A0A077YZH1_TRITR Loading...

Mitochondrial import inner membrane translocase s ubunit tim17 b-like protein

Essential component of the TIM23 complex, a complex that mediates the translocation of transit peptide-containing proteins across the mitochondrial inner membrane.

AlphaFold DB , UniProt , Accession A0A077YZH1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 207 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	29.1	Very low	55.3	Low	214 Å²	214	139.2 Å²	139.2	100%	1.054	68%	0.684	S	S	*	*				0	75.7	0	-68.5	-167.7	-67.4	0	0	107.5	E3	M1-E3 HydrophobicContact CB-CB 4.38Å; M1-E3 PolarHBondContact O-N 3.43Å; M1-E3 VanDerWaalsContact O-N 3.15Å
2	E	45	Very low	57.6	Low	202 Å²	202	129.9 Å²	129.9	94%	0.944	64%	0.636	S	S	*	*			trans	-81.9	68.7	152	-75.7	172.7	151	0	0	104.9	Y4	E2-Y4 PolarHBondContact O-N 2.68Å
3	E	41.1	Very low	60	Low	127 Å²	127	123.4 Å²	123.4	59%	0.593	61%	0.605	S	S	*	*			trans	-72.6	106.6	-177.5	-168.2	95.9	-165.5	0	0	107	M1 T5	M1-E3 HydrophobicContact CB-CB 4.38Å; M1-E3 PolarHBondContact O-N 3.43Å; M1-E3 VanDerWaalsContact O-N 3.15Å; E3-T5 VanDerWaalsContact C-N 3.3Å; E3-T5 PolarHBondContact O-N 3.5Å
4	Y	46	Very low	62.1	Low	143 Å²	143	121.3 Å²	121.3	56%	0.561	60%	0.603	S	S	*	*			trans	33.8	51.3	139.1	-81.8	-89.9	0	0	0	117.6	E2 R6	E2-Y4 PolarHBondContact O-N 2.68Å; Y4-R6 VanDerWaalsContact C-N 3.28Å
5	T	41.8	Very low	64	Low	139 Å²	139	120.5 Å²	120.5	85%	0.853	60%	0.601	S	S	*	*			trans	-92	10.6	163.1	40.5	0	0	0	0	112.1	E3	E3-T5 VanDerWaalsContact C-N 3.3Å; E3-T5 PolarHBondContact O-N 3.5Å
6	R	53.8	Low	65.6	Low	158 Å²	158	115.8 Å²	115.8	60%	0.596	58%	0.579	S	S	*	*	S	Bend	trans	-68.7	125.5	157.9	-98.5	-174.6	166.1	132.2	2.5	107.9	Y4	Y4-R6 VanDerWaalsContact C-N 3.28Å
7	E	53.4	Low	67.1	Low	120 Å²	120	111.2 Å²	111.2	56%	0.561	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-46.4	136.1	172.5	-84.6	89.9	-179.7	0	0	110.9	W11	E7-W11 HydrophobicContact CB-CB 4.01Å; E7-W11 HydrophobicContact CB-CG 4.24Å; E7-W11 HydrophobicContact CG-CG 4.38Å
8	P	60.6	Low	68.6	Low	105 Å²	105	107.2 Å²	107.2	68%	0.682	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-57.1	143.8	-177.4	22.7	-32.6	0	0	0	111	P10 W11	P8-P10 VanDerWaalsContact O-N 3.14Å; P8-W11 PolarHBondContact O-N 3.25Å
9	C	73.5	Confident	70	Confident	69 Å²	69	103.2 Å²	103.2	47%	0.466	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	120.8	165.9	-38	0	0	0	0	106	C78	C9-C78 HydrophobicContact CB-CB 4.13Å; C9-C78 WeakPolarHBondContact CB-SG 3.27Å; C9-C78 WeakPolarHBondContact SG-CB 3.38Å; C9-C78 CovalentContact SG-SG 2.06Å; C9-C78 PolarHBondContact SG-SG 3.2Å
10	P	77.4	Confident	71.1	Confident	95 Å²	95	98.8 Å²	98.8	62%	0.617	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	cis	-106.1	-1.6	34.4	37.8	-35.7	0	0	0	117.6	P8 R12 I13 V14	P8-P10 VanDerWaalsContact O-N 3.14Å; P10-R12 PolarHBondContact O-N 3.37Å; P10-I13 WeakPolarHBondContact O-CB 3.38Å; P10-I13 PolarHBondContact O-N 2.94Å; P10-V14 PolarHBondContact O-N 3.22Å
11	W	86.4	Confident	72.3	Confident	159 Å²	159	98.3 Å²	98.3	60%	0.602	51%	0.512	S	S	*	.	H	α-helix	trans	-62.6	-42.6	-172.2	-171.9	-105.1	0	0	0	112.8	E7 P8 I13 V14 D15	E7-W11 HydrophobicContact CB-CB 4.01Å; E7-W11 HydrophobicContact CB-CG 4.24Å; E7-W11 HydrophobicContact CG-CG 4.38Å; P8-W11 PolarHBondContact O-N 3.25Å; W11-I13 PolarHBondContact O-N 2.94Å; W11-V14 PolarHBondContact O-N 2.98Å; W11-D15 PolarHBondContact O-N 3.21Å
12	R	82.7	Confident	75.4	Confident	28 Å²	28	91 Å²	91	11%	0.106	48%	0.482	C	S	.	.	H	α-helix	trans	-53.6	-36.8	173	171.8	172.9	152.8	67.1	-6.3	113.4	P10 D16 D77	P10-R12 PolarHBondContact O-N 3.37Å; R12-D16 VanDerWaalsContact CG-OD2 3.27Å; R12-D16 WeakPolarHBondContact CG-OD2 3.04Å; R12-D16 IonicContact CZ-OD2 3.93Å; R12-D16 IonicContact NE-OD2 2.9Å; R12-D16 IonicContact NH1-OD1 3.95Å; R12-D16 IonicContact NH1-OD2 2.67Å; R12-D16 PolarHBondContact NH1-OD2 3.35Å; R12-D16 VanDerWaalsContact O-CB 3.27Å; R12-D16 WeakPolarHBondContact O-CB 3.37Å; R12-D16 PolarHBondContact O-N 3Å; R12-D16 VanDerWaalsContact O-OD2 3.12Å; R12-D77 IonicContact CZ-OD2 3.49Å; R12-D77 IonicContact NH2-OD2 3.73Å; R12-D77 PolarHBondContact NH2-OD2 3.46Å
13	I	88.6	Confident	77.7	Confident	45 Å²	45	88.4 Å²	88.4	23%	0.231	47%	0.471	C	S	.	.	H	α-helix	trans	-68.3	-40.5	179.8	-57.9	170.5	0	0	0	109.9	P10 W11 C17 A75	P10-I13 WeakPolarHBondContact O-CB 3.38Å; P10-I13 PolarHBondContact O-N 2.94Å; W11-I13 PolarHBondContact O-N 2.94Å; I13-C17 VanDerWaalsContact O-CB 3.29Å; I13-C17 WeakPolarHBondContact O-CB 3.33Å; I13-C17 PolarHBondContact O-N 3.11Å; I13-C17 PolarHBondContact O-SG 2.83Å; I13-A75 HydrophobicContact CD1-CB 4.32Å
14	V	90.1	Very high	80.2	Confident	94 Å²	94	82.4 Å²	82.4	57%	0.57	44%	0.444	S	S	*	.	H	α-helix	trans	-68.1	-42.4	179	-179.2	0	0	0	0	110.7	P10 W11 C17 G18	P10-V14 PolarHBondContact O-N 3.22Å; W11-V14 PolarHBondContact O-N 2.98Å; V14-C17 PolarHBondContact O-N 3.37Å; V14-G18 PolarHBondContact O-N 2.79Å
15	D	90.9	Very high	82.5	Confident	109 Å²	109	76.8 Å²	76.8	58%	0.583	43%	0.427	S	S	*	.	H	α-helix	trans	-64.6	-45.8	176.8	-168.1	54	0	0	0	111.7	W11 C17 G18 G19	W11-D15 PolarHBondContact O-N 3.21Å; D15-C17 PolarHBondContact O-N 2.94Å; D15-G18 PolarHBondContact O-N 3.3Å; D15-G18 VanDerWaalsContact O-N 3.14Å; D15-G19 PolarHBondContact O-N 2.88Å
16	D	89.9	Confident	85.1	Confident	46 Å²	46	74.6 Å²	74.6	25%	0.246	41%	0.414	C	S	.	.	H	α-helix	trans	-66.5	-37.3	177.6	-71.2	-35.7	0	0	0	111.9	R12 A20 S74	R12-D16 VanDerWaalsContact CG-OD2 3.27Å; R12-D16 WeakPolarHBondContact CG-OD2 3.04Å; R12-D16 IonicContact CZ-OD2 3.93Å; R12-D16 IonicContact NE-OD2 2.9Å; R12-D16 IonicContact NH1-OD1 3.95Å; R12-D16 IonicContact NH1-OD2 2.67Å; R12-D16 PolarHBondContact NH1-OD2 3.35Å; R12-D16 VanDerWaalsContact O-CB 3.27Å; R12-D16 WeakPolarHBondContact O-CB 3.37Å; R12-D16 PolarHBondContact O-N 3Å; R12-D16 VanDerWaalsContact O-OD2 3.12Å; D16-A20 WeakPolarHBondContact O-CB 3.33Å; D16-A20 PolarHBondContact O-N 3.15Å; D16-S74 WeakPolarHBondContact CB-OG 3.43Å; D16-S74 VanDerWaalsContact OD2-CB 3.32Å; D16-S74 WeakPolarHBondContact OD2-CB 3.25Å; D16-S74 PolarHBondContact OD2-OG 3.33Å
17	C	91.2	Very high	86.9	Confident	38 Å²	38	69 Å²	69	26%	0.257	40%	0.404	S	S	.	.	H	α-helix	trans	-59.3	-46	170.3	-74.5	0	0	0	0	111.5	I13 V14 D15 F21 G71	I13-C17 VanDerWaalsContact O-CB 3.29Å; I13-C17 WeakPolarHBondContact O-CB 3.33Å; I13-C17 PolarHBondContact O-N 3.11Å; I13-C17 PolarHBondContact O-SG 2.83Å; V14-C17 PolarHBondContact O-N 3.37Å; D15-C17 PolarHBondContact O-N 2.94Å; C17-F21 VanDerWaalsContact O-CB 3.25Å; C17-F21 WeakPolarHBondContact O-CB 3.2Å; C17-F21 PolarHBondContact O-N 3.24Å; C17-G71 WeakPolarHBondContact SG-CA 3.15Å
18	G	93.5	Very high	88.8	Confident	38 Å²	38	63.6 Å²	63.6	39%	0.392	38%	0.381	S	S	.	.	H	α-helix	trans	-68	-45.6	-178.6	0	0	0	0	0	112.4	V14 D15 F21 S22	V14-G18 PolarHBondContact O-N 2.79Å; D15-G18 PolarHBondContact O-N 3.3Å; D15-G18 VanDerWaalsContact O-N 3.14Å; G18-F21 PolarHBondContact O-N 3.41Å; G18-S22 PolarHBondContact O-N 3.47Å
19	G	94.2	Very high	90.3	Very high	31 Å²	31	58.8 Å²	58.8	32%	0.32	35%	0.351	S	S	.	.	H	α-helix	trans	-57.7	-51.6	173.4	0	0	0	0	0	111	D15 F21 S22 M23	D15-G19 PolarHBondContact O-N 2.88Å; G19-F21 PolarHBondContact O-N 2.92Å; G19-S22 PolarHBondContact O-N 3.3Å; G19-S22 PolarHBondContact O-OG 2.88Å; G19-M23 WeakPolarHBondContact O-CG 3.33Å; G19-M23 PolarHBondContact O-N 3.43Å
20	A	93.9	Very high	91.3	Very high	16 Å²	16	60.2 Å²	60.2	13%	0.132	35%	0.353	C	S	.	.	H	α-helix	trans	-64.3	-37.9	178.2	0	0	0	0	0	112.8	D16 M23 G24 F66	D16-A20 WeakPolarHBondContact O-CB 3.33Å; D16-A20 PolarHBondContact O-N 3.15Å; A20-M23 PolarHBondContact O-N 3.47Å; A20-G24 PolarHBondContact O-N 2.88Å; A20-F66 HydrophobicContact CB-CB 4.44Å; A20-F66 VanDerWaalsContact CB-O 3.27Å; A20-F66 WeakPolarHBondContact CB-O 3.44Å; A20-F66 WeakPolarHBondContact O-CB 3.33Å
21	F	94.7	Very high	92	Very high	89 Å²	89	60.7 Å²	60.7	39%	0.39	35%	0.346	S	S	.	.	H	α-helix	trans	-59.3	-47.9	173	-179.7	-98	0	0	0	111.4	C17 G18 G19 G24 A25 A67	C17-F21 VanDerWaalsContact O-CB 3.25Å; C17-F21 WeakPolarHBondContact O-CB 3.2Å; C17-F21 PolarHBondContact O-N 3.24Å; G18-F21 PolarHBondContact O-N 3.41Å; G19-F21 PolarHBondContact O-N 2.92Å; F21-G24 PolarHBondContact O-N 3.2Å; F21-A25 HydrophobicContact CE1-CB 4.33Å; F21-A25 WeakPolarHBondContact O-CB 3.44Å; F21-A25 PolarHBondContact O-N 2.96Å; F21-A67 HydrophobicContact CB-CB 3.93Å; F21-A67 HydrophobicContact CD2-CB 4.3Å
22	S	95.7	Very high	92.2	Very high	60 Å²	60	54.4 Å²	54.4	42%	0.42	32%	0.323	S	S	.	.	H	α-helix	trans	-63.4	-43.4	179.7	76.1	0	0	0	0	111.7	G18 G19 G24 A25 V26	G18-S22 PolarHBondContact O-N 3.47Å; G19-S22 PolarHBondContact O-N 3.3Å; G19-S22 PolarHBondContact O-OG 2.88Å; S22-G24 PolarHBondContact O-N 3.34Å; S22-A25 PolarHBondContact O-N 3.02Å; S22-V26 WeakPolarHBondContact O-CB 3.31Å; S22-V26 VanDerWaalsContact O-CG2 3.29Å; S22-V26 WeakPolarHBondContact O-CG2 3.45Å; S22-V26 PolarHBondContact O-N 3.37Å
23	M	93.1	Very high	92.6	Very high	147 Å²	147	53.5 Å²	53.5	72%	0.724	32%	0.322	S	S	*	.	H	α-helix	trans	-61.7	-44	176.1	-69.6	-161.7	82	0	0	111.4	G19 A20 G27	G19-M23 WeakPolarHBondContact O-CG 3.33Å; G19-M23 PolarHBondContact O-N 3.43Å; A20-M23 PolarHBondContact O-N 3.47Å; M23-G27 PolarHBondContact O-N 2.73Å
24	G	93.6	Very high	92.7	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-68.5	-37.7	176.9	0	0	0	0	0	113.3	A20 F21 S22 G28	A20-G24 PolarHBondContact O-N 2.88Å; F21-G24 PolarHBondContact O-N 3.2Å; S22-G24 PolarHBondContact O-N 3.34Å; G24-G28 WeakPolarHBondContact O-CA 3.38Å; G24-G28 PolarHBondContact O-N 3.48Å
25	A	94.1	Very high	92.6	Very high	25 Å²	25	58.3 Å²	58.3	21%	0.207	33%	0.33	C	S	.	.	H	α-helix	trans	-71.1	-43.7	179.5	0	0	0	0	0	111.8	F21 S22 G29	F21-A25 HydrophobicContact CE1-CB 4.33Å; F21-A25 WeakPolarHBondContact O-CB 3.44Å; F21-A25 PolarHBondContact O-N 2.96Å; S22-A25 PolarHBondContact O-N 3.02Å; A25-G29 VanDerWaalsContact O-CA 3.3Å; A25-G29 WeakPolarHBondContact O-CA 3.34Å; A25-G29 PolarHBondContact O-N 2.79Å
26	V	94.8	Very high	92.5	Very high	93 Å²	93	53.8 Å²	53.8	56%	0.564	31%	0.309	S	S	*	.	H	α-helix	trans	-70.2	-52.6	177.2	175.7	0	0	0	0	110.3	S22 G29 I30	S22-V26 WeakPolarHBondContact O-CB 3.31Å; S22-V26 VanDerWaalsContact O-CG2 3.29Å; S22-V26 WeakPolarHBondContact O-CG2 3.45Å; S22-V26 PolarHBondContact O-N 3.37Å; V26-G29 PolarHBondContact O-N 3.23Å; V26-I30 HydrophobicContact CG1-CD1 3.91Å; V26-I30 WeakPolarHBondContact O-CB 3.13Å; V26-I30 VanDerWaalsContact O-CG1 3.27Å; V26-I30 WeakPolarHBondContact O-CG1 3.3Å; V26-I30 PolarHBondContact O-N 3.44Å
27	G	93.3	Very high	92.4	Very high	39 Å²	39	54.1 Å²	54.1	40%	0.402	31%	0.31	S	S	.	.	H	α-helix	trans	-65.1	-48.1	-179	0	0	0	0	0	112.6	M23 G29 I30 F31	M23-G27 PolarHBondContact O-N 2.73Å; G27-G29 VanDerWaalsContact C-N 3.3Å; G27-G29 PolarHBondContact O-N 3.21Å; G27-I30 PolarHBondContact O-N 3.38Å; G27-F31 WeakPolarHBondContact O-CB 3.37Å; G27-F31 PolarHBondContact O-N 2.99Å
