G4V7D2_SCHMA Loading...

Protein MIS12 homolog

AlphaFold DB , UniProt , Accession G4V7D2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 225 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	40	Very low	42.6	Very low	248 Å²	248	166.4 Å²	166.4	100%	1.222	87%	0.868	S	S	*	*				0	101.8	0	-85.8	174.6	150.6	0	0	107.9
2	M	36.2	Very low	44.1	Very low	189 Å²	189	159.7 Å²	159.7	93%	0.931	84%	0.839	S	S	*	*			trans	-110	117.8	167.9	-84.7	-173.8	93.7	0	0	107.2	K4	M2-K4 PolarHBondContact O-N 3.22Å; M2-K4 VanDerWaalsContact O-N 3.16Å
3	H	38.2	Very low	46.4	Very low	199 Å²	199	152.7 Å²	152.7	92%	0.921	81%	0.809	S	S	*	*			trans	-60.9	111.8	172.5	-94.4	-69.7	0	0	0	109.1	S5	H3-S5 PolarHBondContact O-N 3.11Å
4	K	39.4	Very low	48.3	Very low	199 Å²	199	147.1 Å²	147.1	87%	0.865	78%	0.779	S	S	*	*			trans	-66.7	106.8	158.6	-95.3	-178.6	173	-179.8	0	106.5	M2 E6	M2-K4 PolarHBondContact O-N 3.22Å; M2-K4 VanDerWaalsContact O-N 3.16Å; K4-E6 PolarHBondContact O-N 3.07Å
5	S	41.6	Very low	50	Low	108 Å²	108	146.1 Å²	146.1	76%	0.755	77%	0.768	S	S	*	*			trans	-66.8	109.8	164.2	-164.2	0	0	0	0	106.7	H3 V7	H3-S5 PolarHBondContact O-N 3.11Å; S5-V7 PolarHBondContact O-N 3.05Å
6	E	41.2	Very low	51.4	Low	183 Å²	183	142.2 Å²	142.2	86%	0.855	75%	0.751	S	S	*	*			trans	-63.3	104.3	168.9	-76.3	177.1	164	0	0	107.5	K4 Q8	K4-E6 PolarHBondContact O-N 3.07Å; E6-Q8 PolarHBondContact O-N 3.11Å
7	V	42.7	Very low	52.6	Low	119 Å²	119	137.2 Å²	137.2	72%	0.721	74%	0.735	S	S	*	*			trans	-67.9	103.9	167.9	179.6	0	0	0	0	105.5	S5 T9	S5-V7 PolarHBondContact O-N 3.05Å; V7-T9 VanDerWaalsContact C-N 3.33Å; V7-T9 PolarHBondContact O-N 3.2Å
8	Q	36.5	Very low	54.3	Low	182 Å²	182	130.8 Å²	130.8	85%	0.85	70%	0.7	S	S	*	*			trans	-60.3	99.1	167.4	-96.4	179.8	-3.2	0	0	107.9	E6 L10	E6-Q8 PolarHBondContact O-N 3.11Å; Q8-L10 PolarHBondContact O-N 3.44Å
9	T	46.9	Very low	56	Low	123 Å²	123	129.2 Å²	129.2	76%	0.755	69%	0.688	S	S	*	*			trans	-73.6	101.6	168.9	44.2	0	0	0	0	107.8	V7 S11	V7-T9 VanDerWaalsContact C-N 3.33Å; V7-T9 PolarHBondContact O-N 3.2Å; T9-S11 PolarHBondContact O-N 3.4Å
10	L	47.8	Very low	57.5	Low	164 Å²	164	125.6 Å²	125.6	86%	0.859	66%	0.664	S	S	*	*			trans	-61.1	105.1	164	-92.1	148.6	0	0	0	107.9	Q8 V12	Q8-L10 PolarHBondContact O-N 3.44Å; L10-V12 PolarHBondContact O-N 3.31Å
11	S	58.5	Low	59.1	Low	116 Å²	116	120 Å²	120	81%	0.811	64%	0.635	S	S	*	*			trans	-72.7	107.3	172.3	170.5	0	0	0	0	108	T9	T9-S11 PolarHBondContact O-N 3.4Å
12	V	60.9	Low	61.5	Low	86 Å²	86	109.6 Å²	109.6	52%	0.521	59%	0.587	S	S	.	*			trans	-90.7	133.4	169.4	-179.1	0	0	0	0	107.1	L10 I14 V16	L10-V12 PolarHBondContact O-N 3.31Å; V12-I14 PolarHBondContact O-N 3.24Å; V12-V16 HydrophobicContact CG1-CB 3.79Å; V12-V16 HydrophobicContact CG1-CG1 3.87Å
13	P	73.4	Confident	64.1	Low	69 Å²	69	106.4 Å²	106.4	45%	0.448	57%	0.568	S	S	.	*			trans	-53.5	139.3	173.6	-23.4	32.7	0	0	0	110.7	E15 V16 A17	P13-E15 WeakPolarHBondContact CB-OE2 3.23Å; P13-E15 PolarHBondContact O-N 2.86Å; P13-E15 VanDerWaalsContact O-N 3.17Å; P13-V16 HydrophobicContact CB-CG2 4.23Å; P13-V16 HydrophobicContact CG-CG2 4.37Å; P13-V16 PolarHBondContact O-N 2.91Å; P13-A17 PolarHBondContact O-N 3.4Å
14	I	73.5	Confident	66.5	Low	75 Å²	75	101.6 Å²	101.6	39%	0.385	55%	0.549	S	S	.	.	H	α-helix	trans	-60.4	-30.6	-175.3	-167	165	0	0	0	111.4	V12 V16 A17 Q18 L30 V95	V12-I14 PolarHBondContact O-N 3.24Å; I14-V16 VanDerWaalsContact C-N 3.33Å; I14-V16 PolarHBondContact O-N 3.33Å; I14-A17 PolarHBondContact O-N 3.08Å; I14-Q18 HydrophobicContact CG1-CG 4.18Å; I14-Q18 WeakPolarHBondContact O-CB 3.08Å; I14-Q18 VanDerWaalsContact O-CG 3.29Å; I14-Q18 WeakPolarHBondContact O-CG 3.25Å; I14-Q18 PolarHBondContact O-N 3.48Å; I14-L30 HydrophobicContact CD1-CD1 4.21Å; I14-V95 HydrophobicContact CD1-CG2 4.18Å
15	E	73.7	Confident	69	Low	132 Å²	132	95.1 Å²	95.1	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-42.2	177.4	-57.5	78.6	-172.2	0	0	111.3	P13 Q18 E19	P13-E15 WeakPolarHBondContact CB-OE2 3.23Å; P13-E15 PolarHBondContact O-N 2.86Å; P13-E15 VanDerWaalsContact O-N 3.17Å; E15-Q18 PolarHBondContact O-N 3.42Å; E15-E19 PolarHBondContact O-N 3.14Å
16	V	71.7	Confident	71.4	Confident	83 Å²	83	93.4 Å²	93.4	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-71.7	-39.5	179.3	179.4	0	0	0	0	110.5	V12 P13 I14 Q18	V12-V16 HydrophobicContact CG1-CB 3.79Å; V12-V16 HydrophobicContact CG1-CG1 3.87Å; P13-V16 HydrophobicContact CB-CG2 4.23Å; P13-V16 HydrophobicContact CG-CG2 4.37Å; P13-V16 PolarHBondContact O-N 2.91Å; I14-V16 VanDerWaalsContact C-N 3.33Å; I14-V16 PolarHBondContact O-N 3.33Å; V16-Q18 VanDerWaalsContact C-N 3.3Å; V16-Q18 PolarHBondContact O-N 3.12Å
17	A	71.6	Confident	73.9	Confident	58 Å²	58	89 Å²	89	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-65.6	-36.1	176	0	0	0	0	0	112	P13 I14	P13-A17 PolarHBondContact O-N 3.4Å; I14-A17 PolarHBondContact O-N 3.08Å
18	Q	84.3	Confident	76.2	Confident	21 Å²	21	85.2 Å²	85.2	10%	0.098	48%	0.481	C	S	.	.	H	α-helix	trans	-84.1	-20.2	-178.8	-72.5	-175.2	8.1	0	0	113.9	I14 E15 V16 Y20 V21 S22 L30	I14-Q18 HydrophobicContact CG1-CG 4.18Å; I14-Q18 WeakPolarHBondContact O-CB 3.08Å; I14-Q18 VanDerWaalsContact O-CG 3.29Å; I14-Q18 WeakPolarHBondContact O-CG 3.25Å; I14-Q18 PolarHBondContact O-N 3.48Å; E15-Q18 PolarHBondContact O-N 3.42Å; V16-Q18 VanDerWaalsContact C-N 3.3Å; V16-Q18 PolarHBondContact O-N 3.12Å; Q18-Y20 PolarHBondContact O-N 2.89Å; Q18-V21 PolarHBondContact O-N 3.2Å; Q18-S22 VanDerWaalsContact O-CB 3.29Å; Q18-S22 WeakPolarHBondContact O-CB 3.46Å; Q18-S22 PolarHBondContact O-N 3.38Å; Q18-S22 PolarHBondContact O-OG 3.15Å; Q18-L30 VanDerWaalsContact NE2-CD1 3.34Å
19	E	86.1	Confident	78.9	Confident	101 Å²	101	76.5 Å²	76.5	47%	0.472	44%	0.441	S	S	.	.	H	α-helix	trans	-55.6	-44	177.4	-169.7	-168.4	151.2	0	0	111	E15 S22 K23	E15-E19 PolarHBondContact O-N 3.14Å; E19-S22 PolarHBondContact O-N 3.01Å; E19-K23 WeakPolarHBondContact O-CG 3.48Å; E19-K23 PolarHBondContact O-N 3.46Å; E19-K23 WeakPolarHBondContact OE1-CE 3.49Å; E19-K23 IonicContact OE1-NZ 2.64Å; E19-K23 PolarHBondContact OE1-NZ 2.82Å
20	Y	86.4	Confident	81	Confident	56 Å²	56	72.7 Å²	72.7	22%	0.22	42%	0.415	C	S	.	.	H	α-helix	trans	-65	-43.4	-179.2	-144.8	-119.1	0	0	0	112.7	Q18 S22 K23 L24 L101 V105 V106 L107 D110	Q18-Y20 PolarHBondContact O-N 2.89Å; Y20-S22 VanDerWaalsContact C-N 3.34Å; Y20-K23 PolarHBondContact O-N 2.89Å; Y20-L24 PolarHBondContact O-N 3.27Å; Y20-L101 HydrophobicContact CD1-CB 4.45Å; Y20-L101 HydrophobicContact CD1-CD1 3.78Å; Y20-V105 WeakPolarHBondContact CE1-O 3.43Å; Y20-V106 WeakPolarHBondContact OH-CA 3.46Å; Y20-L107 HydrophobicContact CD1-CD1 4.15Å; Y20-L107 HydrophobicContact CD1-CG 4.1Å; Y20-L107 HydrophobicContact CD2-CD1 4.1Å; Y20-L107 HydrophobicContact CE1-CB 4.31Å; Y20-L107 HydrophobicContact CE1-CD1 3.91Å; Y20-L107 HydrophobicContact CE1-CD2 4.34Å; Y20-L107 HydrophobicContact CE1-CG 3.47Å; Y20-L107 VanDerWaalsContact CE1-CG 3.47Å; Y20-L107 HydrophobicContact CE2-CD1 3.83Å; Y20-L107 HydrophobicContact CE2-CG 4.11Å; Y20-L107 HydrophobicContact CG-CD1 4.23Å; Y20-L107 VanDerWaalsContact CZ-CG 3.45Å; Y20-L107 WeakPolarHBondContact OH-CB 3.15Å; Y20-L107 PolarHBondContact OH-N 3.41Å; Y20-D110 WeakPolarHBondContact CE2-OD2 3.34Å; Y20-D110 PolarHBondContact OH-OD2 3.45Å
21	V	90.1	Very high	83.2	Confident	8 Å²	8	69.5 Å²	69.5	5%	0.048	40%	0.396	C	S	.	.	H	α-helix	trans	-66	-40.7	176	179	0	0	0	0	110.4	Q18 K23 L24 L25 P29 L99 L101	Q18-V21 PolarHBondContact O-N 3.2Å; V21-K23 PolarHBondContact O-N 3.27Å; V21-L24 WeakPolarHBondContact O-CB 3.29Å; V21-L24 PolarHBondContact O-N 2.88Å; V21-L24 VanDerWaalsContact O-N 3.15Å; V21-L25 HydrophobicContact CG1-CD1 3.49Å; V21-L25 VanDerWaalsContact CG1-CD1 3.49Å; V21-L25 HydrophobicContact CG1-CG 4.05Å; V21-L25 WeakPolarHBondContact O-CB 3.37Å; V21-L25 WeakPolarHBondContact O-CG 3.37Å; V21-L25 PolarHBondContact O-N 3.48Å; V21-P29 HydrophobicContact CB-CG 4.41Å; V21-P29 HydrophobicContact CG1-CG 3.7Å; V21-L99 HydrophobicContact CG1-CB 4.25Å; V21-L99 WeakPolarHBondContact CG1-O 3.48Å; V21-L101 HydrophobicContact CB-CD1 4.3Å; V21-L101 HydrophobicContact CG2-CB 3.97Å; V21-L101 HydrophobicContact CG2-CD1 3.8Å; V21-L101 HydrophobicContact CG2-CG 4Å
22	S	91.6	Very high	84.9	Confident	30 Å²	30	66.9 Å²	66.9	21%	0.21	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-40.1	-179.8	-56.5	0	0	0	0	111.7	Q18 E19 Y20 L24 L25 G26 F27	Q18-S22 VanDerWaalsContact O-CB 3.29Å; Q18-S22 WeakPolarHBondContact O-CB 3.46Å; Q18-S22 PolarHBondContact O-N 3.38Å; Q18-S22 PolarHBondContact O-OG 3.15Å; E19-S22 PolarHBondContact O-N 3.01Å; Y20-S22 VanDerWaalsContact C-N 3.34Å; S22-L24 VanDerWaalsContact C-N 3.3Å; S22-L24 PolarHBondContact O-N 3.33Å; S22-L25 PolarHBondContact O-N 2.99Å; S22-G26 WeakPolarHBondContact O-CA 3.47Å; S22-G26 PolarHBondContact O-N 2.97Å; S22-F27 WeakPolarHBondContact CA-O 3.42Å
23	K	89.4	Confident	86.5	Confident	122 Å²	122	62.8 Å²	62.8	53%	0.53	35%	0.348	S	S	.	.	H	α-helix	trans	-59.6	-40.7	172.3	-76.7	178	-174.4	166	0	112	E19 Y20 V21 L107	E19-K23 WeakPolarHBondContact O-CG 3.48Å; E19-K23 PolarHBondContact O-N 3.46Å; E19-K23 WeakPolarHBondContact OE1-CE 3.49Å; E19-K23 IonicContact OE1-NZ 2.64Å; E19-K23 PolarHBondContact OE1-NZ 2.82Å; Y20-K23 PolarHBondContact O-N 2.89Å; V21-K23 PolarHBondContact O-N 3.27Å; K23-L107 HydrophobicContact CB-CD1 4.12Å
24	L	89.7	Confident	87.5	Confident	99 Å²	99	63.1 Å²	63.1	52%	0.518	35%	0.346	S	S	.	.	H	α-helix	trans	-70.3	-44.7	178.8	177.9	62	0	0	0	112.9	Y20 V21 S22 L101 L107	Y20-L24 PolarHBondContact O-N 3.27Å; V21-L24 WeakPolarHBondContact O-CB 3.29Å; V21-L24 PolarHBondContact O-N 2.88Å; V21-L24 VanDerWaalsContact O-N 3.15Å; S22-L24 VanDerWaalsContact C-N 3.3Å; S22-L24 PolarHBondContact O-N 3.33Å; L24-L101 HydrophobicContact CB-CD1 4.26Å; L24-L101 HydrophobicContact CD2-CD1 3.82Å; L24-L101 HydrophobicContact CD2-CD2 4.04Å; L24-L101 HydrophobicContact CD2-CG 4.29Å; L24-L107 HydrophobicContact CB-CD2 3.93Å; L24-L107 HydrophobicContact CD1-CD2 3.81Å; L24-L107 HydrophobicContact CD2-CD2 4.26Å; L24-L107 HydrophobicContact CG-CD2 4.2Å
