrophobicContact CG2-CD2 4.28Å; V38-F80 HydrophobicContact CG2-CE1 4.12Å; V38-F80 HydrophobicContact CG2-CG 3.72Å
39	Q	87.4	Confident	88.7	Confident	106 Å²	106	58.9 Å²	58.9	50%	0.495	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	39.1	-175.4	-54.1	-56.1	-32.6	0	0	114	Q41 T72 I74	Q39-Q41 VanDerWaalsContact C-N 3.3Å; Q39-Q41 PolarHBondContact O-N 2.91Å; Q39-T72 PolarHBondContact NE2-O 2.87Å; Q39-I74 WeakPolarHBondContact CG-O 3.26Å; Q39-I74 PolarHBondContact NE2-O 3.46Å
40	G	83.1	Confident	88.9	Confident	78 Å²	78	57.7 Å²	57.7	80%	0.804	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	-15	-178.4	0	0	0	0	0	115.8	V38	V38-G40 PolarHBondContact O-N 2.96Å; V38-G40 VanDerWaalsContact O-N 3.12Å
41	Q	89.9	Confident	89	Confident	101 Å²	101	52 Å²	52	47%	0.472	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	142.5	170	-64.4	-169.3	-6.2	0	0	110.6	N37 V38 Q39 F43 P77	N37-Q41 CarbonylContact C-O 3.57Å; N37-Q41 VanDerWaalsContact CA-O 3.26Å; N37-Q41 WeakPolarHBondContact CA-O 3.43Å; V38-Q41 PolarHBondContact N-O 3.28Å; V38-Q41 PolarHBondContact O-N 3.21Å; Q39-Q41 VanDerWaalsContact C-N 3.3Å; Q39-Q41 PolarHBondContact O-N 2.91Å; Q41-F43 HydrophobicContact CB-CE2 3.76Å; Q41-F43 HydrophobicContact CB-CZ 4.09Å; Q41-P77 HydrophobicContact CB-CB 4.41Å; Q41-P77 HydrophobicContact CG-CB 4.44Å; Q41-P77 HydrophobicContact CG-CG 4.49Å; Q41-P77 VanDerWaalsContact OE1-CB 3.31Å
42	S	90.9	Very high	89.1	Confident	82 Å²	82	49.8 Å²	49.8	57%	0.573	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.2	-175.4	65.3	0	0	0	0	112.1	N37	N37-S42 WeakPolarHBondContact OD1-CB 3.39Å
43	F	92.1	Very high	89	Confident	19 Å²	19	49.5 Å²	49.5	8%	0.083	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.5	-173.3	-64.1	-85.4	0	0	0	110.4	V35 V36 V38 Q41 P77 F80 E81 L84	V35-F43 CarbonylContact C-O 3.55Å; V35-F43 WeakPolarHBondContact CA-O 3.37Å; V36-F43 PolarHBondContact N-O 3.38Å; V36-F43 PolarHBondContact O-N 2.99Å; V38-F43 HydrophobicContact CB-CE2 4.16Å; V38-F43 HydrophobicContact CG2-CD2 4.22Å; V38-F43 HydrophobicContact CG2-CE2 4.3Å; Q41-F43 HydrophobicContact CB-CE2 3.76Å; Q41-F43 HydrophobicContact CB-CZ 4.09Å; F43-P77 HydrophobicContact CE2-CB 4.22Å; F43-P77 HydrophobicContact CZ-CB 4.14Å; F43-F80 HydrophobicContact CB-CD1 4.39Å; F43-F80 HydrophobicContact CB-CE1 3.89Å; F43-F80 HydrophobicContact CD1-CD1 4.48Å; F43-F80 AromaticContact CD2-CD1 3.66Å; F43-F80 HydrophobicContact CD2-CD1 3.66Å; F43-F80 AromaticContact CD2-CE1 3.94Å; F43-F80 HydrophobicContact CD2-CE1 3.94Å; F43-F80 HydrophobicContact CE2-CD1 4.02Å; F43-F80 AromaticContact CG-CD1 3.92Å; F43-F80 HydrophobicContact CG-CD1 3.92Å; F43-F80 AromaticContact CG-CE1 3.94Å; F43-F80 HydrophobicContact CG-CE1 3.94Å; F43-E81 HydrophobicContact CE1-CB 3.81Å; F43-E81 HydrophobicContact CE1-CG 4.17Å; F43-E81 HydrophobicContact CZ-CB 4.37Å; F43-L84 HydrophobicContact CB-CD2 3.95Å; F43-L84 HydrophobicContact CD1-CD2 4.25Å; F43-L84 HydrophobicContact CG-CD2 4.42Å
44	R	90.8	Very high	89	Confident	151 Å²	151	46.2 Å²	46.2	57%	0.57	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.8	176.6	-63.3	-177.7	180	-120.9	-4.4	110.5	R26 C32 V35	R26-R44 VanDerWaalsContact CG-O 3.26Å; R26-R44 WeakPolarHBondContact CG-O 3.41Å; C32-R44 HydrophobicContact CB-CB 3.99Å; V35-R44 HydrophobicContact CG2-CG 4.47Å
45	A	91.4	Very high	88.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	174.8	177.7	0	0	0	0	0	112.2	C32 D33 I34 L50 L84	C32-A45 CarbonylContact C-O 3.58Å; C32-A45 VanDerWaalsContact CA-O 3.24Å; C32-A45 WeakPolarHBondContact CA-O 3.42Å; C32-A45 WeakPolarHBondContact CB-O 3.31Å; D33-A45 PolarHBondContact N-O 3.02Å; I34-A45 HydrophobicContact CG2-CB 4.09Å; I34-A45 VanDerWaalsContact CG2-O 3.31Å; I34-A45 WeakPolarHBondContact CG2-O 3.48Å; I34-A45 PolarHBondContact N-O 3.46Å; I34-A45 PolarHBondContact O-N 3.31Å; A45-L50 HydrophobicContact CB-CD1 3.87Å; A45-L50 HydrophobicContact CB-CD2 4.47Å; A45-L50 HydrophobicContact CB-CG 4.14Å; A45-L84 HydrophobicContact CB-CD1 4.07Å
46	H	89.3	Confident	88.8	Confident	15 Å²	15	47.9 Å²	47.9	7%	0.069	28%	0.281	C	S	.	.			trans	-101.9	126.9	170.3	-50.3	85.8	0	0	0	109.9	L22 R30 L31 D33 V48 V49 L50 Y88	L22-H46 PolarHBondContact O-CE1 2.92Å; R30-H46 PolarHBondContact O-NE2 3.17Å; L31-H46 PolarHBondContact O-CD2 2.96Å; L31-H46 VanDerWaalsContact O-CD2 3.25Å; D33-H46 WeakPolarHBondContact OD1-CA 3.48Å; H46-V48 VanDerWaalsContact C-N 3.26Å; H46-V48 PolarHBondContact O-N 3.32Å; H46-V49 HydrophobicContact CB-CG2 4.16Å; H46-V49 PolarHBondContact O-N 3.02Å; H46-L50 PolarHBondContact O-N 3.21Å; H46-Y88 PolarHBondContact N-OH 3.49Å; H46-Y88 AromaticContact ND1-CE1 3.54Å; H46-Y88 AromaticContact ND1-CZ 3.69Å; H46-Y88 PolarHBondContact ND1-OH 3.14Å
47	K	88.7	Confident	88.7	Confident	53 Å²	53	48.1 Å²	48.1	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-55.7	-40.6	178.8	-69.3	176.6	174.2	134.9	0	112.1	D33 I34 V49 L50 A51 M61 M66	D33-K47 VanDerWaalsContact O-CE 3.29Å; D33-K47 WeakPolarHBondContact O-CE 3.36Å; D33-K47 PolarHBondContact O-NZ 3.27Å; D33-K47 WeakPolarHBondContact OD1-CG 3.44Å; D33-K47 PolarHBondContact OD1-N 3Å; D33-K47 WeakPolarHBondContact OD2-CB 3.26Å; D33-K47 VanDerWaalsContact OD2-CD 3.31Å; D33-K47 WeakPolarHBondContact OD2-CD 3.31Å; D33-K47 WeakPolarHBondContact OD2-CG 3.48Å; I34-K47 HydrophobicContact CB-CG 3.8Å; I34-K47 HydrophobicContact CD1-CG 4.26Å; I34-K47 HydrophobicContact CG2-CG 3.75Å; K47-V49 VanDerWaalsContact C-N 3.32Å; K47-V49 PolarHBondContact O-N 3.44Å; K47-L50 PolarHBondContact O-N 2.88Å; K47-A51 VanDerWaalsContact O-CB 3.26Å; K47-A51 WeakPolarHBondContact O-CB 3.41Å; K47-A51 PolarHBondContact O-N 3.5Å; K47-M61 HydrophobicContact CB-SD 3.83Å; K47-M61 HydrophobicContact CD-SD 4.45Å; K47-M61 HydrophobicContact CG-SD 3.7Å; K47-M66 WeakPolarHBondContact CE-O 3.48Å; K47-M66 PolarHBondContact NZ-O 3.24Å
48	V	87.1	Confident	88.6	Confident	119 Å²	119	51.1 Å²	51.1	72%	0.721	29%	0.289	S	S	*	.	H	α-helix	trans	-57.7	-42.8	179.8	-176.3	0	0	0	0	111.9	H46 A52	H46-V48 VanDerWaalsContact C-N 3.26Å; H46-V48 PolarHBondContact O-N 3.32Å; V48-A52 WeakPolarHBondContact O-CB 3.32Å; V48-A52 PolarHBondContact O-N 3.3Å; V48-A52 VanDerWaalsContact O-N 3.07Å
49	V	89	Confident	88.2	Confident	10 Å²	10	54.9 Å²	54.9	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-71.5	-43.2	179.1	-179.7	0	0	0	0	110.5	L22 H46 K47 A52 S53 C87 Y88	L22-V49 HydrophobicContact CD1-CG2 4.06Å; H46-V49 HydrophobicContact CB-CG2 4.16Å; H46-V49 PolarHBondContact O-N 3.02Å; K47-V49 VanDerWaalsContact C-N 3.32Å; K47-V49 PolarHBondContact O-N 3.44Å; V49-A52 PolarHBondContact O-N 3.07Å; V49-S53 PolarHBondContact O-N 3.21Å; V49-S53 VanDerWaalsContact O-N 3.12Å; V49-S53 PolarHBondContact O-OG 3.12Å; V49-C87 HydrophobicContact CG1-CB 4.15Å; V49-C87 WeakPolarHBondContact CG1-O 3.12Å; V49-Y88 HydrophobicContact CB-CE1 4.19Å; V49-Y88 HydrophobicContact CB-CE2 4.15Å; V49-Y88 HydrophobicContact CG1-CD1 4.29Å; V49-Y88 HydrophobicContact CG1-CD2 3.96Å; V49-Y88 HydrophobicContact CG1-CE1 4.03Å; V49-Y88 HydrophobicContact CG1-CE2 3.64Å; V49-Y88 HydrophobicContact CG1-CG 4.26Å; V49-Y88 HydrophobicContact CG2-CE1 3.9Å
50	L	89.3	Confident	87.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-43.5	177.7	-67.8	-173.7	0	0	0	112.5	I34 V36 A45 H46 K47 A52 S53 S54 F57 M61 L84	I34-L50 HydrophobicContact CG2-CD1 4.07Å; V36-L50 HydrophobicContact CG2-CD1 4.01Å; A45-L50 HydrophobicContact CB-CD1 3.87Å; A45-L50 HydrophobicContact CB-CD2 4.47Å; A45-L50 HydrophobicContact CB-CG 4.14Å; H46-L50 PolarHBondContact O-N 3.21Å; K47-L50 PolarHBondContact O-N 2.88Å; L50-A52 VanDerWaalsContact C-N 3.34Å; L50-A52 PolarHBondContact O-N 3.24Å; L50-S53 PolarHBondContact O-N 3.32Å; L50-S54 WeakPolarHBondContact O-CB 3.44Å; L50-S54 PolarHBondContact O-N 3.24Å; L50-F57 HydrophobicContact CB-CB 4.02Å; L50-F57 HydrophobicContact CB-CD2 3.69Å; L50-F57 HydrophobicContact CB-CE2 4.37Å; L50-F57 HydrophobicContact CB-CG 4.05Å; L50-F57 HydrophobicContact CD1-CD2 4.14Å; L50-F57 HydrophobicContact CD1-CE2 4.07Å; L50-F57 HydrophobicContact CD1-CZ 4.38Å; L50-F57 HydrophobicContact CD2-CD2 3.98Å; L50-F57 HydrophobicContact CD2-CE2 3.87Å; L50-F57 HydrophobicContact CG-CD2 4.14Å; L50-F57 HydrophobicContact CG-CE2 4.33Å; L50-M61 HydrophobicContact CB-CE 4.1Å; L50-M61 HydrophobicContact CD1-CE 3.88Å; L50-L84 HydrophobicContact CD2-CD1 3.74Å
51	A	88	Confident	87.4	Confident	26 Å²	26	51.3 Å²	51.3	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-68.9	-28.1	177	0	0	0	0	0	113.5	K47 R58	K47-A51 VanDerWaalsContact O-CB 3.26Å; K47-A51 WeakPolarHBondContact O-CB 3.41Å; K47-A51 PolarHBondContact O-N 3.5Å; A51-R58 HydrophobicContact CB-CB 3.83Å; A51-R58 HydrophobicContact CB-CG 4.18Å
52	A	86.4	Confident	86.1	Confident	88 Å²	88	50.4 Å²	50.4	73%	0.727	28%	0.276	S	S	*	.	H	α-helix	trans	-72.3	-35.9	172.7	0	0	0	0	0	112.3	V48 V49 L50	V48-A52 WeakPolarHBondContact O-CB 3.32Å; V48-A52 PolarHBondContact O-N 3.3Å; V48-A52 VanDerWaalsContact O-N 3.07Å; V49-A52 PolarHBondContact O-N 3.07Å; L50-A52 VanDerWaalsContact C-N 3.34Å; L50-A52 PolarHBondContact O-N 3.24Å
53	S	86.3	Confident	84.6	Confident	26 Å²	26	53.5 Å²	53.5	18%	0.182	29%	0.286	C	S	.	.	H	α-helix	trans	-91.5	-26.8	-176.3	-54.9	0	0	0	0	114.7	V49 L50 C87	V49-S53 PolarHBondContact O-N 3.21Å; V49-S53 VanDerWaalsContact O-N 3.12Å; V49-S53 PolarHBondContact O-OG 3.12Å; L50-S53 PolarHBondContact O-N 3.32Å; S53-C87 WeakPolarHBondContact CB-SG 3.17Å; S53-C87 WeakPolarHBondContact OG-CB 3.46Å
54	S	88.6	Confident	82.8	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.007	31%	0.314	C	S	.	.			trans	-130.9	119.9	-173.2	167.7	0	0	0	0	111.8	L50 Y56 F57 R58 L109	L50-S54 WeakPolarHBondContact O-CB 3.44Å; L50-S54 PolarHBondContact O-N 3.24Å; S54-Y56 VanDerWaalsContact C-N 3.33Å; S54-Y56 PolarHBondContact O-N 3.38Å; S54-Y56 PolarHBondContact OG-N 3.26Å; S54-F57 PolarHBondContact O-N 3.16Å; S54-F57 PolarHBondContact OG-N 3.11Å; S54-R58 PolarHBondContact O-N 3.21Å; S54-L109 WeakPolarHBondContact CB-O 3.28Å; S54-L109 PolarHBondContact OG-O 2.82Å
55	P	87.8	Confident	81.5	Confident	34 Å²	34	58.9 Å²	58.9	22%	0.221	33%	0.328	C	S	.	.	H	α-helix	trans	-56.4	-43.9	170.4	-26.8	36.1	0	0	0	113	F57 R58 D59 Q110	P55-F57 VanDerWaalsContact C-N 3.33Å; P55-F57 PolarHBondContact O-N 2.83Å; P55-R58 PolarHBondContact O-N 3.29Å; P55-D59 WeakPolarHBondContact O-CB 3.43Å; P55-D59 PolarHBondContact O-N 2.74Å; P55-Q110 HydrophobicContact CB-CB 3.96Å; P55-Q110 WeakPolarHBondContact CD-O 3.46Å; P55-Q110 HydrophobicContact CG-CB 4.03Å
56	Y	88	Confident	80.4	Confident	41 Å²	41	63.8 Å²	63.8	16%	0.161	35%	0.352	C	S	.	.	H	α-helix	trans	-53.7	-49	176.3	170.9	-94.7	0	0	0	111.7	S54 H60 L71 F108 L109	S54-Y56 VanDerWaalsContact C-N 3.33Å; S54-Y56 PolarHBondContact O-N 3.38Å; S54-Y56 PolarHBondContact OG-N 3.26Å; Y56-H60 AromaticContact CZ-CD2 3.85Å; Y56-H60 WeakPolarHBondContact O-CB 3.31Å; Y56-H60 PolarHBondContact O-N 3.14Å; Y56-L71 HydrophobicContact CE1-CD2 4.15Å; Y56-F108 HydrophobicContact CD1-CE1 4.1Å; Y56-F108 HydrophobicContact CD2-CE1 4.39Å; Y56-F108 HydrophobicContact CD2-CZ 4.5Å; Y56-F108 AromaticContact CE1-CE1 3.61Å; Y56-F108 HydrophobicContact CE1-CE1 3.61Å; Y56-F108 HydrophobicContact CE1-CZ 4.12Å; Y56-F108 AromaticContact CE2-CE1 3.94Å; Y56-F108 HydrophobicContact CE2-CE1 3.94Å; Y56-F108 HydrophobicContact CE2-CE2 4.49Å; Y56-F108 AromaticContact CE2-CZ 3.75Å; Y56-F108 HydrophobicContact CE2-CZ 3.75Å; Y56-F108 HydrophobicContact CG-CE1 4.47Å; Y56-F108 AromaticContact CZ-CE1 3.52Å; Y56-F108 AromaticContact CZ-CZ 3.53Å; Y56-L109 HydrophobicContact CD1-CD2 3.79Å; Y56-L109 HydrophobicContact CE1-CD2 4.34Å
57	F	87.4	Confident	79.9	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-68.4	-40.5	179.1	-77	-36.9	0	0	0	112.9	V36 L50 S54 P55 D59 M61 L71 F80 L109	V36-F57 HydrophobicContact CG1-CZ 4.45Å; V36-F57 HydrophobicContact CG2-CZ 4.45Å; L50-F57 HydrophobicContact CB-CB 4.02Å; L50-F57 HydrophobicContact CB-CD2 3.69Å; L50-F57 HydrophobicContact CB-CE2 4.37Å; L50-F57 HydrophobicContact CB-CG 4.05Å; L50-F57 HydrophobicContact CD1-CD2 4.14Å; L50-F57 HydrophobicContact CD1-CE2 4.07Å; L50-F57 HydrophobicContact CD1-CZ 4.38Å; L50-F57 HydrophobicContact CD2-CD2 3.98Å; L50-F57 HydrophobicContact CD2-CE2 3.87Å; L50-F57 HydrophobicContact CG-CD2 4.14Å; L50-F57 HydrophobicContact CG-CE2 4.33Å; S54-F57 PolarHBondContact O-N 3.16Å; S54-F57 PolarHBondContact OG-N 3.11Å; P55-F57 VanDerWaalsContact C-N 3.33Å; P55-F57 PolarHBondContact O-N 2.83Å; F57-D59 PolarHBondContact O-N 3.47Å; F57-M61 HydrophobicContact CB-CE 3.5Å; F57-M61 VanDerWaalsContact CB-CE 3.5Å; F57-M61 HydrophobicContact CB-SD 4.35Å; F57-M61 HydrophobicContact CD1-CE 3.32Å; F57-M61 HydrophobicContact CD2-CE 4.43Å; F57-M61 HydrophobicContact CE1-CE 4.09Å; F57-M61 HydrophobicContact CG-CE 3.52Å; F57-M61 WeakPolarHBondContact O-CB 3.32Å; F57-M61 WeakPolarHBondContact O-CG 3.39Å; F57-M61 PolarHBondContact O-N 3.3Å; F57-L71 HydrophobicContact CE1-CD1 4.35Å; F57-L71 HydrophobicContact CE1-CD2 4.48Å; F57-L71 HydrophobicContact CZ-CD1 4.07Å; F57-F80 HydrophobicContact CE2-CE2 4.3Å; F57-F80 AromaticContact CZ-CE2 3.98Å; F57-F80 HydrophobicContact CZ-CE2 3.98Å; F57-F80 HydrophobicContact CZ-CZ 4.18Å; F57-L109 HydrophobicContact CD1-CD2 4.46Å; F57-L109 HydrophobicContact CD2-CD2 4.17Å; F57-L109 HydrophobicContact CE1-CD2 3.98Å; F57-L109 HydrophobicContact CE2-CD1 4.32Å; F57-L109 HydrophobicContact CE2-CD2 3.63Å; F57-L109 HydrophobicContact CZ-CD2 3.54Å
58	R	86.9	Confident	79.7	Confident	117 Å²	117	67.4 Å²	67.4	44%	0.442	38%	0.383	S	S	.	.	H	α-helix	trans	-57.1	-50.6	175.3	-177.1	-172.7	64	-127.9	-10	111.6	A51 S54 P55 S62	A51-R58 HydrophobicContact CB-CB 3.83Å; A51-R58 HydrophobicContact CB-CG 4.18Å; S54-R58 PolarHBondContact O-N 3.21Å; P55-R58 PolarHBondContact O-N 3.29Å; R58-S62 PolarHBondContact O-N 3.19Å; R58-S62 VanDerWaalsContact O-N 3.15Å
59	D	83.9	Confident	79.6	Confident	79 Å²	79	62.3 Å²	62.3	42%	0.422	35%	0.352	S	S	.	.	H	α-helix	trans	-74.9	-38.9	-170.9	-57.6	-12.9	0	0	0	109.7	P55 F57 S62	P55-D59 WeakPolarHBondContact O-CB 3.43Å; P55-D59 PolarHBondContact O-N 2.74Å; F57-D59 PolarHBondContact O-N 3.47Å; D59-S62 WeakPolarHBondContact O-CB 3.21Å; D59-S62 PolarHBondContact O-N 3.15Å; D59-S62 PolarHBondContact O-OG 3.5Å
60	H	75.9	Confident	79.5	Confident	82 Å²	82	65.9 Å²	65.9	38%	0.38	38%	0.378	S	S	.	.	H	α-helix	trans	-75.3	-24.8	177	-160.6	-49.6	0	0	0	114.2	Y56	Y56-H60 AromaticContact CZ-CD2 3.85Å; Y56-H60 WeakPolarHBondContact O-CB 3.31Å; Y56-H60 PolarHBondContact O-N 3.14Å
61	M	76.8	Confident	79.3	Confident	27 Å²	27	66 Å²	66	13%	0.133	38%	0.378	C	S	.	.	H	α-helix	trans	-87.1	-15.1	174.7	-66.4	173	-156.1	0	0	113.3	I34 K47 L50 F57 L63 S64	I34-M61 HydrophobicContact CD1-CE 3.58Å; I34-M61 HydrophobicContact CD1-CG 4.38Å; I34-M61 HydrophobicContact CD1-SD 3.95Å; K47-M61 HydrophobicContact CB-SD 3.83Å; K47-M61 HydrophobicContact CD-SD 4.45Å; K47-M61 HydrophobicContact CG-SD 3.7Å; L50-M61 HydrophobicContact CB-CE 4.1Å; L50-M61 HydrophobicContact CD1-CE 3.88Å; F57-M61 HydrophobicContact CB-CE 3.5Å; F57-M61 VanDerWaalsContact CB-CE 3.5Å; F57-M61 HydrophobicContact CB-SD 4.35Å; F57-M61 HydrophobicContact CD1-CE 3.32Å; F57-M61 HydrophobicContact CD2-CE 4.43Å; F57-M61 HydrophobicContact CE1-CE 4.09Å; F57-M61 HydrophobicContact CG-CE 3.52Å; F57-M61 WeakPolarHBondContact O-CB 3.32Å; F57-M61 WeakPolarHBondContact O-CG 3.39Å; F57-M61 PolarHBondContact O-N 3.3Å; M61-L63 PolarHBondContact O-N 3.4Å; M61-L63 VanDerWaalsContact O-N 3.17Å; M61-S64 PolarHBondContact O-N 2.89Å
62	S	64.6	Low	79	Confident	81 Å²	81	70.2 Å²	70.2	57%	0.566	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.2	-179.5	71.7	0	0	0	0	113.8	R58 D59 S64	R58-S62 PolarHBondContact O-N 3.19Å; R58-S62 VanDerWaalsContact O-N 3.15Å; D59-S62 WeakPolarHBondContact O-CB 3.21Å; D59-S62 PolarHBondContact O-N 3.15Å; D59-S62 PolarHBondContact O-OG 3.5Å; S62-S64 PolarHBondContact O-N 2.9Å
63	L	57.5	Low	78.9	Confident	148 Å²	148	69.1 Å²	69.1	78%	0.775	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	16.4	-177.9	-56.8	177.7	0	0	0	114.2	M61 Q65	M61-L63 PolarHBondContact O-N 3.4Å; M61-L63 VanDerWaalsContact O-N 3.17Å; L63-Q65 PolarHBondContact O-N 3.01Å
64	S	55.1	Low	78.8	Confident	96 Å²	96	68.2 Å²	68.2	67%	0.671	38%	0.379	S	S	*	.	S	Bend	trans	50.3	66.2	150	68.9	0	0	0	0	118.7	M61 S62	M61-S64 PolarHBondContact O-N 2.89Å; S62-S64 PolarHBondContact O-N 2.9Å
65	Q	63.9	Low	78.5	Confident	186 Å²	186	77.5 Å²	77.5	87%	0.869	41%	0.413	S	S	*	.			trans	-167.9	-14.9	135.4	-113.2	-179.8	40.2	0	0	114.7	L63 S67	L63-Q65 PolarHBondContact O-N 3.01Å; Q65-S67 PolarHBondContact O-N 3.26Å; Q65-S67 VanDerWaalsContact O-N 3.14Å
66	M	67.4	Low	78.2	Confident	103 Å²	103	77.8 Å²	77.8	51%	0.507	41%	0.413	S	S	.	.			trans	-51.6	118.8	-176.4	-70.1	-173.3	159.5	0	0	113.4	K47 V69	K47-M66 WeakPolarHBondContact CE-O 3.48Å; K47-M66 PolarHBondContact NZ-O 3.24Å; M66-V69 HydrophobicContact CB-CG2 4.48Å; M66-V69 HydrophobicContact SD-CG2 4.36Å
67	S	80.1	Confident	78.2	Confident	76 Å²	76	77 Å²	77	53%	0.531	41%	0.413	S	S	.	.	S	Bend	trans	-93.5	-18.7	170	50.9	0	0	0	0	112.6	I34 V35 Q65	I34-S67 CarbonylContact C-O 3.48Å; I34-S67 WeakPolarHBondContact CA-O 3.24Å; V35-S67 PolarHBondContact N-O 2.91Å; Q65-S67 PolarHBondContact O-N 3.26Å; Q65-S67 VanDerWaalsContact O-N 3.14Å
68	T	83.1	Confident	78.2	Confident	69 Å²	69	79.1 Å²	79.1	42%	0.423	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139	179.6	-54.1	0	0	0	0	109.8	V35	V35-T68 CarbonylContact O-C 3.51Å; V35-T68 VanDerWaalsContact O-CA 3.26Å; V35-T68 WeakPolarHBondContact O-CA 3.31Å
69	V	86.5	Confident	78.2	Confident	12 Å²	12	73.6 Å²	73.6	7%	0.073	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.6	174.5	170.5	0	0	0	0	109	I34 V35 V36 N37 M66 L71	I34-V69 HydrophobicContact CD1-CB 4.41Å; I34-V69 HydrophobicContact CD1-CG2 3.79Å; V35-V69 PolarHBondContact O-N 2.89Å; V36-V69 CarbonylContact C-O 3.55Å; V36-V69 WeakPolarHBondContact CA-O 3.32Å; N37-V69 PolarHBondContact N-O 3.29Å; M66-V69 HydrophobicContact CB-CG2 4.48Å; M66-V69 HydrophobicContact SD-CG2 4.36Å; V69-L71 HydrophobicContact CG1-CD2 3.88Å
70	S	85.2	Confident	78.5	Confident	85 Å²	85	69.9 Å²	69.9	59%	0.594	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.6	176.9	46.9	0	0	0	0	111.9	N37	N37-S70 CarbonylContact O-C 3.58Å; N37-S70 WeakPolarHBondContact O-CA 3.48Å
71	L	85.5	Confident	79.2	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.016	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	101.2	178.4	-52.3	-174.7	0	0	0	109.9	V36 N37 V38 Y56 F57 V69 I74 F80 F108 L109	V36-L71 HydrophobicContact CG1-CD1 3.67Å; V36-L71 HydrophobicContact CG1-CG 3.77Å; N37-L71 PolarHBondContact O-N 2.72Å; V38-L71 HydrophobicContact CG2-CB 4.21Å; V38-L71 HydrophobicContact CG2-CD1 4.32Å; V38-L71 HydrophobicContact CG2-CG 4.5Å; Y56-L71 HydrophobicContact CE1-CD2 4.15Å; F57-L71 HydrophobicContact CE1-CD1 4.35Å; F57-L71 HydrophobicContact CE1-CD2 4.48Å; F57-L71 HydrophobicContact CZ-CD1 4.07Å; V69-L71 HydrophobicContact CG1-CD2 3.88Å; L71-I74 HydrophobicContact CD1-CD1 3.86Å; L71-F80 HydrophobicContact CD1-CD2 4.13Å; L71-F80 HydrophobicContact CD1-CE2 3.78Å; L71-F80 HydrophobicContact CD1-CZ 4.39Å; L71-F108 HydrophobicContact CD2-CE1 3.85Å; L71-F108 HydrophobicContact CD2-CZ 4.35Å; L71-L109 HydrophobicContact CD1-CD2 4.34Å
72	T	82.9	Confident	79.7	Confident	115 Å²	115	71 Å²	71	71%	0.706	39%	0.393	S	S	*	.	S	Bend	trans	-82.8	-25.2	179.5	52.1	0	0	0	0	113.3	Q39	Q39-T72 PolarHBondContact NE2-O 2.87Å
73	V	83.1	Confident	80.8	Confident	65 Å²	65	67.2 Å²	67.2	39%	0.394	37%	0.366	S	S	.	.	S	Bend	trans	-69.9	-33.8	-176.8	178.1	0	0	0	0	112.4	R75 T104 F108	V73-R75 PolarHBondContact O-N 3.06Å; V73-T104 HydrophobicContact CG1-CG2 4.43Å; V73-F108 HydrophobicContact CB-CD2 3.86Å; V73-F108 HydrophobicContact CB-CE2 4.08Å; V73-F108 HydrophobicContact CB-CG 4.31Å; V73-F108 HydrophobicContact CG1-CB 4.37Å; V73-F108 HydrophobicContact CG1-CD2 3.89Å; V73-F108 HydrophobicContact CG1-CG 4.24Å; V73-F108 HydrophobicContact CG2-CD2 3.76Å; V73-F108 HydrophobicContact CG2-CE2 3.62Å; V73-F108 HydrophobicContact CG2-CZ 4.43Å
74	I	85.1	Confident	82.4	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	33%	0.33	C	S	.	.			trans	-81.7	110.8	179.7	-54.7	178	0	0	0	108.6	V38 Q39 L71 N76 F80 A105	V38-I74 HydrophobicContact CG1-CB 3.88Å; V38-I74 HydrophobicContact CG1-CG2 3.96Å; V38-I74 WeakPolarHBondContact CG1-O 3.41Å; Q39-I74 WeakPolarHBondContact CG-O 3.26Å; Q39-I74 PolarHBondContact NE2-O 3.46Å; L71-I74 HydrophobicContact CD1-CD1 3.86Å; I74-N76 WeakPolarHBondContact CG2-O 3.46Å; I74-F80 HydrophobicContact CD1-CB 4.41Å; I74-F80 HydrophobicContact CD1-CD2 3.73Å; I74-F80 HydrophobicContact CD1-CG 4.45Å; I74-F80 HydrophobicContact CG2-CB 4.31Å; I74-A105 HydrophobicContact CD1-CB 3.87Å; I74-A105 HydrophobicContact CG1-CB 3.91Å; I74-A105 HydrophobicContact CG2-CB 4.31Å
75	R	81.1	Confident	83.8	Confident	196 Å²	196	57.1 Å²	57.1	74%	0.74	31%	0.307	S	S	*	.			trans	-84	-23.9	-178.4	-68	-173.2	178.1	-168.8	-0.7	114.6	V73	V73-R75 PolarHBondContact O-N 3.06Å