28	G	91.8	Very high	92.1	Very high	7 Å²	7	61.2 Å²	61.2	7%	0.072	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-37.5	175	0	0	0	0	0	111.9	G24 H32	G24-G28 WeakPolarHBondContact O-CA 3.38Å; G24-G28 PolarHBondContact O-N 3.48Å; G28-H32 VanDerWaalsContact O-CB 3.23Å; G28-H32 WeakPolarHBondContact O-CB 3.49Å; G28-H32 PolarHBondContact O-CD2 2.86Å; G28-H32 PolarHBondContact O-N 3.45Å
29	G	93.7	Very high	91.9	Very high	5 Å²	5	65 Å²	65	5%	0.052	35%	0.347	C	S	.	.	H	α-helix	trans	-67.5	-45.5	178.3	0	0	0	0	0	113.6	A25 V26 G27 G33 L55	A25-G29 VanDerWaalsContact O-CA 3.3Å; A25-G29 WeakPolarHBondContact O-CA 3.34Å; A25-G29 PolarHBondContact O-N 2.79Å; V26-G29 PolarHBondContact O-N 3.23Å; G27-G29 VanDerWaalsContact C-N 3.3Å; G27-G29 PolarHBondContact O-N 3.21Å; G29-G33 WeakPolarHBondContact O-CA 3.07Å; G29-G33 PolarHBondContact O-N 2.9Å; G29-L55 VanDerWaalsContact C-CD1 3.5Å; G29-L55 WeakPolarHBondContact O-CD1 3.26Å
30	I	94.2	Very high	91.5	Very high	98 Å²	98	64.1 Å²	64.1	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-51.3	174.3	-70.1	169.6	0	0	0	109.8	V26 G27 G33 F34	V26-I30 HydrophobicContact CG1-CD1 3.91Å; V26-I30 WeakPolarHBondContact O-CB 3.13Å; V26-I30 VanDerWaalsContact O-CG1 3.27Å; V26-I30 WeakPolarHBondContact O-CG1 3.3Å; V26-I30 PolarHBondContact O-N 3.44Å; G27-I30 PolarHBondContact O-N 3.38Å; I30-G33 PolarHBondContact O-N 2.64Å; I30-F34 HydrophobicContact CG2-CD2 3.65Å; I30-F34 HydrophobicContact CG2-CE2 3.65Å; I30-F34 WeakPolarHBondContact O-CD2 3.38Å; I30-F34 PolarHBondContact O-N 2.8Å
31	F	91.4	Very high	91	Very high	106 Å²	106	67.7 Å²	67.7	47%	0.465	36%	0.359	S	S	.	.	H	α-helix	trans	-63	-49.1	-177	-179.3	-102.9	0	0	0	112.6	G27 R35	G27-F31 WeakPolarHBondContact O-CB 3.37Å; G27-F31 PolarHBondContact O-N 2.99Å; F31-R35 VanDerWaalsContact O-CB 3.26Å; F31-R35 WeakPolarHBondContact O-CB 3.39Å; F31-R35 PolarHBondContact O-N 2.9Å
32	H	91.4	Very high	90.3	Very high	27 Å²	27	67.5 Å²	67.5	13%	0.125	37%	0.373	C	S	.	.	H	α-helix	trans	-72.2	-33.3	179.4	-74.2	-65	0	0	0	112.5	G28 R35 G36 S54 R58	G28-H32 VanDerWaalsContact O-CB 3.23Å; G28-H32 WeakPolarHBondContact O-CB 3.49Å; G28-H32 PolarHBondContact O-CD2 2.86Å; G28-H32 PolarHBondContact O-N 3.45Å; H32-R35 PolarHBondContact O-N 2.86Å; H32-G36 WeakPolarHBondContact O-CA 3.44Å; H32-G36 PolarHBondContact O-N 2.9Å; H32-S54 PolarHBondContact O-OG 3.04Å; H32-S54 VanDerWaalsContact O-OG 3.04Å; H32-R58 HydrophobicContact CB-CB 3.99Å; H32-R58 VanDerWaalsContact ND1-CD 3.3Å; H32-R58 WeakPolarHBondContact ND1-CD 3.19Å
33	G	91.4	Very high	89.8	Confident	9 Å²	9	66.2 Å²	66.2	9%	0.093	37%	0.37	C	S	.	.	H	α-helix	trans	-62.7	-50.1	173.6	0	0	0	0	0	111.9	G29 I30 R35 G36 M37	G29-G33 WeakPolarHBondContact O-CA 3.07Å; G29-G33 PolarHBondContact O-N 2.9Å; I30-G33 PolarHBondContact O-N 2.64Å; G33-R35 PolarHBondContact O-N 3.21Å; G33-G36 PolarHBondContact O-N 2.87Å; G33-M37 VanDerWaalsContact O-CG 3.32Å; G33-M37 WeakPolarHBondContact O-CG 3.23Å; G33-M37 PolarHBondContact O-N 3.34Å
34	F	90.9	Very high	89.4	Confident	107 Å²	107	65.7 Å²	65.7	47%	0.469	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-42.3	175.5	-80.9	-64.7	0	0	0	112.4	I30 M37 R38	I30-F34 HydrophobicContact CG2-CD2 3.65Å; I30-F34 HydrophobicContact CG2-CE2 3.65Å; I30-F34 WeakPolarHBondContact O-CD2 3.38Å; I30-F34 PolarHBondContact O-N 2.8Å; F34-M37 HydrophobicContact CB-CE 4.46Å; F34-M37 HydrophobicContact CD1-CE 3.36Å; F34-M37 HydrophobicContact CE1-CE 3.73Å; F34-M37 HydrophobicContact CG-CE 4.05Å; F34-M37 PolarHBondContact O-N 3.14Å; F34-R38 WeakPolarHBondContact O-CG 3.31Å; F34-R38 PolarHBondContact O-N 3.29Å
35	R	87.9	Confident	89.2	Confident	133 Å²	133	70.5 Å²	70.5	50%	0.502	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-42.4	176.7	-174.1	174.4	176	178	-1	111.7	F31 H32 G33 R38 T39	F31-R35 VanDerWaalsContact O-CB 3.26Å; F31-R35 WeakPolarHBondContact O-CB 3.39Å; F31-R35 PolarHBondContact O-N 2.9Å; H32-R35 PolarHBondContact O-N 2.86Å; G33-R35 PolarHBondContact O-N 3.21Å; R35-R38 PolarHBondContact O-N 2.99Å; R35-T39 PolarHBondContact O-N 3.38Å; R35-T39 PolarHBondContact O-OG1 2.94Å
36	G	87.2	Confident	89	Confident	14 Å²	14	75.2 Å²	75.2	14%	0.144	41%	0.414	C	S	.	.	H	α-helix	trans	-63.2	-42.2	176.9	0	0	0	0	0	112.4	H32 G33 R38 T39 A40 S54	H32-G36 WeakPolarHBondContact O-CA 3.44Å; H32-G36 PolarHBondContact O-N 2.9Å; G33-G36 PolarHBondContact O-N 2.87Å; G36-R38 VanDerWaalsContact C-N 3.26Å; G36-R38 PolarHBondContact O-N 3.29Å; G36-T39 PolarHBondContact O-N 3.35Å; G36-A40 WeakPolarHBondContact O-CB 3.31Å; G36-A40 PolarHBondContact O-N 3.01Å; G36-S54 WeakPolarHBondContact CA-OG 3.34Å
37	M	88.1	Confident	88.7	Confident	52 Å²	52	76.3 Å²	76.3	26%	0.256	41%	0.408	S	S	.	.	H	α-helix	trans	-60.9	-34.4	174	-72.6	-170	-69.3	0	0	112.8	G33 F34 R47 L48	G33-M37 VanDerWaalsContact O-CG 3.32Å; G33-M37 WeakPolarHBondContact O-CG 3.23Å; G33-M37 PolarHBondContact O-N 3.34Å; F34-M37 HydrophobicContact CB-CE 4.46Å; F34-M37 HydrophobicContact CD1-CE 3.36Å; F34-M37 HydrophobicContact CE1-CE 3.73Å; F34-M37 HydrophobicContact CG-CE 4.05Å; F34-M37 PolarHBondContact O-N 3.14Å; M37-R47 WeakPolarHBondContact CG-O 3.47Å; M37-R47 WeakPolarHBondContact O-CG 3.1Å; M37-L48 HydrophobicContact SD-CD2 3.94Å
38	R	85.8	Confident	88.6	Confident	187 Å²	187	78.9 Å²	78.9	71%	0.706	41%	0.413	S	S	*	.	H	α-helix	trans	-78	-33.7	178.8	-70.3	-175.7	-165	123.1	0.6	113.2	F34 R35 G36	F34-R38 WeakPolarHBondContact O-CG 3.31Å; F34-R38 PolarHBondContact O-N 3.29Å; R35-R38 PolarHBondContact O-N 2.99Å; G36-R38 VanDerWaalsContact C-N 3.26Å; G36-R38 PolarHBondContact O-N 3.29Å
39	T	88.8	Confident	88.5	Confident	117 Å²	117	84.1 Å²	84.1	72%	0.718	44%	0.438	S	S	*	.	H	α-helix	trans	-84.3	-18.2	178.1	-56.7	0	0	0	0	112.6	R35 G36	R35-T39 PolarHBondContact O-N 3.38Å; R35-T39 PolarHBondContact O-OG1 2.94Å; G36-T39 PolarHBondContact O-N 3.35Å
40	A	86	Confident	88.3	Confident	14 Å²	14	84.8 Å²	84.8	12%	0.116	45%	0.445	C	S	.	.	S	Bend	trans	-66.6	149.9	178.4	0	0	0	0	0	113.3	G36 R47	G36-A40 WeakPolarHBondContact O-CB 3.31Å; G36-A40 PolarHBondContact O-N 3.01Å; A40-R47 HydrophobicContact CB-CB 4.48Å; A40-R47 HydrophobicContact CB-CG 4.17Å
41	P	82.8	Confident	88.2	Confident	91 Å²	91	80.3 Å²	80.3	59%	0.591	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-60.2	158.9	179.7	25	-34.6	0	0	0	112.7	G43 K46	P41-G43 PolarHBondContact O-N 3.46Å; P41-K46 HydrophobicContact CG-CB 4.45Å; P41-K46 HydrophobicContact CG-CD 4.47Å
42	A	80.6	Confident	88.1	Confident	84 Å²	84	81.8 Å²	81.8	69%	0.694	43%	0.429	S	S	*	.	S	Bend	trans	-58.4	134.8	-176.7	0	0	0	0	0	112.7
43	G	84	Confident	88.1	Confident	34 Å²	34	83.4 Å²	83.4	35%	0.351	44%	0.444	S	S	.	.	S	Bend	trans	131.5	130.6	-178.6	0	0	0	0	0	111.6	P41 T45 K46 R47	P41-G43 PolarHBondContact O-N 3.46Å; G43-T45 PolarHBondContact O-N 3.39Å; G43-K46 PolarHBondContact O-N 3.45Å; G43-R47 WeakPolarHBondContact O-CB 3.41Å; G43-R47 VanDerWaalsContact O-CG 3.26Å; G43-R47 WeakPolarHBondContact O-CG 3.28Å; G43-R47 PolarHBondContact O-N 3.49Å
44	L	86	Confident	88.1	Confident	136 Å²	136	83.6 Å²	83.6	71%	0.712	44%	0.443	S	S	*	.	H	α-helix	trans	-60.1	-46.7	-176.5	-178.1	61.2	0	0	0	111.7	R47 L48	L44-R47 PolarHBondContact O-N 3.47Å; L44-L48 HydrophobicContact CD1-CD1 4.37Å; L44-L48 HydrophobicContact CD1-CG 4.43Å; L44-L48 HydrophobicContact CG-CD1 4.28Å; L44-L48 VanDerWaalsContact O-CG 3.31Å; L44-L48 WeakPolarHBondContact O-CG 3.4Å; L44-L48 PolarHBondContact O-N 3.43Å
45	T	89.6	Confident	88.1	Confident	102 Å²	102	81.3 Å²	81.3	63%	0.626	44%	0.436	S	S	*	.	H	α-helix	trans	-63.6	-45.4	177.5	49.4	0	0	0	0	112.3	G43 R47 L48 I49	G43-T45 PolarHBondContact O-N 3.39Å; T45-R47 VanDerWaalsContact C-N 3.33Å; T45-R47 PolarHBondContact O-N 3.08Å; T45-L48 PolarHBondContact O-N 2.88Å; T45-I49 WeakPolarHBondContact O-CB 2.91Å; T45-I49 WeakPolarHBondContact O-CD1 3.43Å; T45-I49 VanDerWaalsContact O-CG1 3.23Å; T45-I49 WeakPolarHBondContact O-CG1 3.21Å; T45-I49 PolarHBondContact O-N 3.19Å
46	K	88.4	Confident	88.3	Confident	125 Å²	125	84.3 Å²	84.3	54%	0.543	45%	0.447	S	S	.	.	H	α-helix	trans	-63.3	-38	177.3	-67.4	-176.8	-178.6	176.4	0	112.3	P41 G43 G50	P41-K46 HydrophobicContact CG-CB 4.45Å; P41-K46 HydrophobicContact CG-CD 4.47Å; G43-K46 PolarHBondContact O-N 3.45Å; K46-G50 PolarHBondContact O-N 2.85Å
47	R	89.3	Confident	88.5	Confident	115 Å²	115	89.9 Å²	89.9	43%	0.434	47%	0.469	S	S	.	.	H	α-helix	trans	-66.1	-45.4	174.8	-75	-179.2	170.8	-169.9	-2.4	112.1	M37 A40 G43 L44 T45 G50 G51	M37-R47 WeakPolarHBondContact CG-O 3.47Å; M37-R47 WeakPolarHBondContact O-CG 3.1Å; A40-R47 HydrophobicContact CB-CB 4.48Å; A40-R47 HydrophobicContact CB-CG 4.17Å; G43-R47 WeakPolarHBondContact O-CB 3.41Å; G43-R47 VanDerWaalsContact O-CG 3.26Å; G43-R47 WeakPolarHBondContact O-CG 3.28Å; G43-R47 PolarHBondContact O-N 3.49Å; L44-R47 PolarHBondContact O-N 3.47Å; T45-R47 VanDerWaalsContact C-N 3.33Å; T45-R47 PolarHBondContact O-N 3.08Å; R47-G50 PolarHBondContact O-N 3.27Å; R47-G51 PolarHBondContact O-N 2.99Å
48	L	91.1	Very high	88.7	Confident	94 Å²	94	92.5 Å²	92.5	49%	0.492	48%	0.476	S	S	.	.	H	α-helix	trans	-64.4	-42.4	177.1	-69.6	175.7	0	0	0	111.6	M37 L44 T45 G51 F52	M37-L48 HydrophobicContact SD-CD2 3.94Å; L44-L48 HydrophobicContact CD1-CD1 4.37Å; L44-L48 HydrophobicContact CD1-CG 4.43Å; L44-L48 HydrophobicContact CG-CD1 4.28Å; L44-L48 VanDerWaalsContact O-CG 3.31Å; L44-L48 WeakPolarHBondContact O-CG 3.4Å; L44-L48 PolarHBondContact O-N 3.43Å; T45-L48 PolarHBondContact O-N 2.88Å; L48-G51 PolarHBondContact O-N 3.36Å; L48-F52 VanDerWaalsContact O-CB 3.32Å; L48-F52 WeakPolarHBondContact O-CB 3.19Å; L48-F52 PolarHBondContact O-N 2.9Å
49	I	90.6	Very high	89	Confident	117 Å²	117	84.1 Å²	84.1	60%	0.6	45%	0.447	S	S	*	.	H	α-helix	trans	-64.2	-45.4	176.1	-67.3	165.1	0	0	0	110.8	T45 G51 F52 S53	T45-I49 WeakPolarHBondContact O-CB 2.91Å; T45-I49 WeakPolarHBondContact O-CD1 3.43Å; T45-I49 VanDerWaalsContact O-CG1 3.23Å; T45-I49 WeakPolarHBondContact O-CG1 3.21Å; T45-I49 PolarHBondContact O-N 3.19Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-F52 PolarHBondContact O-N 3.12Å; I49-S53 WeakPolarHBondContact O-CB 3.48Å; I49-S53 PolarHBondContact O-N 3.28Å; I49-S53 PolarHBondContact O-OG 3.45Å
50	G	89.6	Confident	89.2	Confident	19 Å²	19	81.8 Å²	81.8	20%	0.196	43%	0.434	C	S	.	.	H	α-helix	trans	-65.9	-35.7	176.8	0	0	0	0	0	113.2	K46 R47 S53 S54	K46-G50 PolarHBondContact O-N 2.85Å; R47-G50 PolarHBondContact O-N 3.27Å; G50-S53 WeakPolarHBondContact CA-OG 3.27Å; G50-S53 PolarHBondContact O-OG 3.4Å; G50-S54 VanDerWaalsContact O-CB 3.3Å; G50-S54 WeakPolarHBondContact O-CB 3.24Å; G50-S54 PolarHBondContact O-N 2.97Å; G50-S54 PolarHBondContact O-OG 3.46Å
51	G	90.5	Very high	89.6	Confident	4 Å²	4	85.9 Å²	85.9	4%	0.041	45%	0.453	C	S	.	.	H	α-helix	trans	-63.2	-49.9	170.8	0	0	0	0	0	111.5	R47 L48 I49 S54 L55	R47-G51 PolarHBondContact O-N 2.99Å; L48-G51 PolarHBondContact O-N 3.36Å; I49-G51 VanDerWaalsContact C-N 3.35Å; G51-S54 PolarHBondContact O-N 2.93Å; G51-S54 PolarHBondContact O-OG 3.4Å; G51-L55 WeakPolarHBondContact O-CB 3.18Å; G51-L55 PolarHBondContact O-N 3.49Å