25	L	91.5	Very high	88.6	Confident	63 Å²	63	63.4 Å²	63.4	33%	0.33	35%	0.348	S	S	.	.	H	α-helix	trans	-86.1	-24.9	-172.1	-65	179	0	0	0	113.6	V21 S22 F27 P29 L99	V21-L25 HydrophobicContact CG1-CD1 3.49Å; V21-L25 VanDerWaalsContact CG1-CD1 3.49Å; V21-L25 HydrophobicContact CG1-CG 4.05Å; V21-L25 WeakPolarHBondContact O-CB 3.37Å; V21-L25 WeakPolarHBondContact O-CG 3.37Å; V21-L25 PolarHBondContact O-N 3.48Å; S22-L25 PolarHBondContact O-N 2.99Å; L25-F27 VanDerWaalsContact C-N 3.27Å; L25-F27 HydrophobicContact CB-CD1 3.94Å; L25-F27 HydrophobicContact CB-CE1 3.78Å; L25-F27 HydrophobicContact CB-CG 4.47Å; L25-F27 HydrophobicContact CB-CZ 4.16Å; L25-F27 HydrophobicContact CD1-CE1 4.35Å; L25-F27 HydrophobicContact CD1-CE2 4.15Å; L25-F27 HydrophobicContact CD1-CZ 3.88Å; L25-F27 HydrophobicContact CG-CE1 4.49Å; L25-F27 HydrophobicContact CG-CZ 4.49Å; L25-F27 WeakPolarHBondContact O-CD1 3.22Å; L25-P29 HydrophobicContact CD1-CG 4.45Å; L25-L99 HydrophobicContact CD1-CB 4.32Å; L25-L99 HydrophobicContact CD1-CD1 4.06Å; L25-L99 HydrophobicContact CD1-CD2 3.9Å; L25-L99 HydrophobicContact CD1-CG 4.31Å
26	G	92.3	Very high	89.7	Confident	71 Å²	71	60.4 Å²	60.4	73%	0.732	34%	0.336	S	S	*	.	S	Bend	trans	79.3	5.2	-172	0	0	0	0	0	114.4	S22	S22-G26 WeakPolarHBondContact O-CA 3.47Å; S22-G26 PolarHBondContact O-N 2.97Å
27	F	92.5	Very high	90.9	Very high	91 Å²	91	59 Å²	59	40%	0.399	32%	0.322	S	S	.	.	S	Bend	trans	-147	156.9	173.3	66.2	-92.3	0	0	0	110.4	S22 L25 L32 L99	S22-F27 WeakPolarHBondContact CA-O 3.42Å; L25-F27 VanDerWaalsContact C-N 3.27Å; L25-F27 HydrophobicContact CB-CD1 3.94Å; L25-F27 HydrophobicContact CB-CE1 3.78Å; L25-F27 HydrophobicContact CB-CG 4.47Å; L25-F27 HydrophobicContact CB-CZ 4.16Å; L25-F27 HydrophobicContact CD1-CE1 4.35Å; L25-F27 HydrophobicContact CD1-CE2 4.15Å; L25-F27 HydrophobicContact CD1-CZ 3.88Å; L25-F27 HydrophobicContact CG-CE1 4.49Å; L25-F27 HydrophobicContact CG-CZ 4.49Å; L25-F27 WeakPolarHBondContact O-CD1 3.22Å; F27-L32 HydrophobicContact CD2-CB 4.18Å; F27-L32 HydrophobicContact CE2-CB 3.98Å; F27-L32 HydrophobicContact CE2-CD2 3.87Å; F27-L32 HydrophobicContact CE2-CG 4.49Å; F27-L32 HydrophobicContact CZ-CD2 4.31Å; F27-L99 HydrophobicContact CE2-CD1 4.14Å; F27-L99 HydrophobicContact CZ-CD1 4.44Å
28	A	92.1	Very high	92.1	Very high	39 Å²	39	60.2 Å²	60.2	32%	0.322	32%	0.321	S	S	.	.			trans	-81.9	128.1	176.8	0	0	0	0	0	110.7	L30 Q31 L32	A28-L30 VanDerWaalsContact C-N 3.32Å; A28-L30 PolarHBondContact O-N 3.38Å; A28-Q31 HydrophobicContact CB-CB 4.01Å; A28-Q31 WeakPolarHBondContact O-CB 3.32Å; A28-Q31 PolarHBondContact O-N 3.42Å; A28-L32 PolarHBondContact O-N 3Å
29	P	92.2	Very high	92.7	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-52.9	-42.9	179.6	-31.8	38	0	0	0	114.6	V21 L25 Q31 L32 S33 L94 V95 L99	V21-P29 HydrophobicContact CB-CG 4.41Å; V21-P29 HydrophobicContact CG1-CG 3.7Å; L25-P29 HydrophobicContact CD1-CG 4.45Å; P29-Q31 VanDerWaalsContact C-N 3.34Å; P29-Q31 PolarHBondContact O-N 2.95Å; P29-L32 WeakPolarHBondContact O-CB 3.42Å; P29-L32 PolarHBondContact O-N 3.41Å; P29-S33 PolarHBondContact O-N 2.99Å; P29-L94 HydrophobicContact CB-CD2 4.36Å; P29-L94 WeakPolarHBondContact O-CD2 3.31Å; P29-V95 HydrophobicContact CB-CG1 4.37Å; P29-L99 HydrophobicContact CB-CB 4.11Å; P29-L99 HydrophobicContact CB-CD1 3.83Å; P29-L99 HydrophobicContact CG-CB 3.99Å; P29-L99 HydrophobicContact CG-CD1 4.12Å
30	L	92.6	Very high	93.2	Very high	42 Å²	42	61.7 Å²	61.7	22%	0.22	33%	0.334	C	S	.	.	H	α-helix	trans	-69	-32.8	178.9	-68.5	173.7	0	0	0	112.4	I14 Q18 A28 L32 S33 D34 D91 V95	I14-L30 HydrophobicContact CD1-CD1 4.21Å; Q18-L30 VanDerWaalsContact NE2-CD1 3.34Å; A28-L30 VanDerWaalsContact C-N 3.32Å; A28-L30 PolarHBondContact O-N 3.38Å; L30-L32 VanDerWaalsContact C-N 3.28Å; L30-L32 PolarHBondContact O-N 3.42Å; L30-S33 WeakPolarHBondContact O-CA 3.35Å; L30-S33 WeakPolarHBondContact O-CB 3.37Å; L30-S33 PolarHBondContact O-N 3.41Å; L30-D34 PolarHBondContact O-N 2.9Å; L30-D91 HydrophobicContact CD2-CB 3.86Å; L30-V95 HydrophobicContact CD2-CG1 3.72Å; L30-V95 HydrophobicContact CG-CG1 4.09Å
31	Q	92.8	Very high	93.6	Very high	98 Å²	98	60.4 Å²	60.4	46%	0.458	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-39.1	173.4	-174.6	63.8	48.4	0	0	111.5	A28 P29 S33 D34 D35	A28-Q31 HydrophobicContact CB-CB 4.01Å; A28-Q31 WeakPolarHBondContact O-CB 3.32Å; A28-Q31 PolarHBondContact O-N 3.42Å; P29-Q31 VanDerWaalsContact C-N 3.34Å; P29-Q31 PolarHBondContact O-N 2.95Å; Q31-S33 VanDerWaalsContact C-N 3.26Å; Q31-S33 PolarHBondContact O-N 3.45Å; Q31-D34 PolarHBondContact O-N 2.76Å; Q31-D35 PolarHBondContact NE2-OD1 3.16Å; Q31-D35 WeakPolarHBondContact O-CB 3.47Å; Q31-D35 PolarHBondContact O-N 3.31Å
32	L	94.1	Very high	93.9	Very high	60 Å²	60	63.7 Å²	63.7	31%	0.314	35%	0.351	S	S	.	.	H	α-helix	trans	-60.4	-39.9	174	172	65.9	0	0	0	111.1	F27 A28 P29 L30 L36 L99	F27-L32 HydrophobicContact CD2-CB 4.18Å; F27-L32 HydrophobicContact CE2-CB 3.98Å; F27-L32 HydrophobicContact CE2-CD2 3.87Å; F27-L32 HydrophobicContact CE2-CG 4.49Å; F27-L32 HydrophobicContact CZ-CD2 4.31Å; A28-L32 PolarHBondContact O-N 3Å; P29-L32 WeakPolarHBondContact O-CB 3.42Å; P29-L32 PolarHBondContact O-N 3.41Å; L30-L32 VanDerWaalsContact C-N 3.28Å; L30-L32 PolarHBondContact O-N 3.42Å; L32-L36 HydrophobicContact CD1-CD1 4.28Å; L32-L36 HydrophobicContact CD1-CG 4.36Å; L32-L36 HydrophobicContact CG-CD1 4.21Å; L32-L36 WeakPolarHBondContact O-CB 3.45Å; L32-L36 VanDerWaalsContact O-CG 3.24Å; L32-L36 WeakPolarHBondContact O-CG 3.47Å; L32-L36 PolarHBondContact O-N 3.39Å; L32-L99 HydrophobicContact CD2-CD1 4.3Å
33	S	94.6	Very high	94.2	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.007	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-46.1	177.3	-166.4	0	0	0	0	112.2	P29 L30 Q31 D35 L36 Y37 F87 F90 D91	P29-S33 PolarHBondContact O-N 2.99Å; L30-S33 WeakPolarHBondContact O-CA 3.35Å; L30-S33 WeakPolarHBondContact O-CB 3.37Å; L30-S33 PolarHBondContact O-N 3.41Å; Q31-S33 VanDerWaalsContact C-N 3.26Å; Q31-S33 PolarHBondContact O-N 3.45Å; S33-D35 VanDerWaalsContact C-N 3.31Å; S33-D35 PolarHBondContact O-N 2.88Å; S33-L36 WeakPolarHBondContact O-CB 3.49Å; S33-L36 PolarHBondContact O-N 2.95Å; S33-L36 VanDerWaalsContact O-N 3.15Å; S33-Y37 WeakPolarHBondContact O-CB 3.37Å; S33-Y37 PolarHBondContact O-N 3.21Å; S33-F87 WeakPolarHBondContact O-CE1 3.44Å; S33-F90 VanDerWaalsContact OG-CD1 3.27Å; S33-F90 WeakPolarHBondContact OG-CD1 3.02Å; S33-D91 WeakPolarHBondContact CB-OD1 3.33Å; S33-D91 PolarHBondContact OG-OD1 3.05Å
34	D	95	Very high	94.4	Very high	76 Å²	76	62.5 Å²	62.5	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-57.8	-44.4	175.6	-70.7	-27.3	0	0	0	111.5	L30 Q31 L36 Y37 N38	L30-D34 PolarHBondContact O-N 2.9Å; Q31-D34 PolarHBondContact O-N 2.76Å; D34-L36 VanDerWaalsContact C-N 3.34Å; D34-L36 PolarHBondContact O-N 3.45Å; D34-Y37 WeakPolarHBondContact O-CB 3.03Å; D34-Y37 PolarHBondContact O-N 3.24Å; D34-N38 WeakPolarHBondContact O-CB 3.48Å; D34-N38 PolarHBondContact O-N 3.07Å; D34-N38 PolarHBondContact O-ND2 2.94Å
35	D	96.6	Very high	94.7	Very high	80 Å²	80	58.4 Å²	58.4	43%	0.428	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-42.3	177.7	-68.7	-15.5	0	0	0	111.1	Q31 S33 N38 V39	Q31-D35 PolarHBondContact NE2-OD1 3.16Å; Q31-D35 WeakPolarHBondContact O-CB 3.47Å; Q31-D35 PolarHBondContact O-N 3.31Å; S33-D35 VanDerWaalsContact C-N 3.31Å; S33-D35 PolarHBondContact O-N 2.88Å; D35-N38 PolarHBondContact O-N 3.49Å; D35-V39 WeakPolarHBondContact O-CG2 3.16Å; D35-V39 PolarHBondContact O-N 3.27Å; D35-V39 VanDerWaalsContact O-N 3.1Å
36	L	96.6	Very high	94.9	Very high	69 Å²	69	60.3 Å²	60.3	36%	0.361	33%	0.333	S	S	.	.	H	α-helix	trans	-65.2	-41.3	175.3	-73.3	172.4	0	0	0	112.1	L32 S33 D34 V39 I40 F87 F90	L32-L36 HydrophobicContact CD1-CD1 4.28Å; L32-L36 HydrophobicContact CD1-CG 4.36Å; L32-L36 HydrophobicContact CG-CD1 4.21Å; L32-L36 WeakPolarHBondContact O-CB 3.45Å; L32-L36 VanDerWaalsContact O-CG 3.24Å; L32-L36 WeakPolarHBondContact O-CG 3.47Å; L32-L36 PolarHBondContact O-N 3.39Å; S33-L36 WeakPolarHBondContact O-CB 3.49Å; S33-L36 PolarHBondContact O-N 2.95Å; S33-L36 VanDerWaalsContact O-N 3.15Å; D34-L36 VanDerWaalsContact C-N 3.34Å; D34-L36 PolarHBondContact O-N 3.45Å; L36-V39 PolarHBondContact O-N 3.35Å; L36-I40 WeakPolarHBondContact O-CB 3.24Å; L36-I40 WeakPolarHBondContact O-CG1 3.36Å; L36-I40 PolarHBondContact O-N 2.95Å; L36-F87 HydrophobicContact CB-CE1 4.03Å; L36-F87 HydrophobicContact CB-CZ 4.27Å; L36-F90 HydrophobicContact CD1-CE1 4.02Å; L36-F90 HydrophobicContact CD1-CZ 4.1Å
37	Y	96.9	Very high	95.1	Very high	53 Å²	53	62.3 Å²	62.3	21%	0.208	33%	0.325	C	S	.	.	H	α-helix	trans	-58.9	-50.2	175.9	178.1	-96.9	0	0	0	110.5	S33 D34 V39 I40 I41 L83 V84 F87	S33-Y37 WeakPolarHBondContact O-CB 3.37Å; S33-Y37 PolarHBondContact O-N 3.21Å; D34-Y37 WeakPolarHBondContact O-CB 3.03Å; D34-Y37 PolarHBondContact O-N 3.24Å; Y37-V39 VanDerWaalsContact C-N 3.28Å; Y37-V39 PolarHBondContact O-N 3.19Å; Y37-I40 PolarHBondContact O-N 2.87Å; Y37-I40 VanDerWaalsContact O-N 3.12Å; Y37-I41 HydrophobicContact CE1-CB 4.29Å; Y37-I41 HydrophobicContact CE1-CG1 4.38Å; Y37-I41 HydrophobicContact CE1-CG2 4.31Å; Y37-I41 HydrophobicContact CE2-CD1 4.38Å; Y37-I41 WeakPolarHBondContact O-CB 3.38Å; Y37-I41 WeakPolarHBondContact O-CG2 3.28Å; Y37-I41 PolarHBondContact O-N 3.03Å; Y37-L83 HydrophobicContact CE2-CB 4.2Å; Y37-V84 HydrophobicContact CE2-CG2 4.32Å; Y37-V84 WeakPolarHBondContact OH-CG2 3.39Å; Y37-F87 VanDerWaalsContact CA-CE1 3.49Å; Y37-F87 VanDerWaalsContact CA-CZ 3.43Å; Y37-F87 HydrophobicContact CD2-CB 4.02Å; Y37-F87 HydrophobicContact CD2-CD1 4.04Å; Y37-F87 AromaticContact CD2-CD2 3.58Å; Y37-F87 HydrophobicContact CD2-CD2 3.58Å; Y37-F87 HydrophobicContact CD2-CE1 4.41Å; Y37-F87 AromaticContact CD2-CE2 3.96Å; Y37-F87 HydrophobicContact CD2-CE2 3.96Å; Y37-F87 AromaticContact CD2-CG 3.59Å; Y37-F87 HydrophobicContact CD2-CG 3.59Å; Y37-F87 HydrophobicContact CD2-CZ 4.35Å; Y37-F87 HydrophobicContact CE2-CD2 4.35Å; Y37-F87 HydrophobicContact CG-CD1 4.35Å; Y37-F87 HydrophobicContact CG-CG 4.34Å; Y37-F87 VanDerWaalsContact N-CE1 3.32Å
