A0A077Z0P4_TRITR Loading...

Cell cll lymphoma protein family member

AlphaFold DB , UniProt , Accession A0A077Z0P4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 180 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	53.4	Low	63.9	Low	243 Å²	243	146.5 Å²	146.5	100%	1.197	73%	0.725	S	S	*	*				0	84.5	0	-74.7	-177.1	-135.8	0	0	110.1
2	I	69.6	Low	64.6	Low	140 Å²	140	140.8 Å²	140.8	72%	0.718	70%	0.699	S	S	*	*			trans	-121.7	9.1	-171	-107.2	145.9	0	0	0	114	R4	I2-R4 PolarHBondContact O-N 3.1Å
3	S	66.7	Low	65.5	Low	110 Å²	110	141.3 Å²	141.3	77%	0.769	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-1.3	-162.9	-37.7	0	0	0	0	116
4	R	63.4	Low	66.5	Low	228 Å²	228	136.7 Å²	136.7	86%	0.86	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-36.9	-178.5	-57.6	-174	-174	-173.6	2.2	113.4	I2 R7 A8	I2-R4 PolarHBondContact O-N 3.1Å; R4-R7 PolarHBondContact O-N 3.21Å; R4-A8 PolarHBondContact O-N 3.48Å
5	S	62.9	Low	67.7	Low	91 Å²	91	136.5 Å²	136.5	64%	0.636	67%	0.671	S	S	*	*	H	α-helix	trans	-65.8	-43.3	-177.8	-174.5	0	0	0	0	112.6	R7 A8 E9	S5-R7 PolarHBondContact O-N 3.38Å; S5-A8 PolarHBondContact O-N 3.01Å; S5-E9 PolarHBondContact O-N 3.18Å
6	L	62.9	Low	68.9	Low	120 Å²	120	133.6 Å²	133.6	63%	0.628	66%	0.655	S	S	*	*	H	α-helix	trans	-61.7	-32.6	-178.6	-131.1	80.3	0	0	0	112.3	T10	L6-T10 PolarHBondContact O-OG1 2.86Å
7	R	61.3	Low	70.2	Confident	207 Å²	207	132.2 Å²	132.2	78%	0.781	65%	0.647	S	S	*	*	H	α-helix	trans	-76	-35.3	179.8	-168	175.5	-176.9	92.7	-1.7	112.3	R4 S5 E9	R4-R7 PolarHBondContact O-N 3.21Å; S5-R7 PolarHBondContact O-N 3.38Å; R7-E9 VanDerWaalsContact C-N 3.35Å
8	A	67	Low	71.3	Confident	65 Å²	65	129.8 Å²	129.8	54%	0.537	64%	0.641	S	S	.	*	H	α-helix	trans	-67	-38.1	175.9	0	0	0	0	0	111.5	R4 S5 T10 R11 N12	R4-A8 PolarHBondContact O-N 3.48Å; S5-A8 PolarHBondContact O-N 3.01Å; A8-T10 PolarHBondContact O-N 3.37Å; A8-R11 PolarHBondContact O-N 2.92Å; A8-N12 PolarHBondContact O-N 3.22Å
9	E	63.7	Low	72.3	Confident	94 Å²	94	129.2 Å²	129.2	44%	0.439	63%	0.634	S	S	.	*	H	α-helix	trans	-61.1	-45.4	179.6	-164.5	-173.2	150.2	0	0	112.3	S5 R7 R11 N12 R13	S5-E9 PolarHBondContact O-N 3.18Å; R7-E9 VanDerWaalsContact C-N 3.35Å; E9-R11 VanDerWaalsContact C-N 3.33Å; E9-R11 PolarHBondContact O-N 3.37Å; E9-N12 PolarHBondContact O-N 2.87Å; E9-N12 VanDerWaalsContact O-N 3.16Å; E9-R13 PolarHBondContact O-N 3.18Å; E9-R13 IonicContact OE1-CZ 2.72Å; E9-R13 IonicContact OE1-NE 2.74Å; E9-R13 IonicContact OE1-NH2 3.65Å; E9-R13 PolarHBondContact OE1-NH2 2.85Å
10	T	66.2	Low	73.3	Confident	95 Å²	95	130.6 Å²	130.6	58%	0.583	63%	0.632	S	S	*	*	H	α-helix	trans	-63.5	-35.8	-180	-54.2	0	0	0	0	112.9	L6 A8 N12	L6-T10 PolarHBondContact O-OG1 2.86Å; A8-T10 PolarHBondContact O-N 3.37Å; T10-N12 VanDerWaalsContact C-N 3.34Å
11	R	65.6	Low	74.2	Confident	218 Å²	218	128 Å²	128	82%	0.823	62%	0.624	S	S	*	*	H	α-helix	trans	-71.5	-29.2	177.1	-174.6	173.4	177.9	157	-0	112.4	A8 E9	A8-R11 PolarHBondContact O-N 2.92Å; E9-R11 VanDerWaalsContact C-N 3.33Å; E9-R11 PolarHBondContact O-N 3.37Å
12	N	72.8	Confident	76	Confident	78 Å²	78	120.1 Å²	120.1	42%	0.417	59%	0.586	S	S	.	*	H	α-helix	trans	-73	-35.4	-177.7	-164.9	36.5	0	0	0	112.1	A8 E9 T10 S14 K15 E16	A8-N12 PolarHBondContact O-N 3.22Å; E9-N12 PolarHBondContact O-N 2.87Å; E9-N12 VanDerWaalsContact O-N 3.16Å; T10-N12 VanDerWaalsContact C-N 3.34Å; N12-S14 PolarHBondContact O-N 3.39Å; N12-K15 PolarHBondContact O-N 2.88Å; N12-E16 PolarHBondContact ND2-OE1 2.91Å; N12-E16 VanDerWaalsContact O-CG 3.29Å; N12-E16 WeakPolarHBondContact O-CG 3.43Å; N12-E16 PolarHBondContact O-N 3.22Å
13	R	76.2	Confident	77.1	Confident	148 Å²	148	117.4 Å²	117.4	56%	0.558	57%	0.573	S	S	*	*	H	α-helix	trans	-56.9	-47.7	-177.6	-68.8	-179.1	-175.4	-176.6	1.8	113.8	E9 K15 E16 E17	E9-R13 PolarHBondContact O-N 3.18Å; E9-R13 IonicContact OE1-CZ 2.72Å; E9-R13 IonicContact OE1-NE 2.74Å; E9-R13 IonicContact OE1-NH2 3.65Å; E9-R13 PolarHBondContact OE1-NH2 2.85Å; R13-K15 PolarHBondContact O-N 2.99Å; R13-E16 PolarHBondContact O-N 3.37Å; R13-E17 PolarHBondContact O-N 2.87Å
14	S	79.6	Confident	78.3	Confident	77 Å²	77	116.3 Å²	116.3	54%	0.538	56%	0.562	S	S	.	*	H	α-helix	trans	-66	-38.2	-179.6	-51.7	0	0	0	0	112.2	N12 E17 V18	N12-S14 PolarHBondContact O-N 3.39Å; S14-E17 PolarHBondContact O-N 2.72Å; S14-V18 WeakPolarHBondContact O-CG2 3.38Å; S14-V18 PolarHBondContact O-N 3.4Å
15	K	84.1	Confident	79.5	Confident	134 Å²	134	109.9 Å²	109.9	58%	0.583	54%	0.543	S	S	*	.	H	α-helix	trans	-67.2	-38.5	177.1	-173.5	176.8	-179.7	178.4	0	111.6	N12 R13 K19	N12-K15 PolarHBondContact O-N 2.88Å; R13-K15 PolarHBondContact O-N 2.99Å; K15-K19 WeakPolarHBondContact O-CG 3.15Å; K15-K19 PolarHBondContact O-N 2.89Å
16	E	87.4	Confident	80.7	Confident	89 Å²	89	112 Å²	112	42%	0.416	54%	0.543	S	S	.	.	H	α-helix	trans	-68.3	-36.1	175.8	-70.9	173	164.7	0	0	112.7	N12 R13 K19 R20	N12-E16 PolarHBondContact ND2-OE1 2.91Å; N12-E16 VanDerWaalsContact O-CG 3.29Å; N12-E16 WeakPolarHBondContact O-CG 3.43Å; N12-E16 PolarHBondContact O-N 3.22Å; R13-E16 PolarHBondContact O-N 3.37Å; E16-K19 PolarHBondContact O-N 2.81Å; E16-R20 WeakPolarHBondContact O-CG 3.44Å; E16-R20 PolarHBondContact O-N 3.24Å
17	E	90	Very high	81.9	Confident	111 Å²	111	114.8 Å²	114.8	52%	0.519	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-47.8	175.1	-175.3	169.1	-160.5	0	0	112.3	R13 S14 K19 R20 V21	R13-E17 PolarHBondContact O-N 2.87Å; S14-E17 PolarHBondContact O-N 2.72Å; E17-K19 VanDerWaalsContact C-N 3.32Å; E17-K19 PolarHBondContact O-N 3.24Å; E17-R20 WeakPolarHBondContact O-CB 3.23Å; E17-R20 PolarHBondContact O-N 3.02Å; E17-R20 VanDerWaalsContact O-N 3.11Å; E17-V21 WeakPolarHBondContact O-CG2 3.18Å; E17-V21 PolarHBondContact O-N 3.44Å
18	V	90.2	Very high	83.1	Confident	89 Å²	89	109.1 Å²	109.1	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-58	-45.7	175.9	173.6	0	0	0	0	111.1	S14 R20 V21 I22	S14-V18 WeakPolarHBondContact O-CG2 3.38Å; S14-V18 PolarHBondContact O-N 3.4Å; V18-R20 VanDerWaalsContact C-N 3.34Å; V18-R20 PolarHBondContact O-N 3.31Å; V18-V21 PolarHBondContact O-N 2.95Å; V18-I22 HydrophobicContact CG1-CD1 3.78Å; V18-I22 HydrophobicContact CG1-CG1 4.46Å; V18-I22 WeakPolarHBondContact O-CG1 3.31Å; V18-I22 PolarHBondContact O-N 3.11Å
19	K	90.4	Very high	84.2	Confident	117 Å²	117	113.2 Å²	113.2	51%	0.509	54%	0.54	S	S	.	.	H	α-helix	trans	-60.1	-42.5	175.9	-73.6	178.9	174.4	-173.5	0	112.1	K15 E16 E17 V21 I22 N23	K15-K19 WeakPolarHBondContact O-CG 3.15Å; K15-K19 PolarHBondContact O-N 2.89Å; E16-K19 PolarHBondContact O-N 2.81Å; E17-K19 VanDerWaalsContact C-N 3.32Å; E17-K19 PolarHBondContact O-N 3.24Å; K19-V21 VanDerWaalsContact C-N 3.35Å; K19-I22 PolarHBondContact O-N 3.47Å; K19-N23 WeakPolarHBondContact O-CB 3.3Å; K19-N23 PolarHBondContact O-N 3.07Å; K19-N23 PolarHBondContact O-OD1 3.22Å
