A0A087XQW1_POEFO Loading...

Chromobox homolog 4 (Pc class homolog, Drosophila)

AlphaFold DB , UniProt , Accession A0A087XQW1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 547 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	49.7	Very low	63.7	Low	241 Å²	241	132.3 Å²	132.3	100%	1.187	76%	0.755	S	S	*	*				0	115.4	0	-67.1	-173.7	-72.4	0	0	106.7
2	E	53.3	Low	66.3	Low	194 Å²	194	126.2 Å²	126.2	91%	0.907	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-73	144.2	169.5	-65.3	178.6	121.6	0	0	108.6
3	L	51.8	Low	68.6	Low	163 Å²	163	119.5 Å²	119.5	85%	0.853	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-78	129.2	172.3	-65.7	171	0	0	0	107.6	A5	L3-A5 PolarHBondContact O-N 2.87Å
4	P	53.2	Low	70.6	Confident	76 Å²	76	119.1 Å²	119.1	49%	0.494	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-57.8	142.5	173.9	25.4	-33.6	0	0	0	109.7	A6	P4-A6 PolarHBondContact O-N 2.7Å
5	A	50.7	Low	72.3	Confident	80 Å²	80	111.9 Å²	111.9	66%	0.661	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.9	-175.6	0	0	0	0	0	110.6	L3 G7 E8	L3-A5 PolarHBondContact O-N 2.87Å; A5-G7 PolarHBondContact O-N 2.72Å; A5-E8 PolarHBondContact O-N 3.26Å
6	A	54.3	Low	73.8	Confident	114 Å²	114	105.1 Å²	105.1	94%	0.942	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	18.2	-163.6	0	0	0	0	0	116.5	P4	P4-A6 PolarHBondContact O-N 2.7Å
7	G	55.3	Low	75.1	Confident	72 Å²	72	102.8 Å²	102.8	74%	0.742	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-9.7	178.8	0	0	0	0	0	115.7	A5	A5-G7 PolarHBondContact O-N 2.72Å
8	E	66.1	Low	76.3	Confident	156 Å²	156	103.7 Å²	103.7	73%	0.729	58%	0.584	S	S	*	*	S	Bend	trans	-92.1	-13.2	-169.8	-163.7	160.1	-136.8	0	0	114.6	A5 V10	A5-E8 PolarHBondContact O-N 3.26Å; E8-V10 PolarHBondContact O-N 3.32Å
9	H	82.2	Confident	77.3	Confident	118 Å²	118	102.4 Å²	102.4	55%	0.546	57%	0.572	S	S	.	*			trans	-96	82.5	-175.8	-62.3	-25.9	0	0	0	112.8	F11	H9-F11 HydrophobicContact CB-CE2 3.65Å; H9-F11 HydrophobicContact CB-CZ 3.78Å; H9-F11 VanDerWaalsContact O-CD2 3.31Å; H9-F11 WeakPolarHBondContact O-CD2 3.35Å; H9-F11 WeakPolarHBondContact O-CE2 3.35Å
10	V	90.8	Very high	78.2	Confident	109 Å²	109	101.6 Å²	101.6	66%	0.661	56%	0.559	S	S	*	*			trans	-83.5	119.2	172.2	-178.8	0	0	0	0	110.4	E8 L49	E8-V10 PolarHBondContact O-N 3.32Å; V10-L49 HydrophobicContact CG1-CD1 3.98Å; V10-L49 HydrophobicContact CG2-CD1 3.88Å
11	F	93.3	Very high	79.1	Confident	132 Å²	132	102.6 Å²	102.6	58%	0.579	56%	0.563	S	S	*	*			trans	-108.5	148.5	179.9	-60.2	-77.8	0	0	0	112.7	H9 W32	H9-F11 HydrophobicContact CB-CE2 3.65Å; H9-F11 HydrophobicContact CB-CZ 3.78Å; H9-F11 VanDerWaalsContact O-CD2 3.31Å; H9-F11 WeakPolarHBondContact O-CD2 3.35Å; H9-F11 WeakPolarHBondContact O-CE2 3.35Å; F11-W32 HydrophobicContact CB-CE3 3.81Å; F11-W32 HydrophobicContact CB-CH2 4.45Å; F11-W32 HydrophobicContact CB-CZ3 3.62Å
12	A	94.9	Very high	81.3	Confident	59 Å²	59	97.9 Å²	97.9	49%	0.488	53%	0.532	S	S	.	.			trans	-72.4	129	177.8	0	0	0	0	0	111.9	R33	A12-R33 HydrophobicContact CB-CB 3.96Å; A12-R33 VanDerWaalsContact O-CB 3.25Å; A12-R33 WeakPolarHBondContact O-CB 3.49Å; A12-R33 PolarHBondContact O-N 3.28Å
13	V	96.8	Very high	83.2	Confident	40 Å²	40	98.5 Å²	98.5	24%	0.242	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	137.4	179.3	174.9	0	0	0	0	110.1	G15 V30 W32 L53	V13-G15 WeakPolarHBondContact CG1-O 3.41Å; V13-V30 HydrophobicContact CB-CG1 4.28Å; V13-V30 HydrophobicContact CG1-CG1 3.8Å; V13-V30 HydrophobicContact CG2-CG1 3.55Å; V13-W32 HydrophobicContact CG2-CE3 3.78Å; V13-W32 HydrophobicContact CG2-CH2 4.46Å; V13-W32 HydrophobicContact CG2-CZ3 3.53Å; V13-L53 HydrophobicContact CB-CD1 3.93Å; V13-L53 HydrophobicContact CG1-CD1 3.82Å; V13-L53 HydrophobicContact CG1-CD2 4.09Å; V13-L53 HydrophobicContact CG2-CD1 4.49Å
14	E	96.4	Very high	85.3	Confident	113 Å²	113	94.1 Å²	94.1	53%	0.528	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-37.1	170.6	-166.3	-160.8	117.9	0	0	111.2	K31 R33	E14-K31 HydrophobicContact CB-CD 4.37Å; E14-K31 HydrophobicContact CB-CG 4.46Å; E14-K31 PolarHBondContact N-O 2.95Å; E14-K31 IonicContact OE1-NZ 3.21Å; E14-K31 PolarHBondContact OE1-NZ 2.98Å; E14-K31 WeakPolarHBondContact OE2-CE 3.49Å; E14-K31 IonicContact OE2-NZ 3.31Å; E14-K31 PolarHBondContact OE2-NZ 2.79Å; E14-R33 HydrophobicContact CB-CB 4.47Å
15	G	95.7	Very high	87.3	Confident	11 Å²	11	95.4 Å²	95.4	11%	0.113	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.1	177	175.6	0	0	0	0	0	112.9	V13 K31	V13-G15 WeakPolarHBondContact CG1-O 3.41Å; G15-K31 WeakPolarHBondContact O-CB 3.32Å; G15-K31 PolarHBondContact O-N 2.96Å
16	I	97.2	Very high	89.5	Confident	3 Å²	3	93.7 Å²	93.7	2%	0.015	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.8	169	-64.8	169	0	0	0	108.3	Y28 I48 L53 L54 F57 R60	I16-Y28 HydrophobicContact CD1-CD1 4.23Å; I16-Y28 HydrophobicContact CD1-CG 4.13Å; I16-Y28 HydrophobicContact CG2-CD1 3.77Å; I16-Y28 HydrophobicContact CG2-CG 4.21Å; I16-I48 HydrophobicContact CD1-CD1 4.48Å; I16-I48 HydrophobicContact CD1-CG2 4.17Å; I16-L53 HydrophobicContact CD1-CB 4.05Å; I16-L53 HydrophobicContact CG1-CB 4.44Å; I16-L54 HydrophobicContact CD1-CD2 3.79Å; I16-F57 HydrophobicContact CB-CB 4.13Å; I16-F57 HydrophobicContact CB-CD2 4.1Å; I16-F57 HydrophobicContact CB-CG 4.28Å; I16-F57 HydrophobicContact CG2-CB 4.25Å; I16-F57 HydrophobicContact CG2-CD2 3.56Å; I16-F57 HydrophobicContact CG2-CE2 4.13Å; I16-F57 HydrophobicContact CG2-CG 3.86Å; I16-R60 PolarHBondContact O-NH1 3.46Å
17	E	95.5	Very high	91.5	Very high	67 Å²	67	89.7 Å²	89.7	31%	0.313	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-39.2	178.8	-73.2	-175.1	-179.4	0	0	113.2	L29 K31 N40	E17-L29 HydrophobicContact CB-CD2 4.17Å; E17-L29 HydrophobicContact CB-CG 4.35Å; E17-L29 PolarHBondContact N-O 3.46Å; E17-K31 HydrophobicContact CG-CB 4.27Å; E17-N40 PolarHBondContact OE1-ND2 2.99Å; E17-N40 PolarHBondContact OE2-ND2 3.12Å
18	K	95.6	Very high	93.5	Very high	119 Å²	119	86.7 Å²	86.7	52%	0.517	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	160.2	-172.7	-59.2	178.1	-172	159.5	0	111.3	Y28 L29 W42	K18-Y28 CarbonylContact O-C 3.59Å; K18-Y28 WeakPolarHBondContact O-CA 3.37Å; K18-L29 HydrophobicContact CB-CB 3.89Å; K18-L29 HydrophobicContact CB-CD2 4.22Å; K18-L29 HydrophobicContact CD-CD2 3.82Å; K18-L29 HydrophobicContact CG-CD2 4.07Å; K18-L29 PolarHBondContact O-N 3.19Å; K18-W42 HydrophobicContact CB-CH2 3.77Å; K18-W42 HydrophobicContact CB-CZ3 4.41Å
19	K	95.9	Very high	95	Very high	79 Å²	79	79.9 Å²	79.9	34%	0.343	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.4	171.1	-178.5	176	-177.4	134.9	0	109.5	I26 Y28 F57	K19-I26 HydrophobicContact CD-CG2 4.36Å; K19-I26 HydrophobicContact CG-CG2 4.16Å; K19-Y28 HydrophobicContact CB-CD1 3.92Å; K19-Y28 HydrophobicContact CB-CE1 3.88Å; K19-Y28 HydrophobicContact CD-CE1 3.67Å; K19-Y28 HydrophobicContact CG-CD1 4.03Å; K19-Y28 HydrophobicContact CG-CE1 3.67Å; K19-Y28 PolarHBondContact NZ-OH 3.21Å; K19-F57 HydrophobicContact CB-CE1 3.69Å; K19-F57 HydrophobicContact CB-CZ 3.71Å; K19-F57 HydrophobicContact CD-CE1 4.31Å
20	R	96.1	Very high	95.8	Very high	85 Å²	85	74.3 Å²	74.3	32%	0.321	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	169.2	166.7	77.1	-175	-176.4	-162.7	-4.1	110.5	E27 W42	R20-E27 HydrophobicContact CG-CB 3.96Å; R20-E27 IonicContact CZ-OE2 2.77Å; R20-E27 PolarHBondContact N-O 3.1Å; R20-E27 IonicContact NE-OE2 2.7Å; R20-E27 PolarHBondContact NE-OE2 3.14Å; R20-E27 IonicContact NH2-OE2 2.99Å; R20-E27 PolarHBondContact NH2-OE2 2.86Å; R20-E27 PolarHBondContact O-N 2.99Å; R20-W42 HydrophobicContact CB-CE3 4.43Å; R20-W42 HydrophobicContact CB-CH2 3.94Å; R20-W42 HydrophobicContact CB-CZ3 3.74Å; R20-W42 HydrophobicContact CG-CD2 4.31Å; R20-W42 HydrophobicContact CG-CE3 3.63Å; R20-W42 HydrophobicContact CG-CH2 3.95Å; R20-W42 HydrophobicContact CG-CZ3 3.44Å; R20-W42 VanDerWaalsContact CG-CZ3 3.44Å; R20-W42 VanDerWaalsContact CZ-CD2 3.44Å; R20-W42 VanDerWaalsContact NH1-CD1 3.31Å
21	I	96.8	Very high	96.1	Very high	124 Å²	124	71.1 Å²	71.1	64%	0.636	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.4	172.7	-57.1	176.7	0	0	0	107.3	K25 I26	I21-K25 CarbonylContact C-O 3.59Å; I21-K25 WeakPolarHBondContact CA-O 3.47Å; I21-I26 HydrophobicContact CG1-CG1 4.16Å
22	R	95.8	Very high	96.3	Very high	142 Å²	142	67 Å²	67	54%	0.536	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	129.4	-178.1	-166.2	-175.6	-173.3	-157.9	2.3	109.5	G24 K25 E27	R22-G24 PolarHBondContact O-N 3.46Å; R22-G24 VanDerWaalsContact O-N 3.08Å; R22-K25 PolarHBondContact N-O 3.36Å; R22-K25 PolarHBondContact O-N 2.94Å; R22-E27 WeakPolarHBondContact CD-OE1 3.28Å
23	K	93.8	Very high	96.3	Very high	207 Å²	207	72.7 Å²	72.7	90%	0.9	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	32.2	-174.5	-59.9	-177	175.9	-175.4	0	113.7	K25	K23-K25 PolarHBondContact O-N 2.87Å
24	G	95.3	Very high	96.3	Very high	70 Å²	70	74.6 Å²	74.6	72%	0.722	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	-17.1	-175.6	0	0	0	0	0	115.7	R22	R22-G24 PolarHBondContact O-N 3.46Å; R22-G24 VanDerWaalsContact O-N 3.08Å
25	K	95.9	Very high	96.2	Very high	104 Å²	104	76.6 Å²	76.6	45%	0.452	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	149.1	171.7	-69.4	-156.9	172.1	-158.5	0	111.4	I21 R22 K23 E46	I21-K25 CarbonylContact C-O 3.59Å; I21-K25 WeakPolarHBondContact CA-O 3.47Å; R22-K25 PolarHBondContact N-O 3.36Å; R22-K25 PolarHBondContact O-N 2.94Å; K23-K25 PolarHBondContact O-N 2.87Å; K25-E46 WeakPolarHBondContact CD-OE1 3.22Å; K25-E46 WeakPolarHBondContact CE-OE1 3.31Å; K25-E46 IonicContact NZ-OE1 2.96Å; K25-E46 PolarHBondContact NZ-OE1 2.9Å; K25-E46 IonicContact NZ-OE2 3.91Å; K25-E46 PolarHBondContact NZ-OE2 2.95Å
26	I	96.3	Very high	96.3	Very high	43 Å²	43	78.3 Å²	78.3	22%	0.221	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.1	169.7	-73	160.4	0	0	0	108.5	K19 I21 Y28 P44 E45	K19-I26 HydrophobicContact CD-CG2 4.36Å; K19-I26 HydrophobicContact CG-CG2 4.16Å; I21-I26 HydrophobicContact CG1-CG1 4.16Å; I26-Y28 HydrophobicContact CG2-CD2 4.07Å; I26-Y28 HydrophobicContact CG2-CE1 4.33Å; I26-Y28 HydrophobicContact CG2-CE2 3.48Å; I26-Y28 VanDerWaalsContact CG2-CE2 3.48Å; I26-P44 WeakPolarHBondContact O-CA 3.49Å; I26-E45 HydrophobicContact CB-CB 4.23Å; I26-E45 WeakPolarHBondContact CB-OE2 3.21Å; I26-E45 WeakPolarHBondContact CD1-OE2 3.15Å; I26-E45 HydrophobicContact CG2-CB 4.15Å; I26-E45 PolarHBondContact O-N 2.7Å
27	E	97.1	Very high	96.2	Very high	30 Å²	30	81.8 Å²	81.8	14%	0.14	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.5	175.5	-64.6	172.2	-176.7	0	0	109.1	R20 R22 W42 E43	R20-E27 HydrophobicContact CG-CB 3.96Å; R20-E27 IonicContact CZ-OE2 2.77Å; R20-E27 PolarHBondContact N-O 3.1Å; R20-E27 IonicContact NE-OE2 2.7Å; R20-E27 PolarHBondContact NE-OE2 3.14Å; R20-E27 IonicContact NH2-OE2 2.99Å; R20-E27 PolarHBondContact NH2-OE2 2.86Å; R20-E27 PolarHBondContact O-N 2.99Å; R22-E27 WeakPolarHBondContact CD-OE1 3.28Å; E27-W42 HydrophobicContact CB-CE3 4.14Å; E27-W42 WeakPolarHBondContact O-CZ3 3.18Å; E27-E43 CarbonylContact C-O 3.42Å; E27-E43 VanDerWaalsContact CA-O 3.27Å; E27-E43 WeakPolarHBondContact CA-O 3.45Å
28	Y	97.2	Very high	96.2	Very high	9 Å²	9	87.6 Å²	87.6	4%	0.035	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137	-179.8	-68.6	-76.1	0	0	0	110.8	I16 K18 K19 I26 V30 W42 E43 E45 I48 L54 F57	I16-Y28 HydrophobicContact CD1-CD1 4.23Å; I16-Y28 HydrophobicContact CD1-CG 4.13Å; I16-Y28 HydrophobicContact CG2-CD1 3.77Å; I16-Y28 HydrophobicContact CG2-CG 4.21Å; K18-Y28 CarbonylContact O-C 3.59Å; K18-Y28 WeakPolarHBondContact O-CA 3.37Å; K19-Y28 HydrophobicContact CB-CD1 3.92Å; K19-Y28 HydrophobicContact CB-CE1 3.88Å; K19-Y28 HydrophobicContact CD-CE1 3.67Å; K19-Y28 HydrophobicContact CG-CD1 4.03Å; K19-Y28 HydrophobicContact CG-CE1 3.67Å; K19-Y28 PolarHBondContact NZ-OH 3.21Å; I26-Y28 HydrophobicContact CG2-CD2 4.07Å; I26-Y28 HydrophobicContact CG2-CE1 4.33Å; I26-Y28 HydrophobicContact CG2-CE2 3.48Å; I26-Y28 VanDerWaalsContact CG2-CE2 3.48Å; Y28-V30 PolarHBondContact O-N 3.36Å; Y28-W42 CarbonylContact O-C 3.58Å; Y28-W42 WeakPolarHBondContact O-CA 3.43Å; Y28-E43 PolarHBondContact N-O 2.87Å; Y28-E43 PolarHBondContact O-N 2.76Å; Y28-E45 HydrophobicContact CD2-CB 4.3Å; Y28-E45 HydrophobicContact CE2-CB 3.79Å; Y28-E45 HydrophobicContact CE2-CG 3.78Å; Y28-E45 VanDerWaalsContact CE2-OE1 3.28Å; Y28-E45 WeakPolarHBondContact CE2-OE1 3.39Å; Y28-E45 PolarHBondContact OH-OE1 3.3Å; Y28-I48 HydrophobicContact CD2-CG1 4.06Å; Y28-L54 HydrophobicContact CD2-CD2 3.98Å; Y28-L54 HydrophobicContact CE1-CD2 4.06Å; Y28-L54 HydrophobicContact CE2-CD2 3.43Å; Y28-L54 VanDerWaalsContact CE2-CD2 3.43Å; Y28-L54 HydrophobicContact CG-CD2 4.49Å; Y28-L54 VanDerWaalsContact CZ-CD2 3.48Å; Y28-F57 HydrophobicContact CE1-CD1 4.13Å; Y28-F57 HydrophobicContact CE1-CE1 4.32Å
29	L	97.3	Very high	96.2	Very high	14 Å²	14	88.6 Å²	88.6	7%	0.073	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	104.2	173	-176.5	62.1	0	0	0	108.6	E17 K18 N40 T41 W42	E17-L29 HydrophobicContact CB-CD2 4.17Å; E17-L29 HydrophobicContact CB-CG 4.35Å; E17-L29 PolarHBondContact N-O 3.46Å; K18-L29 HydrophobicContact CB-CB 3.89Å; K18-L29 HydrophobicContact CB-CD2 4.22Å; K18-L29 HydrophobicContact CD-CD2 3.82Å; K18-L29 HydrophobicContact CG-CD2 4.07Å; K18-L29 PolarHBondContact O-N 3.19Å; L29-N40 HydrophobicContact CD1-CB 3.6Å; L29-N40 WeakPolarHBondContact CD1-O 3.26Å; L29-N40 HydrophobicContact CG-CB 4.01Å; L29-T41 WeakPolarHBondContact CA-O 3.45Å; L29-W42 HydrophobicContact CB-CD2 4.09Å; L29-W42 HydrophobicContact CB-CE3 3.99Å; L29-W42 HydrophobicContact CB-CH2 3.86Å; L29-W42 HydrophobicContact CB-CZ2 3.93Å; L29-W42 HydrophobicContact CB-CZ3 3.86Å; L29-W42 HydrophobicContact CD1-CD2 4.23Å; L29-W42 HydrophobicContact CD1-CG 4.35Å; L29-W42 HydrophobicContact CD1-CZ2 4.4Å; L29-W42 HydrophobicContact CD2-CZ2 4.27Å; L29-W42 HydrophobicContact CG-CZ2 4.44Å
30	V	97.6	Very high	96.3	Very high	0 Å²	0	85.9 Å²	85.9	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.2	-175.5	174.8	0	0	0	0	110.3	V13 Y28 W32 N40 T41 E43 I48	V13-V30 HydrophobicContact CB-CG1 4.28Å; V13-V30 HydrophobicContact CG1-CG1 3.8Å; V13-V30 HydrophobicContact CG2-CG1 3.55Å; Y28-V30 PolarHBondContact O-N 3.36Å; V30-W32 HydrophobicContact CB-CZ2 4.22Å; V30-W32 HydrophobicContact CG1-CD2 3.74Å; V30-W32 HydrophobicContact CG1-CE3 3.77Å; V30-W32 HydrophobicContact CG1-CG 4.44Å; V30-W32 HydrophobicContact CG1-CH2 3.87Å; V30-W32 HydrophobicContact CG1-CZ2 3.84Å; V30-W32 HydrophobicContact CG1-CZ3 3.82Å; V30-N40 WeakPolarHBondContact O-CA 3.4Å; V30-N40 WeakPolarHBondContact O-CB 3.5Å; V30-N40 PolarHBondContact O-OD1 3.23Å; V30-T41 PolarHBondContact N-O 3.19Å; V30-E43 HydrophobicContact CB-CG 4.11Å; V30-E43 HydrophobicContact CG2-CB 3.8Å; V30-E43 HydrophobicContact CG2-CG 3.58Å; V30-I48 HydrophobicContact CG2-CD1 3.75Å
31	K	97.6	Very high	96.3	Very high	43 Å²	43	84.5 Å²	84.5	19%	0.187	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	105.9	168.9	-171.3	-172.8	177.5	-164.7	0	109.5	E14 G15 E17 N40	E14-K31 HydrophobicContact CB-CD 4.37Å; E14-K31 HydrophobicContact CB-CG 4.46Å; E14-K31 PolarHBondContact N-O 2.95Å; E14-K31 IonicContact OE1-NZ 3.21Å; E14-K31 PolarHBondContact OE1-NZ 2.98Å; E14-K31 WeakPolarHBondContact OE2-CE 3.49Å; E14-K31 IonicContact OE2-NZ 3.31Å; E14-K31 PolarHBondContact OE2-NZ 2.79Å; G15-K31 WeakPolarHBondContact O-CB 3.32Å; G15-K31 PolarHBondContact O-N 2.96Å; E17-K31 HydrophobicContact CG-CB 4.27Å; K31-N40 WeakPolarHBondContact CA-OD1 3.48Å
