A0A077ZKH2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKH2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 179 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	35	Very low	33.3	Very low	231 Å²	231	126.5 Å²	126.5	100%	1.138	76%	0.755	S	S	*	*				0	99.7	0	-71.9	175.1	175.7	0	0	108.8	L3	M1-L3 PolarHBondContact O-N 2.96Å
2	L	35.5	Very low	33	Very low	168 Å²	168	122.1 Å²	122.1	88%	0.88	73%	0.73	S	S	*	*			trans	36.9	17.7	163.2	-70.1	166.7	0	0	0	121.9
3	L	34.3	Very low	32.6	Very low	173 Å²	173	121.4 Å²	121.4	91%	0.906	72%	0.716	S	S	*	*	S	Bend	trans	-108.1	-9.8	176.4	-115.1	112.4	0	0	0	114	M1	M1-L3 PolarHBondContact O-N 2.96Å
4	G	33.5	Very low	32.4	Very low	86 Å²	86	117.4 Å²	117.4	89%	0.887	69%	0.686	S	S	*	*	S	Bend	trans	-94.9	-2.3	-175.4	0	0	0	0	0	116.1
5	A	36.3	Very low	32.4	Very low	72 Å²	72	113.9 Å²	113.9	60%	0.595	67%	0.67	S	S	*	*	S	Bend	trans	-106.2	12.8	-170.6	0	0	0	0	0	114.6	I7	A5-I7 HydrophobicContact CB-CD1 4.11Å; A5-I7 HydrophobicContact CB-CG1 4.09Å; A5-I7 WeakPolarHBondContact O-CG1 3.33Å; A5-I7 PolarHBondContact O-N 3.14Å; A5-I7 VanDerWaalsContact O-N 3.07Å
6	G	31.6	Very low	32.4	Very low	73 Å²	73	113.8 Å²	113.8	75%	0.753	67%	0.665	S	S	*	*			trans	65.1	13.7	176.7	0	0	0	0	0	115.1	S8	G6-S8 PolarHBondContact O-N 3.43Å
7	I	32.5	Very low	32.6	Very low	119 Å²	119	109.4 Å²	109.4	61%	0.61	64%	0.638	S	S	*	*			trans	-80.7	76.4	-178.3	-51.7	174.7	0	0	0	109	A5	A5-I7 HydrophobicContact CB-CD1 4.11Å; A5-I7 HydrophobicContact CB-CG1 4.09Å; A5-I7 WeakPolarHBondContact O-CG1 3.33Å; A5-I7 PolarHBondContact O-N 3.14Å; A5-I7 VanDerWaalsContact O-N 3.07Å
8	S	31.7	Very low	32.9	Very low	93 Å²	93	104.5 Å²	104.5	65%	0.65	61%	0.608	S	S	*	*			trans	-100	111	165.5	171.2	0	0	0	0	107.4	G6	G6-S8 PolarHBondContact O-N 3.43Å
9	R	33.2	Very low	33.1	Very low	190 Å²	190	105.2 Å²	105.2	72%	0.717	61%	0.614	S	S	*	*	S	Bend	trans	129.5	141.8	154.2	-69	159.3	176	-161.4	-2.8	114.3	V11 T12	R9-V11 HydrophobicContact CB-CB 4.38Å; R9-V11 HydrophobicContact CB-CG2 4.02Å; R9-V11 PolarHBondContact O-N 3.35Å; R9-T12 PolarHBondContact O-OG1 3.06Å
10	P	32.9	Very low	33.5	Very low	93 Å²	93	109.1 Å²	109.1	60%	0.604	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	6.7	174.8	25.6	-34.6	0	0	0	115.3
11	V	30.1	Very low	33.8	Very low	94 Å²	94	105.7 Å²	105.7	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-79.2	-25.2	-176.7	-178.4	0	0	0	0	111.4	R9	R9-V11 HydrophobicContact CB-CB 4.38Å; R9-V11 HydrophobicContact CB-CG2 4.02Å; R9-V11 PolarHBondContact O-N 3.35Å
12	T	29.1	Very low	34.2	Very low	73 Å²	73	97.9 Å²	97.9	45%	0.448	57%	0.568	S	S	.	*	H	α-helix	trans	-75.1	-26.4	-176.7	-8.6	0	0	0	0	113.8	R9	R9-T12 PolarHBondContact O-OG1 3.06Å
13	M	27.6	Very low	34.7	Very low	113 Å²	113	92.7 Å²	92.7	56%	0.557	54%	0.544	S	S	*	.	H	α-helix	trans	-74.7	-37.2	179.3	-71.2	-108.6	-71.8	0	0	112.1	C15 N16 I17	M13-C15 PolarHBondContact O-N 3.31Å; M13-N16 PolarHBondContact O-N 3.1Å; M13-I17 PolarHBondContact O-N 3.43Å
14	F	30.5	Very low	35.4	Very low	65 Å²	65	89.6 Å²	89.6	29%	0.285	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-40.3	-179.2	-163.4	-104.5	0	0	0	111.7	I17 L18 A33 L51	F14-I17 PolarHBondContact O-N 3.06Å; F14-L18 HydrophobicContact CD1-CD1 3.63Å; F14-L18 HydrophobicContact CD1-CG 4.47Å; F14-L18 HydrophobicContact CE1-CD1 3.43Å; F14-L18 VanDerWaalsContact CE1-CD1 3.43Å; F14-L18 HydrophobicContact CE1-CG 4.32Å; F14-L18 HydrophobicContact CZ-CD1 4.17Å; F14-L18 WeakPolarHBondContact O-CG 3.35Å; F14-L18 PolarHBondContact O-N 3.34Å; F14-A33 HydrophobicContact CZ-CB 3.87Å; F14-L51 HydrophobicContact CE2-CD2 4.31Å
15	C	32.1	Very low	36	Very low	66 Å²	66	89.5 Å²	89.5	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-66	-38.1	176.5	-62.8	0	0	0	0	112.5	M13 I17 L18 V19	M13-C15 PolarHBondContact O-N 3.31Å; C15-I17 VanDerWaalsContact C-N 3.34Å; C15-I17 PolarHBondContact O-N 3.33Å; C15-L18 PolarHBondContact O-N 3.34Å; C15-V19 WeakPolarHBondContact O-CG2 3.29Å; C15-V19 PolarHBondContact O-N 3.18Å; C15-V19 VanDerWaalsContact O-N 3.15Å
16	N	32.8	Very low	36.3	Very low	111 Å²	111	89.6 Å²	89.6	59%	0.594	49%	0.489	S	S	*	.	H	α-helix	trans	-69.7	-27.9	-179.2	-77.3	-13.1	0	0	0	113.8	M13	M13-N16 PolarHBondContact O-N 3.1Å
17	I	36.3	Very low	37.2	Very low	40 Å²	40	95.1 Å²	95.1	21%	0.205	49%	0.487	C	S	.	.	H	α-helix	trans	-78.7	-39.5	176.6	-65.6	169.6	0	0	0	110.4	M13 F14 C15 V19 K20 L48 L55	M13-I17 PolarHBondContact O-N 3.43Å; F14-I17 PolarHBondContact O-N 3.06Å; C15-I17 VanDerWaalsContact C-N 3.34Å; C15-I17 PolarHBondContact O-N 3.33Å; I17-V19 VanDerWaalsContact C-N 3.3Å; I17-V19 PolarHBondContact O-N 3.36Å; I17-K20 WeakPolarHBondContact O-CB 3.4Å; I17-K20 PolarHBondContact O-N 2.68Å; I17-L48 HydrophobicContact CD1-CD2 3.85Å; I17-L55 HydrophobicContact CG2-CD1 4Å
18	L	37.8	Very low	38	Very low	21 Å²	21	92.9 Å²	92.9	11%	0.11	48%	0.478	C	S	.	.	H	α-helix	trans	-69	-26.1	178.6	-69.5	175.5	0	0	0	113.6	F14 C15 K20 F21 F26 V29	F14-L18 HydrophobicContact CD1-CD1 3.63Å; F14-L18 HydrophobicContact CD1-CG 4.47Å; F14-L18 HydrophobicContact CE1-CD1 3.43Å; F14-L18 VanDerWaalsContact CE1-CD1 3.43Å; F14-L18 HydrophobicContact CE1-CG 4.32Å; F14-L18 HydrophobicContact CZ-CD1 4.17Å; F14-L18 WeakPolarHBondContact O-CG 3.35Å; F14-L18 PolarHBondContact O-N 3.34Å; C15-L18 PolarHBondContact O-N 3.34Å; L18-K20 PolarHBondContact O-N 2.78Å; L18-F21 PolarHBondContact O-N 3.43Å; L18-F26 HydrophobicContact CB-CD2 4.37Å; L18-F26 HydrophobicContact CB-CE2 3.96Å; L18-V29 HydrophobicContact CD2-CG1 3.82Å
19	V	37	Very low	38.8	Very low	118 Å²	118	89.5 Å²	89.5	72%	0.715	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.8	174.9	170.2	0	0	0	0	112.5	C15 I17 F21	C15-V19 WeakPolarHBondContact O-CG2 3.29Å; C15-V19 PolarHBondContact O-N 3.18Å; C15-V19 VanDerWaalsContact O-N 3.15Å; I17-V19 VanDerWaalsContact C-N 3.3Å; I17-V19 PolarHBondContact O-N 3.36Å; V19-F21 VanDerWaalsContact C-N 3.32Å
20	K	41.2	Very low	39.5	Very low	182 Å²	182	85.5 Å²	85.5	79%	0.791	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.3	176.3	-65.9	-173.9	176.6	-174.1	0	113.6	I17 L18	I17-K20 WeakPolarHBondContact O-CB 3.4Å; I17-K20 PolarHBondContact O-N 2.68Å; L18-K20 PolarHBondContact O-N 2.78Å
21	F	38.9	Very low	40.4	Very low	39 Å²	39	86 Å²	86	17%	0.171	44%	0.436	C	S	.	.	S	Bend	trans	-82.1	134.2	179.6	-90.5	-84.4	0	0	0	111.2	L18 V19 Q25 V29 L55	L18-F21 PolarHBondContact O-N 3.43Å; V19-F21 VanDerWaalsContact C-N 3.32Å; F21-Q25 HydrophobicContact CD1-CB 3.68Å; F21-Q25 VanDerWaalsContact CD1-OE1 3.25Å; F21-Q25 HydrophobicContact CE1-CB 4.37Å; F21-V29 HydrophobicContact CD1-CG2 4.08Å; F21-V29 HydrophobicContact CE1-CG2 3.88Å; F21-V29 HydrophobicContact CZ-CG2 4.2Å; F21-L55 HydrophobicContact CE2-CD2 3.58Å; F21-L55 HydrophobicContact CZ-CD2 3.29Å
22	P	44.4	Very low	41.3	Very low	67 Å²	67	84.3 Å²	84.3	44%	0.435	42%	0.424	S	S	.	.			trans	-51.5	135.4	164.7	-24	33.4	0	0	0	109.2	E24 Q25 F26	P22-E24 PolarHBondContact O-N 2.96Å; P22-Q25 WeakPolarHBondContact O-CA 3.47Å; P22-Q25 PolarHBondContact O-N 3.45Å; P22-F26 PolarHBondContact O-N 3.45Å
23	P	45.9	Very low	42.3	Very low	59 Å²	59	81.1 Å²	81.1	38%	0.383	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-16.1	-171.6	16.8	-27.7	0	0	0	114.6	F26 Y141	P23-F26 WeakPolarHBondContact O-CB 3.37Å; P23-Y141 HydrophobicContact CB-CD1 3.56Å; P23-Y141 HydrophobicContact CB-CD2 4.04Å; P23-Y141 HydrophobicContact CB-CE1 3.38Å; P23-Y141 HydrophobicContact CB-CE2 3.86Å; P23-Y141 HydrophobicContact CB-CG 3.88Å; P23-Y141 HydrophobicContact CG-CD1 4.16Å; P23-Y141 HydrophobicContact CG-CD2 3.77Å; P23-Y141 HydrophobicContact CG-CE1 3.75Å; P23-Y141 HydrophobicContact CG-CE2 3.31Å; P23-Y141 HydrophobicContact CG-CG 4.16Å
24	E	47.5	Very low	43.4	Very low	107 Å²	107	80.3 Å²	80.3	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-35.9	166	-62.1	-53.4	143.7	0	0	113.9	P22 Y141	P22-E24 PolarHBondContact O-N 2.96Å; E24-Y141 VanDerWaalsContact CD-OH 3.23Å; E24-Y141 VanDerWaalsContact CG-OH 3.27Å; E24-Y141 WeakPolarHBondContact CG-OH 3.46Å; E24-Y141 VanDerWaalsContact OE1-CE1 3.25Å; E24-Y141 WeakPolarHBondContact OE1-CE1 3.24Å; E24-Y141 PolarHBondContact OE1-OH 3.34Å
25	Q	47.4	Very low	44.3	Very low	84 Å²	84	84.3 Å²	84.3	39%	0.393	42%	0.416	S	S	.	.	H	α-helix	trans	-86.3	-18.3	178.4	-64.8	179.3	15	0	0	112	F21 P22 R27 V28 V29	F21-Q25 HydrophobicContact CD1-CB 3.68Å; F21-Q25 VanDerWaalsContact CD1-OE1 3.25Å; F21-Q25 HydrophobicContact CE1-CB 4.37Å; P22-Q25 WeakPolarHBondContact O-CA 3.47Å; P22-Q25 PolarHBondContact O-N 3.45Å; Q25-R27 VanDerWaalsContact C-N 3.29Å; Q25-R27 PolarHBondContact O-N 2.94Å; Q25-V28 PolarHBondContact O-N 3.31Å; Q25-V29 WeakPolarHBondContact O-CB 3.2Å; Q25-V29 VanDerWaalsContact O-CG2 3.25Å; Q25-V29 WeakPolarHBondContact O-CG2 3.42Å; Q25-V29 PolarHBondContact O-N 2.87Å