52	F	91.2	Very high	90.1	Very high	136 Å²	136	82.6 Å²	82.6	60%	0.596	43%	0.431	S	S	*	.	H	α-helix	trans	-65.8	-39	180	-171.5	-101.9	0	0	0	112.8	L48 I49 L55 R56	L48-F52 VanDerWaalsContact O-CB 3.32Å; L48-F52 WeakPolarHBondContact O-CB 3.19Å; L48-F52 PolarHBondContact O-N 2.9Å; I49-F52 PolarHBondContact O-N 3.12Å; F52-L55 HydrophobicContact CD2-CD2 4.27Å; F52-L55 WeakPolarHBondContact O-CB 3.28Å; F52-L55 PolarHBondContact O-N 2.84Å; F52-R56 WeakPolarHBondContact O-CB 3.43Å; F52-R56 PolarHBondContact O-N 3.27Å
53	S	91	Very high	90.7	Very high	62 Å²	62	78.6 Å²	78.6	43%	0.434	40%	0.398	S	S	.	.	H	α-helix	trans	-64.4	-43.8	174.4	67.8	0	0	0	0	111.1	I49 G50 L55 R56 E57	I49-S53 WeakPolarHBondContact O-CB 3.48Å; I49-S53 PolarHBondContact O-N 3.28Å; I49-S53 PolarHBondContact O-OG 3.45Å; G50-S53 WeakPolarHBondContact CA-OG 3.27Å; G50-S53 PolarHBondContact O-OG 3.4Å; S53-L55 VanDerWaalsContact C-N 3.33Å; S53-L55 PolarHBondContact O-N 2.86Å; S53-R56 PolarHBondContact O-N 2.06Å; S53-E57 WeakPolarHBondContact O-CB 3.09Å; S53-E57 PolarHBondContact O-N 3.45Å
54	S	91.1	Very high	91.2	Very high	13 Å²	13	78.2 Å²	78.2	9%	0.091	39%	0.394	C	S	.	.	H	α-helix	trans	-65.7	-35.3	176.6	73.7	0	0	0	0	113.1	H32 G36 G50 G51 R58	H32-S54 PolarHBondContact O-OG 3.04Å; H32-S54 VanDerWaalsContact O-OG 3.04Å; G36-S54 WeakPolarHBondContact CA-OG 3.34Å; G50-S54 VanDerWaalsContact O-CB 3.3Å; G50-S54 WeakPolarHBondContact O-CB 3.24Å; G50-S54 PolarHBondContact O-N 2.97Å; G50-S54 PolarHBondContact O-OG 3.46Å; G51-S54 PolarHBondContact O-N 2.93Å; G51-S54 PolarHBondContact O-OG 3.4Å; S54-R58 VanDerWaalsContact O-CB 3.25Å; S54-R58 WeakPolarHBondContact O-CB 3.22Å; S54-R58 WeakPolarHBondContact O-CG 3.24Å; S54-R58 PolarHBondContact O-N 3.06Å
55	L	91.4	Very high	91.5	Very high	58 Å²	58	73.7 Å²	73.7	30%	0.304	37%	0.369	S	S	.	.	H	α-helix	trans	-62.4	-52.7	173.3	167	63.1	0	0	0	110.1	G29 G51 F52 S53 E57 R58 A59	G29-L55 VanDerWaalsContact C-CD1 3.5Å; G29-L55 WeakPolarHBondContact O-CD1 3.26Å; G51-L55 WeakPolarHBondContact O-CB 3.18Å; G51-L55 PolarHBondContact O-N 3.49Å; F52-L55 HydrophobicContact CD2-CD2 4.27Å; F52-L55 WeakPolarHBondContact O-CB 3.28Å; F52-L55 PolarHBondContact O-N 2.84Å; S53-L55 VanDerWaalsContact C-N 3.33Å; S53-L55 PolarHBondContact O-N 2.86Å; L55-E57 VanDerWaalsContact C-N 3.33Å; L55-E57 PolarHBondContact O-N 3.04Å; L55-R58 PolarHBondContact O-N 2.67Å; L55-A59 HydrophobicContact CD1-CB 3.86Å; L55-A59 WeakPolarHBondContact O-CB 3.49Å; L55-A59 PolarHBondContact O-N 2.9Å
56	R	91.1	Very high	91.7	Very high	197 Å²	197	72.2 Å²	72.2	74%	0.743	35%	0.354	S	S	*	.	H	α-helix	trans	-63.5	-37.1	-177.7	-174.9	176.4	-179.8	179.3	0.8	112.8	F52 S53 P60	F52-R56 WeakPolarHBondContact O-CB 3.43Å; F52-R56 PolarHBondContact O-N 3.27Å; S53-R56 PolarHBondContact O-N 2.06Å; R56-P60 VanDerWaalsContact O-CD 3.28Å; R56-P60 WeakPolarHBondContact O-CD 3.41Å; R56-P60 WeakPolarHBondContact O-CG 3.1Å
57	E	91.9	Very high	92	Very high	130 Å²	130	67 Å²	67	61%	0.607	34%	0.335	S	S	*	.	H	α-helix	trans	-75	-41	179.8	-171.3	-179.2	-178	0	0	111.9	S53 L55 I61	S53-E57 WeakPolarHBondContact O-CB 3.09Å; S53-E57 PolarHBondContact O-N 3.45Å; L55-E57 VanDerWaalsContact C-N 3.33Å; L55-E57 PolarHBondContact O-N 3.04Å; E57-I61 WeakPolarHBondContact O-CD1 3.39Å; E57-I61 WeakPolarHBondContact O-CG1 3.4Å
58	R	91.6	Very high	92.2	Very high	108 Å²	108	65.2 Å²	65.2	41%	0.408	34%	0.336	S	S	.	.	H	α-helix	trans	-100.4	-30.4	-168.8	-58.6	-179.3	179.5	-132.4	0.3	114.8	H32 S54 L55 I61 V62	H32-R58 HydrophobicContact CB-CB 3.99Å; H32-R58 VanDerWaalsContact ND1-CD 3.3Å; H32-R58 WeakPolarHBondContact ND1-CD 3.19Å; S54-R58 VanDerWaalsContact O-CB 3.25Å; S54-R58 WeakPolarHBondContact O-CB 3.22Å; S54-R58 WeakPolarHBondContact O-CG 3.24Å; S54-R58 PolarHBondContact O-N 3.06Å; L55-R58 PolarHBondContact O-N 2.67Å; R58-I61 PolarHBondContact O-N 2.88Å; R58-V62 WeakPolarHBondContact O-CG2 3.36Å; R58-V62 PolarHBondContact O-N 3.26Å
59	A	92.7	Very high	92.3	Very high	11 Å²	11	63.9 Å²	63.9	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-56.6	-47.8	179.7	0	0	0	0	0	113.9	L55 I61 V62 G63	L55-A59 HydrophobicContact CD1-CB 3.86Å; L55-A59 WeakPolarHBondContact O-CB 3.49Å; L55-A59 PolarHBondContact O-N 2.9Å; A59-I61 VanDerWaalsContact C-N 3.32Å; A59-I61 PolarHBondContact O-N 3.31Å; A59-V62 PolarHBondContact O-N 2.86Å; A59-G63 PolarHBondContact O-N 3.32Å
60	P	93.2	Very high	92.4	Very high	68 Å²	68	58.5 Å²	58.5	44%	0.442	30%	0.298	S	S	.	.	H	α-helix	trans	-70.3	-28.9	179.2	27.3	-34.6	0	0	0	112.8	R56 G64	R56-P60 VanDerWaalsContact O-CD 3.28Å; R56-P60 WeakPolarHBondContact O-CD 3.41Å; R56-P60 WeakPolarHBondContact O-CG 3.1Å; P60-G64 PolarHBondContact O-N 2.82Å
61	I	94.1	Very high	92.5	Very high	99 Å²	99	58.1 Å²	58.1	51%	0.508	29%	0.294	S	S	.	.	H	α-helix	trans	-66.5	-51	176	-60.9	174.1	0	0	0	109.5	E57 R58 A59 G64 Q65	E57-I61 WeakPolarHBondContact O-CD1 3.39Å; E57-I61 WeakPolarHBondContact O-CG1 3.4Å; R58-I61 PolarHBondContact O-N 2.88Å; A59-I61 VanDerWaalsContact C-N 3.32Å; A59-I61 PolarHBondContact O-N 3.31Å; I61-G64 PolarHBondContact O-N 2.65Å; I61-Q65 WeakPolarHBondContact O-CG 3.41Å; I61-Q65 PolarHBondContact O-N 3.46Å
62	V	92.8	Very high	92.6	Very high	23 Å²	23	59.7 Å²	59.7	14%	0.139	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-44.6	177.3	177.8	0	0	0	0	110.6	R58 A59 G64 Q65 F66	R58-V62 WeakPolarHBondContact O-CG2 3.36Å; R58-V62 PolarHBondContact O-N 3.26Å; A59-V62 PolarHBondContact O-N 2.86Å; V62-G64 PolarHBondContact O-N 2.92Å; V62-Q65 WeakPolarHBondContact O-CB 3.48Å; V62-Q65 PolarHBondContact O-N 2.84Å; V62-F66 HydrophobicContact CG1-CD2 3.74Å; V62-F66 HydrophobicContact CG1-CE2 3.7Å; V62-F66 WeakPolarHBondContact O-CD2 3.22Å; V62-F66 PolarHBondContact O-N 3.15Å
63	G	94.5	Very high	92.6	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-54.9	-47.6	173.4	0	0	0	0	0	112.7	A59 Q65 F66 A67	A59-G63 PolarHBondContact O-N 3.32Å; G63-Q65 VanDerWaalsContact C-N 3.33Å; G63-Q65 PolarHBondContact O-N 3.03Å; G63-F66 PolarHBondContact O-N 3.45Å; G63-A67 WeakPolarHBondContact O-CB 3.4Å; G63-A67 PolarHBondContact O-N 3.43Å
64	G	93.5	Very high	92.5	Very high	25 Å²	25	52.1 Å²	52.1	26%	0.258	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-37.1	177.6	0	0	0	0	0	113.2	P60 I61 V62 A67 V68	P60-G64 PolarHBondContact O-N 2.82Å; I61-G64 PolarHBondContact O-N 2.65Å; V62-G64 PolarHBondContact O-N 2.92Å; G64-A67 WeakPolarHBondContact O-CB 3.33Å; G64-A67 PolarHBondContact O-N 3.47Å; G64-V68 WeakPolarHBondContact O-CG2 3.36Å; G64-V68 PolarHBondContact O-N 2.84Å
65	Q	92	Very high	92.5	Very high	41 Å²	41	53.1 Å²	53.1	19%	0.192	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-45.3	174.4	-71.9	-41	-66.6	0	0	112.5	I61 V62 G63 A67 V68 W69 F193	I61-Q65 WeakPolarHBondContact O-CG 3.41Å; I61-Q65 PolarHBondContact O-N 3.46Å; V62-Q65 WeakPolarHBondContact O-CB 3.48Å; V62-Q65 PolarHBondContact O-N 2.84Å; G63-Q65 VanDerWaalsContact C-N 3.33Å; G63-Q65 PolarHBondContact O-N 3.03Å; Q65-A67 VanDerWaalsContact C-N 3.34Å; Q65-V68 PolarHBondContact O-N 2.92Å; Q65-W69 PolarHBondContact O-N 3.02Å; Q65-W69 VanDerWaalsContact O-N 3.12Å; Q65-F193 HydrophobicContact CB-CD1 3.53Å; Q65-F193 HydrophobicContact CB-CE1 3.42Å; Q65-F193 VanDerWaalsContact CB-CE1 3.42Å; Q65-F193 HydrophobicContact CB-CE2 4.44Å; Q65-F193 HydrophobicContact CB-CG 4.13Å; Q65-F193 HydrophobicContact CB-CZ 3.88Å; Q65-F193 HydrophobicContact CG-CD1 3.56Å; Q65-F193 HydrophobicContact CG-CE1 3.84Å; Q65-F193 HydrophobicContact CG-CG 4.31Å
66	F	93.1	Very high	92.5	Very high	71 Å²	71	51.1 Å²	51.1	31%	0.311	26%	0.261	S	S	.	.	H	α-helix	trans	-66	-36.8	174.5	-83.8	-79.8	0	0	0	112	A20 V62 G63 V68 W69 G70 F193	A20-F66 HydrophobicContact CB-CB 4.44Å; A20-F66 VanDerWaalsContact CB-O 3.27Å; A20-F66 WeakPolarHBondContact CB-O 3.44Å; A20-F66 WeakPolarHBondContact O-CB 3.33Å; V62-F66 HydrophobicContact CG1-CD2 3.74Å; V62-F66 HydrophobicContact CG1-CE2 3.7Å; V62-F66 WeakPolarHBondContact O-CD2 3.22Å; V62-F66 PolarHBondContact O-N 3.15Å; G63-F66 PolarHBondContact O-N 3.45Å; F66-V68 PolarHBondContact O-N 3.3Å; F66-W69 PolarHBondContact O-N 3.23Å; F66-G70 PolarHBondContact O-N 3.44Å; F66-F193 HydrophobicContact CZ-CE2 4.45Å
67	A	94.9	Very high	92.4	Very high	17 Å²	17	42.3 Å²	42.3	14%	0.14	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-44.3	175.5	0	0	0	0	0	112.1	F21 G63 G64 Q65 W69 G70 G71	F21-A67 HydrophobicContact CB-CB 3.93Å; F21-A67 HydrophobicContact CD2-CB 4.3Å; G63-A67 WeakPolarHBondContact O-CB 3.4Å; G63-A67 PolarHBondContact O-N 3.43Å; G64-A67 WeakPolarHBondContact O-CB 3.33Å; G64-A67 PolarHBondContact O-N 3.47Å; Q65-A67 VanDerWaalsContact C-N 3.34Å; A67-W69 VanDerWaalsContact C-N 3.34Å; A67-G70 PolarHBondContact O-N 3.2Å; A67-G71 PolarHBondContact O-N 3.43Å
68	V	94.3	Very high	92.1	Very high	76 Å²	76	37.1 Å²	37.1	46%	0.461	21%	0.206	S	C	.	.	H	α-helix	trans	-62.6	-43.8	175.5	171.7	0	0	0	0	110.7	G64 Q65 F66 V72 V103	G64-V68 WeakPolarHBondContact O-CG2 3.36Å; G64-V68 PolarHBondContact O-N 2.84Å; Q65-V68 PolarHBondContact O-N 2.92Å; F66-V68 PolarHBondContact O-N 3.3Å; V68-V72 HydrophobicContact CG1-CG2 4.36Å; V68-V72 WeakPolarHBondContact O-CB 3.39Å; V68-V72 VanDerWaalsContact O-CG2 3.26Å; V68-V72 WeakPolarHBondContact O-CG2 3.46Å; V68-V72 PolarHBondContact O-N 2.8Å; V68-V103 HydrophobicContact CG1-CG1 3.91Å
69	W	92.7	Very high	91.8	Very high	66 Å²	66	36 Å²	36	25%	0.25	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-46.8	177.1	-172.4	89.5	0	0	0	111.9	Q65 F66 A67 F73 T99 L123	Q65-W69 PolarHBondContact O-N 3.02Å; Q65-W69 VanDerWaalsContact O-N 3.12Å; F66-W69 PolarHBondContact O-N 3.23Å; A67-W69 VanDerWaalsContact C-N 3.34Å; W69-F73 WeakPolarHBondContact O-CB 3.32Å; W69-F73 PolarHBondContact O-N 3.09Å; W69-T99 HydrophobicContact CD2-CG2 4.38Å; W69-T99 HydrophobicContact CG-CG2 4.11Å; W69-T99 WeakPolarHBondContact O-CG2 3.22Å; W69-L123 HydrophobicContact CH2-CD1 3.84Å; W69-L123 HydrophobicContact CZ2-CD1 3.71Å
70	G	92.4	Very high	91.4	Very high	5 Å²	5	36.4 Å²	36.4	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-44	177.1	0	0	0	0	0	112.9	F66 A67 F73 S74	F66-G70 PolarHBondContact O-N 3.44Å; A67-G70 PolarHBondContact O-N 3.2Å; G70-F73 WeakPolarHBondContact O-CB 3.27Å; G70-F73 PolarHBondContact O-N 3Å; G70-S74 PolarHBondContact O-N 3.32Å; G70-S74 PolarHBondContact O-OG 3.44Å; G70-S74 VanDerWaalsContact O-OG 3.05Å
71	G	91.6	Very high	90.9	Very high	10 Å²	10	33.6 Å²	33.6	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-43.6	178.2	0	0	0	0	0	113.4	C17 A67 A75	C17-G71 WeakPolarHBondContact SG-CA 3.15Å; A67-G71 PolarHBondContact O-N 3.43Å; G71-A75 WeakPolarHBondContact O-CB 3.27Å; G71-A75 PolarHBondContact O-N 3.01Å