32	W	96.8	Very high	96.3	Very high	44 Å²	44	82.4 Å²	82.4	17%	0.167	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	134.6	-179.2	-60.2	114.2	0	0	0	111.8	F11 V13 V30 G34 W35 T41 E43	F11-W32 HydrophobicContact CB-CE3 3.81Å; F11-W32 HydrophobicContact CB-CH2 4.45Å; F11-W32 HydrophobicContact CB-CZ3 3.62Å; V13-W32 HydrophobicContact CG2-CE3 3.78Å; V13-W32 HydrophobicContact CG2-CH2 4.46Å; V13-W32 HydrophobicContact CG2-CZ3 3.53Å; V30-W32 HydrophobicContact CB-CZ2 4.22Å; V30-W32 HydrophobicContact CG1-CD2 3.74Å; V30-W32 HydrophobicContact CG1-CE3 3.77Å; V30-W32 HydrophobicContact CG1-CG 4.44Å; V30-W32 HydrophobicContact CG1-CH2 3.87Å; V30-W32 HydrophobicContact CG1-CZ2 3.84Å; V30-W32 HydrophobicContact CG1-CZ3 3.82Å; W32-G34 PolarHBondContact O-N 3.44Å; W32-W35 HydrophobicContact CB-CB 4.02Å; W32-W35 HydrophobicContact CB-CG 4.06Å; W32-W35 PolarHBondContact O-N 3.48Å; W32-T41 WeakPolarHBondContact CZ2-OG1 3.49Å; W32-T41 PolarHBondContact NE1-OG1 3.5Å; W32-E43 HydrophobicContact CH2-CG 4.12Å; W32-E43 HydrophobicContact CZ2-CG 3.82Å
33	R	96.3	Very high	96.3	Very high	179 Å²	179	77.4 Å²	77.4	68%	0.675	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	125.5	-176.2	-173.6	-177.1	178.5	-152	-1.2	110.3	A12 E14 W35	A12-R33 HydrophobicContact CB-CB 3.96Å; A12-R33 VanDerWaalsContact O-CB 3.25Å; A12-R33 WeakPolarHBondContact O-CB 3.49Å; A12-R33 PolarHBondContact O-N 3.28Å; E14-R33 HydrophobicContact CB-CB 4.47Å; R33-W35 VanDerWaalsContact C-N 3.3Å
34	G	95.9	Very high	96.4	Very high	81 Å²	81	69.1 Å²	69.1	84%	0.835	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-6.2	-178.7	0	0	0	0	0	115	W32	W32-G34 PolarHBondContact O-N 3.44Å
35	W	95.5	Very high	96.4	Very high	155 Å²	155	69.2 Å²	69.2	59%	0.587	34%	0.335	S	S	*	.	S	Bend	trans	-99	153.8	176.9	-65.8	82.5	0	0	0	111.6	W32 R33 Y39	W32-W35 HydrophobicContact CB-CB 4.02Å; W32-W35 HydrophobicContact CB-CG 4.06Å; W32-W35 PolarHBondContact O-N 3.48Å; R33-W35 VanDerWaalsContact C-N 3.3Å; W35-Y39 AromaticContact CE3-CD2 3.82Å; W35-Y39 HydrophobicContact CE3-CD2 3.82Å; W35-Y39 HydrophobicContact CE3-CE2 4.28Å; W35-Y39 HydrophobicContact CE3-CG 4.12Å
36	S	96.4	Very high	96.2	Very high	46 Å²	46	70.3 Å²	70.3	32%	0.322	34%	0.342	S	S	.	.			trans	-72.6	149.1	174	89.8	0	0	0	0	111.1	K38 Y39	S36-K38 PolarHBondContact O-N 3.21Å; S36-K38 WeakPolarHBondContact OG-CB 3.44Å; S36-K38 PolarHBondContact OG-N 3.02Å; S36-Y39 PolarHBondContact O-N 3.3Å; S36-Y39 WeakPolarHBondContact OG-CD2 3.38Å
37	P	95.2	Very high	96.2	Very high	76 Å²	76	72.5 Å²	72.5	49%	0.494	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-56.3	-11.3	178.1	-27.8	35.2	0	0	0	116.3	Y39 N40	P37-Y39 PolarHBondContact O-N 2.88Å; P37-N40 WeakPolarHBondContact CA-OD1 3.38Å; P37-N40 VanDerWaalsContact O-CG 3.3Å; P37-N40 PolarHBondContact O-N 3.11Å; P37-N40 PolarHBondContact O-ND2 3.4Å
38	K	96	Very high	96	Very high	190 Å²	190	72 Å²	72	83%	0.826	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-66.6	-23.5	173	-57.7	179.7	-179.6	179	0	112.9	S36	S36-K38 PolarHBondContact O-N 3.21Å; S36-K38 WeakPolarHBondContact OG-CB 3.44Å; S36-K38 PolarHBondContact OG-N 3.02Å
39	Y	95.7	Very high	95.9	Very high	140 Å²	140	77.7 Å²	77.7	55%	0.549	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-100.2	11.5	-178.4	-57.5	-69.7	0	0	0	113.2	W35 S36 P37 T41	W35-Y39 AromaticContact CE3-CD2 3.82Å; W35-Y39 HydrophobicContact CE3-CD2 3.82Å; W35-Y39 HydrophobicContact CE3-CE2 4.28Å; W35-Y39 HydrophobicContact CE3-CG 4.12Å; S36-Y39 PolarHBondContact O-N 3.3Å; S36-Y39 WeakPolarHBondContact OG-CD2 3.38Å; P37-Y39 PolarHBondContact O-N 2.88Å; Y39-T41 PolarHBondContact O-N 3.19Å
40	N	96.9	Very high	95.8	Very high	21 Å²	21	79.2 Å²	79.2	11%	0.112	39%	0.391	C	S	.	.			trans	-67.4	120.4	179.2	-69	-0.2	0	0	0	110.6	E17 L29 V30 K31 P37	E17-N40 PolarHBondContact OE1-ND2 2.99Å; E17-N40 PolarHBondContact OE2-ND2 3.12Å; L29-N40 HydrophobicContact CD1-CB 3.6Å; L29-N40 WeakPolarHBondContact CD1-O 3.26Å; L29-N40 HydrophobicContact CG-CB 4.01Å; V30-N40 WeakPolarHBondContact O-CA 3.4Å; V30-N40 WeakPolarHBondContact O-CB 3.5Å; V30-N40 PolarHBondContact O-OD1 3.23Å; K31-N40 WeakPolarHBondContact CA-OD1 3.48Å; P37-N40 WeakPolarHBondContact CA-OD1 3.38Å; P37-N40 VanDerWaalsContact O-CG 3.3Å; P37-N40 PolarHBondContact O-N 3.11Å; P37-N40 PolarHBondContact O-ND2 3.4Å
41	T	97	Very high	95.6	Very high	56 Å²	56	83.2 Å²	83.2	34%	0.344	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	163.5	-178.9	55.5	0	0	0	0	111.9	L29 V30 W32 Y39 E43	L29-T41 WeakPolarHBondContact CA-O 3.45Å; V30-T41 PolarHBondContact N-O 3.19Å; W32-T41 WeakPolarHBondContact CZ2-OG1 3.49Å; W32-T41 PolarHBondContact NE1-OG1 3.5Å; Y39-T41 PolarHBondContact O-N 3.19Å; T41-E43 VanDerWaalsContact CB-OE1 3.24Å; T41-E43 WeakPolarHBondContact CB-OE1 3.27Å; T41-E43 PolarHBondContact OG1-OE1 3.12Å
42	W	97.3	Very high	95.5	Very high	81 Å²	81	89.9 Å²	89.9	31%	0.307	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	95.4	177.7	-75.7	94.6	0	0	0	109.9	K18 R20 E27 Y28 L29	K18-W42 HydrophobicContact CB-CH2 3.77Å; K18-W42 HydrophobicContact CB-CZ3 4.41Å; R20-W42 HydrophobicContact CB-CE3 4.43Å; R20-W42 HydrophobicContact CB-CH2 3.94Å; R20-W42 HydrophobicContact CB-CZ3 3.74Å; R20-W42 HydrophobicContact CG-CD2 4.31Å; R20-W42 HydrophobicContact CG-CE3 3.63Å; R20-W42 HydrophobicContact CG-CH2 3.95Å; R20-W42 HydrophobicContact CG-CZ3 3.44Å; R20-W42 VanDerWaalsContact CG-CZ3 3.44Å; R20-W42 VanDerWaalsContact CZ-CD2 3.44Å; R20-W42 VanDerWaalsContact NH1-CD1 3.31Å; E27-W42 HydrophobicContact CB-CE3 4.14Å; E27-W42 WeakPolarHBondContact O-CZ3 3.18Å; Y28-W42 CarbonylContact O-C 3.58Å; Y28-W42 WeakPolarHBondContact O-CA 3.43Å; L29-W42 HydrophobicContact CB-CD2 4.09Å; L29-W42 HydrophobicContact CB-CE3 3.99Å; L29-W42 HydrophobicContact CB-CH2 3.86Å; L29-W42 HydrophobicContact CB-CZ2 3.93Å; L29-W42 HydrophobicContact CB-CZ3 3.86Å; L29-W42 HydrophobicContact CD1-CD2 4.23Å; L29-W42 HydrophobicContact CD1-CG 4.35Å; L29-W42 HydrophobicContact CD1-CZ2 4.4Å; L29-W42 HydrophobicContact CD2-CZ2 4.27Å; L29-W42 HydrophobicContact CG-CZ2 4.44Å
43	E	96.1	Very high	95.5	Very high	37 Å²	37	89.3 Å²	89.3	17%	0.173	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	142.7	-179.6	-58.4	-50.8	129.8	0	0	110.9	E27 Y28 V30 W32 T41 N47 I48	E27-E43 CarbonylContact C-O 3.42Å; E27-E43 VanDerWaalsContact CA-O 3.27Å; E27-E43 WeakPolarHBondContact CA-O 3.45Å; Y28-E43 PolarHBondContact N-O 2.87Å; Y28-E43 PolarHBondContact O-N 2.76Å; V30-E43 HydrophobicContact CB-CG 4.11Å; V30-E43 HydrophobicContact CG2-CB 3.8Å; V30-E43 HydrophobicContact CG2-CG 3.58Å; W32-E43 HydrophobicContact CH2-CG 4.12Å; W32-E43 HydrophobicContact CZ2-CG 3.82Å; T41-E43 VanDerWaalsContact CB-OE1 3.24Å; T41-E43 WeakPolarHBondContact CB-OE1 3.27Å; T41-E43 PolarHBondContact OG1-OE1 3.12Å; E43-N47 HydrophobicContact CB-CB 4.14Å; E43-N47 PolarHBondContact OE2-ND2 3.1Å; E43-I48 HydrophobicContact CB-CD1 4.23Å
44	P	95.8	Very high	95.5	Very high	33 Å²	33	82.7 Å²	82.7	21%	0.214	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	156.8	171.3	30.1	-36.1	0	0	0	111.1	I26 E46 N47	I26-P44 WeakPolarHBondContact O-CA 3.49Å; P44-E46 HydrophobicContact CB-CB 4.44Å; P44-E46 PolarHBondContact O-N 3Å; P44-E46 VanDerWaalsContact O-N 3.15Å; P44-N47 HydrophobicContact CG-CB 4.08Å; P44-N47 PolarHBondContact O-N 3.34Å
45	E	94.3	Very high	95.5	Very high	71 Å²	71	83.4 Å²	83.4	33%	0.332	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-53.5	-32.8	173.1	-172.4	147	-122.2	0	0	112.6	I26 Y28 N47 I48	I26-E45 HydrophobicContact CB-CB 4.23Å; I26-E45 WeakPolarHBondContact CB-OE2 3.21Å; I26-E45 WeakPolarHBondContact CD1-OE2 3.15Å; I26-E45 HydrophobicContact CG2-CB 4.15Å; I26-E45 PolarHBondContact O-N 2.7Å; Y28-E45 HydrophobicContact CD2-CB 4.3Å; Y28-E45 HydrophobicContact CE2-CB 3.79Å; Y28-E45 HydrophobicContact CE2-CG 3.78Å; Y28-E45 VanDerWaalsContact CE2-OE1 3.28Å; Y28-E45 WeakPolarHBondContact CE2-OE1 3.39Å; Y28-E45 PolarHBondContact OH-OE1 3.3Å; E45-N47 VanDerWaalsContact C-N 3.27Å; E45-N47 PolarHBondContact O-N 3.42Å; E45-I48 PolarHBondContact O-N 3.11Å
46	E	93.1	Very high	95.5	Very high	127 Å²	127	78.6 Å²	78.6	59%	0.593	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-59.4	-27.5	174.4	-69.1	149.4	-122.6	0	0	114.2	K25 P44	K25-E46 WeakPolarHBondContact CD-OE1 3.22Å; K25-E46 WeakPolarHBondContact CE-OE1 3.31Å; K25-E46 IonicContact NZ-OE1 2.96Å; K25-E46 PolarHBondContact NZ-OE1 2.9Å; K25-E46 IonicContact NZ-OE2 3.91Å; K25-E46 PolarHBondContact NZ-OE2 2.95Å; P44-E46 HydrophobicContact CB-CB 4.44Å; P44-E46 PolarHBondContact O-N 3Å; P44-E46 VanDerWaalsContact O-N 3.15Å
47	N	94.4	Very high	95.5	Very high	89 Å²	89	77.1 Å²	77.1	48%	0.476	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-85.5	-8.9	179.6	-75.5	11.8	0	0	0	113.1	E43 P44 E45 L49	E43-N47 HydrophobicContact CB-CB 4.14Å; E43-N47 PolarHBondContact OE2-ND2 3.1Å; P44-N47 HydrophobicContact CG-CB 4.08Å; P44-N47 PolarHBondContact O-N 3.34Å; E45-N47 VanDerWaalsContact C-N 3.27Å; E45-N47 PolarHBondContact O-N 3.42Å; N47-L49 PolarHBondContact O-N 3.08Å; N47-L49 VanDerWaalsContact O-N 3.14Å
48	I	94.3	Very high	95.5	Very high	19 Å²	19	78.6 Å²	78.6	10%	0.097	39%	0.388	C	S	.	.			trans	-89.4	82	-173	-49.9	-58.1	0	0	0	110.8	I16 Y28 V30 E43 E45 D50 L53 L54	I16-I48 HydrophobicContact CD1-CD1 4.48Å; I16-I48 HydrophobicContact CD1-CG2 4.17Å; Y28-I48 HydrophobicContact CD2-CG1 4.06Å; V30-I48 HydrophobicContact CG2-CD1 3.75Å; E43-I48 HydrophobicContact CB-CD1 4.23Å; E45-I48 PolarHBondContact O-N 3.11Å; I48-D50 VanDerWaalsContact C-N 3.29Å; I48-D50 PolarHBondContact O-N 3.46Å; I48-L53 HydrophobicContact CG2-CB 4.24Å; I48-L53 HydrophobicContact CG2-CD1 4.23Å; I48-L54 HydrophobicContact CB-CD2 4.29Å; I48-L54 HydrophobicContact CB-CG 4.49Å; I48-L54 HydrophobicContact CG1-CD2 4.39Å; I48-L54 HydrophobicContact CG2-CD1 4.35Å; I48-L54 HydrophobicContact CG2-CD2 3.92Å; I48-L54 HydrophobicContact CG2-CG 3.86Å
49	L	94.7	Very high	95.5	Very high	130 Å²	130	74.4 Å²	74.4	68%	0.681	37%	0.371	S	S	*	.			trans	-64.2	-24.6	-174.5	-55.5	-178	0	0	0	115	V10 N47 P51	V10-L49 HydrophobicContact CG1-CD1 3.98Å; V10-L49 HydrophobicContact CG2-CD1 3.88Å; N47-L49 PolarHBondContact O-N 3.08Å; N47-L49 VanDerWaalsContact O-N 3.14Å; L49-P51 WeakPolarHBondContact O-CD 3.31Å
50	D	94.7	Very high	95.4	Very high	46 Å²	46	73.3 Å²	73.3	25%	0.246	37%	0.366	C	S	.	.			trans	-103.7	106.5	178.1	-173.6	-10.6	0	0	0	111.6	I48 R52 L53	I48-D50 VanDerWaalsContact C-N 3.29Å; I48-D50 PolarHBondContact O-N 3.46Å; D50-R52 PolarHBondContact O-N 3.47Å; D50-R52 VanDerWaalsContact O-N 3.11Å; D50-R52 WeakPolarHBondContact OD1-CB 3.47Å; D50-R52 WeakPolarHBondContact OD1-CG 3.39Å; D50-R52 IonicContact OD1-CZ 3.55Å; D50-R52 PolarHBondContact OD1-N 2.92Å; D50-R52 IonicContact OD1-NE 3.92Å; D50-R52 PolarHBondContact OD1-NE 3.05Å; D50-R52 IonicContact OD1-NH2 3.99Å; D50-R52 IonicContact OD2-CZ 3.26Å; D50-R52 VanDerWaalsContact OD2-CZ 3.23Å; D50-R52 IonicContact OD2-NE 2.86Å; D50-R52 PolarHBondContact OD2-NE 2.99Å; D50-R52 IonicContact OD2-NH2 3.86Å; D50-R52 PolarHBondContact OD2-NH2 3.01Å; D50-L53 HydrophobicContact CB-CD1 4.03Å; D50-L53 HydrophobicContact CB-CG 4.15Å; D50-L53 WeakPolarHBondContact O-CB 3.41Å; D50-L53 PolarHBondContact O-N 3.28Å; D50-L53 VanDerWaalsContact O-N 3.09Å
51	P	93.9	Very high	95.2	Very high	84 Å²	84	75.6 Å²	75.6	55%	0.545	38%	0.376	S	S	.	.	H	α-helix	trans	-65.4	-16.4	-179.2	27.7	-35.3	0	0	0	113.2	L49 L53 L54 V55	L49-P51 WeakPolarHBondContact O-CD 3.31Å; P51-L53 PolarHBondContact O-N 3.48Å; P51-L54 WeakPolarHBondContact O-CB 3.36Å; P51-L54 PolarHBondContact O-N 3.34Å; P51-V55 WeakPolarHBondContact O-CG2 3.31Å; P51-V55 PolarHBondContact O-N 3.31Å
52	R	96.3	Very high	95	Very high	183 Å²	183	79.8 Å²	79.8	69%	0.691	39%	0.386	S	S	*	.	H	α-helix	trans	-64.2	-29.9	174.8	-57.8	175	-63.6	-178	3.6	111.4	D50 A56	D50-R52 PolarHBondContact O-N 3.47Å; D50-R52 VanDerWaalsContact O-N 3.11Å; D50-R52 WeakPolarHBondContact OD1-CB 3.47Å; D50-R52 WeakPolarHBondContact OD1-CG 3.39Å; D50-R52 IonicContact OD1-CZ 3.55Å; D50-R52 PolarHBondContact OD1-N 2.92Å; D50-R52 IonicContact OD1-NE 3.92Å; D50-R52 PolarHBondContact OD1-NE 3.05Å; D50-R52 IonicContact OD1-NH2 3.99Å; D50-R52 IonicContact OD2-CZ 3.26Å; D50-R52 VanDerWaalsContact OD2-CZ 3.23Å; D50-R52 IonicContact OD2-NE 2.86Å; D50-R52 PolarHBondContact OD2-NE 2.99Å; D50-R52 IonicContact OD2-NH2 3.86Å; D50-R52 PolarHBondContact OD2-NH2 3.01Å; R52-A56 WeakPolarHBondContact O-CB 3.34Å; R52-A56 PolarHBondContact O-N 2.72Å
53	L	95.9	Very high	94.7	Very high	32 Å²	32	80.8 Å²	80.8	17%	0.168	39%	0.394	C	S	.	.	H	α-helix	trans	-64.9	-43.1	174	-61.9	171.5	0	0	0	111.2	V13 I16 I48 D50 P51 F57	V13-L53 HydrophobicContact CB-CD1 3.93Å; V13-L53 HydrophobicContact CG1-CD1 3.82Å; V13-L53 HydrophobicContact CG1-CD2 4.09Å; V13-L53 HydrophobicContact CG2-CD1 4.49Å; I16-L53 HydrophobicContact CD1-CB 4.05Å; I16-L53 HydrophobicContact CG1-CB 4.44Å; I48-L53 HydrophobicContact CG2-CB 4.24Å; I48-L53 HydrophobicContact CG2-CD1 4.23Å; D50-L53 HydrophobicContact CB-CD1 4.03Å; D50-L53 HydrophobicContact CB-CG 4.15Å; D50-L53 WeakPolarHBondContact O-CB 3.41Å; D50-L53 PolarHBondContact O-N 3.28Å; D50-L53 VanDerWaalsContact O-N 3.09Å; P51-L53 PolarHBondContact O-N 3.48Å; L53-F57 WeakPolarHBondContact O-CB 3.24Å; L53-F57 PolarHBondContact O-N 2.72Å
54	L	95.8	Very high	94.4	Very high	39 Å²	39	84.7 Å²	84.7	20%	0.204	41%	0.412	C	S	.	.	H	α-helix	trans	-66.3	-43.4	176.8	-60.1	174.7	0	0	0	111.5	I16 Y28 I48 P51 F57 Q58	I16-L54 HydrophobicContact CD1-CD2 3.79Å; Y28-L54 HydrophobicContact CD2-CD2 3.98Å; Y28-L54 HydrophobicContact CE1-CD2 4.06Å; Y28-L54 HydrophobicContact CE2-CD2 3.43Å; Y28-L54 VanDerWaalsContact CE2-CD2 3.43Å; Y28-L54 HydrophobicContact CG-CD2 4.49Å; Y28-L54 VanDerWaalsContact CZ-CD2 3.48Å; I48-L54 HydrophobicContact CB-CD2 4.29Å; I48-L54 HydrophobicContact CB-CG 4.49Å; I48-L54 HydrophobicContact CG1-CD2 4.39Å; I48-L54 HydrophobicContact CG2-CD1 4.35Å; I48-L54 HydrophobicContact CG2-CD2 3.92Å; I48-L54 HydrophobicContact CG2-CG 3.86Å; P51-L54 WeakPolarHBondContact O-CB 3.36Å; P51-L54 PolarHBondContact O-N 3.34Å; L54-F57 PolarHBondContact O-N 3.18Å; L54-Q58 WeakPolarHBondContact O-CB 3.41Å; L54-Q58 PolarHBondContact O-N 3.47Å
55	V	95.9	Very high	94	Very high	96 Å²	96	89.3 Å²	89.3	58%	0.582	43%	0.431	S	S	*	.	H	α-helix	trans	-64.6	-44.4	176.2	173.4	0	0	0	0	111.4	P51 F57 Q58 H59	P51-V55 WeakPolarHBondContact O-CG2 3.31Å; P51-V55 PolarHBondContact O-N 3.31Å; V55-F57 VanDerWaalsContact C-N 3.34Å; V55-F57 PolarHBondContact O-N 3.35Å; V55-Q58 PolarHBondContact O-N 3.43Å; V55-H59 VanDerWaalsContact O-CB 3.31Å; V55-H59 WeakPolarHBondContact O-CB 3.24Å; V55-H59 PolarHBondContact O-N 3.23Å
56	A	95.9	Very high	93.4	Very high	54 Å²	54	93.6 Å²	93.6	45%	0.446	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-39.3	176.4	0	0	0	0	0	112	R52 R60	R52-A56 WeakPolarHBondContact O-CB 3.34Å; R52-A56 PolarHBondContact O-N 2.72Å; A56-R60 WeakPolarHBondContact O-CB 3.48Å; A56-R60 PolarHBondContact O-N 2.95Å
57	F	96.2	Very high	92.8	Very high	16 Å²	16	92.9 Å²	92.9	7%	0.07	45%	0.451	C	S	.	.	H	α-helix	trans	-63.2	-52.4	172.8	177.1	-96.6	0	0	0	111.9	I16 K19 Y28 L53 L54 V55 H59 R60 E61	I16-F57 HydrophobicContact CB-CB 4.13Å; I16-F57 HydrophobicContact CB-CD2 4.1Å; I16-F57 HydrophobicContact CB-CG 4.28Å; I16-F57 HydrophobicContact CG2-CB 4.25Å; I16-F57 HydrophobicContact CG2-CD2 3.56Å; I16-F57 HydrophobicContact CG2-CE2 4.13Å; I16-F57 HydrophobicContact CG2-CG 3.86Å; K19-F57 HydrophobicContact CB-CE1 3.69Å; K19-F57 HydrophobicContact CB-CZ 3.71Å; K19-F57 HydrophobicContact CD-CE1 4.31Å; Y28-F57 HydrophobicContact CE1-CD1 4.13Å; Y28-F57 HydrophobicContact CE1-CE1 4.32Å; L53-F57 WeakPolarHBondContact O-CB 3.24Å; L53-F57 PolarHBondContact O-N 2.72Å; L54-F57 PolarHBondContact O-N 3.18Å; V55-F57 VanDerWaalsContact C-N 3.34Å; V55-F57 PolarHBondContact O-N 3.35Å; F57-H59 VanDerWaalsContact C-N 3.26Å; F57-H59 PolarHBondContact O-N 2.85Å; F57-R60 WeakPolarHBondContact O-CB 3.35Å; F57-R60 PolarHBondContact O-N 3.08Å; F57-R60 VanDerWaalsContact O-N 3.1Å; F57-E61 HydrophobicContact CE1-CB 4.28Å; F57-E61 HydrophobicContact CZ-CB 4.38Å; F57-E61 WeakPolarHBondContact O-CB 3.42Å; F57-E61 PolarHBondContact O-N 3.15Å
58	Q	95.6	Very high	91.3	Very high	107 Å²	107	91 Å²	91	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-35	-179.2	-166.8	-169.9	57.2	0	0	112	L54 V55 R62	L54-Q58 WeakPolarHBondContact O-CB 3.41Å; L54-Q58 PolarHBondContact O-N 3.47Å; V55-Q58 PolarHBondContact O-N 3.43Å; Q58-R62 VanDerWaalsContact O-CB 3.31Å; Q58-R62 WeakPolarHBondContact O-CB 3.32Å; Q58-R62 PolarHBondContact O-N 2.55Å