76	N	83.2	Confident	84.9	Confident	40 Å²	40	49.8 Å²	49.8	21%	0.214	27%	0.272	C	S	.	.			trans	-110.7	113.6	178.7	-176.5	-12.5	0	0	0	109.7	I74 S78 V79 D98	I74-N76 WeakPolarHBondContact CG2-O 3.46Å; N76-S78 VanDerWaalsContact C-N 3.34Å; N76-S78 PolarHBondContact O-N 2.95Å; N76-S78 VanDerWaalsContact OD1-CB 3.3Å; N76-S78 WeakPolarHBondContact OD1-CB 3.34Å; N76-S78 PolarHBondContact OD1-N 3.49Å; N76-V79 HydrophobicContact CB-CB 4.23Å; N76-V79 HydrophobicContact CB-CG2 3.97Å; N76-V79 PolarHBondContact O-N 3.24Å; N76-D98 PolarHBondContact ND2-OD1 3.02Å; N76-D98 PolarHBondContact ND2-OD2 3.23Å
77	P	86.9	Confident	85.8	Confident	26 Å²	26	45.5 Å²	45.5	17%	0.169	25%	0.252	C	S	.	.	H	α-helix	trans	-72.4	-25.5	-178.4	30.1	-35	0	0	0	113.1	V38 Q41 F43 V79 F80 E81	V38-P77 HydrophobicContact CG1-CB 4.38Å; Q41-P77 HydrophobicContact CB-CB 4.41Å; Q41-P77 HydrophobicContact CG-CB 4.44Å; Q41-P77 HydrophobicContact CG-CG 4.49Å; Q41-P77 VanDerWaalsContact OE1-CB 3.31Å; F43-P77 HydrophobicContact CE2-CB 4.22Å; F43-P77 HydrophobicContact CZ-CB 4.14Å; P77-V79 VanDerWaalsContact C-N 3.3Å; P77-V79 PolarHBondContact O-N 3.05Å; P77-F80 WeakPolarHBondContact O-CB 3.4Å; P77-F80 PolarHBondContact O-N 2.92Å; P77-F80 VanDerWaalsContact O-N 3.11Å; P77-E81 PolarHBondContact O-N 2.94Å
78	S	87.2	Confident	86.1	Confident	50 Å²	50	41.9 Å²	41.9	35%	0.35	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-40.8	174.1	-179.7	0	0	0	0	111.3	N76 F80 E81 Q82	N76-S78 VanDerWaalsContact C-N 3.34Å; N76-S78 PolarHBondContact O-N 2.95Å; N76-S78 VanDerWaalsContact OD1-CB 3.3Å; N76-S78 WeakPolarHBondContact OD1-CB 3.34Å; N76-S78 PolarHBondContact OD1-N 3.49Å; S78-F80 VanDerWaalsContact C-N 3.3Å; S78-F80 PolarHBondContact O-N 3.22Å; S78-E81 PolarHBondContact O-N 2.68Å; S78-E81 VanDerWaalsContact O-N 3.12Å; S78-Q82 WeakPolarHBondContact O-CG 3.43Å; S78-Q82 PolarHBondContact O-N 2.68Å
79	V	87.8	Confident	86	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-37.6	174.7	168	0	0	0	0	111.6	N76 P77 L83 D98 Y102 A105	N76-V79 HydrophobicContact CB-CB 4.23Å; N76-V79 HydrophobicContact CB-CG2 3.97Å; N76-V79 PolarHBondContact O-N 3.24Å; P77-V79 VanDerWaalsContact C-N 3.3Å; P77-V79 PolarHBondContact O-N 3.05Å; V79-L83 HydrophobicContact CG1-CD1 4.22Å; V79-L83 WeakPolarHBondContact O-CB 3.12Å; V79-L83 VanDerWaalsContact O-CG 3.3Å; V79-L83 WeakPolarHBondContact O-CG 3.35Å; V79-L83 PolarHBondContact O-N 2.96Å; V79-D98 HydrophobicContact CG2-CB 4.03Å; V79-Y102 HydrophobicContact CB-CE1 4.35Å; V79-Y102 HydrophobicContact CG1-CD1 3.74Å; V79-Y102 HydrophobicContact CG1-CD2 4.44Å; V79-Y102 HydrophobicContact CG1-CE1 3.94Å; V79-Y102 HydrophobicContact CG1-CG 3.99Å; V79-Y102 HydrophobicContact CG2-CD2 4.18Å; V79-Y102 HydrophobicContact CG2-CE1 4.4Å; V79-Y102 HydrophobicContact CG2-CE2 3.89Å; V79-A105 HydrophobicContact CG1-CB 4.02Å
80	F	90.4	Very high	85.4	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-69.2	-40.7	172.4	-176.6	-102.9	0	0	0	112.2	V36 V38 F43 F57 L71 I74 P77 S78 Q82 L83 L84 L109	V36-F80 HydrophobicContact CB-CE1 4.01Å; V36-F80 HydrophobicContact CB-CZ 3.9Å; V36-F80 HydrophobicContact CG1-CE1 3.91Å; V36-F80 HydrophobicContact CG1-CE2 4.26Å; V36-F80 HydrophobicContact CG1-CZ 3.58Å; V36-F80 HydrophobicContact CG2-CZ 4.27Å; V38-F80 HydrophobicContact CG1-CB 4.38Å; V38-F80 HydrophobicContact CG2-CB 4.12Å; V38-F80 HydrophobicContact CG2-CD1 3.63Å; V38-F80 HydrophobicContact CG2-CD2 4.28Å; V38-F80 HydrophobicContact CG2-CE1 4.12Å; V38-F80 HydrophobicContact CG2-CG 3.72Å; F43-F80 HydrophobicContact CB-CD1 4.39Å; F43-F80 HydrophobicContact CB-CE1 3.89Å; F43-F80 HydrophobicContact CD1-CD1 4.48Å; F43-F80 AromaticContact CD2-CD1 3.66Å; F43-F80 HydrophobicContact CD2-CD1 3.66Å; F43-F80 AromaticContact CD2-CE1 3.94Å; F43-F80 HydrophobicContact CD2-CE1 3.94Å; F43-F80 HydrophobicContact CE2-CD1 4.02Å; F43-F80 AromaticContact CG-CD1 3.92Å; F43-F80 HydrophobicContact CG-CD1 3.92Å; F43-F80 AromaticContact CG-CE1 3.94Å; F43-F80 HydrophobicContact CG-CE1 3.94Å; F57-F80 HydrophobicContact CE2-CE2 4.3Å; F57-F80 AromaticContact CZ-CE2 3.98Å; F57-F80 HydrophobicContact CZ-CE2 3.98Å; F57-F80 HydrophobicContact CZ-CZ 4.18Å; L71-F80 HydrophobicContact CD1-CD2 4.13Å; L71-F80 HydrophobicContact CD1-CE2 3.78Å; L71-F80 HydrophobicContact CD1-CZ 4.39Å; I74-F80 HydrophobicContact CD1-CB 4.41Å; I74-F80 HydrophobicContact CD1-CD2 3.73Å; I74-F80 HydrophobicContact CD1-CG 4.45Å; I74-F80 HydrophobicContact CG2-CB 4.31Å; P77-F80 WeakPolarHBondContact O-CB 3.4Å; P77-F80 PolarHBondContact O-N 2.92Å; P77-F80 VanDerWaalsContact O-N 3.11Å; S78-F80 VanDerWaalsContact C-N 3.3Å; S78-F80 PolarHBondContact O-N 3.22Å; F80-Q82 VanDerWaalsContact C-N 3.32Å; F80-Q82 PolarHBondContact O-N 2.78Å; F80-L83 PolarHBondContact O-N 3.47Å; F80-L84 HydrophobicContact CE1-CB 4.4Å; F80-L84 HydrophobicContact CE1-CD2 4.23Å; F80-L84 WeakPolarHBondContact O-CB 3.41Å; F80-L84 PolarHBondContact O-N 3.31Å; F80-L109 HydrophobicContact CD2-CD1 4.38Å; F80-L109 HydrophobicContact CE2-CD1 4.21Å
81	E	89.1	Confident	84.7	Confident	82 Å²	82	43.4 Å²	43.4	38%	0.383	22%	0.22	S	C	.	.	H	α-helix	trans	-62	-38.5	176.2	-174.9	170.4	-150.9	0	0	112.4	F43 P77 S78 T85	F43-E81 HydrophobicContact CE1-CB 3.81Å; F43-E81 HydrophobicContact CE1-CG 4.17Å; F43-E81 HydrophobicContact CZ-CB 4.37Å; P77-E81 PolarHBondContact O-N 2.94Å; S78-E81 PolarHBondContact O-N 2.68Å; S78-E81 VanDerWaalsContact O-N 3.12Å; E81-T85 VanDerWaalsContact O-CB 3.26Å; E81-T85 WeakPolarHBondContact O-CB 3.43Å; E81-T85 PolarHBondContact O-N 3.4Å; E81-T85 PolarHBondContact O-OG1 2.76Å
82	Q	87.8	Confident	84.3	Confident	49 Å²	49	43.4 Å²	43.4	23%	0.229	22%	0.22	C	C	.	.	H	α-helix	trans	-70.6	-41.3	176.6	-67.9	-64	-34.7	0	0	111.9	S78 F80 T85 F86 L92 Y102	S78-Q82 WeakPolarHBondContact O-CG 3.43Å; S78-Q82 PolarHBondContact O-N 2.68Å; F80-Q82 VanDerWaalsContact C-N 3.32Å; F80-Q82 PolarHBondContact O-N 2.78Å; Q82-T85 PolarHBondContact O-N 3.37Å; Q82-F86 PolarHBondContact O-N 3.35Å; Q82-L92 HydrophobicContact CB-CD1 4.26Å; Q82-L92 WeakPolarHBondContact O-CD1 2.96Å; Q82-Y102 HydrophobicContact CB-CE1 3.94Å; Q82-Y102 WeakPolarHBondContact CB-OH 3.35Å; Q82-Y102 VanDerWaalsContact CG-OH 3.29Å; Q82-Y102 WeakPolarHBondContact CG-OH 3.42Å
83	L	88.3	Confident	83.7	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-42	172.4	-72.4	170.4	0	0	0	111.8	V79 F80 F86 C87 L92 Y102 A105 L109 I114	V79-L83 HydrophobicContact CG1-CD1 4.22Å; V79-L83 WeakPolarHBondContact O-CB 3.12Å; V79-L83 VanDerWaalsContact O-CG 3.3Å; V79-L83 WeakPolarHBondContact O-CG 3.35Å; V79-L83 PolarHBondContact O-N 2.96Å; F80-L83 PolarHBondContact O-N 3.47Å; L83-F86 WeakPolarHBondContact O-CB 3.45Å; L83-F86 PolarHBondContact O-N 3.22Å; L83-C87 PolarHBondContact O-N 2.98Å; L83-C87 VanDerWaalsContact O-N 3.15Å; L83-C87 PolarHBondContact O-SG 3.48Å; L83-L92 HydrophobicContact CD2-CD1 4.13Å; L83-L92 HydrophobicContact CD2-CD2 4.42Å; L83-Y102 HydrophobicContact CD1-CD1 4.48Å; L83-Y102 HydrophobicContact CD2-CD1 4.25Å; L83-Y102 HydrophobicContact CG-CD1 4.14Å; L83-Y102 HydrophobicContact CG-CE1 4.32Å; L83-A105 HydrophobicContact CD1-CB 3.52Å; L83-L109 HydrophobicContact CD1-CD1 4.46Å; L83-I114 HydrophobicContact CD2-CD1 3.53Å
84	L	90	Very high	83.2	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-45.6	173.2	179.1	63.9	0	0	0	110.7	F43 A45 L50 F80 F86 C87 Y88	F43-L84 HydrophobicContact CB-CD2 3.95Å; F43-L84 HydrophobicContact CD1-CD2 4.25Å; F43-L84 HydrophobicContact CG-CD2 4.42Å; A45-L84 HydrophobicContact CB-CD1 4.07Å; L50-L84 HydrophobicContact CD2-CD1 3.74Å; F80-L84 HydrophobicContact CE1-CB 4.4Å; F80-L84 HydrophobicContact CE1-CD2 4.23Å; F80-L84 WeakPolarHBondContact O-CB 3.41Å; F80-L84 PolarHBondContact O-N 3.31Å; L84-F86 VanDerWaalsContact C-N 3.3Å; L84-F86 PolarHBondContact O-N 2.93Å; L84-C87 WeakPolarHBondContact O-CB 3.45Å; L84-C87 PolarHBondContact O-N 2.67Å; L84-C87 VanDerWaalsContact O-N 3.14Å; L84-Y88 HydrophobicContact CD1-CD2 4.29Å; L84-Y88 HydrophobicContact CD1-CE2 3.83Å; L84-Y88 WeakPolarHBondContact O-CD2 3.16Å; L84-Y88 PolarHBondContact O-N 3.15Å
85	T	86	Confident	82.5	Confident	31 Å²	31	40.1 Å²	40.1	19%	0.19	20%	0.195	C	C	.	.	H	α-helix	trans	-62.9	-36.7	177.8	-63.1	0	0	0	0	111.6	E81 Q82 C87 Y88 T89	E81-T85 VanDerWaalsContact O-CB 3.26Å; E81-T85 WeakPolarHBondContact O-CB 3.43Å; E81-T85 PolarHBondContact O-N 3.4Å; E81-T85 PolarHBondContact O-OG1 2.76Å; Q82-T85 PolarHBondContact O-N 3.37Å; T85-C87 PolarHBondContact O-N 3.49Å; T85-Y88 PolarHBondContact O-N 3.17Å; T85-T89 HydrophobicContact CG2-CG2 4.04Å; T85-T89 WeakPolarHBondContact O-CB 3.36Å; T85-T89 WeakPolarHBondContact O-CG2 3.46Å; T85-T89 PolarHBondContact O-N 3.41Å; T85-T89 PolarHBondContact O-OG1 3.11Å
86	F	86.8	Confident	81.9	Confident	31 Å²	31	35.2 Å²	35.2	14%	0.136	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-43.2	171.7	168.3	-98.6	0	0	0	112.4	Q82 L83 L84 Y88 T89 G90 R91 L92 M111 H113 I114 I221	Q82-F86 PolarHBondContact O-N 3.35Å; L83-F86 WeakPolarHBondContact O-CB 3.45Å; L83-F86 PolarHBondContact O-N 3.22Å; L84-F86 VanDerWaalsContact C-N 3.3Å; L84-F86 PolarHBondContact O-N 2.93Å; F86-Y88 PolarHBondContact O-N 3.25Å; F86-Y88 VanDerWaalsContact O-N 3.11Å; F86-T89 PolarHBondContact O-N 3.44Å; F86-G90 WeakPolarHBondContact O-CA 3.29Å; F86-G90 PolarHBondContact O-N 3.2Å; F86-R91 VanDerWaalsContact CA-O 3.31Å; F86-R91 WeakPolarHBondContact CA-O 3.38Å; F86-L92 HydrophobicContact CB-CB 4.1Å; F86-L92 HydrophobicContact CB-CD1 3.94Å; F86-L92 HydrophobicContact CD2-CB 3.81Å; F86-L92 HydrophobicContact CG-CB 4.16Å; F86-M111 HydrophobicContact CD1-CE 4.06Å; F86-M111 HydrophobicContact CE1-CE 4.04Å; F86-H113 AromaticContact CE1-NE2 3.5Å; F86-H113 AromaticContact CZ-NE2 3.82Å; F86-I114 HydrophobicContact CD1-CD1 3.83Å; F86-I114 HydrophobicContact CE1-CD1 3.76Å; F86-I114 HydrophobicContact CE1-CG1 4.08Å; F86-I114 HydrophobicContact CZ-CG1 4.45Å; F86-I221 HydrophobicContact CE2-CG2 4.38Å
87	C	86.6	Confident	81.3	Confident	13 Å²	13	37.3 Å²	37.3	9%	0.088	21%	0.206	C	C	.	.	H	α-helix	trans	-58.1	-26.2	176.4	-59	0	0	0	0	113.7	V49 S53 L83 L84 T85	V49-C87 HydrophobicContact CG1-CB 4.15Å; V49-C87 WeakPolarHBondContact CG1-O 3.12Å; S53-C87 WeakPolarHBondContact CB-SG 3.17Å; S53-C87 WeakPolarHBondContact OG-CB 3.46Å; L83-C87 PolarHBondContact O-N 2.98Å; L83-C87 VanDerWaalsContact O-N 3.15Å; L83-C87 PolarHBondContact O-SG 3.48Å; L84-C87 WeakPolarHBondContact O-CB 3.45Å; L84-C87 PolarHBondContact O-N 2.67Å; L84-C87 VanDerWaalsContact O-N 3.14Å; T85-C87 PolarHBondContact O-N 3.49Å
88	Y	85.4	Confident	80.8	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-101.2	-17.5	-179.6	-76.5	-96.5	0	0	0	114.7	L22 N23 R26 H46 V49 L84 T85 F86	L22-Y88 HydrophobicContact CB-CD1 4.15Å; L22-Y88 HydrophobicContact CB-CE1 4.12Å; N23-Y88 HydrophobicContact CB-CD1 4.15Å; N23-Y88 HydrophobicContact CB-CG 4.4Å; R26-Y88 HydrophobicContact CB-CD1 4.46Å; R26-Y88 HydrophobicContact CB-CE1 4.05Å; R26-Y88 HydrophobicContact CG-CE1 4.48Å; H46-Y88 PolarHBondContact N-OH 3.49Å; H46-Y88 AromaticContact ND1-CE1 3.54Å; H46-Y88 AromaticContact ND1-CZ 3.69Å; H46-Y88 PolarHBondContact ND1-OH 3.14Å; V49-Y88 HydrophobicContact CB-CE1 4.19Å; V49-Y88 HydrophobicContact CB-CE2 4.15Å; V49-Y88 HydrophobicContact CG1-CD1 4.29Å; V49-Y88 HydrophobicContact CG1-CD2 3.96Å; V49-Y88 HydrophobicContact CG1-CE1 4.03Å; V49-Y88 HydrophobicContact CG1-CE2 3.64Å; V49-Y88 HydrophobicContact CG1-CG 4.26Å; V49-Y88 HydrophobicContact CG2-CE1 3.9Å; L84-Y88 HydrophobicContact CD1-CD2 4.29Å; L84-Y88 HydrophobicContact CD1-CE2 3.83Å; L84-Y88 WeakPolarHBondContact O-CD2 3.16Å; L84-Y88 PolarHBondContact O-N 3.15Å; T85-Y88 PolarHBondContact O-N 3.17Å; F86-Y88 PolarHBondContact O-N 3.25Å; F86-Y88 VanDerWaalsContact O-N 3.11Å
89	T	80.6	Confident	80.4	Confident	47 Å²	47	35.8 Å²	35.8	29%	0.288	19%	0.192	S	C	.	.	H	α-helix	trans	-122.8	-15.5	-172.8	63.4	0	0	0	0	114.2	T85 F86 R91	T85-T89 HydrophobicContact CG2-CG2 4.04Å; T85-T89 WeakPolarHBondContact O-CB 3.36Å; T85-T89 WeakPolarHBondContact O-CG2 3.46Å; T85-T89 PolarHBondContact O-N 3.41Å; T85-T89 PolarHBondContact O-OG1 3.11Å; F86-T89 PolarHBondContact O-N 3.44Å; T89-R91 PolarHBondContact O-N 3.19Å; T89-R91 PolarHBondContact OG1-N 3.43Å; T89-R91 VanDerWaalsContact OG1-N 3.16Å; T89-R91 PolarHBondContact OG1-O 2.91Å
90	G	73.8	Confident	79.8	Confident	13 Å²	13	38.7 Å²	38.7	13%	0.134	21%	0.207	C	C	.	.	S	Bend	trans	64.9	11.8	-168.1	0	0	0	0	0	114	F86 N222	F86-G90 WeakPolarHBondContact O-CA 3.29Å; F86-G90 PolarHBondContact O-N 3.2Å; G90-N222 CarbonylContact O-C 3.56Å
91	R	71.1	Confident	79.5	Confident	137 Å²	137	40.6 Å²	40.6	52%	0.517	22%	0.221	S	C	.	.			trans	-118.8	127.1	179.2	-57.5	-174	-169.7	-158.7	3.2	110.3	F86 T89 I221	F86-R91 VanDerWaalsContact CA-O 3.31Å; F86-R91 WeakPolarHBondContact CA-O 3.38Å; T89-R91 PolarHBondContact O-N 3.19Å; T89-R91 PolarHBondContact OG1-N 3.43Å; T89-R91 VanDerWaalsContact OG1-N 3.16Å; T89-R91 PolarHBondContact OG1-O 2.91Å; R91-I221 WeakPolarHBondContact CA-O 3.41Å
92	L	77.8	Confident	79.2	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.203	C	C	.	.			trans	-116	132.7	173.9	-172	64.1	0	0	0	108	Q82 L83 F86 L94 Y102 I114 R220 I221	Q82-L92 HydrophobicContact CB-CD1 4.26Å; Q82-L92 WeakPolarHBondContact O-CD1 2.96Å; L83-L92 HydrophobicContact CD2-CD1 4.13Å; L83-L92 HydrophobicContact CD2-CD2 4.42Å; F86-L92 HydrophobicContact CB-CB 4.1Å; F86-L92 HydrophobicContact CB-CD1 3.94Å; F86-L92 HydrophobicContact CD2-CB 3.81Å; F86-L92 HydrophobicContact CG-CB 4.16Å; L92-L94 HydrophobicContact CD2-CD2 3.76Å; L92-L94 HydrophobicContact CD2-CG 4.18Å; L92-L94 HydrophobicContact CG-CD2 3.93Å; L92-L94 HydrophobicContact CG-CG 4.24Å; L92-Y102 HydrophobicContact CD1-CE1 4.06Å; L92-I114 HydrophobicContact CD2-CD1 4.45Å; L92-I114 HydrophobicContact CD2-CG2 3.8Å; L92-R220 WeakPolarHBondContact O-CA 3.35Å; L92-I221 HydrophobicContact CB-CG2 3.82Å; L92-I221 PolarHBondContact O-N 3.38Å
93	C	70.1	Confident	79	Confident	27 Å²	27	35.6 Å²	35.6	18%	0.182	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.2	173.1	-59	0	0	0	0	108.3	Y102 I218 L219 R220	C93-Y102 PolarHBondContact O-OH 3.01Å; C93-I218 HydrophobicContact CB-CG2 4Å; C93-L219 WeakPolarHBondContact CA-O 3.42Å; C93-R220 PolarHBondContact SG-NE 3.45Å
94	L	71.7	Confident	78.9	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.5	179.3	-66.7	-177.8	0	0	0	111.1	L92 Y102 C118 L219 W227	L92-L94 HydrophobicContact CD2-CD2 3.76Å; L92-L94 HydrophobicContact CD2-CG 4.18Å; L92-L94 HydrophobicContact CG-CD2 3.93Å; L92-L94 HydrophobicContact CG-CG 4.24Å; L94-Y102 HydrophobicContact CD2-CD1 3.61Å; L94-Y102 HydrophobicContact CD2-CD2 3.59Å; L94-Y102 HydrophobicContact CD2-CE1 3.81Å; L94-Y102 HydrophobicContact CD2-CE2 3.78Å; L94-Y102 HydrophobicContact CD2-CG 3.52Å; L94-C118 VanDerWaalsContact CD1-SG 3.59Å; L94-L219 HydrophobicContact CB-CB 4.47Å; L94-L219 PolarHBondContact N-O 2.72Å; L94-L219 PolarHBondContact O-N 2.93Å; L94-W227 HydrophobicContact CD1-CH2 3.6Å; L94-W227 HydrophobicContact CD1-CZ3 3.95Å; L94-W227 HydrophobicContact CG-CH2 4.3Å; L94-W227 HydrophobicContact CG-CZ3 4.38Å
95	Q	70.8	Confident	78.9	Confident	86 Å²	86	38.7 Å²	38.7	40%	0.402	22%	0.217	S	C	.	.			trans	-92.8	134.7	160.8	-72.1	-179.7	-68.3	0	0	108.8	A97 D98 E216	Q95-A97 VanDerWaalsContact C-N 3.28Å; Q95-A97 PolarHBondContact O-N 3.18Å; Q95-D98 PolarHBondContact O-N 2.89Å; Q95-E216 PolarHBondContact NE2-OE2 3.01Å
96	L	68	Low	79	Confident	93 Å²	93	37.2 Å²	37.2	49%	0.487	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-69.1	-27.6	-172.7	-157.1	69.8	0	0	0	112.5	D98 I99 I125	L96-D98 VanDerWaalsContact C-N 3.34Å; L96-D98 PolarHBondContact O-N 3.09Å; L96-I99 HydrophobicContact CD1-CD1 4.18Å; L96-I99 VanDerWaalsContact O-CG2 3.28Å; L96-I99 WeakPolarHBondContact O-CG2 3.5Å; L96-I99 PolarHBondContact O-N 2.84Å; L96-I125 HydrophobicContact CD1-CD1 3.96Å
97	A	72.3	Confident	79	Confident	84 Å²	84	39.1 Å²	39.1	69%	0.694	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-62	-37.7	174.5	0	0	0	0	0	113.1	Q95	Q95-A97 VanDerWaalsContact C-N 3.28Å; Q95-A97 PolarHBondContact O-N 3.18Å
98	D	75.9	Confident	79.1	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.16	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-90.8	4.8	-176.6	-108.6	-49.5	0	0	0	113.5	N76 V79 Q95 L96 I100 S101 Y102	N76-D98 PolarHBondContact ND2-OD1 3.02Å; N76-D98 PolarHBondContact ND2-OD2 3.23Å; V79-D98 HydrophobicContact CG2-CB 4.03Å; Q95-D98 PolarHBondContact O-N 2.89Å; L96-D98 VanDerWaalsContact C-N 3.34Å; L96-D98 PolarHBondContact O-N 3.09Å; D98-I100 PolarHBondContact O-N 3.3Å; D98-I100 VanDerWaalsContact O-N 3.11Å; D98-S101 WeakPolarHBondContact O-CA 3.48Å; D98-S101 WeakPolarHBondContact O-CB 3.21Å; D98-S101 PolarHBondContact O-N 3.43Å; D98-S101 WeakPolarHBondContact OD1-CB 3.46Å; D98-S101 PolarHBondContact OD1-OG 3.01Å; D98-Y102 HydrophobicContact CB-CD2 3.94Å; D98-Y102 HydrophobicContact CB-CE2 3.81Å; D98-Y102 WeakPolarHBondContact O-CD2 3.33Å; D98-Y102 PolarHBondContact O-N 2.92Å
99	I	77.6	Confident	79.2	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.072	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-28.9	-170.2	-162	156	0	0	0	113.5	L96 Y102 L103 L122	L96-I99 HydrophobicContact CD1-CD1 4.18Å; L96-I99 VanDerWaalsContact O-CG2 3.28Å; L96-I99 WeakPolarHBondContact O-CG2 3.5Å; L96-I99 PolarHBondContact O-N 2.84Å; I99-Y102 PolarHBondContact O-N 2.64Å; I99-L103 HydrophobicContact CG1-CD1 4.4Å; I99-L103 WeakPolarHBondContact O-CB 3.2Å; I99-L103 VanDerWaalsContact O-CG 3.29Å; I99-L103 WeakPolarHBondContact O-CG 3.26Å; I99-L103 PolarHBondContact O-N 3.19Å; I99-L122 HydrophobicContact CD1-CD1 3.95Å; I99-L122 HydrophobicContact CD1-CD2 3.96Å; I99-L122 HydrophobicContact CD1-CG 3.84Å; I99-L122 HydrophobicContact CG1-CD1 4.33Å
100	I	76.6	Confident	79.6	Confident	61 Å²	61	43.7 Å²	43.7	31%	0.313	24%	0.241	S	C	.	.	H	α-helix	trans	-67	-42.8	172.4	-59	177.4	0	0	0	110.7	D98 L103 T104 M408	D98-I100 PolarHBondContact O-N 3.3Å; D98-I100 VanDerWaalsContact O-N 3.11Å; I100-L103 PolarHBondContact O-N 2.89Å; I100-T104 WeakPolarHBondContact O-CB 3.25Å; I100-T104 PolarHBondContact O-N 3.3Å; I100-T104 PolarHBondContact O-OG1 3.14Å; I100-M408 HydrophobicContact CD1-CE 3.88Å; I100-M408 HydrophobicContact CD1-SD 4.28Å
101	S	83.3	Confident	80.1	Confident	42 Å²	42	43.2 Å²	43.2	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-46.1	174.1	-47.7	0	0	0	0	111	D98 T104 A105	D98-S101 WeakPolarHBondContact O-CA 3.48Å; D98-S101 WeakPolarHBondContact O-CB 3.21Å; D98-S101 PolarHBondContact O-N 3.43Å; D98-S101 WeakPolarHBondContact OD1-CB 3.46Å; D98-S101 PolarHBondContact OD1-OG 3.01Å; S101-T104 PolarHBondContact O-N 2.85Å; S101-A105 WeakPolarHBondContact O-CB 3.43Å; S101-A105 PolarHBondContact O-N 3.46Å
102	Y	83.3	Confident	80.5	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-48	176.6	-81.1	-74.5	0	0	0	112.5	V79 Q82 L83 L92 C93 L94 D98 I99 T104 A105 A106	V79-Y102 HydrophobicContact CB-CE1 4.35Å; V79-Y102 HydrophobicContact CG1-CD1 3.74Å; V79-Y102 HydrophobicContact CG1-CD2 4.44Å; V79-Y102 HydrophobicContact CG1-CE1 3.94Å; V79-Y102 HydrophobicContact CG1-CG 3.99Å; V79-Y102 HydrophobicContact CG2-CD2 4.18Å; V79-Y102 HydrophobicContact CG2-CE1 4.4Å; V79-Y102 HydrophobicContact CG2-CE2 3.89Å; Q82-Y102 HydrophobicContact CB-CE1 3.94Å; Q82-Y102 WeakPolarHBondContact CB-OH 3.35Å; Q82-Y102 VanDerWaalsContact CG-OH 3.29Å; Q82-Y102 WeakPolarHBondContact CG-OH 3.42Å; L83-Y102 HydrophobicContact CD1-CD1 4.48Å; L83-Y102 HydrophobicContact CD2-CD1 4.25Å; L83-Y102 HydrophobicContact CG-CD1 4.14Å; L83-Y102 HydrophobicContact CG-CE1 4.32Å; L92-Y102 HydrophobicContact CD1-CE1 4.06Å; C93-Y102 PolarHBondContact O-OH 3.01Å; L94-Y102 HydrophobicContact CD2-CD1 3.61Å; L94-Y102 HydrophobicContact CD2-CD2 3.59Å; L94-Y102 HydrophobicContact CD2-CE1 3.81Å; L94-Y102 HydrophobicContact CD2-CE2 3.78Å; L94-Y102 HydrophobicContact CD2-CG 3.52Å; D98-Y102 HydrophobicContact CB-CD2 3.94Å; D98-Y102 HydrophobicContact CB-CE2 3.81Å; D98-Y102 WeakPolarHBondContact O-CD2 3.33Å; D98-Y102 PolarHBondContact O-N 2.92Å; I99-Y102 PolarHBondContact O-N 2.64Å; Y102-T104 VanDerWaalsContact C-N 3.32Å; Y102-T104 PolarHBondContact O-N 2.9Å; Y102-A105 PolarHBondContact O-N 3Å; Y102-A106 WeakPolarHBondContact O-CB 3.35Å; Y102-A106 PolarHBondContact O-N 3.45Å
103	L	83.4	Confident	80.4	Confident	22 Å²	22	46 Å²	46	12%	0.115	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-40.3	177.7	-74.3	168.7	0	0	0	111.7	I99 I100 S107 I115 C118 L122 Y389	I99-L103 HydrophobicContact CG1-CD1 4.4Å; I99-L103 WeakPolarHBondContact O-CB 3.2Å; I99-L103 VanDerWaalsContact O-CG 3.29Å; I99-L103 WeakPolarHBondContact O-CG 3.26Å; I99-L103 PolarHBondContact O-N 3.19Å; I100-L103 PolarHBondContact O-N 2.89Å; L103-S107 WeakPolarHBondContact O-CB 3.44Å; L103-S107 PolarHBondContact O-N 2.84Å; L103-I115 HydrophobicContact CD2-CG2 4.06Å; L103-C118 HydrophobicContact CD2-CB 3.66Å; L103-C118 HydrophobicContact CG-CB 4.36Å; L103-L122 HydrophobicContact CD1-CD1 4.17Å; L103-Y389 HydrophobicContact CD1-CE1 4.12Å