26	F	42.8	Very low	44.9	Very low	74 Å²	74	83.1 Å²	83.1	33%	0.325	41%	0.405	S	S	.	.	H	α-helix	trans	-60.4	-36	178.9	-175.6	-97.3	0	0	0	112.4	L18 P22 P23 K30	L18-F26 HydrophobicContact CB-CD2 4.37Å; L18-F26 HydrophobicContact CB-CE2 3.96Å; P22-F26 PolarHBondContact O-N 3.45Å; P23-F26 WeakPolarHBondContact O-CB 3.37Å; F26-K30 HydrophobicContact CD1-CD 4.31Å; F26-K30 HydrophobicContact CE1-CD 3.74Å; F26-K30 HydrophobicContact CZ-CD 4.24Å; F26-K30 WeakPolarHBondContact O-CA 3.37Å; F26-K30 WeakPolarHBondContact O-CB 3.38Å; F26-K30 PolarHBondContact O-N 2.87Å
27	R	49.1	Very low	45.5	Very low	189 Å²	189	82 Å²	82	71%	0.713	40%	0.398	S	S	*	.	H	α-helix	trans	-69.2	-44.6	179.1	-73.2	-176.8	176.9	-114.6	1.2	112.3	Q25 Q31	Q25-R27 VanDerWaalsContact C-N 3.29Å; Q25-R27 PolarHBondContact O-N 2.94Å; R27-Q31 WeakPolarHBondContact O-CB 3.13Å; R27-Q31 VanDerWaalsContact O-CG 3.31Å; R27-Q31 WeakPolarHBondContact O-CG 3.27Å; R27-Q31 PolarHBondContact O-N 3.23Å
28	V	49.1	Very low	46	Very low	72 Å²	72	83.4 Å²	83.4	44%	0.436	42%	0.422	S	S	.	.	H	α-helix	trans	-68	-47.9	179.1	-179.1	0	0	0	0	110.2	Q25 K30 Q31 L32	Q25-V28 PolarHBondContact O-N 3.31Å; V28-K30 VanDerWaalsContact C-N 3.34Å; V28-K30 PolarHBondContact O-N 2.95Å; V28-Q31 PolarHBondContact O-N 3.36Å; V28-L32 VanDerWaalsContact O-CB 3.25Å; V28-L32 WeakPolarHBondContact O-CB 3.4Å; V28-L32 PolarHBondContact O-N 3.13Å
29	V	49.5	Very low	46.4	Very low	23 Å²	23	92.9 Å²	92.9	14%	0.139	46%	0.456	C	S	.	.	H	α-helix	trans	-65.9	-36.5	178.4	176.1	0	0	0	0	111.4	L18 F21 Q25 A33	L18-V29 HydrophobicContact CD2-CG1 3.82Å; F21-V29 HydrophobicContact CD1-CG2 4.08Å; F21-V29 HydrophobicContact CE1-CG2 3.88Å; F21-V29 HydrophobicContact CZ-CG2 4.2Å; Q25-V29 WeakPolarHBondContact O-CB 3.2Å; Q25-V29 VanDerWaalsContact O-CG2 3.25Å; Q25-V29 WeakPolarHBondContact O-CG2 3.42Å; Q25-V29 PolarHBondContact O-N 2.87Å; V29-A33 WeakPolarHBondContact O-CB 3.34Å; V29-A33 PolarHBondContact O-N 3.49Å
30	K	48.6	Very low	46.8	Very low	106 Å²	106	90.2 Å²	90.2	46%	0.461	44%	0.437	S	S	.	.	H	α-helix	trans	-68.3	-40.5	174.5	-178.2	176.5	179.6	-179.8	0	112.1	F26 V28 N34	F26-K30 HydrophobicContact CD1-CD 4.31Å; F26-K30 HydrophobicContact CE1-CD 3.74Å; F26-K30 HydrophobicContact CZ-CD 4.24Å; F26-K30 WeakPolarHBondContact O-CA 3.37Å; F26-K30 WeakPolarHBondContact O-CB 3.38Å; F26-K30 PolarHBondContact O-N 2.87Å; V28-K30 VanDerWaalsContact C-N 3.34Å; V28-K30 PolarHBondContact O-N 2.95Å; K30-N34 WeakPolarHBondContact O-CB 3.4Å; K30-N34 PolarHBondContact O-N 3.18Å; K30-N34 PolarHBondContact O-ND2 3.46Å
31	Q	51	Low	47.2	Very low	103 Å²	103	90.1 Å²	90.1	48%	0.481	45%	0.446	S	S	.	.	H	α-helix	trans	-67.8	-42.8	175.1	-78.2	-178.1	-18.2	0	0	111.4	R27 V28 N34 R35	R27-Q31 WeakPolarHBondContact O-CB 3.13Å; R27-Q31 VanDerWaalsContact O-CG 3.31Å; R27-Q31 WeakPolarHBondContact O-CG 3.27Å; R27-Q31 PolarHBondContact O-N 3.23Å; V28-Q31 PolarHBondContact O-N 3.36Å; Q31-N34 PolarHBondContact O-N 2.93Å; Q31-R35 WeakPolarHBondContact O-CB 3.44Å; Q31-R35 WeakPolarHBondContact O-CG 3.5Å; Q31-R35 PolarHBondContact O-N 3.44Å
32	L	48.8	Very low	47.9	Very low	59 Å²	59	90.3 Å²	90.3	31%	0.309	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-47.7	174.8	-161.3	86.7	0	0	0	110.9	V28 R35 L36 L70 Y74	V28-L32 VanDerWaalsContact O-CB 3.25Å; V28-L32 WeakPolarHBondContact O-CB 3.4Å; V28-L32 PolarHBondContact O-N 3.13Å; L32-R35 PolarHBondContact O-N 2.78Å; L32-L36 HydrophobicContact CD2-CD1 4.29Å; L32-L36 HydrophobicContact CG-CD1 4.14Å; L32-L36 WeakPolarHBondContact O-CB 3.25Å; L32-L36 WeakPolarHBondContact O-CD1 3.46Å; L32-L36 WeakPolarHBondContact O-CG 3.31Å; L32-L36 PolarHBondContact O-N 3.4Å; L32-L70 HydrophobicContact CD1-CD2 4.48Å; L32-Y74 HydrophobicContact CD1-CE2 4.32Å
33	A	49.4	Very low	48.3	Very low	6 Å²	6	89.7 Å²	89.7	5%	0.05	45%	0.448	C	S	.	.	H	α-helix	trans	-62.4	-43.4	176.1	0	0	0	0	0	112.6	F14 V29 R35 L36 I37	F14-A33 HydrophobicContact CZ-CB 3.87Å; V29-A33 WeakPolarHBondContact O-CB 3.34Å; V29-A33 PolarHBondContact O-N 3.49Å; A33-R35 VanDerWaalsContact C-N 3.33Å; A33-R35 PolarHBondContact O-N 3.21Å; A33-L36 PolarHBondContact O-N 3.29Å; A33-I37 WeakPolarHBondContact O-CB 3.31Å; A33-I37 WeakPolarHBondContact O-CD1 3.43Å; A33-I37 WeakPolarHBondContact O-CG1 3.35Å; A33-I37 PolarHBondContact O-N 3.36Å
34	N	50.4	Low	48	Very low	95 Å²	95	90 Å²	90	51%	0.508	45%	0.45	S	S	.	.	H	α-helix	trans	-65.3	-35.7	176.5	-77.6	-24.4	0	0	0	112.3	K30 Q31 G38	K30-N34 WeakPolarHBondContact O-CB 3.4Å; K30-N34 PolarHBondContact O-N 3.18Å; K30-N34 PolarHBondContact O-ND2 3.46Å; Q31-N34 PolarHBondContact O-N 2.93Å; N34-G38 PolarHBondContact O-N 3.4Å
35	R	49.5	Very low	47.7	Very low	150 Å²	150	89.3 Å²	89.3	57%	0.566	46%	0.457	S	S	*	.	H	α-helix	trans	-72.2	-35.7	174.5	-77.7	-174.1	159.7	167.6	-5.8	112.4	Q31 L32 A33 G38 E77	Q31-R35 WeakPolarHBondContact O-CB 3.44Å; Q31-R35 WeakPolarHBondContact O-CG 3.5Å; Q31-R35 PolarHBondContact O-N 3.44Å; L32-R35 PolarHBondContact O-N 2.78Å; A33-R35 VanDerWaalsContact C-N 3.33Å; A33-R35 PolarHBondContact O-N 3.21Å; R35-G38 PolarHBondContact O-N 2.84Å; R35-E77 IonicContact CZ-OE1 3.47Å; R35-E77 VanDerWaalsContact CZ-OE1 3.26Å; R35-E77 IonicContact CZ-OE2 2.74Å; R35-E77 IonicContact NE-OE1 3.26Å; R35-E77 IonicContact NH1-OE1 2.82Å; R35-E77 PolarHBondContact NH1-OE1 2.91Å; R35-E77 IonicContact NH1-OE2 3.66Å; R35-E77 PolarHBondContact NH1-OE2 2.95Å
36	L	45.8	Very low	47.8	Very low	41 Å²	41	92.4 Å²	92.4	22%	0.215	47%	0.47	C	S	.	.	H	α-helix	trans	-69.6	-32	173.2	-71.6	167	0	0	0	112.5	L32 A33 G38 R39 L40	L32-L36 HydrophobicContact CD2-CD1 4.29Å; L32-L36 HydrophobicContact CG-CD1 4.14Å; L32-L36 WeakPolarHBondContact O-CB 3.25Å; L32-L36 WeakPolarHBondContact O-CD1 3.46Å; L32-L36 WeakPolarHBondContact O-CG 3.31Å; L32-L36 PolarHBondContact O-N 3.4Å; A33-L36 PolarHBondContact O-N 3.29Å; L36-G38 VanDerWaalsContact C-N 3.26Å; L36-G38 PolarHBondContact O-N 3.31Å; L36-R39 PolarHBondContact O-N 3.48Å; L36-L40 HydrophobicContact CD2-CD1 4.12Å
37	I	44.3	Very low	47.9	Very low	88 Å²	88	93.3 Å²	93.3	45%	0.451	47%	0.471	S	S	.	.	H	α-helix	trans	-62.6	-33.2	173.6	-75.4	161.7	0	0	0	111.5	A33	A33-I37 WeakPolarHBondContact O-CB 3.31Å; A33-I37 WeakPolarHBondContact O-CD1 3.43Å; A33-I37 WeakPolarHBondContact O-CG1 3.35Å; A33-I37 PolarHBondContact O-N 3.36Å
38	G	48.5	Very low	47.6	Very low	68 Å²	68	85.7 Å²	85.7	70%	0.701	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.3	-178.4	0	0	0	0	0	115.8	N34 R35 L36	N34-G38 PolarHBondContact O-N 3.4Å; R35-G38 PolarHBondContact O-N 2.84Å; L36-G38 VanDerWaalsContact C-N 3.26Å; L36-G38 PolarHBondContact O-N 3.31Å
39	R	45.1	Very low	47.6	Very low	221 Å²	221	84 Å²	84	83%	0.834	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	-2.9	-168.4	-75.5	-165.5	136.2	179.2	-2.9	116.3	L36	L36-R39 PolarHBondContact O-N 3.48Å
40	L	44.7	Very low	47.6	Very low	61 Å²	61	90 Å²	90	32%	0.319	46%	0.462	S	S	.	.			trans	-126.6	107.3	-174.3	-69.8	163.5	0	0	0	110.9	L36 I42	L36-L40 HydrophobicContact CD2-CD1 4.12Å; L40-I42 HydrophobicContact CB-CB 4.18Å; L40-I42 HydrophobicContact CB-CD1 3.99Å; L40-I42 HydrophobicContact CB-CG1 3.97Å; L40-I42 HydrophobicContact CD2-CD1 3.54Å; L40-I42 HydrophobicContact CD2-CG1 4.31Å; L40-I42 HydrophobicContact CG-CD1 4.23Å; L40-I42 PolarHBondContact O-N 3.13Å
41	D	50	Low	47.4	Very low	181 Å²	181	86.5 Å²	86.5	97%	0.968	45%	0.448	S	S	*	.			trans	-69.5	46.1	172.4	-134.9	-1.3	0	0	0	111.5
42	I	54.8	Low	47.1	Very low	43 Å²	43	85.6 Å²	85.6	22%	0.221	44%	0.444	C	S	.	.			trans	-121	133	-163.6	-61.9	-174.6	0	0	0	110	L40 K46 R47	L40-I42 HydrophobicContact CB-CB 4.18Å; L40-I42 HydrophobicContact CB-CD1 3.99Å; L40-I42 HydrophobicContact CB-CG1 3.97Å; L40-I42 HydrophobicContact CD2-CD1 3.54Å; L40-I42 HydrophobicContact CD2-CG1 4.31Å; L40-I42 HydrophobicContact CG-CD1 4.23Å; L40-I42 PolarHBondContact O-N 3.13Å; I42-K46 HydrophobicContact CG2-CB 3.3Å; I42-K46 HydrophobicContact CG2-CD 4.09Å; I42-K46 HydrophobicContact CG2-CG 4.33Å; I42-R47 HydrophobicContact CB-CG 4.34Å; I42-R47 HydrophobicContact CG2-CG 4.24Å; I42-R47 PolarHBondContact O-NE 3.31Å; I42-R47 PolarHBondContact O-NH2 3.42Å
43	A	51.5	Low	47.2	Very low	53 Å²	53	85.6 Å²	85.6	44%	0.438	45%	0.448	S	S	.	.			trans	-48.5	138.8	176.4	0	0	0	0	0	112.1	S45 K46 R47	A43-S45 PolarHBondContact O-N 3.49Å; A43-K46 PolarHBondContact O-N 3.45Å; A43-R47 PolarHBondContact O-N 3.06Å
44	P	41	Very low	47.2	Very low	65 Å²	65	89.4 Å²	89.4	42%	0.422	47%	0.467	S	S	.	.	H	α-helix	trans	-48.9	-37.4	-177.5	-23.7	28	0	0	0	114.6	R47 L48	P44-R47 WeakPolarHBondContact O-CB 3.48Å; P44-R47 PolarHBondContact O-N 3.26Å; P44-L48 PolarHBondContact O-N 3.2Å; P44-L48 VanDerWaalsContact O-N 3.13Å
45	S	39.9	Very low	47	Very low	94 Å²	94	87 Å²	87	66%	0.657	45%	0.454	S	S	*	.	H	α-helix	trans	-67.6	-34.9	179.3	17.5	0	0	0	0	113.3	A43 G49	A43-S45 PolarHBondContact O-N 3.49Å; S45-G49 PolarHBondContact O-N 3.4Å