59	H	95.5	Very high	89.4	Confident	101 Å²	101	100.1 Å²	100.1	47%	0.468	49%	0.487	S	S	.	.	H	α-helix	trans	-66.2	-44.8	173.9	-174.4	-113.8	0	0	0	111.7	V55 F57 R62 Q63	V55-H59 VanDerWaalsContact O-CB 3.31Å; V55-H59 WeakPolarHBondContact O-CB 3.24Å; V55-H59 PolarHBondContact O-N 3.23Å; F57-H59 VanDerWaalsContact C-N 3.26Å; F57-H59 PolarHBondContact O-N 2.85Å; H59-R62 PolarHBondContact O-N 2.87Å; H59-Q63 PolarHBondContact CE1-NE2 3.26Å; H59-Q63 WeakPolarHBondContact O-CB 3.37Å; H59-Q63 WeakPolarHBondContact O-CG 3.41Å; H59-Q63 PolarHBondContact O-N 2.83Å
60	R	93.8	Very high	87.6	Confident	118 Å²	118	103.9 Å²	103.9	45%	0.445	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-45.9	174.5	-173.6	-171.3	-64.1	156.2	1	111.8	I16 A56 F57 R62 Q63 E64	I16-R60 PolarHBondContact O-NH1 3.46Å; A56-R60 WeakPolarHBondContact O-CB 3.48Å; A56-R60 PolarHBondContact O-N 2.95Å; F57-R60 WeakPolarHBondContact O-CB 3.35Å; F57-R60 PolarHBondContact O-N 3.08Å; F57-R60 VanDerWaalsContact O-N 3.1Å; R60-R62 PolarHBondContact O-N 3.12Å; R60-Q63 WeakPolarHBondContact O-CB 3.39Å; R60-Q63 PolarHBondContact O-N 3.06Å; R60-E64 WeakPolarHBondContact O-CB 3.35Å; R60-E64 PolarHBondContact O-N 3.42Å
61	E	92.9	Very high	85.8	Confident	69 Å²	69	110.6 Å²	110.6	32%	0.322	52%	0.519	S	S	.	.	H	α-helix	trans	-59.3	-46.1	177.7	-179.1	-179.4	-124.5	0	0	111.2	F57 E64 Q65	F57-E61 HydrophobicContact CE1-CB 4.28Å; F57-E61 HydrophobicContact CZ-CB 4.38Å; F57-E61 WeakPolarHBondContact O-CB 3.42Å; F57-E61 PolarHBondContact O-N 3.15Å; E61-E64 PolarHBondContact O-N 3.48Å; E61-Q65 WeakPolarHBondContact O-CG 3.25Å; E61-Q65 PolarHBondContact O-N 3.47Å
62	R	93.1	Very high	84.2	Confident	144 Å²	144	118.6 Å²	118.6	54%	0.543	54%	0.538	S	S	.	.	H	α-helix	trans	-62.8	-42	174.4	-171.8	-174.8	-59.3	167.3	4.9	112.2	Q58 H59 R60 M66	Q58-R62 VanDerWaalsContact O-CB 3.31Å; Q58-R62 WeakPolarHBondContact O-CB 3.32Å; Q58-R62 PolarHBondContact O-N 2.55Å; H59-R62 PolarHBondContact O-N 2.87Å; R60-R62 PolarHBondContact O-N 3.12Å; R62-M66 VanDerWaalsContact O-CG 3.24Å; R62-M66 WeakPolarHBondContact O-CG 3.48Å; R62-M66 PolarHBondContact O-N 3.25Å; R62-M66 VanDerWaalsContact O-N 3.14Å
63	Q	91.4	Very high	83	Confident	101 Å²	101	113.1 Å²	113.1	47%	0.472	54%	0.538	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174.5	-76.4	-177.2	-20.7	0	0	111.4	H59 R60 M66 M67	H59-Q63 PolarHBondContact CE1-NE2 3.26Å; H59-Q63 WeakPolarHBondContact O-CB 3.37Å; H59-Q63 WeakPolarHBondContact O-CG 3.41Å; H59-Q63 PolarHBondContact O-N 2.83Å; R60-Q63 WeakPolarHBondContact O-CB 3.39Å; R60-Q63 PolarHBondContact O-N 3.06Å; Q63-M66 PolarHBondContact O-N 3.35Å; Q63-M66 VanDerWaalsContact O-N 3.16Å; Q63-M67 WeakPolarHBondContact O-CG 3.4Å; Q63-M67 PolarHBondContact O-N 3.18Å
64	E	88.5	Confident	81.5	Confident	120 Å²	120	117.8 Å²	117.8	56%	0.561	57%	0.57	S	S	*	*	H	α-helix	trans	-63.7	-43.4	179	-171.2	161.7	-163.4	0	0	112.2	R60 E61 M66 M67 G68	R60-E64 WeakPolarHBondContact O-CB 3.35Å; R60-E64 PolarHBondContact O-N 3.42Å; E61-E64 PolarHBondContact O-N 3.48Å; E64-M66 VanDerWaalsContact C-N 3.29Å; E64-M66 PolarHBondContact O-N 3.18Å; E64-M67 HydrophobicContact CB-CE 4Å; E64-M67 HydrophobicContact CG-CE 4.33Å; E64-M67 PolarHBondContact O-N 3.11Å; E64-G68 WeakPolarHBondContact O-CA 3.38Å; E64-G68 PolarHBondContact O-N 2.88Å
65	Q	87.4	Confident	79.9	Confident	130 Å²	130	125 Å²	125	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-57.6	-40.7	171.7	-70	171.7	17.1	0	0	112	E61	E61-Q65 WeakPolarHBondContact O-CG 3.25Å; E61-Q65 PolarHBondContact O-N 3.47Å
66	M	82.8	Confident	78.1	Confident	160 Å²	160	126 Å²	126	79%	0.788	61%	0.609	S	S	*	*	H	α-helix	trans	-70.6	-33.3	178.4	-68.9	-73.4	-78	0	0	113.4	R62 Q63 E64	R62-M66 VanDerWaalsContact O-CG 3.24Å; R62-M66 WeakPolarHBondContact O-CG 3.48Å; R62-M66 PolarHBondContact O-N 3.25Å; R62-M66 VanDerWaalsContact O-N 3.14Å; Q63-M66 PolarHBondContact O-N 3.35Å; Q63-M66 VanDerWaalsContact O-N 3.16Å; E64-M66 VanDerWaalsContact C-N 3.29Å; E64-M66 PolarHBondContact O-N 3.18Å
67	M	79.3	Confident	76.5	Confident	113 Å²	113	132.6 Å²	132.6	56%	0.557	63%	0.627	S	S	*	*	H	α-helix	trans	-91.7	-12.5	177.9	65.7	-175	158.6	0	0	114.8	Q63 E64 Y69 R70	Q63-M67 WeakPolarHBondContact O-CG 3.4Å; Q63-M67 PolarHBondContact O-N 3.18Å; E64-M67 HydrophobicContact CB-CE 4Å; E64-M67 HydrophobicContact CG-CE 4.33Å; E64-M67 PolarHBondContact O-N 3.11Å; M67-Y69 PolarHBondContact O-N 2.98Å; M67-Y69 VanDerWaalsContact O-N 3.09Å; M67-R70 PolarHBondContact O-N 3.09Å
68	G	63.8	Low	74.4	Confident	48 Å²	48	139 Å²	139	50%	0.495	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-55.7	-30.4	-172.8	0	0	0	0	0	115.4	E64 R70	E64-G68 WeakPolarHBondContact O-CA 3.38Å; E64-G68 PolarHBondContact O-N 2.88Å; G68-R70 PolarHBondContact O-N 3.02Å
69	Y	53.9	Low	72.6	Confident	212 Å²	212	141.5 Å²	141.5	83%	0.831	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-66.8	-0	179.9	-73.4	-74.3	0	0	0	115.8	M67	M67-Y69 PolarHBondContact O-N 2.98Å; M67-Y69 VanDerWaalsContact O-N 3.09Å
70	R	57.4	Low	70.7	Confident	209 Å²	209	143.5 Å²	143.5	79%	0.789	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-118.2	-1.7	-169.9	-64.9	-56.5	-168.4	-163.5	3.5	117.1	M67 G68	M67-R70 PolarHBondContact O-N 3.09Å; G68-R70 PolarHBondContact O-N 3.02Å
71	K	57.6	Low	69	Low	187 Å²	187	145 Å²	145	81%	0.813	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	-27.2	-169.8	-69.5	-64.7	-179.7	178.6	0	119.3
72	R	59.8	Low	67.3	Low	252 Å²	252	150.5 Å²	150.5	95%	0.951	73%	0.728	S	S	*	*	S	Bend	trans	-140.5	108.3	173.6	-68.6	-168.8	179.1	-178.5	1.2	112.8
73	G	71	Confident	65.7	Low	67 Å²	67	148 Å²	148	69%	0.691	73%	0.728	S	S	*	*	S	Bend	trans	157.8	151.2	178.2	0	0	0	0	0	109.5	K75	G73-K75 PolarHBondContact O-N 3.44Å
74	P	64.8	Low	64.4	Low	130 Å²	130	146.7 Å²	146.7	84%	0.844	73%	0.729	S	S	*	*			trans	-54	136.2	167.8	-22.4	33.6	0	0	0	109.1
75	K	62.3	Low	63.1	Low	191 Å²	191	145.7 Å²	145.7	83%	0.83	74%	0.735	S	S	*	*			trans	-50.2	130	171	-69	179.8	-178.2	176.7	0	107.1	G73 K77	G73-K75 PolarHBondContact O-N 3.44Å; K75-K77 PolarHBondContact O-N 3.2Å
76	P	58.1	Low	61.9	Low	117 Å²	117	147.2 Å²	147.2	76%	0.76	74%	0.74	S	S	*	*			trans	-55.8	113.3	169.5	23.5	-31.7	0	0	0	106.1	H78	P76-H78 PolarHBondContact O-N 3.14Å; P76-H78 VanDerWaalsContact O-N 3.13Å
77	K	60.9	Low	60.5	Low	193 Å²	193	142.6 Å²	142.6	84%	0.839	73%	0.727	S	S	*	*			trans	-52.4	126.9	171.8	-72.2	-177.5	179.3	178.8	0	104.8	K75 L79	K75-K77 PolarHBondContact O-N 3.2Å; K77-L79 PolarHBondContact O-N 3.3Å
78	H	52.9	Low	59.5	Low	151 Å²	151	148 Å²	148	70%	0.699	74%	0.742	S	S	*	*			trans	-48.5	112.7	178.9	176.9	-76.5	0	0	0	106.9	P76 L80	P76-H78 PolarHBondContact O-N 3.14Å; P76-H78 VanDerWaalsContact O-N 3.13Å; H78-L80 PolarHBondContact ND1-N 2.87Å; H78-L80 VanDerWaalsContact ND1-N 3.19Å; H78-L80 PolarHBondContact O-N 3.38Å
79	L	57	Low	59	Low	158 Å²	158	156.3 Å²	156.3	83%	0.827	76%	0.758	S	S	*	*			trans	-66.8	87.4	170.7	-76.3	173.8	0	0	0	104.6	K77 L81	K77-L79 PolarHBondContact O-N 3.3Å; L79-L81 VanDerWaalsContact C-N 3.35Å; L79-L81 PolarHBondContact O-N 3.28Å
80	L	55.5	Low	59.2	Low	143 Å²	143	151.7 Å²	151.7	75%	0.749	76%	0.756	S	S	*	*			trans	-47.9	113.2	157.7	-73.3	172.6	0	0	0	103.8	H78 Q82	H78-L80 PolarHBondContact ND1-N 2.87Å; H78-L80 VanDerWaalsContact ND1-N 3.19Å; H78-L80 PolarHBondContact O-N 3.38Å; L80-Q82 PolarHBondContact O-N 2.89Å
81	L	59.5	Low	58.8	Low	150 Å²	150	149.3 Å²	149.3	79%	0.785	76%	0.759	S	S	*	*			trans	-44.5	123.4	176.6	-67.4	164.5	0	0	0	105.9	L79 V83	L79-L81 VanDerWaalsContact C-N 3.35Å; L79-L81 PolarHBondContact O-N 3.28Å; L81-V83 HydrophobicContact CB-CG2 4.13Å; L81-V83 WeakPolarHBondContact O-CG2 3.43Å; L81-V83 PolarHBondContact O-N 3.07Å
82	Q	55.5	Low	58.4	Low	185 Å²	185	148 Å²	148	86%	0.864	76%	0.76	S	S	*	*			trans	-73.7	70.5	175.5	-172.7	173.8	-10.3	0	0	107.1	L80 P84	L80-Q82 PolarHBondContact O-N 2.89Å; Q82-P84 WeakPolarHBondContact O-CD 3.49Å; Q82-P84 VanDerWaalsContact O-N 3.15Å
83	V	60.9	Low	58.1	Low	90 Å²	90	141.9 Å²	141.9	55%	0.545	75%	0.752	S	S	.	*			trans	-56.4	119.2	174	-170.2	0	0	0	0	105.1	L81 S85 A87	L81-V83 HydrophobicContact CB-CG2 4.13Å; L81-V83 WeakPolarHBondContact O-CG2 3.43Å; L81-V83 PolarHBondContact O-N 3.07Å; V83-S85 PolarHBondContact O-N 3.4Å; V83-A87 HydrophobicContact CG1-CB 3.55Å
84	P	63.8	Low	56.5	Low	75 Å²	75	143.7 Å²	143.7	49%	0.487	76%	0.761	S	S	.	*			trans	-56.4	142.8	-171.6	-27.6	35.1	0	0	0	111.3	Q82 F86 A87	Q82-P84 WeakPolarHBondContact O-CD 3.49Å; Q82-P84 VanDerWaalsContact O-N 3.15Å; P84-F86 HydrophobicContact CB-CD1 3.73Å; P84-F86 HydrophobicContact CB-CE1 3.69Å; P84-F86 HydrophobicContact CG-CE1 4.16Å; P84-F86 PolarHBondContact O-N 3.29Å; P84-A87 PolarHBondContact O-N 3.5Å
85	S	60.2	Low	55	Low	98 Å²	98	141.2 Å²	141.2	69%	0.685	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-57.7	-14.5	-163.8	-48.5	0	0	0	0	115.6	V83 A87 R88	V83-S85 PolarHBondContact O-N 3.4Å; S85-A87 VanDerWaalsContact C-N 3.25Å; S85-A87 PolarHBondContact O-N 2.74Å; S85-R88 PolarHBondContact O-N 2.91Å
86	F	63.2	Low	53.9	Low	163 Å²	163	140.3 Å²	140.3	72%	0.715	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-59.8	-34.5	172.1	74.4	-104.4	0	0	0	112.5	P84 R88 R89	P84-F86 HydrophobicContact CB-CD1 3.73Å; P84-F86 HydrophobicContact CB-CE1 3.69Å; P84-F86 HydrophobicContact CG-CE1 4.16Å; P84-F86 PolarHBondContact O-N 3.29Å; F86-R88 PolarHBondContact O-N 2.96Å; F86-R89 PolarHBondContact O-N 2.82Å
87	A	54.1	Low	53	Low	62 Å²	62	142.7 Å²	142.7	51%	0.512	76%	0.764	S	S	.	*	G	3₁₀ helix	trans	-73	3	-177.8	0	0	0	0	0	114.6	V83 P84 S85	V83-A87 HydrophobicContact CG1-CB 3.55Å; P84-A87 PolarHBondContact O-N 3.5Å; S85-A87 VanDerWaalsContact C-N 3.25Å; S85-A87 PolarHBondContact O-N 2.74Å
88	R	56.3	Low	51.7	Low	228 Å²	228	142.9 Å²	142.9	86%	0.86	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-103	3.6	175.2	-77.7	-174.1	162.9	-159.3	-5.6	114.1	S85 F86 S90	S85-R88 PolarHBondContact O-N 2.91Å; F86-R88 PolarHBondContact O-N 2.96Å; R88-S90 PolarHBondContact O-N 3.01Å
89	R	53.3	Low	50.6	Low	221 Å²	221	141.7 Å²	141.7	83%	0.834	77%	0.771	S	S	*	*			trans	-95.2	74.9	-175.1	-72.3	-174.1	171.8	-100.5	2.8	113.9	F86	F86-R89 PolarHBondContact O-N 2.82Å
90	S	59.6	Low	49.7	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	77%	0.771	S	S	*	*			trans	-168.1	77.6	157.7	60.2	0	0	0	0	114.1	R88	R88-S90 PolarHBondContact O-N 3.01Å
91	N	49.2	Very low	48.6	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	77%	0.774	S	S	*	*			trans	-161.5	84.5	150.8	-163.5	11.4	0	0	0	112.9
92	I	49	Very low	47.3	Very low	160 Å²	160	141.9 Å²	141.9	82%	0.821	77%	0.773	S	S	*	*			trans	-151.1	131.6	171.8	-65.7	-173.4	0	0	0	102.7
93	P	52.3	Low	46.4	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	77%	0.766	S	S	*	*				-145.2	142.2	54.3	37.7	-17.8	0	0	0	118.9
94	A	37.5	Very low	45	Very low	105 Å²	105	142.5 Å²	142.5	87%	0.868	79%	0.785	S	S	*	*			trans	-177.6	137.9	136.3	0	0	0	0	0	107.9
95	G	34.8	Very low	43.5	Very low	79 Å²	79	142.3 Å²	142.3	81%	0.814	80%	0.797	S	S	*	*			cis	118.5	76.3	-8.6	0	0	0	0	0	114.3
96	L	38.2	Very low	42.2	Very low	172 Å²	172	143.4 Å²	143.4	90%	0.901	80%	0.8	S	S	*	*			trans	-156.9	139.5	148.8	-168	53.9	0	0	0	109.7
97	E	39.2	Very low	40.7	Very low	166 Å²	166	145.5 Å²	145.5	78%	0.776	81%	0.809	S	S	*	*			trans	-79.4	153.9	170.6	-64.2	-82.3	100.2	0	0	110
98	E	33	Very low	39.8	Very low	198 Å²	198	151.9 Å²	151.9	93%	0.925	83%	0.825	S	S	*	*			trans	-144.2	100.7	161.2	-160.6	163.5	-133	0	0	111.6
99	T	30.8	Very low	38.5	Very low	125 Å²	125	149.5 Å²	149.5	77%	0.767	83%	0.829	S	S	*	*			trans	-107.7	137.7	167.5	49.9	0	0	0	0	109.6
100	V	38.2	Very low	37.3	Very low	138 Å²	138	145.8 Å²	145.8	84%	0.836	83%	0.826	S	S	*	*			trans	-66.8	131.2	-176.5	177.8	0	0	0	0	112.3
101	Q	32	Very low	36.6	Very low	173 Å²	173	145.1 Å²	145.1	81%	0.808	82%	0.818	S	S	*	*			trans	-171.2	125.1	133	-107.5	170.7	-21.4	0	0	115.9
102	D	32.5	Very low	35.7	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	81%	0.809	S	S	*	*			trans	51.3	150	138.4	-71.5	-46	0	0	0	126.7
103	A	36	Very low	35	Very low	86 Å²	86	142.6 Å²	142.6	71%	0.711	81%	0.805	S	S	*	*			trans	80.8	107.5	147	0	0	0	0	0	122.6
104	E	32	Very low	34.2	Very low	202 Å²	202	147.9 Å²	147.9	94%	0.944	81%	0.809	S	S	*	*			trans	61.8	157.1	136.1	-58.7	-159.3	150.5	0	0	123.3
105	G	31.8	Very low	34.4	Very low	72 Å²	72	148.9 Å²	148.9	74%	0.742	81%	0.806	S	S	*	*			trans	109.7	56.5	131.2	0	0	0	0	0	119.3
106	T	32.2	Very low	34.3	Very low	121 Å²	121	153.5 Å²	153.5	74%	0.742	81%	0.807	S	S	*	*			trans	-11.7	125.4	153.8	-57.4	0	0	0	0	117
107	F	31.9	Very low	34.1	Very low	207 Å²	207	151.4 Å²	151.4	91%	0.908	80%	0.803	S	S	*	*				-166.5	157.3	125.5	-91.9	-57.3	0	0	0	112
108	K	35.1	Very low	33.9	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	81%	0.807	S	S	*	*			trans	-93.2	141.4	178.3	-67.4	-179.3	177.7	179.8	0	111
109	L	30.3	Very low	33.9	Very low	179 Å²	179	150.9 Å²	150.9	94%	0.937	80%	0.801	S	S	*	*				-173.8	145	114.5	-97.9	157.6	0	0	0	112
110	D	28.5	Very low	33.9	Very low	143 Å²	143	154.4 Å²	154.4	77%	0.765	80%	0.801	S	S	*	*			trans	-93.8	175.2	169.6	-144.4	26.1	0	0	0	107.4
111	P	44.6	Very low	34.2	Very low	100 Å²	100	156.5 Å²	156.5	65%	0.649	80%	0.802	S	S	*	*			cis	-143.5	-171.1	10.7	27.8	-0.4	0	0	0	117.5
112	V	30.7	Very low	34.3	Very low	107 Å²	107	156.1 Å²	156.1	65%	0.648	81%	0.805	S	S	*	*			trans	114.8	115	141.4	-170.6	0	0	0	0	119.6
113	Q	33.2	Very low	34.8	Very low	159 Å²	159	155.2 Å²	155.2	74%	0.743	80%	0.8	S	S	*	*			trans	75.7	105.3	151.4	-77.3	173.2	82.9	0	0	124
114	R	36.6	Very low	35	Very low	234 Å²	234	157.1 Å²	157.1	88%	0.883	81%	0.808	S	S	*	*			trans	-79.4	169.7	138.1	-107.5	178.2	-168.7	169	4.9	109.9
115	P	41.7	Very low	35.7	Very low	126 Å²	126	156 Å²	156	82%	0.818	80%	0.8	S	S	*	*				-152.7	-177.9	56	41.6	-19.2	0	0	0	118.9
116	Q	31.6	Very low	36.4	Very low	177 Å²	177	161 Å²	161	83%	0.827	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.1	160	174	-77.8	-178.1	-28.8	0	0	114.1
117	P	34.7	Very low	36.9	Very low	127 Å²	127	164.7 Å²	164.7	83%	0.825	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.5	158.3	168.9	34.4	-35.1	0	0	0	113.9
118	Q	33.6	Very low	37.3	Very low	181 Å²	181	163 Å²	163	85%	0.846	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-87.8	161	-168.8	-59.9	148.3	-16.1	0	0	113.8
119	H	34.1	Very low	37.2	Very low	172 Å²	172	161.6 Å²	161.6	80%	0.796	80%	0.801	S	S	*	*			trans	-110.3	131.1	162.3	178.5	-81.6	0	0	0	110.2
120	Y	31.4	Very low	37.1	Very low	199 Å²	199	163.8 Å²	163.8	78%	0.78	80%	0.798	S	S	*	*			trans	-68.2	142.7	-178.6	-93.2	-111.7	0	0	0	112.8
121	Q	44.2	Very low	37.5	Very low	183 Å²	183	164.4 Å²	164.4	86%	0.855	80%	0.797	S	S	*	*			trans	-125.3	127.5	162.3	-71.6	-168.7	2.5	0	0	109.8
122	L	33	Very low	37.1	Very low	165 Å²	165	165.4 Å²	165.4	86%	0.864	80%	0.803	S	S	*	*			trans	-109.6	85.3	180	-123.1	172.8	0	0	0	111.1
123	N	44	Very low	37	Very low	124 Å²	124	167.3 Å²	167.3	66%	0.663	81%	0.809	S	S	*	*			trans	24	108.6	144	-178.5	9.9	0	0	0	118.4	K125	N123-K125 WeakPolarHBondContact OD1-CB 3.19Å; N123-K125 PolarHBondContact OD1-N 3.05Å; N123-K125 VanDerWaalsContact OD1-N 3.14Å
124	S	40.5	Very low	37	Very low	127 Å²	127	164.7 Å²	164.7	89%	0.888	81%	0.809	S	S	*	*			trans	-122.2	97	148.6	52.6	0	0	0	0	110.6
125	K	46.7	Very low	36.8	Very low	177 Å²	177	162.1 Å²	162.1	77%	0.77	81%	0.807	S	S	*	*			trans	-78.3	156.5	-179.4	-157.5	167.5	-175.8	172.1	0	111.6	N123	N123-K125 WeakPolarHBondContact OD1-CB 3.19Å; N123-K125 PolarHBondContact OD1-N 3.05Å; N123-K125 VanDerWaalsContact OD1-N 3.14Å
126	K	46.8	Very low	36.4	Very low	177 Å²	177	164.6 Å²	164.6	77%	0.77	81%	0.807	S	S	*	*			trans	83.6	84.4	170.4	-49	-179.7	-176.2	-177.2	0	117.3
127	H	41.7	Very low	36.8	Very low	199 Å²	199	162.3 Å²	162.3	92%	0.921	80%	0.799	S	S	*	*			trans	-105.1	141.1	135.4	-83.2	-82.3	0	0	0	108.4
