A0A087YN74_POEFO Loading...

GRB2 associated binding protein 3

AlphaFold DB , UniProt , Accession A0A087YN74, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 559 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	43.8	Very low	77.6	Confident	210 Å²	210	76.1 Å²	76.1	100%	1.034	43%	0.428	S	S	*	.				0	138.1	0	-55	-164.6	81	0	0	105.5	T3	M1-T3 PolarHBondContact O-N 3.49Å
2	S	48.3	Very low	79	Confident	77 Å²	77	69.8 Å²	69.8	54%	0.538	39%	0.392	S	S	.	.			trans	-63	110.5	-179.3	-72.3	0	0	0	0	110.8	G4 N41	S2-G4 PolarHBondContact O-N 3.27Å; S2-N41 WeakPolarHBondContact CB-OD1 3.11Å; S2-N41 PolarHBondContact OG-OD1 3.35Å
3	T	56.1	Low	80.1	Confident	124 Å²	124	68.8 Å²	68.8	76%	0.761	39%	0.385	S	S	*	.			trans	-78.6	58.1	165.9	44.1	0	0	0	0	109.2	M1	M1-T3 PolarHBondContact O-N 3.49Å
4	G	63.2	Low	81	Confident	4 Å²	4	65.6 Å²	65.6	4%	0.041	36%	0.364	C	S	.	.			trans	-69.9	133.6	159.9	0	0	0	0	0	108.6	S2	S2-G4 PolarHBondContact O-N 3.27Å
5	D	84.3	Confident	81.5	Confident	102 Å²	102	61.4 Å²	61.4	55%	0.545	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	142	-173.3	-173.1	27.5	0	0	0	110.9	V7 R34 S35	D5-V7 PolarHBondContact O-N 2.92Å; D5-R34 CarbonylContact O-C 3.48Å; D5-R34 WeakPolarHBondContact O-CA 3.24Å; D5-S35 PolarHBondContact N-O 3.32Å; D5-S35 VanDerWaalsContact N-O 3.1Å; D5-S35 PolarHBondContact O-N 3.14Å
6	V	89.5	Confident	81.8	Confident	67 Å²	67	58.2 Å²	58.2	41%	0.406	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	82.6	-163.9	-178.8	0	0	0	0	110.3	T9 V32	V6-T9 HydrophobicContact CG1-CG2 3.25Å; V6-V32 HydrophobicContact CG1-CG1 4.01Å
7	V	90.6	Very high	82	Confident	58 Å²	58	57.9 Å²	57.9	35%	0.352	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	-43.1	-176.1	-178.3	0	0	0	0	112.6	D5 L33 N111 I115	D5-V7 PolarHBondContact O-N 2.92Å; V7-L33 HydrophobicContact CB-CD2 4.26Å; V7-L33 HydrophobicContact CB-CG 4.34Å; V7-L33 HydrophobicContact CG1-CD2 4.27Å; V7-L33 PolarHBondContact N-O 3.29Å; V7-N111 HydrophobicContact CG1-CB 4.09Å; V7-N111 VanDerWaalsContact CG1-OD1 3.28Å; V7-N111 WeakPolarHBondContact CG1-OD1 3.3Å; V7-I115 HydrophobicContact CG2-CD1 4.45Å
8	C	92.8	Very high	81.8	Confident	25 Å²	25	60.7 Å²	60.7	17%	0.169	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	139.3	-177.2	-165.9	0	0	0	0	112.3	L33 W108	C8-L33 HydrophobicContact CB-CB 3.99Å; C8-L33 HydrophobicContact CB-CD2 4.02Å; C8-L33 PolarHBondContact O-N 2.96Å; C8-W108 HydrophobicContact CB-CE3 4.42Å; C8-W108 HydrophobicContact CB-CH2 4.26Å; C8-W108 HydrophobicContact CB-CZ3 4.16Å
9	T	94.8	Very high	81.6	Confident	63 Å²	63	68.4 Å²	68.4	39%	0.387	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148.4	172.5	72.9	0	0	0	0	111.4	V6 W30 F31 V32	V6-T9 HydrophobicContact CG1-CG2 3.25Å; T9-W30 VanDerWaalsContact CB-CZ2 3.49Å; T9-W30 HydrophobicContact CG2-CZ2 4.5Å; T9-W30 VanDerWaalsContact OG1-CZ2 3.26Å; T9-W30 WeakPolarHBondContact OG1-CZ2 3.44Å; T9-F31 VanDerWaalsContact CA-O 3.3Å; T9-F31 WeakPolarHBondContact CA-O 3.49Å; T9-V32 HydrophobicContact CG2-CB 4.3Å; T9-V32 HydrophobicContact CG2-CG1 4.07Å; T9-V32 HydrophobicContact CG2-CG2 4Å
10	G	95	Very high	81.4	Confident	10 Å²	10	70.6 Å²	70.6	10%	0.103	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.6	178.5	-175.7	0	0	0	0	0	114.1	W30 F31	G10-W30 VanDerWaalsContact C-CE3 3.49Å; G10-W30 CarbonylContact O-C 3.58Å; G10-W30 WeakPolarHBondContact O-CA 3.41Å; G10-F31 PolarHBondContact N-O 3.02Å; G10-F31 VanDerWaalsContact N-O 3.13Å; G10-F31 PolarHBondContact O-N 3.12Å
11	W	95.3	Very high	81.3	Confident	97 Å²	97	69 Å²	69	37%	0.367	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	105.8	177.7	-75.4	107.9	0	0	0	111.7	K28 R29 W30	W11-K28 HydrophobicContact CB-CD 4.45Å; W11-K28 HydrophobicContact CB-CG 4.29Å; W11-K28 HydrophobicContact CD2-CG 4.44Å; W11-K28 HydrophobicContact CE3-CG 3.84Å; W11-R29 WeakPolarHBondContact CA-O 3.4Å; W11-W30 AromaticContact CD1-CE3 3.59Å; W11-W30 AromaticContact CD1-CZ3 3.61Å; W11-W30 HydrophobicContact CD2-CB 4.44Å; W11-W30 AromaticContact CD2-CE3 3.8Å; W11-W30 HydrophobicContact CD2-CE3 3.8Å; W11-W30 AromaticContact CE2-CE3 3.75Å; W11-W30 HydrophobicContact CE3-CB 4.1Å; W11-W30 AromaticContact CG-CE3 3.74Å; W11-W30 HydrophobicContact CG-CE3 3.74Å; W11-W30 HydrophobicContact CG-CZ3 4.13Å; W11-W30 HydrophobicContact CH2-CB 4.41Å; W11-W30 HydrophobicContact CZ2-CE3 4.5Å; W11-W30 HydrophobicContact CZ3-CB 4.09Å; W11-W30 AromaticContact NE1-CE3 3.58Å; W11-W30 AromaticContact NE1-CZ3 3.76Å
12	L	95.1	Very high	82.7	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.7	174.5	-58.7	173.9	0	0	0	111.4	K28 R29 F31 F86 L97 A99 W108	L12-K28 CarbonylContact O-C 3.46Å; L12-K28 WeakPolarHBondContact O-CA 3.26Å; L12-R29 PolarHBondContact N-O 3.08Å; L12-R29 PolarHBondContact O-N 3.16Å; L12-F31 HydrophobicContact CB-CD2 3.66Å; L12-F31 HydrophobicContact CB-CE2 3.74Å; L12-F31 HydrophobicContact CB-CG 4.44Å; L12-F31 HydrophobicContact CD1-CB 4.27Å; L12-F31 HydrophobicContact CD1-CD1 4.36Å; L12-F31 HydrophobicContact CD1-CD2 4.03Å; L12-F31 HydrophobicContact CD1-CE2 4.45Å; L12-F31 HydrophobicContact CD1-CG 3.98Å; L12-F31 HydrophobicContact CG-CD2 4.11Å; L12-F31 HydrophobicContact CG-CG 4.45Å; L12-F86 HydrophobicContact CD1-CE1 4.17Å; L12-F86 HydrophobicContact CD1-CZ 3.68Å; L12-F86 HydrophobicContact CD2-CE1 4.09Å; L12-F86 HydrophobicContact CD2-CZ 4.39Å; L12-L97 HydrophobicContact CD1-CB 4.38Å; L12-L97 HydrophobicContact CD1-CD1 4.03Å; L12-A99 HydrophobicContact CD2-CB 3.89Å; L12-W108 HydrophobicContact CD1-CD2 3.97Å; L12-W108 HydrophobicContact CD1-CE3 4.39Å; L12-W108 HydrophobicContact CD1-CG 4.28Å; L12-W108 HydrophobicContact CD1-CZ2 4.24Å; L12-W108 HydrophobicContact CD2-CG 4.49Å; L12-W108 HydrophobicContact CG-CZ2 4.47Å
13	I	93.4	Very high	83.8	Confident	58 Å²	58	75.7 Å²	75.7	30%	0.297	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	106.5	170.8	-50.6	177.9	0	0	0	107.9	W26 K28 V98	I13-W26 HydrophobicContact CG2-CB 3.9Å; I13-W26 HydrophobicContact CG2-CE3 4.29Å; I13-K28 HydrophobicContact CG1-CB 4.21Å; I13-K28 HydrophobicContact CG1-CG 4.26Å; I13-V98 HydrophobicContact CB-CB 4.28Å; I13-V98 PolarHBondContact N-O 3.47Å; I13-V98 PolarHBondContact O-N 3.33Å
14	K	92.8	Very high	85.1	Confident	23 Å²	23	75.4 Å²	75.4	10%	0.1	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	148.6	-179	84.4	177.7	-146.3	-48.9	0	113.2	R27 F31 Y47 Y96 L97	K14-R27 PolarHBondContact N-O 3.38Å; K14-R27 VanDerWaalsContact N-O 3.07Å; K14-R27 PolarHBondContact O-N 3.03Å; K14-F31 HydrophobicContact CB-CE2 4.29Å; K14-F31 HydrophobicContact CB-CZ 3.97Å; K14-F31 HydrophobicContact CD-CE2 4.33Å; K14-F31 HydrophobicContact CD-CZ 3.75Å; K14-F31 HydrophobicContact CG-CZ 4.38Å; K14-Y47 HydrophobicContact CD-CD1 4.38Å; K14-Y47 HydrophobicContact CD-CD2 4.29Å; K14-Y47 HydrophobicContact CD-CE1 4.22Å; K14-Y47 HydrophobicContact CD-CE2 4.18Å; K14-Y47 HydrophobicContact CD-CG 4.43Å; K14-Y47 VanDerWaalsContact CE-CZ 3.46Å; K14-Y96 WeakPolarHBondContact CA-O 3.44Å; K14-L97 HydrophobicContact CB-CD2 3.34Å
15	S	88.3	Confident	86.2	Confident	3 Å²	3	78.9 Å²	78.9	2%	0.021	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-68.5	163.7	175.7	73.3	0	0	0	0	113.8	Y96	S15-Y96 PolarHBondContact N-O 3.01Å; S15-Y96 PolarHBondContact OG-N 2.69Å
16	P	85.8	Confident	86.5	Confident	10 Å²	10	75.8 Å²	75.8	7%	0.065	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-55.2	167.9	152.5	-19.3	30.8	0	0	0	112.4	L21 F24 R93	P16-L21 HydrophobicContact CG-CD1 4.27Å; P16-F24 HydrophobicContact CB-CB 3.78Å; P16-F24 HydrophobicContact CG-CB 3.56Å; P16-F24 WeakPolarHBondContact CG-O 3.39Å; P16-R93 PolarHBondContact O-NH2 2.74Å
17	P	84.5	Confident	86.6	Confident	53 Å²	53	79.7 Å²	79.7	34%	0.344	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-56.5	142.3	160.7	-16.7	29.9	0	0	0	110	K19 K20 L21	P17-K19 PolarHBondContact O-N 3.37Å; P17-K20 CarbonylContact O-C 3.35Å; P17-K20 VanDerWaalsContact O-CA 3.32Å; P17-K20 WeakPolarHBondContact O-CA 3.41Å; P17-K20 WeakPolarHBondContact O-CB 3.48Å; P17-K20 PolarHBondContact O-N 3.06Å; P17-L21 PolarHBondContact O-N 2.79Å
18	E	79.3	Confident	86.7	Confident	109 Å²	109	82 Å²	82	51%	0.509	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-51.6	-49.6	-176.5	-173	-173.3	177.1	0	0	113.2	K20 L21	E18-K20 PolarHBondContact O-N 3.29Å; E18-L21 VanDerWaalsContact O-CB 3.22Å; E18-L21 WeakPolarHBondContact O-CB 3.37Å; E18-L21 PolarHBondContact O-N 2.92Å
19	K	78.4	Confident	86.9	Confident	206 Å²	206	82.8 Å²	82.8	90%	0.896	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-56.4	-8.3	174	-57	-175.4	-179.1	-176.8	0	114.3	P17	P17-K19 PolarHBondContact O-N 3.37Å
20	K	77.9	Confident	86.9	Confident	112 Å²	112	81 Å²	81	49%	0.487	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-126.5	3.4	179.7	-67.1	-174.9	179	-179	0	113.4	P17 E18 K22 R23 F24	P17-K20 CarbonylContact O-C 3.35Å; P17-K20 VanDerWaalsContact O-CA 3.32Å; P17-K20 WeakPolarHBondContact O-CA 3.41Å; P17-K20 WeakPolarHBondContact O-CB 3.48Å; P17-K20 PolarHBondContact O-N 3.06Å; E18-K20 PolarHBondContact O-N 3.29Å; K20-K22 VanDerWaalsContact C-N 3.29Å; K20-K22 PolarHBondContact O-N 3.11Å; K20-R23 PolarHBondContact O-N 3.33Å; K20-F24 HydrophobicContact CB-CD2 3.76Å; K20-F24 HydrophobicContact CB-CE2 4.13Å; K20-F24 HydrophobicContact CD-CD2 4.44Å; K20-F24 HydrophobicContact CD-CE2 4.04Å; K20-F24 HydrophobicContact CG-CD2 4.42Å; K20-F24 HydrophobicContact CG-CE2 4.29Å; K20-F24 PolarHBondContact O-N 3.23Å
21	L	77.4	Confident	87	Confident	39 Å²	39	80.6 Å²	80.6	20%	0.204	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-32.7	-172.7	-173.2	58.5	0	0	0	113.8	P16 P17 E18 R23 W26 I76	P16-L21 HydrophobicContact CG-CD1 4.27Å; P17-L21 PolarHBondContact O-N 2.79Å; E18-L21 VanDerWaalsContact O-CB 3.22Å; E18-L21 WeakPolarHBondContact O-CB 3.37Å; E18-L21 PolarHBondContact O-N 2.92Å; L21-R23 VanDerWaalsContact C-N 3.33Å; L21-R23 PolarHBondContact O-N 3.07Å; L21-W26 HydrophobicContact CD1-CZ2 4.3Å; L21-I76 HydrophobicContact CD2-CD1 4.31Å; L21-I76 HydrophobicContact CD2-CG1 4.16Å; L21-I76 HydrophobicContact CD2-CG2 4.19Å
22	K	73.4	Confident	86.9	Confident	215 Å²	215	76.5 Å²	76.5	94%	0.935	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-17.8	176.4	-65.3	-176	179.6	179.3	0	114.8	K20	K20-K22 VanDerWaalsContact C-N 3.29Å; K20-K22 PolarHBondContact O-N 3.11Å
23	R	72.9	Confident	86.9	Confident	211 Å²	211	76.5 Å²	76.5	80%	0.796	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-7	-169.1	-83.2	-169.5	-77.8	175.2	-7.6	115.6	K20 L21	K20-R23 PolarHBondContact O-N 3.33Å; L21-R23 VanDerWaalsContact C-N 3.33Å; L21-R23 PolarHBondContact O-N 3.07Å
24	F	83.3	Confident	86.8	Confident	118 Å²	118	75.8 Å²	75.8	52%	0.518	34%	0.342	S	S	.	.	S	Bend	trans	-129	147.1	-172.1	-75.2	-98.5	0	0	0	111.9	P16 K20	P16-F24 HydrophobicContact CB-CB 3.78Å; P16-F24 HydrophobicContact CG-CB 3.56Å; P16-F24 WeakPolarHBondContact CG-O 3.39Å; K20-F24 HydrophobicContact CB-CD2 3.76Å; K20-F24 HydrophobicContact CB-CE2 4.13Å; K20-F24 HydrophobicContact CD-CD2 4.44Å; K20-F24 HydrophobicContact CD-CE2 4.04Å; K20-F24 HydrophobicContact CG-CD2 4.42Å; K20-F24 HydrophobicContact CG-CE2 4.29Å; K20-F24 PolarHBondContact O-N 3.23Å
25	A	85.6	Confident	86.6	Confident	78 Å²	78	75.7 Å²	75.7	65%	0.645	34%	0.344	S	S	*	.			trans	-76.7	148.4	176.2	0	0	0	0	0	112.4
26	W	89.9	Confident	86.4	Confident	37 Å²	37	75.6 Å²	75.6	14%	0.14	34%	0.343	C	S	.	.			trans	-65.7	154	168.8	-68.9	62.9	0	0	0	110.5	I13 L21 I76 F80 L85 V98	I13-W26 HydrophobicContact CG2-CB 3.9Å; I13-W26 HydrophobicContact CG2-CE3 4.29Å; L21-W26 HydrophobicContact CD1-CZ2 4.3Å; W26-I76 HydrophobicContact CH2-CG2 4.15Å; W26-I76 HydrophobicContact CZ2-CG2 3.63Å; W26-F80 HydrophobicContact CD2-CE1 4.45Å; W26-F80 HydrophobicContact CD2-CE2 4.29Å; W26-F80 AromaticContact CD2-CZ 3.91Å; W26-F80 HydrophobicContact CD2-CZ 3.91Å; W26-F80 HydrophobicContact CE3-CE1 4.4Å; W26-F80 HydrophobicContact CE3-CZ 4.31Å; W26-F80 HydrophobicContact CG-CE2 4.43Å; W26-F80 HydrophobicContact CG-CZ 4.03Å; W26-F80 HydrophobicContact CZ2-CE2 4.5Å; W26-L85 HydrophobicContact CH2-CD1 3.97Å; W26-L85 HydrophobicContact CZ3-CD1 4.27Å; W26-V98 HydrophobicContact CE3-CG2 4.47Å; W26-V98 HydrophobicContact CH2-CG2 4.44Å; W26-V98 HydrophobicContact CZ3-CG2 3.82Å
27	R	91.6	Very high	85.9	Confident	148 Å²	148	80 Å²	80	56%	0.558	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.6	120.9	-175.3	-68.5	-174.7	172.8	-167.6	-5.3	112.4	K14 R29	K14-R27 PolarHBondContact N-O 3.38Å; K14-R27 VanDerWaalsContact N-O 3.07Å; K14-R27 PolarHBondContact O-N 3.03Å; R27-R29 PolarHBondContact O-N 2.71Å
28	K	94.3	Very high	85.1	Confident	108 Å²	108	85.4 Å²	85.4	47%	0.47	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	129.8	167.2	-163.2	164.7	-174.9	168.1	0	109.7	W11 L12 I13	W11-K28 HydrophobicContact CB-CD 4.45Å; W11-K28 HydrophobicContact CB-CG 4.29Å; W11-K28 HydrophobicContact CD2-CG 4.44Å; W11-K28 HydrophobicContact CE3-CG 3.84Å; L12-K28 CarbonylContact O-C 3.46Å; L12-K28 WeakPolarHBondContact O-CA 3.26Å; I13-K28 HydrophobicContact CG1-CB 4.21Å; I13-K28 HydrophobicContact CG1-CG 4.26Å
29	R	95.4	Very high	84.7	Confident	40 Å²	40	82.5 Å²	82.5	15%	0.151	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	152.1	-178.6	-74.1	-67.4	176.1	-98.8	21.9	109.4	W11 L12 R27 F31 Y47 Y48	W11-R29 WeakPolarHBondContact CA-O 3.4Å; L12-R29 PolarHBondContact N-O 3.08Å; L12-R29 PolarHBondContact O-N 3.16Å; R27-R29 PolarHBondContact O-N 2.71Å; R29-F31 HydrophobicContact CB-CD2 4.29Å; R29-F31 HydrophobicContact CB-CE2 3.85Å; R29-F31 WeakPolarHBondContact O-CD2 3.46Å; R29-Y47 HydrophobicContact CB-CD2 4.42Å; R29-Y47 HydrophobicContact CG-CD2 4.32Å; R29-Y48 WeakPolarHBondContact CD-O 3.44Å
30	W	95.9	Very high	84.6	Confident	27 Å²	27	76.4 Å²	76.4	10%	0.102	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	119.7	177.1	179.9	-98	0	0	0	108.3	T9 G10 W11 Y47 Y48 K51	T9-W30 VanDerWaalsContact CB-CZ2 3.49Å; T9-W30 HydrophobicContact CG2-CZ2 4.5Å; T9-W30 VanDerWaalsContact OG1-CZ2 3.26Å; T9-W30 WeakPolarHBondContact OG1-CZ2 3.44Å; G10-W30 VanDerWaalsContact C-CE3 3.49Å; G10-W30 CarbonylContact O-C 3.58Å; G10-W30 WeakPolarHBondContact O-CA 3.41Å; W11-W30 AromaticContact CD1-CE3 3.59Å; W11-W30 AromaticContact CD1-CZ3 3.61Å; W11-W30 HydrophobicContact CD2-CB 4.44Å; W11-W30 AromaticContact CD2-CE3 3.8Å; W11-W30 HydrophobicContact CD2-CE3 3.8Å; W11-W30 AromaticContact CE2-CE3 3.75Å; W11-W30 HydrophobicContact CE3-CB 4.1Å; W11-W30 AromaticContact CG-CE3 3.74Å; W11-W30 HydrophobicContact CG-CE3 3.74Å; W11-W30 HydrophobicContact CG-CZ3 4.13Å; W11-W30 HydrophobicContact CH2-CB 4.41Å; W11-W30 HydrophobicContact CZ2-CE3 4.5Å; W11-W30 HydrophobicContact CZ3-CB 4.09Å; W11-W30 AromaticContact NE1-CE3 3.58Å; W11-W30 AromaticContact NE1-CZ3 3.76Å; W30-Y47 CarbonylContact O-C 3.59Å; W30-Y47 WeakPolarHBondContact O-CA 3.49Å; W30-Y48 PolarHBondContact N-O 3.36Å; W30-Y48 PolarHBondContact O-N 3.23Å; W30-K51 HydrophobicContact CD2-CB 3.95Å; W30-K51 HydrophobicContact CD2-CG 4.18Å; W30-K51 HydrophobicContact CE3-CB 4.36Å; W30-K51 HydrophobicContact CG-CB 4.13Å; W30-K51 HydrophobicContact CH2-CD 4.01Å; W30-K51 HydrophobicContact CZ2-CD 3.88Å; W30-K51 HydrophobicContact CZ2-CG 4.02Å; W30-K51 HydrophobicContact CZ3-CD 4.38Å
31	F	95.9	Very high	84.9	Confident	1 Å²	1	73.4 Å²	73.4	0%	0.004	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	147.4	179	-77.5	-106.8	0	0	0	110.2	T9 G10 L12 K14 R29 L45 E46 Y47 L97 W108	T9-F31 VanDerWaalsContact CA-O 3.3Å; T9-F31 WeakPolarHBondContact CA-O 3.49Å; G10-F31 PolarHBondContact N-O 3.02Å; G10-F31 VanDerWaalsContact N-O 3.13Å; G10-F31 PolarHBondContact O-N 3.12Å; L12-F31 HydrophobicContact CB-CD2 3.66Å; L12-F31 HydrophobicContact CB-CE2 3.74Å; L12-F31 HydrophobicContact CB-CG 4.44Å; L12-F31 HydrophobicContact CD1-CB 4.27Å; L12-F31 HydrophobicContact CD1-CD1 4.36Å; L12-F31 HydrophobicContact CD1-CD2 4.03Å; L12-F31 HydrophobicContact CD1-CE2 4.45Å; L12-F31 HydrophobicContact CD1-CG 3.98Å; L12-F31 HydrophobicContact CG-CD2 4.11Å; L12-F31 HydrophobicContact CG-CG 4.45Å; K14-F31 HydrophobicContact CB-CE2 4.29Å; K14-F31 HydrophobicContact CB-CZ 3.97Å; K14-F31 HydrophobicContact CD-CE2 4.33Å; K14-F31 HydrophobicContact CD-CZ 3.75Å; K14-F31 HydrophobicContact CG-CZ 4.38Å; R29-F31 HydrophobicContact CB-CD2 4.29Å; R29-F31 HydrophobicContact CB-CE2 3.85Å; R29-F31 WeakPolarHBondContact O-CD2 3.46Å; F31-L45 HydrophobicContact CB-CD1 4.39Å; F31-L45 HydrophobicContact CD1-CD1 3.93Å; F31-L45 HydrophobicContact CD1-CD2 4.19Å; F31-L45 HydrophobicContact CD1-CG 4Å; F31-L45 HydrophobicContact CE1-CD2 4.43Å; F31-E46 CarbonylContact C-O 3.58Å; F31-E46 WeakPolarHBondContact CA-O 3.38Å; F31-Y47 AromaticContact CE1-CD1 3.87Å; F31-Y47 HydrophobicContact CE1-CD1 3.87Å; F31-Y47 HydrophobicContact CE1-CG 4.03Å; F31-Y47 HydrophobicContact CZ-CD1 4.11Å; F31-Y47 HydrophobicContact CZ-CG 4.03Å; F31-L97 HydrophobicContact CE1-CD1 4.22Å; F31-L97 HydrophobicContact CE1-CD2 4Å; F31-L97 HydrophobicContact CE2-CD2 4.27Å; F31-L97 HydrophobicContact CZ-CD2 3.53Å; F31-W108 HydrophobicContact CB-CH2 3.59Å; F31-W108 HydrophobicContact CB-CZ2 4.06Å; F31-W108 HydrophobicContact CB-CZ3 4.24Å
32	V	94.9	Very high	85.2	Confident	10 Å²	10	75.1 Å²	75.1	6%	0.061	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	110.1	177.6	177.6	0	0	0	0	107.2	V6 T9 R34 E46 Y48	V6-V32 HydrophobicContact CG1-CG1 4.01Å; T9-V32 HydrophobicContact CG2-CB 4.3Å; T9-V32 HydrophobicContact CG2-CG1 4.07Å; T9-V32 HydrophobicContact CG2-CG2 4Å; V32-R34 HydrophobicContact CG1-CG 4.09Å; V32-E46 HydrophobicContact CB-CB 4.48Å; V32-E46 PolarHBondContact N-O 3.48Å; V32-E46 PolarHBondContact O-N 3.37Å; V32-Y48 HydrophobicContact CB-CD2 4.5Å; V32-Y48 HydrophobicContact CB-CE2 4.05Å; V32-Y48 HydrophobicContact CG2-CD2 3.95Å; V32-Y48 HydrophobicContact CG2-CE2 3.77Å
33	L	93.8	Very high	86	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.3	167.6	-177.4	59.4	0	0	0	108	V7 C8 L45 L62 W108 N111 I112 I115	V7-L33 HydrophobicContact CB-CD2 4.26Å; V7-L33 HydrophobicContact CB-CG 4.34Å; V7-L33 HydrophobicContact CG1-CD2 4.27Å; V7-L33 PolarHBondContact N-O 3.29Å; C8-L33 HydrophobicContact CB-CB 3.99Å; C8-L33 HydrophobicContact CB-CD2 4.02Å; C8-L33 PolarHBondContact O-N 2.96Å; L33-L45 HydrophobicContact CB-CD1 4.21Å; L33-L45 HydrophobicContact CD1-CB 4.45Å; L33-L45 HydrophobicContact CD1-CD1 4.36Å; L33-L62 HydrophobicContact CD1-CD1 3.32Å; L33-W108 HydrophobicContact CB-CZ3 3.97Å; L33-N111 HydrophobicContact CD2-CB 3.62Å; L33-I112 HydrophobicContact CD1-CG1 4.14Å; L33-I112 HydrophobicContact CD2-CG1 3.93Å; L33-I115 HydrophobicContact CD1-CD1 3.87Å; L33-I115 HydrophobicContact CD2-CD1 3.97Å; L33-I115 HydrophobicContact CG-CD1 3.91Å