20	R	92.1	Very high	85.4	Confident	158 Å²	158	113.3 Å²	113.3	60%	0.596	54%	0.539	S	S	*	.	H	α-helix	trans	-62	-42.5	176.3	-78.6	-173.9	-66.8	155.2	1.2	111.7	E16 E17 V18 N23 T24	E16-R20 WeakPolarHBondContact O-CG 3.44Å; E16-R20 PolarHBondContact O-N 3.24Å; E17-R20 WeakPolarHBondContact O-CB 3.23Å; E17-R20 PolarHBondContact O-N 3.02Å; E17-R20 VanDerWaalsContact O-N 3.11Å; V18-R20 VanDerWaalsContact C-N 3.34Å; V18-R20 PolarHBondContact O-N 3.31Å; R20-N23 PolarHBondContact O-N 3.45Å; R20-T24 WeakPolarHBondContact O-CB 3.44Å; R20-T24 PolarHBondContact O-N 3.35Å; R20-T24 PolarHBondContact O-OG1 3.4Å
21	V	93.6	Very high	86.7	Confident	75 Å²	75	115.5 Å²	115.5	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-49.2	177.8	171.3	0	0	0	0	110.6	E17 V18 K19 N23 T24 I25	E17-V21 WeakPolarHBondContact O-CG2 3.18Å; E17-V21 PolarHBondContact O-N 3.44Å; V18-V21 PolarHBondContact O-N 2.95Å; K19-V21 VanDerWaalsContact C-N 3.35Å; V21-N23 PolarHBondContact O-N 3.18Å; V21-T24 WeakPolarHBondContact O-CB 3.48Å; V21-T24 PolarHBondContact O-N 3.42Å; V21-T24 VanDerWaalsContact O-N 3.12Å; V21-I25 HydrophobicContact CG1-CD1 3.71Å; V21-I25 HydrophobicContact CG1-CG1 4.39Å; V21-I25 VanDerWaalsContact O-CG1 3.31Å; V21-I25 WeakPolarHBondContact O-CG1 3.47Å; V21-I25 PolarHBondContact O-N 2.93Å
22	I	90.9	Very high	88	Confident	78 Å²	78	108 Å²	108	40%	0.4	51%	0.511	S	S	.	.	H	α-helix	trans	-57.1	-51	177.1	-66.4	166.2	0	0	0	110.4	V18 K19 T24 I25 E26	V18-I22 HydrophobicContact CG1-CD1 3.78Å; V18-I22 HydrophobicContact CG1-CG1 4.46Å; V18-I22 WeakPolarHBondContact O-CG1 3.31Å; V18-I22 PolarHBondContact O-N 3.11Å; K19-I22 PolarHBondContact O-N 3.47Å; I22-T24 PolarHBondContact O-N 2.96Å; I22-I25 PolarHBondContact O-N 3.34Å; I22-I25 VanDerWaalsContact O-N 3.09Å; I22-E26 HydrophobicContact CG2-CG 4.37Å; I22-E26 WeakPolarHBondContact CG2-OE1 3.19Å; I22-E26 WeakPolarHBondContact O-CG 3.47Å; I22-E26 PolarHBondContact O-N 3.48Å
23	N	91.2	Very high	89	Confident	84 Å²	84	109.3 Å²	109.3	45%	0.449	51%	0.513	S	S	.	.	H	α-helix	trans	-60.7	-33.2	178.6	-68.5	-1.6	0	0	0	112.6	K19 R20 V21 K27	K19-N23 WeakPolarHBondContact O-CB 3.3Å; K19-N23 PolarHBondContact O-N 3.07Å; K19-N23 PolarHBondContact O-OD1 3.22Å; R20-N23 PolarHBondContact O-N 3.45Å; V21-N23 PolarHBondContact O-N 3.18Å; N23-K27 WeakPolarHBondContact O-CD 3.43Å; N23-K27 VanDerWaalsContact O-CG 3.27Å; N23-K27 WeakPolarHBondContact O-CG 3.25Å; N23-K27 PolarHBondContact O-N 3.39Å
24	T	92.2	Very high	89.8	Confident	87 Å²	87	106.1 Å²	106.1	53%	0.534	50%	0.503	S	S	.	.	H	α-helix	trans	-71	-42.6	176.4	-58.3	0	0	0	0	110.7	R20 V21 I22 K27	R20-T24 WeakPolarHBondContact O-CB 3.44Å; R20-T24 PolarHBondContact O-N 3.35Å; R20-T24 PolarHBondContact O-OG1 3.4Å; V21-T24 WeakPolarHBondContact O-CB 3.48Å; V21-T24 PolarHBondContact O-N 3.42Å; V21-T24 VanDerWaalsContact O-N 3.12Å; I22-T24 PolarHBondContact O-N 2.96Å; T24-K27 PolarHBondContact O-N 3.18Å
25	I	89.5	Confident	90.4	Very high	92 Å²	92	107.9 Å²	107.9	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-65.7	-40.1	177.6	-67	168.6	0	0	0	110.9	V21 I22 K27 V28 K30	V21-I25 HydrophobicContact CG1-CD1 3.71Å; V21-I25 HydrophobicContact CG1-CG1 4.39Å; V21-I25 VanDerWaalsContact O-CG1 3.31Å; V21-I25 WeakPolarHBondContact O-CG1 3.47Å; V21-I25 PolarHBondContact O-N 2.93Å; I22-I25 PolarHBondContact O-N 3.34Å; I22-I25 VanDerWaalsContact O-N 3.09Å; I25-K27 VanDerWaalsContact C-N 3.26Å; I25-K27 PolarHBondContact O-N 3.16Å; I25-V28 PolarHBondContact O-N 3.42Å; I25-V28 VanDerWaalsContact O-N 3.16Å; I25-K30 WeakPolarHBondContact O-CE 3.21Å; I25-K30 PolarHBondContact O-NZ 3.37Å
26	E	87.3	Confident	90.8	Very high	135 Å²	135	104.2 Å²	104.2	63%	0.631	49%	0.487	S	S	*	.	H	α-helix	trans	-63.4	-31.8	178.6	-74.9	177.5	177.7	0	0	112.5	I22 V28	I22-E26 HydrophobicContact CG2-CG 4.37Å; I22-E26 WeakPolarHBondContact CG2-OE1 3.19Å; I22-E26 WeakPolarHBondContact O-CG 3.47Å; I22-E26 PolarHBondContact O-N 3.48Å; E26-V28 VanDerWaalsContact C-N 3.29Å; E26-V28 PolarHBondContact O-N 3.23Å
27	K	88	Confident	91	Very high	180 Å²	180	106.1 Å²	106.1	78%	0.783	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-16.8	175.1	-70.7	171.2	-176.3	-175.7	0	114.2	N23 T24 I25	N23-K27 WeakPolarHBondContact O-CD 3.43Å; N23-K27 VanDerWaalsContact O-CG 3.27Å; N23-K27 WeakPolarHBondContact O-CG 3.25Å; N23-K27 PolarHBondContact O-N 3.39Å; T24-K27 PolarHBondContact O-N 3.18Å; I25-K27 VanDerWaalsContact C-N 3.26Å; I25-K27 PolarHBondContact O-N 3.16Å
28	V	87.2	Confident	91	Very high	88 Å²	88	105.8 Å²	105.8	53%	0.533	50%	0.499	S	S	.	.	S	Bend	trans	-76.9	126.1	178.8	178.2	0	0	0	0	109.7	I25 E26 K30	I25-V28 PolarHBondContact O-N 3.42Å; I25-V28 VanDerWaalsContact O-N 3.16Å; E26-V28 VanDerWaalsContact C-N 3.29Å; E26-V28 PolarHBondContact O-N 3.23Å; V28-K30 WeakPolarHBondContact O-CD 3.43Å; V28-K30 WeakPolarHBondContact O-CE 3.37Å; V28-K30 PolarHBondContact O-N 3.26Å
29	R	89.5	Confident	90.6	Very high	151 Å²	151	110.3 Å²	110.3	57%	0.57	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-53	121.7	173.6	-178.1	167.7	179.9	77.6	-16.7	110.2	P50	R29-P50 VanDerWaalsContact NE-CB 3.3Å
30	K	88.7	Confident	90.4	Very high	96 Å²	96	112.6 Å²	112.6	42%	0.417	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-81.2	143	179.3	-53.1	-59.5	173.7	-173.9	0	110	I25 V28 V51	I25-K30 WeakPolarHBondContact O-CE 3.21Å; I25-K30 PolarHBondContact O-NZ 3.37Å; V28-K30 WeakPolarHBondContact O-CD 3.43Å; V28-K30 WeakPolarHBondContact O-CE 3.37Å; V28-K30 PolarHBondContact O-N 3.26Å; K30-V51 HydrophobicContact CB-CB 3.9Å; K30-V51 HydrophobicContact CB-CG2 3.67Å; K30-V51 PolarHBondContact O-N 3.27Å
31	W	94.2	Very high	90.2	Very high	140 Å²	140	107 Å²	107	53%	0.53	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.1	174	-68.6	76.3	0	0	0	108.5	W48	W31-W48 HydrophobicContact CB-CE3 4Å; W31-W48 HydrophobicContact CE3-CB 3.78Å; W31-W48 HydrophobicContact CZ3-CB 4.33Å; W31-W48 VanDerWaalsContact CZ3-O 3.23Å; W31-W48 WeakPolarHBondContact CZ3-O 3.43Å
32	E	92.3	Very high	90	Very high	62 Å²	62	110 Å²	110	29%	0.29	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.9	174	54	174.9	-177.7	0	0	109.8	K34 V49 V51	E32-K34 HydrophobicContact CG-CD 4.06Å; E32-K34 HydrophobicContact CG-CG 3.74Å; E32-K34 PolarHBondContact O-N 3.27Å; E32-K34 WeakPolarHBondContact OE1-CD 3.4Å; E32-K34 VanDerWaalsContact OE1-CE 3.31Å; E32-K34 WeakPolarHBondContact OE1-CE 3.25Å; E32-K34 IonicContact OE1-NZ 3.77Å; E32-K34 PolarHBondContact OE1-NZ 3.15Å; E32-K34 IonicContact OE2-NZ 3.95Å; E32-V49 PolarHBondContact N-O 3.44Å; E32-V49 PolarHBondContact O-N 2.89Å; E32-V51 HydrophobicContact CB-CG2 3.72Å; E32-V51 HydrophobicContact CG-CB 4.5Å; E32-V51 HydrophobicContact CG-CG2 3.63Å