38	N	96.5	Very high	95.2	Very high	85 Å²	85	58.4 Å²	58.4	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-38.1	-179.8	-72.5	-34.7	0	0	0	112.5	D34 D35 I41 T42	D34-N38 WeakPolarHBondContact O-CB 3.48Å; D34-N38 PolarHBondContact O-N 3.07Å; D34-N38 PolarHBondContact O-ND2 2.94Å; D35-N38 PolarHBondContact O-N 3.49Å; N38-I41 WeakPolarHBondContact O-CG2 3.46Å; N38-T42 WeakPolarHBondContact O-CB 3.42Å; N38-T42 PolarHBondContact O-N 3.22Å; N38-T42 PolarHBondContact O-OG1 3.38Å
39	V	97.5	Very high	95.3	Very high	79 Å²	79	59.7 Å²	59.7	48%	0.479	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-49.8	174.1	171.7	0	0	0	0	110.4	D35 L36 Y37 T42 H43	D35-V39 WeakPolarHBondContact O-CG2 3.16Å; D35-V39 PolarHBondContact O-N 3.27Å; D35-V39 VanDerWaalsContact O-N 3.1Å; L36-V39 PolarHBondContact O-N 3.35Å; Y37-V39 VanDerWaalsContact C-N 3.28Å; Y37-V39 PolarHBondContact O-N 3.19Å; V39-T42 PolarHBondContact O-N 3.22Å; V39-H43 PolarHBondContact O-N 2.87Å; V39-H43 VanDerWaalsContact O-N 3.08Å; V39-H43 PolarHBondContact O-ND1 3.27Å
40	I	96.8	Very high	95.4	Very high	73 Å²	73	64.2 Å²	64.2	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-43.4	-175.5	-74.9	164.2	0	0	0	111.7	L36 Y37 T42 H43 L44 L83 F87	L36-I40 WeakPolarHBondContact O-CB 3.24Å; L36-I40 WeakPolarHBondContact O-CG1 3.36Å; L36-I40 PolarHBondContact O-N 2.95Å; Y37-I40 PolarHBondContact O-N 2.87Å; Y37-I40 VanDerWaalsContact O-N 3.12Å; I40-T42 VanDerWaalsContact C-N 3.3Å; I40-T42 PolarHBondContact O-N 3.08Å; I40-H43 PolarHBondContact O-N 3.42Å; I40-L44 WeakPolarHBondContact O-CB 3.42Å; I40-L44 PolarHBondContact O-N 2.93Å; I40-L83 HydrophobicContact CG2-CD1 3.93Å; I40-L83 HydrophobicContact CG2-CD2 3.92Å; I40-F87 HydrophobicContact CD1-CE2 4.02Å; I40-F87 HydrophobicContact CD1-CZ 3.67Å
41	I	95.1	Very high	95.5	Very high	29 Å²	29	66.7 Å²	66.7	15%	0.149	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-38.8	179.7	-155.1	69.4	0	0	0	111.2	Y37 N38 L44 G45 E80 L83	Y37-I41 HydrophobicContact CE1-CB 4.29Å; Y37-I41 HydrophobicContact CE1-CG1 4.38Å; Y37-I41 HydrophobicContact CE1-CG2 4.31Å; Y37-I41 HydrophobicContact CE2-CD1 4.38Å; Y37-I41 WeakPolarHBondContact O-CB 3.38Å; Y37-I41 WeakPolarHBondContact O-CG2 3.28Å; Y37-I41 PolarHBondContact O-N 3.03Å; N38-I41 WeakPolarHBondContact O-CG2 3.46Å; I41-L44 HydrophobicContact CD1-CD2 4.47Å; I41-L44 PolarHBondContact O-N 2.99Å; I41-G45 PolarHBondContact O-N 2.92Å; I41-E80 HydrophobicContact CD1-CB 4.2Å; I41-E80 HydrophobicContact CD1-CG 3.64Å; I41-E80 HydrophobicContact CG1-CG 4.37Å; I41-L83 HydrophobicContact CD1-CB 4.45Å; I41-L83 HydrophobicContact CD1-CD1 3.54Å
42	T	96.3	Very high	95.4	Very high	77 Å²	77	62.9 Å²	62.9	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-47.4	175.6	-60.2	0	0	0	0	111.2	N38 V39 I40 L44 G45 Q46	N38-T42 WeakPolarHBondContact O-CB 3.42Å; N38-T42 PolarHBondContact O-N 3.22Å; N38-T42 PolarHBondContact O-OG1 3.38Å; V39-T42 PolarHBondContact O-N 3.22Å; I40-T42 VanDerWaalsContact C-N 3.3Å; I40-T42 PolarHBondContact O-N 3.08Å; T42-L44 VanDerWaalsContact C-N 3.34Å; T42-L44 PolarHBondContact O-N 3.5Å; T42-G45 PolarHBondContact O-N 3.49Å; T42-Q46 WeakPolarHBondContact O-CG 3.37Å; T42-Q46 PolarHBondContact O-N 2.78Å; T42-Q46 VanDerWaalsContact O-N 3.08Å
43	H	96.2	Very high	95.3	Very high	103 Å²	103	66.3 Å²	66.3	48%	0.477	34%	0.339	S	S	.	.	H	α-helix	trans	-65.7	-37.8	178.2	-75	80.1	0	0	0	111.9	V39 I40 Q46 M47	V39-H43 PolarHBondContact O-N 2.87Å; V39-H43 VanDerWaalsContact O-N 3.08Å; V39-H43 PolarHBondContact O-ND1 3.27Å; I40-H43 PolarHBondContact O-N 3.42Å; H43-Q46 PolarHBondContact O-N 2.96Å; H43-M47 WeakPolarHBondContact O-CG 3.46Å; H43-M47 PolarHBondContact O-N 3.43Å
44	L	95.3	Very high	95.2	Very high	25 Å²	25	72.3 Å²	72.3	13%	0.131	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-47.6	174.5	178.5	66.4	0	0	0	111	I40 I41 T42 Q46 M47 I48 L79 L83	I40-L44 WeakPolarHBondContact O-CB 3.42Å; I40-L44 PolarHBondContact O-N 2.93Å; I41-L44 HydrophobicContact CD1-CD2 4.47Å; I41-L44 PolarHBondContact O-N 2.99Å; T42-L44 VanDerWaalsContact C-N 3.34Å; T42-L44 PolarHBondContact O-N 3.5Å; L44-Q46 VanDerWaalsContact C-N 3.33Å; L44-Q46 PolarHBondContact O-N 2.88Å; L44-M47 HydrophobicContact CD1-CE 4.25Å; L44-M47 PolarHBondContact O-N 3.18Å; L44-I48 HydrophobicContact CD1-CD1 4.02Å; L44-I48 HydrophobicContact CD1-CG1 4.3Å; L44-I48 HydrophobicContact CD2-CD1 4.45Å; L44-I48 HydrophobicContact CG-CD1 3.86Å; L44-I48 WeakPolarHBondContact O-CG1 3.31Å; L44-I48 PolarHBondContact O-N 3.38Å; L44-L79 HydrophobicContact CD1-CB 4.4Å; L44-L79 HydrophobicContact CD1-CD1 4.07Å; L44-L79 HydrophobicContact CD2-CB 3.63Å; L44-L83 HydrophobicContact CB-CD1 4.39Å; L44-L83 HydrophobicContact CD2-CD1 3.39Å; L44-L83 HydrophobicContact CD2-CG 4.33Å; L44-L83 HydrophobicContact CG-CD1 4.47Å
45	G	94.4	Very high	95	Very high	13 Å²	13	70 Å²	70	13%	0.134	35%	0.352	C	S	.	.	H	α-helix	trans	-55.4	-48	176.6	0	0	0	0	0	112.1	I41 T42 I48 D49	I41-G45 PolarHBondContact O-N 2.92Å; T42-G45 PolarHBondContact O-N 3.49Å; G45-I48 PolarHBondContact O-N 3.22Å; G45-D49 VanDerWaalsContact O-CG 3.32Å; G45-D49 PolarHBondContact O-N 3.46Å
46	Q	96.2	Very high	94.6	Very high	102 Å²	102	68.9 Å²	68.9	48%	0.477	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-45.1	176.3	-70.1	172.2	-6.2	0	0	112.4	T42 H43 L44 I48 D49 E50	T42-Q46 WeakPolarHBondContact O-CG 3.37Å; T42-Q46 PolarHBondContact O-N 2.78Å; T42-Q46 VanDerWaalsContact O-N 3.08Å; H43-Q46 PolarHBondContact O-N 2.96Å; L44-Q46 VanDerWaalsContact C-N 3.33Å; L44-Q46 PolarHBondContact O-N 2.88Å; Q46-I48 VanDerWaalsContact C-N 3.31Å; Q46-I48 PolarHBondContact O-N 2.89Å; Q46-D49 PolarHBondContact O-N 2.86Å; Q46-E50 WeakPolarHBondContact O-CG 3.34Å; Q46-E50 PolarHBondContact O-N 2.9Å
47	M	96.1	Very high	94.3	Very high	113 Å²	113	72.3 Å²	72.3	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-62.3	-37.7	178	-75.8	-171.7	-66.6	0	0	112.6	H43 L44 F51	H43-M47 WeakPolarHBondContact O-CG 3.46Å; H43-M47 PolarHBondContact O-N 3.43Å; L44-M47 HydrophobicContact CD1-CE 4.25Å; L44-M47 PolarHBondContact O-N 3.18Å; M47-F51 VanDerWaalsContact O-CB 3.25Å; M47-F51 WeakPolarHBondContact O-CB 3.49Å; M47-F51 PolarHBondContact O-N 3.45Å
48	I	95.5	Very high	93.9	Very high	10 Å²	10	77.4 Å²	77.4	5%	0.051	39%	0.393	C	S	.	.	H	α-helix	trans	-70.5	-38.6	177.7	-63.7	165.9	0	0	0	110.6	L44 G45 Q46 F51 S52 T72 L75 K76 L79	L44-I48 HydrophobicContact CD1-CD1 4.02Å; L44-I48 HydrophobicContact CD1-CG1 4.3Å; L44-I48 HydrophobicContact CD2-CD1 4.45Å; L44-I48 HydrophobicContact CG-CD1 3.86Å; L44-I48 WeakPolarHBondContact O-CG1 3.31Å; L44-I48 PolarHBondContact O-N 3.38Å; G45-I48 PolarHBondContact O-N 3.22Å; Q46-I48 VanDerWaalsContact C-N 3.31Å; Q46-I48 PolarHBondContact O-N 2.89Å; I48-F51 WeakPolarHBondContact O-CB 3.42Å; I48-F51 PolarHBondContact O-N 3.33Å; I48-S52 PolarHBondContact O-N 3.02Å; I48-T72 HydrophobicContact CG2-CG2 4Å; I48-L75 HydrophobicContact CG2-CB 4.16Å; I48-K76 HydrophobicContact CB-CG 4.31Å; I48-K76 HydrophobicContact CD1-CB 4.37Å; I48-K76 HydrophobicContact CD1-CG 3.69Å; I48-K76 HydrophobicContact CG2-CG 3.98Å; I48-L79 HydrophobicContact CD1-CD1 3.95Å; I48-L79 HydrophobicContact CG1-CD1 4.4Å
49	D	93.8	Very high	93.5	Very high	66 Å²	66	77 Å²	77	35%	0.353	39%	0.387	S	S	.	.	H	α-helix	trans	-65.4	-46.6	176.1	-68.8	-26.8	0	0	0	110.9	G45 Q46 F51 S52 E53 K76	G45-D49 VanDerWaalsContact O-CG 3.32Å; G45-D49 PolarHBondContact O-N 3.46Å; Q46-D49 PolarHBondContact O-N 2.86Å; D49-F51 VanDerWaalsContact C-N 3.3Å; D49-F51 PolarHBondContact O-N 3.3Å; D49-S52 WeakPolarHBondContact O-CA 3.33Å; D49-S52 VanDerWaalsContact O-CB 3.23Å; D49-S52 WeakPolarHBondContact O-CB 3.45Å; D49-S52 PolarHBondContact O-N 2.93Å; D49-S52 VanDerWaalsContact O-N 3.09Å; D49-E53 PolarHBondContact O-N 3.32Å; D49-K76 WeakPolarHBondContact OD1-CE 3.41Å; D49-K76 IonicContact OD1-NZ 3.14Å; D49-K76 PolarHBondContact OD1-NZ 2.98Å; D49-K76 IonicContact OD2-NZ 3.06Å; D49-K76 PolarHBondContact OD2-NZ 2.69Å
50	E	95.1	Very high	92.5	Very high	94 Å²	94	75.2 Å²	75.2	44%	0.439	39%	0.385	S	S	.	.	H	α-helix	trans	-59.8	-38.2	172.6	-76	-172.3	-157.4	0	0	113	Q46 S52 E53 K54	Q46-E50 WeakPolarHBondContact O-CG 3.34Å; Q46-E50 PolarHBondContact O-N 2.9Å; E50-S52 VanDerWaalsContact C-N 3.3Å; E50-E53 PolarHBondContact O-N 3.43Å; E50-K54 WeakPolarHBondContact O-CB 3.38Å; E50-K54 WeakPolarHBondContact O-CG 3.46Å; E50-K54 PolarHBondContact O-N 3.34Å; E50-K54 IonicContact OE2-NZ 2.7Å; E50-K54 PolarHBondContact OE2-NZ 3.36Å; E50-K54 VanDerWaalsContact OE2-NZ 3.14Å
51	F	93.3	Very high	91.5	Very high	95 Å²	95	80.5 Å²	80.5	42%	0.417	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-40.1	175.8	173.6	-107	0	0	0	111.1	M47 I48 D49 K54 L55 L75	M47-F51 VanDerWaalsContact O-CB 3.25Å; M47-F51 WeakPolarHBondContact O-CB 3.49Å; M47-F51 PolarHBondContact O-N 3.45Å; I48-F51 WeakPolarHBondContact O-CB 3.42Å; I48-F51 PolarHBondContact O-N 3.33Å; D49-F51 VanDerWaalsContact C-N 3.3Å; D49-F51 PolarHBondContact O-N 3.3Å; F51-K54 PolarHBondContact O-N 3.24Å; F51-L55 HydrophobicContact CD1-CD1 3.99Å; F51-L55 HydrophobicContact CE1-CD1 3.37Å; F51-L55 HydrophobicContact CE1-CG 4.22Å; F51-L55 HydrophobicContact CE2-CD1 4.16Å; F51-L55 HydrophobicContact CE2-CG 4.19Å; F51-L55 HydrophobicContact CZ-CD1 3.48Å; F51-L55 VanDerWaalsContact CZ-CD1 3.48Å; F51-L55 HydrophobicContact CZ-CD2 4.41Å; F51-L55 HydrophobicContact CZ-CG 3.99Å; F51-L55 WeakPolarHBondContact O-CB 3.36Å; F51-L55 WeakPolarHBondContact O-CG 3.49Å; F51-L55 PolarHBondContact O-N 3.48Å; F51-L75 HydrophobicContact CD1-CD1 4.08Å; F51-L75 HydrophobicContact CE1-CD1 3.83Å
52	S	91.1	Very high	90.9	Very high	18 Å²	18	87 Å²	87	13%	0.126	44%	0.44	C	S	.	.	H	α-helix	trans	-61.9	-47.9	175.3	-160.1	0	0	0	0	111.7	I48 D49 E50 K54 L55 S56 L68 T72	I48-S52 PolarHBondContact O-N 3.02Å; D49-S52 WeakPolarHBondContact O-CA 3.33Å; D49-S52 VanDerWaalsContact O-CB 3.23Å; D49-S52 WeakPolarHBondContact O-CB 3.45Å; D49-S52 PolarHBondContact O-N 2.93Å; D49-S52 VanDerWaalsContact O-N 3.09Å; E50-S52 VanDerWaalsContact C-N 3.3Å; S52-K54 PolarHBondContact O-N 2.88Å; S52-L55 PolarHBondContact O-N 3.37Å; S52-S56 PolarHBondContact O-N 2.97Å; S52-L68 VanDerWaalsContact OG-CG 3.26Å; S52-L68 WeakPolarHBondContact OG-CG 3.45Å; S52-T72 VanDerWaalsContact CB-OG1 3.26Å; S52-T72 WeakPolarHBondContact CB-OG1 3.37Å; S52-T72 PolarHBondContact OG-OG1 2.89Å