72	V	93	Very high	90.2	Very high	37 Å²	37	35 Å²	35	22%	0.224	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-39.3	175.9	175.6	0	0	0	0	110.4	V68 S74 A75 V76 T99 L102 V103	V68-V72 HydrophobicContact CG1-CG2 4.36Å; V68-V72 WeakPolarHBondContact O-CB 3.39Å; V68-V72 VanDerWaalsContact O-CG2 3.26Å; V68-V72 WeakPolarHBondContact O-CG2 3.46Å; V68-V72 PolarHBondContact O-N 2.8Å; V72-S74 PolarHBondContact O-N 3.02Å; V72-A75 PolarHBondContact O-N 3.05Å; V72-V76 HydrophobicContact CG1-CG2 4.15Å; V72-V76 WeakPolarHBondContact O-CB 3.47Å; V72-V76 VanDerWaalsContact O-CG2 3.27Å; V72-V76 WeakPolarHBondContact O-CG2 3.23Å; V72-V76 PolarHBondContact O-N 3.21Å; V72-T99 HydrophobicContact CB-CG2 3.96Å; V72-T99 HydrophobicContact CG1-CG2 3.83Å; V72-L102 HydrophobicContact CG1-CB 3.98Å; V72-L102 HydrophobicContact CG1-CD1 3.85Å; V72-V103 HydrophobicContact CB-CG1 4.17Å; V72-V103 HydrophobicContact CG1-CG1 4.36Å; V72-V103 HydrophobicContact CG2-CG1 4.05Å
73	F	92.2	Very high	89.7	Confident	39 Å²	39	39 Å²	39	17%	0.171	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-51.3	174.6	176.9	-109.1	0	0	0	112	W69 G70 A75 V76 D77 S95 T99 L123	W69-F73 WeakPolarHBondContact O-CB 3.32Å; W69-F73 PolarHBondContact O-N 3.09Å; G70-F73 WeakPolarHBondContact O-CB 3.27Å; G70-F73 PolarHBondContact O-N 3Å; F73-A75 PolarHBondContact O-N 3.37Å; F73-V76 PolarHBondContact O-N 3.02Å; F73-D77 VanDerWaalsContact O-CB 3.28Å; F73-D77 WeakPolarHBondContact O-CB 3.35Å; F73-D77 PolarHBondContact O-N 3.38Å; F73-S95 WeakPolarHBondContact CE2-OG 3.08Å; F73-T99 VanDerWaalsContact CA-OG1 3.23Å; F73-T99 WeakPolarHBondContact CA-OG1 3.16Å; F73-T99 HydrophobicContact CB-CG2 4.1Å; F73-T99 PolarHBondContact N-OG1 3.33Å; F73-L123 HydrophobicContact CD2-CD2 3.94Å; F73-L123 HydrophobicContact CE2-CD2 3.11Å; F73-L123 HydrophobicContact CZ-CD2 3.57Å
74	S	89.5	Confident	88.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68.1	-35.1	180	-52.1	0	0	0	0	112.8	D16 G70 V72 C78	D16-S74 WeakPolarHBondContact CB-OG 3.43Å; D16-S74 VanDerWaalsContact OD2-CB 3.32Å; D16-S74 WeakPolarHBondContact OD2-CB 3.25Å; D16-S74 PolarHBondContact OD2-OG 3.33Å; G70-S74 PolarHBondContact O-N 3.32Å; G70-S74 PolarHBondContact O-OG 3.44Å; G70-S74 VanDerWaalsContact O-OG 3.05Å; V72-S74 PolarHBondContact O-N 3.02Å; S74-C78 VanDerWaalsContact O-CB 3.24Å; S74-C78 WeakPolarHBondContact O-CB 3.4Å; S74-C78 PolarHBondContact O-N 2.74Å; S74-C78 PolarHBondContact O-SG 3.42Å
75	A	90.3	Very high	87.8	Confident	35 Å²	35	52.3 Å²	52.3	29%	0.289	27%	0.265	S	S	.	.	H	α-helix	trans	-64	-44.9	174.3	0	0	0	0	0	111.8	I13 G71 V72 F73 T79	I13-A75 HydrophobicContact CD1-CB 4.32Å; G71-A75 WeakPolarHBondContact O-CB 3.27Å; G71-A75 PolarHBondContact O-N 3.01Å; V72-A75 PolarHBondContact O-N 3.05Å; F73-A75 PolarHBondContact O-N 3.37Å; A75-T79 WeakPolarHBondContact O-CB 3.38Å; A75-T79 PolarHBondContact O-N 2.91Å; A75-T79 PolarHBondContact O-OG1 3.14Å
76	V	90.7	Very high	86.7	Confident	15 Å²	15	57.2 Å²	57.2	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-43.1	177.5	176.1	0	0	0	0	110.7	V72 F73 T79 L80 M98 L102	V72-V76 HydrophobicContact CG1-CG2 4.15Å; V72-V76 WeakPolarHBondContact O-CB 3.47Å; V72-V76 VanDerWaalsContact O-CG2 3.27Å; V72-V76 WeakPolarHBondContact O-CG2 3.23Å; V72-V76 PolarHBondContact O-N 3.21Å; F73-V76 PolarHBondContact O-N 3.02Å; V76-T79 WeakPolarHBondContact O-CB 3.35Å; V76-T79 PolarHBondContact O-N 2.78Å; V76-T79 VanDerWaalsContact O-N 3.15Å; V76-L80 HydrophobicContact CG1-CD1 3.87Å; V76-L80 HydrophobicContact CG1-CG 4.2Å; V76-L80 WeakPolarHBondContact O-CG 3.22Å; V76-L80 PolarHBondContact O-N 3.46Å; V76-M98 HydrophobicContact CG1-CB 3.88Å; V76-M98 HydrophobicContact CG1-SD 3.93Å; V76-M98 HydrophobicContact CG2-CB 4.47Å; V76-L102 HydrophobicContact CG2-CD1 3.67Å
77	D	88.9	Confident	85.4	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.064	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-46.8	178.3	-172.1	61.1	0	0	0	112.2	R12 F73 T79 L80 A81 N91	R12-D77 IonicContact CZ-OD2 3.49Å; R12-D77 IonicContact NH2-OD2 3.73Å; R12-D77 PolarHBondContact NH2-OD2 3.46Å; F73-D77 VanDerWaalsContact O-CB 3.28Å; F73-D77 WeakPolarHBondContact O-CB 3.35Å; F73-D77 PolarHBondContact O-N 3.38Å; D77-T79 VanDerWaalsContact C-N 3.26Å; D77-T79 PolarHBondContact O-N 2.97Å; D77-L80 PolarHBondContact O-N 2.95Å; D77-A81 VanDerWaalsContact O-CB 3.31Å; D77-A81 WeakPolarHBondContact O-CB 3.35Å; D77-A81 PolarHBondContact O-N 2.9Å; D77-N91 PolarHBondContact OD1-ND2 3.36Å
78	C	86.2	Confident	84.7	Confident	21 Å²	21	63 Å²	63	14%	0.142	31%	0.314	C	S	.	.	H	α-helix	trans	-54	-43.6	170.5	-79.2	0	0	0	0	111.4	C9 S74 H82	C9-C78 HydrophobicContact CB-CB 4.13Å; C9-C78 WeakPolarHBondContact CB-SG 3.27Å; C9-C78 WeakPolarHBondContact SG-CB 3.38Å; C9-C78 CovalentContact SG-SG 2.06Å; C9-C78 PolarHBondContact SG-SG 3.2Å; S74-C78 VanDerWaalsContact O-CB 3.24Å; S74-C78 WeakPolarHBondContact O-CB 3.4Å; S74-C78 PolarHBondContact O-N 2.74Å; S74-C78 PolarHBondContact O-SG 3.42Å; C78-H82 WeakPolarHBondContact O-CB 2.99Å; C78-H82 PolarHBondContact O-N 2.83Å; C78-H82 VanDerWaalsContact O-N 3.08Å
79	T	86.4	Confident	83.9	Confident	85 Å²	85	62.1 Å²	62.1	52%	0.521	31%	0.31	S	S	.	.	H	α-helix	trans	-66.8	-44.8	-179.1	-57	0	0	0	0	111.4	A75 V76 D77 H82 V83	A75-T79 WeakPolarHBondContact O-CB 3.38Å; A75-T79 PolarHBondContact O-N 2.91Å; A75-T79 PolarHBondContact O-OG1 3.14Å; V76-T79 WeakPolarHBondContact O-CB 3.35Å; V76-T79 PolarHBondContact O-N 2.78Å; V76-T79 VanDerWaalsContact O-N 3.15Å; D77-T79 VanDerWaalsContact C-N 3.26Å; D77-T79 PolarHBondContact O-N 2.97Å; T79-H82 PolarHBondContact O-N 3.4Å; T79-V83 HydrophobicContact CG2-CG2 4.5Å; T79-V83 VanDerWaalsContact O-CG2 3.26Å; T79-V83 WeakPolarHBondContact O-CG2 3.23Å; T79-V83 PolarHBondContact O-N 3.01Å
80	L	84.2	Confident	83.5	Confident	20 Å²	20	66.6 Å²	66.6	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-72	-38.7	-178.8	-67.4	173.2	0	0	0	112.6	V76 D77 H82 V83 R84 N91 I94 M98	V76-L80 HydrophobicContact CG1-CD1 3.87Å; V76-L80 HydrophobicContact CG1-CG 4.2Å; V76-L80 WeakPolarHBondContact O-CG 3.22Å; V76-L80 PolarHBondContact O-N 3.46Å; D77-L80 PolarHBondContact O-N 2.95Å; L80-H82 VanDerWaalsContact C-N 3.28Å; L80-H82 PolarHBondContact O-N 3.05Å; L80-V83 PolarHBondContact O-N 2.52Å; L80-R84 PolarHBondContact O-N 2.9Å; L80-N91 WeakPolarHBondContact CB-OD1 3.43Å; L80-N91 WeakPolarHBondContact CD1-OD1 3.29Å; L80-I94 HydrophobicContact CD1-CB 4.31Å; L80-I94 HydrophobicContact CD1-CG2 3.99Å; L80-M98 HydrophobicContact CD1-SD 4.41Å; L80-M98 HydrophobicContact CD2-SD 4.42Å
81	A	81.1	Confident	83.2	Confident	8 Å²	8	66.5 Å²	66.5	7%	0.066	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-41.8	172.7	0	0	0	0	0	110.9	D77 R85 E87	D77-A81 VanDerWaalsContact O-CB 3.31Å; D77-A81 WeakPolarHBondContact O-CB 3.35Å; D77-A81 PolarHBondContact O-N 2.9Å; A81-R85 WeakPolarHBondContact O-CA 3.39Å; A81-R85 PolarHBondContact O-N 3.47Å; A81-E87 WeakPolarHBondContact CB-OE1 3.44Å
82	H	80.3	Confident	82.9	Confident	128 Å²	128	67 Å²	67	59%	0.593	33%	0.327	S	S	*	.	H	α-helix	trans	-65.2	-43.3	176.1	-169.2	77.7	0	0	0	112.8	C78 T79 L80	C78-H82 WeakPolarHBondContact O-CB 2.99Å; C78-H82 PolarHBondContact O-N 2.83Å; C78-H82 VanDerWaalsContact O-N 3.08Å; T79-H82 PolarHBondContact O-N 3.4Å; L80-H82 VanDerWaalsContact C-N 3.28Å; L80-H82 PolarHBondContact O-N 3.05Å
83	V	81.3	Confident	82.8	Confident	107 Å²	107	67 Å²	67	65%	0.648	33%	0.326	S	S	*	.	H	α-helix	trans	-74.2	-42.3	-176.8	171.3	0	0	0	0	112.3	T79 L80	T79-V83 HydrophobicContact CG2-CG2 4.5Å; T79-V83 VanDerWaalsContact O-CG2 3.26Å; T79-V83 WeakPolarHBondContact O-CG2 3.23Å; T79-V83 PolarHBondContact O-N 3.01Å; L80-V83 PolarHBondContact O-N 2.52Å
84	R	77	Confident	82.7	Confident	121 Å²	121	66.4 Å²	66.4	46%	0.457	32%	0.324	S	S	.	.	H	α-helix	trans	-94.4	-20.4	-173.8	-75.9	-157.1	-177.4	141.1	2.7	115.2	L80 K86	L80-R84 PolarHBondContact O-N 2.9Å; R84-K86 PolarHBondContact O-N 2.97Å
85	R	71.9	Confident	82.8	Confident	184 Å²	184	66.4 Å²	66.4	69%	0.694	32%	0.324	S	S	*	.			trans	49.3	22.3	-176.7	-57.7	-68.9	-163.6	151.7	6.3	113.5	A81	A81-R85 WeakPolarHBondContact O-CA 3.39Å; A81-R85 PolarHBondContact O-N 3.47Å
86	K	68.3	Low	82.8	Confident	144 Å²	144	64.8 Å²	64.8	63%	0.626	31%	0.31	S	S	*	.			trans	-135.1	122.9	-179.1	-74.9	-170.2	177	-175.3	0	107.9	R84 D88	R84-K86 PolarHBondContact O-N 2.97Å; K86-D88 PolarHBondContact O-N 2.84Å
87	E	66.7	Low	83	Confident	117 Å²	117	65.4 Å²	65.4	55%	0.547	32%	0.317	S	S	.	.			trans	-95.1	84	178.8	-59.7	-60.9	151.4	0	0	108.5	A81	A81-E87 WeakPolarHBondContact CB-OE1 3.44Å
88	D	79.4	Confident	83.2	Confident	93 Å²	93	69 Å²	69	50%	0.497	34%	0.335	S	S	.	.			trans	-105.9	150.6	173.9	-68.8	-52.9	0	0	0	109.9	K86 W90 N91	K86-D88 PolarHBondContact O-N 2.84Å; D88-W90 HydrophobicContact CB-CB 4.48Å; D88-W90 PolarHBondContact O-N 3.33Å; D88-N91 WeakPolarHBondContact O-CB 3.45Å; D88-N91 PolarHBondContact O-N 2.89Å
89	P	78.4	Confident	83.5	Confident	58 Å²	58	68 Å²	68	38%	0.377	33%	0.328	S	S	.	.	H	α-helix	trans	-55.3	-24.5	174.6	-25.6	33.5	0	0	0	113.7	N91 S92 I93 I131	P89-N91 PolarHBondContact O-N 3Å; P89-S92 PolarHBondContact O-N 3.3Å; P89-I93 WeakPolarHBondContact O-CG1 3.25Å; P89-I93 PolarHBondContact O-N 2.7Å; P89-I131 HydrophobicContact CB-CD1 4.28Å; P89-I131 HydrophobicContact CG-CD1 4Å
90	W	84.4	Confident	83.8	Confident	159 Å²	159	64 Å²	64	60%	0.602	30%	0.304	S	S	*	.	H	α-helix	trans	-64.1	-26.2	173.9	-170.5	-114.5	0	0	0	113	D88 I93 I94	D88-W90 HydrophobicContact CB-CB 4.48Å; D88-W90 PolarHBondContact O-N 3.33Å; W90-I93 HydrophobicContact CE3-CD1 4.26Å; W90-I93 PolarHBondContact O-N 3.48Å; W90-I94 HydrophobicContact CD2-CD1 4.42Å; W90-I94 HydrophobicContact CD2-CG1 4.48Å; W90-I94 HydrophobicContact CG-CD1 4.09Å; W90-I94 HydrophobicContact CG-CG1 4.5Å; W90-I94 HydrophobicContact CZ2-CG1 4.49Å; W90-I94 VanDerWaalsContact O-CG1 3.31Å; W90-I94 WeakPolarHBondContact O-CG1 3.43Å; W90-I94 PolarHBondContact O-N 2.88Å
91	N	85.8	Confident	84.3	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-62.9	-50.2	175.4	-168.9	32.3	0	0	0	111	D77 L80 D88 P89 I93 I94 S95	D77-N91 PolarHBondContact OD1-ND2 3.36Å; L80-N91 WeakPolarHBondContact CB-OD1 3.43Å; L80-N91 WeakPolarHBondContact CD1-OD1 3.29Å; D88-N91 WeakPolarHBondContact O-CB 3.45Å; D88-N91 PolarHBondContact O-N 2.89Å; P89-N91 PolarHBondContact O-N 3Å; N91-I93 VanDerWaalsContact C-N 3.32Å; N91-I93 PolarHBondContact O-N 2.74Å; N91-I94 PolarHBondContact O-N 3.16Å; N91-S95 WeakPolarHBondContact O-CB 3.47Å; N91-S95 PolarHBondContact O-N 3.19Å; N91-S95 PolarHBondContact O-OG 2.91Å; N91-S95 VanDerWaalsContact O-OG 3.12Å
92	S	85.2	Confident	84.8	Confident	19 Å²	19	67.8 Å²	67.8	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-59.7	-40.1	175.8	-55.8	0	0	0	0	112.6	P89 S95 G96 L123 E127	P89-S92 PolarHBondContact O-N 3.3Å; S92-S95 VanDerWaalsContact CA-OG 3.28Å; S92-S95 WeakPolarHBondContact CA-OG 3.4Å; S92-S95 PolarHBondContact O-N 3.32Å; S92-S95 PolarHBondContact O-OG 3.28Å; S92-G96 PolarHBondContact O-N 2.96Å; S92-L123 WeakPolarHBondContact O-CD2 3.32Å; S92-E127 WeakPolarHBondContact CB-OE1 3.36Å; S92-E127 PolarHBondContact OG-OE1 3.45Å