33	K	94.6	Very high	90	Very high	105 Å²	105	111.1 Å²	111.1	46%	0.457	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	105	174	-165.7	-175.2	67.7	143.6	0	108	Y46 W48	K33-Y46 HydrophobicContact CD-CD1 3.72Å; K33-Y46 HydrophobicContact CD-CE1 4.18Å; K33-Y46 HydrophobicContact CD-CG 3.89Å; K33-Y46 VanDerWaalsContact CE-CE1 3.46Å; K33-Y46 HydrophobicContact CG-CD1 3.59Å; K33-Y46 HydrophobicContact CG-CE1 4.28Å; K33-Y46 HydrophobicContact CG-CG 4.06Å; K33-Y46 VanDerWaalsContact NZ-CZ 3.28Å; K33-W48 HydrophobicContact CB-CD2 4.41Å; K33-W48 HydrophobicContact CB-CE3 4.14Å; K33-W48 HydrophobicContact CB-CH2 4.12Å; K33-W48 HydrophobicContact CB-CZ2 4.37Å; K33-W48 HydrophobicContact CB-CZ3 3.99Å
34	K	92.2	Very high	90.1	Very high	81 Å²	81	113.4 Å²	113.4	35%	0.352	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	151.2	176	-54.2	-162.5	97.6	136.8	0	111.2	E32 Y46 K47 V49	E32-K34 HydrophobicContact CG-CD 4.06Å; E32-K34 HydrophobicContact CG-CG 3.74Å; E32-K34 PolarHBondContact O-N 3.27Å; E32-K34 WeakPolarHBondContact OE1-CD 3.4Å; E32-K34 VanDerWaalsContact OE1-CE 3.31Å; E32-K34 WeakPolarHBondContact OE1-CE 3.25Å; E32-K34 IonicContact OE1-NZ 3.77Å; E32-K34 PolarHBondContact OE1-NZ 3.15Å; E32-K34 IonicContact OE2-NZ 3.95Å; K34-Y46 WeakPolarHBondContact O-CA 3.47Å; K34-K47 PolarHBondContact N-O 3.12Å; K34-K47 PolarHBondContact O-N 2.96Å; K34-V49 HydrophobicContact CB-CG2 4.19Å; K34-V49 HydrophobicContact CD-CB 4.32Å; K34-V49 HydrophobicContact CG-CB 4.24Å; K34-V49 HydrophobicContact CG-CG2 4.44Å
35	W	93.6	Very high	90.1	Very high	114 Å²	114	113 Å²	113	43%	0.432	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	124.2	162.7	-71.7	106	0	0	0	109.6	R44 V45 Y46	W35-R44 HydrophobicContact CB-CB 4.43Å; W35-R44 HydrophobicContact CD2-CB 4.36Å; W35-R44 HydrophobicContact CE3-CB 3.73Å; W35-R44 HydrophobicContact CZ3-CB 4.34Å; W35-R44 WeakPolarHBondContact CZ3-O 3.47Å; W35-V45 WeakPolarHBondContact CA-O 3.38Å; W35-Y46 AromaticContact CD1-CE1 3.56Å; W35-Y46 AromaticContact CD1-CZ 3.98Å; W35-Y46 AromaticContact CD2-CD1 3.84Å; W35-Y46 HydrophobicContact CD2-CD1 3.84Å; W35-Y46 HydrophobicContact CD2-CD2 4.3Å; W35-Y46 AromaticContact CD2-CE1 3.7Å; W35-Y46 HydrophobicContact CD2-CE1 3.7Å; W35-Y46 HydrophobicContact CD2-CE2 4.16Å; W35-Y46 HydrophobicContact CD2-CG 4.16Å; W35-Y46 AromaticContact CD2-CZ 3.85Å; W35-Y46 AromaticContact CE2-CD1 3.95Å; W35-Y46 AromaticContact CE2-CE1 3.36Å; W35-Y46 AromaticContact CE2-CE2 3.46Å; W35-Y46 VanDerWaalsContact CE2-CE2 3.46Å; W35-Y46 AromaticContact CE2-CZ 3.06Å; W35-Y46 VanDerWaalsContact CE2-OH 3.28Å; W35-Y46 HydrophobicContact CE3-CD1 4.2Å; W35-Y46 HydrophobicContact CE3-CD2 4.15Å; W35-Y46 HydrophobicContact CE3-CE1 4.42Å; W35-Y46 HydrophobicContact CE3-CE2 4.36Å; W35-Y46 HydrophobicContact CE3-CG 4.08Å; W35-Y46 HydrophobicContact CG-CD1 4.13Å; W35-Y46 AromaticContact CG-CE1 3.91Å; W35-Y46 HydrophobicContact CG-CE1 3.91Å; W35-Y46 AromaticContact CH2-CD2 3.54Å; W35-Y46 HydrophobicContact CH2-CD2 3.54Å; W35-Y46 AromaticContact CH2-CE2 3.3Å; W35-Y46 HydrophobicContact CH2-CE2 3.3Å; W35-Y46 HydrophobicContact CH2-CG 4.29Å; W35-Y46 AromaticContact CH2-CZ 3.88Å; W35-Y46 HydrophobicContact CZ2-CD1 4.45Å; W35-Y46 AromaticContact CZ2-CD2 3.72Å; W35-Y46 HydrophobicContact CZ2-CD2 3.72Å; W35-Y46 AromaticContact CZ2-CE1 3.9Å; W35-Y46 HydrophobicContact CZ2-CE1 3.9Å; W35-Y46 AromaticContact CZ2-CE2 3.02Å; W35-Y46 HydrophobicContact CZ2-CE2 3.02Å; W35-Y46 HydrophobicContact CZ2-CG 4.39Å; W35-Y46 AromaticContact CZ2-CZ 3.12Å; W35-Y46 VanDerWaalsContact CZ2-OH 3.3Å; W35-Y46 WeakPolarHBondContact CZ2-OH 3.5Å; W35-Y46 AromaticContact CZ3-CD2 3.76Å; W35-Y46 HydrophobicContact CZ3-CD2 3.76Å; W35-Y46 AromaticContact CZ3-CE2 3.97Å; W35-Y46 HydrophobicContact CZ3-CE2 3.97Å; W35-Y46 HydrophobicContact CZ3-CG 4.12Å; W35-Y46 AromaticContact NE1-CE1 3.24Å; W35-Y46 AromaticContact NE1-CZ 3.16Å; W35-Y46 PolarHBondContact NE1-OH 3.17Å
36	V	91.2	Very high	90.3	Very high	57 Å²	57	113.9 Å²	113.9	35%	0.345	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.1	173.8	-179.2	0	0	0	0	107.4	R44 V45 K47 V49	V36-R44 WeakPolarHBondContact O-CA 3.27Å; V36-V45 PolarHBondContact N-O 2.94Å; V36-V45 PolarHBondContact O-N 2.71Å; V36-K47 HydrophobicContact CB-CB 4.35Å; V36-K47 HydrophobicContact CG2-CB 3.8Å; V36-K47 HydrophobicContact CG2-CD 4.37Å; V36-V49 HydrophobicContact CG2-CG2 3.83Å
37	M	92.4	Very high	90.6	Very high	129 Å²	129	113.7 Å²	113.7	64%	0.635	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	129.8	171.6	-175	172.2	-75.4	0	0	108.4	K39 R44	M37-K39 PolarHBondContact O-N 3Å; M37-R44 HydrophobicContact CB-CG 4.33Å
38	L	90.5	Very high	90.9	Very high	104 Å²	104	112.7 Å²	112.7	55%	0.545	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-73.5	122.7	175.9	-167.1	65.6	0	0	0	107.8	D40 S41 I43	L38-D40 PolarHBondContact O-N 3.48Å; L38-D40 VanDerWaalsContact O-N 3.1Å; L38-S41 PolarHBondContact O-N 2.8Å; L38-S41 VanDerWaalsContact O-O 3.13Å; L38-I43 PolarHBondContact N-O 3.28Å
39	K	81.2	Confident	91.1	Very high	183 Å²	183	110.5 Å²	110.5	80%	0.796	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	117.8	174.7	-166.1	172.9	179.5	-176.7	0	105.6	M37	M37-K39 PolarHBondContact O-N 3Å
40	D	86.3	Confident	91.3	Very high	166 Å²	166	105 Å²	105	89%	0.888	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	93	11.4	-175.7	-37.8	-35.4	0	0	0	116.4	L38	L38-D40 PolarHBondContact O-N 3.48Å; L38-D40 VanDerWaalsContact O-N 3.1Å
41	S	87.9	Confident	91.3	Very high	41 Å²	41	102.1 Å²	102.1	29%	0.287	49%	0.486	S	S	.	.	S	Bend	trans	-141.5	157.5	170.5	-173.5	0	0	0	0	112.5	L38 I43	L38-S41 PolarHBondContact O-N 2.8Å; L38-S41 VanDerWaalsContact O-O 3.13Å; S41-I43 PolarHBondContact O-N 2.84Å; S41-I43 WeakPolarHBondContact OG-CG1 3.33Å; S41-I43 PolarHBondContact OG-N 3.24Å
42	T	88.8	Confident	90.8	Very high	136 Å²	136	99.4 Å²	99.4	83%	0.834	49%	0.488	S	S	*	.	S	Bend	trans	-77.8	-6.5	169.3	54.9	0	0	0	0	112.6
43	I	91.1	Very high	89.7	Confident	102 Å²	102	104.8 Å²	104.8	52%	0.523	51%	0.513	S	S	.	.			trans	-80.6	137.9	-176.9	-56.9	166.7	0	0	0	110.6	L38 S41 V45	L38-I43 PolarHBondContact N-O 3.28Å; S41-I43 PolarHBondContact O-N 2.84Å; S41-I43 WeakPolarHBondContact OG-CG1 3.33Å; S41-I43 PolarHBondContact OG-N 3.24Å; I43-V45 HydrophobicContact CG2-CG2 4.22Å