46	K	49.3	Very low	46.9	Very low	149 Å²	149	85.7 Å²	85.7	65%	0.648	46%	0.458	S	S	*	.	H	α-helix	trans	-75.2	-27.6	174.2	-79.1	-175.8	179.7	-177.1	0	112.3	I42 A43 R50	I42-K46 HydrophobicContact CG2-CB 3.3Å; I42-K46 HydrophobicContact CG2-CD 4.09Å; I42-K46 HydrophobicContact CG2-CG 4.33Å; A43-K46 PolarHBondContact O-N 3.45Å; K46-R50 PolarHBondContact O-N 3.5Å
47	R	45.1	Very low	46.8	Very low	92 Å²	92	89.3 Å²	89.3	35%	0.347	47%	0.474	S	S	.	.	H	α-helix	trans	-68.2	-44.7	174	-73.6	-178.8	-87	169.4	-5.3	111.5	I42 A43 P44 R50 L51	I42-R47 HydrophobicContact CB-CG 4.34Å; I42-R47 HydrophobicContact CG2-CG 4.24Å; I42-R47 PolarHBondContact O-NE 3.31Å; I42-R47 PolarHBondContact O-NH2 3.42Å; A43-R47 PolarHBondContact O-N 3.06Å; P44-R47 WeakPolarHBondContact O-CB 3.48Å; P44-R47 PolarHBondContact O-N 3.26Å; R47-R50 PolarHBondContact O-N 2.72Å; R47-L51 WeakPolarHBondContact O-CB 3.48Å; R47-L51 PolarHBondContact O-N 3.21Å
48	L	42.5	Very low	46.8	Very low	30 Å²	30	88.2 Å²	88.2	16%	0.157	47%	0.468	C	S	.	.	H	α-helix	trans	-61	-47.7	176.2	-102	159.6	0	0	0	112.2	I17 P44 R50 L51 E52	I17-L48 HydrophobicContact CD1-CD2 3.85Å; P44-L48 PolarHBondContact O-N 3.2Å; P44-L48 VanDerWaalsContact O-N 3.13Å; L48-R50 VanDerWaalsContact C-N 3.29Å; L48-R50 PolarHBondContact O-N 3.26Å; L48-L51 PolarHBondContact O-N 2.87Å; L48-L51 VanDerWaalsContact O-N 3.12Å; L48-E52 WeakPolarHBondContact O-CB 3.1Å; L48-E52 VanDerWaalsContact O-CG 3.31Å; L48-E52 WeakPolarHBondContact O-CG 3.09Å; L48-E52 PolarHBondContact O-N 3.3Å
49	G	49.2	Very low	46.5	Very low	37 Å²	37	87.8 Å²	87.8	38%	0.381	46%	0.464	S	S	.	.	H	α-helix	trans	-61.7	-34.7	179.1	0	0	0	0	0	113.9	S45 S53	S45-G49 PolarHBondContact O-N 3.4Å; G49-S53 PolarHBondContact O-N 2.96Å; G49-S53 PolarHBondContact O-OG 3.46Å
50	R	50.6	Low	46.7	Very low	149 Å²	149	83.7 Å²	83.7	56%	0.562	46%	0.459	S	S	*	.	H	α-helix	trans	-73.6	-35.8	174.3	-76.4	-171.8	168.3	-173.2	-3.8	113	K46 R47 L48 S53 L54	K46-R50 PolarHBondContact O-N 3.5Å; R47-R50 PolarHBondContact O-N 2.72Å; L48-R50 VanDerWaalsContact C-N 3.29Å; L48-R50 PolarHBondContact O-N 3.26Å; R50-S53 PolarHBondContact O-OG 3.47Å; R50-L54 WeakPolarHBondContact O-CB 3.26Å; R50-L54 WeakPolarHBondContact O-CD1 3.5Å; R50-L54 VanDerWaalsContact O-CG 3.24Å; R50-L54 WeakPolarHBondContact O-CG 3.37Å; R50-L54 PolarHBondContact O-N 3.22Å; R50-L54 VanDerWaalsContact O-N 3.12Å
51	L	43.9	Very low	46.6	Very low	32 Å²	32	84.4 Å²	84.4	17%	0.168	46%	0.457	C	S	.	.	H	α-helix	trans	-67.4	-45	175.4	-158	97	0	0	0	110	F14 R47 L48 L54 L55	F14-L51 HydrophobicContact CE2-CD2 4.31Å; R47-L51 WeakPolarHBondContact O-CB 3.48Å; R47-L51 PolarHBondContact O-N 3.21Å; L48-L51 PolarHBondContact O-N 2.87Å; L48-L51 VanDerWaalsContact O-N 3.12Å; L51-L54 PolarHBondContact O-N 3.31Å; L51-L55 HydrophobicContact CD2-CD1 3.82Å; L51-L55 HydrophobicContact CG-CD1 4.04Å; L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.45Å; L51-L55 WeakPolarHBondContact O-CD1 3.49Å; L51-L55 WeakPolarHBondContact O-CG 3.49Å; L51-L55 PolarHBondContact O-N 3.38Å
52	E	44.5	Very low	46.3	Very low	84 Å²	84	82.4 Å²	82.4	39%	0.393	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-39.8	178.1	-72.7	172	171	0	0	112.3	L48 L55 L56	L48-E52 WeakPolarHBondContact O-CB 3.1Å; L48-E52 VanDerWaalsContact O-CG 3.31Å; L48-E52 WeakPolarHBondContact O-CG 3.09Å; L48-E52 PolarHBondContact O-N 3.3Å; E52-L55 PolarHBondContact O-N 3.31Å; E52-L56 WeakPolarHBondContact O-CD1 3.25Å; E52-L56 PolarHBondContact O-N 3.01Å
53	S	51	Low	45.8	Very low	58 Å²	58	83.6 Å²	83.6	41%	0.406	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-41.6	174.9	65.3	0	0	0	0	112.3	G49 R50 L55 E57	G49-S53 PolarHBondContact O-N 2.96Å; G49-S53 PolarHBondContact O-OG 3.46Å; R50-S53 PolarHBondContact O-OG 3.47Å; S53-L55 VanDerWaalsContact C-N 3.35Å; S53-E57 PolarHBondContact O-N 3.09Å
54	L	49.5	Very low	45.5	Very low	86 Å²	86	85.2 Å²	85.2	45%	0.45	46%	0.459	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175	-75	168.2	0	0	0	111.4	R50 L51 E57 L58	R50-L54 WeakPolarHBondContact O-CB 3.26Å; R50-L54 WeakPolarHBondContact O-CD1 3.5Å; R50-L54 VanDerWaalsContact O-CG 3.24Å; R50-L54 WeakPolarHBondContact O-CG 3.37Å; R50-L54 PolarHBondContact O-N 3.22Å; R50-L54 VanDerWaalsContact O-N 3.12Å; L51-L54 PolarHBondContact O-N 3.31Å; L54-E57 PolarHBondContact O-N 2.51Å; L54-L58 VanDerWaalsContact O-CB 3.3Å; L54-L58 WeakPolarHBondContact O-CB 3.48Å; L54-L58 PolarHBondContact O-N 2.9Å
55	L	46.8	Very low	46.1	Very low	45 Å²	45	86.5 Å²	86.5	24%	0.236	46%	0.459	C	S	.	.	H	α-helix	trans	-67.7	-35	-179.6	-75	169.6	0	0	0	113.4	I17 F21 L51 E52 S53	I17-L55 HydrophobicContact CG2-CD1 4Å; F21-L55 HydrophobicContact CE2-CD2 3.58Å; F21-L55 HydrophobicContact CZ-CD2 3.29Å; L51-L55 HydrophobicContact CD2-CD1 3.82Å; L51-L55 HydrophobicContact CG-CD1 4.04Å; L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.45Å; L51-L55 WeakPolarHBondContact O-CD1 3.49Å; L51-L55 WeakPolarHBondContact O-CG 3.49Å; L51-L55 PolarHBondContact O-N 3.38Å; E52-L55 PolarHBondContact O-N 3.31Å; S53-L55 VanDerWaalsContact C-N 3.35Å
56	L	47.6	Very low	46.5	Very low	123 Å²	123	83.9 Å²	83.9	64%	0.644	44%	0.438	S	S	*	.	H	α-helix	trans	-66.6	-39.1	174.4	-88.6	152.9	0	0	0	111.8	E52	E52-L56 WeakPolarHBondContact O-CD1 3.25Å; E52-L56 PolarHBondContact O-N 3.01Å
57	E	44.1	Very low	46.4	Very low	117 Å²	117	79.7 Å²	79.7	55%	0.547	42%	0.418	S	S	.	.	H	α-helix	trans	-79.2	-27.5	177.6	-66.5	-178.2	177.9	0	0	112.3	S53 L54 G59 W61	S53-E57 PolarHBondContact O-N 3.09Å; L54-E57 PolarHBondContact O-N 2.51Å; E57-G59 VanDerWaalsContact C-N 3.3Å; E57-G59 PolarHBondContact O-N 2.71Å; E57-W61 PolarHBondContact O-NE1 2.86Å; E57-W61 VanDerWaalsContact O-NE1 3.12Å
58	L	44	Very low	46.8	Very low	64 Å²	64	76.6 Å²	76.6	34%	0.335	41%	0.414	S	S	.	.	H	α-helix	trans	-67	-27.5	180	-133.7	69.2	0	0	0	114	L54 D60 W61 L66	L54-L58 VanDerWaalsContact O-CB 3.3Å; L54-L58 WeakPolarHBondContact O-CB 3.48Å; L54-L58 PolarHBondContact O-N 2.9Å; L58-D60 VanDerWaalsContact C-N 3.29Å; L58-D60 PolarHBondContact O-N 2.74Å; L58-W61 HydrophobicContact CD1-CE3 4.32Å; L58-W61 HydrophobicContact CD1-CZ3 4.46Å; L58-W61 PolarHBondContact O-N 3.41Å; L58-L66 HydrophobicContact CD1-CD1 3.4Å; L58-L66 VanDerWaalsContact CD1-CD1 3.4Å; L58-L66 HydrophobicContact CD2-CD1 3.85Å; L58-L66 HydrophobicContact CG-CD1 3.37Å
59	G	42.4	Very low	47.3	Very low	60 Å²	60	78.2 Å²	78.2	62%	0.619	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-26.1	-174.6	0	0	0	0	0	114.4	E57	E57-G59 VanDerWaalsContact C-N 3.3Å; E57-G59 PolarHBondContact O-N 2.71Å
60	D	48.3	Very low	47.2	Very low	135 Å²	135	79 Å²	79	72%	0.722	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-3.9	-177.3	-67.2	-35.2	0	0	0	113.2	L58	L58-D60 VanDerWaalsContact C-N 3.29Å; L58-D60 PolarHBondContact O-N 2.74Å
61	W	42.5	Very low	47.4	Very low	75 Å²	75	77.9 Å²	77.9	28%	0.284	42%	0.418	S	S	.	.			trans	-82.8	128	-173.6	-75.6	21.6	0	0	0	111.2	E57 L58 Q65 L66 Q69	E57-W61 PolarHBondContact O-NE1 2.86Å; E57-W61 VanDerWaalsContact O-NE1 3.12Å; L58-W61 HydrophobicContact CD1-CE3 4.32Å; L58-W61 HydrophobicContact CD1-CZ3 4.46Å; L58-W61 PolarHBondContact O-N 3.41Å; W61-Q65 HydrophobicContact CB-CB 4.14Å; W61-Q65 HydrophobicContact CD2-CB 4.35Å; W61-Q65 HydrophobicContact CG-CB 4.23Å; W61-L66 HydrophobicContact CE3-CB 4.2Å; W61-Q69 HydrophobicContact CE3-CB 4.21Å; W61-Q69 HydrophobicContact CE3-CG 4.17Å; W61-Q69 HydrophobicContact CH2-CB 3.59Å; W61-Q69 HydrophobicContact CH2-CG 3.23Å; W61-Q69 HydrophobicContact CZ2-CG 4.14Å; W61-Q69 HydrophobicContact CZ3-CB 3.2Å; W61-Q69 HydrophobicContact CZ3-CG 3.27Å
62	K	44.6	Very low	47.9	Very low	140 Å²	140	82 Å²	82	61%	0.609	44%	0.439	S	S	*	.			trans	-58.5	148.4	163.3	-66.1	178	-177.6	176.7	0	108.3	S64 Q65 L66	K62-S64 PolarHBondContact O-N 3.49Å; K62-Q65 HydrophobicContact CB-CG 4.24Å; K62-Q65 WeakPolarHBondContact O-CA 2.9Å; K62-Q65 WeakPolarHBondContact O-CB 3.25Å; K62-Q65 PolarHBondContact O-N 2.86Å; K62-L66 PolarHBondContact O-N 3.06Å; K62-L66 VanDerWaalsContact O-N 3.1Å
63	P	43.8	Very low	47.9	Very low	68 Å²	68	83.9 Å²	83.9	44%	0.442	45%	0.446	S	S	.	.	H	α-helix	trans	-47.4	-41.6	174.6	-30.1	35.6	0	0	0	112.6	Q65 L66 Y67 W86	P63-Q65 VanDerWaalsContact C-N 3.33Å; P63-Q65 PolarHBondContact O-N 3.19Å; P63-L66 WeakPolarHBondContact O-CB 3.35Å; P63-L66 PolarHBondContact O-N 3.07Å; P63-Y67 VanDerWaalsContact O-CD2 3.25Å; P63-Y67 WeakPolarHBondContact O-CD2 3.25Å; P63-Y67 PolarHBondContact O-N 2.87Å; P63-W86 HydrophobicContact CB-CZ3 4.48Å
64	S	45.2	Very low	47.7	Very low	86 Å²	86	84.7 Å²	84.7	60%	0.601	44%	0.44	S	S	*	.	H	α-helix	trans	-61.9	-32.2	175.8	52.3	0	0	0	0	115	K62 G68	K62-S64 PolarHBondContact O-N 3.49Å; S64-G68 PolarHBondContact O-N 2.92Å