34	R	91.6	Very high	86.9	Confident	44 Å²	44	56.5 Å²	56.5	17%	0.166	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.9	169.3	-55.2	-173.9	-168.9	-71.1	-11.1	109	D5 V32 V44 E46 Y48	D5-R34 CarbonylContact O-C 3.48Å; D5-R34 WeakPolarHBondContact O-CA 3.24Å; V32-R34 HydrophobicContact CG1-CG 4.09Å; R34-V44 HydrophobicContact CB-CG2 3.94Å; R34-V44 HydrophobicContact CG-CG2 4.28Å; R34-V44 PolarHBondContact N-O 3.28Å; R34-V44 PolarHBondContact O-N 3.27Å; R34-E46 IonicContact CZ-OE2 3.19Å; R34-E46 IonicContact NE-OE2 2.75Å; R34-E46 PolarHBondContact NE-OE2 3.2Å; R34-E46 IonicContact NH2-OE2 2.76Å; R34-E46 PolarHBondContact NH2-OE2 3.43Å; R34-Y48 PolarHBondContact NH2-OH 3.03Å; R34-Y48 VanDerWaalsContact NH2-OH 3.08Å
35	S	89.3	Confident	87.4	Confident	21 Å²	21	51 Å²	51	15%	0.147	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	138.1	160.6	-173.3	0	0	0	0	110.7	D5 D43	D5-S35 PolarHBondContact N-O 3.32Å; D5-S35 VanDerWaalsContact N-O 3.1Å; D5-S35 PolarHBondContact O-N 3.14Å; S35-D43 WeakPolarHBondContact CA-OD1 3.32Å; S35-D43 VanDerWaalsContact CB-OD1 3.31Å; S35-D43 WeakPolarHBondContact CB-OD1 3.41Å; S35-D43 PolarHBondContact OG-OD1 2.88Å
36	G	82.8	Confident	87.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.01	25%	0.247	C	C	.	.			trans	-91	-26.4	-178.7	0	0	0	0	0	114	M38 C39 G40 N41 D43	G36-M38 PolarHBondContact O-N 2.97Å; G36-C39 CarbonylContact O-C 3.49Å; G36-C39 PolarHBondContact O-N 3.44Å; G36-C39 PolarHBondContact O-SG 3.14Å; G36-G40 PolarHBondContact O-N 3.35Å; G36-N41 CarbonylContact C-O 3.56Å; G36-N41 WeakPolarHBondContact CA-O 3.43Å; G36-N41 PolarHBondContact O-N 2.89Å; G36-D43 PolarHBondContact N-OD1 3.09Å
37	R	75.6	Confident	88.1	Confident	103 Å²	103	47.2 Å²	47.2	39%	0.389	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-47	-54.8	-168.5	-177.8	172.6	-63.8	148.3	20.4	114.3	C39 E122	R37-C39 PolarHBondContact O-N 3.25Å; R37-E122 IonicContact CZ-OE1 3.39Å; R37-E122 IonicContact NE-OE1 3.3Å; R37-E122 PolarHBondContact NE-OE1 3.4Å; R37-E122 IonicContact NH2-OE1 2.81Å; R37-E122 PolarHBondContact NH2-OE1 2.87Å
38	M	68.4	Low	88.2	Confident	166 Å²	166	41.3 Å²	41.3	82%	0.818	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-71.6	1.9	-174.7	-60.5	-58.1	-176.2	0	0	114.5	G36	G36-M38 PolarHBondContact O-N 2.97Å
39	C	70.9	Confident	88.2	Confident	48 Å²	48	41.9 Å²	41.9	32%	0.324	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-148.2	12.9	-172.3	65.8	0	0	0	0	114.7	G36 R37 N41	G36-C39 CarbonylContact O-C 3.49Å; G36-C39 PolarHBondContact O-N 3.44Å; G36-C39 PolarHBondContact O-SG 3.14Å; R37-C39 PolarHBondContact O-N 3.25Å; C39-N41 PolarHBondContact O-N 2.85Å; C39-N41 VanDerWaalsContact O-N 3.1Å; C39-N41 PolarHBondContact O-ND2 3.46Å; C39-N41 PolarHBondContact SG-ND2 3.32Å; C39-N41 VanDerWaalsContact SG-ND2 3.4Å
40	G	76.3	Confident	88.1	Confident	77 Å²	77	42.6 Å²	42.6	79%	0.794	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	19.1	179.3	0	0	0	0	0	115.3	G36	G36-G40 PolarHBondContact O-N 3.35Å
41	N	82.9	Confident	87.8	Confident	50 Å²	50	47.8 Å²	47.8	27%	0.267	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-89.4	166.1	172.4	-77.1	-106.4	0	0	0	109.3	S2 G36 C39	S2-N41 WeakPolarHBondContact CB-OD1 3.11Å; S2-N41 PolarHBondContact OG-OD1 3.35Å; G36-N41 CarbonylContact C-O 3.56Å; G36-N41 WeakPolarHBondContact CA-O 3.43Å; G36-N41 PolarHBondContact O-N 2.89Å; C39-N41 PolarHBondContact O-N 2.85Å; C39-N41 VanDerWaalsContact O-N 3.1Å; C39-N41 PolarHBondContact O-ND2 3.46Å; C39-N41 PolarHBondContact SG-ND2 3.32Å; C39-N41 VanDerWaalsContact SG-ND2 3.4Å
42	P	84.9	Confident	87.4	Confident	74 Å²	74	54.8 Å²	54.8	48%	0.481	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-73	144.6	167.2	29.9	-34.6	0	0	0	111.3	V44	P42-V44 HydrophobicContact CB-CG1 4.18Å; P42-V44 HydrophobicContact CG-CG1 4.09Å; P42-V44 PolarHBondContact O-N 2.83Å
43	D	90.2	Very high	87.2	Confident	26 Å²	26	56 Å²	56	14%	0.139	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-68.7	124.5	166.7	-63.6	-78.1	0	0	0	110.7	S35 G36 L62 I115	S35-D43 WeakPolarHBondContact CA-OD1 3.32Å; S35-D43 VanDerWaalsContact CB-OD1 3.31Å; S35-D43 WeakPolarHBondContact CB-OD1 3.41Å; S35-D43 PolarHBondContact OG-OD1 2.88Å; G36-D43 PolarHBondContact N-OD1 3.09Å; D43-L62 HydrophobicContact CB-CB 4.17Å; D43-L62 WeakPolarHBondContact O-CB 3.26Å; D43-L62 PolarHBondContact O-N 2.92Å; D43-I115 HydrophobicContact CB-CG2 3.48Å; D43-I115 VanDerWaalsContact CB-CG2 3.48Å
44	V	92.3	Very high	86.9	Confident	10 Å²	10	65 Å²	65	6%	0.061	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	139	-170.7	-65.7	0	0	0	0	113.7	R34 P42 E46 T59 I60	R34-V44 HydrophobicContact CB-CG2 3.94Å; R34-V44 HydrophobicContact CG-CG2 4.28Å; R34-V44 PolarHBondContact N-O 3.28Å; R34-V44 PolarHBondContact O-N 3.27Å; P42-V44 HydrophobicContact CB-CG1 4.18Å; P42-V44 HydrophobicContact CG-CG1 4.09Å; P42-V44 PolarHBondContact O-N 2.83Å; V44-E46 HydrophobicContact CG2-CG 4.2Å; V44-T59 HydrophobicContact CB-CG2 3.61Å; V44-T59 HydrophobicContact CG1-CG2 3.61Å; V44-T59 HydrophobicContact CG2-CG2 4.03Å; V44-I60 CarbonylContact C-O 3.43Å; V44-I60 WeakPolarHBondContact CA-O 3.45Å
45	L	93.4	Very high	86.9	Confident	1 Å²	1	71 Å²	71	1%	0.005	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	102.6	167.7	-178.2	62.3	0	0	0	109.9	F31 L33 I60 L62 V88 W108 I112	F31-L45 HydrophobicContact CB-CD1 4.39Å; F31-L45 HydrophobicContact CD1-CD1 3.93Å; F31-L45 HydrophobicContact CD1-CD2 4.19Å; F31-L45 HydrophobicContact CD1-CG 4Å; F31-L45 HydrophobicContact CE1-CD2 4.43Å; L33-L45 HydrophobicContact CB-CD1 4.21Å; L33-L45 HydrophobicContact CD1-CB 4.45Å; L33-L45 HydrophobicContact CD1-CD1 4.36Å; L45-I60 HydrophobicContact CB-CB 4.34Å; L45-I60 PolarHBondContact N-O 3.32Å; L45-I60 WeakPolarHBondContact O-CB 3.47Å; L45-I60 PolarHBondContact O-N 3.04Å; L45-L62 HydrophobicContact CB-CD1 4.15Å; L45-L62 HydrophobicContact CB-CD2 3.93Å; L45-L62 HydrophobicContact CB-CG 4.32Å; L45-V88 HydrophobicContact CD2-CG2 4.5Å; L45-W108 HydrophobicContact CD1-CH2 4.44Å; L45-W108 HydrophobicContact CD1-CZ3 3.7Å; L45-I112 HydrophobicContact CD2-CD1 4Å
46	E	94.4	Very high	87	Confident	22 Å²	22	72.2 Å²	72.2	10%	0.103	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	145.8	176.4	-64.2	-167.7	124.8	0	0	111.5	F31 V32 R34 V44 Y48 P56 T59	F31-E46 CarbonylContact C-O 3.58Å; F31-E46 WeakPolarHBondContact CA-O 3.38Å; V32-E46 HydrophobicContact CB-CB 4.48Å; V32-E46 PolarHBondContact N-O 3.48Å; V32-E46 PolarHBondContact O-N 3.37Å; R34-E46 IonicContact CZ-OE2 3.19Å; R34-E46 IonicContact NE-OE2 2.75Å; R34-E46 PolarHBondContact NE-OE2 3.2Å; R34-E46 IonicContact NH2-OE2 2.76Å; R34-E46 PolarHBondContact NH2-OE2 3.43Å; V44-E46 HydrophobicContact CG2-CG 4.2Å; E46-Y48 HydrophobicContact CB-CD2 4.41Å; E46-Y48 HydrophobicContact CB-CE2 3.73Å; E46-Y48 PolarHBondContact OE2-OH 3.29Å; E46-P56 HydrophobicContact CB-CB 4.21Å; E46-P56 HydrophobicContact CG-CB 4.44Å; E46-P56 WeakPolarHBondContact OE1-CG 3.44Å; E46-T59 HydrophobicContact CG-CG2 3.93Å; E46-T59 PolarHBondContact OE1-OG1 3.48Å; E46-T59 VanDerWaalsContact OE1-OG1 3.13Å
47	Y	94.4	Very high	87.5	Confident	14 Å²	14	76.3 Å²	76.3	6%	0.055	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	140.6	166.1	73.3	-101	0	0	0	114.2	K14 R29 W30 F31 I57 R58 I60 F95	K14-Y47 HydrophobicContact CD-CD1 4.38Å; K14-Y47 HydrophobicContact CD-CD2 4.29Å; K14-Y47 HydrophobicContact CD-CE1 4.22Å; K14-Y47 HydrophobicContact CD-CE2 4.18Å; K14-Y47 HydrophobicContact CD-CG 4.43Å; K14-Y47 VanDerWaalsContact CE-CZ 3.46Å; R29-Y47 HydrophobicContact CB-CD2 4.42Å; R29-Y47 HydrophobicContact CG-CD2 4.32Å; W30-Y47 CarbonylContact O-C 3.59Å; W30-Y47 WeakPolarHBondContact O-CA 3.49Å; F31-Y47 AromaticContact CE1-CD1 3.87Å; F31-Y47 HydrophobicContact CE1-CD1 3.87Å; F31-Y47 HydrophobicContact CE1-CG 4.03Å; F31-Y47 HydrophobicContact CZ-CD1 4.11Å; F31-Y47 HydrophobicContact CZ-CG 4.03Å; Y47-I57 HydrophobicContact CD2-CB 3.95Å; Y47-I57 HydrophobicContact CD2-CD1 4.19Å; Y47-I57 HydrophobicContact CD2-CG2 4.5Å; Y47-I57 HydrophobicContact CE2-CB 3.56Å; Y47-I57 HydrophobicContact CE2-CD1 4.13Å; Y47-I57 HydrophobicContact CE2-CG1 4.42Å; Y47-I57 HydrophobicContact CE2-CG2 3.64Å; Y47-I57 PolarHBondContact O-N 3.16Å; Y47-R58 HydrophobicContact CE1-CB 3.78Å; Y47-R58 PolarHBondContact N-O 2.96Å; Y47-R58 VanDerWaalsContact N-O 3.1Å; Y47-I60 HydrophobicContact CD1-CD1 4.19Å; Y47-I60 HydrophobicContact CE1-CD1 4.25Å; Y47-F95 HydrophobicContact CE1-CE1 4.13Å
48	Y	95.1	Very high	88.3	Confident	25 Å²	25	76.8 Å²	76.8	10%	0.098	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.3	-167	-70.8	-91.8	0	0	0	111	R29 W30 V32 R34 E46 S50 S53 K55 P56	R29-Y48 WeakPolarHBondContact CD-O 3.44Å; W30-Y48 PolarHBondContact N-O 3.36Å; W30-Y48 PolarHBondContact O-N 3.23Å; V32-Y48 HydrophobicContact CB-CD2 4.5Å; V32-Y48 HydrophobicContact CB-CE2 4.05Å; V32-Y48 HydrophobicContact CG2-CD2 3.95Å; V32-Y48 HydrophobicContact CG2-CE2 3.77Å; R34-Y48 PolarHBondContact NH2-OH 3.03Å; R34-Y48 VanDerWaalsContact NH2-OH 3.08Å; E46-Y48 HydrophobicContact CB-CD2 4.41Å; E46-Y48 HydrophobicContact CB-CE2 3.73Å; E46-Y48 PolarHBondContact OE2-OH 3.29Å; Y48-S50 VanDerWaalsContact C-N 3.34Å; Y48-S53 WeakPolarHBondContact CD1-O 3.38Å; Y48-S53 WeakPolarHBondContact CE1-O 3.47Å; Y48-K55 VanDerWaalsContact CD1-O 3.29Å; Y48-K55 WeakPolarHBondContact CD1-O 3.35Å; Y48-P56 HydrophobicContact CD1-CB 4.44Å; Y48-P56 HydrophobicContact CE1-CB 4.07Å; Y48-P56 VanDerWaalsContact CE1-N 3.25Å; Y48-P56 HydrophobicContact CE2-CB 4.36Å
49	Q	93.5	Very high	89.4	Confident	120 Å²	120	71.4 Å²	71.4	56%	0.561	38%	0.379	S	S	*	.	S	Bend	trans	-64.4	-43.7	176.3	-179.3	162.8	-19.7	0	0	111.2	S53 I57	Q49-S53 PolarHBondContact N-OG 3.04Å; Q49-I57 HydrophobicContact CB-CD1 4.06Å
50	S	92.4	Very high	90.4	Very high	55 Å²	55	69.4 Å²	69.4	39%	0.385	37%	0.365	S	S	.	.	S	Bend	trans	-150.3	159.9	176.9	-52.9	0	0	0	0	109.6	Y48 N52 S53	Y48-S50 VanDerWaalsContact C-N 3.34Å; S50-N52 PolarHBondContact O-N 3.23Å; S50-S53 PolarHBondContact N-OG 2.9Å; S50-S53 PolarHBondContact O-N 3.14Å; S50-S53 PolarHBondContact O-OG 3.17Å
51	K	90.3	Very high	91	Very high	135 Å²	135	70.2 Å²	70.2	59%	0.587	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-34.4	176.8	-173	170.9	-178.2	174.5	0	114	W30	W30-K51 HydrophobicContact CD2-CB 3.95Å; W30-K51 HydrophobicContact CD2-CG 4.18Å; W30-K51 HydrophobicContact CE3-CB 4.36Å; W30-K51 HydrophobicContact CG-CB 4.13Å; W30-K51 HydrophobicContact CH2-CD 4.01Å; W30-K51 HydrophobicContact CZ2-CD 3.88Å; W30-K51 HydrophobicContact CZ2-CG 4.02Å; W30-K51 HydrophobicContact CZ3-CD 4.38Å
52	N	88.5	Confident	91.3	Very high	148 Å²	148	68 Å²	68	79%	0.791	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	0.9	-176.2	-55.8	5.7	0	0	0	114.3	S50	S50-N52 PolarHBondContact O-N 3.23Å
53	S	90.1	Very high	91.1	Very high	37 Å²	37	71.9 Å²	71.9	26%	0.259	35%	0.349	S	S	.	.			trans	-85.2	123.2	-176	59.3	0	0	0	0	112.2	Y48 Q49 S50 K55	Y48-S53 WeakPolarHBondContact CD1-O 3.38Å; Y48-S53 WeakPolarHBondContact CE1-O 3.47Å; Q49-S53 PolarHBondContact N-OG 3.04Å; S50-S53 PolarHBondContact N-OG 2.9Å; S50-S53 PolarHBondContact O-N 3.14Å; S50-S53 PolarHBondContact O-OG 3.17Å; S53-K55 VanDerWaalsContact C-N 3.27Å; S53-K55 PolarHBondContact O-N 2.97Å
54	K	87.3	Confident	90.6	Very high	188 Å²	188	76.9 Å²	76.9	82%	0.817	37%	0.371	S	S	*	.	S	Bend	trans	-76.9	-0.1	-172	-60.7	-170.1	177.6	-170	0	115.9
55	K	91.2	Very high	90.4	Very high	171 Å²	171	77 Å²	77	74%	0.743	37%	0.373	S	S	*	.	S	Bend	trans	-132.1	131.1	179.2	-69.6	-168.2	173.9	-166.9	0	109.5	Y48 S53	Y48-K55 VanDerWaalsContact CD1-O 3.29Å; Y48-K55 WeakPolarHBondContact CD1-O 3.35Å; S53-K55 VanDerWaalsContact C-N 3.27Å; S53-K55 PolarHBondContact O-N 2.97Å
56	P	92.6	Very high	90.1	Very high	45 Å²	45	82 Å²	82	29%	0.292	40%	0.396	S	S	.	.			trans	-64.3	150.5	169.6	30.8	-36.4	0	0	0	109.4	E46 Y48	E46-P56 HydrophobicContact CB-CB 4.21Å; E46-P56 HydrophobicContact CG-CB 4.44Å; E46-P56 WeakPolarHBondContact OE1-CG 3.44Å; Y48-P56 HydrophobicContact CD1-CB 4.44Å; Y48-P56 HydrophobicContact CE1-CB 4.07Å; Y48-P56 VanDerWaalsContact CE1-N 3.25Å; Y48-P56 HydrophobicContact CE2-CB 4.36Å
57	I	92.7	Very high	89.9	Confident	87 Å²	87	82 Å²	82	45%	0.446	40%	0.397	S	S	.	.	S	Bend	trans	-76.4	-34.1	169.3	-60.5	171.1	0	0	0	109.5	Y47 Q49	Y47-I57 HydrophobicContact CD2-CB 3.95Å; Y47-I57 HydrophobicContact CD2-CD1 4.19Å; Y47-I57 HydrophobicContact CD2-CG2 4.5Å; Y47-I57 HydrophobicContact CE2-CB 3.56Å; Y47-I57 HydrophobicContact CE2-CD1 4.13Å; Y47-I57 HydrophobicContact CE2-CG1 4.42Å; Y47-I57 HydrophobicContact CE2-CG2 3.64Å; Y47-I57 PolarHBondContact O-N 3.16Å; Q49-I57 HydrophobicContact CB-CD1 4.06Å
58	R	91.8	Very high	89.5	Confident	113 Å²	113	84.8 Å²	84.8	43%	0.426	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	142.6	170.8	-177	169.3	-178	107.3	-7.6	108.6	Y47 I60 S92	Y47-R58 HydrophobicContact CE1-CB 3.78Å; Y47-R58 PolarHBondContact N-O 2.96Å; Y47-R58 VanDerWaalsContact N-O 3.1Å; R58-I60 HydrophobicContact CG-CG1 4.38Å; R58-S92 PolarHBondContact NH2-OG 3.5Å
59	T	92.4	Very high	88.9	Confident	53 Å²	53	87.9 Å²	87.9	33%	0.325	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	136.1	163.7	-54.1	0	0	0	0	106.6	V44 E46	V44-T59 HydrophobicContact CB-CG2 3.61Å; V44-T59 HydrophobicContact CG1-CG2 3.61Å; V44-T59 HydrophobicContact CG2-CG2 4.03Å; E46-T59 HydrophobicContact CG-CG2 3.93Å; E46-T59 PolarHBondContact OE1-OG1 3.48Å; E46-T59 VanDerWaalsContact OE1-OG1 3.13Å
60	I	91.3	Very high	88	Confident	6 Å²	6	83.6 Å²	83.6	3%	0.031	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115.5	178.7	-55.3	166.6	0	0	0	106.1	V44 L45 Y47 R58 T90 F95	V44-I60 CarbonylContact C-O 3.43Å; V44-I60 WeakPolarHBondContact CA-O 3.45Å; L45-I60 HydrophobicContact CB-CB 4.34Å; L45-I60 PolarHBondContact N-O 3.32Å; L45-I60 WeakPolarHBondContact O-CB 3.47Å; L45-I60 PolarHBondContact O-N 3.04Å; Y47-I60 HydrophobicContact CD1-CD1 4.19Å; Y47-I60 HydrophobicContact CE1-CD1 4.25Å; R58-I60 HydrophobicContact CG-CG1 4.38Å; I60-T90 HydrophobicContact CG2-CG2 4.16Å; I60-T90 WeakPolarHBondContact CG2-OG1 3.32Å; I60-F95 HydrophobicContact CD1-CD1 4.25Å; I60-F95 HydrophobicContact CD1-CD2 4.11Å; I60-F95 HydrophobicContact CD1-CE1 3.87Å; I60-F95 HydrophobicContact CD1-CE2 3.73Å; I60-F95 HydrophobicContact CD1-CG 4.36Å; I60-F95 HydrophobicContact CD1-CZ 3.59Å; I60-F95 HydrophobicContact CG1-CE2 4.16Å; I60-F95 HydrophobicContact CG1-CZ 3.95Å; I60-F95 HydrophobicContact CG2-CE2 4.33Å
61	D	89.3	Confident	86.2	Confident	95 Å²	95	86 Å²	86	51%	0.508	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	139.9	177.9	-52.1	-63	0	0	0	110.6
62	L	88.5	Confident	84.4	Confident	2 Å²	2	85.8 Å²	85.8	1%	0.01	42%	0.422	C	S	.	.			trans	-106.7	11.5	-172	-61.9	178.8	0	0	0	113.9	L33 D43 L45 E64 C65 I112 I115	L33-L62 HydrophobicContact CD1-CD1 3.32Å; D43-L62 HydrophobicContact CB-CB 4.17Å; D43-L62 WeakPolarHBondContact O-CB 3.26Å; D43-L62 PolarHBondContact O-N 2.92Å; L45-L62 HydrophobicContact CB-CD1 4.15Å; L45-L62 HydrophobicContact CB-CD2 3.93Å; L45-L62 HydrophobicContact CB-CG 4.32Å; L62-E64 VanDerWaalsContact C-N 3.31Å; L62-E64 PolarHBondContact O-N 3.02Å; L62-C65 VanDerWaalsContact CB-SG 3.58Å; L62-C65 HydrophobicContact CD2-CB 3.95Å; L62-C65 PolarHBondContact O-SG 3.37Å; L62-I112 HydrophobicContact CD1-CG2 4.36Å; L62-I112 HydrophobicContact CD2-CG2 4.04Å; L62-I115 HydrophobicContact CB-CG2 3.98Å; L62-I115 HydrophobicContact CD1-CG2 3.94Å
63	K	81.9	Confident	82.6	Confident	157 Å²	157	87.2 Å²	87.2	68%	0.683	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-41.3	173.6	-66.4	-166.7	165.7	-146.8	0	112.7
64	E	79.9	Confident	80.8	Confident	130 Å²	130	89.5 Å²	89.5	61%	0.607	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	47.9	-177.1	-62.7	163.5	-154.5	0	0	110.3	L62 S91	L62-E64 VanDerWaalsContact C-N 3.31Å; L62-E64 PolarHBondContact O-N 3.02Å; E64-S91 WeakPolarHBondContact OE2-CB 3.46Å; E64-S91 PolarHBondContact OE2-OG 3.22Å
65	C	87	Confident	79.2	Confident	14 Å²	14	92.8 Å²	92.8	10%	0.095	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.6	174.5	53.7	0	0	0	0	112.6	L62 C116	L62-C65 VanDerWaalsContact CB-SG 3.58Å; L62-C65 HydrophobicContact CD2-CB 3.95Å; L62-C65 PolarHBondContact O-SG 3.37Å; C65-C116 HydrophobicContact CB-CB 4.31Å; C65-C116 WeakPolarHBondContact CB-SG 3.41Å; C65-C116 VanDerWaalsContact O-CB 3.27Å; C65-C116 WeakPolarHBondContact O-CB 3.31Å; C65-C116 PolarHBondContact O-SG 3.46Å; C65-C116 WeakPolarHBondContact SG-CB 3.06Å; C65-C116 CovalentContact SG-SG 2.03Å; C65-C116 PolarHBondContact SG-SG 3.01Å
66	E	87.9	Confident	77.6	Confident	105 Å²	105	85.9 Å²	85.9	49%	0.491	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.8	163.1	178.2	179.4	-134.7	0	0	107.5	E68 K89	E66-E68 HydrophobicContact CG-CG 4.43Å; E66-K89 HydrophobicContact CB-CB 4.17Å; E66-K89 HydrophobicContact CB-CD 4.09Å; E66-K89 HydrophobicContact CG-CD 4.02Å; E66-K89 PolarHBondContact N-O 2.82Å; E66-K89 PolarHBondContact O-N 3.34Å; E66-K89 IonicContact OE1-NZ 3.91Å; E66-K89 WeakPolarHBondContact OE2-CD 3.48Å; E66-K89 WeakPolarHBondContact OE2-CE 3.36Å; E66-K89 IonicContact OE2-NZ 2.69Å; E66-K89 PolarHBondContact OE2-NZ 2.84Å
67	V	90.2	Very high	75.8	Confident	22 Å²	22	89 Å²	89	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122	-175.8	-175.6	0	0	0	0	110.3	F86 V87 V88 I109 I112	V67-F86 HydrophobicContact CG1-CD2 4.22Å; V67-V87 VanDerWaalsContact CA-O 3.31Å; V67-V87 WeakPolarHBondContact CA-O 3.5Å; V67-V88 HydrophobicContact CG1-CG2 4.35Å; V67-V88 HydrophobicContact CG2-CG1 4.33Å; V67-V88 HydrophobicContact CG2-CG2 4.14Å; V67-I109 HydrophobicContact CG1-CB 4.38Å; V67-I109 HydrophobicContact CG1-CG1 4.16Å; V67-I109 HydrophobicContact CG1-CG2 4.23Å; V67-I112 HydrophobicContact CG2-CB 4.06Å; V67-I112 HydrophobicContact CG2-CG2 3.56Å
68	E	85.8	Confident	74	Confident	72 Å²	72	96.1 Å²	96.1	34%	0.336	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141.2	-174.2	-65.2	171.7	149	0	0	111.3	E66 F86 V87 K89	E66-E68 HydrophobicContact CG-CG 4.43Å; E68-F86 WeakPolarHBondContact O-CA 3.45Å; E68-F86 WeakPolarHBondContact O-CB 2.9Å; E68-V87 PolarHBondContact N-O 2.84Å; E68-V87 PolarHBondContact O-N 2.76Å; E68-K89 IonicContact OE1-NZ 2.72Å; E68-K89 PolarHBondContact OE1-NZ 3.05Å; E68-K89 WeakPolarHBondContact OE2-CE 3.35Å; E68-K89 IonicContact OE2-NZ 3.01Å; E68-K89 PolarHBondContact OE2-NZ 3.44Å