128	H	39.8	Very low	37	Very low	173 Å²	173	162 Å²	162	80%	0.801	80%	0.797	S	S	*	*			trans	-84.4	134.1	175.8	-76	-94.3	0	0	0	110.6	Y130	H128-Y130 PolarHBondContact O-N 2.77Å
129	Q	33.5	Very low	36.9	Very low	165 Å²	165	156.5 Å²	156.5	77%	0.771	78%	0.783	S	S	*	*			trans	-84.6	108.7	177.9	-179.4	179.8	4.9	0	0	109.9	Q131	Q129-Q131 HydrophobicContact CG-CG 4.44Å
130	Y	27.9	Very low	36.8	Very low	225 Å²	225	156.3 Å²	156.3	88%	0.882	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.6	119.5	160.9	-101.7	-87	0	0	0	108.8	H128	H128-Y130 PolarHBondContact O-N 2.77Å
131	Q	37.5	Very low	37	Very low	156 Å²	156	151.1 Å²	151.1	73%	0.729	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-81.2	130.6	175	-68.1	175.6	-27.6	0	0	110	Q129	Q129-Q131 HydrophobicContact CG-CG 4.44Å
132	P	36.6	Very low	36.5	Very low	120 Å²	120	149.8 Å²	149.8	78%	0.779	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.8	116.5	159.7	31.2	-28.7	0	0	0	108.4
133	N	28.9	Very low	36.5	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81.3	122.2	170.6	-171.9	10.6	0	0	0	109.5
134	S	31.4	Very low	36.1	Very low	104 Å²	104	149.4 Å²	149.4	73%	0.727	78%	0.783	S	S	*	*			trans	-136.8	113.9	176.3	57.1	0	0	0	0	109.2
135	Q	32.7	Very low	35.8	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	78%	0.778	S	S	*	*			trans	-128.8	115.3	-178.8	-168.6	167.1	-1.3	0	0	110.1
136	E	34.5	Very low	35.8	Very low	178 Å²	178	150 Å²	150	83%	0.832	78%	0.784	S	S	*	*			trans	-143.9	158.1	-178.4	-55.5	-174.5	161.1	0	0	106.7
137	I	38.6	Very low	36	Very low	129 Å²	129	150.9 Å²	150.9	66%	0.662	79%	0.788	S	S	*	*			cis	-150.6	153.8	4.1	-142.5	174.1	0	0	0	109.2
138	P	40	Very low	36.7	Very low	120 Å²	120	150.5 Å²	150.5	78%	0.779	78%	0.783	S	S	*	*				-114	126.2	116.9	-10.2	28.6	0	0	0	109.6
139	A	31.7	Very low	37	Very low	67 Å²	67	150.9 Å²	150.9	55%	0.554	78%	0.783	S	S	*	*				60	120.5	71.8	0	0	0	0	0	110.4
140	D	30.5	Very low	37.4	Very low	168 Å²	168	150.3 Å²	150.3	90%	0.898	78%	0.784	S	S	*	*			cis	-120.6	-178	46.3	-75.1	-50.5	0	0	0	118.5
141	A	36.2	Very low	38.3	Very low	90 Å²	90	149.5 Å²	149.5	74%	0.744	78%	0.781	S	S	*	*			trans	-57.1	153.3	-172.1	0	0	0	0	0	115.1
142	L	34.8	Very low	39.1	Very low	154 Å²	154	150.9 Å²	150.9	81%	0.806	79%	0.787	S	S	*	*				-174.3	147.8	58.2	-173.6	67.8	0	0	0	112.8
143	N	33.3	Very low	39.6	Very low	131 Å²	131	152.7 Å²	152.7	70%	0.701	79%	0.789	S	S	*	*			trans	42.5	103.1	161	-81.6	-40.8	0	0	0	122.5
144	N	34	Very low	40.5	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	79%	0.787	S	S	*	*				58.5	91.4	105.4	-165.5	-0.2	0	0	0	119.6
145	S	34.2	Very low	41.3	Very low	113 Å²	113	152.5 Å²	152.5	79%	0.79	79%	0.789	S	S	*	*			trans	-162.8	156.1	131.8	57.9	0	0	0	0	114.8	K147	S145-K147 PolarHBondContact O-N 2.83Å
146	K	46.9	Very low	42.5	Very low	205 Å²	205	152.4 Å²	152.4	89%	0.891	79%	0.786	S	S	*	*			trans	-42.9	103.5	-173.7	-61.8	162.2	-178.1	173.3	0	115.6	K148	K146-K148 PolarHBondContact O-N 2.97Å
147	K	50.9	Low	43.5	Very low	195 Å²	195	152.6 Å²	152.6	85%	0.848	78%	0.784	S	S	*	*			trans	-58.2	120.6	166.5	-75.5	-177.7	176.8	176.5	0	110.7	S145	S145-K147 PolarHBondContact O-N 2.83Å
148	K	56.1	Low	44.1	Very low	190 Å²	190	155.2 Å²	155.2	83%	0.826	79%	0.792	S	S	*	*			trans	-90.1	128.3	163.1	-70.4	-175.3	-179.9	178.5	0	108.9	K146 I150	K146-K148 PolarHBondContact O-N 2.97Å; K148-I150 PolarHBondContact O-N 2.66Å
149	F	46.3	Very low	45.1	Very low	182 Å²	182	157.3 Å²	157.3	80%	0.798	79%	0.792	S	S	*	*			trans	-73.3	96	171	-70.1	-83.7	0	0	0	110.2	Y151	F149-Y151 HydrophobicContact CB-CD2 4.45Å; F149-Y151 HydrophobicContact CB-CE2 4.27Å; F149-Y151 PolarHBondContact O-N 2.69Å
150	I	43.4	Very low	45.9	Very low	152 Å²	152	163.1 Å²	163.1	78%	0.779	81%	0.807	S	S	*	*			trans	-75.5	102.1	165	-61.1	176.9	0	0	0	106.9	K148 Q152	K148-I150 PolarHBondContact O-N 2.66Å; I150-Q152 VanDerWaalsContact C-N 3.34Å; I150-Q152 PolarHBondContact O-N 3.29Å
151	Y	45.2	Very low	47	Very low	209 Å²	209	165.1 Å²	165.1	82%	0.82	80%	0.803	S	S	*	*			trans	-68.5	95.5	167	-83	-91.9	0	0	0	108.6	F149 L153	F149-Y151 HydrophobicContact CB-CD2 4.45Å; F149-Y151 HydrophobicContact CB-CE2 4.27Å; F149-Y151 PolarHBondContact O-N 2.69Å; Y151-L153 VanDerWaalsContact C-N 3.33Å; Y151-L153 PolarHBondContact O-N 3.44Å
152	Q	54.1	Low	47.6	Very low	185 Å²	185	169.2 Å²	169.2	86%	0.864	81%	0.807	S	S	*	*			trans	-70.7	90.8	174.6	-166.3	172.7	26.7	0	0	108.7	I150 N154	I150-Q152 VanDerWaalsContact C-N 3.34Å; I150-Q152 PolarHBondContact O-N 3.29Å; Q152-N154 PolarHBondContact O-N 3.42Å; Q152-N154 VanDerWaalsContact O-N 3.12Å
153	L	47.4	Very low	48.5	Very low	158 Å²	158	166 Å²	166	83%	0.827	80%	0.795	S	S	*	*			trans	-64.1	114.2	-176.3	-165.6	75.1	0	0	0	109.5	Y151 S155	Y151-L153 VanDerWaalsContact C-N 3.33Å; Y151-L153 PolarHBondContact O-N 3.44Å; L153-S155 PolarHBondContact O-N 3.33Å
154	N	47.4	Very low	49.6	Very low	138 Å²	138	164.6 Å²	164.6	74%	0.738	79%	0.788	S	S	*	*			trans	-64.2	104.1	-178.6	-174.7	-32	0	0	0	109.9	Q152 K156	Q152-N154 PolarHBondContact O-N 3.42Å; Q152-N154 VanDerWaalsContact O-N 3.12Å; N154-K156 PolarHBondContact O-N 3.23Å
155	S	48.6	Very low	50.9	Low	109 Å²	109	162.6 Å²	162.6	76%	0.762	78%	0.783	S	S	*	*			trans	-75.2	66.5	-179.3	45.8	0	0	0	0	111.5	L153 K157	L153-S155 PolarHBondContact O-N 3.33Å; S155-K157 VanDerWaalsContact C-N 3.32Å; S155-K157 PolarHBondContact O-N 3.25Å
156	K	58.6	Low	51.8	Low	178 Å²	178	163.7 Å²	163.7	77%	0.774	78%	0.776	S	S	*	*			trans	-61.3	90	173.5	-170	82.7	175.2	-171.6	0	109.8	N154 H158	N154-K156 PolarHBondContact O-N 3.23Å; K156-H158 PolarHBondContact O-N 3.25Å
157	K	55.8	Low	52	Low	182 Å²	182	160.5 Å²	160.5	79%	0.791	77%	0.765	S	S	*	*			trans	-10.1	100.1	-178.9	-61.1	-172.3	179.4	-173.5	0	115.2	S155 H159	S155-K157 VanDerWaalsContact C-N 3.32Å; S155-K157 PolarHBondContact O-N 3.25Å; K157-H159 PolarHBondContact O-N 3.41Å
158	H	50.3	Low	52	Low	183 Å²	183	159.7 Å²	159.7	85%	0.847	76%	0.758	S	S	*	*			trans	-71.9	107.1	160.5	-71.3	-81.8	0	0	0	108.6	K156	K156-H158 PolarHBondContact O-N 3.25Å
159	H	60.7	Low	51.8	Low	165 Å²	165	155.2 Å²	155.2	76%	0.764	74%	0.743	S	S	*	*			trans	-65	138.6	163.2	-72.2	-102.4	0	0	0	108.6	K157 Y161	K157-H159 PolarHBondContact O-N 3.41Å; H159-Y161 PolarHBondContact O-N 2.84Å
160	H	50.1	Low	52.1	Low	188 Å²	188	149.3 Å²	149.3	87%	0.87	73%	0.728	S	S	*	*			trans	-65.5	128.6	166.3	-81.8	53.7	0	0	0	108	E162	H160-E162 PolarHBondContact O-N 2.68Å
161	Y	53.7	Low	52.5	Low	210 Å²	210	148.2 Å²	148.2	82%	0.824	72%	0.72	S	S	*	*			trans	-85.4	96.7	175.7	-174.6	-94.1	0	0	0	108.5	H159 P163	H159-Y161 PolarHBondContact O-N 2.84Å; Y161-P163 HydrophobicContact CE1-CB 4.15Å; Y161-P163 WeakPolarHBondContact O-CD 3.22Å
162	E	48.5	Very low	52.8	Low	176 Å²	176	141.1 Å²	141.1	82%	0.822	70%	0.698	S	S	*	*			trans	-84.4	115.5	170.1	-171.3	161.3	-142.2	0	0	108.3	H160	H160-E162 PolarHBondContact O-N 2.68Å
163	P	53.2	Low	52.8	Low	87 Å²	87	135.8 Å²	135.8	57%	0.565	68%	0.681	S	S	*	*			trans	-76.5	125.3	-178.7	30	-32.7	0	0	0	110.5	Y161 P165	Y161-P163 HydrophobicContact CE1-CB 4.15Å; Y161-P163 WeakPolarHBondContact O-CD 3.22Å; P163-P165 WeakPolarHBondContact O-CD 3.45Å
164	D	55.4	Low	52.9	Low	102 Å²	102	137.1 Å²	137.1	55%	0.545	68%	0.675	S	S	.	*			trans	-54.9	116.6	-179.6	-175.6	-14.2	0	0	0	112	H166 M167	D164-H166 PolarHBondContact O-N 2.96Å; D164-H166 WeakPolarHBondContact OD1-CB 3.34Å; D164-H166 PolarHBondContact OD1-N 2.99Å; D164-M167 PolarHBondContact O-N 2.87Å
165	P	61.9	Low	53	Low	107 Å²	107	136.2 Å²	136.2	70%	0.695	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-58	-28.2	179.9	-26.3	35.8	0	0	0	114.3	P163 M167 Y168	P163-P165 WeakPolarHBondContact O-CD 3.45Å; P165-M167 PolarHBondContact O-N 2.91Å; P165-M167 VanDerWaalsContact O-N 3.09Å; P165-Y168 PolarHBondContact O-N 3.39Å
166	H	52.4	Low	52.9	Low	137 Å²	137	138.3 Å²	138.3	63%	0.634	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-67.8	-11.8	-174.5	-162.8	-79.1	0	0	0	113.3	D164 Y168	D164-H166 PolarHBondContact O-N 2.96Å; D164-H166 WeakPolarHBondContact OD1-CB 3.34Å; D164-H166 PolarHBondContact OD1-N 2.99Å; H166-Y168 PolarHBondContact O-N 3.48Å
167	M	52.1	Low	52.1	Low	138 Å²	138	137 Å²	137	68%	0.68	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-63.8	-19.9	176	-76.8	-66	-64	0	0	114.4	D164 P165	D164-M167 PolarHBondContact O-N 2.87Å; P165-M167 PolarHBondContact O-N 2.91Å; P165-M167 VanDerWaalsContact O-N 3.09Å
168	Y	51.1	Low	51.7	Low	178 Å²	178	133.6 Å²	133.6	70%	0.698	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-32.8	-176.6	-74.9	-85	0	0	0	114.4	P165 H166 A170 Q171 V172	P165-Y168 PolarHBondContact O-N 3.39Å; H166-Y168 PolarHBondContact O-N 3.48Å; Y168-A170 VanDerWaalsContact C-N 3.28Å; Y168-A170 PolarHBondContact O-N 3.34Å; Y168-Q171 WeakPolarHBondContact O-CB 3.46Å; Y168-Q171 PolarHBondContact O-N 2.93Å; Y168-V172 PolarHBondContact O-N 3.3Å
169	D	50.8	Low	51.3	Low	95 Å²	95	130.7 Å²	130.7	51%	0.508	65%	0.651	S	S	.	*	H	α-helix	trans	-66.7	-29.4	-175.8	-108	-37.1	0	0	0	113.3	Q171 V172 S173	D169-Q171 PolarHBondContact O-N 3.1Å; D169-V172 PolarHBondContact O-N 2.97Å; D169-S173 WeakPolarHBondContact O-CB 3.39Å; D169-S173 PolarHBondContact O-N 2.93Å; D169-S173 PolarHBondContact O-OG 3.14Å
170	A	53.1	Low	50.3	Low	58 Å²	58	132.2 Å²	132.2	48%	0.479	66%	0.655	S	S	.	*	H	α-helix	trans	-64.5	-23.6	173.2	0	0	0	0	0	113.3	Y168	Y168-A170 VanDerWaalsContact C-N 3.28Å; Y168-A170 PolarHBondContact O-N 3.34Å
171	Q	52.5	Low	50	Low	129 Å²	129	129 Å²	129	60%	0.603	65%	0.649	S	S	*	*	H	α-helix	trans	-83.6	-45.7	172.8	-61.3	-79.6	-3.8	0	0	110.8	Y168 D169 S173 R174 L175	Y168-Q171 WeakPolarHBondContact O-CB 3.46Å; Y168-Q171 PolarHBondContact O-N 2.93Å; D169-Q171 PolarHBondContact O-N 3.1Å; Q171-S173 VanDerWaalsContact C-N 3.32Å; Q171-S173 PolarHBondContact O-N 3.03Å; Q171-R174 PolarHBondContact O-N 3.49Å; Q171-L175 PolarHBondContact O-N 3.27Å
172	V	51.7	Low	49.3	Very low	60 Å²	60	126.9 Å²	126.9	36%	0.364	65%	0.646	S	S	.	*	H	α-helix	trans	-61.3	-40.3	-179.4	175.4	0	0	0	0	111.8	Y168 D169 R174 L175 K176	Y168-V172 PolarHBondContact O-N 3.3Å; D169-V172 PolarHBondContact O-N 2.97Å; V172-R174 PolarHBondContact O-N 2.95Å; V172-L175 PolarHBondContact O-N 2.81Å; V172-K176 HydrophobicContact CG1-CD 4.48Å; V172-K176 PolarHBondContact O-N 3.36Å
173	S	54.4	Low	48.9	Very low	73 Å²	73	127.3 Å²	127.3	51%	0.51	65%	0.648	S	S	.	*	H	α-helix	trans	-60	-43.8	178.3	-60	0	0	0	0	112.2	D169 Q171 L175 K176 E177	D169-S173 WeakPolarHBondContact O-CB 3.39Å; D169-S173 PolarHBondContact O-N 2.93Å; D169-S173 PolarHBondContact O-OG 3.14Å; Q171-S173 VanDerWaalsContact C-N 3.32Å; Q171-S173 PolarHBondContact O-N 3.03Å; S173-L175 VanDerWaalsContact C-N 3.32Å; S173-L175 PolarHBondContact O-N 3.21Å; S173-K176 PolarHBondContact O-N 3.45Å; S173-E177 PolarHBondContact O-N 3.16Å
174	R	49.5	Very low	48	Very low	186 Å²	186	129.1 Å²	129.1	70%	0.702	66%	0.658	S	S	*	*	H	α-helix	trans	-69.3	-27.1	179.1	-68.3	178.6	177	-167.3	-1	113.4	Q171 V172 V178	Q171-R174 PolarHBondContact O-N 3.49Å; V172-R174 PolarHBondContact O-N 2.95Å; R174-V178 WeakPolarHBondContact O-CG2 3.47Å
175	L	47.9	Very low	46.9	Very low	120 Å²	120	128.1 Å²	128.1	63%	0.628	66%	0.664	S	S	*	*	H	α-helix	trans	-73.7	-36.1	175.2	-75.2	165.9	0	0	0	112.3	Q171 V172 S173 E177 V179	Q171-L175 PolarHBondContact O-N 3.27Å; V172-L175 PolarHBondContact O-N 2.81Å; S173-L175 VanDerWaalsContact C-N 3.32Å; S173-L175 PolarHBondContact O-N 3.21Å; L175-E177 VanDerWaalsContact C-N 3.35Å; L175-E177 PolarHBondContact O-N 2.61Å; L175-V179 WeakPolarHBondContact O-CG2 3.08Å; L175-V179 PolarHBondContact O-N 2.93Å
176	K	48.3	Very low	45.5	Very low	152 Å²	152	130.2 Å²	130.2	66%	0.661	67%	0.669	S	S	*	*	H	α-helix	trans	-67.8	-32.4	179	-71.6	176.3	179	174.1	0	113.2	V172 S173	V172-K176 HydrophobicContact CG1-CD 4.48Å; V172-K176 PolarHBondContact O-N 3.36Å; S173-K176 PolarHBondContact O-N 3.45Å
177	E	40.7	Very low	44.9	Very low	152 Å²	152	133.4 Å²	133.4	71%	0.71	68%	0.681	S	S	*	*	H	α-helix	trans	-69.2	-41.6	178.2	-168.2	172.2	-163.9	0	0	112.2	S173 L175 V179 K180	S173-E177 PolarHBondContact O-N 3.16Å; L175-E177 VanDerWaalsContact C-N 3.35Å; L175-E177 PolarHBondContact O-N 2.61Å; E177-V179 VanDerWaalsContact C-N 3.34Å; E177-V179 PolarHBondContact O-N 2.83Å; E177-K180 PolarHBondContact O-N 3.46Å
178	V	46.6	Very low	43.9	Very low	110 Å²	110	134.7 Å²	134.7	67%	0.667	69%	0.69	S	S	*	*	H	α-helix	trans	-67.8	-30.9	-179.4	174	0	0	0	0	112.9	R174 K180	R174-V178 WeakPolarHBondContact O-CG2 3.47Å; V178-K180 VanDerWaalsContact C-N 3.26Å; V178-K180 PolarHBondContact O-N 2.97Å
179	V	42.9	Very low	43.1	Very low	122 Å²	122	129.7 Å²	129.7	74%	0.739	69%	0.685	S	S	*	*	H	α-helix	trans	-67	-23.9	-178	169.3	0	0	0	0	112.9	L175 E177 V181	L175-V179 WeakPolarHBondContact O-CG2 3.08Å; L175-V179 PolarHBondContact O-N 2.93Å; E177-V179 VanDerWaalsContact C-N 3.34Å; E177-V179 PolarHBondContact O-N 2.83Å; V179-V181 VanDerWaalsContact C-N 3.34Å; V179-V181 PolarHBondContact O-N 2.82Å
180	K	39.3	Very low	42.4	Very low	197 Å²	197	132.3 Å²	132.3	86%	0.857	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	8.7	-171.7	-150	178.8	177.9	179.6	0	115.5	E177 V178	E177-K180 PolarHBondContact O-N 3.46Å; V178-K180 VanDerWaalsContact C-N 3.26Å; V178-K180 PolarHBondContact O-N 2.97Å
181	V	44.5	Very low	41.9	Very low	121 Å²	121	135.8 Å²	135.8	73%	0.733	72%	0.717	S	S	*	*	S	Bend	trans	-120	-17.2	-173.2	-175.5	0	0	0	0	113.8	V179	V179-V181 VanDerWaalsContact C-N 3.34Å; V179-V181 PolarHBondContact O-N 2.82Å
182	Q	39.1	Very low	41.1	Very low	165 Å²	165	132 Å²	132	77%	0.771	71%	0.713	S	S	*	*			trans	-107.7	51.8	-170.8	-160.7	61.4	74.4	0	0	114.1
183	E	40.5	Very low	40.3	Very low	184 Å²	184	141.7 Å²	141.7	86%	0.86	74%	0.743	S	S	*	*			trans	-122.8	78.1	168.4	-170.2	162.2	-144.2	0	0	111.7
184	T	33.1	Very low	39.9	Very low	125 Å²	125	145.4 Å²	145.4	77%	0.767	76%	0.757	S	S	*	*			trans	-168.7	142.2	154.5	4.3	0	0	0	0	112.1
185	A	33.2	Very low	39.7	Very low	81 Å²	81	141.4 Å²	141.4	67%	0.669	75%	0.749	S	S	*	*			trans	62.8	106.6	155.9	0	0	0	0	0	121.8
186	N	32.7	Very low	39.6	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	75%	0.746	S	S	*	*			trans	83.2	112.3	131.4	-63.3	-29.1	0	0	0	123.1
187	K	38.8	Very low	39.9	Very low	203 Å²	203	139.5 Å²	139.5	88%	0.883	75%	0.751	S	S	*	*			trans	16	125.8	142.3	-55.7	-178.7	-178.7	-178.5	0	119.5
188	L	30.8	Very low	40.3	Very low	166 Å²	166	137 Å²	137	87%	0.869	76%	0.756	S	S	*	*				171.5	144.5	102.9	-175.8	59.2	0	0	0	113.1
189	A	34.4	Very low	40.2	Very low	72 Å²	72	137.2 Å²	137.2	60%	0.595	75%	0.753	S	S	*	*			trans	36	134.1	158.5	0	0	0	0	0	123.7
190	N	36.5	Very low	40.5	Very low	150 Å²	150	136.1 Å²	136.1	80%	0.802	74%	0.74	S	S	*	*			trans	62.1	123.5	154.2	-69.9	-23.3	0	0	0	119.6	G192	N190-G192 VanDerWaalsContact C-N 3.32Å; N190-G192 PolarHBondContact O-N 2.83Å
191	P	43.3	Very low	41.2	Very low	131 Å²	131	132 Å²	132	85%	0.851	72%	0.723	S	S	*	*			trans	-77	78.1	173.4	33.3	-35	0	0	0	111.8
192	G	35.7	Very low	41.3	Very low	50 Å²	50	134.7 Å²	134.7	52%	0.515	73%	0.726	S	S	.	*			trans	-71.5	135.3	169.7	0	0	0	0	0	112.1	N190 N194	N190-G192 VanDerWaalsContact C-N 3.32Å; N190-G192 PolarHBondContact O-N 2.83Å; G192-N194 PolarHBondContact O-N 2.94Å; G192-N194 VanDerWaalsContact O-N 3.11Å; G192-N194 PolarHBondContact O-ND2 3.31Å; G192-N194 VanDerWaalsContact O-ND2 3.1Å
193	W	34	Very low	41.5	Very low	263 Å²	263	133.1 Å²	133.1	100%	0.996	71%	0.712	S	S	*	*			trans	-63.3	111.1	174.8	-74.2	80.2	0	0	0	110.6
194	N	47.1	Very low	42	Very low	152 Å²	152	129.3 Å²	129.3	81%	0.813	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-82.3	122.8	-179.9	-87.2	-90	0	0	0	111.2	G192	G192-N194 PolarHBondContact O-N 2.94Å; G192-N194 VanDerWaalsContact O-N 3.11Å; G192-N194 PolarHBondContact O-ND2 3.31Å; G192-N194 VanDerWaalsContact O-ND2 3.1Å
195	L	44.6	Very low	42.7	Very low	101 Å²	101	131.7 Å²	131.7	53%	0.529	69%	0.692	S	S	.	*	P	Polyproline II helix	trans	-86.7	135.5	177.3	-166.3	71.8	0	0	0	110.1	L199 Q200	L195-L199 HydrophobicContact CD1-CD1 3.97Å; L195-L199 HydrophobicContact CD2-CB 3.67Å; L195-L199 HydrophobicContact CD2-CD1 4.2Å; L195-L199 HydrophobicContact CG-CB 3.99Å; L195-L199 HydrophobicContact CG-CD1 4.04Å; L195-Q200 PolarHBondContact O-NE2 2.87Å