44	R	92.8	Very high	88.2	Confident	133 Å²	133	105 Å²	105	50%	0.502	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.8	167.8	-72.8	168.6	45.9	172.2	-5.6	109.2	W35 V36 M37	W35-R44 HydrophobicContact CB-CB 4.43Å; W35-R44 HydrophobicContact CD2-CB 4.36Å; W35-R44 HydrophobicContact CE3-CB 3.73Å; W35-R44 HydrophobicContact CZ3-CB 4.34Å; W35-R44 WeakPolarHBondContact CZ3-O 3.47Å; V36-R44 WeakPolarHBondContact O-CA 3.27Å; M37-R44 HydrophobicContact CB-CG 4.33Å
45	V	92.1	Very high	86.5	Confident	79 Å²	79	109 Å²	109	48%	0.479	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.6	177.3	-176.3	0	0	0	0	109.4	W35 V36 I43 K47	W35-V45 WeakPolarHBondContact CA-O 3.38Å; V36-V45 PolarHBondContact N-O 2.94Å; V36-V45 PolarHBondContact O-N 2.71Å; I43-V45 HydrophobicContact CG2-CG2 4.22Å; V45-K47 PolarHBondContact O-N 2.7Å
46	Y	94.2	Very high	84.7	Confident	110 Å²	110	113.4 Å²	113.4	43%	0.431	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.3	120.6	169.8	-81.5	-62.6	0	0	0	109.9	K33 K34 W35	K33-Y46 HydrophobicContact CD-CD1 3.72Å; K33-Y46 HydrophobicContact CD-CE1 4.18Å; K33-Y46 HydrophobicContact CD-CG 3.89Å; K33-Y46 VanDerWaalsContact CE-CE1 3.46Å; K33-Y46 HydrophobicContact CG-CD1 3.59Å; K33-Y46 HydrophobicContact CG-CE1 4.28Å; K33-Y46 HydrophobicContact CG-CG 4.06Å; K33-Y46 VanDerWaalsContact NZ-CZ 3.28Å; K34-Y46 WeakPolarHBondContact O-CA 3.47Å; W35-Y46 AromaticContact CD1-CE1 3.56Å; W35-Y46 AromaticContact CD1-CZ 3.98Å; W35-Y46 AromaticContact CD2-CD1 3.84Å; W35-Y46 HydrophobicContact CD2-CD1 3.84Å; W35-Y46 HydrophobicContact CD2-CD2 4.3Å; W35-Y46 AromaticContact CD2-CE1 3.7Å; W35-Y46 HydrophobicContact CD2-CE1 3.7Å; W35-Y46 HydrophobicContact CD2-CE2 4.16Å; W35-Y46 HydrophobicContact CD2-CG 4.16Å; W35-Y46 AromaticContact CD2-CZ 3.85Å; W35-Y46 AromaticContact CE2-CD1 3.95Å; W35-Y46 AromaticContact CE2-CE1 3.36Å; W35-Y46 AromaticContact CE2-CE2 3.46Å; W35-Y46 VanDerWaalsContact CE2-CE2 3.46Å; W35-Y46 AromaticContact CE2-CZ 3.06Å; W35-Y46 VanDerWaalsContact CE2-OH 3.28Å; W35-Y46 HydrophobicContact CE3-CD1 4.2Å; W35-Y46 HydrophobicContact CE3-CD2 4.15Å; W35-Y46 HydrophobicContact CE3-CE1 4.42Å; W35-Y46 HydrophobicContact CE3-CE2 4.36Å; W35-Y46 HydrophobicContact CE3-CG 4.08Å; W35-Y46 HydrophobicContact CG-CD1 4.13Å; W35-Y46 AromaticContact CG-CE1 3.91Å; W35-Y46 HydrophobicContact CG-CE1 3.91Å; W35-Y46 AromaticContact CH2-CD2 3.54Å; W35-Y46 HydrophobicContact CH2-CD2 3.54Å; W35-Y46 AromaticContact CH2-CE2 3.3Å; W35-Y46 HydrophobicContact CH2-CE2 3.3Å; W35-Y46 HydrophobicContact CH2-CG 4.29Å; W35-Y46 AromaticContact CH2-CZ 3.88Å; W35-Y46 HydrophobicContact CZ2-CD1 4.45Å; W35-Y46 AromaticContact CZ2-CD2 3.72Å; W35-Y46 HydrophobicContact CZ2-CD2 3.72Å; W35-Y46 AromaticContact CZ2-CE1 3.9Å; W35-Y46 HydrophobicContact CZ2-CE1 3.9Å; W35-Y46 AromaticContact CZ2-CE2 3.02Å; W35-Y46 HydrophobicContact CZ2-CE2 3.02Å; W35-Y46 HydrophobicContact CZ2-CG 4.39Å; W35-Y46 AromaticContact CZ2-CZ 3.12Å; W35-Y46 VanDerWaalsContact CZ2-OH 3.3Å; W35-Y46 WeakPolarHBondContact CZ2-OH 3.5Å; W35-Y46 AromaticContact CZ3-CD2 3.76Å; W35-Y46 HydrophobicContact CZ3-CD2 3.76Å; W35-Y46 AromaticContact CZ3-CE2 3.97Å; W35-Y46 HydrophobicContact CZ3-CE2 3.97Å; W35-Y46 HydrophobicContact CZ3-CG 4.12Å; W35-Y46 AromaticContact NE1-CE1 3.24Å; W35-Y46 AromaticContact NE1-CZ 3.16Å; W35-Y46 PolarHBondContact NE1-OH 3.17Å
47	K	93.4	Very high	82.6	Confident	130 Å²	130	120.8 Å²	120.8	57%	0.565	59%	0.592	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-123.9	138.4	173.2	-171.7	173.3	-179.9	176.5	0	108.7	K34 V36 V45 V49	K34-K47 PolarHBondContact N-O 3.12Å; K34-K47 PolarHBondContact O-N 2.96Å; V36-K47 HydrophobicContact CB-CB 4.35Å; V36-K47 HydrophobicContact CG2-CB 3.8Å; V36-K47 HydrophobicContact CG2-CD 4.37Å; V45-K47 PolarHBondContact O-N 2.7Å; K47-V49 HydrophobicContact CB-CG2 4.29Å; K47-V49 HydrophobicContact CG-CG2 4.35Å; K47-V49 PolarHBondContact O-N 3.24Å
48	W	95.3	Very high	80.2	Confident	160 Å²	160	118.4 Å²	118.4	61%	0.606	60%	0.6	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70	113.3	165.7	-70.6	103.6	0	0	0	107.5	W31 K33	W31-W48 HydrophobicContact CB-CE3 4Å; W31-W48 HydrophobicContact CE3-CB 3.78Å; W31-W48 HydrophobicContact CZ3-CB 4.33Å; W31-W48 VanDerWaalsContact CZ3-O 3.23Å; W31-W48 WeakPolarHBondContact CZ3-O 3.43Å; K33-W48 HydrophobicContact CB-CD2 4.41Å; K33-W48 HydrophobicContact CB-CE3 4.14Å; K33-W48 HydrophobicContact CB-CH2 4.12Å; K33-W48 HydrophobicContact CB-CZ2 4.37Å; K33-W48 HydrophobicContact CB-CZ3 3.99Å
49	V	91.3	Very high	78.1	Confident	41 Å²	41	119.3 Å²	119.3	25%	0.248	62%	0.615	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.5	137	178.7	-178.2	0	0	0	0	106.9	E32 K34 V36 K47 V51	E32-V49 PolarHBondContact N-O 3.44Å; E32-V49 PolarHBondContact O-N 2.89Å; K34-V49 HydrophobicContact CB-CG2 4.19Å; K34-V49 HydrophobicContact CD-CB 4.32Å; K34-V49 HydrophobicContact CG-CB 4.24Å; K34-V49 HydrophobicContact CG-CG2 4.44Å; V36-V49 HydrophobicContact CG2-CG2 3.83Å; K47-V49 HydrophobicContact CB-CG2 4.29Å; K47-V49 HydrophobicContact CG-CG2 4.35Å; K47-V49 PolarHBondContact O-N 3.24Å; V49-V51 PolarHBondContact O-N 2.88Å
50	P	93.3	Very high	76.1	Confident	36 Å²	36	116.6 Å²	116.6	23%	0.234	62%	0.619	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-60.5	135.2	175.1	24.7	-34.7	0	0	0	111.3	R29 S52	R29-P50 VanDerWaalsContact NE-CB 3.3Å; P50-S52 PolarHBondContact O-N 3.48Å
51	V	89.1	Confident	73.9	Confident	36 Å²	36	112.1 Å²	112.1	22%	0.218	61%	0.606	C	S	.	*			trans	-69.2	115.5	175.8	-177.7	0	0	0	0	107.8	K30 E32 V49	K30-V51 HydrophobicContact CB-CB 3.9Å; K30-V51 HydrophobicContact CB-CG2 3.67Å; K30-V51 PolarHBondContact O-N 3.27Å; E32-V51 HydrophobicContact CB-CG2 3.72Å; E32-V51 HydrophobicContact CG-CB 4.5Å; E32-V51 HydrophobicContact CG-CG2 3.63Å; V49-V51 PolarHBondContact O-N 2.88Å
52	S	82.8	Confident	72.2	Confident	83 Å²	83	118.5 Å²	118.5	58%	0.58	64%	0.635	S	S	*	*			trans	-76.8	133.4	165.2	-62.7	0	0	0	0	108.6	P50 S54	P50-S52 PolarHBondContact O-N 3.48Å; S52-S54 PolarHBondContact O-N 3.09Å
53	E	70.6	Confident	70.1	Confident	174 Å²	174	120.7 Å²	120.7	81%	0.813	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-67.1	4.7	-172.1	-55.6	175.1	-158.9	0	0	113.7	Q55	E53-Q55 PolarHBondContact O-N 2.72Å
54	S	62.7	Low	67.4	Low	111 Å²	111	121.5 Å²	121.5	78%	0.776	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-86.2	8	-169.8	62	0	0	0	0	115.7	S52	S52-S54 PolarHBondContact O-N 3.09Å
55	Q	57	Low	65.1	Low	163 Å²	163	122 Å²	122	76%	0.762	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-127.4	31.9	-177.8	-154.1	179.4	-4.8	0	0	114.2	E53	E53-Q55 PolarHBondContact O-N 2.72Å
56	R	54.9	Low	62.4	Low	208 Å²	208	122.6 Å²	122.6	79%	0.785	66%	0.664	S	S	*	*			trans	-124.4	46.2	-179.2	-68.8	-92.2	-175.4	164.1	0.1	112.8