104	T	86.6	Confident	80.8	Confident	68 Å²	68	45.1 Å²	45.1	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-65.6	-46.8	177.4	-54.8	0	0	0	0	111.3	V73 I100 S101 Y102 S107 F108	V73-T104 HydrophobicContact CG1-CG2 4.43Å; I100-T104 WeakPolarHBondContact O-CB 3.25Å; I100-T104 PolarHBondContact O-N 3.3Å; I100-T104 PolarHBondContact O-OG1 3.14Å; S101-T104 PolarHBondContact O-N 2.85Å; Y102-T104 VanDerWaalsContact C-N 3.32Å; Y102-T104 PolarHBondContact O-N 2.9Å; T104-S107 PolarHBondContact O-N 2.79Å; T104-F108 WeakPolarHBondContact O-CB 3.32Å; T104-F108 PolarHBondContact O-N 3.35Å
105	A	88.3	Confident	81.2	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-67.9	-42.7	178.9	0	0	0	0	0	112.5	I74 V79 L83 S101 Y102 F108 L109	I74-A105 HydrophobicContact CD1-CB 3.87Å; I74-A105 HydrophobicContact CG1-CB 3.91Å; I74-A105 HydrophobicContact CG2-CB 4.31Å; V79-A105 HydrophobicContact CG1-CB 4.02Å; L83-A105 HydrophobicContact CD1-CB 3.52Å; S101-A105 WeakPolarHBondContact O-CB 3.43Å; S101-A105 PolarHBondContact O-N 3.46Å; Y102-A105 PolarHBondContact O-N 3Å; A105-F108 PolarHBondContact O-N 3.07Å; A105-L109 WeakPolarHBondContact O-CB 3.28Å; A105-L109 WeakPolarHBondContact O-CG 3.5Å; A105-L109 PolarHBondContact O-N 3.32Å
106	A	88.1	Confident	81.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-36.9	176.4	0	0	0	0	0	112.3	Y102 L109 Q110 M111 I114 I115	Y102-A106 WeakPolarHBondContact O-CB 3.35Å; Y102-A106 PolarHBondContact O-N 3.45Å; A106-L109 CarbonylContact O-C 3.5Å; A106-Q110 PolarHBondContact O-N 2.88Å; A106-M111 HydrophobicContact CB-CB 4.41Å; A106-M111 PolarHBondContact O-N 3.27Å; A106-I114 HydrophobicContact CB-CB 4.22Å; A106-I114 HydrophobicContact CB-CG2 4.19Å; A106-I115 HydrophobicContact CB-CG1 3.88Å
107	S	88.1	Confident	81.5	Confident	72 Å²	72	46.3 Å²	46.3	50%	0.503	25%	0.248	S	C	.	.	H	α-helix	trans	-63.4	-48.8	172.5	-177.4	0	0	0	0	111.7	L103 T104 L109 Q110	L103-S107 WeakPolarHBondContact O-CB 3.44Å; L103-S107 PolarHBondContact O-N 2.84Å; T104-S107 PolarHBondContact O-N 2.79Å; S107-L109 VanDerWaalsContact C-N 3.35Å; S107-L109 PolarHBondContact O-N 2.96Å; S107-Q110 PolarHBondContact O-N 3.49Å
108	F	88.8	Confident	81.5	Confident	56 Å²	56	42.3 Å²	42.3	25%	0.246	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-43.4	175.9	179.8	-88.6	0	0	0	112.5	Y56 L71 V73 T104 A105 Q110	Y56-F108 HydrophobicContact CD1-CE1 4.1Å; Y56-F108 HydrophobicContact CD2-CE1 4.39Å; Y56-F108 HydrophobicContact CD2-CZ 4.5Å; Y56-F108 AromaticContact CE1-CE1 3.61Å; Y56-F108 HydrophobicContact CE1-CE1 3.61Å; Y56-F108 HydrophobicContact CE1-CZ 4.12Å; Y56-F108 AromaticContact CE2-CE1 3.94Å; Y56-F108 HydrophobicContact CE2-CE1 3.94Å; Y56-F108 HydrophobicContact CE2-CE2 4.49Å; Y56-F108 AromaticContact CE2-CZ 3.75Å; Y56-F108 HydrophobicContact CE2-CZ 3.75Å; Y56-F108 HydrophobicContact CG-CE1 4.47Å; Y56-F108 AromaticContact CZ-CE1 3.52Å; Y56-F108 AromaticContact CZ-CZ 3.53Å; L71-F108 HydrophobicContact CD2-CE1 3.85Å; L71-F108 HydrophobicContact CD2-CZ 4.35Å; V73-F108 HydrophobicContact CB-CD2 3.86Å; V73-F108 HydrophobicContact CB-CE2 4.08Å; V73-F108 HydrophobicContact CB-CG 4.31Å; V73-F108 HydrophobicContact CG1-CB 4.37Å; V73-F108 HydrophobicContact CG1-CD2 3.89Å; V73-F108 HydrophobicContact CG1-CG 4.24Å; V73-F108 HydrophobicContact CG2-CD2 3.76Å; V73-F108 HydrophobicContact CG2-CE2 3.62Å; V73-F108 HydrophobicContact CG2-CZ 4.43Å; T104-F108 WeakPolarHBondContact O-CB 3.32Å; T104-F108 PolarHBondContact O-N 3.35Å; A105-F108 PolarHBondContact O-N 3.07Å; F108-Q110 PolarHBondContact O-N 2.96Å
109	L	87.9	Confident	81.4	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.016	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	2.2	176.4	-63.6	177.7	0	0	0	113.7	S54 Y56 F57 L71 F80 L83 A105 A106 S107 M111	S54-L109 WeakPolarHBondContact CB-O 3.28Å; S54-L109 PolarHBondContact OG-O 2.82Å; Y56-L109 HydrophobicContact CD1-CD2 3.79Å; Y56-L109 HydrophobicContact CE1-CD2 4.34Å; F57-L109 HydrophobicContact CD1-CD2 4.46Å; F57-L109 HydrophobicContact CD2-CD2 4.17Å; F57-L109 HydrophobicContact CE1-CD2 3.98Å; F57-L109 HydrophobicContact CE2-CD1 4.32Å; F57-L109 HydrophobicContact CE2-CD2 3.63Å; F57-L109 HydrophobicContact CZ-CD2 3.54Å; L71-L109 HydrophobicContact CD1-CD2 4.34Å; F80-L109 HydrophobicContact CD2-CD1 4.38Å; F80-L109 HydrophobicContact CE2-CD1 4.21Å; L83-L109 HydrophobicContact CD1-CD1 4.46Å; A105-L109 WeakPolarHBondContact O-CB 3.28Å; A105-L109 WeakPolarHBondContact O-CG 3.5Å; A105-L109 PolarHBondContact O-N 3.32Å; A106-L109 CarbonylContact O-C 3.5Å; S107-L109 VanDerWaalsContact C-N 3.35Å; S107-L109 PolarHBondContact O-N 2.96Å; L109-M111 HydrophobicContact CB-CG 3.85Å; L109-M111 HydrophobicContact CB-SD 4.07Å; L109-M111 HydrophobicContact CD1-SD 4.24Å; L109-M111 PolarHBondContact O-N 3.27Å
110	Q	87.8	Confident	81.1	Confident	98 Å²	98	46.8 Å²	46.8	46%	0.458	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	30.6	179.9	-56.6	178.7	17.4	0	0	114.2	P55 A106 S107 F108 Q112	P55-Q110 HydrophobicContact CB-CB 3.96Å; P55-Q110 WeakPolarHBondContact CD-O 3.46Å; P55-Q110 HydrophobicContact CG-CB 4.03Å; A106-Q110 PolarHBondContact O-N 2.88Å; S107-Q110 PolarHBondContact O-N 3.49Å; F108-Q110 PolarHBondContact O-N 2.96Å; Q110-Q112 VanDerWaalsContact C-N 3.26Å; Q110-Q112 PolarHBondContact O-N 2.77Å
111	M	84.8	Confident	80.5	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.231	C	C	.	.			trans	-85.2	62.4	-178.3	-59.1	-175.3	79.5	0	0	111	F86 A106 L109 H113 I114 I115	F86-M111 HydrophobicContact CD1-CE 4.06Å; F86-M111 HydrophobicContact CE1-CE 4.04Å; A106-M111 HydrophobicContact CB-CB 4.41Å; A106-M111 PolarHBondContact O-N 3.27Å; L109-M111 HydrophobicContact CB-CG 3.85Å; L109-M111 HydrophobicContact CB-SD 4.07Å; L109-M111 HydrophobicContact CD1-SD 4.24Å; L109-M111 PolarHBondContact O-N 3.27Å; M111-H113 PolarHBondContact O-N 2.8Å; M111-H113 VanDerWaalsContact O-N 3.09Å; M111-I114 HydrophobicContact CB-CD1 3.93Å; M111-I114 HydrophobicContact CB-CG1 4.13Å; M111-I114 HydrophobicContact CE-CD1 3.68Å; M111-I114 WeakPolarHBondContact O-CB 3.46Å; M111-I114 PolarHBondContact O-N 2.89Å; M111-I114 HydrophobicContact SD-CD1 3.95Å; M111-I115 PolarHBondContact O-N 3.17Å
112	Q	78.5	Confident	79.7	Confident	103 Å²	103	44.8 Å²	44.8	48%	0.481	23%	0.225	S	C	.	.	H	α-helix	trans	-51.5	-38.6	-170.5	-166.9	63.6	42.3	0	0	113.9	Q110 I114 I115 D116	Q110-Q112 VanDerWaalsContact C-N 3.26Å; Q110-Q112 PolarHBondContact O-N 2.77Å; Q112-I114 PolarHBondContact O-N 3.29Å; Q112-I115 WeakPolarHBondContact O-CB 3.2Å; Q112-I115 PolarHBondContact O-N 3.06Å; Q112-D116 PolarHBondContact NE2-OD1 3.5Å; Q112-D116 VanDerWaalsContact O-CG 3.26Å; Q112-D116 PolarHBondContact O-N 3.19Å
113	H	77.3	Confident	79	Confident	97 Å²	97	50.3 Å²	50.3	45%	0.449	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-22.9	178	60.7	-94.6	0	0	0	114.3	F86 M111 R117	F86-H113 AromaticContact CE1-NE2 3.5Å; F86-H113 AromaticContact CZ-NE2 3.82Å; M111-H113 PolarHBondContact O-N 2.8Å; M111-H113 VanDerWaalsContact O-N 3.09Å; H113-R117 WeakPolarHBondContact O-CG 3.38Å
114	I	78.8	Confident	77.9	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-78.8	-47.4	170.5	-56.7	-176.7	0	0	0	109.2	L83 F86 L92 A106 M111 Q112 D116 R117 C118	L83-I114 HydrophobicContact CD2-CD1 3.53Å; F86-I114 HydrophobicContact CD1-CD1 3.83Å; F86-I114 HydrophobicContact CE1-CD1 3.76Å; F86-I114 HydrophobicContact CE1-CG1 4.08Å; F86-I114 HydrophobicContact CZ-CG1 4.45Å; L92-I114 HydrophobicContact CD2-CD1 4.45Å; L92-I114 HydrophobicContact CD2-CG2 3.8Å; A106-I114 HydrophobicContact CB-CB 4.22Å; A106-I114 HydrophobicContact CB-CG2 4.19Å; M111-I114 HydrophobicContact CB-CD1 3.93Å; M111-I114 HydrophobicContact CB-CG1 4.13Å; M111-I114 HydrophobicContact CE-CD1 3.68Å; M111-I114 WeakPolarHBondContact O-CB 3.46Å; M111-I114 PolarHBondContact O-N 2.89Å; M111-I114 HydrophobicContact SD-CD1 3.95Å; Q112-I114 PolarHBondContact O-N 3.29Å; I114-D116 PolarHBondContact O-N 2.94Å; I114-R117 PolarHBondContact O-N 3.02Å; I114-C118 WeakPolarHBondContact O-CB 3.32Å; I114-C118 PolarHBondContact O-N 3.33Å; I114-C118 PolarHBondContact O-SG 3.28Å
115	I	78.5	Confident	76.6	Confident	26 Å²	26	50 Å²	50	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-55.6	-52.5	-178.6	-53	174.5	0	0	0	110.3	L103 A106 M111 Q112 R117 C118 T119	L103-I115 HydrophobicContact CD2-CG2 4.06Å; A106-I115 HydrophobicContact CB-CG1 3.88Å; M111-I115 PolarHBondContact O-N 3.17Å; Q112-I115 WeakPolarHBondContact O-CB 3.2Å; Q112-I115 PolarHBondContact O-N 3.06Å; I115-R117 PolarHBondContact O-N 2.99Å; I115-C118 PolarHBondContact O-N 3.25Å; I115-T119 PolarHBondContact O-N 2.86Å; I115-T119 PolarHBondContact O-OG1 3.4Å
116	D	74.8	Confident	74.9	Confident	69 Å²	69	53.9 Å²	53.9	37%	0.369	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-27.1	-177.3	-61.2	-18.5	0	0	0	113.2	Q112 I114 T119 Q120	Q112-D116 PolarHBondContact NE2-OD1 3.5Å; Q112-D116 VanDerWaalsContact O-CG 3.26Å; Q112-D116 PolarHBondContact O-N 3.19Å; I114-D116 PolarHBondContact O-N 2.94Å; D116-T119 PolarHBondContact O-OG1 2.94Å; D116-T119 VanDerWaalsContact O-OG1 3.11Å; D116-Q120 WeakPolarHBondContact O-CG 3.33Å; D116-Q120 PolarHBondContact O-N 3.01Å; D116-Q120 PolarHBondContact O-NE2 3.23Å; D116-Q120 VanDerWaalsContact O-NE2 3.14Å
117	R	70.8	Confident	73.1	Confident	112 Å²	112	59.1 Å²	59.1	42%	0.423	30%	0.298	S	S	.	.	H	α-helix	trans	-88.8	-35.3	177.1	-63.9	-55.6	-166.2	172.7	6.1	112.2	H113 I114 I115 T119 Q120 I121 W227	H113-R117 WeakPolarHBondContact O-CG 3.38Å; I114-R117 PolarHBondContact O-N 3.02Å; I115-R117 PolarHBondContact O-N 2.99Å; R117-T119 VanDerWaalsContact C-N 3.34Å; R117-Q120 VanDerWaalsContact CD-OE1 3.24Å; R117-Q120 PolarHBondContact O-N 3.15Å; R117-I121 WeakPolarHBondContact O-CG1 3.44Å; R117-I121 PolarHBondContact O-N 3.07Å; R117-W227 HydrophobicContact CB-CZ2 4.02Å
118	C	71.6	Confident	71.2	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-40	171.4	-71.4	0	0	0	0	111.9	L94 L103 I114 I115 I121 L122	L94-C118 VanDerWaalsContact CD1-SG 3.59Å; L103-C118 HydrophobicContact CD2-CB 3.66Å; L103-C118 HydrophobicContact CG-CB 4.36Å; I114-C118 WeakPolarHBondContact O-CB 3.32Å; I114-C118 PolarHBondContact O-N 3.33Å; I114-C118 PolarHBondContact O-SG 3.28Å; I115-C118 PolarHBondContact O-N 3.25Å; C118-I121 PolarHBondContact O-N 3.16Å; C118-L122 WeakPolarHBondContact O-CG 3.36Å; C118-L122 PolarHBondContact O-N 2.84Å; C118-L122 VanDerWaalsContact O-N 3.1Å
119	T	74.8	Confident	69.5	Low	47 Å²	47	64.2 Å²	64.2	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-46.2	174.7	51.9	0	0	0	0	111.8	I115 D116 R117 I121 L122 E123	I115-T119 PolarHBondContact O-N 2.86Å; I115-T119 PolarHBondContact O-OG1 3.4Å; D116-T119 PolarHBondContact O-OG1 2.94Å; D116-T119 VanDerWaalsContact O-OG1 3.11Å; R117-T119 VanDerWaalsContact C-N 3.34Å; T119-I121 PolarHBondContact O-N 3.41Å; T119-L122 PolarHBondContact O-N 2.91Å; T119-E123 WeakPolarHBondContact O-CG 3.33Å; T119-E123 PolarHBondContact O-N 3Å
120	Q	70.8	Confident	67.6	Low	91 Å²	91	66.6 Å²	66.6	43%	0.425	33%	0.331	S	S	.	.	H	α-helix	trans	-58	-34	174.9	-74.9	165.3	24	0	0	113.1	D116 R117 G124	D116-Q120 WeakPolarHBondContact O-CG 3.33Å; D116-Q120 PolarHBondContact O-N 3.01Å; D116-Q120 PolarHBondContact O-NE2 3.23Å; D116-Q120 VanDerWaalsContact O-NE2 3.14Å; R117-Q120 VanDerWaalsContact CD-OE1 3.24Å; R117-Q120 PolarHBondContact O-N 3.15Å; Q120-G124 PolarHBondContact O-N 3.33Å
121	I	64.9	Low	65.5	Low	28 Å²	28	66.8 Å²	66.8	14%	0.144	34%	0.335	C	S	.	.	H	α-helix	trans	-68.7	-45.1	173.3	-74.6	168	0	0	0	111.4	R117 C118 T119 E123 G124 I125 L219 W227	R117-I121 WeakPolarHBondContact O-CG1 3.44Å; R117-I121 PolarHBondContact O-N 3.07Å; C118-I121 PolarHBondContact O-N 3.16Å; T119-I121 PolarHBondContact O-N 3.41Å; I121-E123 VanDerWaalsContact C-N 3.34Å; I121-E123 PolarHBondContact O-N 3.37Å; I121-G124 PolarHBondContact O-N 2.89Å; I121-I125 HydrophobicContact CG2-CD1 3.65Å; I121-I125 HydrophobicContact CG2-CG1 4.32Å; I121-I125 WeakPolarHBondContact O-CB 3.33Å; I121-I125 VanDerWaalsContact O-CG1 3.28Å; I121-I125 WeakPolarHBondContact O-CG1 3.26Å; I121-I125 PolarHBondContact O-N 3.43Å; I121-L219 HydrophobicContact CG2-CD1 4.35Å; I121-W227 HydrophobicContact CD1-CD2 3.56Å; I121-W227 VanDerWaalsContact CD1-CE2 3.48Å; I121-W227 HydrophobicContact CD1-CE3 3.64Å; I121-W227 HydrophobicContact CD1-CG 4.28Å; I121-W227 HydrophobicContact CD1-CH2 3.59Å; I121-W227 HydrophobicContact CD1-CZ2 3.49Å; I121-W227 VanDerWaalsContact CD1-CZ2 3.49Å; I121-W227 HydrophobicContact CD1-CZ3 3.66Å
122	L	67	Low	63.4	Low	32 Å²	32	69.5 Å²	69.5	17%	0.168	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-41.3	177.6	-74.8	169.7	0	0	0	111.7	I99 L103 C118 T119 I125 H126 Y389	I99-L122 HydrophobicContact CD1-CD1 3.95Å; I99-L122 HydrophobicContact CD1-CD2 3.96Å; I99-L122 HydrophobicContact CD1-CG 3.84Å; I99-L122 HydrophobicContact CG1-CD1 4.33Å; L103-L122 HydrophobicContact CD1-CD1 4.17Å; C118-L122 WeakPolarHBondContact O-CG 3.36Å; C118-L122 PolarHBondContact O-N 2.84Å; C118-L122 VanDerWaalsContact O-N 3.1Å; T119-L122 PolarHBondContact O-N 2.91Å; L122-I125 PolarHBondContact O-N 3.44Å; L122-H126 VanDerWaalsContact O-CB 3.28Å; L122-H126 WeakPolarHBondContact O-CB 3.49Å; L122-H126 PolarHBondContact O-N 2.81Å; L122-Y389 HydrophobicContact CD1-CD1 4.36Å; L122-Y389 HydrophobicContact CD1-CE1 3.7Å
123	E	67.1	Low	61.8	Low	121 Å²	121	70.5 Å²	70.5	57%	0.565	37%	0.366	S	S	*	.	H	α-helix	trans	-60.7	-47.2	171.1	-70.5	173.9	172.8	0	0	111.3	T119 I121 I125 H126 L127	T119-E123 WeakPolarHBondContact O-CG 3.33Å; T119-E123 PolarHBondContact O-N 3Å; I121-E123 VanDerWaalsContact C-N 3.34Å; I121-E123 PolarHBondContact O-N 3.37Å; E123-I125 PolarHBondContact O-N 3.3Å; E123-H126 PolarHBondContact O-N 3.22Å; E123-L127 WeakPolarHBondContact O-CB 3.15Å; E123-L127 VanDerWaalsContact O-CG 3.25Å; E123-L127 WeakPolarHBondContact O-CG 3.37Å; E123-L127 PolarHBondContact O-N 3.5Å
124	G	59.8	Low	60.5	Low	29 Å²	29	70 Å²	70	30%	0.299	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-34.8	177.8	0	0	0	0	0	114.2	Q120 I121 K128	Q120-G124 PolarHBondContact O-N 3.33Å; I121-G124 PolarHBondContact O-N 2.89Å; G124-K128 WeakPolarHBondContact O-CB 3.3Å; G124-K128 VanDerWaalsContact O-CG 3.32Å; G124-K128 WeakPolarHBondContact O-CG 3.49Å; G124-K128 PolarHBondContact O-N 3.39Å; G124-K128 VanDerWaalsContact O-N 3.07Å
125	I	59.7	Low	58.5	Low	55 Å²	55	75.4 Å²	75.4	28%	0.282	40%	0.398	S	S	.	.	H	α-helix	trans	-70.8	-47.6	173.2	-70.2	168	0	0	0	110	L96 I121 L122 E123 L127 K128 I129	L96-I125 HydrophobicContact CD1-CD1 3.96Å; I121-I125 HydrophobicContact CG2-CD1 3.65Å; I121-I125 HydrophobicContact CG2-CG1 4.32Å; I121-I125 WeakPolarHBondContact O-CB 3.33Å; I121-I125 VanDerWaalsContact O-CG1 3.28Å; I121-I125 WeakPolarHBondContact O-CG1 3.26Å; I121-I125 PolarHBondContact O-N 3.43Å; L122-I125 PolarHBondContact O-N 3.44Å; E123-I125 PolarHBondContact O-N 3.3Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 PolarHBondContact O-N 3.1Å; I125-K128 PolarHBondContact O-N 2.82Å; I125-K128 VanDerWaalsContact O-N 3.16Å; I125-I129 HydrophobicContact CG2-CD1 3.85Å; I125-I129 HydrophobicContact CG2-CG1 4.5Å; I125-I129 WeakPolarHBondContact O-CG1 3.5Å; I125-I129 PolarHBondContact O-N 2.79Å
126	H	52.9	Low	56.7	Low	81 Å²	81	81.6 Å²	81.6	38%	0.375	43%	0.427	S	S	.	.	H	α-helix	trans	-60	-39.8	177.8	-171.8	-61.5	0	0	0	111.7	L122 E123 S130	L122-H126 VanDerWaalsContact O-CB 3.28Å; L122-H126 WeakPolarHBondContact O-CB 3.49Å; L122-H126 PolarHBondContact O-N 2.81Å; E123-H126 PolarHBondContact O-N 3.22Å; H126-S130 WeakPolarHBondContact O-CB 3.49Å; H126-S130 PolarHBondContact O-N 2.94Å; H126-S130 PolarHBondContact O-OG 3.09Å
127	L	49.8	Very low	55.3	Low	111 Å²	111	81.6 Å²	81.6	58%	0.581	44%	0.436	S	S	*	.	H	α-helix	trans	-66.4	-41.9	174.2	-74	167.5	0	0	0	112.3	E123 I125 S130 L131	E123-L127 WeakPolarHBondContact O-CB 3.15Å; E123-L127 VanDerWaalsContact O-CG 3.25Å; E123-L127 WeakPolarHBondContact O-CG 3.37Å; E123-L127 PolarHBondContact O-N 3.5Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 PolarHBondContact O-N 3.1Å; L127-S130 CarbonylContact O-C 3.6Å; L127-S130 WeakPolarHBondContact O-CB 3.29Å; L127-S130 PolarHBondContact O-N 3.44Å; L127-L131 PolarHBondContact O-N 2.94Å
128	K	48.7	Very low	54.1	Low	158 Å²	158	82 Å²	82	69%	0.687	45%	0.451	S	S	*	.	H	α-helix	trans	-66.6	-38.1	177.1	-79.3	178.7	177.2	-175	0	113.1	G124 I125 S130 L131 A132	G124-K128 WeakPolarHBondContact O-CB 3.3Å; G124-K128 VanDerWaalsContact O-CG 3.32Å; G124-K128 WeakPolarHBondContact O-CG 3.49Å; G124-K128 PolarHBondContact O-N 3.39Å; G124-K128 VanDerWaalsContact O-N 3.07Å; I125-K128 PolarHBondContact O-N 2.82Å; I125-K128 VanDerWaalsContact O-N 3.16Å; K128-S130 VanDerWaalsContact C-N 3.34Å; K128-L131 PolarHBondContact O-N 2.91Å; K128-A132 WeakPolarHBondContact O-CB 3.46Å; K128-A132 PolarHBondContact O-N 2.92Å
129	I	53.3	Low	52.5	Low	77 Å²	77	86.8 Å²	86.8	40%	0.395	48%	0.484	S	S	.	.	H	α-helix	trans	-61.3	-47.1	170.7	-65.7	164.6	0	0	0	109.4	I125 L131 A132 D133	I125-I129 HydrophobicContact CG2-CD1 3.85Å; I125-I129 HydrophobicContact CG2-CG1 4.5Å; I125-I129 WeakPolarHBondContact O-CG1 3.5Å; I125-I129 PolarHBondContact O-N 2.79Å; I129-L131 PolarHBondContact O-N 3.35Å; I129-L131 VanDerWaalsContact O-N 3.15Å; I129-A132 PolarHBondContact O-N 3.43Å; I129-D133 WeakPolarHBondContact O-CB 3.33Å; I129-D133 PolarHBondContact O-N 3.38Å
130	S	47.2	Very low	50.7	Low	53 Å²	53	91.4 Å²	91.4	37%	0.371	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-17.6	179.3	-53.4	0	0	0	0	114.6	H126 L127 K128 V134	H126-S130 WeakPolarHBondContact O-CB 3.49Å; H126-S130 PolarHBondContact O-N 2.94Å; H126-S130 PolarHBondContact O-OG 3.09Å; L127-S130 CarbonylContact O-C 3.6Å; L127-S130 WeakPolarHBondContact O-CB 3.29Å; L127-S130 PolarHBondContact O-N 3.44Å; K128-S130 VanDerWaalsContact C-N 3.34Å; S130-V134 WeakPolarHBondContact O-CG2 3.39Å
131	L	44.9	Very low	49.2	Very low	102 Å²	102	94.6 Å²	94.6	53%	0.534	53%	0.526	S	S	.	.	H	α-helix	trans	-91.4	-43.1	173.4	-83	157	0	0	0	111.6	L127 K128 I129 D133 V134 D135	L127-L131 PolarHBondContact O-N 2.94Å; K128-L131 PolarHBondContact O-N 2.91Å; I129-L131 PolarHBondContact O-N 3.35Å; I129-L131 VanDerWaalsContact O-N 3.15Å; L131-D133 VanDerWaalsContact C-N 3.26Å; L131-D133 PolarHBondContact O-N 2.97Å; L131-V134 WeakPolarHBondContact O-CA 3.15Å; L131-V134 WeakPolarHBondContact O-CB 3.45Å; L131-V134 PolarHBondContact O-N 3.23Å; L131-D135 PolarHBondContact O-N 3.24Å
132	A	41.3	Very low	47.9	Very low	59 Å²	59	100.5 Å²	100.5	49%	0.488	56%	0.559	S	S	.	*	H	α-helix	trans	-60.3	-36.6	174.7	0	0	0	0	0	112.3	K128 I129 V134 E136	K128-A132 WeakPolarHBondContact O-CB 3.46Å; K128-A132 PolarHBondContact O-N 2.92Å; I129-A132 PolarHBondContact O-N 3.43Å; A132-V134 PolarHBondContact O-N 3.11Å; A132-E136 PolarHBondContact O-N 3.12Å
133	D	45.1	Very low	46.5	Very low	123 Å²	123	106.4 Å²	106.4	66%	0.658	59%	0.59	S	S	*	*	H	α-helix	trans	-67.8	-5.6	172.8	-72.8	-26.1	0	0	0	113.7	I129 L131	I129-D133 WeakPolarHBondContact O-CB 3.33Å; I129-D133 PolarHBondContact O-N 3.38Å; L131-D133 VanDerWaalsContact C-N 3.26Å; L131-D133 PolarHBondContact O-N 2.97Å
134	V	49.4	Very low	44.9	Very low	88 Å²	88	107.6 Å²	107.6	53%	0.533	60%	0.601	S	S	.	*	H	α-helix	trans	-112.6	-37.8	179.3	173	0	0	0	0	112.2	S130 L131 A132 E136 A137	S130-V134 WeakPolarHBondContact O-CG2 3.39Å; L131-V134 WeakPolarHBondContact O-CA 3.15Å; L131-V134 WeakPolarHBondContact O-CB 3.45Å; L131-V134 PolarHBondContact O-N 3.23Å; A132-V134 PolarHBondContact O-N 3.11Å; V134-E136 VanDerWaalsContact C-N 3.32Å; V134-E136 PolarHBondContact O-N 2.82Å; V134-A137 VanDerWaalsContact O-CB 3.27Å; V134-A137 WeakPolarHBondContact O-CB 3.29Å; V134-A137 PolarHBondContact O-N 2.9Å
135	D	36.6	Very low	43.5	Very low	120 Å²	120	110.6 Å²	110.6	64%	0.642	62%	0.622	S	S	*	*	H	α-helix	trans	-69.2	-29.2	176.1	-68.5	-41.8	0	0	0	111.9	L131 A137	L131-D135 PolarHBondContact O-N 3.24Å; D135-A137 PolarHBondContact O-N 3.34Å; D135-A137 VanDerWaalsContact O-N 3.09Å
136	E	41.3	Very low	42.3	Very low	157 Å²	157	113.6 Å²	113.6	73%	0.734	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	38.1	171.1	-154.8	-166.2	-112	0	0	112.9	A132 V134	A132-E136 PolarHBondContact O-N 3.12Å; V134-E136 VanDerWaalsContact C-N 3.32Å; V134-E136 PolarHBondContact O-N 2.82Å
137	A	43.7	Very low	41.6	Very low	68 Å²	68	115.8 Å²	115.8	56%	0.562	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	2.6	-179.9	0	0	0	0	0	115.3	V134 D135	V134-A137 VanDerWaalsContact O-CB 3.27Å; V134-A137 WeakPolarHBondContact O-CB 3.29Å; V134-A137 PolarHBondContact O-N 2.9Å; D135-A137 PolarHBondContact O-N 3.34Å; D135-A137 VanDerWaalsContact O-N 3.09Å
138	T	47.5	Very low	40.7	Very low	121 Å²	121	122.5 Å²	122.5	74%	0.742	68%	0.684	S	S	*	*			trans	-135.2	56.7	-175.7	57	0	0	0	0	114.3
139	C	36.6	Very low	39.8	Very low	101 Å²	101	119.8 Å²	119.8	68%	0.682	69%	0.692	S	S	*	*			trans	-169	131.3	155.3	49.3	0	0	0	0	107.1
140	D	36.7	Very low	38.6	Very low	144 Å²	144	120.9 Å²	120.9	77%	0.77	71%	0.712	S	S	*	*			cis	-129.3	-166.2	-12.1	-67.6	-53.5	0	0	0	106.4
