A0A077ZG14_TRITR Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZG14, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 211 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	31.1	Very low	30.4	Very low	243 Å²	243	106.5 Å²	106.5	100%	1.197	57%	0.571	S	S	*	*				0	82.6	0	-75.9	-178.7	176.7	0	0	105.4	S3	M1-S3 PolarHBondContact O-N 2.88Å
2	D	22.9	Very low	31	Very low	169 Å²	169	102.1 Å²	102.1	90%	0.904	56%	0.555	S	S	*	*			trans	-89	93.7	-179.8	-92.7	-33.7	0	0	0	107.7	S4	D2-S4 VanDerWaalsContact C-N 3.31Å; D2-S4 PolarHBondContact O-N 3Å
3	S	23.9	Very low	31.8	Very low	102 Å²	102	96.2 Å²	96.2	71%	0.713	53%	0.528	S	S	*	.			trans	-83.6	85.7	161.2	59.6	0	0	0	0	106.5	M1 L5	M1-S3 PolarHBondContact O-N 2.88Å; S3-L5 PolarHBondContact O-N 2.98Å
4	S	25.9	Very low	32.3	Very low	91 Å²	91	102.4 Å²	102.4	64%	0.636	55%	0.548	S	S	*	.			trans	-55	108.7	161.8	55.8	0	0	0	0	106.3	D2 D6	D2-S4 VanDerWaalsContact C-N 3.31Å; D2-S4 PolarHBondContact O-N 3Å; S4-D6 PolarHBondContact O-N 3.32Å
5	L	26.3	Very low	32.9	Very low	140 Å²	140	101.9 Å²	101.9	73%	0.733	55%	0.545	S	S	*	.			trans	-64.3	89.4	173.3	-82	150.9	0	0	0	106.4	S3 S7	S3-L5 PolarHBondContact O-N 2.98Å; L5-S7 PolarHBondContact O-N 2.86Å
6	D	28.3	Very low	33.6	Very low	120 Å²	120	104.8 Å²	104.8	64%	0.642	55%	0.554	S	S	*	*			trans	-66.8	82.9	165.3	-77.1	-13.5	0	0	0	106.9	S4 R8	S4-D6 PolarHBondContact O-N 3.32Å; D6-R8 PolarHBondContact O-N 3.5Å; D6-R8 VanDerWaalsContact O-N 3.11Å
7	S	28.7	Very low	34.4	Very low	55 Å²	55	107.5 Å²	107.5	39%	0.385	56%	0.563	S	S	.	*			trans	-63.5	110.2	171.8	-71.8	0	0	0	0	108.2	L5 E114	L5-S7 PolarHBondContact O-N 2.86Å; S7-E114 WeakPolarHBondContact CB-OE1 3.39Å; S7-E114 PolarHBondContact OG-OE1 3Å
8	R	33.4	Very low	35.1	Very low	162 Å²	162	102.3 Å²	102.3	61%	0.611	54%	0.54	S	S	*	.			trans	-99.5	134.5	176.7	-63.7	179.9	-174.5	-171.7	-0.3	109.4	D6	D6-R8 PolarHBondContact O-N 3.5Å; D6-R8 VanDerWaalsContact O-N 3.11Å
9	I	35.8	Very low	35.6	Very low	16 Å²	16	99.3 Å²	99.3	8%	0.082	53%	0.527	C	S	.	.			trans	-110.9	117	173	-63.5	171.5	0	0	0	107.3	I11 Y118 I121	I9-I11 HydrophobicContact CG2-CD1 4.42Å; I9-I11 HydrophobicContact CG2-CG1 4.21Å; I9-Y118 HydrophobicContact CD1-CD1 3.99Å; I9-Y118 HydrophobicContact CD1-CE1 3.54Å; I9-Y118 HydrophobicContact CG1-CE1 4.03Å; I9-I121 HydrophobicContact CD1-CD1 3.25Å
10	I	38.3	Very low	36.2	Very low	60 Å²	60	100.7 Å²	100.7	31%	0.308	53%	0.528	S	S	.	.			trans	-96	130.3	176.6	-61.5	165.7	0	0	0	108.1	Q104	I10-Q104 HydrophobicContact CD1-CG 3.96Å; I10-Q104 HydrophobicContact CG1-CG 4.11Å; I10-Q104 HydrophobicContact CG2-CG 3.98Å
11	I	40.1	Very low	36.8	Very low	13 Å²	13	100.1 Å²	100.1	7%	0.067	52%	0.523	C	S	.	.			trans	-119.4	123.1	176.6	-66.8	165.5	0	0	0	107.6	I9 W22 L26	I9-I11 HydrophobicContact CG2-CD1 4.42Å; I9-I11 HydrophobicContact CG2-CG1 4.21Å; I11-W22 HydrophobicContact CG2-CB 4.3Å; I11-W22 HydrophobicContact CG2-CD2 3.98Å; I11-W22 HydrophobicContact CG2-CG 3.84Å; I11-L26 HydrophobicContact CD1-CD1 3.36Å; I11-L26 HydrophobicContact CD1-CD2 3.8Å; I11-L26 HydrophobicContact CD1-CG 4.09Å
12	S	37.9	Very low	37.6	Very low	54 Å²	54	89.2 Å²	89.2	38%	0.378	47%	0.468	S	S	.	.			trans	-105.2	140.7	176.8	178.9	0	0	0	0	110.2
13	A	40.7	Very low	38.8	Very low	26 Å²	26	86.5 Å²	86.5	22%	0.215	45%	0.449	C	S	.	.			trans	-121.6	151.3	177.3	0	0	0	0	0	109.9	D15 C19	A13-D15 PolarHBondContact O-N 3.04Å; A13-C19 HydrophobicContact CB-CB 3.93Å; A13-C19 VanDerWaalsContact CB-N 3.25Å
14	K	39.6	Very low	40	Very low	183 Å²	183	86.7 Å²	86.7	80%	0.796	44%	0.438	S	S	*	.	S	Bend	trans	-67.1	-25.6	-179.4	-71.7	-176.1	177.7	178.2	0	113.4
15	D	41.3	Very low	41.1	Very low	94 Å²	94	84.8 Å²	84.8	50%	0.503	42%	0.419	S	S	.	.	S	Bend	trans	-153.8	176.2	-179.5	54.9	45.3	0	0	0	110.4	A13 E17 G18 C19	A13-D15 PolarHBondContact O-N 3.04Å; D15-E17 VanDerWaalsContact C-N 3.25Å; D15-E17 PolarHBondContact O-N 3.33Å; D15-E17 PolarHBondContact OD1-N 2.98Å; D15-E17 VanDerWaalsContact OD1-N 3.11Å; D15-G18 PolarHBondContact O-N 2.97Å; D15-G18 PolarHBondContact OD1-N 3.49Å; D15-C19 PolarHBondContact O-N 3.12Å; D15-C19 VanDerWaalsContact O-N 3.15Å
16	Q	44	Very low	42.1	Very low	149 Å²	149	78.5 Å²	78.5	70%	0.696	39%	0.387	S	S	*	.	H	α-helix	trans	-66.3	-27	-179	-166.1	179.8	9.3	0	0	112.9	K20	Q16-K20 WeakPolarHBondContact O-CG 3.18Å; Q16-K20 PolarHBondContact O-N 3.39Å; Q16-K20 VanDerWaalsContact O-N 3.17Å
17	E	47	Very low	43.1	Very low	151 Å²	151	76 Å²	76	71%	0.706	37%	0.372	S	S	*	.	H	α-helix	trans	-72.4	-46.9	179.1	-171.8	166.4	-171.7	0	0	110.4	D15 C19 K20 E21	D15-E17 VanDerWaalsContact C-N 3.25Å; D15-E17 PolarHBondContact O-N 3.33Å; D15-E17 PolarHBondContact OD1-N 2.98Å; D15-E17 VanDerWaalsContact OD1-N 3.11Å; E17-C19 VanDerWaalsContact C-N 3.27Å; E17-C19 PolarHBondContact O-N 3.29Å; E17-K20 WeakPolarHBondContact O-CB 3.31Å; E17-K20 PolarHBondContact O-N 3.08Å; E17-K20 VanDerWaalsContact O-N 3.09Å; E17-E21 PolarHBondContact O-N 2.87Å
18	G	46.1	Very low	44	Very low	14 Å²	14	79.2 Å²	79.2	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-60.5	-35.4	172.7	0	0	0	0	0	112.5	D15 E21 W22	D15-G18 PolarHBondContact O-N 2.97Å; D15-G18 PolarHBondContact OD1-N 3.49Å; G18-E21 PolarHBondContact O-N 2.85Å; G18-W22 WeakPolarHBondContact O-CB 3.22Å; G18-W22 PolarHBondContact O-N 2.87Å
19	C	45.3	Very low	44.5	Very low	45 Å²	45	72.3 Å²	72.3	30%	0.304	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-39.7	174.6	-172.3	0	0	0	0	112.3	A13 D15 E17 K23	A13-C19 HydrophobicContact CB-CB 3.93Å; A13-C19 VanDerWaalsContact CB-N 3.25Å; D15-C19 PolarHBondContact O-N 3.12Å; D15-C19 VanDerWaalsContact O-N 3.15Å; E17-C19 VanDerWaalsContact C-N 3.27Å; E17-C19 PolarHBondContact O-N 3.29Å; C19-K23 WeakPolarHBondContact O-CB 3.35Å; C19-K23 PolarHBondContact O-N 3.15Å
20	K	48.3	Very low	44.8	Very low	126 Å²	126	73.5 Å²	73.5	55%	0.548	36%	0.362	S	S	.	.	H	α-helix	trans	-66.9	-45	176.3	-73.3	174.2	-177.7	177.4	0	111.1	Q16 E17 W22 K23 E24	Q16-K20 WeakPolarHBondContact O-CG 3.18Å; Q16-K20 PolarHBondContact O-N 3.39Å; Q16-K20 VanDerWaalsContact O-N 3.17Å; E17-K20 WeakPolarHBondContact O-CB 3.31Å; E17-K20 PolarHBondContact O-N 3.08Å; E17-K20 VanDerWaalsContact O-N 3.09Å; K20-W22 VanDerWaalsContact C-N 3.33Å; K20-W22 PolarHBondContact O-N 3.36Å; K20-K23 WeakPolarHBondContact O-CB 3.33Å; K20-K23 PolarHBondContact O-N 2.94Å; K20-E24 PolarHBondContact O-N 3.41Å
21	E	48.1	Very low	45.1	Very low	89 Å²	89	75.5 Å²	75.5	42%	0.416	37%	0.37	S	S	.	.	H	α-helix	trans	-58.1	-46.8	175.6	-173.6	178.2	-172.8	0	0	110.9	E17 G18 K23 E24 Q25	E17-E21 PolarHBondContact O-N 2.87Å; G18-E21 PolarHBondContact O-N 2.85Å; E21-K23 PolarHBondContact O-N 3.38Å; E21-E24 PolarHBondContact O-N 3.36Å; E21-Q25 HydrophobicContact CG-CG 4.48Å; E21-Q25 VanDerWaalsContact O-CG 3.23Å; E21-Q25 WeakPolarHBondContact O-CG 3.45Å; E21-Q25 PolarHBondContact O-N 2.8Å
22	W	47.3	Very low	45.2	Very low	14 Å²	14	83.1 Å²	83.1	5%	0.053	40%	0.398	C	S	.	.	H	α-helix	trans	-58.5	-45.7	176.3	-86.2	124.5	0	0	0	113.3	I11 G18 K20 E24 Q25 L26 L125 T129 S133	I11-W22 HydrophobicContact CG2-CB 4.3Å; I11-W22 HydrophobicContact CG2-CD2 3.98Å; I11-W22 HydrophobicContact CG2-CG 3.84Å; G18-W22 WeakPolarHBondContact O-CB 3.22Å; G18-W22 PolarHBondContact O-N 2.87Å; K20-W22 VanDerWaalsContact C-N 3.33Å; K20-W22 PolarHBondContact O-N 3.36Å; W22-E24 VanDerWaalsContact C-N 3.35Å; W22-E24 PolarHBondContact O-N 3.21Å; W22-Q25 PolarHBondContact O-N 2.91Å; W22-L26 WeakPolarHBondContact O-CB 3.36Å; W22-L26 VanDerWaalsContact O-CG 3.26Å; W22-L26 WeakPolarHBondContact O-CG 3.28Å; W22-L26 PolarHBondContact O-N 2.77Å; W22-L125 HydrophobicContact CE3-CD2 4.05Å; W22-L125 HydrophobicContact CH2-CB 4.48Å; W22-L125 HydrophobicContact CH2-CD2 3.09Å; W22-L125 HydrophobicContact CH2-CG 4.31Å; W22-L125 HydrophobicContact CZ2-CD2 4.06Å; W22-L125 HydrophobicContact CZ3-CD2 3.13Å; W22-L125 HydrophobicContact CZ3-CG 4.28Å; W22-T129 HydrophobicContact CH2-CG2 4.17Å; W22-T129 HydrophobicContact CZ3-CG2 4.44Å; W22-S133 WeakPolarHBondContact CZ2-OG 3.48Å; W22-S133 PolarHBondContact NE1-OG 2.61Å
23	K	49.2	Very low	45.3	Very low	113 Å²	113	81.5 Å²	81.5	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-57.9	-48.4	177.3	-178.6	-179.8	178.5	179.1	0	110.9	C19 K20 E21 Q25 L26 I27	C19-K23 WeakPolarHBondContact O-CB 3.35Å; C19-K23 PolarHBondContact O-N 3.15Å; K20-K23 WeakPolarHBondContact O-CB 3.33Å; K20-K23 PolarHBondContact O-N 2.94Å; E21-K23 PolarHBondContact O-N 3.38Å; K23-Q25 PolarHBondContact O-N 3.35Å; K23-L26 PolarHBondContact O-N 3.22Å; K23-I27 HydrophobicContact CG-CD1 3.86Å; K23-I27 WeakPolarHBondContact O-CB 3.48Å; K23-I27 WeakPolarHBondContact O-CD1 3.21Å; K23-I27 WeakPolarHBondContact O-CG1 3.34Å; K23-I27 PolarHBondContact O-N 2.92Å