65	Q	53.1	Low	47.6	Very low	92 Å²	92	84.5 Å²	84.5	43%	0.43	44%	0.444	S	S	.	.	H	α-helix	trans	-75.8	-39.8	177.2	-65.7	173.5	-76.9	0	0	111.2	W61 K62 P63 G68 Q69	W61-Q65 HydrophobicContact CB-CB 4.14Å; W61-Q65 HydrophobicContact CD2-CB 4.35Å; W61-Q65 HydrophobicContact CG-CB 4.23Å; K62-Q65 HydrophobicContact CB-CG 4.24Å; K62-Q65 WeakPolarHBondContact O-CA 2.9Å; K62-Q65 WeakPolarHBondContact O-CB 3.25Å; K62-Q65 PolarHBondContact O-N 2.86Å; P63-Q65 VanDerWaalsContact C-N 3.33Å; P63-Q65 PolarHBondContact O-N 3.19Å; Q65-G68 PolarHBondContact O-N 3.13Å; Q65-Q69 WeakPolarHBondContact O-CB 3.4Å; Q65-Q69 VanDerWaalsContact O-CG 3.26Å; Q65-Q69 WeakPolarHBondContact O-CG 3.12Å; Q65-Q69 PolarHBondContact O-N 3.3Å
66	L	49	Very low	47.7	Very low	40 Å²	40	89.9 Å²	89.9	21%	0.209	47%	0.473	C	S	.	.	H	α-helix	trans	-59.9	-46.7	171.7	-171.5	116.5	0	0	0	111.8	L58 W61 K62 P63 Q69 L70	L58-L66 HydrophobicContact CD1-CD1 3.4Å; L58-L66 VanDerWaalsContact CD1-CD1 3.4Å; L58-L66 HydrophobicContact CD2-CD1 3.85Å; L58-L66 HydrophobicContact CG-CD1 3.37Å; W61-L66 HydrophobicContact CE3-CB 4.2Å; K62-L66 PolarHBondContact O-N 3.06Å; K62-L66 VanDerWaalsContact O-N 3.1Å; P63-L66 WeakPolarHBondContact O-CB 3.35Å; P63-L66 PolarHBondContact O-N 3.07Å; L66-Q69 PolarHBondContact O-N 2.84Å; L66-L70 HydrophobicContact CD2-CD1 3.67Å; L66-L70 HydrophobicContact CG-CD1 4.06Å; L66-L70 WeakPolarHBondContact O-CB 3.25Å; L66-L70 VanDerWaalsContact O-CG 3.25Å; L66-L70 WeakPolarHBondContact O-CG 3.28Å; L66-L70 PolarHBondContact O-N 3.14Å
67	Y	45.9	Very low	47.6	Very low	61 Å²	61	87.4 Å²	87.4	24%	0.239	46%	0.458	C	S	.	.	H	α-helix	trans	-65.7	-45.4	176.7	-89.2	-88.2	0	0	0	112.6	P63 Q69 L70 E71 C83 W86	P63-Y67 VanDerWaalsContact O-CD2 3.25Å; P63-Y67 WeakPolarHBondContact O-CD2 3.25Å; P63-Y67 PolarHBondContact O-N 2.87Å; Y67-Q69 PolarHBondContact O-N 2.86Å; Y67-L70 PolarHBondContact O-N 2.81Å; Y67-E71 VanDerWaalsContact O-CB 3.28Å; Y67-E71 WeakPolarHBondContact O-CB 3.24Å; Y67-E71 PolarHBondContact O-N 3.07Å; Y67-C83 HydrophobicContact CE1-CB 4.35Å; Y67-W86 HydrophobicContact CD2-CZ3 4.49Å; Y67-W86 HydrophobicContact CE2-CD2 4.22Å; Y67-W86 AromaticContact CE2-CE3 3.42Å; Y67-W86 HydrophobicContact CE2-CE3 3.42Å; Y67-W86 VanDerWaalsContact CE2-CE3 3.42Å; Y67-W86 HydrophobicContact CE2-CH2 4.32Å; Y67-W86 AromaticContact CE2-CZ3 3.49Å; Y67-W86 HydrophobicContact CE2-CZ3 3.49Å; Y67-W86 VanDerWaalsContact CE2-CZ3 3.49Å; Y67-W86 AromaticContact CZ-CE3 3.66Å; Y67-W86 VanDerWaalsContact OH-CB 3.31Å; Y67-W86 WeakPolarHBondContact OH-CB 3.41Å
68	G	55.3	Low	47.5	Very low	26 Å²	26	83.6 Å²	83.6	27%	0.268	45%	0.447	S	S	.	.	H	α-helix	trans	-60.1	-32.6	176.9	0	0	0	0	0	112.6	S64 Q65 I72	S64-G68 PolarHBondContact O-N 2.92Å; Q65-G68 PolarHBondContact O-N 3.13Å; G68-I72 VanDerWaalsContact O-CD1 3.24Å; G68-I72 WeakPolarHBondContact O-CD1 3.39Å; G68-I72 WeakPolarHBondContact O-CG1 3.21Å; G68-I72 PolarHBondContact O-N 3.28Å; G68-I72 VanDerWaalsContact O-N 3.14Å
69	Q	53	Low	47.5	Very low	65 Å²	65	87.7 Å²	87.7	30%	0.304	47%	0.469	S	S	.	.	H	α-helix	trans	-78.7	-39.7	176.5	-75	-85.2	-39.2	0	0	112.3	W61 Q65 L66 Y67 E71 I72 F73	W61-Q69 HydrophobicContact CE3-CB 4.21Å; W61-Q69 HydrophobicContact CE3-CG 4.17Å; W61-Q69 HydrophobicContact CH2-CB 3.59Å; W61-Q69 HydrophobicContact CH2-CG 3.23Å; W61-Q69 HydrophobicContact CZ2-CG 4.14Å; W61-Q69 HydrophobicContact CZ3-CB 3.2Å; W61-Q69 HydrophobicContact CZ3-CG 3.27Å; Q65-Q69 WeakPolarHBondContact O-CB 3.4Å; Q65-Q69 VanDerWaalsContact O-CG 3.26Å; Q65-Q69 WeakPolarHBondContact O-CG 3.12Å; Q65-Q69 PolarHBondContact O-N 3.3Å; L66-Q69 PolarHBondContact O-N 2.84Å; Y67-Q69 PolarHBondContact O-N 2.86Å; Q69-E71 VanDerWaalsContact C-N 3.3Å; Q69-E71 PolarHBondContact O-N 3.32Å; Q69-I72 PolarHBondContact O-N 2.91Å; Q69-F73 HydrophobicContact CB-CD2 4.49Å; Q69-F73 HydrophobicContact CB-CE2 4.44Å; Q69-F73 WeakPolarHBondContact O-CD2 3.41Å; Q69-F73 PolarHBondContact O-N 3.48Å; Q69-F73 VanDerWaalsContact OE1-CE2 3.26Å
70	L	46.1	Very low	47.6	Very low	54 Å²	54	87 Å²	87	28%	0.283	46%	0.455	S	S	.	.	H	α-helix	trans	-62.5	-37.6	172.2	-73.4	171.1	0	0	0	111.9	L32 L66 Y67 F73 Y74	L32-L70 HydrophobicContact CD1-CD2 4.48Å; L66-L70 HydrophobicContact CD2-CD1 3.67Å; L66-L70 HydrophobicContact CG-CD1 4.06Å; L66-L70 WeakPolarHBondContact O-CB 3.25Å; L66-L70 VanDerWaalsContact O-CG 3.25Å; L66-L70 WeakPolarHBondContact O-CG 3.28Å; L66-L70 PolarHBondContact O-N 3.14Å; Y67-L70 PolarHBondContact O-N 2.81Å; L70-F73 PolarHBondContact O-N 3.02Å; L70-Y74 HydrophobicContact CD2-CD2 4.1Å; L70-Y74 HydrophobicContact CD2-CE2 4.24Å; L70-Y74 WeakPolarHBondContact O-CA 2.99Å; L70-Y74 WeakPolarHBondContact O-CB 3.13Å; L70-Y74 PolarHBondContact O-N 3.18Å
71	E	54.3	Low	47	Very low	125 Å²	125	85.7 Å²	85.7	58%	0.584	45%	0.452	S	S	*	.	H	α-helix	trans	-65.4	-38.5	174.5	-173.1	175.7	-166.7	0	0	111.7	Y67 Q69 P75 A78	Y67-E71 VanDerWaalsContact O-CB 3.28Å; Y67-E71 WeakPolarHBondContact O-CB 3.24Å; Y67-E71 PolarHBondContact O-N 3.07Å; Q69-E71 VanDerWaalsContact C-N 3.3Å; Q69-E71 PolarHBondContact O-N 3.32Å; E71-P75 WeakPolarHBondContact O-CA 3.37Å; E71-A78 HydrophobicContact CG-CB 4.4Å
72	I	55.6	Low	46.8	Very low	119 Å²	119	86.6 Å²	86.6	61%	0.61	46%	0.461	S	S	*	.	H	α-helix	trans	-66.7	-42.3	173.4	-70.7	162.4	0	0	0	111.7	G68 Q69	G68-I72 VanDerWaalsContact O-CD1 3.24Å; G68-I72 WeakPolarHBondContact O-CD1 3.39Å; G68-I72 WeakPolarHBondContact O-CG1 3.21Å; G68-I72 PolarHBondContact O-N 3.28Å; G68-I72 VanDerWaalsContact O-N 3.14Å; Q69-I72 PolarHBondContact O-N 2.91Å
73	F	44.2	Very low	46.2	Very low	123 Å²	123	81.3 Å²	81.3	54%	0.539	44%	0.442	S	S	.	.	H	α-helix	trans	-82	-27.5	-176.4	-73.5	-61.9	0	0	0	113.6	Q69 L70	Q69-F73 HydrophobicContact CB-CD2 4.49Å; Q69-F73 HydrophobicContact CB-CE2 4.44Å; Q69-F73 WeakPolarHBondContact O-CD2 3.41Å; Q69-F73 PolarHBondContact O-N 3.48Å; Q69-F73 VanDerWaalsContact OE1-CE2 3.26Å; L70-F73 PolarHBondContact O-N 3.02Å
74	Y	45.6	Very low	45.6	Very low	75 Å²	75	84.3 Å²	84.3	29%	0.294	45%	0.45	S	S	.	.			trans	-141.8	67.1	-171.4	-52.8	-78.5	0	0	0	111	L32 L70 D76 E77	L32-Y74 HydrophobicContact CD1-CE2 4.32Å; L70-Y74 HydrophobicContact CD2-CD2 4.1Å; L70-Y74 HydrophobicContact CD2-CE2 4.24Å; L70-Y74 WeakPolarHBondContact O-CA 2.99Å; L70-Y74 WeakPolarHBondContact O-CB 3.13Å; L70-Y74 PolarHBondContact O-N 3.18Å; Y74-D76 PolarHBondContact O-N 3.35Å; Y74-E77 PolarHBondContact O-N 3.33Å
75	P	48.1	Very low	45	Very low	82 Å²	82	85.5 Å²	85.5	53%	0.532	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-59.3	-31.5	-178.2	24	-34.4	0	0	0	112.7	E71 E77	E71-P75 WeakPolarHBondContact O-CA 3.37Å; P75-E77 VanDerWaalsContact C-N 3.3Å; P75-E77 PolarHBondContact O-N 2.87Å
76	D	49	Very low	44.1	Very low	157 Å²	157	85 Å²	85	84%	0.84	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-76.4	-12.1	-180	-63.7	-35.9	0	0	0	114	Y74	Y74-D76 PolarHBondContact O-N 3.35Å
77	E	45.4	Very low	43.4	Very low	71 Å²	71	89.9 Å²	89.9	33%	0.332	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-105.9	-9.1	-176.6	-62.3	-165.6	-174.5	0	0	113.4	R35 Y74 P75 D79 S80	R35-E77 IonicContact CZ-OE1 3.47Å; R35-E77 VanDerWaalsContact CZ-OE1 3.26Å; R35-E77 IonicContact CZ-OE2 2.74Å; R35-E77 IonicContact NE-OE1 3.26Å; R35-E77 IonicContact NH1-OE1 2.82Å; R35-E77 PolarHBondContact NH1-OE1 2.91Å; R35-E77 IonicContact NH1-OE2 3.66Å; R35-E77 PolarHBondContact NH1-OE2 2.95Å; Y74-E77 PolarHBondContact O-N 3.33Å; P75-E77 VanDerWaalsContact C-N 3.3Å; P75-E77 PolarHBondContact O-N 2.87Å; E77-D79 VanDerWaalsContact C-N 3.27Å; E77-D79 PolarHBondContact O-N 3.47Å; E77-S80 WeakPolarHBondContact O-CB 3.48Å; E77-S80 PolarHBondContact O-N 2.86Å
78	A	42.1	Very low	43	Very low	38 Å²	38	94.7 Å²	94.7	31%	0.314	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-27.1	177.7	0	0	0	0	0	113.1	E71 S80	E71-A78 HydrophobicContact CG-CB 4.4Å; A78-S80 VanDerWaalsContact C-N 3.29Å; A78-S80 PolarHBondContact O-N 3.35Å
79	D	43.1	Very low	42	Very low	149 Å²	149	98.5 Å²	98.5	80%	0.797	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	4.4	176.8	-75	-26.8	0	0	0	113.7	E77 V81	E77-D79 VanDerWaalsContact C-N 3.27Å; E77-D79 PolarHBondContact O-N 3.47Å; D79-V81 PolarHBondContact O-N 2.81Å
80	S	44.9	Very low	41.2	Very low	47 Å²	47	100.2 Å²	100.2	33%	0.329	51%	0.513	S	S	.	.	S	Bend	trans	-64.2	133.5	176.1	-180	0	0	0	0	110.6	E77 A78 L82 C83	E77-S80 WeakPolarHBondContact O-CB 3.48Å; E77-S80 PolarHBondContact O-N 2.86Å; A78-S80 VanDerWaalsContact C-N 3.29Å; A78-S80 PolarHBondContact O-N 3.35Å; S80-L82 PolarHBondContact O-N 3.28Å; S80-C83 WeakPolarHBondContact O-CB 3.17Å; S80-C83 PolarHBondContact O-N 3.43Å
81	V	37	Very low	40.3	Very low	107 Å²	107	101 Å²	101	65%	0.648	52%	0.523	S	S	*	.	H	α-helix	trans	-47.6	-28.8	174.4	173.4	0	0	0	0	112.5	D79 C83 Q84 E85	D79-V81 PolarHBondContact O-N 2.81Å; V81-C83 VanDerWaalsContact C-N 3.33Å; V81-C83 PolarHBondContact O-N 2.8Å; V81-Q84 PolarHBondContact O-N 3.24Å; V81-E85 PolarHBondContact O-N 3.14Å