141	D	39.8	Very low	37.8	Very low	158 Å²	158	130 Å²	130	85%	0.845	74%	0.739	S	S	*	*			cis	-139	-166.9	12.8	-42.8	-93.6	0	0	0	111.5
142	D	38.3	Very low	37.5	Very low	153 Å²	153	131 Å²	131	82%	0.818	75%	0.751	S	S	*	*			trans	-69.4	170.5	178.9	-71.5	-67.9	0	0	0	114.6
143	D	37.2	Very low	36.9	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	77%	0.765	S	S	*	*			cis	-161.2	167.9	44.7	-145.2	-25.1	0	0	0	116.4
144	D	33	Very low	36.2	Very low	147 Å²	147	138 Å²	138	79%	0.786	78%	0.779	S	S	*	*			trans	68.8	86.2	159.4	-144.7	-17.8	0	0	0	121.4
145	A	30.3	Very low	35.5	Very low	91 Å²	91	140.4 Å²	140.4	75%	0.752	79%	0.794	S	S	*	*			trans	-171.8	141.3	134.6	0	0	0	0	0	113.1
146	P	35.8	Very low	35.1	Very low	118 Å²	118	143.5 Å²	143.5	77%	0.766	81%	0.807	S	S	*	*			trans	-83.8	151.5	-172.1	32.3	-36.5	0	0	0	115.5
147	P	37.5	Very low	34.5	Very low	128 Å²	128	144.6 Å²	144.6	83%	0.831	81%	0.812	S	S	*	*			trans	-81.2	148.5	-173.2	32.5	-36.6	0	0	0	114.3
148	R	31.3	Very low	33.8	Very low	251 Å²	251	145.8 Å²	145.8	95%	0.947	82%	0.821	S	S	*	*			trans	-128.4	114.2	168.8	-103.5	-172	170.4	-159.3	-2.4	113.5
149	A	28.9	Very low	32.8	Very low	102 Å²	102	149.5 Å²	149.5	84%	0.843	83%	0.833	S	S	*	*			trans	44.5	107.8	153	0	0	0	0	0	119
150	A	27.7	Very low	32.5	Very low	99 Å²	99	151 Å²	151	82%	0.818	84%	0.839	S	S	*	*			trans	-68.8	155.7	167.8	0	0	0	0	0	113.5
151	R	31.9	Very low	32	Very low	246 Å²	246	155.9 Å²	155.9	93%	0.928	85%	0.846	S	S	*	*				-162.8	155.4	126.8	-107.7	169.9	180	-149.4	-4.2	112.3
152	P	38.6	Very low	31.4	Very low	123 Å²	123	152 Å²	152	80%	0.799	84%	0.844	S	S	*	*			trans	-103	160.5	-161.4	38.9	-35.6	0	0	0	115.2
153	G	28.8	Very low	30.8	Very low	75 Å²	75	149 Å²	149	77%	0.773	85%	0.849	S	S	*	*			trans	76.1	113.3	135.8	0	0	0	0	0	119.1
154	R	30	Very low	30.2	Very low	254 Å²	254	145 Å²	145	96%	0.958	84%	0.844	S	S	*	*			trans	-140.8	122.4	144.3	-75.5	-162	175.3	-165.2	-1.9	111.1
155	T	35	Very low	30	Very low	138 Å²	138	141.6 Å²	141.6	85%	0.847	84%	0.844	S	S	*	*			trans	-84.6	138.3	157.2	43.1	0	0	0	0	109.2
156	M	27.4	Very low	30	Very low	185 Å²	185	146.1 Å²	146.1	91%	0.911	85%	0.849	S	S	*	*			trans	-165.6	165.4	134	-132.5	-178.5	-81.9	0	0	111.1
157	E	28.1	Very low	29.7	Very low	180 Å²	180	149.7 Å²	149.7	84%	0.841	86%	0.855	S	S	*	*			trans	-93	169.3	-172.4	-60.2	168.4	102.1	0	0	113.2
158	A	29.6	Very low	29.2	Very low	92 Å²	92	150 Å²	150	76%	0.76	86%	0.858	S	S	*	*			trans	36.7	117.7	146.6	0	0	0	0	0	120.4
159	M	27	Very low	29	Very low	199 Å²	199	140.4 Å²	140.4	98%	0.98	84%	0.838	S	S	*	*			trans	-137.1	138.5	135.9	-117.8	-172.9	-173.3	0	0	112.2
160	V	28.8	Very low	29	Very low	134 Å²	134	143.2 Å²	143.2	81%	0.812	84%	0.838	S	S	*	*			trans	-96	134	-174.3	171.3	0	0	0	0	110.8
161	R	27.8	Very low	29	Very low	245 Å²	245	147.1 Å²	147.1	93%	0.925	84%	0.837	S	S	*	*			trans	174.7	149.2	137.2	-98.5	163.1	85.6	160.4	6.7	111.3
162	G	25.5	Very low	28.8	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	83%	0.834	S	S	*	*			trans	149.4	8.2	140	0	0	0	0	0	124
163	G	25.9	Very low	28.5	Very low	88 Å²	88	145.9 Å²	145.9	91%	0.907	84%	0.84	S	S	*	*			trans	70.8	177.9	162.7	0	0	0	0	0	117.9
164	G	26.2	Very low	28.3	Very low	71 Å²	71	146.1 Å²	146.1	73%	0.732	84%	0.842	S	S	*	*			trans	126.9	24.1	178.1	0	0	0	0	0	117.5	H166	G164-H166 PolarHBondContact O-N 3.42Å
165	G	27.4	Very low	28.2	Very low	76 Å²	76	138.5 Å²	138.5	78%	0.784	83%	0.834	S	S	*	*			trans	-73.6	121.9	177.9	0	0	0	0	0	113.1
166	H	30.6	Very low	27.9	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.866	84%	0.838	S	S	*	*			trans	-108.3	108.5	170.3	-87.7	-97.4	0	0	0	111.2	G164	G164-H166 PolarHBondContact O-N 3.42Å
167	H	30.3	Very low	27.8	Very low	193 Å²	193	139.1 Å²	139.1	89%	0.894	84%	0.836	S	S	*	*			trans	-73.7	142.6	163.4	-75.5	-102.4	0	0	0	110.3
168	C	27.3	Very low	27.7	Very low	133 Å²	133	134 Å²	134	90%	0.899	83%	0.833	S	S	*	*			trans	-145.3	124.9	139	-159.5	0	0	0	0	109.5
169	G	26.6	Very low	27.5	Very low	51 Å²	51	136.2 Å²	136.2	53%	0.526	84%	0.837	S	S	.	*			trans	-128.3	-158.6	168	0	0	0	0	0	109.3
170	L	28.7	Very low	27.5	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	83%	0.832	S	S	*	*			trans	77	146.1	-171.5	-47.9	164.1	0	0	0	112.5
171	K	27.9	Very low	27.2	Very low	181 Å²	181	135.6 Å²	135.6	79%	0.787	83%	0.831	S	S	*	*			cis	-149.8	148	1.8	-138	160.1	-173.2	172.6	0	111.7
172	L	28.2	Very low	27.1	Very low	166 Å²	166	129.2 Å²	129.2	87%	0.869	82%	0.823	S	S	*	*			trans	-79	139.1	164	-80.8	156.7	0	0	0	110.4
173	L	31	Very low	27	Very low	178 Å²	178	134.2 Å²	134.2	93%	0.932	83%	0.825	S	S	*	*			trans	-144.6	154.5	155.2	-80.4	178.9	0	0	0	107.6
174	G	24.4	Very low	27	Very low	79 Å²	79	136.2 Å²	136.2	81%	0.814	82%	0.82	S	S	*	*			trans	-164.9	167.1	-179.4	0	0	0	0	0	114.3
175	A	28.7	Very low	26.9	Very low	94 Å²	94	140.4 Å²	140.4	78%	0.777	82%	0.824	S	S	*	*			trans	-147.6	141.3	171	0	0	0	0	0	105.8
176	R	29.1	Very low	26.8	Very low	252 Å²	252	141.7 Å²	141.7	95%	0.951	82%	0.82	S	S	*	*				48.8	115.9	62.9	-73	-171.5	171	-164.7	-2.6	111.7
177	G	24.5	Very low	26.9	Very low	84 Å²	84	138.4 Å²	138.4	87%	0.866	82%	0.816	S	S	*	*			cis	166.4	160.5	-3.7	0	0	0	0	0	109.4
178	G	26.4	Very low	26.7	Very low	74 Å²	74	133.4 Å²	133.4	76%	0.763	81%	0.808	S	S	*	*			trans	-173.6	135.5	179.1	0	0	0	0	0	111.1
179	T	25.5	Very low	26.6	Very low	138 Å²	138	136 Å²	136	85%	0.847	81%	0.807	S	S	*	*			trans	-134.4	121.9	-179.2	48.5	0	0	0	0	109.3
180	E	26	Very low	26.5	Very low	190 Å²	190	142.3 Å²	142.3	89%	0.888	82%	0.822	S	S	*	*			trans	-147.1	155.3	164	46.5	-144.6	120.8	0	0	110
181	V	24.3	Very low	26.7	Very low	129 Å²	129	139.2 Å²	139.2	78%	0.782	81%	0.812	S	S	*	*			trans	-146.3	160.5	-159.5	-165.8	0	0	0	0	108.2
182	C	24.3	Very low	26.6	Very low	112 Å²	112	138.2 Å²	138.2	76%	0.757	81%	0.814	S	S	*	*			trans	76.3	154	177.7	-56.1	0	0	0	0	114.4
183	E	24.3	Very low	26.4	Very low	183 Å²	183	135.6 Å²	135.6	86%	0.855	81%	0.81	S	S	*	*			cis	-144.4	174.2	2.2	-142.6	161.4	-172.9	0	0	113.6
184	V	24.7	Very low	27.1	Very low	130 Å²	130	132.8 Å²	132.8	79%	0.788	80%	0.802	S	S	*	*			trans	-86.5	130	-176.9	174.8	0	0	0	0	111.4
185	I	24.9	Very low	27.7	Very low	159 Å²	159	134.2 Å²	134.2	82%	0.815	80%	0.797	S	S	*	*			trans	-137.1	126.6	155.3	-55.3	-178.9	0	0	0	110.5
186	S	24.9	Very low	28	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	80%	0.796	S	S	*	*			trans	-133.6	150.1	155.9	-55.7	0	0	0	0	106.2
187	P	33.6	Very low	27.9	Very low	118 Å²	118	129.5 Å²	129.5	77%	0.766	79%	0.789	S	S	*	*				-156.7	-176.9	95.3	41.1	-22.5	0	0	0	115.9
188	A	24.9	Very low	28.1	Very low	88 Å²	88	131.9 Å²	131.9	73%	0.727	79%	0.787	S	S	*	*			trans	65.1	122.1	163.3	0	0	0	0	0	117.3
189	E	25	Very low	28	Very low	189 Å²	189	136.3 Å²	136.3	88%	0.883	79%	0.787	S	S	*	*			cis	85	104.1	43.1	-62.2	-148.4	140.9	0	0	115.3
190	E	24.5	Very low	28.2	Very low	182 Å²	182	138.8 Å²	138.8	85%	0.85	79%	0.789	S	S	*	*			trans	30.5	168.7	135.1	-84.3	-145	114.4	0	0	123.8
191	P	34.5	Very low	28.3	Very low	95 Å²	95	135.1 Å²	135.1	62%	0.617	78%	0.784	S	S	*	*			cis	-135.6	-167.1	-2.6	22.5	4.2	0	0	0	115.5
192	L	24.5	Very low	28.4	Very low	161 Å²	161	132.3 Å²	132.3	84%	0.843	78%	0.782	S	S	*	*			trans	104.8	138.3	149.4	-57.9	177	0	0	0	121.1
193	S	24.8	Very low	28.5	Very low	110 Å²	110	134.8 Å²	134.8	77%	0.769	79%	0.787	S	S	*	*			trans	-127.1	-166.6	171.8	-12.6	0	0	0	0	108.8
194	P	44.6	Very low	28.7	Very low	119 Å²	119	132.6 Å²	132.6	77%	0.773	79%	0.785	S	S	*	*			cis	-111.9	-110.3	-14.5	24.7	0.2	0	0	0	108.3
195	P	38.4	Very low	28.7	Very low	109 Å²	109	129.3 Å²	129.3	71%	0.708	78%	0.778	S	S	*	*			cis	-115	-158	-49.2	44.5	-29.1	0	0	0	110.8
196	P	35.4	Very low	29.4	Very low	117 Å²	117	128.4 Å²	128.4	76%	0.76	78%	0.782	S	S	*	*			cis	-129.3	174.2	-11.4	42	-26.2	0	0	0	116
197	T	25.3	Very low	29.4	Very low	131 Å²	131	127.3 Å²	127.3	80%	0.804	79%	0.787	S	S	*	*			trans	-82.8	158.8	166.8	47	0	0	0	0	113.3
198	V	28.7	Very low	29.1	Very low	134 Å²	134	126.5 Å²	126.5	81%	0.812	79%	0.79	S	S	*	*			trans	-133.9	130.8	158.9	178.1	0	0	0	0	109
199	E	25.8	Very low	29.2	Very low	166 Å²	166	129.3 Å²	129.3	78%	0.776	80%	0.799	S	S	*	*			trans	-101.8	157.5	170.1	-62.4	-158.6	138.9	0	0	111.3
200	H	29.2	Very low	29.5	Very low	191 Å²	191	126.4 Å²	126.4	88%	0.884	80%	0.799	S	S	*	*			trans	-149	147.3	154.5	-107.7	-80.2	0	0	0	110.2
201	S	27.5	Very low	29.7	Very low	112 Å²	112	123.1 Å²	123.1	78%	0.783	80%	0.796	S	S	*	*			trans	-119	152.6	-158.4	-37	0	0	0	0	114.7
202	G	25.8	Very low	29.5	Very low	71 Å²	71	130.7 Å²	130.7	73%	0.732	81%	0.813	S	S	*	*			trans	99.1	158.4	163.9	0	0	0	0	0	115.8
203	L	27.6	Very low	29.7	Very low	164 Å²	164	128.9 Å²	128.9	86%	0.859	81%	0.809	S	S	*	*			cis	-162.6	151.6	-5.8	-113.5	175.7	0	0	0	110
204	V	27.4	Very low	30	Very low	136 Å²	136	129.1 Å²	129.1	82%	0.824	81%	0.81	S	S	*	*			trans	68.6	138.2	160.9	-179.8	0	0	0	0	118.7
205	G	25.3	Very low	29.8	Very low	62 Å²	62	131.7 Å²	131.7	64%	0.639	81%	0.809	S	S	*	*			trans	-128.8	-156.9	160.5	0	0	0	0	0	109.6
206	P	40.2	Very low	29.9	Very low	140 Å²	140	131.5 Å²	131.5	91%	0.909	80%	0.799	S	S	*	*			cis	-121.7	179.1	3.2	41.8	-28.9	0	0	0	113.4
207	G	24.3	Very low	30.4	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	79%	0.787	S	S	*	*			trans	-149.7	111.5	167.9	0	0	0	0	0	111.2
208	A	27.6	Very low	31.6	Very low	102 Å²	102	126.5 Å²	126.5	84%	0.843	76%	0.764	S	S	*	*			trans	-99.7	120.5	-179.9	0	0	0	0	0	111.1
209	T	26.8	Very low	32.6	Very low	147 Å²	147	121.6 Å²	121.6	90%	0.902	73%	0.734	S	S	*	*			trans	-136.5	132.3	156.2	49.1	0	0	0	0	108.5
210	S	31	Very low	34.1	Very low	128 Å²	128	116.8 Å²	116.8	90%	0.895	71%	0.708	S	S	*	*			trans	-94	132.4	179.5	46.3	0	0	0	0	110.4
211	S	28.5	Very low	35.5	Very low	113 Å²	113	108.5 Å²	108.5	79%	0.79	67%	0.67	S	S	*	*			trans	-126.9	137.4	166	60.6	0	0	0	0	109.1	T213	S211-T213 PolarHBondContact O-N 3.37Å
212	R	31.3	Very low	36.9	Very low	253 Å²	253	105.5 Å²	105.5	96%	0.955	65%	0.645	S	S	*	*			trans	-77.4	115.9	-169.5	-69.5	174	172.4	163.2	-4.3	110.3	S214	R212-S214 PolarHBondContact O-N 3.06Å
213	T	28.2	Very low	37.9	Very low	124 Å²	124	108.3 Å²	108.3	76%	0.761	63%	0.634	S	S	*	*			trans	-76.4	111.6	170	44.7	0	0	0	0	110.2	S211 K215	S211-T213 PolarHBondContact O-N 3.37Å; T213-K215 PolarHBondContact O-N 3.46Å
214	S	30.7	Very low	38.8	Very low	115 Å²	115	104.1 Å²	104.1	80%	0.804	62%	0.623	S	S	*	*			trans	-66.1	102.4	166.8	51.8	0	0	0	0	109	R212 E216	R212-S214 PolarHBondContact O-N 3.06Å; S214-E216 PolarHBondContact O-N 2.68Å
215	K	41.6	Very low	39.6	Very low	172 Å²	172	98.8 Å²	98.8	75%	0.748	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-62.1	127.1	178.6	-68.4	177.1	-179.6	172.2	0	110	T213	T213-K215 PolarHBondContact O-N 3.46Å
216	E	39.8	Very low	40.5	Very low	106 Å²	106	101.8 Å²	101.8	50%	0.495	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-65	148	175.9	-62.1	-173.4	138.8	0	0	111.4	Q95 S214 I218	Q95-E216 PolarHBondContact NE2-OE2 3.01Å; S214-E216 PolarHBondContact O-N 2.68Å; E216-I218 PolarHBondContact O-N 3.47Å
217	P	46.5	Very low	41.1	Very low	79 Å²	79	98.6 Å²	98.6	51%	0.513	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-70.5	117.3	177.4	28.3	-33.5	0	0	0	111	M229	P217-M229 HydrophobicContact CB-CE 4.4Å; P217-M229 HydrophobicContact CB-CG 4.1Å; P217-M229 HydrophobicContact CB-SD 3.86Å
218	I	50.8	Low	42.6	Very low	63 Å²	63	99.1 Å²	99.1	32%	0.323	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.3	-179.9	-57.4	176.9	0	0	0	109.3	C93 E216 R220 E230	C93-I218 HydrophobicContact CB-CG2 4Å; E216-I218 PolarHBondContact O-N 3.47Å; I218-R220 HydrophobicContact CG2-CG 4.19Å; I218-E230 PolarHBondContact O-N 3.47Å
219	L	48.3	Very low	43.4	Very low	32 Å²	32	99.4 Å²	99.4	17%	0.168	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.7	171.5	-73.9	166.7	0	0	0	109.9	C93 L94 I121 W227 M229	C93-L219 WeakPolarHBondContact CA-O 3.42Å; L94-L219 HydrophobicContact CB-CB 4.47Å; L94-L219 PolarHBondContact N-O 2.72Å; L94-L219 PolarHBondContact O-N 2.93Å; I121-L219 HydrophobicContact CG2-CD1 4.35Å; L219-W227 HydrophobicContact CB-CE3 4.44Å; L219-W227 HydrophobicContact CB-CZ3 4.37Å; L219-M229 HydrophobicContact CD2-CB 4.38Å; L219-M229 HydrophobicContact CD2-CE 3.94Å
220	R	56.9	Low	44.2	Very low	65 Å²	65	96.1 Å²	96.1	25%	0.245	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.5	177.9	-74.8	-172.9	163.3	161.8	2.7	111.8	L92 C93 I218 W227 Y228 E230	L92-R220 WeakPolarHBondContact O-CA 3.35Å; C93-R220 PolarHBondContact SG-NE 3.45Å; I218-R220 HydrophobicContact CG2-CG 4.19Å; R220-W227 CarbonylContact O-C 3.59Å; R220-W227 VanDerWaalsContact O-CA 3.32Å; R220-W227 WeakPolarHBondContact O-CA 3.36Å; R220-Y228 HydrophobicContact CB-CD1 4.06Å; R220-Y228 HydrophobicContact CB-CD2 4.43Å; R220-Y228 HydrophobicContact CB-CE1 3.61Å; R220-Y228 HydrophobicContact CB-CE2 4.03Å; R220-Y228 HydrophobicContact CB-CG 4.46Å; R220-Y228 WeakPolarHBondContact CD-OH 3.49Å; R220-Y228 PolarHBondContact N-O 3.45Å; R220-Y228 PolarHBondContact O-N 3.11Å; R220-E230 WeakPolarHBondContact CD-OE2 3.41Å; R220-E230 IonicContact CZ-OE1 3.51Å; R220-E230 IonicContact CZ-OE2 3.34Å; R220-E230 IonicContact NE-OE2 2.67Å; R220-E230 IonicContact NH1-OE1 2.66Å; R220-E230 PolarHBondContact NH1-OE1 2.68Å; R220-E230 IonicContact NH1-OE2 2.67Å; R220-E230 PolarHBondContact NH1-OE2 2.88Å
221	I	59	Low	44.6	Very low	16 Å²	16	95 Å²	95	8%	0.082	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.9	169.4	-161.4	-176.7	0	0	0	110.3	F86 R91 L92 Q226 W227	F86-I221 HydrophobicContact CE2-CG2 4.38Å; R91-I221 WeakPolarHBondContact CA-O 3.41Å; L92-I221 HydrophobicContact CB-CG2 3.82Å; L92-I221 PolarHBondContact O-N 3.38Å; I221-Q226 CarbonylContact C-O 3.6Å; I221-Q226 WeakPolarHBondContact CA-O 3.19Å; I221-W227 HydrophobicContact CB-CD2 3.81Å; I221-W227 HydrophobicContact CB-CE3 3.9Å; I221-W227 HydrophobicContact CB-CH2 3.94Å; I221-W227 HydrophobicContact CB-CZ2 3.85Å; I221-W227 HydrophobicContact CB-CZ3 3.96Å; I221-W227 HydrophobicContact CD1-CD2 4.4Å; I221-W227 HydrophobicContact CD1-CH2 4.43Å; I221-W227 HydrophobicContact CD1-CZ2 3.6Å; I221-W227 HydrophobicContact CG1-CD2 3.93Å; I221-W227 HydrophobicContact CG1-CG 4.27Å; I221-W227 HydrophobicContact CG1-CZ2 3.96Å; I221-W227 HydrophobicContact CG2-CH2 4.38Å; I221-W227 HydrophobicContact CG2-CZ2 4.5Å
222	N	57.4	Low	44.9	Very low	49 Å²	49	92.6 Å²	92.6	26%	0.262	48%	0.482	S	S	.	.			trans	-102	172.8	170.9	77.2	10.8	0	0	0	112.5	G90 A224 G225 Q226	G90-N222 CarbonylContact O-C 3.56Å; N222-A224 PolarHBondContact O-N 3.48Å; N222-A224 VanDerWaalsContact O-N 3.13Å; N222-A224 WeakPolarHBondContact OD1-CA 3.48Å; N222-A224 WeakPolarHBondContact OD1-CB 3.28Å; N222-A224 PolarHBondContact OD1-N 2.9Å; N222-G225 PolarHBondContact O-N 3.35Å; N222-G225 PolarHBondContact OD1-N 3.5Å; N222-Q226 PolarHBondContact N-O 3.19Å; N222-Q226 PolarHBondContact ND2-OE1 2.96Å; N222-Q226 WeakPolarHBondContact OD1-CB 3.18Å; N222-Q226 PolarHBondContact OD1-N 3.36Å
223	R	46.1	Very low	44.7	Very low	130 Å²	130	85.5 Å²	85.5	49%	0.491	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.8	-179.4	-169	173.2	-178.6	160.1	5.8	114.2	S15 N16 G225	S15-R223 VanDerWaalsContact C-NH1 3.33Å; S15-R223 PolarHBondContact O-NH1 2.96Å; N16-R223 WeakPolarHBondContact OD1-CD 3.27Å; N16-R223 PolarHBondContact OD1-NH1 2.86Å; R223-G225 VanDerWaalsContact C-N 3.31Å
224	A	46.2	Very low	44.8	Very low	77 Å²	77	88 Å²	88	64%	0.636	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	4	172.8	0	0	0	0	0	113.2	N222 Q226	N222-A224 PolarHBondContact O-N 3.48Å; N222-A224 VanDerWaalsContact O-N 3.13Å; N222-A224 WeakPolarHBondContact OD1-CA 3.48Å; N222-A224 WeakPolarHBondContact OD1-CB 3.28Å; N222-A224 PolarHBondContact OD1-N 2.9Å; A224-Q226 VanDerWaalsContact C-N 3.26Å; A224-Q226 HydrophobicContact CB-CG 4.31Å; A224-Q226 PolarHBondContact O-N 2.83Å
225	G	44.4	Very low	45.2	Very low	24 Å²	24	88 Å²	88	25%	0.247	47%	0.472	C	S	.	.	S	Bend	trans	76.2	9.8	-178.9	0	0	0	0	0	114.5	N222 R223	N222-G225 PolarHBondContact O-N 3.35Å; N222-G225 PolarHBondContact OD1-N 3.5Å; R223-G225 VanDerWaalsContact C-N 3.31Å
226	Q	44.2	Very low	44.7	Very low	124 Å²	124	88.6 Å²	88.6	58%	0.579	48%	0.477	S	S	*	.			trans	-84.2	142.7	177.5	-57.2	166.3	-35.4	0	0	109.8	I221 N222 A224	I221-Q226 CarbonylContact C-O 3.6Å; I221-Q226 WeakPolarHBondContact CA-O 3.19Å; N222-Q226 PolarHBondContact N-O 3.19Å; N222-Q226 PolarHBondContact ND2-OE1 2.96Å; N222-Q226 WeakPolarHBondContact OD1-CB 3.18Å; N222-Q226 PolarHBondContact OD1-N 3.36Å; A224-Q226 VanDerWaalsContact C-N 3.26Å; A224-Q226 HydrophobicContact CB-CG 4.31Å; A224-Q226 PolarHBondContact O-N 2.83Å
227	W	52.9	Low	44.2	Very low	74 Å²	74	94.6 Å²	94.6	28%	0.28	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.3	-177.1	-69.2	83.8	0	0	0	111.7	L94 R117 I121 L219 R220 I221	L94-W227 HydrophobicContact CD1-CH2 3.6Å; L94-W227 HydrophobicContact CD1-CZ3 3.95Å; L94-W227 HydrophobicContact CG-CH2 4.3Å; L94-W227 HydrophobicContact CG-CZ3 4.38Å; R117-W227 HydrophobicContact CB-CZ2 4.02Å; I121-W227 HydrophobicContact CD1-CD2 3.56Å; I121-W227 VanDerWaalsContact CD1-CE2 3.48Å; I121-W227 HydrophobicContact CD1-CE3 3.64Å; I121-W227 HydrophobicContact CD1-CG 4.28Å; I121-W227 HydrophobicContact CD1-CH2 3.59Å; I121-W227 HydrophobicContact CD1-CZ2 3.49Å; I121-W227 VanDerWaalsContact CD1-CZ2 3.49Å; I121-W227 HydrophobicContact CD1-CZ3 3.66Å; L219-W227 HydrophobicContact CB-CE3 4.44Å; L219-W227 HydrophobicContact CB-CZ3 4.37Å; R220-W227 CarbonylContact O-C 3.59Å; R220-W227 VanDerWaalsContact O-CA 3.32Å; R220-W227 WeakPolarHBondContact O-CA 3.36Å; I221-W227 HydrophobicContact CB-CD2 3.81Å; I221-W227 HydrophobicContact CB-CE3 3.9Å; I221-W227 HydrophobicContact CB-CH2 3.94Å; I221-W227 HydrophobicContact CB-CZ2 3.85Å; I221-W227 HydrophobicContact CB-CZ3 3.96Å; I221-W227 HydrophobicContact CD1-CD2 4.4Å; I221-W227 HydrophobicContact CD1-CH2 4.43Å; I221-W227 HydrophobicContact CD1-CZ2 3.6Å; I221-W227 HydrophobicContact CG1-CD2 3.93Å; I221-W227 HydrophobicContact CG1-CG 4.27Å; I221-W227 HydrophobicContact CG1-CZ2 3.96Å; I221-W227 HydrophobicContact CG2-CH2 4.38Å; I221-W227 HydrophobicContact CG2-CZ2 4.5Å
228	Y	56.3	Low	43.5	Very low	88 Å²	88	96.6 Å²	96.6	35%	0.345	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.3	172	69.3	-82.4	0	0	0	110.6	R220 E230	R220-Y228 HydrophobicContact CB-CD1 4.06Å; R220-Y228 HydrophobicContact CB-CD2 4.43Å; R220-Y228 HydrophobicContact CB-CE1 3.61Å; R220-Y228 HydrophobicContact CB-CE2 4.03Å; R220-Y228 HydrophobicContact CB-CG 4.46Å; R220-Y228 WeakPolarHBondContact CD-OH 3.49Å; R220-Y228 PolarHBondContact N-O 3.45Å; R220-Y228 PolarHBondContact O-N 3.11Å; Y228-E230 HydrophobicContact CE2-CB 4.45Å; Y228-E230 WeakPolarHBondContact CE2-OE2 3.35Å
229	M	44.2	Very low	42.4	Very low	109 Å²	109	100.4 Å²	100.4	54%	0.537	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.3	179	-176.8	178.4	-71.6	0	0	108.6	P217 L219	P217-M229 HydrophobicContact CB-CE 4.4Å; P217-M229 HydrophobicContact CB-CG 4.1Å; P217-M229 HydrophobicContact CB-SD 3.86Å; L219-M229 HydrophobicContact CD2-CB 4.38Å; L219-M229 HydrophobicContact CD2-CE 3.94Å
230	E	44.5	Very low	41.6	Very low	77 Å²	77	104.6 Å²	104.6	36%	0.36	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	92.2	-179	-156.7	168	114	0	0	109.4	I218 R220 Y228 G232	I218-E230 PolarHBondContact O-N 3.47Å; R220-E230 WeakPolarHBondContact CD-OE2 3.41Å; R220-E230 IonicContact CZ-OE1 3.51Å; R220-E230 IonicContact CZ-OE2 3.34Å; R220-E230 IonicContact NE-OE2 2.67Å; R220-E230 IonicContact NH1-OE1 2.66Å; R220-E230 PolarHBondContact NH1-OE1 2.68Å; R220-E230 IonicContact NH1-OE2 2.67Å; R220-E230 PolarHBondContact NH1-OE2 2.88Å; Y228-E230 HydrophobicContact CE2-CB 4.45Å; Y228-E230 WeakPolarHBondContact CE2-OE2 3.35Å; E230-G232 PolarHBondContact O-N 2.94Å
231	T	38.4	Very low	40.4	Very low	105 Å²	105	106 Å²	106	64%	0.644	58%	0.584	S	S	*	*			trans	-73.2	108.5	171.1	50.2	0	0	0	0	108.7	S233	T231-S233 PolarHBondContact O-N 3.5Å
232	G	34.3	Very low	39.1	Very low	62 Å²	62	113.7 Å²	113.7	64%	0.639	62%	0.62	S	S	*	*			trans	-67.6	96.9	-169.8	0	0	0	0	0	114.4	E230	E230-G232 PolarHBondContact O-N 2.94Å
233	S	29	Very low	37.8	Very low	104 Å²	104	120.7 Å²	120.7	73%	0.727	65%	0.651	S	S	*	*			trans	-122.6	81.5	171.9	61.9	0	0	0	0	111.2	T231	T231-S233 PolarHBondContact O-N 3.5Å
234	E	29.9	Very low	37	Very low	177 Å²	177	118.2 Å²	118.2	83%	0.827	67%	0.666	S	S	*	*			trans	-83.8	138.2	161.9	-78.8	-81.3	89.3	0	0	108.8	E236	E234-E236 PolarHBondContact O-N 2.83Å
235	P	37.8	Very low	36.2	Very low	116 Å²	116	118.5 Å²	118.5	75%	0.753	68%	0.677	S	S	*	*			trans	-82.4	113.2	177.8	31.5	-32.1	0	0	0	111.3	R237	P235-R237 PolarHBondContact O-N 3.42Å
236	E	31.9	Very low	35.4	Very low	184 Å²	184	121.4 Å²	121.4	86%	0.86	71%	0.706	S	S	*	*			trans	-69.1	119.8	170.7	-66.5	-170.5	128.9	0	0	110.5	E234	E234-E236 PolarHBondContact O-N 2.83Å
237	R	29.9	Very low	34.7	Very low	231 Å²	231	119.7 Å²	119.7	87%	0.872	72%	0.722	S	S	*	*			trans	-85.2	116.4	161.9	-80.7	-172.4	174.8	-175.2	-3.2	109	P235	P235-R237 PolarHBondContact O-N 3.42Å
238	T	30.3	Very low	33.5	Very low	122 Å²	122	120.2 Å²	120.2	75%	0.748	75%	0.751	S	S	*	*			trans	-122.3	91.6	168.4	56.2	0	0	0	0	109.5	S240	T238-S240 PolarHBondContact O-N 2.83Å