53	E	91.9	Very high	90	Very high	132 Å²	132	87.3 Å²	87.3	62%	0.617	44%	0.435	S	S	*	.	H	α-helix	trans	-57.9	-49.9	176.3	-69.7	-178.9	169.2	0	0	111.6	D49 E50 L55 S56 D57	D49-E53 PolarHBondContact O-N 3.32Å; E50-E53 PolarHBondContact O-N 3.43Å; E53-L55 VanDerWaalsContact C-N 3.29Å; E53-L55 PolarHBondContact O-N 3.42Å; E53-S56 WeakPolarHBondContact O-CB 3.42Å; E53-S56 PolarHBondContact O-N 3.21Å; E53-S56 VanDerWaalsContact O-N 3.11Å; E53-D57 PolarHBondContact O-N 2.87Å
54	K	92.7	Very high	89.4	Confident	127 Å²	127	86 Å²	86	55%	0.552	44%	0.435	S	S	*	.	H	α-helix	trans	-61.6	-34.4	178.3	-73.3	167.3	-176.1	150.6	0	112.9	E50 F51 S52 K58	E50-K54 WeakPolarHBondContact O-CB 3.38Å; E50-K54 WeakPolarHBondContact O-CG 3.46Å; E50-K54 PolarHBondContact O-N 3.34Å; E50-K54 IonicContact OE2-NZ 2.7Å; E50-K54 PolarHBondContact OE2-NZ 3.36Å; E50-K54 VanDerWaalsContact OE2-NZ 3.14Å; F51-K54 PolarHBondContact O-N 3.24Å; S52-K54 PolarHBondContact O-N 2.88Å; K54-K58 WeakPolarHBondContact O-CB 3.43Å; K54-K58 PolarHBondContact O-N 2.97Å
55	L	90.8	Very high	89	Confident	28 Å²	28	88.2 Å²	88.2	15%	0.147	46%	0.456	C	S	.	.	H	α-helix	trans	-69.1	-42.6	174.1	-82.5	179.6	0	0	0	111.8	F51 S52 E53 K58 F59 L68 L71	F51-L55 HydrophobicContact CD1-CD1 3.99Å; F51-L55 HydrophobicContact CE1-CD1 3.37Å; F51-L55 HydrophobicContact CE1-CG 4.22Å; F51-L55 HydrophobicContact CE2-CD1 4.16Å; F51-L55 HydrophobicContact CE2-CG 4.19Å; F51-L55 HydrophobicContact CZ-CD1 3.48Å; F51-L55 VanDerWaalsContact CZ-CD1 3.48Å; F51-L55 HydrophobicContact CZ-CD2 4.41Å; F51-L55 HydrophobicContact CZ-CG 3.99Å; F51-L55 WeakPolarHBondContact O-CB 3.36Å; F51-L55 WeakPolarHBondContact O-CG 3.49Å; F51-L55 PolarHBondContact O-N 3.48Å; S52-L55 PolarHBondContact O-N 3.37Å; E53-L55 VanDerWaalsContact C-N 3.29Å; E53-L55 PolarHBondContact O-N 3.42Å; L55-K58 PolarHBondContact O-N 2.85Å; L55-F59 HydrophobicContact CD2-CD2 3.89Å; L55-F59 HydrophobicContact CD2-CE2 4.15Å; L55-F59 WeakPolarHBondContact O-CA 3.47Å; L55-F59 WeakPolarHBondContact O-CB 3.47Å; L55-F59 PolarHBondContact O-N 3.48Å; L55-L68 HydrophobicContact CB-CD1 3.98Å; L55-L68 HydrophobicContact CD1-CD1 4.09Å; L55-L71 HydrophobicContact CD1-CD2 4.17Å
56	S	89.2	Confident	88.8	Confident	56 Å²	56	94.7 Å²	94.7	39%	0.392	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-47	176.1	-168.7	0	0	0	0	111.2	S52 E53 K58 G60	S52-S56 PolarHBondContact O-N 2.97Å; E53-S56 WeakPolarHBondContact O-CB 3.42Å; E53-S56 PolarHBondContact O-N 3.21Å; E53-S56 VanDerWaalsContact O-N 3.11Å; S56-K58 VanDerWaalsContact C-N 3.33Å; S56-K58 PolarHBondContact O-N 3.43Å; S56-G60 WeakPolarHBondContact O-CA 3.41Å; S56-G60 PolarHBondContact O-N 3.32Å
57	D	89.4	Confident	88.4	Confident	141 Å²	141	96.3 Å²	96.3	75%	0.754	49%	0.488	S	S	*	.	H	α-helix	trans	-61.5	-40.8	-179.9	-72.3	-13.1	0	0	0	112.4	E53	E53-D57 PolarHBondContact O-N 2.87Å
58	K	90	Very high	88.2	Confident	160 Å²	160	91.8 Å²	91.8	70%	0.696	47%	0.466	S	S	*	.	H	α-helix	trans	-85.9	-29.3	-175	-167.5	170.5	-178.1	175.6	0	113.6	K54 L55 S56	K54-K58 WeakPolarHBondContact O-CB 3.43Å; K54-K58 PolarHBondContact O-N 2.97Å; L55-K58 PolarHBondContact O-N 2.85Å; S56-K58 VanDerWaalsContact C-N 3.33Å; S56-K58 PolarHBondContact O-N 3.43Å
59	F	88	Confident	88	Confident	76 Å²	76	97.9 Å²	97.9	33%	0.333	49%	0.494	S	S	.	.	H	α-helix	trans	-134	20.3	-170.1	-58	-71.6	0	0	0	113.8	L55 L61 K62 F63	L55-F59 HydrophobicContact CD2-CD2 3.89Å; L55-F59 HydrophobicContact CD2-CE2 4.15Å; L55-F59 WeakPolarHBondContact O-CA 3.47Å; L55-F59 WeakPolarHBondContact O-CB 3.47Å; L55-F59 PolarHBondContact O-N 3.48Å; F59-L61 PolarHBondContact O-N 2.89Å; F59-K62 HydrophobicContact CD1-CD 4.38Å; F59-K62 WeakPolarHBondContact O-CA 3.35Å; F59-K62 PolarHBondContact O-N 3.32Å; F59-F63 HydrophobicContact CB-CD2 3.81Å; F59-F63 HydrophobicContact CB-CE2 4.16Å; F59-F63 PolarHBondContact O-N 3.36Å; F59-F63 VanDerWaalsContact O-N 3.16Å
60	G	75.6	Confident	87.9	Confident	42 Å²	42	98.5 Å²	98.5	43%	0.433	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-21.2	-175.8	0	0	0	0	0	115.3	S56	S56-G60 WeakPolarHBondContact O-CA 3.41Å; S56-G60 PolarHBondContact O-N 3.32Å
61	L	76.3	Confident	87.8	Confident	184 Å²	184	96.9 Å²	96.9	96%	0.963	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-18.9	172.4	-64.4	175.3	0	0	0	113.8	F59	F59-L61 PolarHBondContact O-N 2.89Å
62	K	81.1	Confident	87.8	Confident	164 Å²	164	93.1 Å²	93.1	71%	0.713	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-27.8	-177.4	-65.7	-172.3	178.4	-177.2	0	113.2	F59	F59-K62 HydrophobicContact CD1-CD 4.38Å; F59-K62 WeakPolarHBondContact O-CA 3.35Å; F59-K62 PolarHBondContact O-N 3.32Å
63	F	77.5	Confident	88	Confident	84 Å²	84	99.7 Å²	99.7	37%	0.368	51%	0.506	S	S	.	.	S	Bend	trans	-110	127.6	179.3	-72.8	-82.9	0	0	0	110.6	F59	F59-F63 HydrophobicContact CB-CD2 3.81Å; F59-F63 HydrophobicContact CB-CE2 4.16Å; F59-F63 PolarHBondContact O-N 3.36Å; F59-F63 VanDerWaalsContact O-N 3.16Å
64	T	85.1	Confident	88.1	Confident	77 Å²	77	99.8 Å²	99.8	47%	0.472	50%	0.502	S	S	.	.			trans	-71.9	151	165.3	56.9	0	0	0	0	109.4	E66 K67 L68	T64-E66 PolarHBondContact O-N 3.34Å; T64-K67 PolarHBondContact O-N 2.92Å; T64-K67 VanDerWaalsContact O-N 3.1Å; T64-K67 WeakPolarHBondContact OG1-CG 3.5Å; T64-K67 PolarHBondContact OG1-N 3.47Å; T64-L68 PolarHBondContact O-N 2.88Å; T64-L68 VanDerWaalsContact O-N 3.1Å
65	A	86.4	Confident	88.2	Confident	71 Å²	71	95.8 Å²	95.8	59%	0.587	49%	0.486	S	S	*	.	H	α-helix	trans	-54.8	-39.7	177.9	0	0	0	0	0	112.3	K67 L68 Q69	A65-K67 PolarHBondContact O-N 3.48Å; A65-L68 PolarHBondContact O-N 3.48Å; A65-Q69 WeakPolarHBondContact O-CG 3.4Å; A65-Q69 PolarHBondContact O-N 3.34Å
66	E	89.1	Confident	88.4	Confident	149 Å²	149	96.9 Å²	96.9	70%	0.696	49%	0.49	S	S	*	.	H	α-helix	trans	-62	-41.8	176.9	-67.1	177.5	173.9	0	0	113.3	T64 L68 Q69 S70	T64-E66 PolarHBondContact O-N 3.34Å; E66-L68 VanDerWaalsContact C-N 3.32Å; E66-Q69 PolarHBondContact O-N 3.25Å; E66-S70 WeakPolarHBondContact O-CB 3.48Å; E66-S70 PolarHBondContact O-N 3.28Å; E66-S70 PolarHBondContact O-OG 3.49Å
67	K	89.7	Confident	88.7	Confident	136 Å²	136	98.5 Å²	98.5	59%	0.591	49%	0.491	S	S	*	.	H	α-helix	trans	-66.2	-38.8	177.2	-78.6	-178.4	178.4	-177.9	0	111.1	T64 A65 S70 L71	T64-K67 PolarHBondContact O-N 2.92Å; T64-K67 VanDerWaalsContact O-N 3.1Å; T64-K67 WeakPolarHBondContact OG1-CG 3.5Å; T64-K67 PolarHBondContact OG1-N 3.47Å; A65-K67 PolarHBondContact O-N 3.48Å; K67-S70 PolarHBondContact O-N 3.12Å; K67-L71 WeakPolarHBondContact O-CB 3.41Å; K67-L71 PolarHBondContact O-N 2.9Å
68	L	90.3	Very high	88.9	Confident	17 Å²	17	99.3 Å²	99.3	9%	0.089	48%	0.484	C	S	.	.	H	α-helix	trans	-67.5	-44.3	177.7	-174.5	65.1	0	0	0	111.2	S52 L55 T64 A65 E66 S70 L71 T72	S52-L68 VanDerWaalsContact OG-CG 3.26Å; S52-L68 WeakPolarHBondContact OG-CG 3.45Å; L55-L68 HydrophobicContact CB-CD1 3.98Å; L55-L68 HydrophobicContact CD1-CD1 4.09Å; T64-L68 PolarHBondContact O-N 2.88Å; T64-L68 VanDerWaalsContact O-N 3.1Å; A65-L68 PolarHBondContact O-N 3.48Å; E66-L68 VanDerWaalsContact C-N 3.32Å; L68-S70 VanDerWaalsContact C-N 3.35Å; L68-S70 PolarHBondContact O-N 3.24Å; L68-L71 PolarHBondContact O-N 3.23Å; L68-T72 WeakPolarHBondContact O-CB 3.4Å; L68-T72 PolarHBondContact O-N 3.41Å; L68-T72 PolarHBondContact O-OG1 3.11Å
69	Q	91.2	Very high	89.2	Confident	138 Å²	138	95 Å²	95	65%	0.645	47%	0.468	S	S	*	.	H	α-helix	trans	-60.5	-43.3	174.2	-75.5	177.9	-5.2	0	0	112.2	A65 E66 L71 T72 Y73	A65-Q69 WeakPolarHBondContact O-CG 3.4Å; A65-Q69 PolarHBondContact O-N 3.34Å; E66-Q69 PolarHBondContact O-N 3.25Å; Q69-L71 VanDerWaalsContact C-N 3.33Å; Q69-L71 PolarHBondContact O-N 3Å; Q69-T72 PolarHBondContact O-N 2.92Å; Q69-Y73 WeakPolarHBondContact O-CB 3.43Å; Q69-Y73 PolarHBondContact O-N 3.26Å
70	S	92.7	Very high	89.5	Confident	79 Å²	79	95.2 Å²	95.2	55%	0.552	47%	0.47	S	S	*	.	H	α-helix	trans	-63.1	-39.8	176.8	-62.1	0	0	0	0	111.8	E66 K67 L68 Y74	E66-S70 WeakPolarHBondContact O-CB 3.48Å; E66-S70 PolarHBondContact O-N 3.28Å; E66-S70 PolarHBondContact O-OG 3.49Å; K67-S70 PolarHBondContact O-N 3.12Å; L68-S70 VanDerWaalsContact C-N 3.35Å; L68-S70 PolarHBondContact O-N 3.24Å; S70-Y74 WeakPolarHBondContact O-CB 3.48Å; S70-Y74 PolarHBondContact O-N 3.39Å
71	L	92.2	Very high	90.3	Very high	61 Å²	61	97.4 Å²	97.4	32%	0.319	47%	0.472	S	S	.	.	H	α-helix	trans	-66	-45.9	174.7	178.5	63.1	0	0	0	111.7	L55 K67 L68 Q69 Y74 L75	L55-L71 HydrophobicContact CD1-CD2 4.17Å; K67-L71 WeakPolarHBondContact O-CB 3.41Å; K67-L71 PolarHBondContact O-N 2.9Å; L68-L71 PolarHBondContact O-N 3.23Å; Q69-L71 VanDerWaalsContact C-N 3.33Å; Q69-L71 PolarHBondContact O-N 3Å; L71-Y74 PolarHBondContact O-N 3.47Å; L71-L75 HydrophobicContact CD1-CD1 4.24Å; L71-L75 HydrophobicContact CD1-CG 4.25Å; L71-L75 HydrophobicContact CG-CD1 4.13Å; L71-L75 WeakPolarHBondContact O-CB 3.4Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 3.42Å
72	T	93.4	Very high	91.2	Very high	16 Å²	16	95.9 Å²	95.9	10%	0.098	45%	0.453	C	S	.	.	H	α-helix	trans	-58.1	-47.7	176	-71.9	0	0	0	0	111.2	I48 S52 L68 Q69 L75 K76	I48-T72 HydrophobicContact CG2-CG2 4Å; S52-T72 VanDerWaalsContact CB-OG1 3.26Å; S52-T72 WeakPolarHBondContact CB-OG1 3.37Å; S52-T72 PolarHBondContact OG-OG1 2.89Å; L68-T72 WeakPolarHBondContact O-CB 3.4Å; L68-T72 PolarHBondContact O-N 3.41Å; L68-T72 PolarHBondContact O-OG1 3.11Å; Q69-T72 PolarHBondContact O-N 2.92Å; T72-L75 PolarHBondContact O-N 3.21Å; T72-K76 HydrophobicContact CG2-CD 4.4Å; T72-K76 WeakPolarHBondContact O-CG 3.42Å; T72-K76 PolarHBondContact O-N 3.21Å
73	Y	94.7	Very high	91.9	Very high	155 Å²	155	89.2 Å²	89.2	61%	0.608	43%	0.425	S	S	*	.	H	α-helix	trans	-59.4	-49.3	177	179.5	-90.7	0	0	0	111.5	Q69 L75 K76 E77	Q69-Y73 WeakPolarHBondContact O-CB 3.43Å; Q69-Y73 PolarHBondContact O-N 3.26Å; Y73-L75 VanDerWaalsContact C-N 3.32Å; Y73-L75 PolarHBondContact O-N 3.03Å; Y73-K76 PolarHBondContact O-N 3.49Å; Y73-E77 VanDerWaalsContact CE1-OE2 3.3Å; Y73-E77 WeakPolarHBondContact CE1-OE2 3.33Å; Y73-E77 PolarHBondContact O-N 2.98Å