24	E	49.6	Very low	45.1	Very low	105 Å²	105	83 Å²	83	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-40.7	179.2	-71.9	-174.8	-167.8	0	0	112.4	K20 E21 W22 I27 R28	K20-E24 PolarHBondContact O-N 3.41Å; E21-E24 PolarHBondContact O-N 3.36Å; W22-E24 VanDerWaalsContact C-N 3.35Å; W22-E24 PolarHBondContact O-N 3.21Å; E24-I27 PolarHBondContact O-N 3.31Å; E24-R28 WeakPolarHBondContact O-CB 3.39Å; E24-R28 VanDerWaalsContact O-CG 3.24Å; E24-R28 WeakPolarHBondContact O-CG 3.25Å; E24-R28 PolarHBondContact O-N 2.97Å; E24-R28 IonicContact OE2-NH2 3.43Å
25	Q	47.6	Very low	44.9	Very low	51 Å²	51	80.1 Å²	80.1	24%	0.238	38%	0.379	C	S	.	.	H	α-helix	trans	-69.1	-40.1	179.9	-66.3	-68.7	-7.1	0	0	112.3	E21 W22 K23 R28 A29 S128	E21-Q25 HydrophobicContact CG-CG 4.48Å; E21-Q25 VanDerWaalsContact O-CG 3.23Å; E21-Q25 WeakPolarHBondContact O-CG 3.45Å; E21-Q25 PolarHBondContact O-N 2.8Å; W22-Q25 PolarHBondContact O-N 2.91Å; K23-Q25 PolarHBondContact O-N 3.35Å; Q25-R28 PolarHBondContact O-N 3.09Å; Q25-A29 VanDerWaalsContact O-CB 3.28Å; Q25-A29 WeakPolarHBondContact O-CB 3.42Å; Q25-A29 PolarHBondContact O-N 2.84Å; Q25-S128 VanDerWaalsContact CG-CB 3.47Å
26	L	48.7	Very low	44.4	Very low	9 Å²	9	77.1 Å²	77.1	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-44.6	173.6	-69.7	165.7	0	0	0	111.3	I11 W22 K23 R28 A29 T30 Y105 F109 I121	I11-L26 HydrophobicContact CD1-CD1 3.36Å; I11-L26 HydrophobicContact CD1-CD2 3.8Å; I11-L26 HydrophobicContact CD1-CG 4.09Å; W22-L26 WeakPolarHBondContact O-CB 3.36Å; W22-L26 VanDerWaalsContact O-CG 3.26Å; W22-L26 WeakPolarHBondContact O-CG 3.28Å; W22-L26 PolarHBondContact O-N 2.77Å; K23-L26 PolarHBondContact O-N 3.22Å; L26-R28 PolarHBondContact O-N 2.77Å; L26-A29 PolarHBondContact O-N 3.32Å; L26-T30 WeakPolarHBondContact O-CB 3.39Å; L26-T30 PolarHBondContact O-N 3.16Å; L26-T30 PolarHBondContact O-OG1 3.39Å; L26-Y105 HydrophobicContact CD1-CD1 4.09Å; L26-Y105 HydrophobicContact CD1-CE1 3.88Å; L26-F109 HydrophobicContact CD2-CZ 4.31Å; L26-I121 HydrophobicContact CD2-CG1 4.48Å
27	I	47.4	Very low	43.6	Very low	67 Å²	67	71.6 Å²	71.6	34%	0.344	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-48.3	175.8	-70.4	166.7	0	0	0	110.2	K23 E24 A29 T30 Q31	K23-I27 HydrophobicContact CG-CD1 3.86Å; K23-I27 WeakPolarHBondContact O-CB 3.48Å; K23-I27 WeakPolarHBondContact O-CD1 3.21Å; K23-I27 WeakPolarHBondContact O-CG1 3.34Å; K23-I27 PolarHBondContact O-N 2.92Å; E24-I27 PolarHBondContact O-N 3.31Å; I27-A29 PolarHBondContact O-N 2.83Å; I27-T30 PolarHBondContact O-N 3.47Å; I27-Q31 HydrophobicContact CG2-CG 4.4Å; I27-Q31 WeakPolarHBondContact O-CB 3.33Å; I27-Q31 VanDerWaalsContact O-CG 3.25Å; I27-Q31 WeakPolarHBondContact O-CG 3.12Å; I27-Q31 PolarHBondContact O-N 3.18Å
28	R	48.6	Very low	42.6	Very low	123 Å²	123	66.1 Å²	66.1	46%	0.464	33%	0.329	S	S	.	.	H	α-helix	trans	-63.4	-40	178.4	-72.8	175.3	-169.7	-160.2	8.3	112.4	E24 Q25 L26 Q31 R32	E24-R28 WeakPolarHBondContact O-CB 3.39Å; E24-R28 VanDerWaalsContact O-CG 3.24Å; E24-R28 WeakPolarHBondContact O-CG 3.25Å; E24-R28 PolarHBondContact O-N 2.97Å; E24-R28 IonicContact OE2-NH2 3.43Å; Q25-R28 PolarHBondContact O-N 3.09Å; L26-R28 PolarHBondContact O-N 2.77Å; R28-Q31 PolarHBondContact O-N 3.35Å; R28-R32 WeakPolarHBondContact O-CB 3.18Å; R28-R32 WeakPolarHBondContact O-CG 2.98Å; R28-R32 PolarHBondContact O-N 3.41Å
29	A	43.5	Very low	41.6	Very low	17 Å²	17	69 Å²	69	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-52.1	175.2	0	0	0	0	0	109.8	Q25 L26 I27 Q31 R32 V33	Q25-A29 VanDerWaalsContact O-CB 3.28Å; Q25-A29 WeakPolarHBondContact O-CB 3.42Å; Q25-A29 PolarHBondContact O-N 2.84Å; L26-A29 PolarHBondContact O-N 3.32Å; I27-A29 PolarHBondContact O-N 2.83Å; A29-Q31 VanDerWaalsContact C-N 3.3Å; A29-Q31 PolarHBondContact O-N 3.33Å; A29-R32 PolarHBondContact O-N 2.9Å; A29-V33 WeakPolarHBondContact O-CB 3.45Å; A29-V33 WeakPolarHBondContact O-CG2 3.43Å; A29-V33 PolarHBondContact O-N 3.15Å
30	T	43.4	Very low	40.8	Very low	40 Å²	40	73.6 Å²	73.6	25%	0.245	35%	0.354	C	S	.	.	H	α-helix	trans	-56.8	-41.2	176.5	-54.5	0	0	0	0	112.5	L26 I27 V33 N34 F109	L26-T30 WeakPolarHBondContact O-CB 3.39Å; L26-T30 PolarHBondContact O-N 3.16Å; L26-T30 PolarHBondContact O-OG1 3.39Å; I27-T30 PolarHBondContact O-N 3.47Å; T30-V33 WeakPolarHBondContact O-CB 3.46Å; T30-V33 PolarHBondContact O-N 3.31Å; T30-N34 WeakPolarHBondContact O-CB 3.48Å; T30-N34 VanDerWaalsContact O-CG 3.23Å; T30-N34 PolarHBondContact O-N 2.86Å; T30-N34 PolarHBondContact O-ND2 2.85Å; T30-F109 HydrophobicContact CG2-CE1 4.34Å; T30-F109 WeakPolarHBondContact OG1-CE1 3.23Å
31	Q	44.1	Very low	39.7	Very low	103 Å²	103	75.5 Å²	75.5	48%	0.481	36%	0.359	S	S	.	.	H	α-helix	trans	-61.7	-50.7	175.4	-76	170.7	-19.2	0	0	111.5	I27 R28 A29 V33 N34 E35	I27-Q31 HydrophobicContact CG2-CG 4.4Å; I27-Q31 WeakPolarHBondContact O-CB 3.33Å; I27-Q31 VanDerWaalsContact O-CG 3.25Å; I27-Q31 WeakPolarHBondContact O-CG 3.12Å; I27-Q31 PolarHBondContact O-N 3.18Å; R28-Q31 PolarHBondContact O-N 3.35Å; A29-Q31 VanDerWaalsContact C-N 3.3Å; A29-Q31 PolarHBondContact O-N 3.33Å; Q31-V33 VanDerWaalsContact C-N 3.26Å; Q31-V33 PolarHBondContact O-N 3.41Å; Q31-N34 PolarHBondContact O-N 2.79Å; Q31-N34 VanDerWaalsContact O-N 3.1Å; Q31-E35 WeakPolarHBondContact O-CG 3.44Å; Q31-E35 PolarHBondContact O-N 3.28Å
32	R	41.9	Very low	38.6	Very low	172 Å²	172	75.4 Å²	75.4	65%	0.649	37%	0.365	S	S	*	.	H	α-helix	trans	-62.2	-35.3	177.2	-73.1	176.1	176.4	-177.9	-0.5	112.9	R28 A29 G36	R28-R32 WeakPolarHBondContact O-CB 3.18Å; R28-R32 WeakPolarHBondContact O-CG 2.98Å; R28-R32 PolarHBondContact O-N 3.41Å; A29-R32 PolarHBondContact O-N 2.9Å; R32-G36 PolarHBondContact O-N 3.03Å
33	V	39.4	Very low	37.6	Very low	21 Å²	21	80 Å²	80	13%	0.127	39%	0.387	C	S	.	.	H	α-helix	trans	-64.5	-45.5	173.6	160.9	0	0	0	0	110.9	A29 T30 Q31 G36 A37 Q120	A29-V33 WeakPolarHBondContact O-CB 3.45Å; A29-V33 WeakPolarHBondContact O-CG2 3.43Å; A29-V33 PolarHBondContact O-N 3.15Å; T30-V33 WeakPolarHBondContact O-CB 3.46Å; T30-V33 PolarHBondContact O-N 3.31Å; Q31-V33 VanDerWaalsContact C-N 3.26Å; Q31-V33 PolarHBondContact O-N 3.41Å; V33-G36 CarbonylContact O-C 3.52Å; V33-G36 PolarHBondContact O-N 3.34Å; V33-A37 WeakPolarHBondContact O-CA 3.21Å; V33-A37 WeakPolarHBondContact O-CB 3.16Å; V33-A37 PolarHBondContact O-N 3.41Å; V33-Q120 VanDerWaalsContact CG1-NE2 3.34Å; V33-Q120 HydrophobicContact CG2-CB 3.44Å; V33-Q120 VanDerWaalsContact CG2-CB 3.44Å; V33-Q120 HydrophobicContact CG2-CG 3.34Å; V33-Q120 VanDerWaalsContact CG2-NE2 3.28Å
34	N	36.5	Very low	36.5	Very low	56 Å²	56	80.9 Å²	80.9	30%	0.299	39%	0.392	S	S	.	.	H	α-helix	trans	-72.3	-33.8	-179.3	-73.6	-18.2	0	0	0	111.4	T30 Q31 S38	T30-N34 WeakPolarHBondContact O-CB 3.48Å; T30-N34 VanDerWaalsContact O-CG 3.23Å; T30-N34 PolarHBondContact O-N 2.86Å; T30-N34 PolarHBondContact O-ND2 2.85Å; Q31-N34 PolarHBondContact O-N 2.79Å; Q31-N34 VanDerWaalsContact O-N 3.1Å; N34-S38 WeakPolarHBondContact O-CA 3.19Å; N34-S38 WeakPolarHBondContact O-CB 3.45Å; N34-S38 PolarHBondContact O-N 3.02Å
35	E	34.8	Very low	35.4	Very low	123 Å²	123	77.9 Å²	77.9	58%	0.575	38%	0.383	S	S	*	.	H	α-helix	trans	-61.8	-47.3	167.8	-70.9	167.2	-173.7	0	0	110.7	Q31 V39	Q31-E35 WeakPolarHBondContact O-CG 3.44Å; Q31-E35 PolarHBondContact O-N 3.28Å; E35-V39 VanDerWaalsContact O-CB 3.31Å; E35-V39 WeakPolarHBondContact O-CB 3.27Å; E35-V39 WeakPolarHBondContact O-CG2 2.95Å; E35-V39 PolarHBondContact O-N 3.44Å
36	G	31.1	Very low	34.3	Very low	31 Å²	31	78.2 Å²	78.2	32%	0.32	39%	0.394	S	S	.	.	H	α-helix	trans	-75.8	-26.9	179.8	0	0	0	0	0	115.2	R32 V33 R40	R32-G36 PolarHBondContact O-N 3.03Å; V33-G36 CarbonylContact O-C 3.52Å; V33-G36 PolarHBondContact O-N 3.34Å; G36-R40 VanDerWaalsContact O-CB 3.25Å; G36-R40 WeakPolarHBondContact O-CB 3.29Å; G36-R40 VanDerWaalsContact O-CG 3.31Å; G36-R40 WeakPolarHBondContact O-CG 3.2Å; G36-R40 PolarHBondContact O-N 2.78Å
37	A	27.5	Very low	33.2	Very low	34 Å²	34	85.7 Å²	85.7	28%	0.281	43%	0.427	S	S	.	.	H	α-helix	trans	-84.9	-38.1	176.9	0	0	0	0	0	110.5	V33 V39 R40 Y41	V33-A37 WeakPolarHBondContact O-CA 3.21Å; V33-A37 WeakPolarHBondContact O-CB 3.16Å; V33-A37 PolarHBondContact O-N 3.41Å; A37-V39 VanDerWaalsContact C-N 3.34Å; A37-R40 PolarHBondContact O-N 3.47Å; A37-Y41 WeakPolarHBondContact O-CA 3.22Å; A37-Y41 WeakPolarHBondContact O-CB 3.48Å; A37-Y41 PolarHBondContact O-N 2.99Å
38	S	25.4	Very low	32.2	Very low	36 Å²	36	87.7 Å²	87.7	25%	0.252	44%	0.442	S	S	.	.	H	α-helix	trans	-55.9	-50.8	164.9	170.5	0	0	0	0	109.8	N34 R40 Y41 V42	N34-S38 WeakPolarHBondContact O-CA 3.19Å; N34-S38 WeakPolarHBondContact O-CB 3.45Å; N34-S38 PolarHBondContact O-N 3.02Å; S38-R40 PolarHBondContact O-N 3.48Å; S38-Y41 PolarHBondContact O-N 3.34Å; S38-V42 WeakPolarHBondContact O-CB 3.42Å; S38-V42 WeakPolarHBondContact O-CG2 3.33Å; S38-V42 PolarHBondContact O-N 2.82Å
39	V	25.8	Very low	31.1	Very low	73 Å²	73	90.5 Å²	90.5	44%	0.442	46%	0.458	S	S	.	.	H	α-helix	trans	-65.1	-42.2	179.1	171.4	0	0	0	0	112.2	E35 A37 Q43	E35-V39 VanDerWaalsContact O-CB 3.31Å; E35-V39 WeakPolarHBondContact O-CB 3.27Å; E35-V39 WeakPolarHBondContact O-CG2 2.95Å; E35-V39 PolarHBondContact O-N 3.44Å; A37-V39 VanDerWaalsContact C-N 3.34Å; V39-Q43 HydrophobicContact CG1-CG 4.38Å; V39-Q43 WeakPolarHBondContact O-CB 3.24Å; V39-Q43 WeakPolarHBondContact O-CG 3.42Å; V39-Q43 PolarHBondContact O-N 2.92Å