239	D	28.7	Very low	32.2	Very low	142 Å²	142	120 Å²	120	76%	0.759	78%	0.775	S	S	*	*			trans	-79.4	108.7	172	-71.9	-57.2	0	0	0	110.3
240	S	30.9	Very low	31.4	Very low	121 Å²	121	120.1 Å²	120.1	85%	0.846	79%	0.793	S	S	*	*			trans	-178.9	151.6	140.1	-79.9	0	0	0	0	111.5	T238	T238-S240 PolarHBondContact O-N 2.83Å
241	A	31.3	Very low	30.5	Very low	93 Å²	93	120.4 Å²	120.4	77%	0.769	82%	0.817	S	S	*	*			trans	-78.4	177.2	179.3	0	0	0	0	0	111.2
242	E	31.9	Very low	30	Very low	179 Å²	179	119.8 Å²	119.8	84%	0.836	83%	0.831	S	S	*	*			cis	-151.2	162.5	36.5	-71.7	-176.8	138.3	0	0	114.8
243	E	31.4	Very low	29.7	Very low	195 Å²	195	120.3 Å²	120.3	91%	0.911	84%	0.837	S	S	*	*			trans	41.1	150.7	156.4	-62.5	-160.7	153.7	0	0	123.1
244	G	28.8	Very low	29.7	Very low	79 Å²	79	122.4 Å²	122.4	81%	0.814	85%	0.845	S	S	*	*			trans	161.1	14.7	167.6	0	0	0	0	0	122.1
245	G	28.8	Very low	29.6	Very low	83 Å²	83	121 Å²	121	86%	0.856	84%	0.843	S	S	*	*			trans	21	123.2	165.7	0	0	0	0	0	123.9
246	G	28.1	Very low	29	Very low	84 Å²	84	126.2 Å²	126.2	87%	0.866	85%	0.848	S	S	*	*				106.9	152.5	128.9	0	0	0	0	0	119.7
247	G	29.5	Very low	28.6	Very low	88 Å²	88	125.2 Å²	125.2	91%	0.907	85%	0.846	S	S	*	*			trans	97.9	136.4	171.6	0	0	0	0	0	114.9
248	G	28.2	Very low	28.3	Very low	86 Å²	86	125 Å²	125	89%	0.887	85%	0.846	S	S	*	*			trans	-143.9	163.3	177.1	0	0	0	0	0	112.4
249	G	27.7	Very low	28.1	Very low	82 Å²	82	126.2 Å²	126.2	85%	0.845	85%	0.846	S	S	*	*			trans	173.3	133.2	179.8	0	0	0	0	0	110.8
250	A	28.2	Very low	27.9	Very low	113 Å²	113	127.3 Å²	127.3	93%	0.934	84%	0.844	S	S	*	*			trans	-93.8	159.6	-169.8	0	0	0	0	0	113.9
251	G	26.5	Very low	27.8	Very low	83 Å²	83	127.8 Å²	127.8	86%	0.856	84%	0.842	S	S	*	*			trans	130.8	136.6	150	0	0	0	0	0	116.5
252	G	25.8	Very low	27.5	Very low	91 Å²	91	131 Å²	131	94%	0.938	84%	0.841	S	S	*	*			trans	106.7	114.1	170.2	0	0	0	0	0	114
253	G	30	Very low	27.3	Very low	74 Å²	74	132 Å²	132	76%	0.763	84%	0.837	S	S	*	*			trans	-146.8	123.2	177.4	0	0	0	0	0	112.8
254	V	28	Very low	27.1	Very low	148 Å²	148	131.9 Å²	131.9	90%	0.897	84%	0.839	S	S	*	*			trans	-156.9	144.7	167.1	-84	0	0	0	0	106.9
255	D	26.9	Very low	27.4	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	83%	0.828	S	S	*	*			cis	-140.1	150.6	-21.2	-170.4	12.1	0	0	0	108.6
256	R	26.2	Very low	27.4	Very low	226 Å²	226	137.6 Å²	137.6	85%	0.853	83%	0.827	S	S	*	*			trans	-97.4	101.9	-176.7	-81.6	178.8	133.8	130.8	-4.2	110	R258	R256-R258 VanDerWaalsContact C-N 3.33Å; R256-R258 PolarHBondContact O-N 2.81Å
257	I	24.3	Very low	27.4	Very low	162 Å²	162	144.7 Å²	144.7	83%	0.831	83%	0.828	S	S	*	*			trans	-60.5	95.7	170.5	-59.7	-179.2	0	0	0	109.4	I259	I257-I259 HydrophobicContact CG2-CG1 4.39Å; I257-I259 PolarHBondContact O-N 2.9Å
258	R	23.3	Very low	27.3	Very low	228 Å²	228	147.7 Å²	147.7	86%	0.86	82%	0.822	S	S	*	*			trans	-94.9	82.2	-172.6	-170.6	178.9	-168.6	161.8	2.6	109.1	R256 K260	R256-R258 VanDerWaalsContact C-N 3.33Å; R256-R258 PolarHBondContact O-N 2.81Å; R258-K260 PolarHBondContact O-N 3.01Å
259	I	25.7	Very low	27.1	Very low	146 Å²	146	147 Å²	147	75%	0.749	82%	0.815	S	S	*	*			trans	-58.8	110.4	173.7	-58.5	178.8	0	0	0	108.1	I257 T261	I257-I259 HydrophobicContact CG2-CG1 4.39Å; I257-I259 PolarHBondContact O-N 2.9Å; I259-T261 PolarHBondContact O-N 2.94Å
260	K	23.3	Very low	27	Very low	166 Å²	166	148.3 Å²	148.3	72%	0.722	82%	0.817	S	S	*	*			trans	-69	110.1	171.1	-79.1	-176.8	171.9	-174	0	109	R258	R258-K260 PolarHBondContact O-N 3.01Å
261	T	29.5	Very low	26.9	Very low	131 Å²	131	147.1 Å²	147.1	80%	0.804	82%	0.816	S	S	*	*			trans	-80.5	112.9	149.5	41.7	0	0	0	0	107.6	I259	I259-T261 PolarHBondContact O-N 2.94Å
262	E	26	Very low	26.9	Very low	161 Å²	161	146.5 Å²	146.5	75%	0.752	81%	0.81	S	S	*	*			trans	-77.2	134.6	171.5	-62.4	-162.8	145.4	0	0	109.2
263	R	28.1	Very low	27	Very low	198 Å²	198	149.7 Å²	149.7	75%	0.747	81%	0.805	S	S	*	*			trans	-77.4	127.9	-174.1	-70.6	170.7	84.5	171.5	1.8	109.9	E265	R263-E265 HydrophobicContact CB-CG 4.19Å; R263-E265 IonicContact CZ-OE1 3.22Å; R263-E265 VanDerWaalsContact CZ-OE1 3.22Å; R263-E265 IonicContact CZ-OE2 3.49Å; R263-E265 VanDerWaalsContact NE-CD 3.26Å; R263-E265 IonicContact NE-OE1 3.48Å; R263-E265 PolarHBondContact NE-OE1 3.36Å; R263-E265 IonicContact NE-OE2 3.41Å; R263-E265 IonicContact NH2-OE1 2.84Å; R263-E265 PolarHBondContact NH2-OE1 3.12Å; R263-E265 IonicContact NH2-OE2 3.51Å; R263-E265 PolarHBondContact NH2-OE2 3.25Å
264	M	26.9	Very low	26.9	Very low	193 Å²	193	155 Å²	155	95%	0.951	81%	0.81	S	S	*	*			trans	-101.5	77.8	166.3	-171.6	168.5	-176.9	0	0	109.3
265	E	34.4	Very low	26.9	Very low	127 Å²	127	152.4 Å²	152.4	59%	0.593	81%	0.805	S	S	*	*			trans	-142	52.4	175.8	65.1	-172.8	94.3	0	0	113.2	R263	R263-E265 HydrophobicContact CB-CG 4.19Å; R263-E265 IonicContact CZ-OE1 3.22Å; R263-E265 VanDerWaalsContact CZ-OE1 3.22Å; R263-E265 IonicContact CZ-OE2 3.49Å; R263-E265 VanDerWaalsContact NE-CD 3.26Å; R263-E265 IonicContact NE-OE1 3.48Å; R263-E265 PolarHBondContact NE-OE1 3.36Å; R263-E265 IonicContact NE-OE2 3.41Å; R263-E265 IonicContact NH2-OE1 2.84Å; R263-E265 PolarHBondContact NH2-OE1 3.12Å; R263-E265 IonicContact NH2-OE2 3.51Å; R263-E265 PolarHBondContact NH2-OE2 3.25Å
266	D	29.1	Very low	26.8	Very low	155 Å²	155	154.8 Å²	154.8	83%	0.829	81%	0.811	S	S	*	*			trans	-92.7	113.2	137.4	-94	-48.6	0	0	0	107.4
267	W	27	Very low	26.8	Very low	234 Å²	234	148.8 Å²	148.8	89%	0.886	81%	0.809	S	S	*	*	S	Bend	trans	169.9	103.1	139.4	-98.4	48.3	0	0	0	110.4
268	I	28	Very low	26.8	Very low	151 Å²	151	146 Å²	146	77%	0.774	81%	0.811	S	S	*	*			trans	65.5	80.2	152.7	-39.5	178.1	0	0	0	118.2
269	G	24.4	Very low	26.9	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	81%	0.808	S	S	*	*				73.9	118.8	98.7	0	0	0	0	0	122.6
270	A	26.2	Very low	27	Very low	108 Å²	108	137.4 Å²	137.4	89%	0.893	81%	0.81	S	S	*	*			trans	86.9	114	138.8	0	0	0	0	0	122.6
271	G	25.5	Very low	27.2	Very low	89 Å²	89	138 Å²	138	92%	0.918	82%	0.816	S	S	*	*			trans	84.9	144.5	151.4	0	0	0	0	0	117.5
272	G	25.5	Very low	27.6	Very low	70 Å²	70	141 Å²	141	72%	0.722	82%	0.82	S	S	*	*			cis	170.1	157.5	-7.5	0	0	0	0	0	113.1
273	N	28.8	Very low	27.7	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	82%	0.82	S	S	*	*			trans	70.1	95.4	167.9	-63	-1.9	0	0	0	121.3
274	Q	28.3	Very low	28.2	Very low	186 Å²	186	131.8 Å²	131.8	87%	0.869	83%	0.831	S	S	*	*				43.9	146.3	116.8	-64.6	-175.2	-3.7	0	0	124.5
275	A	27.3	Very low	28.2	Very low	94 Å²	94	127 Å²	127	78%	0.777	82%	0.821	S	S	*	*			trans	72	150.2	158.3	0	0	0	0	0	117.3
276	E	26.1	Very low	27.9	Very low	197 Å²	197	127.7 Å²	127.7	92%	0.921	84%	0.835	S	S	*	*			cis	-144.3	-173.8	-1	-141.4	172.7	168.4	0	0	110.6
277	A	25.6	Very low	27.6	Very low	99 Å²	99	126.5 Å²	126.5	82%	0.818	83%	0.832	S	S	*	*			trans	-133.4	141	-172.5	0	0	0	0	0	114.6
278	A	23.9	Very low	27.6	Very low	104 Å²	104	124 Å²	124	86%	0.86	83%	0.833	S	S	*	*			trans	-161.9	138.4	162	0	0	0	0	0	115.1
279	A	25.1	Very low	27.4	Very low	96 Å²	96	124.2 Å²	124.2	79%	0.793	83%	0.834	S	S	*	*			trans	16.8	119.3	153.1	0	0	0	0	0	123.8
280	A	28.2	Very low	27.7	Very low	97 Å²	97	126.3 Å²	126.3	80%	0.802	83%	0.828	S	S	*	*				30.3	131.5	123.1	0	0	0	0	0	123.2
281	E	27.2	Very low	28.3	Very low	180 Å²	180	128 Å²	128	84%	0.841	83%	0.828	S	S	*	*				-161.1	166.5	114.1	-108.3	-57.4	147.5	0	0	110
282	E	38.6	Very low	29.2	Very low	193 Å²	193	127.9 Å²	127.9	90%	0.902	81%	0.812	S	S	*	*			trans	-85	139.5	-172	-68.5	-155.4	140.3	0	0	115.1
283	G	28	Very low	30	Very low	72 Å²	72	128.4 Å²	128.4	74%	0.742	82%	0.818	S	S	*	*			trans	-176.6	116.1	171.6	0	0	0	0	0	111.9	A285	G283-A285 PolarHBondContact O-N 3.34Å
284	G	39.3	Very low	30.1	Very low	94 Å²	94	132.4 Å²	132.4	97%	0.969	82%	0.821	S	S	*	*			trans	-68.6	124.6	-176	0	0	0	0	0	113.1
285	A	26.7	Very low	30	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	82%	0.819	S	S	*	*			trans	-135.4	137.1	179.7	0	0	0	0	0	112.5	G283	G283-A285 PolarHBondContact O-N 3.34Å
286	T	27.1	Very low	30	Very low	143 Å²	143	131.8 Å²	131.8	88%	0.877	83%	0.826	S	S	*	*			trans	-73.9	131.6	172.3	7.6	0	0	0	0	111
287	V	23.8	Very low	30	Very low	129 Å²	129	129.8 Å²	129.8	78%	0.782	82%	0.82	S	S	*	*			trans	-86.7	120.1	175.4	178.5	0	0	0	0	110.2	I289	V287-I289 HydrophobicContact CG1-CD1 4.29Å; V287-I289 HydrophobicContact CG1-CG1 3.96Å
288	M	25.8	Very low	30	Very low	182 Å²	182	134 Å²	134	90%	0.897	83%	0.825	S	S	*	*			trans	-105	144.9	161.1	-63.8	-151.2	-56.5	0	0	109.7
289	I	25	Very low	30.1	Very low	156 Å²	156	134.8 Å²	134.8	80%	0.8	82%	0.82	S	S	*	*			trans	-132.2	127.8	172.8	-57.5	178.4	0	0	0	107.7	V287	V287-I289 HydrophobicContact CG1-CD1 4.29Å; V287-I289 HydrophobicContact CG1-CG1 3.96Å
290	D	29.3	Very low	30.2	Very low	115 Å²	115	134.8 Å²	134.8	62%	0.615	82%	0.82	S	S	*	*			trans	-120.1	149.6	169.7	172.9	47.4	0	0	0	109.8	S292	D290-S292 VanDerWaalsContact C-N 3.26Å; D290-S292 PolarHBondContact O-N 3.36Å; D290-S292 VanDerWaalsContact O-N 3.08Å; D290-S292 VanDerWaalsContact OD2-CB 3.29Å; D290-S292 WeakPolarHBondContact OD2-CB 3.26Å; D290-S292 PolarHBondContact OD2-OG 2.97Å
291	T	39.6	Very low	30.5	Very low	145 Å²	145	135.8 Å²	135.8	89%	0.89	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	43.3	-170.4	49.1	0	0	0	0	113.6
292	S	43.3	Very low	30.8	Very low	85 Å²	85	135.8 Å²	135.8	59%	0.594	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	-8	-172.2	59.1	0	0	0	0	115.8	D290 R294	D290-S292 VanDerWaalsContact C-N 3.26Å; D290-S292 PolarHBondContact O-N 3.36Å; D290-S292 VanDerWaalsContact O-N 3.08Å; D290-S292 VanDerWaalsContact OD2-CB 3.29Å; D290-S292 WeakPolarHBondContact OD2-CB 3.26Å; D290-S292 PolarHBondContact OD2-OG 2.97Å; S292-R294 PolarHBondContact O-N 3.33Å; S292-R294 VanDerWaalsContact O-N 3.15Å
293	G	44.1	Very low	30.2	Very low	81 Å²	81	130.2 Å²	130.2	84%	0.835	82%	0.817	S	S	*	*			trans	67.9	17.5	154.5	0	0	0	0	0	118.3
294	R	29.6	Very low	30.3	Very low	241 Å²	241	130.2 Å²	130.2	91%	0.909	82%	0.817	S	S	*	*			trans	-137.4	137.2	170.5	-86.6	-173.3	168.4	177.4	-3.4	112.6	S292	S292-R294 PolarHBondContact O-N 3.33Å; S292-R294 VanDerWaalsContact O-N 3.15Å
295	S	26.3	Very low	29.8	Very low	117 Å²	117	134.8 Å²	134.8	82%	0.818	82%	0.818	S	S	*	*			trans	-125.6	138.5	176.5	49.6	0	0	0	0	111
296	T	27.9	Very low	29.7	Very low	151 Å²	151	134.3 Å²	134.3	93%	0.926	82%	0.822	S	S	*	*			trans	-150.8	132.9	170.7	5.9	0	0	0	0	109.3
297	L	26	Very low	29.7	Very low	154 Å²	154	133.8 Å²	133.8	81%	0.806	82%	0.819	S	S	*	*			trans	-90.6	143.3	179.3	-83.8	156.6	0	0	0	111.6
298	M	24.9	Very low	30	Very low	187 Å²	187	138.5 Å²	138.5	92%	0.921	82%	0.823	S	S	*	*			trans	-138.2	147.7	156.7	-82.4	-65	164.6	0	0	108.4
299	T	26.1	Very low	30.1	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	82%	0.817	S	S	*	*			trans	-129.2	155	-157.9	43.8	0	0	0	0	114.6
300	A	26.7	Very low	30.3	Very low	95 Å²	95	131.5 Å²	131.5	79%	0.785	82%	0.818	S	S	*	*			trans	68.7	167.8	155	0	0	0	0	0	118.1
301	P	34.8	Very low	30.3	Very low	118 Å²	118	135.7 Å²	135.7	77%	0.766	83%	0.834	S	S	*	*			cis	-121.9	175.4	-12.6	27	-6.4	0	0	0	114.1
302	L	33.2	Very low	29.6	Very low	181 Å²	181	134 Å²	134	95%	0.948	83%	0.834	S	S	*	*			trans	-126.7	147.8	159.1	-88.5	173.2	0	0	0	110.6
303	G	27.8	Very low	29	Very low	76 Å²	76	135.6 Å²	135.6	78%	0.784	85%	0.846	S	S	*	*			trans	92.3	141	-179.3	0	0	0	0	0	113.7
304	G	28.3	Very low	28.2	Very low	71 Å²	71	137.7 Å²	137.7	73%	0.732	85%	0.848	S	S	*	*			cis	174.1	178	-5.1	0	0	0	0	0	112.3
305	L	28.9	Very low	28.1	Very low	191 Å²	191	131.6 Å²	131.6	100%	1	84%	0.842	S	S	*	*			trans	67.1	134.9	175.5	-62.4	168.8	0	0	0	117.8
306	G	25.2	Very low	27.9	Very low	80 Å²	80	135.5 Å²	135.5	83%	0.825	85%	0.845	S	S	*	*			trans	167.7	119.4	172.3	0	0	0	0	0	111.2
307	T	28	Very low	27.9	Very low	133 Å²	133	131.6 Å²	131.6	82%	0.816	82%	0.824	S	S	*	*			trans	-103.8	151.5	-175	54.8	0	0	0	0	112.3
308	R	28.8	Very low	27.9	Very low	228 Å²	228	131.5 Å²	131.5	86%	0.86	82%	0.819	S	S	*	*				174.3	129.9	124.3	-95.1	169	78.3	169.6	6.3	115.1
309	S	29.1	Very low	28	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	81%	0.807	S	S	*	*			trans	28.2	120.3	143.3	61.5	0	0	0	0	121.4
310	G	27.7	Very low	27.9	Very low	81 Å²	81	127.2 Å²	127.2	84%	0.835	80%	0.799	S	S	*	*			trans	-163.4	97.7	155.9	0	0	0	0	0	111.2
311	Q	29.4	Very low	27.9	Very low	203 Å²	203	131.2 Å²	131.2	95%	0.949	79%	0.794	S	S	*	*			trans	-88.6	136.7	178.6	-73.1	177	-40.6	0	0	111.8
312	A	25.8	Very low	27.4	Very low	108 Å²	108	134.4 Å²	134.4	89%	0.893	80%	0.796	S	S	*	*			trans	-155.2	125.4	144.1	0	0	0	0	0	108.6
313	S	29.5	Very low	27.1	Very low	120 Å²	120	130.8 Å²	130.8	84%	0.839	79%	0.786	S	S	*	*			trans	-127.2	132.2	-174.6	56	0	0	0	0	111.5
314	S	28.6	Very low	27.8	Very low	125 Å²	125	132.1 Å²	132.1	87%	0.874	78%	0.781	S	S	*	*			trans	-158.9	112	156	58.4	0	0	0	0	111.1
315	S	27.7	Very low	27.7	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	79%	0.787	S	S	*	*			trans	-94.1	143.5	167.3	52.4	0	0	0	0	110.5
316	F	21.6	Very low	27.4	Very low	198 Å²	198	129.8 Å²	129.8	87%	0.868	78%	0.776	S	S	*	*			trans	-155.5	161	142.4	-141.5	-104.6	0	0	0	112.6
317	S	26.9	Very low	27.3	Very low	70 Å²	70	131.8 Å²	131.8	49%	0.49	78%	0.777	S	S	.	*			trans	-95.3	-167.6	177.5	49	0	0	0	0	110.2
318	E	27.4	Very low	27	Very low	151 Å²	151	132.1 Å²	132.1	71%	0.706	78%	0.778	S	S	*	*			cis	-164.9	143.1	16.2	-149.6	151.5	119.6	0	0	112.8
319	T	26.2	Very low	26.8	Very low	111 Å²	111	126.9 Å²	126.9	68%	0.681	77%	0.772	S	S	*	*			trans	61.6	161.1	146.1	48.3	0	0	0	0	125.3
320	D	24.2	Very low	26.4	Very low	108 Å²	108	127 Å²	127	58%	0.578	77%	0.767	S	S	*	*			trans	82.9	137.6	149.2	-81.2	8.2	0	0	0	121.1
321	R	26.2	Very low	26.2	Very low	180 Å²	180	131.4 Å²	131.4	68%	0.679	77%	0.771	S	S	*	*			cis	-168.2	161.9	-16.4	-133.9	171.4	-174.4	129.1	-4.1	113.3
322	F	24.8	Very low	26	Very low	184 Å²	184	127.1 Å²	127.1	81%	0.807	76%	0.759	S	S	*	*			trans	73.9	149.3	146.4	-82.9	-49.9	0	0	0	126
323	S	26.8	Very low	25.9	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	75%	0.751	S	S	*	*			trans	-169.4	177.7	160.6	-140.3	0	0	0	0	106.4
324	P	43.8	Very low	25.7	Very low	103 Å²	103	132.5 Å²	132.5	67%	0.669	74%	0.744	S	S	*	*			cis	-135.5	-148.7	-5.3	42.3	-22	0	0	0	112.7
325	T	24.4	Very low	25.6	Very low	140 Å²	140	134.7 Å²	134.7	86%	0.859	74%	0.74	S	S	*	*			trans	74.6	135.7	156.9	34.1	0	0	0	0	122.1
326	G	23.3	Very low	25.4	Very low	74 Å²	74	140.4 Å²	140.4	76%	0.763	75%	0.745	S	S	*	*			trans	172.7	134.4	165.9	0	0	0	0	0	111.8
327	S	23.2	Very low	25.6	Very low	121 Å²	121	135.5 Å²	135.5	85%	0.846	74%	0.741	S	S	*	*			trans	-141.2	147.4	-173.2	-54.1	0	0	0	0	112.3
328	V	22.3	Very low	25.5	Very low	140 Å²	140	140.2 Å²	140.2	85%	0.848	75%	0.752	S	S	*	*			trans	171.4	156.5	161.9	136.6	0	0	0	0	108.8
329	V	23	Very low	25.4	Very low	119 Å²	119	138 Å²	138	72%	0.721	75%	0.753	S	S	*	*			cis	-171.1	135.8	-47.6	126.5	0	0	0	0	108.2
330	V	22	Very low	25.3	Very low	111 Å²	111	140.4 Å²	140.4	67%	0.673	76%	0.757	S	S	*	*			trans	36.6	126.3	155.8	-177.6	0	0	0	0	121.4	T332	V330-T332 HydrophobicContact CG1-CG2 4.01Å
331	L	23.3	Very low	25.4	Very low	174 Å²	174	140.8 Å²	140.8	91%	0.911	77%	0.768	S	S	*	*				-140.7	165.9	126.8	-94.2	-171.6	0	0	0	110.9
332	T	24.7	Very low	26.1	Very low	113 Å²	113	137.7 Å²	137.7	69%	0.693	77%	0.771	S	S	*	*			trans	-129	152.9	-160.2	57.4	0	0	0	0	113.4	V330	V330-T332 HydrophobicContact CG1-CG2 4.01Å
333	E	24.7	Very low	26.1	Very low	158 Å²	158	133.9 Å²	133.9	74%	0.738	77%	0.767	S	S	*	*			trans	178.6	168.9	131.4	-92.9	-150.8	123.5	0	0	109.8
334	R	24.8	Very low	26.1	Very low	184 Å²	184	140.4 Å²	140.4	69%	0.694	78%	0.776	S	S	*	*			cis	-176.5	117.1	-42.2	178.6	178.7	-169.3	173.5	4.2	110
335	Q	25.5	Very low	25.2	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.794	78%	0.776	S	S	*	*			trans	64.9	167.4	167.9	-63.9	177.6	7	0	0	114.3
336	R	25	Very low	25.4	Very low	234 Å²	234	140.3 Å²	140.3	88%	0.883	78%	0.776	S	S	*	*			cis	-145.2	145.8	20.2	-169.9	176.9	-171.5	157.4	1.9	111.9
337	A	25.5	Very low	25.7	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	78%	0.779	S	S	*	*			trans	-78.7	155.5	179	0	0	0	0	0	113.3
338	K	24.7	Very low	26	Very low	170 Å²	170	147.4 Å²	147.4	74%	0.739	78%	0.78	S	S	*	*			trans	-138.3	127.2	145.2	-176.4	146.5	-177.8	-178.6	0	110.5	E340	K338-E340 VanDerWaalsContact CE-CD 3.47Å; K338-E340 WeakPolarHBondContact CE-OE1 3.3Å; K338-E340 IonicContact NZ-OE1 2.9Å; K338-E340 PolarHBondContact NZ-OE1 3.33Å; K338-E340 IonicContact NZ-OE2 3.7Å
339	S	25.5	Very low	26.2	Very low	103 Å²	103	152.3 Å²	152.3	72%	0.72	78%	0.783	S	S	*	*			trans	-107	138.6	178	52.2	0	0	0	0	110.3
340	E	24.6	Very low	26.5	Very low	163 Å²	163	155.2 Å²	155.2	76%	0.762	79%	0.789	S	S	*	*			trans	-155.9	127.9	163.6	-109.5	143.7	-143.6	0	0	111	K338	K338-E340 VanDerWaalsContact CE-CD 3.47Å; K338-E340 WeakPolarHBondContact CE-OE1 3.3Å; K338-E340 IonicContact NZ-OE1 2.9Å; K338-E340 PolarHBondContact NZ-OE1 3.33Å; K338-E340 IonicContact NZ-OE2 3.7Å
341	S	26.5	Very low	26.7	Very low	115 Å²	115	156 Å²	156	80%	0.804	80%	0.797	S	S	*	*			trans	-173.2	169.5	175.1	60.7	0	0	0	0	106.7
342	P	40.6	Very low	26.8	Very low	116 Å²	116	153.2 Å²	153.2	75%	0.753	79%	0.791	S	S	*	*			cis	-119.1	-170.7	2	38.7	-20.2	0	0	0	112.2
343	S	23.8	Very low	27.1	Very low	103 Å²	103	153.8 Å²	153.8	72%	0.72	80%	0.8	S	S	*	*				169.2	137.3	87.5	49.7	0	0	0	0	109.3
344	R	26.5	Very low	27.7	Very low	243 Å²	243	156 Å²	156	92%	0.917	81%	0.811	S	S	*	*				64.8	126.2	97.2	-162.9	-173.8	-176.1	162.5	3	113.8
345	A	25.9	Very low	27.9	Very low	83 Å²	83	150.5 Å²	150.5	69%	0.686	81%	0.811	S	S	*	*			cis	-166.1	173.7	-13.1	0	0	0	0	0	108.1
346	D	28.7	Very low	28.3	Very low	159 Å²	159	150.8 Å²	150.8	85%	0.85	81%	0.813	S	S	*	*			trans	-157.6	173.1	141.8	-132.1	-49.6	0	0	0	113
347	E	28.3	Very low	28.4	Very low	178 Å²	178	149.2 Å²	149.2	83%	0.832	82%	0.815	S	S	*	*			trans	-81.8	152	-157.1	-71.1	-173.6	53.1	0	0	118.1
348	L	29.2	Very low	28.7	Very low	165 Å²	165	152.5 Å²	152.5	86%	0.864	81%	0.814	S	S	*	*			trans	-76.7	129	165.4	-82.1	159.9	0	0	0	111
349	R	26.9	Very low	29	Very low	243 Å²	243	149.3 Å²	149.3	92%	0.917	82%	0.82	S	S	*	*			trans	-140.2	91.9	165.6	-161.8	173	-171.3	170.8	3.9	113
350	Q	29	Very low	29.2	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	82%	0.82	S	S	*	*			trans	-85.7	141.3	164.7	-67	-177.8	-5.3	0	0	110.7
351	P	26.5	Very low	29.7	Very low	128 Å²	128	149.1 Å²	149.1	83%	0.831	82%	0.82	S	S	*	*			trans	-105.9	141.6	151.3	34.9	-27	0	0	0	110.6
352	S	26.7	Very low	30	Very low	115 Å²	115	150.2 Å²	150.2	80%	0.804	82%	0.817	S	S	*	*			trans	-106.3	142.6	178.5	47.7	0	0	0	0	112.1
353	S	30.7	Very low	29.7	Very low	126 Å²	126	151 Å²	151	88%	0.881	81%	0.812	S	S	*	*			trans	-173.4	155.2	153	19.5	0	0	0	0	110
354	Q	37	Very low	30.2	Very low	205 Å²	205	147.9 Å²	147.9	96%	0.958	80%	0.796	S	S	*	*			trans	-85.3	143.2	-178.5	-66.5	161.9	-43.6	0	0	110.9
355	G	29.3	Very low	30.7	Very low	68 Å²	68	139.5 Å²	139.5	70%	0.701	79%	0.785	S	S	*	*			trans	-151.5	137.9	173.2	0	0	0	0	0	109.9	E357	G355-E357 PolarHBondContact O-N 3.21Å
356	E	32.8	Very low	31.2	Very low	176 Å²	176	144 Å²	144	82%	0.822	79%	0.786	S	S	*	*			trans	-60.9	128.9	-167.4	-62.6	169.8	117.2	0	0	112.8	H358	E356-H358 PolarHBondContact O-N 2.86Å
357	E	27	Very low	31.7	Very low	201 Å²	201	143.6 Å²	143.6	94%	0.939	78%	0.779	S	S	*	*			trans	-72.3	73.2	-177.7	-68.6	179.5	-144.1	0	0	112.3	G355 A359	G355-E357 PolarHBondContact O-N 3.21Å; E357-A359 PolarHBondContact O-N 2.84Å; E357-A359 VanDerWaalsContact O-N 3.1Å
358	H	33.3	Very low	32.3	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.755	78%	0.778	S	S	*	*			trans	-66.2	106.3	166.8	-83.6	-85.8	0	0	0	110	E356 A360	E356-H358 PolarHBondContact O-N 2.86Å; H358-A360 VanDerWaalsContact C-N 3.31Å; H358-A360 PolarHBondContact O-N 2.08Å
359	A	29.8	Very low	32.8	Very low	103 Å²	103	144.1 Å²	144.1	85%	0.851	78%	0.775	S	S	*	*			trans	-60	91.1	168.4	0	0	0	0	0	110.6	E357 F361	E357-A359 PolarHBondContact O-N 2.84Å; E357-A359 VanDerWaalsContact O-N 3.1Å; A359-F361 PolarHBondContact O-N 3.3Å
360	A	29.4	Very low	33.5	Very low	89 Å²	89	138.8 Å²	138.8	74%	0.736	76%	0.764	S	S	*	*			trans	-66	122.5	169.6	0	0	0	0	0	108.4	H358 D362	H358-A360 VanDerWaalsContact C-N 3.31Å; H358-A360 PolarHBondContact O-N 2.08Å; A360-D362 VanDerWaalsContact C-N 3.25Å; A360-D362 PolarHBondContact O-N 2.52Å
361	F	35.1	Very low	34	Very low	173 Å²	173	140.9 Å²	140.9	76%	0.759	76%	0.764	S	S	*	*			trans	-72.2	85.7	172	-176.7	-103.4	0	0	0	108.9	A359 M363	A359-F361 PolarHBondContact O-N 3.3Å; F361-M363 HydrophobicContact CD1-CG 3.96Å; F361-M363 HydrophobicContact CE1-CG 3.57Å; F361-M363 HydrophobicContact CE1-SD 3.59Å; F361-M363 VanDerWaalsContact CE1-SD 3.59Å; F361-M363 HydrophobicContact CZ-CG 4.49Å; F361-M363 HydrophobicContact CZ-SD 4Å; F361-M363 PolarHBondContact O-N 3.05Å
362	D	32.5	Very low	34.7	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	76%	0.761	S	S	*	*			trans	-74.8	103.8	-178.5	-176.7	29	0	0	0	111.1	A360 G364	A360-D362 VanDerWaalsContact C-N 3.25Å; A360-D362 PolarHBondContact O-N 2.52Å; D362-G364 PolarHBondContact O-N 2.98Å; D362-G364 PolarHBondContact OD1-N 3.4Å
