A0A087Y048_POEFO Loading...

SEBOX homeobox

AlphaFold DB , UniProt , Accession A0A087Y048, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 269 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.4	Very low	74.6	Confident	246 Å²	246	183.5 Å²	183.5	100%	1.212	84%	0.84	S	S	*	*				0	101.5	0	-82	171.1	170	0	0	107.7	G3	M1-G3 PolarHBondContact O-N 2.99Å
2	E	49.1	Very low	76.3	Confident	200 Å²	200	172.7 Å²	172.7	94%	0.935	79%	0.789	S	S	*	*			trans	-68.8	113.6	177.4	-73.6	175.9	141.4	0	0	109	Q4	E2-Q4 PolarHBondContact O-N 3.5Å
3	G	63.3	Low	77.9	Confident	67 Å²	67	163.8 Å²	163.8	69%	0.691	76%	0.759	S	S	*	*			trans	-59	121.9	177.9	0	0	0	0	0	110.2	M1 R5	M1-G3 PolarHBondContact O-N 2.99Å; G3-R5 PolarHBondContact O-N 3.41Å
4	Q	69.4	Low	79.2	Confident	193 Å²	193	166.1 Å²	166.1	90%	0.902	76%	0.758	S	S	*	*			trans	-49.9	103.8	177.2	-170.1	173.2	-32.4	0	0	110.1	E2 K6	E2-Q4 PolarHBondContact O-N 3.5Å; Q4-K6 PolarHBondContact O-N 3.41Å; Q4-K6 VanDerWaalsContact O-N 3.11Å
5	R	72.6	Confident	80.2	Confident	236 Å²	236	159.7 Å²	159.7	89%	0.891	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-56.7	117.7	179.7	-78.1	176.3	160.3	177.7	-4.8	109.1	G3 R7	G3-R5 PolarHBondContact O-N 3.41Å; R5-R7 PolarHBondContact O-N 3.41Å; R5-R7 VanDerWaalsContact O-N 3.11Å
6	K	78.8	Confident	81.2	Confident	213 Å²	213	152.1 Å²	152.1	93%	0.926	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-55.2	116.3	173.8	-103.3	168.7	173.8	170	0	108.8	Q4 K8	Q4-K6 PolarHBondContact O-N 3.41Å; Q4-K6 VanDerWaalsContact O-N 3.11Å; K6-K8 PolarHBondContact O-N 2.95Å
7	R	80	Confident	82.1	Confident	234 Å²	234	145.9 Å²	145.9	88%	0.883	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62	135.7	174.3	-69.7	-177.5	-172.1	171.1	2.4	108.8	R5 R9	R5-R7 PolarHBondContact O-N 3.41Å; R5-R7 VanDerWaalsContact O-N 3.11Å; R7-R9 PolarHBondContact O-N 3.2Å
8	K	85.3	Confident	82.8	Confident	199 Å²	199	141.5 Å²	141.5	87%	0.865	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-57.9	137.3	175.6	-65.5	-176	178.9	-177	0	109.9	K6	K6-K8 PolarHBondContact O-N 2.95Å
9	R	89.2	Confident	83.4	Confident	237 Å²	237	136.7 Å²	136.7	89%	0.894	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-68.7	137.4	177.7	-174.2	173.5	178.8	173.2	-2.1	109.4	R7	R7-R9 PolarHBondContact O-N 3.2Å
10	T	91.1	Very high	84	Confident	44 Å²	44	129.9 Å²	129.9	27%	0.27	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-90.6	133.8	172.6	-56.1	0	0	0	0	108.7	F12 L44 K48	T10-F12 HydrophobicContact CG2-CD1 4.37Å; T10-F12 HydrophobicContact CG2-CE1 4.07Å; T10-F12 HydrophobicContact CG2-CZ 4.38Å; T10-L44 HydrophobicContact CG2-CD2 4.31Å; T10-K48 WeakPolarHBondContact OG1-CD 3.34Å; T10-K48 WeakPolarHBondContact OG1-CE 3.09Å; T10-K48 PolarHBondContact OG1-NZ 3.43Å
11	I	93.6	Very high	84.6	Confident	150 Å²	150	127.8 Å²	127.8	77%	0.769	61%	0.605	S	S	*	*			trans	-107.5	129	170.7	-56.2	176.1	0	0	0	106.2
12	F	94.8	Very high	86.6	Confident	53 Å²	53	119.6 Å²	119.6	23%	0.232	56%	0.564	C	S	.	*			trans	-91.7	138.7	179	-57.2	-75.4	0	0	0	109.2	T10 L17 L44 K48 W52	T10-F12 HydrophobicContact CG2-CD1 4.37Å; T10-F12 HydrophobicContact CG2-CE1 4.07Å; T10-F12 HydrophobicContact CG2-CZ 4.38Å; F12-L17 HydrophobicContact CB-CD1 4.45Å; F12-L17 HydrophobicContact CB-CD2 3.72Å; F12-L17 HydrophobicContact CB-CG 3.83Å; F12-L17 HydrophobicContact CD2-CD2 4.27Å; F12-L17 HydrophobicContact CG-CD2 4.17Å; F12-L44 HydrophobicContact CD1-CD1 3.53Å; F12-L44 HydrophobicContact CD1-CD2 4.06Å; F12-L44 HydrophobicContact CD1-CG 4.46Å; F12-L44 HydrophobicContact CE1-CD1 3.69Å; F12-L44 HydrophobicContact CE1-CD2 4.14Å; F12-L44 HydrophobicContact CE1-CG 4.5Å; F12-K48 HydrophobicContact CE1-CB 4.28Å; F12-K48 HydrophobicContact CZ-CB 4.41Å; F12-W52 AromaticContact CD2-CD1 3.96Å; F12-W52 AromaticContact CE2-CD1 3.68Å; F12-W52 HydrophobicContact CZ-CB 4.33Å
13	S	97.3	Very high	88.7	Confident	57 Å²	57	110 Å²	110	40%	0.399	52%	0.519	S	S	.	.			trans	-72	162.4	171.3	78.5	0	0	0	0	110.9	A15 Q16 L17	S13-A15 VanDerWaalsContact C-N 3.31Å; S13-A15 PolarHBondContact O-N 2.9Å; S13-Q16 PolarHBondContact O-N 3.15Å; S13-Q16 VanDerWaalsContact OG-CG 3.28Å; S13-Q16 WeakPolarHBondContact OG-CG 3.21Å; S13-Q16 PolarHBondContact OG-N 2.55Å; S13-L17 WeakPolarHBondContact O-CG 3.41Å; S13-L17 PolarHBondContact O-N 2.74Å
14	R	95.5	Very high	90.2	Very high	197 Å²	197	107.9 Å²	107.9	74%	0.743	49%	0.491	S	S	*	.	H	α-helix	trans	-59.3	-42.6	177.2	-174.2	64.2	65.2	149.1	2.4	112.1	Q16 L17 S18	R14-Q16 PolarHBondContact O-N 2.93Å; R14-L17 PolarHBondContact O-N 2.61Å; R14-S18 PolarHBondContact O-N 3.26Å
15	A	94.1	Very high	91.3	Very high	69 Å²	69	102.3 Å²	102.3	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-60.9	-44.8	177.2	0	0	0	0	0	111.7	S13 L17 S18 E19	S13-A15 VanDerWaalsContact C-N 3.31Å; S13-A15 PolarHBondContact O-N 2.9Å; A15-L17 VanDerWaalsContact C-N 3.34Å; A15-L17 PolarHBondContact O-N 3.46Å; A15-S18 WeakPolarHBondContact O-CB 3.29Å; A15-S18 PolarHBondContact O-N 3.35Å; A15-E19 PolarHBondContact O-N 3.16Å; A15-E19 VanDerWaalsContact O-N 3.15Å
16	Q	96.1	Very high	92.1	Very high	39 Å²	39	93.7 Å²	93.7	18%	0.182	45%	0.452	C	S	.	.	H	α-helix	trans	-61.7	-41.8	176.4	-70.4	170.1	-22.9	0	0	112.1	S13 R14 S18 L20 T42 L44	S13-Q16 PolarHBondContact O-N 3.15Å; S13-Q16 VanDerWaalsContact OG-CG 3.28Å; S13-Q16 WeakPolarHBondContact OG-CG 3.21Å; S13-Q16 PolarHBondContact OG-N 2.55Å; R14-Q16 PolarHBondContact O-N 2.93Å; Q16-S18 VanDerWaalsContact C-N 3.34Å; Q16-L20 WeakPolarHBondContact O-CG 3.27Å; Q16-L20 PolarHBondContact O-N 3.08Å; Q16-L20 VanDerWaalsContact O-N 3.14Å; Q16-T42 PolarHBondContact NE2-O 3.03Å; Q16-L44 HydrophobicContact CB-CD1 4.21Å; Q16-L44 HydrophobicContact CG-CD1 4.19Å
17	L	97	Very high	92.7	Very high	47 Å²	47	85.6 Å²	85.6	25%	0.246	42%	0.42	C	S	.	.	H	α-helix	trans	-64.4	-40	176.8	-68.7	173.9	0	0	0	111.7	F12 S13 R14 A15 L20 E21 W52	F12-L17 HydrophobicContact CB-CD1 4.45Å; F12-L17 HydrophobicContact CB-CD2 3.72Å; F12-L17 HydrophobicContact CB-CG 3.83Å; F12-L17 HydrophobicContact CD2-CD2 4.27Å; F12-L17 HydrophobicContact CG-CD2 4.17Å; S13-L17 WeakPolarHBondContact O-CG 3.41Å; S13-L17 PolarHBondContact O-N 2.74Å; R14-L17 PolarHBondContact O-N 2.61Å; A15-L17 VanDerWaalsContact C-N 3.34Å; A15-L17 PolarHBondContact O-N 3.46Å; L17-L20 PolarHBondContact O-N 3.23Å; L17-E21 WeakPolarHBondContact O-CB 2.85Å; L17-E21 VanDerWaalsContact O-CG 3.3Å; L17-E21 WeakPolarHBondContact O-CG 3.46Å; L17-E21 PolarHBondContact O-N 2.99Å; L17-W52 HydrophobicContact CD2-CZ2 4.42Å; L17-W52 VanDerWaalsContact CD2-NE1 3.27Å
18	S	94.7	Very high	93.4	Very high	66 Å²	66	75.9 Å²	75.9	46%	0.462	39%	0.387	S	S	.	.	H	α-helix	trans	-57.4	-50.5	177.1	-168.6	0	0	0	0	111.6	R14 A15 Q16 L20 E21 Q22	R14-S18 PolarHBondContact O-N 3.26Å; A15-S18 WeakPolarHBondContact O-CB 3.29Å; A15-S18 PolarHBondContact O-N 3.35Å; Q16-S18 VanDerWaalsContact C-N 3.34Å; S18-L20 VanDerWaalsContact C-N 3.32Å; S18-L20 PolarHBondContact O-N 3.39Å; S18-E21 PolarHBondContact O-N 3.17Å; S18-Q22 WeakPolarHBondContact O-CB 3.45Å; S18-Q22 PolarHBondContact O-N 3.47Å
19	E	93.9	Very high	93.9	Very high	51 Å²	51	71.9 Å²	71.9	24%	0.238	37%	0.368	C	S	.	.	H	α-helix	trans	-59.8	-41.7	177.3	-66.7	-59.7	147	0	0	112.2	A15 A23 H41 T42	A15-E19 PolarHBondContact O-N 3.16Å; A15-E19 VanDerWaalsContact O-N 3.15Å; E19-A23 WeakPolarHBondContact O-CB 3.39Å; E19-A23 PolarHBondContact O-N 3.42Å; E19-H41 IonicContact OE2-CD2 3.96Å; E19-H41 IonicContact OE2-NE2 3.96Å; E19-T42 HydrophobicContact CB-CG2 4.06Å
20	L	95.9	Very high	94.1	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-71.3	-35.9	179.9	-66.3	173.1	0	0	0	112.9	Q16 L17 S18 A23 F24 L38 L44 I49 W52 F53	Q16-L20 WeakPolarHBondContact O-CG 3.27Å; Q16-L20 PolarHBondContact O-N 3.08Å; Q16-L20 VanDerWaalsContact O-N 3.14Å; L17-L20 PolarHBondContact O-N 3.23Å; S18-L20 VanDerWaalsContact C-N 3.32Å; S18-L20 PolarHBondContact O-N 3.39Å; L20-A23 PolarHBondContact O-N 3.24Å; L20-F24 WeakPolarHBondContact O-CB 3.36Å; L20-F24 PolarHBondContact O-N 3.13Å; L20-L38 HydrophobicContact CD2-CD1 4.38Å; L20-L44 HydrophobicContact CD1-CD1 4.44Å; L20-I49 HydrophobicContact CD1-CD1 4.13Å; L20-I49 HydrophobicContact CD2-CD1 3.71Å; L20-I49 HydrophobicContact CD2-CG2 3.96Å; L20-W52 HydrophobicContact CB-CD2 4.08Å; L20-W52 HydrophobicContact CB-CE3 3.94Å; L20-W52 HydrophobicContact CB-CH2 3.65Å; L20-W52 HydrophobicContact CB-CZ2 3.77Å; L20-W52 HydrophobicContact CB-CZ3 3.73Å; L20-W52 HydrophobicContact CD1-CD2 3.92Å; L20-W52 HydrophobicContact CD1-CE3 4.39Å; L20-W52 HydrophobicContact CD1-CG 3.98Å; L20-W52 WeakPolarHBondContact O-CH2 3.1Å; L20-W52 WeakPolarHBondContact O-CZ3 3.43Å; L20-F53 HydrophobicContact CD2-CE2 4.01Å
21	E	95.8	Very high	94.3	Very high	86 Å²	86	63.6 Å²	63.6	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-71.5	-39.2	175.7	-72.7	-173.7	155	0	0	111.6	L17 S18 A23 F24 A25 W52 R56	L17-E21 WeakPolarHBondContact O-CB 2.85Å; L17-E21 VanDerWaalsContact O-CG 3.3Å; L17-E21 WeakPolarHBondContact O-CG 3.46Å; L17-E21 PolarHBondContact O-N 2.99Å; S18-E21 PolarHBondContact O-N 3.17Å; E21-A23 VanDerWaalsContact C-N 3.32Å; E21-F24 PolarHBondContact O-N 2.9Å; E21-A25 PolarHBondContact O-N 2.98Å; E21-A25 VanDerWaalsContact O-N 3.16Å; E21-W52 HydrophobicContact CG-CH2 3.8Å; E21-W52 HydrophobicContact CG-CZ2 3.79Å; E21-R56 IonicContact OE1-CZ 3.59Å; E21-R56 IonicContact OE1-NH1 3.09Å; E21-R56 PolarHBondContact OE1-NH1 3.38Å; E21-R56 VanDerWaalsContact OE1-NH1 3.09Å; E21-R56 IonicContact OE1-NH2 3.91Å
22	Q	92.3	Very high	94.4	Very high	73 Å²	73	59.6 Å²	59.6	34%	0.341	32%	0.319	S	S	.	.	H	α-helix	trans	-57.8	-47.5	169.4	-173.4	176.7	-70.3	0	0	109.9	S18 F24 A25 Y116 W119	S18-Q22 WeakPolarHBondContact O-CB 3.45Å; S18-Q22 PolarHBondContact O-N 3.47Å; Q22-F24 VanDerWaalsContact C-N 3.32Å; Q22-F24 PolarHBondContact O-N 2.95Å; Q22-A25 PolarHBondContact O-N 3.35Å; Q22-Y116 HydrophobicContact CG-CD2 3.94Å; Q22-Y116 HydrophobicContact CG-CE2 3.65Å; Q22-Y116 WeakPolarHBondContact O-CE2 3.35Å; Q22-Y116 VanDerWaalsContact O-CZ 3.26Å; Q22-Y116 PolarHBondContact O-OH 3.24Å; Q22-W119 HydrophobicContact CG-CZ2 4.36Å; Q22-W119 VanDerWaalsContact NE2-CG 3.34Å
23	A	93.1	Very high	94.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-36.2	177	0	0	0	0	0	114.6	E19 L20 E21 A25 V26 T27 L38 F53 W119	E19-A23 WeakPolarHBondContact O-CB 3.39Å; E19-A23 PolarHBondContact O-N 3.42Å; L20-A23 PolarHBondContact O-N 3.24Å; E21-A23 VanDerWaalsContact C-N 3.32Å; A23-A25 VanDerWaalsContact C-N 3.33Å; A23-A25 PolarHBondContact O-N 3.32Å; A23-V26 WeakPolarHBondContact O-CG2 3.49Å; A23-V26 PolarHBondContact O-N 3.28Å; A23-T27 PolarHBondContact O-N 3.41Å; A23-L38 HydrophobicContact CB-CD1 3.84Å; A23-L38 HydrophobicContact CB-CD2 4.1Å; A23-F53 HydrophobicContact CB-CZ 3.96Å; A23-W119 VanDerWaalsContact CA-CZ2 3.47Å; A23-W119 HydrophobicContact CB-CH2 3.35Å; A23-W119 HydrophobicContact CB-CZ2 4.09Å; A23-W119 HydrophobicContact CB-CZ3 3.87Å