196	P	46.8	Very low	43.4	Very low	86 Å²	86	131 Å²	131	56%	0.558	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-53.7	142.9	-178.2	-28.6	35.6	0	0	0	113.7	A198 L199	P196-A198 PolarHBondContact O-N 3.21Å; P196-L199 PolarHBondContact O-N 3.3Å
197	L	54.4	Low	44.7	Very low	146 Å²	146	133.4 Å²	133.4	76%	0.764	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-53.1	-33.7	-174.5	-90.1	71	0	0	0	113.7	L199 Q200	L197-L199 PolarHBondContact O-N 3.01Å; L197-Q200 PolarHBondContact O-N 3.29Å
198	A	47.9	Very low	45	Very low	101 Å²	101	130.5 Å²	130.5	84%	0.835	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-59	-14.5	176.7	0	0	0	0	0	114.6	P196	P196-A198 PolarHBondContact O-N 3.21Å
199	L	44.3	Very low	46.3	Very low	113 Å²	113	127.3 Å²	127.3	59%	0.592	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-109.6	-0.2	177.5	-60.3	176.8	0	0	0	113.4	L195 P196 L197 Q201	L195-L199 HydrophobicContact CD1-CD1 3.97Å; L195-L199 HydrophobicContact CD2-CB 3.67Å; L195-L199 HydrophobicContact CD2-CD1 4.2Å; L195-L199 HydrophobicContact CG-CB 3.99Å; L195-L199 HydrophobicContact CG-CD1 4.04Å; P196-L199 PolarHBondContact O-N 3.3Å; L197-L199 PolarHBondContact O-N 3.01Å; L199-Q201 PolarHBondContact O-N 2.84Å
200	Q	50.5	Low	46.8	Very low	100 Å²	100	125.7 Å²	125.7	47%	0.467	65%	0.652	S	S	.	*			trans	-81.1	59.1	-176.6	-64.9	-173	12.7	0	0	112.9	L195 L197 K202	L195-Q200 PolarHBondContact O-NE2 2.87Å; L197-Q200 PolarHBondContact O-N 3.29Å; Q200-K202 PolarHBondContact O-N 3.13Å
201	Q	52.6	Low	47.1	Very low	109 Å²	109	122.4 Å²	122.4	51%	0.509	64%	0.64	S	S	.	*			trans	-70.8	92.4	175.9	-168.9	147.1	101.5	0	0	110	L199 W203	L199-Q201 PolarHBondContact O-N 2.84Å; Q201-W203 PolarHBondContact O-N 2.83Å; Q201-W203 PolarHBondContact O-NE1 2.83Å
202	K	47	Very low	47.1	Very low	179 Å²	179	121.3 Å²	121.3	78%	0.778	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-65.1	119.1	177.7	-76.4	-176.9	178.4	176.5	0	110.7	Q200	Q200-K202 PolarHBondContact O-N 3.13Å
203	W	43.6	Very low	47.9	Very low	131 Å²	131	121.2 Å²	121.2	50%	0.496	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-94.6	131.2	175.1	-65.4	82.8	0	0	0	110.4	Q201 L212 K214	Q201-W203 PolarHBondContact O-N 2.83Å; Q201-W203 PolarHBondContact O-NE1 2.83Å; W203-L212 HydrophobicContact CB-CB 4.1Å; W203-L212 HydrophobicContact CB-CD1 4.09Å; W203-L212 HydrophobicContact CB-CD2 4.01Å; W203-L212 HydrophobicContact CB-CG 4.29Å; W203-L212 HydrophobicContact CD2-CB 4.42Å; W203-L212 HydrophobicContact CE3-CB 3.96Å; W203-L212 HydrophobicContact CG-CD1 4.42Å; W203-K214 HydrophobicContact CE3-CB 4.33Å; W203-K214 HydrophobicContact CH2-CB 3.88Å; W203-K214 HydrophobicContact CH2-CD 4.34Å; W203-K214 HydrophobicContact CH2-CG 4.39Å; W203-K214 HydrophobicContact CZ3-CB 3.62Å; W203-K214 HydrophobicContact CZ3-CG 4.5Å
204	I	51.5	Low	48.4	Very low	104 Å²	104	114.9 Å²	114.9	53%	0.533	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	133.1	176	-59	178.1	0	0	0	108.8	S213 V215	I204-S213 PolarHBondContact O-N 2.9Å; I204-V215 HydrophobicContact CD1-CG2 4.17Å; I204-V215 HydrophobicContact CG1-CG2 4.44Å
205	R	47.3	Very low	48.1	Very low	175 Å²	175	111.6 Å²	111.6	66%	0.66	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89	115.9	-179.3	-177.1	-179.8	-179.6	-171	-2.5	109.5	K207 L212	R205-K207 PolarHBondContact O-N 2.88Å; R205-L212 HydrophobicContact CB-CD2 3.99Å
206	N	47.6	Very low	48	Very low	68 Å²	68	114.7 Å²	114.7	36%	0.364	59%	0.592	S	S	.	*			trans	-67.8	131.3	172.2	-77.4	-15.3	0	0	0	109.7	D208 G210 C211	N206-D208 VanDerWaalsContact C-N 3.26Å; N206-D208 PolarHBondContact O-N 2.9Å; N206-G210 WeakPolarHBondContact O-CA 3.4Å; N206-G210 PolarHBondContact O-N 3.28Å; N206-C211 PolarHBondContact N-O 3.48Å
207	K	60.9	Low	47.7	Very low	202 Å²	202	119.7 Å²	119.7	88%	0.878	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-30.9	-173.4	-67.6	-178.1	177.5	179.9	0	112.4	R205	R205-K207 PolarHBondContact O-N 2.88Å
208	D	45	Very low	46.8	Very low	142 Å²	142	119.3 Å²	119.3	76%	0.759	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-22.7	-165.6	-0.1	-78.3	0	0	0	112.4	N206	N206-D208 VanDerWaalsContact C-N 3.26Å; N206-D208 PolarHBondContact O-N 2.9Å
209	T	56.6	Low	46.3	Very low	98 Å²	98	119.4 Å²	119.4	60%	0.601	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	-11.4	179.3	48.1	0	0	0	0	114	C211	T209-C211 PolarHBondContact O-N 2.81Å
210	G	46.6	Very low	45.7	Very low	38 Å²	38	120.5 Å²	120.5	39%	0.392	62%	0.618	S	S	.	*			trans	70.9	-11.2	178.6	0	0	0	0	0	115.6	N206	N206-G210 WeakPolarHBondContact O-CA 3.4Å; N206-G210 PolarHBondContact O-N 3.28Å
211	C	41.1	Very low	44.8	Very low	82 Å²	82	121.7 Å²	121.7	55%	0.554	62%	0.624	S	S	*	*			trans	-70.4	144.3	178.3	-68.2	0	0	0	0	112.2	N206 T209	N206-C211 PolarHBondContact N-O 3.48Å; T209-C211 PolarHBondContact O-N 2.81Å
212	L	43.9	Very low	43.8	Very low	107 Å²	107	123.6 Å²	123.6	56%	0.56	64%	0.642	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.2	123.5	168.3	-65.1	-179.5	0	0	0	109.1	W203 R205	W203-L212 HydrophobicContact CB-CB 4.1Å; W203-L212 HydrophobicContact CB-CD1 4.09Å; W203-L212 HydrophobicContact CB-CD2 4.01Å; W203-L212 HydrophobicContact CB-CG 4.29Å; W203-L212 HydrophobicContact CD2-CB 4.42Å; W203-L212 HydrophobicContact CE3-CB 3.96Å; W203-L212 HydrophobicContact CG-CD1 4.42Å; R205-L212 HydrophobicContact CB-CD2 3.99Å
213	S	53	Low	43	Very low	49 Å²	49	124.2 Å²	124.2	34%	0.343	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	146.5	174.9	69.8	0	0	0	0	110.9	I204	I204-S213 PolarHBondContact O-N 2.9Å
214	K	44.7	Very low	42.5	Very low	130 Å²	130	126.8 Å²	126.8	57%	0.565	65%	0.654	S	S	*	*			trans	-82.4	124.8	177.5	-176.3	164.4	175.9	156	0	108.8	W203 K216	W203-K214 HydrophobicContact CE3-CB 4.33Å; W203-K214 HydrophobicContact CH2-CB 3.88Å; W203-K214 HydrophobicContact CH2-CD 4.34Å; W203-K214 HydrophobicContact CH2-CG 4.39Å; W203-K214 HydrophobicContact CZ3-CB 3.62Å; W203-K214 HydrophobicContact CZ3-CG 4.5Å; K214-K216 PolarHBondContact O-N 2.83Å
215	V	40.1	Very low	41.6	Very low	83 Å²	83	128 Å²	128	50%	0.503	67%	0.669	S	S	.	*			trans	-58.9	127.2	173.9	180	0	0	0	0	109.2	I204	I204-V215 HydrophobicContact CD1-CG2 4.17Å; I204-V215 HydrophobicContact CG1-CG2 4.44Å
216	K	41.8	Very low	40.6	Very low	166 Å²	166	125.4 Å²	125.4	72%	0.722	67%	0.672	S	S	*	*			trans	-93.6	104.8	168.1	179	-175.1	177.7	-174.8	0	107.2	K214 L218	K214-K216 PolarHBondContact O-N 2.83Å; K216-L218 HydrophobicContact CD-CD1 4.3Å; K216-L218 PolarHBondContact O-N 3.24Å
217	E	41.3	Very low	39.8	Very low	190 Å²	190	130.7 Å²	130.7	89%	0.888	69%	0.692	S	S	*	*			trans	-62.1	132	170.2	-70.2	-179.6	135.4	0	0	109.8
218	L	34.7	Very low	38.2	Very low	138 Å²	138	127.6 Å²	127.6	72%	0.723	69%	0.685	S	S	*	*			trans	-135.4	121.2	171.6	-98.8	162	0	0	0	105.8	K216	K216-L218 HydrophobicContact CD-CD1 4.3Å; K216-L218 PolarHBondContact O-N 3.24Å
219	A	39	Very low	37.5	Very low	104 Å²	104	124.9 Å²	124.9	86%	0.86	68%	0.683	S	S	*	*			trans	-83.4	137.7	-161.1	0	0	0	0	0	113.8
220	V	31.4	Very low	36.1	Very low	135 Å²	135	127.5 Å²	127.5	82%	0.818	69%	0.688	S	S	*	*			trans	-152.8	128.6	173.2	175.9	0	0	0	0	104.2
221	E	30.9	Very low	35.2	Very low	126 Å²	126	135.1 Å²	135.1	59%	0.589	71%	0.705	S	S	*	*			cis	-156.8	139.2	0.5	171.3	-179.9	-180	0	0	108.4	R223	E221-R223 HydrophobicContact CG-CG 4.08Å; E221-R223 WeakPolarHBondContact OE1-CG 3.5Å; E221-R223 IonicContact OE1-CZ 2.72Å; E221-R223 VanDerWaalsContact OE1-CZ 3.31Å; E221-R223 IonicContact OE1-NE 3.68Å; E221-R223 PolarHBondContact OE1-NE 2.97Å; E221-R223 IonicContact OE1-NH2 3.71Å; E221-R223 PolarHBondContact OE1-NH2 3.29Å; E221-R223 IonicContact OE2-CZ 2.87Å; E221-R223 IonicContact OE2-NE 2.7Å; E221-R223 IonicContact OE2-NH2 3.16Å; E221-R223 PolarHBondContact OE2-NH2 2.99Å
222	V	31.6	Very low	34.7	Very low	148 Å²	148	137.7 Å²	137.7	90%	0.897	71%	0.709	S	S	*	*			trans	-110	119.3	167.2	173	0	0	0	0	108.5	K224	V222-K224 PolarHBondContact O-N 2.85Å
223	R	31.4	Very low	33.9	Very low	193 Å²	193	139.4 Å²	139.4	73%	0.728	72%	0.719	S	S	*	*			trans	-90.6	107	-179.3	-72	-165.3	169.7	173.9	7.2	112.3	E221	E221-R223 HydrophobicContact CG-CG 4.08Å; E221-R223 WeakPolarHBondContact OE1-CG 3.5Å; E221-R223 IonicContact OE1-CZ 2.72Å; E221-R223 VanDerWaalsContact OE1-CZ 3.31Å; E221-R223 IonicContact OE1-NE 3.68Å; E221-R223 PolarHBondContact OE1-NE 2.97Å; E221-R223 IonicContact OE1-NH2 3.71Å; E221-R223 PolarHBondContact OE1-NH2 3.29Å; E221-R223 IonicContact OE2-CZ 2.87Å; E221-R223 IonicContact OE2-NE 2.7Å; E221-R223 IonicContact OE2-NH2 3.16Å; E221-R223 PolarHBondContact OE2-NH2 2.99Å
224	K	32.1	Very low	32.9	Very low	185 Å²	185	141.4 Å²	141.4	80%	0.804	74%	0.738	S	S	*	*			trans	46.5	135.6	141.2	-63.7	-171.4	180	-175.5	0	119.5	V222	V222-K224 PolarHBondContact O-N 2.85Å
225	P	32.3	Very low	32.2	Very low	130 Å²	130	143.3 Å²	143.3	84%	0.844	75%	0.753	S	S	*	*				-108.3	-157.3	115.3	33.3	-35.4	0	0	0	112.3
226	V	27.2	Very low	31.9	Very low	120 Å²	120	148.6 Å²	148.6	73%	0.727	77%	0.77	S	S	*	*			trans	-134.7	150.3	-147.5	155.3	0	0	0	0	111.7
227	K	30.1	Very low	31.7	Very low	178 Å²	178	146.4 Å²	146.4	77%	0.774	77%	0.772	S	S	*	*			trans	71.1	151.6	178.5	-68.9	176.9	176.1	-173	0	115.7
228	D	27.2	Very low	30.9	Very low	137 Å²	137	144.4 Å²	144.4	73%	0.733	77%	0.767	S	S	*	*			cis	-156.3	168.6	-11.5	-114.2	-29.9	0	0	0	111.9
229	A	30.6	Very low	31.4	Very low	86 Å²	86	142.4 Å²	142.4	71%	0.711	76%	0.763	S	S	*	*			trans	69.8	123.7	151.9	0	0	0	0	0	123.6
230	Q	27.5	Very low	31	Very low	153 Å²	153	146.6 Å²	146.6	72%	0.715	76%	0.762	S	S	*	*			trans	72.8	119.9	139.6	-69	-168.4	16	0	0	123.8
231	R	28.3	Very low	30.9	Very low	197 Å²	197	148.4 Å²	148.4	74%	0.743	76%	0.761	S	S	*	*				68.7	154.8	128.7	-72.3	-176.6	168.7	147.1	-4.5	120.5
232	E	29.1	Very low	30.8	Very low	137 Å²	137	147.6 Å²	147.6	64%	0.64	78%	0.776	S	S	*	*			cis	-164	156.9	-32	-148.7	-179.9	119.1	0	0	108.8
233	N	28.6	Very low	30.7	Very low	143 Å²	143	146.2 Å²	146.2	77%	0.765	77%	0.768	S	S	*	*			trans	63.9	150.7	163.1	-64.5	-41.3	0	0	0	120.5
234	A	30.2	Very low	30.8	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	77%	0.773	S	S	*	*			trans	-93.5	165.4	-172.3	0	0	0	0	0	112.9
235	L	31.3	Very low	31.1	Very low	171 Å²	171	141.3 Å²	141.3	90%	0.895	77%	0.77	S	S	*	*				-173.6	163.4	125	-98	161.9	0	0	0	111.7
236	K	33.3	Very low	31.1	Very low	194 Å²	194	140.8 Å²	140.8	84%	0.843	77%	0.77	S	S	*	*			trans	-136.5	155.6	167.2	-77	-175.3	179.3	178.1	0	106.3
237	P	37.5	Very low	31.5	Very low	119 Å²	119	140.4 Å²	140.4	77%	0.773	77%	0.773	S	S	*	*			cis	-140.4	170.8	27.4	40.9	-22	0	0	0	118.2
238	N	23.8	Very low	31.9	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	78%	0.778	S	S	*	*			trans	8.6	159.8	137.4	-131.1	29	0	0	0	121.2
239	P	46.4	Very low	32.5	Very low	97 Å²	97	137.6 Å²	137.6	63%	0.63	78%	0.78	S	S	*	*			cis	-129.6	158.5	-25.5	30.1	-12.2	0	0	0	114.7
240	K	30.7	Very low	33.2	Very low	191 Å²	191	138.9 Å²	138.9	83%	0.83	78%	0.784	S	S	*	*			trans	-166.9	133	140.2	-110.7	158.8	-173.8	178.5	0	114.3
241	E	28.8	Very low	34.2	Very low	174 Å²	174	140.7 Å²	140.7	81%	0.813	79%	0.789	S	S	*	*			trans	20	105.8	156.1	-63.3	171.9	120.9	0	0	120.7
242	A	29.4	Very low	35.5	Very low	108 Å²	108	137.7 Å²	137.7	89%	0.893	79%	0.785	S	S	*	*			trans	-141.7	110.1	143.3	0	0	0	0	0	108.2
243	T	29.3	Very low	36.6	Very low	120 Å²	120	137.7 Å²	137.7	74%	0.736	78%	0.783	S	S	*	*			trans	-116.4	133.4	-170	-63.5	0	0	0	0	111.3
244	L	32.5	Very low	38	Very low	159 Å²	159	136.2 Å²	136.2	83%	0.832	77%	0.774	S	S	*	*			trans	151.4	153.9	143.7	-83.1	169.1	0	0	0	110.3
245	P	39.9	Very low	39.2	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	76%	0.758	S	S	*	*			cis	-122.8	140.3	-33.7	33.8	-19.6	0	0	0	112
246	S	31.5	Very low	40.4	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	74%	0.743	S	S	*	*			trans	-81.2	143.7	172.5	-169.4	0	0	0	0	111.6
247	S	36	Very low	41.2	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	73%	0.725	S	S	*	*			trans	-75.3	133.1	-175.6	51.8	0	0	0	0	113	S249	S247-S249 PolarHBondContact O-N 3.05Å; S247-S249 VanDerWaalsContact O-N 3.12Å
248	V	38.2	Very low	42.2	Very low	145 Å²	145	128.7 Å²	128.7	88%	0.879	71%	0.712	S	S	*	*			trans	-75.1	103.4	-175.3	-177.9	0	0	0	0	110.9	S250	V248-S250 PolarHBondContact O-N 2.95Å
249	S	40	Very low	43.6	Very low	112 Å²	112	124.8 Å²	124.8	78%	0.783	69%	0.691	S	S	*	*			trans	-80.7	97.2	178.1	-174.4	0	0	0	0	111.8	S247 K251	S247-S249 PolarHBondContact O-N 3.05Å; S247-S249 VanDerWaalsContact O-N 3.12Å; S249-K251 PolarHBondContact O-N 2.71Å
250	S	44.3	Very low	44.1	Very low	113 Å²	113	130.2 Å²	130.2	79%	0.79	71%	0.705	S	S	*	*			trans	-73	103.4	175.9	-170.7	0	0	0	0	111.2	V248 M252	V248-S250 PolarHBondContact O-N 2.95Å; S250-M252 PolarHBondContact O-N 3.19Å
251	K	50	Low	45.2	Very low	191 Å²	191	126.7 Å²	126.7	83%	0.83	70%	0.695	S	S	*	*			trans	-93.3	99	-173.5	-171.1	173.6	-177.5	174.4	0	112.5	S249	S249-K251 PolarHBondContact O-N 2.71Å
252	M	53.8	Low	46.5	Very low	134 Å²	134	119.1 Å²	119.1	66%	0.66	66%	0.664	S	S	*	*			trans	-69.8	131.9	177.6	-164	147.6	58.9	0	0	112.1	S250 M268	S250-M252 PolarHBondContact O-N 3.19Å; M252-M268 HydrophobicContact SD-CG 4.38Å
253	K	54	Low	47.6	Very low	137 Å²	137	120.1 Å²	120.1	60%	0.596	64%	0.644	S	S	*	*			trans	-111.5	96.7	-175.5	-171.3	-178.4	180	-178.8	0	112	I255	K253-I255 HydrophobicContact CD-CD1 4.39Å; K253-I255 HydrophobicContact CD-CG1 4.22Å; K253-I255 HydrophobicContact CG-CG1 4.08Å; K253-I255 PolarHBondContact O-N 2.7Å; K253-I255 VanDerWaalsContact O-N 3.08Å
254	I	56.3	Low	49.1	Very low	112 Å²	112	116.9 Å²	116.9	57%	0.574	62%	0.622	S	S	*	*			trans	-73.3	99.2	173.7	-56.4	175.1	0	0	0	109.4	K256	I254-K256 PolarHBondContact O-N 3.31Å
255	I	55.7	Low	50.2	Low	79 Å²	79	111 Å²	111	41%	0.405	59%	0.593	S	S	.	*			trans	-83.4	87.7	172.5	-56.3	179.6	0	0	0	108.3	K253 N257 V267	K253-I255 HydrophobicContact CD-CD1 4.39Å; K253-I255 HydrophobicContact CD-CG1 4.22Å; K253-I255 HydrophobicContact CG-CG1 4.08Å; K253-I255 PolarHBondContact O-N 2.7Å; K253-I255 VanDerWaalsContact O-N 3.08Å; I255-N257 PolarHBondContact O-N 3.07Å; I255-V267 HydrophobicContact CD1-CB 4.41Å; I255-V267 HydrophobicContact CD1-CG2 4.29Å
256	K	56.3	Low	51.3	Low	133 Å²	133	107.4 Å²	107.4	58%	0.578	57%	0.567	S	S	*	*			trans	-69.6	70	-178.5	-169.5	-166.9	175.5	-179.2	0	112.4	I254 K258 I264	I254-K256 PolarHBondContact O-N 3.31Å; K256-K258 PolarHBondContact O-N 3.39Å; K256-I264 HydrophobicContact CG-CG2 4.46Å
257	N	51	Low	52.3	Low	86 Å²	86	103.9 Å²	103.9	46%	0.46	54%	0.54	S	S	.	.			trans	-76.1	98.7	160.4	-176.2	-1	0	0	0	108.3	I255 N259	I255-N257 PolarHBondContact O-N 3.07Å; N257-N259 VanDerWaalsContact C-N 3.32Å; N257-N259 PolarHBondContact O-N 3.36Å; N257-N259 VanDerWaalsContact O-N 3.12Å; N257-N259 PolarHBondContact OD1-N 3.36Å
258	K	57.3	Low	52.9	Low	118 Å²	118	103 Å²	103	51%	0.513	53%	0.525	S	S	.	.			trans	-77.6	88.9	166.6	-177.4	165.9	-174.6	156.7	0	107.4	K256 E543	K256-K258 PolarHBondContact O-N 3.39Å; K258-E543 IonicContact NZ-OE1 3.23Å; K258-E543 IonicContact NZ-OE2 3.08Å; K258-E543 PolarHBondContact NZ-OE2 3.23Å
259	N	54.7	Low	53.3	Low	66 Å²	66	98.9 Å²	98.9	35%	0.353	50%	0.503	S	S	.	.			trans	-54.8	148.8	166.5	-68.9	-64.3	0	0	0	109.2	N257 N261 G262 R263	N257-N259 VanDerWaalsContact C-N 3.32Å; N257-N259 PolarHBondContact O-N 3.36Å; N257-N259 VanDerWaalsContact O-N 3.12Å; N257-N259 PolarHBondContact OD1-N 3.36Å; N259-N261 PolarHBondContact O-N 3.35Å; N259-G262 PolarHBondContact O-N 2.7Å; N259-R263 PolarHBondContact N-O 3.21Å; N259-R263 PolarHBondContact ND2-O 2.92Å; N259-R263 VanDerWaalsContact ND2-O 3.12Å
260	K	55.4	Low	53.8	Low	210 Å²	210	102 Å²	102	91%	0.913	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-4	178.4	59.5	-176.9	177.4	-179.1	0	115.7
261	N	54.4	Low	54	Low	117 Å²	117	104.4 Å²	104.4	63%	0.626	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	22.2	177.1	-54.4	2.2	0	0	0	112.5	N259 R263	N259-N261 PolarHBondContact O-N 3.35Å; N261-R263 PolarHBondContact O-N 2.77Å