40	R	27.9	Very low	30.2	Very low	142 Å²	142	93.4 Å²	93.4	54%	0.536	48%	0.477	S	S	.	.	H	α-helix	trans	-73.8	-32.8	178.1	-79	176.1	176.9	177.5	0.4	113.4	G36 A37 S38 Q43 Q44 R116	G36-R40 VanDerWaalsContact O-CB 3.25Å; G36-R40 WeakPolarHBondContact O-CB 3.29Å; G36-R40 VanDerWaalsContact O-CG 3.31Å; G36-R40 WeakPolarHBondContact O-CG 3.2Å; G36-R40 PolarHBondContact O-N 2.78Å; A37-R40 PolarHBondContact O-N 3.47Å; S38-R40 PolarHBondContact O-N 3.48Å; R40-Q43 PolarHBondContact O-N 2.85Å; R40-Q44 VanDerWaalsContact O-CB 3.22Å; R40-Q44 WeakPolarHBondContact O-CB 3.32Å; R40-Q44 WeakPolarHBondContact O-CG 3.48Å; R40-Q44 PolarHBondContact O-N 3.31Å; R40-R116 VanDerWaalsContact CD-NH2 3.25Å
41	Y	26.3	Very low	29.4	Very low	166 Å²	166	96.4 Å²	96.4	65%	0.651	50%	0.499	S	S	*	.	H	α-helix	trans	-71.1	-43.6	174.6	-169.5	-96.5	0	0	0	110.1	A37 S38 Q43 Q44 C45	A37-Y41 WeakPolarHBondContact O-CA 3.22Å; A37-Y41 WeakPolarHBondContact O-CB 3.48Å; A37-Y41 PolarHBondContact O-N 2.99Å; S38-Y41 PolarHBondContact O-N 3.34Å; Y41-Q43 PolarHBondContact O-N 3.1Å; Y41-Q44 PolarHBondContact O-N 2.91Å; Y41-C45 WeakPolarHBondContact O-CB 3.25Å; Y41-C45 PolarHBondContact O-N 3.4Å; Y41-C45 PolarHBondContact O-SG 3.47Å; Y41-C45 VanDerWaalsContact O-SG 3.33Å
42	V	25.5	Very low	28.6	Very low	87 Å²	87	99.6 Å²	99.6	53%	0.527	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-37.4	171.8	172.6	0	0	0	0	111.3	S38 A46	S38-V42 WeakPolarHBondContact O-CB 3.42Å; S38-V42 WeakPolarHBondContact O-CG2 3.33Å; S38-V42 PolarHBondContact O-N 2.82Å; V42-A46 WeakPolarHBondContact O-CA 3.43Å; V42-A46 WeakPolarHBondContact O-CB 2.93Å; V42-A46 PolarHBondContact O-N 3.3Å
43	Q	25.4	Very low	27.8	Very low	111 Å²	111	97.1 Å²	97.1	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-74.3	-35.1	175.3	-76.6	173	-7.9	0	0	113.6	V39 R40 Y41 K47	V39-Q43 HydrophobicContact CG1-CG 4.38Å; V39-Q43 WeakPolarHBondContact O-CB 3.24Å; V39-Q43 WeakPolarHBondContact O-CG 3.42Å; V39-Q43 PolarHBondContact O-N 2.92Å; R40-Q43 PolarHBondContact O-N 2.85Å; Y41-Q43 PolarHBondContact O-N 3.1Å; Q43-K47 VanDerWaalsContact O-CB 3.3Å; Q43-K47 WeakPolarHBondContact O-CB 3.31Å; Q43-K47 WeakPolarHBondContact O-CG 3.39Å; Q43-K47 PolarHBondContact O-N 2.85Å
44	Q	26.6	Very low	27.3	Very low	131 Å²	131	102 Å²	102	61%	0.612	55%	0.553	S	S	*	*	H	α-helix	trans	-73	-41.7	174.7	-81.7	179.6	-40.5	0	0	110.9	R40 Y41 K47 V48	R40-Q44 VanDerWaalsContact O-CB 3.22Å; R40-Q44 WeakPolarHBondContact O-CB 3.32Å; R40-Q44 WeakPolarHBondContact O-CG 3.48Å; R40-Q44 PolarHBondContact O-N 3.31Å; Y41-Q44 PolarHBondContact O-N 2.91Å; Q44-K47 PolarHBondContact O-N 3.17Å; Q44-V48 WeakPolarHBondContact O-CB 3.25Å; Q44-V48 WeakPolarHBondContact O-CG2 3.1Å; Q44-V48 PolarHBondContact O-N 3.33Å
45	C	26.3	Very low	26.9	Very low	43 Å²	43	109 Å²	109	29%	0.291	58%	0.58	S	S	.	*	H	α-helix	trans	-67.6	-41.6	171.9	-69	0	0	0	0	111.1	Y41 K47 V48 F49	Y41-C45 WeakPolarHBondContact O-CB 3.25Å; Y41-C45 PolarHBondContact O-N 3.4Å; Y41-C45 PolarHBondContact O-SG 3.47Å; Y41-C45 VanDerWaalsContact O-SG 3.33Å; C45-K47 VanDerWaalsContact C-N 3.27Å; C45-K47 PolarHBondContact O-N 3.38Å; C45-V48 CarbonylContact O-C 3.59Å; C45-V48 PolarHBondContact O-N 2.65Å; C45-V48 VanDerWaalsContact O-N 3.16Å; C45-F49 HydrophobicContact CB-CD2 4.46Å; C45-F49 WeakPolarHBondContact O-CB 3.31Å; C45-F49 WeakPolarHBondContact O-CD2 3.42Å; C45-F49 PolarHBondContact O-N 2.94Å
46	A	23.4	Very low	26.6	Very low	58 Å²	58	110.9 Å²	110.9	48%	0.479	59%	0.593	S	S	.	*	H	α-helix	trans	-62.7	-31.6	174	0	0	0	0	0	113	V42 S50	V42-A46 WeakPolarHBondContact O-CA 3.43Å; V42-A46 WeakPolarHBondContact O-CB 2.93Å; V42-A46 PolarHBondContact O-N 3.3Å; A46-S50 WeakPolarHBondContact O-CB 3.01Å; A46-S50 PolarHBondContact O-N 2.99Å; A46-S50 PolarHBondContact O-OG 2.78Å
47	K	25.7	Very low	26.4	Very low	166 Å²	166	116.3 Å²	116.3	72%	0.722	62%	0.615	S	S	*	*	H	α-helix	trans	-79	-28.4	173.1	-80.5	-179.8	174.8	-177.7	0	113.9	Q43 Q44 C45 S50	Q43-K47 VanDerWaalsContact O-CB 3.3Å; Q43-K47 WeakPolarHBondContact O-CB 3.31Å; Q43-K47 WeakPolarHBondContact O-CG 3.39Å; Q43-K47 PolarHBondContact O-N 2.85Å; Q44-K47 PolarHBondContact O-N 3.17Å; C45-K47 VanDerWaalsContact C-N 3.27Å; C45-K47 PolarHBondContact O-N 3.38Å; K47-S50 PolarHBondContact O-OG 3.47Å
48	V	27	Very low	26.4	Very low	109 Å²	109	120.4 Å²	120.4	66%	0.661	64%	0.637	S	S	*	*	H	α-helix	trans	-79.3	-21.3	174	171.5	0	0	0	0	111.4	Q44 C45	Q44-V48 WeakPolarHBondContact O-CB 3.25Å; Q44-V48 WeakPolarHBondContact O-CG2 3.1Å; Q44-V48 PolarHBondContact O-N 3.33Å; C45-V48 CarbonylContact O-C 3.59Å; C45-V48 PolarHBondContact O-N 2.65Å; C45-V48 VanDerWaalsContact O-N 3.16Å
49	F	25.7	Very low	26.7	Very low	182 Å²	182	122.4 Å²	122.4	80%	0.798	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	9.9	170.6	-75.3	-73.3	0	0	0	113.9	C45	C45-F49 HydrophobicContact CB-CD2 4.46Å; C45-F49 WeakPolarHBondContact O-CB 3.31Å; C45-F49 WeakPolarHBondContact O-CD2 3.42Å; C45-F49 PolarHBondContact O-N 2.94Å
50	S	25.5	Very low	26.8	Very low	78 Å²	78	127 Å²	127	55%	0.545	67%	0.673	S	S	.	*			trans	-117.7	22	-178.8	80.3	0	0	0	0	115.3	A46 K47 E52	A46-S50 WeakPolarHBondContact O-CB 3.01Å; A46-S50 PolarHBondContact O-N 2.99Å; A46-S50 PolarHBondContact O-OG 2.78Å; K47-S50 PolarHBondContact O-OG 3.47Å; S50-E52 PolarHBondContact O-N 3.43Å
51	S	26.9	Very low	26.8	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	69%	0.686	S	S	*	*	S	Bend	trans	-82.4	86.4	165.7	56.3	0	0	0	0	109.4
52	E	25.8	Very low	26.8	Very low	171 Å²	171	122.7 Å²	122.7	80%	0.799	69%	0.689	S	S	*	*	S	Bend	trans	60	126.1	179.6	-67	-173.8	159.9	0	0	116	S50 P54	S50-E52 PolarHBondContact O-N 3.43Å; E52-P54 WeakPolarHBondContact O-CD 3.11Å; E52-P54 VanDerWaalsContact O-N 3.16Å
53	P	26	Very low	26.9	Very low	119 Å²	119	126.8 Å²	126.8	77%	0.773	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-65.6	118.3	-179.2	27.3	-31.1	0	0	0	109.3	K55	P53-K55 PolarHBondContact O-N 2.83Å
54	P	28.8	Very low	27	Very low	125 Å²	125	127.3 Å²	127.3	81%	0.812	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-65.1	124.3	168.2	26.1	-29.6	0	0	0	107.6	E52 L56	E52-P54 WeakPolarHBondContact O-CD 3.11Å; E52-P54 VanDerWaalsContact O-N 3.16Å; P54-L56 PolarHBondContact O-N 2.8Å
55	K	28.3	Very low	26.9	Very low	203 Å²	203	130.8 Å²	130.8	88%	0.883	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-54.6	130.7	178	-74.1	174.3	175.8	174.1	0	109.6	P53 D57	P53-K55 PolarHBondContact O-N 2.83Å; K55-D57 PolarHBondContact O-N 3.43Å; K55-D57 VanDerWaalsContact O-N 3.12Å
56	L	27.4	Very low	26.9	Very low	161 Å²	161	132.2 Å²	132.2	84%	0.843	76%	0.757	S	S	*	*			trans	-60.6	108.3	170.9	-94.5	136.1	0	0	0	109.5	P54 T58	P54-L56 PolarHBondContact O-N 2.8Å; L56-T58 HydrophobicContact CB-CG2 4.46Å; L56-T58 HydrophobicContact CD2-CG2 3.95Å
57	D	28	Very low	27.1	Very low	145 Å²	145	132.9 Å²	132.9	78%	0.775	77%	0.769	S	S	*	*			trans	-91.2	96.1	160.4	-153.5	-1.7	0	0	0	107.4	K55 S59	K55-D57 PolarHBondContact O-N 3.43Å; K55-D57 VanDerWaalsContact O-N 3.12Å; D57-S59 PolarHBondContact O-N 2.73Å
58	T	27.8	Very low	27.3	Very low	121 Å²	121	134.5 Å²	134.5	74%	0.742	78%	0.776	S	S	*	*			trans	-85.5	87.3	175.3	48.2	0	0	0	0	108.4	L56	L56-T58 HydrophobicContact CB-CG2 4.46Å; L56-T58 HydrophobicContact CD2-CG2 3.95Å
59	S	30.7	Very low	27.5	Very low	78 Å²	78	136.3 Å²	136.3	55%	0.545	78%	0.776	S	S	.	*			trans	-146.4	110	167.9	59.8	0	0	0	0	110.7	D57	D57-S59 PolarHBondContact O-N 2.73Å
60	D	27.9	Very low	28.1	Very low	170 Å²	170	131.7 Å²	131.7	91%	0.909	77%	0.771	S	S	*	*			trans	50	81.5	148.1	-60.2	-24.4	0	0	0	117.8
61	S	27.9	Very low	28.6	Very low	114 Å²	114	132.7 Å²	132.7	80%	0.797	77%	0.77	S	S	*	*			trans	-153.8	120.3	156.5	174.5	0	0	0	0	110.5
62	S	26.6	Very low	28.7	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	76%	0.764	S	S	*	*			trans	-95.7	133.3	172.7	51.3	0	0	0	0	109.2
63	M	26.4	Very low	29.2	Very low	174 Å²	174	125.9 Å²	125.9	86%	0.857	75%	0.75	S	S	*	*	S	Bend	trans	100.5	112.5	175.5	-54.1	-162.8	-89.1	0	0	115
64	C	29.1	Very low	29.6	Very low	122 Å²	122	126.1 Å²	126.1	82%	0.824	74%	0.741	S	S	*	*	S	Bend	trans	71.9	109.2	-178.5	-59.4	0	0	0	0	115
65	E	24.5	Very low	30	Very low	204 Å²	204	124.4 Å²	124.4	95%	0.953	72%	0.721	S	S	*	*			trans	158.2	138.7	147	-88.4	165.3	-165.7	0	0	111.5
66	G	26	Very low	30.4	Very low	73 Å²	73	118.4 Å²	118.4	75%	0.753	70%	0.696	S	S	*	*			trans	95.1	45.7	158	0	0	0	0	0	118.3	K68	G66-K68 PolarHBondContact O-N 2.79Å
67	G	26.5	Very low	31	Very low	71 Å²	71	117.2 Å²	117.2	73%	0.732	69%	0.687	S	S	*	*			trans	-71.4	88.5	165.5	0	0	0	0	0	111.4	F69	G67-F69 PolarHBondContact O-N 3.5Å
68	K	30.1	Very low	31.6	Very low	201 Å²	201	114.4 Å²	114.4	87%	0.874	67%	0.671	S	S	*	*			trans	-53.3	105.9	166.4	-72.7	178	178.5	176.9	0	108.7	G66 A70	G66-K68 PolarHBondContact O-N 2.79Å; K68-A70 VanDerWaalsContact C-N 3.29Å; K68-A70 PolarHBondContact O-N 2.79Å