24	F	94.3	Very high	94.2	Very high	21 Å²	21	58.3 Å²	58.3	9%	0.092	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-35.3	-179.3	-175.8	-92.5	0	0	0	113.4	L20 E21 Q22 V26 T27 P28 W52 F53 R56 R57	L20-F24 WeakPolarHBondContact O-CB 3.36Å; L20-F24 PolarHBondContact O-N 3.13Å; E21-F24 PolarHBondContact O-N 2.9Å; Q22-F24 VanDerWaalsContact C-N 3.32Å; Q22-F24 PolarHBondContact O-N 2.95Å; F24-V26 PolarHBondContact O-N 2.92Å; F24-T27 CarbonylContact O-C 3.53Å; F24-P28 HydrophobicContact CD2-CB 4.37Å; F24-P28 HydrophobicContact CE2-CB 3.79Å; F24-P28 HydrophobicContact CZ-CB 3.9Å; F24-P28 HydrophobicContact CZ-CG 4.35Å; F24-W52 HydrophobicContact CB-CH2 4.29Å; F24-W52 HydrophobicContact CB-CZ3 4.15Å; F24-W52 HydrophobicContact CD2-CZ3 4.36Å; F24-F53 HydrophobicContact CB-CE1 4.09Å; F24-F53 AromaticContact CD2-CD1 3.79Å; F24-F53 HydrophobicContact CD2-CD1 3.79Å; F24-F53 AromaticContact CD2-CE1 3.9Å; F24-F53 HydrophobicContact CD2-CE1 3.9Å; F24-R56 HydrophobicContact CD1-CG 4.04Å; F24-R56 HydrophobicContact CD2-CB 4.08Å; F24-R56 HydrophobicContact CD2-CG 3.52Å; F24-R56 HydrophobicContact CE1-CG 4.02Å; F24-R56 HydrophobicContact CE2-CB 3.93Å; F24-R56 HydrophobicContact CE2-CG 3.49Å; F24-R56 VanDerWaalsContact CE2-CG 3.49Å; F24-R56 HydrophobicContact CG-CG 3.8Å; F24-R56 HydrophobicContact CZ-CG 3.76Å; F24-R57 HydrophobicContact CE2-CG 3.68Å; F24-R57 HydrophobicContact CZ-CG 4.14Å
25	A	91.6	Very high	94.3	Very high	77 Å²	77	51 Å²	51	64%	0.636	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.6	-178.5	0	0	0	0	0	112.5	E21 Q22 A23 Y116	E21-A25 PolarHBondContact O-N 2.98Å; E21-A25 VanDerWaalsContact O-N 3.16Å; Q22-A25 PolarHBondContact O-N 3.35Å; A23-A25 VanDerWaalsContact C-N 3.33Å; A23-A25 PolarHBondContact O-N 3.32Å; A25-Y116 WeakPolarHBondContact CA-OH 3.42Å; A25-Y116 HydrophobicContact CB-CE2 4.5Å; A25-Y116 WeakPolarHBondContact CB-OH 3.45Å; A25-Y116 PolarHBondContact N-OH 3.02Å; A25-Y116 PolarHBondContact O-OH 3.4Å
26	V	89.9	Confident	94.4	Very high	55 Å²	55	53 Å²	53	33%	0.333	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-53.3	-175.8	-155.1	0	0	0	0	106.3	A23 F24 Y116 W119 I120	A23-V26 WeakPolarHBondContact O-CG2 3.49Å; A23-V26 PolarHBondContact O-N 3.28Å; F24-V26 PolarHBondContact O-N 2.92Å; V26-Y116 VanDerWaalsContact CA-OH 3.24Å; V26-Y116 WeakPolarHBondContact CA-OH 3.43Å; V26-Y116 HydrophobicContact CB-CD1 4.41Å; V26-Y116 HydrophobicContact CB-CE1 3.45Å; V26-Y116 VanDerWaalsContact CB-CE1 3.45Å; V26-Y116 HydrophobicContact CG1-CD1 4.16Å; V26-Y116 HydrophobicContact CG1-CE1 3.54Å; V26-Y116 HydrophobicContact CG2-CD1 3.95Å; V26-Y116 HydrophobicContact CG2-CE1 3.13Å; V26-Y116 HydrophobicContact CG2-CE2 4.07Å; V26-Y116 WeakPolarHBondContact CG2-OH 3.39Å; V26-Y116 PolarHBondContact N-OH 3.14Å; V26-W119 HydrophobicContact CG2-CH2 3.77Å; V26-W119 HydrophobicContact CG2-CZ2 3.15Å; V26-I120 HydrophobicContact CB-CD1 3.7Å; V26-I120 HydrophobicContact CG1-CD1 3.14Å; V26-I120 HydrophobicContact CG2-CD1 3.32Å; V26-I120 HydrophobicContact CG2-CG1 4.02Å
27	T	91.8	Very high	94.1	Very high	43 Å²	43	53 Å²	53	26%	0.264	28%	0.281	S	S	.	.			trans	-139.9	103.1	-173	-178.8	0	0	0	0	107.1	A23 F24 Y29 P30 L34	A23-T27 PolarHBondContact O-N 3.41Å; F24-T27 CarbonylContact O-C 3.53Å; T27-Y29 PolarHBondContact O-N 3.16Å; T27-Y29 VanDerWaalsContact O-N 3.09Å; T27-Y29 VanDerWaalsContact OG1-C 3.31Å; T27-Y29 PolarHBondContact OG1-N 3.35Å; T27-Y29 PolarHBondContact OG1-O 3.36Å; T27-P30 HydrophobicContact CG2-CB 4.32Å; T27-L34 HydrophobicContact CG2-CD2 3.69Å
28	P	93.8	Very high	94	Very high	29 Å²	29	50.7 Å²	50.7	19%	0.188	27%	0.269	C	S	.	.	S	Bend	trans	-61.6	-14.3	170.2	-24.5	35	0	0	0	112.5	F24 P30 R57 L66	F24-P28 HydrophobicContact CD2-CB 4.37Å; F24-P28 HydrophobicContact CE2-CB 3.79Å; F24-P28 HydrophobicContact CZ-CB 3.9Å; F24-P28 HydrophobicContact CZ-CG 4.35Å; P28-P30 WeakPolarHBondContact O-CD 2.84Å; P28-R57 HydrophobicContact CB-CG 4.24Å; P28-R57 VanDerWaalsContact O-CD 3.29Å; P28-R57 WeakPolarHBondContact O-CD 3.26Å; P28-R57 PolarHBondContact O-NH1 2.81Å; P28-L66 HydrophobicContact CB-CD2 4.28Å; P28-L66 HydrophobicContact CG-CD1 4.36Å
29	Y	95.8	Very high	94.1	Very high	116 Å²	116	48.2 Å²	48.2	46%	0.455	25%	0.253	S	S	.	.	S	Bend	trans	-124.4	72.1	-177.1	-61	-88.2	0	0	0	110.9	T27 R57 L66	T27-Y29 PolarHBondContact O-N 3.16Å; T27-Y29 VanDerWaalsContact O-N 3.09Å; T27-Y29 VanDerWaalsContact OG1-C 3.31Å; T27-Y29 PolarHBondContact OG1-N 3.35Å; T27-Y29 PolarHBondContact OG1-O 3.36Å; Y29-R57 VanDerWaalsContact CE1-NE 3.27Å; Y29-L66 HydrophobicContact CE2-CD2 4.44Å
30	P	94.4	Very high	94.1	Very high	8 Å²	8	49.2 Å²	49.2	5%	0.052	27%	0.269	C	S	.	.			trans	-68.8	138.8	180	30.3	-37.7	0	0	0	111.5	T27 P28 L34 R35 F53	T27-P30 HydrophobicContact CG2-CB 4.32Å; P28-P30 WeakPolarHBondContact O-CD 2.84Å; P30-L34 HydrophobicContact CB-CB 4.29Å; P30-L34 HydrophobicContact CB-CD2 3.69Å; P30-L34 HydrophobicContact CB-CG 4.06Å; P30-R35 HydrophobicContact CB-CG 3.97Å; P30-R35 HydrophobicContact CG-CG 3.8Å; P30-R35 PolarHBondContact O-NH1 2.88Å; P30-F53 HydrophobicContact CB-CE1 4.39Å; P30-F53 HydrophobicContact CB-CZ 4.48Å; P30-F53 HydrophobicContact CG-CD1 3.53Å; P30-F53 HydrophobicContact CG-CD2 4.01Å; P30-F53 HydrophobicContact CG-CE1 3.54Å; P30-F53 HydrophobicContact CG-CE2 4.04Å; P30-F53 HydrophobicContact CG-CG 3.77Å; P30-F53 HydrophobicContact CG-CZ 3.81Å
31	D	95.3	Very high	93.9	Very high	98 Å²	98	53.2 Å²	53.2	52%	0.524	29%	0.288	S	S	.	.			trans	-69.4	164.3	172.3	-177.1	37.2	0	0	0	112.1	T33 L34 R35	D31-T33 VanDerWaalsContact C-N 3.27Å; D31-T33 PolarHBondContact O-N 3.3Å; D31-T33 PolarHBondContact OD2-OG1 3.47Å; D31-L34 PolarHBondContact O-N 3.5Å; D31-R35 WeakPolarHBondContact O-CG 3.39Å; D31-R35 PolarHBondContact O-N 2.89Å
32	I	95.9	Very high	93.8	Very high	66 Å²	66	49.5 Å²	49.5	34%	0.338	27%	0.271	S	S	.	.	H	α-helix	trans	-52.7	-44.8	178.9	-174.6	61	0	0	0	111.9	L34 R35 E36 E46	I32-L34 PolarHBondContact O-N 2.63Å; I32-R35 PolarHBondContact O-N 3.18Å; I32-R35 VanDerWaalsContact O-N 3.13Å; I32-E36 HydrophobicContact CD1-CG 4.3Å; I32-E36 HydrophobicContact CG1-CG 4.4Å; I32-E36 WeakPolarHBondContact O-CG 3.47Å; I32-E36 PolarHBondContact O-N 3.32Å; I32-E46 HydrophobicContact CD1-CG 4.11Å
33	T	95	Very high	94	Very high	67 Å²	67	53.9 Å²	53.9	41%	0.411	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-44.9	-179.6	53.9	0	0	0	0	112.3	D31 E36 R37	D31-T33 VanDerWaalsContact C-N 3.27Å; D31-T33 PolarHBondContact O-N 3.3Å; D31-T33 PolarHBondContact OD2-OG1 3.47Å; T33-E36 PolarHBondContact O-N 2.99Å; T33-R37 WeakPolarHBondContact O-CG 3.4Å; T33-R37 PolarHBondContact O-N 3.02Å
34	L	92.2	Very high	94.1	Very high	17 Å²	17	54.7 Å²	54.7	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-39.8	176.7	179.9	56.9	0	0	0	111.4	T27 P30 D31 I32 E36 R37 L38 W119	T27-L34 HydrophobicContact CG2-CD2 3.69Å; P30-L34 HydrophobicContact CB-CB 4.29Å; P30-L34 HydrophobicContact CB-CD2 3.69Å; P30-L34 HydrophobicContact CB-CG 4.06Å; D31-L34 PolarHBondContact O-N 3.5Å; I32-L34 PolarHBondContact O-N 2.63Å; L34-E36 PolarHBondContact O-N 2.86Å; L34-R37 PolarHBondContact O-N 3.37Å; L34-L38 HydrophobicContact CD1-CG 4.45Å; L34-L38 HydrophobicContact CG-CD1 4.3Å; L34-L38 WeakPolarHBondContact O-CG 3.07Å; L34-L38 PolarHBondContact O-N 2.84Å; L34-W119 HydrophobicContact CD1-CZ3 4.29Å
35	R	96.7	Very high	94.2	Very high	43 Å²	43	57.3 Å²	57.3	16%	0.162	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-37.8	177.2	-66.1	-165	-52.4	-86.8	0.9	112.3	P30 D31 I32 L38 A39 E46 I49	P30-R35 HydrophobicContact CB-CG 3.97Å; P30-R35 HydrophobicContact CG-CG 3.8Å; P30-R35 PolarHBondContact O-NH1 2.88Å; D31-R35 WeakPolarHBondContact O-CG 3.39Å; D31-R35 PolarHBondContact O-N 2.89Å; I32-R35 PolarHBondContact O-N 3.18Å; I32-R35 VanDerWaalsContact O-N 3.13Å; R35-L38 PolarHBondContact O-N 2.89Å; R35-A39 VanDerWaalsContact O-CB 3.31Å; R35-A39 WeakPolarHBondContact O-CB 3.37Å; R35-A39 PolarHBondContact O-N 2.78Å; R35-E46 HydrophobicContact CB-CG 4.05Å; R35-E46 IonicContact CZ-OE1 3.32Å; R35-E46 IonicContact NE-OE1 2.75Å; R35-E46 PolarHBondContact NE-OE1 3Å; R35-E46 IonicContact NH2-OE1 2.98Å; R35-E46 PolarHBondContact NH2-OE1 3.49Å; R35-I49 HydrophobicContact CB-CG2 4.32Å; R35-I49 HydrophobicContact CG-CG2 4.23Å
36	E	96.1	Very high	94.5	Very high	112 Å²	112	55.9 Å²	55.9	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-65.3	-40.3	175.9	-73.8	177.6	161.3	0	0	112.1	I32 T33 L34 A39 A40 E46	I32-E36 HydrophobicContact CD1-CG 4.3Å; I32-E36 HydrophobicContact CG1-CG 4.4Å; I32-E36 WeakPolarHBondContact O-CG 3.47Å; I32-E36 PolarHBondContact O-N 3.32Å; T33-E36 PolarHBondContact O-N 2.99Å; L34-E36 PolarHBondContact O-N 2.86Å; E36-A39 WeakPolarHBondContact O-CB 3.33Å; E36-A39 PolarHBondContact O-N 3.17Å; E36-A40 PolarHBondContact O-N 3.2Å; E36-E46 HydrophobicContact CG-CG 4.48Å
37	R	91.7	Very high	94.8	Very high	37 Å²	37	56 Å²	56	14%	0.14	30%	0.298	C	S	.	.	H	α-helix	trans	-66.8	-42.9	175.3	-72.5	173	167.9	146.2	-8.9	112.3	T33 L34 A39 A40 H41 Y123 S124 N125	T33-R37 WeakPolarHBondContact O-CG 3.4Å; T33-R37 PolarHBondContact O-N 3.02Å; L34-R37 PolarHBondContact O-N 3.37Å; R37-A39 VanDerWaalsContact C-N 3.28Å; R37-A39 PolarHBondContact O-N 2.86Å; R37-A40 PolarHBondContact O-N 2.98Å; R37-H41 PolarHBondContact O-N 3.39Å; R37-Y123 HydrophobicContact CB-CD1 4.11Å; R37-Y123 VanDerWaalsContact CD-C 3.47Å; R37-Y123 WeakPolarHBondContact CD-O 3.32Å; R37-Y123 VanDerWaalsContact CZ-C 3.48Å; R37-Y123 PolarHBondContact NE-O 3.08Å; R37-Y123 PolarHBondContact NH1-O 2.75Å; R37-S124 PolarHBondContact NH1-O 3.32Å; R37-S124 VanDerWaalsContact NH2-C 3.32Å; R37-S124 PolarHBondContact NH2-O 3.06Å; R37-N125 VanDerWaalsContact NH2-C 3.34Å; R37-N125 PolarHBondContact NH2-O 2.96Å
38	L	94.9	Very high	95	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-38.6	172.3	-72.5	170.8	0	0	0	111.6	L20 A23 L34 R35 H41 T42 I49 F53 W119	L20-L38 HydrophobicContact CD2-CD1 4.38Å; A23-L38 HydrophobicContact CB-CD1 3.84Å; A23-L38 HydrophobicContact CB-CD2 4.1Å; L34-L38 HydrophobicContact CD1-CG 4.45Å; L34-L38 HydrophobicContact CG-CD1 4.3Å; L34-L38 WeakPolarHBondContact O-CG 3.07Å; L34-L38 PolarHBondContact O-N 2.84Å; R35-L38 PolarHBondContact O-N 2.89Å; L38-H41 PolarHBondContact O-N 2.69Å; L38-T42 WeakPolarHBondContact O-CB 3.3Å; L38-T42 WeakPolarHBondContact O-CG2 3.31Å; L38-T42 PolarHBondContact O-N 3.1Å; L38-T42 PolarHBondContact O-OG1 2.84Å; L38-I49 HydrophobicContact CB-CG2 4.36Å; L38-I49 HydrophobicContact CD1-CG2 4.29Å; L38-F53 HydrophobicContact CD1-CE2 4.07Å; L38-F53 HydrophobicContact CD1-CZ 4.23Å; L38-W119 HydrophobicContact CD2-CZ3 4.46Å
39	A	95.9	Very high	95.2	Very high	14 Å²	14	55.4 Å²	55.4	12%	0.116	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-44	175.7	0	0	0	0	0	111.8	R35 E36 R37 H43 L44 E46 I49	R35-A39 VanDerWaalsContact O-CB 3.31Å; R35-A39 WeakPolarHBondContact O-CB 3.37Å; R35-A39 PolarHBondContact O-N 2.78Å; E36-A39 WeakPolarHBondContact O-CB 3.33Å; E36-A39 PolarHBondContact O-N 3.17Å; R37-A39 VanDerWaalsContact C-N 3.28Å; R37-A39 PolarHBondContact O-N 2.86Å; A39-H43 WeakPolarHBondContact O-CA 3.2Å; A39-H43 PolarHBondContact O-N 3.38Å; A39-L44 CarbonylContact C-O 3.56Å; A39-L44 WeakPolarHBondContact CA-O 3.34Å; A39-L44 WeakPolarHBondContact CB-O 3.37Å; A39-L44 PolarHBondContact O-N 2.89Å; A39-L44 VanDerWaalsContact O-N 3.17Å; A39-E46 HydrophobicContact CB-CB 4.37Å; A39-I49 HydrophobicContact CB-CG1 4.37Å