363	M	35.5	Very low	35.2	Very low	132 Å²	132	145.2 Å²	145.2	65%	0.65	76%	0.76	S	S	*	*			trans	-78.4	64.3	165.7	-76.3	-69.7	-67	0	0	109.7	F361	F361-M363 HydrophobicContact CD1-CG 3.96Å; F361-M363 HydrophobicContact CE1-CG 3.57Å; F361-M363 HydrophobicContact CE1-SD 3.59Å; F361-M363 VanDerWaalsContact CE1-SD 3.59Å; F361-M363 HydrophobicContact CZ-CG 4.49Å; F361-M363 HydrophobicContact CZ-SD 4Å; F361-M363 PolarHBondContact O-N 3.05Å
364	G	34.6	Very low	36	Very low	38 Å²	38	144.3 Å²	144.3	39%	0.392	75%	0.749	S	S	.	*			trans	-62.7	147.4	-176.1	0	0	0	0	0	113.5	D362	D362-G364 PolarHBondContact O-N 2.98Å; D362-G364 PolarHBondContact OD1-N 3.4Å
365	G	37.2	Very low	37.1	Very low	66 Å²	66	137 Å²	137	68%	0.68	73%	0.728	S	S	*	*	S	Bend	trans	91.7	45.6	169.2	0	0	0	0	0	116.8
366	Y	35.3	Very low	37.5	Very low	178 Å²	178	141.3 Å²	141.3	70%	0.698	74%	0.735	S	S	*	*			trans	-152.4	72	155.6	-160.2	-94.5	0	0	0	112
367	E	40.2	Very low	38	Very low	150 Å²	150	142.3 Å²	142.3	70%	0.701	73%	0.732	S	S	*	*	S	Bend	trans	-134.3	-19.1	172.5	-65.9	-72.5	146.4	0	0	113.3	K397	E367-K397 IonicContact OE1-NZ 3.58Å; E367-K397 PolarHBondContact OE1-NZ 3.34Å
368	D	39.3	Very low	38.6	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	73%	0.728	S	S	*	*	S	Bend	trans	-88.5	-4	-170.1	-67.7	-49.4	0	0	0	116.5
369	Y	41.7	Very low	39	Very low	201 Å²	201	143.8 Å²	143.8	79%	0.788	73%	0.727	S	S	*	*	S	Bend	trans	-108.1	83.9	177.5	-88.4	-90.5	0	0	0	112.7
370	L	41.2	Very low	39.5	Very low	131 Å²	131	150.4 Å²	150.4	69%	0.686	73%	0.73	S	S	*	*			trans	157.8	69.4	135.4	-83.2	171.4	0	0	0	110.8
371	R	38.5	Very low	40	Very low	224 Å²	224	155.1 Å²	155.1	85%	0.845	73%	0.73	S	S	*	*			trans	-111.3	64.8	164	-166.4	-169.7	-61.8	178.9	4.5	110.4
372	E	40.8	Very low	40.5	Very low	166 Å²	166	151.4 Å²	151.4	78%	0.776	72%	0.718	S	S	*	*			trans	-82.7	116.7	174	-163.8	163.4	-128.5	0	0	109.4	V374	E372-V374 PolarHBondContact O-N 3.06Å
373	Q	37.9	Very low	41.4	Very low	168 Å²	168	148 Å²	148	79%	0.785	70%	0.703	S	S	*	*			trans	-81.4	117.2	179.4	-105.4	-169.3	-37.8	0	0	110.7
374	V	46.6	Very low	42.3	Very low	107 Å²	107	151.4 Å²	151.4	65%	0.648	71%	0.709	S	S	*	*			trans	-118.6	68.3	167.7	-170.2	0	0	0	0	108.6	E372	E372-V374 PolarHBondContact O-N 3.06Å
375	G	60.1	Low	43.7	Very low	50 Å²	50	151.9 Å²	151.9	52%	0.515	70%	0.702	S	S	.	*	S	Bend	trans	68.4	-160	-174.8	0	0	0	0	0	114.1	R377	G375-R377 PolarHBondContact O-N 3.08Å
376	D	39.7	Very low	44.5	Very low	159 Å²	159	152.4 Å²	152.4	85%	0.85	69%	0.693	S	S	*	*	S	Bend	trans	-76.5	22.6	-168.2	-54	-50.9	0	0	0	115.5
377	R	42.9	Very low	45.6	Very low	198 Å²	198	144 Å²	144	75%	0.747	66%	0.66	S	S	*	*			trans	-119.3	110.7	-177.6	-86.4	-177.2	-79	-176	-5	113.4	G375 F379	G375-R377 PolarHBondContact O-N 3.08Å; R377-F379 HydrophobicContact CB-CE2 4.11Å; R377-F379 VanDerWaalsContact O-CD2 3.27Å; R377-F379 WeakPolarHBondContact O-CD2 3.33Å; R377-F379 PolarHBondContact O-N 3.19Å
378	W	39.9	Very low	46.4	Very low	229 Å²	229	142.7 Å²	142.7	87%	0.867	66%	0.656	S	S	*	*			trans	-71.2	91.2	176.8	-56.4	87.2	0	0	0	112	R380	W378-R380 PolarHBondContact O-N 3.04Å
379	F	41.1	Very low	46.8	Very low	166 Å²	166	138 Å²	138	73%	0.728	63%	0.627	S	S	*	*			trans	-75	106.7	171.5	-70.8	-82.6	0	0	0	110.9	R377 Y381	R377-F379 HydrophobicContact CB-CE2 4.11Å; R377-F379 VanDerWaalsContact O-CD2 3.27Å; R377-F379 WeakPolarHBondContact O-CD2 3.33Å; R377-F379 PolarHBondContact O-N 3.19Å; F379-Y381 VanDerWaalsContact C-N 3.29Å; F379-Y381 PolarHBondContact O-N 3.12Å
380	R	39.8	Very low	47.7	Very low	241 Å²	241	130.5 Å²	130.5	91%	0.909	60%	0.604	S	S	*	*			trans	-71.5	84	166.7	-75	-174.8	179	160.1	0.9	110.1	W378 N382	W378-R380 PolarHBondContact O-N 3.04Å; R380-N382 PolarHBondContact O-N 3.14Å
381	Y	40.3	Very low	48.7	Very low	189 Å²	189	129.2 Å²	129.2	74%	0.741	60%	0.604	S	S	*	*			trans	-67.3	101.6	162.5	-157.3	-95.8	0	0	0	107.9	F379 P383	F379-Y381 VanDerWaalsContact C-N 3.29Å; F379-Y381 PolarHBondContact O-N 3.12Å; Y381-P383 WeakPolarHBondContact O-CD 3.15Å
382	N	45.5	Very low	49.8	Very low	94 Å²	94	124.7 Å²	124.7	50%	0.503	59%	0.591	S	S	.	*			trans	-102.8	88.6	-178.5	-167.6	11.2	0	0	0	108.5	R380 R384 N395	R380-N382 PolarHBondContact O-N 3.14Å; N382-R384 PolarHBondContact O-N 3.28Å; N382-N395 PolarHBondContact ND2-O 3.34Å
383	P	51.9	Low	50.9	Low	67 Å²	67	120.2 Å²	120.2	44%	0.435	58%	0.578	S	S	.	*			trans	-58.7	133.7	179.2	25.8	-34.4	0	0	0	109.2	Y381 L385	Y381-P383 WeakPolarHBondContact O-CD 3.15Å; P383-L385 HydrophobicContact CG-CD2 4.38Å; P383-L385 WeakPolarHBondContact O-CG 3.46Å; P383-L385 PolarHBondContact O-N 3.11Å
384	R	54.4	Low	52.7	Low	203 Å²	203	114.2 Å²	114.2	77%	0.766	55%	0.55	S	S	*	.			trans	-68	103.6	-179	-72	179.9	177.1	146.9	-0.4	109.2	N382 T386	N382-R384 PolarHBondContact O-N 3.28Å; R384-T386 PolarHBondContact O-N 3.13Å
385	L	64.3	Low	53.9	Low	49 Å²	49	114.5 Å²	114.5	26%	0.257	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	91.9	-175.5	-62.7	-179.1	0	0	0	109.9	P383 F394 K397 L400	P383-L385 HydrophobicContact CG-CD2 4.38Å; P383-L385 WeakPolarHBondContact O-CG 3.46Å; P383-L385 PolarHBondContact O-N 3.11Å; L385-F394 PolarHBondContact N-O 3.4Å; L385-F394 VanDerWaalsContact N-O 3.07Å; L385-F394 PolarHBondContact O-N 3.33Å; L385-K397 VanDerWaalsContact CD1-CA 3.43Å; L385-K397 HydrophobicContact CD1-CB 3.86Å; L385-L400 HydrophobicContact CB-CB 4.34Å; L385-L400 HydrophobicContact CB-CD2 3.85Å
386	T	53.8	Low	54.5	Low	77 Å²	77	118.1 Å²	118.1	47%	0.472	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.8	133.3	179.5	48.3	0	0	0	0	112	R384 I388 K392	R384-T386 PolarHBondContact O-N 3.13Å; T386-I388 PolarHBondContact O-N 2.99Å; T386-K392 WeakPolarHBondContact CA-O 3.26Å
387	C	58.1	Low	55.9	Low	1 Å²	1	114.9 Å²	114.9	1%	0.007	53%	0.529	C	S	.	.			trans	-69.8	126.4	169.3	-178.4	0	0	0	0	111.2	Y389 C391 K392 F394 L400 H403 H407	C387-Y389 PolarHBondContact O-N 2.85Å; C387-C391 WeakPolarHBondContact O-CA 3.29Å; C387-C391 PolarHBondContact O-N 3.38Å; C387-K392 PolarHBondContact N-O 2.75Å; C387-F394 HydrophobicContact CB-CE2 4.1Å; C387-L400 HydrophobicContact CB-CD1 3.73Å; C387-H403 VanDerWaalsContact SG-CD2 3.54Å; C387-H403 PolarHBondContact SG-NE2 2.88Å; C387-H403 VanDerWaalsContact SG-NE2 3.4Å; C387-H407 VanDerWaalsContact SG-CD2 3.58Å; C387-H407 PolarHBondContact SG-NE2 2.99Å
388	I	56.1	Low	57.4	Low	123 Å²	123	107.6 Å²	107.6	63%	0.631	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.8	-179.6	65.8	-178.5	0	0	0	113.9	T386	T386-I388 PolarHBondContact O-N 2.99Å
389	Y	47.3	Very low	59.1	Low	55 Å²	55	97.7 Å²	97.7	22%	0.216	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-18.6	-176.7	-62.1	-84.1	0	0	0	114.6	L103 L122 C387 M404 H407	L103-Y389 HydrophobicContact CD1-CE1 4.12Å; L122-Y389 HydrophobicContact CD1-CD1 4.36Å; L122-Y389 HydrophobicContact CD1-CE1 3.7Å; C387-Y389 PolarHBondContact O-N 2.85Å; Y389-M404 HydrophobicContact CD2-CE 3.96Å; Y389-M404 HydrophobicContact CD2-SD 3.64Å; Y389-M404 HydrophobicContact CE2-CE 3.46Å; Y389-M404 VanDerWaalsContact CE2-CE 3.46Å; Y389-M404 HydrophobicContact CE2-SD 3.63Å; Y389-H407 WeakPolarHBondContact CB-ND1 3.38Å; Y389-H407 HydrophobicContact CD2-CB 4.17Å; Y389-H407 HydrophobicContact CG-CB 4.14Å; Y389-H407 AromaticContact CG-CG 3.95Å
390	C	61.5	Low	60.7	Low	43 Å²	43	91.1 Å²	91.1	29%	0.291	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.8	17.4	178.1	68.8	0	0	0	0	114.3	K392 H403 H407	C390-K392 PolarHBondContact O-N 2.99Å; C390-H403 PolarHBondContact SG-NE2 2.87Å; C390-H407 WeakPolarHBondContact CB-CE1 3.19Å; C390-H407 PolarHBondContact SG-CE1 3.46Å; C390-H407 PolarHBondContact SG-NE2 3.06Å
391	C	62.4	Low	62.2	Low	104 Å²	104	82.6 Å²	82.6	70%	0.703	43%	0.426	S	S	*	.			trans	55.9	5.1	176.9	-56	0	0	0	0	117	C387 S393	C387-C391 WeakPolarHBondContact O-CA 3.29Å; C387-C391 PolarHBondContact O-N 3.38Å; C391-S393 PolarHBondContact O-N 3.16Å
392	K	60.6	Low	63.6	Low	129 Å²	129	78 Å²	78	56%	0.561	41%	0.407	S	S	*	.			trans	-63.3	125.7	178.5	-70.2	178.4	-175.2	173.8	0	110.7	T386 C387 C390 F394	T386-K392 WeakPolarHBondContact CA-O 3.26Å; C387-K392 PolarHBondContact N-O 2.75Å; C390-K392 PolarHBondContact O-N 2.99Å; K392-F394 HydrophobicContact CB-CE2 3.76Å; K392-F394 HydrophobicContact CB-CZ 3.96Å; K392-F394 VanDerWaalsContact O-CD2 3.26Å; K392-F394 WeakPolarHBondContact O-CD2 3.42Å; K392-F394 WeakPolarHBondContact O-CE2 3.27Å
393	S	64.1	Low	65	Low	72 Å²	72	74.6 Å²	74.6	50%	0.503	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.7	178.3	58.6	0	0	0	0	112.2	C391	C391-S393 PolarHBondContact O-N 3.16Å
394	F	75.4	Confident	65.6	Low	43 Å²	43	72.8 Å²	72.8	19%	0.189	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.1	175.8	-60.7	-88.1	0	0	0	111	L385 C387 K392 Q396 L400 H403	L385-F394 PolarHBondContact N-O 3.4Å; L385-F394 VanDerWaalsContact N-O 3.07Å; L385-F394 PolarHBondContact O-N 3.33Å; C387-F394 HydrophobicContact CB-CE2 4.1Å; K392-F394 HydrophobicContact CB-CE2 3.76Å; K392-F394 HydrophobicContact CB-CZ 3.96Å; K392-F394 VanDerWaalsContact O-CD2 3.26Å; K392-F394 WeakPolarHBondContact O-CD2 3.42Å; K392-F394 WeakPolarHBondContact O-CE2 3.27Å; F394-Q396 VanDerWaalsContact C-N 3.35Å; F394-L400 HydrophobicContact CB-CB 4.23Å; F394-L400 HydrophobicContact CD2-CB 4.2Å; F394-L400 HydrophobicContact CD2-CD1 3.94Å; F394-L400 HydrophobicContact CE2-CD1 4.26Å; F394-L400 HydrophobicContact CG-CB 4.35Å; F394-H403 HydrophobicContact CE1-CB 4.06Å; F394-H403 HydrophobicContact CE2-CB 4.08Å; F394-H403 AromaticContact CE2-CD2 3.29Å; F394-H403 WeakPolarHBondContact CE2-CD2 3.35Å; F394-H403 AromaticContact CE2-CG 3.73Å; F394-H403 AromaticContact CE2-NE2 3.94Å; F394-H403 HydrophobicContact CZ-CB 3.63Å; F394-H403 AromaticContact CZ-CD2 3.38Å; F394-H403 WeakPolarHBondContact CZ-CD2 3.44Å; F394-H403 AromaticContact CZ-CG 3.33Å; F394-H403 AromaticContact CZ-ND1 3.89Å; F394-H403 AromaticContact CZ-NE2 3.95Å
395	N	71.8	Confident	66.4	Low	112 Å²	112	67.3 Å²	67.3	60%	0.599	35%	0.354	S	S	*	.	S	Bend	trans	-92.8	7.4	-177.1	-59.7	-19.1	0	0	0	113.1	N382	N382-N395 PolarHBondContact ND2-O 3.34Å
396	Q	73.4	Confident	66.5	Low	127 Å²	127	68.9 Å²	68.9	59%	0.593	36%	0.362	S	S	*	.	S	Bend	trans	-155.1	135.1	-174	-66.3	177.7	-13.3	0	0	110.8	F394 S399 L400	F394-Q396 VanDerWaalsContact C-N 3.35Å; Q396-S399 WeakPolarHBondContact O-CB 3.44Å; Q396-S399 PolarHBondContact O-N 3.27Å; Q396-L400 PolarHBondContact O-N 3.22Å
397	K	70.3	Confident	66.8	Low	91 Å²	91	67.9 Å²	67.9	40%	0.396	35%	0.352	S	S	.	.	H	α-helix	trans	-53.2	-57.1	179.6	-172.8	169.3	172	174.9	0	112.5	E367 L385 S399 L400 D401	E367-K397 IonicContact OE1-NZ 3.58Å; E367-K397 PolarHBondContact OE1-NZ 3.34Å; L385-K397 VanDerWaalsContact CD1-CA 3.43Å; L385-K397 HydrophobicContact CD1-CB 3.86Å; K397-S399 PolarHBondContact O-N 3.47Å; K397-L400 CarbonylContact O-C 3.33Å; K397-L400 WeakPolarHBondContact O-CA 3.49Å; K397-L400 WeakPolarHBondContact O-CB 3.47Å; K397-L400 PolarHBondContact O-N 3.12Å; K397-D401 VanDerWaalsContact O-CG 3.26Å; K397-D401 PolarHBondContact O-N 3.24Å
398	G	74	Confident	66.6	Low	45 Å²	45	72 Å²	72	46%	0.464	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-15.4	176.8	0	0	0	0	0	116.1	R402	G398-R402 VanDerWaalsContact O-CB 3.26Å; G398-R402 WeakPolarHBondContact O-CB 3.45Å; G398-R402 PolarHBondContact O-N 3.25Å
399	S	74.9	Confident	66.7	Low	20 Å²	20	67.8 Å²	67.8	14%	0.14	36%	0.359	C	S	.	.	H	α-helix	trans	-83.1	-36.6	169.3	-77.6	0	0	0	0	112.5	Q396 K397 R402 H403	Q396-S399 WeakPolarHBondContact O-CB 3.44Å; Q396-S399 PolarHBondContact O-N 3.27Å; K397-S399 PolarHBondContact O-N 3.47Å; S399-R402 PolarHBondContact OG-NH2 3.13Å; S399-H403 WeakPolarHBondContact O-CB 3.35Å; S399-H403 PolarHBondContact O-N 3.3Å; S399-H403 VanDerWaalsContact O-N 3.16Å
400	L	74.4	Confident	67.3	Low	28 Å²	28	69 Å²	69	15%	0.147	37%	0.368	C	S	.	.	H	α-helix	trans	-64.2	-47.8	167.6	174.5	59.3	0	0	0	110.4	L385 C387 F394 Q396 K397 R402 H403 M404	L385-L400 HydrophobicContact CB-CB 4.34Å; L385-L400 HydrophobicContact CB-CD2 3.85Å; C387-L400 HydrophobicContact CB-CD1 3.73Å; F394-L400 HydrophobicContact CB-CB 4.23Å; F394-L400 HydrophobicContact CD2-CB 4.2Å; F394-L400 HydrophobicContact CD2-CD1 3.94Å; F394-L400 HydrophobicContact CE2-CD1 4.26Å; F394-L400 HydrophobicContact CG-CB 4.35Å; Q396-L400 PolarHBondContact O-N 3.22Å; K397-L400 CarbonylContact O-C 3.33Å; K397-L400 WeakPolarHBondContact O-CA 3.49Å; K397-L400 WeakPolarHBondContact O-CB 3.47Å; K397-L400 PolarHBondContact O-N 3.12Å; L400-R402 VanDerWaalsContact C-N 3.32Å; L400-R402 PolarHBondContact O-N 2.78Å; L400-H403 CarbonylContact O-C 3.33Å; L400-H403 WeakPolarHBondContact O-CA 3.24Å; L400-H403 WeakPolarHBondContact O-CB 3.39Å; L400-H403 PolarHBondContact O-N 3.46Å; L400-M404 HydrophobicContact CD1-CG 4.1Å; L400-M404 HydrophobicContact CG-CG 4.32Å; L400-M404 WeakPolarHBondContact O-CB 3.36Å; L400-M404 PolarHBondContact O-N 3.37Å
401	D	71.1	Confident	67.6	Low	62 Å²	62	69.3 Å²	69.3	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-37.6	-177.1	-53.9	-31.6	0	0	0	112.6	K397 H403 M404 R405	K397-D401 VanDerWaalsContact O-CG 3.26Å; K397-D401 PolarHBondContact O-N 3.24Å; D401-H403 VanDerWaalsContact C-N 3.35Å; D401-M404 WeakPolarHBondContact O-CB 3.46Å; D401-R405 WeakPolarHBondContact O-CG 3.33Å; D401-R405 PolarHBondContact O-N 2.97Å; D401-R405 PolarHBondContact O-NE 2.88Å
402	R	71.1	Confident	67.9	Low	92 Å²	92	67.9 Å²	67.9	35%	0.347	36%	0.359	S	S	.	.	H	α-helix	trans	-68.1	-34.8	173.2	176.2	178.5	57.9	-168.4	-9.7	112.1	G398 S399 L400 R424	G398-R402 VanDerWaalsContact O-CB 3.26Å; G398-R402 WeakPolarHBondContact O-CB 3.45Å; G398-R402 PolarHBondContact O-N 3.25Å; S399-R402 PolarHBondContact OG-NH2 3.13Å; L400-R402 VanDerWaalsContact C-N 3.32Å; L400-R402 PolarHBondContact O-N 2.78Å; R402-R424 HydrophobicContact CG-CG 4.29Å
403	H	73.4	Confident	68.5	Low	23 Å²	23	64.5 Å²	64.5	11%	0.106	34%	0.344	C	S	.	.	H	α-helix	trans	-74.5	-36.3	175.7	172	64.8	0	0	0	111.8	C387 C390 F394 S399 L400 D401 R405 L406 H407	C387-H403 VanDerWaalsContact SG-CD2 3.54Å; C387-H403 PolarHBondContact SG-NE2 2.88Å; C387-H403 VanDerWaalsContact SG-NE2 3.4Å; C390-H403 PolarHBondContact SG-NE2 2.87Å; F394-H403 HydrophobicContact CE1-CB 4.06Å; F394-H403 HydrophobicContact CE2-CB 4.08Å; F394-H403 AromaticContact CE2-CD2 3.29Å; F394-H403 WeakPolarHBondContact CE2-CD2 3.35Å; F394-H403 AromaticContact CE2-CG 3.73Å; F394-H403 AromaticContact CE2-NE2 3.94Å; F394-H403 HydrophobicContact CZ-CB 3.63Å; F394-H403 AromaticContact CZ-CD2 3.38Å; F394-H403 WeakPolarHBondContact CZ-CD2 3.44Å; F394-H403 AromaticContact CZ-CG 3.33Å; F394-H403 AromaticContact CZ-ND1 3.89Å; F394-H403 AromaticContact CZ-NE2 3.95Å; S399-H403 WeakPolarHBondContact O-CB 3.35Å; S399-H403 PolarHBondContact O-N 3.3Å; S399-H403 VanDerWaalsContact O-N 3.16Å; L400-H403 CarbonylContact O-C 3.33Å; L400-H403 WeakPolarHBondContact O-CA 3.24Å; L400-H403 WeakPolarHBondContact O-CB 3.39Å; L400-H403 PolarHBondContact O-N 3.46Å; D401-H403 VanDerWaalsContact C-N 3.35Å; H403-R405 VanDerWaalsContact C-N 3.3Å; H403-R405 PolarHBondContact O-N 2.86Å; H403-L406 VanDerWaalsContact O-CB 3.27Å; H403-L406 WeakPolarHBondContact O-CB 3.32Å; H403-L406 PolarHBondContact O-N 3.14Å; H403-H407 AromaticContact CD2-NE2 3.05Å; H403-H407 PolarHBondContact CD2-NE2 3.05Å; H403-H407 AromaticContact CE1-NE2 2.52Å; H403-H407 PolarHBondContact CE1-NE2 3.27Å; H403-H407 AromaticContact CG-NE2 3.81Å; H403-H407 AromaticContact ND1-NE2 3.55Å; H403-H407 AromaticContact NE2-CD2 3.78Å; H403-H407 AromaticContact NE2-NE2 2.08Å; H403-H407 PolarHBondContact NE2-NE2 3.32Å
404	M	65.8	Low	68.8	Low	29 Å²	29	64.7 Å²	64.7	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-56.5	-40.2	172.7	-89.7	-57.4	-42.9	0	0	112.6	Y389 L400 D401 L406 H407 M408	Y389-M404 HydrophobicContact CD2-CE 3.96Å; Y389-M404 HydrophobicContact CD2-SD 3.64Å; Y389-M404 HydrophobicContact CE2-CE 3.46Å; Y389-M404 VanDerWaalsContact CE2-CE 3.46Å; Y389-M404 HydrophobicContact CE2-SD 3.63Å; L400-M404 HydrophobicContact CD1-CG 4.1Å; L400-M404 HydrophobicContact CG-CG 4.32Å; L400-M404 WeakPolarHBondContact O-CB 3.36Å; L400-M404 PolarHBondContact O-N 3.37Å; D401-M404 WeakPolarHBondContact O-CB 3.46Å; M404-L406 PolarHBondContact O-N 3.07Å; M404-L406 VanDerWaalsContact O-N 3.14Å; M404-H407 PolarHBondContact O-N 3.19Å; M404-H407 VanDerWaalsContact O-N 3.08Å; M404-M408 HydrophobicContact CE-CG 3.83Å; M404-M408 HydrophobicContact CE-SD 3.68Å; M404-M408 WeakPolarHBondContact O-CG 3.46Å; M404-M408 PolarHBondContact O-N 3.44Å
405	R	71.2	Confident	68.9	Low	89 Å²	89	62.7 Å²	62.7	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-58.3	-24.4	175.1	-71.9	170.4	-128.2	174.7	-6.1	114.3	D401 H403 G409 I410	D401-R405 WeakPolarHBondContact O-CG 3.33Å; D401-R405 PolarHBondContact O-N 2.97Å; D401-R405 PolarHBondContact O-NE 2.88Å; H403-R405 VanDerWaalsContact C-N 3.3Å; H403-R405 PolarHBondContact O-N 2.86Å; R405-G409 PolarHBondContact O-N 3.06Å; R405-G409 VanDerWaalsContact O-N 3.12Å; R405-I410 HydrophobicContact CB-CB 4.49Å; R405-I410 HydrophobicContact CG-CB 4.4Å; R405-I410 PolarHBondContact O-N 2.87Å
406	L	65.3	Low	68.8	Low	82 Å²	82	69.2 Å²	69.2	43%	0.429	35%	0.35	S	S	.	.	H	α-helix	trans	-69	-49.1	174	-58.5	165.5	0	0	0	110.3	H403 M404 M408 G409 T423	H403-L406 VanDerWaalsContact O-CB 3.27Å; H403-L406 WeakPolarHBondContact O-CB 3.32Å; H403-L406 PolarHBondContact O-N 3.14Å; M404-L406 PolarHBondContact O-N 3.07Å; M404-L406 VanDerWaalsContact O-N 3.14Å; L406-M408 VanDerWaalsContact C-N 3.26Å; L406-M408 PolarHBondContact O-N 3.19Å; L406-G409 PolarHBondContact O-N 2.89Å; L406-T423 HydrophobicContact CD2-CG2 4.03Å
407	H	60.4	Low	68.7	Low	55 Å²	55	67.9 Å²	67.9	26%	0.255	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-30.4	177.1	-61.9	-70.3	0	0	0	113.1	C387 Y389 C390 H403 M404	C387-H407 VanDerWaalsContact SG-CD2 3.58Å; C387-H407 PolarHBondContact SG-NE2 2.99Å; Y389-H407 WeakPolarHBondContact CB-ND1 3.38Å; Y389-H407 HydrophobicContact CD2-CB 4.17Å; Y389-H407 HydrophobicContact CG-CB 4.14Å; Y389-H407 AromaticContact CG-CG 3.95Å; C390-H407 WeakPolarHBondContact CB-CE1 3.19Å; C390-H407 PolarHBondContact SG-CE1 3.46Å; C390-H407 PolarHBondContact SG-NE2 3.06Å; H403-H407 AromaticContact CD2-NE2 3.05Å; H403-H407 PolarHBondContact CD2-NE2 3.05Å; H403-H407 AromaticContact CE1-NE2 2.52Å; H403-H407 PolarHBondContact CE1-NE2 3.27Å; H403-H407 AromaticContact CG-NE2 3.81Å; H403-H407 AromaticContact ND1-NE2 3.55Å; H403-H407 AromaticContact NE2-CD2 3.78Å; H403-H407 AromaticContact NE2-NE2 2.08Å; H403-H407 PolarHBondContact NE2-NE2 3.32Å; M404-H407 PolarHBondContact O-N 3.19Å; M404-H407 VanDerWaalsContact O-N 3.08Å
408	M	54.8	Low	68.7	Low	87 Å²	87	66.2 Å²	66.2	43%	0.429	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-2	178.6	-59.2	176.7	78.3	0	0	113.7	I100 M404 L406 I410	I100-M408 HydrophobicContact CD1-CE 3.88Å; I100-M408 HydrophobicContact CD1-SD 4.28Å; M404-M408 HydrophobicContact CE-CG 3.83Å; M404-M408 HydrophobicContact CE-SD 3.68Å; M404-M408 WeakPolarHBondContact O-CG 3.46Å; M404-M408 PolarHBondContact O-N 3.44Å; L406-M408 VanDerWaalsContact C-N 3.26Å; L406-M408 PolarHBondContact O-N 3.19Å; M408-I410 HydrophobicContact CB-CD1 3.84Å; M408-I410 HydrophobicContact CB-CG1 3.8Å; M408-I410 HydrophobicContact CE-CD1 4.01Å; M408-I410 PolarHBondContact O-N 3.48Å; M408-I410 VanDerWaalsContact O-N 3.13Å; M408-I410 HydrophobicContact SD-CD1 4.25Å
409	G	57.4	Low	68.3	Low	36 Å²	36	66.1 Å²	66.1	37%	0.371	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	8.3	-177.4	0	0	0	0	0	115.8	R405 L406 T411	R405-G409 PolarHBondContact O-N 3.06Å; R405-G409 VanDerWaalsContact O-N 3.12Å; L406-G409 PolarHBondContact O-N 2.89Å; G409-T411 PolarHBondContact O-N 2.84Å; G409-T411 VanDerWaalsContact O-N 3.11Å
410	I	60.1	Low	68.1	Low	79 Å²	79	70 Å²	70	41%	0.405	36%	0.359	S	S	.	.			trans	-76	106.1	-170.6	-57.3	176	0	0	0	109.9	R405 M408 P412	R405-I410 HydrophobicContact CB-CB 4.49Å; R405-I410 HydrophobicContact CG-CB 4.4Å; R405-I410 PolarHBondContact O-N 2.87Å; M408-I410 HydrophobicContact CB-CD1 3.84Å; M408-I410 HydrophobicContact CB-CG1 3.8Å; M408-I410 HydrophobicContact CE-CD1 4.01Å; M408-I410 PolarHBondContact O-N 3.48Å; M408-I410 VanDerWaalsContact O-N 3.13Å; M408-I410 HydrophobicContact SD-CD1 4.25Å; I410-P412 VanDerWaalsContact O-CD 3.24Å; I410-P412 WeakPolarHBondContact O-CD 3.44Å
411	T	67.7	Low	68.2	Low	50 Å²	50	75.4 Å²	75.4	31%	0.307	38%	0.381	S	S	.	.			trans	-113.2	76.5	-178.6	43.4	0	0	0	0	111.4	G409 F413 K421 Y422 T423	G409-T411 PolarHBondContact O-N 2.84Å; G409-T411 VanDerWaalsContact O-N 3.11Å; T411-F413 PolarHBondContact O-N 3.02Å; T411-F413 VanDerWaalsContact O-N 3.14Å; T411-K421 HydrophobicContact CG2-CB 4.33Å; T411-Y422 CarbonylContact C-O 3.54Å; T411-Y422 WeakPolarHBondContact CA-O 3.11Å; T411-T423 HydrophobicContact CG2-CG2 3.58Å
412	P	69.3	Low	68.4	Low	75 Å²	75	74.8 Å²	74.8	49%	0.487	37%	0.374	S	S	.	.			trans	-78.1	2	-170.4	33.6	-35.1	0	0	0	113.8	I410	I410-P412 VanDerWaalsContact O-CD 3.24Å; I410-P412 WeakPolarHBondContact O-CD 3.44Å