69	F	32.4	Very low	32.1	Very low	147 Å²	147	111.2 Å²	111.2	65%	0.645	65%	0.653	S	S	*	*			trans	-66.3	96	165.1	-76.1	-78.5	0	0	0	107.4	G67 N71 F75	G67-F69 PolarHBondContact O-N 3.5Å; F69-N71 PolarHBondContact O-N 2.88Å; F69-F75 HydrophobicContact CD1-CB 4.35Å; F69-F75 AromaticContact CD1-CD2 3.71Å; F69-F75 HydrophobicContact CD1-CD2 3.71Å; F69-F75 HydrophobicContact CD1-CG 4.43Å; F69-F75 HydrophobicContact CD2-CD2 4.11Å; F69-F75 HydrophobicContact CD2-CE2 4.38Å; F69-F75 AromaticContact CE1-CD2 3.55Å; F69-F75 HydrophobicContact CE1-CD2 3.55Å; F69-F75 HydrophobicContact CE1-CE2 4.04Å; F69-F75 AromaticContact CE2-CD2 3.96Å; F69-F75 HydrophobicContact CE2-CD2 3.96Å; F69-F75 AromaticContact CE2-CE2 3.87Å; F69-F75 HydrophobicContact CE2-CE2 3.87Å; F69-F75 AromaticContact CG-CD2 4Å; F69-F75 HydrophobicContact CG-CD2 4Å; F69-F75 AromaticContact CZ-CD2 3.68Å; F69-F75 HydrophobicContact CZ-CD2 3.68Å; F69-F75 AromaticContact CZ-CE2 3.69Å; F69-F75 HydrophobicContact CZ-CE2 3.69Å
70	A	36.9	Very low	32.6	Very low	85 Å²	85	110.9 Å²	110.9	70%	0.702	65%	0.645	S	S	*	*	S	Bend	trans	-71	9.8	-169.9	0	0	0	0	0	114.8	K68	K68-A70 VanDerWaalsContact C-N 3.29Å; K68-A70 PolarHBondContact O-N 2.79Å
71	N	35.8	Very low	33.2	Very low	98 Å²	98	108.8 Å²	108.8	52%	0.524	63%	0.628	S	S	.	*			trans	-166.2	116.9	166.1	-107.9	-23.9	0	0	0	108.9	F69 S73 Q74	F69-N71 PolarHBondContact O-N 2.88Å; N71-S73 PolarHBondContact O-N 2.98Å; N71-Q74 HydrophobicContact CB-CG 4.33Å; N71-Q74 PolarHBondContact O-N 3.33Å
72	G	30.2	Very low	33.8	Very low	58 Å²	58	109.9 Å²	109.9	60%	0.598	62%	0.618	S	S	*	*	H	α-helix	trans	-55	-25	177	0	0	0	0	0	113.3	F75 Q76	G72-F75 PolarHBondContact O-N 3.35Å; G72-Q76 VanDerWaalsContact O-CB 3.31Å; G72-Q76 WeakPolarHBondContact O-CB 3.18Å; G72-Q76 PolarHBondContact O-N 3.4Å
73	S	36	Very low	34.3	Very low	72 Å²	72	108.6 Å²	108.6	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-62.7	-39.6	174	57.1	0	0	0	0	113.6	N71 Q76 E77	N71-S73 PolarHBondContact O-N 2.98Å; S73-Q76 PolarHBondContact O-N 3.48Å; S73-E77 WeakPolarHBondContact O-CB 3.32Å; S73-E77 PolarHBondContact O-N 3.11Å
74	Q	35	Very low	34.9	Very low	124 Å²	124	104.8 Å²	104.8	58%	0.579	59%	0.585	S	S	*	*	H	α-helix	trans	-73.2	-33	-179.1	-71.3	-178.6	-22.6	0	0	112.2	N71 L78	N71-Q74 HydrophobicContact CB-CG 4.33Å; N71-Q74 PolarHBondContact O-N 3.33Å; Q74-L78 WeakPolarHBondContact O-CB 2.97Å; Q74-L78 PolarHBondContact O-N 3.32Å; Q74-L78 VanDerWaalsContact O-N 3.08Å
75	F	35.9	Very low	35.3	Very low	90 Å²	90	103.1 Å²	103.1	40%	0.395	57%	0.566	S	S	.	*	H	α-helix	trans	-73.7	-40.6	175.1	-168.9	-99.4	0	0	0	111.1	F69 G72 L78 C79	F69-F75 HydrophobicContact CD1-CB 4.35Å; F69-F75 AromaticContact CD1-CD2 3.71Å; F69-F75 HydrophobicContact CD1-CD2 3.71Å; F69-F75 HydrophobicContact CD1-CG 4.43Å; F69-F75 HydrophobicContact CD2-CD2 4.11Å; F69-F75 HydrophobicContact CD2-CE2 4.38Å; F69-F75 AromaticContact CE1-CD2 3.55Å; F69-F75 HydrophobicContact CE1-CD2 3.55Å; F69-F75 HydrophobicContact CE1-CE2 4.04Å; F69-F75 AromaticContact CE2-CD2 3.96Å; F69-F75 HydrophobicContact CE2-CD2 3.96Å; F69-F75 AromaticContact CE2-CE2 3.87Å; F69-F75 HydrophobicContact CE2-CE2 3.87Å; F69-F75 AromaticContact CG-CD2 4Å; F69-F75 HydrophobicContact CG-CD2 4Å; F69-F75 AromaticContact CZ-CD2 3.68Å; F69-F75 HydrophobicContact CZ-CD2 3.68Å; F69-F75 AromaticContact CZ-CE2 3.69Å; F69-F75 HydrophobicContact CZ-CE2 3.69Å; G72-F75 PolarHBondContact O-N 3.35Å; F75-L78 PolarHBondContact O-N 3.09Å; F75-C79 WeakPolarHBondContact O-CB 3.44Å; F75-C79 PolarHBondContact O-N 3.26Å; F75-C79 PolarHBondContact O-SG 3.38Å; F75-C79 VanDerWaalsContact O-SG 3.41Å
76	Q	38.1	Very low	35.8	Very low	77 Å²	77	96.2 Å²	96.2	36%	0.36	54%	0.54	S	S	.	.	H	α-helix	trans	-61.2	-46.7	172.3	-168.5	68.7	46.4	0	0	111	G72 S73 L78 C79 D80	G72-Q76 VanDerWaalsContact O-CB 3.31Å; G72-Q76 WeakPolarHBondContact O-CB 3.18Å; G72-Q76 PolarHBondContact O-N 3.4Å; S73-Q76 PolarHBondContact O-N 3.48Å; Q76-L78 VanDerWaalsContact C-N 3.31Å; Q76-L78 PolarHBondContact O-N 2.95Å; Q76-C79 PolarHBondContact O-N 3.41Å; Q76-C79 VanDerWaalsContact O-N 3.15Å; Q76-D80 PolarHBondContact NE2-OD1 3.37Å; Q76-D80 VanDerWaalsContact NE2-OD1 3.09Å; Q76-D80 WeakPolarHBondContact O-CB 3.22Å; Q76-D80 PolarHBondContact O-N 3.17Å
77	E	39.1	Very low	36.2	Very low	136 Å²	136	96.2 Å²	96.2	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-57	-41	174.1	-104	179.9	152.9	0	0	112.6	S73 K81	S73-E77 WeakPolarHBondContact O-CB 3.32Å; S73-E77 PolarHBondContact O-N 3.11Å; E77-K81 WeakPolarHBondContact O-CB 3.15Å; E77-K81 PolarHBondContact O-N 3.2Å
78	L	41.8	Very low	36.6	Very low	86 Å²	86	99 Å²	99	45%	0.45	52%	0.516	S	S	.	.	H	α-helix	trans	-67.1	-41.4	177.4	-167.8	81	0	0	0	111.7	Q74 F75 Q76 K82	Q74-L78 WeakPolarHBondContact O-CB 2.97Å; Q74-L78 PolarHBondContact O-N 3.32Å; Q74-L78 VanDerWaalsContact O-N 3.08Å; F75-L78 PolarHBondContact O-N 3.09Å; Q76-L78 VanDerWaalsContact C-N 3.31Å; Q76-L78 PolarHBondContact O-N 2.95Å; L78-K82 WeakPolarHBondContact O-CB 3.3Å; L78-K82 WeakPolarHBondContact O-CG 3.46Å; L78-K82 PolarHBondContact O-N 3.47Å
79	C	38.4	Very low	36.8	Very low	53 Å²	53	95.2 Å²	95.2	36%	0.358	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-45.2	175.9	-76.2	0	0	0	0	111.5	F75 Q76 K81 K82 L83	F75-C79 WeakPolarHBondContact O-CB 3.44Å; F75-C79 PolarHBondContact O-N 3.26Å; F75-C79 PolarHBondContact O-SG 3.38Å; F75-C79 VanDerWaalsContact O-SG 3.41Å; Q76-C79 PolarHBondContact O-N 3.41Å; Q76-C79 VanDerWaalsContact O-N 3.15Å; C79-K81 VanDerWaalsContact C-N 3.35Å; C79-K82 PolarHBondContact O-N 2.97Å; C79-L83 VanDerWaalsContact O-CB 3.28Å; C79-L83 WeakPolarHBondContact O-CB 3.34Å; C79-L83 PolarHBondContact O-N 3.47Å
80	D	39.8	Very low	36.8	Very low	71 Å²	71	94.3 Å²	94.3	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-41.5	177.9	-65.8	-15.7	0	0	0	110.5	Q76 L83 L84	Q76-D80 PolarHBondContact NE2-OD1 3.37Å; Q76-D80 VanDerWaalsContact NE2-OD1 3.09Å; Q76-D80 WeakPolarHBondContact O-CB 3.22Å; Q76-D80 PolarHBondContact O-N 3.17Å; D80-L83 PolarHBondContact O-N 3.03Å; D80-L84 WeakPolarHBondContact O-CB 3.47Å; D80-L84 WeakPolarHBondContact O-CG 3.23Å; D80-L84 PolarHBondContact O-N 3.03Å
81	K	42	Very low	36.6	Very low	126 Å²	126	94.5 Å²	94.5	55%	0.548	49%	0.493	S	S	.	.	H	α-helix	trans	-63.3	-46.1	174.8	-172.9	178.5	178.4	-177.4	0	112.2	E77 C79 L83 L84 E85	E77-K81 WeakPolarHBondContact O-CB 3.15Å; E77-K81 PolarHBondContact O-N 3.2Å; C79-K81 VanDerWaalsContact C-N 3.35Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 3.25Å; K81-L84 PolarHBondContact O-N 3.45Å; K81-E85 VanDerWaalsContact CE-OE1 3.22Å; K81-E85 WeakPolarHBondContact CE-OE1 3.36Å; K81-E85 WeakPolarHBondContact O-CB 3.49Å; K81-E85 WeakPolarHBondContact O-CG 3.48Å; K81-E85 PolarHBondContact O-N 3.46Å
82	K	40	Very low	36.2	Very low	138 Å²	138	93.3 Å²	93.3	60%	0.6	50%	0.496	S	S	*	.	H	α-helix	trans	-65.9	-34.6	176.3	-78.4	-170.7	176	-171.2	0	112.6	L78 C79 S86	L78-K82 WeakPolarHBondContact O-CB 3.3Å; L78-K82 WeakPolarHBondContact O-CG 3.46Å; L78-K82 PolarHBondContact O-N 3.47Å; C79-K82 PolarHBondContact O-N 2.97Å; K82-S86 VanDerWaalsContact O-CB 3.25Å; K82-S86 WeakPolarHBondContact O-CB 3.21Å; K82-S86 PolarHBondContact O-N 2.83Å
83	L	36.8	Very low	36.1	Very low	74 Å²	74	95.3 Å²	95.3	39%	0.387	49%	0.493	S	S	.	.	H	α-helix	trans	-67.7	-45.8	175.3	-178.2	64.7	0	0	0	110.6	C79 D80 K81 S86 L87	C79-L83 VanDerWaalsContact O-CB 3.28Å; C79-L83 WeakPolarHBondContact O-CB 3.34Å; C79-L83 PolarHBondContact O-N 3.47Å; D80-L83 PolarHBondContact O-N 3.03Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 3.25Å; L83-S86 PolarHBondContact O-N 3.47Å; L83-L87 HydrophobicContact CD1-CD1 4.41Å; L83-L87 HydrophobicContact CG-CD1 4.06Å; L83-L87 WeakPolarHBondContact O-CB 3.26Å; L83-L87 WeakPolarHBondContact O-CG 3.28Å; L83-L87 PolarHBondContact O-N 3.3Å
84	L	38.4	Very low	35.8	Very low	94 Å²	94	96 Å²	96	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-46.4	173.8	-80.9	161.4	0	0	0	111.8	D80 K81 S86 L87 E88	D80-L84 WeakPolarHBondContact O-CB 3.47Å; D80-L84 WeakPolarHBondContact O-CG 3.23Å; D80-L84 PolarHBondContact O-N 3.03Å; K81-L84 PolarHBondContact O-N 3.45Å; L84-S86 VanDerWaalsContact C-N 3.31Å; L84-S86 PolarHBondContact O-N 2.91Å; L84-L87 PolarHBondContact O-N 3.44Å; L84-E88 WeakPolarHBondContact O-CB 3.42Å; L84-E88 WeakPolarHBondContact O-CG 3.38Å; L84-E88 PolarHBondContact O-N 2.99Å
85	E	38.8	Very low	35.5	Very low	87 Å²	87	97.6 Å²	97.6	41%	0.407	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-39.5	175	-77.9	173.1	179.6	0	0	111.7	K81 N89	K81-E85 VanDerWaalsContact CE-OE1 3.22Å; K81-E85 WeakPolarHBondContact CE-OE1 3.36Å; K81-E85 WeakPolarHBondContact O-CB 3.49Å; K81-E85 WeakPolarHBondContact O-CG 3.48Å; K81-E85 PolarHBondContact O-N 3.46Å; E85-N89 WeakPolarHBondContact O-CB 3.4Å; E85-N89 PolarHBondContact O-N 3.06Å; E85-N89 PolarHBondContact O-ND2 2.92Å