93	I	90.2	Very high	85.4	Confident	38 Å²	38	62.6 Å²	62.6	20%	0.195	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-45.1	178.8	-62.5	169.7	0	0	0	110.8	P89 W90 N91 G96 A97 A124	P89-I93 WeakPolarHBondContact O-CG1 3.25Å; P89-I93 PolarHBondContact O-N 2.7Å; W90-I93 HydrophobicContact CE3-CD1 4.26Å; W90-I93 PolarHBondContact O-N 3.48Å; N91-I93 VanDerWaalsContact C-N 3.32Å; N91-I93 PolarHBondContact O-N 2.74Å; I93-G96 PolarHBondContact O-N 3.02Å; I93-A97 PolarHBondContact O-N 2.95Å; I93-A124 HydrophobicContact CD1-CB 4.01Å; I93-A124 HydrophobicContact CG1-CB 4.08Å
94	I	91.5	Very high	85.9	Confident	27 Å²	27	57.9 Å²	57.9	14%	0.138	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-42.7	177.2	-67.4	164.9	0	0	0	110.7	L80 W90 N91 G96 A97 M98	L80-I94 HydrophobicContact CD1-CB 4.31Å; L80-I94 HydrophobicContact CD1-CG2 3.99Å; W90-I94 HydrophobicContact CD2-CD1 4.42Å; W90-I94 HydrophobicContact CD2-CG1 4.48Å; W90-I94 HydrophobicContact CG-CD1 4.09Å; W90-I94 HydrophobicContact CG-CG1 4.5Å; W90-I94 HydrophobicContact CZ2-CG1 4.49Å; W90-I94 VanDerWaalsContact O-CG1 3.31Å; W90-I94 WeakPolarHBondContact O-CG1 3.43Å; W90-I94 PolarHBondContact O-N 2.88Å; N91-I94 PolarHBondContact O-N 3.16Å; I94-G96 VanDerWaalsContact C-N 3.3Å; I94-G96 PolarHBondContact O-N 2.6Å; I94-A97 PolarHBondContact O-N 3.41Å; I94-M98 HydrophobicContact CG2-CE 3.68Å; I94-M98 HydrophobicContact CG2-CG 3.98Å; I94-M98 HydrophobicContact CG2-SD 3.82Å; I94-M98 WeakPolarHBondContact O-CB 3.22Å; I94-M98 WeakPolarHBondContact O-CG 3.32Å; I94-M98 PolarHBondContact O-N 3.04Å
95	S	90.4	Very high	86.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-38.5	179.5	57.8	0	0	0	0	111.3	F73 N91 S92 T99	F73-S95 WeakPolarHBondContact CE2-OG 3.08Å; N91-S95 WeakPolarHBondContact O-CB 3.47Å; N91-S95 PolarHBondContact O-N 3.19Å; N91-S95 PolarHBondContact O-OG 2.91Å; N91-S95 VanDerWaalsContact O-OG 3.12Å; S92-S95 VanDerWaalsContact CA-OG 3.28Å; S92-S95 WeakPolarHBondContact CA-OG 3.4Å; S92-S95 PolarHBondContact O-N 3.32Å; S92-S95 PolarHBondContact O-OG 3.28Å; S95-T99 WeakPolarHBondContact O-CB 3.28Å; S95-T99 PolarHBondContact O-N 2.83Å; S95-T99 PolarHBondContact O-OG1 2.93Å
96	G	91.7	Very high	87.4	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-46.4	171.2	0	0	0	0	0	113.3	S92 I93 I94 T99 G100	S92-G96 PolarHBondContact O-N 2.96Å; I93-G96 PolarHBondContact O-N 3.02Å; I94-G96 VanDerWaalsContact C-N 3.3Å; I94-G96 PolarHBondContact O-N 2.6Å; G96-T99 PolarHBondContact O-N 3.34Å; G96-G100 PolarHBondContact O-N 3.49Å
97	A	94.2	Very high	88.4	Confident	29 Å²	29	53.7 Å²	53.7	24%	0.24	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-44.7	178.2	0	0	0	0	0	112.5	I93 I94 T99 G100 A101 A116	I93-A97 PolarHBondContact O-N 2.95Å; I94-A97 PolarHBondContact O-N 3.41Å; A97-T99 VanDerWaalsContact C-N 3.35Å; A97-G100 PolarHBondContact O-N 2.93Å; A97-A101 WeakPolarHBondContact O-CB 3.27Å; A97-A101 PolarHBondContact O-N 3.24Å; A97-A116 WeakPolarHBondContact CA-O 3.29Å; A97-A116 WeakPolarHBondContact O-CA 3.47Å; A97-A116 WeakPolarHBondContact O-CB 3.3Å
98	M	93.1	Very high	89.5	Confident	86 Å²	86	49.9 Å²	49.9	42%	0.424	26%	0.258	S	S	.	.	H	α-helix	trans	-63.3	-41.3	175.5	-77.3	-174.7	174	0	0	111.5	V76 L80 I94 A101 L102	V76-M98 HydrophobicContact CG1-CB 3.88Å; V76-M98 HydrophobicContact CG1-SD 3.93Å; V76-M98 HydrophobicContact CG2-CB 4.47Å; L80-M98 HydrophobicContact CD1-SD 4.41Å; L80-M98 HydrophobicContact CD2-SD 4.42Å; I94-M98 HydrophobicContact CG2-CE 3.68Å; I94-M98 HydrophobicContact CG2-CG 3.98Å; I94-M98 HydrophobicContact CG2-SD 3.82Å; I94-M98 WeakPolarHBondContact O-CB 3.22Å; I94-M98 WeakPolarHBondContact O-CG 3.32Å; I94-M98 PolarHBondContact O-N 3.04Å; M98-A101 PolarHBondContact O-N 2.89Å; M98-L102 WeakPolarHBondContact O-CB 3.26Å; M98-L102 VanDerWaalsContact O-CG 3.23Å; M98-L102 WeakPolarHBondContact O-CG 3.23Å; M98-L102 PolarHBondContact O-N 3.43Å
99	T	92.2	Very high	90	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-50.6	176.9	-62.6	0	0	0	0	110.8	W69 V72 F73 S95 G96 A97 A101 L102 V103	W69-T99 HydrophobicContact CD2-CG2 4.38Å; W69-T99 HydrophobicContact CG-CG2 4.11Å; W69-T99 WeakPolarHBondContact O-CG2 3.22Å; V72-T99 HydrophobicContact CB-CG2 3.96Å; V72-T99 HydrophobicContact CG1-CG2 3.83Å; F73-T99 VanDerWaalsContact CA-OG1 3.23Å; F73-T99 WeakPolarHBondContact CA-OG1 3.16Å; F73-T99 HydrophobicContact CB-CG2 4.1Å; F73-T99 PolarHBondContact N-OG1 3.33Å; S95-T99 WeakPolarHBondContact O-CB 3.28Å; S95-T99 PolarHBondContact O-N 2.83Å; S95-T99 PolarHBondContact O-OG1 2.93Å; G96-T99 PolarHBondContact O-N 3.34Å; A97-T99 VanDerWaalsContact C-N 3.35Å; T99-A101 VanDerWaalsContact C-N 3.29Å; T99-A101 PolarHBondContact O-N 3.31Å; T99-L102 PolarHBondContact O-N 3.3Å; T99-V103 HydrophobicContact CG2-CG1 4.42Å; T99-V103 WeakPolarHBondContact O-CG1 3.33Å; T99-V103 WeakPolarHBondContact O-CG2 3.38Å; T99-V103 PolarHBondContact O-N 3.06Å
100	G	93.1	Very high	90.6	Very high	3 Å²	3	50.4 Å²	50.4	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-54.7	-46	176.1	0	0	0	0	0	112.3	G96 A97 V103 T104 S115	G96-G100 PolarHBondContact O-N 3.49Å; A97-G100 PolarHBondContact O-N 2.93Å; G100-V103 WeakPolarHBondContact O-CG2 3.49Å; G100-T104 PolarHBondContact O-N 3.35Å; G100-T104 PolarHBondContact O-OG1 3.06Å; G100-S115 PolarHBondContact O-OG 3.39Å
101	A	93.3	Very high	91	Very high	21 Å²	21	45.9 Å²	45.9	17%	0.174	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-50.3	175.9	0	0	0	0	0	112.2	A97 M98 T99 T104 M105 M112 A116	A97-A101 WeakPolarHBondContact O-CB 3.27Å; A97-A101 PolarHBondContact O-N 3.24Å; M98-A101 PolarHBondContact O-N 2.89Å; T99-A101 VanDerWaalsContact C-N 3.29Å; T99-A101 PolarHBondContact O-N 3.31Å; A101-T104 CarbonylContact O-C 3.52Å; A101-T104 PolarHBondContact O-N 3.33Å; A101-T104 PolarHBondContact O-OG1 3.46Å; A101-M105 WeakPolarHBondContact O-CA 3.16Å; A101-M105 PolarHBondContact O-N 3.46Å; A101-M112 HydrophobicContact CB-CG 3.72Å; A101-M112 HydrophobicContact CB-SD 4.37Å; A101-A116 HydrophobicContact CB-CB 4.1Å
102	L	93.1	Very high	91.2	Very high	85 Å²	85	48.6 Å²	48.6	45%	0.445	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-46.2	-176	-76.2	172.5	0	0	0	112.1	V72 V76 M98 T99 T104 M105	V72-L102 HydrophobicContact CG1-CB 3.98Å; V72-L102 HydrophobicContact CG1-CD1 3.85Å; V76-L102 HydrophobicContact CG2-CD1 3.67Å; M98-L102 WeakPolarHBondContact O-CB 3.26Å; M98-L102 VanDerWaalsContact O-CG 3.23Å; M98-L102 WeakPolarHBondContact O-CG 3.23Å; M98-L102 PolarHBondContact O-N 3.43Å; T99-L102 PolarHBondContact O-N 3.3Å; L102-T104 VanDerWaalsContact C-N 3.28Å; L102-T104 PolarHBondContact O-N 2.95Å; L102-M105 WeakPolarHBondContact O-CG 3.34Å; L102-M105 PolarHBondContact O-N 2.91Å
103	V	91.6	Very high	91.6	Very high	19 Å²	19	52.2 Å²	52.2	12%	0.115	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-40	-179	-61.3	0	0	0	0	110.2	V68 V72 T99 G100 F196	V68-V103 HydrophobicContact CG1-CG1 3.91Å; V72-V103 HydrophobicContact CB-CG1 4.17Å; V72-V103 HydrophobicContact CG1-CG1 4.36Å; V72-V103 HydrophobicContact CG2-CG1 4.05Å; T99-V103 HydrophobicContact CG2-CG1 4.42Å; T99-V103 WeakPolarHBondContact O-CG1 3.33Å; T99-V103 WeakPolarHBondContact O-CG2 3.38Å; T99-V103 PolarHBondContact O-N 3.06Å; G100-V103 WeakPolarHBondContact O-CG2 3.49Å; V103-F196 HydrophobicContact CB-CE1 4.34Å; V103-F196 HydrophobicContact CB-CE2 4.42Å; V103-F196 HydrophobicContact CB-CZ 3.59Å; V103-F196 HydrophobicContact CG2-CE2 4.01Å; V103-F196 HydrophobicContact CG2-CZ 3.6Å; V103-F196 WeakPolarHBondContact O-CE1 3.23Å; V103-F196 WeakPolarHBondContact O-CZ 3.44Å
104	T	91.8	Very high	91.7	Very high	8 Å²	8	52.4 Å²	52.4	5%	0.049	31%	0.308	C	S	.	.	H	α-helix	trans	-92	5.8	-176.6	57.6	0	0	0	0	114.3	G100 A101 L102 R106 N107 T111 M112 S115 F196	G100-T104 PolarHBondContact O-N 3.35Å; G100-T104 PolarHBondContact O-OG1 3.06Å; A101-T104 CarbonylContact O-C 3.52Å; A101-T104 PolarHBondContact O-N 3.33Å; A101-T104 PolarHBondContact O-OG1 3.46Å; L102-T104 VanDerWaalsContact C-N 3.28Å; L102-T104 PolarHBondContact O-N 2.95Å; T104-R106 PolarHBondContact O-N 2.85Å; T104-N107 WeakPolarHBondContact O-CB 3.44Å; T104-N107 PolarHBondContact O-N 3.04Å; T104-T111 HydrophobicContact CG2-CG2 4.22Å; T104-M112 WeakPolarHBondContact OG1-CA 3.48Å; T104-S115 WeakPolarHBondContact OG1-CB 3.43Å; T104-S115 PolarHBondContact OG1-OG 3.5Å; T104-F196 HydrophobicContact CG2-CD2 4.46Å; T104-F196 HydrophobicContact CG2-CE2 3.45Å; T104-F196 VanDerWaalsContact CG2-CE2 3.45Å; T104-F196 HydrophobicContact CG2-CZ 3.5Å
105	M	90	Very high	91.6	Very high	127 Å²	127	52.2 Å²	52.2	63%	0.626	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-57.8	-31.1	-173.3	80.5	-175.4	-56.4	0	0	112.8	A101 L102 N107	A101-M105 WeakPolarHBondContact O-CA 3.16Å; A101-M105 PolarHBondContact O-N 3.46Å; L102-M105 WeakPolarHBondContact O-CG 3.34Å; L102-M105 PolarHBondContact O-N 2.91Å; M105-N107 VanDerWaalsContact C-N 3.28Å; M105-N107 PolarHBondContact O-N 2.89Å
106	R	90.9	Very high	91.8	Very high	180 Å²	180	53.2 Å²	53.2	68%	0.679	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-72.6	-15.1	177.9	63.2	175.8	174.4	175.1	-4.2	114.5	T104 G108	T104-R106 PolarHBondContact O-N 2.85Å; R106-G108 VanDerWaalsContact C-N 3.32Å
107	N	89.8	Confident	91.9	Very high	54 Å²	54	58.2 Å²	58.2	29%	0.289	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-94.6	13	-176.9	-62.3	-15.3	0	0	0	112.7	T104 M105 T111 G195	T104-N107 WeakPolarHBondContact O-CB 3.44Å; T104-N107 PolarHBondContact O-N 3.04Å; M105-N107 VanDerWaalsContact C-N 3.28Å; M105-N107 PolarHBondContact O-N 2.89Å; N107-T111 HydrophobicContact CB-CG2 3.9Å; N107-T111 PolarHBondContact O-OG1 2.81Å; N107-T111 VanDerWaalsContact O-OG1 3.07Å; N107-G195 PolarHBondContact ND2-O 2.92Å
108	G	89	Confident	91.8	Very high	37 Å²	37	60 Å²	60	38%	0.381	35%	0.346	S	S	.	.			trans	86.5	163.5	-179.7	0	0	0	0	0	114.4	R106 G110 T111 M112	R106-G108 VanDerWaalsContact C-N 3.32Å; G108-G110 VanDerWaalsContact C-N 3.34Å; G108-G110 PolarHBondContact O-N 3.49Å; G108-T111 PolarHBondContact O-N 3.33Å; G108-M112 PolarHBondContact O-N 2.79Å
109	V	90.8	Very high	91.7	Very high	100 Å²	100	56 Å²	56	61%	0.606	33%	0.328	S	S	*	.	H	α-helix	trans	-63.6	-35.6	-171.5	-179.8	0	0	0	0	112.7	M112 I113	V109-M112 HydrophobicContact CG1-CE 4.1Å; V109-M112 WeakPolarHBondContact O-CB 3.26Å; V109-M112 PolarHBondContact O-N 3.42Å; V109-I113 HydrophobicContact CG1-CD1 4.01Å; V109-I113 HydrophobicContact CG1-CG1 4.49Å; V109-I113 WeakPolarHBondContact O-CG1 3Å; V109-I113 PolarHBondContact O-N 3.29Å
110	G	91	Very high	91.7	Very high	63 Å²	63	56.5 Å²	56.5	65%	0.649	33%	0.332	S	S	*	.	H	α-helix	trans	-62.6	-46	178.5	0	0	0	0	0	112.7	G108 M112 G114	G108-G110 VanDerWaalsContact C-N 3.34Å; G108-G110 PolarHBondContact O-N 3.49Å; G110-M112 VanDerWaalsContact C-N 3.34Å; G110-G114 PolarHBondContact O-N 3.33Å
111	T	91.6	Very high	91.8	Very high	64 Å²	64	59.7 Å²	59.7	39%	0.393	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-37.7	175.5	-47.7	0	0	0	0	111.3	T104 N107 G108 I113 G114 S115	T104-T111 HydrophobicContact CG2-CG2 4.22Å; N107-T111 HydrophobicContact CB-CG2 3.9Å; N107-T111 PolarHBondContact O-OG1 2.81Å; N107-T111 VanDerWaalsContact O-OG1 3.07Å; G108-T111 PolarHBondContact O-N 3.33Å; T111-I113 PolarHBondContact O-N 3.45Å; T111-G114 PolarHBondContact O-N 2.88Å; T111-S115 WeakPolarHBondContact O-CB 3.43Å; T111-S115 PolarHBondContact O-N 2.9Å; T111-S115 PolarHBondContact O-OG 3Å