40	A	94.1	Very high	95.3	Very high	71 Å²	71	53.4 Å²	53.4	59%	0.587	28%	0.284	S	S	*	.	H	α-helix	trans	-62.9	-44.7	175	0	0	0	0	0	112	E36 R37	E36-A40 PolarHBondContact O-N 3.2Å; R37-A40 PolarHBondContact O-N 2.98Å
41	H	92.4	Very high	95.4	Very high	85 Å²	85	56.3 Å²	56.3	39%	0.394	30%	0.301	S	S	.	.	H	α-helix	trans	-71.1	-41.6	-177.3	-168.8	70.8	0	0	0	113.2	E19 R37 L38 Y123	E19-H41 IonicContact OE2-CD2 3.96Å; E19-H41 IonicContact OE2-NE2 3.96Å; R37-H41 PolarHBondContact O-N 3.39Å; L38-H41 PolarHBondContact O-N 2.69Å; H41-Y123 HydrophobicContact CB-CE1 4.36Å; H41-Y123 PolarHBondContact CE1-OH 3.13Å; H41-Y123 PolarHBondContact ND1-OH 3.01Å
42	T	93.8	Very high	95.5	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.043	28%	0.279	C	S	.	.	H	α-helix	trans	-87.2	-6.2	-177.8	60.9	0	0	0	0	113.5	Q16 E19 L38 L44	Q16-T42 PolarHBondContact NE2-O 3.03Å; E19-T42 HydrophobicContact CB-CG2 4.06Å; L38-T42 WeakPolarHBondContact O-CB 3.3Å; L38-T42 WeakPolarHBondContact O-CG2 3.31Å; L38-T42 PolarHBondContact O-N 3.1Å; L38-T42 PolarHBondContact O-OG1 2.84Å; T42-L44 PolarHBondContact O-N 3.12Å
43	H	96	Very high	95.6	Very high	166 Å²	166	49.2 Å²	49.2	77%	0.769	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	37.3	-171.5	-60.4	-77.7	0	0	0	113.5	A39	A39-H43 WeakPolarHBondContact O-CA 3.2Å; A39-H43 PolarHBondContact O-N 3.38Å
44	L	95.4	Very high	95.7	Very high	16 Å²	16	50.3 Å²	50.3	8%	0.084	26%	0.263	C	S	.	.			trans	-113.1	145.1	177.4	-65.2	167.7	0	0	0	109.4	T10 F12 Q16 L20 A39 T42 E46 I49	T10-L44 HydrophobicContact CG2-CD2 4.31Å; F12-L44 HydrophobicContact CD1-CD1 3.53Å; F12-L44 HydrophobicContact CD1-CD2 4.06Å; F12-L44 HydrophobicContact CD1-CG 4.46Å; F12-L44 HydrophobicContact CE1-CD1 3.69Å; F12-L44 HydrophobicContact CE1-CD2 4.14Å; F12-L44 HydrophobicContact CE1-CG 4.5Å; Q16-L44 HydrophobicContact CB-CD1 4.21Å; Q16-L44 HydrophobicContact CG-CD1 4.19Å; L20-L44 HydrophobicContact CD1-CD1 4.44Å; A39-L44 CarbonylContact C-O 3.56Å; A39-L44 WeakPolarHBondContact CA-O 3.34Å; A39-L44 WeakPolarHBondContact CB-O 3.37Å; A39-L44 PolarHBondContact O-N 2.89Å; A39-L44 VanDerWaalsContact O-N 3.17Å; T42-L44 PolarHBondContact O-N 3.12Å; L44-E46 PolarHBondContact O-N 2.85Å; L44-I49 HydrophobicContact CB-CD1 3.75Å; L44-I49 HydrophobicContact CB-CG1 4.47Å; L44-I49 HydrophobicContact CD1-CD1 3.72Å; L44-I49 HydrophobicContact CG-CD1 4.4Å
45	P	96.3	Very high	95.9	Very high	76 Å²	76	53.2 Å²	53.2	49%	0.494	28%	0.279	S	S	.	.			trans	-58.8	141.2	170.6	-21.6	31.4	0	0	0	111.1	S47 K48 I49	P45-S47 PolarHBondContact O-N 3.09Å; P45-K48 HydrophobicContact CB-CG 4.18Å; P45-K48 HydrophobicContact CG-CG 4.12Å; P45-K48 WeakPolarHBondContact O-CA 3.31Å; P45-K48 VanDerWaalsContact O-CB 3.31Å; P45-K48 WeakPolarHBondContact O-CB 3.47Å; P45-K48 PolarHBondContact O-N 3.39Å; P45-I49 PolarHBondContact O-N 3.05Å
46	E	96.9	Very high	95.9	Very high	47 Å²	47	55.2 Å²	55.2	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-46.4	-43.6	175.4	-178.5	-77.5	168.2	0	0	111.3	I32 R35 E36 A39 L44 K48 I49 Q50	I32-E46 HydrophobicContact CD1-CG 4.11Å; R35-E46 HydrophobicContact CB-CG 4.05Å; R35-E46 IonicContact CZ-OE1 3.32Å; R35-E46 IonicContact NE-OE1 2.75Å; R35-E46 PolarHBondContact NE-OE1 3Å; R35-E46 IonicContact NH2-OE1 2.98Å; R35-E46 PolarHBondContact NH2-OE1 3.49Å; E36-E46 HydrophobicContact CG-CG 4.48Å; A39-E46 HydrophobicContact CB-CB 4.37Å; L44-E46 PolarHBondContact O-N 2.85Å; E46-K48 PolarHBondContact O-N 2.95Å; E46-K48 VanDerWaalsContact O-N 3.1Å; E46-I49 CarbonylContact O-C 3.1Å; E46-I49 WeakPolarHBondContact O-CA 3.05Å; E46-I49 VanDerWaalsContact O-CB 3.3Å; E46-I49 WeakPolarHBondContact O-CB 3.42Å; E46-I49 PolarHBondContact O-N 3.15Å; E46-Q50 PolarHBondContact O-N 3.38Å
47	S	96.6	Very high	95.9	Very high	59 Å²	59	52 Å²	52	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-59.7	-29.7	-177.9	61.6	0	0	0	0	113	P45 V51	P45-S47 PolarHBondContact O-N 3.09Å; S47-V51 VanDerWaalsContact O-CG2 3.26Å; S47-V51 WeakPolarHBondContact O-CG2 3.29Å; S47-V51 PolarHBondContact O-N 3.39Å; S47-V51 VanDerWaalsContact O-N 3.1Å
48	K	97.1	Very high	96	Very high	58 Å²	58	53 Å²	53	25%	0.252	29%	0.286	S	S	.	.	H	α-helix	trans	-73.6	-39	175	-61.6	-65.3	176.3	162.5	0	111	T10 F12 P45 E46 V51 W52	T10-K48 WeakPolarHBondContact OG1-CD 3.34Å; T10-K48 WeakPolarHBondContact OG1-CE 3.09Å; T10-K48 PolarHBondContact OG1-NZ 3.43Å; F12-K48 HydrophobicContact CE1-CB 4.28Å; F12-K48 HydrophobicContact CZ-CB 4.41Å; P45-K48 HydrophobicContact CB-CG 4.18Å; P45-K48 HydrophobicContact CG-CG 4.12Å; P45-K48 WeakPolarHBondContact O-CA 3.31Å; P45-K48 VanDerWaalsContact O-CB 3.31Å; P45-K48 WeakPolarHBondContact O-CB 3.47Å; P45-K48 PolarHBondContact O-N 3.39Å; E46-K48 PolarHBondContact O-N 2.95Å; E46-K48 VanDerWaalsContact O-N 3.1Å; K48-V51 PolarHBondContact O-N 3.25Å; K48-W52 VanDerWaalsContact O-CB 3.26Å; K48-W52 WeakPolarHBondContact O-CB 3.43Å; K48-W52 PolarHBondContact O-N 3.24Å
49	I	97.1	Very high	95.7	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-49.4	173.3	-53.5	-44.5	0	0	0	109.8	L20 R35 L38 A39 L44 P45 E46 V51 W52 F53	L20-I49 HydrophobicContact CD1-CD1 4.13Å; L20-I49 HydrophobicContact CD2-CD1 3.71Å; L20-I49 HydrophobicContact CD2-CG2 3.96Å; R35-I49 HydrophobicContact CB-CG2 4.32Å; R35-I49 HydrophobicContact CG-CG2 4.23Å; L38-I49 HydrophobicContact CB-CG2 4.36Å; L38-I49 HydrophobicContact CD1-CG2 4.29Å; A39-I49 HydrophobicContact CB-CG1 4.37Å; L44-I49 HydrophobicContact CB-CD1 3.75Å; L44-I49 HydrophobicContact CB-CG1 4.47Å; L44-I49 HydrophobicContact CD1-CD1 3.72Å; L44-I49 HydrophobicContact CG-CD1 4.4Å; P45-I49 PolarHBondContact O-N 3.05Å; E46-I49 CarbonylContact O-C 3.1Å; E46-I49 WeakPolarHBondContact O-CA 3.05Å; E46-I49 VanDerWaalsContact O-CB 3.3Å; E46-I49 WeakPolarHBondContact O-CB 3.42Å; E46-I49 PolarHBondContact O-N 3.15Å; I49-V51 PolarHBondContact O-N 3.5Å; I49-W52 WeakPolarHBondContact O-CB 3.48Å; I49-W52 PolarHBondContact O-N 3.42Å; I49-W52 VanDerWaalsContact O-N 3.13Å; I49-F53 HydrophobicContact CG2-CD2 3.76Å; I49-F53 HydrophobicContact CG2-CE2 3.74Å; I49-F53 WeakPolarHBondContact O-CD2 3.21Å; I49-F53 PolarHBondContact O-N 3.43Å
50	Q	97.3	Very high	95.2	Very high	75 Å²	75	59.1 Å²	59.1	35%	0.35	31%	0.309	S	S	.	.	H	α-helix	trans	-53.8	-51.9	176.7	-178.6	-178.7	-65	0	0	112	E46 W52 F53 Q54	E46-Q50 PolarHBondContact O-N 3.38Å; Q50-W52 VanDerWaalsContact C-N 3.32Å; Q50-W52 PolarHBondContact O-N 3.15Å; Q50-F53 PolarHBondContact O-N 2.94Å; Q50-Q54 WeakPolarHBondContact O-CG 3.36Å; Q50-Q54 PolarHBondContact O-N 3.14Å
51	V	97.2	Very high	94.8	Very high	69 Å²	69	57.6 Å²	57.6	42%	0.418	29%	0.29	S	S	.	.	H	α-helix	trans	-64.6	-37.7	179.5	171.7	0	0	0	0	111.4	S47 K48 I49 Q54 N55	S47-V51 VanDerWaalsContact O-CG2 3.26Å; S47-V51 WeakPolarHBondContact O-CG2 3.29Å; S47-V51 PolarHBondContact O-N 3.39Å; S47-V51 VanDerWaalsContact O-N 3.1Å; K48-V51 PolarHBondContact O-N 3.25Å; I49-V51 PolarHBondContact O-N 3.5Å; V51-Q54 PolarHBondContact O-N 2.75Å; V51-N55 WeakPolarHBondContact O-CB 3.28Å; V51-N55 VanDerWaalsContact O-CG 3.31Å; V51-N55 PolarHBondContact O-N 3.37Å; V51-N55 PolarHBondContact O-ND2 3.25Å
52	W	97.4	Very high	94.2	Very high	13 Å²	13	62.7 Å²	62.7	5%	0.049	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-47.5	176.3	-174.4	101.7	0	0	0	111.3	F12 L17 L20 E21 F24 K48 I49 Q50 Q54 N55 R56	F12-W52 AromaticContact CD2-CD1 3.96Å; F12-W52 AromaticContact CE2-CD1 3.68Å; F12-W52 HydrophobicContact CZ-CB 4.33Å; L17-W52 HydrophobicContact CD2-CZ2 4.42Å; L17-W52 VanDerWaalsContact CD2-NE1 3.27Å; L20-W52 HydrophobicContact CB-CD2 4.08Å; L20-W52 HydrophobicContact CB-CE3 3.94Å; L20-W52 HydrophobicContact CB-CH2 3.65Å; L20-W52 HydrophobicContact CB-CZ2 3.77Å; L20-W52 HydrophobicContact CB-CZ3 3.73Å; L20-W52 HydrophobicContact CD1-CD2 3.92Å; L20-W52 HydrophobicContact CD1-CE3 4.39Å; L20-W52 HydrophobicContact CD1-CG 3.98Å; L20-W52 WeakPolarHBondContact O-CH2 3.1Å; L20-W52 WeakPolarHBondContact O-CZ3 3.43Å; E21-W52 HydrophobicContact CG-CH2 3.8Å; E21-W52 HydrophobicContact CG-CZ2 3.79Å; F24-W52 HydrophobicContact CB-CH2 4.29Å; F24-W52 HydrophobicContact CB-CZ3 4.15Å; F24-W52 HydrophobicContact CD2-CZ3 4.36Å; K48-W52 VanDerWaalsContact O-CB 3.26Å; K48-W52 WeakPolarHBondContact O-CB 3.43Å; K48-W52 PolarHBondContact O-N 3.24Å; I49-W52 WeakPolarHBondContact O-CB 3.48Å; I49-W52 PolarHBondContact O-N 3.42Å; I49-W52 VanDerWaalsContact O-N 3.13Å; Q50-W52 VanDerWaalsContact C-N 3.32Å; Q50-W52 PolarHBondContact O-N 3.15Å; W52-Q54 PolarHBondContact O-N 3.46Å; W52-N55 PolarHBondContact O-N 3.1Å; W52-R56 HydrophobicContact CE3-CB 4.15Å; W52-R56 HydrophobicContact CH2-CB 4.19Å; W52-R56 HydrophobicContact CH2-CG 3.88Å; W52-R56 HydrophobicContact CZ2-CG 4.48Å; W52-R56 HydrophobicContact CZ3-CB 3.94Å; W52-R56 HydrophobicContact CZ3-CG 3.98Å; W52-R56 WeakPolarHBondContact O-CB 3.37Å; W52-R56 PolarHBondContact O-N 3.5Å
53	F	97.8	Very high	93.4	Very high	2 Å²	2	67 Å²	67	1%	0.009	34%	0.337	C	S	.	.	H	α-helix	trans	-63.6	-40.2	177.7	-89.8	-94.3	0	0	0	112.2	L20 A23 F24 P30 L38 I49 Q50 R56 R57	L20-F53 HydrophobicContact CD2-CE2 4.01Å; A23-F53 HydrophobicContact CB-CZ 3.96Å; F24-F53 HydrophobicContact CB-CE1 4.09Å; F24-F53 AromaticContact CD2-CD1 3.79Å; F24-F53 HydrophobicContact CD2-CD1 3.79Å; F24-F53 AromaticContact CD2-CE1 3.9Å; F24-F53 HydrophobicContact CD2-CE1 3.9Å; P30-F53 HydrophobicContact CB-CE1 4.39Å; P30-F53 HydrophobicContact CB-CZ 4.48Å; P30-F53 HydrophobicContact CG-CD1 3.53Å; P30-F53 HydrophobicContact CG-CD2 4.01Å; P30-F53 HydrophobicContact CG-CE1 3.54Å; P30-F53 HydrophobicContact CG-CE2 4.04Å; P30-F53 HydrophobicContact CG-CG 3.77Å; P30-F53 HydrophobicContact CG-CZ 3.81Å; L38-F53 HydrophobicContact CD1-CE2 4.07Å; L38-F53 HydrophobicContact CD1-CZ 4.23Å; I49-F53 HydrophobicContact CG2-CD2 3.76Å; I49-F53 HydrophobicContact CG2-CE2 3.74Å; I49-F53 WeakPolarHBondContact O-CD2 3.21Å; I49-F53 PolarHBondContact O-N 3.43Å; Q50-F53 PolarHBondContact O-N 2.94Å; F53-R56 PolarHBondContact O-N 3.21Å; F53-R57 WeakPolarHBondContact O-CG 3.47Å; F53-R57 PolarHBondContact O-N 3.03Å
54	Q	97	Very high	92.4	Very high	89 Å²	89	62.2 Å²	62.2	42%	0.416	33%	0.333	S	S	.	.	H	α-helix	trans	-59.5	-48.8	173.5	-71.5	178.3	25.3	0	0	111.6	Q50 V51 W52 R56 R57 A58	Q50-Q54 WeakPolarHBondContact O-CG 3.36Å; Q50-Q54 PolarHBondContact O-N 3.14Å; V51-Q54 PolarHBondContact O-N 2.75Å; W52-Q54 PolarHBondContact O-N 3.46Å; Q54-R56 VanDerWaalsContact C-N 3.34Å; Q54-R56 PolarHBondContact O-N 3.13Å; Q54-R57 PolarHBondContact O-N 2.93Å; Q54-A58 WeakPolarHBondContact O-CB 3.48Å; Q54-A58 PolarHBondContact O-N 2.89Å
55	N	96.8	Very high	91.1	Very high	78 Å²	78	71.8 Å²	71.8	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-38.1	178.2	-73.4	-25	0	0	0	112.2	V51 W52 A58 R59	V51-N55 WeakPolarHBondContact O-CB 3.28Å; V51-N55 VanDerWaalsContact O-CG 3.31Å; V51-N55 PolarHBondContact O-N 3.37Å; V51-N55 PolarHBondContact O-ND2 3.25Å; W52-N55 PolarHBondContact O-N 3.1Å; N55-A58 PolarHBondContact O-N 3.48Å; N55-R59 WeakPolarHBondContact O-CG 3.26Å; N55-R59 PolarHBondContact O-N 3.11Å; N55-R59 PolarHBondContact O-NE 3.23Å