74	Y	95.9	Very high	92.7	Very high	134 Å²	134	88 Å²	88	53%	0.525	43%	0.425	S	S	.	.	H	α-helix	trans	-59.6	-40.7	178.1	175.6	-97.5	0	0	0	112.8	S70 L71 R78	S70-Y74 WeakPolarHBondContact O-CB 3.48Å; S70-Y74 PolarHBondContact O-N 3.39Å; L71-Y74 PolarHBondContact O-N 3.47Å; Y74-R78 WeakPolarHBondContact O-CB 3.48Å; Y74-R78 PolarHBondContact O-N 3.26Å
75	L	94.8	Very high	93.1	Very high	44 Å²	44	88.6 Å²	88.6	23%	0.23	43%	0.425	C	S	.	.	H	α-helix	trans	-67.2	-40.5	177	-73.4	174.1	0	0	0	112	I48 F51 L71 T72 Y73 L79	I48-L75 HydrophobicContact CG2-CB 4.16Å; F51-L75 HydrophobicContact CD1-CD1 4.08Å; F51-L75 HydrophobicContact CE1-CD1 3.83Å; L71-L75 HydrophobicContact CD1-CD1 4.24Å; L71-L75 HydrophobicContact CD1-CG 4.25Å; L71-L75 HydrophobicContact CG-CD1 4.13Å; L71-L75 WeakPolarHBondContact O-CB 3.4Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 3.42Å; T72-L75 PolarHBondContact O-N 3.21Å; Y73-L75 VanDerWaalsContact C-N 3.32Å; Y73-L75 PolarHBondContact O-N 3.03Å; L75-L79 VanDerWaalsContact O-CB 3.26Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 WeakPolarHBondContact O-CD1 3.34Å; L75-L79 VanDerWaalsContact O-CG 3.22Å; L75-L79 WeakPolarHBondContact O-CG 3.39Å; L75-L79 PolarHBondContact O-N 2.96Å; L75-L79 VanDerWaalsContact O-N 3.07Å
76	K	94.7	Very high	93.6	Very high	50 Å²	50	90.2 Å²	90.2	22%	0.217	42%	0.422	C	S	.	.	H	α-helix	trans	-59.9	-60.2	175	-74.1	-175.5	179.4	-173.4	0	109.8	I48 D49 T72 Y73 R78 L79 E80	I48-K76 HydrophobicContact CB-CG 4.31Å; I48-K76 HydrophobicContact CD1-CB 4.37Å; I48-K76 HydrophobicContact CD1-CG 3.69Å; I48-K76 HydrophobicContact CG2-CG 3.98Å; D49-K76 WeakPolarHBondContact OD1-CE 3.41Å; D49-K76 IonicContact OD1-NZ 3.14Å; D49-K76 PolarHBondContact OD1-NZ 2.98Å; D49-K76 IonicContact OD2-NZ 3.06Å; D49-K76 PolarHBondContact OD2-NZ 2.69Å; T72-K76 HydrophobicContact CG2-CD 4.4Å; T72-K76 WeakPolarHBondContact O-CG 3.42Å; T72-K76 PolarHBondContact O-N 3.21Å; Y73-K76 PolarHBondContact O-N 3.49Å; K76-R78 VanDerWaalsContact C-N 3.32Å; K76-R78 PolarHBondContact O-N 3.44Å; K76-L79 PolarHBondContact O-N 3.45Å; K76-L79 VanDerWaalsContact O-N 3.17Å; K76-E80 VanDerWaalsContact O-CB 3.3Å; K76-E80 WeakPolarHBondContact O-CB 3.16Å; K76-E80 WeakPolarHBondContact O-CG 3.5Å; K76-E80 PolarHBondContact O-N 3.27Å
77	E	94.2	Very high	93.9	Very high	91 Å²	91	84.2 Å²	84.2	43%	0.425	39%	0.393	S	S	.	.	H	α-helix	trans	-51.8	-49.3	-179.5	-174.1	-179.4	-168.8	0	0	111.8	Y73 L79 E80 D81	Y73-E77 VanDerWaalsContact CE1-OE2 3.3Å; Y73-E77 WeakPolarHBondContact CE1-OE2 3.33Å; Y73-E77 PolarHBondContact O-N 2.98Å; E77-L79 PolarHBondContact O-N 3.37Å; E77-E80 PolarHBondContact O-N 3.31Å; E77-D81 PolarHBondContact O-N 3.44Å
78	R	94.8	Very high	94.1	Very high	157 Å²	157	81.9 Å²	81.9	59%	0.592	39%	0.387	S	S	*	.	H	α-helix	trans	-68.7	-33.7	-175.8	-169.5	58.7	172.2	179.6	2.3	114.1	Y74 K76 R82	Y74-R78 WeakPolarHBondContact O-CB 3.48Å; Y74-R78 PolarHBondContact O-N 3.26Å; K76-R78 VanDerWaalsContact C-N 3.32Å; K76-R78 PolarHBondContact O-N 3.44Å; R78-R82 PolarHBondContact O-N 3.29Å
79	L	95.2	Very high	94.3	Very high	71 Å²	71	84.8 Å²	84.8	37%	0.372	41%	0.409	S	S	.	.	H	α-helix	trans	-84.2	-32.4	179.7	-67.9	170.6	0	0	0	111.5	L44 I48 L75 K76 E77 R82 L83	L44-L79 HydrophobicContact CD1-CB 4.4Å; L44-L79 HydrophobicContact CD1-CD1 4.07Å; L44-L79 HydrophobicContact CD2-CB 3.63Å; I48-L79 HydrophobicContact CD1-CD1 3.95Å; I48-L79 HydrophobicContact CG1-CD1 4.4Å; L75-L79 VanDerWaalsContact O-CB 3.26Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 WeakPolarHBondContact O-CD1 3.34Å; L75-L79 VanDerWaalsContact O-CG 3.22Å; L75-L79 WeakPolarHBondContact O-CG 3.39Å; L75-L79 PolarHBondContact O-N 2.96Å; L75-L79 VanDerWaalsContact O-N 3.07Å; K76-L79 PolarHBondContact O-N 3.45Å; K76-L79 VanDerWaalsContact O-N 3.17Å; E77-L79 PolarHBondContact O-N 3.37Å; L79-R82 PolarHBondContact O-N 3.11Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 2.85Å
80	E	94.3	Very high	94.5	Very high	80 Å²	80	81.4 Å²	81.4	37%	0.374	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-51.5	171.2	-70.2	179	-178.6	0	0	110.6	I41 K76 E77 R82 L83 V84	I41-E80 HydrophobicContact CD1-CB 4.2Å; I41-E80 HydrophobicContact CD1-CG 3.64Å; I41-E80 HydrophobicContact CG1-CG 4.37Å; K76-E80 VanDerWaalsContact O-CB 3.3Å; K76-E80 WeakPolarHBondContact O-CB 3.16Å; K76-E80 WeakPolarHBondContact O-CG 3.5Å; K76-E80 PolarHBondContact O-N 3.27Å; E77-E80 PolarHBondContact O-N 3.31Å; E80-R82 PolarHBondContact O-N 2.73Å; E80-L83 WeakPolarHBondContact O-CB 3.41Å; E80-L83 PolarHBondContact O-N 3Å; E80-V84 WeakPolarHBondContact O-CG2 3.28Å; E80-V84 PolarHBondContact O-N 2.97Å
81	D	93.4	Very high	94.6	Very high	87 Å²	87	79.4 Å²	79.4	47%	0.465	38%	0.375	S	S	.	.	H	α-helix	trans	-52.3	-42.5	174.5	-76.7	-14.2	0	0	0	111.7	E77 V84 D85	E77-D81 PolarHBondContact O-N 3.44Å; D81-V84 PolarHBondContact O-N 3.29Å; D81-D85 PolarHBondContact O-N 3.36Å
82	R	94.5	Very high	94.5	Very high	152 Å²	152	81.8 Å²	81.8	57%	0.574	39%	0.387	S	S	*	.	H	α-helix	trans	-69.6	-34.7	-179.6	-173.9	55.4	174.5	174.4	2.8	112.4	R78 L79 E80 M86	R78-R82 PolarHBondContact O-N 3.29Å; L79-R82 PolarHBondContact O-N 3.11Å; E80-R82 PolarHBondContact O-N 2.73Å; R82-M86 HydrophobicContact CG-SD 4.42Å; R82-M86 VanDerWaalsContact O-CG 3.28Å; R82-M86 WeakPolarHBondContact O-CG 3.49Å; R82-M86 PolarHBondContact O-N 3.12Å
83	L	95.2	Very high	94.5	Very high	25 Å²	25	86.3 Å²	86.3	13%	0.131	41%	0.406	C	S	.	.	H	α-helix	trans	-68.5	-39.8	175.7	-80.6	176.7	0	0	0	111.3	Y37 I40 I41 L44 L79 E80 D85 M86 F87	Y37-L83 HydrophobicContact CE2-CB 4.2Å; I40-L83 HydrophobicContact CG2-CD1 3.93Å; I40-L83 HydrophobicContact CG2-CD2 3.92Å; I41-L83 HydrophobicContact CD1-CB 4.45Å; I41-L83 HydrophobicContact CD1-CD1 3.54Å; L44-L83 HydrophobicContact CB-CD1 4.39Å; L44-L83 HydrophobicContact CD2-CD1 3.39Å; L44-L83 HydrophobicContact CD2-CG 4.33Å; L44-L83 HydrophobicContact CG-CD1 4.47Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 2.85Å; E80-L83 WeakPolarHBondContact O-CB 3.41Å; E80-L83 PolarHBondContact O-N 3Å; L83-D85 PolarHBondContact O-N 2.94Å; L83-M86 PolarHBondContact O-N 2.91Å; L83-M86 VanDerWaalsContact O-N 3.15Å; L83-F87 HydrophobicContact CD2-CE2 4.48Å; L83-F87 WeakPolarHBondContact O-CB 3.4Å; L83-F87 WeakPolarHBondContact O-CD2 3.38Å; L83-F87 PolarHBondContact O-N 3.08Å
84	V	94.7	Very high	94.4	Very high	58 Å²	58	79.3 Å²	79.3	35%	0.352	38%	0.379	S	S	.	.	H	α-helix	trans	-55.8	-53.2	175.5	174.3	0	0	0	0	110.5	Y37 E80 D81 M86 F87 D88	Y37-V84 HydrophobicContact CE2-CG2 4.32Å; Y37-V84 WeakPolarHBondContact OH-CG2 3.39Å; E80-V84 WeakPolarHBondContact O-CG2 3.28Å; E80-V84 PolarHBondContact O-N 2.97Å; D81-V84 PolarHBondContact O-N 3.29Å; V84-M86 PolarHBondContact O-N 3.22Å; V84-F87 PolarHBondContact O-N 3.3Å; V84-D88 PolarHBondContact O-N 3.21Å
85	D	94.7	Very high	94.1	Very high	89 Å²	89	74.3 Å²	74.3	48%	0.476	36%	0.362	S	S	.	.	H	α-helix	trans	-56.2	-38.2	177.3	-73.4	-18.7	0	0	0	113.1	D81 L83 S89	D81-D85 PolarHBondContact O-N 3.36Å; L83-D85 PolarHBondContact O-N 2.94Å; D85-S89 PolarHBondContact O-N 2.88Å; D85-S89 PolarHBondContact O-OG 3.49Å
86	M	95.6	Very high	93.8	Very high	106 Å²	106	74.6 Å²	74.6	52%	0.522	37%	0.368	S	S	.	.	H	α-helix	trans	-71.4	-38.2	179.4	-74.3	-179.5	65.8	0	0	111.7	R82 L83 V84 S89 F90	R82-M86 HydrophobicContact CG-SD 4.42Å; R82-M86 VanDerWaalsContact O-CG 3.28Å; R82-M86 WeakPolarHBondContact O-CG 3.49Å; R82-M86 PolarHBondContact O-N 3.12Å; L83-M86 PolarHBondContact O-N 2.91Å; L83-M86 VanDerWaalsContact O-N 3.15Å; V84-M86 PolarHBondContact O-N 3.22Å; M86-S89 WeakPolarHBondContact O-CB 3.38Å; M86-S89 PolarHBondContact O-N 3.49Å; M86-F90 WeakPolarHBondContact O-CB 3.31Å; M86-F90 PolarHBondContact O-N 2.94Å
87	F	96.4	Very high	93.5	Very high	23 Å²	23	79.6 Å²	79.6	10%	0.101	39%	0.39	C	S	.	.	H	α-helix	trans	-73.8	-35.9	178.4	-93.7	-95.4	0	0	0	112.4	S33 L36 Y37 I40 L83 V84 S89 F90 D91	S33-F87 WeakPolarHBondContact O-CE1 3.44Å; L36-F87 HydrophobicContact CB-CE1 4.03Å; L36-F87 HydrophobicContact CB-CZ 4.27Å; Y37-F87 VanDerWaalsContact CA-CE1 3.49Å; Y37-F87 VanDerWaalsContact CA-CZ 3.43Å; Y37-F87 HydrophobicContact CD2-CB 4.02Å; Y37-F87 HydrophobicContact CD2-CD1 4.04Å; Y37-F87 AromaticContact CD2-CD2 3.58Å; Y37-F87 HydrophobicContact CD2-CD2 3.58Å; Y37-F87 HydrophobicContact CD2-CE1 4.41Å; Y37-F87 AromaticContact CD2-CE2 3.96Å; Y37-F87 HydrophobicContact CD2-CE2 3.96Å; Y37-F87 AromaticContact CD2-CG 3.59Å; Y37-F87 HydrophobicContact CD2-CG 3.59Å; Y37-F87 HydrophobicContact CD2-CZ 4.35Å; Y37-F87 HydrophobicContact CE2-CD2 4.35Å; Y37-F87 HydrophobicContact CG-CD1 4.35Å; Y37-F87 HydrophobicContact CG-CG 4.34Å; Y37-F87 VanDerWaalsContact N-CE1 3.32Å; I40-F87 HydrophobicContact CD1-CE2 4.02Å; I40-F87 HydrophobicContact CD1-CZ 3.67Å; L83-F87 HydrophobicContact CD2-CE2 4.48Å; L83-F87 WeakPolarHBondContact O-CB 3.4Å; L83-F87 WeakPolarHBondContact O-CD2 3.38Å; L83-F87 PolarHBondContact O-N 3.08Å; V84-F87 PolarHBondContact O-N 3.3Å; F87-S89 PolarHBondContact O-N 3.4Å; F87-F90 HydrophobicContact CD1-CD1 4.09Å; F87-F90 HydrophobicContact CE1-CD1 4.15Å; F87-F90 CarbonylContact O-C 3.14Å; F87-F90 WeakPolarHBondContact O-CA 3.49Å; F87-F90 WeakPolarHBondContact O-CB 3.38Å; F87-F90 PolarHBondContact O-N 3.11Å; F87-D91 PolarHBondContact O-N 2.91Å
88	D	94	Very high	93.3	Very high	87 Å²	87	79 Å²	79	47%	0.465	39%	0.392	S	S	.	.	H	α-helix	trans	-56.6	-42.8	169.5	-74	-12.1	0	0	0	111.3	V84 I92	V84-D88 PolarHBondContact O-N 3.21Å; D88-I92 WeakPolarHBondContact O-CD1 3.39Å; D88-I92 VanDerWaalsContact O-CG1 3.31Å; D88-I92 WeakPolarHBondContact O-CG1 3.49Å; D88-I92 PolarHBondContact O-N 3.43Å
89	S	94.3	Very high	93.1	Very high	78 Å²	78	73.2 Å²	73.2	55%	0.545	37%	0.373	S	S	.	.	H	α-helix	trans	-68.7	-36.6	176.5	-59.7	0	0	0	0	112.2	D85 M86 F87 F93	D85-S89 PolarHBondContact O-N 2.88Å; D85-S89 PolarHBondContact O-OG 3.49Å; M86-S89 WeakPolarHBondContact O-CB 3.38Å; M86-S89 PolarHBondContact O-N 3.49Å; F87-S89 PolarHBondContact O-N 3.4Å; S89-F93 WeakPolarHBondContact O-CB 3.34Å; S89-F93 PolarHBondContact O-N 2.92Å; S89-F93 VanDerWaalsContact O-N 3.09Å