86	S	35.2	Very low	35.1	Very low	59 Å²	59	100.8 Å²	100.8	41%	0.413	52%	0.523	S	S	.	.	H	α-helix	trans	-68.4	-39.8	176.4	-173.8	0	0	0	0	111.8	K82 L83 L84 N90	K82-S86 VanDerWaalsContact O-CB 3.25Å; K82-S86 WeakPolarHBondContact O-CB 3.21Å; K82-S86 PolarHBondContact O-N 2.83Å; L83-S86 PolarHBondContact O-N 3.47Å; L84-S86 VanDerWaalsContact C-N 3.31Å; L84-S86 PolarHBondContact O-N 2.91Å; S86-N90 VanDerWaalsContact O-CB 3.29Å; S86-N90 WeakPolarHBondContact O-CB 3.46Å; S86-N90 PolarHBondContact O-N 3.31Å; S86-N90 PolarHBondContact O-ND2 2.85Å; S86-N90 PolarHBondContact OG-ND2 2.97Å
87	L	33.8	Very low	34.5	Very low	74 Å²	74	101.2 Å²	101.2	39%	0.387	54%	0.54	S	S	.	.	H	α-helix	trans	-65.5	-52.1	174.7	-69.7	166	0	0	0	109.9	L83 L84 N89 N90 F91	L83-L87 HydrophobicContact CD1-CD1 4.41Å; L83-L87 HydrophobicContact CG-CD1 4.06Å; L83-L87 WeakPolarHBondContact O-CB 3.26Å; L83-L87 WeakPolarHBondContact O-CG 3.28Å; L83-L87 PolarHBondContact O-N 3.3Å; L84-L87 PolarHBondContact O-N 3.44Å; L87-N89 VanDerWaalsContact C-N 3.33Å; L87-N89 PolarHBondContact O-N 2.94Å; L87-N90 PolarHBondContact O-N 2.87Å; L87-N90 VanDerWaalsContact O-N 3.15Å; L87-F91 HydrophobicContact CB-CD2 4.21Å; L87-F91 HydrophobicContact CB-CE2 4.18Å; L87-F91 HydrophobicContact CD2-CE2 3.88Å; L87-F91 WeakPolarHBondContact O-CB 2.95Å; L87-F91 WeakPolarHBondContact O-CD2 3.47Å; L87-F91 PolarHBondContact O-N 3.24Å
88	E	34.5	Very low	33.6	Very low	128 Å²	128	102.4 Å²	102.4	60%	0.598	55%	0.546	S	S	*	.	H	α-helix	trans	-58.4	-41.8	178.9	-73.4	176.9	170.6	0	0	112.2	L84 F91 A92	L84-E88 WeakPolarHBondContact O-CB 3.42Å; L84-E88 WeakPolarHBondContact O-CG 3.38Å; L84-E88 PolarHBondContact O-N 2.99Å; E88-F91 PolarHBondContact O-N 3.11Å; E88-A92 VanDerWaalsContact O-CB 3.27Å; E88-A92 WeakPolarHBondContact O-CB 3.14Å; E88-A92 PolarHBondContact O-N 2.84Å
89	N	34.4	Very low	32.7	Very low	122 Å²	122	108.6 Å²	108.6	65%	0.652	56%	0.563	S	S	*	*	H	α-helix	trans	-71.3	-31.2	176.9	-73.9	-44.8	0	0	0	113.6	E85 L87	E85-N89 WeakPolarHBondContact O-CB 3.4Å; E85-N89 PolarHBondContact O-N 3.06Å; E85-N89 PolarHBondContact O-ND2 2.92Å; L87-N89 VanDerWaalsContact C-N 3.33Å; L87-N89 PolarHBondContact O-N 2.94Å
90	N	31.7	Very low	31.9	Very low	128 Å²	128	114.5 Å²	114.5	68%	0.684	58%	0.583	S	S	*	*	H	α-helix	trans	-81.1	-19.9	175.6	-75.7	-54.1	0	0	0	112.9	S86 L87	S86-N90 VanDerWaalsContact O-CB 3.29Å; S86-N90 WeakPolarHBondContact O-CB 3.46Å; S86-N90 PolarHBondContact O-N 3.31Å; S86-N90 PolarHBondContact O-ND2 2.85Å; S86-N90 PolarHBondContact OG-ND2 2.97Å; L87-N90 PolarHBondContact O-N 2.87Å; L87-N90 VanDerWaalsContact O-N 3.15Å
91	F	32	Very low	31.1	Very low	90 Å²	90	118.9 Å²	118.9	40%	0.395	61%	0.606	S	S	.	*	H	α-helix	trans	-93.6	-7.9	173.7	-71.4	-64.4	0	0	0	113.6	L87 E88 D93 C94	L87-F91 HydrophobicContact CB-CD2 4.21Å; L87-F91 HydrophobicContact CB-CE2 4.18Å; L87-F91 HydrophobicContact CD2-CE2 3.88Å; L87-F91 WeakPolarHBondContact O-CB 2.95Å; L87-F91 WeakPolarHBondContact O-CD2 3.47Å; L87-F91 PolarHBondContact O-N 3.24Å; E88-F91 PolarHBondContact O-N 3.11Å; F91-D93 VanDerWaalsContact C-N 3.31Å; F91-D93 PolarHBondContact O-N 2.78Å; F91-C94 PolarHBondContact O-SG 3.49Å; F91-C94 VanDerWaalsContact O-SG 3.33Å
92	A	27.6	Very low	30.2	Very low	72 Å²	72	119.2 Å²	119.2	60%	0.595	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-3.2	-175.9	0	0	0	0	0	115.5	E88	E88-A92 VanDerWaalsContact O-CB 3.27Å; E88-A92 WeakPolarHBondContact O-CB 3.14Å; E88-A92 PolarHBondContact O-N 2.84Å
93	D	29.6	Very low	29.5	Very low	101 Å²	101	116.4 Å²	116.4	54%	0.54	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106	31.9	176.3	-133.4	2.3	0	0	0	111.8	F91 D95 K96	F91-D93 VanDerWaalsContact C-N 3.31Å; F91-D93 PolarHBondContact O-N 2.78Å; D93-D95 PolarHBondContact O-N 2.84Å; D93-K96 IonicContact OD1-NZ 3.34Å; D93-K96 PolarHBondContact OD1-NZ 3.28Å; D93-K96 IonicContact OD2-NZ 2.78Å; D93-K96 PolarHBondContact OD2-NZ 3.36Å
94	C	29.4	Very low	29	Very low	85 Å²	85	119.8 Å²	119.8	57%	0.574	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-63.8	-16.9	173.5	-85.4	0	0	0	0	113.8	F91 K96 A97	F91-C94 PolarHBondContact O-SG 3.49Å; F91-C94 VanDerWaalsContact O-SG 3.33Å; C94-K96 PolarHBondContact O-N 3.35Å; C94-A97 WeakPolarHBondContact O-CB 3.03Å; C94-A97 PolarHBondContact O-N 3.15Å; C94-A97 VanDerWaalsContact O-N 3.11Å
95	D	28.6	Very low	28.5	Very low	158 Å²	158	117.8 Å²	117.8	85%	0.845	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-75.9	-0.5	-178.4	-70	-24.3	0	0	0	114	D93	D93-D95 PolarHBondContact O-N 2.84Å
96	K	27.9	Very low	28	Very low	157 Å²	157	116.7 Å²	116.7	68%	0.683	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-99.5	-0.6	169.2	-67.3	176.2	-171.2	144.5	0	113.5	D93 C94 Q98	D93-K96 IonicContact OD1-NZ 3.34Å; D93-K96 PolarHBondContact OD1-NZ 3.28Å; D93-K96 IonicContact OD2-NZ 2.78Å; D93-K96 PolarHBondContact OD2-NZ 3.36Å; C94-K96 PolarHBondContact O-N 3.35Å; K96-Q98 PolarHBondContact O-N 2.84Å
97	A	24.5	Very low	27.7	Very low	86 Å²	86	115 Å²	115	71%	0.711	61%	0.605	S	S	*	*			trans	-89.8	74.4	176.6	0	0	0	0	0	111.2	C94	C94-A97 WeakPolarHBondContact O-CB 3.03Å; C94-A97 PolarHBondContact O-N 3.15Å; C94-A97 VanDerWaalsContact O-N 3.11Å
98	Q	20.9	Very low	27.4	Very low	162 Å²	162	115.4 Å²	115.4	76%	0.757	63%	0.627	S	S	*	*			trans	-98	125.3	151.9	-67.3	179.4	-28.5	0	0	104.3	K96	K96-Q98 PolarHBondContact O-N 2.84Å
99	W	22.5	Very low	27.2	Very low	215 Å²	215	112 Å²	112	81%	0.814	61%	0.61	S	S	*	*				-164.7	140.8	61.9	-82.5	63.8	0	0	0	111.3
100	F	22.1	Very low	27	Very low	178 Å²	178	115.3 Å²	115.3	78%	0.781	62%	0.622	S	S	*	*			trans	28.1	144.9	138.4	-60.4	-91.6	0	0	0	124.1	D102	F100-D102 PolarHBondContact O-N 3.43Å
101	D	21.5	Very low	26.9	Very low	163 Å²	163	110.6 Å²	110.6	87%	0.872	60%	0.601	S	S	*	*	S	Bend	trans	68.9	-10.4	171.7	-70.8	-16.2	0	0	0	121.3
102	D	24	Very low	26.8	Very low	132 Å²	132	111.3 Å²	111.3	71%	0.706	62%	0.624	S	S	*	*			trans	-143.2	108.6	177.1	-75	-57	0	0	0	111.1	F100 Q104	F100-D102 PolarHBondContact O-N 3.43Å; D102-Q104 PolarHBondContact O-N 3.04Å
103	C	25	Very low	27	Very low	80 Å²	80	111.1 Å²	111.1	54%	0.541	62%	0.615	S	S	.	*			trans	-66.1	99.5	170.6	-86.5	0	0	0	0	109.8
104	Q	26.5	Very low	27.2	Very low	145 Å²	145	111 Å²	111	68%	0.678	61%	0.611	S	S	*	*			trans	-90.5	120.7	166.7	-86.6	-171.1	-3.1	0	0	110.8	I10 D102	I10-Q104 HydrophobicContact CD1-CG 3.96Å; I10-Q104 HydrophobicContact CG1-CG 4.11Å; I10-Q104 HydrophobicContact CG2-CG 3.98Å; D102-Q104 PolarHBondContact O-N 3.04Å
105	Y	27.9	Very low	27.4	Very low	52 Å²	52	113.2 Å²	113.2	20%	0.204	61%	0.613	C	S	.	*			trans	-97.7	129.4	168	-166.6	-112.7	0	0	0	109.4	L26	L26-Y105 HydrophobicContact CD1-CD1 4.09Å; L26-Y105 HydrophobicContact CD1-CE1 3.88Å
106	A	27.5	Very low	27.9	Very low	64 Å²	64	109.6 Å²	109.6	53%	0.529	59%	0.588	S	S	.	*			trans	-115.6	105.7	168.6	0	0	0	0	0	107.7
107	S	30	Very low	28.3	Very low	22 Å²	22	102.6 Å²	102.6	15%	0.154	56%	0.559	C	S	.	*			trans	-107.7	121.2	169.2	44.8	0	0	0	0	110	F109	S107-F109 VanDerWaalsContact C-N 3.29Å; S107-F109 PolarHBondContact O-N 3Å; S107-F109 WeakPolarHBondContact OG-CD2 3.11Å; S107-F109 WeakPolarHBondContact OG-CE2 3.47Å
108	G	26.8	Very low	29.1	Very low	83 Å²	83	102.4 Å²	102.4	86%	0.856	54%	0.54	S	S	*	.			trans	-67.1	88	165	0	0	0	0	0	110
109	F	30.9	Very low	30	Very low	56 Å²	56	99.1 Å²	99.1	25%	0.246	53%	0.527	C	S	.	.			trans	-82.8	111.4	169.2	-83	-82.3	0	0	0	109.1	L26 T30 S107 A117 I121	L26-F109 HydrophobicContact CD2-CZ 4.31Å; T30-F109 HydrophobicContact CG2-CE1 4.34Å; T30-F109 WeakPolarHBondContact OG1-CE1 3.23Å; S107-F109 VanDerWaalsContact C-N 3.29Å; S107-F109 PolarHBondContact O-N 3Å; S107-F109 WeakPolarHBondContact OG-CD2 3.11Å; S107-F109 WeakPolarHBondContact OG-CE2 3.47Å; F109-A117 HydrophobicContact CB-CB 4.24Å; F109-I121 HydrophobicContact CD2-CD1 4.05Å; F109-I121 HydrophobicContact CE1-CD1 4.42Å; F109-I121 HydrophobicContact CE1-CG1 4.31Å; F109-I121 HydrophobicContact CE2-CD1 3.72Å; F109-I121 HydrophobicContact CE2-CG1 4.19Å; F109-I121 HydrophobicContact CZ-CD1 3.95Å; F109-I121 HydrophobicContact CZ-CG1 3.91Å
110	Q	29.8	Very low	30.9	Very low	192 Å²	192	90 Å²	90	90%	0.897	49%	0.494	S	S	*	.			trans	-93.9	92.7	160.7	-82.5	-176.4	-19.5	0	0	108.5
111	A	29.9	Very low	31.9	Very low	29 Å²	29	82 Å²	82	24%	0.24	46%	0.458	C	S	.	.			trans	-97.3	146.7	161.3	0	0	0	0	0	108.9	T113 R116 A117	A111-T113 VanDerWaalsContact CB-O 3.23Å; A111-T113 WeakPolarHBondContact CB-O 3.28Å; A111-T113 PolarHBondContact O-N 3.27Å; A111-R116 HydrophobicContact CB-CB 4.24Å; A111-A117 HydrophobicContact CB-CB 3.56Å; A111-A117 VanDerWaalsContact CB-N 3.3Å
112	A	29.8	Very low	32.8	Very low	106 Å²	106	78.6 Å²	78.6	88%	0.876	44%	0.436	S	S	*	.	S	Bend	trans	-55.9	-20.5	178.9	0	0	0	0	0	113.4
113	T	32.9	Very low	33.7	Very low	68 Å²	68	77.3 Å²	77.3	42%	0.417	43%	0.426	S	S	.	.	S	Bend	trans	-145	149.2	165	61.4	0	0	0	0	109.1	A111 E115 R116 A117	A111-T113 VanDerWaalsContact CB-O 3.23Å; A111-T113 WeakPolarHBondContact CB-O 3.28Å; A111-T113 PolarHBondContact O-N 3.27Å; T113-E115 PolarHBondContact O-N 3.27Å; T113-R116 PolarHBondContact O-N 2.93Å; T113-A117 PolarHBondContact O-N 3.04Å