56	R	96.4	Very high	89.6	Confident	85 Å²	85	70.2 Å²	70.2	32%	0.321	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-46.2	177.6	-173.3	67.5	-172.8	-176.8	2.4	111.1	E21 F24 W52 F53 Q54 R59 S60	E21-R56 IonicContact OE1-CZ 3.59Å; E21-R56 IonicContact OE1-NH1 3.09Å; E21-R56 PolarHBondContact OE1-NH1 3.38Å; E21-R56 VanDerWaalsContact OE1-NH1 3.09Å; E21-R56 IonicContact OE1-NH2 3.91Å; F24-R56 HydrophobicContact CD1-CG 4.04Å; F24-R56 HydrophobicContact CD2-CB 4.08Å; F24-R56 HydrophobicContact CD2-CG 3.52Å; F24-R56 HydrophobicContact CE1-CG 4.02Å; F24-R56 HydrophobicContact CE2-CB 3.93Å; F24-R56 HydrophobicContact CE2-CG 3.49Å; F24-R56 VanDerWaalsContact CE2-CG 3.49Å; F24-R56 HydrophobicContact CG-CG 3.8Å; F24-R56 HydrophobicContact CZ-CG 3.76Å; W52-R56 HydrophobicContact CE3-CB 4.15Å; W52-R56 HydrophobicContact CH2-CB 4.19Å; W52-R56 HydrophobicContact CH2-CG 3.88Å; W52-R56 HydrophobicContact CZ2-CG 4.48Å; W52-R56 HydrophobicContact CZ3-CB 3.94Å; W52-R56 HydrophobicContact CZ3-CG 3.98Å; W52-R56 WeakPolarHBondContact O-CB 3.37Å; W52-R56 PolarHBondContact O-N 3.5Å; F53-R56 PolarHBondContact O-N 3.21Å; Q54-R56 VanDerWaalsContact C-N 3.34Å; Q54-R56 PolarHBondContact O-N 3.13Å; R56-R59 PolarHBondContact O-N 3.35Å; R56-S60 PolarHBondContact O-N 2.94Å
57	R	95.9	Very high	88.1	Confident	44 Å²	44	73 Å²	73	17%	0.166	38%	0.38	C	S	.	.	H	α-helix	trans	-61.7	-44.5	173.8	-71	-165.4	-60.2	-87.9	2.9	112.2	F24 P28 Y29 F53 Q54 R59 S60 I61 L66	F24-R57 HydrophobicContact CE2-CG 3.68Å; F24-R57 HydrophobicContact CZ-CG 4.14Å; P28-R57 HydrophobicContact CB-CG 4.24Å; P28-R57 VanDerWaalsContact O-CD 3.29Å; P28-R57 WeakPolarHBondContact O-CD 3.26Å; P28-R57 PolarHBondContact O-NH1 2.81Å; Y29-R57 VanDerWaalsContact CE1-NE 3.27Å; F53-R57 WeakPolarHBondContact O-CG 3.47Å; F53-R57 PolarHBondContact O-N 3.03Å; Q54-R57 PolarHBondContact O-N 2.93Å; R57-R59 VanDerWaalsContact C-N 3.27Å; R57-R59 PolarHBondContact O-N 3.11Å; R57-S60 PolarHBondContact O-N 2.56Å; R57-S60 VanDerWaalsContact O-N 3.11Å; R57-I61 VanDerWaalsContact O-CG1 3.3Å; R57-I61 WeakPolarHBondContact O-CG1 3.12Å; R57-I61 PolarHBondContact O-N 3.47Å; R57-L66 HydrophobicContact CG-CD2 4.33Å
58	A	93	Very high	86.5	Confident	59 Å²	59	78.5 Å²	78.5	49%	0.488	39%	0.392	S	S	.	.	H	α-helix	trans	-57.4	-41.7	178.4	0	0	0	0	0	112	Q54 N55 K62	Q54-A58 WeakPolarHBondContact O-CB 3.48Å; Q54-A58 PolarHBondContact O-N 2.89Å; N55-A58 PolarHBondContact O-N 3.48Å; A58-K62 PolarHBondContact O-N 3.47Å; A58-K62 VanDerWaalsContact O-N 3.16Å
59	R	90.1	Very high	84.6	Confident	127 Å²	127	80 Å²	80	48%	0.479	41%	0.407	S	S	.	.	H	α-helix	trans	-65.6	-45.5	173.3	-73.1	-177.4	-74.1	-111.7	2	112.3	N55 R56 R57 I61 K62 T63	N55-R59 WeakPolarHBondContact O-CG 3.26Å; N55-R59 PolarHBondContact O-N 3.11Å; N55-R59 PolarHBondContact O-NE 3.23Å; R56-R59 PolarHBondContact O-N 3.35Å; R57-R59 VanDerWaalsContact C-N 3.27Å; R57-R59 PolarHBondContact O-N 3.11Å; R59-I61 VanDerWaalsContact C-N 3.31Å; R59-I61 PolarHBondContact O-N 2.71Å; R59-K62 PolarHBondContact O-N 3.29Å; R59-K62 VanDerWaalsContact O-N 3.15Å; R59-T63 PolarHBondContact O-N 3.36Å; R59-T63 PolarHBondContact O-OG1 3.41Å
60	S	85	Confident	82.3	Confident	16 Å²	16	85.7 Å²	85.7	11%	0.112	44%	0.442	C	S	.	.	H	α-helix	trans	-61.2	-38.5	179.5	-163.7	0	0	0	0	112.9	R56 R57 T63 G64 R65 L66	R56-S60 PolarHBondContact O-N 2.94Å; R57-S60 PolarHBondContact O-N 2.56Å; R57-S60 VanDerWaalsContact O-N 3.11Å; S60-T63 PolarHBondContact O-N 3.43Å; S60-T63 PolarHBondContact O-OG1 2.87Å; S60-G64 PolarHBondContact O-N 3.16Å; S60-R65 PolarHBondContact O-N 2.92Å; S60-R65 WeakPolarHBondContact OG-CB 3.47Å; S60-L66 PolarHBondContact O-N 2.83Å
61	I	86.2	Confident	79.9	Confident	39 Å²	39	91.8 Å²	91.8	20%	0.2	47%	0.468	C	S	.	.	H	α-helix	trans	-66.2	-43.2	174.8	-65.5	163.3	0	0	0	110.5	R57 R59 T63 G64 L66 R68	R57-I61 VanDerWaalsContact O-CG1 3.3Å; R57-I61 WeakPolarHBondContact O-CG1 3.12Å; R57-I61 PolarHBondContact O-N 3.47Å; R59-I61 VanDerWaalsContact C-N 3.31Å; R59-I61 PolarHBondContact O-N 2.71Å; I61-T63 VanDerWaalsContact C-N 3.27Å; I61-T63 PolarHBondContact O-N 3.19Å; I61-G64 PolarHBondContact O-N 3.24Å; I61-G64 VanDerWaalsContact O-N 3.15Å; I61-L66 WeakPolarHBondContact CA-O 3.25Å; I61-L66 HydrophobicContact CG1-CB 4.12Å; I61-L66 WeakPolarHBondContact CG1-O 3.24Å; I61-R68 HydrophobicContact CG2-CB 4.03Å
62	K	79.6	Confident	77.3	Confident	191 Å²	191	94 Å²	94	83%	0.83	49%	0.486	S	S	*	.	H	α-helix	trans	-64.4	-31.9	179.3	-174.3	170.1	178.6	178.8	0	112.6	A58 R59 G64	A58-K62 PolarHBondContact O-N 3.47Å; A58-K62 VanDerWaalsContact O-N 3.16Å; R59-K62 PolarHBondContact O-N 3.29Å; R59-K62 VanDerWaalsContact O-N 3.15Å; K62-G64 VanDerWaalsContact C-N 3.33Å
63	T	77.1	Confident	74.7	Confident	98 Å²	98	100.9 Å²	100.9	60%	0.601	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	4.9	176.9	56.9	0	0	0	0	113.7	R59 S60 I61 R65	R59-T63 PolarHBondContact O-N 3.36Å; R59-T63 PolarHBondContact O-OG1 3.41Å; S60-T63 PolarHBondContact O-N 3.43Å; S60-T63 PolarHBondContact O-OG1 2.87Å; I61-T63 VanDerWaalsContact C-N 3.27Å; I61-T63 PolarHBondContact O-N 3.19Å; T63-R65 VanDerWaalsContact C-N 3.27Å; T63-R65 PolarHBondContact O-N 3.31Å
64	G	73.4	Confident	72.4	Confident	66 Å²	66	104.4 Å²	104.4	68%	0.68	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.7	6.4	177.4	0	0	0	0	0	115.3	S60 I61 K62	S60-G64 PolarHBondContact O-N 3.16Å; I61-G64 PolarHBondContact O-N 3.24Å; I61-G64 VanDerWaalsContact O-N 3.15Å; K62-G64 VanDerWaalsContact C-N 3.33Å
65	R	68.6	Low	69.6	Low	216 Å²	216	103.8 Å²	103.8	82%	0.815	58%	0.579	S	S	*	*	S	Bend	trans	-82.9	-14.5	179.5	-68.7	-167.8	-179.8	-152.5	1	113.9	S60 T63	S60-R65 PolarHBondContact O-N 2.92Å; S60-R65 WeakPolarHBondContact OG-CB 3.47Å; T63-R65 VanDerWaalsContact C-N 3.27Å; T63-R65 PolarHBondContact O-N 3.31Å
66	L	64.7	Low	66.8	Low	44 Å²	44	103.9 Å²	103.9	23%	0.23	60%	0.598	C	S	.	*	S	Bend	trans	-136.3	124.3	174.3	-151.5	74.7	0	0	0	108.7	P28 Y29 R57 S60 I61 R68	P28-L66 HydrophobicContact CB-CD2 4.28Å; P28-L66 HydrophobicContact CG-CD1 4.36Å; Y29-L66 HydrophobicContact CE2-CD2 4.44Å; R57-L66 HydrophobicContact CG-CD2 4.33Å; S60-L66 PolarHBondContact O-N 2.83Å; I61-L66 WeakPolarHBondContact CA-O 3.25Å; I61-L66 HydrophobicContact CG1-CB 4.12Å; I61-L66 WeakPolarHBondContact CG1-O 3.24Å; L66-R68 PolarHBondContact O-N 2.96Å
67	S	65.1	Low	64.4	Low	105 Å²	105	112.2 Å²	112.2	73%	0.734	63%	0.629	S	S	*	*			trans	-64.6	136.4	173.1	58.3	0	0	0	0	109
68	R	63	Low	61.6	Low	175 Å²	175	113.7 Å²	113.7	66%	0.66	66%	0.658	S	S	*	*			trans	-59.3	132.6	169.8	-177.8	177.5	-66.1	-101.5	-0.9	106.6	I61 L66 T70	I61-R68 HydrophobicContact CG2-CB 4.03Å; L66-R68 PolarHBondContact O-N 2.96Å; R68-T70 VanDerWaalsContact C-N 3.27Å; R68-T70 PolarHBondContact O-N 3.27Å
69	P	57.7	Low	59.1	Low	89 Å²	89	120.7 Å²	120.7	58%	0.578	68%	0.678	S	S	*	*			trans	-62.2	99.7	169.8	24	-30.5	0	0	0	106.9	K71	P69-K71 PolarHBondContact O-N 3.41Å; P69-K71 VanDerWaalsContact O-N 3.11Å
70	T	49.3	Very low	56.9	Low	119 Å²	119	122.1 Å²	122.1	73%	0.73	69%	0.694	S	S	*	*			trans	-68.2	108.2	175.9	50.1	0	0	0	0	105.9	R68 S72	R68-T70 VanDerWaalsContact C-N 3.27Å; R68-T70 PolarHBondContact O-N 3.27Å; T70-S72 VanDerWaalsContact C-N 3.32Å; T70-S72 PolarHBondContact O-N 3.01Å
71	K	47.3	Very low	54.9	Low	203 Å²	203	128.4 Å²	128.4	88%	0.883	72%	0.721	S	S	*	*			trans	-59.7	109.5	149.6	-66.7	-175.2	176.7	-174.4	0	104.6	P69 D73	P69-K71 PolarHBondContact O-N 3.41Å; P69-K71 VanDerWaalsContact O-N 3.11Å; K71-D73 PolarHBondContact O-N 3.42Å
72	S	43	Very low	53.2	Low	116 Å²	116	131.9 Å²	131.9	81%	0.811	75%	0.747	S	S	*	*			trans	-61.6	87.2	172.5	49.8	0	0	0	0	108.6	T70	T70-S72 VanDerWaalsContact C-N 3.32Å; T70-S72 PolarHBondContact O-N 3.01Å
73	D	42.4	Very low	52	Low	157 Å²	157	128.1 Å²	128.1	84%	0.84	74%	0.742	S	S	*	*			trans	-93	105.9	151.5	-162.4	-118.1	0	0	0	105.5	K71 G75	K71-D73 PolarHBondContact O-N 3.42Å; D73-G75 PolarHBondContact O-N 2.94Å
74	G	48	Very low	50.4	Low	77 Å²	77	128.5 Å²	128.5	79%	0.794	76%	0.755	S	S	*	*			trans	-67.7	122.3	179.1	0	0	0	0	0	109.7
75	G	38.2	Very low	48.7	Very low	76 Å²	76	128.2 Å²	128.2	78%	0.784	75%	0.752	S	S	*	*			trans	-170.5	105.9	173	0	0	0	0	0	112.8	D73	D73-G75 PolarHBondContact O-N 2.94Å
76	G	38.2	Very low	47.6	Very low	79 Å²	79	127.4 Å²	127.4	81%	0.814	76%	0.757	S	S	*	*			trans	95.1	80.6	147.5	0	0	0	0	0	116.9
77	R	46.3	Very low	46.1	Very low	261 Å²	261	129 Å²	129	99%	0.985	78%	0.784	S	S	*	*			trans	-55.4	135.6	144.1	-70.5	-178.2	175.2	-112	1.1	108.7
78	G	37.8	Very low	44.9	Very low	74 Å²	74	129.1 Å²	129.1	76%	0.763	79%	0.792	S	S	*	*			trans	-175.8	55.6	175.1	0	0	0	0	0	112.4
79	F	39.6	Very low	43.9	Very low	206 Å²	206	125.2 Å²	125.2	90%	0.904	79%	0.791	S	S	*	*			trans	-110.4	103.6	159.7	-166.6	-98.4	0	0	0	107.3
80	L	43.6	Very low	43.4	Very low	158 Å²	158	125.2 Å²	125.2	83%	0.827	80%	0.799	S	S	*	*			trans	-70.8	129.1	174.1	-82.4	142.9	0	0	0	109.5
81	E	43.3	Very low	43.4	Very low	147 Å²	147	129.1 Å²	129.1	69%	0.687	80%	0.801	S	S	*	*			trans	-57.3	156.4	163.1	-176.2	-128.9	121.9	0	0	112.3	P83	E81-P83 WeakPolarHBondContact OE1-CA 2.96Å; E81-P83 VanDerWaalsContact OE1-CB 3.31Å; E81-P83 WeakPolarHBondContact OE1-CB 3.11Å; E81-P83 WeakPolarHBondContact OE1-CD 3.12Å; E81-P83 VanDerWaalsContact OE1-N 3.17Å
82	P	51.1	Low	43.6	Very low	113 Å²	113	125.3 Å²	125.3	73%	0.734	80%	0.797	S	S	*	*				-135.1	164.7	128.1	35	-21.7	0	0	0	114.6
83	P	53.7	Low	43.9	Very low	112 Å²	112	124.3 Å²	124.3	73%	0.727	80%	0.796	S	S	*	*			trans	-94.6	174.4	-152.7	35.7	-35.8	0	0	0	116.4	E81	E81-P83 WeakPolarHBondContact OE1-CA 2.96Å; E81-P83 VanDerWaalsContact OE1-CB 3.31Å; E81-P83 WeakPolarHBondContact OE1-CB 3.11Å; E81-P83 WeakPolarHBondContact OE1-CD 3.12Å; E81-P83 VanDerWaalsContact OE1-N 3.17Å
84	A	44.1	Very low	44	Very low	105 Å²	105	123.3 Å²	123.3	87%	0.868	80%	0.796	S	S	*	*			trans	-58.6	161.1	-168	0	0	0	0	0	119.7
85	G	38.4	Very low	44.3	Very low	60 Å²	60	125.8 Å²	125.8	62%	0.619	80%	0.796	S	S	*	*			trans	169.6	99	149.1	0	0	0	0	0	119
86	H	45	Very low	44.6	Very low	199 Å²	199	124 Å²	124	92%	0.921	78%	0.778	S	S	*	*			trans	65.4	130.6	140.4	-51.1	90.7	0	0	0	123.4
87	G	33.1	Very low	45.3	Very low	78 Å²	78	127.2 Å²	127.2	80%	0.804	78%	0.775	S	S	*	*			trans	149.3	97	148.8	0	0	0	0	0	115.3
88	A	41.1	Very low	45.6	Very low	108 Å²	108	118.6 Å²	118.6	89%	0.893	76%	0.76	S	S	*	*			trans	-73.4	138.2	171.1	0	0	0	0	0	111.7
89	S	42	Very low	45.9	Very low	93 Å²	93	120.6 Å²	120.6	65%	0.65	75%	0.753	S	S	*	*			trans	-158	130.7	156.6	-163	0	0	0	0	110.8	Y91	S89-Y91 WeakPolarHBondContact OG-CE2 3.36Å; S89-Y91 PolarHBondContact OG-OH 3.11Å
90	A	45.3	Very low	46.4	Very low	89 Å²	89	117.2 Å²	117.2	74%	0.736	74%	0.743	S	S	*	*			trans	-87.9	125.2	-173.6	0	0	0	0	0	111.7
91	Y	49.3	Very low	46.5	Very low	200 Å²	200	118.8 Å²	118.8	78%	0.784	74%	0.744	S	S	*	*			trans	-147.7	144.9	158.3	-54.3	-78.5	0	0	0	109.6	S89	S89-Y91 WeakPolarHBondContact OG-CE2 3.36Å; S89-Y91 PolarHBondContact OG-OH 3.11Å
92	P	52.3	Low	47	Very low	123 Å²	123	121.9 Å²	121.9	80%	0.799	75%	0.749	S	S	*	*			trans	-80.6	155.9	-176.3	33.5	-33	0	0	0	112.2	T94	P92-T94 PolarHBondContact O-N 3.06Å
93	A	48.3	Very low	46.4	Very low	96 Å²	96	124.9 Å²	124.9	79%	0.793	75%	0.753	S	S	*	*			trans	-30.7	121.8	-179.2	0	0	0	0	0	116.5