262	G	56	Low	53.9	Low	15 Å²	15	103.2 Å²	103.2	16%	0.155	49%	0.494	C	S	.	.	S	Bend	trans	75.1	-22	179.1	0	0	0	0	0	116	N259 I264	N259-G262 PolarHBondContact O-N 2.7Å; G262-I264 PolarHBondContact O-N 3.23Å; G262-I264 VanDerWaalsContact O-N 3.11Å
263	R	52.1	Low	53.5	Low	129 Å²	129	103.2 Å²	103.2	49%	0.487	50%	0.497	S	S	.	.			trans	-64.3	107.5	-178.3	-65.1	177.8	178	174.9	-3	112.7	N259 N261 T540	N259-R263 PolarHBondContact N-O 3.21Å; N259-R263 PolarHBondContact ND2-O 2.92Å; N259-R263 VanDerWaalsContact ND2-O 3.12Å; N261-R263 PolarHBondContact O-N 2.77Å; R263-T540 HydrophobicContact CB-CG2 4.34Å; R263-T540 HydrophobicContact CG-CG2 4.26Å
264	I	61.5	Low	53.3	Low	52 Å²	52	100.3 Å²	100.3	27%	0.267	51%	0.506	S	S	.	.			trans	-71.5	154.9	161.3	-48.3	174.1	0	0	0	108.8	K256 G262 I266 V539 F541	K256-I264 HydrophobicContact CG-CG2 4.46Å; G262-I264 PolarHBondContact O-N 3.23Å; G262-I264 VanDerWaalsContact O-N 3.11Å; I264-I266 HydrophobicContact CG2-CG1 4.47Å; I264-V539 VanDerWaalsContact O-O 3.1Å; I264-F541 HydrophobicContact CB-CD2 3.94Å; I264-F541 HydrophobicContact CB-CE2 4.27Å; I264-F541 HydrophobicContact CG1-CD2 4.46Å
265	V	55.4	Low	52.5	Low	36 Å²	36	102 Å²	102	22%	0.218	52%	0.517	C	S	.	.			trans	-122.2	128.6	171.6	175.8	0	0	0	0	109.5	V267 T538	V265-V267 HydrophobicContact CG1-CG2 4.2Å; V265-T538 HydrophobicContact CG1-CG2 3.94Å
266	I	62.6	Low	51.9	Low	39 Å²	39	107.1 Å²	107.1	20%	0.2	54%	0.536	C	S	.	.			trans	-114.5	104.7	178.6	-55.1	-176.9	0	0	0	109.8	I264 M268 L537 F541	I264-I266 HydrophobicContact CG2-CG1 4.47Å; I266-M268 PolarHBondContact O-N 3.09Å; I266-L537 CarbonylContact C-O 3.58Å; I266-L537 CarbonylContact O-C 3.47Å; I266-L537 VanDerWaalsContact O-O 3.06Å; I266-F541 HydrophobicContact CD1-CE2 3.82Å; I266-F541 HydrophobicContact CD1-CZ 3.8Å; I266-F541 HydrophobicContact CG1-CE2 4.22Å
267	V	52.5	Low	51.2	Low	46 Å²	46	106.7 Å²	106.7	28%	0.279	54%	0.544	S	S	.	.			trans	-83.9	104.2	179.3	179.2	0	0	0	0	109.4	I255 V265 S269 L537	I255-V267 HydrophobicContact CD1-CB 4.41Å; I255-V267 HydrophobicContact CD1-CG2 4.29Å; V265-V267 HydrophobicContact CG1-CG2 4.2Å; V267-S269 PolarHBondContact O-N 3.48Å; V267-L537 HydrophobicContact CG1-CD2 3.9Å
268	M	49.6	Very low	50.5	Low	92 Å²	92	110.8 Å²	110.8	45%	0.453	56%	0.56	S	S	.	*			trans	-83.2	101.7	173.3	-65	-168.3	-64.9	0	0	110.8	M252 I266 K270 S536 L537	M252-M268 HydrophobicContact SD-CG 4.38Å; I266-M268 PolarHBondContact O-N 3.09Å; M268-K270 PolarHBondContact O-N 3.43Å; M268-S536 VanDerWaalsContact CE-O 3.26Å; M268-S536 WeakPolarHBondContact CE-O 3.49Å; M268-L537 WeakPolarHBondContact O-CD2 3.32Å
269	S	47.3	Very low	49.4	Very low	60 Å²	60	109.2 Å²	109.2	42%	0.42	58%	0.577	S	S	.	*			trans	-69.2	96	175.7	-58.1	0	0	0	0	111.5	V267 Y271	V267-S269 PolarHBondContact O-N 3.48Å; S269-Y271 PolarHBondContact O-N 2.97Å
270	K	50.5	Low	48.3	Very low	176 Å²	176	110.2 Å²	110.2	77%	0.765	60%	0.595	S	S	*	*			trans	-72.2	104.1	170.2	-179.8	177.3	176.1	-178.6	0	109.7	M268	M268-K270 PolarHBondContact O-N 3.43Å
271	Y	46.9	Very low	47.3	Very low	165 Å²	165	109.2 Å²	109.2	65%	0.647	59%	0.59	S	S	*	*			trans	61.6	113.9	-176.4	-49.8	-64	0	0	0	114.9	S269	S269-Y271 PolarHBondContact O-N 2.97Å
272	M	49.6	Very low	46.1	Very low	165 Å²	165	109.7 Å²	109.7	81%	0.813	59%	0.593	S	S	*	*			trans	-116.3	86.8	154.6	-71.5	-81.6	89.5	0	0	105.8
273	D	45	Very low	45	Very low	134 Å²	134	117.8 Å²	117.8	72%	0.717	62%	0.624	S	S	*	*			trans	-65.5	135.2	-177.8	-65.9	-49.4	0	0	0	110.7	N275	D273-N275 PolarHBondContact O-N 2.85Å
274	G	48.7	Very low	43.8	Very low	76 Å²	76	119.4 Å²	119.4	78%	0.784	64%	0.637	S	S	*	*			trans	-76.1	36.8	-160.8	0	0	0	0	0	116.6	K276	G274-K276 PolarHBondContact O-N 3.48Å
275	N	39.9	Very low	42.2	Very low	149 Å²	149	128.2 Å²	128.2	80%	0.797	67%	0.666	S	S	*	*			trans	-74.8	72.7	178.4	-95.6	27.8	0	0	0	112.5	D273 V277	D273-N275 PolarHBondContact O-N 2.85Å; N275-V277 VanDerWaalsContact C-N 3.27Å; N275-V277 PolarHBondContact O-N 3.49Å
276	K	43.2	Very low	40.9	Very low	185 Å²	185	133.7 Å²	133.7	80%	0.804	69%	0.69	S	S	*	*			trans	-70.3	86.1	152.7	-86.2	-167.6	170.6	-170.2	0	109.2	G274	G274-K276 PolarHBondContact O-N 3.48Å
277	V	41.6	Very low	39.4	Very low	125 Å²	125	137.3 Å²	137.3	76%	0.758	72%	0.719	S	S	*	*			trans	-72.5	131.9	151.7	179.4	0	0	0	0	107	N275	N275-V277 VanDerWaalsContact C-N 3.27Å; N275-V277 PolarHBondContact O-N 3.49Å
278	H	35.8	Very low	38.2	Very low	171 Å²	171	139.5 Å²	139.5	79%	0.792	74%	0.736	S	S	*	*			trans	-74.1	133.9	-173.6	-77.2	-123.2	0	0	0	111.3
279	G	34.3	Very low	37.1	Very low	85 Å²	85	144.8 Å²	144.8	88%	0.876	75%	0.751	S	S	*	*			trans	-87.3	114.2	166.5	0	0	0	0	0	110.9
280	A	32.8	Very low	36.2	Very low	87 Å²	87	148.8 Å²	148.8	72%	0.719	76%	0.763	S	S	*	*			trans	-155.9	123.5	164.5	0	0	0	0	0	110.7
281	K	34.4	Very low	35.1	Very low	190 Å²	190	147.6 Å²	147.6	83%	0.826	76%	0.76	S	S	*	*			trans	34.8	137	130.3	-67.5	-157.9	169.7	-156.7	0	119.6
282	D	29.4	Very low	34.2	Very low	126 Å²	126	147.5 Å²	147.5	67%	0.674	76%	0.763	S	S	*	*			cis	-170	-179	2.3	-134.5	-53.5	0	0	0	111.2
283	K	32.5	Very low	33	Very low	186 Å²	186	144.8 Å²	144.8	81%	0.809	76%	0.755	S	S	*	*			trans	73.2	96	162.3	-53	-147.7	178	-172.8	0	122
284	H	26.3	Very low	32.3	Very low	163 Å²	163	146.9 Å²	146.9	76%	0.755	76%	0.761	S	S	*	*				52.8	110.2	106.8	-173.6	-66.1	0	0	0	121.9
285	R	29	Very low	31.3	Very low	236 Å²	236	147.3 Å²	147.3	89%	0.891	75%	0.752	S	S	*	*				-162.5	164.3	122.5	-149.6	169.5	179.6	-170.3	-2.8	111.7
286	E	27.3	Very low	30.8	Very low	152 Å²	152	144.8 Å²	144.8	71%	0.71	75%	0.746	S	S	*	*			trans	-103.5	175.3	-169.1	-54.3	156.9	99.7	0	0	114.5
287	S	30.1	Very low	30.2	Very low	115 Å²	115	144.7 Å²	144.7	80%	0.804	75%	0.746	S	S	*	*			trans	68.3	157.4	151.2	77.4	0	0	0	0	119
288	S	27.6	Very low	29.5	Very low	91 Å²	91	143.3 Å²	143.3	64%	0.636	74%	0.738	S	S	*	*			cis	-176	153.3	-24	51.6	0	0	0	0	111.1
289	R	27.3	Very low	29.2	Very low	203 Å²	203	142.9 Å²	142.9	77%	0.766	74%	0.736	S	S	*	*			trans	61.7	172.9	158.7	-68.7	170.7	172.4	-101.9	3	115.6
290	E	28.3	Very low	28.9	Very low	144 Å²	144	145.5 Å²	145.5	67%	0.673	73%	0.726	S	S	*	*			cis	-154	166.6	-33.4	-106.7	160.1	160.1	0	0	109.9
291	E	26.5	Very low	28.6	Very low	151 Å²	151	147.7 Å²	147.7	71%	0.706	73%	0.725	S	S	*	*			trans	25.3	128	158.2	-82.6	-154.6	115.4	0	0	127.2
292	K	28.4	Very low	28.3	Very low	164 Å²	164	145.8 Å²	145.8	71%	0.713	72%	0.724	S	S	*	*				65.1	118.4	124.5	-89.3	-171.5	-166.1	140.9	0	126.5
293	T	25.7	Very low	29.6	Very low	107 Å²	107	145.6 Å²	145.6	66%	0.656	73%	0.73	S	S	*	*				65.8	133	126.7	49.4	0	0	0	0	126.6
294	Q	30.4	Very low	30.6	Very low	178 Å²	178	142.1 Å²	142.1	83%	0.832	73%	0.726	S	S	*	*			trans	74.9	153.9	138.8	-73.6	177.8	-14.1	0	0	120.5
295	S	26.1	Very low	31.8	Very low	86 Å²	86	140.4 Å²	140.4	60%	0.601	73%	0.73	S	S	*	*			cis	-171.1	159.6	-18.5	54.5	0	0	0	0	115
296	S	30.2	Very low	31.7	Very low	95 Å²	95	132.9 Å²	132.9	66%	0.664	73%	0.725	S	S	*	*			trans	67.6	164.3	161.2	76.9	0	0	0	0	118.3
297	K	29.9	Very low	31.9	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.796	73%	0.732	S	S	*	*			cis	-151.3	-166.1	21.5	-107.8	-169.2	172.9	-175.5	0	110.5
298	T	27.9	Very low	32	Very low	97 Å²	97	134.9 Å²	134.9	60%	0.595	74%	0.736	S	S	*	*				-161.5	162.1	-66.9	34.1	0	0	0	0	111.4
299	Q	28.6	Very low	32.1	Very low	161 Å²	161	139.4 Å²	139.4	75%	0.752	75%	0.75	S	S	*	*			trans	72.9	158.6	156.8	-76.7	170.1	-86.1	0	0	120
300	E	29.5	Very low	32.2	Very low	141 Å²	141	134.9 Å²	134.9	66%	0.659	75%	0.745	S	S	*	*			cis	-176	174.5	-18.8	-171.1	174	-169.9	0	0	112.6
301	N	25.7	Very low	32.1	Very low	132 Å²	132	136 Å²	136	71%	0.706	75%	0.75	S	S	*	*			trans	101.6	164.5	154.2	-71.5	-62.4	0	0	0	123.6
302	N	28.8	Very low	32.4	Very low	150 Å²	150	137 Å²	137	80%	0.802	75%	0.754	S	S	*	*			trans	-140.9	-174.6	-164.4	-65	-78.4	0	0	0	111.3
303	P	55.2	Low	34	Very low	123 Å²	123	134 Å²	134	80%	0.799	75%	0.752	S	S	*	*			cis	-124.5	-114.8	-28.6	24.8	2.1	0	0	0	116.2
304	P	54.6	Low	34.1	Very low	113 Å²	113	137.6 Å²	137.6	73%	0.734	76%	0.761	S	S	*	*			trans	-127.3	-148.3	-135	44.7	-22	0	0	0	114.2
305	P	50.2	Low	34.2	Very low	127 Å²	127	136.8 Å²	136.8	83%	0.825	76%	0.762	S	S	*	*			cis	-132.7	-163	-18.9	43.4	-25	0	0	0	114.7
306	G	28.1	Very low	34.5	Very low	78 Å²	78	135.9 Å²	135.9	80%	0.804	77%	0.767	S	S	*	*			trans	167.8	117.2	161	0	0	0	0	0	122.9
307	A	31	Very low	34.9	Very low	103 Å²	103	139.4 Å²	139.4	85%	0.851	78%	0.777	S	S	*	*			trans	46.2	112.4	143	0	0	0	0	0	127.9
308	K	31.6	Very low	36.4	Very low	206 Å²	206	135.7 Å²	135.7	90%	0.896	77%	0.771	S	S	*	*			trans	17.6	142.2	133.5	-56.1	-176.1	177.7	-178.6	0	125.3
309	M	30.2	Very low	36.8	Very low	185 Å²	185	140.8 Å²	140.8	91%	0.911	79%	0.785	S	S	*	*				-170.9	-176.7	128.4	-102.6	178.2	179.3	0	0	111.1
310	T	29.6	Very low	37	Very low	108 Å²	108	140.6 Å²	140.6	66%	0.663	78%	0.784	S	S	*	*				-166.6	142.2	-69.6	-79.4	0	0	0	0	111.9
311	E	25.9	Very low	37.4	Very low	168 Å²	168	140.4 Å²	140.4	79%	0.785	79%	0.786	S	S	*	*			trans	58.2	166.4	164.4	-77.6	-172.3	160.9	0	0	121.6
312	H	32	Very low	37.6	Very low	171 Å²	171	139.4 Å²	139.4	79%	0.792	79%	0.789	S	S	*	*				-161.4	178.7	-50.3	-113.6	-18.2	0	0	0	110.1
313	P	63.6	Low	37.6	Very low	102 Å²	102	142.4 Å²	142.4	66%	0.662	79%	0.794	S	S	*	*			trans	-131.9	179.3	-155.9	46.3	-32.9	0	0	0	117.9
314	E	28	Very low	36.5	Very low	182 Å²	182	140 Å²	140	85%	0.85	79%	0.793	S	S	*	*			trans	-145.5	135.2	152.6	46.6	-178.3	-151.7	0	0	109.2
315	N	31.4	Very low	35.5	Very low	161 Å²	161	140.5 Å²	140.5	86%	0.861	80%	0.798	S	S	*	*			cis	89	128.8	47.3	-68.5	-29.2	0	0	0	113
316	G	31.5	Very low	34.9	Very low	68 Å²	68	138.7 Å²	138.7	70%	0.701	79%	0.789	S	S	*	*			trans	-151	-86.4	-165.6	0	0	0	0	0	116.9
317	I	40	Very low	35.1	Very low	169 Å²	169	141.8 Å²	141.8	87%	0.867	79%	0.792	S	S	*	*			trans	64	169	175.4	18.9	-178.6	0	0	0	117
318	P	61.9	Low	35.2	Very low	105 Å²	105	141.6 Å²	141.6	68%	0.682	78%	0.784	S	S	*	*			trans	-139.3	-163.5	-131.2	46	-25.6	0	0	0	116.1
319	K	34.5	Very low	35.1	Very low	204 Å²	204	138 Å²	138	89%	0.887	78%	0.779	S	S	*	*			trans	-177.5	162	144.9	-94.1	142.1	-172.6	176.5	0	109.4
320	E	34.2	Very low	35.4	Very low	156 Å²	156	133.3 Å²	133.3	73%	0.729	77%	0.77	S	S	*	*			cis	160.7	153.5	-29.1	-119.5	-73	80.3	0	0	107.4
321	I	37.2	Very low	35.4	Very low	137 Å²	137	137.1 Å²	137.1	70%	0.703	78%	0.78	S	S	*	*			trans	91.3	132.9	156.2	-62.5	151.8	0	0	0	122.9
322	C	30.1	Very low	35.9	Very low	112 Å²	112	137.8 Å²	137.8	76%	0.757	78%	0.783	S	S	*	*			trans	93.4	84.8	152.2	-89.4	0	0	0	0	125.7
323	K	29.1	Very low	36.9	Very low	212 Å²	212	134.7 Å²	134.7	92%	0.922	78%	0.778	S	S	*	*				28.2	142.1	122.6	-63.6	-171.7	175.7	-175.3	0	124.1
324	G	31.6	Very low	35.6	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	78%	0.783	S	S	*	*				156	114.8	128.2	0	0	0	0	0	120.6
325	S	34.4	Very low	35.9	Very low	122 Å²	122	136.2 Å²	136.2	85%	0.853	78%	0.778	S	S	*	*			trans	57.8	155.5	153	-109.7	0	0	0	0	122
326	S	36.3	Very low	35.8	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	77%	0.774	S	S	*	*			cis	-178.4	137.4	-30.1	47.2	0	0	0	0	113.1
327	V	33.2	Very low	35.9	Very low	142 Å²	142	136 Å²	136	86%	0.861	78%	0.777	S	S	*	*			trans	67.7	149.5	145.9	176	0	0	0	0	117.2
328	S	32.2	Very low	36.2	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	77%	0.769	S	S	*	*			cis	-156.7	157	16.2	28.2	0	0	0	0	114.3
329	V	29.2	Very low	34.8	Very low	130 Å²	130	137.3 Å²	137.3	79%	0.788	78%	0.777	S	S	*	*			trans	48.7	116.9	138.6	179.2	0	0	0	0	118.9
330	A	37	Very low	34.8	Very low	88 Å²	88	134.7 Å²	134.7	73%	0.727	77%	0.772	S	S	*	*				75.4	151.1	57.8	0	0	0	0	0	114
331	E	29.9	Very low	34.9	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	78%	0.78	S	S	*	*			cis	-139.9	180	19.7	-63.8	-173.3	130	0	0	114.8
332	H	37.1	Very low	35	Very low	182 Å²	182	140.8 Å²	140.8	84%	0.843	79%	0.787	S	S	*	*			trans	-127.9	154.8	173.8	-111.4	-39.7	0	0	0	108.5
333	P	53.3	Low	35.2	Very low	106 Å²	106	145 Å²	145	69%	0.688	79%	0.793	S	S	*	*				-160.3	144.4	102.9	36.6	-15.9	0	0	0	119.5
334	L	36.1	Very low	35.5	Very low	146 Å²	146	140.2 Å²	140.2	76%	0.764	79%	0.786	S	S	*	*				54.1	155.4	127.7	-49.5	175.2	0	0	0	121.2
335	K	33.8	Very low	35.7	Very low	170 Å²	170	146.3 Å²	146.3	74%	0.739	79%	0.792	S	S	*	*			cis	-164.1	155.8	-9.3	-123.2	176.2	177.1	174.2	0	112.6
336	C	29.4	Very low	36.1	Very low	117 Å²	117	146.3 Å²	146.3	79%	0.791	79%	0.789	S	S	*	*			trans	61.2	142.4	146.5	-66.8	0	0	0	0	123.7
337	S	33.6	Very low	36	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	80%	0.797	S	S	*	*			trans	-92.7	179.1	162.1	68.5	0	0	0	0	110.2
338	P	45.7	Very low	36.7	Very low	107 Å²	107	147 Å²	147	70%	0.695	80%	0.797	S	S	*	*				-157	-170.9	60.2	43.3	-20.7	0	0	0	118.3
339	K	32.2	Very low	36.7	Very low	194 Å²	194	147.4 Å²	147.4	84%	0.843	80%	0.8	S	S	*	*			trans	92.1	154.2	154.7	-75.9	-177.2	178.5	-177.5	0	121.3
340	D	34.7	Very low	37.1	Very low	149 Å²	149	147.8 Å²	147.8	80%	0.797	80%	0.802	S	S	*	*			trans	-79.7	148.6	-163.2	-43.6	-99.2	0	0	0	115
341	R	37.1	Very low	36.9	Very low	236 Å²	236	147.7 Å²	147.7	89%	0.891	80%	0.802	S	S	*	*			trans	-159.9	143.1	137.6	-118.9	167.8	177.4	157.5	-1.2	112.2
342	H	40	Very low	37.6	Very low	185 Å²	185	148.1 Å²	148.1	86%	0.856	80%	0.804	S	S	*	*			trans	-66	144.6	165.3	-71.1	-102.6	0	0	0	110.1
343	F	33.7	Very low	38.2	Very low	200 Å²	200	148.5 Å²	148.5	88%	0.877	81%	0.806	S	S	*	*			trans	-141.8	157.9	156.5	-111.9	-81.4	0	0	0	112.5
344	S	35.2	Very low	37.3	Very low	111 Å²	111	153.6 Å²	153.6	78%	0.776	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-90.5	173.1	-166.7	-65.4	0	0	0	0	114.1
345	K	36	Very low	37.4	Very low	203 Å²	203	152.8 Å²	152.8	88%	0.883	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-49.8	140.5	173	-49	166.8	-174.4	172.7	0	112.2
346	P	43.3	Very low	37.8	Very low	122 Å²	122	150.3 Å²	150.3	79%	0.792	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.3	150.9	155.9	34.3	-32	0	0	0	111.2
347	S	32.4	Very low	38.5	Very low	115 Å²	115	153.1 Å²	153.1	80%	0.804	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-98.3	153.2	158.1	-68.9	0	0	0	0	109.1
348	P	49.3	Very low	38.7	Very low	132 Å²	132	154.7 Å²	154.7	86%	0.857	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75.8	162.9	179.7	32.8	-36	0	0	0	112.7
349	S	32	Very low	38.4	Very low	107 Å²	107	154.1 Å²	154.1	75%	0.748	82%	0.819	S	S	*	*			trans	-143.7	160.3	168.9	-174	0	0	0	0	109
350	T	36.5	Very low	38.7	Very low	137 Å²	137	156.7 Å²	156.7	84%	0.84	82%	0.824	S	S	*	*			trans	64.7	149.2	-173.3	84	0	0	0	0	114.8
351	A	34.2	Very low	38.6	Very low	87 Å²	87	153 Å²	153	72%	0.719	82%	0.82	S	S	*	*			cis	-144	-170.7	3.9	0	0	0	0	0	112.1
352	E	43.8	Very low	38.4	Very low	196 Å²	196	150.9 Å²	150.9	92%	0.916	82%	0.821	S	S	*	*			trans	104	85.5	162.6	-61	177.6	-170	0	0	117.5
353	E	49.9	Very low	38.1	Very low	191 Å²	191	145.8 Å²	145.8	89%	0.893	81%	0.811	S	S	*	*			trans	-82.7	139.2	147.5	-62.1	173.7	114.1	0	0	109.3
354	Y	35.2	Very low	38.2	Very low	212 Å²	212	144.5 Å²	144.5	83%	0.831	81%	0.813	S	S	*	*			trans	-165.9	162.4	133.6	-133.4	-102.8	0	0	0	112.7
355	N	38	Very low	38.5	Very low	130 Å²	130	147 Å²	147	70%	0.695	82%	0.817	S	S	*	*			trans	82.8	95.5	173.3	-47.7	-68.7	0	0	0	117.6
356	T	41.9	Very low	39.4	Very low	117 Å²	117	142 Å²	142	72%	0.718	81%	0.805	S	S	*	*				24.1	119.1	127.6	50.8	0	0	0	0	118.5
357	E	42.8	Very low	39	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	81%	0.806	S	S	*	*				86.9	150.1	60.5	-172.6	171.1	-131.2	0	0	113.2
358	V	39.2	Very low	39.2	Very low	140 Å²	140	144.7 Å²	144.7	85%	0.848	80%	0.804	S	S	*	*			trans	74.5	126.6	-172.5	-170	0	0	0	0	113.2
359	A	39.6	Very low	38.9	Very low	96 Å²	96	145.5 Å²	145.5	79%	0.793	80%	0.8	S	S	*	*			cis	-130.1	162.9	2.7	0	0	0	0	0	113.1
360	R	38.2	Very low	39.7	Very low	247 Å²	247	145.7 Å²	145.7	93%	0.932	80%	0.799	S	S	*	*			trans	-97.2	133	177.5	-172.6	-176	-163.9	151	0.2	109.7
361	G	32.9	Very low	39.7	Very low	71 Å²	71	146.8 Å²	146.8	73%	0.732	80%	0.799	S	S	*	*			trans	-91.5	142.5	-177.9	0	0	0	0	0	114.5