413	F	71.9	Confident	68.3	Low	58 Å²	58	71.3 Å²	71.3	25%	0.254	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	104	-177.3	-58.7	-71.7	0	0	0	110.3	T411 K421 Y422 K425 L428	T411-F413 PolarHBondContact O-N 3.02Å; T411-F413 VanDerWaalsContact O-N 3.14Å; F413-K421 CarbonylContact O-C 3.46Å; F413-Y422 PolarHBondContact N-O 3.2Å; F413-Y422 PolarHBondContact O-N 3.37Å; F413-K425 HydrophobicContact CD1-CB 4.04Å; F413-K425 HydrophobicContact CD1-CG 4.42Å; F413-K425 VanDerWaalsContact CD2-N 3.34Å; F413-K425 HydrophobicContact CE1-CB 3.71Å; F413-K425 HydrophobicContact CE1-CG 4.22Å; F413-K425 HydrophobicContact CE2-CB 4.35Å; F413-K425 VanDerWaalsContact CE2-N 3.34Å; F413-K425 HydrophobicContact CZ-CB 3.88Å; F413-L428 HydrophobicContact CB-CB 3.91Å; F413-L428 HydrophobicContact CB-CD2 3.75Å; F413-L428 HydrophobicContact CB-CG 4.42Å
414	V	70.9	Confident	68.3	Low	75 Å²	75	73.9 Å²	73.9	46%	0.455	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.5	-175.8	-173.6	0	0	0	0	111	R416 G419 K421	V414-R416 PolarHBondContact O-N 3.38Å; V414-G419 WeakPolarHBondContact CG1-O 3.26Å; V414-K421 HydrophobicContact CG2-CG 4.32Å
415	C	76.9	Confident	68.7	Low	2 Å²	2	79.5 Å²	79.5	1%	0.014	40%	0.395	C	S	.	.			trans	-74	116	173.2	-173	0	0	0	0	111.6	I417 G419 K420 L428 H431	C415-I417 PolarHBondContact O-N 2.98Å; C415-I417 PolarHBondContact SG-N 3.25Å; C415-I417 VanDerWaalsContact SG-N 3.37Å; C415-G419 VanDerWaalsContact O-CA 3.32Å; C415-G419 WeakPolarHBondContact O-CA 3.42Å; C415-G419 PolarHBondContact O-N 3.38Å; C415-K420 WeakPolarHBondContact CB-O 3.17Å; C415-K420 PolarHBondContact N-O 3.34Å; C415-L428 HydrophobicContact CB-CD1 3.9Å; C415-H431 PolarHBondContact SG-CD2 3.3Å; C415-H431 PolarHBondContact SG-NE2 3.27Å
416	R	70	Confident	68.9	Low	249 Å²	249	79 Å²	79	94%	0.94	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-8	174.2	-62.1	-174.4	-177.1	176.7	1	114.4	V414	V414-R416 PolarHBondContact O-N 3.38Å
417	I	71	Confident	69.4	Low	99 Å²	99	78.6 Å²	78.6	51%	0.508	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-33.4	-176.9	-54.4	173.4	0	0	0	111.8	C415 H435	C415-I417 PolarHBondContact O-N 2.98Å; C415-I417 PolarHBondContact SG-N 3.25Å; C415-I417 VanDerWaalsContact SG-N 3.37Å; I417-H435 HydrophobicContact CD1-CB 3.59Å; I417-H435 HydrophobicContact CG2-CB 4.17Å
418	C	70.8	Confident	70.4	Confident	55 Å²	55	77 Å²	77	37%	0.372	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.5	21	-178.2	70.3	0	0	0	0	114.8	K420 H431 H435	C418-K420 PolarHBondContact O-N 3.49Å; C418-H431 PolarHBondContact SG-CE1 2.86Å; C418-H431 PolarHBondContact SG-NE2 3.33Å; C418-H435 PolarHBondContact SG-NE2 2.83Å
419	G	66.4	Low	71.4	Confident	44 Å²	44	76.8 Å²	76.8	45%	0.454	39%	0.387	S	S	.	.			trans	71.6	-18.8	174.2	0	0	0	0	0	116.9	V414 C415 K421	V414-G419 WeakPolarHBondContact CG1-O 3.26Å; C415-G419 VanDerWaalsContact O-CA 3.32Å; C415-G419 WeakPolarHBondContact O-CA 3.42Å; C415-G419 PolarHBondContact O-N 3.38Å; G419-K421 PolarHBondContact O-N 3.19Å
420	K	71.1	Confident	72.3	Confident	102 Å²	102	80.1 Å²	80.1	44%	0.443	39%	0.389	S	S	.	.			trans	-60	135.4	-173.5	-59.1	-155.7	175.7	-152.2	0	112.5	C415 C418 Y422	C415-K420 WeakPolarHBondContact CB-O 3.17Å; C415-K420 PolarHBondContact N-O 3.34Å; C418-K420 PolarHBondContact O-N 3.49Å; K420-Y422 HydrophobicContact CB-CE2 4.21Å; K420-Y422 WeakPolarHBondContact O-CE2 3.34Å
421	K	76.1	Confident	73.2	Confident	141 Å²	141	77.5 Å²	77.5	61%	0.613	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	149.2	-168.3	-51.1	177.5	-174.8	164	0	111.5	T411 F413 V414 G419	T411-K421 HydrophobicContact CG2-CB 4.33Å; F413-K421 CarbonylContact O-C 3.46Å; V414-K421 HydrophobicContact CG2-CG 4.32Å; G419-K421 PolarHBondContact O-N 3.19Å
422	Y	75.3	Confident	73.5	Confident	49 Å²	49	77.9 Å²	77.9	19%	0.192	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.5	-175.2	-62.8	-77.6	0	0	0	111.8	T411 F413 K420 R424 Q427 L428 H431	T411-Y422 CarbonylContact C-O 3.54Å; T411-Y422 WeakPolarHBondContact CA-O 3.11Å; F413-Y422 PolarHBondContact N-O 3.2Å; F413-Y422 PolarHBondContact O-N 3.37Å; K420-Y422 HydrophobicContact CB-CE2 4.21Å; K420-Y422 WeakPolarHBondContact O-CE2 3.34Å; Y422-R424 VanDerWaalsContact C-N 3.32Å; Y422-Q427 HydrophobicContact CD1-CB 3.73Å; Y422-Q427 HydrophobicContact CG-CB 4.13Å; Y422-L428 HydrophobicContact CD2-CB 3.93Å; Y422-L428 HydrophobicContact CD2-CD1 3.92Å; Y422-L428 HydrophobicContact CE2-CD1 4.29Å; Y422-L428 HydrophobicContact CG-CB 4.28Å; Y422-H431 HydrophobicContact CE1-CB 4.47Å; Y422-H431 HydrophobicContact CE2-CB 3.94Å; Y422-H431 AromaticContact CE2-CD2 3.66Å; Y422-H431 AromaticContact CE2-CG 3.79Å; Y422-H431 AromaticContact CZ-CD2 4Å; Y422-H431 AromaticContact CZ-CG 3.68Å; Y422-H431 PolarHBondContact OH-ND1 2.88Å; Y422-H431 VanDerWaalsContact OH-ND1 3.12Å
423	T	69.6	Low	73.9	Confident	18 Å²	18	77 Å²	77	11%	0.11	36%	0.361	C	S	.	.	S	Bend	trans	-83.4	-9.2	175.9	56	0	0	0	0	113.2	L406 T411 Q427	L406-T423 HydrophobicContact CD2-CG2 4.03Å; T411-T423 HydrophobicContact CG2-CG2 3.58Å; T423-Q427 PolarHBondContact OG1-OE1 2.97Å
424	R	72.4	Confident	73.9	Confident	78 Å²	78	80.7 Å²	80.7	29%	0.294	38%	0.377	S	S	.	.	S	Bend	trans	-139.3	142.8	-177.8	-52.7	163.9	52.2	153.9	-6	113.1	R402 Y422 D426 Q427 L428	R402-R424 HydrophobicContact CG-CG 4.29Å; Y422-R424 VanDerWaalsContact C-N 3.32Å; R424-D426 VanDerWaalsContact C-N 3.32Å; R424-D426 WeakPolarHBondContact CB-OD1 3.39Å; R424-D426 IonicContact CZ-OD1 2.69Å; R424-D426 IonicContact CZ-OD2 3.7Å; R424-D426 IonicContact NE-OD1 2.96Å; R424-D426 PolarHBondContact NE-OD1 2.98Å; R424-D426 IonicContact NE-OD2 2.69Å; R424-D426 PolarHBondContact NE-OD2 3.29Å; R424-D426 IonicContact NH2-OD1 3.57Å; R424-D426 PolarHBondContact NH2-OD1 3.46Å; R424-D426 IonicContact NH2-OD2 2.68Å; R424-D426 PolarHBondContact NH2-OD2 3.37Å; R424-D426 PolarHBondContact O-N 3.36Å; R424-Q427 HydrophobicContact CB-CB 4.39Å; R424-Q427 HydrophobicContact CB-CG 4.11Å; R424-Q427 PolarHBondContact O-N 3.35Å; R424-L428 PolarHBondContact O-N 2.93Å
425	K	74.3	Confident	73.9	Confident	146 Å²	146	81.1 Å²	81.1	64%	0.635	37%	0.374	S	S	*	.	H	α-helix	trans	-58.8	-39.4	176.7	-170.6	174.8	179.4	176.4	0	112.6	F413 Q427 L428 E429	F413-K425 HydrophobicContact CD1-CB 4.04Å; F413-K425 HydrophobicContact CD1-CG 4.42Å; F413-K425 VanDerWaalsContact CD2-N 3.34Å; F413-K425 HydrophobicContact CE1-CB 3.71Å; F413-K425 HydrophobicContact CE1-CG 4.22Å; F413-K425 HydrophobicContact CE2-CB 4.35Å; F413-K425 VanDerWaalsContact CE2-N 3.34Å; F413-K425 HydrophobicContact CZ-CB 3.88Å; K425-Q427 VanDerWaalsContact C-N 3.32Å; K425-Q427 PolarHBondContact O-N 3.18Å; K425-L428 PolarHBondContact O-N 3.34Å; K425-E429 WeakPolarHBondContact O-CB 3.39Å; K425-E429 PolarHBondContact O-N 2.67Å
426	D	75.4	Confident	73.5	Confident	79 Å²	79	85 Å²	85	42%	0.422	40%	0.398	S	S	.	.	H	α-helix	trans	-71.2	-24.9	-179.8	65.8	-53.9	0	0	0	113.3	R424 Y430	R424-D426 VanDerWaalsContact C-N 3.32Å; R424-D426 WeakPolarHBondContact CB-OD1 3.39Å; R424-D426 IonicContact CZ-OD1 2.69Å; R424-D426 IonicContact CZ-OD2 3.7Å; R424-D426 IonicContact NE-OD1 2.96Å; R424-D426 PolarHBondContact NE-OD1 2.98Å; R424-D426 IonicContact NE-OD2 2.69Å; R424-D426 PolarHBondContact NE-OD2 3.29Å; R424-D426 IonicContact NH2-OD1 3.57Å; R424-D426 PolarHBondContact NH2-OD1 3.46Å; R424-D426 IonicContact NH2-OD2 2.68Å; R424-D426 PolarHBondContact NH2-OD2 3.37Å; R424-D426 PolarHBondContact O-N 3.36Å; D426-Y430 WeakPolarHBondContact O-CB 3.49Å; D426-Y430 PolarHBondContact O-N 3.37Å
427	Q	76.1	Confident	73.4	Confident	73 Å²	73	75.2 Å²	75.2	34%	0.341	37%	0.374	S	S	.	.	H	α-helix	trans	-75.2	-43	171.3	-69.1	174.3	-38.9	0	0	111.6	Y422 T423 R424 K425 E429 Y430 H431	Y422-Q427 HydrophobicContact CD1-CB 3.73Å; Y422-Q427 HydrophobicContact CG-CB 4.13Å; T423-Q427 PolarHBondContact OG1-OE1 2.97Å; R424-Q427 HydrophobicContact CB-CB 4.39Å; R424-Q427 HydrophobicContact CB-CG 4.11Å; R424-Q427 PolarHBondContact O-N 3.35Å; K425-Q427 VanDerWaalsContact C-N 3.32Å; K425-Q427 PolarHBondContact O-N 3.18Å; Q427-E429 VanDerWaalsContact C-N 3.32Å; Q427-E429 PolarHBondContact O-N 2.95Å; Q427-Y430 WeakPolarHBondContact O-CB 3.21Å; Q427-Y430 PolarHBondContact O-N 3.03Å; Q427-H431 WeakPolarHBondContact O-CB 3.46Å; Q427-H431 PolarHBondContact O-N 2.91Å
428	L	80.1	Confident	73.3	Confident	23 Å²	23	74.8 Å²	74.8	12%	0.12	37%	0.373	C	S	.	.	H	α-helix	trans	-59.7	-44.5	172.1	171.5	61.7	0	0	0	110.8	F413 C415 Y422 R424 K425 H431 I432	F413-L428 HydrophobicContact CB-CB 3.91Å; F413-L428 HydrophobicContact CB-CD2 3.75Å; F413-L428 HydrophobicContact CB-CG 4.42Å; C415-L428 HydrophobicContact CB-CD1 3.9Å; Y422-L428 HydrophobicContact CD2-CB 3.93Å; Y422-L428 HydrophobicContact CD2-CD1 3.92Å; Y422-L428 HydrophobicContact CE2-CD1 4.29Å; Y422-L428 HydrophobicContact CG-CB 4.28Å; R424-L428 PolarHBondContact O-N 2.93Å; K425-L428 PolarHBondContact O-N 3.34Å; L428-H431 PolarHBondContact O-N 3.45Å; L428-I432 HydrophobicContact CD1-CD1 3.76Å; L428-I432 HydrophobicContact CD1-CG1 4.03Å; L428-I432 HydrophobicContact CD2-CD1 4.39Å; L428-I432 HydrophobicContact CG-CD1 3.8Å; L428-I432 HydrophobicContact CG-CG1 4.43Å; L428-I432 WeakPolarHBondContact O-CG1 3.34Å; L428-I432 PolarHBondContact O-N 2.67Å
429	E	77.4	Confident	73.5	Confident	82 Å²	82	78 Å²	78	38%	0.383	38%	0.381	S	S	.	.	H	α-helix	trans	-67.5	-40.7	178.3	-167.9	178	173.7	0	0	112.1	K425 Q427 H431 I432 R433	K425-E429 WeakPolarHBondContact O-CB 3.39Å; K425-E429 PolarHBondContact O-N 2.67Å; Q427-E429 VanDerWaalsContact C-N 3.32Å; Q427-E429 PolarHBondContact O-N 2.95Å; E429-H431 PolarHBondContact O-N 3.19Å; E429-I432 PolarHBondContact O-N 3.09Å; E429-R433 WeakPolarHBondContact O-CG 3.12Å; E429-R433 PolarHBondContact O-N 3.1Å; E429-R433 IonicContact OE1-CZ 3.83Å; E429-R433 IonicContact OE1-NE 2.68Å; E429-R433 IonicContact OE1-NH2 3.53Å; E429-R433 PolarHBondContact OE1-NH2 3.1Å
430	Y	75.5	Confident	73.8	Confident	106 Å²	106	78.1 Å²	78.1	42%	0.416	37%	0.373	S	S	.	.	H	α-helix	trans	-52.9	-44.2	169.7	172.3	-96.7	0	0	0	112.3	D426 Q427 K434 F452	D426-Y430 WeakPolarHBondContact O-CB 3.49Å; D426-Y430 PolarHBondContact O-N 3.37Å; Q427-Y430 WeakPolarHBondContact O-CB 3.21Å; Q427-Y430 PolarHBondContact O-N 3.03Å; Y430-K434 VanDerWaalsContact CZ-CE 3.49Å; Y430-K434 WeakPolarHBondContact OH-CE 3.27Å; Y430-K434 PolarHBondContact OH-NZ 3.08Å; Y430-F452 AromaticContact CD2-CD2 3.92Å; Y430-F452 HydrophobicContact CD2-CD2 3.92Å; Y430-F452 AromaticContact CD2-CE2 3.45Å; Y430-F452 HydrophobicContact CD2-CE2 3.45Å; Y430-F452 VanDerWaalsContact CD2-CE2 3.45Å; Y430-F452 AromaticContact CD2-CZ 3.96Å; Y430-F452 HydrophobicContact CD2-CZ 3.96Å; Y430-F452 HydrophobicContact CE2-CD2 4.29Å; Y430-F452 HydrophobicContact CE2-CE2 4.03Å; Y430-F452 HydrophobicContact CG-CE2 4.35Å
431	H	79.6	Confident	74.1	Confident	24 Å²	24	74.6 Å²	74.6	11%	0.111	36%	0.358	C	S	.	.	H	α-helix	trans	-72	-42.4	178.8	171.5	78	0	0	0	112.8	C415 C418 Y422 Q427 L428 E429 R433 K434 H435	C415-H431 PolarHBondContact SG-CD2 3.3Å; C415-H431 PolarHBondContact SG-NE2 3.27Å; C418-H431 PolarHBondContact SG-CE1 2.86Å; C418-H431 PolarHBondContact SG-NE2 3.33Å; Y422-H431 HydrophobicContact CE1-CB 4.47Å; Y422-H431 HydrophobicContact CE2-CB 3.94Å; Y422-H431 AromaticContact CE2-CD2 3.66Å; Y422-H431 AromaticContact CE2-CG 3.79Å; Y422-H431 AromaticContact CZ-CD2 4Å; Y422-H431 AromaticContact CZ-CG 3.68Å; Y422-H431 PolarHBondContact OH-ND1 2.88Å; Y422-H431 VanDerWaalsContact OH-ND1 3.12Å; Q427-H431 WeakPolarHBondContact O-CB 3.46Å; Q427-H431 PolarHBondContact O-N 2.91Å; L428-H431 PolarHBondContact O-N 3.45Å; E429-H431 PolarHBondContact O-N 3.19Å; H431-R433 VanDerWaalsContact C-N 3.33Å; H431-R433 PolarHBondContact O-N 3.48Å; H431-K434 WeakPolarHBondContact O-CB 3.35Å; H431-K434 PolarHBondContact O-N 3.04Å; H431-H435 AromaticContact CD2-NE2 3.81Å; H431-H435 AromaticContact CE1-NE2 3.22Å; H431-H435 PolarHBondContact CE1-NE2 3.48Å; H431-H435 AromaticContact NE2-CD2 3.62Å; H431-H435 AromaticContact NE2-NE2 2.98Å; H431-H435 PolarHBondContact NE2-NE2 3.33Å
432	I	74.5	Confident	74.4	Confident	58 Å²	58	73 Å²	73	30%	0.297	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-39.2	176.8	-71.8	169.5	0	0	0	111.6	L428 E429 K434 H435 T436	L428-I432 HydrophobicContact CD1-CD1 3.76Å; L428-I432 HydrophobicContact CD1-CG1 4.03Å; L428-I432 HydrophobicContact CD2-CD1 4.39Å; L428-I432 HydrophobicContact CG-CD1 3.8Å; L428-I432 HydrophobicContact CG-CG1 4.43Å; L428-I432 WeakPolarHBondContact O-CG1 3.34Å; L428-I432 PolarHBondContact O-N 2.67Å; E429-I432 PolarHBondContact O-N 3.09Å; I432-K434 PolarHBondContact O-N 2.79Å; I432-H435 PolarHBondContact O-N 2.89Å; I432-H435 VanDerWaalsContact O-N 3.1Å; I432-T436 HydrophobicContact CG2-CG2 4.39Å; I432-T436 PolarHBondContact O-N 3.06Å; I432-T436 VanDerWaalsContact O-N 3.09Å; I432-T436 PolarHBondContact O-OG1 3.14Å
433	R	76.3	Confident	74.7	Confident	57 Å²	57	70.7 Å²	70.7	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-68.2	-10.5	176	-61.3	-167.7	-152.5	173	-4.5	114	E429 H431 G437 P451 F452	E429-R433 WeakPolarHBondContact O-CG 3.12Å; E429-R433 PolarHBondContact O-N 3.1Å; E429-R433 IonicContact OE1-CZ 3.83Å; E429-R433 IonicContact OE1-NE 2.68Å; E429-R433 IonicContact OE1-NH2 3.53Å; E429-R433 PolarHBondContact OE1-NH2 3.1Å; H431-R433 VanDerWaalsContact C-N 3.33Å; H431-R433 PolarHBondContact O-N 3.48Å; R433-G437 PolarHBondContact O-N 2.8Å; R433-P451 HydrophobicContact CB-CB 4.39Å; R433-P451 PolarHBondContact NH1-O 3.44Å; R433-F452 HydrophobicContact CB-CE2 4.3Å; R433-F452 HydrophobicContact CB-CZ 3.91Å; R433-F452 VanDerWaalsContact CD-CZ 3.44Å; R433-F452 HydrophobicContact CG-CZ 3.97Å
434	K	71.9	Confident	75.2	Confident	135 Å²	135	74.8 Å²	74.8	59%	0.587	36%	0.361	S	S	*	.	H	α-helix	trans	-76	-45.8	166.2	-65.7	-168.7	175.8	-174.4	0	111.5	Y430 H431 I432 G437	Y430-K434 VanDerWaalsContact CZ-CE 3.49Å; Y430-K434 WeakPolarHBondContact OH-CE 3.27Å; Y430-K434 PolarHBondContact OH-NZ 3.08Å; H431-K434 WeakPolarHBondContact O-CB 3.35Å; H431-K434 PolarHBondContact O-N 3.04Å; I432-K434 PolarHBondContact O-N 2.79Å; K434-G437 PolarHBondContact O-N 2.82Å
435	H	72.1	Confident	75.4	Confident	83 Å²	83	74.1 Å²	74.1	38%	0.384	37%	0.366	S	S	.	.	H	α-helix	trans	-63.3	-43.8	178	-68.2	-68.4	0	0	0	112.7	I417 C418 H431 I432 G437	I417-H435 HydrophobicContact CD1-CB 3.59Å; I417-H435 HydrophobicContact CG2-CB 4.17Å; C418-H435 PolarHBondContact SG-NE2 2.83Å; H431-H435 AromaticContact CD2-NE2 3.81Å; H431-H435 AromaticContact CE1-NE2 3.22Å; H431-H435 PolarHBondContact CE1-NE2 3.48Å; H431-H435 AromaticContact NE2-CD2 3.62Å; H431-H435 AromaticContact NE2-NE2 2.98Å; H431-H435 PolarHBondContact NE2-NE2 3.33Å; I432-H435 PolarHBondContact O-N 2.89Å; I432-H435 VanDerWaalsContact O-N 3.1Å; H435-G437 VanDerWaalsContact C-N 3.32Å; H435-G437 PolarHBondContact O-N 3.23Å
436	T	67.7	Low	75.9	Confident	85 Å²	85	69.4 Å²	69.4	52%	0.521	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.3	-177.2	59.6	0	0	0	0	114.1	I432 N438	I432-T436 HydrophobicContact CG2-CG2 4.39Å; I432-T436 PolarHBondContact O-N 3.06Å; I432-T436 VanDerWaalsContact O-N 3.09Å; I432-T436 PolarHBondContact O-OG1 3.14Å; T436-N438 PolarHBondContact O-N 3.47Å
437	G	67.3	Low	75.9	Confident	43 Å²	43	68.4 Å²	68.4	44%	0.443	36%	0.359	S	S	.	.			trans	61.3	2.3	180	0	0	0	0	0	116.2	R433 K434 H435 K439	R433-G437 PolarHBondContact O-N 2.8Å; K434-G437 PolarHBondContact O-N 2.82Å; H435-G437 VanDerWaalsContact C-N 3.32Å; H435-G437 PolarHBondContact O-N 3.23Å; G437-K439 WeakPolarHBondContact O-CG 3.24Å; G437-K439 PolarHBondContact O-N 3.04Å
438	N	69.9	Low	76.1	Confident	90 Å²	90	70.7 Å²	70.7	48%	0.481	37%	0.368	S	S	.	.			trans	-70	121.4	-165.7	-170.7	-12.9	0	0	0	112.1	T436 P440 P451	T436-N438 PolarHBondContact O-N 3.47Å; N438-P440 WeakPolarHBondContact O-CD 3.42Å; N438-P440 WeakPolarHBondContact OD1-CD 3.36Å; N438-P451 WeakPolarHBondContact O-CB 3.15Å
439	K	74.1	Confident	76	Confident	121 Å²	121	72.6 Å²	72.6	53%	0.526	38%	0.383	S	S	.	.			trans	-126.1	70.3	-173.8	-69.3	162.4	-174.4	171.3	0	111.5	G437 F441 F450 P451	G437-K439 WeakPolarHBondContact O-CG 3.24Å; G437-K439 PolarHBondContact O-N 3.04Å; K439-F441 VanDerWaalsContact C-N 3.3Å; K439-F441 PolarHBondContact O-N 3.24Å; K439-F450 CarbonylContact C-O 3.58Å; K439-F450 WeakPolarHBondContact CA-O 3.46Å; K439-P451 HydrophobicContact CG-CB 4.42Å
440	P	74.1	Confident	76	Confident	47 Å²	47	70.3 Å²	70.3	31%	0.305	37%	0.372	S	S	.	.			trans	-77.1	-12.1	-170.9	30.6	-33	0	0	0	114.1	N438	N438-P440 WeakPolarHBondContact O-CD 3.42Å; N438-P440 WeakPolarHBondContact OD1-CD 3.36Å
441	F	77.1	Confident	75.8	Confident	29 Å²	29	66.9 Å²	66.9	13%	0.127	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	100.4	-176.8	-56.4	-81.2	0	0	0	111.1	K439 F450 Q453 L456 A472	K439-F441 VanDerWaalsContact C-N 3.3Å; K439-F441 PolarHBondContact O-N 3.24Å; F441-F450 PolarHBondContact N-O 3.05Å; F441-F450 VanDerWaalsContact N-O 3.13Å; F441-F450 PolarHBondContact O-N 3.5Å; F441-Q453 HydrophobicContact CD1-CB 3.75Å; F441-Q453 HydrophobicContact CD1-CG 4.16Å; F441-Q453 VanDerWaalsContact CD2-N 3.33Å; F441-Q453 HydrophobicContact CE1-CB 3.74Å; F441-Q453 HydrophobicContact CE1-CG 4.3Å; F441-Q453 HydrophobicContact CG-CB 4.19Å; F441-Q453 HydrophobicContact CZ-CB 4.16Å; F441-L456 HydrophobicContact CB-CB 4.35Å; F441-L456 HydrophobicContact CB-CD2 3.93Å; F441-A472 HydrophobicContact CD1-CB 4.32Å
442	H	80.9	Confident	75.5	Confident	107 Å²	107	67.5 Å²	67.5	50%	0.495	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	148.6	179.2	60.4	-89.2	0	0	0	112.6	K448 L456	H442-K448 CarbonylContact C-O 3.52Å; H442-K448 WeakPolarHBondContact CA-O 3.39Å; H442-L456 WeakPolarHBondContact O-CD2 3.36Å
443	C	83	Confident	75.7	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.007	37%	0.369	C	S	.	.			trans	-87.2	115.5	171.3	-172.4	0	0	0	0	110.5	V445 C446 G447 K448 F450 L456	C443-V445 PolarHBondContact O-N 2.8Å; C443-C446 PolarHBondContact O-N 3.22Å; C443-G447 WeakPolarHBondContact O-CA 3.43Å; C443-G447 PolarHBondContact O-N 3.24Å; C443-K448 PolarHBondContact N-O 3.21Å; C443-F450 HydrophobicContact CB-CE2 4.31Å; C443-L456 HydrophobicContact CB-CD1 3.53Å
444	H	78.9	Confident	75.8	Confident	103 Å²	103	69.5 Å²	69.5	48%	0.477	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.4	179.1	63.9	-101.6	0	0	0	114	F460	H444-F460 AromaticContact CE1-CE2 3.71Å; H444-F460 AromaticContact NE2-CE2 3.89Å
445	V	77.5	Confident	76.1	Confident	64 Å²	64	65.8 Å²	65.8	39%	0.388	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-28.2	-178.3	-168.7	0	0	0	0	112.9	C443 F460 H464	C443-V445 PolarHBondContact O-N 2.8Å; V445-F460 HydrophobicContact CG2-CD2 4.43Å; V445-F460 HydrophobicContact CG2-CE2 3.79Å; V445-H464 WeakPolarHBondContact CG1-ND1 3.4Å
446	C	83.9	Confident	76.6	Confident	48 Å²	48	62.3 Å²	62.3	32%	0.324	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	10.8	-174.6	71	0	0	0	0	115.5	C443 K448 H459 H464	C443-C446 PolarHBondContact O-N 3.22Å; C446-K448 PolarHBondContact O-N 3.43Å; C446-H459 PolarHBondContact SG-NE2 3.06Å; C446-H464 PolarHBondContact SG-NE2 2.95Å; C446-H464 VanDerWaalsContact SG-NE2 3.39Å
447	G	76.6	Confident	77.3	Confident	57 Å²	57	61 Å²	61	59%	0.588	35%	0.349	S	S	*	.			trans	69.1	-5.4	176.9	0	0	0	0	0	116.2	C443 S449	C443-G447 WeakPolarHBondContact O-CA 3.43Å; C443-G447 PolarHBondContact O-N 3.24Å; G447-S449 PolarHBondContact O-N 2.85Å
448	K	79.2	Confident	78	Confident	122 Å²	122	64.3 Å²	64.3	53%	0.53	35%	0.352	S	S	.	.			trans	-70.8	125.8	-173.2	-68.7	178.1	-177.4	176	0	111.9	H442 C443 C446 F450	H442-K448 CarbonylContact C-O 3.52Å; H442-K448 WeakPolarHBondContact CA-O 3.39Å; C443-K448 PolarHBondContact N-O 3.21Å; C446-K448 PolarHBondContact O-N 3.43Å; K448-F450 HydrophobicContact CB-CE2 3.75Å; K448-F450 HydrophobicContact CB-CZ 3.83Å; K448-F450 VanDerWaalsContact O-CD2 3.27Å; K448-F450 WeakPolarHBondContact O-CD2 3.25Å; K448-F450 WeakPolarHBondContact O-CE2 3.32Å
449	S	78.3	Confident	78.7	Confident	63 Å²	63	61.1 Å²	61.1	44%	0.441	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.5	-179.6	-55.1	0	0	0	0	113	G447	G447-S449 PolarHBondContact O-N 2.85Å
450	F	77	Confident	79	Confident	34 Å²	34	56 Å²	56	15%	0.149	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.9	-175.2	-59.7	-83.6	0	0	0	111.5	K439 F441 C443 K448 F452 I455 L456 H459	K439-F450 CarbonylContact C-O 3.58Å; K439-F450 WeakPolarHBondContact CA-O 3.46Å; F441-F450 PolarHBondContact N-O 3.05Å; F441-F450 VanDerWaalsContact N-O 3.13Å; F441-F450 PolarHBondContact O-N 3.5Å; C443-F450 HydrophobicContact CB-CE2 4.31Å; K448-F450 HydrophobicContact CB-CE2 3.75Å; K448-F450 HydrophobicContact CB-CZ 3.83Å; K448-F450 VanDerWaalsContact O-CD2 3.27Å; K448-F450 WeakPolarHBondContact O-CD2 3.25Å; K448-F450 WeakPolarHBondContact O-CE2 3.32Å; F450-F452 VanDerWaalsContact C-N 3.3Å; F450-F452 PolarHBondContact O-N 2.82Å; F450-I455 HydrophobicContact CB-CG2 4.5Å; F450-I455 HydrophobicContact CD1-CB 4.47Å; F450-I455 HydrophobicContact CD1-CG2 3.61Å; F450-I455 HydrophobicContact CE1-CG2 4.24Å; F450-I455 HydrophobicContact CG-CG2 4.31Å; F450-L456 HydrophobicContact CB-CB 4.34Å; F450-L456 HydrophobicContact CD2-CB 3.97Å; F450-L456 HydrophobicContact CD2-CD1 3.85Å; F450-L456 HydrophobicContact CD2-CG 4.5Å; F450-L456 HydrophobicContact CE2-CD1 4.02Å; F450-L456 HydrophobicContact CG-CB 4.36Å; F450-H459 HydrophobicContact CE1-CB 4.12Å; F450-H459 HydrophobicContact CE2-CB 4.18Å; F450-H459 AromaticContact CE2-CD2 3.43Å; F450-H459 VanDerWaalsContact CE2-CD2 3.43Å; F450-H459 WeakPolarHBondContact CE2-CD2 3.43Å; F450-H459 AromaticContact CE2-CG 3.87Å; F450-H459 HydrophobicContact CZ-CB 3.7Å; F450-H459 AromaticContact CZ-CD2 3.36Å; F450-H459 WeakPolarHBondContact CZ-CD2 3.5Å; F450-H459 AromaticContact CZ-CG 3.36Å; F450-H459 AromaticContact CZ-ND1 3.93Å; F450-H459 AromaticContact CZ-NE2 3.93Å