90	F	95.3	Very high	92.7	Very high	67 Å²	67	75.9 Å²	75.9	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-68.1	-42.2	177.5	177.6	-111.5	0	0	0	111.5	S33 L36 M86 F87 I92 F93 L94	S33-F90 VanDerWaalsContact OG-CD1 3.27Å; S33-F90 WeakPolarHBondContact OG-CD1 3.02Å; L36-F90 HydrophobicContact CD1-CE1 4.02Å; L36-F90 HydrophobicContact CD1-CZ 4.1Å; M86-F90 WeakPolarHBondContact O-CB 3.31Å; M86-F90 PolarHBondContact O-N 2.94Å; F87-F90 HydrophobicContact CD1-CD1 4.09Å; F87-F90 HydrophobicContact CE1-CD1 4.15Å; F87-F90 CarbonylContact O-C 3.14Å; F87-F90 WeakPolarHBondContact O-CA 3.49Å; F87-F90 WeakPolarHBondContact O-CB 3.38Å; F87-F90 PolarHBondContact O-N 3.11Å; F90-I92 PolarHBondContact O-N 3.41Å; F90-F93 WeakPolarHBondContact O-CB 3.35Å; F90-F93 PolarHBondContact O-N 3.3Å; F90-F93 VanDerWaalsContact O-N 3.16Å; F90-L94 HydrophobicContact CE1-CD2 4.29Å; F90-L94 HydrophobicContact CZ-CD1 4.27Å; F90-L94 VanDerWaalsContact O-CB 3.28Å; F90-L94 WeakPolarHBondContact O-CB 3.45Å; F90-L94 PolarHBondContact O-N 3.13Å
91	D	93.7	Very high	92.3	Very high	36 Å²	36	73.8 Å²	73.8	19%	0.193	37%	0.37	C	S	.	.	H	α-helix	trans	-55.9	-52	174.6	-77.8	-3.9	0	0	0	110.7	L30 S33 F87 F93 L94 V95	L30-D91 HydrophobicContact CD2-CB 3.86Å; S33-D91 WeakPolarHBondContact CB-OD1 3.33Å; S33-D91 PolarHBondContact OG-OD1 3.05Å; F87-D91 PolarHBondContact O-N 2.91Å; D91-F93 VanDerWaalsContact C-N 3.28Å; D91-F93 PolarHBondContact O-N 2.91Å; D91-L94 PolarHBondContact O-N 3.06Å; D91-V95 WeakPolarHBondContact O-CG1 3.44Å; D91-V95 VanDerWaalsContact O-CG2 3.27Å; D91-V95 WeakPolarHBondContact O-CG2 3.48Å; D91-V95 PolarHBondContact O-N 3.26Å
92	I	91.3	Very high	91.8	Very high	112 Å²	112	73.4 Å²	73.4	57%	0.574	37%	0.368	S	S	*	.	H	α-helix	trans	-57.1	-45.5	177.8	-66.6	166.6	0	0	0	110.3	D88 F90 S96	D88-I92 WeakPolarHBondContact O-CD1 3.39Å; D88-I92 VanDerWaalsContact O-CG1 3.31Å; D88-I92 WeakPolarHBondContact O-CG1 3.49Å; D88-I92 PolarHBondContact O-N 3.43Å; F90-I92 PolarHBondContact O-N 3.41Å; I92-S96 WeakPolarHBondContact O-CB 3.5Å; I92-S96 PolarHBondContact O-N 3.06Å; I92-S96 PolarHBondContact O-OG 3.3Å
93	F	92.9	Very high	91.1	Very high	110 Å²	110	71.5 Å²	71.5	48%	0.482	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-44.6	178.6	176.3	-108.2	0	0	0	112.3	S89 F90 D91 V95 K97 V98	S89-F93 WeakPolarHBondContact O-CB 3.34Å; S89-F93 PolarHBondContact O-N 2.92Å; S89-F93 VanDerWaalsContact O-N 3.09Å; F90-F93 WeakPolarHBondContact O-CB 3.35Å; F90-F93 PolarHBondContact O-N 3.3Å; F90-F93 VanDerWaalsContact O-N 3.16Å; D91-F93 VanDerWaalsContact C-N 3.28Å; D91-F93 PolarHBondContact O-N 2.91Å; F93-V95 PolarHBondContact O-N 3.44Å; F93-K97 HydrophobicContact CD2-CB 3.94Å; F93-K97 HydrophobicContact CD2-CG 3.97Å; F93-K97 HydrophobicContact CE2-CB 3.86Å; F93-K97 HydrophobicContact CE2-CG 4.15Å; F93-K97 WeakPolarHBondContact O-CB 3.46Å; F93-K97 PolarHBondContact O-N 3.48Å; F93-V98 HydrophobicContact CD1-CG2 3.81Å; F93-V98 HydrophobicContact CE1-CG2 3.28Å; F93-V98 HydrophobicContact CE2-CG2 4.32Å; F93-V98 HydrophobicContact CZ-CG2 3.58Å; F93-V98 PolarHBondContact O-N 3.49Å
94	L	92.5	Very high	90.5	Very high	9 Å²	9	75 Å²	75	5%	0.047	41%	0.405	C	S	.	.	I	π-helix	trans	-59.6	-49.4	-178.8	-170.5	68.1	0	0	0	110.2	P29 F90 D91 V98 L99	P29-L94 HydrophobicContact CB-CD2 4.36Å; P29-L94 WeakPolarHBondContact O-CD2 3.31Å; F90-L94 HydrophobicContact CE1-CD2 4.29Å; F90-L94 HydrophobicContact CZ-CD1 4.27Å; F90-L94 VanDerWaalsContact O-CB 3.28Å; F90-L94 WeakPolarHBondContact O-CB 3.45Å; F90-L94 PolarHBondContact O-N 3.13Å; D91-L94 PolarHBondContact O-N 3.06Å; L94-V98 HydrophobicContact CD1-CB 4.31Å; L94-V98 HydrophobicContact CD1-CG1 4.39Å; L94-V98 PolarHBondContact O-N 3.46Å; L94-L99 HydrophobicContact CD1-CD1 3.67Å; L94-L99 HydrophobicContact CD1-CG 3.83Å; L94-L99 HydrophobicContact CD2-CD1 4.27Å; L94-L99 HydrophobicContact CG-CD1 3.9Å; L94-L99 HydrophobicContact CG-CG 4.19Å; L94-L99 PolarHBondContact O-N 3.28Å
95	V	90.5	Very high	90	Very high	28 Å²	28	75.5 Å²	75.5	17%	0.17	41%	0.408	C	S	.	.	I	π-helix	trans	-82.7	-23.7	-173.4	-52.7	0	0	0	0	113.4	I14 P29 L30 D91 F93	I14-V95 HydrophobicContact CD1-CG2 4.18Å; P29-V95 HydrophobicContact CB-CG1 4.37Å; L30-V95 HydrophobicContact CD2-CG1 3.72Å; L30-V95 HydrophobicContact CG-CG1 4.09Å; D91-V95 WeakPolarHBondContact O-CG1 3.44Å; D91-V95 VanDerWaalsContact O-CG2 3.27Å; D91-V95 WeakPolarHBondContact O-CG2 3.48Å; D91-V95 PolarHBondContact O-N 3.26Å; F93-V95 PolarHBondContact O-N 3.44Å
96	S	86.7	Confident	89.5	Confident	51 Å²	51	73.9 Å²	73.9	36%	0.357	40%	0.401	S	S	.	.	I	π-helix	trans	-99.9	-20.2	-176.7	72.7	0	0	0	0	114.6	I92	I92-S96 WeakPolarHBondContact O-CB 3.5Å; I92-S96 PolarHBondContact O-N 3.06Å; I92-S96 PolarHBondContact O-OG 3.3Å
97	K	88.5	Confident	89.1	Confident	154 Å²	154	69.8 Å²	69.8	67%	0.67	38%	0.381	S	S	*	.	I	π-helix	trans	-128.3	-36.9	-174.3	-59.4	-62.3	174.5	-169.1	0	114.6	F93	F93-K97 HydrophobicContact CD2-CB 3.94Å; F93-K97 HydrophobicContact CD2-CG 3.97Å; F93-K97 HydrophobicContact CE2-CB 3.86Å; F93-K97 HydrophobicContact CE2-CG 4.15Å; F93-K97 WeakPolarHBondContact O-CB 3.46Å; F93-K97 PolarHBondContact O-N 3.48Å
98	V	91.3	Very high	88.6	Confident	80 Å²	80	76.7 Å²	76.7	49%	0.485	41%	0.411	S	S	.	.	I	π-helix	trans	-98	-60.9	-170.6	-177.4	0	0	0	0	111.3	F93 L94 Y100	F93-V98 HydrophobicContact CD1-CG2 3.81Å; F93-V98 HydrophobicContact CE1-CG2 3.28Å; F93-V98 HydrophobicContact CE2-CG2 4.32Å; F93-V98 HydrophobicContact CZ-CG2 3.58Å; F93-V98 PolarHBondContact O-N 3.49Å; L94-V98 HydrophobicContact CD1-CB 4.31Å; L94-V98 HydrophobicContact CD1-CG1 4.39Å; L94-V98 PolarHBondContact O-N 3.46Å; V98-Y100 VanDerWaalsContact C-N 3.34Å; V98-Y100 PolarHBondContact O-N 2.9Å
99	L	91	Very high	88	Confident	34 Å²	34	79.3 Å²	79.3	18%	0.178	43%	0.425	C	S	.	.	S	Bend	trans	-102	54.1	-178.6	-56.9	-175.7	0	0	0	109.6	V21 L25 F27 P29 L32 L94	V21-L99 HydrophobicContact CG1-CB 4.25Å; V21-L99 WeakPolarHBondContact CG1-O 3.48Å; L25-L99 HydrophobicContact CD1-CB 4.32Å; L25-L99 HydrophobicContact CD1-CD1 4.06Å; L25-L99 HydrophobicContact CD1-CD2 3.9Å; L25-L99 HydrophobicContact CD1-CG 4.31Å; F27-L99 HydrophobicContact CE2-CD1 4.14Å; F27-L99 HydrophobicContact CZ-CD1 4.44Å; P29-L99 HydrophobicContact CB-CB 4.11Å; P29-L99 HydrophobicContact CB-CD1 3.83Å; P29-L99 HydrophobicContact CG-CB 3.99Å; P29-L99 HydrophobicContact CG-CD1 4.12Å; L32-L99 HydrophobicContact CD2-CD1 4.3Å; L94-L99 HydrophobicContact CD1-CD1 3.67Å; L94-L99 HydrophobicContact CD1-CG 3.83Å; L94-L99 HydrophobicContact CD2-CD1 4.27Å; L94-L99 HydrophobicContact CG-CD1 3.9Å; L94-L99 HydrophobicContact CG-CG 4.19Å; L94-L99 PolarHBondContact O-N 3.28Å
100	Y	86.5	Confident	87.6	Confident	128 Å²	128	76.8 Å²	76.8	50%	0.502	41%	0.405	S	S	.	.			trans	-115.5	133.4	179.4	169.7	-101.7	0	0	0	109.9	V98 N102	V98-Y100 VanDerWaalsContact C-N 3.34Å; V98-Y100 PolarHBondContact O-N 2.9Å; Y100-N102 HydrophobicContact CE1-CB 4.09Å
101	L	84.6	Confident	87	Confident	36 Å²	36	79 Å²	79	19%	0.188	42%	0.416	C	S	.	.			trans	-103	128.2	166.8	-82.8	160	0	0	0	109.2	Y20 V21 L24 V105	Y20-L101 HydrophobicContact CD1-CB 4.45Å; Y20-L101 HydrophobicContact CD1-CD1 3.78Å; V21-L101 HydrophobicContact CB-CD1 4.3Å; V21-L101 HydrophobicContact CG2-CB 3.97Å; V21-L101 HydrophobicContact CG2-CD1 3.8Å; V21-L101 HydrophobicContact CG2-CG 4Å; L24-L101 HydrophobicContact CB-CD1 4.26Å; L24-L101 HydrophobicContact CD2-CD1 3.82Å; L24-L101 HydrophobicContact CD2-CD2 4.04Å; L24-L101 HydrophobicContact CD2-CG 4.29Å; L101-V105 HydrophobicContact CD2-CB 4.18Å; L101-V105 HydrophobicContact CD2-CG1 3.77Å
102	N	83.4	Confident	86.2	Confident	78 Å²	78	84.9 Å²	84.9	42%	0.417	45%	0.447	S	S	.	.			trans	-62.5	139.9	172.5	-173.2	-43.1	0	0	0	109.4	Y100 S104 V105	Y100-N102 HydrophobicContact CE1-CB 4.09Å; N102-S104 PolarHBondContact O-N 3.25Å; N102-S104 PolarHBondContact OD1-N 2.99Å; N102-S104 PolarHBondContact OD1-OG 3.48Å; N102-V105 HydrophobicContact CB-CG2 4.15Å; N102-V105 WeakPolarHBondContact O-CB 3.49Å; N102-V105 PolarHBondContact O-N 3.06Å
103	S	79.9	Confident	85.5	Confident	112 Å²	112	86.2 Å²	86.2	78%	0.783	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-20.4	176.9	52.5	0	0	0	0	114.4
104	S	82.9	Confident	84.8	Confident	100 Å²	100	86.3 Å²	86.3	70%	0.699	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.6	176.4	-55.2	0	0	0	0	114.1	N102	N102-S104 PolarHBondContact O-N 3.25Å; N102-S104 PolarHBondContact OD1-N 2.99Å; N102-S104 PolarHBondContact OD1-OG 3.48Å
105	V	84.1	Confident	83.9	Confident	68 Å²	68	92.3 Å²	92.3	41%	0.412	48%	0.484	S	S	.	.			trans	-88.1	131.4	-179.1	177.5	0	0	0	0	109.2	Y20 L101 N102	Y20-V105 WeakPolarHBondContact CE1-O 3.43Å; L101-V105 HydrophobicContact CD2-CB 4.18Å; L101-V105 HydrophobicContact CD2-CG1 3.77Å; N102-V105 HydrophobicContact CB-CG2 4.15Å; N102-V105 WeakPolarHBondContact O-CB 3.49Å; N102-V105 PolarHBondContact O-N 3.06Å
106	V	84.5	Confident	83.3	Confident	54 Å²	54	98.6 Å²	98.6	33%	0.327	51%	0.506	S	S	.	.			trans	-116.5	128.1	176.2	-173.4	0	0	0	0	107.2	Y20 D110 L114	Y20-V106 WeakPolarHBondContact OH-CA 3.46Å; V106-D110 HydrophobicContact CG1-CB 3.95Å; V106-L114 HydrophobicContact CB-CD1 4.32Å; V106-L114 HydrophobicContact CB-CD2 4.28Å; V106-L114 HydrophobicContact CG1-CD1 4.02Å; V106-L114 HydrophobicContact CG1-CD2 3.84Å; V106-L114 HydrophobicContact CG1-CG 4.03Å; V106-L114 HydrophobicContact CG2-CD1 4.16Å; V106-L114 HydrophobicContact CG2-CD2 3.55Å; V106-L114 HydrophobicContact CG2-CG 4.37Å
107	L	86.5	Confident	83.2	Confident	20 Å²	20	97.9 Å²	97.9	11%	0.105	50%	0.501	C	S	.	.			trans	-66.3	146.9	170.9	-63	174.8	0	0	0	109.3	Y20 K23 L24 D109 D110 E111	Y20-L107 HydrophobicContact CD1-CD1 4.15Å; Y20-L107 HydrophobicContact CD1-CG 4.1Å; Y20-L107 HydrophobicContact CD2-CD1 4.1Å; Y20-L107 HydrophobicContact CE1-CB 4.31Å; Y20-L107 HydrophobicContact CE1-CD1 3.91Å; Y20-L107 HydrophobicContact CE1-CD2 4.34Å; Y20-L107 HydrophobicContact CE1-CG 3.47Å; Y20-L107 VanDerWaalsContact CE1-CG 3.47Å; Y20-L107 HydrophobicContact CE2-CD1 3.83Å; Y20-L107 HydrophobicContact CE2-CG 4.11Å; Y20-L107 HydrophobicContact CG-CD1 4.23Å; Y20-L107 VanDerWaalsContact CZ-CG 3.45Å; Y20-L107 WeakPolarHBondContact OH-CB 3.15Å; Y20-L107 PolarHBondContact OH-N 3.41Å; K23-L107 HydrophobicContact CB-CD1 4.12Å; L24-L107 HydrophobicContact CB-CD2 3.93Å; L24-L107 HydrophobicContact CD1-CD2 3.81Å; L24-L107 HydrophobicContact CD2-CD2 4.26Å; L24-L107 HydrophobicContact CG-CD2 4.2Å; L107-D109 PolarHBondContact O-N 2.74Å; L107-D109 VanDerWaalsContact O-N 3.12Å; L107-D110 PolarHBondContact O-N 3.33Å; L107-E111 PolarHBondContact O-N 3.36Å