69	M	83.3	Confident	72.5	Confident	90 Å²	90	95 Å²	95	44%	0.443	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.1	160.9	-166.7	165.9	73.8	0	0	108.7	N71 M105 I109	M69-N71 WeakPolarHBondContact CE-OD1 3.32Å; M69-N71 PolarHBondContact O-N 3.11Å; M69-N71 VanDerWaalsContact O-N 3.1Å; M69-N71 PolarHBondContact O-OD1 2.89Å; M69-M105 HydrophobicContact CG-CE 3.9Å; M69-M105 HydrophobicContact CG-SD 4.15Å; M69-M105 HydrophobicContact SD-CE 3.45Å; M69-M105 WeakPolarHBondContact SD-CE 3.19Å; M69-M105 HydrophobicContact SD-SD 4.46Å; M69-I109 HydrophobicContact CB-CD1 3.83Å; M69-I109 HydrophobicContact CG-CD1 4.15Å
70	L	72.7	Confident	71.2	Confident	30 Å²	30	93.9 Å²	93.9	16%	0.157	43%	0.434	C	S	.	.			trans	-87.2	87.6	-176.5	-165.6	81.8	0	0	0	111.8	N72 L74 L85 V87	L70-N72 VanDerWaalsContact C-N 3.29Å; L70-N72 PolarHBondContact O-N 3.28Å; L70-L74 HydrophobicContact CD1-CD1 3.63Å; L70-L74 HydrophobicContact CD1-CG 3.94Å; L70-L74 HydrophobicContact CD2-CB 4.04Å; L70-L74 HydrophobicContact CD2-CD1 4.2Å; L70-L74 HydrophobicContact CD2-CG 4.32Å; L70-L85 HydrophobicContact CB-CD2 4.39Å; L70-L85 HydrophobicContact CB-CG 4.26Å; L70-L85 HydrophobicContact CD2-CD2 3.6Å; L70-L85 HydrophobicContact CD2-CG 4.29Å; L70-L85 PolarHBondContact N-O 3.44Å; L70-V87 HydrophobicContact CB-CG2 4.09Å; L70-V87 HydrophobicContact CD1-CG2 3.91Å; L70-V87 HydrophobicContact CG-CG2 4.5Å
71	N	56.5	Low	69.6	Low	107 Å²	107	100.3 Å²	100.3	57%	0.572	46%	0.464	S	S	*	.			trans	-70.5	77.3	-179.6	-64	1.3	0	0	0	112.1	M69 Q73	M69-N71 WeakPolarHBondContact CE-OD1 3.32Å; M69-N71 PolarHBondContact O-N 3.11Å; M69-N71 VanDerWaalsContact O-N 3.1Å; M69-N71 PolarHBondContact O-OD1 2.89Å; N71-Q73 PolarHBondContact O-N 3.3Å
72	N	51.4	Low	68.3	Low	130 Å²	130	99.2 Å²	99.2	70%	0.695	48%	0.475	S	S	*	.	S	Bend	trans	59.5	-8.2	168.4	-59.9	-36.6	0	0	0	118.4	L70	L70-N72 VanDerWaalsContact C-N 3.29Å; L70-N72 PolarHBondContact O-N 3.28Å
73	Q	50.7	Low	67.8	Low	178 Å²	178	104 Å²	104	83%	0.832	50%	0.496	S	S	*	.			trans	-84.8	-20.5	-159.6	-161.7	163.8	-1.4	0	0	116	N71	N71-Q73 PolarHBondContact O-N 3.3Å
74	L	51.9	Low	68.1	Low	84 Å²	84	99 Å²	99	44%	0.44	48%	0.475	S	S	.	.	S	Bend	trans	-97.1	136.3	176.1	-56	172.8	0	0	0	112.1	L70 I76 Y96	L70-L74 HydrophobicContact CD1-CD1 3.63Å; L70-L74 HydrophobicContact CD1-CG 3.94Å; L70-L74 HydrophobicContact CD2-CB 4.04Å; L70-L74 HydrophobicContact CD2-CD1 4.2Å; L70-L74 HydrophobicContact CD2-CG 4.32Å; L74-I76 HydrophobicContact CB-CD1 3.82Å; L74-I76 HydrophobicContact CB-CG1 3.87Å; L74-I76 HydrophobicContact CD1-CD1 3.68Å; L74-I76 HydrophobicContact CG-CD1 4.4Å; L74-I76 PolarHBondContact O-N 2.95Å; L74-Y96 HydrophobicContact CD1-CE1 3.85Å
75	R	54.6	Low	68.5	Low	258 Å²	258	93.5 Å²	93.5	97%	0.974	45%	0.45	S	S	*	.			trans	-72.3	37	177.3	-58.4	178	-179.4	172	0.1	113.5	K77	R75-K77 PolarHBondContact O-N 3.31Å
76	I	57.8	Low	68.8	Low	25 Å²	25	92.9 Å²	92.9	13%	0.128	45%	0.445	C	S	.	.	S	Bend	trans	-80.1	71.6	-175.9	-66.5	175.7	0	0	0	109.4	L21 W26 L74 Y96	L21-I76 HydrophobicContact CD2-CD1 4.31Å; L21-I76 HydrophobicContact CD2-CG1 4.16Å; L21-I76 HydrophobicContact CD2-CG2 4.19Å; W26-I76 HydrophobicContact CH2-CG2 4.15Å; W26-I76 HydrophobicContact CZ2-CG2 3.63Å; L74-I76 HydrophobicContact CB-CD1 3.82Å; L74-I76 HydrophobicContact CB-CG1 3.87Å; L74-I76 HydrophobicContact CD1-CD1 3.68Å; L74-I76 HydrophobicContact CG-CD1 4.4Å; L74-I76 PolarHBondContact O-N 2.95Å; I76-Y96 HydrophobicContact CD1-CD1 3.69Å; I76-Y96 HydrophobicContact CD1-CD2 4.37Å; I76-Y96 HydrophobicContact CD1-CE1 3.29Å; I76-Y96 HydrophobicContact CD1-CE2 4.03Å; I76-Y96 HydrophobicContact CD1-CG 4.22Å; I76-Y96 VanDerWaalsContact CD1-CZ 3.49Å
77	K	53.1	Low	68.9	Low	110 Å²	110	88 Å²	88	48%	0.478	42%	0.423	S	S	.	.			trans	61.2	123.9	-176.2	-89.2	175.6	160.6	-73.7	0	114.8	R75 D79 F80	R75-K77 PolarHBondContact O-N 3.31Å; K77-D79 HydrophobicContact CB-CB 4.02Å; K77-D79 WeakPolarHBondContact CB-OD1 3.22Å; K77-D79 HydrophobicContact CD-CB 4.4Å; K77-D79 WeakPolarHBondContact CG-OD1 3.06Å; K77-D79 IonicContact NZ-OD1 2.6Å; K77-D79 PolarHBondContact NZ-OD1 3.35Å; K77-D79 IonicContact NZ-OD2 3.8Å; K77-D79 PolarHBondContact NZ-OD2 3.46Å; K77-D79 PolarHBondContact O-N 2.9Å; K77-F80 HydrophobicContact CB-CD2 3.9Å; K77-F80 HydrophobicContact CB-CE2 4.46Å; K77-F80 HydrophobicContact CD-CD2 4.44Å; K77-F80 HydrophobicContact CD-CE2 4.17Å; K77-F80 PolarHBondContact O-N 3.14Å
78	R	56.5	Low	69	Low	237 Å²	237	87 Å²	87	89%	0.894	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-49.6	-31.2	164.3	-83.5	179	164.1	142.8	-5.6	112	F80 H81	R78-F80 PolarHBondContact O-N 3.16Å; R78-H81 PolarHBondContact O-N 2.97Å
79	D	59.5	Low	69.3	Low	89 Å²	89	86.3 Å²	86.3	48%	0.476	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-55.2	-13.8	176.3	-35.7	29.3	0	0	0	115.3	K77 K83	K77-D79 HydrophobicContact CB-CB 4.02Å; K77-D79 WeakPolarHBondContact CB-OD1 3.22Å; K77-D79 HydrophobicContact CD-CB 4.4Å; K77-D79 WeakPolarHBondContact CG-OD1 3.06Å; K77-D79 IonicContact NZ-OD1 2.6Å; K77-D79 PolarHBondContact NZ-OD1 3.35Å; K77-D79 IonicContact NZ-OD2 3.8Å; K77-D79 PolarHBondContact NZ-OD2 3.46Å; K77-D79 PolarHBondContact O-N 2.9Å; D79-K83 PolarHBondContact O-NZ 2.92Å
80	F	66.3	Low	69.6	Low	30 Å²	30	83.1 Å²	83.1	13%	0.132	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-120.1	9.2	-178.7	-68	-92.3	0	0	0	114.3	W26 K77 R78 G82 K83 V98	W26-F80 HydrophobicContact CD2-CE1 4.45Å; W26-F80 HydrophobicContact CD2-CE2 4.29Å; W26-F80 AromaticContact CD2-CZ 3.91Å; W26-F80 HydrophobicContact CD2-CZ 3.91Å; W26-F80 HydrophobicContact CE3-CE1 4.4Å; W26-F80 HydrophobicContact CE3-CZ 4.31Å; W26-F80 HydrophobicContact CG-CE2 4.43Å; W26-F80 HydrophobicContact CG-CZ 4.03Å; W26-F80 HydrophobicContact CZ2-CE2 4.5Å; K77-F80 HydrophobicContact CB-CD2 3.9Å; K77-F80 HydrophobicContact CB-CE2 4.46Å; K77-F80 HydrophobicContact CD-CD2 4.44Å; K77-F80 HydrophobicContact CD-CE2 4.17Å; K77-F80 PolarHBondContact O-N 3.14Å; R78-F80 PolarHBondContact O-N 3.16Å; F80-G82 PolarHBondContact O-N 3.43Å; F80-K83 HydrophobicContact CD1-CD 3.77Å; F80-K83 HydrophobicContact CE1-CD 4.43Å; F80-K83 HydrophobicContact CG-CD 4.43Å; F80-K83 PolarHBondContact O-N 3.17Å; F80-V98 HydrophobicContact CD1-CG2 3.83Å; F80-V98 HydrophobicContact CE1-CG2 4.09Å
81	H	56.1	Low	70.3	Confident	141 Å²	141	86.2 Å²	86.2	65%	0.653	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	136	168.2	-128.7	-81.2	0	0	0	110.1	R78 K83	R78-H81 PolarHBondContact O-N 2.97Å; H81-K83 VanDerWaalsContact C-N 3.34Å
82	G	62.5	Low	71.6	Confident	73 Å²	73	85.1 Å²	85.1	75%	0.753	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	29.5	-178.2	0	0	0	0	0	114.3	F80	F80-G82 PolarHBondContact O-N 3.43Å
83	K	78.2	Confident	73.4	Confident	103 Å²	103	81.4 Å²	81.4	45%	0.448	40%	0.399	S	S	.	.	S	Bend	trans	-122.5	149.2	170.1	-63.6	-179.1	-173.2	159.8	0	110.1	D79 F80 H81 L85 V98	D79-K83 PolarHBondContact O-NZ 2.92Å; F80-K83 HydrophobicContact CD1-CD 3.77Å; F80-K83 HydrophobicContact CE1-CD 4.43Å; F80-K83 HydrophobicContact CG-CD 4.43Å; F80-K83 PolarHBondContact O-N 3.17Å; H81-K83 VanDerWaalsContact C-N 3.34Å; K83-L85 VanDerWaalsContact C-N 3.28Å; K83-L85 PolarHBondContact O-N 2.95Å; K83-V98 HydrophobicContact CB-CG1 4.21Å
84	H	88.1	Confident	75.3	Confident	50 Å²	50	74.5 Å²	74.5	23%	0.231	37%	0.369	C	S	.	.			trans	-75.3	80.8	-173.6	-39.9	-73.3	0	0	0	110.1	V98 A99 T101 E102 M105	H84-V98 WeakPolarHBondContact O-CA 3.15Å; H84-A99 HydrophobicContact CB-CB 4.37Å; H84-A99 PolarHBondContact O-N 3.39Å; H84-T101 WeakPolarHBondContact CB-O 3.37Å; H84-T101 WeakPolarHBondContact CD2-CA 3Å; H84-T101 PolarHBondContact CD2-O 3.41Å; H84-E102 PolarHBondContact CE1-N 3.45Å; H84-E102 WeakPolarHBondContact ND1-CA 3.15Å; H84-E102 WeakPolarHBondContact ND1-CB 3.48Å; H84-E102 PolarHBondContact ND1-N 2.84Å; H84-M105 VanDerWaalsContact CA-SD 3.53Å; H84-M105 HydrophobicContact CB-CB 3.66Å; H84-M105 HydrophobicContact CB-CE 4.18Å; H84-M105 HydrophobicContact CB-CG 4.26Å; H84-M105 HydrophobicContact CB-SD 3.73Å
85	L	89.1	Confident	77.1	Confident	16 Å²	16	70.6 Å²	70.6	8%	0.084	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.1	-172.7	173.7	67.2	0	0	0	110.2	W26 L70 K83 L97 V98	W26-L85 HydrophobicContact CH2-CD1 3.97Å; W26-L85 HydrophobicContact CZ3-CD1 4.27Å; L70-L85 HydrophobicContact CB-CD2 4.39Å; L70-L85 HydrophobicContact CB-CG 4.26Å; L70-L85 HydrophobicContact CD2-CD2 3.6Å; L70-L85 HydrophobicContact CD2-CG 4.29Å; L70-L85 PolarHBondContact N-O 3.44Å; K83-L85 VanDerWaalsContact C-N 3.28Å; K83-L85 PolarHBondContact O-N 2.95Å; L85-L97 WeakPolarHBondContact CA-O 3.47Å; L85-V98 HydrophobicContact CB-CG2 4.16Å; L85-V98 HydrophobicContact CD1-CG2 3.51Å; L85-V98 HydrophobicContact CG-CG2 4.41Å
86	F	91.9	Very high	78.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	163.2	175.2	69.9	-79.3	0	0	0	111.4	L12 V67 E68 V88 L97 M105 W108 I109 I112	L12-F86 HydrophobicContact CD1-CE1 4.17Å; L12-F86 HydrophobicContact CD1-CZ 3.68Å; L12-F86 HydrophobicContact CD2-CE1 4.09Å; L12-F86 HydrophobicContact CD2-CZ 4.39Å; V67-F86 HydrophobicContact CG1-CD2 4.22Å; E68-F86 WeakPolarHBondContact O-CA 3.45Å; E68-F86 WeakPolarHBondContact O-CB 2.9Å; F86-V88 HydrophobicContact CD2-CG2 4.16Å; F86-V88 HydrophobicContact CE2-CG2 3.93Å; F86-L97 HydrophobicContact CD1-CB 4.03Å; F86-L97 VanDerWaalsContact CD1-O 3.3Å; F86-L97 WeakPolarHBondContact CD1-O 3.3Å; F86-L97 HydrophobicContact CD2-CB 4.34Å; F86-L97 HydrophobicContact CD2-CD1 4.48Å; F86-L97 HydrophobicContact CE1-CB 3.68Å; F86-L97 HydrophobicContact CE2-CB 4.03Å; F86-L97 HydrophobicContact CE2-CD1 3.68Å; F86-L97 HydrophobicContact CE2-CG 4.4Å; F86-L97 HydrophobicContact CG-CB 4.36Å; F86-L97 HydrophobicContact CZ-CB 3.69Å; F86-L97 HydrophobicContact CZ-CD1 3.76Å; F86-L97 HydrophobicContact CZ-CG 4.35Å; F86-L97 PolarHBondContact N-O 2.93Å; F86-L97 PolarHBondContact O-N 2.72Å; F86-M105 HydrophobicContact CB-CG 4.09Å; F86-M105 HydrophobicContact CB-SD 4.37Å; F86-M105 HydrophobicContact CD1-CB 4.49Å; F86-M105 HydrophobicContact CD1-CG 3.85Å; F86-M105 HydrophobicContact CG-CG 4.28Å; F86-W108 HydrophobicContact CE1-CB 4.06Å; F86-W108 HydrophobicContact CE1-CG 4.45Å; F86-W108 HydrophobicContact CE2-CB 3.98Å; F86-W108 HydrophobicContact CZ-CB 3.5Å; F86-W108 VanDerWaalsContact CZ-CB 3.5Å; F86-W108 AromaticContact CZ-CG 3.92Å; F86-W108 HydrophobicContact CZ-CG 3.92Å; F86-I109 HydrophobicContact CB-CD1 3.78Å; F86-I109 HydrophobicContact CB-CG1 3.81Å; F86-I109 HydrophobicContact CD2-CG1 4.05Å; F86-I109 HydrophobicContact CG-CD1 4.46Å; F86-I109 HydrophobicContact CG-CG1 4.03Å; F86-I112 HydrophobicContact CE2-CD1 4.26Å
87	V	90.8	Very high	80.5	Confident	4 Å²	4	58 Å²	58	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.4	-176.3	-166.3	0	0	0	0	108.8	V67 E68 L70 K89 V94 Y96	V67-V87 VanDerWaalsContact CA-O 3.31Å; V67-V87 WeakPolarHBondContact CA-O 3.5Å; E68-V87 PolarHBondContact N-O 2.84Å; E68-V87 PolarHBondContact O-N 2.76Å; L70-V87 HydrophobicContact CB-CG2 4.09Å; L70-V87 HydrophobicContact CD1-CG2 3.91Å; L70-V87 HydrophobicContact CG-CG2 4.5Å; V87-K89 HydrophobicContact CG1-CG 4.16Å; V87-V94 HydrophobicContact CG1-CG1 3.31Å; V87-Y96 HydrophobicContact CG1-CD1 4.16Å; V87-Y96 HydrophobicContact CG1-CE1 4.07Å; V87-Y96 HydrophobicContact CG2-CD1 3.76Å; V87-Y96 HydrophobicContact CG2-CE1 3.92Å
88	V	92.3	Very high	82.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.1	164.7	-179.8	0	0	0	0	107	L45 V67 F86 F95 L97 I112	L45-V88 HydrophobicContact CD2-CG2 4.5Å; V67-V88 HydrophobicContact CG1-CG2 4.35Å; V67-V88 HydrophobicContact CG2-CG1 4.33Å; V67-V88 HydrophobicContact CG2-CG2 4.14Å; F86-V88 HydrophobicContact CD2-CG2 4.16Å; F86-V88 HydrophobicContact CE2-CG2 3.93Å; V88-F95 HydrophobicContact CB-CB 4.45Å; V88-F95 PolarHBondContact N-O 2.8Å; V88-F95 PolarHBondContact O-N 2.96Å; V88-L97 HydrophobicContact CB-CD1 4.49Å; V88-L97 HydrophobicContact CG2-CD1 3.76Å; V88-I112 HydrophobicContact CG2-CD1 4.1Å
89	K	91	Very high	84.2	Confident	58 Å²	58	42.1 Å²	42.1	25%	0.252	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	145.2	169.6	-63.1	163	169.9	173.3	0	108.6	E66 E68 V87 V94	E66-K89 HydrophobicContact CB-CB 4.17Å; E66-K89 HydrophobicContact CB-CD 4.09Å; E66-K89 HydrophobicContact CG-CD 4.02Å; E66-K89 PolarHBondContact N-O 2.82Å; E66-K89 PolarHBondContact O-N 3.34Å; E66-K89 IonicContact OE1-NZ 3.91Å; E66-K89 WeakPolarHBondContact OE2-CD 3.48Å; E66-K89 WeakPolarHBondContact OE2-CE 3.36Å; E66-K89 IonicContact OE2-NZ 2.69Å; E66-K89 PolarHBondContact OE2-NZ 2.84Å; E68-K89 IonicContact OE1-NZ 2.72Å; E68-K89 PolarHBondContact OE1-NZ 3.05Å; E68-K89 WeakPolarHBondContact OE2-CE 3.35Å; E68-K89 IonicContact OE2-NZ 3.01Å; E68-K89 PolarHBondContact OE2-NZ 3.44Å; V87-K89 HydrophobicContact CG1-CG 4.16Å; K89-V94 HydrophobicContact CG-CG1 4.35Å; K89-V94 HydrophobicContact CG-CG2 4.3Å
90	T	90.2	Very high	85.6	Confident	22 Å²	22	43.6 Å²	43.6	14%	0.135	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.9	172.6	-42.3	0	0	0	0	106.4	I60 S92 R93	I60-T90 HydrophobicContact CG2-CG2 4.16Å; I60-T90 WeakPolarHBondContact CG2-OG1 3.32Å; T90-S92 PolarHBondContact O-N 2.92Å; T90-R93 PolarHBondContact N-O 3.03Å; T90-R93 VanDerWaalsContact N-O 3.1Å; T90-R93 CarbonylContact O-C 3.6Å; T90-R93 PolarHBondContact O-N 2.83Å
91	S	87.2	Confident	86.8	Confident	95 Å²	95	44.2 Å²	44.2	66%	0.664	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-34.8	-177.2	46.7	0	0	0	0	115.3	E64	E64-S91 WeakPolarHBondContact OE2-CB 3.46Å; E64-S91 PolarHBondContact OE2-OG 3.22Å
92	S	84.3	Confident	88.5	Confident	85 Å²	85	42.1 Å²	42.1	59%	0.594	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-18.6	176.2	64.6	0	0	0	0	116.3	R58 T90	R58-S92 PolarHBondContact NH2-OG 3.5Å; T90-S92 PolarHBondContact O-N 2.92Å
93	R	89.3	Confident	89.9	Confident	51 Å²	51	45.1 Å²	45.1	19%	0.192	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	142.6	-171	173.5	167.4	173.9	-168.5	-5.5	114.9	P16 T90 F95	P16-R93 PolarHBondContact O-NH2 2.74Å; T90-R93 PolarHBondContact N-O 3.03Å; T90-R93 VanDerWaalsContact N-O 3.1Å; T90-R93 CarbonylContact O-C 3.6Å; T90-R93 PolarHBondContact O-N 2.83Å; R93-F95 HydrophobicContact CB-CE2 4Å; R93-F95 HydrophobicContact CB-CZ 4.35Å; R93-F95 HydrophobicContact CG-CD2 4.09Å; R93-F95 HydrophobicContact CG-CE1 4.43Å; R93-F95 HydrophobicContact CG-CE2 3.79Å; R93-F95 HydrophobicContact CG-CZ 3.98Å
94	V	89.9	Confident	90.6	Very high	34 Å²	34	43.9 Å²	43.9	21%	0.206	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	138.1	161.6	-169.8	0	0	0	0	113.1	V87 K89 Y96	V87-V94 HydrophobicContact CG1-CG1 3.31Å; K89-V94 HydrophobicContact CG-CG1 4.35Å; K89-V94 HydrophobicContact CG-CG2 4.3Å; V94-Y96 HydrophobicContact CB-CE2 4.44Å; V94-Y96 HydrophobicContact CG1-CD2 4.35Å; V94-Y96 HydrophobicContact CG1-CE1 4.27Å; V94-Y96 HydrophobicContact CG1-CE2 3.81Å
95	F	91.3	Very high	90.9	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	114	173.8	-61.6	-96.5	0	0	0	110.8	Y47 I60 V88 R93 L97	Y47-F95 HydrophobicContact CE1-CE1 4.13Å; I60-F95 HydrophobicContact CD1-CD1 4.25Å; I60-F95 HydrophobicContact CD1-CD2 4.11Å; I60-F95 HydrophobicContact CD1-CE1 3.87Å; I60-F95 HydrophobicContact CD1-CE2 3.73Å; I60-F95 HydrophobicContact CD1-CG 4.36Å; I60-F95 HydrophobicContact CD1-CZ 3.59Å; I60-F95 HydrophobicContact CG1-CE2 4.16Å; I60-F95 HydrophobicContact CG1-CZ 3.95Å; I60-F95 HydrophobicContact CG2-CE2 4.33Å; V88-F95 HydrophobicContact CB-CB 4.45Å; V88-F95 PolarHBondContact N-O 2.8Å; V88-F95 PolarHBondContact O-N 2.96Å; R93-F95 HydrophobicContact CB-CE2 4Å; R93-F95 HydrophobicContact CB-CZ 4.35Å; R93-F95 HydrophobicContact CG-CD2 4.09Å; R93-F95 HydrophobicContact CG-CE1 4.43Å; R93-F95 HydrophobicContact CG-CE2 3.79Å; R93-F95 HydrophobicContact CG-CZ 3.98Å; F95-L97 HydrophobicContact CB-CD2 4.48Å; F95-L97 HydrophobicContact CB-CG 4.5Å
96	Y	90.9	Very high	91.1	Very high	18 Å²	18	44.2 Å²	44.2	7%	0.071	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.1	170.5	-55.4	-88.3	0	0	0	109	K14 S15 L74 I76 V87 V94	K14-Y96 WeakPolarHBondContact CA-O 3.44Å; S15-Y96 PolarHBondContact N-O 3.01Å; S15-Y96 PolarHBondContact OG-N 2.69Å; L74-Y96 HydrophobicContact CD1-CE1 3.85Å; I76-Y96 HydrophobicContact CD1-CD1 3.69Å; I76-Y96 HydrophobicContact CD1-CD2 4.37Å; I76-Y96 HydrophobicContact CD1-CE1 3.29Å; I76-Y96 HydrophobicContact CD1-CE2 4.03Å; I76-Y96 HydrophobicContact CD1-CG 4.22Å; I76-Y96 VanDerWaalsContact CD1-CZ 3.49Å; V87-Y96 HydrophobicContact CG1-CD1 4.16Å; V87-Y96 HydrophobicContact CG1-CE1 4.07Å; V87-Y96 HydrophobicContact CG2-CD1 3.76Å; V87-Y96 HydrophobicContact CG2-CE1 3.92Å; V94-Y96 HydrophobicContact CB-CE2 4.44Å; V94-Y96 HydrophobicContact CG1-CD2 4.35Å; V94-Y96 HydrophobicContact CG1-CE1 4.27Å; V94-Y96 HydrophobicContact CG1-CE2 3.81Å
97	L	92.9	Very high	91.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.5	-172	-59.8	-178.8	0	0	0	110.1	L12 K14 F31 L85 F86 V88 F95	L12-L97 HydrophobicContact CD1-CB 4.38Å; L12-L97 HydrophobicContact CD1-CD1 4.03Å; K14-L97 HydrophobicContact CB-CD2 3.34Å; F31-L97 HydrophobicContact CE1-CD1 4.22Å; F31-L97 HydrophobicContact CE1-CD2 4Å; F31-L97 HydrophobicContact CE2-CD2 4.27Å; F31-L97 HydrophobicContact CZ-CD2 3.53Å; L85-L97 WeakPolarHBondContact CA-O 3.47Å; F86-L97 HydrophobicContact CD1-CB 4.03Å; F86-L97 VanDerWaalsContact CD1-O 3.3Å; F86-L97 WeakPolarHBondContact CD1-O 3.3Å; F86-L97 HydrophobicContact CD2-CB 4.34Å; F86-L97 HydrophobicContact CD2-CD1 4.48Å; F86-L97 HydrophobicContact CE1-CB 3.68Å; F86-L97 HydrophobicContact CE2-CB 4.03Å; F86-L97 HydrophobicContact CE2-CD1 3.68Å; F86-L97 HydrophobicContact CE2-CG 4.4Å; F86-L97 HydrophobicContact CG-CB 4.36Å; F86-L97 HydrophobicContact CZ-CB 3.69Å; F86-L97 HydrophobicContact CZ-CD1 3.76Å; F86-L97 HydrophobicContact CZ-CG 4.35Å; F86-L97 PolarHBondContact N-O 2.93Å; F86-L97 PolarHBondContact O-N 2.72Å; V88-L97 HydrophobicContact CB-CD1 4.49Å; V88-L97 HydrophobicContact CG2-CD1 3.76Å; F95-L97 HydrophobicContact CB-CD2 4.48Å; F95-L97 HydrophobicContact CB-CG 4.5Å