94	T	44.8	Very low	45.8	Very low	136 Å²	136	124.5 Å²	124.5	83%	0.834	75%	0.745	S	S	*	*			trans	-104	113.8	145.8	53	0	0	0	0	107.4	P92 G96	P92-T94 PolarHBondContact O-N 3.06Å; T94-G96 PolarHBondContact O-N 2.96Å
95	T	54.3	Low	45.5	Very low	128 Å²	128	127 Å²	127	79%	0.785	74%	0.739	S	S	*	*			trans	-53.1	100.7	176	-37.9	0	0	0	0	108.9
96	G	45.1	Very low	45.4	Very low	40 Å²	40	129.1 Å²	129.1	41%	0.412	75%	0.745	S	S	.	*			trans	-66.3	140.2	176	0	0	0	0	0	109.3	T94 A98 D99	T94-G96 PolarHBondContact O-N 2.96Å; G96-A98 PolarHBondContact O-N 3.46Å; G96-D99 PolarHBondContact O-N 3.47Å
97	L	52.6	Low	45	Very low	145 Å²	145	124.2 Å²	124.2	76%	0.759	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	2.6	170	-132	163.9	0	0	0	113.6	I100	L97-I100 HydrophobicContact CD2-CD1 4.32Å
98	A	52.1	Low	44.8	Very low	80 Å²	80	125.4 Å²	125.4	66%	0.661	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-19.3	169.8	0	0	0	0	0	113.8	G96	G96-A98 PolarHBondContact O-N 3.46Å
99	D	45.8	Very low	44.6	Very low	117 Å²	117	126.2 Å²	126.2	63%	0.626	72%	0.715	S	S	*	*	S	Bend	trans	-88.5	-5.9	178.2	-90	-48.8	0	0	0	114.2	G96 F101	G96-D99 PolarHBondContact O-N 3.47Å; D99-F101 VanDerWaalsContact C-N 3.34Å
100	I	49	Very low	44.2	Very low	134 Å²	134	128.5 Å²	128.5	69%	0.687	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-19.3	172.6	-62.4	-176.7	0	0	0	111.6	L97	L97-I100 HydrophobicContact CD2-CD1 4.32Å
101	F	46.7	Very low	44.3	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.842	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	15.2	-178.1	-109.5	-85.9	0	0	0	114.2	D99	D99-F101 VanDerWaalsContact C-N 3.34Å
102	R	53.8	Low	44.3	Very low	212 Å²	212	125.5 Å²	125.5	80%	0.8	70%	0.698	S	S	*	*			trans	-128.5	34.7	-174.5	-144.8	-167.9	166.9	163.7	-1.2	114.2
103	Q	37.8	Very low	44	Very low	175 Å²	175	123.3 Å²	123.3	82%	0.818	68%	0.684	S	S	*	*	S	Bend	trans	-103.4	108.4	162.2	-165.5	77.7	12.7	0	0	108.6
104	D	41.3	Very low	44.2	Very low	105 Å²	105	122.8 Å²	122.8	56%	0.561	67%	0.673	S	S	*	*			trans	59.9	94.7	144.9	-155.4	-117	0	0	0	117.9
105	Q	38	Very low	44.5	Very low	157 Å²	157	122.9 Å²	122.9	73%	0.734	67%	0.668	S	S	*	*				-146.6	73.2	129.8	-78.9	-155.5	51.8	0	0	109.8	H107	Q105-H107 VanDerWaalsContact CB-CD2 3.48Å; Q105-H107 WeakPolarHBondContact CB-CD2 3.39Å; Q105-H107 WeakPolarHBondContact CG-CD2 3.33Å; Q105-H107 PolarHBondContact O-N 3.4Å; Q105-H107 PolarHBondContact OE1-CD2 3.35Å
106	S	35.8	Very low	44.4	Very low	105 Å²	105	118.3 Å²	118.3	73%	0.734	64%	0.636	S	S	*	*			trans	-68.3	64.1	143.5	39.2	0	0	0	0	109.6
107	H	35.9	Very low	44.9	Very low	96 Å²	96	119 Å²	119	44%	0.444	63%	0.634	S	S	.	*			trans	-96.6	92.9	156.9	-65.4	-106.9	0	0	0	103.5	Q105 E110	Q105-H107 VanDerWaalsContact CB-CD2 3.48Å; Q105-H107 WeakPolarHBondContact CB-CD2 3.39Å; Q105-H107 WeakPolarHBondContact CG-CD2 3.33Å; Q105-H107 PolarHBondContact O-N 3.4Å; Q105-H107 PolarHBondContact OE1-CD2 3.35Å; H107-E110 HydrophobicContact CB-CG 4.41Å; H107-E110 IonicContact ND1-OE1 3.86Å
108	S	30.4	Very low	45.2	Very low	102 Å²	102	115.8 Å²	115.8	71%	0.713	62%	0.618	S	S	*	*				31	105.6	94.3	-169.4	0	0	0	0	109.6	E110	S108-E110 VanDerWaalsContact C-N 3.32Å; S108-E110 WeakPolarHBondContact O-CA 3.45Å; S108-E110 PolarHBondContact O-N 2.81Å
109	C	35.4	Very low	45.9	Very low	125 Å²	125	112.7 Å²	112.7	85%	0.845	59%	0.59	S	S	*	*	S	Bend	trans	-28.8	95.4	168.7	-165.5	0	0	0	0	109.8	E111	C109-E111 PolarHBondContact O-N 3.25Å; C109-E111 VanDerWaalsContact O-N 3.14Å
110	E	34.6	Very low	46.8	Very low	141 Å²	141	109 Å²	109	66%	0.659	57%	0.569	S	S	*	*			trans	-58.3	125.6	-168.8	-102.5	-87.6	119.2	0	0	107.3	H107 S108 V112	H107-E110 HydrophobicContact CB-CG 4.41Å; H107-E110 IonicContact ND1-OE1 3.86Å; S108-E110 VanDerWaalsContact C-N 3.32Å; S108-E110 WeakPolarHBondContact O-CA 3.45Å; S108-E110 PolarHBondContact O-N 2.81Å; E110-V112 PolarHBondContact O-N 2.96Å
111	E	47.2	Very low	47.5	Very low	151 Å²	151	107.3 Å²	107.3	71%	0.706	56%	0.559	S	S	*	*			trans	-30.8	106.1	172.5	-173	178.5	131.4	0	0	109.5	C109 P113	C109-E111 PolarHBondContact O-N 3.25Å; C109-E111 VanDerWaalsContact O-N 3.14Å; E111-P113 VanDerWaalsContact O-CD 3.25Å; E111-P113 WeakPolarHBondContact O-CD 3.44Å
112	V	48.4	Very low	48.2	Very low	75 Å²	75	104.1 Å²	104.1	46%	0.455	55%	0.549	S	S	.	.			trans	-45.1	114.3	170	168.4	0	0	0	0	106.6	E110 Y116	E110-V112 PolarHBondContact O-N 2.96Å; V112-Y116 HydrophobicContact CB-CD1 4.46Å; V112-Y116 HydrophobicContact CG1-CD1 3.18Å; V112-Y116 HydrophobicContact CG1-CE1 4.05Å; V112-Y116 HydrophobicContact CG1-CG 3.8Å
113	P	45.7	Very low	48.3	Very low	77 Å²	77	95.9 Å²	95.9	50%	0.5	52%	0.518	S	S	.	.			trans	-48.6	137.9	-176	-29.5	33.9	0	0	0	109	E111 L115 Y116 S117	E111-P113 VanDerWaalsContact O-CD 3.25Å; E111-P113 WeakPolarHBondContact O-CD 3.44Å; P113-L115 PolarHBondContact O-N 3.32Å; P113-Y116 VanDerWaalsContact O-CA 3.29Å; P113-Y116 WeakPolarHBondContact O-CA 3.3Å; P113-Y116 WeakPolarHBondContact O-CB 3.37Å; P113-Y116 PolarHBondContact O-N 3.35Å; P113-S117 PolarHBondContact O-N 3.15Å
114	P	54.2	Low	49.3	Very low	85 Å²	85	90.4 Å²	90.4	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-51.4	-36.3	-177.8	-29	33.6	0	0	0	112.8	Y116 S117 D118	P114-Y116 PolarHBondContact O-N 3.5Å; P114-Y116 VanDerWaalsContact O-N 3.12Å; P114-S117 PolarHBondContact O-N 3.41Å; P114-D118 WeakPolarHBondContact O-CB 3.37Å; P114-D118 PolarHBondContact O-N 2.97Å
115	L	50.5	Low	50.1	Low	139 Å²	139	91.1 Å²	91.1	73%	0.728	50%	0.503	S	S	*	.	H	α-helix	trans	-52.9	-31.9	171.5	-79.6	158.8	0	0	0	114.1	P113 W119	P113-L115 PolarHBondContact O-N 3.32Å; L115-W119 PolarHBondContact O-N 3.09Å
116	Y	51.8	Low	50.8	Low	31 Å²	31	91.7 Å²	91.7	12%	0.122	51%	0.505	C	S	.	.	H	α-helix	trans	-79.9	-33.7	179.8	-163.1	-97.9	0	0	0	113.7	Q22 A25 V26 V112 P113 P114 W119 I120	Q22-Y116 HydrophobicContact CG-CD2 3.94Å; Q22-Y116 HydrophobicContact CG-CE2 3.65Å; Q22-Y116 WeakPolarHBondContact O-CE2 3.35Å; Q22-Y116 VanDerWaalsContact O-CZ 3.26Å; Q22-Y116 PolarHBondContact O-OH 3.24Å; A25-Y116 WeakPolarHBondContact CA-OH 3.42Å; A25-Y116 HydrophobicContact CB-CE2 4.5Å; A25-Y116 WeakPolarHBondContact CB-OH 3.45Å; A25-Y116 PolarHBondContact N-OH 3.02Å; A25-Y116 PolarHBondContact O-OH 3.4Å; V26-Y116 VanDerWaalsContact CA-OH 3.24Å; V26-Y116 WeakPolarHBondContact CA-OH 3.43Å; V26-Y116 HydrophobicContact CB-CD1 4.41Å; V26-Y116 HydrophobicContact CB-CE1 3.45Å; V26-Y116 VanDerWaalsContact CB-CE1 3.45Å; V26-Y116 HydrophobicContact CG1-CD1 4.16Å; V26-Y116 HydrophobicContact CG1-CE1 3.54Å; V26-Y116 HydrophobicContact CG2-CD1 3.95Å; V26-Y116 HydrophobicContact CG2-CE1 3.13Å; V26-Y116 HydrophobicContact CG2-CE2 4.07Å; V26-Y116 WeakPolarHBondContact CG2-OH 3.39Å; V26-Y116 PolarHBondContact N-OH 3.14Å; V112-Y116 HydrophobicContact CB-CD1 4.46Å; V112-Y116 HydrophobicContact CG1-CD1 3.18Å; V112-Y116 HydrophobicContact CG1-CE1 4.05Å; V112-Y116 HydrophobicContact CG1-CG 3.8Å; P113-Y116 VanDerWaalsContact O-CA 3.29Å; P113-Y116 WeakPolarHBondContact O-CA 3.3Å; P113-Y116 WeakPolarHBondContact O-CB 3.37Å; P113-Y116 PolarHBondContact O-N 3.35Å; P114-Y116 PolarHBondContact O-N 3.5Å; P114-Y116 VanDerWaalsContact O-N 3.12Å; Y116-W119 AromaticContact CD2-NE1 3.23Å; Y116-W119 HydrophobicContact CE2-CZ2 4.25Å; Y116-W119 AromaticContact CE2-NE1 3.58Å; Y116-W119 AromaticContact CG-NE1 3.53Å; Y116-W119 PolarHBondContact O-NE1 3.17Å; Y116-I120 HydrophobicContact CD1-CD1 4.39Å; Y116-I120 WeakPolarHBondContact O-CD1 3.41Å; Y116-I120 WeakPolarHBondContact O-CG1 3.29Å
117	S	56.1	Low	51.1	Low	54 Å²	54	90.8 Å²	90.8	38%	0.378	51%	0.505	S	S	.	.	H	α-helix	trans	-72.8	-35	168.5	-156.8	0	0	0	0	110.4	P113 P114 I120 Q121	P113-S117 PolarHBondContact O-N 3.15Å; P114-S117 PolarHBondContact O-N 3.41Å; S117-I120 PolarHBondContact O-N 2.72Å; S117-Q121 WeakPolarHBondContact O-CG 3.46Å; S117-Q121 PolarHBondContact O-N 3.34Å
118	D	59	Low	51.1	Low	79 Å²	79	91.6 Å²	91.6	42%	0.422	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-47.1	-179	-80.2	-26.6	0	0	0	113.2	P114 I120 Q121 I122	P114-D118 WeakPolarHBondContact O-CB 3.37Å; P114-D118 PolarHBondContact O-N 2.97Å; D118-I120 VanDerWaalsContact C-N 3.27Å; D118-I120 PolarHBondContact O-N 3.11Å; D118-Q121 PolarHBondContact O-N 2.76Å; D118-Q121 VanDerWaalsContact O-N 3.16Å; D118-I122 WeakPolarHBondContact O-CD1 3.39Å; D118-I122 WeakPolarHBondContact O-CG1 3.48Å; D118-I122 PolarHBondContact O-N 3.46Å
119	W	66.5	Low	52.1	Low	15 Å²	15	92.4 Å²	92.4	6%	0.057	53%	0.527	C	S	.	.	H	α-helix	trans	-63.2	-39.5	178	77.4	-91.3	0	0	0	110.3	Q22 A23 V26 L34 L38 L115 Y116 Q121 I122 Y123	Q22-W119 HydrophobicContact CG-CZ2 4.36Å; Q22-W119 VanDerWaalsContact NE2-CG 3.34Å; A23-W119 VanDerWaalsContact CA-CZ2 3.47Å; A23-W119 HydrophobicContact CB-CH2 3.35Å; A23-W119 HydrophobicContact CB-CZ2 4.09Å; A23-W119 HydrophobicContact CB-CZ3 3.87Å; V26-W119 HydrophobicContact CG2-CH2 3.77Å; V26-W119 HydrophobicContact CG2-CZ2 3.15Å; L34-W119 HydrophobicContact CD1-CZ3 4.29Å; L38-W119 HydrophobicContact CD2-CZ3 4.46Å; L115-W119 PolarHBondContact O-N 3.09Å; Y116-W119 AromaticContact CD2-NE1 3.23Å; Y116-W119 HydrophobicContact CE2-CZ2 4.25Å; Y116-W119 AromaticContact CE2-NE1 3.58Å; Y116-W119 AromaticContact CG-NE1 3.53Å; Y116-W119 PolarHBondContact O-NE1 3.17Å; W119-Q121 VanDerWaalsContact C-N 3.34Å; W119-Q121 PolarHBondContact O-N 3.32Å; W119-I122 WeakPolarHBondContact O-CB 3.31Å; W119-I122 PolarHBondContact O-N 3.39Å; W119-Y123 HydrophobicContact CB-CD2 4.26Å; W119-Y123 HydrophobicContact CB-CE2 3.99Å; W119-Y123 HydrophobicContact CD2-CD2 4.25Å; W119-Y123 HydrophobicContact CD2-CE2 4.36Å; W119-Y123 AromaticContact CE3-CD2 3.32Å; W119-Y123 HydrophobicContact CE3-CD2 3.32Å; W119-Y123 AromaticContact CE3-CE2 3.56Å; W119-Y123 HydrophobicContact CE3-CE2 3.56Å; W119-Y123 AromaticContact CZ3-CD2 3.98Å; W119-Y123 HydrophobicContact CZ3-CD2 3.98Å; W119-Y123 HydrophobicContact CZ3-CE2 4.45Å; W119-Y123 WeakPolarHBondContact O-CD2 3.3Å; W119-Y123 PolarHBondContact O-N 2.96Å
120	I	65.3	Low	52.4	Low	38 Å²	38	92.5 Å²	92.5	20%	0.195	52%	0.523	C	S	.	.	H	α-helix	trans	-62.1	-43.1	175.4	-58.9	173.1	0	0	0	110.7	V26 Y116 S117 D118 I122 Y123 S124	V26-I120 HydrophobicContact CB-CD1 3.7Å; V26-I120 HydrophobicContact CG1-CD1 3.14Å; V26-I120 HydrophobicContact CG2-CD1 3.32Å; V26-I120 HydrophobicContact CG2-CG1 4.02Å; Y116-I120 HydrophobicContact CD1-CD1 4.39Å; Y116-I120 WeakPolarHBondContact O-CD1 3.41Å; Y116-I120 WeakPolarHBondContact O-CG1 3.29Å; S117-I120 PolarHBondContact O-N 2.72Å; D118-I120 VanDerWaalsContact C-N 3.27Å; D118-I120 PolarHBondContact O-N 3.11Å; I120-I122 VanDerWaalsContact C-N 3.35Å; I120-I122 PolarHBondContact O-N 2.84Å; I120-Y123 CarbonylContact O-C 3.57Å; I120-Y123 WeakPolarHBondContact O-CA 3.48Å; I120-Y123 PolarHBondContact O-N 3.05Å; I120-Y123 VanDerWaalsContact O-N 3.08Å; I120-S124 VanDerWaalsContact CG2-OG 3.29Å; I120-S124 WeakPolarHBondContact CG2-OG 3.32Å; I120-S124 WeakPolarHBondContact O-CA 3.45Å; I120-S124 WeakPolarHBondContact O-CB 3.36Å; I120-S124 PolarHBondContact O-N 3.45Å; I120-S124 PolarHBondContact O-OG 3.35Å