362	Q	32.8	Very low	39.8	Very low	192 Å²	192	151.7 Å²	151.7	90%	0.897	81%	0.807	S	S	*	*			trans	-160.4	157.6	153.8	-95.4	-176.4	-98.6	0	0	107.2
363	A	33.2	Very low	39.4	Very low	79 Å²	79	149.9 Å²	149.9	65%	0.653	80%	0.803	S	S	*	*			cis	177	116.3	-34.9	0	0	0	0	0	106
364	D	35.2	Very low	38.5	Very low	172 Å²	172	147.5 Å²	147.5	92%	0.92	80%	0.801	S	S	*	*			trans	-157.8	154.6	164.4	-94	-39.2	0	0	0	110.3
365	L	42.6	Very low	38.5	Very low	165 Å²	165	142 Å²	142	86%	0.864	80%	0.8	S	S	*	*			trans	-156	166.7	-171.3	-91.3	162.2	0	0	0	107.9
366	P	53.6	Low	38.2	Very low	96 Å²	96	141.7 Å²	141.7	62%	0.623	81%	0.808	S	S	*	*			cis	-128	-176.5	-3	25.2	-0.2	0	0	0	113
367	D	34.8	Very low	38	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	81%	0.811	S	S	*	*				177.6	135.4	110	-90.4	-17.6	0	0	0	115.3
368	D	37.7	Very low	38.4	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	81%	0.806	S	S	*	*			trans	33.6	104.2	152.4	-119	3.5	0	0	0	123.3
369	L	43	Very low	38.9	Very low	150 Å²	150	137.3 Å²	137.3	79%	0.785	80%	0.802	S	S	*	*				175.5	159.2	104.1	-115.7	64	0	0	0	111.7
370	P	49	Very low	38.8	Very low	111 Å²	111	139.1 Å²	139.1	72%	0.721	80%	0.803	S	S	*	*			trans	-99.7	149.4	-165.4	37.1	-34.3	0	0	0	117
371	L	36.2	Very low	38.8	Very low	159 Å²	159	132 Å²	132	83%	0.832	79%	0.792	S	S	*	*			trans	2.1	129.9	145.6	-53.5	168.7	0	0	0	118.3
372	Q	37.1	Very low	39.1	Very low	190 Å²	190	139.8 Å²	139.8	89%	0.888	80%	0.799	S	S	*	*				-175.1	171.3	91.2	-94.8	-162.2	42.9	0	0	113.9
373	L	33.8	Very low	39.1	Very low	159 Å²	159	135.9 Å²	135.9	83%	0.832	79%	0.789	S	S	*	*			trans	-82.3	148.6	-175.8	-58.3	162.2	0	0	0	112.5
374	T	32.2	Very low	39.5	Very low	140 Å²	140	136.7 Å²	136.7	86%	0.859	80%	0.795	S	S	*	*				175.9	150.7	122.5	-74.2	0	0	0	0	110.7
375	A	35.2	Very low	39.4	Very low	97 Å²	97	135.7 Å²	135.7	80%	0.802	79%	0.79	S	S	*	*			trans	-76.4	152.1	-175.6	0	0	0	0	0	114.5
376	S	31.4	Very low	39.3	Very low	123 Å²	123	133.5 Å²	133.5	86%	0.86	78%	0.784	S	S	*	*			trans	-152.2	165.4	164.6	64.8	0	0	0	0	111.8
377	S	38	Very low	38.5	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	79%	0.787	S	S	*	*			trans	-163.7	169	173.8	62.7	0	0	0	0	109.1
378	P	49.8	Very low	38.7	Very low	113 Å²	113	133.3 Å²	133.3	73%	0.734	79%	0.787	S	S	*	*			cis	-114.2	176.4	-27.5	39.3	-27.1	0	0	0	111.4
379	P	50.8	Low	39.2	Very low	118 Å²	118	132 Å²	132	77%	0.766	79%	0.787	S	S	*	*			trans	-87	127.8	-173.7	32.2	-34.6	0	0	0	116.4
380	T	38.4	Very low	38.8	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	79%	0.785	S	S	*	*				71.7	137.5	122.4	-45.9	0	0	0	0	121.8
381	S	36.5	Very low	38.8	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	79%	0.785	S	S	*	*			trans	-97.5	176.5	178.3	52.7	0	0	0	0	113.5
382	W	39.8	Very low	38.7	Very low	233 Å²	233	129.4 Å²	129.4	88%	0.883	78%	0.784	S	S	*	*			trans	-124	146.7	161.3	-83.7	77.3	0	0	0	113
383	T	33.8	Very low	38.6	Very low	110 Å²	110	124.4 Å²	124.4	68%	0.675	78%	0.775	S	S	*	*			trans	-34.3	145.7	170.9	51.3	0	0	0	0	116.4
384	A	41.5	Very low	38.7	Very low	96 Å²	96	122.6 Å²	122.6	79%	0.793	77%	0.77	S	S	*	*			cis	82.8	116.2	30.5	0	0	0	0	0	116.3
385	D	32.3	Very low	38.9	Very low	152 Å²	152	123.6 Å²	123.6	81%	0.813	77%	0.77	S	S	*	*			trans	-159.3	170	150	-141.7	-39.1	0	0	0	112.2
386	T	41.1	Very low	39	Very low	118 Å²	118	125.9 Å²	125.9	72%	0.724	77%	0.765	S	S	*	*			trans	-46.9	140.5	178.2	44.5	0	0	0	0	115.6
387	A	35.5	Very low	39.5	Very low	83 Å²	83	128.7 Å²	128.7	69%	0.686	77%	0.768	S	S	*	*			cis	74.9	133.6	48.1	0	0	0	0	0	112.6
388	I	39.7	Very low	39.2	Very low	161 Å²	161	132.2 Å²	132.2	83%	0.826	76%	0.764	S	S	*	*			cis	-162.2	-178.2	6.6	24.2	163.9	0	0	0	108.1
389	P	48.3	Very low	39	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	77%	0.769	S	S	*	*			cis	-131.7	-98.7	8.3	36.2	-13	0	0	0	116.1
390	T	33.6	Very low	38.6	Very low	122 Å²	122	133.9 Å²	133.9	75%	0.748	76%	0.764	S	S	*	*			trans	-159.7	163.1	-167.8	-13.1	0	0	0	0	110.4
391	P	49.9	Very low	38.4	Very low	113 Å²	113	131.8 Å²	131.8	73%	0.734	76%	0.755	S	S	*	*				-147.8	147.7	74.6	37.7	-18.2	0	0	0	118.4
392	T	34.2	Very low	38.4	Very low	130 Å²	130	136.7 Å²	136.7	80%	0.798	76%	0.764	S	S	*	*			trans	62.1	120.6	149	-48.5	0	0	0	0	117.9
393	A	35.4	Very low	38.8	Very low	85 Å²	85	131.1 Å²	131.1	70%	0.702	76%	0.758	S	S	*	*				-159.7	135.6	58.9	0	0	0	0	0	116.9
394	V	36.1	Very low	39	Very low	122 Å²	122	132.2 Å²	132.2	74%	0.739	77%	0.769	S	S	*	*			trans	69.1	132.9	132.7	176.7	0	0	0	0	121.9
395	N	36.8	Very low	38.6	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	76%	0.764	S	S	*	*			trans	76.4	104	163.1	-71.2	-13.5	0	0	0	121
396	Q	35.3	Very low	38.8	Very low	146 Å²	146	137.2 Å²	137.2	68%	0.682	77%	0.766	S	S	*	*			trans	-83	154.1	162.1	-52.2	166.4	25.1	0	0	110.6
397	I	42.4	Very low	38.9	Very low	182 Å²	182	141.2 Å²	141.2	93%	0.933	77%	0.773	S	S	*	*			trans	-131.2	145.7	138.1	-85.9	165.7	0	0	0	107
398	R	31.3	Very low	38.9	Very low	185 Å²	185	148.2 Å²	148.2	70%	0.698	78%	0.782	S	S	*	*			trans	-125	137.5	-160.4	-177.4	-175	-60.5	-175.3	2.8	112.3
399	I	46.6	Very low	38.7	Very low	165 Å²	165	149.2 Å²	149.2	85%	0.846	78%	0.78	S	S	*	*			trans	-97.5	133	167.2	-57.3	173.3	0	0	0	109.6
400	P	43.1	Very low	37.9	Very low	101 Å²	101	151.4 Å²	151.4	66%	0.656	79%	0.785	S	S	*	*			trans	-139.9	164.7	142.8	35.9	-21.9	0	0	0	113
401	S	32.6	Very low	38	Very low	89 Å²	89	150.9 Å²	150.9	62%	0.622	79%	0.786	S	S	*	*			cis	175.4	115.6	-42.8	49	0	0	0	0	108.9
402	F	36.9	Very low	37.4	Very low	202 Å²	202	152.1 Å²	152.1	89%	0.886	79%	0.786	S	S	*	*			trans	60.7	175.7	165.1	-60.1	-64.6	0	0	0	117.2
403	P	49.1	Very low	38.3	Very low	117 Å²	117	151.3 Å²	151.3	76%	0.76	78%	0.783	S	S	*	*			cis	-119.2	169.5	-10.9	37.2	-22.5	0	0	0	114.8
404	C	37.4	Very low	38.5	Very low	132 Å²	132	153.5 Å²	153.5	89%	0.892	79%	0.787	S	S	*	*			trans	-92	146.3	159.8	-76.6	0	0	0	0	110.5
405	D	34.1	Very low	38.7	Very low	131 Å²	131	156.6 Å²	156.6	70%	0.701	79%	0.794	S	S	*	*			trans	-148.5	158.2	168.5	-163.5	16.9	0	0	0	113.2
406	R	36.1	Very low	38.7	Very low	223 Å²	223	155.3 Å²	155.3	84%	0.842	79%	0.787	S	S	*	*			trans	64	127.9	161	-80.7	154.7	-168	-133.4	-9.5	121.7
407	K	42	Very low	38.9	Very low	202 Å²	202	159.5 Å²	159.5	88%	0.878	80%	0.797	S	S	*	*			trans	-77.3	164.9	171.4	-33.3	-166.5	-178.2	-166.2	0	111.2
408	R	35.3	Very low	38.5	Very low	230 Å²	230	158 Å²	158	87%	0.868	79%	0.79	S	S	*	*				158	110.8	114.1	-177.8	-172.4	-61.7	149.2	-1.7	115.8
409	K	36.2	Very low	38.8	Very low	181 Å²	181	156.2 Å²	156.2	79%	0.787	80%	0.8	S	S	*	*			trans	62.6	147.9	143.1	-64.3	-78.9	-172.8	173.6	0	122.1
410	L	31.5	Very low	38.4	Very low	162 Å²	162	151.2 Å²	151.2	85%	0.848	79%	0.789	S	S	*	*			trans	54.4	118.9	147.9	-65.4	161.1	0	0	0	117.1
411	S	36.7	Very low	38.3	Very low	110 Å²	110	156.5 Å²	156.5	77%	0.769	80%	0.802	S	S	*	*				-162.8	174.5	65.1	54.8	0	0	0	0	113.6
412	D	36.3	Very low	38.6	Very low	139 Å²	139	159.3 Å²	159.3	74%	0.743	81%	0.808	S	S	*	*			trans	-95.2	150	164.7	-162.2	1.6	0	0	0	108.7
413	P	53.8	Low	38.6	Very low	113 Å²	113	157.5 Å²	157.5	73%	0.734	81%	0.807	S	S	*	*				-138.8	146.1	124.9	37.3	-26.3	0	0	0	114.9
414	V	39.1	Very low	38	Very low	131 Å²	131	159.6 Å²	159.6	79%	0.794	81%	0.811	S	S	*	*			trans	-59.7	130.1	165.9	172.5	0	0	0	0	111.1
415	E	40.6	Very low	37.8	Very low	187 Å²	187	157.9 Å²	157.9	87%	0.874	81%	0.806	S	S	*	*			trans	-144	132.2	152.2	-136.5	175.2	-134.1	0	0	111
416	D	37.3	Very low	38.1	Very low	134 Å²	134	156.9 Å²	156.9	72%	0.717	81%	0.81	S	S	*	*			trans	-90	122.4	-179.2	167.9	29	0	0	0	110.4
417	R	37.5	Very low	38.1	Very low	234 Å²	234	157.7 Å²	157.7	88%	0.883	81%	0.813	S	S	*	*			trans	-153.9	134.3	160.6	-123.5	164.4	-176.1	179.8	0.5	117.1	V419	R417-V419 PolarHBondContact O-N 2.97Å
418	N	35.6	Very low	37.9	Very low	150 Å²	150	152.8 Å²	152.8	80%	0.802	80%	0.804	S	S	*	*			trans	-71.7	112.5	179.4	-76.5	-102.8	0	0	0	113
419	V	38.1	Very low	38.4	Very low	148 Å²	148	150.2 Å²	150.2	90%	0.897	81%	0.806	S	S	*	*			trans	-144	143.1	156.2	-175.8	0	0	0	0	105.2	R417	R417-V419 PolarHBondContact O-N 2.97Å
420	G	36.1	Very low	38.5	Very low	60 Å²	60	147.4 Å²	147.4	62%	0.619	81%	0.809	S	S	*	*			cis	150	144.6	8.7	0	0	0	0	0	106.4	I422	G420-I422 PolarHBondContact O-N 3.39Å
421	K	42.8	Very low	39	Very low	212 Å²	212	147.9 Å²	147.9	92%	0.922	81%	0.809	S	S	*	*			trans	-76.3	129	-167.8	-60.3	166.3	-171.6	164.9	0	111.4
422	I	38.4	Very low	39.8	Very low	148 Å²	148	148.2 Å²	148.2	76%	0.759	81%	0.809	S	S	*	*			trans	-122	122.3	160.7	-60.9	-178.8	0	0	0	108.6	G420 L424	G420-I422 PolarHBondContact O-N 3.39Å; I422-L424 HydrophobicContact CG2-CD1 3.91Å
423	L	36	Very low	39.7	Very low	164 Å²	164	148.4 Å²	148.4	86%	0.859	82%	0.815	S	S	*	*			trans	-108.2	119.9	166.8	-73.2	164.4	0	0	0	106.7
424	L	37.5	Very low	38.9	Very low	160 Å²	160	147.5 Å²	147.5	84%	0.838	82%	0.817	S	S	*	*			trans	-79.2	125	162.4	-97.8	73.8	0	0	0	108.7	I422	I422-L424 HydrophobicContact CG2-CD1 3.91Å
425	A	32.1	Very low	38.8	Very low	97 Å²	97	145.7 Å²	145.7	80%	0.802	82%	0.816	S	S	*	*			trans	-122	132.3	166.5	0	0	0	0	0	107.9
426	S	40.8	Very low	38.4	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	81%	0.814	S	S	*	*			trans	-128.6	123.9	-180	-58.6	0	0	0	0	111.1
427	R	37.4	Very low	38.4	Very low	240 Å²	240	143.1 Å²	143.1	91%	0.906	82%	0.818	S	S	*	*			trans	-87.7	172.7	152.5	-54.2	175.7	173.4	-173.4	-3.6	106.8
428	S	37.3	Very low	39.6	Very low	99 Å²	99	137.4 Å²	137.4	69%	0.692	81%	0.811	S	S	*	*			cis	-150.5	145.4	15.9	-49.7	0	0	0	0	108.4
429	L	44.6	Very low	40.2	Very low	175 Å²	175	135.8 Å²	135.8	92%	0.916	81%	0.809	S	S	*	*				44.6	121.9	101.9	-54.5	175.2	0	0	0	117.9
430	S	37.9	Very low	40	Very low	122 Å²	122	137 Å²	137	85%	0.853	81%	0.805	S	S	*	*			trans	-151.1	160.6	149.7	57.2	0	0	0	0	109.7
431	M	43.2	Very low	39.6	Very low	173 Å²	173	140.4 Å²	140.4	85%	0.852	81%	0.808	S	S	*	*			trans	-128.7	161.9	-175.7	-75.7	-120.6	81.6	0	0	110.9
432	P	53.1	Low	39.6	Very low	117 Å²	117	138.4 Å²	138.4	76%	0.76	80%	0.8	S	S	*	*			trans	-86.4	166.1	-172.8	35.6	-35.9	0	0	0	114.2
433	T	33.8	Very low	40	Very low	143 Å²	143	137.5 Å²	137.5	88%	0.877	80%	0.804	S	S	*	*			trans	-113.4	147.9	-179.4	-57.4	0	0	0	0	111.3
434	A	36.7	Very low	40.3	Very low	93 Å²	93	138.9 Å²	138.9	77%	0.769	81%	0.808	S	S	*	*			trans	-125.6	170.3	168.8	0	0	0	0	0	108.7
435	A	37.3	Very low	40	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	80%	0.798	S	S	*	*			cis	-155.5	-165	7.9	0	0	0	0	0	109.7
436	V	32.8	Very low	40.4	Very low	139 Å²	139	140.5 Å²	140.5	84%	0.842	80%	0.803	S	S	*	*			trans	137.2	139	149.6	169.8	0	0	0	0	114.2
437	T	36.7	Very low	39.9	Very low	128 Å²	128	142.9 Å²	142.9	79%	0.785	80%	0.802	S	S	*	*			trans	-159.1	176.6	179.2	47.1	0	0	0	0	108.5
438	P	62.5	Low	39.6	Very low	114 Å²	114	137 Å²	137	74%	0.74	80%	0.796	S	S	*	*			cis	-117.8	-153.5	-27.2	35	-13.7	0	0	0	110.2
439	P	48.8	Very low	39.3	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	80%	0.797	S	S	*	*				-146.6	153.5	70.7	38.3	-18.3	0	0	0	118.4
440	Q	33.2	Very low	38.6	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.813	79%	0.793	S	S	*	*			trans	17.6	130.2	147	-60.8	-69.4	-4.7	0	0	122.5
441	D	29.6	Very low	38.2	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	78%	0.783	S	S	*	*				-154	175.9	114.5	-139.8	-31.7	0	0	0	112.3
442	K	41.6	Very low	37.7	Very low	170 Å²	170	133.7 Å²	133.7	74%	0.739	78%	0.783	S	S	*	*			trans	-82.4	155.2	-152.4	-63.3	159.7	-154.4	78.5	0	117.5
443	P	47.8	Very low	36.7	Very low	130 Å²	130	136.8 Å²	136.8	84%	0.844	79%	0.787	S	S	*	*			trans	-82.6	166.8	166.5	36.4	-35.9	0	0	0	112.9
444	M	41.4	Very low	36.7	Very low	192 Å²	192	136.1 Å²	136.1	95%	0.946	79%	0.788	S	S	*	*			trans	-115.6	141.7	173.9	-173.8	160.3	62.6	0	0	111.3
445	D	30.7	Very low	36.3	Very low	117 Å²	117	137 Å²	137	63%	0.626	79%	0.788	S	S	*	*			trans	-93.3	152.8	-174.7	-178.9	26.8	0	0	0	112.7	H447	D445-H447 IonicContact OD1-CD2 3.97Å; D445-H447 PolarHBondContact OD1-CD2 2.87Å; D445-H447 VanDerWaalsContact OD1-CD2 3.26Å; D445-H447 IonicContact OD1-NE2 2.68Å; D445-H447 IonicContact OD2-CD2 2.69Å
446	L	40	Very low	36.2	Very low	174 Å²	174	139.3 Å²	139.3	91%	0.911	79%	0.793	S	S	*	*			trans	-166.3	103	158.9	-113	173.4	0	0	0	111.4
447	H	32.3	Very low	36.1	Very low	160 Å²	160	138.1 Å²	138.1	74%	0.741	79%	0.79	S	S	*	*			trans	-89.2	131.4	175.4	-86.2	-93.1	0	0	0	113.5	D445	D445-H447 IonicContact OD1-CD2 3.97Å; D445-H447 PolarHBondContact OD1-CD2 2.87Å; D445-H447 VanDerWaalsContact OD1-CD2 3.26Å; D445-H447 IonicContact OD1-NE2 2.68Å; D445-H447 IonicContact OD2-CD2 2.69Å
448	C	30.6	Very low	36	Very low	117 Å²	117	136.8 Å²	136.8	79%	0.791	79%	0.792	S	S	*	*			trans	-176.5	131.4	143.8	-90.4	0	0	0	0	107.2
449	S	31.2	Very low	34.4	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	80%	0.795	S	S	*	*			cis	71.6	131.7	35.6	96.4	0	0	0	0	111.9
450	V	29.4	Very low	33.6	Very low	135 Å²	135	142.8 Å²	142.8	82%	0.818	80%	0.801	S	S	*	*			cis	-149.4	159.5	14.2	173.7	0	0	0	0	111.9
451	A	29.4	Very low	33.6	Very low	78 Å²	78	141.8 Å²	141.8	65%	0.645	80%	0.801	S	S	*	*			trans	80.4	150	155.7	0	0	0	0	0	123
452	H	33.3	Very low	33.8	Very low	185 Å²	185	140.7 Å²	140.7	86%	0.856	81%	0.81	S	S	*	*			trans	-112.8	143.9	170.7	-58.4	-109.9	0	0	0	110.6
453	H	31.8	Very low	33.5	Very low	182 Å²	182	140.6 Å²	140.6	84%	0.843	82%	0.818	S	S	*	*			trans	-136.7	131.4	157.3	-45.8	-48.6	0	0	0	109.7
454	S	33.1	Very low	32.7	Very low	128 Å²	128	137.8 Å²	137.8	90%	0.895	81%	0.812	S	S	*	*			trans	-91.2	138.5	162	-63.7	0	0	0	0	109.1
455	S	29.6	Very low	32.7	Very low	112 Å²	112	133 Å²	133	78%	0.783	80%	0.798	S	S	*	*			trans	-152.7	134.2	153.2	-166.6	0	0	0	0	111
456	T	34.2	Very low	32.9	Very low	141 Å²	141	135.3 Å²	135.3	87%	0.865	81%	0.805	S	S	*	*			trans	-103.5	128.1	169.3	-53.6	0	0	0	0	107.4
457	C	30.6	Very low	32.5	Very low	115 Å²	115	134.2 Å²	134.2	78%	0.777	80%	0.795	S	S	*	*			trans	-138.9	113.8	168.1	54.4	0	0	0	0	110.1
458	A	33.8	Very low	33.2	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	80%	0.8	S	S	*	*			trans	-114.2	141.3	167.3	0	0	0	0	0	107.9
459	T	28.8	Very low	34.9	Very low	133 Å²	133	134.9 Å²	134.9	82%	0.816	80%	0.797	S	S	*	*			trans	-143.6	110.6	-174.9	-28.7	0	0	0	0	110.7
460	Y	33.6	Very low	35.1	Very low	224 Å²	224	138.7 Å²	138.7	88%	0.878	81%	0.805	S	S	*	*			trans	-158.4	166.9	137.8	67.3	-99.3	0	0	0	109.4
461	D	33.2	Very low	35.9	Very low	152 Å²	152	139 Å²	139	81%	0.813	80%	0.802	S	S	*	*			trans	-85.5	145.7	-146.4	-50.5	-91.6	0	0	0	117
462	A	34.1	Very low	36.4	Very low	107 Å²	107	142.9 Å²	142.9	88%	0.884	81%	0.812	S	S	*	*			trans	-154.3	118.6	147	0	0	0	0	0	109.3
463	N	33.5	Very low	36.4	Very low	168 Å²	168	138.7 Å²	138.7	90%	0.898	80%	0.803	S	S	*	*			trans	-100.2	142.8	-177.3	-173.5	20.8	0	0	0	111.7
464	G	33	Very low	36.4	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	80%	0.801	S	S	*	*			trans	-171.3	76.3	-174.1	0	0	0	0	0	114.7
465	S	39.4	Very low	37.4	Very low	93 Å²	93	134.2 Å²	134.2	65%	0.65	79%	0.789	S	S	*	*			trans	-0.6	145.1	166.3	-51.1	0	0	0	0	123.4
466	Q	36.1	Very low	37.5	Very low	165 Å²	165	137.6 Å²	137.6	77%	0.771	79%	0.789	S	S	*	*			trans	74.2	146.7	144.3	-83.4	169.4	-78	0	0	118.6
467	E	32.3	Very low	37.3	Very low	150 Å²	150	137.5 Å²	137.5	70%	0.701	78%	0.783	S	S	*	*			cis	-157.5	139.3	-3	-168.4	159.4	114.5	0	0	112.3
468	E	45.3	Very low	37.3	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	79%	0.787	S	S	*	*			trans	38.4	159.8	158.7	-66	-130.4	116.4	0	0	124.9
469	P	66.6	Low	37	Very low	111 Å²	111	149.7 Å²	149.7	72%	0.721	79%	0.792	S	S	*	*			trans	-115.6	-177.4	-165.9	43.5	-32.5	0	0	0	115.3
470	M	36.4	Very low	37.1	Very low	182 Å²	182	152.3 Å²	152.3	90%	0.897	79%	0.787	S	S	*	*			trans	-143.3	125.6	161.4	-162.6	178.7	-62.2	0	0	110.7
471	D	45.4	Very low	37	Very low	141 Å²	141	147 Å²	147	75%	0.754	78%	0.777	S	S	*	*			trans	-131.6	135	-177.8	-179.4	29	0	0	0	110.5
472	L	41	Very low	36.8	Very low	161 Å²	161	145.5 Å²	145.5	84%	0.843	77%	0.765	S	S	*	*			trans	-151.7	143.9	176.3	-77	-177.3	0	0	0	110.4
473	S	32.8	Very low	36.8	Very low	97 Å²	97	144.7 Å²	144.7	68%	0.678	76%	0.758	S	S	*	*			trans	-132.7	153.6	-147	57.5	0	0	0	0	117