98	V	92.1	Very high	91.4	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.8	175.6	175.4	0	0	0	0	109.4	I13 W26 F80 K83 H84 L85	I13-V98 HydrophobicContact CB-CB 4.28Å; I13-V98 PolarHBondContact N-O 3.47Å; I13-V98 PolarHBondContact O-N 3.33Å; W26-V98 HydrophobicContact CE3-CG2 4.47Å; W26-V98 HydrophobicContact CH2-CG2 4.44Å; W26-V98 HydrophobicContact CZ3-CG2 3.82Å; F80-V98 HydrophobicContact CD1-CG2 3.83Å; F80-V98 HydrophobicContact CE1-CG2 4.09Å; K83-V98 HydrophobicContact CB-CG1 4.21Å; H84-V98 WeakPolarHBondContact O-CA 3.15Å; L85-V98 HydrophobicContact CB-CG2 4.16Å; L85-V98 HydrophobicContact CD1-CG2 3.51Å; L85-V98 HydrophobicContact CG-CG2 4.41Å
99	A	93.5	Very high	91.4	Very high	7 Å²	7	46.9 Å²	46.9	6%	0.058	26%	0.257	C	S	.	.			trans	-84.6	169	168.4	0	0	0	0	0	111.1	L12 H84 E104 M105	L12-A99 HydrophobicContact CD2-CB 3.89Å; H84-A99 HydrophobicContact CB-CB 4.37Å; H84-A99 PolarHBondContact O-N 3.39Å; A99-E104 HydrophobicContact CB-CB 3.79Å; A99-M105 HydrophobicContact CB-CB 3.94Å
100	N	90.4	Very high	91.5	Very high	119 Å²	119	47.5 Å²	47.5	64%	0.636	27%	0.268	S	S	*	.	S	Bend	trans	-85.9	-28.3	178.2	-166	87.3	0	0	0	112.5	E104	N100-E104 WeakPolarHBondContact CA-OE2 3.5Å; N100-E104 VanDerWaalsContact CB-OE2 3.27Å; N100-E104 WeakPolarHBondContact CB-OE2 3.09Å; N100-E104 PolarHBondContact N-OE2 3.28Å
101	T	91	Very high	91.6	Very high	44 Å²	44	48.5 Å²	48.5	27%	0.27	27%	0.273	S	S	.	.	S	Bend	trans	-134.3	170.7	177.4	82.4	0	0	0	0	111.4	H84 E103 E104 M105	H84-T101 WeakPolarHBondContact CB-O 3.37Å; H84-T101 WeakPolarHBondContact CD2-CA 3Å; H84-T101 PolarHBondContact CD2-O 3.41Å; T101-E103 WeakPolarHBondContact CB-OE2 3.27Å; T101-E103 PolarHBondContact OG1-OE2 3.47Å; T101-E104 PolarHBondContact OG1-N 2.81Å; T101-M105 PolarHBondContact O-N 2.6Å
102	E	91	Very high	91.9	Very high	97 Å²	97	44 Å²	44	45%	0.453	24%	0.241	S	C	.	.	H	α-helix	trans	-75	-36.4	-179.3	-152.5	179.1	120.6	0	0	111.9	H84 E104 M105 N106	H84-E102 PolarHBondContact CE1-N 3.45Å; H84-E102 WeakPolarHBondContact ND1-CA 3.15Å; H84-E102 WeakPolarHBondContact ND1-CB 3.48Å; H84-E102 PolarHBondContact ND1-N 2.84Å; E102-E104 VanDerWaalsContact C-N 3.34Å; E102-M105 HydrophobicContact CG-CE 3.83Å; E102-M105 WeakPolarHBondContact O-CB 3.41Å; E102-M105 PolarHBondContact O-N 2.82Å; E102-M105 VanDerWaalsContact O-N 3.15Å; E102-N106 WeakPolarHBondContact O-CB 3.31Å; E102-N106 VanDerWaalsContact O-CG 3.23Å; E102-N106 PolarHBondContact O-N 3.46Å; E102-N106 PolarHBondContact O-ND2 2.87Å
103	E	92.7	Very high	92.2	Very high	136 Å²	136	41.3 Å²	41.3	64%	0.636	22%	0.223	S	C	*	.	H	α-helix	trans	-67	-37.6	177.5	-44.2	74.4	-162.8	0	0	110.4	T101 G107	T101-E103 WeakPolarHBondContact CB-OE2 3.27Å; T101-E103 PolarHBondContact OG1-OE2 3.47Å; E103-G107 PolarHBondContact O-N 2.81Å
104	E	93.8	Very high	92.2	Very high	76 Å²	76	43.8 Å²	43.8	36%	0.355	24%	0.237	S	C	.	.	H	α-helix	trans	-58.9	-51	168	-77.8	-171.4	166.2	0	0	110.8	A99 N100 T101 E102 G107 W108	A99-E104 HydrophobicContact CB-CB 3.79Å; N100-E104 WeakPolarHBondContact CA-OE2 3.5Å; N100-E104 VanDerWaalsContact CB-OE2 3.27Å; N100-E104 WeakPolarHBondContact CB-OE2 3.09Å; N100-E104 PolarHBondContact N-OE2 3.28Å; T101-E104 PolarHBondContact OG1-N 2.81Å; E102-E104 VanDerWaalsContact C-N 3.34Å; E104-G107 PolarHBondContact O-N 3.05Å; E104-W108 PolarHBondContact O-N 3.1Å
105	M	92.9	Very high	92.1	Very high	8 Å²	8	42.8 Å²	42.8	4%	0.039	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-50.1	-179.8	174.2	-177.2	72.7	0	0	111.8	M69 H84 F86 A99 T101 E102 G107 W108 I109	M69-M105 HydrophobicContact CG-CE 3.9Å; M69-M105 HydrophobicContact CG-SD 4.15Å; M69-M105 HydrophobicContact SD-CE 3.45Å; M69-M105 WeakPolarHBondContact SD-CE 3.19Å; M69-M105 HydrophobicContact SD-SD 4.46Å; H84-M105 VanDerWaalsContact CA-SD 3.53Å; H84-M105 HydrophobicContact CB-CB 3.66Å; H84-M105 HydrophobicContact CB-CE 4.18Å; H84-M105 HydrophobicContact CB-CG 4.26Å; H84-M105 HydrophobicContact CB-SD 3.73Å; F86-M105 HydrophobicContact CB-CG 4.09Å; F86-M105 HydrophobicContact CB-SD 4.37Å; F86-M105 HydrophobicContact CD1-CB 4.49Å; F86-M105 HydrophobicContact CD1-CG 3.85Å; F86-M105 HydrophobicContact CG-CG 4.28Å; A99-M105 HydrophobicContact CB-CB 3.94Å; T101-M105 PolarHBondContact O-N 2.6Å; E102-M105 HydrophobicContact CG-CE 3.83Å; E102-M105 WeakPolarHBondContact O-CB 3.41Å; E102-M105 PolarHBondContact O-N 2.82Å; E102-M105 VanDerWaalsContact O-N 3.15Å; M105-G107 VanDerWaalsContact C-N 3.29Å; M105-G107 PolarHBondContact O-N 2.9Å; M105-W108 PolarHBondContact O-N 3.17Å; M105-W108 VanDerWaalsContact O-N 3.12Å; M105-I109 HydrophobicContact CG-CD1 3.69Å; M105-I109 HydrophobicContact CG-CG1 4.29Å; M105-I109 WeakPolarHBondContact O-CG1 3.29Å; M105-I109 PolarHBondContact O-N 2.79Å; M105-I109 HydrophobicContact SD-CD1 4.33Å
106	N	93.2	Very high	91.9	Very high	65 Å²	65	43.4 Å²	43.4	35%	0.348	23%	0.234	S	C	.	.	H	α-helix	trans	-64.4	-36.9	-178.8	-67.4	-18.5	0	0	0	110.7	E102 S110	E102-N106 WeakPolarHBondContact O-CB 3.31Å; E102-N106 VanDerWaalsContact O-CG 3.23Å; E102-N106 PolarHBondContact O-N 3.46Å; E102-N106 PolarHBondContact O-ND2 2.87Å; N106-S110 WeakPolarHBondContact O-CB 3.19Å; N106-S110 PolarHBondContact O-N 3.1Å
107	G	94.1	Very high	91.4	Very high	26 Å²	26	51.6 Å²	51.6	27%	0.268	27%	0.265	S	S	.	.	H	α-helix	trans	-62.3	-44.3	169.7	0	0	0	0	0	113.1	E103 E104 M105 N111	E103-G107 PolarHBondContact O-N 2.81Å; E104-G107 PolarHBondContact O-N 3.05Å; M105-G107 VanDerWaalsContact C-N 3.29Å; M105-G107 PolarHBondContact O-N 2.9Å; G107-N111 WeakPolarHBondContact O-CB 3.36Å; G107-N111 PolarHBondContact O-N 3.31Å; G107-N111 PolarHBondContact O-ND2 3.1Å
108	W	94.9	Very high	90.2	Very high	7 Å²	7	55.5 Å²	55.5	3%	0.027	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-44.8	175.6	-82.2	106.4	0	0	0	112.4	C8 L12 F31 L33 L45 F86 E104 M105 I112	C8-W108 HydrophobicContact CB-CE3 4.42Å; C8-W108 HydrophobicContact CB-CH2 4.26Å; C8-W108 HydrophobicContact CB-CZ3 4.16Å; L12-W108 HydrophobicContact CD1-CD2 3.97Å; L12-W108 HydrophobicContact CD1-CE3 4.39Å; L12-W108 HydrophobicContact CD1-CG 4.28Å; L12-W108 HydrophobicContact CD1-CZ2 4.24Å; L12-W108 HydrophobicContact CD2-CG 4.49Å; L12-W108 HydrophobicContact CG-CZ2 4.47Å; F31-W108 HydrophobicContact CB-CH2 3.59Å; F31-W108 HydrophobicContact CB-CZ2 4.06Å; F31-W108 HydrophobicContact CB-CZ3 4.24Å; L33-W108 HydrophobicContact CB-CZ3 3.97Å; L45-W108 HydrophobicContact CD1-CH2 4.44Å; L45-W108 HydrophobicContact CD1-CZ3 3.7Å; F86-W108 HydrophobicContact CE1-CB 4.06Å; F86-W108 HydrophobicContact CE1-CG 4.45Å; F86-W108 HydrophobicContact CE2-CB 3.98Å; F86-W108 HydrophobicContact CZ-CB 3.5Å; F86-W108 VanDerWaalsContact CZ-CB 3.5Å; F86-W108 AromaticContact CZ-CG 3.92Å; F86-W108 HydrophobicContact CZ-CG 3.92Å; E104-W108 PolarHBondContact O-N 3.1Å; M105-W108 PolarHBondContact O-N 3.17Å; M105-W108 VanDerWaalsContact O-N 3.12Å; W108-I112 HydrophobicContact CE3-CD1 4.05Å; W108-I112 HydrophobicContact CE3-CG1 4.45Å; W108-I112 WeakPolarHBondContact O-CB 3.47Å; W108-I112 WeakPolarHBondContact O-CD1 3.41Å; W108-I112 WeakPolarHBondContact O-CG1 3.49Å; W108-I112 PolarHBondContact O-N 3.07Å; W108-I112 VanDerWaalsContact O-N 3.09Å
109	I	93.3	Very high	88.6	Confident	28 Å²	28	56.5 Å²	56.5	14%	0.144	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-49.6	176.7	-66.5	169.4	0	0	0	109.9	V67 M69 F86 M105 S113	V67-I109 HydrophobicContact CG1-CB 4.38Å; V67-I109 HydrophobicContact CG1-CG1 4.16Å; V67-I109 HydrophobicContact CG1-CG2 4.23Å; M69-I109 HydrophobicContact CB-CD1 3.83Å; M69-I109 HydrophobicContact CG-CD1 4.15Å; F86-I109 HydrophobicContact CB-CD1 3.78Å; F86-I109 HydrophobicContact CB-CG1 3.81Å; F86-I109 HydrophobicContact CD2-CG1 4.05Å; F86-I109 HydrophobicContact CG-CD1 4.46Å; F86-I109 HydrophobicContact CG-CG1 4.03Å; M105-I109 HydrophobicContact CG-CD1 3.69Å; M105-I109 HydrophobicContact CG-CG1 4.29Å; M105-I109 WeakPolarHBondContact O-CG1 3.29Å; M105-I109 PolarHBondContact O-N 2.79Å; M105-I109 HydrophobicContact SD-CD1 4.33Å; I109-S113 WeakPolarHBondContact O-CB 3.5Å; I109-S113 PolarHBondContact O-N 3.46Å
110	S	93.1	Very high	86.9	Confident	70 Å²	70	61.8 Å²	61.8	49%	0.49	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-53.5	-178.8	-173.2	0	0	0	0	111.8	N106 I112 S113 Q114	N106-S110 WeakPolarHBondContact O-CB 3.19Å; N106-S110 PolarHBondContact O-N 3.1Å; S110-I112 PolarHBondContact O-N 3.48Å; S110-S113 PolarHBondContact O-N 2.84Å; S110-Q114 VanDerWaalsContact O-CB 3.26Å; S110-Q114 WeakPolarHBondContact O-CB 3.06Å; S110-Q114 PolarHBondContact O-N 2.93Å
111	N	92.9	Very high	85.1	Confident	43 Å²	43	60.8 Å²	60.8	23%	0.23	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-39.4	-178.2	-75.3	-63.6	0	0	0	113	V7 L33 G107 I115	V7-N111 HydrophobicContact CG1-CB 4.09Å; V7-N111 VanDerWaalsContact CG1-OD1 3.28Å; V7-N111 WeakPolarHBondContact CG1-OD1 3.3Å; L33-N111 HydrophobicContact CD2-CB 3.62Å; G107-N111 WeakPolarHBondContact O-CB 3.36Å; G107-N111 PolarHBondContact O-N 3.31Å; G107-N111 PolarHBondContact O-ND2 3.1Å; N111-I115 WeakPolarHBondContact O-CG1 3.1Å; N111-I115 PolarHBondContact O-N 2.93Å
112	I	92.6	Very high	83.2	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-74.4	-43.9	177.4	-54.9	163.3	0	0	0	110.3	L33 L45 L62 V67 F86 V88 W108 S110 Q114 I115 C116	L33-I112 HydrophobicContact CD1-CG1 4.14Å; L33-I112 HydrophobicContact CD2-CG1 3.93Å; L45-I112 HydrophobicContact CD2-CD1 4Å; L62-I112 HydrophobicContact CD1-CG2 4.36Å; L62-I112 HydrophobicContact CD2-CG2 4.04Å; V67-I112 HydrophobicContact CG2-CB 4.06Å; V67-I112 HydrophobicContact CG2-CG2 3.56Å; F86-I112 HydrophobicContact CE2-CD1 4.26Å; V88-I112 HydrophobicContact CG2-CD1 4.1Å; W108-I112 HydrophobicContact CE3-CD1 4.05Å; W108-I112 HydrophobicContact CE3-CG1 4.45Å; W108-I112 WeakPolarHBondContact O-CB 3.47Å; W108-I112 WeakPolarHBondContact O-CD1 3.41Å; W108-I112 WeakPolarHBondContact O-CG1 3.49Å; W108-I112 PolarHBondContact O-N 3.07Å; W108-I112 VanDerWaalsContact O-N 3.09Å; S110-I112 PolarHBondContact O-N 3.48Å; I112-Q114 VanDerWaalsContact C-N 3.35Å; I112-Q114 PolarHBondContact O-N 2.95Å; I112-I115 WeakPolarHBondContact O-CA 3.36Å; I112-I115 WeakPolarHBondContact O-CB 3.4Å; I112-I115 PolarHBondContact O-N 2.73Å; I112-I115 VanDerWaalsContact O-N 3.09Å; I112-C116 PolarHBondContact O-N 2.85Å; I112-C116 PolarHBondContact O-SG 2.03Å
113	S	90.8	Very high	81.2	Confident	29 Å²	29	66.1 Å²	66.1	20%	0.203	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-41.1	179.2	-174.7	0	0	0	0	112.3	I109 S110 I115 C116 R117	I109-S113 WeakPolarHBondContact O-CB 3.5Å; I109-S113 PolarHBondContact O-N 3.46Å; S110-S113 PolarHBondContact O-N 2.84Å; S113-I115 VanDerWaalsContact C-N 3.3Å; S113-I115 PolarHBondContact O-N 3Å; S113-C116 PolarHBondContact O-N 2.89Å; S113-R117 WeakPolarHBondContact O-CB 3.2Å; S113-R117 WeakPolarHBondContact O-CG 3.36Å; S113-R117 PolarHBondContact O-N 3.24Å; S113-R117 PolarHBondContact OG-NE 2.96Å
114	Q	88.9	Confident	79.2	Confident	104 Å²	104	63 Å²	63	49%	0.486	33%	0.334	S	S	.	.	H	α-helix	trans	-56.7	-44.5	172.6	-177.1	175.3	-14.6	0	0	111.3	S110 I112 F118	S110-Q114 VanDerWaalsContact O-CB 3.26Å; S110-Q114 WeakPolarHBondContact O-CB 3.06Å; S110-Q114 PolarHBondContact O-N 2.93Å; I112-Q114 VanDerWaalsContact C-N 3.35Å; I112-Q114 PolarHBondContact O-N 2.95Å; Q114-F118 HydrophobicContact CG-CD2 4.12Å; Q114-F118 HydrophobicContact CG-CE2 3.74Å; Q114-F118 WeakPolarHBondContact O-CD2 3.49Å; Q114-F118 PolarHBondContact O-N 3.1Å
115	I	88.5	Confident	77	Confident	13 Å²	13	67.4 Å²	67.4	7%	0.067	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-50.4	176.3	-74.4	171.8	0	0	0	111.6	V7 L33 D43 L62 N111 I112 S113 R117 F118 G119	V7-I115 HydrophobicContact CG2-CD1 4.45Å; L33-I115 HydrophobicContact CD1-CD1 3.87Å; L33-I115 HydrophobicContact CD2-CD1 3.97Å; L33-I115 HydrophobicContact CG-CD1 3.91Å; D43-I115 HydrophobicContact CB-CG2 3.48Å; D43-I115 VanDerWaalsContact CB-CG2 3.48Å; L62-I115 HydrophobicContact CB-CG2 3.98Å; L62-I115 HydrophobicContact CD1-CG2 3.94Å; N111-I115 WeakPolarHBondContact O-CG1 3.1Å; N111-I115 PolarHBondContact O-N 2.93Å; I112-I115 WeakPolarHBondContact O-CA 3.36Å; I112-I115 WeakPolarHBondContact O-CB 3.4Å; I112-I115 PolarHBondContact O-N 2.73Å; I112-I115 VanDerWaalsContact O-N 3.09Å; S113-I115 VanDerWaalsContact C-N 3.3Å; S113-I115 PolarHBondContact O-N 3Å; I115-R117 VanDerWaalsContact C-N 3.3Å; I115-R117 PolarHBondContact O-N 3.05Å; I115-F118 PolarHBondContact O-N 3.03Å; I115-G119 PolarHBondContact O-N 2.87Å
116	C	86.1	Confident	74.6	Confident	15 Å²	15	71.2 Å²	71.2	10%	0.101	38%	0.382	C	S	.	.	H	α-helix	trans	-57.3	-43.6	179.2	-46.1	0	0	0	0	111.6	C65 I112 S113 F118 G119	C65-C116 HydrophobicContact CB-CB 4.31Å; C65-C116 WeakPolarHBondContact CB-SG 3.41Å; C65-C116 VanDerWaalsContact O-CB 3.27Å; C65-C116 WeakPolarHBondContact O-CB 3.31Å; C65-C116 PolarHBondContact O-SG 3.46Å; C65-C116 WeakPolarHBondContact SG-CB 3.06Å; C65-C116 CovalentContact SG-SG 2.03Å; C65-C116 PolarHBondContact SG-SG 3.01Å; I112-C116 PolarHBondContact O-N 2.85Å; I112-C116 PolarHBondContact O-SG 2.03Å; S113-C116 PolarHBondContact O-N 2.89Å; C116-F118 PolarHBondContact O-N 2.83Å; C116-G119 PolarHBondContact O-N 3.3Å
117	R	80.8	Confident	71.9	Confident	189 Å²	189	74 Å²	74	71%	0.713	40%	0.402	S	S	*	.	H	α-helix	trans	-61	-44.9	-176.7	-79.2	171.8	179.6	-151.7	-3.9	113	S113 I115	S113-R117 WeakPolarHBondContact O-CB 3.2Å; S113-R117 WeakPolarHBondContact O-CG 3.36Å; S113-R117 PolarHBondContact O-N 3.24Å; S113-R117 PolarHBondContact OG-NE 2.96Å; I115-R117 VanDerWaalsContact C-N 3.3Å; I115-R117 PolarHBondContact O-N 3.05Å
118	F	66.9	Low	69.8	Low	84 Å²	84	80.7 Å²	80.7	37%	0.368	43%	0.431	S	S	.	.	H	α-helix	trans	-75.5	-36.3	-178.4	-72.3	-61.5	0	0	0	112.4	Q114 I115 C116 N120 L121 E122	Q114-F118 HydrophobicContact CG-CD2 4.12Å; Q114-F118 HydrophobicContact CG-CE2 3.74Å; Q114-F118 WeakPolarHBondContact O-CD2 3.49Å; Q114-F118 PolarHBondContact O-N 3.1Å; I115-F118 PolarHBondContact O-N 3.03Å; C116-F118 PolarHBondContact O-N 2.83Å; F118-N120 PolarHBondContact O-N 3Å; F118-L121 WeakPolarHBondContact O-CB 3.39Å; F118-L121 PolarHBondContact O-N 3.17Å; F118-E122 WeakPolarHBondContact O-CG 3.43Å; F118-E122 PolarHBondContact O-N 3.09Å
119	G	59.5	Low	67.1	Low	26 Å²	26	87.6 Å²	87.6	27%	0.268	47%	0.469	S	S	.	.	H	α-helix	trans	-59.6	-16	178.3	0	0	0	0	0	114.7	I115 C116	I115-G119 PolarHBondContact O-N 2.87Å; C116-G119 PolarHBondContact O-N 3.3Å
120	N	57.2	Low	64.7	Low	119 Å²	119	90.6 Å²	90.6	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-84.3	-28.1	172.3	-171.7	-108.3	0	0	0	113.6	F118	F118-N120 PolarHBondContact O-N 3Å
121	L	52.2	Low	61.8	Low	97 Å²	97	92.5 Å²	92.5	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-74.2	-37.3	179.8	-174.2	65.8	0	0	0	111.7	F118 E123 A124	F118-L121 WeakPolarHBondContact O-CB 3.39Å; F118-L121 PolarHBondContact O-N 3.17Å; L121-E123 PolarHBondContact O-N 2.99Å; L121-E123 VanDerWaalsContact O-N 3.09Å; L121-A124 PolarHBondContact O-N 3.47Å; L121-A124 VanDerWaalsContact O-N 3.08Å
122	E	52.6	Low	59.1	Low	112 Å²	112	95.4 Å²	95.4	52%	0.523	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-6.5	-175.1	-53	179	-146.2	0	0	113.1	R37 F118	R37-E122 IonicContact CZ-OE1 3.39Å; R37-E122 IonicContact NE-OE1 3.3Å; R37-E122 PolarHBondContact NE-OE1 3.4Å; R37-E122 IonicContact NH2-OE1 2.81Å; R37-E122 PolarHBondContact NH2-OE1 2.87Å; F118-E122 WeakPolarHBondContact O-CG 3.43Å; F118-E122 PolarHBondContact O-N 3.09Å
123	E	49.4	Very low	56.4	Low	141 Å²	141	103.3 Å²	103.3	66%	0.659	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-12.9	176	-164.6	162.4	-124.3	0	0	112.7	L121	L121-E123 PolarHBondContact O-N 2.99Å; L121-E123 VanDerWaalsContact O-N 3.09Å
124	A	49.3	Very low	53.7	Low	70 Å²	70	107.1 Å²	107.1	58%	0.579	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-80.7	-23.4	177.2	0	0	0	0	0	113.1	L121 S126	L121-A124 PolarHBondContact O-N 3.47Å; L121-A124 VanDerWaalsContact O-N 3.08Å; A124-S126 PolarHBondContact O-N 3.48Å
125	E	48.4	Very low	51.2	Low	169 Å²	169	108.5 Å²	108.5	79%	0.79	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-82.4	8.5	-177.7	-60.9	-171.7	157.2	0	0	113.9
126	S	42.2	Very low	48.3	Very low	89 Å²	89	113.8 Å²	113.8	62%	0.622	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-117.2	20.9	-179	77.9	0	0	0	0	115	A124	A124-S126 PolarHBondContact O-N 3.48Å
127	T	37.2	Very low	45.8	Very low	124 Å²	124	118 Å²	118	76%	0.761	68%	0.679	S	S	*	*			trans	-110.4	94.2	169.6	-58.1	0	0	0	0	109.3	D129	T127-D129 PolarHBondContact O-N 2.93Å
128	D	48.6	Very low	43.7	Very low	165 Å²	165	116.4 Å²	116.4	88%	0.882	68%	0.683	S	S	*	*			trans	-67	115.6	170.5	-64.7	-62	0	0	0	110.5
129	D	38.4	Very low	42.4	Very low	153 Å²	153	120.6 Å²	120.6	82%	0.818	70%	0.704	S	S	*	*			trans	-145.3	139.1	133.9	-158.4	-3.6	0	0	0	110.1	T127	T127-D129 PolarHBondContact O-N 2.93Å
130	A	43.8	Very low	41.5	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	73%	0.728	S	S	*	*			trans	-118.6	110.9	-172.7	0	0	0	0	0	110.1
131	S	31.4	Very low	40.1	Very low	110 Å²	110	125 Å²	125	77%	0.769	74%	0.736	S	S	*	*			trans	-138.8	118.1	169.1	-82.8	0	0	0	0	111.9
132	S	36.5	Very low	39.5	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	75%	0.754	S	S	*	*			trans	-22.8	147.1	164.1	56.6	0	0	0	0	116.1
133	L	36.9	Very low	38.4	Very low	165 Å²	165	129.2 Å²	129.2	86%	0.864	77%	0.768	S	S	*	*				-145.3	159.5	71.4	-83.3	168	0	0	0	115.9
134	T	33.2	Very low	37.7	Very low	109 Å²	109	127.1 Å²	127.1	67%	0.669	77%	0.769	S	S	*	*			trans	-80.6	152.5	-178.3	48.1	0	0	0	0	114	T136	T134-T136 PolarHBondContact O-N 3.47Å
135	P	36	Very low	36.8	Very low	133 Å²	133	130.2 Å²	130.2	86%	0.864	78%	0.776	S	S	*	*			trans	-77.2	115.3	171.2	31.4	-32.8	0	0	0	111.5
136	T	27.2	Very low	36.3	Very low	125 Å²	125	132.7 Å²	132.7	77%	0.767	78%	0.778	S	S	*	*			trans	-88.4	134.3	175.2	-60.6	0	0	0	0	111.3	T134	T134-T136 PolarHBondContact O-N 3.47Å
137	S	34.9	Very low	35.9	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	78%	0.784	S	S	*	*			trans	-64.4	137	178.3	-177.9	0	0	0	0	113.2
138	I	36.2	Very low	35.7	Very low	156 Å²	156	133 Å²	133	80%	0.8	78%	0.78	S	S	*	*			trans	-135.8	114.2	158.3	-58.4	-179	0	0	0	107.9
139	Q	39.6	Very low	34.9	Very low	173 Å²	173	133.3 Å²	133.3	81%	0.808	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-88	147.2	163.9	-68.3	-170.5	-82.4	0	0	110.4
140	P	39.4	Very low	34.6	Very low	120 Å²	120	129.7 Å²	129.7	78%	0.779	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-97.5	148.7	141.8	-12.1	30.4	0	0	0	111
141	S	29.5	Very low	34.1	Very low	116 Å²	116	131 Å²	131	81%	0.811	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-80	154.1	177.9	49.2	0	0	0	0	113