114	E	33	Very low	34.3	Very low	98 Å²	98	74.4 Å²	74.4	46%	0.458	41%	0.41	S	S	.	.	H	α-helix	trans	-53.4	-41.2	175.7	-76	-173.3	132.7	0	0	112	S7 R116 A117 Y118	S7-E114 WeakPolarHBondContact CB-OE1 3.39Å; S7-E114 PolarHBondContact OG-OE1 3Å; E114-R116 PolarHBondContact O-N 3.3Å; E114-R116 VanDerWaalsContact O-N 3.15Å; E114-A117 WeakPolarHBondContact O-CB 3.35Å; E114-A117 PolarHBondContact O-N 3.45Å; E114-A117 VanDerWaalsContact O-N 3.09Å; E114-Y118 HydrophobicContact CB-CD2 4.36Å; E114-Y118 HydrophobicContact CB-CE2 4.16Å; E114-Y118 WeakPolarHBondContact O-CD2 3.32Å; E114-Y118 PolarHBondContact O-N 2.98Å
115	E	33.9	Very low	34.8	Very low	131 Å²	131	68.2 Å²	68.2	61%	0.612	38%	0.381	S	S	*	.	H	α-helix	trans	-54.3	-35.7	177.8	-64.4	158.6	159.5	0	0	112.5	T113 Y118 I119	T113-E115 PolarHBondContact O-N 3.27Å; E115-Y118 PolarHBondContact O-N 3.09Å; E115-I119 WeakPolarHBondContact O-CD1 3.49Å; E115-I119 VanDerWaalsContact O-CG1 3.23Å; E115-I119 WeakPolarHBondContact O-CG1 3.36Å; E115-I119 PolarHBondContact O-N 3.39Å
116	R	38.5	Very low	35.1	Very low	83 Å²	83	70.1 Å²	70.1	31%	0.313	40%	0.402	S	S	.	.	H	α-helix	trans	-78	-35.7	-179.2	-168.8	148.3	178.4	169.5	-14.1	112.2	R40 A111 T113 E114 Y118 I119 Q120	R40-R116 VanDerWaalsContact CD-NH2 3.25Å; A111-R116 HydrophobicContact CB-CB 4.24Å; T113-R116 PolarHBondContact O-N 2.93Å; E114-R116 PolarHBondContact O-N 3.3Å; E114-R116 VanDerWaalsContact O-N 3.15Å; R116-Y118 VanDerWaalsContact C-N 3.3Å; R116-I119 PolarHBondContact O-N 3.39Å; R116-Q120 HydrophobicContact CG-CG 4.45Å; R116-Q120 VanDerWaalsContact O-CB 3.32Å; R116-Q120 WeakPolarHBondContact O-CB 3.33Å; R116-Q120 WeakPolarHBondContact O-CG 3.03Å; R116-Q120 PolarHBondContact O-N 3.5Å; R116-Q120 PolarHBondContact O-OE1 3.33Å; R116-Q120 VanDerWaalsContact O-OE1 3.06Å
117	A	37.6	Very low	35.6	Very low	9 Å²	9	74.9 Å²	74.9	7%	0.074	41%	0.411	C	S	.	.	H	α-helix	trans	-59.1	-45.7	168.4	0	0	0	0	0	110.2	F109 A111 T113 E114 Q120 I121	F109-A117 HydrophobicContact CB-CB 4.24Å; A111-A117 HydrophobicContact CB-CB 3.56Å; A111-A117 VanDerWaalsContact CB-N 3.3Å; T113-A117 PolarHBondContact O-N 3.04Å; E114-A117 WeakPolarHBondContact O-CB 3.35Å; E114-A117 PolarHBondContact O-N 3.45Å; E114-A117 VanDerWaalsContact O-N 3.09Å; A117-Q120 PolarHBondContact O-N 3.04Å; A117-I121 WeakPolarHBondContact O-CB 3.46Å; A117-I121 WeakPolarHBondContact O-CD1 3.38Å; A117-I121 WeakPolarHBondContact O-CG1 3.18Å; A117-I121 PolarHBondContact O-N 2.96Å
118	Y	40.9	Very low	35.8	Very low	82 Å²	82	74.6 Å²	74.6	32%	0.322	41%	0.409	S	S	.	.	H	α-helix	trans	-63.6	-48.8	178.1	-73.9	-67.5	0	0	0	112.5	I9 E114 E115 R116 Q120 I121 F122	I9-Y118 HydrophobicContact CD1-CD1 3.99Å; I9-Y118 HydrophobicContact CD1-CE1 3.54Å; I9-Y118 HydrophobicContact CG1-CE1 4.03Å; E114-Y118 HydrophobicContact CB-CD2 4.36Å; E114-Y118 HydrophobicContact CB-CE2 4.16Å; E114-Y118 WeakPolarHBondContact O-CD2 3.32Å; E114-Y118 PolarHBondContact O-N 2.98Å; E115-Y118 PolarHBondContact O-N 3.09Å; R116-Y118 VanDerWaalsContact C-N 3.3Å; Y118-Q120 VanDerWaalsContact C-N 3.26Å; Y118-Q120 PolarHBondContact O-N 3.15Å; Y118-I121 PolarHBondContact O-N 3.26Å; Y118-F122 WeakPolarHBondContact O-CB 3.42Å; Y118-F122 WeakPolarHBondContact O-CD2 3.04Å; Y118-F122 PolarHBondContact O-N 2.82Å
119	I	39.4	Very low	36	Very low	93 Å²	93	72.2 Å²	72.2	48%	0.477	38%	0.378	S	S	.	.	H	α-helix	trans	-57.1	-42	177.6	-72.1	163.3	0	0	0	111	E115 R116 F122 E123	E115-I119 WeakPolarHBondContact O-CD1 3.49Å; E115-I119 VanDerWaalsContact O-CG1 3.23Å; E115-I119 WeakPolarHBondContact O-CG1 3.36Å; E115-I119 PolarHBondContact O-N 3.39Å; R116-I119 PolarHBondContact O-N 3.39Å; I119-F122 CarbonylContact O-C 3.57Å; I119-F122 PolarHBondContact O-N 2.82Å; I119-E123 HydrophobicContact CG2-CG 4.16Å; I119-E123 WeakPolarHBondContact O-CB 3.4Å; I119-E123 VanDerWaalsContact O-CG 3.31Å; I119-E123 WeakPolarHBondContact O-CG 3.06Å; I119-E123 PolarHBondContact O-N 2.93Å
120	Q	42	Very low	36	Very low	25 Å²	25	78.1 Å²	78.1	12%	0.117	41%	0.412	C	S	.	.	H	α-helix	trans	-75.9	-31.8	-176	-69.5	164.6	-22.1	0	0	112.6	V33 R116 A117 Y118 G124	V33-Q120 VanDerWaalsContact CG1-NE2 3.34Å; V33-Q120 HydrophobicContact CG2-CB 3.44Å; V33-Q120 VanDerWaalsContact CG2-CB 3.44Å; V33-Q120 HydrophobicContact CG2-CG 3.34Å; V33-Q120 VanDerWaalsContact CG2-NE2 3.28Å; R116-Q120 HydrophobicContact CG-CG 4.45Å; R116-Q120 VanDerWaalsContact O-CB 3.32Å; R116-Q120 WeakPolarHBondContact O-CB 3.33Å; R116-Q120 WeakPolarHBondContact O-CG 3.03Å; R116-Q120 PolarHBondContact O-N 3.5Å; R116-Q120 PolarHBondContact O-OE1 3.33Å; R116-Q120 VanDerWaalsContact O-OE1 3.06Å; A117-Q120 PolarHBondContact O-N 3.04Å; Y118-Q120 VanDerWaalsContact C-N 3.26Å; Y118-Q120 PolarHBondContact O-N 3.15Å; Q120-G124 PolarHBondContact O-N 3.42Å
121	I	41.3	Very low	36	Very low	8 Å²	8	72.6 Å²	72.6	4%	0.041	41%	0.407	C	S	.	.	H	α-helix	trans	-61.1	-55.8	165	-70.3	165.8	0	0	0	107.8	I9 L26 F109 A117 Y118 E123 G124 L125	I9-I121 HydrophobicContact CD1-CD1 3.25Å; L26-I121 HydrophobicContact CD2-CG1 4.48Å; F109-I121 HydrophobicContact CD2-CD1 4.05Å; F109-I121 HydrophobicContact CE1-CD1 4.42Å; F109-I121 HydrophobicContact CE1-CG1 4.31Å; F109-I121 HydrophobicContact CE2-CD1 3.72Å; F109-I121 HydrophobicContact CE2-CG1 4.19Å; F109-I121 HydrophobicContact CZ-CD1 3.95Å; F109-I121 HydrophobicContact CZ-CG1 3.91Å; A117-I121 WeakPolarHBondContact O-CB 3.46Å; A117-I121 WeakPolarHBondContact O-CD1 3.38Å; A117-I121 WeakPolarHBondContact O-CG1 3.18Å; A117-I121 PolarHBondContact O-N 2.96Å; Y118-I121 PolarHBondContact O-N 3.26Å; I121-E123 PolarHBondContact O-N 3.11Å; I121-G124 WeakPolarHBondContact O-CA 3.49Å; I121-G124 PolarHBondContact O-N 3.37Å; I121-L125 HydrophobicContact CG2-CD1 3.47Å; I121-L125 VanDerWaalsContact CG2-CD1 3.47Å; I121-L125 HydrophobicContact CG2-CG 4.09Å; I121-L125 WeakPolarHBondContact O-CB 3.12Å; I121-L125 WeakPolarHBondContact O-CD1 3.4Å; I121-L125 WeakPolarHBondContact O-CG 3.32Å; I121-L125 PolarHBondContact O-N 2.72Å
122	F	42.2	Very low	35.8	Very low	92 Å²	92	74.5 Å²	74.5	40%	0.404	42%	0.423	S	S	.	.	H	α-helix	trans	-57.7	-37.9	179.2	-84.1	-74	0	0	0	114.6	Y118 I119 L125 S126 I174	Y118-F122 WeakPolarHBondContact O-CB 3.42Å; Y118-F122 WeakPolarHBondContact O-CD2 3.04Å; Y118-F122 PolarHBondContact O-N 2.82Å; I119-F122 CarbonylContact O-C 3.57Å; I119-F122 PolarHBondContact O-N 2.82Å; F122-L125 HydrophobicContact CD1-CD1 4.13Å; F122-L125 HydrophobicContact CG-CD1 4.34Å; F122-L125 PolarHBondContact O-N 3.29Å; F122-S126 WeakPolarHBondContact O-CB 3.31Å; F122-S126 PolarHBondContact O-N 2.95Å; F122-I174 HydrophobicContact CE2-CD1 4.33Å; F122-I174 HydrophobicContact CZ-CD1 4.42Å
123	E	41.1	Very low	35.8	Very low	105 Å²	105	71 Å²	71	49%	0.491	39%	0.392	S	S	.	.	H	α-helix	trans	-72.6	-31.3	175.5	-75.5	-179	170.7	0	0	112.9	I119 I121 S126 K127	I119-E123 HydrophobicContact CG2-CG 4.16Å; I119-E123 WeakPolarHBondContact O-CB 3.4Å; I119-E123 VanDerWaalsContact O-CG 3.31Å; I119-E123 WeakPolarHBondContact O-CG 3.06Å; I119-E123 PolarHBondContact O-N 2.93Å; I121-E123 PolarHBondContact O-N 3.11Å; E123-S126 PolarHBondContact O-OG 3.29Å; E123-K127 WeakPolarHBondContact O-CG 3.49Å
124	G	39.2	Very low	35.7	Very low	19 Å²	19	74.1 Å²	74.1	20%	0.196	40%	0.396	C	S	.	.	H	α-helix	trans	-71.6	-37.4	170.3	0	0	0	0	0	112.4	Q120 I121 S128	Q120-G124 PolarHBondContact O-N 3.42Å; I121-G124 WeakPolarHBondContact O-CA 3.49Å; I121-G124 PolarHBondContact O-N 3.37Å; G124-S128 VanDerWaalsContact O-CB 3.32Å; G124-S128 WeakPolarHBondContact O-CB 3.18Å; G124-S128 PolarHBondContact O-N 2.75Å; G124-S128 PolarHBondContact O-OG 2.8Å
125	L	36.8	Very low	35.7	Very low	16 Å²	16	72.1 Å²	72.1	8%	0.084	39%	0.39	C	S	.	.	H	α-helix	trans	-67.3	-38.9	176.4	-62.1	159.7	0	0	0	111.7	W22 I121 F122 K127 V135	W22-L125 HydrophobicContact CE3-CD2 4.05Å; W22-L125 HydrophobicContact CH2-CB 4.48Å; W22-L125 HydrophobicContact CH2-CD2 3.09Å; W22-L125 HydrophobicContact CH2-CG 4.31Å; W22-L125 HydrophobicContact CZ2-CD2 4.06Å; W22-L125 HydrophobicContact CZ3-CD2 3.13Å; W22-L125 HydrophobicContact CZ3-CG 4.28Å; I121-L125 HydrophobicContact CG2-CD1 3.47Å; I121-L125 VanDerWaalsContact CG2-CD1 3.47Å; I121-L125 HydrophobicContact CG2-CG 4.09Å; I121-L125 WeakPolarHBondContact O-CB 3.12Å; I121-L125 WeakPolarHBondContact O-CD1 3.4Å; I121-L125 WeakPolarHBondContact O-CG 3.32Å; I121-L125 PolarHBondContact O-N 2.72Å; F122-L125 HydrophobicContact CD1-CD1 4.13Å; F122-L125 HydrophobicContact CG-CD1 4.34Å; F122-L125 PolarHBondContact O-N 3.29Å; L125-K127 PolarHBondContact O-N 3.48Å; L125-V135 HydrophobicContact CB-CG2 4.34Å; L125-V135 HydrophobicContact CD1-CB 4.37Å; L125-V135 HydrophobicContact CD1-CG1 4.37Å; L125-V135 HydrophobicContact CD1-CG2 3.21Å; L125-V135 HydrophobicContact CD2-CG2 3.33Å; L125-V135 HydrophobicContact CG-CG2 3.76Å
126	S	34.1	Very low	35.5	Very low	92 Å²	92	69.9 Å²	69.9	64%	0.643	38%	0.382	S	S	*	.	H	α-helix	trans	-74.3	-22.2	-178.9	73.4	0	0	0	0	114.3	F122 E123	F122-S126 WeakPolarHBondContact O-CB 3.31Å; F122-S126 PolarHBondContact O-N 2.95Å; E123-S126 PolarHBondContact O-OG 3.29Å