57	F	47.5	Very low	59.6	Low	212 Å²	212	123.3 Å²	123.3	93%	0.93	69%	0.685	S	S	*	*			trans	-141	81.2	162.9	-64.5	-73.7	0	0	0	109.5
58	G	41.7	Very low	57.6	Low	78 Å²	78	124.7 Å²	124.7	80%	0.804	69%	0.694	S	S	*	*			trans	-157.9	-4.4	-177.8	0	0	0	0	0	115.9	S60	G58-S60 PolarHBondContact O-N 3.15Å
59	S	45.3	Very low	55.1	Low	123 Å²	123	125.3 Å²	125.3	86%	0.86	70%	0.703	S	S	*	*			trans	-97.4	71.3	165.6	57.8	0	0	0	0	109.5	A61	S59-A61 PolarHBondContact O-N 3.29Å; S59-A61 VanDerWaalsContact O-N 3.15Å
60	S	39.2	Very low	52.8	Low	126 Å²	126	131.8 Å²	131.8	88%	0.881	74%	0.736	S	S	*	*			trans	-69.4	93.7	159	-174.5	0	0	0	0	107.7	G58	G58-S60 PolarHBondContact O-N 3.15Å
61	A	40.8	Very low	50.1	Low	73 Å²	73	134.3 Å²	134.3	60%	0.603	75%	0.754	S	S	*	*			trans	168.9	62.3	156.1	0	0	0	0	0	112.6	S59	S59-A61 PolarHBondContact O-N 3.29Å; S59-A61 VanDerWaalsContact O-N 3.15Å
62	I	51.3	Low	47.7	Very low	175 Å²	175	140.2 Å²	140.2	90%	0.897	78%	0.784	S	S	*	*			trans	-120.7	98.4	138.8	-61.5	-175.6	0	0	0	105.3
63	K	46.1	Very low	46.1	Very low	181 Å²	181	145.5 Å²	145.5	79%	0.787	80%	0.796	S	S	*	*			trans	-78.9	122	-178.9	-59	179.6	-178.3	-172.3	0	108.2
64	T	33.4	Very low	44.6	Very low	119 Å²	119	143 Å²	143	73%	0.73	80%	0.795	S	S	*	*			trans	65.8	100	131.6	-39.8	0	0	0	0	118.6
65	V	46.1	Very low	43.8	Very low	143 Å²	143	144.3 Å²	144.3	87%	0.867	80%	0.798	S	S	*	*				-138.5	90.3	125.3	-175.8	0	0	0	0	108.3
66	T	33.7	Very low	42.8	Very low	92 Å²	92	143.7 Å²	143.7	56%	0.564	80%	0.8	S	S	*	*			trans	59	96.5	136.4	-39.7	0	0	0	0	119.2	E68	T66-E68 HydrophobicContact CG2-CG 3.63Å
67	S	37	Very low	42.5	Very low	126 Å²	126	138.2 Å²	138.2	88%	0.881	80%	0.799	S	S	*	*			trans	-94.4	105.7	154.5	-70.5	0	0	0	0	109.1
68	E	50	Low	42.3	Very low	158 Å²	158	135.8 Å²	135.8	74%	0.738	80%	0.796	S	S	*	*			trans	174.9	122.1	166	40.8	-152.5	135.6	0	0	104.3	T66	T66-E68 HydrophobicContact CG2-CG 3.63Å
69	E	42.7	Very low	42.1	Very low	174 Å²	174	137.9 Å²	137.9	81%	0.813	79%	0.789	S	S	*	*			cis	-168.3	134.2	35.6	173.1	157.7	95.5	0	0	108.5	S71	E69-S71 PolarHBondContact O-N 2.94Å
70	L	44.2	Very low	42.4	Very low	176 Å²	176	139.6 Å²	139.6	92%	0.921	79%	0.787	S	S	*	*			trans	-77	94.2	165.9	-72.6	163.5	0	0	0	108.4
71	S	36.5	Very low	42.5	Very low	89 Å²	89	137.8 Å²	137.8	62%	0.622	78%	0.775	S	S	*	*			trans	-166.9	109.6	160.8	-96.8	0	0	0	0	114.8	E69	E69-S71 PolarHBondContact O-N 2.94Å
72	L	38.6	Very low	42.9	Very low	161 Å²	161	143 Å²	143	84%	0.843	79%	0.787	S	S	*	*			trans	35.3	113.1	134.8	-51.1	173.8	0	0	0	119.1
73	K	49.4	Very low	42.4	Very low	194 Å²	194	141.8 Å²	141.8	84%	0.843	78%	0.782	S	S	*	*				171.1	138.4	111.4	-91.1	179.4	-175.8	-171.2	0	111.4
74	P	37.9	Very low	41.9	Very low	121 Å²	121	136 Å²	136	79%	0.786	77%	0.773	S	S	*	*			trans	-85.6	132	173	34.4	-28.1	0	0	0	109.4
75	V	46.9	Very low	42.5	Very low	138 Å²	138	135.6 Å²	135.6	84%	0.836	78%	0.776	S	S	*	*			trans	-132.8	121.8	166.1	173.5	0	0	0	0	108
76	D	36.4	Very low	42	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	77%	0.77	S	S	*	*			trans	-66.5	173.4	178.2	-64.5	-64.9	0	0	0	113.5
77	A	48.7	Very low	42.2	Very low	94 Å²	94	139.1 Å²	139.1	78%	0.777	78%	0.777	S	S	*	*			trans	100.3	95.5	159.3	0	0	0	0	0	116.6
78	N	43.5	Very low	42.2	Very low	160 Å²	160	142.2 Å²	142.2	86%	0.856	78%	0.777	S	S	*	*				64.1	127.2	121.5	-106.1	12.1	0	0	0	120.4
79	D	37.1	Very low	41.6	Very low	123 Å²	123	140 Å²	140	66%	0.658	78%	0.779	S	S	*	*			trans	77.6	95.4	132.7	-153.9	20.8	0	0	0	117
80	L	52.1	Low	41.5	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	78%	0.778	S	S	*	*				-161.6	115.9	120.5	-128.5	67.7	0	0	0	111.5
81	S	40.3	Very low	41.1	Very low	88 Å²	88	134.8 Å²	134.8	62%	0.615	77%	0.768	S	S	*	*			trans	-53.5	169.8	157.8	43.4	0	0	0	0	114.2
82	Q	49.1	Very low	41.9	Very low	183 Å²	183	138 Å²	138	86%	0.855	78%	0.777	S	S	*	*			trans	89.6	134.6	175.7	-73.2	-177.6	-38.1	0	0	114.7
83	D	41.2	Very low	42	Very low	149 Å²	149	136 Å²	136	80%	0.797	78%	0.776	S	S	*	*			cis	-167.5	157.8	-1.1	-170.7	7.7	0	0	0	106.1
84	G	34.5	Very low	41.8	Very low	59 Å²	59	131.1 Å²	131.1	61%	0.608	77%	0.767	S	S	*	*			trans	-84.5	145.9	-179.4	0	0	0	0	0	113.7
85	S	45.9	Very low	42.3	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	77%	0.768	S	S	*	*			trans	-177.3	105.6	149.2	30.3	0	0	0	0	106.5
86	E	36.4	Very low	41.9	Very low	159 Å²	159	135.7 Å²	135.7	74%	0.743	77%	0.77	S	S	*	*				68.9	116.8	86.1	-79.2	-154.9	112	0	0	114.7
87	Q	37.5	Very low	42.1	Very low	150 Å²	150	136.4 Å²	136.4	70%	0.701	77%	0.773	S	S	*	*			trans	71.2	105.5	144.5	-58.5	176.9	16.4	0	0	118.2
88	Q	37.3	Very low	42	Very low	190 Å²	190	139.6 Å²	139.6	89%	0.888	77%	0.771	S	S	*	*				-159.6	125.3	116.3	-105.1	157.1	79	0	0	112
89	S	37	Very low	42.2	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	76%	0.758	S	S	*	*			trans	-77.8	119.9	178	50.5	0	0	0	0	110.8
90	E	40.7	Very low	42.7	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	76%	0.758	S	S	*	*			trans	-110.1	95.6	163.6	-75.4	-68.4	159.9	0	0	107.9	I92	E90-I92 PolarHBondContact O-N 2.88Å
91	G	36.8	Very low	42.5	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	76%	0.757	S	S	*	*			trans	-71.1	100.2	174.6	0	0	0	0	0	110.1	S93	G91-S93 PolarHBondContact O-N 3.11Å
92	I	52.9	Low	42.7	Very low	157 Å²	157	136.4 Å²	136.4	81%	0.805	76%	0.759	S	S	*	*			trans	-81.6	69.9	171	-5.6	173.6	0	0	0	109	E90 S94	E90-I92 PolarHBondContact O-N 2.88Å; I92-S94 PolarHBondContact O-N 2.96Å; I92-S94 VanDerWaalsContact O-N 3.09Å
93	S	40.5	Very low	42.6	Very low	119 Å²	119	139.1 Å²	139.1	83%	0.832	76%	0.762	S	S	*	*			trans	-79.4	73.8	166.6	-67.5	0	0	0	0	109.2	G91	G91-S93 PolarHBondContact O-N 3.11Å
94	S	45.6	Very low	42.8	Very low	92 Å²	92	139.3 Å²	139.3	64%	0.643	76%	0.762	S	S	*	*			trans	-112.8	60.5	163.2	67.2	0	0	0	0	109.9	I92 F96	I92-S94 PolarHBondContact O-N 2.96Å; I92-S94 VanDerWaalsContact O-N 3.09Å; S94-F96 VanDerWaalsContact C-N 3.31Å; S94-F96 PolarHBondContact O-N 3.45Å
95	L	47.6	Very low	43.3	Very low	155 Å²	155	144.1 Å²	144.1	81%	0.812	77%	0.773	S	S	*	*			trans	-70.9	94.7	166.1	-68.1	177.9	0	0	0	108.1	L97	L95-L97 PolarHBondContact O-N 3.11Å; L95-L97 VanDerWaalsContact O-N 3.17Å
96	F	40.2	Very low	43.5	Very low	199 Å²	199	145.8 Å²	145.8	87%	0.873	77%	0.772	S	S	*	*			trans	19.6	87.2	146.5	-73.8	-94.5	0	0	0	114.3	S94 H98	S94-F96 VanDerWaalsContact C-N 3.31Å; S94-F96 PolarHBondContact O-N 3.45Å; F96-H98 PolarHBondContact O-N 3.38Å
97	L	39.9	Very low	43.8	Very low	166 Å²	166	145 Å²	145	87%	0.869	77%	0.772	S	S	*	*			trans	-55.9	110.7	159	-92.7	94.6	0	0	0	107.5	L95	L95-L97 PolarHBondContact O-N 3.11Å; L95-L97 VanDerWaalsContact O-N 3.17Å