142	V	38.2	Very low	34.2	Very low	145 Å²	145	134.4 Å²	134.4	88%	0.879	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-73	140	161.5	-78.1	0	0	0	0	110.7
143	D	30.5	Very low	34.9	Very low	154 Å²	154	134.3 Å²	134.3	82%	0.824	78%	0.776	S	S	*	*			trans	-149.9	-177.1	147.8	-153.3	-8.4	0	0	0	109.5
144	S	34	Very low	34.4	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	77%	0.769	S	S	*	*			trans	-104.2	171.7	-134.5	-58.3	0	0	0	0	117.8
145	D	31.4	Very low	34.5	Very low	136 Å²	136	132.6 Å²	132.6	73%	0.727	77%	0.768	S	S	*	*			trans	88.4	103.9	145.5	-90.5	-33.7	0	0	0	123.2
146	R	37.5	Very low	34.4	Very low	221 Å²	221	133.5 Å²	133.5	83%	0.834	77%	0.766	S	S	*	*				72.6	138.4	115.1	-96.6	-177.1	177.9	-151.3	-2.1	123.3
147	V	32.5	Very low	34.8	Very low	122 Å²	122	137.8 Å²	137.8	74%	0.739	77%	0.769	S	S	*	*			trans	87.6	95.7	155.1	-179.6	0	0	0	0	119.1
148	S	33	Very low	34.9	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	77%	0.767	S	S	*	*				51.3	137.4	124.1	-48.8	0	0	0	0	124.4
149	L	33.2	Very low	34.9	Very low	171 Å²	171	141.3 Å²	141.3	90%	0.895	77%	0.77	S	S	*	*			trans	69.5	136.2	152.5	-70	158.2	0	0	0	116.5
150	A	31	Very low	34.9	Very low	78 Å²	78	140.2 Å²	140.2	65%	0.645	77%	0.77	S	S	*	*			cis	-157.1	178.1	12.4	0	0	0	0	0	113.5
151	S	33.2	Very low	35.5	Very low	118 Å²	118	145 Å²	145	83%	0.825	77%	0.774	S	S	*	*			trans	59.2	120.9	154.1	49	0	0	0	0	121.9
152	Q	33.9	Very low	36.9	Very low	182 Å²	182	147.6 Å²	147.6	85%	0.85	78%	0.778	S	S	*	*			trans	-81.4	-174.4	149.4	-62.3	-167.9	-36.1	0	0	110.6
153	P	52	Low	37.5	Very low	102 Å²	102	147.6 Å²	147.6	66%	0.662	77%	0.772	S	S	*	*			cis	-115.1	-161.7	-19.9	12.4	15	0	0	0	110
154	D	27	Very low	38.2	Very low	133 Å²	133	147.5 Å²	147.5	71%	0.711	77%	0.771	S	S	*	*			cis	-161.5	129.8	42.2	-111	-56.6	0	0	0	116.6
155	T	34.4	Very low	38.8	Very low	105 Å²	105	147.1 Å²	147.1	64%	0.644	77%	0.768	S	S	*	*				41.4	104.9	128.4	-47.3	0	0	0	0	121.4
156	N	33.5	Very low	39.3	Very low	152 Å²	152	149 Å²	149	81%	0.813	77%	0.773	S	S	*	*				177.9	108.1	118.6	-103	-68.4	0	0	0	114.4
157	Y	36.7	Very low	39.4	Very low	214 Å²	214	143.3 Å²	143.3	84%	0.839	77%	0.765	S	S	*	*			trans	-178.2	136.4	137.9	-126.5	-93.5	0	0	0	110.8
158	P	36.7	Very low	39.9	Very low	102 Å²	102	145.9 Å²	145.9	66%	0.662	77%	0.769	S	S	*	*			trans	-73.7	152.2	171.7	30.7	-34.7	0	0	0	112.2
159	R	35.9	Very low	40.1	Very low	230 Å²	230	147.9 Å²	147.9	87%	0.868	78%	0.778	S	S	*	*			trans	-121.9	84.6	-178.5	-76	-172.8	172.4	-172.2	-1	112.4	Y161	R159-Y161 PolarHBondContact O-N 3.32Å
160	D	39.8	Very low	40.1	Very low	150 Å²	150	149.9 Å²	149.9	80%	0.802	77%	0.773	S	S	*	*			trans	-84.3	48.9	175.4	-68.3	-11.2	0	0	0	112.7
161	Y	52.1	Low	40.7	Very low	220 Å²	220	151.4 Å²	151.4	86%	0.863	78%	0.779	S	S	*	*			trans	-133.6	86.5	172.4	-69.1	-72.5	0	0	0	110.3	R159 L163	R159-Y161 PolarHBondContact O-N 3.32Å; Y161-L163 PolarHBondContact O-N 3.08Å
162	L	57.6	Low	40.8	Very low	172 Å²	172	153 Å²	153	90%	0.901	78%	0.777	S	S	*	*			trans	-75.7	109.1	170.6	-72.6	173.4	0	0	0	109.9	L164	L162-L164 PolarHBondContact O-N 3.42Å
163	L	50.7	Low	40.7	Very low	144 Å²	144	150 Å²	150	75%	0.754	77%	0.771	S	S	*	*			trans	-78.1	113.8	175	-170.4	67.7	0	0	0	109.8	Y161 S165	Y161-L163 PolarHBondContact O-N 3.08Å; L163-S165 WeakPolarHBondContact CD2-OG 3.44Å; L163-S165 PolarHBondContact O-N 3.04Å
164	L	46.8	Very low	39.6	Very low	153 Å²	153	150.3 Å²	150.3	80%	0.801	77%	0.771	S	S	*	*	S	Bend	trans	-65.7	7.6	-174.9	-76.9	160.1	0	0	0	115.5	L162 Q166	L162-L164 PolarHBondContact O-N 3.42Å; L164-Q166 VanDerWaalsContact C-N 3.35Å; L164-Q166 PolarHBondContact O-N 3.36Å
165	S	45.2	Very low	39.8	Very low	87 Å²	87	153.7 Å²	153.7	61%	0.608	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	13.8	-173.2	70.4	0	0	0	0	115	L163	L163-S165 WeakPolarHBondContact CD2-OG 3.44Å; L163-S165 PolarHBondContact O-N 3.04Å
166	Q	43.2	Very low	39.8	Very low	177 Å²	177	155.9 Å²	155.9	83%	0.827	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	20.5	-176.9	-64.1	-170.2	-5.1	0	0	114	L164 E168	L164-Q166 VanDerWaalsContact C-N 3.35Å; L164-Q166 PolarHBondContact O-N 3.36Å; Q166-E168 VanDerWaalsContact C-N 3.32Å; Q166-E168 PolarHBondContact O-N 2.87Å
167	C	39.7	Very low	39.7	Very low	101 Å²	101	154.6 Å²	154.6	68%	0.682	77%	0.77	S	S	*	*			trans	-82.5	65.9	178.6	-62.6	0	0	0	0	112.9	T169	C167-T169 PolarHBondContact O-N 2.78Å
168	E	42	Very low	40	Very low	175 Å²	175	147.9 Å²	147.9	82%	0.818	75%	0.754	S	S	*	*			trans	-88	105.6	175	-167.8	172.8	-176.6	0	0	111.4	Q166 R170	Q166-E168 VanDerWaalsContact C-N 3.32Å; Q166-E168 PolarHBondContact O-N 2.87Å; E168-R170 PolarHBondContact O-N 3.34Å
169	T	37.3	Very low	39.9	Very low	140 Å²	140	152.4 Å²	152.4	86%	0.859	76%	0.764	S	S	*	*			trans	-83.2	100.8	-177	-60.2	0	0	0	0	111.6	C167	C167-T169 PolarHBondContact O-N 2.78Å
170	R	34.2	Very low	39.8	Very low	213 Å²	213	145.9 Å²	145.9	80%	0.804	75%	0.75	S	S	*	*			trans	-118.4	107.4	169.9	-167.7	169.6	-174.5	153.7	0.8	111.6	E168	E168-R170 PolarHBondContact O-N 3.34Å
171	S	42.7	Very low	39.3	Very low	110 Å²	110	145.7 Å²	145.7	77%	0.769	75%	0.749	S	S	*	*			trans	-74.9	128.8	177.1	178.6	0	0	0	0	111.9
172	I	34.6	Very low	38.7	Very low	151 Å²	151	139.9 Å²	139.9	77%	0.774	74%	0.741	S	S	*	*			trans	-152.1	144.4	154.3	12.6	175.9	0	0	0	112.6
173	T	32.9	Very low	37.5	Very low	119 Å²	119	138.8 Å²	138.8	73%	0.73	74%	0.735	S	S	*	*			trans	-71.3	170.1	176.3	51	0	0	0	0	112.7
174	T	29.4	Very low	36.7	Very low	109 Å²	109	140.1 Å²	140.1	67%	0.669	74%	0.742	S	S	*	*			cis	-167.1	157.5	42.1	42.3	0	0	0	0	114.2
175	R	31.3	Very low	36	Very low	204 Å²	204	137.3 Å²	137.3	77%	0.77	74%	0.735	S	S	*	*			trans	69.5	127.2	150.3	-71.7	162.7	-173	-87.9	-0.1	117.9
176	Q	34.3	Very low	35.5	Very low	151 Å²	151	139.6 Å²	139.6	71%	0.706	74%	0.74	S	S	*	*				78.2	141.4	60.9	-77.7	-174.3	-94.6	0	0	113.1
177	D	30.5	Very low	35.1	Very low	124 Å²	124	138.4 Å²	138.4	66%	0.663	73%	0.734	S	S	*	*			cis	-144.7	179.7	26.3	-88.5	-58.8	0	0	0	111.4
178	S	42.7	Very low	34.8	Very low	73 Å²	73	140.9 Å²	140.9	51%	0.51	74%	0.736	S	S	.	*			cis	-162.1	169.9	-23.1	-101.9	0	0	0	0	106.2
179	F	33.9	Very low	34.3	Very low	197 Å²	197	142.6 Å²	142.6	86%	0.864	73%	0.734	S	S	*	*				-174.2	175.7	60.1	-71.8	-87.2	0	0	0	109.7
180	T	34.4	Very low	34.1	Very low	93 Å²	93	143.1 Å²	143.1	57%	0.571	73%	0.731	S	S	*	*			cis	-176.3	158.5	-36.6	-77.6	0	0	0	0	109.6
181	N	29.6	Very low	34.1	Very low	146 Å²	146	137.7 Å²	137.7	78%	0.781	73%	0.726	S	S	*	*			trans	112.3	138.4	165.5	-66.4	-70.3	0	0	0	114.7
182	S	39.6	Very low	33.4	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	73%	0.732	S	S	*	*			cis	-161.5	131.3	-6.9	44.9	0	0	0	0	108
183	D	32.6	Very low	33.5	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	73%	0.73	S	S	*	*				80.8	108.5	67.7	-94.9	-44.1	0	0	0	116.5
184	I	33.7	Very low	33.6	Very low	172 Å²	172	138.2 Å²	138.2	88%	0.882	73%	0.729	S	S	*	*			trans	174.9	149.1	145.5	42.7	163.4	0	0	0	109
185	S	31.4	Very low	33.8	Very low	94 Å²	94	138.9 Å²	138.9	66%	0.657	73%	0.733	S	S	*	*			cis	-167.9	142.2	-22.7	-168.5	0	0	0	0	110.6
186	L	35.3	Very low	34.2	Very low	136 Å²	136	137.9 Å²	137.9	71%	0.712	73%	0.734	S	S	*	*			trans	41.6	122.8	146.8	-63.1	175.9	0	0	0	121.3
187	E	34.8	Very low	34	Very low	151 Å²	151	136.9 Å²	136.9	71%	0.706	73%	0.733	S	S	*	*				72.9	156.4	92.2	-69.1	-154.6	123.7	0	0	115.8
188	Q	32.8	Very low	34.2	Very low	154 Å²	154	137.5 Å²	137.5	72%	0.72	73%	0.734	S	S	*	*			cis	-150.9	-158.7	0.4	-129.5	177.1	37.4	0	0	112.2
189	R	32.8	Very low	33.7	Very low	210 Å²	210	142.5 Å²	142.5	79%	0.792	75%	0.749	S	S	*	*			trans	-86.4	162.7	-163.2	-40	176	-176.1	-165.2	0.6	117
190	L	31.8	Very low	33.4	Very low	152 Å²	152	136.4 Å²	136.4	80%	0.796	74%	0.741	S	S	*	*			trans	54.5	153.4	134.2	-74.1	170	0	0	0	120.2
191	S	34.8	Very low	33.1	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	76%	0.755	S	S	*	*			cis	-152.1	169.1	3	-75.8	0	0	0	0	109.5
192	D	28.1	Very low	33.4	Very low	169 Å²	169	138 Å²	138	90%	0.904	75%	0.747	S	S	*	*				-167.8	172.9	115.4	-134.5	-35.5	0	0	0	113
193	D	36.2	Very low	33.2	Very low	138 Å²	138	138.5 Å²	138.5	74%	0.738	75%	0.751	S	S	*	*			trans	-106.2	159.1	-168.1	178.2	43	0	0	0	115.7
194	A	35.1	Very low	33.2	Very low	84 Å²	84	138.8 Å²	138.8	69%	0.694	75%	0.751	S	S	*	*			trans	-177.4	95	149	0	0	0	0	0	114.9
195	V	35	Very low	33	Very low	124 Å²	124	135 Å²	135	75%	0.752	74%	0.74	S	S	*	*			trans	45.6	124.3	142.3	-57.9	0	0	0	0	123.1
196	K	39.8	Very low	32.9	Very low	183 Å²	183	135.1 Å²	135.1	80%	0.796	74%	0.741	S	S	*	*				146.5	114.6	105.8	-167.2	165.9	-173.8	173	0	117.2
197	D	29.3	Very low	32.7	Very low	129 Å²	129	135.8 Å²	135.8	69%	0.69	74%	0.744	S	S	*	*			trans	13.8	152.4	138	-47.7	-24.3	0	0	0	123
198	M	34.7	Very low	32.4	Very low	138 Å²	138	133.1 Å²	133.1	68%	0.68	74%	0.742	S	S	*	*			cis	-172.4	153.2	-13.2	-100.8	-74.4	89.3	0	0	109.7
199	H	31.8	Very low	32.3	Very low	178 Å²	178	133.9 Å²	133.9	82%	0.824	75%	0.745	S	S	*	*			trans	49.7	150.8	153	-66.6	-54.5	0	0	0	124.9
200	G	28.2	Very low	32.3	Very low	68 Å²	68	131.9 Å²	131.9	70%	0.701	75%	0.747	S	S	*	*			trans	107.9	94.9	164.7	0	0	0	0	0	114.2
201	E	28.2	Very low	32.3	Very low	186 Å²	186	129.5 Å²	129.5	87%	0.869	74%	0.743	S	S	*	*				58.7	130.6	75.9	-68.1	-147.4	-145.2	0	0	115.2
202	S	34.7	Very low	31.9	Very low	88 Å²	88	136.7 Å²	136.7	62%	0.615	76%	0.755	S	S	*	*			cis	-164.4	170.4	-0.8	-100.1	0	0	0	0	111.3
203	S	35.2	Very low	32.1	Very low	109 Å²	109	134 Å²	134	76%	0.762	75%	0.75	S	S	*	*			trans	75.2	142.9	163	-60.8	0	0	0	0	119.2
204	L	32.9	Very low	33	Very low	153 Å²	153	133.4 Å²	133.4	80%	0.801	75%	0.753	S	S	*	*			cis	-159.8	150.6	-3.9	-114.7	168.5	0	0	0	111.9
205	S	29.7	Very low	32.8	Very low	93 Å²	93	135.2 Å²	135.2	65%	0.65	76%	0.761	S	S	*	*			trans	18.3	152.4	149.6	61.4	0	0	0	0	123.1
206	S	28.6	Very low	32.7	Very low	96 Å²	96	136.2 Å²	136.2	67%	0.671	76%	0.761	S	S	*	*			cis	-173.8	143.3	-9.4	-89.4	0	0	0	0	108
207	I	32	Very low	32.5	Very low	150 Å²	150	137.5 Å²	137.5	77%	0.769	76%	0.762	S	S	*	*				40.3	117.6	98.5	-46.6	172.6	0	0	0	112.9
208	S	29.1	Very low	32.6	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	77%	0.768	S	S	*	*				-150.2	157.5	57	41.1	0	0	0	0	111.9
209	H	29.7	Very low	32.7	Very low	169 Å²	169	138.5 Å²	138.5	78%	0.782	78%	0.78	S	S	*	*			cis	94.4	150.1	35.7	87.6	-136.6	0	0	0	116.4
210	M	33.3	Very low	32.6	Very low	169 Å²	169	133.6 Å²	133.6	83%	0.833	78%	0.777	S	S	*	*			trans	-91.7	164.7	-143.2	-60.9	161.5	48.3	0	0	119.3
211	S	31.2	Very low	32.9	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	78%	0.783	S	S	*	*			trans	85.6	126.7	133.2	69.5	0	0	0	0	123.1
212	R	27.6	Very low	33.2	Very low	248 Å²	248	137.7 Å²	137.7	94%	0.936	77%	0.77	S	S	*	*				-172.1	155.5	125.8	-111.2	174.1	171.7	146.1	-2.9	113.7
213	S	32.8	Very low	33.1	Very low	114 Å²	114	139 Å²	139	80%	0.797	78%	0.779	S	S	*	*			trans	-119.6	-173.6	165.1	-42.9	0	0	0	0	107.9
214	P	54.9	Low	32.8	Very low	124 Å²	124	141.1 Å²	141.1	81%	0.805	78%	0.782	S	S	*	*			cis	-134.2	-172.6	-8.1	43.4	-27	0	0	0	113.9
215	S	29.9	Very low	32.8	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	78%	0.781	S	S	*	*			trans	-164.3	171.9	154.8	57.1	0	0	0	0	113.4
216	L	33.7	Very low	34	Very low	146 Å²	146	139 Å²	139	76%	0.764	78%	0.783	S	S	*	*			trans	-121.4	164.8	-177	-68.5	163.5	0	0	0	111.2
217	Y	34.9	Very low	34.3	Very low	209 Å²	209	143.7 Å²	143.7	82%	0.82	79%	0.792	S	S	*	*			trans	142.1	120.2	132.8	-81.2	-69.3	0	0	0	118.4
218	S	31.2	Very low	34.3	Very low	115 Å²	115	141.9 Å²	141.9	80%	0.804	79%	0.793	S	S	*	*			trans	71.6	145.3	137.3	64	0	0	0	0	124.5
219	N	37.7	Very low	34.4	Very low	174 Å²	174	141.9 Å²	141.9	93%	0.93	80%	0.798	S	S	*	*			trans	-94.3	162.8	175.9	-77.1	-21.9	0	0	0	113.9
220	G	29.2	Very low	35.3	Very low	75 Å²	75	139 Å²	139	77%	0.773	80%	0.795	S	S	*	*			trans	153.3	168.4	143.8	0	0	0	0	0	115.6
221	R	34.8	Very low	35.2	Very low	218 Å²	218	136.5 Å²	136.5	82%	0.823	79%	0.792	S	S	*	*			cis	-170	150.3	-35.8	-155	-155.7	163.6	-154.1	-2.6	108.9
222	M	33.2	Very low	35.1	Very low	121 Å²	121	136.7 Å²	136.7	60%	0.596	79%	0.794	S	S	*	*			trans	70.8	131.9	160.5	-53.6	-107.8	66.6	0	0	121
223	S	33.4	Very low	35.6	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	79%	0.792	S	S	*	*				-175.7	175.1	121.6	35.3	0	0	0	0	110.4
224	N	29.9	Very low	36.3	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	79%	0.789	S	S	*	*			trans	-115.3	175.2	-157.7	-64.3	-46	0	0	0	115.6
225	A	31.3	Very low	35.3	Very low	94 Å²	94	135.2 Å²	135.2	78%	0.777	79%	0.79	S	S	*	*			trans	-76.1	-165.9	177.2	0	0	0	0	0	112.7
226	P	56.3	Low	35.8	Very low	107 Å²	107	137.2 Å²	137.2	70%	0.695	79%	0.79	S	S	*	*			cis	-140.8	-172.8	3.1	44.9	-26.2	0	0	0	116.1
227	F	33.4	Very low	36.3	Very low	194 Å²	194	136 Å²	136	85%	0.851	79%	0.791	S	S	*	*			trans	176.6	107.8	141	-91.2	-63.7	0	0	0	107.4
228	S	32.2	Very low	36.1	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	79%	0.792	S	S	*	*				84.8	133.1	89.1	-67.7	0	0	0	0	115.3
229	A	31.7	Very low	36	Very low	95 Å²	95	130.4 Å²	130.4	79%	0.785	79%	0.788	S	S	*	*			trans	-103.9	-155.6	-171.3	0	0	0	0	0	110.8
230	P	48.6	Very low	35.6	Very low	110 Å²	110	127.2 Å²	127.2	71%	0.714	78%	0.779	S	S	*	*			cis	-143.7	-159.9	8	39.9	-15.7	0	0	0	116.1
231	C	30.3	Very low	35.7	Very low	115 Å²	115	129 Å²	129	78%	0.777	78%	0.779	S	S	*	*			trans	76.3	145.8	159.2	-68.3	0	0	0	0	119
232	S	30	Very low	35.8	Very low	106 Å²	106	124 Å²	124	74%	0.741	78%	0.778	S	S	*	*			cis	-160.6	152.7	-12.6	-96.2	0	0	0	0	111
233	F	37.8	Very low	36.2	Very low	207 Å²	207	124.3 Å²	124.3	91%	0.908	79%	0.789	S	S	*	*			trans	-80.2	156.5	159	-70.3	-77.3	0	0	0	110.4
234	P	48.6	Very low	36.4	Very low	113 Å²	113	125.4 Å²	125.4	73%	0.734	79%	0.785	S	S	*	*				-149.5	151.9	110.8	35	-17.7	0	0	0	117.3
235	V	32.6	Very low	36.6	Very low	135 Å²	135	126.8 Å²	126.8	82%	0.818	79%	0.786	S	S	*	*			trans	70	124.4	138.5	172.2	0	0	0	0	120.9
236	L	40.2	Very low	36.6	Very low	165 Å²	165	129.6 Å²	129.6	86%	0.864	78%	0.783	S	S	*	*			trans	-88.5	153.1	154.1	-77.6	164.2	0	0	0	110.5
237	P	45.8	Very low	35.3	Very low	120 Å²	120	131.2 Å²	131.2	78%	0.779	80%	0.795	S	S	*	*			trans	-121.7	163.2	137.2	36.2	-30	0	0	0	112.9
238	S	30.1	Very low	35.5	Very low	120 Å²	120	126.6 Å²	126.6	84%	0.839	79%	0.787	S	S	*	*			trans	-90.3	166.6	-170.7	-56	0	0	0	0	114.4
239	A	29.1	Very low	36.3	Very low	86 Å²	86	126.9 Å²	126.9	71%	0.711	79%	0.787	S	S	*	*			trans	110.9	127	132.3	0	0	0	0	0	120.4
240	S	29.9	Very low	36.6	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	78%	0.778	S	S	*	*			trans	89	151	133.4	77.9	0	0	0	0	122.2
241	S	29.6	Very low	35.9	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	78%	0.778	S	S	*	*			trans	64.8	119.6	159.6	59.2	0	0	0	0	120.7
242	S	36.7	Very low	36.4	Very low	113 Å²	113	131.4 Å²	131.4	79%	0.79	78%	0.779	S	S	*	*			trans	-79.5	163.9	149.4	-38.6	0	0	0	0	110.6
243	P	43.4	Very low	36.6	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	77%	0.772	S	S	*	*			trans	-121.3	162.1	143.6	34.7	-26.4	0	0	0	113.3
244	L	36.3	Very low	36.5	Very low	139 Å²	139	130.2 Å²	130.2	73%	0.728	76%	0.763	S	S	*	*			trans	-110.6	141.6	179.8	-74.6	158.7	0	0	0	110.8
245	H	34.1	Very low	35.7	Very low	183 Å²	183	130.7 Å²	130.7	85%	0.847	76%	0.759	S	S	*	*			trans	-150.8	112.9	145.3	-81.4	-75.5	0	0	0	107.3
246	H	32	Very low	36	Very low	153 Å²	153	132.9 Å²	132.9	71%	0.708	76%	0.758	S	S	*	*				75.2	97.5	63.6	-73	-65.7	0	0	0	114.7
247	C	29.5	Very low	36.8	Very low	141 Å²	141	130.3 Å²	130.3	95%	0.953	75%	0.751	S	S	*	*				-163.9	160.5	115.8	-110.5	0	0	0	0	111.7
248	S	37	Very low	36.1	Very low	98 Å²	98	134.5 Å²	134.5	69%	0.685	76%	0.757	S	S	*	*			trans	-118.9	-166.2	-176.9	74.1	0	0	0	0	109.9
249	P	48.2	Very low	36.3	Very low	119 Å²	119	134.3 Å²	134.3	77%	0.773	76%	0.755	S	S	*	*			cis	-112.1	158.8	22.4	34.2	-18.2	0	0	0	114.1
250	N	38.2	Very low	37.3	Very low	113 Å²	113	135.3 Å²	135.3	60%	0.604	76%	0.755	S	S	*	*			cis	87.1	105.4	23.4	-159.3	34.6	0	0	0	115.4
251	V	35.4	Very low	37.3	Very low	119 Å²	119	136.2 Å²	136.2	72%	0.721	76%	0.756	S	S	*	*			trans	-144.4	98.5	170.8	175.6	0	0	0	0	108.2
252	F	39.7	Very low	37.4	Very low	182 Å²	182	136.5 Å²	136.5	80%	0.798	75%	0.753	S	S	*	*			trans	57.2	116.2	170.7	-51.4	-58.3	0	0	0	116.6
253	Q	34.3	Very low	37.1	Very low	126 Å²	126	140.3 Å²	140.3	59%	0.589	76%	0.755	S	S	*	*			cis	53.3	138.2	45.1	-63.9	-171.7	-107.8	0	0	113.1
254	F	35.3	Very low	36.6	Very low	163 Å²	163	140.9 Å²	140.9	72%	0.715	75%	0.751	S	S	*	*			cis	-161.5	173.6	6.8	-127.9	-158.4	0	0	0	107.3
255	D	31.8	Very low	36.5	Very low	122 Å²	122	137.8 Å²	137.8	65%	0.652	75%	0.746	S	S	*	*			cis	-152.5	-162.2	-1	-154.9	-9.9	0	0	0	111.2
256	K	39.8	Very low	36.5	Very low	182 Å²	182	134.3 Å²	134.3	79%	0.791	75%	0.749	S	S	*	*			trans	-97.6	171.3	-167.3	-95.1	172.9	177.5	171.8	0	116.9
257	P	57.1	Low	36.5	Very low	110 Å²	110	130.6 Å²	130.6	71%	0.714	75%	0.752	S	S	*	*			trans	-98.7	166.1	-165.5	39.2	-37.4	0	0	0	115.6
258	F	31.5	Very low	36.7	Very low	209 Å²	209	131.1 Å²	131.1	92%	0.917	75%	0.746	S	S	*	*			trans	-143.8	161.2	168.8	-80.7	-78.1	0	0	0	113.5
259	S	33.5	Very low	36.8	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	75%	0.75	S	S	*	*			trans	-160.4	165.9	175.3	-58.8	0	0	0	0	107.9
260	P	50.6	Low	36.4	Very low	108 Å²	108	136.1 Å²	136.1	70%	0.701	76%	0.757	S	S	*	*			cis	-130.1	-157.6	-17	29.1	-4.8	0	0	0	112.1
261	T	30.2	Very low	36.8	Very low	127 Å²	127	136.7 Å²	136.7	78%	0.779	77%	0.765	S	S	*	*			trans	75.4	153.7	165.3	76.3	0	0	0	0	116.9
262	V	30.7	Very low	37.6	Very low	117 Å²	117	136.2 Å²	136.2	71%	0.709	76%	0.764	S	S	*	*			cis	-160.5	139	-14.3	120.6	0	0	0	0	110.1
263	F	31.3	Very low	38.4	Very low	192 Å²	192	132.8 Å²	132.8	84%	0.842	76%	0.76	S	S	*	*			trans	56.7	165.4	171.4	-82.4	-117.3	0	0	0	115.8
264	D	32.2	Very low	39.5	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	77%	0.771	S	S	*	*			cis	-146.7	173.4	14.8	-162.3	10.3	0	0	0	112.8
265	A	33.8	Very low	40.5	Very low	75 Å²	75	132.6 Å²	132.6	62%	0.62	78%	0.776	S	S	*	*			trans	41.7	118.7	152.2	0	0	0	0	0	123.1
266	A	35	Very low	41.3	Very low	110 Å²	110	132.3 Å²	132.3	91%	0.909	78%	0.781	S	S	*	*			trans	60.4	128.1	139.4	0	0	0	0	0	121.8
267	G	31.8	Very low	41.8	Very low	75 Å²	75	129.7 Å²	129.7	77%	0.773	78%	0.783	S	S	*	*			trans	144.2	134.2	158.8	0	0	0	0	0	116
268	D	34.2	Very low	40.9	Very low	152 Å²	152	133.5 Å²	133.5	81%	0.813	79%	0.788	S	S	*	*			trans	32.4	106	155.9	-65.6	1	0	0	0	121.7
269	T	38.1	Very low	41.3	Very low	127 Å²	127	129.8 Å²	129.8	78%	0.779	79%	0.785	S	S	*	*			trans	-0.4	120.3	135.1	53.2	0	0	0	0	118