127	K	37.4	Very low	35	Very low	164 Å²	164	68 Å²	68	71%	0.713	38%	0.381	S	S	*	.	H	α-helix	trans	-99.8	-15.9	-175.9	-71.8	178.4	-179.7	170.6	0	114.7	E123 L125	E123-K127 WeakPolarHBondContact O-CG 3.49Å; L125-K127 PolarHBondContact O-N 3.48Å
128	S	33.5	Very low	34.5	Very low	16 Å²	16	74.5 Å²	74.5	11%	0.112	41%	0.414	C	S	.	.	S	Bend	trans	-102.3	-7.7	-165.4	61.1	0	0	0	0	116.1	Q25 G124	Q25-S128 VanDerWaalsContact CG-CB 3.47Å; G124-S128 VanDerWaalsContact O-CB 3.32Å; G124-S128 WeakPolarHBondContact O-CB 3.18Å; G124-S128 PolarHBondContact O-N 2.75Å; G124-S128 PolarHBondContact O-OG 2.8Å
129	T	31.1	Very low	33.9	Very low	33 Å²	33	75.4 Å²	75.4	20%	0.202	43%	0.429	C	S	.	.			trans	-131.7	126.8	-169.1	65.3	0	0	0	0	111.5	W22 G131 S133	W22-T129 HydrophobicContact CH2-CG2 4.17Å; W22-T129 HydrophobicContact CZ3-CG2 4.44Å; T129-G131 PolarHBondContact O-N 3.26Å; T129-S133 VanDerWaalsContact CG2-OG 3.28Å; T129-S133 WeakPolarHBondContact CG2-OG 3.23Å
130	N	32.5	Very low	33.4	Very low	179 Å²	179	76.6 Å²	76.6	96%	0.957	43%	0.431	S	S	*	.	S	Bend	trans	-62.8	49.7	167.8	-77.2	-25	0	0	0	111.9	A132	N130-A132 VanDerWaalsContact C-N 3.32Å; N130-A132 PolarHBondContact O-N 2.88Å
131	G	28.9	Very low	32.7	Very low	77 Å²	77	79 Å²	79	79%	0.794	45%	0.448	S	S	*	.	S	Bend	trans	74.1	8.6	-178.4	0	0	0	0	0	116	T129	T129-G131 PolarHBondContact O-N 3.26Å
132	A	26.9	Very low	32	Very low	69 Å²	69	88.8 Å²	88.8	57%	0.57	49%	0.491	S	S	*	.			trans	-92.9	-5.5	-166.8	0	0	0	0	0	116.2	N130	N130-A132 VanDerWaalsContact C-N 3.32Å; N130-A132 PolarHBondContact O-N 2.88Å
133	S	28.4	Very low	31.3	Very low	33 Å²	33	91.8 Å²	91.8	23%	0.231	51%	0.511	C	S	.	.			trans	-130.5	121.7	-154.4	-103.9	0	0	0	0	112.8	W22 T129	W22-S133 WeakPolarHBondContact CZ2-OG 3.48Å; W22-S133 PolarHBondContact NE1-OG 2.61Å; T129-S133 VanDerWaalsContact CG2-OG 3.28Å; T129-S133 WeakPolarHBondContact CG2-OG 3.23Å
134	R	31	Very low	30.6	Very low	132 Å²	132	91.9 Å²	91.9	50%	0.498	51%	0.51	S	S	.	.			trans	-109.7	128.5	-173	-64.4	-178.9	178.1	-179.7	-4.1	109.5	H169	R134-H169 PolarHBondContact NH1-CE1 3.43Å; R134-H169 PolarHBondContact NH1-ND1 3.4Å; R134-H169 PolarHBondContact NH1-NE2 3.16Å
135	V	32.4	Very low	29.9	Very low	57 Å²	57	96.4 Å²	96.4	35%	0.345	53%	0.526	S	S	.	.			trans	-88.8	117.7	169.9	-177.3	0	0	0	0	107.4	L125	L125-V135 HydrophobicContact CB-CG2 4.34Å; L125-V135 HydrophobicContact CD1-CB 4.37Å; L125-V135 HydrophobicContact CD1-CG1 4.37Å; L125-V135 HydrophobicContact CD1-CG2 3.21Å; L125-V135 HydrophobicContact CD2-CG2 3.33Å; L125-V135 HydrophobicContact CG-CG2 3.76Å
136	I	29.5	Very low	29.5	Very low	84 Å²	84	102.3 Å²	102.3	43%	0.431	55%	0.551	S	S	.	*			trans	-113.4	96.2	174.6	-54	174.9	0	0	0	106.1
137	S	30	Very low	29	Very low	42 Å²	42	105.3 Å²	105.3	29%	0.294	56%	0.555	S	S	.	*			trans	-109.7	119.5	169.5	174.4	0	0	0	0	109.1
138	N	25.5	Very low	28.5	Very low	146 Å²	146	103 Å²	103	78%	0.781	55%	0.55	S	S	*	.			trans	-132.1	66.5	175.2	-132.6	9.9	0	0	0	109.6
139	T	29.2	Very low	28.1	Very low	102 Å²	102	113.5 Å²	113.5	63%	0.626	59%	0.587	S	S	*	*			trans	-151.7	73.9	160.8	28	0	0	0	0	108.7
140	F	29	Very low	27.9	Very low	117 Å²	117	117.5 Å²	117.5	51%	0.513	61%	0.612	S	S	.	*			trans	-79.6	137.2	166.4	-71.8	-83.2	0	0	0	109.4	K142 F144 F146	F140-K142 PolarHBondContact O-N 3.38Å; F140-F144 HydrophobicContact CD1-CB 4.1Å; F140-F146 HydrophobicContact CE1-CD2 4.14Å; F140-F146 AromaticContact CE1-CE2 3.92Å; F140-F146 HydrophobicContact CE1-CE2 3.92Å
141	P	27.7	Very low	27.6	Very low	75 Å²	75	116.8 Å²	116.8	49%	0.487	61%	0.608	S	S	.	*			trans	-52.5	138.1	157.4	-19.6	30.6	0	0	0	108.4	N143 F144	P141-N143 PolarHBondContact O-N 3.43Å; P141-F144 PolarHBondContact O-N 3.05Å
142	K	26.4	Very low	27.6	Very low	214 Å²	214	120 Å²	120	93%	0.93	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	-2.9	-176.5	-79.1	179.6	175.5	175.1	0	115.8	F140	F140-K142 PolarHBondContact O-N 3.38Å
143	N	25.9	Very low	27.7	Very low	155 Å²	155	125.3 Å²	125.3	83%	0.829	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	15.8	-176.1	-60.7	-26.9	0	0	0	113.9	P141	P141-N143 PolarHBondContact O-N 3.43Å
144	F	26.9	Very low	27.5	Very low	108 Å²	108	131.7 Å²	131.7	47%	0.474	65%	0.651	S	S	.	*			trans	-101.8	120	177	-126.1	-90.5	0	0	0	111.3	F140 P141 F146	F140-F144 HydrophobicContact CD1-CB 4.1Å; P141-F144 PolarHBondContact O-N 3.05Å; F144-F146 HydrophobicContact CD1-CD2 4.14Å; F144-F146 AromaticContact CD1-CE2 3.46Å; F144-F146 HydrophobicContact CD1-CE2 3.46Å; F144-F146 VanDerWaalsContact CD1-CE2 3.46Å; F144-F146 AromaticContact CD1-CZ 3.87Å; F144-F146 HydrophobicContact CD1-CZ 3.87Å; F144-F146 HydrophobicContact CE1-CE1 4.38Å; F144-F146 AromaticContact CE1-CE2 3.68Å; F144-F146 HydrophobicContact CE1-CE2 3.68Å; F144-F146 AromaticContact CE1-CZ 3.55Å; F144-F146 HydrophobicContact CE1-CZ 3.55Å
145	Q	25.9	Very low	27.2	Very low	114 Å²	114	134.7 Å²	134.7	53%	0.533	67%	0.667	S	S	.	*			trans	-123.4	134.9	176.4	-70.6	-177.2	-1.1	0	0	109.3
146	F	27.1	Very low	27	Very low	139 Å²	139	140.4 Å²	140.4	61%	0.61	69%	0.687	S	S	*	*			trans	-111.6	134.7	170.7	-76.7	-84.2	0	0	0	110	F140 F144	F140-F146 HydrophobicContact CE1-CD2 4.14Å; F140-F146 AromaticContact CE1-CE2 3.92Å; F140-F146 HydrophobicContact CE1-CE2 3.92Å; F144-F146 HydrophobicContact CD1-CD2 4.14Å; F144-F146 AromaticContact CD1-CE2 3.46Å; F144-F146 HydrophobicContact CD1-CE2 3.46Å; F144-F146 VanDerWaalsContact CD1-CE2 3.46Å; F144-F146 AromaticContact CD1-CZ 3.87Å; F144-F146 HydrophobicContact CD1-CZ 3.87Å; F144-F146 HydrophobicContact CE1-CE1 4.38Å; F144-F146 AromaticContact CE1-CE2 3.68Å; F144-F146 HydrophobicContact CE1-CE2 3.68Å; F144-F146 AromaticContact CE1-CZ 3.55Å; F144-F146 HydrophobicContact CE1-CZ 3.55Å
147	Q	25.1	Very low	26.8	Very low	155 Å²	155	143.2 Å²	143.2	72%	0.724	71%	0.708	S	S	*	*			trans	-110.7	134.9	174.8	-72.3	-178.3	-3.4	0	0	110.2
148	L	26	Very low	26.6	Very low	115 Å²	115	149.4 Å²	149.4	60%	0.602	73%	0.73	S	S	*	*			trans	-100.9	137.5	168.5	-97.1	112.2	0	0	0	110.3	G173	L148-G173 VanDerWaalsContact CD1-O 3.27Å; L148-G173 WeakPolarHBondContact CD1-O 3.02Å; L148-G173 WeakPolarHBondContact CD2-O 3.42Å; L148-G173 WeakPolarHBondContact CG-O 3.46Å
149	R	24.6	Very low	26.7	Very low	237 Å²	237	147.6 Å²	147.6	89%	0.894	73%	0.726	S	S	*	*			trans	-124.5	133.6	160.9	-99.9	-171.2	173.8	179.5	1.5	109.5
150	T	27.9	Very low	26.5	Very low	118 Å²	118	151.3 Å²	151.3	72%	0.724	74%	0.741	S	S	*	*			trans	-99.5	125.8	168.3	46.8	0	0	0	0	109.3	D152	T150-D152 PolarHBondContact O-N 2.95Å
151	D	25.4	Very low	26.3	Very low	164 Å²	164	148 Å²	148	88%	0.877	74%	0.74	S	S	*	*	S	Bend	trans	-73.3	80.3	165.7	-78.8	-24.6	0	0	0	108.9
152	D	28	Very low	26.2	Very low	143 Å²	143	149.1 Å²	149.1	77%	0.765	74%	0.742	S	S	*	*	S	Bend	trans	170.3	128.6	141.9	-97.6	-29.2	0	0	0	106.9	T150	T150-D152 PolarHBondContact O-N 2.95Å
153	Q	29	Very low	26.3	Very low	181 Å²	181	143.9 Å²	143.9	85%	0.846	73%	0.728	S	S	*	*			trans	82.6	81	175	-43.6	-155	6.5	0	0	116.8	K155	Q153-K155 PolarHBondContact O-N 2.7Å
154	L	25.3	Very low	26.3	Very low	168 Å²	168	141.5 Å²	141.5	88%	0.88	71%	0.714	S	S	*	*			trans	-29.4	128.9	135.2	-85.8	150.1	0	0	0	111.5
155	K	25	Very low	26.2	Very low	194 Å²	194	144.8 Å²	144.8	84%	0.843	73%	0.73	S	S	*	*			trans	96.9	81.1	166.2	-55	172.2	179.9	178	0	116.6	Q153	Q153-K155 PolarHBondContact O-N 2.7Å
156	K	26.9	Very low	26.2	Very low	178 Å²	178	146.6 Å²	146.6	77%	0.774	74%	0.737	S	S	*	*				-170.2	104	123.9	-101.4	165.9	-173	-179.4	0	109.2	F158	K156-F158 HydrophobicContact CB-CD2 4.26Å; K156-F158 HydrophobicContact CB-CE2 3.86Å; K156-F158 HydrophobicContact CD-CE2 4.46Å; K156-F158 HydrophobicContact CD-CZ 4.44Å; K156-F158 PolarHBondContact O-N 3.02Å; K156-F158 VanDerWaalsContact O-N 3.16Å
157	V	26.4	Very low	26.1	Very low	143 Å²	143	143.2 Å²	143.2	87%	0.867	74%	0.741	S	S	*	*			trans	-69.8	104.5	168.4	177	0	0	0	0	106.4	P159	V157-P159 WeakPolarHBondContact O-CD 3.45Å
158	F	26.1	Very low	26	Very low	171 Å²	171	140.3 Å²	140.3	75%	0.75	74%	0.738	S	S	*	*			trans	-82.4	116.9	166.2	-76.4	-86.4	0	0	0	107.4	K156 L160	K156-F158 HydrophobicContact CB-CD2 4.26Å; K156-F158 HydrophobicContact CB-CE2 3.86Å; K156-F158 HydrophobicContact CD-CE2 4.46Å; K156-F158 HydrophobicContact CD-CZ 4.44Å; K156-F158 PolarHBondContact O-N 3.02Å; K156-F158 VanDerWaalsContact O-N 3.16Å; F158-L160 PolarHBondContact O-N 3.17Å
159	P	26.7	Very low	26	Very low	108 Å²	108	139.4 Å²	139.4	70%	0.701	73%	0.731	S	S	*	*			trans	-57.3	135.9	165.5	24.6	-29.4	0	0	0	107.2	V157 G161	V157-P159 WeakPolarHBondContact O-CD 3.45Å; P159-G161 PolarHBondContact O-N 2.97Å
160	L	26	Very low	26.1	Very low	180 Å²	180	135.6 Å²	135.6	94%	0.942	72%	0.717	S	S	*	*			trans	-64.4	68	160.6	-89.8	150.9	0	0	0	107.6	F158	F158-L160 PolarHBondContact O-N 3.17Å
161	G	23.7	Very low	26	Very low	48 Å²	48	136.4 Å²	136.4	50%	0.495	72%	0.722	S	S	.	*			trans	-94	134.5	165.7	0	0	0	0	0	107.1	P159	P159-G161 PolarHBondContact O-N 2.97Å