82	L	36.9	Very low	39.1	Very low	93 Å²	93	100.3 Å²	100.3	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-29.2	175.9	-64.8	171.7	0	0	0	113.6	S80 W86	S80-L82 PolarHBondContact O-N 3.28Å; L82-W86 WeakPolarHBondContact O-CB 3.46Å; L82-W86 PolarHBondContact O-N 3.46Å
83	C	31.6	Very low	37.7	Very low	29 Å²	29	98.1 Å²	98.1	20%	0.196	51%	0.507	C	S	.	.	H	α-helix	trans	-77.3	-35.1	178.2	-70.4	0	0	0	0	112.4	Y67 S80 V81 L87	Y67-C83 HydrophobicContact CE1-CB 4.35Å; S80-C83 WeakPolarHBondContact O-CB 3.17Å; S80-C83 PolarHBondContact O-N 3.43Å; V81-C83 VanDerWaalsContact C-N 3.33Å; V81-C83 PolarHBondContact O-N 2.8Å; C83-L87 PolarHBondContact O-N 2.78Å
84	Q	31.4	Very low	36.9	Very low	132 Å²	132	98.4 Å²	98.4	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-71.5	-42.1	175.2	-73.7	-175.7	-31.4	0	0	112.1	V81 W86 L87 E88	V81-Q84 PolarHBondContact O-N 3.24Å; Q84-W86 PolarHBondContact O-N 2.8Å; Q84-L87 WeakPolarHBondContact O-CB 3.35Å; Q84-L87 PolarHBondContact O-N 3.36Å; Q84-L87 VanDerWaalsContact O-N 3.13Å; Q84-E88 PolarHBondContact O-N 3.18Å
85	E	33	Very low	36	Very low	111 Å²	111	98.5 Å²	98.5	52%	0.519	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-27.2	177.2	-165.9	174.1	-169.3	0	0	112.2	V81 N89	V81-E85 PolarHBondContact O-N 3.14Å; E85-N89 PolarHBondContact O-ND2 3.22Å
86	W	34.4	Very low	35.2	Very low	80 Å²	80	100.6 Å²	100.6	30%	0.303	53%	0.532	S	S	.	.	H	α-helix	trans	-71	-35	174.4	-134.6	80.5	0	0	0	113	P63 Y67 L82 Q84 H90	P63-W86 HydrophobicContact CB-CZ3 4.48Å; Y67-W86 HydrophobicContact CD2-CZ3 4.49Å; Y67-W86 HydrophobicContact CE2-CD2 4.22Å; Y67-W86 AromaticContact CE2-CE3 3.42Å; Y67-W86 HydrophobicContact CE2-CE3 3.42Å; Y67-W86 VanDerWaalsContact CE2-CE3 3.42Å; Y67-W86 HydrophobicContact CE2-CH2 4.32Å; Y67-W86 AromaticContact CE2-CZ3 3.49Å; Y67-W86 HydrophobicContact CE2-CZ3 3.49Å; Y67-W86 VanDerWaalsContact CE2-CZ3 3.49Å; Y67-W86 AromaticContact CZ-CE3 3.66Å; Y67-W86 VanDerWaalsContact OH-CB 3.31Å; Y67-W86 WeakPolarHBondContact OH-CB 3.41Å; L82-W86 WeakPolarHBondContact O-CB 3.46Å; L82-W86 PolarHBondContact O-N 3.46Å; Q84-W86 PolarHBondContact O-N 2.8Å; W86-H90 AromaticContact CD1-CE1 3.78Å; W86-H90 AromaticContact CD2-CE1 3.96Å; W86-H90 AromaticContact CD2-ND1 3.79Å; W86-H90 AromaticContact CE2-CE1 3.94Å; W86-H90 AromaticContact CG-CE1 3.91Å; W86-H90 AromaticContact CG-ND1 3.89Å; W86-H90 AromaticContact NE1-CE1 3.77Å; W86-H90 PolarHBondContact O-ND1 3.21Å
87	L	34.5	Very low	34.4	Very low	144 Å²	144	100.9 Å²	100.9	75%	0.754	53%	0.532	S	S	*	.	H	α-helix	trans	-71.8	-33.7	180	-97.7	151	0	0	0	112.9	C83 Q84	C83-L87 PolarHBondContact O-N 2.78Å; Q84-L87 WeakPolarHBondContact O-CB 3.35Å; Q84-L87 PolarHBondContact O-N 3.36Å; Q84-L87 VanDerWaalsContact O-N 3.13Å
88	E	37.7	Very low	33.7	Very low	161 Å²	161	102 Å²	102	75%	0.752	54%	0.539	S	S	*	.	H	α-helix	trans	-81.9	-25.7	-176.9	-69.4	-177.7	162.8	0	0	113.7	Q84	Q84-E88 PolarHBondContact O-N 3.18Å
89	N	35.1	Very low	33.4	Very low	106 Å²	106	103.1 Å²	103.1	57%	0.567	55%	0.549	S	S	*	.	H	α-helix	trans	-104	-10.8	-166.6	-72.5	-48.3	0	0	0	116.3	E85 S91	E85-N89 PolarHBondContact O-ND2 3.22Å; N89-S91 PolarHBondContact O-N 2.91Å
90	H	35.9	Very low	33	Very low	102 Å²	102	98.8 Å²	98.8	47%	0.472	53%	0.53	S	S	.	.			trans	-104.2	36.8	-167.7	-68.7	100.7	0	0	0	116.5	W86 R92	W86-H90 AromaticContact CD1-CE1 3.78Å; W86-H90 AromaticContact CD2-CE1 3.96Å; W86-H90 AromaticContact CD2-ND1 3.79Å; W86-H90 AromaticContact CE2-CE1 3.94Å; W86-H90 AromaticContact CG-CE1 3.91Å; W86-H90 AromaticContact CG-ND1 3.89Å; W86-H90 AromaticContact NE1-CE1 3.77Å; W86-H90 PolarHBondContact O-ND1 3.21Å; H90-R92 PolarHBondContact O-N 2.87Å
91	S	26.5	Very low	32.6	Very low	71 Å²	71	102.7 Å²	102.7	50%	0.497	56%	0.557	S	S	.	*			trans	-80.4	93.5	160.1	41.1	0	0	0	0	109.3	N89 H109	N89-S91 PolarHBondContact O-N 2.91Å; S91-H109 PolarHBondContact O-CD2 3.14Å; S91-H109 VanDerWaalsContact O-CD2 3.31Å
92	R	28.5	Very low	32.3	Very low	109 Å²	109	103.6 Å²	103.6	41%	0.411	56%	0.557	S	S	.	*	S	Bend	trans	172.8	110.7	150.1	-91.6	141.1	-146.2	-82	-20.3	115	H90 H109 S110 R111	H90-R92 PolarHBondContact O-N 2.87Å; R92-H109 HydrophobicContact CG-CB 3.87Å; R92-H109 WeakPolarHBondContact CG-O 3.32Å; R92-H109 VanDerWaalsContact CZ-C 3.44Å; R92-H109 PolarHBondContact NE-CD2 3.48Å; R92-H109 VanDerWaalsContact NH1-C 3.35Å; R92-H109 PolarHBondContact NH1-O 3.45Å; R92-H109 PolarHBondContact NH2-CD2 3.29Å; R92-H109 PolarHBondContact NH2-NE2 3.37Å; R92-S110 PolarHBondContact NH2-O 2.88Å; R92-R111 VanDerWaalsContact CZ-CB 3.41Å
93	V	26.8	Very low	32.1	Very low	73 Å²	73	107.9 Å²	107.9	44%	0.442	58%	0.575	S	S	.	*			trans	45.7	92	143.9	-162.6	0	0	0	0	118.5	A107	V93-A107 WeakPolarHBondContact CG1-O 3.18Å; V93-A107 WeakPolarHBondContact CG2-O 3.34Å
94	L	27.2	Very low	32	Very low	130 Å²	130	112.2 Å²	112.2	68%	0.681	60%	0.595	S	S	*	*			trans	-73.6	114	155.3	-76.2	161.2	0	0	0	109
95	A	27.8	Very low	31.9	Very low	77 Å²	77	110.7 Å²	110.7	64%	0.636	60%	0.597	S	S	*	*			trans	-101.7	119.7	162.6	0	0	0	0	0	107.9
96	H	30	Very low	31.9	Very low	125 Å²	125	111.1 Å²	111.1	58%	0.579	60%	0.602	S	S	*	*			trans	-89.4	115.9	179	-159.1	-144.7	0	0	0	108.5	I98 I106	H96-I98 WeakPolarHBondContact ND1-CG1 3.26Å; H96-I98 PolarHBondContact O-N 2.85Å; H96-I106 HydrophobicContact CB-CD1 4.33Å
97	I	31.8	Very low	31.6	Very low	164 Å²	164	110 Å²	110	84%	0.841	61%	0.61	S	S	*	*			trans	-86.5	94.5	168.5	-58.7	174.5	0	0	0	106.3
98	I	32.5	Very low	31.1	Very low	95 Å²	95	112 Å²	112	49%	0.487	61%	0.613	S	S	.	*			trans	-79.9	144.1	168.1	-59.4	174.1	0	0	0	107.2	H96 S100	H96-I98 WeakPolarHBondContact ND1-CG1 3.26Å; H96-I98 PolarHBondContact O-N 2.85Å; I98-S100 PolarHBondContact O-N 3.46Å
99	A	34.1	Very low	30.8	Very low	61 Å²	61	109.1 Å²	109.1	50%	0.504	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	36.9	-175.5	0	0	0	0	0	115.9	I166 L168	A99-I166 HydrophobicContact CB-CD1 4.21Å; A99-I166 HydrophobicContact CB-CG2 4.04Å; A99-L168 HydrophobicContact CB-CD2 4.38Å
100	S	34.5	Very low	30.6	Very low	57 Å²	57	109.4 Å²	109.4	40%	0.399	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.4	22.2	-176	-50.5	0	0	0	0	113.7	I98 I102	I98-S100 PolarHBondContact O-N 3.46Å; S100-I102 PolarHBondContact O-N 3.42Å
101	S	38.4	Very low	30.9	Very low	129 Å²	129	112.5 Å²	112.5	90%	0.902	62%	0.617	S	S	*	*	S	Bend	trans	54.4	21.1	167.8	46.3	0	0	0	0	117.3
102	I	30	Very low	31.8	Very low	126 Å²	126	116.1 Å²	116.1	65%	0.646	63%	0.629	S	S	*	*			trans	-113	114.3	175.2	-64.1	169.1	0	0	0	108.5	S100	S100-I102 PolarHBondContact O-N 3.42Å
103	E	31.6	Very low	32.6	Very low	184 Å²	184	114.6 Å²	114.6	86%	0.86	63%	0.629	S	S	*	*			trans	-85.2	112.4	174.8	-64.9	-176.4	169.8	0	0	109.6
104	N	30.9	Very low	33.7	Very low	119 Å²	119	113.4 Å²	113.4	64%	0.636	62%	0.623	S	S	*	*			trans	-112.4	122.2	168.8	-78.7	-32.1	0	0	0	109.6	I106	N104-I106 PolarHBondContact O-N 3.34Å
105	P	28.4	Very low	34.6	Very low	100 Å²	100	111.2 Å²	111.2	65%	0.649	62%	0.619	S	S	*	*			trans	-74	123	177.3	27.6	-31.3	0	0	0	111.2	F108	P105-F108 HydrophobicContact CB-CE2 4.35Å; P105-F108 HydrophobicContact CB-CZ 4.2Å
106	I	34	Very low	35.9	Very low	121 Å²	121	110.4 Å²	110.4	62%	0.621	61%	0.612	S	S	*	*			trans	-94.2	-22.8	-174.1	-63.2	172.1	0	0	0	113	H96 N104	H96-I106 HydrophobicContact CB-CD1 4.33Å; N104-I106 PolarHBondContact O-N 3.34Å
107	A	26.5	Very low	36.9	Very low	57 Å²	57	107.8 Å²	107.8	47%	0.471	60%	0.601	S	S	.	*			trans	-171.3	161.3	170	0	0	0	0	0	112.1	V93	V93-A107 WeakPolarHBondContact CG1-O 3.18Å; V93-A107 WeakPolarHBondContact CG2-O 3.34Å
108	F	24.9	Very low	37.7	Very low	186 Å²	186	105.6 Å²	105.6	82%	0.816	59%	0.585	S	S	*	*			trans	-121	140.1	172.7	-67.2	-87.5	0	0	0	111.6	P105	P105-F108 HydrophobicContact CB-CE2 4.35Å; P105-F108 HydrophobicContact CB-CZ 4.2Å
109	H	31.6	Very low	38.5	Very low	99 Å²	99	109.3 Å²	109.3	46%	0.458	59%	0.593	S	S	.	*			trans	-145.2	127.3	160.8	-177.4	58.8	0	0	0	109.1	S91 R92	S91-H109 PolarHBondContact O-CD2 3.14Å; S91-H109 VanDerWaalsContact O-CD2 3.31Å; R92-H109 HydrophobicContact CG-CB 3.87Å; R92-H109 WeakPolarHBondContact CG-O 3.32Å; R92-H109 VanDerWaalsContact CZ-C 3.44Å; R92-H109 PolarHBondContact NE-CD2 3.48Å; R92-H109 VanDerWaalsContact NH1-C 3.35Å; R92-H109 PolarHBondContact NH1-O 3.45Å; R92-H109 PolarHBondContact NH2-CD2 3.29Å; R92-H109 PolarHBondContact NH2-NE2 3.37Å
110	S	31.2	Very low	39	Very low	112 Å²	112	110.1 Å²	110.1	78%	0.783	60%	0.599	S	S	*	*			trans	-116.9	131.6	-174.4	69.8	0	0	0	0	111.7	R92	R92-S110 PolarHBondContact NH2-O 2.88Å
111	R	41.6	Very low	39.4	Very low	167 Å²	167	111.1 Å²	111.1	63%	0.63	60%	0.599	S	S	*	*			trans	-141	132.5	-179.4	171.6	178.6	130.8	154.7	-7.3	104.7	R92 E117	R92-R111 VanDerWaalsContact CZ-CB 3.41Å; R111-E117 IonicContact NH2-OE1 3.57Å; R111-E117 IonicContact NH2-OE2 3.26Å