270	Q	39.3	Very low	41.3	Very low	194 Å²	194	130.6 Å²	130.6	91%	0.907	79%	0.785	S	S	*	*			trans	-121.7	120.8	152.4	-70.2	-164.8	3.6	0	0	111.3
271	T	46.3	Very low	40.5	Very low	126 Å²	126	133.9 Å²	133.9	77%	0.773	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-85.8	139.9	-177.9	-39.6	0	0	0	0	110.5
272	P	53.3	Low	40.8	Very low	108 Å²	108	134.7 Å²	134.7	70%	0.701	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.4	152.9	169.6	28	-35.3	0	0	0	111.6
273	P	56.5	Low	40.9	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.4	149.1	-176.4	27.1	-35.3	0	0	0	112.8
274	P	56.7	Low	40.9	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.1	144	-174.5	28.8	-35.4	0	0	0	113.2
275	L	56	Low	40.9	Very low	156 Å²	156	136.7 Å²	136.7	82%	0.817	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-81	155.1	171.2	-84.4	73.8	0	0	0	111
276	P	49.3	Very low	40.9	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-64.9	148.8	-177.5	26.2	-35.5	0	0	0	113.2
277	P	50.2	Low	40.8	Very low	126 Å²	126	140.8 Å²	140.8	82%	0.818	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.9	146.4	-176.8	29	-35.5	0	0	0	112.6
278	K	37.5	Very low	40.8	Very low	191 Å²	191	144.8 Å²	144.8	83%	0.83	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-85.3	138.3	168.6	-67.3	175.6	-179.4	172.7	0	109.6
279	P	40.8	Very low	40.8	Very low	131 Å²	131	141.4 Å²	141.4	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75.2	126.1	174.1	29.9	-33	0	0	0	111.1
280	T	34.2	Very low	40.4	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	82%	0.815	S	S	*	*			trans	-126.7	110.1	170	43.6	0	0	0	0	110.5
281	H	33.6	Very low	40.1	Very low	177 Å²	177	133.6 Å²	133.6	82%	0.819	80%	0.804	S	S	*	*			trans	-148.3	132.9	169.1	-121.5	-112.8	0	0	0	104.6
282	L	35.4	Very low	39.6	Very low	145 Å²	145	136.8 Å²	136.8	76%	0.759	81%	0.81	S	S	*	*			cis	-133.8	150.8	7.3	-55.5	117.8	0	0	0	109.8
283	S	33.1	Very low	38.8	Very low	125 Å²	125	143.4 Å²	143.4	87%	0.874	82%	0.821	S	S	*	*			trans	177.3	78.5	147.3	-81.7	0	0	0	0	111.6
284	E	32.7	Very low	38.9	Very low	199 Å²	199	143.4 Å²	143.4	93%	0.93	82%	0.821	S	S	*	*			trans	-157.8	100.7	155.7	-137.9	166.9	-142.9	0	0	111.8
285	L	31.1	Very low	37.7	Very low	167 Å²	167	146.4 Å²	146.4	87%	0.874	82%	0.821	S	S	*	*			trans	-156.6	89.2	157.1	-171.1	76	0	0	0	109.7
286	L	34.8	Very low	36.5	Very low	172 Å²	172	144 Å²	144	90%	0.901	81%	0.813	S	S	*	*			trans	-178.3	126.1	130.4	-96.7	165.2	0	0	0	108.6
287	S	32.6	Very low	35.6	Very low	99 Å²	99	147.9 Å²	147.9	69%	0.692	82%	0.818	S	S	*	*			trans	-100.3	166.2	-173.1	177.7	0	0	0	0	112.2
288	N	32	Very low	34.7	Very low	158 Å²	158	147.1 Å²	147.1	85%	0.845	82%	0.816	S	S	*	*			trans	100.4	140.7	164.6	-51.2	-10.7	0	0	0	115.2
289	G	33	Very low	35.1	Very low	81 Å²	81	143.4 Å²	143.4	84%	0.835	81%	0.811	S	S	*	*			cis	149.7	127.5	-7.1	0	0	0	0	0	113.2
290	G	30.4	Very low	34.8	Very low	74 Å²	74	145.2 Å²	145.2	76%	0.763	81%	0.809	S	S	*	*			trans	109.7	115.5	-174.2	0	0	0	0	0	111.1
291	A	32	Very low	34.5	Very low	84 Å²	84	146.5 Å²	146.5	69%	0.694	81%	0.805	S	S	*	*				74.6	136.1	68.9	0	0	0	0	0	112.1
292	H	35.8	Very low	34.7	Very low	193 Å²	193	147.1 Å²	147.1	89%	0.894	81%	0.806	S	S	*	*			cis	-137	-173.5	30.1	-70.9	-97.4	0	0	0	115.1
293	R	38.2	Very low	35.7	Very low	246 Å²	246	146.4 Å²	146.4	93%	0.928	81%	0.81	S	S	*	*			trans	-92.9	171.1	-173.3	-112.8	-168.2	156.9	-177.4	-5.1	114.1
294	P	57.2	Low	35.7	Very low	111 Å²	111	145.3 Å²	145.3	72%	0.721	81%	0.808	S	S	*	*			trans	-107.8	-178.6	-168.4	42.7	-37.8	0	0	0	115.1
295	K	32.8	Very low	35.7	Very low	192 Å²	192	141.2 Å²	141.2	84%	0.835	80%	0.801	S	S	*	*			trans	-162.9	132.4	153.3	-118.5	-178.2	179.2	-177.5	0	118.5
296	T	29.7	Very low	36.1	Very low	106 Å²	106	139.7 Å²	139.7	65%	0.65	80%	0.799	S	S	*	*			trans	40.8	112.9	138.6	52.3	0	0	0	0	125.3
297	F	30.4	Very low	36.8	Very low	198 Å²	198	137.5 Å²	137.5	87%	0.868	80%	0.795	S	S	*	*				51.1	125.4	113.4	-80.1	-79.2	0	0	0	125
298	S	31.5	Very low	36.9	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	79%	0.794	S	S	*	*			trans	89	169.2	133.2	85.7	0	0	0	0	119.2
299	P	46.8	Very low	37.1	Very low	114 Å²	114	138.3 Å²	138.3	74%	0.74	79%	0.794	S	S	*	*				-141.6	-169.1	-104.8	38.6	-15.3	0	0	0	117.8
300	Q	33.7	Very low	36.9	Very low	169 Å²	169	138.2 Å²	138.2	79%	0.79	78%	0.78	S	S	*	*			trans	102.4	144.9	142.5	-127.5	175.6	1.3	0	0	121.5
301	H	28.8	Very low	37.2	Very low	158 Å²	158	144.8 Å²	144.8	73%	0.731	78%	0.782	S	S	*	*			trans	89	156.1	165.5	-82.6	-85.2	0	0	0	123.2
302	F	37.6	Very low	37.5	Very low	190 Å²	190	151.2 Å²	151.2	83%	0.833	79%	0.788	S	S	*	*			trans	-119.6	174.1	-157.4	-81.2	-78.3	0	0	0	110.9
303	P	55.1	Low	37.3	Very low	130 Å²	130	147.8 Å²	147.8	84%	0.844	78%	0.781	S	S	*	*			cis	-136.4	-155.3	29.2	42.1	-20.9	0	0	0	116.2
304	A	34.7	Very low	37.1	Very low	101 Å²	101	140.5 Å²	140.5	84%	0.835	77%	0.768	S	S	*	*			trans	-151.7	167.3	-167.8	0	0	0	0	0	113.3
305	S	31.9	Very low	36.2	Very low	113 Å²	113	143.4 Å²	143.4	79%	0.79	78%	0.776	S	S	*	*			trans	-131.9	101.8	-179.5	58.1	0	0	0	0	114.3
306	V	39	Very low	36.2	Very low	136 Å²	136	140 Å²	140	82%	0.824	78%	0.777	S	S	*	*			trans	26.7	128.7	137.8	-174.1	0	0	0	0	118
307	P	50	Low	36.3	Very low	125 Å²	125	138.2 Å²	138.2	81%	0.812	78%	0.78	S	S	*	*			cis	-122.8	-137.3	39.4	24.1	1.8	0	0	0	113.4
308	A	33.9	Very low	36.5	Very low	81 Å²	81	136.4 Å²	136.4	67%	0.669	78%	0.778	S	S	*	*			cis	-160.4	-154.4	10.8	0	0	0	0	0	114.7
309	F	36.8	Very low	36.8	Very low	194 Å²	194	136.9 Å²	136.9	85%	0.851	77%	0.772	S	S	*	*			trans	-140.1	165.3	-165.8	-61.7	-60.4	0	0	0	111.5
310	S	29.4	Very low	36.5	Very low	78 Å²	78	138 Å²	138	55%	0.545	77%	0.767	S	S	.	*			cis	-162.3	156.2	-11.7	-109.5	0	0	0	0	111.5
311	R	36.1	Very low	36.7	Very low	213 Å²	213	138 Å²	138	80%	0.804	77%	0.765	S	S	*	*			trans	11.1	159.7	140.1	-68.5	167.2	-73	-147.3	-1	121.5
312	R	37.9	Very low	36.9	Very low	218 Å²	218	135.5 Å²	135.5	82%	0.823	76%	0.761	S	S	*	*			cis	176.1	176.3	-18.8	-163.3	-178.5	-172.6	-129.1	4.6	107.3
313	T	31.8	Very low	36.6	Very low	121 Å²	121	135.4 Å²	135.4	74%	0.742	77%	0.765	S	S	*	*			trans	79	166.7	163.2	72.3	0	0	0	0	118.1
314	S	33.3	Very low	35.4	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	76%	0.763	S	S	*	*				-177.1	143.1	-71.2	50.2	0	0	0	0	112.8
315	L	39	Very low	35.2	Very low	172 Å²	172	136.1 Å²	136.1	90%	0.901	77%	0.766	S	S	*	*			trans	66.7	161.4	179.5	-45.2	176.3	0	0	0	112.2
316	S	33.4	Very low	35.2	Very low	121 Å²	121	134.4 Å²	134.4	85%	0.846	76%	0.759	S	S	*	*			cis	-165	171.6	-9.2	33.4	0	0	0	0	106.5
317	G	30.6	Very low	34.9	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	75%	0.75	S	S	*	*			cis	159.5	-175.6	3.5	0	0	0	0	0	109.9
318	L	34.5	Very low	34.2	Very low	159 Å²	159	132.7 Å²	132.7	83%	0.832	75%	0.747	S	S	*	*			trans	71.3	115.4	165.8	-140.1	68.7	0	0	0	119
319	D	39.5	Very low	34.5	Very low	120 Å²	120	138.5 Å²	138.5	64%	0.642	75%	0.751	S	S	*	*			trans	47.7	149.1	133.8	-62.9	-38.1	0	0	0	123.6
320	H	40.6	Very low	34.7	Very low	137 Å²	137	136.5 Å²	136.5	63%	0.634	75%	0.749	S	S	*	*			cis	-163.3	161.8	10.9	-118.7	8.4	0	0	0	113.3
321	F	36.8	Very low	35.2	Very low	168 Å²	168	139.3 Å²	139.3	74%	0.737	76%	0.755	S	S	*	*			trans	67.2	113.8	150.6	-69.5	-51.1	0	0	0	126.8
322	T	33.9	Very low	35.2	Very low	107 Å²	107	138.6 Å²	138.6	66%	0.656	75%	0.752	S	S	*	*				101.5	113	122.8	-61.2	0	0	0	0	122.6
323	M	31.1	Very low	35.3	Very low	187 Å²	187	135.5 Å²	135.5	92%	0.921	75%	0.752	S	S	*	*			trans	36.9	129.1	151.7	-62.1	-167.6	-65.3	0	0	122.2
324	G	28.4	Very low	35.5	Very low	77 Å²	77	141.2 Å²	141.2	79%	0.794	76%	0.76	S	S	*	*			trans	-154.2	-13.1	-179.2	0	0	0	0	0	121.9
325	N	30.3	Very low	36.1	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	77%	0.769	S	S	*	*			trans	69.9	167.3	170.4	-158.9	20	0	0	0	119.3
326	A	33.8	Very low	36.3	Very low	77 Å²	77	147.4 Å²	147.4	64%	0.636	77%	0.765	S	S	*	*			trans	76.4	119.6	159.2	0	0	0	0	0	122.5
327	D	32.8	Very low	36.6	Very low	120 Å²	120	146.4 Å²	146.4	64%	0.642	76%	0.757	S	S	*	*			trans	16.9	137.1	151.7	-74.9	-88.3	0	0	0	121.6	R329	D327-R329 IonicContact OD1-CZ 3.46Å; D327-R329 IonicContact OD1-NE 3.47Å; D327-R329 PolarHBondContact OD1-NE 3.22Å; D327-R329 IonicContact OD1-NH2 3.22Å; D327-R329 PolarHBondContact OD1-NH2 3.19Å
328	S	34.9	Very low	37.2	Very low	106 Å²	106	150.2 Å²	150.2	74%	0.741	76%	0.76	S	S	*	*				-166.6	135.4	51.4	31.5	0	0	0	0	115.5
329	R	38.9	Very low	37.2	Very low	202 Å²	202	150 Å²	150	76%	0.762	76%	0.759	S	S	*	*				30.3	122.2	128.4	-50.6	172.7	-161.9	-157.1	-0.8	116.1	D327	D327-R329 IonicContact OD1-CZ 3.46Å; D327-R329 IonicContact OD1-NE 3.47Å; D327-R329 PolarHBondContact OD1-NE 3.22Å; D327-R329 IonicContact OD1-NH2 3.22Å; D327-R329 PolarHBondContact OD1-NH2 3.19Å
330	L	42.5	Very low	37.3	Very low	153 Å²	153	151.4 Å²	151.4	80%	0.801	77%	0.766	S	S	*	*				-157.4	179.6	61.1	-78.1	171.5	0	0	0	110.4
331	M	38.5	Very low	37.3	Very low	137 Å²	137	150.7 Å²	150.7	68%	0.675	77%	0.774	S	S	*	*			cis	-149.1	-140.8	7.4	-139.4	-59.2	156.3	0	0	110.8
332	R	37.6	Very low	37.1	Very low	198 Å²	198	148.4 Å²	148.4	75%	0.747	78%	0.778	S	S	*	*			trans	-75.8	162	177.2	-82.6	165.9	171.6	140.9	-3.2	114
333	N	39.4	Very low	37.2	Very low	153 Å²	153	150.9 Å²	150.9	82%	0.818	79%	0.786	S	S	*	*			cis	-146.3	156	7.6	-120.9	-21.3	0	0	0	111.5
334	R	36.7	Very low	37.1	Very low	241 Å²	241	149.2 Å²	149.2	91%	0.909	78%	0.781	S	S	*	*			trans	-113.6	151.5	-166.2	-153.4	179.9	-175.5	170.9	1.4	113.7
335	R	45.7	Very low	37.2	Very low	221 Å²	221	152.3 Å²	152.3	83%	0.834	78%	0.784	S	S	*	*			trans	-99.3	-175.6	168.6	-79.9	-176.6	160.7	-150.4	-2.3	111.1
336	Q	43.4	Very low	37.1	Very low	174 Å²	174	151.1 Å²	151.1	81%	0.813	78%	0.783	S	S	*	*			trans	77.8	120.7	165	-69	159.9	-16.4	0	0	113.8
337	S	39.1	Very low	37	Very low	99 Å²	99	159 Å²	159	69%	0.692	80%	0.796	S	S	*	*			cis	93.5	118.4	46.1	73.8	0	0	0	0	112.3
338	I	43.4	Very low	36.8	Very low	150 Å²	150	158.8 Å²	158.8	77%	0.769	80%	0.799	S	S	*	*			trans	-97.2	129.2	-175.2	-60.1	173.7	0	0	0	110.3	L340	I338-L340 HydrophobicContact CG2-CD1 3.74Å
339	N	34.6	Very low	36.7	Very low	153 Å²	153	162 Å²	162	82%	0.818	80%	0.802	S	S	*	*			trans	-126.9	139.8	152	-72.3	-82.9	0	0	0	106.4
340	L	40.2	Very low	36.2	Very low	150 Å²	150	156.3 Å²	156.3	79%	0.785	79%	0.794	S	S	*	*			trans	-114.5	138.7	170.8	-108.9	70.2	0	0	0	109.1	I338	I338-L340 HydrophobicContact CG2-CD1 3.74Å
341	P	42.1	Very low	35.8	Very low	123 Å²	123	158.9 Å²	158.9	80%	0.799	79%	0.794	S	S	*	*			trans	-82.5	149.4	171.8	34.2	-33.2	0	0	0	111.1
342	C	31.3	Very low	35.6	Very low	120 Å²	120	161.1 Å²	161.1	81%	0.811	80%	0.803	S	S	*	*			trans	-126.5	133.8	165.7	55.2	0	0	0	0	109
343	L	35.7	Very low	35.2	Very low	158 Å²	158	158.4 Å²	158.4	83%	0.827	80%	0.803	S	S	*	*			trans	-137.9	129.4	175.2	-76.6	176.2	0	0	0	110.7
344	N	30.4	Very low	35.1	Very low	153 Å²	153	158.1 Å²	158.1	82%	0.818	80%	0.801	S	S	*	*			trans	11.9	125	157.9	-53.7	-5	0	0	0	119.3
345	T	29.5	Very low	35.9	Very low	142 Å²	142	152 Å²	152	87%	0.871	80%	0.796	S	S	*	*			trans	-120.8	109.4	150.8	42.6	0	0	0	0	110.6
346	V	29.8	Very low	35.9	Very low	144 Å²	144	152.3 Å²	152.3	87%	0.873	80%	0.799	S	S	*	*			trans	-136.5	115.7	160.6	175	0	0	0	0	106.9
347	R	30.9	Very low	36.6	Very low	243 Å²	243	149.5 Å²	149.5	92%	0.917	79%	0.793	S	S	*	*			trans	-152.3	144.7	157.9	-161.9	168.9	177	151.9	2.3	111.2
348	V	28.5	Very low	36.9	Very low	115 Å²	115	150.4 Å²	150.4	70%	0.697	80%	0.797	S	S	*	*			trans	-78.3	167.9	175.8	174.3	0	0	0	0	110.8
349	Q	31.6	Very low	37.1	Very low	173 Å²	173	151.7 Å²	151.7	81%	0.808	80%	0.801	S	S	*	*			trans	-33.2	152.8	164.9	-57.6	156.4	-23.9	0	0	113
350	S	29.5	Very low	37.6	Very low	83 Å²	83	148.9 Å²	148.9	58%	0.58	80%	0.8	S	S	*	*			cis	-178.8	170.3	50	-158.9	0	0	0	0	113.3
351	Y	33.6	Very low	37.3	Very low	207 Å²	207	147.5 Å²	147.5	81%	0.812	80%	0.802	S	S	*	*			trans	67.2	123	158.9	-59.1	-60.1	0	0	0	122.8
352	Q	35.1	Very low	37.5	Very low	183 Å²	183	147.3 Å²	147.3	86%	0.855	80%	0.801	S	S	*	*			trans	61.1	149.6	150.5	-70.1	-179.4	-22.5	0	0	119.1
353	D	29.5	Very low	37.8	Very low	142 Å²	142	147.3 Å²	147.3	76%	0.759	80%	0.803	S	S	*	*			cis	-138.8	175.6	4.9	-156.3	12.2	0	0	0	112.5
354	D	37.2	Very low	38.2	Very low	146 Å²	146	145.9 Å²	145.9	78%	0.781	80%	0.803	S	S	*	*			trans	-65.4	145.5	-168.4	-81.8	-40.7	0	0	0	117.5
355	S	52.5	Low	38.6	Very low	113 Å²	113	143.6 Å²	143.6	79%	0.79	80%	0.799	S	S	*	*				153	71	127.5	-69.1	0	0	0	0	116.1
356	Y	47.2	Very low	39	Very low	228 Å²	228	144.7 Å²	144.7	89%	0.894	80%	0.798	S	S	*	*			trans	-158	139.6	147.9	-147.3	-104.8	0	0	0	112.9
357	V	56.8	Low	39.7	Very low	114 Å²	114	144 Å²	144	69%	0.691	80%	0.797	S	S	*	*			trans	-107.2	118.9	-176.2	-179.2	0	0	0	0	111.1
358	P	45.5	Very low	39.8	Very low	119 Å²	119	137.2 Å²	137.2	77%	0.773	79%	0.787	S	S	*	*			trans	-86.1	119.5	171.3	32.4	-30.5	0	0	0	111.2
359	M	48	Very low	40.3	Very low	176 Å²	176	137.3 Å²	137.3	87%	0.867	79%	0.788	S	S	*	*			trans	-81.9	137.7	172.2	-72.1	-67.1	-71.8	0	0	111.2
360	A	45.5	Very low	40.5	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	79%	0.789	S	S	*	*			trans	-116.5	147.9	177.5	0	0	0	0	0	112
361	S	32.5	Very low	40.8	Very low	120 Å²	120	136.8 Å²	136.8	84%	0.839	79%	0.793	S	S	*	*			trans	-159.4	156.9	171.3	44.1	0	0	0	0	110.2
362	P	46	Very low	41	Very low	120 Å²	120	134.1 Å²	134.1	78%	0.779	79%	0.793	S	S	*	*				-123.8	174.7	-129	42.8	-34.5	0	0	0	117
363	S	39.1	Very low	41.4	Very low	120 Å²	120	130.6 Å²	130.6	84%	0.839	79%	0.788	S	S	*	*			trans	-68.1	150.1	161.4	-44.8	0	0	0	0	112.4
364	P	44.7	Very low	42.5	Very low	127 Å²	127	133.9 Å²	133.9	83%	0.825	79%	0.792	S	S	*	*			trans	-140.8	170.7	140.2	38.1	-24.6	0	0	0	114.3
365	S	38	Very low	43.3	Very low	106 Å²	106	133.7 Å²	133.7	74%	0.741	79%	0.789	S	S	*	*			trans	-111.4	147.8	172.1	54.8	0	0	0	0	111.6
366	L	36.7	Very low	43.2	Very low	164 Å²	164	133.5 Å²	133.5	86%	0.859	79%	0.785	S	S	*	*			trans	39.8	127.6	162.5	-74.8	170.2	0	0	0	119.2
367	P	46	Very low	42.9	Very low	129 Å²	129	130.9 Å²	130.9	84%	0.838	78%	0.783	S	S	*	*				-139.3	-168.7	113.1	40.6	-30	0	0	0	114.7
368	S	32.9	Very low	42.3	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	79%	0.786	S	S	*	*			trans	-81.6	157.9	-172.1	-176.1	0	0	0	0	115.2
369	V	39.3	Very low	42	Very low	117 Å²	117	131.4 Å²	131.4	71%	0.709	79%	0.792	S	S	*	*			trans	12.3	112.7	151.2	-177.3	0	0	0	0	117.7
370	E	35.6	Very low	41.4	Very low	180 Å²	180	134.4 Å²	134.4	84%	0.841	79%	0.793	S	S	*	*				-159	156.8	99.5	-159.7	61.8	-104.7	0	0	107.3
371	G	36.2	Very low	40.8	Very low	64 Å²	64	137.2 Å²	137.2	66%	0.66	80%	0.801	S	S	*	*			trans	-102.1	148	-169.6	0	0	0	0	0	115.7
372	D	37.2	Very low	40.9	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	80%	0.798	S	S	*	*				-154.9	145.8	121.7	-143.3	-19.2	0	0	0	114.6
373	S	42.3	Very low	40.2	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	80%	0.8	S	S	*	*			trans	6.4	102.8	159.6	-58.7	0	0	0	0	121.2
374	Y	53.7	Low	39.8	Very low	211 Å²	211	140.8 Å²	140.8	83%	0.827	80%	0.803	S	S	*	*			trans	-146.7	132.3	144.9	-161.8	-98.9	0	0	0	112.3
375	I	54.7	Low	39.2	Very low	141 Å²	141	142.8 Å²	142.8	72%	0.723	81%	0.806	S	S	*	*			trans	-120.4	110.8	-177.3	-58.3	177.5	0	0	0	110.3	M377	I375-M377 PolarHBondContact O-N 3.13Å
376	P	48.8	Very low	38.7	Very low	109 Å²	109	143.2 Å²	143.2	71%	0.708	81%	0.809	S	S	*	*			trans	-79.2	109.3	173.9	30.5	-32.3	0	0	0	111.4	S378	P376-S378 PolarHBondContact O-N 2.77Å
377	M	41.8	Very low	38.5	Very low	174 Å²	174	141.8 Å²	141.8	86%	0.857	81%	0.807	S	S	*	*			trans	-72.9	119.7	176	-77.5	-76.9	-80.8	0	0	111.9	I375	I375-M377 PolarHBondContact O-N 3.13Å
378	S	43.8	Very low	37.9	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	81%	0.806	S	S	*	*			trans	-157	124.8	165.9	-82.6	0	0	0	0	111.2	P376 R380	P376-S378 PolarHBondContact O-N 2.77Å; S378-R380 PolarHBondContact O-N 3.05Å
379	P	38.5	Very low	38	Very low	136 Å²	136	143.8 Å²	143.8	88%	0.883	81%	0.812	S	S	*	*			trans	-79.1	118.7	-172.5	30.2	-33.9	0	0	0	112.1
380	R	36.6	Very low	37.5	Very low	239 Å²	239	150 Å²	150	90%	0.902	82%	0.823	S	S	*	*			trans	-133.1	127.5	159.7	-75.7	-170.6	170.5	-176.3	-1.9	109.8	S378 S382	S378-R380 PolarHBondContact O-N 3.05Å; R380-S382 PolarHBondContact O-N 2.88Å
381	T	33.4	Very low	37.4	Very low	154 Å²	154	145.8 Å²	145.8	95%	0.945	82%	0.819	S	S	*	*			trans	-69.4	106.6	176.1	49.3	0	0	0	0	109.9
382	S	34.7	Very low	37.3	Very low	112 Å²	112	151.6 Å²	151.6	78%	0.783	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-91.6	153.5	177.9	47.1	0	0	0	0	112.5	R380	R380-S382 PolarHBondContact O-N 2.88Å
383	S	30.3	Very low	37.2	Very low	116 Å²	116	149.6 Å²	149.6	81%	0.811	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-71	152	173.4	-54.5	0	0	0	0	111.9	L385	S383-L385 PolarHBondContact O-N 2.86Å
384	F	31.3	Very low	36.5	Very low	207 Å²	207	148.4 Å²	148.4	91%	0.908	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-63.1	125.5	170.1	-60.9	-95.4	0	0	0	111.9
385	L	32.5	Very low	35.3	Very low	169 Å²	169	144 Å²	144	89%	0.885	82%	0.824	S	S	*	*			trans	-155.6	131.3	136.4	-85.7	-165.8	0	0	0	110	S383	S383-L385 PolarHBondContact O-N 2.86Å
386	S	27.6	Very low	34.1	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	83%	0.826	S	S	*	*			trans	-169	154.2	173	-73.5	0	0	0	0	106.3
387	T	31.7	Very low	33.3	Very low	133 Å²	133	145.6 Å²	145.6	82%	0.816	84%	0.836	S	S	*	*			cis	-138.9	162.7	27.2	47	0	0	0	0	114.7
388	N	34	Very low	32.7	Very low	153 Å²	153	142.3 Å²	142.3	82%	0.818	83%	0.83	S	S	*	*			trans	-73.4	163.5	-178.7	-48	-28.5	0	0	0	115.6
389	S	33.3	Very low	32.8	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	83%	0.827	S	S	*	*			trans	165.8	154.8	132.4	42.4	0	0	0	0	110.7
390	R	29	Very low	32.4	Very low	246 Å²	246	142.2 Å²	142.2	93%	0.928	82%	0.824	S	S	*	*			cis	-157.1	169.7	-18.8	172.8	168.3	175.6	160.5	-0.8	107.3
391	A	34.4	Very low	32.2	Very low	93 Å²	93	138.5 Å²	138.5	77%	0.769	82%	0.819	S	S	*	*			trans	-71.8	177.4	-172.7	0	0	0	0	0	116.9
392	E	34.1	Very low	32	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	81%	0.812	S	S	*	*			trans	-51.2	168.6	-176.6	-44.3	175.7	150.4	0	0	115.4
393	S	34	Very low	31.9	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	82%	0.815	S	S	*	*			cis	-159.5	-178.2	18.3	-153.8	0	0	0	0	113.7
394	A	28	Very low	32.6	Very low	85 Å²	85	140.2 Å²	140.2	70%	0.702	81%	0.813	S	S	*	*			trans	76.9	110.2	162.7	0	0	0	0	0	121.7
395	S	28.6	Very low	32.7	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	81%	0.805	S	S	*	*			trans	59.1	124.9	132.2	-59.7	0	0	0	0	124.1