112	M	91	Very high	91.8	Very high	61 Å²	61	61.5 Å²	61.5	30%	0.3	36%	0.357	S	S	.	.	H	α-helix	trans	-59.4	-44.5	177.7	-173.4	-175.9	65.3	0	0	112.7	A101 T104 G108 V109 G110 S115 A116	A101-M112 HydrophobicContact CB-CG 3.72Å; A101-M112 HydrophobicContact CB-SD 4.37Å; T104-M112 WeakPolarHBondContact OG1-CA 3.48Å; G108-M112 PolarHBondContact O-N 2.79Å; V109-M112 HydrophobicContact CG1-CE 4.1Å; V109-M112 WeakPolarHBondContact O-CB 3.26Å; V109-M112 PolarHBondContact O-N 3.42Å; G110-M112 VanDerWaalsContact C-N 3.34Å; M112-S115 PolarHBondContact O-OG 3.43Å; M112-A116 VanDerWaalsContact O-CB 3.22Å; M112-A116 WeakPolarHBondContact O-CB 3.4Å; M112-A116 PolarHBondContact O-N 3.36Å
113	I	93.3	Very high	91.6	Very high	95 Å²	95	57.9 Å²	57.9	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-68.9	-44	178.3	-65.8	167.6	0	0	0	110.3	V109 T111 S115 A116 I117	V109-I113 HydrophobicContact CG1-CD1 4.01Å; V109-I113 HydrophobicContact CG1-CG1 4.49Å; V109-I113 WeakPolarHBondContact O-CG1 3Å; V109-I113 PolarHBondContact O-N 3.29Å; T111-I113 PolarHBondContact O-N 3.45Å; I113-S115 PolarHBondContact O-N 2.84Å; I113-A116 PolarHBondContact O-N 3.25Å; I113-I117 HydrophobicContact CG2-CD1 3.86Å; I113-I117 HydrophobicContact CG2-CG1 4.49Å; I113-I117 WeakPolarHBondContact O-CG1 3.12Å; I113-I117 PolarHBondContact O-N 3.48Å
114	G	91.8	Very high	91.6	Very high	42 Å²	42	58.9 Å²	58.9	43%	0.433	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-42.9	179.4	0	0	0	0	0	113	G110 T111 M118	G110-G114 PolarHBondContact O-N 3.33Å; T111-G114 PolarHBondContact O-N 2.88Å; G114-M118 WeakPolarHBondContact O-CB 3.48Å; G114-M118 PolarHBondContact O-N 3.44Å; G114-M118 VanDerWaalsContact O-N 3.09Å
115	S	91	Very high	91.6	Very high	23 Å²	23	64.4 Å²	64.4	16%	0.161	38%	0.376	C	S	.	.	H	α-helix	trans	-72.2	-35.1	177.4	63.6	0	0	0	0	112.9	G100 T104 T111 M112 I113 M118 G119	G100-S115 PolarHBondContact O-OG 3.39Å; T104-S115 WeakPolarHBondContact OG1-CB 3.43Å; T104-S115 PolarHBondContact OG1-OG 3.5Å; T111-S115 WeakPolarHBondContact O-CB 3.43Å; T111-S115 PolarHBondContact O-N 2.9Å; T111-S115 PolarHBondContact O-OG 3Å; M112-S115 PolarHBondContact O-OG 3.43Å; I113-S115 PolarHBondContact O-N 2.84Å; S115-M118 PolarHBondContact O-N 2.98Å; S115-G119 PolarHBondContact O-N 2.96Å
116	A	93.2	Very high	91.7	Very high	20 Å²	20	63.4 Å²	63.4	17%	0.165	37%	0.372	C	S	.	.	H	α-helix	trans	-63.5	-45.8	175.7	0	0	0	0	0	111.2	A97 A101 M112 I113 M118 G120	A97-A116 WeakPolarHBondContact CA-O 3.29Å; A97-A116 WeakPolarHBondContact O-CA 3.47Å; A97-A116 WeakPolarHBondContact O-CB 3.3Å; A101-A116 HydrophobicContact CB-CB 4.1Å; M112-A116 VanDerWaalsContact O-CB 3.22Å; M112-A116 WeakPolarHBondContact O-CB 3.4Å; M112-A116 PolarHBondContact O-N 3.36Å; I113-A116 PolarHBondContact O-N 3.25Å; A116-M118 VanDerWaalsContact C-N 3.34Å; A116-G120 PolarHBondContact O-N 2.84Å
117	I	94.4	Very high	91.5	Very high	106 Å²	106	57.6 Å²	57.6	54%	0.544	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-47.8	175.4	-66.5	167.5	0	0	0	109.6	I113 G119 G120 V121	I113-I117 HydrophobicContact CG2-CD1 3.86Å; I113-I117 HydrophobicContact CG2-CG1 4.49Å; I113-I117 WeakPolarHBondContact O-CG1 3.12Å; I113-I117 PolarHBondContact O-N 3.48Å; I117-G119 PolarHBondContact O-N 3.44Å; I117-G120 PolarHBondContact O-N 2.99Å; I117-V121 HydrophobicContact CG2-CG2 4.18Å; I117-V121 WeakPolarHBondContact O-CB 3.34Å; I117-V121 WeakPolarHBondContact O-CG2 3.38Å; I117-V121 PolarHBondContact O-N 3.18Å
118	M	91.5	Very high	91.4	Very high	65 Å²	65	56.8 Å²	56.8	32%	0.32	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-44.3	-177.7	-168.9	-88.5	173	0	0	112.5	G114 S115 A116 V121 I122 L192	G114-M118 WeakPolarHBondContact O-CB 3.48Å; G114-M118 PolarHBondContact O-N 3.44Å; G114-M118 VanDerWaalsContact O-N 3.09Å; S115-M118 PolarHBondContact O-N 2.98Å; A116-M118 VanDerWaalsContact C-N 3.34Å; M118-V121 PolarHBondContact O-N 3.2Å; M118-I122 HydrophobicContact CE-CD1 3.15Å; M118-I122 HydrophobicContact CE-CG1 4Å; M118-I122 PolarHBondContact O-N 3.12Å; M118-I122 HydrophobicContact SD-CD1 3.7Å; M118-I122 HydrophobicContact SD-CG1 4.38Å; M118-L192 HydrophobicContact CE-CD1 3.2Å; M118-L192 HydrophobicContact CE-CD2 3.87Å; M118-L192 HydrophobicContact CE-CG 4.18Å; M118-L192 HydrophobicContact SD-CD1 3.67Å
119	G	91.3	Very high	91.6	Very high	4 Å²	4	58.9 Å²	58.9	4%	0.041	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-45.3	174.5	0	0	0	0	0	112.4	S115 I117 V121 I122 L123	S115-G119 PolarHBondContact O-N 2.96Å; I117-G119 PolarHBondContact O-N 3.44Å; G119-V121 PolarHBondContact O-N 3.02Å; G119-I122 PolarHBondContact O-N 3.11Å; G119-L123 WeakPolarHBondContact O-CD1 3.44Å; G119-L123 PolarHBondContact O-N 3.13Å
120	G	92.5	Very high	91.5	Very high	9 Å²	9	55.6 Å²	55.6	9%	0.093	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-40.3	176.3	0	0	0	0	0	113	A116 I117 A124	A116-G120 PolarHBondContact O-N 2.84Å; I117-G120 PolarHBondContact O-N 2.99Å; G120-A124 VanDerWaalsContact O-CB 3.23Å; G120-A124 WeakPolarHBondContact O-CB 3.4Å; G120-A124 PolarHBondContact O-N 3.32Å
121	V	94.5	Very high	91.4	Very high	71 Å²	71	56.3 Å²	56.3	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-44.7	178.5	170.7	0	0	0	0	111.6	I117 M118 G119 L123 A124 M125	I117-V121 HydrophobicContact CG2-CG2 4.18Å; I117-V121 WeakPolarHBondContact O-CB 3.34Å; I117-V121 WeakPolarHBondContact O-CG2 3.38Å; I117-V121 PolarHBondContact O-N 3.18Å; M118-V121 PolarHBondContact O-N 3.2Å; G119-V121 PolarHBondContact O-N 3.02Å; V121-L123 VanDerWaalsContact C-N 3.35Å; V121-L123 PolarHBondContact O-N 3.27Å; V121-A124 PolarHBondContact O-N 3.36Å; V121-M125 HydrophobicContact CG1-CE 3.81Å; V121-M125 HydrophobicContact CG1-SD 4.46Å; V121-M125 WeakPolarHBondContact O-CG 3.5Å; V121-M125 PolarHBondContact O-N 3.34Å
122	I	93	Very high	91.3	Very high	58 Å²	58	59.9 Å²	59.9	30%	0.297	35%	0.347	S	S	.	.	H	α-helix	trans	-59.5	-47.2	177.6	-75.5	-178.1	0	0	0	110.7	M118 G119 M125 I126	M118-I122 HydrophobicContact CE-CD1 3.15Å; M118-I122 HydrophobicContact CE-CG1 4Å; M118-I122 PolarHBondContact O-N 3.12Å; M118-I122 HydrophobicContact SD-CD1 3.7Å; M118-I122 HydrophobicContact SD-CG1 4.38Å; G119-I122 PolarHBondContact O-N 3.11Å; I122-M125 WeakPolarHBondContact O-CB 3.05Å; I122-M125 PolarHBondContact O-N 3.17Å; I122-M125 VanDerWaalsContact O-N 3.14Å; I122-I126 HydrophobicContact CG2-CD1 3.78Å; I122-I126 HydrophobicContact CG2-CG1 4.4Å; I122-I126 WeakPolarHBondContact O-CG1 3.4Å; I122-I126 PolarHBondContact O-N 3.05Å
123	L	89.3	Confident	91.3	Very high	9 Å²	9	61.5 Å²	61.5	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-72.2	-33	-178.3	-83.5	83.5	0	0	0	112.5	W69 F73 S92 G119 V121 M125 I126 E127	W69-L123 HydrophobicContact CH2-CD1 3.84Å; W69-L123 HydrophobicContact CZ2-CD1 3.71Å; F73-L123 HydrophobicContact CD2-CD2 3.94Å; F73-L123 HydrophobicContact CE2-CD2 3.11Å; F73-L123 HydrophobicContact CZ-CD2 3.57Å; S92-L123 WeakPolarHBondContact O-CD2 3.32Å; G119-L123 WeakPolarHBondContact O-CD1 3.44Å; G119-L123 PolarHBondContact O-N 3.13Å; V121-L123 VanDerWaalsContact C-N 3.35Å; V121-L123 PolarHBondContact O-N 3.27Å; L123-M125 PolarHBondContact O-N 2.93Å; L123-I126 PolarHBondContact O-N 3.4Å; L123-E127 WeakPolarHBondContact O-CB 3.25Å; L123-E127 WeakPolarHBondContact O-CG 3.36Å; L123-E127 PolarHBondContact O-N 2.8Å
124	A	92.1	Very high	91.1	Very high	40 Å²	40	61.5 Å²	61.5	33%	0.331	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-36.2	169.7	0	0	0	0	0	111.6	I93 G120 V121 G128	I93-A124 HydrophobicContact CD1-CB 4.01Å; I93-A124 HydrophobicContact CG1-CB 4.08Å; G120-A124 VanDerWaalsContact O-CB 3.23Å; G120-A124 WeakPolarHBondContact O-CB 3.4Å; G120-A124 PolarHBondContact O-N 3.32Å; V121-A124 PolarHBondContact O-N 3.36Å; A124-G128 WeakPolarHBondContact O-CA 3.3Å; A124-G128 PolarHBondContact O-N 2.85Å
125	M	92.2	Very high	90.9	Very high	125 Å²	125	68.1 Å²	68.1	62%	0.616	37%	0.372	S	S	*	.	H	α-helix	trans	-70.5	-44.5	173.3	-69.2	179.1	179.3	0	0	112.2	V121 I122 L123 G128 V129	V121-M125 HydrophobicContact CG1-CE 3.81Å; V121-M125 HydrophobicContact CG1-SD 4.46Å; V121-M125 WeakPolarHBondContact O-CG 3.5Å; V121-M125 PolarHBondContact O-N 3.34Å; I122-M125 WeakPolarHBondContact O-CB 3.05Å; I122-M125 PolarHBondContact O-N 3.17Å; I122-M125 VanDerWaalsContact O-N 3.14Å; L123-M125 PolarHBondContact O-N 2.93Å; M125-G128 PolarHBondContact O-N 2.87Å; M125-V129 VanDerWaalsContact O-CG2 3.3Å; M125-V129 WeakPolarHBondContact O-CG2 3.31Å; M125-V129 PolarHBondContact O-N 2.84Å
126	I	90.7	Very high	90.6	Very high	106 Å²	106	73 Å²	73	54%	0.544	39%	0.391	S	S	.	.	H	α-helix	trans	-62.7	-47.8	179.9	-66	169.5	0	0	0	110.8	I122 L123 V129 G130	I122-I126 HydrophobicContact CG2-CD1 3.78Å; I122-I126 HydrophobicContact CG2-CG1 4.4Å; I122-I126 WeakPolarHBondContact O-CG1 3.4Å; I122-I126 PolarHBondContact O-N 3.05Å; L123-I126 PolarHBondContact O-N 3.4Å; I126-V129 PolarHBondContact O-N 3.07Å; I126-G130 PolarHBondContact O-N 3.42Å
127	E	87.5	Confident	90.3	Very high	57 Å²	57	74.8 Å²	74.8	27%	0.266	40%	0.4	S	S	.	.	H	α-helix	trans	-65.2	-39.3	175.1	-69.4	-66	168.6	0	0	111.7	S92 L123 V129 G130 I131	S92-E127 WeakPolarHBondContact CB-OE1 3.36Å; S92-E127 PolarHBondContact OG-OE1 3.45Å; L123-E127 WeakPolarHBondContact O-CB 3.25Å; L123-E127 WeakPolarHBondContact O-CG 3.36Å; L123-E127 PolarHBondContact O-N 2.8Å; E127-V129 VanDerWaalsContact C-N 3.34Å; E127-V129 PolarHBondContact O-N 3.49Å; E127-G130 PolarHBondContact O-N 3.48Å; E127-I131 VanDerWaalsContact O-CG1 3.31Å; E127-I131 WeakPolarHBondContact O-CG1 3.32Å; E127-I131 PolarHBondContact O-N 2.93Å
128	G	89	Confident	89.7	Confident	38 Å²	38	72.3 Å²	72.3	39%	0.392	40%	0.395	S	S	.	.	H	α-helix	trans	-59.9	-42.9	175.6	0	0	0	0	0	112.6	A124 M125 F132	A124-G128 WeakPolarHBondContact O-CA 3.3Å; A124-G128 PolarHBondContact O-N 2.85Å; M125-G128 PolarHBondContact O-N 2.87Å; G128-F132 WeakPolarHBondContact O-CB 3.44Å; G128-F132 PolarHBondContact O-N 3.18Å
129	V	92.4	Very high	89.1	Confident	81 Å²	81	74.5 Å²	74.5	49%	0.491	41%	0.408	S	S	.	.	H	α-helix	trans	-69	-39.7	174.2	174.1	0	0	0	0	111	M125 I126 E127 I131 F132 I133	M125-V129 VanDerWaalsContact O-CG2 3.3Å; M125-V129 WeakPolarHBondContact O-CG2 3.31Å; M125-V129 PolarHBondContact O-N 2.84Å; I126-V129 PolarHBondContact O-N 3.07Å; E127-V129 VanDerWaalsContact C-N 3.34Å; E127-V129 PolarHBondContact O-N 3.49Å; V129-I131 PolarHBondContact O-N 3.3Å; V129-F132 PolarHBondContact O-N 3.34Å; V129-I133 HydrophobicContact CG1-CD1 3.69Å; V129-I133 HydrophobicContact CG1-CG1 4.21Å; V129-I133 WeakPolarHBondContact O-CG1 3.28Å; V129-I133 PolarHBondContact O-N 2.75Å
130	G	89.1	Confident	88.5	Confident	31 Å²	31	81.4 Å²	81.4	32%	0.32	44%	0.439	S	S	.	.	H	α-helix	trans	-58.5	-46.5	175.1	0	0	0	0	0	112.4	I126 E127 T134	I126-G130 PolarHBondContact O-N 3.42Å; E127-G130 PolarHBondContact O-N 3.48Å; G130-T134 WeakPolarHBondContact O-CB 3.44Å; G130-T134 PolarHBondContact O-N 3.01Å; G130-T134 PolarHBondContact O-OG1 3.33Å