451	P	71.6	Confident	79.3	Confident	33 Å²	33	63.5 Å²	63.5	21%	0.214	34%	0.335	C	S	.	.	S	Bend	trans	-76.9	-12.1	179.2	29	-30.6	0	0	0	113.9	R433 N438 K439 I455	R433-P451 HydrophobicContact CB-CB 4.39Å; R433-P451 PolarHBondContact NH1-O 3.44Å; N438-P451 WeakPolarHBondContact O-CB 3.15Å; K439-P451 HydrophobicContact CG-CB 4.42Å; P451-I455 HydrophobicContact CG-CD1 4.43Å
452	F	74.2	Confident	79.6	Confident	37 Å²	37	69.3 Å²	69.3	16%	0.162	36%	0.36	C	S	.	.			trans	-144.4	137.2	-179.8	-59.8	-82.3	0	0	0	112.6	Y430 R433 F450 A454 I455 L456	Y430-F452 AromaticContact CD2-CD2 3.92Å; Y430-F452 HydrophobicContact CD2-CD2 3.92Å; Y430-F452 AromaticContact CD2-CE2 3.45Å; Y430-F452 HydrophobicContact CD2-CE2 3.45Å; Y430-F452 VanDerWaalsContact CD2-CE2 3.45Å; Y430-F452 AromaticContact CD2-CZ 3.96Å; Y430-F452 HydrophobicContact CD2-CZ 3.96Å; Y430-F452 HydrophobicContact CE2-CD2 4.29Å; Y430-F452 HydrophobicContact CE2-CE2 4.03Å; Y430-F452 HydrophobicContact CG-CE2 4.35Å; R433-F452 HydrophobicContact CB-CE2 4.3Å; R433-F452 HydrophobicContact CB-CZ 3.91Å; R433-F452 VanDerWaalsContact CD-CZ 3.44Å; R433-F452 HydrophobicContact CG-CZ 3.97Å; F450-F452 VanDerWaalsContact C-N 3.3Å; F450-F452 PolarHBondContact O-N 2.82Å; F452-A454 PolarHBondContact O-N 3.09Å; F452-I455 HydrophobicContact CB-CD1 4.27Å; F452-I455 HydrophobicContact CB-CG1 4.18Å; F452-I455 HydrophobicContact CD2-CD1 3.94Å; F452-I455 PolarHBondContact O-N 3.38Å; F452-L456 PolarHBondContact O-N 3.43Å; F452-L456 VanDerWaalsContact O-N 3.09Å
453	Q	78	Confident	79.5	Confident	82 Å²	82	68.6 Å²	68.6	38%	0.383	36%	0.359	S	S	.	.	H	α-helix	trans	-55.2	-33.6	174	-162.5	-179.1	5.3	0	0	112.8	F441 I455 L456 N457	F441-Q453 HydrophobicContact CD1-CB 3.75Å; F441-Q453 HydrophobicContact CD1-CG 4.16Å; F441-Q453 VanDerWaalsContact CD2-N 3.33Å; F441-Q453 HydrophobicContact CE1-CB 3.74Å; F441-Q453 HydrophobicContact CE1-CG 4.3Å; F441-Q453 HydrophobicContact CG-CB 4.19Å; F441-Q453 HydrophobicContact CZ-CB 4.16Å; Q453-I455 VanDerWaalsContact C-N 3.33Å; Q453-I455 PolarHBondContact O-N 2.97Å; Q453-L456 PolarHBondContact O-N 3.2Å; Q453-N457 WeakPolarHBondContact O-CB 3.43Å; Q453-N457 PolarHBondContact O-N 3.42Å; Q453-N457 PolarHBondContact O-ND2 3.13Å
454	A	78	Confident	79.5	Confident	75 Å²	75	70.1 Å²	70.1	62%	0.62	37%	0.367	S	S	*	.	H	α-helix	trans	-63.4	-36	175.3	0	0	0	0	0	113.1	F452 Q458	F452-A454 PolarHBondContact O-N 3.09Å; A454-Q458 PolarHBondContact O-N 3.37Å
455	I	78.8	Confident	79	Confident	58 Å²	58	70.4 Å²	70.4	30%	0.297	38%	0.377	S	S	.	.	H	α-helix	trans	-75.4	-42.3	176.8	-58.4	177.1	0	0	0	109.8	F450 P451 F452 Q453 N457 Q458 H459	F450-I455 HydrophobicContact CB-CG2 4.5Å; F450-I455 HydrophobicContact CD1-CB 4.47Å; F450-I455 HydrophobicContact CD1-CG2 3.61Å; F450-I455 HydrophobicContact CE1-CG2 4.24Å; F450-I455 HydrophobicContact CG-CG2 4.31Å; P451-I455 HydrophobicContact CG-CD1 4.43Å; F452-I455 HydrophobicContact CB-CD1 4.27Å; F452-I455 HydrophobicContact CB-CG1 4.18Å; F452-I455 HydrophobicContact CD2-CD1 3.94Å; F452-I455 PolarHBondContact O-N 3.38Å; Q453-I455 VanDerWaalsContact C-N 3.33Å; Q453-I455 PolarHBondContact O-N 2.97Å; I455-N457 VanDerWaalsContact C-N 3.33Å; I455-N457 PolarHBondContact O-N 2.78Å; I455-Q458 PolarHBondContact O-N 2.91Å; I455-H459 WeakPolarHBondContact O-CB 3.38Å; I455-H459 PolarHBondContact O-N 3.44Å
456	L	82.6	Confident	78.5	Confident	10 Å²	10	71.5 Å²	71.5	5%	0.052	40%	0.402	C	S	.	.	H	α-helix	trans	-55.1	-47.8	170.9	170.7	59.2	0	0	0	111.1	F441 H442 C443 F450 F452 Q453 Q458 H459 F460 A472	F441-L456 HydrophobicContact CB-CB 4.35Å; F441-L456 HydrophobicContact CB-CD2 3.93Å; H442-L456 WeakPolarHBondContact O-CD2 3.36Å; C443-L456 HydrophobicContact CB-CD1 3.53Å; F450-L456 HydrophobicContact CB-CB 4.34Å; F450-L456 HydrophobicContact CD2-CB 3.97Å; F450-L456 HydrophobicContact CD2-CD1 3.85Å; F450-L456 HydrophobicContact CD2-CG 4.5Å; F450-L456 HydrophobicContact CE2-CD1 4.02Å; F450-L456 HydrophobicContact CG-CB 4.36Å; F452-L456 PolarHBondContact O-N 3.43Å; F452-L456 VanDerWaalsContact O-N 3.09Å; Q453-L456 PolarHBondContact O-N 3.2Å; L456-Q458 PolarHBondContact O-N 2.66Å; L456-H459 PolarHBondContact O-N 3.45Å; L456-F460 VanDerWaalsContact O-CB 3.25Å; L456-F460 WeakPolarHBondContact O-CB 3.27Å; L456-F460 PolarHBondContact O-N 3.39Å; L456-A472 HydrophobicContact CD2-CB 4.18Å
457	N	82.1	Confident	77.4	Confident	58 Å²	58	72.5 Å²	72.5	31%	0.31	41%	0.408	S	S	.	.	H	α-helix	trans	-63.5	-37.4	178.1	-72.6	-13.3	0	0	0	112.5	Q453 I455 R461	Q453-N457 WeakPolarHBondContact O-CB 3.43Å; Q453-N457 PolarHBondContact O-N 3.42Å; Q453-N457 PolarHBondContact O-ND2 3.13Å; I455-N457 VanDerWaalsContact C-N 3.33Å; I455-N457 PolarHBondContact O-N 2.78Å; N457-R461 WeakPolarHBondContact O-CB 3.45Å; N457-R461 VanDerWaalsContact O-CG 3.24Å; N457-R461 WeakPolarHBondContact O-CG 3.41Å; N457-R461 PolarHBondContact O-N 3.35Å
458	Q	82.9	Confident	76.6	Confident	111 Å²	111	73.7 Å²	73.7	52%	0.519	41%	0.413	S	S	.	.	H	α-helix	trans	-69	-40.9	174.5	-167.3	-171.3	37	0	0	111.8	A454 I455 L456 K462	A454-Q458 PolarHBondContact O-N 3.37Å; I455-Q458 PolarHBondContact O-N 2.91Å; L456-Q458 PolarHBondContact O-N 2.66Å; Q458-K462 HydrophobicContact CG-CD 4.46Å; Q458-K462 WeakPolarHBondContact O-CB 3.27Å; Q458-K462 WeakPolarHBondContact O-CG 3.34Å; Q458-K462 PolarHBondContact O-N 3.45Å
459	H	83.5	Confident	75.4	Confident	24 Å²	24	71.8 Å²	71.8	11%	0.111	41%	0.413	C	S	.	.	H	α-helix	trans	-62.1	-51.1	174.9	167.3	64.7	0	0	0	110.9	C446 F450 I455 L456 R461 K462 N463 H464	C446-H459 PolarHBondContact SG-NE2 3.06Å; F450-H459 HydrophobicContact CE1-CB 4.12Å; F450-H459 HydrophobicContact CE2-CB 4.18Å; F450-H459 AromaticContact CE2-CD2 3.43Å; F450-H459 VanDerWaalsContact CE2-CD2 3.43Å; F450-H459 WeakPolarHBondContact CE2-CD2 3.43Å; F450-H459 AromaticContact CE2-CG 3.87Å; F450-H459 HydrophobicContact CZ-CB 3.7Å; F450-H459 AromaticContact CZ-CD2 3.36Å; F450-H459 WeakPolarHBondContact CZ-CD2 3.5Å; F450-H459 AromaticContact CZ-CG 3.36Å; F450-H459 AromaticContact CZ-ND1 3.93Å; F450-H459 AromaticContact CZ-NE2 3.93Å; I455-H459 WeakPolarHBondContact O-CB 3.38Å; I455-H459 PolarHBondContact O-N 3.44Å; L456-H459 PolarHBondContact O-N 3.45Å; H459-R461 PolarHBondContact O-N 2.85Å; H459-K462 PolarHBondContact O-N 3.02Å; H459-N463 PolarHBondContact ND1-ND2 3.35Å; H459-N463 WeakPolarHBondContact O-CB 3.49Å; H459-N463 PolarHBondContact O-N 2.82Å; H459-N463 PolarHBondContact O-ND2 2.78Å; H459-H464 AromaticContact NE2-NE2 3.75Å
460	F	80.6	Confident	74.4	Confident	13 Å²	13	76.5 Å²	76.5	6%	0.057	43%	0.428	C	S	.	.	H	α-helix	trans	-56.5	-50.9	178.7	-170.8	-94.9	0	0	0	111.5	H444 V445 L456 K462 N463 H464 C467 P469	H444-F460 AromaticContact CE1-CE2 3.71Å; H444-F460 AromaticContact NE2-CE2 3.89Å; V445-F460 HydrophobicContact CG2-CD2 4.43Å; V445-F460 HydrophobicContact CG2-CE2 3.79Å; L456-F460 VanDerWaalsContact O-CB 3.25Å; L456-F460 WeakPolarHBondContact O-CB 3.27Å; L456-F460 PolarHBondContact O-N 3.39Å; F460-K462 PolarHBondContact O-N 3.4Å; F460-K462 VanDerWaalsContact O-N 3.14Å; F460-N463 PolarHBondContact O-N 2.86Å; F460-H464 HydrophobicContact CD2-CB 4.14Å; F460-H464 HydrophobicContact CE2-CB 4.26Å; F460-H464 HydrophobicContact CG-CB 4.49Å; F460-H464 CarbonylContact O-C 3.59Å; F460-H464 WeakPolarHBondContact O-CA 3.42Å; F460-H464 PolarHBondContact O-N 3.3Å; F460-C467 HydrophobicContact CE1-CB 4.24Å; F460-C467 VanDerWaalsContact CE1-O 3.27Å; F460-C467 WeakPolarHBondContact CE1-O 3.44Å; F460-C467 HydrophobicContact CE2-CB 4.24Å; F460-C467 HydrophobicContact CZ-CB 3.55Å; F460-P469 HydrophobicContact CD1-CB 4.18Å; F460-P469 HydrophobicContact CE1-CB 3.85Å; F460-P469 HydrophobicContact CE1-CG 4.27Å; F460-P469 HydrophobicContact CZ-CB 4.24Å
461	R	81.3	Confident	72.9	Confident	205 Å²	205	82.4 Å²	82.4	77%	0.774	46%	0.456	S	S	*	.	H	α-helix	trans	-58.9	-26.1	175.7	-74.9	175.6	-180	-172	-0	114.8	N457 H459	N457-R461 WeakPolarHBondContact O-CB 3.45Å; N457-R461 VanDerWaalsContact O-CG 3.24Å; N457-R461 WeakPolarHBondContact O-CG 3.41Å; N457-R461 PolarHBondContact O-N 3.35Å; H459-R461 PolarHBondContact O-N 2.85Å
462	K	82.1	Confident	71.9	Confident	151 Å²	151	82.2 Å²	82.2	66%	0.657	46%	0.457	S	S	*	.	H	α-helix	trans	-94.5	-27.4	-179.2	-76.4	-176.9	173.4	-173.5	0	114.3	Q458 H459 F460	Q458-K462 HydrophobicContact CG-CD 4.46Å; Q458-K462 WeakPolarHBondContact O-CB 3.27Å; Q458-K462 WeakPolarHBondContact O-CG 3.34Å; Q458-K462 PolarHBondContact O-N 3.45Å; H459-K462 PolarHBondContact O-N 3.02Å; F460-K462 PolarHBondContact O-N 3.4Å; F460-K462 VanDerWaalsContact O-N 3.14Å
463	N	80.3	Confident	70.6	Confident	91 Å²	91	88.4 Å²	88.4	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-117.3	-18.2	-169.3	-62	-99.5	0	0	0	112.9	H459 F460 P465	H459-N463 PolarHBondContact ND1-ND2 3.35Å; H459-N463 WeakPolarHBondContact O-CB 3.49Å; H459-N463 PolarHBondContact O-N 2.82Å; H459-N463 PolarHBondContact O-ND2 2.78Å; F460-N463 PolarHBondContact O-N 2.86Å; N463-P465 VanDerWaalsContact C-CD 3.43Å
464	H	82.1	Confident	68.8	Low	34 Å²	34	88.5 Å²	88.5	16%	0.157	50%	0.496	C	S	.	.	S	Bend	trans	-131.6	56.6	-179.3	-54.1	-51	0	0	0	111.3	V445 C446 H459 F460 G466	V445-H464 WeakPolarHBondContact CG1-ND1 3.4Å; C446-H464 PolarHBondContact SG-NE2 2.95Å; C446-H464 VanDerWaalsContact SG-NE2 3.39Å; H459-H464 AromaticContact NE2-NE2 3.75Å; F460-H464 HydrophobicContact CD2-CB 4.14Å; F460-H464 HydrophobicContact CE2-CB 4.26Å; F460-H464 HydrophobicContact CG-CB 4.49Å; F460-H464 CarbonylContact O-C 3.59Å; F460-H464 WeakPolarHBondContact O-CA 3.42Å; F460-H464 PolarHBondContact O-N 3.3Å; H464-G466 PolarHBondContact O-N 3.18Å
465	P	68.3	Low	67.1	Low	108 Å²	108	89.2 Å²	89.2	70%	0.701	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	132.6	177.9	29.2	-35.1	0	0	0	110.9	N463	N463-P465 VanDerWaalsContact C-CD 3.43Å
466	G	66.4	Low	64.6	Low	88 Å²	88	91 Å²	91	91%	0.907	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.9	-20.3	178	0	0	0	0	0	115.3	H464	H464-G466 PolarHBondContact O-N 3.18Å
467	C	62.6	Low	62.5	Low	68 Å²	68	96.7 Å²	96.7	46%	0.459	56%	0.557	S	S	.	*			trans	-77.2	149.9	170.5	-63.4	0	0	0	0	111.3	F460	F460-C467 HydrophobicContact CE1-CB 4.24Å; F460-C467 VanDerWaalsContact CE1-O 3.27Å; F460-C467 WeakPolarHBondContact CE1-O 3.44Å; F460-C467 HydrophobicContact CE2-CB 4.24Å; F460-C467 HydrophobicContact CZ-CB 3.55Å
468	A	58.6	Low	60	Low	82 Å²	82	102.1 Å²	102.1	68%	0.678	58%	0.58	S	S	*	*			trans	-88.5	135.5	170.6	0	0	0	0	0	110.5	Q470	A468-Q470 PolarHBondContact O-N 3.18Å
469	P	54.8	Low	57.9	Low	83 Å²	83	103.2 Å²	103.2	54%	0.539	60%	0.595	S	S	.	*			trans	-76.5	112.8	174.8	30.4	-31.1	0	0	0	109.9	F460	F460-P469 HydrophobicContact CD1-CB 4.18Å; F460-P469 HydrophobicContact CE1-CB 3.85Å; F460-P469 HydrophobicContact CE1-CG 4.27Å; F460-P469 HydrophobicContact CZ-CB 4.24Å
470	Q	56.6	Low	55.4	Low	162 Å²	162	107.8 Å²	107.8	76%	0.757	63%	0.625	S	S	*	*			trans	-64.2	153.1	161.5	-86.1	-169.9	-44.2	0	0	110.8	A468 A472	A468-Q470 PolarHBondContact O-N 3.18Å; Q470-A472 PolarHBondContact O-N 2.91Å
471	E	46.2	Very low	53.3	Low	158 Å²	158	113.5 Å²	113.5	74%	0.738	66%	0.661	S	S	*	*			trans	-66.9	115.3	176.7	-60.3	-137.4	115.3	0	0	110.3	H473	E471-H473 VanDerWaalsContact C-N 3.33Å; E471-H473 PolarHBondContact O-N 3.2Å
472	A	50	Low	50.9	Low	28 Å²	28	107.8 Å²	107.8	23%	0.231	66%	0.658	C	S	.	*			trans	-72.5	88.6	175.6	0	0	0	0	0	109.3	F441 L456 Q470 S474	F441-A472 HydrophobicContact CD1-CB 4.32Å; L456-A472 HydrophobicContact CD2-CB 4.18Å; Q470-A472 PolarHBondContact O-N 2.91Å; A472-S474 PolarHBondContact O-N 3.16Å; A472-S474 VanDerWaalsContact O-N 3.16Å
473	H	47.5	Very low	48.4	Very low	167 Å²	167	106 Å²	106	77%	0.773	66%	0.664	S	S	*	*			trans	-52.1	120.2	174.9	-67.1	-68.8	0	0	0	110.2	E471 A475	E471-H473 VanDerWaalsContact C-N 3.33Å; E471-H473 PolarHBondContact O-N 3.2Å; H473-A475 PolarHBondContact O-N 3.16Å
474	S	40.7	Very low	46.3	Very low	85 Å²	85	107.6 Å²	107.6	59%	0.594	68%	0.677	S	S	*	*			trans	-69.2	112	173.9	51.8	0	0	0	0	109.3	A472 S476	A472-S474 PolarHBondContact O-N 3.16Å; A472-S474 VanDerWaalsContact O-N 3.16Å; S474-S476 PolarHBondContact O-N 2.96Å; S474-S476 VanDerWaalsContact O-N 3.16Å
475	A	40.3	Very low	44	Very low	90 Å²	90	111.9 Å²	111.9	74%	0.744	71%	0.708	S	S	*	*			trans	-59.5	118.3	165.9	0	0	0	0	0	108.9	H473	H473-A475 PolarHBondContact O-N 3.16Å
476	S	28.3	Very low	42.1	Very low	95 Å²	95	111.8 Å²	111.8	66%	0.664	71%	0.709	S	S	*	*			trans	-62.9	146.2	173.5	-69.3	0	0	0	0	110.3	S474 E478	S474-S476 PolarHBondContact O-N 2.96Å; S474-S476 VanDerWaalsContact O-N 3.16Å; S476-E478 VanDerWaalsContact C-N 3.35Å; S476-E478 PolarHBondContact O-N 2.87Å
477	P	38.5	Very low	40.6	Very low	129 Å²	129	120 Å²	120	84%	0.838	71%	0.713	S	S	*	*			trans	-73.6	90.1	171.9	31.2	-33.1	0	0	0	109.2
478	E	28.6	Very low	39	Very low	172 Å²	172	120.6 Å²	120.6	80%	0.804	73%	0.731	S	S	*	*			trans	-63.5	140.3	170.7	-65.4	-152.1	129.8	0	0	110.5	S476 T480	S476-E478 VanDerWaalsContact C-N 3.35Å; S476-E478 PolarHBondContact O-N 2.87Å; E478-T480 VanDerWaalsContact C-N 3.29Å; E478-T480 PolarHBondContact O-N 2.87Å
479	T	38.4	Very low	37.6	Very low	134 Å²	134	120.7 Å²	120.7	82%	0.822	74%	0.74	S	S	*	*			trans	-77.8	73.9	-172.4	50	0	0	0	0	111.7	T481	T479-T481 PolarHBondContact O-N 3.3Å; T479-T481 VanDerWaalsContact O-N 3.08Å
480	T	31.3	Very low	36.2	Very low	121 Å²	121	120.4 Å²	120.4	74%	0.742	75%	0.752	S	S	*	*			trans	-76.3	93.1	173.8	-42.7	0	0	0	0	110.7	E478 A482	E478-T480 VanDerWaalsContact C-N 3.29Å; E478-T480 PolarHBondContact O-N 2.87Å; T480-A482 HydrophobicContact CG2-CB 4.35Å; T480-A482 PolarHBondContact O-N 2.9Å
481	T	37.3	Very low	35.7	Very low	132 Å²	132	118.3 Å²	118.3	81%	0.81	75%	0.752	S	S	*	*			trans	-70.2	79	166	50.3	0	0	0	0	110.1	T479 S483	T479-T481 PolarHBondContact O-N 3.3Å; T479-T481 VanDerWaalsContact O-N 3.08Å; T481-S483 PolarHBondContact O-N 3.08Å
482	A	29.7	Very low	34.9	Very low	86 Å²	86	115 Å²	115	71%	0.711	75%	0.747	S	S	*	*			trans	-81.7	99.1	178	0	0	0	0	0	110.8	T480	T480-A482 HydrophobicContact CG2-CB 4.35Å; T480-A482 PolarHBondContact O-N 2.9Å
483	S	29.9	Very low	33.9	Very low	112 Å²	112	120.5 Å²	120.5	78%	0.783	77%	0.772	S	S	*	*			trans	-61.7	144.6	171.7	-61.1	0	0	0	0	111.9	T481 P485	T481-S483 PolarHBondContact O-N 3.08Å; S483-P485 WeakPolarHBondContact O-CD 3.39Å
484	V	36.3	Very low	33	Very low	125 Å²	125	121.3 Å²	121.3	76%	0.758	78%	0.776	S	S	*	*			trans	-68.6	137.7	175.2	173.7	0	0	0	0	111.7	S486	V484-S486 WeakPolarHBondContact CG1-OG 2.93Å
485	P	33.1	Very low	32.4	Very low	124 Å²	124	121.4 Å²	121.4	81%	0.805	78%	0.782	S	S	*	*			trans	-123.4	104.7	149.3	33.8	-20.1	0	0	0	111.3	S483	S483-P485 WeakPolarHBondContact O-CD 3.39Å
486	S	29.8	Very low	32.1	Very low	106 Å²	106	122.7 Å²	122.7	74%	0.741	79%	0.786	S	S	*	*			trans	-95.3	97.4	172.7	-66.9	0	0	0	0	111.2	V484	V484-S486 WeakPolarHBondContact CG1-OG 2.93Å
487	R	33.9	Very low	32.7	Very low	261 Å²	261	123.7 Å²	123.7	99%	0.985	79%	0.79	S	S	*	*			trans	-178.8	133.9	162.9	-105.6	164.7	174.1	-161.2	-3.7	108.6
488	G	29.7	Very low	32.3	Very low	80 Å²	80	122 Å²	122	83%	0.825	78%	0.782	S	S	*	*			cis	151.9	126.2	-7.5	0	0	0	0	0	111.4
489	G	28.2	Very low	32.4	Very low	85 Å²	85	122.4 Å²	122.4	88%	0.876	78%	0.783	S	S	*	*			trans	109.5	125.6	175.5	0	0	0	0	0	114.9
490	G	25.1	Very low	31.9	Very low	76 Å²	76	124.8 Å²	124.8	78%	0.784	79%	0.785	S	S	*	*			trans	-106.3	-153.1	147.8	0	0	0	0	0	108.7
491	P	48	Very low	32	Very low	119 Å²	119	127.6 Å²	127.6	77%	0.773	79%	0.79	S	S	*	*			cis	-132.4	-162	3.1	42.1	-24.4	0	0	0	113.5
492	S	29	Very low	32.5	Very low	89 Å²	89	126.9 Å²	126.9	62%	0.622	79%	0.787	S	S	*	*			trans	82	106.2	148.6	-76.3	0	0	0	0	121.9
493	D	28.7	Very low	32.6	Very low	143 Å²	143	130.9 Å²	130.9	77%	0.765	79%	0.791	S	S	*	*				82.9	146.5	113.2	-57.3	-42.1	0	0	0	123.6
494	E	28.9	Very low	32.7	Very low	184 Å²	184	129.9 Å²	129.9	86%	0.86	79%	0.79	S	S	*	*			trans	83.7	138.1	155.5	-74.8	-75.9	69.4	0	0	124.3
495	A	27.5	Very low	32.4	Very low	87 Å²	87	128 Å²	128	72%	0.719	80%	0.796	S	S	*	*			trans	62	121.3	150.7	0	0	0	0	0	122.9
496	S	33.1	Very low	32.2	Very low	116 Å²	116	126 Å²	126	81%	0.811	80%	0.798	S	S	*	*			trans	-86.6	161.7	142.2	-49.5	0	0	0	0	109.4
497	P	42.2	Very low	32.1	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	80%	0.798	S	S	*	*				-156.4	158.9	92	40	-21.2	0	0	0	118.5
498	S	29.6	Very low	31.9	Very low	95 Å²	95	118 Å²	118	66%	0.664	79%	0.793	S	S	*	*			trans	60	135.9	137.3	-64.1	0	0	0	0	125.2
499	Q	29.7	Very low	31.9	Very low	180 Å²	180	121.3 Å²	121.3	84%	0.841	79%	0.792	S	S	*	*			trans	74.3	151.5	139.3	-73.1	165.8	-34.8	0	0	118
500	E	29.1	Very low	32.2	Very low	184 Å²	184	122.2 Å²	122.2	86%	0.86	79%	0.785	S	S	*	*			cis	-133	165	7.6	-65.5	179.8	104.6	0	0	112.7
501	E	33.1	Very low	32.5	Very low	180 Å²	180	121.6 Å²	121.6	84%	0.841	78%	0.779	S	S	*	*			trans	-107.7	164.9	152.6	-69.4	-157.4	148.8	0	0	109.3
502	P	48	Very low	31.9	Very low	117 Å²	117	123.8 Å²	123.8	76%	0.76	78%	0.778	S	S	*	*				-153.9	147	103.6	37.7	-19.4	0	0	0	118.8
503	E	32.6	Very low	32	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.794	79%	0.787	S	S	*	*			trans	67.9	115.6	130.4	-66.1	-79.4	91.4	0	0	124.1
504	A	31.6	Very low	32.3	Very low	91 Å²	91	126.2 Å²	126.2	75%	0.752	78%	0.782	S	S	*	*				88.6	133.5	118.3	0	0	0	0	0	124.7
505	G	28.9	Very low	32.5	Very low	86 Å²	86	125.1 Å²	125.1	89%	0.887	78%	0.782	S	S	*	*			trans	98.1	139.4	153.5	0	0	0	0	0	117.6
506	G	28.5	Very low	32.7	Very low	82 Å²	82	124.2 Å²	124.2	85%	0.845	78%	0.781	S	S	*	*			cis	160.2	136.5	-9.4	0	0	0	0	0	113.6
507	G	28.2	Very low	33.7	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	78%	0.78	S	S	*	*			trans	83	132.4	178.2	0	0	0	0	0	114.4
508	S	30.2	Very low	33.4	Very low	127 Å²	127	127.5 Å²	127.5	89%	0.888	78%	0.784	S	S	*	*			cis	70.4	114.5	43.7	-49.2	0	0	0	0	112.3
509	N	30.6	Very low	33.6	Very low	149 Å²	149	129.2 Å²	129.2	80%	0.797	79%	0.79	S	S	*	*				176.9	161.9	58.2	-175.5	22.7	0	0	0	111.3
510	S	32.7	Very low	33.8	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	78%	0.783	S	S	*	*			trans	49.1	143.7	154.1	58.8	0	0	0	0	122.4
511	G	32.7	Very low	34	Very low	64 Å²	64	122.9 Å²	122.9	66%	0.66	78%	0.78	S	S	*	*			cis	159.9	174.2	-1.9	0	0	0	0	0	113.2
512	H	34.7	Very low	34	Very low	165 Å²	165	118.6 Å²	118.6	76%	0.764	77%	0.77	S	S	*	*			trans	66.7	147.7	175	-64.4	-58.8	0	0	0	116.8
513	Y	32.4	Very low	33.4	Very low	204 Å²	204	119.3 Å²	119.3	80%	0.8	77%	0.773	S	S	*	*			cis	-163.1	175	0.6	-119.2	-33	0	0	0	108.1
514	A	33.7	Very low	33.7	Very low	79 Å²	79	117.5 Å²	117.5	65%	0.653	77%	0.773	S	S	*	*			cis	-157.2	-148.9	0.8	0	0	0	0	0	111.5
515	D	34	Very low	34.1	Very low	161 Å²	161	116.2 Å²	116.2	86%	0.861	77%	0.769	S	S	*	*			trans	-63.2	171	-176.4	-55.7	-94.5	0	0	0	116.4
516	G	31.3	Very low	35.4	Very low	68 Å²	68	118 Å²	118	70%	0.701	77%	0.765	S	S	*	*			cis	146.4	-175	7	0	0	0	0	0	109.6
517	P	53.9	Low	35.6	Very low	121 Å²	121	125.7 Å²	125.7	79%	0.786	79%	0.787	S	S	*	*			cis	-130.6	169	-4.4	42.3	-26.6	0	0	0	116.1
518	Q	35.6	Very low	36	Very low	180 Å²	180	128.4 Å²	128.4	84%	0.841	79%	0.789	S	S	*	*			trans	26.8	137.7	145	-54.1	-176.9	17.5	0	0	121.1
519	T	34.4	Very low	36.3	Very low	130 Å²	130	128.5 Å²	128.5	80%	0.798	78%	0.784	S	S	*	*				-160.2	173.5	59.7	42.4	0	0	0	0	112.3
520	S	33.7	Very low	36.6	Very low	99 Å²	99	127.3 Å²	127.3	69%	0.692	78%	0.783	S	S	*	*			cis	-169.2	158.9	-24	54.2	0	0	0	0	112
521	V	34.2	Very low	36.8	Very low	133 Å²	133	128.8 Å²	128.8	81%	0.806	79%	0.787	S	S	*	*			trans	14.9	140	139.5	-174.8	0	0	0	0	119.6
522	S	32.5	Very low	37.1	Very low	89 Å²	89	132.8 Å²	132.8	62%	0.622	80%	0.795	S	S	*	*			cis	179.4	166.9	-18.8	-87	0	0	0	0	108.2
523	T	35.1	Very low	37.2	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	80%	0.797	S	S	*	*			trans	62.6	154.3	163.3	42.9	0	0	0	0	116.6
524	T	38.1	Very low	37.6	Very low	131 Å²	131	125.4 Å²	125.4	80%	0.804	80%	0.797	S	S	*	*			cis	-150.9	157	1.7	-4.9	0	0	0	0	108.6
525	G	40.5	Very low	37.9	Very low	65 Å²	65	129 Å²	129	67%	0.67	81%	0.808	S	S	*	*			trans	-105.8	-176.1	153.3	0	0	0	0	0	110.6
526	P	56	Low	38.2	Very low	124 Å²	124	126.3 Å²	126.3	81%	0.805	80%	0.803	S	S	*	*			cis	-124.6	163.5	3.3	41	-28.3	0	0	0	114.8
527	D	33.1	Very low	38.8	Very low	243 Å²	243	131.6 Å²	131.6	100%	1.299	81%	0.813	S	S	*	*			trans	-160	0	135.7	-103.2	-24.1	0	0	0	108.1

Retrieved 527 of 527 residues in 573.1 ms (Link to these results)

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