162	D	26.3	Very low	26.1	Very low	98 Å²	98	136.4 Å²	136.4	52%	0.524	72%	0.715	S	S	.	*			trans	65.8	75.9	167.6	-49.9	-30.2	0	0	0	115.4	I164	D162-I164 HydrophobicContact CB-CD1 4.1Å; D162-I164 HydrophobicContact CB-CG1 3.74Å; D162-I164 PolarHBondContact O-N 3.12Å
163	V	27.9	Very low	25.9	Very low	105 Å²	105	131.7 Å²	131.7	64%	0.636	70%	0.7	S	S	*	*			trans	-66.6	82.8	152.1	-178.7	0	0	0	0	107.2	H165 Y170	V163-H165 PolarHBondContact O-N 2.86Å; V163-Y170 HydrophobicContact CG1-CE1 4.13Å; V163-Y170 WeakPolarHBondContact CG1-OH 3.27Å
164	I	26.2	Very low	25.8	Very low	104 Å²	104	128.6 Å²	128.6	53%	0.533	69%	0.687	S	S	.	*			trans	-76.8	111.4	177.4	-58.7	179.5	0	0	0	108.2	D162 K166 V200	D162-I164 HydrophobicContact CB-CD1 4.1Å; D162-I164 HydrophobicContact CB-CG1 3.74Å; D162-I164 PolarHBondContact O-N 3.12Å; I164-K166 PolarHBondContact O-N 3.29Å; I164-K166 VanDerWaalsContact O-N 3.12Å; I164-V200 HydrophobicContact CD1-CG1 3.62Å
165	H	25.9	Very low	25.7	Very low	177 Å²	177	125.5 Å²	125.5	82%	0.819	68%	0.68	S	S	*	*			trans	-66.5	99.5	172	-157.4	-68.3	0	0	0	109.4	V163	V163-H165 PolarHBondContact O-N 2.86Å
166	K	24.8	Very low	25.7	Very low	152 Å²	152	120.7 Å²	120.7	66%	0.661	67%	0.669	S	S	*	*			trans	-149.8	112.7	164	-111.7	-179.6	-175.8	168.9	0	109.6	I164 E201	I164-K166 PolarHBondContact O-N 3.29Å; I164-K166 VanDerWaalsContact O-N 3.12Å; K166-E201 IonicContact NZ-OE1 3.74Å; K166-E201 PolarHBondContact NZ-OE1 3.47Å
167	G	24.8	Very low	25.5	Very low	69 Å²	69	121.9 Å²	121.9	71%	0.711	67%	0.674	S	S	*	*	S	Bend	trans	57.5	86.5	159.7	0	0	0	0	0	116.9
168	S	23.5	Very low	25.5	Very low	94 Å²	94	119.9 Å²	119.9	66%	0.657	67%	0.666	S	S	*	*	S	Bend	trans	51.9	108.1	151.8	73.6	0	0	0	0	117.4
169	H	25.6	Very low	25.4	Very low	95 Å²	95	117.6 Å²	117.6	44%	0.44	67%	0.672	S	S	.	*			trans	101.1	130.8	158.2	-48.1	78.6	0	0	0	117.8	R134	R134-H169 PolarHBondContact NH1-CE1 3.43Å; R134-H169 PolarHBondContact NH1-ND1 3.4Å; R134-H169 PolarHBondContact NH1-NE2 3.16Å
170	Y	26	Very low	25.2	Very low	157 Å²	157	117 Å²	117	62%	0.616	67%	0.667	S	S	*	*			trans	-106.8	145.6	163.2	-63.3	-85.6	0	0	0	108.7	V163	V163-Y170 HydrophobicContact CG1-CE1 4.13Å; V163-Y170 WeakPolarHBondContact CG1-OH 3.27Å
171	V	26.6	Very low	25.2	Very low	136 Å²	136	115.4 Å²	115.4	82%	0.824	66%	0.659	S	S	*	*			trans	-124.3	131.4	179.4	-179.3	0	0	0	0	109.3
172	F	26.6	Very low	25.1	Very low	164 Å²	164	120 Å²	120	72%	0.719	68%	0.682	S	S	*	*			trans	-133	135.4	174.3	-62.9	-84.7	0	0	0	110
173	G	24.5	Very low	24.8	Very low	44 Å²	44	119.6 Å²	119.6	45%	0.454	69%	0.686	S	S	.	*			trans	-111.8	151.4	178	0	0	0	0	0	112.8	L148	L148-G173 VanDerWaalsContact CD1-O 3.27Å; L148-G173 WeakPolarHBondContact CD1-O 3.02Å; L148-G173 WeakPolarHBondContact CD2-O 3.42Å; L148-G173 WeakPolarHBondContact CG-O 3.46Å
174	I	26.7	Very low	24.5	Very low	115 Å²	115	123.1 Å²	123.1	59%	0.59	70%	0.696	S	S	*	*			trans	-129	131.7	-179.7	-53.3	175.5	0	0	0	109.3	F122	F122-I174 HydrophobicContact CE2-CD1 4.33Å; F122-I174 HydrophobicContact CZ-CD1 4.42Å
175	S	24.2	Very low	24.4	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	71%	0.706	S	S	*	*			trans	-105.4	132.2	174.5	-175	0	0	0	0	110.8
176	P	23.6	Very low	24.2	Very low	94 Å²	94	125 Å²	125	61%	0.61	71%	0.709	S	S	*	*			trans	-82.6	151.9	168.2	33.1	-28	0	0	0	110.1
177	F	23.3	Very low	24.1	Very low	203 Å²	203	121.7 Å²	121.7	89%	0.89	70%	0.701	S	S	*	*			trans	100.9	99.9	173.6	-54.3	-72.1	0	0	0	117.5
178	S	25.6	Very low	24.1	Very low	100 Å²	100	128.3 Å²	128.3	70%	0.699	71%	0.71	S	S	*	*			trans	-164.2	126	133.3	174.7	0	0	0	0	109.9
179	S	24.4	Very low	24.1	Very low	124 Å²	124	131.2 Å²	131.2	87%	0.867	72%	0.718	S	S	*	*			trans	-97.4	21.4	-175.5	57.9	0	0	0	0	113.7
180	T	23.6	Very low	24	Very low	96 Å²	96	130.5 Å²	130.5	59%	0.589	74%	0.736	S	S	*	*			trans	-139.1	124.8	-171.8	47.6	0	0	0	0	112.6
181	N	25.3	Very low	23.9	Very low	146 Å²	146	133 Å²	133	78%	0.781	75%	0.75	S	S	*	*			trans	87.7	83.7	161.9	-57.6	-16.7	0	0	0	117.3	S183	N181-S183 PolarHBondContact O-N 2.69Å; N181-S183 VanDerWaalsContact O-N 3.17Å
182	C	21.2	Very low	23.9	Very low	145 Å²	145	135.9 Å²	135.9	98%	0.98	75%	0.754	S	S	*	*			trans	-59.8	99	145.1	-62.2	0	0	0	0	109.5
183	S	21.3	Very low	23.9	Very low	88 Å²	88	136.4 Å²	136.4	62%	0.615	76%	0.759	S	S	*	*			trans	-153.4	110.4	158.6	47.8	0	0	0	0	110.9	N181	N181-S183 PolarHBondContact O-N 2.69Å; N181-S183 VanDerWaalsContact O-N 3.17Å
184	E	20.7	Very low	24	Very low	180 Å²	180	143.2 Å²	143.2	84%	0.841	78%	0.776	S	S	*	*			trans	38.7	110.6	146.9	-59.7	-179.8	156.7	0	0	118.3
185	T	24.4	Very low	24.1	Very low	120 Å²	120	143.3 Å²	143.3	74%	0.736	79%	0.787	S	S	*	*			trans	-153.3	126.5	141.3	-43.6	0	0	0	0	112.8
186	F	21.2	Very low	24.3	Very low	200 Å²	200	146.4 Å²	146.4	88%	0.877	79%	0.788	S	S	*	*			trans	-65.2	150.1	177.2	-80.9	-109.6	0	0	0	114.2
187	V	23.9	Very low	24.9	Very low	83 Å²	83	145.1 Å²	145.1	50%	0.503	78%	0.781	S	S	.	*			trans	-127.7	121.8	163.1	-175.7	0	0	0	0	110.4
188	K	23.7	Very low	25.6	Very low	207 Å²	207	140.5 Å²	140.5	90%	0.9	77%	0.774	S	S	*	*			trans	-97.6	116.2	177.7	-163.4	179.1	-172.8	180	0	108.8
189	L	23.5	Very low	26	Very low	156 Å²	156	142.9 Å²	142.9	82%	0.817	77%	0.774	S	S	*	*			trans	-82	118.1	173.7	-73.9	168.7	0	0	0	110.2
190	G	23.8	Very low	26.4	Very low	80 Å²	80	140.1 Å²	140.1	83%	0.825	75%	0.751	S	S	*	*			trans	-107.6	127.7	171.5	0	0	0	0	0	111.1
191	K	24.8	Very low	26.7	Very low	209 Å²	209	142 Å²	142	91%	0.909	75%	0.753	S	S	*	*			trans	-94.6	125.6	174.8	-148.9	-173.5	-169.6	-172.9	0	107.5
192	Q	25.3	Very low	27	Very low	196 Å²	196	143 Å²	143	92%	0.916	75%	0.754	S	S	*	*			trans	-158.9	132.6	157.7	-130.9	175.5	3.7	0	0	115.1
193	E	26	Very low	27.6	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.822	75%	0.747	S	S	*	*			trans	-68	135	164.8	-61.4	166.1	148.5	0	0	110.5
194	K	28.3	Very low	28	Very low	186 Å²	186	146.8 Å²	146.8	81%	0.809	75%	0.747	S	S	*	*			trans	168.8	142.7	133	-91.7	167.7	-175	-174	0	112
195	S	27.3	Very low	28.5	Very low	117 Å²	117	146.1 Å²	146.1	82%	0.818	75%	0.75	S	S	*	*			trans	-53.9	141.5	175.4	47.3	0	0	0	0	114.8
196	F	29.5	Very low	28.5	Very low	169 Å²	169	143.6 Å²	143.6	74%	0.741	75%	0.747	S	S	*	*			trans	-120.7	155.1	171.7	-79.9	-79.6	0	0	0	113.6
197	S	35.6	Very low	28.6	Very low	67 Å²	67	137.5 Å²	137.5	47%	0.469	74%	0.741	S	S	.	*			trans	-86.8	168.4	-154.9	55.1	0	0	0	0	115.7	E199	S197-E199 PolarHBondContact O-N 3.37Å
198	S	37.2	Very low	28.7	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-59.2	-1.4	179.6	48.2	0	0	0	0	116.6	V200	S198-V200 VanDerWaalsContact C-N 3.35Å
199	E	34.1	Very low	28.6	Very low	151 Å²	151	143.4 Å²	143.4	71%	0.706	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-82.2	-9.1	-179.3	-77	175.8	136.3	0	0	114.1	S197	S197-E199 PolarHBondContact O-N 3.37Å
200	V	33.7	Very low	28.6	Very low	65 Å²	65	145.8 Å²	145.8	39%	0.394	76%	0.755	S	S	.	*	G	3₁₀ helix	trans	-85.2	-18.3	178.9	-176.7	0	0	0	0	112.2	I164 S198	I164-V200 HydrophobicContact CD1-CG1 3.62Å; S198-V200 VanDerWaalsContact C-N 3.35Å
201	E	30.7	Very low	28.7	Very low	135 Å²	135	155.1 Å²	155.1	63%	0.631	77%	0.773	S	S	*	*	S	Bend	trans	-78.9	-17.8	-177.4	-76	-164.8	129.6	0	0	115	K166	K166-E201 IonicContact NZ-OE1 3.74Å; K166-E201 PolarHBondContact NZ-OE1 3.47Å
202	E	30.9	Very low	28.9	Very low	168 Å²	168	152.5 Å²	152.5	79%	0.785	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-91.5	-11.1	-177.6	-89.2	-174.3	153.5	0	0	115.5
203	K	33.8	Very low	29.1	Very low	193 Å²	193	150.2 Å²	150.2	84%	0.839	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-90.8	6.5	-178.6	-75.5	-177.8	-179.9	171.8	0	114.9
204	L	30.5	Very low	29.3	Very low	119 Å²	119	148.7 Å²	148.7	62%	0.623	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-90.1	5.8	-179.3	-75.1	163.8	0	0	0	114.5	G206	L204-G206 PolarHBondContact O-N 2.95Å
205	N	29.9	Very low	29.3	Very low	167 Å²	167	146.5 Å²	146.5	89%	0.893	75%	0.752	S	S	*	*	S	Bend	trans	-92.8	24.4	-176.4	-89.1	-18.2	0	0	0	115.6
206	G	24.7	Very low	29.4	Very low	66 Å²	66	148.4 Å²	148.4	68%	0.68	75%	0.748	S	S	*	*	S	Bend	trans	-147.2	93.5	-174.9	0	0	0	0	0	115.3	L204	L204-G206 PolarHBondContact O-N 2.95Å
207	G	23.5	Very low	29.4	Very low	72 Å²	72	147 Å²	147	74%	0.742	75%	0.748	S	S	*	*			trans	69.8	96.3	145.1	0	0	0	0	0	118.3
208	F	24.9	Very low	29	Very low	180 Å²	180	152.7 Å²	152.7	79%	0.789	77%	0.768	S	S	*	*			trans	-91.2	136	158.7	-74.5	-89.3	0	0	0	110.3
209	Y	23.2	Very low	28.4	Very low	235 Å²	235	156.4 Å²	156.4	92%	0.922	77%	0.771	S	S	*	*			trans	-113.7	129	157.2	-77.7	-86.7	0	0	0	108.3
210	Y	23.2	Very low	27.9	Very low	206 Å²	206	156.8 Å²	156.8	81%	0.808	78%	0.776	S	S	*	*			trans	-84.6	143.5	177.4	-95.5	-99.6	0	0	0	111.4
211	F	25.7	Very low	27.4	Very low	276 Å²	276	165.2 Å²	165.2	100%	1.211	81%	0.811	S	S	*	*			trans	-127.7	0	132.9	-72.1	-77.5	0	0	0	107.7

Retrieved 211 of 211 residues in 209.1 ms (Link to these results)

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