121	Q	62.3	Low	53.2	Low	100 Å²	100	91.1 Å²	91.1	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-61.6	-41.4	175.9	-73.5	-178.8	36.8	0	0	112.4	S117 D118 W119 Y123 S124 N125	S117-Q121 WeakPolarHBondContact O-CG 3.46Å; S117-Q121 PolarHBondContact O-N 3.34Å; D118-Q121 PolarHBondContact O-N 2.76Å; D118-Q121 VanDerWaalsContact O-N 3.16Å; W119-Q121 VanDerWaalsContact C-N 3.34Å; W119-Q121 PolarHBondContact O-N 3.32Å; Q121-Y123 PolarHBondContact O-N 3.07Å; Q121-S124 PolarHBondContact O-N 3.16Å; Q121-S124 VanDerWaalsContact O-N 3.15Å; Q121-N125 PolarHBondContact O-N 3.44Å; Q121-N125 VanDerWaalsContact O-N 3.16Å
122	I	61.9	Low	53.6	Low	124 Å²	124	89.6 Å²	89.6	64%	0.636	53%	0.53	S	S	*	.	H	α-helix	trans	-58.7	-37.5	172.7	-66.4	162.9	0	0	0	110.7	D118 W119 I120	D118-I122 WeakPolarHBondContact O-CD1 3.39Å; D118-I122 WeakPolarHBondContact O-CG1 3.48Å; D118-I122 PolarHBondContact O-N 3.46Å; W119-I122 WeakPolarHBondContact O-CB 3.31Å; W119-I122 PolarHBondContact O-N 3.39Å; I120-I122 VanDerWaalsContact C-N 3.35Å; I120-I122 PolarHBondContact O-N 2.84Å
123	Y	56.9	Low	53.3	Low	40 Å²	40	92 Å²	92	16%	0.157	55%	0.547	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	18.2	176.9	-54.7	-68.7	0	0	0	114.3	R37 H41 W119 I120 Q121	R37-Y123 HydrophobicContact CB-CD1 4.11Å; R37-Y123 VanDerWaalsContact CD-C 3.47Å; R37-Y123 WeakPolarHBondContact CD-O 3.32Å; R37-Y123 VanDerWaalsContact CZ-C 3.48Å; R37-Y123 PolarHBondContact NE-O 3.08Å; R37-Y123 PolarHBondContact NH1-O 2.75Å; H41-Y123 HydrophobicContact CB-CE1 4.36Å; H41-Y123 PolarHBondContact CE1-OH 3.13Å; H41-Y123 PolarHBondContact ND1-OH 3.01Å; W119-Y123 HydrophobicContact CB-CD2 4.26Å; W119-Y123 HydrophobicContact CB-CE2 3.99Å; W119-Y123 HydrophobicContact CD2-CD2 4.25Å; W119-Y123 HydrophobicContact CD2-CE2 4.36Å; W119-Y123 AromaticContact CE3-CD2 3.32Å; W119-Y123 HydrophobicContact CE3-CD2 3.32Å; W119-Y123 AromaticContact CE3-CE2 3.56Å; W119-Y123 HydrophobicContact CE3-CE2 3.56Å; W119-Y123 AromaticContact CZ3-CD2 3.98Å; W119-Y123 HydrophobicContact CZ3-CD2 3.98Å; W119-Y123 HydrophobicContact CZ3-CE2 4.45Å; W119-Y123 WeakPolarHBondContact O-CD2 3.3Å; W119-Y123 PolarHBondContact O-N 2.96Å; I120-Y123 CarbonylContact O-C 3.57Å; I120-Y123 WeakPolarHBondContact O-CA 3.48Å; I120-Y123 PolarHBondContact O-N 3.05Å; I120-Y123 VanDerWaalsContact O-N 3.08Å; Q121-Y123 PolarHBondContact O-N 3.07Å
124	S	58	Low	53	Low	60 Å²	60	93.2 Å²	93.2	42%	0.42	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.3	-42	178.5	-66.1	0	0	0	0	110.8	R37 I120 Q121	R37-S124 PolarHBondContact NH1-O 3.32Å; R37-S124 VanDerWaalsContact NH2-C 3.32Å; R37-S124 PolarHBondContact NH2-O 3.06Å; I120-S124 VanDerWaalsContact CG2-OG 3.29Å; I120-S124 WeakPolarHBondContact CG2-OG 3.32Å; I120-S124 WeakPolarHBondContact O-CA 3.45Å; I120-S124 WeakPolarHBondContact O-CB 3.36Å; I120-S124 PolarHBondContact O-N 3.45Å; I120-S124 PolarHBondContact O-OG 3.35Å; Q121-S124 PolarHBondContact O-N 3.16Å; Q121-S124 VanDerWaalsContact O-N 3.15Å
125	N	59	Low	52.5	Low	119 Å²	119	95.6 Å²	95.6	64%	0.636	57%	0.572	S	S	*	*			trans	-84.7	120.7	-175.4	-70.7	-38.3	0	0	0	111.7	R37 Q121	R37-N125 VanDerWaalsContact NH2-C 3.34Å; R37-N125 PolarHBondContact NH2-O 2.96Å; Q121-N125 PolarHBondContact O-N 3.44Å; Q121-N125 VanDerWaalsContact O-N 3.16Å
126	Q	51.4	Low	52.1	Low	169 Å²	169	94.2 Å²	94.2	79%	0.79	57%	0.574	S	S	*	*			trans	-119	78.6	165.8	-140.6	136.8	81	0	0	108.3
127	A	42.3	Very low	51.8	Low	87 Å²	87	100.5 Å²	100.5	72%	0.719	61%	0.609	S	S	*	*	S	Bend	trans	-159.9	122.4	158.9	0	0	0	0	0	108.5
128	S	37.1	Very low	51.3	Low	112 Å²	112	104 Å²	104	78%	0.783	63%	0.63	S	S	*	*			trans	78.2	96.8	169.6	-50.1	0	0	0	0	117.2	T130	S128-T130 PolarHBondContact O-N 3.15Å
129	S	49.9	Very low	50.7	Low	120 Å²	120	109.6 Å²	109.6	84%	0.839	65%	0.654	S	S	*	*			trans	-42.8	121.4	149	47.7	0	0	0	0	113.1
130	T	41.8	Very low	49.5	Very low	126 Å²	126	117.5 Å²	117.5	77%	0.773	69%	0.691	S	S	*	*			trans	-154.5	124.5	146	37	0	0	0	0	109.2	S128	S128-T130 PolarHBondContact O-N 3.15Å
131	P	51.4	Low	48.2	Very low	113 Å²	113	123.3 Å²	123.3	73%	0.734	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-66.4	160	164.8	30.6	-32.7	0	0	0	110
132	P	56.8	Low	47.5	Very low	119 Å²	119	127.5 Å²	127.5	77%	0.773	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60.8	138	-178.8	26.4	-34.2	0	0	0	110.5	C134	P132-C134 PolarHBondContact O-N 3.26Å
133	P	40.9	Very low	45.9	Very low	124 Å²	124	127.4 Å²	127.4	81%	0.805	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-71.1	128.3	177.8	29.1	-31	0	0	0	109.5
134	C	39.1	Very low	44.8	Very low	104 Å²	104	131 Å²	131	70%	0.703	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.4	162.7	-59.2	0	0	0	0	109.1	P132 S136	P132-C134 PolarHBondContact O-N 3.26Å; C134-S136 PolarHBondContact O-N 3.18Å; C134-S136 PolarHBondContact O-OG 3.19Å
135	P	43.5	Very low	43.8	Very low	135 Å²	135	133.8 Å²	133.8	88%	0.877	80%	0.801	S	S	*	*			trans	-70.5	104.7	177.2	27.7	-31.2	0	0	0	109.4
136	S	43.8	Very low	42.6	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	82%	0.815	S	S	*	*			trans	-99.8	127.6	175	-54.8	0	0	0	0	109.5	C134	C134-S136 PolarHBondContact O-N 3.18Å; C134-S136 PolarHBondContact O-OG 3.19Å
137	L	44.5	Very low	41.9	Very low	163 Å²	163	134.5 Å²	134.5	85%	0.853	81%	0.813	S	S	*	*			trans	-45.5	148.8	176.4	-100.5	71.8	0	0	0	113.6
138	P	45.7	Very low	42.5	Very low	128 Å²	128	135.5 Å²	135.5	83%	0.831	81%	0.812	S	S	*	*			trans	-74.3	135.3	177.6	29.7	-30.8	0	0	0	112.5
139	Q	45.7	Very low	42.5	Very low	197 Å²	197	137.7 Å²	137.7	92%	0.921	82%	0.815	S	S	*	*			trans	-62.9	144.2	172	-80	178.7	-18.8	0	0	112.6
140	Q	41.3	Very low	41.6	Very low	180 Å²	180	134.8 Å²	134.8	84%	0.841	80%	0.804	S	S	*	*			trans	-124	126	156.8	-164.7	172.8	-82.2	0	0	111.2
141	L	38.8	Very low	41.6	Very low	161 Å²	161	135.9 Å²	135.9	84%	0.843	80%	0.8	S	S	*	*			trans	79.9	118.9	156.7	-121.1	70	0	0	0	121.8
142	Q	46.7	Very low	40.8	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.874	80%	0.804	S	S	*	*			trans	-64.9	145.3	164.4	-64.3	161.7	-0.4	0	0	111.8
143	S	29.8	Very low	39.5	Very low	122 Å²	122	145.5 Å²	145.5	85%	0.853	81%	0.807	S	S	*	*			trans	-159.7	122.7	135.7	-162.7	0	0	0	0	109.8
144	C	33.6	Very low	39.1	Very low	116 Å²	116	147.3 Å²	147.3	78%	0.784	80%	0.804	S	S	*	*			trans	-95.3	145.7	-178.6	50.7	0	0	0	0	110.9
145	S	35.8	Very low	39	Very low	118 Å²	118	150.3 Å²	150.3	83%	0.825	81%	0.808	S	S	*	*			trans	-163.6	117.1	153.7	-82.8	0	0	0	0	112.7
146	K	35.5	Very low	38.3	Very low	213 Å²	213	151.8 Å²	151.8	93%	0.926	80%	0.803	S	S	*	*			trans	59	126.4	143.3	-92	166.4	172.4	173.2	0	122.4
147	A	35	Very low	37.8	Very low	91 Å²	91	153.8 Å²	153.8	75%	0.752	80%	0.801	S	S	*	*			trans	-74.6	-166.4	163.8	0	0	0	0	0	112
148	P	55.4	Low	37.8	Very low	107 Å²	107	154.3 Å²	154.3	70%	0.695	80%	0.798	S	S	*	*			cis	-137.9	-162.7	-9.1	30.5	-4.8	0	0	0	113.7
149	D	36.6	Very low	37.3	Very low	158 Å²	158	157 Å²	157	85%	0.845	81%	0.805	S	S	*	*			trans	103	126	155.4	-66.2	-56.6	0	0	0	119.7
150	G	31.9	Very low	36.6	Very low	60 Å²	60	151.3 Å²	151.3	62%	0.619	80%	0.799	S	S	*	*			trans	131.3	111.7	136.4	0	0	0	0	0	117.9
151	H	41.4	Very low	36.5	Very low	149 Å²	149	147.5 Å²	147.5	69%	0.69	79%	0.792	S	S	*	*			trans	88.1	79.1	141.9	-62.9	-84.2	0	0	0	119.9	W153	H151-W153 HydrophobicContact CB-CZ2 4.4Å; H151-W153 AromaticContact ND1-CE2 3.91Å; H151-W153 AromaticContact ND1-CH2 3.92Å; H151-W153 AromaticContact ND1-CZ2 3.27Å; H151-W153 VanDerWaalsContact ND1-CZ2 3.27Å; H151-W153 WeakPolarHBondContact ND1-CZ2 3.45Å
152	R	34.1	Very low	36.3	Very low	214 Å²	214	149.3 Å²	149.3	81%	0.808	79%	0.788	S	S	*	*			trans	-37.4	128.3	133	166.9	-169.4	-93.3	-144.7	-8.6	112.7
153	W	29.7	Very low	35.8	Very low	220 Å²	220	149.1 Å²	149.1	83%	0.833	78%	0.784	S	S	*	*			trans	-140.2	124.4	149.3	-53.7	106.5	0	0	0	109	H151	H151-W153 HydrophobicContact CB-CZ2 4.4Å; H151-W153 AromaticContact ND1-CE2 3.91Å; H151-W153 AromaticContact ND1-CH2 3.92Å; H151-W153 AromaticContact ND1-CZ2 3.27Å; H151-W153 VanDerWaalsContact ND1-CZ2 3.27Å; H151-W153 WeakPolarHBondContact ND1-CZ2 3.45Å
154	E	33	Very low	36.3	Very low	161 Å²	161	147.8 Å²	147.8	75%	0.752	78%	0.775	S	S	*	*			trans	-115.3	167	170.7	-139.2	172.1	121.2	0	0	106.1
155	E	36.6	Very low	36.8	Very low	168 Å²	168	147.4 Å²	147.4	79%	0.785	77%	0.774	S	S	*	*			trans	80	142.6	175.2	-103.4	161.5	68.2	0	0	117
156	E	30.6	Very low	36.9	Very low	166 Å²	166	150.4 Å²	150.4	78%	0.776	77%	0.772	S	S	*	*			cis	-158.7	170	14.1	-162.3	178.9	83.2	0	0	110.4
157	Q	33	Very low	37.3	Very low	151 Å²	151	146.5 Å²	146.5	71%	0.706	76%	0.76	S	S	*	*			trans	-83.7	160.6	-173.5	-57	-172.1	59.2	0	0	115.8
158	Q	43.3	Very low	37.3	Very low	173 Å²	173	148.3 Å²	148.3	81%	0.808	76%	0.762	S	S	*	*			trans	37.3	113.7	140.2	-70.7	169.9	15.3	0	0	120.5
159	L	34.9	Very low	36.2	Very low	186 Å²	186	146.1 Å²	146.1	97%	0.974	76%	0.759	S	S	*	*				172.7	134.4	122	-169.7	68.2	0	0	0	108.7
160	G	31.8	Very low	36.4	Very low	76 Å²	76	144.2 Å²	144.2	78%	0.784	76%	0.758	S	S	*	*			trans	161.4	92	168.6	0	0	0	0	0	117.6
161	S	38.8	Very low	36.8	Very low	101 Å²	101	149.7 Å²	149.7	71%	0.706	77%	0.765	S	S	*	*			trans	-55.9	144.1	172.2	-120.9	0	0	0	0	115.9
162	R	35.9	Very low	37.3	Very low	198 Å²	198	148.3 Å²	148.3	75%	0.747	77%	0.77	S	S	*	*			trans	95.1	143.9	131.8	-69.7	165.9	-173.4	-150.1	1.9	121.7
163	F	36	Very low	37.9	Very low	184 Å²	184	144.7 Å²	144.7	81%	0.807	76%	0.762	S	S	*	*			trans	79	131.7	161.2	-55	-68.9	0	0	0	115.3
164	S	40.4	Very low	38.9	Very low	94 Å²	94	140.1 Å²	140.1	66%	0.657	76%	0.76	S	S	*	*			cis	-156.3	134.5	12.7	-168.1	0	0	0	0	109.7
165	S	42.9	Very low	39.1	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	76%	0.761	S	S	*	*			trans	-65.2	150.7	152.8	-44.6	0	0	0	0	110
166	F	38.9	Very low	39.2	Very low	181 Å²	181	136.5 Å²	136.5	79%	0.794	76%	0.758	S	S	*	*			trans	178.4	138.7	144.5	-87.4	-71.1	0	0	0	107.3
167	I	43.3	Very low	39.5	Very low	131 Å²	131	140.4 Å²	140.4	67%	0.672	77%	0.766	S	S	*	*			cis	-176	155.7	-19.4	-124.3	-168.5	0	0	0	108.3
168	T	34.2	Very low	39.7	Very low	128 Å²	128	140.3 Å²	140.3	79%	0.785	77%	0.765	S	S	*	*			trans	72.1	139.3	148.7	-61.9	0	0	0	0	120
169	G	33.3	Very low	39.2	Very low	62 Å²	62	137.2 Å²	137.2	64%	0.639	76%	0.763	S	S	*	*			cis	-162.4	154.1	10.2	0	0	0	0	0	109.1
170	S	39.7	Very low	39.4	Very low	118 Å²	118	134.7 Å²	134.7	83%	0.825	75%	0.746	S	S	*	*				116.9	110.5	74.9	-78.7	0	0	0	0	108.6
171	F	40.6	Very low	39.8	Very low	174 Å²	174	139 Å²	139	76%	0.763	75%	0.746	S	S	*	*			trans	-56.8	157.8	166.4	-118.4	-100.9	0	0	0	111.1	Q173	F171-Q173 HydrophobicContact CD1-CG 4.18Å; F171-Q173 HydrophobicContact CE1-CG 3.94Å
172	P	53	Low	40	Very low	121 Å²	121	142 Å²	142	79%	0.786	75%	0.748	S	S	*	*				-146.1	155.7	90.7	32.6	-13.1	0	0	0	116.6
173	Q	45.8	Very low	40.7	Very low	137 Å²	137	137.7 Å²	137.7	64%	0.64	75%	0.746	S	S	*	*			trans	-59.4	168.1	160.3	-68.3	-87.3	10.1	0	0	111.2	F171	F171-Q173 HydrophobicContact CD1-CG 4.18Å; F171-Q173 HydrophobicContact CE1-CG 3.94Å
174	P	51	Low	40.7	Very low	124 Å²	124	134.7 Å²	134.7	81%	0.805	75%	0.748	S	S	*	*				-140.3	159.8	113.8	33.5	-18.5	0	0	0	116.3
175	I	37.3	Very low	40.8	Very low	149 Å²	149	136.3 Å²	136.3	76%	0.764	75%	0.754	S	S	*	*			trans	-93	154.9	-171.7	-81	165	0	0	0	112.9
176	S	39	Very low	40.7	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	76%	0.757	S	S	*	*			trans	72.7	116.8	153	-85.4	0	0	0	0	121.2