98	H	45.9	Very low	44.6	Very low	160 Å²	160	144 Å²	144	74%	0.741	77%	0.77	S	S	*	*			trans	-53.2	123.7	165	-166.9	-117.2	0	0	0	107.3	F96 S100	F96-H98 PolarHBondContact O-N 3.38Å; H98-S100 VanDerWaalsContact C-N 3.29Å; H98-S100 PolarHBondContact O-N 2.92Å
99	P	48.8	Very low	45.3	Very low	89 Å²	89	142.5 Å²	142.5	58%	0.578	76%	0.763	S	S	*	*			trans	-67.1	100.3	172.6	27.3	-28.6	0	0	0	105.8	F101	P99-F101 WeakPolarHBondContact O-CD2 3.37Å; P99-F101 PolarHBondContact O-N 3.15Å
100	S	47	Very low	46.1	Very low	95 Å²	95	143.8 Å²	143.8	66%	0.664	76%	0.761	S	S	*	*			trans	-50	110.7	162.7	-177	0	0	0	0	105.9	H98 S102	H98-S100 VanDerWaalsContact C-N 3.29Å; H98-S100 PolarHBondContact O-N 2.92Å; S100-S102 PolarHBondContact O-N 3.24Å
101	F	47.1	Very low	46.6	Very low	185 Å²	185	140.6 Å²	140.6	81%	0.811	76%	0.755	S	S	*	*			trans	-68.6	74.5	172.4	-84.1	-90.8	0	0	0	107.2	P99 R103	P99-F101 WeakPolarHBondContact O-CD2 3.37Å; P99-F101 PolarHBondContact O-N 3.15Å; F101-R103 PolarHBondContact O-N 3.13Å; F101-R103 VanDerWaalsContact O-N 3.13Å
102	S	45.4	Very low	46.8	Very low	93 Å²	93	142 Å²	142	65%	0.65	76%	0.76	S	S	*	*			trans	-58.1	116.9	166.5	-66.5	0	0	0	0	106.7	S100 L104	S100-S102 PolarHBondContact O-N 3.24Å; S102-L104 PolarHBondContact O-N 2.94Å; S102-L104 VanDerWaalsContact O-N 3.15Å
103	R	46.9	Very low	46.9	Very low	241 Å²	241	142.7 Å²	142.7	91%	0.909	76%	0.76	S	S	*	*			trans	-32.9	114.7	-179.3	-64.8	176.6	176.9	-177.8	-2	110.9	F101 N105	F101-R103 PolarHBondContact O-N 3.13Å; F101-R103 VanDerWaalsContact O-N 3.13Å; R103-N105 PolarHBondContact O-N 3.45Å
104	L	44.1	Very low	46.8	Very low	153 Å²	153	146.5 Å²	146.5	80%	0.801	76%	0.764	S	S	*	*			trans	-67.6	99.2	174.3	-69.1	176.5	0	0	0	108.5	S102 I106	S102-L104 PolarHBondContact O-N 2.94Å; S102-L104 VanDerWaalsContact O-N 3.15Å; L104-I106 PolarHBondContact O-N 3.44Å; L104-I106 VanDerWaalsContact O-N 3.15Å
105	N	45.5	Very low	46.7	Very low	159 Å²	159	145.3 Å²	145.3	85%	0.85	77%	0.766	S	S	*	*			trans	-63.9	109.3	157.1	-93.5	-4.4	0	0	0	107.3	R103 L107	R103-N105 PolarHBondContact O-N 3.45Å; N105-L107 PolarHBondContact O-N 3.45Å; N105-L107 VanDerWaalsContact O-N 3.11Å
106	I	50.3	Low	46.7	Very low	147 Å²	147	145.7 Å²	145.7	75%	0.754	77%	0.769	S	S	*	*			trans	-73.1	98.5	168.6	-68.5	162.4	0	0	0	106.1	L104 I108	L104-I106 PolarHBondContact O-N 3.44Å; L104-I106 VanDerWaalsContact O-N 3.15Å; I106-I108 HydrophobicContact CG2-CG1 3.88Å; I106-I108 PolarHBondContact O-N 3.26Å
107	L	42.8	Very low	46.7	Very low	144 Å²	144	143 Å²	143	75%	0.754	76%	0.763	S	S	*	*			trans	-79.9	100.7	169.7	-168.7	67.1	0	0	0	107.9	N105 Q109	N105-L107 PolarHBondContact O-N 3.45Å; N105-L107 VanDerWaalsContact O-N 3.11Å; L107-Q109 PolarHBondContact O-N 2.98Å
108	I	55.4	Low	47	Very low	128 Å²	128	139.8 Å²	139.8	66%	0.656	76%	0.755	S	S	*	*			trans	-76.4	100	168.9	-53.9	179.4	0	0	0	106.4	I106 L110	I106-I108 HydrophobicContact CG2-CG1 3.88Å; I106-I108 PolarHBondContact O-N 3.26Å; I108-L110 HydrophobicContact CG2-CG 4.03Å; I108-L110 PolarHBondContact O-N 2.96Å
109	Q	50.1	Low	47.1	Very low	159 Å²	159	138.4 Å²	138.4	74%	0.743	75%	0.753	S	S	*	*			trans	-82.7	95.5	170.5	-161.7	74.2	20.1	0	0	108.2	L107	L107-Q109 PolarHBondContact O-N 2.98Å
110	L	54.5	Low	47.1	Very low	138 Å²	138	141 Å²	141	72%	0.723	77%	0.767	S	S	*	*			trans	-78.2	136.5	167.5	-74.4	160.4	0	0	0	109	I108	I108-L110 HydrophobicContact CG2-CG 4.03Å; I108-L110 PolarHBondContact O-N 2.96Å
111	P	51.1	Low	47.5	Very low	105 Å²	105	146.8 Å²	146.8	68%	0.682	77%	0.774	S	S	*	*			trans	-67.3	137.1	170.9	27.8	-31.2	0	0	0	110	E113	P111-E113 PolarHBondContact O-N 3.06Å
112	A	42.1	Very low	47.2	Very low	97 Å²	97	143.1 Å²	143.1	80%	0.802	77%	0.767	S	S	*	*			trans	-70.8	104	177.9	0	0	0	0	0	109.6
113	E	53.5	Low	47.4	Very low	172 Å²	172	147.1 Å²	147.1	80%	0.804	78%	0.78	S	S	*	*			trans	-111.5	125.7	166.6	-67.7	-68	139.3	0	0	107.8	P111	P111-E113 PolarHBondContact O-N 3.06Å
114	E	39.4	Very low	47.5	Very low	199 Å²	199	140.2 Å²	140.2	93%	0.93	77%	0.769	S	S	*	*			trans	-72.2	130.5	-172.9	-49.9	-144.5	138	0	0	110.7
115	G	43.4	Very low	47.4	Very low	67 Å²	67	140.7 Å²	140.7	69%	0.691	77%	0.772	S	S	*	*			trans	161.5	84.8	173.1	0	0	0	0	0	116.1
116	L	47.8	Very low	47.6	Very low	164 Å²	164	141.4 Å²	141.4	86%	0.859	77%	0.768	S	S	*	*			trans	47.1	121.3	134.2	-64.7	159.1	0	0	0	121
117	D	39.5	Very low	47.3	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	77%	0.766	S	S	*	*			trans	83.2	114.5	144	-70.4	-22.2	0	0	0	122.9
118	S	46.1	Very low	47.8	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	76%	0.762	S	S	*	*			trans	57.4	102.7	140.2	64.4	0	0	0	0	119.6
119	D	49	Very low	47.6	Very low	131 Å²	131	138.9 Å²	138.9	70%	0.701	77%	0.771	S	S	*	*				177.3	112.3	107.9	-91.6	-15.7	0	0	0	111.6	R121	D119-R121 PolarHBondContact O-N 3.33Å
120	V	48.3	Very low	47.8	Very low	145 Å²	145	137 Å²	137	88%	0.879	77%	0.766	S	S	*	*			trans	-81.1	106	172.3	-176.9	0	0	0	0	107.8
121	R	54.5	Low	47.7	Very low	215 Å²	215	138.3 Å²	138.3	81%	0.811	77%	0.768	S	S	*	*			trans	-114.6	89.8	169.2	-70.1	-168.7	-179.1	-167.3	1.6	110.9	D119	D119-R121 PolarHBondContact O-N 3.33Å
122	T	41.9	Very low	47.7	Very low	108 Å²	108	140.5 Å²	140.5	66%	0.663	77%	0.774	S	S	*	*			trans	2.9	114.2	136.2	-48.6	0	0	0	0	115.8
123	L	49.7	Very low	48.5	Very low	177 Å²	177	140.8 Å²	140.8	93%	0.927	77%	0.771	S	S	*	*			trans	-126.6	86.5	148.1	-74.1	177.1	0	0	0	107.7
124	S	49.1	Very low	48.7	Very low	96 Å²	96	140 Å²	140	67%	0.671	77%	0.772	S	S	*	*			trans	-61.2	139	166.9	47.3	0	0	0	0	111.4
125	N	41.2	Very low	49.4	Very low	164 Å²	164	135.3 Å²	135.3	88%	0.877	77%	0.767	S	S	*	*			trans	-13.7	127.6	159	-67.7	-7.7	0	0	0	116.5
126	F	50.4	Low	49.9	Very low	173 Å²	173	141.5 Å²	141.5	76%	0.759	78%	0.776	S	S	*	*			trans	-100.1	114.3	152.5	-170.2	-96	0	0	0	107.9	E128	F126-E128 HydrophobicContact CE1-CB 3.95Å; F126-E128 HydrophobicContact CE1-CG 4.12Å; F126-E128 WeakPolarHBondContact CE1-OE2 3.31Å; F126-E128 HydrophobicContact CZ-CG 4.17Å; F126-E128 WeakPolarHBondContact CZ-OE1 3.35Å; F126-E128 WeakPolarHBondContact CZ-OE2 3.47Å
127	A	43	Very low	50.1	Low	87 Å²	87	138.3 Å²	138.3	72%	0.719	77%	0.767	S	S	*	*			trans	-104.7	136.2	171.1	0	0	0	0	0	108
128	E	54	Low	50.2	Low	143 Å²	143	141.1 Å²	141.1	67%	0.668	78%	0.776	S	S	*	*			trans	-165.4	102.1	165.4	-101.7	169.1	-167.8	0	0	105.9	F126	F126-E128 HydrophobicContact CE1-CB 3.95Å; F126-E128 HydrophobicContact CE1-CG 4.12Å; F126-E128 WeakPolarHBondContact CE1-OE2 3.31Å; F126-E128 HydrophobicContact CZ-CG 4.17Å; F126-E128 WeakPolarHBondContact CZ-OE1 3.35Å; F126-E128 WeakPolarHBondContact CZ-OE2 3.47Å