108	K	85.7	Confident	83.2	Confident	169 Å²	169	95.4 Å²	95.4	74%	0.735	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-53.8	-36.7	-179.1	-68.5	-174.9	175.8	-179.2	0	113	D110 E111	K108-D110 PolarHBondContact O-N 2.9Å; K108-E111 WeakPolarHBondContact O-CB 3.47Å; K108-E111 PolarHBondContact O-N 2.9Å
109	D	83	Confident	83.1	Confident	142 Å²	142	100 Å²	100	76%	0.759	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-66.9	-24.1	-179.2	-59.8	-27	0	0	0	112.6	L107	L107-D109 PolarHBondContact O-N 2.74Å; L107-D109 VanDerWaalsContact O-N 3.12Å
110	D	84.7	Confident	83	Confident	25 Å²	25	105.3 Å²	105.3	13%	0.134	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-101.8	-0.7	-179.9	-58.2	-47.7	0	0	0	113	Y20 V106 L107 K108 L112 Q113	Y20-D110 WeakPolarHBondContact CE2-OD2 3.34Å; Y20-D110 PolarHBondContact OH-OD2 3.45Å; V106-D110 HydrophobicContact CG1-CB 3.95Å; L107-D110 PolarHBondContact O-N 3.33Å; K108-D110 PolarHBondContact O-N 2.9Å; D110-L112 PolarHBondContact O-N 3.44Å; D110-L112 VanDerWaalsContact O-N 3.17Å; D110-Q113 WeakPolarHBondContact O-CA 3.07Å; D110-Q113 WeakPolarHBondContact O-CB 3.38Å; D110-Q113 PolarHBondContact O-N 3.24Å; D110-Q113 PolarHBondContact OD1-NE2 2.97Å
111	E	82.3	Confident	83.2	Confident	112 Å²	112	102.8 Å²	102.8	52%	0.523	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-55.5	-36.5	177.4	-77.5	177.5	-167.5	0	0	111.7	L107 K108 Q113 L114	L107-E111 PolarHBondContact O-N 3.36Å; K108-E111 WeakPolarHBondContact O-CB 3.47Å; K108-E111 PolarHBondContact O-N 2.9Å; E111-Q113 PolarHBondContact O-N 3Å; E111-L114 WeakPolarHBondContact O-CB 3.29Å; E111-L114 WeakPolarHBondContact O-CG 3.45Å; E111-L114 PolarHBondContact O-N 3.11Å
112	L	76.9	Confident	83.7	Confident	161 Å²	161	106.1 Å²	106.1	84%	0.843	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-68.3	-20.1	177.4	-66	174.4	0	0	0	113.3	D110	D110-L112 PolarHBondContact O-N 3.44Å; D110-L112 VanDerWaalsContact O-N 3.17Å
113	Q	77.3	Confident	84.2	Confident	139 Å²	139	104.6 Å²	104.6	65%	0.65	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-87.4	-9.7	-179.3	-58.5	175.2	29.3	0	0	112.5	D110 E111 E115	D110-Q113 WeakPolarHBondContact O-CA 3.07Å; D110-Q113 WeakPolarHBondContact O-CB 3.38Å; D110-Q113 PolarHBondContact O-N 3.24Å; D110-Q113 PolarHBondContact OD1-NE2 2.97Å; E111-Q113 PolarHBondContact O-N 3Å; Q113-E115 VanDerWaalsContact C-N 3.32Å; Q113-E115 PolarHBondContact O-N 3.49Å
114	L	78.2	Confident	84.9	Confident	112 Å²	112	103.6 Å²	103.6	59%	0.586	51%	0.513	S	S	*	.	S	Bend	trans	-66.8	-32.5	-178.5	-65.6	173.8	0	0	0	113.4	V106 E111	V106-L114 HydrophobicContact CB-CD1 4.32Å; V106-L114 HydrophobicContact CB-CD2 4.28Å; V106-L114 HydrophobicContact CG1-CD1 4.02Å; V106-L114 HydrophobicContact CG1-CD2 3.84Å; V106-L114 HydrophobicContact CG1-CG 4.03Å; V106-L114 HydrophobicContact CG2-CD1 4.16Å; V106-L114 HydrophobicContact CG2-CD2 3.55Å; V106-L114 HydrophobicContact CG2-CG 4.37Å; E111-L114 WeakPolarHBondContact O-CB 3.29Å; E111-L114 WeakPolarHBondContact O-CG 3.45Å; E111-L114 PolarHBondContact O-N 3.11Å
115	E	72.6	Confident	85.6	Confident	136 Å²	136	104.5 Å²	104.5	64%	0.636	51%	0.507	S	S	*	.			trans	-122.2	83.1	178.8	-73.2	-165.5	-169.5	0	0	111	Q113 R120	Q113-E115 VanDerWaalsContact C-N 3.32Å; Q113-E115 PolarHBondContact O-N 3.49Å; E115-R120 IonicContact OE2-CZ 3.8Å; E115-R120 IonicContact OE2-NH1 3.59Å; E115-R120 IonicContact OE2-NH2 2.72Å; E115-R120 PolarHBondContact OE2-NH2 3.08Å
116	Y	79.5	Confident	86.2	Confident	160 Å²	160	106 Å²	106	63%	0.627	51%	0.512	S	S	*	.			trans	-82.6	133.3	162.9	177.8	-103.9	0	0	0	110.6	E118 D121	Y116-E118 HydrophobicContact CE1-CB 3.76Å; Y116-D121 WeakPolarHBondContact CE2-OD2 3.49Å
117	S	83.8	Confident	86.8	Confident	36 Å²	36	111.2 Å²	111.2	25%	0.252	53%	0.526	S	S	.	.			trans	-135.7	103.2	169.2	-176.1	0	0	0	0	109.8	K119 R120 D121	S117-K119 PolarHBondContact O-N 2.89Å; S117-R120 WeakPolarHBondContact O-CA 3.5Å; S117-R120 WeakPolarHBondContact O-CB 3.39Å; S117-R120 PolarHBondContact O-N 3.3Å; S117-D121 PolarHBondContact O-N 2.79Å
118	E	88	Confident	87.3	Confident	102 Å²	102	115.1 Å²	115.1	48%	0.477	55%	0.546	S	S	.	.	H	α-helix	trans	-51	-34.1	176.1	-166.4	-171	161.9	0	0	112.3	Y116 D121 K122	Y116-E118 HydrophobicContact CE1-CB 3.76Å; E118-D121 PolarHBondContact O-N 2.89Å; E118-K122 HydrophobicContact CG-CD 4.28Å; E118-K122 WeakPolarHBondContact O-CB 3.48Å; E118-K122 WeakPolarHBondContact O-CG 3.44Å; E118-K122 PolarHBondContact O-N 3.43Å; E118-K122 VanDerWaalsContact OE1-CE 3.31Å; E118-K122 WeakPolarHBondContact OE1-CE 3.46Å; E118-K122 IonicContact OE1-NZ 2.94Å; E118-K122 PolarHBondContact OE1-NZ 3.12Å
119	K	89.8	Confident	87.9	Confident	176 Å²	176	111 Å²	111	77%	0.765	53%	0.531	S	S	*	.	H	α-helix	trans	-66.4	-42.5	175.6	-173.5	-179.8	178.9	-178.6	0	112.4	S117 A123	S117-K119 PolarHBondContact O-N 2.89Å; K119-A123 WeakPolarHBondContact O-CB 3.37Å; K119-A123 PolarHBondContact O-N 3.08Å; K119-A123 VanDerWaalsContact O-N 3.11Å
120	R	88.1	Confident	88.5	Confident	146 Å²	146	107.3 Å²	107.3	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-66.4	-42.8	175.9	-65.6	-174.4	-150.7	174.4	11.7	109.7	E115 S117 A123 I124	E115-R120 IonicContact OE2-CZ 3.8Å; E115-R120 IonicContact OE2-NH1 3.59Å; E115-R120 IonicContact OE2-NH2 2.72Å; E115-R120 PolarHBondContact OE2-NH2 3.08Å; S117-R120 WeakPolarHBondContact O-CA 3.5Å; S117-R120 WeakPolarHBondContact O-CB 3.39Å; S117-R120 PolarHBondContact O-N 3.3Å; R120-A123 WeakPolarHBondContact O-CA 3.39Å; R120-A123 WeakPolarHBondContact O-CB 3.41Å; R120-A123 PolarHBondContact O-N 3.26Å; R120-A123 VanDerWaalsContact O-N 3.1Å; R120-I124 WeakPolarHBondContact O-CG1 3.34Å; R120-I124 PolarHBondContact O-N 2.89Å
121	D	91.7	Very high	89.2	Confident	74 Å²	74	112.5 Å²	112.5	40%	0.396	53%	0.532	S	S	.	.	H	α-helix	trans	-63.9	-49.2	-178.5	-75	18.3	0	0	0	111.8	Y116 S117 E118 A123 I124 E125	Y116-D121 WeakPolarHBondContact CE2-OD2 3.49Å; S117-D121 PolarHBondContact O-N 2.79Å; E118-D121 PolarHBondContact O-N 2.89Å; D121-A123 PolarHBondContact O-N 2.84Å; D121-I124 WeakPolarHBondContact O-CB 3.42Å; D121-I124 PolarHBondContact O-N 3.03Å; D121-I124 VanDerWaalsContact O-N 3.08Å; D121-E125 PolarHBondContact O-N 3.1Å
122	K	94.6	Very high	89.9	Confident	107 Å²	107	110.6 Å²	110.6	47%	0.465	53%	0.528	S	S	.	.	H	α-helix	trans	-58.3	-35.7	172	-77.1	175.7	170.4	167.9	0	112.3	E118 N126	E118-K122 HydrophobicContact CG-CD 4.28Å; E118-K122 WeakPolarHBondContact O-CB 3.48Å; E118-K122 WeakPolarHBondContact O-CG 3.44Å; E118-K122 PolarHBondContact O-N 3.43Å; E118-K122 VanDerWaalsContact OE1-CE 3.31Å; E118-K122 WeakPolarHBondContact OE1-CE 3.46Å; E118-K122 IonicContact OE1-NZ 2.94Å; E118-K122 PolarHBondContact OE1-NZ 3.12Å; K122-N126 WeakPolarHBondContact O-CB 3.47Å; K122-N126 VanDerWaalsContact O-CG 3.29Å; K122-N126 PolarHBondContact O-N 3.11Å; K122-N126 PolarHBondContact O-ND2 2.97Å
123	A	94.3	Very high	90.9	Very high	45 Å²	45	107.4 Å²	107.4	37%	0.372	51%	0.512	S	S	.	.	H	α-helix	trans	-69.3	-37.4	176.6	0	0	0	0	0	112.3	K119 R120 D121 R127	K119-A123 WeakPolarHBondContact O-CB 3.37Å; K119-A123 PolarHBondContact O-N 3.08Å; K119-A123 VanDerWaalsContact O-N 3.11Å; R120-A123 WeakPolarHBondContact O-CA 3.39Å; R120-A123 WeakPolarHBondContact O-CB 3.41Å; R120-A123 PolarHBondContact O-N 3.26Å; R120-A123 VanDerWaalsContact O-N 3.1Å; D121-A123 PolarHBondContact O-N 2.84Å; A123-R127 VanDerWaalsContact O-CG 3.28Å; A123-R127 WeakPolarHBondContact O-CG 3.39Å; A123-R127 PolarHBondContact O-N 3.02Å; A123-R127 VanDerWaalsContact O-N 3.12Å
124	I	94.7	Very high	91.8	Very high	91 Å²	91	107.6 Å²	107.6	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-65.6	-47.3	174.1	-68.9	166.3	0	0	0	109.9	R120 D121 N126 R127 I128	R120-I124 WeakPolarHBondContact O-CG1 3.34Å; R120-I124 PolarHBondContact O-N 2.89Å; D121-I124 WeakPolarHBondContact O-CB 3.42Å; D121-I124 PolarHBondContact O-N 3.03Å; D121-I124 VanDerWaalsContact O-N 3.08Å; I124-N126 PolarHBondContact O-N 2.92Å; I124-R127 WeakPolarHBondContact O-CA 3.35Å; I124-R127 WeakPolarHBondContact O-CB 3.33Å; I124-R127 PolarHBondContact O-N 2.83Å; I124-R127 VanDerWaalsContact O-N 3.08Å; I124-I128 HydrophobicContact CG2-CD1 3.89Å; I124-I128 HydrophobicContact CG2-CG1 4.4Å; I124-I128 WeakPolarHBondContact O-CG1 3.41Å; I124-I128 PolarHBondContact O-N 2.88Å
125	E	97	Very high	92.8	Very high	120 Å²	120	106.5 Å²	106.5	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-58.9	-47	178.6	-172.2	173.3	-160.5	0	0	112	D121 R127 I128 I129	D121-E125 PolarHBondContact O-N 3.1Å; E125-R127 VanDerWaalsContact C-N 3.27Å; E125-R127 PolarHBondContact O-N 2.91Å; E125-I128 WeakPolarHBondContact O-CB 3.33Å; E125-I128 PolarHBondContact O-N 3.32Å; E125-I128 VanDerWaalsContact O-N 3.11Å; E125-I129 HydrophobicContact CG-CD1 4.34Å; E125-I129 WeakPolarHBondContact O-CG1 3.46Å; E125-I129 PolarHBondContact O-N 3.25Å
126	N	96.8	Very high	94	Very high	99 Å²	99	103.8 Å²	103.8	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-59.9	-36.4	174.9	-77.1	-47.7	0	0	0	112.8	K122 I124 T130	K122-N126 WeakPolarHBondContact O-CB 3.47Å; K122-N126 VanDerWaalsContact O-CG 3.29Å; K122-N126 PolarHBondContact O-N 3.11Å; K122-N126 PolarHBondContact O-ND2 2.97Å; I124-N126 PolarHBondContact O-N 2.92Å; N126-T130 WeakPolarHBondContact O-CB 3.41Å; N126-T130 PolarHBondContact O-N 2.91Å; N126-T130 PolarHBondContact O-OG1 3.48Å
127	R	96.9	Very high	94.8	Very high	164 Å²	164	101.3 Å²	101.3	62%	0.619	49%	0.49	S	S	*	.	H	α-helix	trans	-67.6	-42.3	174.4	-76.2	171.6	174.5	-177	-0.3	111.5	A123 I124 E125 I129 T130 Y131	A123-R127 VanDerWaalsContact O-CG 3.28Å; A123-R127 WeakPolarHBondContact O-CG 3.39Å; A123-R127 PolarHBondContact O-N 3.02Å; A123-R127 VanDerWaalsContact O-N 3.12Å; I124-R127 WeakPolarHBondContact O-CA 3.35Å; I124-R127 WeakPolarHBondContact O-CB 3.33Å; I124-R127 PolarHBondContact O-N 2.83Å; I124-R127 VanDerWaalsContact O-N 3.08Å; E125-R127 VanDerWaalsContact C-N 3.27Å; E125-R127 PolarHBondContact O-N 2.91Å; R127-I129 VanDerWaalsContact C-N 3.35Å; R127-I129 PolarHBondContact O-N 3.3Å; R127-T130 WeakPolarHBondContact O-CB 3.47Å; R127-T130 PolarHBondContact O-N 3.12Å; R127-Y131 HydrophobicContact CB-CD2 4.45Å; R127-Y131 HydrophobicContact CB-CE2 4.36Å; R127-Y131 WeakPolarHBondContact O-CD2 3.14Å; R127-Y131 PolarHBondContact O-N 3.17Å