112	I	44.9	Very low	39.4	Very low	148 Å²	148	112.9 Å²	112.9	76%	0.759	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-72.5	125.8	178.3	-60.9	166.6	0	0	0	107.6	S114	I112-S114 PolarHBondContact O-N 3.31Å
113	L	45.9	Very low	39.9	Very low	76 Å²	76	109.4 Å²	109.4	40%	0.398	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-56.9	132.8	173.3	-69.1	169.7	0	0	0	110	E117 K118 M121	L113-E117 HydrophobicContact CB-CB 4.4Å; L113-E117 HydrophobicContact CD2-CB 4.15Å; L113-K118 HydrophobicContact CB-CG 4.15Å; L113-M121 HydrophobicContact CD1-CE 3.69Å; L113-M121 HydrophobicContact CD1-SD 4.14Å; L113-M121 HydrophobicContact CD2-CE 4.45Å
114	S	49.6	Very low	40.3	Very low	48 Å²	48	105.2 Å²	105.2	34%	0.336	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-64	157.8	172.9	68.8	0	0	0	0	111	I112 A116 E117 K118	I112-S114 PolarHBondContact O-N 3.31Å; S114-A116 PolarHBondContact O-N 3.1Å; S114-A116 VanDerWaalsContact O-N 3.14Å; S114-E117 VanDerWaalsContact CB-OE2 3.29Å; S114-E117 WeakPolarHBondContact CB-OE2 3.45Å; S114-E117 PolarHBondContact N-OE2 2.87Å; S114-E117 PolarHBondContact O-N 3.41Å; S114-E117 WeakPolarHBondContact OG-CG 3.38Å; S114-E117 PolarHBondContact OG-N 3.15Å; S114-E117 PolarHBondContact OG-OE2 3.32Å; S114-K118 PolarHBondContact O-N 3.44Å
115	S	45.7	Very low	41.3	Very low	84 Å²	84	106.4 Å²	106.4	59%	0.587	58%	0.577	S	S	*	*	H	α-helix	trans	-62.8	-17.8	176.6	-51.5	0	0	0	0	113.4	R119	S115-R119 WeakPolarHBondContact O-CG 3.16Å; S115-R119 PolarHBondContact O-N 2.81Å; S115-R119 PolarHBondContact O-NE 3.38Å
116	A	55.1	Low	42.7	Very low	60 Å²	60	109.2 Å²	109.2	50%	0.496	59%	0.587	S	S	.	*	H	α-helix	trans	-77.3	-46	174.2	0	0	0	0	0	111	S114 K118 R119 A120	S114-A116 PolarHBondContact O-N 3.1Å; S114-A116 VanDerWaalsContact O-N 3.14Å; A116-K118 VanDerWaalsContact C-N 3.32Å; A116-K118 PolarHBondContact O-N 2.77Å; A116-R119 PolarHBondContact O-N 3.33Å; A116-R119 VanDerWaalsContact O-N 3.1Å; A116-A120 PolarHBondContact O-N 3.43Å
117	E	51.6	Low	44.1	Very low	71 Å²	71	106.9 Å²	106.9	33%	0.332	58%	0.575	S	S	.	*	H	α-helix	trans	-62.3	-40.1	175.9	-68.4	159.9	130.5	0	0	111	R111 L113 S114 R119 A120 M121	R111-E117 IonicContact NH2-OE1 3.57Å; R111-E117 IonicContact NH2-OE2 3.26Å; L113-E117 HydrophobicContact CB-CB 4.4Å; L113-E117 HydrophobicContact CD2-CB 4.15Å; S114-E117 VanDerWaalsContact CB-OE2 3.29Å; S114-E117 WeakPolarHBondContact CB-OE2 3.45Å; S114-E117 PolarHBondContact N-OE2 2.87Å; S114-E117 PolarHBondContact O-N 3.41Å; S114-E117 WeakPolarHBondContact OG-CG 3.38Å; S114-E117 PolarHBondContact OG-N 3.15Å; S114-E117 PolarHBondContact OG-OE2 3.32Å; E117-R119 VanDerWaalsContact C-N 3.28Å; E117-R119 PolarHBondContact O-N 2.9Å; E117-A120 PolarHBondContact O-N 3.39Å; E117-M121 WeakPolarHBondContact O-CG 3.14Å; E117-M121 PolarHBondContact O-N 3.02Å
118	K	48.5	Very low	45.9	Very low	117 Å²	117	107 Å²	107	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-62.8	-30.4	174.1	-70.4	-179.7	-177.9	177.4	0	113.9	L113 S114 A116	L113-K118 HydrophobicContact CB-CG 4.15Å; S114-K118 PolarHBondContact O-N 3.44Å; A116-K118 VanDerWaalsContact C-N 3.32Å; A116-K118 PolarHBondContact O-N 2.77Å
119	R	48.8	Very low	47.6	Very low	174 Å²	174	103.7 Å²	103.7	66%	0.657	57%	0.57	S	S	*	*	H	α-helix	trans	-80.7	-33	178.8	-78.9	-177.9	-76.2	178	0.1	112.3	S115 A116 E117 M121 Q122	S115-R119 WeakPolarHBondContact O-CG 3.16Å; S115-R119 PolarHBondContact O-N 2.81Å; S115-R119 PolarHBondContact O-NE 3.38Å; A116-R119 PolarHBondContact O-N 3.33Å; A116-R119 VanDerWaalsContact O-N 3.1Å; E117-R119 VanDerWaalsContact C-N 3.28Å; E117-R119 PolarHBondContact O-N 2.9Å; R119-M121 PolarHBondContact O-N 2.89Å; R119-Q122 PolarHBondContact O-N 3.21Å
120	A	45.7	Very low	48.8	Very low	77 Å²	77	108.3 Å²	108.3	64%	0.636	58%	0.583	S	S	*	*	H	α-helix	trans	-68.1	-19	173.4	0	0	0	0	0	113.2	A116 E117 Q122	A116-A120 PolarHBondContact O-N 3.43Å; E117-A120 PolarHBondContact O-N 3.39Å; A120-Q122 VanDerWaalsContact C-N 3.28Å; A120-Q122 PolarHBondContact O-N 3.37Å
121	M	41.5	Very low	49.8	Very low	79 Å²	79	105.5 Å²	105.5	39%	0.389	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-2.6	175.9	-68.6	-177.9	174.4	0	0	114.4	L113 E117 R119 T123 I136	L113-M121 HydrophobicContact CD1-CE 3.69Å; L113-M121 HydrophobicContact CD1-SD 4.14Å; L113-M121 HydrophobicContact CD2-CE 4.45Å; E117-M121 WeakPolarHBondContact O-CG 3.14Å; E117-M121 PolarHBondContact O-N 3.02Å; R119-M121 PolarHBondContact O-N 2.89Å; M121-T123 PolarHBondContact O-N 3.41Å; M121-I136 HydrophobicContact CB-CD1 4.3Å; M121-I136 HydrophobicContact CE-CD1 4.26Å; M121-I136 HydrophobicContact CG-CD1 3.67Å; M121-I136 HydrophobicContact CG-CG1 4.44Å; M121-I136 HydrophobicContact SD-CD1 4.37Å
122	Q	38.6	Very low	50.6	Low	165 Å²	165	98.7 Å²	98.7	77%	0.771	54%	0.54	S	S	*	.			trans	-80.9	61.6	176.1	-64.9	-175.5	-5	0	0	110.9	R119 A120	R119-Q122 PolarHBondContact O-N 3.21Å; A120-Q122 VanDerWaalsContact C-N 3.28Å; A120-Q122 PolarHBondContact O-N 3.37Å
123	T	41.2	Very low	51.3	Low	54 Å²	54	101.2 Å²	101.2	33%	0.331	54%	0.54	S	S	.	.			trans	-82.9	147.3	162.5	35.7	0	0	0	0	109.7	M121	M121-T123 PolarHBondContact O-N 3.41Å
124	P	40.3	Very low	51.5	Low	96 Å²	96	104.4 Å²	104.4	62%	0.623	55%	0.547	S	S	*	.			trans	-54.3	145.4	-160	17	-31.2	0	0	0	115	D126	P124-D126 PolarHBondContact O-N 3.43Å
125	V	50.7	Low	51.6	Low	144 Å²	144	103.2 Å²	103.2	87%	0.873	54%	0.539	S	S	*	.	S	Bend	trans	-64.3	7.9	-159.4	-178.7	0	0	0	0	116
126	D	59.7	Low	52.2	Low	159 Å²	159	102.3 Å²	102.3	85%	0.85	53%	0.527	S	S	*	.	S	Bend	trans	-119.4	35	-175.2	-66.1	-41.1	0	0	0	113.8	P124	P124-D126 PolarHBondContact O-N 3.43Å
127	I	62.5	Low	52.3	Low	72 Å²	72	103.6 Å²	103.6	37%	0.369	53%	0.525	S	S	.	.	S	Bend	trans	-122.4	133.6	-177.3	-60	177.2	0	0	0	110.5	T131 A132	I127-T131 HydrophobicContact CG2-CG2 3.44Å; I127-T131 VanDerWaalsContact CG2-CG2 3.44Å; I127-A132 HydrophobicContact CG2-CB 4.3Å
128	S	64.5	Low	52.2	Low	58 Å²	58	102.5 Å²	102.5	41%	0.406	52%	0.521	S	S	.	.			trans	-57.5	146.6	177.4	85.5	0	0	0	0	111	R130 T131 A132	S128-R130 PolarHBondContact O-N 3.25Å; S128-T131 WeakPolarHBondContact O-CA 3.5Å; S128-T131 PolarHBondContact O-N 3.34Å; S128-T131 WeakPolarHBondContact OG-CB 3.5Å; S128-T131 PolarHBondContact OG-N 2.9Å; S128-T131 VanDerWaalsContact OG-N 3.14Å; S128-T131 PolarHBondContact OG-OG1 3.5Å; S128-A132 PolarHBondContact O-N 2.85Å
129	P	60.2	Low	52.5	Low	118 Å²	118	100.8 Å²	100.8	77%	0.766	52%	0.523	S	S	*	.	H	α-helix	trans	-55.1	-33.1	-179.9	-26.4	33.4	0	0	0	113.4	R133	P129-R133 WeakPolarHBondContact O-CB 3.43Å; P129-R133 PolarHBondContact O-N 3.39Å; P129-R133 VanDerWaalsContact O-N 3.13Å
130	R	56.2	Low	52.9	Low	196 Å²	196	96.2 Å²	96.2	74%	0.74	52%	0.523	S	S	*	.	H	α-helix	trans	-64.6	-50.3	174.1	178.8	175.7	-100.9	167.6	-6.3	110.5	S128 A132 R133 W134	S128-R130 PolarHBondContact O-N 3.25Å; R130-A132 PolarHBondContact O-N 3.38Å; R130-R133 PolarHBondContact O-N 2.97Å; R130-W134 PolarHBondContact O-N 3.49Å; R130-W134 VanDerWaalsContact O-N 3.13Å
131	T	52.6	Low	53	Low	52 Å²	52	95.6 Å²	95.6	32%	0.319	51%	0.505	S	S	.	.	H	α-helix	trans	-65.7	-36.8	180	-51.6	0	0	0	0	112	I127 S128 R133 W134 S135 L145	I127-T131 HydrophobicContact CG2-CG2 3.44Å; I127-T131 VanDerWaalsContact CG2-CG2 3.44Å; S128-T131 WeakPolarHBondContact O-CA 3.5Å; S128-T131 PolarHBondContact O-N 3.34Å; S128-T131 WeakPolarHBondContact OG-CB 3.5Å; S128-T131 PolarHBondContact OG-N 2.9Å; S128-T131 VanDerWaalsContact OG-N 3.14Å; S128-T131 PolarHBondContact OG-OG1 3.5Å; T131-R133 PolarHBondContact O-N 3.12Å; T131-W134 PolarHBondContact O-N 3.12Å; T131-S135 WeakPolarHBondContact O-CB 3.28Å; T131-S135 PolarHBondContact O-N 3.33Å; T131-L145 HydrophobicContact CG2-CD2 4.09Å
132	A	59.4	Low	53.7	Low	24 Å²	24	95.1 Å²	95.1	20%	0.198	52%	0.52	C	S	.	.	H	α-helix	trans	-61.9	-44	175.1	0	0	0	0	0	111.4	I127 S128 R130 W134 S135 I136	I127-A132 HydrophobicContact CG2-CB 4.3Å; S128-A132 PolarHBondContact O-N 2.85Å; R130-A132 PolarHBondContact O-N 3.38Å; A132-W134 PolarHBondContact O-N 3.31Å; A132-S135 PolarHBondContact O-N 3.12Å; A132-I136 WeakPolarHBondContact O-CD1 3.44Å; A132-I136 WeakPolarHBondContact O-CG1 3.3Å; A132-I136 PolarHBondContact O-N 2.84Å
133	R	58.7	Low	53.9	Low	202 Å²	202	90.2 Å²	90.2	76%	0.762	50%	0.503	S	S	*	.	H	α-helix	trans	-61.6	-41.8	176.1	-175	174.4	160.9	160.8	-4.3	112.3	P129 R130 T131 L137	P129-R133 WeakPolarHBondContact O-CB 3.43Å; P129-R133 PolarHBondContact O-N 3.39Å; P129-R133 VanDerWaalsContact O-N 3.13Å; R130-R133 PolarHBondContact O-N 2.97Å; T131-R133 PolarHBondContact O-N 3.12Å; R133-L137 PolarHBondContact O-N 2.94Å