129	T	51.6	Low	50.4	Low	136 Å²	136	139.8 Å²	139.8	83%	0.834	78%	0.777	S	S	*	*				55	137.9	90.3	65.2	0	0	0	0	112.3
130	N	53.8	Low	50.5	Low	121 Å²	121	139.4 Å²	139.4	65%	0.647	78%	0.783	S	S	*	*			cis	-167.5	134	25.6	145	-45.6	0	0	0	106.2
131	E	52.5	Low	50.2	Low	164 Å²	164	141 Å²	141	77%	0.766	78%	0.779	S	S	*	*				81	141.2	107.7	-42.7	-171.5	130.6	0	0	120.5
132	D	50.2	Low	49.7	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	77%	0.77	S	S	*	*			trans	-3.3	139.1	162.9	-78.8	-36.9	0	0	0	121.3
133	S	59.3	Low	50.4	Low	104 Å²	104	136.9 Å²	136.9	73%	0.727	78%	0.778	S	S	*	*				-171.2	123	125.9	-81.1	0	0	0	0	114.1
134	N	58.4	Low	49.9	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	77%	0.772	S	S	*	*			trans	89.7	98.5	138.5	-60.3	-15.7	0	0	0	121.3
135	A	52.9	Low	50.3	Low	101 Å²	101	136.4 Å²	136.4	84%	0.835	78%	0.778	S	S	*	*			trans	-40.5	139.7	145.2	0	0	0	0	0	114.4
136	F	54	Low	50.8	Low	198 Å²	198	136 Å²	136	87%	0.868	78%	0.776	S	S	*	*			trans	-140.6	123.1	151	-178.5	-103.1	0	0	0	109.6
137	S	52.8	Low	51	Low	97 Å²	97	136.5 Å²	136.5	68%	0.678	78%	0.781	S	S	*	*			trans	-71.5	161.3	-172.4	-62.6	0	0	0	0	114.3	G139	S137-G139 PolarHBondContact O-N 2.97Å
138	E	42.1	Very low	51.1	Low	201 Å²	201	136.5 Å²	136.5	94%	0.939	78%	0.781	S	S	*	*			trans	-40.4	125.9	168.5	-61.3	-179.9	148.9	0	0	113.6
139	G	50.3	Low	50.3	Low	70 Å²	70	137.8 Å²	137.8	72%	0.722	79%	0.791	S	S	*	*			trans	-128.8	98.2	172.7	0	0	0	0	0	110.3	S137	S137-G139 PolarHBondContact O-N 2.97Å
140	C	51.1	Low	49.8	Very low	123 Å²	123	136.4 Å²	136.4	83%	0.831	79%	0.787	S	S	*	*			trans	1.9	118.5	164	-74.7	0	0	0	0	118.3
141	F	41.2	Very low	49.1	Very low	179 Å²	179	136.7 Å²	136.7	79%	0.785	80%	0.798	S	S	*	*			trans	-55.6	137.8	146	94.6	-68.7	0	0	0	108.7
142	N	44.3	Very low	48.4	Very low	117 Å²	117	132 Å²	132	63%	0.626	80%	0.795	S	S	*	*			trans	156.1	107.5	148.8	-76	-29.1	0	0	0	109.7
143	S	55.5	Low	47.8	Very low	119 Å²	119	132 Å²	132	83%	0.832	80%	0.8	S	S	*	*				163	122.8	121.7	-75.8	0	0	0	0	111.3
144	D	40.3	Very low	47.4	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	80%	0.804	S	S	*	*			trans	-44.2	136.4	163	-89.8	-52.6	0	0	0	112.8
145	S	58.2	Low	46.4	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	80%	0.8	S	S	*	*			trans	-161.6	88.6	148.4	-84.3	0	0	0	0	110.4	Q147	S145-Q147 PolarHBondContact O-N 3.32Å
146	N	50.8	Low	45.8	Very low	156 Å²	156	130.6 Å²	130.6	83%	0.834	80%	0.796	S	S	*	*			trans	-69.5	109.5	155.5	-72.4	-41.7	0	0	0	108.1
147	Q	54	Low	45.5	Very low	182 Å²	182	127.2 Å²	127.2	85%	0.85	79%	0.791	S	S	*	*			trans	-136.1	139.4	159.9	-78.8	-68.5	1.7	0	0	109.9	S145	S145-Q147 PolarHBondContact O-N 3.32Å
148	A	46	Very low	45.1	Very low	87 Å²	87	131.3 Å²	131.3	72%	0.719	80%	0.8	S	S	*	*			trans	-77.8	163.3	-156.4	0	0	0	0	0	115.2
149	L	36.9	Very low	45.4	Very low	171 Å²	171	127.4 Å²	127.4	90%	0.895	80%	0.795	S	S	*	*			trans	-38	131.2	172.7	-79.3	76	0	0	0	114.6
150	S	42	Very low	45.3	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	80%	0.798	S	S	*	*				-165.7	124.6	127.9	46.8	0	0	0	0	112.2
151	S	37.6	Very low	45	Very low	126 Å²	126	126.1 Å²	126.1	88%	0.881	79%	0.793	S	S	*	*			trans	48	101	140.9	-41	0	0	0	0	119.2
152	G	37.8	Very low	45.7	Very low	67 Å²	67	122.6 Å²	122.6	69%	0.691	79%	0.787	S	S	*	*			trans	172.9	107.3	164.5	0	0	0	0	0	114.6	V154	G152-V154 PolarHBondContact O-N 3.46Å
153	T	37.9	Very low	46.6	Very low	151 Å²	151	121.1 Å²	121.1	93%	0.926	78%	0.779	S	S	*	*			trans	-30.1	115.6	168.3	-46.4	0	0	0	0	114.8
154	V	50.3	Low	46.5	Very low	133 Å²	133	123.3 Å²	123.3	81%	0.806	77%	0.773	S	S	*	*			trans	-149.5	133.4	160.2	-82.7	0	0	0	0	111	G152 A156	G152-V154 PolarHBondContact O-N 3.46Å; V154-A156 PolarHBondContact O-N 2.64Å
155	S	37.3	Very low	47.4	Very low	105 Å²	105	124.7 Å²	124.7	73%	0.734	77%	0.768	S	S	*	*			trans	-35.8	113.6	172.8	48.2	0	0	0	0	114.9	V157	S155-V157 PolarHBondContact O-N 2.93Å; S155-V157 VanDerWaalsContact O-N 3.16Å
156	A	41.6	Very low	47.4	Very low	91 Å²	91	124.3 Å²	124.3	75%	0.752	75%	0.753	S	S	*	*			trans	-75.2	100.4	166.7	0	0	0	0	0	109.1	V154 E158	V154-A156 PolarHBondContact O-N 2.64Å; A156-E158 PolarHBondContact O-N 3.38Å
157	V	46.8	Very low	47.9	Very low	126 Å²	126	121.7 Å²	121.7	76%	0.764	74%	0.739	S	S	*	*			trans	-77	82.1	166.9	-159.8	0	0	0	0	106.3	S155 S159	S155-V157 PolarHBondContact O-N 2.93Å; S155-V157 VanDerWaalsContact O-N 3.16Å; V157-S159 VanDerWaalsContact C-N 3.3Å; V157-S159 PolarHBondContact O-N 2.97Å; V157-S159 VanDerWaalsContact O-N 3.14Å
158	E	46	Very low	48.5	Very low	184 Å²	184	115.4 Å²	115.4	86%	0.86	72%	0.715	S	S	*	*			trans	-87.9	66.2	-175.9	-153.2	176.9	-160	0	0	110.2	A156 G160	A156-E158 PolarHBondContact O-N 3.38Å; E158-G160 PolarHBondContact O-N 3.22Å
159	S	46.3	Very low	49.7	Very low	119 Å²	119	115.8 Å²	115.8	83%	0.832	70%	0.704	S	S	*	*			trans	-83	93.5	168.3	-78.1	0	0	0	0	109	V157	V157-S159 VanDerWaalsContact C-N 3.3Å; V157-S159 PolarHBondContact O-N 2.97Å; V157-S159 VanDerWaalsContact O-N 3.14Å
160	G	48.7	Very low	51	Low	77 Å²	77	113.5 Å²	113.5	79%	0.794	69%	0.688	S	S	*	*			trans	-170.9	3	-179.5	0	0	0	0	0	119.1	E158	E158-G160 PolarHBondContact O-N 3.22Å
161	A	44.8	Very low	52.1	Low	89 Å²	89	111.6 Å²	111.6	74%	0.736	68%	0.675	S	S	*	*			trans	-135.5	95.7	176.9	0	0	0	0	0	110.5	D163	A161-D163 VanDerWaalsContact C-N 3.31Å; A161-D163 PolarHBondContact O-N 3.41Å
162	T	55.8	Low	53	Low	105 Å²	105	108.8 Å²	108.8	64%	0.644	66%	0.655	S	S	*	*			trans	-67	96.2	161.6	38.6	0	0	0	0	107.5	F164	T162-F164 PolarHBondContact O-N 3.21Å
163	D	64.7	Low	54.3	Low	85 Å²	85	110.4 Å²	110.4	46%	0.455	65%	0.646	S	S	.	*			trans	-57	136.9	173.8	-175.8	-4.4	0	0	0	108.2	A161 R165 E166 L167	A161-D163 VanDerWaalsContact C-N 3.31Å; A161-D163 PolarHBondContact O-N 3.41Å; D163-R165 HydrophobicContact CB-CB 4.5Å; D163-R165 PolarHBondContact O-N 3.37Å; D163-R165 PolarHBondContact OD1-N 3.34Å; D163-R165 WeakPolarHBondContact OD2-CD 3.5Å; D163-E166 WeakPolarHBondContact O-CA 3.34Å; D163-E166 WeakPolarHBondContact O-CB 3.31Å; D163-E166 PolarHBondContact O-N 2.82Å; D163-L167 PolarHBondContact O-N 2.98Å
164	F	51.9	Low	55.3	Low	165 Å²	165	110.9 Å²	110.9	72%	0.724	63%	0.632	S	S	*	*	H	α-helix	trans	-50.1	-29.9	173.8	176.3	-96.1	0	0	0	111.8	T162 L167 S168	T162-F164 PolarHBondContact O-N 3.21Å; F164-L167 PolarHBondContact O-N 3.21Å; F164-S168 WeakPolarHBondContact O-CB 3.47Å; F164-S168 PolarHBondContact O-N 2.74Å