396	S	29.2	Very low	32.8	Very low	111 Å²	111	134.7 Å²	134.7	78%	0.776	81%	0.805	S	S	*	*			trans	106.2	133.5	137.9	82.5	0	0	0	0	120.4
397	L	31.5	Very low	33.7	Very low	173 Å²	173	136.8 Å²	136.8	91%	0.906	81%	0.805	S	S	*	*			trans	69.8	158.2	160.6	-58.5	176.7	0	0	0	120.1
398	S	29.5	Very low	34.3	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	80%	0.798	S	S	*	*			trans	-124.8	-175.3	-165.9	64.9	0	0	0	0	109.9
399	P	46.2	Very low	35.2	Very low	108 Å²	108	132.7 Å²	132.7	70%	0.701	80%	0.796	S	S	*	*			cis	-137.9	-175.6	-13.3	33.8	-12.5	0	0	0	115.2
400	V	30	Very low	35.8	Very low	133 Å²	133	132.2 Å²	132.2	81%	0.806	79%	0.79	S	S	*	*			trans	85.3	136.5	138	138.1	0	0	0	0	123.1
401	M	32	Very low	37	Very low	162 Å²	162	125.9 Å²	125.9	80%	0.798	78%	0.78	S	S	*	*			trans	61.1	106.9	160.5	-76.9	-74	165.9	0	0	122.2
402	C	29.5	Very low	37.9	Very low	118 Å²	118	127 Å²	127	80%	0.797	78%	0.778	S	S	*	*				170.6	149.7	100.5	-96.6	0	0	0	0	113.7
403	Q	33.9	Very low	38.9	Very low	184 Å²	184	126.1 Å²	126.1	86%	0.86	77%	0.773	S	S	*	*			trans	-163.4	167.3	173.6	-86.9	-145.4	23.8	0	0	109.9
404	P	44.7	Very low	40.2	Very low	116 Å²	116	130.9 Å²	130.9	75%	0.753	77%	0.774	S	S	*	*			cis	-128.4	-174	-27.4	35.4	-18.1	0	0	0	112
405	G	32.8	Very low	41.6	Very low	72 Å²	72	135 Å²	135	74%	0.742	78%	0.779	S	S	*	*			trans	-149.3	103.5	170.6	0	0	0	0	0	112.9
406	E	35.4	Very low	42.6	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	78%	0.783	S	S	*	*			trans	-107.9	125.4	-177.2	-173.6	-179	173.5	0	0	110.9
407	I	46.3	Very low	44	Very low	159 Å²	159	140.7 Å²	140.7	82%	0.815	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-97.8	120	176.1	-82.4	61.8	0	0	0	109.2
408	A	44.1	Very low	44.7	Very low	81 Å²	81	138.2 Å²	138.2	67%	0.669	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-84.4	149.7	178.5	0	0	0	0	0	113
409	P	51.7	Low	45.6	Very low	119 Å²	119	144.4 Å²	144.4	77%	0.773	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.2	157.1	175.7	30.2	-35.3	0	0	0	113
410	P	47.1	Very low	45.7	Very low	111 Å²	111	146.7 Å²	146.7	72%	0.721	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-71.2	153	-167.5	27.3	-35.9	0	0	0	115	V412	P410-V412 PolarHBondContact O-N 2.86Å
411	P	53.9	Low	46.8	Very low	112 Å²	112	151.7 Å²	151.7	73%	0.727	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.6	122.2	-171.6	29	-35.3	0	0	0	113.7
412	V	54	Low	47.7	Very low	118 Å²	118	155.2 Å²	155.2	72%	0.715	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-91.8	117.3	173.3	-177	0	0	0	0	110.2	P410 R414	P410-V412 PolarHBondContact O-N 2.86Å; V412-R414 HydrophobicContact CB-CG 4.33Å; V412-R414 HydrophobicContact CG1-CG 3.86Å; V412-R414 PolarHBondContact O-N 2.87Å
413	H	55.2	Low	48.9	Very low	166 Å²	166	155.9 Å²	155.9	77%	0.769	80%	0.798	S	S	*	*			trans	-73.3	75.3	-178.2	-68	-80.8	0	0	0	113.9	H415	H413-H415 PolarHBondContact O-N 2.91Å
414	R	59.6	Low	50.2	Low	210 Å²	210	158 Å²	158	79%	0.792	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	26.9	-175.7	-57.9	178.8	87.4	172	7.2	115.2	V412	V412-R414 HydrophobicContact CB-CG 4.33Å; V412-R414 HydrophobicContact CG1-CG 3.86Å; V412-R414 PolarHBondContact O-N 2.87Å
415	H	57.6	Low	50.9	Low	171 Å²	171	157.5 Å²	157.5	79%	0.792	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	-1.7	-166.8	-65.5	-60.3	0	0	0	116.9	H413 K417	H413-H415 PolarHBondContact O-N 2.91Å; H415-K417 PolarHBondContact O-N 3.48Å
416	L	49.9	Very low	52.4	Low	174 Å²	174	159.4 Å²	159.4	91%	0.911	79%	0.794	S	S	*	*			trans	-77.7	88.1	171.5	-64	-176.5	0	0	0	111.5
417	K	59.5	Low	53.8	Low	174 Å²	174	156.4 Å²	156.4	76%	0.757	79%	0.791	S	S	*	*			trans	-113.9	121.5	164.3	-73.2	179.5	179.5	172.9	0	109.3	H415 R419	H415-K417 PolarHBondContact O-N 3.48Å; K417-R419 PolarHBondContact O-N 3.04Å
418	P	45.7	Very low	54.7	Low	121 Å²	121	156.1 Å²	156.1	79%	0.786	79%	0.79	S	S	*	*			trans	-64.9	110.4	176.4	26	-33	0	0	0	110.1	L420	P418-L420 VanDerWaalsContact C-N 3.26Å; P418-L420 PolarHBondContact O-N 2.66Å
419	R	48.8	Very low	55.5	Low	236 Å²	236	158 Å²	158	89%	0.891	79%	0.789	S	S	*	*			trans	-77.1	75.5	177.9	-72.6	-127.4	-172.8	169.5	4.3	110.8	K417 R421	K417-R419 PolarHBondContact O-N 3.04Å; R419-R421 VanDerWaalsContact C-N 3.25Å; R419-R421 PolarHBondContact O-N 2.82Å
420	L	47.1	Very low	56.1	Low	155 Å²	155	158 Å²	158	81%	0.812	78%	0.782	S	S	*	*			trans	-63.6	86.1	167.1	-73.8	173.9	0	0	0	110.2	P418 R422	P418-L420 VanDerWaalsContact C-N 3.26Å; P418-L420 PolarHBondContact O-N 2.66Å; L420-R422 PolarHBondContact O-N 3.48Å
421	R	53.7	Low	56.6	Low	238 Å²	238	163 Å²	163	90%	0.898	79%	0.786	S	S	*	*			trans	-64.6	84.5	164.5	-81.7	-179.4	164.8	155.2	-6.3	108.7	R419 V423	R419-R421 VanDerWaalsContact C-N 3.25Å; R419-R421 PolarHBondContact O-N 2.82Å; R421-V423 PolarHBondContact O-N 2.96Å
422	R	50.6	Low	56.6	Low	236 Å²	236	161 Å²	161	89%	0.891	79%	0.786	S	S	*	*			trans	-65.4	103.8	159.8	-77.5	-171.1	179.1	177.5	0.1	107.7	L420 R424	L420-R422 PolarHBondContact O-N 3.48Å; R422-R424 PolarHBondContact O-N 3.2Å
423	V	54.9	Low	56.6	Low	133 Å²	133	161.6 Å²	161.6	81%	0.806	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-56.4	129	161.6	179.8	0	0	0	0	106.9	R421	R421-V423 PolarHBondContact O-N 2.96Å
424	R	62	Low	56.3	Low	229 Å²	229	158.9 Å²	158.9	86%	0.864	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-74.3	129	177.6	-166.3	176.1	-171.7	165.1	-1.2	107	R422	R422-R424 PolarHBondContact O-N 3.2Å
425	P	59.8	Low	55.9	Low	105 Å²	105	155 Å²	155	68%	0.682	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.2	148.5	172.6	27.1	-34	0	0	0	109.3
426	P	63.8	Low	55.4	Low	111 Å²	111	154.5 Å²	154.5	72%	0.721	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-59.4	152.8	173.1	26.9	-34.3	0	0	0	110.4
427	P	63.9	Low	55.4	Low	126 Å²	126	151 Å²	151	82%	0.818	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61.9	143.7	173.8	28.3	-34.3	0	0	0	110.2	D429	P427-D429 PolarHBondContact O-N 3.4Å
428	L	65.1	Low	54.7	Low	153 Å²	153	151.6 Å²	151.6	80%	0.801	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-70	126.9	168.1	-74.5	88.2	0	0	0	108.6
429	D	61.1	Low	54.5	Low	119 Å²	119	153.9 Å²	153.9	64%	0.636	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-75.1	128.2	166.3	-170.1	-3.9	0	0	0	109.1	P427 R431	P427-D429 PolarHBondContact O-N 3.4Å; D429-R431 WeakPolarHBondContact OD1-CB 3.49Å; D429-R431 VanDerWaalsContact OD1-CG 3.26Å; D429-R431 WeakPolarHBondContact OD1-CG 3.03Å; D429-R431 PolarHBondContact OD1-N 3.33Å
430	L	64.6	Low	54.3	Low	120 Å²	120	148.1 Å²	148.1	63%	0.628	77%	0.768	S	S	*	*			trans	-106	9.7	-179.6	-62.4	-179.9	0	0	0	112.9	G432 L433	L430-G432 PolarHBondContact O-N 2.87Å; L430-L433 HydrophobicContact CD2-CD1 4.44Å; L430-L433 PolarHBondContact O-N 3.35Å
431	R	58.6	Low	54.1	Low	215 Å²	215	146 Å²	146	81%	0.811	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-13	173	-81.7	177.3	172.8	-111.7	0.9	115.2	D429	D429-R431 WeakPolarHBondContact OD1-CB 3.49Å; D429-R431 VanDerWaalsContact OD1-CG 3.26Å; D429-R431 WeakPolarHBondContact OD1-CG 3.03Å; D429-R431 PolarHBondContact OD1-N 3.33Å
432	G	54.1	Low	53.6	Low	70 Å²	70	143.4 Å²	143.4	72%	0.722	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-1.1	-179.1	0	0	0	0	0	116.7	L430	L430-G432 PolarHBondContact O-N 2.87Å
433	L	52.9	Low	53.1	Low	132 Å²	132	138.6 Å²	138.6	69%	0.691	75%	0.75	S	S	*	*			trans	-108.7	13.9	-174.4	-63	-179.9	0	0	0	114.7	L430 T435	L430-L433 HydrophobicContact CD2-CD1 4.44Å; L430-L433 PolarHBondContact O-N 3.35Å; L433-T435 PolarHBondContact O-N 3.09Å
434	S	49.1	Very low	52.4	Low	108 Å²	108	137.9 Å²	137.9	76%	0.755	75%	0.748	S	S	*	*			trans	-80.1	50.6	-179.9	-59.3	0	0	0	0	113.8
435	T	50.6	Low	51.1	Low	130 Å²	130	134.1 Å²	134.1	80%	0.798	74%	0.744	S	S	*	*			trans	-136.4	48.8	173.3	63.8	0	0	0	0	112.3	L433	L433-T435 PolarHBondContact O-N 3.09Å
436	I	46.8	Very low	50	Low	159 Å²	159	134.5 Å²	134.5	82%	0.815	75%	0.748	S	S	*	*	S	Bend	trans	-116.6	112.2	155.3	-60.1	179.4	0	0	0	105.9	E438	I436-E438 PolarHBondContact O-N 3.41Å
437	T	50.5	Low	48.8	Very low	101 Å²	101	140.3 Å²	140.3	62%	0.62	76%	0.756	S	S	*	*			trans	-69.2	126.7	-177.7	46.6	0	0	0	0	111	F439	T437-F439 PolarHBondContact O-N 3.4Å; T437-F439 VanDerWaalsContact OG1-CE2 3.24Å; T437-F439 WeakPolarHBondContact OG1-CE2 3.33Å
438	E	44.7	Very low	47.4	Very low	186 Å²	186	140.7 Å²	140.7	87%	0.869	76%	0.755	S	S	*	*			trans	-63.2	116.7	170.4	-65	168.3	-162.9	0	0	109.8	I436 P440	I436-E438 PolarHBondContact O-N 3.41Å; E438-P440 WeakPolarHBondContact O-CD 3.45Å
439	F	41.7	Very low	46	Very low	170 Å²	170	140.4 Å²	140.4	75%	0.746	75%	0.751	S	S	*	*			trans	-111	99.7	172.5	-85.1	-74.2	0	0	0	110	T437 T441	T437-F439 PolarHBondContact O-N 3.4Å; T437-F439 VanDerWaalsContact OG1-CE2 3.24Å; T437-F439 WeakPolarHBondContact OG1-CE2 3.33Å; F439-T441 PolarHBondContact O-N 3.31Å
440	P	45.5	Very low	44.8	Very low	114 Å²	114	141.2 Å²	141.2	74%	0.74	76%	0.761	S	S	*	*			trans	-82.8	98.5	174.5	30.1	-29.4	0	0	0	110.5	E438	E438-P440 WeakPolarHBondContact O-CD 3.45Å
441	T	42	Very low	43.4	Very low	111 Å²	111	142.3 Å²	142.3	68%	0.681	77%	0.767	S	S	*	*			trans	-116.5	84.8	171.4	55.2	0	0	0	0	111.2	F439 I443	F439-T441 PolarHBondContact O-N 3.31Å; T441-I443 PolarHBondContact O-N 2.83Å
442	H	43.9	Very low	41.9	Very low	184 Å²	184	137.1 Å²	137.1	85%	0.852	76%	0.764	S	S	*	*			trans	-70.8	114.6	160.5	-72.6	-100.3	0	0	0	108.7
443	I	40.5	Very low	40.8	Very low	135 Å²	135	138.3 Å²	138.3	69%	0.692	76%	0.76	S	S	*	*			trans	-131.5	109.1	169.8	-58.9	179.8	0	0	0	107.9	T441 L445	T441-I443 PolarHBondContact O-N 2.83Å; I443-L445 PolarHBondContact O-N 3.43Å
444	P	38.8	Very low	40	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	77%	0.768	S	S	*	*			trans	-75.8	122.1	172.7	30.7	-31.5	0	0	0	109.3
445	L	34.8	Very low	39.6	Very low	150 Å²	150	141.5 Å²	141.5	79%	0.785	77%	0.767	S	S	*	*			trans	-105.4	86.4	-175.6	-148	167.2	0	0	0	110.4	I443 R447	I443-L445 PolarHBondContact O-N 3.43Å; L445-R447 PolarHBondContact O-N 3.09Å
446	C	37	Very low	38.8	Very low	113 Å²	113	142.6 Å²	142.6	76%	0.764	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-59.8	123.1	174.7	-58.7	0	0	0	0	110.6
447	R	39.4	Very low	38.1	Very low	234 Å²	234	140.9 Å²	140.9	88%	0.883	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-90.5	122.1	164.6	-87.2	-171.7	169.4	-175	-3.1	109.8	L445	L445-R447 PolarHBondContact O-N 3.09Å
448	V	32.7	Very low	37.2	Very low	133 Å²	133	144.2 Å²	144.2	81%	0.806	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-73.8	144.1	173.9	178.2	0	0	0	0	109.5
449	M	36.5	Very low	36.7	Very low	147 Å²	147	143.2 Å²	143.2	72%	0.724	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.7	146.4	176.3	-59	-99.2	61	0	0	111
450	T	37.1	Very low	36.4	Very low	136 Å²	136	141 Å²	141	83%	0.834	78%	0.775	S	S	*	*			trans	-141.6	101.8	167.8	54	0	0	0	0	109.4
451	D	33.8	Very low	35.6	Very low	143 Å²	143	143.7 Å²	143.7	77%	0.765	78%	0.782	S	S	*	*			trans	-101.6	134.2	179.9	-73.1	-58.8	0	0	0	112.7
452	S	27.2	Very low	35.2	Very low	107 Å²	107	145.2 Å²	145.2	75%	0.748	79%	0.786	S	S	*	*			trans	-171.3	120	155.8	52.2	0	0	0	0	107.8
453	C	31.6	Very low	34.5	Very low	95 Å²	95	146.5 Å²	146.5	64%	0.642	78%	0.784	S	S	*	*				65.4	119.2	64.6	-65	0	0	0	0	112.3
454	F	35.1	Very low	34	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.842	79%	0.791	S	S	*	*			cis	-137.3	-140	-0.1	-69.1	-80.5	0	0	0	111.7
455	P	42.3	Very low	33.6	Very low	115 Å²	115	151.3 Å²	151.3	75%	0.747	79%	0.787	S	S	*	*				-127.2	169.2	-118.2	39.8	-20.4	0	0	0	115.9
456	L	32.8	Very low	33.3	Very low	152 Å²	152	152.2 Å²	152.2	80%	0.796	79%	0.787	S	S	*	*			trans	-159	124.1	146.5	-117.8	163.6	0	0	0	112.2
457	T	32.7	Very low	33	Very low	124 Å²	124	154.1 Å²	154.1	76%	0.761	79%	0.789	S	S	*	*			trans	-81	132.5	176	46.6	0	0	0	0	111.5
458	H	31.9	Very low	32.5	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.787	79%	0.787	S	S	*	*			trans	-128.6	114.3	161.7	-79.9	-79.1	0	0	0	110.6
459	L	33.9	Very low	32.3	Very low	165 Å²	165	150.2 Å²	150.2	86%	0.864	79%	0.794	S	S	*	*			trans	-76.5	137.8	172.2	-71	162.4	0	0	0	110.1	L461	L459-L461 PolarHBondContact O-N 3.37Å
460	P	35.9	Very low	32.2	Very low	123 Å²	123	148 Å²	148	80%	0.799	79%	0.793	S	S	*	*			trans	-75.6	116.5	158	31	-29.3	0	0	0	108.8	D462	P460-D462 PolarHBondContact O-N 2.86Å
461	L	27.8	Very low	31.8	Very low	172 Å²	172	146.4 Å²	146.4	90%	0.901	79%	0.788	S	S	*	*			trans	-80	108.8	172.6	179.7	61.1	0	0	0	109.6	L459	L459-L461 PolarHBondContact O-N 3.37Å
462	D	32.9	Very low	31.8	Very low	143 Å²	143	145 Å²	145	77%	0.765	78%	0.784	S	S	*	*			trans	-72.6	149	173.5	-166.7	8.3	0	0	0	111.3	P460	P460-D462 PolarHBondContact O-N 2.86Å
463	R	30.4	Very low	32	Very low	210 Å²	210	146.9 Å²	146.9	79%	0.792	79%	0.786	S	S	*	*			trans	-114.5	84.5	-174.8	-175.7	-163.5	155.1	-172	-7.3	110.5
464	R	30	Very low	32.3	Very low	227 Å²	227	150.4 Å²	150.4	86%	0.857	79%	0.793	S	S	*	*			trans	-101.5	113.6	167.4	-170.3	169.3	-176.5	168.3	1.4	111.1
465	L	29.8	Very low	32.2	Very low	126 Å²	126	146.7 Å²	146.7	66%	0.66	79%	0.786	S	S	*	*			trans	-76.1	140.2	153.9	-82.7	72.2	0	0	0	107.5
466	E	28.2	Very low	31.8	Very low	169 Å²	169	146.8 Å²	146.8	79%	0.79	78%	0.784	S	S	*	*				-169.3	167	108.1	-139.7	172.3	-172	0	0	112.4
467	N	30.8	Very low	31.8	Very low	153 Å²	153	146.2 Å²	146.2	82%	0.818	78%	0.782	S	S	*	*			trans	87.2	123.6	164.6	-58.2	-12.4	0	0	0	118.8
468	G	28.6	Very low	31.5	Very low	80 Å²	80	145.7 Å²	145.7	83%	0.825	78%	0.782	S	S	*	*			trans	145.9	60	170.3	0	0	0	0	0	115.5
469	E	28.8	Very low	31.3	Very low	206 Å²	206	143 Å²	143	96%	0.963	78%	0.783	S	S	*	*			trans	-87.2	106.1	171.5	-72.7	-167.6	132.5	0	0	112.4
470	S	34.4	Very low	30.9	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	78%	0.777	S	S	*	*			trans	-165.9	97.7	157.7	60.8	0	0	0	0	108.1
471	S	28.8	Very low	30.8	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	78%	0.778	S	S	*	*				87.6	144.7	86.4	69.6	0	0	0	0	114.2
472	T	34	Very low	31	Very low	114 Å²	114	138.9 Å²	138.9	70%	0.699	76%	0.763	S	S	*	*			trans	63.7	97.9	169.3	42.1	0	0	0	0	119.6
473	D	31.4	Very low	30.7	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	77%	0.768	S	S	*	*				65.9	161.8	113.9	-52.2	-15.6	0	0	0	123.5
474	E	36.9	Very low	30.9	Very low	169 Å²	169	138.1 Å²	138.1	79%	0.79	76%	0.761	S	S	*	*			trans	64	117.3	172.8	-56.6	-70.5	81.7	0	0	116.7
475	V	33.4	Very low	30.9	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	75%	0.747	S	S	*	*			cis	100.9	141.2	47.9	166.5	0	0	0	0	113.2
476	T	34.3	Very low	30.9	Very low	118 Å²	118	133.1 Å²	133.1	72%	0.724	76%	0.758	S	S	*	*			trans	68.9	109.7	169.8	37.2	0	0	0	0	122.7
477	N	32	Very low	30.9	Very low	140 Å²	140	131.4 Å²	131.4	75%	0.749	75%	0.753	S	S	*	*				50.2	125.4	109.1	-66.2	-8.7	0	0	0	124
478	C	26.9	Very low	30.8	Very low	112 Å²	112	130.4 Å²	130.4	76%	0.757	76%	0.757	S	S	*	*				80.4	155.9	127.2	-68.2	0	0	0	0	123.1
479	S	27.8	Very low	31	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	76%	0.756	S	S	*	*			trans	63.9	132.1	176.3	24.5	0	0	0	0	116.4
480	A	26.6	Very low	31.8	Very low	90 Å²	90	129.4 Å²	129.4	74%	0.744	74%	0.744	S	S	*	*			cis	90.1	144.3	23.3	0	0	0	0	0	115.5
481	L	33.9	Very low	31.5	Very low	158 Å²	158	131.5 Å²	131.5	83%	0.827	75%	0.747	S	S	*	*			trans	70.1	154.9	-178.4	-53.4	-178.1	0	0	0	114.9
482	E	30.1	Very low	31.7	Very low	126 Å²	126	133.6 Å²	133.6	59%	0.589	75%	0.75	S	S	*	*			cis	-171.1	137.7	-25.2	169.6	174.8	179.4	0	0	108.4
483	L	28.2	Very low	31.5	Very low	163 Å²	163	131.7 Å²	131.7	85%	0.853	75%	0.753	S	S	*	*			trans	-154	94.4	156.2	-138.1	69.8	0	0	0	112.9
484	R	33.8	Very low	31.5	Very low	174 Å²	174	129.7 Å²	129.7	66%	0.657	76%	0.757	S	S	*	*				55.4	104.6	119.5	-55.2	-100	-80.5	149	-4.5	117.2
485	Q	30.8	Very low	31.3	Very low	122 Å²	122	126 Å²	126	57%	0.57	76%	0.755	S	S	*	*				77.3	110.5	76.2	-75.4	173.7	12.2	0	0	114.9
486	S	29.2	Very low	31.3	Very low	125 Å²	125	127.3 Å²	127.3	87%	0.874	75%	0.753	S	S	*	*				-129.9	149.6	129.9	60.4	0	0	0	0	108.1
487	L	28.9	Very low	31	Very low	134 Å²	134	128.5 Å²	128.5	70%	0.702	75%	0.751	S	S	*	*			trans	-128.6	147.3	-167.6	-81.1	160	0	0	0	110.6
488	C	27.2	Very low	31	Very low	131 Å²	131	134.1 Å²	134.1	89%	0.885	76%	0.761	S	S	*	*			trans	-158.5	137.1	134.8	-98.4	0	0	0	0	111.2
489	L	33.8	Very low	31.4	Very low	154 Å²	154	138.4 Å²	138.4	81%	0.806	77%	0.767	S	S	*	*			trans	-123.2	165.6	172.4	-82.5	172.4	0	0	0	106
490	P	45.8	Very low	31.8	Very low	111 Å²	111	144.5 Å²	144.5	72%	0.721	77%	0.773	S	S	*	*			cis	-137	-162.2	42.7	38.1	-14	0	0	0	112.4
491	L	28.7	Very low	32.1	Very low	144 Å²	144	144.7 Å²	144.7	75%	0.754	77%	0.769	S	S	*	*			cis	-154.9	164.4	20.3	-171.4	59.2	0	0	0	112.4
492	D	31.2	Very low	32.4	Very low	148 Å²	148	142 Å²	142	79%	0.791	76%	0.763	S	S	*	*			trans	-9.4	149.8	175.1	-60.6	-41.9	0	0	0	121.6
493	G	30.5	Very low	32.9	Very low	73 Å²	73	143 Å²	143	75%	0.753	77%	0.773	S	S	*	*			cis	148.5	95	-2.4	0	0	0	0	0	114.2
494	A	31.8	Very low	33.8	Very low	104 Å²	104	142.5 Å²	142.5	86%	0.86	77%	0.77	S	S	*	*			trans	-155.3	131	164.8	0	0	0	0	0	113.5
495	A	32.8	Very low	34.6	Very low	91 Å²	91	141 Å²	141	75%	0.752	78%	0.775	S	S	*	*			trans	-53.5	157	159.9	0	0	0	0	0	112.9
496	Q	33.5	Very low	35.4	Very low	141 Å²	141	145.4 Å²	145.4	66%	0.659	79%	0.788	S	S	*	*			cis	-163.7	167.8	-2.6	-113.5	-60.9	4.6	0	0	110.3
497	H	27.2	Very low	36.9	Very low	144 Å²	144	147.1 Å²	147.1	67%	0.667	79%	0.786	S	S	*	*			trans	50.3	114.5	151.7	-62.2	-43.4	0	0	0	120.9
498	W	32.3	Very low	38	Very low	257 Å²	257	145 Å²	145	97%	0.973	78%	0.782	S	S	*	*				-160.1	179.9	107.3	-91.1	-5.7	0	0	0	111.6
499	K	35.7	Very low	39	Very low	203 Å²	203	145.9 Å²	145.9	88%	0.883	78%	0.778	S	S	*	*			trans	-91.3	167.6	-157.1	-68.1	176.5	179.3	173	0	114.9
500	R	34.8	Very low	39.8	Very low	242 Å²	242	144.2 Å²	144.2	91%	0.913	77%	0.77	S	S	*	*			trans	-27.7	152.2	153.3	-67.3	178	170.6	172.1	-3.9	113.3
501	S	34.6	Very low	40	Very low	93 Å²	93	147.8 Å²	147.8	65%	0.65	77%	0.774	S	S	*	*			cis	-160.5	146.6	36.7	53	0	0	0	0	115.2
502	S	39.6	Very low	40.8	Very low	103 Å²	103	147.9 Å²	147.9	72%	0.72	78%	0.776	S	S	*	*			trans	33.6	94.9	146.6	61	0	0	0	0	118.3	L504	S502-L504 PolarHBondContact O-N 2.83Å
503	N	40.5	Very low	41.2	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	78%	0.776	S	S	*	*			trans	-71.5	118.8	160.4	-65.8	-18.7	0	0	0	109.2
504	L	46.1	Very low	41.7	Very low	152 Å²	152	147.6 Å²	147.6	80%	0.796	78%	0.779	S	S	*	*			trans	-100.7	97.6	158.5	-83.9	167.2	0	0	0	106.1	S502 Y506	S502-L504 PolarHBondContact O-N 2.83Å; L504-Y506 PolarHBondContact O-N 3.12Å