131	I	87.4	Confident	87.5	Confident	77 Å²	77	88.6 Å²	88.6	40%	0.395	47%	0.468	S	S	.	.	H	α-helix	trans	-64.4	-43.4	174.5	-65	166.6	0	0	0	110.4	P89 E127 V129 T134 R135	P89-I131 HydrophobicContact CB-CD1 4.28Å; P89-I131 HydrophobicContact CG-CD1 4Å; E127-I131 VanDerWaalsContact O-CG1 3.31Å; E127-I131 WeakPolarHBondContact O-CG1 3.32Å; E127-I131 PolarHBondContact O-N 2.93Å; V129-I131 PolarHBondContact O-N 3.3Å; I131-T134 PolarHBondContact O-N 3.32Å; I131-R135 HydrophobicContact CG2-CG 4.18Å; I131-R135 WeakPolarHBondContact O-CB 3.26Å; I131-R135 WeakPolarHBondContact O-CG 3.44Å; I131-R135 PolarHBondContact O-N 3.19Å
132	F	89.7	Confident	85.9	Confident	140 Å²	140	92.5 Å²	92.5	61%	0.614	48%	0.475	S	S	*	.	H	α-helix	trans	-59.8	-49.5	179.3	177.7	-100.8	0	0	0	112.4	G128 V129 T134 R135 F136	G128-F132 WeakPolarHBondContact O-CB 3.44Å; G128-F132 PolarHBondContact O-N 3.18Å; V129-F132 PolarHBondContact O-N 3.34Å; F132-T134 VanDerWaalsContact C-N 3.33Å; F132-T134 PolarHBondContact O-N 3Å; F132-R135 PolarHBondContact O-N 3.04Å; F132-F136 WeakPolarHBondContact O-CB 3.35Å; F132-F136 PolarHBondContact O-N 3.24Å
133	I	91	Very high	84.2	Confident	94 Å²	94	95 Å²	95	48%	0.482	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-41.3	178.3	-66.3	170.9	0	0	0	110.5	V129 R135 F136 T137	V129-I133 HydrophobicContact CG1-CD1 3.69Å; V129-I133 HydrophobicContact CG1-CG1 4.21Å; V129-I133 WeakPolarHBondContact O-CG1 3.28Å; V129-I133 PolarHBondContact O-N 2.75Å; I133-R135 VanDerWaalsContact C-N 3.35Å; I133-R135 PolarHBondContact O-N 2.99Å; I133-F136 PolarHBondContact O-N 3.25Å; I133-T137 WeakPolarHBondContact O-CB 3.49Å; I133-T137 PolarHBondContact O-N 2.88Å; I133-T137 PolarHBondContact O-OG1 3.38Å
134	T	89	Confident	82.5	Confident	96 Å²	96	97.4 Å²	97.4	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-62.9	-41.9	177.7	-57.5	0	0	0	0	111.3	G130 I131 F132 A138	G130-T134 WeakPolarHBondContact O-CB 3.44Å; G130-T134 PolarHBondContact O-N 3.01Å; G130-T134 PolarHBondContact O-OG1 3.33Å; I131-T134 PolarHBondContact O-N 3.32Å; F132-T134 VanDerWaalsContact C-N 3.33Å; F132-T134 PolarHBondContact O-N 3Å; T134-A138 WeakPolarHBondContact O-CB 3.3Å; T134-A138 PolarHBondContact O-N 2.9Å
135	R	87.9	Confident	80.4	Confident	180 Å²	180	103.8 Å²	103.8	68%	0.679	54%	0.543	S	S	*	.	H	α-helix	trans	-65.5	-46.6	175.8	-69.5	-69.7	-175.6	134.4	1.7	111.8	I131 F132 I133 T137 A138 D139	I131-R135 HydrophobicContact CG2-CG 4.18Å; I131-R135 WeakPolarHBondContact O-CB 3.26Å; I131-R135 WeakPolarHBondContact O-CG 3.44Å; I131-R135 PolarHBondContact O-N 3.19Å; F132-R135 PolarHBondContact O-N 3.04Å; I133-R135 VanDerWaalsContact C-N 3.35Å; I133-R135 PolarHBondContact O-N 2.99Å; R135-T137 VanDerWaalsContact C-N 3.32Å; R135-T137 PolarHBondContact O-N 3.13Å; R135-A138 PolarHBondContact O-N 3.39Å; R135-D139 PolarHBondContact O-N 2.83Å
136	F	85	Confident	78.1	Confident	125 Å²	125	104.8 Å²	104.8	55%	0.548	55%	0.55	S	S	.	*	H	α-helix	trans	-60.7	-41.7	178.3	-171	-96.8	0	0	0	112	F132 I133 D139 Q140	F132-F136 WeakPolarHBondContact O-CB 3.35Å; F132-F136 PolarHBondContact O-N 3.24Å; I133-F136 PolarHBondContact O-N 3.25Å; F136-D139 PolarHBondContact O-N 2.83Å; F136-Q140 WeakPolarHBondContact O-CG 3.42Å; F136-Q140 PolarHBondContact O-N 3.32Å
137	T	88	Confident	75.9	Confident	59 Å²	59	104 Å²	104	36%	0.362	55%	0.554	S	S	.	*	H	α-helix	trans	-70.9	-39.4	176.4	-51.9	0	0	0	0	111.5	I133 R135 D139 Q140 F141	I133-T137 WeakPolarHBondContact O-CB 3.49Å; I133-T137 PolarHBondContact O-N 2.88Å; I133-T137 PolarHBondContact O-OG1 3.38Å; R135-T137 VanDerWaalsContact C-N 3.32Å; R135-T137 PolarHBondContact O-N 3.13Å; T137-D139 VanDerWaalsContact C-N 3.27Å; T137-D139 PolarHBondContact O-N 3.44Å; T137-Q140 WeakPolarHBondContact O-CB 3.45Å; T137-Q140 PolarHBondContact O-N 2.96Å; T137-Q140 VanDerWaalsContact O-N 3.11Å; T137-F141 HydrophobicContact CG2-CD2 3.88Å; T137-F141 HydrophobicContact CG2-CE2 3.7Å; T137-F141 VanDerWaalsContact O-CD2 3.25Å; T137-F141 WeakPolarHBondContact O-CD2 3.35Å; T137-F141 PolarHBondContact O-N 2.93Å
138	A	81.7	Confident	73.8	Confident	54 Å²	54	106.9 Å²	106.9	45%	0.446	58%	0.581	S	S	.	*	H	α-helix	trans	-63.8	-32.3	175.7	0	0	0	0	0	112.4	T134 R135 Q140 F141 R142	T134-A138 WeakPolarHBondContact O-CB 3.3Å; T134-A138 PolarHBondContact O-N 2.9Å; R135-A138 PolarHBondContact O-N 3.39Å; A138-Q140 VanDerWaalsContact C-N 3.34Å; A138-F141 CarbonylContact O-C 3.55Å; A138-F141 PolarHBondContact O-N 3.33Å; A138-R142 PolarHBondContact O-N 3.42Å
139	D	77.5	Confident	71.5	Confident	111 Å²	111	114.1 Å²	114.1	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-68.4	-32.3	173.2	-74.6	-33.5	0	0	0	112.4	R135 F136 T137 F141	R135-D139 PolarHBondContact O-N 2.83Å; F136-D139 PolarHBondContact O-N 2.83Å; T137-D139 VanDerWaalsContact C-N 3.27Å; T137-D139 PolarHBondContact O-N 3.44Å; D139-F141 VanDerWaalsContact C-N 3.34Å
140	Q	78.4	Confident	69.1	Low	148 Å²	148	113 Å²	113	69%	0.692	60%	0.603	S	S	*	*	H	α-helix	trans	-67.6	-33.9	173.8	-62.9	-84.7	-79.2	0	0	112.2	F136 T137 A138	F136-Q140 WeakPolarHBondContact O-CG 3.42Å; F136-Q140 PolarHBondContact O-N 3.32Å; T137-Q140 WeakPolarHBondContact O-CB 3.45Å; T137-Q140 PolarHBondContact O-N 2.96Å; T137-Q140 VanDerWaalsContact O-N 3.11Å; A138-Q140 VanDerWaalsContact C-N 3.34Å
141	F	71.4	Confident	66.5	Low	160 Å²	160	116.7 Å²	116.7	70%	0.702	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	12.1	-179.2	-64.5	-69	0	0	0	114.1	T137 A138 D139 P143	T137-F141 HydrophobicContact CG2-CD2 3.88Å; T137-F141 HydrophobicContact CG2-CE2 3.7Å; T137-F141 VanDerWaalsContact O-CD2 3.25Å; T137-F141 WeakPolarHBondContact O-CD2 3.35Å; T137-F141 PolarHBondContact O-N 2.93Å; A138-F141 CarbonylContact O-C 3.55Å; A138-F141 PolarHBondContact O-N 3.33Å; D139-F141 VanDerWaalsContact C-N 3.34Å; F141-P143 WeakPolarHBondContact O-CD 3.38Å
142	R	60.9	Low	64.3	Low	153 Å²	153	121 Å²	121	58%	0.577	64%	0.638	S	S	*	*			trans	-60.3	110.3	178.7	-168.4	178	175.4	-179.7	5.3	108	A138 G144	A138-R142 PolarHBondContact O-N 3.42Å; R142-G144 PolarHBondContact O-N 3.4Å
143	P	58.1	Low	61.9	Low	111 Å²	111	118.4 Å²	118.4	72%	0.721	64%	0.638	S	S	*	*			trans	-58.7	133	175.6	24.4	-31.1	0	0	0	106.9	F141 K145	F141-P143 WeakPolarHBondContact O-CD 3.38Å; P143-K145 PolarHBondContact O-N 2.87Å
144	G	53.7	Low	59.6	Low	59 Å²	59	120.3 Å²	120.3	61%	0.608	65%	0.648	S	S	*	*			trans	-41.6	142.3	-174.7	0	0	0	0	0	111.8	R142 N146	R142-G144 PolarHBondContact O-N 3.4Å; G144-N146 PolarHBondContact O-N 3.38Å
145	K	47.7	Very low	57.1	Low	174 Å²	174	121.5 Å²	121.5	76%	0.757	65%	0.649	S	S	*	*	S	Bend	trans	-63.3	31	-170.7	-139.3	176.5	176.1	175.1	0	115	P143	P143-K145 PolarHBondContact O-N 2.87Å
146	N	44.2	Very low	54.8	Low	146 Å²	146	119.3 Å²	119.3	78%	0.781	65%	0.651	S	S	*	*			trans	-125.5	19.8	-171.7	-66.4	8.5	0	0	0	114.7	G144	G144-N146 PolarHBondContact O-N 3.38Å
147	S	45.2	Very low	52.2	Low	89 Å²	89	119.5 Å²	119.5	62%	0.622	66%	0.658	S	S	*	*	S	Bend	trans	-116.9	-0.8	172.5	-58.9	0	0	0	0	115.7	H149	S147-H149 VanDerWaalsContact C-N 3.34Å
148	S	41.8	Very low	49.5	Very low	118 Å²	118	123.5 Å²	123.5	83%	0.825	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-1.2	175.5	-59.9	0	0	0	0	114.8
149	H	41.4	Very low	47	Very low	190 Å²	190	129.9 Å²	129.9	88%	0.88	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.4	4.6	167.2	-83.6	-80	0	0	0	114.5	S147	S147-H149 VanDerWaalsContact C-N 3.34Å
150	A	41.5	Very low	44.7	Very low	57 Å²	57	130.5 Å²	130.5	47%	0.471	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.9	-7.2	178.7	0	0	0	0	0	114.8
151	N	35.5	Very low	42.3	Very low	110 Å²	110	131.4 Å²	131.4	59%	0.588	71%	0.71	S	S	*	*	S	Bend	trans	-125.7	19	-173.2	-122.9	10.5	0	0	0	116.9	I155	N151-I155 WeakPolarHBondContact OD1-CD1 3.2Å
152	L	41.1	Very low	40.2	Very low	166 Å²	166	128.5 Å²	128.5	87%	0.869	71%	0.71	S	S	*	*	S	Bend	trans	-96.5	-7.2	162.6	-156.2	69.7	0	0	0	112.8
153	S	39.1	Very low	38.9	Very low	87 Å²	87	126.7 Å²	126.7	61%	0.608	72%	0.715	S	S	*	*	S	Bend	trans	-122.4	-7.4	-172.5	55.6	0	0	0	0	117.3
154	I	42.2	Very low	37.3	Very low	134 Å²	134	126.2 Å²	126.2	69%	0.687	71%	0.706	S	S	*	*	S	Bend	trans	-122.8	20.3	-176.9	-46.8	-178.5	0	0	0	114
155	I	36.3	Very low	36.5	Very low	120 Å²	120	128.8 Å²	128.8	62%	0.615	71%	0.712	S	S	*	*			trans	-130	20.3	169.2	-32.6	-179.7	0	0	0	112.5	N151 N157	N151-I155 WeakPolarHBondContact OD1-CD1 3.2Å; I155-N157 VanDerWaalsContact C-N 3.29Å; I155-N157 PolarHBondContact O-N 3.34Å
156	N	40.4	Very low	35.7	Very low	134 Å²	134	124.9 Å²	124.9	72%	0.717	71%	0.707	S	S	*	*	S	Bend	trans	-88.5	84.9	146.9	-70.8	-46.1	0	0	0	105.5
157	N	29.6	Very low	35	Very low	130 Å²	130	123.8 Å²	123.8	70%	0.695	71%	0.706	S	S	*	*	S	Bend	trans	146.8	96.9	156.3	-68.7	-16.9	0	0	0	110.2	I155	I155-N157 VanDerWaalsContact C-N 3.29Å; I155-N157 PolarHBondContact O-N 3.34Å
158	D	31.3	Very low	34.4	Very low	142 Å²	142	126.9 Å²	126.9	76%	0.759	71%	0.714	S	S	*	*			trans	69.7	89	136.6	-45.2	-33.9	0	0	0	119.2
159	F	30.5	Very low	33.9	Very low	188 Å²	188	128.9 Å²	128.9	83%	0.825	72%	0.716	S	S	*	*				-176.9	119.3	113	-140.4	-113.2	0	0	0	111.8	F161	F159-F161 PolarHBondContact O-N 2.87Å
160	S	29	Very low	33.9	Very low	124 Å²	124	124.4 Å²	124.4	87%	0.867	70%	0.703	S	S	*	*			trans	-63	92.8	162.5	-76.8	0	0	0	0	110
161	F	27.1	Very low	33.4	Very low	168 Å²	168	129.7 Å²	129.7	74%	0.737	72%	0.723	S	S	*	*			trans	-93.6	98.7	159.2	-159.4	-100.8	0	0	0	108.3	F159 V163	F159-F161 PolarHBondContact O-N 2.87Å; F161-V163 VanDerWaalsContact C-N 3.35Å; F161-V163 HydrophobicContact CD1-CG2 3.74Å; F161-V163 HydrophobicContact CE1-CG2 4.15Å; F161-V163 PolarHBondContact O-N 3.42Å
162	S	27.7	Very low	33.3	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	73%	0.734	S	S	*	*			trans	-62.3	93.1	170.9	-176	0	0	0	0	109.1	N164	S162-N164 PolarHBondContact O-N 2.79Å
163	V	33	Very low	33.1	Very low	115 Å²	115	131.1 Å²	131.1	70%	0.697	74%	0.735	S	S	*	*			trans	-79.9	97.8	162.5	-179.4	0	0	0	0	106.2	F161 P165	F161-V163 VanDerWaalsContact C-N 3.35Å; F161-V163 HydrophobicContact CD1-CG2 3.74Å; F161-V163 HydrophobicContact CE1-CG2 4.15Å; F161-V163 PolarHBondContact O-N 3.42Å; V163-P165 WeakPolarHBondContact O-CD 3.43Å
164	N	25.7	Very low	32.7	Very low	100 Å²	100	132.9 Å²	132.9	54%	0.535	74%	0.743	S	S	.	*			trans	-80.5	111.5	179.1	-153.7	-18.8	0	0	0	108.5	S162 S166 T167	S162-N164 PolarHBondContact O-N 2.79Å; N164-S166 PolarHBondContact O-N 2.88Å; N164-S166 PolarHBondContact OD1-OG 2.71Å; N164-T167 PolarHBondContact O-OG1 2.86Å
165	P	35	Very low	32.1	Very low	113 Å²	113	135 Å²	135	73%	0.734	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-75.2	14.3	-173.2	31.2	-34.4	0	0	0	113.9	V163 T167	V163-P165 WeakPolarHBondContact O-CD 3.43Å; P165-T167 PolarHBondContact O-N 3.22Å
166	S	31.7	Very low	31.9	Very low	93 Å²	93	135.3 Å²	135.3	65%	0.65	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-83.2	11.2	171.9	51.6	0	0	0	0	114.1	N164	N164-S166 PolarHBondContact O-N 2.88Å; N164-S166 PolarHBondContact OD1-OG 2.71Å