177	R	36.5	Very low	40.7	Very low	247 Å²	247	137.3 Å²	137.3	93%	0.932	75%	0.75	S	S	*	*				-142.5	123.5	113.8	-115.2	-174.2	177	-98.6	-0.2	112.4
178	Q	37.1	Very low	40.5	Very low	149 Å²	149	140.7 Å²	140.7	70%	0.696	76%	0.755	S	S	*	*			trans	-76.1	143.3	172.4	-166.5	179.6	47.1	0	0	109.3
179	S	32.1	Very low	40.9	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	75%	0.754	S	S	*	*			trans	-144.1	120.9	151.2	-156.1	0	0	0	0	109.2
180	H	39.5	Very low	41.2	Very low	133 Å²	133	143.3 Å²	143.3	62%	0.616	76%	0.757	S	S	*	*			trans	-56.6	150.5	171.4	-63.3	-92.3	0	0	0	110.5
181	H	40.8	Very low	41.2	Very low	168 Å²	168	147.4 Å²	147.4	78%	0.778	76%	0.76	S	S	*	*				-174.9	149.7	122.9	-60	-43.2	0	0	0	109.3
182	H	43.4	Very low	41.6	Very low	162 Å²	162	144.6 Å²	144.6	75%	0.75	76%	0.757	S	S	*	*			trans	-49	168.2	-165.7	52.8	-99.1	0	0	0	121.5
183	P	49.8	Very low	40.9	Very low	109 Å²	109	146.1 Å²	146.1	71%	0.708	76%	0.759	S	S	*	*			trans	-93.6	154.4	-172.4	37.4	-32.4	0	0	0	113.8
184	S	36.8	Very low	40.5	Very low	121 Å²	121	150 Å²	150	85%	0.846	77%	0.774	S	S	*	*			trans	-135.7	87.4	159.8	-86.4	0	0	0	0	109.6	R186	S184-R186 PolarHBondContact O-N 3.4Å
185	T	41.4	Very low	40.4	Very low	128 Å²	128	152.4 Å²	152.4	79%	0.785	77%	0.772	S	S	*	*			trans	-81.3	99.9	169	-43.9	0	0	0	0	107.7	S187	T185-S187 VanDerWaalsContact C-N 3.3Å; T185-S187 PolarHBondContact O-N 2.88Å
186	R	41.9	Very low	40.7	Very low	218 Å²	218	151.4 Å²	151.4	82%	0.823	78%	0.775	S	S	*	*			trans	-73.9	88.3	170.4	-166.5	175.7	-170.2	-152	3	108.6	S184 Y188	S184-R186 PolarHBondContact O-N 3.4Å; R186-Y188 PolarHBondContact O-N 3.37Å
187	S	37.3	Very low	40.6	Very low	92 Å²	92	154 Å²	154	64%	0.643	78%	0.776	S	S	*	*			trans	-68	120.8	173.8	-179.2	0	0	0	0	110.2	T185 Q189	T185-S187 VanDerWaalsContact C-N 3.3Å; T185-S187 PolarHBondContact O-N 2.88Å; S187-Q189 PolarHBondContact O-N 3.45Å
188	Y	39	Very low	41.2	Very low	201 Å²	201	147.6 Å²	147.6	79%	0.788	77%	0.768	S	S	*	*			trans	-75.4	112.1	161.4	-78.2	-94.8	0	0	0	107.4	R186 A190	R186-Y188 PolarHBondContact O-N 3.37Å; Y188-A190 PolarHBondContact O-N 3.02Å; Y188-A190 VanDerWaalsContact O-N 3.15Å
189	Q	44.5	Very low	41.1	Very low	161 Å²	161	148 Å²	148	75%	0.752	77%	0.774	S	S	*	*			trans	-67.6	110.1	170.6	-71.5	178.3	-18.1	0	0	108.8	S187	S187-Q189 PolarHBondContact O-N 3.45Å
190	A	38.7	Very low	41.6	Very low	85 Å²	85	146.8 Å²	146.8	70%	0.702	77%	0.772	S	S	*	*			trans	-73.8	120.5	163.1	0	0	0	0	0	108.5	Y188 T192	Y188-A190 PolarHBondContact O-N 3.02Å; Y188-A190 VanDerWaalsContact O-N 3.15Å; A190-T192 PolarHBondContact O-N 3.15Å
191	F	39.2	Very low	42.4	Very low	203 Å²	203	146 Å²	146	89%	0.89	78%	0.778	S	S	*	*			trans	-74.5	100	168	-70.9	-83.5	0	0	0	108.7
192	T	49.6	Very low	43	Very low	116 Å²	116	142.8 Å²	142.8	71%	0.712	77%	0.772	S	S	*	*			trans	-88.7	119.1	167.8	54.2	0	0	0	0	110.1	A190	A190-T192 PolarHBondContact O-N 3.15Å
193	N	37.8	Very low	42.7	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	78%	0.775	S	S	*	*			trans	51.6	98.4	144.8	-65.3	-53.9	0	0	0	118.3
194	F	37.8	Very low	42.1	Very low	219 Å²	219	143.9 Å²	143.9	96%	0.961	78%	0.782	S	S	*	*			trans	-65.9	134.4	148.3	-94	-92	0	0	0	110
195	K	49.7	Very low	42.2	Very low	174 Å²	174	146.9 Å²	146.9	76%	0.757	78%	0.782	S	S	*	*			trans	-87.3	128.8	-174.9	-168.2	157.6	177.3	172.8	0	109.1	Q197	K195-Q197 PolarHBondContact O-N 3.14Å
196	P	42.2	Very low	42.3	Very low	128 Å²	128	147.1 Å²	147.1	83%	0.831	77%	0.774	S	S	*	*			trans	-83.5	108.9	166	30.4	-26.9	0	0	0	108.2
197	Q	38	Very low	42.2	Very low	159 Å²	159	144.8 Å²	144.8	74%	0.743	77%	0.773	S	S	*	*			trans	-85.9	124.8	161.9	-74.2	-162.1	22.9	0	0	108.9	K195	K195-Q197 PolarHBondContact O-N 3.14Å
198	S	48.4	Very low	42.6	Very low	112 Å²	112	147.1 Å²	147.1	78%	0.783	78%	0.775	S	S	*	*			trans	-65	126.5	167.6	159.3	0	0	0	0	110.6
199	L	35.9	Very low	42.8	Very low	157 Å²	157	148 Å²	148	82%	0.822	78%	0.779	S	S	*	*			trans	-158.4	108.6	151.9	-98.5	124.5	0	0	0	109.3
200	A	42.8	Very low	42.5	Very low	84 Å²	84	143.8 Å²	143.8	69%	0.694	78%	0.778	S	S	*	*			trans	-81.6	178.1	145.4	0	0	0	0	0	108.2
201	P	56.3	Low	42.4	Very low	116 Å²	116	143.3 Å²	143.3	75%	0.753	78%	0.781	S	S	*	*			cis	-135	-146.7	-3	44	-23.3	0	0	0	110.1
202	P	53.3	Low	42.3	Very low	101 Å²	101	141.9 Å²	141.9	66%	0.656	78%	0.783	S	S	*	*			cis	-134.6	170.1	-18.2	38.6	-19.6	0	0	0	116.8
203	L	36.9	Very low	41.9	Very low	156 Å²	156	140.9 Å²	140.9	82%	0.817	79%	0.786	S	S	*	*			trans	52.3	122	141.6	-72.4	159.2	0	0	0	122
204	T	37.5	Very low	42.1	Very low	137 Å²	137	137.7 Å²	137.7	84%	0.84	78%	0.781	S	S	*	*				172.1	114.4	109.6	33.3	0	0	0	0	111
205	H	38.2	Very low	42.2	Very low	184 Å²	184	134.5 Å²	134.5	85%	0.852	78%	0.78	S	S	*	*				-165.6	116	129.2	-148.6	-101.6	0	0	0	110.1
206	Q	44.3	Very low	41.5	Very low	134 Å²	134	129.6 Å²	129.6	63%	0.626	78%	0.778	S	S	*	*			trans	-65.4	143.3	168.5	-88.9	-102.5	47.7	0	0	110.7
207	H	38.8	Very low	41.2	Very low	169 Å²	169	126.8 Å²	126.8	78%	0.782	77%	0.773	S	S	*	*			trans	-148.1	115.3	135.5	-125.3	177.8	0	0	0	109.1
208	M	47	Very low	41.6	Very low	141 Å²	141	127.7 Å²	127.7	70%	0.695	78%	0.777	S	S	*	*			trans	-70.9	130.1	170.9	-66.9	-94.5	86.6	0	0	109.1
209	Y	43	Very low	41.6	Very low	220 Å²	220	128.2 Å²	128.2	86%	0.863	78%	0.781	S	S	*	*			trans	-137.4	125.7	147.5	-97.1	-82.4	0	0	0	109.9
210	G	36.8	Very low	41.8	Very low	71 Å²	71	126 Å²	126	73%	0.732	78%	0.778	S	S	*	*			trans	-65.3	163.9	175	0	0	0	0	0	112.4
211	G	37.1	Very low	42.2	Very low	75 Å²	75	128.1 Å²	128.1	77%	0.773	78%	0.782	S	S	*	*			trans	-75	-179.6	-170.7	0	0	0	0	0	115.8
212	N	36.9	Very low	42.1	Very low	174 Å²	174	129 Å²	129	93%	0.93	78%	0.781	S	S	*	*			trans	-161.2	142	136.8	-113.9	10	0	0	0	109.3
213	A	41.4	Very low	41.4	Very low	95 Å²	95	132.7 Å²	132.7	79%	0.785	79%	0.789	S	S	*	*			trans	-82	165.1	174.3	0	0	0	0	0	111.5
214	A	41.6	Very low	42	Very low	86 Å²	86	131.5 Å²	131.5	71%	0.711	79%	0.788	S	S	*	*			trans	111.3	135.1	150.2	0	0	0	0	0	117.4
215	T	40	Very low	42.4	Very low	151 Å²	151	129.6 Å²	129.6	93%	0.926	78%	0.776	S	S	*	*			trans	73	136.1	165.5	73.1	0	0	0	0	114.6
216	G	35.1	Very low	42.8	Very low	71 Å²	71	126.3 Å²	126.3	73%	0.732	77%	0.771	S	S	*	*			cis	159	131.8	11.2	0	0	0	0	0	105.8
217	G	37.1	Very low	43	Very low	70 Å²	70	125.1 Å²	125.1	72%	0.722	78%	0.778	S	S	*	*			trans	28.3	123.1	164.1	0	0	0	0	0	121.3
218	H	46	Very low	43.8	Very low	177 Å²	177	123.7 Å²	123.7	82%	0.819	77%	0.771	S	S	*	*				-175.2	126	110.5	44	-94.3	0	0	0	110.7
219	S	48.6	Very low	43.9	Very low	123 Å²	123	122.5 Å²	122.5	86%	0.86	77%	0.774	S	S	*	*			trans	-72.8	120.2	161	48.7	0	0	0	0	109.2
220	S	40.1	Very low	43.8	Very low	111 Å²	111	119.6 Å²	119.6	78%	0.776	77%	0.768	S	S	*	*			trans	-143.6	115.4	157.8	-163.4	0	0	0	0	109.9
221	V	51.1	Low	44.4	Very low	128 Å²	128	120.8 Å²	120.8	78%	0.776	76%	0.763	S	S	*	*			trans	-73.8	154.3	169.4	-163.4	0	0	0	0	107.9
222	D	52.5	Low	44.7	Very low	135 Å²	135	125.2 Å²	125.2	72%	0.722	77%	0.766	S	S	*	*			trans	77.8	91.2	166.5	-111.6	-76	0	0	0	118.6
223	Q	40.5	Very low	44.7	Very low	179 Å²	179	125.6 Å²	125.6	84%	0.836	76%	0.755	S	S	*	*			trans	-163.8	80	139.1	-113.2	167.5	72.4	0	0	110.6	V225	Q223-V225 VanDerWaalsContact C-N 3.34Å; Q223-V225 PolarHBondContact O-N 2.84Å
224	V	48.1	Very low	44.8	Very low	131 Å²	131	131.3 Å²	131.3	79%	0.794	76%	0.756	S	S	*	*			trans	-80.4	88.7	157.3	60.1	0	0	0	0	107.4	P226	V224-P226 WeakPolarHBondContact O-CD 3.23Å
225	V	45.7	Very low	45	Very low	97 Å²	97	134.4 Å²	134.4	59%	0.588	76%	0.756	S	S	*	*			trans	-80.3	118.5	161.2	163.1	0	0	0	0	106.8	Q223 S227	Q223-V225 VanDerWaalsContact C-N 3.34Å; Q223-V225 PolarHBondContact O-N 2.84Å; V225-S227 PolarHBondContact O-N 3.14Å
226	P	47	Very low	45.5	Very low	115 Å²	115	132.7 Å²	132.7	75%	0.747	75%	0.745	S	S	*	*			trans	-66.6	105.5	164.3	-15.2	30.5	0	0	0	107.5	V224 H228	V224-P226 WeakPolarHBondContact O-CD 3.23Å; P226-H228 PolarHBondContact O-N 3.42Å
227	S	49.4	Very low	46.1	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	75%	0.747	S	S	*	*			trans	-53.8	114.6	173.4	-60.3	0	0	0	0	109.9	V225	V225-S227 PolarHBondContact O-N 3.14Å
228	H	54.3	Low	46.7	Very low	139 Å²	139	140.6 Å²	140.6	64%	0.644	75%	0.753	S	S	*	*			trans	-33.3	124.2	166.6	-172.7	80.3	0	0	0	112.7	P226 Q230	P226-H228 PolarHBondContact O-N 3.42Å; H228-Q230 PolarHBondContact O-N 3.28Å; H228-Q230 VanDerWaalsContact O-N 3.08Å
229	P	49.1	Very low	46.6	Very low	116 Å²	116	135.2 Å²	135.2	75%	0.753	75%	0.746	S	S	*	*			trans	-69.4	108	163.9	27.5	-29.1	0	0	0	107.8
230	Q	42.2	Very low	46.4	Very low	159 Å²	159	139.3 Å²	139.3	74%	0.743	75%	0.751	S	S	*	*			trans	-48.8	132.3	169	-72	-76.8	3	0	0	109.5	H228 M232	H228-Q230 PolarHBondContact O-N 3.28Å; H228-Q230 VanDerWaalsContact O-N 3.08Å; Q230-M232 PolarHBondContact O-N 2.76Å; Q230-M232 VanDerWaalsContact O-N 3.14Å
231	P	48.2	Very low	46.4	Very low	95 Å²	95	137.1 Å²	137.1	62%	0.617	75%	0.746	S	S	*	*			trans	-61.1	120.4	166.6	25.1	-29.1	0	0	0	107.2	Y233	P231-Y233 VanDerWaalsContact C-N 3.3Å; P231-Y233 PolarHBondContact O-N 3.32Å
232	M	45.1	Very low	46.2	Very low	169 Å²	169	140 Å²	140	83%	0.833	75%	0.751	S	S	*	*			trans	-54.7	101.2	166.3	-108.3	-156.5	177.9	0	0	107	Q230 W234	Q230-M232 PolarHBondContact O-N 2.76Å; Q230-M232 VanDerWaalsContact O-N 3.14Å; M232-W234 WeakPolarHBondContact O-CZ3 3.44Å; M232-W234 PolarHBondContact O-N 3.1Å
233	Y	36.7	Very low	45.5	Very low	181 Å²	181	142.3 Å²	142.3	71%	0.71	76%	0.757	S	S	*	*			trans	-71.5	115.9	164.7	177.9	-108.6	0	0	0	105.7	P231 E235	P231-Y233 VanDerWaalsContact C-N 3.3Å; P231-Y233 PolarHBondContact O-N 3.32Å; Y233-E235 HydrophobicContact CD1-CB 3.8Å; Y233-E235 HydrophobicContact CD1-CG 4.2Å; Y233-E235 HydrophobicContact CE1-CB 4Å; Y233-E235 HydrophobicContact CE1-CG 3.98Å; Y233-E235 PolarHBondContact O-N 2.95Å
234	W	43.3	Very low	45.9	Very low	215 Å²	215	142.4 Å²	142.4	81%	0.814	76%	0.762	S	S	*	*			trans	-68.2	78.2	173.4	25.1	90.9	0	0	0	108.5	M232 V236	M232-W234 WeakPolarHBondContact O-CZ3 3.44Å; M232-W234 PolarHBondContact O-N 3.1Å; W234-V236 PolarHBondContact O-N 3.45Å; W234-V236 VanDerWaalsContact O-N 3.14Å
235	E	44.4	Very low	45.7	Very low	151 Å²	151	138.6 Å²	138.6	71%	0.706	75%	0.749	S	S	*	*			trans	-71.9	103.5	175.7	-161.3	164.3	-173.4	0	0	108.7	Y233 T237	Y233-E235 HydrophobicContact CD1-CB 3.8Å; Y233-E235 HydrophobicContact CD1-CG 4.2Å; Y233-E235 HydrophobicContact CE1-CB 4Å; Y233-E235 HydrophobicContact CE1-CG 3.98Å; Y233-E235 PolarHBondContact O-N 2.95Å; E235-T237 PolarHBondContact O-N 3.21Å
236	V	51.6	Low	45.9	Very low	115 Å²	115	140 Å²	140	70%	0.697	76%	0.76	S	S	*	*			trans	-77.2	100.5	169.5	166.6	0	0	0	0	107.6	W234 Q238	W234-V236 PolarHBondContact O-N 3.45Å; W234-V236 VanDerWaalsContact O-N 3.14Å; V236-Q238 PolarHBondContact O-N 3.48Å
237	T	47.9	Very low	46.1	Very low	124 Å²	124	143.1 Å²	143.1	76%	0.761	76%	0.764	S	S	*	*			trans	-67.2	112.4	165	-39.8	0	0	0	0	108.3	E235 G239	E235-T237 PolarHBondContact O-N 3.21Å; T237-G239 PolarHBondContact O-N 3.36Å
238	Q	49.7	Very low	46.6	Very low	183 Å²	183	142.3 Å²	142.3	86%	0.855	76%	0.755	S	S	*	*			trans	-72.4	78.7	170.1	-73	-81.7	-7.6	0	0	108.7	V236	V236-Q238 PolarHBondContact O-N 3.48Å