474	C	31.4	Very low	36.6	Very low	118 Å²	118	145 Å²	145	80%	0.797	76%	0.755	S	S	*	*			trans	71	170.4	148.4	-76.4	0	0	0	0	119.7
475	P	54.6	Low	36.4	Very low	98 Å²	98	148.1 Å²	148.1	64%	0.636	76%	0.759	S	S	*	*			cis	-146.4	-176	-40.9	41.5	-25.2	0	0	0	116.2
476	K	31.7	Very low	35.8	Very low	182 Å²	182	151.9 Å²	151.9	79%	0.791	77%	0.766	S	S	*	*			trans	73.8	153.2	153.9	-76.8	166.1	-172.1	168.7	0	117.9
477	N	29.3	Very low	36.7	Very low	139 Å²	139	149.1 Å²	149.1	74%	0.743	76%	0.762	S	S	*	*			cis	-147.2	-172.8	6.9	-95.7	-40.4	0	0	0	110.2
478	R	31.7	Very low	37.5	Very low	229 Å²	229	146.8 Å²	146.8	86%	0.864	76%	0.76	S	S	*	*				164.9	75.4	-53.7	-171.6	-162	175.2	-150.3	-2.6	112.8
479	R	27.7	Very low	36.8	Very low	242 Å²	242	144.3 Å²	144.3	91%	0.913	76%	0.757	S	S	*	*			trans	-162.7	132.8	164.1	-104.7	172.1	-174.9	179.2	0.1	108.2
480	R	29.7	Very low	35	Very low	189 Å²	189	147.6 Å²	147.6	71%	0.713	76%	0.763	S	S	*	*			cis	70.8	124.2	28.4	-130.3	-173.9	-168.4	-85	-1.8	111.3	E482	R480-E482 WeakPolarHBondContact CG-OE2 3.33Å; R480-E482 IonicContact CZ-OE1 3.02Å; R480-E482 IonicContact CZ-OE2 2.72Å; R480-E482 IonicContact NE-OE2 3.09Å; R480-E482 IonicContact NH1-OE1 2.7Å; R480-E482 PolarHBondContact NH1-OE1 3.13Å; R480-E482 IonicContact NH1-OE2 2.66Å; R480-E482 PolarHBondContact NH1-OE2 3.09Å; R480-E482 IonicContact NH2-OE1 3.75Å; R480-E482 PolarHBondContact NH2-OE1 3.38Å; R480-E482 IonicContact NH2-OE2 2.72Å
481	V	31.3	Very low	34.8	Very low	111 Å²	111	143.6 Å²	143.6	67%	0.673	76%	0.759	S	S	*	*				-153.3	138.1	51.3	167.3	0	0	0	0	111.1
482	E	29.4	Very low	34	Very low	122 Å²	122	145.4 Å²	145.4	57%	0.57	76%	0.763	S	S	*	*				30.2	152.5	114.9	-53.1	117.9	109	0	0	117.4	R480	R480-E482 WeakPolarHBondContact CG-OE2 3.33Å; R480-E482 IonicContact CZ-OE1 3.02Å; R480-E482 IonicContact CZ-OE2 2.72Å; R480-E482 IonicContact NE-OE2 3.09Å; R480-E482 IonicContact NH1-OE1 2.7Å; R480-E482 PolarHBondContact NH1-OE1 3.13Å; R480-E482 IonicContact NH1-OE2 2.66Å; R480-E482 PolarHBondContact NH1-OE2 3.09Å; R480-E482 IonicContact NH2-OE1 3.75Å; R480-E482 PolarHBondContact NH2-OE1 3.38Å; R480-E482 IonicContact NH2-OE2 2.72Å
483	A	33.1	Very low	34.5	Very low	89 Å²	89	142.9 Å²	142.9	74%	0.736	76%	0.756	S	S	*	*			cis	-170.6	178.4	7	0	0	0	0	0	108.4
484	E	29.5	Very low	34.5	Very low	176 Å²	176	142.2 Å²	142.2	82%	0.822	76%	0.757	S	S	*	*			cis	-178.1	-176.3	-24.6	-170.3	157.7	102.9	0	0	109.9
485	V	28.8	Very low	34.6	Very low	135 Å²	135	142.7 Å²	142.7	82%	0.818	76%	0.756	S	S	*	*			trans	86.8	157.4	163.6	-167.4	0	0	0	0	119.8
486	Q	27.4	Very low	33.5	Very low	172 Å²	172	146.5 Å²	146.5	80%	0.804	77%	0.765	S	S	*	*			trans	-134.7	-151.7	-162.7	-37.2	172.6	-22.7	0	0	112.6
487	P	54.5	Low	33.4	Very low	107 Å²	107	144.7 Å²	144.7	70%	0.695	76%	0.764	S	S	*	*			cis	-124.9	-45.4	-31	22.7	-8.5	0	0	0	125.9
488	P	49.3	Very low	33.3	Very low	101 Å²	101	143.6 Å²	143.6	66%	0.656	76%	0.762	S	S	*	*				-134.3	174.8	-118.7	39.9	-21.2	0	0	0	119.9
489	V	31.6	Very low	34.3	Very low	128 Å²	128	137.5 Å²	137.5	78%	0.776	75%	0.752	S	S	*	*			trans	71.6	128.5	166.1	-166.9	0	0	0	0	116.1
490	E	29.1	Very low	34.9	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	75%	0.749	S	S	*	*			cis	116.2	120.9	11.2	-179.9	-177	-142.8	0	0	113
491	A	31	Very low	34.9	Very low	98 Å²	98	128.8 Å²	128.8	81%	0.81	75%	0.749	S	S	*	*			trans	178.2	147.8	153.2	0	0	0	0	0	114.5
492	E	29.6	Very low	35	Very low	180 Å²	180	132.5 Å²	132.5	84%	0.841	76%	0.756	S	S	*	*			trans	-119.1	-171.6	163.9	-91.3	-99.7	169	0	0	107
493	P	50.7	Low	35	Very low	108 Å²	108	132.3 Å²	132.3	70%	0.701	76%	0.759	S	S	*	*			cis	-142.8	-170.8	7.6	43.4	-23.1	0	0	0	117.7
494	A	32.5	Very low	34.8	Very low	83 Å²	83	134.4 Å²	134.4	69%	0.686	76%	0.758	S	S	*	*			trans	77.5	160.1	139.1	0	0	0	0	0	121.6
495	V	34.7	Very low	34.8	Very low	128 Å²	128	131.4 Å²	131.4	78%	0.776	75%	0.752	S	S	*	*			cis	-168.3	161.8	-32.5	140.6	0	0	0	0	108.8
496	E	31.6	Very low	34.9	Very low	178 Å²	178	134 Å²	134	83%	0.832	76%	0.755	S	S	*	*			trans	97.1	129.6	153.1	-106.7	171.8	176.2	0	0	125.8
497	D	28.1	Very low	34.9	Very low	143 Å²	143	132.1 Å²	132.1	77%	0.765	76%	0.755	S	S	*	*			trans	93.2	170.4	133.3	-137.6	6.4	0	0	0	123.8
498	T	28.9	Very low	33.6	Very low	116 Å²	116	132.7 Å²	132.7	71%	0.712	76%	0.762	S	S	*	*			trans	-132.4	-150.1	-134.8	-31.6	0	0	0	0	113.1
499	P	52.8	Low	32.4	Very low	101 Å²	101	133.7 Å²	133.7	66%	0.656	77%	0.77	S	S	*	*			trans	-106.7	-171.6	-132.9	45	-31.7	0	0	0	114.6
500	P	38.8	Very low	32.3	Very low	130 Å²	130	134.8 Å²	134.8	84%	0.844	77%	0.767	S	S	*	*			trans	-121.3	158	140.6	36.6	-29.6	0	0	0	114
501	V	30.1	Very low	32.2	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	76%	0.762	S	S	*	*			trans	-128.2	145.2	177.5	171.9	0	0	0	0	108.7
502	K	33.5	Very low	32.3	Very low	188 Å²	188	135 Å²	135	82%	0.817	76%	0.761	S	S	*	*			trans	155	152.1	154.3	-90.2	156	-175.6	-180	0	111.6
503	D	30	Very low	32.7	Very low	119 Å²	119	132.3 Å²	132.3	64%	0.636	76%	0.758	S	S	*	*			cis	-167.3	153.7	-29.1	-127.2	-22.3	0	0	0	110.2
504	N	29.2	Very low	31.6	Very low	133 Å²	133	136 Å²	136	71%	0.711	77%	0.766	S	S	*	*			trans	59.5	172.7	159.1	-75	-54.1	0	0	0	120.5
505	T	28.3	Very low	32	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.693	77%	0.773	S	S	*	*			cis	179.6	124.6	-48.6	-86.5	0	0	0	0	108.2
506	Q	31.7	Very low	32.1	Very low	190 Å²	190	140.1 Å²	140.1	89%	0.888	77%	0.773	S	S	*	*			trans	-163.2	162	141.9	-147.6	156.3	-5	0	0	113.4
507	T	27.5	Very low	32.5	Very low	131 Å²	131	135.7 Å²	135.7	80%	0.804	77%	0.767	S	S	*	*			trans	-134.4	146.5	-168.2	25.4	0	0	0	0	113.3
508	S	26.6	Very low	33.2	Very low	120 Å²	120	138.5 Å²	138.5	84%	0.839	77%	0.772	S	S	*	*			trans	-167	155.9	150.7	54.9	0	0	0	0	113.7
509	C	24.8	Very low	33.6	Very low	121 Å²	121	142.8 Å²	142.8	82%	0.818	78%	0.781	S	S	*	*			trans	-64.4	174.4	174.1	-62	0	0	0	0	112.8
510	E	28	Very low	33.1	Very low	152 Å²	152	144.8 Å²	144.8	71%	0.71	79%	0.785	S	S	*	*			cis	-168.4	-179.9	31.7	-154.2	-171.1	-134.7	0	0	111.9
511	K	28.7	Very low	33.1	Very low	173 Å²	173	143 Å²	143	75%	0.752	78%	0.776	S	S	*	*			trans	72	114.8	163	-69.6	-175.6	173.2	77.4	0	119.7
512	S	31.4	Very low	33.7	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	77%	0.773	S	S	*	*			trans	-79	164.2	147.7	61.4	0	0	0	0	110.4
513	P	38.3	Very low	34.4	Very low	122 Å²	122	139.9 Å²	139.9	79%	0.792	76%	0.763	S	S	*	*				-142.8	-170.6	82.3	41.2	-26	0	0	0	115
514	E	28.7	Very low	35.2	Very low	185 Å²	185	143 Å²	143	86%	0.864	78%	0.776	S	S	*	*			trans	86.4	125.8	159.7	-155.4	155.9	-130.1	0	0	119.1
515	E	41	Very low	36.2	Very low	179 Å²	179	138.1 Å²	138.1	84%	0.836	76%	0.757	S	S	*	*			trans	-89.5	123.6	179.6	-70.8	-167.9	113.5	0	0	112.5	A517	E515-A517 PolarHBondContact O-N 2.92Å
516	P	36.8	Very low	36.9	Very low	120 Å²	120	140.5 Å²	140.5	78%	0.779	77%	0.765	S	S	*	*			trans	-79.6	105.5	156.9	30.6	-29.9	0	0	0	109.3	K518	P516-K518 PolarHBondContact O-N 3.34Å
517	A	39.6	Very low	38.1	Very low	85 Å²	85	137 Å²	137	70%	0.702	75%	0.752	S	S	*	*			trans	-47.7	127.2	-176.9	0	0	0	0	0	113.1	E515 K519	E515-A517 PolarHBondContact O-N 2.92Å; A517-K519 PolarHBondContact O-N 3.18Å
518	K	41.3	Very low	39.2	Very low	201 Å²	201	136.3 Å²	136.3	87%	0.874	74%	0.741	S	S	*	*			trans	-58.2	101.5	-177	-69.3	179.6	-180	172.9	0	110.7	P516 I520	P516-K518 PolarHBondContact O-N 3.34Å; K518-I520 PolarHBondContact O-N 3.4Å
519	K	37.3	Very low	40.8	Very low	207 Å²	207	134.7 Å²	134.7	90%	0.9	72%	0.723	S	S	*	*			trans	-57.6	105.4	177.5	-68	178.4	-178.6	174.5	0	109	A517 S521	A517-K519 PolarHBondContact O-N 3.18Å; K519-S521 PolarHBondContact O-N 3.29Å
520	I	42.4	Very low	42.2	Very low	142 Å²	142	132.2 Å²	132.2	73%	0.728	70%	0.704	S	S	*	*			trans	-65.5	105.9	-178.3	-58.8	176.1	0	0	0	108.2	K518	K518-I520 PolarHBondContact O-N 3.4Å
521	S	39	Very low	43.3	Very low	94 Å²	94	129 Å²	129	66%	0.657	69%	0.691	S	S	*	*			trans	-59.8	137.3	168.1	46	0	0	0	0	109.3	K519 F523	K519-S521 PolarHBondContact O-N 3.29Å; S521-F523 PolarHBondContact O-N 3.14Å; S521-F523 VanDerWaalsContact O-N 3.14Å
522	P	43.9	Very low	44.6	Very low	101 Å²	101	126.7 Å²	126.7	66%	0.656	69%	0.686	S	S	*	*			trans	-63.9	119	173	26.5	-32.5	0	0	0	108.5	M524	P522-M524 PolarHBondContact O-N 3.23Å; P522-M524 VanDerWaalsContact O-N 3.1Å
523	F	47.9	Very low	45.7	Very low	140 Å²	140	124.6 Å²	124.6	61%	0.614	67%	0.669	S	S	*	*			trans	-65.2	109.7	179.9	179.5	-99.8	0	0	0	109.9	S521 G525	S521-F523 PolarHBondContact O-N 3.14Å; S521-F523 VanDerWaalsContact O-N 3.14Å; F523-G525 VanDerWaalsContact C-N 3.28Å; F523-G525 VanDerWaalsContact CE1-CA 3.44Å; F523-G525 PolarHBondContact O-N 3.21Å
524	M	46.4	Very low	46.2	Very low	185 Å²	185	125.4 Å²	125.4	91%	0.911	67%	0.671	S	S	*	*			trans	-91.5	23.9	179.4	-68.4	-178.7	59.9	0	0	112.9	P522	P522-M524 PolarHBondContact O-N 3.23Å; P522-M524 VanDerWaalsContact O-N 3.1Å
525	G	49.7	Very low	47.2	Very low	29 Å²	29	123.2 Å²	123.2	30%	0.299	67%	0.666	S	S	.	*	S	Bend	trans	-83.9	155.5	176.3	0	0	0	0	0	113.2	F523 I527	F523-G525 VanDerWaalsContact C-N 3.28Å; F523-G525 VanDerWaalsContact CE1-CA 3.44Å; F523-G525 PolarHBondContact O-N 3.21Å; G525-I527 PolarHBondContact O-N 2.8Å
526	N	44.4	Very low	47.5	Very low	163 Å²	163	118.4 Å²	118.4	87%	0.872	65%	0.652	S	S	*	*			trans	-65.3	123	179.2	-67.8	-35	0	0	0	111.3
527	I	55.6	Low	48.2	Very low	118 Å²	118	116.6 Å²	116.6	61%	0.605	64%	0.635	S	S	*	*			trans	-91	109.4	-177.2	-57.9	179.7	0	0	0	110.1	G525 F541	G525-I527 PolarHBondContact O-N 2.8Å; I527-F541 HydrophobicContact CG2-CD1 3.37Å; I527-F541 HydrophobicContact CG2-CE1 3.59Å; I527-F541 HydrophobicContact CG2-CG 4.48Å
528	I	50.3	Low	48.8	Very low	115 Å²	115	115.2 Å²	115.2	59%	0.59	62%	0.618	S	S	*	*			trans	-86.6	119	172	-56	177.5	0	0	0	109.2
529	I	61.2	Low	49.5	Very low	87 Å²	87	107 Å²	107	45%	0.446	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.7	114.6	174	-56.2	173.4	0	0	0	107.9	I532 V539 F541	I529-I532 HydrophobicContact CG2-CD1 4.07Å; I529-I532 HydrophobicContact CG2-CG1 3.57Å; I529-V539 HydrophobicContact CG2-CG1 3.87Å; I529-F541 HydrophobicContact CG1-CE1 4.28Å
530	T	55.1	Low	50.1	Low	68 Å²	68	98.4 Å²	98.4	42%	0.417	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-39	178.6	61.4	0	0	0	0	112	T540 K542	T530-T540 PolarHBondContact OG1-O 2.84Å; T530-K542 HydrophobicContact CG2-CB 4.06Å
531	D	49.3	Very low	51.1	Low	85 Å²	85	93.4 Å²	93.4	46%	0.455	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.8	-172.2	-53.4	-94.7	0	0	0	111.3
532	I	57.1	Low	51.6	Low	125 Å²	125	94.5 Å²	94.5	64%	0.641	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	109.7	168.3	-56.2	178	0	0	0	107.6	I529	I529-I532 HydrophobicContact CG2-CD1 4.07Å; I529-I532 HydrophobicContact CG2-CG1 3.57Å
533	T	55	Low	52	Low	66 Å²	66	95.7 Å²	95.7	41%	0.405	51%	0.512	S	S	.	.			trans	-81	136.2	176	62.3	0	0	0	0	110.7	N535 S536 T538	T533-N535 PolarHBondContact O-N 2.98Å; T533-S536 PolarHBondContact O-N 3.12Å; T533-T538 PolarHBondContact OG1-O 3.22Å; T533-T538 PolarHBondContact OG1-OG1 3.05Å
534	T	49.1	Very low	51.6	Low	138 Å²	138	95.8 Å²	95.8	85%	0.847	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.8	-175.7	47.3	0	0	0	0	115	S536	T534-S536 PolarHBondContact O-N 3.49Å; T534-S536 VanDerWaalsContact O-N 3.07Å; T534-S536 PolarHBondContact O-OG 2.92Å
535	N	48.3	Very low	51.4	Low	139 Å²	139	93.3 Å²	93.3	74%	0.743	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	16.3	174.2	-82.4	-18	0	0	0	114.9	T533 L537	T533-N535 PolarHBondContact O-N 2.98Å; N535-L537 WeakPolarHBondContact O-CG 3.47Å; N535-L537 PolarHBondContact O-N 2.97Å
536	S	47.5	Very low	50.8	Low	78 Å²	78	96.8 Å²	96.8	55%	0.545	53%	0.525	S	S	.	.	S	Bend	trans	63	3.3	160	-54.3	0	0	0	0	118.1	M268 T533 T534	M268-S536 VanDerWaalsContact CE-O 3.26Å; M268-S536 WeakPolarHBondContact CE-O 3.49Å; T533-S536 PolarHBondContact O-N 3.12Å; T534-S536 PolarHBondContact O-N 3.49Å; T534-S536 VanDerWaalsContact O-N 3.07Å; T534-S536 PolarHBondContact O-OG 2.92Å
537	L	51.7	Low	50.5	Low	83 Å²	83	101.7 Å²	101.7	44%	0.435	54%	0.538	S	S	.	.	S	Bend	trans	-128	-1.6	-167.6	-68.6	162.9	0	0	0	114.6	I266 V267 M268 N535	I266-L537 CarbonylContact C-O 3.58Å; I266-L537 CarbonylContact O-C 3.47Å; I266-L537 VanDerWaalsContact O-O 3.06Å; V267-L537 HydrophobicContact CG1-CD2 3.9Å; M268-L537 WeakPolarHBondContact O-CD2 3.32Å; N535-L537 WeakPolarHBondContact O-CG 3.47Å; N535-L537 PolarHBondContact O-N 2.97Å
538	T	53.1	Low	50.3	Low	55 Å²	55	100.9 Å²	100.9	34%	0.337	54%	0.535	S	S	.	.			trans	-142.3	114.3	178.5	56.4	0	0	0	0	111.2	V265 T533	V265-T538 HydrophobicContact CG1-CG2 3.94Å; T533-T538 PolarHBondContact OG1-O 3.22Å; T533-T538 PolarHBondContact OG1-OG1 3.05Å
539	V	55	Low	50.3	Low	29 Å²	29	100.1 Å²	100.1	18%	0.176	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.1	163.6	-179.3	0	0	0	0	106.7	I264 I529 F541	I264-V539 VanDerWaalsContact O-O 3.1Å; I529-V539 HydrophobicContact CG2-CG1 3.87Å; V539-F541 HydrophobicContact CB-CE2 4.35Å; V539-F541 HydrophobicContact CB-CZ 4.16Å; V539-F541 HydrophobicContact CG1-CE1 3.87Å; V539-F541 HydrophobicContact CG1-CE2 4.12Å; V539-F541 HydrophobicContact CG1-CZ 3.62Å
540	T	51.1	Low	49.6	Very low	26 Å²	26	100.8 Å²	100.8	16%	0.16	54%	0.537	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.7	-179.8	49.5	0	0	0	0	111	R263 T530	R263-T540 HydrophobicContact CB-CG2 4.34Å; R263-T540 HydrophobicContact CG-CG2 4.26Å; T530-T540 PolarHBondContact OG1-O 2.84Å
541	F	62.4	Low	49.3	Very low	37 Å²	37	102.8 Å²	102.8	16%	0.162	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	142.4	176.7	-50.2	-85.4	0	0	0	110	I264 I266 I527 I529 V539	I264-F541 HydrophobicContact CB-CD2 3.94Å; I264-F541 HydrophobicContact CB-CE2 4.27Å; I264-F541 HydrophobicContact CG1-CD2 4.46Å; I266-F541 HydrophobicContact CD1-CE2 3.82Å; I266-F541 HydrophobicContact CD1-CZ 3.8Å; I266-F541 HydrophobicContact CG1-CE2 4.22Å; I527-F541 HydrophobicContact CG2-CD1 3.37Å; I527-F541 HydrophobicContact CG2-CE1 3.59Å; I527-F541 HydrophobicContact CG2-CG 4.48Å; I529-F541 HydrophobicContact CG1-CE1 4.28Å; V539-F541 HydrophobicContact CB-CE2 4.35Å; V539-F541 HydrophobicContact CB-CZ 4.16Å; V539-F541 HydrophobicContact CG1-CE1 3.87Å; V539-F541 HydrophobicContact CG1-CE2 4.12Å; V539-F541 HydrophobicContact CG1-CZ 3.62Å
542	K	49.5	Very low	49.3	Very low	117 Å²	117	103.9 Å²	103.9	51%	0.509	55%	0.55	S	S	.	.			trans	-106.2	107.5	163.6	-172.4	177	177.2	-168.5	0	107.8	T530 Y544	T530-K542 HydrophobicContact CG2-CB 4.06Å; K542-Y544 HydrophobicContact CB-CE2 4.36Å; K542-Y544 HydrophobicContact CD-CE1 4.48Å; K542-Y544 HydrophobicContact CD-CE2 3.73Å; K542-Y544 WeakPolarHBondContact CE-OH 3.5Å; K542-Y544 HydrophobicContact CG-CD2 4.37Å; K542-Y544 HydrophobicContact CG-CE2 4.04Å; K542-Y544 PolarHBondContact NZ-OH 3.2Å; K542-Y544 PolarHBondContact O-N 3.28Å
543	E	51.6	Low	48.8	Very low	126 Å²	126	102.5 Å²	102.5	59%	0.589	54%	0.543	S	S	*	.			trans	-59.3	113.3	173.7	-168.6	167	-159.9	0	0	108.1	K258	K258-E543 IonicContact NZ-OE1 3.23Å; K258-E543 IonicContact NZ-OE2 3.08Å; K258-E543 PolarHBondContact NZ-OE2 3.23Å
544	Y	40.9	Very low	48.4	Very low	142 Å²	142	105.1 Å²	105.1	56%	0.557	55%	0.553	S	S	*	*			trans	-107.5	143.6	170.2	-83.4	-72.1	0	0	0	109.2	K542	K542-Y544 HydrophobicContact CB-CE2 4.36Å; K542-Y544 HydrophobicContact CD-CE1 4.48Å; K542-Y544 HydrophobicContact CD-CE2 3.73Å; K542-Y544 WeakPolarHBondContact CE-OH 3.5Å; K542-Y544 HydrophobicContact CG-CD2 4.37Å; K542-Y544 HydrophobicContact CG-CE2 4.04Å; K542-Y544 PolarHBondContact NZ-OH 3.2Å; K542-Y544 PolarHBondContact O-N 3.28Å
545	V	42.7	Very low	48.3	Very low	134 Å²	134	102.5 Å²	102.5	81%	0.812	53%	0.531	S	S	*	.			trans	-69.6	152.4	-172.7	-172.5	0	0	0	0	110.2
546	S	35.8	Very low	48.3	Very low	102 Å²	102	99.5 Å²	99.5	71%	0.713	51%	0.513	S	S	*	.			trans	-58.9	138.2	169.8	-154.8	0	0	0	0	110.3
547	F	38.7	Very low	48.4	Very low	265 Å²	265	101.5 Å²	101.5	100%	1.162	51%	0.51	S	S	*	.			trans	-77.8	0	147.2	-65.8	-83.8	0	0	0	109.2

Retrieved 547 of 547 residues in 414.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).