167	T	30.4	Very low	31.5	Very low	122 Å²	122	133.2 Å²	133.2	75%	0.748	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-116.7	16	-178.1	51.7	0	0	0	0	115.1	N164 P165	N164-T167 PolarHBondContact O-OG1 2.86Å; P165-T167 PolarHBondContact O-N 3.22Å
168	I	32.9	Very low	31.5	Very low	155 Å²	155	132.7 Å²	132.7	80%	0.795	76%	0.764	S	S	*	*			trans	-114.5	95.6	167.4	-57	176.1	0	0	0	108.4
169	D	29.5	Very low	31.6	Very low	160 Å²	160	131 Å²	131	86%	0.856	76%	0.763	S	S	*	*			trans	-78.3	147.3	170.3	-124.9	-15.7	0	0	0	110.5
170	P	42	Very low	31.5	Very low	95 Å²	95	127.4 Å²	127.4	62%	0.617	76%	0.757	S	S	*	*	S	Bend	trans	-102.5	119.2	-162	35.9	-27.8	0	0	0	112.2
171	N	32.2	Very low	31.5	Very low	168 Å²	168	128.4 Å²	128.4	90%	0.898	75%	0.753	S	S	*	*			trans	-171	16.2	159.1	-94.3	-31.2	0	0	0	116.1
172	T	33.6	Very low	31.5	Very low	133 Å²	133	130.1 Å²	130.1	82%	0.816	75%	0.754	S	S	*	*			trans	-129.5	43.1	-170.7	-42.7	0	0	0	0	115.3
173	I	35.7	Very low	31.4	Very low	173 Å²	173	132.9 Å²	132.9	89%	0.887	76%	0.756	S	S	*	*			trans	-136	96.3	149.3	-53.1	-178.9	0	0	0	108.6
174	T	31.5	Very low	30.9	Very low	125 Å²	125	132.6 Å²	132.6	77%	0.767	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-49.3	137.1	171.1	-42.1	0	0	0	0	111.1
175	Q	28.8	Very low	30.9	Very low	178 Å²	178	133.1 Å²	133.1	83%	0.832	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-51.1	134.7	170.6	-63.5	172.7	-29.9	0	0	111.5
176	P	32.9	Very low	30.6	Very low	127 Å²	127	133.1 Å²	133.1	83%	0.825	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-75.5	124.1	156.1	-2.2	19.5	0	0	0	108.8
177	A	30.7	Very low	30.3	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-59.3	163.5	171.5	0	0	0	0	0	112.4
178	P	30.7	Very low	30.1	Very low	119 Å²	119	132 Å²	132	77%	0.773	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-82.9	126	-157.4	31.9	-31.6	0	0	0	113	T180	P178-T180 PolarHBondContact O-N 3.3Å
179	S	34.1	Very low	29.8	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	77%	0.772	S	S	*	*			trans	-79.9	114.6	166.2	50.3	0	0	0	0	110	D181	S179-D181 PolarHBondContact O-N 3.01Å
180	T	27.9	Very low	29.7	Very low	114 Å²	114	129 Å²	129	70%	0.699	76%	0.759	S	S	*	*			trans	-85.8	98	172.1	-56.2	0	0	0	0	108.7	P178	P178-T180 PolarHBondContact O-N 3.3Å
181	D	29.6	Very low	29.2	Very low	145 Å²	145	129.4 Å²	129.4	78%	0.775	76%	0.762	S	S	*	*			trans	-125.1	83.6	164.6	-64.2	-46	0	0	0	106.4	S179	S179-D181 PolarHBondContact O-N 3.01Å
182	R	26.4	Very low	29.6	Very low	203 Å²	203	124.8 Å²	124.8	77%	0.766	74%	0.737	S	S	*	*				39.4	106.7	87.8	-103.2	-165.3	175.8	143.2	6	115.1
183	E	24.6	Very low	29.9	Very low	158 Å²	158	120.8 Å²	120.8	74%	0.738	71%	0.708	S	S	*	*			trans	56.7	114.7	141.3	-75.4	162.2	87.9	0	0	117.3
184	S	22.9	Very low	29.9	Very low	108 Å²	108	116.4 Å²	116.4	76%	0.755	69%	0.693	S	S	*	*				-177.6	140.5	97.3	39.4	0	0	0	0	112.4
185	S	26.5	Very low	29.9	Very low	111 Å²	111	112.8 Å²	112.8	78%	0.776	68%	0.681	S	S	*	*			trans	65.9	98.8	145.8	-52.3	0	0	0	0	118
186	S	27.5	Very low	30.3	Very low	113 Å²	113	105.8 Å²	105.8	79%	0.79	65%	0.648	S	S	*	*				-169.8	112.3	115.6	29.1	0	0	0	0	111.4	S188	S186-S188 PolarHBondContact O-N 3.04Å
187	S	26.9	Very low	30.4	Very low	123 Å²	123	100.9 Å²	100.9	86%	0.86	62%	0.62	S	S	*	*			trans	-49.6	109.3	154.2	47.4	0	0	0	0	111.5
188	S	26.1	Very low	30.4	Very low	70 Å²	70	103 Å²	103	49%	0.49	62%	0.618	S	S	.	*			trans	-146.8	106.1	143.2	56.4	0	0	0	0	107.3	S186 F190	S186-S188 PolarHBondContact O-N 3.04Å; S188-F190 WeakPolarHBondContact O-CD2 3.21Å; S188-F190 PolarHBondContact O-N 3.28Å
189	S	26.4	Very low	30.6	Very low	116 Å²	116	104 Å²	104	81%	0.811	62%	0.617	S	S	*	*			trans	-40	106.7	163.4	-57.3	0	0	0	0	108.8	P191	S189-P191 WeakPolarHBondContact O-CD 3.49Å
190	F	27.5	Very low	30.4	Very low	135 Å²	135	104.7 Å²	104.7	59%	0.592	62%	0.617	S	S	*	*			trans	-87	104.8	174.5	-79.8	-80.4	0	0	0	108.3	S188 L192	S188-F190 WeakPolarHBondContact O-CD2 3.21Å; S188-F190 PolarHBondContact O-N 3.28Å; F190-L192 HydrophobicContact CB-CB 3.96Å; F190-L192 HydrophobicContact CD1-CB 4.08Å; F190-L192 HydrophobicContact CD1-CD2 4Å; F190-L192 HydrophobicContact CE1-CD2 4.45Å; F190-L192 HydrophobicContact CG-CB 4.47Å; F190-L192 PolarHBondContact O-N 3.45Å; F190-L192 VanDerWaalsContact O-N 3.16Å
191	P	31.1	Very low	30.3	Very low	103 Å²	103	104.7 Å²	104.7	67%	0.669	61%	0.612	S	S	*	*			trans	-81	38.4	160.9	37.9	-37.4	0	0	0	110	S189 F193 S194	S189-P191 WeakPolarHBondContact O-CD 3.49Å; P191-F193 VanDerWaalsContact C-N 3.31Å; P191-F193 PolarHBondContact O-N 3.02Å; P191-S194 PolarHBondContact O-OG 2.9Å
192	L	41.1	Very low	30.5	Very low	72 Å²	72	103.7 Å²	103.7	38%	0.377	61%	0.614	S	S	.	*			trans	-73.1	-18.6	-160.3	-173.7	57.3	0	0	0	114.2	M118 F190	M118-L192 HydrophobicContact CE-CD1 3.2Å; M118-L192 HydrophobicContact CE-CD2 3.87Å; M118-L192 HydrophobicContact CE-CG 4.18Å; M118-L192 HydrophobicContact SD-CD1 3.67Å; F190-L192 HydrophobicContact CB-CB 3.96Å; F190-L192 HydrophobicContact CD1-CB 4.08Å; F190-L192 HydrophobicContact CD1-CD2 4Å; F190-L192 HydrophobicContact CE1-CD2 4.45Å; F190-L192 HydrophobicContact CG-CB 4.47Å; F190-L192 PolarHBondContact O-N 3.45Å; F190-L192 VanDerWaalsContact O-N 3.16Å
193	F	38.4	Very low	30.7	Very low	48 Å²	48	103.8 Å²	103.8	21%	0.211	62%	0.62	C	S	.	*	S	Bend	trans	-128.5	0.7	-175.1	-99.7	-77	0	0	0	115.8	Q65 F66 P191 G195 F196	Q65-F193 HydrophobicContact CB-CD1 3.53Å; Q65-F193 HydrophobicContact CB-CE1 3.42Å; Q65-F193 VanDerWaalsContact CB-CE1 3.42Å; Q65-F193 HydrophobicContact CB-CE2 4.44Å; Q65-F193 HydrophobicContact CB-CG 4.13Å; Q65-F193 HydrophobicContact CB-CZ 3.88Å; Q65-F193 HydrophobicContact CG-CD1 3.56Å; Q65-F193 HydrophobicContact CG-CE1 3.84Å; Q65-F193 HydrophobicContact CG-CG 4.31Å; F66-F193 HydrophobicContact CZ-CE2 4.45Å; P191-F193 VanDerWaalsContact C-N 3.31Å; P191-F193 PolarHBondContact O-N 3.02Å; F193-G195 PolarHBondContact O-N 2.99Å; F193-G195 VanDerWaalsContact O-N 3.11Å; F193-F196 HydrophobicContact CD1-CB 4.16Å; F193-F196 AromaticContact CD1-CD2 3.58Å; F193-F196 HydrophobicContact CD1-CD2 3.58Å; F193-F196 HydrophobicContact CD1-CE2 4.37Å; F193-F196 HydrophobicContact CD1-CG 4.18Å; F193-F196 AromaticContact CE1-CD2 3.46Å; F193-F196 HydrophobicContact CE1-CD2 3.46Å; F193-F196 VanDerWaalsContact CE1-CD2 3.46Å; F193-F196 AromaticContact CE1-CE2 3.82Å; F193-F196 HydrophobicContact CE1-CE2 3.82Å; F193-F196 HydrophobicContact CE1-CG 4.21Å; F193-F196 PolarHBondContact O-N 3.46Å; F193-F196 VanDerWaalsContact O-N 3.13Å
194	S	36.7	Very low	30.8	Very low	81 Å²	81	99.7 Å²	99.7	57%	0.566	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-11.7	173.3	35.9	0	0	0	0	113.8	P191	P191-S194 PolarHBondContact O-OG 2.9Å
195	G	30.2	Very low	30.9	Very low	50 Å²	50	106 Å²	106	52%	0.515	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-12.3	174.1	0	0	0	0	0	114.5	N107 F193 G197	N107-G195 PolarHBondContact ND2-O 2.92Å; F193-G195 PolarHBondContact O-N 2.99Å; F193-G195 VanDerWaalsContact O-N 3.11Å; G195-G197 PolarHBondContact O-N 3.28Å; G195-G197 VanDerWaalsContact O-N 3.13Å
196	F	38.6	Very low	31	Very low	30 Å²	30	106.8 Å²	106.8	13%	0.132	63%	0.63	C	S	.	*	S	Bend	trans	-87.3	60.4	166.9	-86.4	-82.1	0	0	0	109.5	V103 T104 F193 L198	V103-F196 HydrophobicContact CB-CE1 4.34Å; V103-F196 HydrophobicContact CB-CE2 4.42Å; V103-F196 HydrophobicContact CB-CZ 3.59Å; V103-F196 HydrophobicContact CG2-CE2 4.01Å; V103-F196 HydrophobicContact CG2-CZ 3.6Å; V103-F196 WeakPolarHBondContact O-CE1 3.23Å; V103-F196 WeakPolarHBondContact O-CZ 3.44Å; T104-F196 HydrophobicContact CG2-CD2 4.46Å; T104-F196 HydrophobicContact CG2-CE2 3.45Å; T104-F196 VanDerWaalsContact CG2-CE2 3.45Å; T104-F196 HydrophobicContact CG2-CZ 3.5Å; F193-F196 HydrophobicContact CD1-CB 4.16Å; F193-F196 AromaticContact CD1-CD2 3.58Å; F193-F196 HydrophobicContact CD1-CD2 3.58Å; F193-F196 HydrophobicContact CD1-CE2 4.37Å; F193-F196 HydrophobicContact CD1-CG 4.18Å; F193-F196 AromaticContact CE1-CD2 3.46Å; F193-F196 HydrophobicContact CE1-CD2 3.46Å; F193-F196 VanDerWaalsContact CE1-CD2 3.46Å; F193-F196 AromaticContact CE1-CE2 3.82Å; F193-F196 HydrophobicContact CE1-CE2 3.82Å; F193-F196 HydrophobicContact CE1-CG 4.21Å; F193-F196 PolarHBondContact O-N 3.46Å; F193-F196 VanDerWaalsContact O-N 3.13Å; F196-L198 PolarHBondContact O-N 3.41Å
197	G	33.6	Very low	31.3	Very low	24 Å²	24	109.1 Å²	109.1	25%	0.247	66%	0.656	C	S	.	*			trans	-62.1	94.5	-175.8	0	0	0	0	0	112.3	G195 T200	G195-G197 PolarHBondContact O-N 3.28Å; G195-G197 VanDerWaalsContact O-N 3.13Å; G197-T200 PolarHBondContact O-OG1 3.12Å; G197-T200 VanDerWaalsContact O-OG1 3.12Å
198	L	30.9	Very low	31.5	Very low	134 Å²	134	108.4 Å²	108.4	70%	0.702	65%	0.646	S	S	*	*	S	Bend	trans	-71.6	-16.4	137.4	-143.7	71.7	0	0	0	110.1	F196 T200 L201	F196-L198 PolarHBondContact O-N 3.41Å; L198-T200 VanDerWaalsContact C-N 3.29Å; L198-T200 PolarHBondContact O-N 3.44Å; L198-L201 HydrophobicContact CD1-CD1 4.25Å; L198-L201 PolarHBondContact O-N 3.32Å
199	D	34.8	Very low	31.8	Very low	139 Å²	139	110.4 Å²	110.4	74%	0.743	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-12.7	177.4	-50.7	-8.9	0	0	0	113.7	L201	D199-L201 VanDerWaalsContact C-N 3.32Å
200	T	30.4	Very low	32.1	Very low	121 Å²	121	110.1 Å²	110.1	74%	0.742	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	0.5	171.6	45.2	0	0	0	0	113.3	G197 L198	G197-T200 PolarHBondContact O-OG1 3.12Å; G197-T200 VanDerWaalsContact O-OG1 3.12Å; L198-T200 VanDerWaalsContact C-N 3.29Å; L198-T200 PolarHBondContact O-N 3.44Å
201	L	25.7	Very low	32.3	Very low	114 Å²	114	108.6 Å²	108.6	60%	0.597	65%	0.648	S	S	*	*	S	Bend	trans	-87.5	128.8	168.1	-75.8	167.5	0	0	0	109.6	L198 D199 F203	L198-L201 HydrophobicContact CD1-CD1 4.25Å; L198-L201 PolarHBondContact O-N 3.32Å; D199-L201 VanDerWaalsContact C-N 3.32Å; L201-F203 PolarHBondContact O-N 2.85Å
202	P	34.4	Very low	32.4	Very low	125 Å²	125	109 Å²	109	81%	0.812	65%	0.647	S	S	*	*	S	Bend	trans	-80.7	46.9	-172	36	-36.9	0	0	0	112.4
203	F	30.4	Very low	31.8	Very low	204 Å²	204	111.5 Å²	111.5	90%	0.895	67%	0.665	S	S	*	*			trans	-122.1	106.3	169.7	-99.3	-86.5	0	0	0	109.1	L201	L201-F203 PolarHBondContact O-N 2.85Å
204	G	25.9	Very low	31.3	Very low	72 Å²	72	116 Å²	116	74%	0.742	70%	0.698	S	S	*	*			trans	119.2	45.6	166.5	0	0	0	0	0	115.9	P206	G204-P206 WeakPolarHBondContact O-CD 3.35Å
205	R	26.1	Very low	30.9	Very low	240 Å²	240	118.7 Å²	118.7	91%	0.906	71%	0.708	S	S	*	*			trans	-87	112.8	155.7	-152.3	-176.9	-162	-154.4	5	107.1	A207	R205-A207 PolarHBondContact O-N 3.3Å
206	P	28.6	Very low	31	Very low	129 Å²	129	124.4 Å²	124.4	84%	0.838	72%	0.724	S	S	*	*			trans	-78.1	106.3	162.9	29.9	-27.8	0	0	0	107.5	G204	G204-P206 WeakPolarHBondContact O-CD 3.35Å
207	A	32.6	Very low	30.3	Very low	161 Å²	161	133 Å²	133	100%	1.331	78%	0.778	S	S	*	*			trans	-122	0	150.8	0	0	0	0	0	106.5	R205	R205-A207 PolarHBondContact O-N 3.3Å

Retrieved 207 of 207 residues in 428.6 ms (Link to these results)

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