239	G	43	Very low	47.3	Very low	65 Å²	65	138.6 Å²	138.6	67%	0.67	75%	0.745	S	S	*	*			trans	-98.6	111.6	173.1	0	0	0	0	0	110.1	T237 G241	T237-G239 PolarHBondContact O-N 3.36Å; G239-G241 PolarHBondContact O-N 2.8Å
240	Q	45.4	Very low	47.8	Very low	209 Å²	209	139.8 Å²	139.8	98%	0.977	74%	0.742	S	S	*	*			trans	-52.6	117.5	173.7	-168.1	157	23.2	0	0	111.6
241	G	39.7	Very low	49.3	Very low	65 Å²	65	133.9 Å²	133.9	67%	0.67	72%	0.724	S	S	*	*			trans	175.1	107.2	176.2	0	0	0	0	0	112.8	G239 Q243	G239-G241 PolarHBondContact O-N 2.8Å; G241-Q243 PolarHBondContact O-N 2.78Å
242	H	46.3	Very low	50.4	Low	188 Å²	188	137.5 Å²	137.5	87%	0.87	73%	0.726	S	S	*	*			trans	-59.9	111.1	172.3	-76.3	70.1	0	0	0	111.1
243	Q	38.6	Very low	51.7	Low	183 Å²	183	132.7 Å²	132.7	86%	0.855	70%	0.703	S	S	*	*			trans	-148.2	126	154.5	-69.2	-67.6	19.4	0	0	109.8	G241 G245	G241-Q243 PolarHBondContact O-N 2.78Å; Q243-G245 PolarHBondContact O-N 3.27Å
244	I	47.7	Very low	53.7	Low	182 Å²	182	127.1 Å²	127.1	93%	0.933	69%	0.691	S	S	*	*			trans	-80.5	104.9	-168.9	-48.7	151.2	0	0	0	108.4
245	G	44.1	Very low	55.2	Low	51 Å²	51	121.2 Å²	121.2	53%	0.526	68%	0.675	S	S	.	*			trans	-130.6	146.5	162.6	0	0	0	0	0	108.1	Q243 Q247	Q243-G245 PolarHBondContact O-N 3.27Å; G245-Q247 VanDerWaalsContact C-N 3.29Å; G245-Q247 PolarHBondContact O-N 2.91Å
246	P	50.8	Low	57.3	Low	125 Å²	125	120 Å²	120	81%	0.812	67%	0.673	S	S	*	*			trans	-71.9	89.7	-173.1	30.2	-32.5	0	0	0	109.1	T248	P246-T248 PolarHBondContact O-N 2.9Å
247	Q	51.1	Low	58.5	Low	181 Å²	181	119.9 Å²	119.9	85%	0.846	67%	0.667	S	S	*	*			trans	-73	86.9	171	-154.3	-160	83.9	0	0	106.8	G245 S249	G245-Q247 VanDerWaalsContact C-N 3.29Å; G245-Q247 PolarHBondContact O-N 2.91Å; Q247-S249 VanDerWaalsContact C-N 3.33Å; Q247-S249 PolarHBondContact O-N 2.93Å
248	T	59	Low	60.1	Low	92 Å²	92	121.2 Å²	121.2	56%	0.564	66%	0.659	S	S	*	*			trans	-73	95.4	170.9	47.9	0	0	0	0	107	P246 M250	P246-T248 PolarHBondContact O-N 2.9Å; T248-M250 PolarHBondContact O-N 2.81Å
249	S	70.1	Confident	61.2	Low	61 Å²	61	116.7 Å²	116.7	43%	0.427	64%	0.641	S	S	.	*			trans	-51.6	139.4	170.3	158.5	0	0	0	0	108.8	Q247 G251 Y252 I253	Q247-S249 VanDerWaalsContact C-N 3.33Å; Q247-S249 PolarHBondContact O-N 2.93Å; S249-G251 PolarHBondContact O-N 3.28Å; S249-G251 PolarHBondContact OG-N 3.05Å; S249-Y252 WeakPolarHBondContact O-CB 3.23Å; S249-Y252 PolarHBondContact O-N 2.92Å; S249-I253 PolarHBondContact O-N 2.76Å
250	M	59.8	Low	62.4	Low	142 Å²	142	116 Å²	116	70%	0.7	63%	0.629	S	S	*	*	H	α-helix	trans	-51	-26.7	179.8	-84.1	-69	-69.1	0	0	113	T248 I253 S254	T248-M250 PolarHBondContact O-N 2.81Å; M250-I253 HydrophobicContact SD-CD1 4.33Å; M250-S254 WeakPolarHBondContact O-CB 2.89Å; M250-S254 PolarHBondContact O-N 3.14Å; M250-S254 VanDerWaalsContact O-N 3.1Å; M250-S254 PolarHBondContact O-OG 3.45Å
251	G	72.4	Confident	63.5	Low	35 Å²	35	108.1 Å²	108.1	36%	0.361	60%	0.6	S	S	.	*	H	α-helix	trans	-63.5	-47.3	171.3	0	0	0	0	0	113	S249 I253 S254 D255	S249-G251 PolarHBondContact O-N 3.28Å; S249-G251 PolarHBondContact OG-N 3.05Å; G251-I253 VanDerWaalsContact C-N 3.32Å; G251-I253 PolarHBondContact O-N 3.47Å; G251-S254 WeakPolarHBondContact O-CB 3.44Å; G251-S254 PolarHBondContact O-N 3.1Å; G251-S254 VanDerWaalsContact O-N 3.14Å; G251-D255 PolarHBondContact O-N 2.93Å
252	Y	72.1	Confident	64.9	Low	171 Å²	171	108.3 Å²	108.3	67%	0.671	59%	0.585	S	S	*	*	H	α-helix	trans	-64.3	-35.2	178.4	-85.4	-88.8	0	0	0	112.9	S249 L256	S249-Y252 WeakPolarHBondContact O-CB 3.23Å; S249-Y252 PolarHBondContact O-N 2.92Å; Y252-L256 VanDerWaalsContact O-CB 3.24Å; Y252-L256 WeakPolarHBondContact O-CB 3.26Å; Y252-L256 PolarHBondContact O-N 2.81Å
253	I	72.8	Confident	65.7	Low	67 Å²	67	104.2 Å²	104.2	34%	0.344	57%	0.573	S	S	.	*	H	α-helix	trans	-67.5	-42.3	175.5	-58.2	170.8	0	0	0	109.8	S249 M250 G251 L256 I257	S249-I253 PolarHBondContact O-N 2.76Å; M250-I253 HydrophobicContact SD-CD1 4.33Å; G251-I253 VanDerWaalsContact C-N 3.32Å; G251-I253 PolarHBondContact O-N 3.47Å; I253-L256 PolarHBondContact O-N 2.83Å; I253-I257 HydrophobicContact CG2-CD1 4Å; I253-I257 WeakPolarHBondContact O-CD1 3.4Å; I253-I257 VanDerWaalsContact O-CG1 3.23Å; I253-I257 WeakPolarHBondContact O-CG1 3.47Å; I253-I257 PolarHBondContact O-N 3.33Å; I253-I257 VanDerWaalsContact O-N 3.07Å
254	S	77.2	Confident	66.9	Low	64 Å²	64	100.5 Å²	100.5	45%	0.448	56%	0.562	S	S	.	*	H	α-helix	trans	-64.9	-44.2	177.6	-56.3	0	0	0	0	111.6	M250 G251 I257 Y258	M250-S254 WeakPolarHBondContact O-CB 2.89Å; M250-S254 PolarHBondContact O-N 3.14Å; M250-S254 VanDerWaalsContact O-N 3.1Å; M250-S254 PolarHBondContact O-OG 3.45Å; G251-S254 WeakPolarHBondContact O-CB 3.44Å; G251-S254 PolarHBondContact O-N 3.1Å; G251-S254 VanDerWaalsContact O-N 3.14Å; S254-I257 PolarHBondContact O-N 3.07Å; S254-Y258 WeakPolarHBondContact O-CB 3.26Å; S254-Y258 PolarHBondContact O-N 2.93Å
255	D	76.3	Confident	67.2	Low	91 Å²	91	98.2 Å²	98.2	49%	0.487	55%	0.552	S	S	.	*	H	α-helix	trans	-65	-40.2	176.4	-74.7	-23.8	0	0	0	111.9	G251 I257 Y258 N259	G251-D255 PolarHBondContact O-N 2.93Å; D255-I257 VanDerWaalsContact C-N 3.34Å; D255-I257 PolarHBondContact O-N 3.3Å; D255-Y258 PolarHBondContact O-N 3.14Å; D255-N259 VanDerWaalsContact O-CB 3.26Å; D255-N259 WeakPolarHBondContact O-CB 3.47Å; D255-N259 PolarHBondContact O-N 2.75Å; D255-N259 PolarHBondContact O-ND2 3.46Å
256	L	87.4	Confident	67.7	Low	125 Å²	125	104.3 Å²	104.3	65%	0.654	56%	0.564	S	S	*	*	H	α-helix	trans	-63.7	-40.8	176.7	-175	63.7	0	0	0	111.6	Y252 I253 A260	Y252-L256 VanDerWaalsContact O-CB 3.24Å; Y252-L256 WeakPolarHBondContact O-CB 3.26Å; Y252-L256 PolarHBondContact O-N 2.81Å; I253-L256 PolarHBondContact O-N 2.83Å; L256-A260 VanDerWaalsContact O-CB 3.23Å; L256-A260 WeakPolarHBondContact O-CB 3.44Å; L256-A260 PolarHBondContact O-N 3.21Å
257	I	76.6	Confident	67.7	Low	113 Å²	113	105.6 Å²	105.6	58%	0.579	56%	0.564	S	S	*	*	H	α-helix	trans	-66	-41.9	175.7	-67.9	165.7	0	0	0	110.6	I253 S254 D255 A260 A261	I253-I257 HydrophobicContact CG2-CD1 4Å; I253-I257 WeakPolarHBondContact O-CD1 3.4Å; I253-I257 VanDerWaalsContact O-CG1 3.23Å; I253-I257 WeakPolarHBondContact O-CG1 3.47Å; I253-I257 PolarHBondContact O-N 3.33Å; I253-I257 VanDerWaalsContact O-N 3.07Å; S254-I257 PolarHBondContact O-N 3.07Å; D255-I257 VanDerWaalsContact C-N 3.34Å; D255-I257 PolarHBondContact O-N 3.3Å; I257-A260 PolarHBondContact O-N 2.95Å; I257-A261 WeakPolarHBondContact O-CB 3.48Å; I257-A261 PolarHBondContact O-N 3.45Å
258	Y	81.4	Confident	67.3	Low	153 Å²	153	105.1 Å²	105.1	60%	0.6	56%	0.562	S	S	*	*	H	α-helix	trans	-65.7	-45.6	178.8	-170.1	-104.3	0	0	0	111.7	S254 D255 A261 I262	S254-Y258 WeakPolarHBondContact O-CB 3.26Å; S254-Y258 PolarHBondContact O-N 2.93Å; D255-Y258 PolarHBondContact O-N 3.14Å; Y258-A261 PolarHBondContact O-N 3Å; Y258-I262 HydrophobicContact CD1-CD1 3.59Å; Y258-I262 HydrophobicContact CD1-CG1 4.49Å; Y258-I262 HydrophobicContact CE1-CD1 3.19Å; Y258-I262 HydrophobicContact CE1-CG1 4.28Å; Y258-I262 HydrophobicContact CG-CD1 4.43Å; Y258-I262 WeakPolarHBondContact O-CG1 3.31Å; Y258-I262 PolarHBondContact O-N 2.9Å
259	N	73.4	Confident	66.5	Low	87 Å²	87	114.6 Å²	114.6	47%	0.465	60%	0.596	S	S	.	*	H	α-helix	trans	-64.4	-41.4	176.4	-69.6	-30.9	0	0	0	111.7	D255 A261 I262 V263	D255-N259 VanDerWaalsContact O-CB 3.26Å; D255-N259 WeakPolarHBondContact O-CB 3.47Å; D255-N259 PolarHBondContact O-N 2.75Å; D255-N259 PolarHBondContact O-ND2 3.46Å; N259-A261 VanDerWaalsContact C-N 3.32Å; N259-A261 PolarHBondContact O-N 3.26Å; N259-I262 PolarHBondContact O-N 3.31Å; N259-V263 WeakPolarHBondContact O-CB 3.38Å; N259-V263 VanDerWaalsContact O-CG2 3.26Å; N259-V263 WeakPolarHBondContact O-CG2 3.41Å; N259-V263 PolarHBondContact O-N 3.2Å
260	A	68.8	Low	66.4	Low	51 Å²	51	117.3 Å²	117.3	42%	0.421	60%	0.604	S	S	.	*	H	α-helix	trans	-63.3	-37.9	174.2	0	0	0	0	0	112.2	L256 I257 T264	L256-A260 VanDerWaalsContact O-CB 3.23Å; L256-A260 WeakPolarHBondContact O-CB 3.44Å; L256-A260 PolarHBondContact O-N 3.21Å; I257-A260 PolarHBondContact O-N 2.95Å; A260-T264 WeakPolarHBondContact O-CB 3.24Å; A260-T264 VanDerWaalsContact O-CG2 3.32Å; A260-T264 WeakPolarHBondContact O-CG2 3.44Å; A260-T264 PolarHBondContact O-N 3.37Å; A260-T264 VanDerWaalsContact O-N 3.1Å; A260-T264 PolarHBondContact O-OG1 3Å
261	A	68.4	Low	66.7	Low	44 Å²	44	116 Å²	116	36%	0.364	60%	0.599	S	S	.	*	H	α-helix	trans	-69.1	-34.3	175.6	0	0	0	0	0	112.6	I257 Y258 N259 T264 N265	I257-A261 WeakPolarHBondContact O-CB 3.48Å; I257-A261 PolarHBondContact O-N 3.45Å; Y258-A261 PolarHBondContact O-N 3Å; N259-A261 VanDerWaalsContact C-N 3.32Å; N259-A261 PolarHBondContact O-N 3.26Å; A261-T264 PolarHBondContact O-OG1 2.76Å; A261-N265 PolarHBondContact O-N 2.91Å; A261-N265 PolarHBondContact O-ND2 3.5Å
262	I	68.2	Low	66.4	Low	69 Å²	69	120.5 Å²	120.5	35%	0.354	61%	0.612	S	S	.	*	H	α-helix	trans	-70.2	-48.1	174.9	-74.6	172.9	0	0	0	110.8	Y258 N259 T264 N265	Y258-I262 HydrophobicContact CD1-CD1 3.59Å; Y258-I262 HydrophobicContact CD1-CG1 4.49Å; Y258-I262 HydrophobicContact CE1-CD1 3.19Å; Y258-I262 HydrophobicContact CE1-CG1 4.28Å; Y258-I262 HydrophobicContact CG-CD1 4.43Å; Y258-I262 WeakPolarHBondContact O-CG1 3.31Å; Y258-I262 PolarHBondContact O-N 2.9Å; N259-I262 PolarHBondContact O-N 3.31Å; I262-T264 VanDerWaalsContact C-N 3.26Å; I262-T264 PolarHBondContact O-N 3.29Å; I262-N265 PolarHBondContact O-N 3.49Å; I262-N265 VanDerWaalsContact O-N 3.14Å
263	V	64.6	Low	66.1	Low	102 Å²	102	117.5 Å²	117.5	62%	0.618	61%	0.609	S	S	*	*	H	α-helix	trans	-63.6	-33.5	-178.5	172.8	0	0	0	0	111.6	N259	N259-V263 WeakPolarHBondContact O-CB 3.38Å; N259-V263 VanDerWaalsContact O-CG2 3.26Å; N259-V263 WeakPolarHBondContact O-CG2 3.41Å; N259-V263 PolarHBondContact O-N 3.2Å
264	T	63.2	Low	65.6	Low	104 Å²	104	120.7 Å²	120.7	64%	0.638	63%	0.625	S	S	*	*	H	α-helix	trans	-78.5	-14.2	177.5	50.6	0	0	0	0	114.6	A260 A261 I262	A260-T264 WeakPolarHBondContact O-CB 3.24Å; A260-T264 VanDerWaalsContact O-CG2 3.32Å; A260-T264 WeakPolarHBondContact O-CG2 3.44Å; A260-T264 PolarHBondContact O-N 3.37Å; A260-T264 VanDerWaalsContact O-N 3.1Å; A260-T264 PolarHBondContact O-OG1 3Å; A261-T264 PolarHBondContact O-OG1 2.76Å; I262-T264 VanDerWaalsContact C-N 3.26Å; I262-T264 PolarHBondContact O-N 3.29Å
265	N	54.2	Low	64.9	Low	135 Å²	135	124.5 Å²	124.5	72%	0.722	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-6.6	176.5	-90	-64	0	0	0	114.1	A261 I262	A261-N265 PolarHBondContact O-N 2.91Å; A261-N265 PolarHBondContact O-ND2 3.5Å; I262-N265 PolarHBondContact O-N 3.49Å; I262-N265 VanDerWaalsContact O-N 3.14Å
266	F	53.3	Low	64.1	Low	178 Å²	178	126.9 Å²	126.9	78%	0.781	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	5.6	179.9	-86.7	-79.9	0	0	0	115.2
267	L	51	Low	62.3	Low	152 Å²	152	127 Å²	127	80%	0.796	65%	0.648	S	S	*	*			trans	-119.7	73.9	170.2	-87.4	88.6	0	0	0	110.6
268	E	42.4	Very low	61.1	Low	171 Å²	171	128.2 Å²	128.2	80%	0.799	65%	0.653	S	S	*	*			trans	-159.7	81.7	151.5	-110	-175.7	132.8	0	0	108.6
269	F	44	Very low	59.2	Low	292 Å²	292	125.9 Å²	125.9	100%	1.281	66%	0.658	S	S	*	*			trans	-106.6	0	144.6	-88.5	-74.5	0	0	0	107.1

Retrieved 269 of 269 residues in 196.1 ms (Link to these results)

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