165	R	59.9	Low	55.8	Low	177 Å²	177	109.6 Å²	109.6	67%	0.668	62%	0.62	S	S	*	*	H	α-helix	trans	-59.7	-45	172	-67.4	-177.2	174.6	-102.9	0	112.4	D163 S168 I169	D163-R165 HydrophobicContact CB-CB 4.5Å; D163-R165 PolarHBondContact O-N 3.37Å; D163-R165 PolarHBondContact OD1-N 3.34Å; D163-R165 WeakPolarHBondContact OD2-CD 3.5Å; R165-S168 PolarHBondContact O-N 3.16Å; R165-S168 PolarHBondContact O-OG 3.14Å; R165-I169 WeakPolarHBondContact O-CB 3.46Å; R165-I169 WeakPolarHBondContact O-CD1 3.42Å; R165-I169 WeakPolarHBondContact O-CG1 3.47Å; R165-I169 PolarHBondContact O-N 3.37Å
166	E	58.7	Low	56.5	Low	107 Å²	107	113 Å²	113	50%	0.5	62%	0.617	S	S	.	*	H	α-helix	trans	-67.6	-39.2	-178.8	-158.7	175.3	-165.4	0	0	111.3	D163 I169 H170	D163-E166 WeakPolarHBondContact O-CA 3.34Å; D163-E166 WeakPolarHBondContact O-CB 3.31Å; D163-E166 PolarHBondContact O-N 2.82Å; E166-I169 PolarHBondContact O-N 3.16Å; E166-H170 WeakPolarHBondContact O-CB 3.35Å; E166-H170 PolarHBondContact O-N 2.74Å
167	L	61	Low	57.6	Low	102 Å²	102	118.5 Å²	118.5	53%	0.534	62%	0.619	S	S	.	*	H	α-helix	trans	-64.5	-39.5	171.9	-71.6	170	0	0	0	112.5	D163 F164 S171	D163-L167 PolarHBondContact O-N 2.98Å; F164-L167 PolarHBondContact O-N 3.21Å; L167-S171 WeakPolarHBondContact O-CB 3.4Å; L167-S171 PolarHBondContact O-N 3.25Å
168	S	65.8	Low	58.2	Low	50 Å²	50	118.5 Å²	118.5	35%	0.35	61%	0.614	S	S	.	*	H	α-helix	trans	-66.7	-40.9	176.9	76.2	0	0	0	0	111.7	F164 R165 C172	F164-S168 WeakPolarHBondContact O-CB 3.47Å; F164-S168 PolarHBondContact O-N 2.74Å; R165-S168 PolarHBondContact O-N 3.16Å; R165-S168 PolarHBondContact O-OG 3.14Å; S168-C172 WeakPolarHBondContact O-CB 3.37Å; S168-C172 PolarHBondContact O-N 3.18Å; S168-C172 PolarHBondContact O-SG 3.49Å
169	I	71.3	Confident	58.6	Low	94 Å²	94	117.8 Å²	117.8	48%	0.482	61%	0.611	S	S	.	*	H	α-helix	trans	-70.7	-43	178.8	-66.6	164.5	0	0	0	109.9	R165 E166 S171 C172 I173	R165-I169 WeakPolarHBondContact O-CB 3.46Å; R165-I169 WeakPolarHBondContact O-CD1 3.42Å; R165-I169 WeakPolarHBondContact O-CG1 3.47Å; R165-I169 PolarHBondContact O-N 3.37Å; E166-I169 PolarHBondContact O-N 3.16Å; I169-S171 PolarHBondContact O-N 3.36Å; I169-C172 PolarHBondContact O-N 3.24Å; I169-I173 HydrophobicContact CG2-CD1 3.52Å; I169-I173 HydrophobicContact CG2-CG1 4.14Å; I169-I173 WeakPolarHBondContact O-CB 3.42Å; I169-I173 VanDerWaalsContact O-CG1 3.25Å; I169-I173 WeakPolarHBondContact O-CG1 3.44Å; I169-I173 PolarHBondContact O-N 2.96Å
170	H	64.2	Low	58.8	Low	124 Å²	124	122.2 Å²	122.2	57%	0.574	62%	0.624	S	S	*	*	H	α-helix	trans	-61.8	-42.9	175.6	-115.9	106.1	0	0	0	111.8	E166 Y174	E166-H170 WeakPolarHBondContact O-CB 3.35Å; E166-H170 PolarHBondContact O-N 2.74Å; H170-Y174 VanDerWaalsContact O-CB 3.31Å; H170-Y174 WeakPolarHBondContact O-CB 3.33Å; H170-Y174 PolarHBondContact O-N 3.39Å
171	S	65.1	Low	59.3	Low	67 Å²	67	124.5 Å²	124.5	47%	0.469	62%	0.615	S	S	.	*	H	α-helix	trans	-64.1	-41.7	175	-179.4	0	0	0	0	111.8	L167 I169 Y174 I175	L167-S171 WeakPolarHBondContact O-CB 3.4Å; L167-S171 PolarHBondContact O-N 3.25Å; I169-S171 PolarHBondContact O-N 3.36Å; S171-Y174 PolarHBondContact O-N 3.36Å; S171-I175 VanDerWaalsContact O-CG1 3.25Å; S171-I175 WeakPolarHBondContact O-CG1 3.13Å; S171-I175 PolarHBondContact O-N 3.17Å; S171-I175 VanDerWaalsContact O-N 3.11Å
172	C	57.7	Low	60.1	Low	67 Å²	67	126.3 Å²	126.3	45%	0.453	61%	0.609	S	S	.	*	H	α-helix	trans	-64.9	-46.9	176.5	-72.7	0	0	0	0	112.2	S168 I169 Y174 I175 Y176	S168-C172 WeakPolarHBondContact O-CB 3.37Å; S168-C172 PolarHBondContact O-N 3.18Å; S168-C172 PolarHBondContact O-SG 3.49Å; I169-C172 PolarHBondContact O-N 3.24Å; C172-Y174 VanDerWaalsContact C-N 3.31Å; C172-Y174 PolarHBondContact O-N 3.43Å; C172-I175 PolarHBondContact O-N 3.17Å; C172-Y176 WeakPolarHBondContact O-CD2 3.48Å; C172-Y176 PolarHBondContact O-N 3.35Å; C172-Y176 VanDerWaalsContact O-N 3.07Å
173	I	65.2	Low	60.3	Low	100 Å²	100	127.5 Å²	127.5	51%	0.513	61%	0.607	S	S	.	*	H	α-helix	trans	-62.1	-40	178.3	-67.7	170.3	0	0	0	110.7	I169 I175 Y176 R177	I169-I173 HydrophobicContact CG2-CD1 3.52Å; I169-I173 HydrophobicContact CG2-CG1 4.14Å; I169-I173 WeakPolarHBondContact O-CB 3.42Å; I169-I173 VanDerWaalsContact O-CG1 3.25Å; I169-I173 WeakPolarHBondContact O-CG1 3.44Å; I169-I173 PolarHBondContact O-N 2.96Å; I173-I175 VanDerWaalsContact C-N 3.32Å; I173-I175 PolarHBondContact O-N 3.09Å; I173-Y176 PolarHBondContact O-N 3.41Å; I173-R177 WeakPolarHBondContact O-CB 3.01Å; I173-R177 PolarHBondContact O-N 3.38Å
174	Y	58.9	Low	60	Low	162 Å²	162	130 Å²	130	64%	0.635	62%	0.616	S	S	*	*	H	α-helix	trans	-66.5	-34.1	178.7	-146.4	-92.8	0	0	0	112.3	H170 S171 C172 L178	H170-Y174 VanDerWaalsContact O-CB 3.31Å; H170-Y174 WeakPolarHBondContact O-CB 3.33Å; H170-Y174 PolarHBondContact O-N 3.39Å; S171-Y174 PolarHBondContact O-N 3.36Å; C172-Y174 VanDerWaalsContact C-N 3.31Å; C172-Y174 PolarHBondContact O-N 3.43Å; Y174-L178 HydrophobicContact CD1-CD1 3.67Å; Y174-L178 HydrophobicContact CE1-CD1 3.52Å; Y174-L178 WeakPolarHBondContact O-CD1 3.29Å; Y174-L178 PolarHBondContact O-N 2.98Å
175	I	60.8	Low	60.6	Low	106 Å²	106	127.8 Å²	127.8	54%	0.544	61%	0.609	S	S	.	*	H	α-helix	trans	-68.7	-42.4	174.2	-67.7	167.4	0	0	0	111.2	S171 C172 I173	S171-I175 VanDerWaalsContact O-CG1 3.25Å; S171-I175 WeakPolarHBondContact O-CG1 3.13Å; S171-I175 PolarHBondContact O-N 3.17Å; S171-I175 VanDerWaalsContact O-N 3.11Å; C172-I175 PolarHBondContact O-N 3.17Å; I173-I175 VanDerWaalsContact C-N 3.32Å; I173-I175 PolarHBondContact O-N 3.09Å
176	Y	52.3	Low	60.6	Low	175 Å²	175	124.5 Å²	124.5	69%	0.686	61%	0.605	S	S	*	*	H	α-helix	trans	-71.4	-33	179.2	-77.1	-73	0	0	0	113.2	C172 I173 L178 Q179	C172-Y176 WeakPolarHBondContact O-CD2 3.48Å; C172-Y176 PolarHBondContact O-N 3.35Å; C172-Y176 VanDerWaalsContact O-N 3.07Å; I173-Y176 PolarHBondContact O-N 3.41Å; Y176-L178 VanDerWaalsContact C-N 3.33Å; Y176-Q179 PolarHBondContact O-N 3.47Å
177	R	63.8	Low	60.7	Low	208 Å²	208	125.8 Å²	125.8	79%	0.785	61%	0.613	S	S	*	*	H	α-helix	trans	-73.5	-22	178.2	-166.5	177.1	-178.6	165.7	1.3	113.5	I173	I173-R177 WeakPolarHBondContact O-CB 3.01Å; I173-R177 PolarHBondContact O-N 3.38Å
178	L	58.7	Low	60.7	Low	126 Å²	126	127.6 Å²	127.6	66%	0.66	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-8.6	173.9	-102.7	92.3	0	0	0	114	Y174 Y176	Y174-L178 HydrophobicContact CD1-CD1 3.67Å; Y174-L178 HydrophobicContact CE1-CD1 3.52Å; Y174-L178 WeakPolarHBondContact O-CD1 3.29Å; Y174-L178 PolarHBondContact O-N 2.98Å; Y176-L178 VanDerWaalsContact C-N 3.33Å
179	Q	55.3	Low	60.3	Low	168 Å²	168	134.1 Å²	134.1	79%	0.785	64%	0.641	S	S	*	*			trans	-101.9	-8.9	-174	-162.9	85.4	7.8	0	0	113.3	Y176	Y176-Q179 PolarHBondContact O-N 3.47Å
180	L	50.4	Low	59.3	Low	212 Å²	212	137.7 Å²	137.7	100%	1.11	66%	0.656	S	S	*	*			trans	-103.6	0	173.6	-92.2	128.6	0	0	0	110.4

Retrieved 180 of 180 residues in 54.5 ms (Link to these results)

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