134	W	51	Low	54.3	Low	143 Å²	143	94.9 Å²	94.9	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-68.3	-38.6	174.9	-73.5	108.1	0	0	0	112.6	R130 T131 A132 I136 L137 L138	R130-W134 PolarHBondContact O-N 3.49Å; R130-W134 VanDerWaalsContact O-N 3.13Å; T131-W134 PolarHBondContact O-N 3.12Å; A132-W134 PolarHBondContact O-N 3.31Å; W134-I136 PolarHBondContact O-N 2.82Å; W134-L137 HydrophobicContact CE3-CD2 3.95Å; W134-L137 HydrophobicContact CZ3-CD2 3.97Å; W134-L137 PolarHBondContact O-N 2.9Å; W134-L138 WeakPolarHBondContact O-CB 3.06Å; W134-L138 VanDerWaalsContact O-CG 3.26Å; W134-L138 WeakPolarHBondContact O-CG 3.42Å; W134-L138 PolarHBondContact O-N 2.96Å
135	S	51.4	Low	55.1	Low	22 Å²	22	95.3 Å²	95.3	15%	0.154	52%	0.523	C	S	.	.	H	α-helix	trans	-58	-48.4	176.2	169.3	0	0	0	0	111.1	T131 A132 L137 L138 S139	T131-S135 WeakPolarHBondContact O-CB 3.28Å; T131-S135 PolarHBondContact O-N 3.33Å; A132-S135 PolarHBondContact O-N 3.12Å; S135-L137 VanDerWaalsContact C-N 3.33Å; S135-L137 PolarHBondContact O-N 3.09Å; S135-L138 PolarHBondContact O-N 3.47Å; S135-S139 WeakPolarHBondContact O-CB 3.24Å; S135-S139 PolarHBondContact O-N 2.9Å; S135-S139 PolarHBondContact O-OG 2.94Å
136	I	58.8	Low	55.7	Low	66 Å²	66	93.4 Å²	93.4	34%	0.338	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-45.2	177.7	-64.9	155.9	0	0	0	111	M121 A132 W134 L138 S139 A140	M121-I136 HydrophobicContact CB-CD1 4.3Å; M121-I136 HydrophobicContact CE-CD1 4.26Å; M121-I136 HydrophobicContact CG-CD1 3.67Å; M121-I136 HydrophobicContact CG-CG1 4.44Å; M121-I136 HydrophobicContact SD-CD1 4.37Å; A132-I136 WeakPolarHBondContact O-CD1 3.44Å; A132-I136 WeakPolarHBondContact O-CG1 3.3Å; A132-I136 PolarHBondContact O-N 2.84Å; W134-I136 PolarHBondContact O-N 2.82Å; I136-L138 PolarHBondContact O-N 3.26Å; I136-S139 PolarHBondContact O-N 2.7Å; I136-A140 PolarHBondContact O-N 2.82Å
137	L	57.3	Low	56.2	Low	87 Å²	87	95 Å²	95	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-45.1	179.4	-167.7	81.8	0	0	0	111.4	R133 W134 S135 A140 Y141	R133-L137 PolarHBondContact O-N 2.94Å; W134-L137 HydrophobicContact CE3-CD2 3.95Å; W134-L137 HydrophobicContact CZ3-CD2 3.97Å; W134-L137 PolarHBondContact O-N 2.9Å; S135-L137 VanDerWaalsContact C-N 3.33Å; S135-L137 PolarHBondContact O-N 3.09Å; L137-A140 WeakPolarHBondContact O-CB 3.43Å; L137-A140 PolarHBondContact O-N 3.01Å; L137-Y141 HydrophobicContact CG-CE2 4.34Å; L137-Y141 WeakPolarHBondContact O-CD2 3.47Å; L137-Y141 WeakPolarHBondContact O-CE2 3.22Å
138	L	48.8	Very low	56.6	Low	47 Å²	47	96.1 Å²	96.1	25%	0.246	51%	0.51	C	S	.	.	H	α-helix	trans	-73.2	-32.3	-178.1	-69.8	171.7	0	0	0	112.6	W134 S135 I136 A140 Y141 G142 C143 L145	W134-L138 WeakPolarHBondContact O-CB 3.06Å; W134-L138 VanDerWaalsContact O-CG 3.26Å; W134-L138 WeakPolarHBondContact O-CG 3.42Å; W134-L138 PolarHBondContact O-N 2.96Å; S135-L138 PolarHBondContact O-N 3.47Å; I136-L138 PolarHBondContact O-N 3.26Å; L138-A140 PolarHBondContact O-N 3.01Å; L138-Y141 PolarHBondContact O-N 2.7Å; L138-G142 PolarHBondContact O-N 2.91Å; L138-C143 HydrophobicContact CB-CB 4.21Å; L138-C143 HydrophobicContact CD2-CB 4.26Å; L138-C143 PolarHBondContact O-N 3.38Å; L138-C143 VanDerWaalsContact O-N 3.09Å; L138-L145 HydrophobicContact CD1-CD1 3.68Å
139	S	54	Low	56.8	Low	81 Å²	81	95.8 Å²	95.8	57%	0.566	51%	0.507	S	S	*	.	H	α-helix	trans	-60.2	-32	173.2	-66.8	0	0	0	0	112.2	S135 I136 Y141 G142	S135-S139 WeakPolarHBondContact O-CB 3.24Å; S135-S139 PolarHBondContact O-N 2.9Å; S135-S139 PolarHBondContact O-OG 2.94Å; I136-S139 PolarHBondContact O-N 2.7Å; S139-Y141 PolarHBondContact O-N 3.25Å; S139-G142 PolarHBondContact O-N 3.39Å
140	A	57.8	Low	57.1	Low	78 Å²	78	92.6 Å²	92.6	65%	0.645	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.9	174.6	0	0	0	0	0	113.3	I136 L137 L138	I136-A140 PolarHBondContact O-N 2.82Å; L137-A140 WeakPolarHBondContact O-CB 3.43Å; L137-A140 PolarHBondContact O-N 3.01Å; L138-A140 PolarHBondContact O-N 3.01Å
141	Y	48.4	Very low	57.9	Low	64 Å²	64	92.7 Å²	92.7	25%	0.251	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	2.3	178.1	-58.4	-67.1	0	0	0	113.9	P23 E24 L137 L138 S139 C143	P23-Y141 HydrophobicContact CB-CD1 3.56Å; P23-Y141 HydrophobicContact CB-CD2 4.04Å; P23-Y141 HydrophobicContact CB-CE1 3.38Å; P23-Y141 HydrophobicContact CB-CE2 3.86Å; P23-Y141 HydrophobicContact CB-CG 3.88Å; P23-Y141 HydrophobicContact CG-CD1 4.16Å; P23-Y141 HydrophobicContact CG-CD2 3.77Å; P23-Y141 HydrophobicContact CG-CE1 3.75Å; P23-Y141 HydrophobicContact CG-CE2 3.31Å; P23-Y141 HydrophobicContact CG-CG 4.16Å; E24-Y141 VanDerWaalsContact CD-OH 3.23Å; E24-Y141 VanDerWaalsContact CG-OH 3.27Å; E24-Y141 WeakPolarHBondContact CG-OH 3.46Å; E24-Y141 VanDerWaalsContact OE1-CE1 3.25Å; E24-Y141 WeakPolarHBondContact OE1-CE1 3.24Å; E24-Y141 PolarHBondContact OE1-OH 3.34Å; L137-Y141 HydrophobicContact CG-CE2 4.34Å; L137-Y141 WeakPolarHBondContact O-CD2 3.47Å; L137-Y141 WeakPolarHBondContact O-CE2 3.22Å; L138-Y141 PolarHBondContact O-N 2.7Å; S139-Y141 PolarHBondContact O-N 3.25Å; Y141-C143 VanDerWaalsContact C-N 3.28Å
142	G	55.1	Low	58.5	Low	69 Å²	69	96.9 Å²	96.9	71%	0.711	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	29.2	-174.7	0	0	0	0	0	113	L138 S139	L138-G142 PolarHBondContact O-N 2.91Å; S139-G142 PolarHBondContact O-N 3.39Å
143	C	43.7	Very low	58.8	Low	62 Å²	62	99 Å²	99	42%	0.419	53%	0.525	S	S	.	.			trans	-100	132.6	177	-62.5	0	0	0	0	111.1	L138 Y141	L138-C143 HydrophobicContact CB-CB 4.21Å; L138-C143 HydrophobicContact CD2-CB 4.26Å; L138-C143 PolarHBondContact O-N 3.38Å; L138-C143 VanDerWaalsContact O-N 3.09Å; Y141-C143 VanDerWaalsContact C-N 3.28Å
144	D	48.5	Very low	59	Low	152 Å²	152	92.9 Å²	92.9	81%	0.813	51%	0.513	S	S	*	.			trans	-89.6	137.4	173.6	-65.4	-38.7	0	0	0	111.1	V146	D144-V146 PolarHBondContact O-N 3.38Å
145	L	57.2	Low	60	Low	105 Å²	105	92.4 Å²	92.4	55%	0.55	52%	0.521	S	S	.	.			trans	-88.1	107.4	176	-167.1	112.6	0	0	0	109.8	T131 L138	T131-L145 HydrophobicContact CG2-CD2 4.09Å; L138-L145 HydrophobicContact CD1-CD1 3.68Å
146	V	64.1	Low	60.4	Low	105 Å²	105	94.2 Å²	94.2	64%	0.636	54%	0.537	S	S	*	.			trans	-103.4	124.7	177.5	-176.8	0	0	0	0	109.8	D144	D144-V146 PolarHBondContact O-N 3.38Å
147	Y	70	Confident	60.8	Low	193 Å²	193	93.9 Å²	93.9	76%	0.757	54%	0.536	S	S	*	.			trans	-70	130.1	171.5	173.6	-98.7	0	0	0	110.2	P149	Y147-P149 HydrophobicContact CE1-CB 4.36Å
148	Q	70.1	Confident	61.3	Low	94 Å²	94	92.2 Å²	92.2	44%	0.439	54%	0.535	S	S	.	.			trans	-118.7	128.3	172.5	-66.8	-69	10.1	0	0	109.8	E152 I153	Q148-E152 PolarHBondContact OE1-OE2 3.07Å; Q148-E152 VanDerWaalsContact OE1-OE2 3.14Å; Q148-I153 HydrophobicContact CB-CG2 3.72Å
149	P	68.6	Low	61.6	Low	51 Å²	51	95.8 Å²	95.8	33%	0.331	55%	0.553	S	S	.	*			trans	-64.2	148.5	178.9	25.3	-31.4	0	0	0	111.1	Y147 K151 E152	Y147-P149 HydrophobicContact CE1-CB 4.36Å; P149-K151 PolarHBondContact O-N 3.07Å; P149-E152 HydrophobicContact CG-CG 4.19Å; P149-E152 PolarHBondContact O-N 2.82Å
150	G	68	Low	62	Low	52 Å²	52	96.1 Å²	96.1	54%	0.536	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.8	-28	-173.5	0	0	0	0	0	115.9	I153	G150-I153 WeakPolarHBondContact O-CG1 3.28Å
151	K	73	Confident	62.2	Low	197 Å²	197	100.8 Å²	100.8	86%	0.857	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-31.6	179.4	-64.6	-179.4	180	178.3	0	113	P149	P149-K151 PolarHBondContact O-N 3.07Å
152	E	65.1	Low	62.6	Low	140 Å²	140	102.6 Å²	102.6	65%	0.654	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-17.2	-176.8	-64	-170.4	179	0	0	112.6	Q148 P149 S154	Q148-E152 PolarHBondContact OE1-OE2 3.07Å; Q148-E152 VanDerWaalsContact OE1-OE2 3.14Å; P149-E152 HydrophobicContact CG-CG 4.19Å; P149-E152 PolarHBondContact O-N 2.82Å; E152-S154 VanDerWaalsContact C-N 3.32Å
153	I	66.3	Low	62.2	Low	69 Å²	69	104.7 Å²	104.7	35%	0.354	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	12.1	176.1	63.3	169	0	0	0	113.1	Q148 G150 N155 A156 D157	Q148-I153 HydrophobicContact CB-CG2 3.72Å; G150-I153 WeakPolarHBondContact O-CG1 3.28Å; I153-N155 PolarHBondContact O-N 2.89Å; I153-N155 VanDerWaalsContact O-N 3.09Å; I153-A156 HydrophobicContact CB-CB 4.41Å; I153-A156 CarbonylContact O-C 3.59Å; I153-A156 WeakPolarHBondContact O-CA 3.38Å; I153-A156 WeakPolarHBondContact O-CB 3.31Å; I153-A156 PolarHBondContact O-N 3.15Å; I153-D157 PolarHBondContact O-N 3.33Å
154	S	62.7	Low	62.7	Low	74 Å²	74	109.4 Å²	109.4	52%	0.517	59%	0.587	S	S	.	*	H	α-helix	trans	-53.9	-36.3	-175.3	-175.6	0	0	0	0	113	E152 A158	E152-S154 VanDerWaalsContact C-N 3.32Å; S154-A158 VanDerWaalsContact O-CB 3.24Å; S154-A158 WeakPolarHBondContact O-CB 3.49Å; S154-A158 PolarHBondContact O-N 3.29Å
155	N	71.1	Confident	62.5	Low	132 Å²	132	107.1 Å²	107.1	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-68	-42.5	176.1	-72.2	-9.3	0	0	0	111.7	I153 L159	I153-N155 PolarHBondContact O-N 2.89Å; I153-N155 VanDerWaalsContact O-N 3.09Å; N155-L159 WeakPolarHBondContact O-CB 3.48Å; N155-L159 VanDerWaalsContact O-CG 3.28Å; N155-L159 WeakPolarHBondContact O-CG 3.49Å; N155-L159 PolarHBondContact O-N 3.29Å