505	D	51.8	Low	42.1	Very low	141 Å²	141	147.8 Å²	147.8	75%	0.754	77%	0.774	S	S	*	*			trans	-67.3	106.6	179.4	-67.7	-34.8	0	0	0	109.6	L507	D505-L507 PolarHBondContact O-N 3.42Å
506	Y	47.6	Very low	42.8	Very low	215 Å²	215	149.3 Å²	149.3	84%	0.843	78%	0.777	S	S	*	*			trans	-68.1	113	170	-94.4	-102.7	0	0	0	108.5	L504 S508	L504-Y506 PolarHBondContact O-N 3.12Å; Y506-S508 PolarHBondContact O-N 3.43Å
507	L	60.6	Low	42.7	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	78%	0.782	S	S	*	*			trans	-63	110	171.7	-67	175.7	0	0	0	109.6	D505 L509	D505-L507 PolarHBondContact O-N 3.42Å; L507-L509 PolarHBondContact O-N 2.81Å
508	S	51.5	Low	43.9	Very low	89 Å²	89	146.5 Å²	146.5	62%	0.622	79%	0.786	S	S	*	*			trans	-60.2	123.5	171.3	-51.5	0	0	0	0	110	Y506 D510	Y506-S508 PolarHBondContact O-N 3.43Å; S508-D510 VanDerWaalsContact C-N 3.28Å; S508-D510 WeakPolarHBondContact CB-OD1 3.49Å; S508-D510 PolarHBondContact O-N 3.3Å; S508-D510 VanDerWaalsContact O-N 3.11Å
509	L	48.3	Very low	44	Very low	151 Å²	151	139.9 Å²	139.9	79%	0.791	77%	0.774	S	S	*	*			trans	-84.3	79.7	168.2	-70.7	178.9	0	0	0	108.7	L507 F511	L507-L509 PolarHBondContact O-N 2.81Å; L509-F511 HydrophobicContact CB-CE2 4.4Å; L509-F511 VanDerWaalsContact O-CD2 3.3Å; L509-F511 WeakPolarHBondContact O-CD2 3.36Å; L509-F511 PolarHBondContact O-N 3.39Å
510	D	51.1	Low	44.3	Very low	119 Å²	119	138.7 Å²	138.7	64%	0.636	77%	0.771	S	S	*	*			trans	-69.7	90.5	-176.3	-66.6	-21.3	0	0	0	111.2	S508 N512	S508-D510 VanDerWaalsContact C-N 3.28Å; S508-D510 WeakPolarHBondContact CB-OD1 3.49Å; S508-D510 PolarHBondContact O-N 3.3Å; S508-D510 VanDerWaalsContact O-N 3.11Å; D510-N512 PolarHBondContact O-N 2.85Å
511	F	49.3	Very low	44.9	Very low	186 Å²	186	137.1 Å²	137.1	82%	0.816	77%	0.771	S	S	*	*			trans	-68.2	73.6	168	-77.7	-85.6	0	0	0	110.5	L509 S513	L509-F511 HydrophobicContact CB-CE2 4.4Å; L509-F511 VanDerWaalsContact O-CD2 3.3Å; L509-F511 WeakPolarHBondContact O-CD2 3.36Å; L509-F511 PolarHBondContact O-N 3.39Å; F511-S513 PolarHBondContact O-N 3.45Å
512	N	46	Very low	45	Very low	146 Å²	146	142.3 Å²	142.3	78%	0.781	78%	0.782	S	S	*	*			trans	-55.7	104.4	176.2	-84.1	-59.2	0	0	0	110.2	D510 A514	D510-N512 PolarHBondContact O-N 2.85Å; N512-A514 PolarHBondContact O-N 2.8Å
513	S	39.3	Very low	45.1	Very low	114 Å²	114	143.2 Å²	143.2	80%	0.797	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.4	120.2	176.3	-63.9	0	0	0	0	108.8	F511 S515	F511-S513 PolarHBondContact O-N 3.45Å; S513-S515 PolarHBondContact O-N 2.91Å
514	A	40.7	Very low	45	Very low	100 Å²	100	144.3 Å²	144.3	83%	0.826	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.8	124.9	-171.4	0	0	0	0	0	111.8	N512	N512-A514 PolarHBondContact O-N 2.8Å
515	S	40.3	Very low	44.9	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70.9	128.9	177.8	-176.6	0	0	0	0	111	S513 S517	S513-S515 PolarHBondContact O-N 2.91Å; S515-S517 PolarHBondContact O-N 3.24Å
516	P	47.8	Very low	44.4	Very low	123 Å²	123	143 Å²	143	80%	0.799	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.5	120.4	176.8	31.2	-32.4	0	0	0	110.9
517	S	31.7	Very low	44.2	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	79%	0.793	S	S	*	*			trans	-105.6	146.7	160.9	-82.2	0	0	0	0	110.9	S515	S515-S517 PolarHBondContact O-N 3.24Å
518	P	51.3	Low	43.6	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	79%	0.789	S	S	*	*			trans	-86.2	162.1	-167	34.2	-36.6	0	0	0	113.6
519	V	36	Very low	43.6	Very low	118 Å²	118	145.8 Å²	145.8	72%	0.715	80%	0.8	S	S	*	*			trans	155.4	136.1	130.6	161.4	0	0	0	0	112.8
520	Q	41.1	Very low	44	Very low	177 Å²	177	147.5 Å²	147.5	83%	0.827	80%	0.801	S	S	*	*			trans	63.1	77.7	161.1	-73.4	163.1	39.1	0	0	122
521	K	46.9	Very low	44.4	Very low	209 Å²	209	146.2 Å²	146.2	91%	0.909	80%	0.797	S	S	*	*				22.2	117.1	124.2	-58.6	179.5	-179.6	-179.6	0	119.5
522	K	38.2	Very low	45.1	Very low	203 Å²	203	144.2 Å²	144.2	88%	0.883	80%	0.795	S	S	*	*				-157.3	155.8	124.5	-107.9	163.9	-174.1	175.9	0	109.6
523	P	41.8	Very low	45.8	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	80%	0.795	S	S	*	*			trans	-83.8	131.7	-160.7	31.6	-34.3	0	0	0	113.3
524	L	38.4	Very low	47.5	Very low	171 Å²	171	147 Å²	147	90%	0.895	79%	0.792	S	S	*	*			trans	-108.4	147.5	154.5	-68.8	175.8	0	0	0	108.2
525	L	44	Very low	48.8	Very low	175 Å²	175	151.1 Å²	151.1	92%	0.916	79%	0.793	S	S	*	*			trans	-67.3	135.8	178.2	-66.2	167.5	0	0	0	109.8	D527	L525-D527 PolarHBondContact O-N 2.75Å
526	A	40.8	Very low	50.3	Low	91 Å²	91	151.4 Å²	151.4	75%	0.752	79%	0.791	S	S	*	*			trans	-78	106.4	171.5	0	0	0	0	0	109.2	E528	A526-E528 PolarHBondContact O-N 2.97Å
527	D	42.3	Very low	51.5	Low	146 Å²	146	149.7 Å²	149.7	78%	0.781	77%	0.774	S	S	*	*			trans	-87	91.1	167.1	-165.5	23.4	0	0	0	108.1	L525 Y529	L525-D527 PolarHBondContact O-N 2.75Å; D527-Y529 PolarHBondContact O-N 3.34Å
528	E	48.6	Very low	53.5	Low	161 Å²	161	152 Å²	152	75%	0.752	77%	0.773	S	S	*	*			trans	-68.4	103.5	179.9	-69.2	-169.8	150.5	0	0	109.9	A526 K530	A526-E528 PolarHBondContact O-N 2.97Å; E528-K530 PolarHBondContact O-N 3.01Å
529	Y	52.5	Low	54.6	Low	216 Å²	216	154.4 Å²	154.4	85%	0.847	77%	0.772	S	S	*	*			trans	-70.9	73.1	-178.2	-152.6	-84.5	0	0	0	112	D527 V531	D527-Y529 PolarHBondContact O-N 3.34Å; Y529-V531 PolarHBondContact O-N 3.03Å; Y529-V531 VanDerWaalsContact O-N 3.16Å
530	K	56.9	Low	56.2	Low	187 Å²	187	156.2 Å²	156.2	81%	0.813	77%	0.77	S	S	*	*			trans	-73.9	103.7	-171.1	-163.9	171.9	-173.4	172.7	0	110.2	E528 D532	E528-K530 PolarHBondContact O-N 3.01Å; K530-D532 PolarHBondContact O-N 2.88Å; K530-D532 VanDerWaalsContact O-N 3.08Å
531	V	58.1	Low	57.8	Low	91 Å²	91	150.3 Å²	150.3	55%	0.552	75%	0.746	S	S	*	*			trans	-66.8	107.7	178.6	-179	0	0	0	0	109.5	Y529 Y533	Y529-V531 PolarHBondContact O-N 3.03Å; Y529-V531 VanDerWaalsContact O-N 3.16Å; V531-Y533 HydrophobicContact CB-CD2 4.4Å; V531-Y533 HydrophobicContact CB-CE2 3.94Å; V531-Y533 HydrophobicContact CG1-CD2 4.06Å; V531-Y533 HydrophobicContact CG1-CE1 4.44Å; V531-Y533 HydrophobicContact CG1-CE2 3.63Å; V531-Y533 VanDerWaalsContact O-CD2 3.26Å; V531-Y533 WeakPolarHBondContact O-CD2 3.36Å; V531-Y533 PolarHBondContact O-N 2.75Å; V531-Y533 VanDerWaalsContact O-N 3.12Å
532	D	63.9	Low	59.1	Low	145 Å²	145	146.1 Å²	146.1	78%	0.775	73%	0.73	S	S	*	*			trans	-80.1	94.1	-176.8	-164.2	31.4	0	0	0	111	K530 V534	K530-D532 PolarHBondContact O-N 2.88Å; K530-D532 VanDerWaalsContact O-N 3.08Å; D532-V534 PolarHBondContact O-N 2.76Å
533	Y	61.8	Low	61	Low	198 Å²	198	139 Å²	139	78%	0.776	71%	0.709	S	S	*	*			trans	-75.5	88.8	178.3	-74.3	-85.1	0	0	0	110.6	V531 Q535	V531-Y533 HydrophobicContact CB-CD2 4.4Å; V531-Y533 HydrophobicContact CB-CE2 3.94Å; V531-Y533 HydrophobicContact CG1-CD2 4.06Å; V531-Y533 HydrophobicContact CG1-CE1 4.44Å; V531-Y533 HydrophobicContact CG1-CE2 3.63Å; V531-Y533 VanDerWaalsContact O-CD2 3.26Å; V531-Y533 WeakPolarHBondContact O-CD2 3.36Å; V531-Y533 PolarHBondContact O-N 2.75Å; V531-Y533 VanDerWaalsContact O-N 3.12Å; Y533-Q535 PolarHBondContact O-N 2.9Å
534	V	74.5	Confident	62.6	Low	121 Å²	121	139.6 Å²	139.6	73%	0.733	71%	0.705	S	S	*	*			trans	-52.7	109.5	173.3	-179.6	0	0	0	0	110	D532 V536	D532-V534 PolarHBondContact O-N 2.76Å; V534-V536 PolarHBondContact O-N 2.82Å; V534-V536 VanDerWaalsContact O-N 3.14Å
535	Q	68.7	Low	64.3	Low	185 Å²	185	137 Å²	137	86%	0.864	69%	0.688	S	S	*	*			trans	-63.2	115.5	-177.7	-170.8	172.6	5.7	0	0	110	Y533 D537	Y533-Q535 PolarHBondContact O-N 2.9Å; Q535-D537 PolarHBondContact O-N 3.08Å
536	V	70.4	Confident	66	Low	115 Å²	115	133.7 Å²	133.7	70%	0.697	67%	0.671	S	S	*	*			trans	-70.4	120.7	-179.2	-177.9	0	0	0	0	109	V534 E538 T541	V534-V536 PolarHBondContact O-N 2.82Å; V534-V536 VanDerWaalsContact O-N 3.14Å; V536-E538 PolarHBondContact O-N 3.13Å; V536-T541 WeakPolarHBondContact CG1-OG1 3.19Å
537	D	73	Confident	67.8	Low	86 Å²	86	132.5 Å²	132.5	46%	0.46	66%	0.655	S	S	.	*			trans	-57.1	110.9	175.7	176.4	-3.8	0	0	0	110.7	Q535 K539 K540 T541	Q535-D537 PolarHBondContact O-N 3.08Å; D537-K539 VanDerWaalsContact C-N 3.32Å; D537-K539 PolarHBondContact O-N 2.93Å; D537-K539 WeakPolarHBondContact OD1-CA 3.08Å; D537-K539 WeakPolarHBondContact OD1-CB 3.33Å; D537-K539 PolarHBondContact OD1-N 2.82Å; D537-K540 HydrophobicContact CB-CB 3.81Å; D537-K540 PolarHBondContact O-N 3.28Å; D537-K540 PolarHBondContact OD1-N 3.05Å; D537-K540 VanDerWaalsContact OD1-N 3.14Å; D537-K540 WeakPolarHBondContact OD2-CB 3.49Å; D537-T541 PolarHBondContact O-N 2.98Å; D537-T541 PolarHBondContact O-OG1 3.4Å
538	E	74.5	Confident	69.8	Low	159 Å²	159	132.9 Å²	132.9	74%	0.743	65%	0.649	S	S	*	*	H	α-helix	trans	-63.4	-37.4	-178.2	-172.3	172.8	-152.3	0	0	111.6	V536 T541 Q542	V536-E538 PolarHBondContact O-N 3.13Å; E538-T541 WeakPolarHBondContact O-CB 3.4Å; E538-T541 PolarHBondContact O-N 3.02Å; E538-Q542 WeakPolarHBondContact O-CB 3.43Å; E538-Q542 PolarHBondContact O-N 2.84Å
539	K	74.3	Confident	70.9	Confident	167 Å²	167	131.3 Å²	131.3	73%	0.726	64%	0.644	S	S	*	*	H	α-helix	trans	-68.5	-42.4	178.5	-60	179.5	-178.6	177.3	0	110.7	D537 T541 Q542 A543	D537-K539 VanDerWaalsContact C-N 3.32Å; D537-K539 PolarHBondContact O-N 2.93Å; D537-K539 WeakPolarHBondContact OD1-CA 3.08Å; D537-K539 WeakPolarHBondContact OD1-CB 3.33Å; D537-K539 PolarHBondContact OD1-N 2.82Å; K539-T541 VanDerWaalsContact C-N 3.28Å; K539-T541 PolarHBondContact O-N 3.23Å; K539-Q542 PolarHBondContact O-N 3.41Å; K539-A543 WeakPolarHBondContact O-CB 3.26Å; K539-A543 PolarHBondContact O-N 3.1Å
540	K	70.3	Confident	72	Confident	156 Å²	156	126.4 Å²	126.4	68%	0.678	63%	0.628	S	S	*	*	H	α-helix	trans	-62.7	-36.5	173.5	-171.8	174.4	-174.2	174.7	0	112	D537 L544	D537-K540 HydrophobicContact CB-CB 3.81Å; D537-K540 PolarHBondContact O-N 3.28Å; D537-K540 PolarHBondContact OD1-N 3.05Å; D537-K540 VanDerWaalsContact OD1-N 3.14Å; D537-K540 WeakPolarHBondContact OD2-CB 3.49Å; K540-L544 PolarHBondContact O-N 3.11Å
541	T	73.3	Confident	72.5	Confident	54 Å²	54	125.7 Å²	125.7	33%	0.331	62%	0.621	S	S	.	*	H	α-helix	trans	-68.8	-43.4	175.4	-55.6	0	0	0	0	111.6	V536 D537 E538 K539 L544 Q545	V536-T541 WeakPolarHBondContact CG1-OG1 3.19Å; D537-T541 PolarHBondContact O-N 2.98Å; D537-T541 PolarHBondContact O-OG1 3.4Å; E538-T541 WeakPolarHBondContact O-CB 3.4Å; E538-T541 PolarHBondContact O-N 3.02Å; K539-T541 VanDerWaalsContact C-N 3.28Å; K539-T541 PolarHBondContact O-N 3.23Å; T541-L544 WeakPolarHBondContact O-CB 3.33Å; T541-L544 PolarHBondContact O-N 3.21Å; T541-Q545 WeakPolarHBondContact O-CG 3.1Å; T541-Q545 PolarHBondContact O-N 3.1Å; T541-Q545 VanDerWaalsContact O-N 3.09Å
542	Q	74.8	Confident	73.1	Confident	121 Å²	121	127.2 Å²	127.2	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-67.3	-39.4	178	-165.7	173.5	44.8	0	0	112.1	E538 K539 L544 Q545 N546	E538-Q542 WeakPolarHBondContact O-CB 3.43Å; E538-Q542 PolarHBondContact O-N 2.84Å; K539-Q542 PolarHBondContact O-N 3.41Å; Q542-L544 VanDerWaalsContact C-N 3.33Å; Q542-L544 PolarHBondContact O-N 2.77Å; Q542-Q545 PolarHBondContact O-N 3.26Å; Q542-Q545 VanDerWaalsContact O-N 3.14Å; Q542-N546 PolarHBondContact O-N 2.87Å
543	A	78.4	Confident	73.2	Confident	54 Å²	54	125.5 Å²	125.5	45%	0.446	61%	0.611	S	S	.	*	H	α-helix	trans	-57.5	-45	171.5	0	0	0	0	0	111.7	K539 Q545 N546 T547	K539-A543 WeakPolarHBondContact O-CB 3.26Å; K539-A543 PolarHBondContact O-N 3.1Å; A543-Q545 VanDerWaalsContact C-N 3.28Å; A543-Q545 PolarHBondContact O-N 3.37Å; A543-N546 PolarHBondContact O-N 2.75Å; A543-T547 PolarHBondContact O-N 2.58Å; A543-T547 PolarHBondContact O-OG1 3.21Å
544	L	75.1	Confident	73.1	Confident	132 Å²	132	120.8 Å²	120.8	69%	0.691	60%	0.602	S	S	*	*	H	α-helix	trans	-62.5	-34.1	176.6	-156	81.5	0	0	0	112.5	K540 T541 Q542 K548	K540-L544 PolarHBondContact O-N 3.11Å; T541-L544 WeakPolarHBondContact O-CB 3.33Å; T541-L544 PolarHBondContact O-N 3.21Å; Q542-L544 VanDerWaalsContact C-N 3.33Å; Q542-L544 PolarHBondContact O-N 2.77Å; L544-K548 WeakPolarHBondContact O-CB 3.3Å; L544-K548 PolarHBondContact O-N 3Å
545	Q	74.5	Confident	72.4	Confident	117 Å²	117	123.8 Å²	123.8	55%	0.547	60%	0.6	S	S	.	*	H	α-helix	trans	-72	-40.8	174.3	-68.4	-172.9	24.5	0	0	112.4	T541 Q542 A543 K548 M549	T541-Q545 WeakPolarHBondContact O-CG 3.1Å; T541-Q545 PolarHBondContact O-N 3.1Å; T541-Q545 VanDerWaalsContact O-N 3.09Å; Q542-Q545 PolarHBondContact O-N 3.26Å; Q542-Q545 VanDerWaalsContact O-N 3.14Å; A543-Q545 VanDerWaalsContact C-N 3.28Å; A543-Q545 PolarHBondContact O-N 3.37Å; Q545-K548 CarbonylContact O-C 3.59Å; Q545-K548 WeakPolarHBondContact O-CB 3.27Å; Q545-K548 PolarHBondContact O-N 2.88Å; Q545-K548 VanDerWaalsContact O-N 3.16Å; Q545-M549 WeakPolarHBondContact O-CG 3.17Å; Q545-M549 PolarHBondContact O-N 2.79Å
546	N	78.9	Confident	71.8	Confident	105 Å²	105	122.1 Å²	122.1	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-61.6	-47.6	176.3	-76.8	-5.6	0	0	0	111.5	Q542 A543 K548 M549 E550	Q542-N546 PolarHBondContact O-N 2.87Å; A543-N546 PolarHBondContact O-N 2.75Å; N546-K548 VanDerWaalsContact C-N 3.27Å; N546-K548 PolarHBondContact O-N 3.15Å; N546-M549 WeakPolarHBondContact O-CB 3.45Å; N546-M549 PolarHBondContact O-N 3.4Å; N546-E550 WeakPolarHBondContact O-CB 3.17Å; N546-E550 PolarHBondContact O-N 3.49Å
547	T	79.4	Confident	71.2	Confident	67 Å²	67	120.9 Å²	120.9	41%	0.411	59%	0.589	S	S	.	*	H	α-helix	trans	-60	-38	173.8	-51.6	0	0	0	0	111.6	A543 M549 W551	A543-T547 PolarHBondContact O-N 2.58Å; A543-T547 PolarHBondContact O-OG1 3.21Å; T547-M549 VanDerWaalsContact C-N 3.28Å; T547-M549 PolarHBondContact O-N 3.01Å; T547-W551 HydrophobicContact CG2-CG 4.49Å; T547-W551 WeakPolarHBondContact O-CB 3.02Å; T547-W551 PolarHBondContact O-N 3.04Å
548	K	83.8	Confident	70.4	Confident	153 Å²	153	125.8 Å²	125.8	67%	0.665	61%	0.606	S	S	*	*	H	α-helix	trans	-66.1	-26.7	175.8	-176.7	-177.6	176.8	-173.6	0	113.3	L544 Q545 N546	L544-K548 WeakPolarHBondContact O-CB 3.3Å; L544-K548 PolarHBondContact O-N 3Å; Q545-K548 CarbonylContact O-C 3.59Å; Q545-K548 WeakPolarHBondContact O-CB 3.27Å; Q545-K548 PolarHBondContact O-N 2.88Å; Q545-K548 VanDerWaalsContact O-N 3.16Å; N546-K548 VanDerWaalsContact C-N 3.27Å; N546-K548 PolarHBondContact O-N 3.15Å
549	M	71.6	Confident	68.9	Low	128 Å²	128	127.5 Å²	127.5	63%	0.631	63%	0.628	S	S	*	*	H	α-helix	trans	-79.5	-50.8	174.2	-71.1	-76.9	-78.1	0	0	111.4	Q545 N546 T547 W551 K552 D553	Q545-M549 WeakPolarHBondContact O-CG 3.17Å; Q545-M549 PolarHBondContact O-N 2.79Å; N546-M549 WeakPolarHBondContact O-CB 3.45Å; N546-M549 PolarHBondContact O-N 3.4Å; T547-M549 VanDerWaalsContact C-N 3.28Å; T547-M549 PolarHBondContact O-N 3.01Å; M549-W551 VanDerWaalsContact C-N 3.28Å; M549-W551 PolarHBondContact O-N 3.33Å; M549-K552 WeakPolarHBondContact O-CA 3.28Å; M549-K552 WeakPolarHBondContact O-CB 3.35Å; M549-K552 PolarHBondContact O-N 3Å; M549-D553 PolarHBondContact O-N 3.01Å; M549-D553 VanDerWaalsContact O-N 3.11Å
550	E	75	Confident	68.6	Low	113 Å²	113	125.5 Å²	125.5	53%	0.528	62%	0.623	S	S	.	*	H	α-helix	trans	-52.1	-45.2	175.7	-179.4	-173	-160.9	0	0	111.8	N546 K552 D553 V554	N546-E550 WeakPolarHBondContact O-CB 3.17Å; N546-E550 PolarHBondContact O-N 3.49Å; E550-K552 PolarHBondContact O-N 2.88Å; E550-D553 PolarHBondContact O-N 2.96Å; E550-D553 VanDerWaalsContact O-N 3.16Å; E550-V554 WeakPolarHBondContact O-CG2 3.43Å; E550-V554 PolarHBondContact O-N 3.04Å; E550-V554 VanDerWaalsContact O-N 3.14Å
551	W	67.4	Low	68.6	Low	173 Å²	173	123.9 Å²	123.9	66%	0.655	62%	0.62	S	S	*	*	H	α-helix	trans	-72.4	-4.6	178.1	-74.5	54.8	0	0	0	114.1	T547 M549 R555	T547-W551 HydrophobicContact CG2-CG 4.49Å; T547-W551 WeakPolarHBondContact O-CB 3.02Å; T547-W551 PolarHBondContact O-N 3.04Å; M549-W551 VanDerWaalsContact C-N 3.28Å; M549-W551 PolarHBondContact O-N 3.33Å; W551-R555 PolarHBondContact O-NE 3.4Å; W551-R555 PolarHBondContact O-NH2 3.38Å
552	K	70.8	Confident	68.3	Low	123 Å²	123	127.8 Å²	127.8	54%	0.535	64%	0.636	S	S	.	*	H	α-helix	trans	-91	-45.2	164.1	-74.1	179.5	168.9	-171	0	111.2	M549 E550 V554 R555 Q556	M549-K552 WeakPolarHBondContact O-CA 3.28Å; M549-K552 WeakPolarHBondContact O-CB 3.35Å; M549-K552 PolarHBondContact O-N 3Å; E550-K552 PolarHBondContact O-N 2.88Å; K552-V554 PolarHBondContact O-N 3.44Å; K552-R555 WeakPolarHBondContact O-CA 3.36Å; K552-R555 WeakPolarHBondContact O-CB 3.26Å; K552-R555 PolarHBondContact O-N 3.26Å; K552-Q556 PolarHBondContact O-N 3.39Å
553	D	65.9	Low	67.9	Low	108 Å²	108	128.2 Å²	128.2	58%	0.578	64%	0.64	S	S	*	*	H	α-helix	trans	-60.5	-45.4	-174.7	-166.2	22.8	0	0	0	112.1	M549 E550 R555 Q556 S557	M549-D553 PolarHBondContact O-N 3.01Å; M549-D553 VanDerWaalsContact O-N 3.11Å; E550-D553 PolarHBondContact O-N 2.96Å; E550-D553 VanDerWaalsContact O-N 3.16Å; D553-R555 PolarHBondContact O-N 3.19Å; D553-Q556 PolarHBondContact O-N 2.86Å; D553-S557 PolarHBondContact O-N 3.43Å; D553-S557 PolarHBondContact O-OG 3.5Å
554	V	61.4	Low	67.2	Low	99 Å²	99	132.8 Å²	132.8	60%	0.6	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-13.4	173.6	174.7	0	0	0	0	113.8	E550 K552	E550-V554 WeakPolarHBondContact O-CG2 3.43Å; E550-V554 PolarHBondContact O-N 3.04Å; E550-V554 VanDerWaalsContact O-N 3.14Å; K552-V554 PolarHBondContact O-N 3.44Å
555	R	58.8	Low	66.7	Low	184 Å²	184	132.9 Å²	132.9	69%	0.694	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-2.8	174.9	-73.6	-177.4	-75.5	176.2	-5.6	114.5	W551 K552 D553	W551-R555 PolarHBondContact O-NE 3.4Å; W551-R555 PolarHBondContact O-NH2 3.38Å; K552-R555 WeakPolarHBondContact O-CA 3.36Å; K552-R555 WeakPolarHBondContact O-CB 3.26Å; K552-R555 PolarHBondContact O-N 3.26Å; D553-R555 PolarHBondContact O-N 3.19Å
556	Q	57	Low	66.2	Low	151 Å²	151	134 Å²	134	71%	0.706	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	-24.8	170.9	-58.3	-158.5	-78.2	0	0	112.1	K552 D553 K558 T559	K552-Q556 PolarHBondContact O-N 3.39Å; D553-Q556 PolarHBondContact O-N 2.86Å; Q556-K558 PolarHBondContact O-N 3.34Å; Q556-T559 PolarHBondContact O-OG1 3.43Å
557	S	57.1	Low	65.2	Low	88 Å²	88	136.2 Å²	136.2	62%	0.615	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	23.2	172.5	73.3	0	0	0	0	114.6	D553	D553-S557 PolarHBondContact O-N 3.43Å; D553-S557 PolarHBondContact O-OG 3.5Å
558	K	55.4	Low	64	Low	190 Å²	190	142 Å²	142	83%	0.826	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.1	42.2	-178	-155	177.8	-179.4	173.3	0	113.2	Q556	Q556-K558 PolarHBondContact O-N 3.34Å
559	T	43.8	Very low	62.2	Low	194 Å²	194	141 Å²	141	100%	1.19	69%	0.687	S	S	*	*			trans	-137.5	0	170	47.1	0	0	0	0	109.3	Q556	Q556-T559 PolarHBondContact O-OG1 3.43Å

Retrieved 559 of 559 residues in 102.5 ms (Link to these results)

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