156	A	60.1	Low	61.9	Low	60 Å²	60	106 Å²	106	50%	0.496	58%	0.583	S	S	.	*	H	α-helix	trans	-69	-41.7	178.3	0	0	0	0	0	111.7	I153 L159 S160	I153-A156 HydrophobicContact CB-CB 4.41Å; I153-A156 CarbonylContact O-C 3.59Å; I153-A156 WeakPolarHBondContact O-CA 3.38Å; I153-A156 WeakPolarHBondContact O-CB 3.31Å; I153-A156 PolarHBondContact O-N 3.15Å; A156-L159 PolarHBondContact O-N 3.13Å; A156-S160 WeakPolarHBondContact O-CB 3.34Å; A156-S160 PolarHBondContact O-N 3.05Å
157	D	66.1	Low	60.8	Low	60 Å²	60	105.5 Å²	105.5	32%	0.321	58%	0.576	S	S	.	*	H	α-helix	trans	-61.7	-44.9	174.5	-176.7	77.4	0	0	0	110.7	I153 L159 S160 R161	I153-D157 PolarHBondContact O-N 3.33Å; D157-L159 PolarHBondContact O-N 3.35Å; D157-S160 PolarHBondContact O-N 3.33Å; D157-S160 PolarHBondContact O-OG 3.17Å; D157-R161 VanDerWaalsContact CG-NE 3.32Å; D157-R161 WeakPolarHBondContact O-CG 3.42Å; D157-R161 PolarHBondContact O-N 3.2Å; D157-R161 IonicContact OD1-CZ 3.47Å; D157-R161 IonicContact OD1-NE 2.76Å; D157-R161 PolarHBondContact OD1-NE 3.28Å; D157-R161 IonicContact OD1-NH2 3.33Å; D157-R161 PolarHBondContact OD1-NH2 3.23Å; D157-R161 IonicContact OD2-CZ 3.69Å; D157-R161 IonicContact OD2-NE 2.71Å; D157-R161 PolarHBondContact OD2-NE 3.5Å; D157-R161 IonicContact OD2-NH2 3.85Å; D157-R161 PolarHBondContact OD2-NH2 3.04Å
158	A	68.8	Low	59.5	Low	52 Å²	52	100 Å²	100	43%	0.43	56%	0.559	S	S	.	*	H	α-helix	trans	-59.2	-49.5	175.3	0	0	0	0	0	111.9	S154 S160 R161 I162	S154-A158 VanDerWaalsContact O-CB 3.24Å; S154-A158 WeakPolarHBondContact O-CB 3.49Å; S154-A158 PolarHBondContact O-N 3.29Å; A158-S160 VanDerWaalsContact C-N 3.29Å; A158-S160 PolarHBondContact O-N 2.76Å; A158-R161 PolarHBondContact O-N 3.4Å; A158-R161 VanDerWaalsContact O-N 3.17Å; A158-I162 WeakPolarHBondContact O-CG1 3.41Å; A158-I162 PolarHBondContact O-N 2.94Å
159	L	55.1	Low	58	Low	121 Å²	121	101.4 Å²	101.4	63%	0.634	57%	0.569	S	S	*	*	H	α-helix	trans	-62.2	-35.2	178.1	-71.2	175.5	0	0	0	112.5	N155 A156 D157 R161 I162	N155-L159 WeakPolarHBondContact O-CB 3.48Å; N155-L159 VanDerWaalsContact O-CG 3.28Å; N155-L159 WeakPolarHBondContact O-CG 3.49Å; N155-L159 PolarHBondContact O-N 3.29Å; A156-L159 PolarHBondContact O-N 3.13Å; D157-L159 PolarHBondContact O-N 3.35Å; L159-R161 VanDerWaalsContact C-N 3.25Å; L159-R161 PolarHBondContact O-N 3.3Å; L159-I162 HydrophobicContact CD2-CD1 3.71Å; L159-I162 PolarHBondContact O-N 3.36Å
160	S	62.5	Low	56.6	Low	89 Å²	89	103.6 Å²	103.6	62%	0.622	58%	0.582	S	S	*	*	H	α-helix	trans	-68.4	-25	178.2	77.5	0	0	0	0	113.3	A156 D157 A158	A156-S160 WeakPolarHBondContact O-CB 3.34Å; A156-S160 PolarHBondContact O-N 3.05Å; D157-S160 PolarHBondContact O-N 3.33Å; D157-S160 PolarHBondContact O-OG 3.17Å; A158-S160 VanDerWaalsContact C-N 3.29Å; A158-S160 PolarHBondContact O-N 2.76Å
161	R	62	Low	55.1	Low	176 Å²	176	107.2 Å²	107.2	66%	0.664	59%	0.588	S	S	*	*	H	α-helix	trans	-92.3	-8.3	179.2	-65.7	173.8	-166.7	-84	-8.2	113.4	D157 A158 L159 P163	D157-R161 VanDerWaalsContact CG-NE 3.32Å; D157-R161 WeakPolarHBondContact O-CG 3.42Å; D157-R161 PolarHBondContact O-N 3.2Å; D157-R161 IonicContact OD1-CZ 3.47Å; D157-R161 IonicContact OD1-NE 2.76Å; D157-R161 PolarHBondContact OD1-NE 3.28Å; D157-R161 IonicContact OD1-NH2 3.33Å; D157-R161 PolarHBondContact OD1-NH2 3.23Å; D157-R161 IonicContact OD2-CZ 3.69Å; D157-R161 IonicContact OD2-NE 2.71Å; D157-R161 PolarHBondContact OD2-NE 3.5Å; D157-R161 IonicContact OD2-NH2 3.85Å; D157-R161 PolarHBondContact OD2-NH2 3.04Å; A158-R161 PolarHBondContact O-N 3.4Å; A158-R161 VanDerWaalsContact O-N 3.17Å; L159-R161 VanDerWaalsContact C-N 3.25Å; L159-R161 PolarHBondContact O-N 3.3Å; R161-P163 VanDerWaalsContact O-CD 3.32Å; R161-P163 WeakPolarHBondContact O-CD 3.32Å
162	I	56.3	Low	53.2	Low	101 Å²	101	102.2 Å²	102.2	52%	0.518	58%	0.577	S	S	.	*	S	Bend	trans	-65.3	119.9	176.9	-63	178.2	0	0	0	107.6	A158 L159 Q164	A158-I162 WeakPolarHBondContact O-CG1 3.41Å; A158-I162 PolarHBondContact O-N 2.94Å; L159-I162 HydrophobicContact CD2-CD1 3.71Å; L159-I162 PolarHBondContact O-N 3.36Å; I162-Q164 PolarHBondContact O-N 3.24Å
163	P	48	Very low	51.9	Low	113 Å²	113	101.4 Å²	101.4	73%	0.734	58%	0.577	S	S	*	*			trans	-62.1	114.9	176.3	23.9	-30.7	0	0	0	108.3	R161 A165	R161-P163 VanDerWaalsContact O-CD 3.32Å; R161-P163 WeakPolarHBondContact O-CD 3.32Å; P163-A165 PolarHBondContact O-N 2.93Å
164	Q	53.9	Low	50.5	Low	162 Å²	162	108.8 Å²	108.8	76%	0.757	60%	0.6	S	S	*	*			trans	-70.2	100.6	171	-64.4	-173.8	13	0	0	106.9	I162 I166	I162-Q164 PolarHBondContact O-N 3.24Å; Q164-I166 HydrophobicContact CB-CD1 4.2Å; Q164-I166 HydrophobicContact CB-CG1 4.34Å; Q164-I166 PolarHBondContact O-N 2.99Å
165	A	44.1	Very low	49.3	Very low	103 Å²	103	109.7 Å²	109.7	85%	0.851	61%	0.607	S	S	*	*			trans	-68.3	77.6	164.4	0	0	0	0	0	107.8	P163 D167	P163-A165 PolarHBondContact O-N 2.93Å; A165-D167 PolarHBondContact O-N 3.08Å
166	I	44.9	Very low	47.5	Very low	83 Å²	83	110.6 Å²	110.6	43%	0.426	61%	0.612	S	S	.	*			trans	-78.4	99.5	165.8	-81.6	161.6	0	0	0	105.5	A99 Q164 L168	A99-I166 HydrophobicContact CB-CD1 4.21Å; A99-I166 HydrophobicContact CB-CG2 4.04Å; Q164-I166 HydrophobicContact CB-CD1 4.2Å; Q164-I166 HydrophobicContact CB-CG1 4.34Å; Q164-I166 PolarHBondContact O-N 2.99Å; I166-L168 VanDerWaalsContact C-N 3.34Å; I166-L168 HydrophobicContact CG2-CD2 3.5Å; I166-L168 VanDerWaalsContact CG2-CD2 3.5Å; I166-L168 HydrophobicContact CG2-CG 3.82Å; I166-L168 PolarHBondContact O-N 2.8Å; I166-L168 VanDerWaalsContact O-N 3.08Å
167	D	39.9	Very low	46.1	Very low	93 Å²	93	117.8 Å²	117.8	50%	0.497	63%	0.632	S	S	.	*			trans	-76.6	88.7	171.3	-174.6	24.4	0	0	0	108.9	A165 L169 T170	A165-D167 PolarHBondContact O-N 3.08Å; D167-L169 PolarHBondContact O-N 3.1Å; D167-L169 VanDerWaalsContact O-N 3.1Å; D167-T170 PolarHBondContact O-N 2.79Å; D167-T170 PolarHBondContact OD2-OG1 3.32Å
168	L	42	Very low	44.4	Very low	77 Å²	77	120.2 Å²	120.2	40%	0.403	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.4	-15.2	178.6	-68.8	175.8	0	0	0	112.9	A99 I166	A99-L168 HydrophobicContact CB-CD2 4.38Å; I166-L168 VanDerWaalsContact C-N 3.34Å; I166-L168 HydrophobicContact CG2-CD2 3.5Å; I166-L168 VanDerWaalsContact CG2-CD2 3.5Å; I166-L168 HydrophobicContact CG2-CG 3.82Å; I166-L168 PolarHBondContact O-N 2.8Å; I166-L168 VanDerWaalsContact O-N 3.08Å
169	L	39.8	Very low	42.7	Very low	124 Å²	124	126.9 Å²	126.9	65%	0.649	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-16.3	-178	-76.3	164.2	0	0	0	114.2	D167 N173	D167-L169 PolarHBondContact O-N 3.1Å; D167-L169 VanDerWaalsContact O-N 3.1Å; L169-N173 PolarHBondContact O-ND2 3.25Å
170	T	38.5	Very low	42.1	Very low	98 Å²	98	127.2 Å²	127.2	60%	0.601	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-17.8	178.3	-62.4	0	0	0	0	112.4	D167	D167-T170 PolarHBondContact O-N 2.79Å; D167-T170 PolarHBondContact OD2-OG1 3.32Å
171	I	36.4	Very low	41	Very low	127 Å²	127	129.2 Å²	129.2	65%	0.651	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-31	178.1	-58	173.9	0	0	0	111.3
172	C	32.9	Very low	39.9	Very low	93 Å²	93	126.6 Å²	126.6	63%	0.628	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-11.1	-178.4	-93.7	0	0	0	0	116	S175	C172-S175 PolarHBondContact O-OG 3.44Å
173	N	38.4	Very low	38.9	Very low	123 Å²	123	128.1 Å²	128.1	66%	0.658	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	4.9	-174.2	-77.5	-56.4	0	0	0	115	L169	L169-N173 PolarHBondContact O-ND2 3.25Å
174	R	36.6	Very low	38.3	Very low	223 Å²	223	129.1 Å²	129.1	84%	0.842	71%	0.714	S	S	*	*			trans	-100.7	-4.3	175.7	-103	-175.9	-179.6	174.7	1.5	114.8	N176	R174-N176 PolarHBondContact O-N 2.99Å
175	S	38.5	Very low	37.3	Very low	93 Å²	93	126.9 Å²	126.9	65%	0.65	71%	0.711	S	S	*	*			trans	-77.2	66.9	168.7	45	0	0	0	0	111	C172 F177	C172-S175 PolarHBondContact O-OG 3.44Å; S175-F177 VanDerWaalsContact C-N 3.29Å; S175-F177 PolarHBondContact O-N 3.47Å
176	N	31.8	Very low	36.8	Very low	152 Å²	152	128.6 Å²	128.6	81%	0.813	70%	0.701	S	S	*	*			trans	-93	53.6	165.4	-102.3	-26.3	0	0	0	110.2	R174 S178	R174-N176 PolarHBondContact O-N 2.99Å; N176-S178 PolarHBondContact O-N 2.71Å
177	F	31.8	Very low	36.2	Very low	210 Å²	210	132.1 Å²	132.1	92%	0.921	72%	0.723	S	S	*	*			trans	-90.8	91.7	161.5	-97.3	-83.5	0	0	0	108	S175	S175-F177 VanDerWaalsContact C-N 3.29Å; S175-F177 PolarHBondContact O-N 3.47Å
178	S	30.7	Very low	35.9	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	74%	0.741	S	S	*	*			trans	-64.6	133.5	165.2	-157.8	0	0	0	0	109.1	N176	N176-S178 PolarHBondContact O-N 2.71Å
179	C	33	Very low	35.3	Very low	193 Å²	193	140.6 Å²	140.6	100%	1.304	77%	0.772	S	S	*	*			trans	-65.5	0	144.7	-72.4	0	0	0	0	109.6

Retrieved 179 of 179 residues in 63.7 ms (Link to these results)

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