128	I	97.4	Very high	95.5	Very high	101 Å²	101	105.2 Å²	105.2	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-48.1	176.1	-69.6	168.4	0	0	0	110	I124 E125 T130 Y131 T132	I124-I128 HydrophobicContact CG2-CD1 3.89Å; I124-I128 HydrophobicContact CG2-CG1 4.4Å; I124-I128 WeakPolarHBondContact O-CG1 3.41Å; I124-I128 PolarHBondContact O-N 2.88Å; E125-I128 WeakPolarHBondContact O-CB 3.33Å; E125-I128 PolarHBondContact O-N 3.32Å; E125-I128 VanDerWaalsContact O-N 3.11Å; I128-T130 VanDerWaalsContact C-N 3.35Å; I128-T130 PolarHBondContact O-N 3.27Å; I128-Y131 PolarHBondContact O-N 2.64Å; I128-T132 WeakPolarHBondContact O-CB 3.48Å; I128-T132 PolarHBondContact O-N 3.47Å; I128-T132 PolarHBondContact O-OG1 3.5Å
129	I	97.5	Very high	95.9	Very high	84 Å²	84	107 Å²	107	43%	0.431	51%	0.514	S	S	.	.	H	α-helix	trans	-59.6	-46.4	176.8	-65.9	167.2	0	0	0	110.7	E125 R127 Y131 T132 N133	E125-I129 HydrophobicContact CG-CD1 4.34Å; E125-I129 WeakPolarHBondContact O-CG1 3.46Å; E125-I129 PolarHBondContact O-N 3.25Å; R127-I129 VanDerWaalsContact C-N 3.35Å; R127-I129 PolarHBondContact O-N 3.3Å; I129-Y131 PolarHBondContact O-N 2.72Å; I129-T132 PolarHBondContact O-N 3.44Å; I129-N133 PolarHBondContact O-N 3.28Å
130	T	97.3	Very high	96.3	Very high	63 Å²	63	101.8 Å²	101.8	39%	0.387	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-47.8	179.1	-60.8	0	0	0	0	112	N126 R127 I128 N133 R134	N126-T130 WeakPolarHBondContact O-CB 3.41Å; N126-T130 PolarHBondContact O-N 2.91Å; N126-T130 PolarHBondContact O-OG1 3.48Å; R127-T130 WeakPolarHBondContact O-CB 3.47Å; R127-T130 PolarHBondContact O-N 3.12Å; I128-T130 VanDerWaalsContact C-N 3.35Å; I128-T130 PolarHBondContact O-N 3.27Å; T130-N133 PolarHBondContact O-N 2.79Å; T130-R134 WeakPolarHBondContact O-CG 3.24Å; T130-R134 PolarHBondContact O-N 3.43Å
131	Y	97.9	Very high	96.7	Very high	134 Å²	134	97.5 Å²	97.5	53%	0.525	49%	0.488	S	S	.	.	H	α-helix	trans	-69.9	-35.5	-180	-72.6	-54.4	0	0	0	112.4	R127 I128 I129 N133 R134 I135	R127-Y131 HydrophobicContact CB-CD2 4.45Å; R127-Y131 HydrophobicContact CB-CE2 4.36Å; R127-Y131 WeakPolarHBondContact O-CD2 3.14Å; R127-Y131 PolarHBondContact O-N 3.17Å; I128-Y131 PolarHBondContact O-N 2.64Å; I129-Y131 PolarHBondContact O-N 2.72Å; Y131-N133 VanDerWaalsContact C-N 3.35Å; Y131-N133 PolarHBondContact O-N 2.91Å; Y131-R134 PolarHBondContact O-N 2.87Å; Y131-I135 VanDerWaalsContact O-CG1 3.31Å; Y131-I135 WeakPolarHBondContact O-CG1 3.48Å; Y131-I135 PolarHBondContact O-N 2.9Å
132	T	97.7	Very high	97	Very high	72 Å²	72	98.4 Å²	98.4	44%	0.442	49%	0.493	S	S	.	.	H	α-helix	trans	-59.4	-46.9	173.5	-58.4	0	0	0	0	110.9	I128 I129 R134 I135 T136	I128-T132 WeakPolarHBondContact O-CB 3.48Å; I128-T132 PolarHBondContact O-N 3.47Å; I128-T132 PolarHBondContact O-OG1 3.5Å; I129-T132 PolarHBondContact O-N 3.44Å; T132-R134 PolarHBondContact O-N 2.93Å; T132-I135 PolarHBondContact O-N 3.49Å; T132-T136 PolarHBondContact O-N 3.24Å; T132-T136 PolarHBondContact O-OG1 2.94Å; T132-T136 VanDerWaalsContact O-OG1 3.13Å
133	N	97	Very high	97.2	Very high	94 Å²	94	97.1 Å²	97.1	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-42.2	176.1	-72.9	-21	0	0	0	112.3	I129 T130 Y131 I135 T136 I137	I129-N133 PolarHBondContact O-N 3.28Å; T130-N133 PolarHBondContact O-N 2.79Å; Y131-N133 VanDerWaalsContact C-N 3.35Å; Y131-N133 PolarHBondContact O-N 2.91Å; N133-I135 PolarHBondContact O-N 3.33Å; N133-T136 PolarHBondContact O-N 2.76Å; N133-I137 WeakPolarHBondContact O-CG1 3.38Å; N133-I137 PolarHBondContact O-N 2.73Å
134	R	97.9	Very high	97.3	Very high	143 Å²	143	101.5 Å²	101.5	54%	0.54	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-42.8	175.9	-72.8	175.8	179.6	-174.4	0.9	112	T130 Y131 T132 T136 I137 L138	T130-R134 WeakPolarHBondContact O-CG 3.24Å; T130-R134 PolarHBondContact O-N 3.43Å; Y131-R134 PolarHBondContact O-N 2.87Å; T132-R134 PolarHBondContact O-N 2.93Å; R134-T136 VanDerWaalsContact C-N 3.32Å; R134-T136 PolarHBondContact O-N 3.06Å; R134-I137 PolarHBondContact O-N 3.31Å; R134-L138 WeakPolarHBondContact O-CB 3.16Å; R134-L138 WeakPolarHBondContact O-CG 3.23Å; R134-L138 PolarHBondContact O-N 3.29Å
135	I	97.8	Very high	97.5	Very high	90 Å²	90	102.2 Å²	102.2	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-43.1	176.6	-71.6	166.7	0	0	0	110.6	Y131 T132 N133 I137 L138 K139	Y131-I135 VanDerWaalsContact O-CG1 3.31Å; Y131-I135 WeakPolarHBondContact O-CG1 3.48Å; Y131-I135 PolarHBondContact O-N 2.9Å; T132-I135 PolarHBondContact O-N 3.49Å; N133-I135 PolarHBondContact O-N 3.33Å; I135-I137 PolarHBondContact O-N 3.36Å; I135-L138 PolarHBondContact O-N 3.15Å; I135-K139 HydrophobicContact CG2-CD 4.29Å; I135-K139 WeakPolarHBondContact O-CG 3.49Å; I135-K139 PolarHBondContact O-N 3.47Å
136	T	97.5	Very high	97.5	Very high	78 Å²	78	101.8 Å²	101.8	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-42.2	177.5	-57	0	0	0	0	112.4	T132 N133 R134 K139 T140	T132-T136 PolarHBondContact O-N 3.24Å; T132-T136 PolarHBondContact O-OG1 2.94Å; T132-T136 VanDerWaalsContact O-OG1 3.13Å; N133-T136 PolarHBondContact O-N 2.76Å; R134-T136 VanDerWaalsContact C-N 3.32Å; R134-T136 PolarHBondContact O-N 3.06Å; T136-K139 PolarHBondContact O-N 3.02Å; T136-T140 PolarHBondContact O-N 2.9Å; T136-T140 VanDerWaalsContact O-N 3.11Å; T136-T140 PolarHBondContact O-OG1 3.43Å
137	I	97.3	Very high	97.6	Very high	109 Å²	109	103.6 Å²	103.6	56%	0.559	51%	0.51	S	S	*	.	H	α-helix	trans	-63.8	-46.7	174.9	-65.4	166.6	0	0	0	110.4	N133 R134 I135 K139 T140 C141	N133-I137 WeakPolarHBondContact O-CG1 3.38Å; N133-I137 PolarHBondContact O-N 2.73Å; R134-I137 PolarHBondContact O-N 3.31Å; I135-I137 PolarHBondContact O-N 3.36Å; I137-K139 VanDerWaalsContact C-N 3.34Å; I137-K139 PolarHBondContact O-N 3.1Å; I137-T140 WeakPolarHBondContact O-CA 3.17Å; I137-T140 WeakPolarHBondContact O-CB 3.45Å; I137-T140 PolarHBondContact O-N 3.04Å; I137-C141 PolarHBondContact O-N 2.92Å
138	L	97.9	Very high	97.6	Very high	118 Å²	118	100.2 Å²	100.2	62%	0.618	50%	0.501	S	S	*	.	H	α-helix	trans	-60.8	-41	179.3	-73.7	172.3	0	0	0	112.3	R134 I135 T140 C141 L142	R134-L138 WeakPolarHBondContact O-CB 3.16Å; R134-L138 WeakPolarHBondContact O-CG 3.23Å; R134-L138 PolarHBondContact O-N 3.29Å; I135-L138 PolarHBondContact O-N 3.15Å; L138-T140 VanDerWaalsContact C-N 3.3Å; L138-T140 PolarHBondContact O-N 3.47Å; L138-C141 PolarHBondContact O-N 3.28Å; L138-L142 WeakPolarHBondContact O-CB 3.5Å; L138-L142 PolarHBondContact O-N 2.92Å
139	K	97.8	Very high	97.6	Very high	139 Å²	139	98.5 Å²	98.5	60%	0.604	50%	0.495	S	S	*	.	H	α-helix	trans	-60.3	-39.5	172.7	-75.1	179.4	176.1	-177.2	0	112.1	I135 T136 I137 L142 T143	I135-K139 HydrophobicContact CG2-CD 4.29Å; I135-K139 WeakPolarHBondContact O-CG 3.49Å; I135-K139 PolarHBondContact O-N 3.47Å; T136-K139 PolarHBondContact O-N 3.02Å; I137-K139 VanDerWaalsContact C-N 3.34Å; I137-K139 PolarHBondContact O-N 3.1Å; K139-L142 PolarHBondContact O-N 3.15Å; K139-T143 WeakPolarHBondContact O-CG2 3.48Å; K139-T143 PolarHBondContact O-N 3.38Å; K139-T143 VanDerWaalsContact O-N 3.12Å; K139-T143 PolarHBondContact O-OG1 3.02Å
140	T	97.5	Very high	97.6	Very high	66 Å²	66	97.4 Å²	97.4	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-67.8	-37.1	176.3	-54.1	0	0	0	0	111.8	T136 I137 L138 T143 K144	T136-T140 PolarHBondContact O-N 2.9Å; T136-T140 VanDerWaalsContact O-N 3.11Å; T136-T140 PolarHBondContact O-OG1 3.43Å; I137-T140 WeakPolarHBondContact O-CA 3.17Å; I137-T140 WeakPolarHBondContact O-CB 3.45Å; I137-T140 PolarHBondContact O-N 3.04Å; L138-T140 VanDerWaalsContact C-N 3.3Å; L138-T140 PolarHBondContact O-N 3.47Å; T140-T143 PolarHBondContact O-OG1 3.3Å; T140-K144 WeakPolarHBondContact O-CG 3.29Å; T140-K144 PolarHBondContact O-N 3.36Å
141	C	97.1	Very high	97.6	Very high	56 Å²	56	99 Å²	99	38%	0.378	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-41.8	173.8	-69.8	0	0	0	0	111.8	I137 L138 T143 K144 I145	I137-C141 PolarHBondContact O-N 2.92Å; L138-C141 PolarHBondContact O-N 3.28Å; C141-T143 PolarHBondContact O-N 3.41Å; C141-K144 WeakPolarHBondContact O-CB 2.96Å; C141-K144 PolarHBondContact O-N 3.36Å; C141-I145 WeakPolarHBondContact O-CG1 3.38Å; C141-I145 PolarHBondContact O-N 3.23Å
142	L	97.9	Very high	97.6	Very high	94 Å²	94	97.4 Å²	97.4	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-57.8	-49.6	177.6	179.9	62.6	0	0	0	111.4	L138 K139 K144 I145 E146	L138-L142 WeakPolarHBondContact O-CB 3.5Å; L138-L142 PolarHBondContact O-N 2.92Å; K139-L142 PolarHBondContact O-N 3.15Å; L142-K144 VanDerWaalsContact C-N 3.28Å; L142-K144 PolarHBondContact O-N 3.26Å; L142-I145 PolarHBondContact O-N 3.49Å; L142-I145 VanDerWaalsContact O-N 3.08Å; L142-E146 HydrophobicContact CD1-CG 4.45Å; L142-E146 WeakPolarHBondContact O-CG 3.4Å; L142-E146 PolarHBondContact O-N 2.89Å
143	T	97.7	Very high	97.6	Very high	80 Å²	80	98.3 Å²	98.3	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-33.9	178.8	54.5	0	0	0	0	112.9	K139 T140 C141 K147	K139-T143 WeakPolarHBondContact O-CG2 3.48Å; K139-T143 PolarHBondContact O-N 3.38Å; K139-T143 VanDerWaalsContact O-N 3.12Å; K139-T143 PolarHBondContact O-OG1 3.02Å; T140-T143 PolarHBondContact O-OG1 3.3Å; C141-T143 PolarHBondContact O-N 3.41Å; T143-K147 WeakPolarHBondContact O-CB 3.34Å; T143-K147 PolarHBondContact O-N 3.27Å; T143-K147 VanDerWaalsContact O-N 3.11Å
144	K	97.6	Very high	97.6	Very high	137 Å²	137	96.8 Å²	96.8	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-65.9	-44.9	172.3	-73.4	177.1	-179.5	179.7	0	111.9	T140 C141 L142 E146 K147 E148	T140-K144 WeakPolarHBondContact O-CG 3.29Å; T140-K144 PolarHBondContact O-N 3.36Å; C141-K144 WeakPolarHBondContact O-CB 2.96Å; C141-K144 PolarHBondContact O-N 3.36Å; L142-K144 VanDerWaalsContact C-N 3.28Å; L142-K144 PolarHBondContact O-N 3.26Å; K144-E146 VanDerWaalsContact C-N 3.35Å; K144-K147 PolarHBondContact O-N 2.7Å; K144-E148 PolarHBondContact O-N 3.3Å
145	I	97.8	Very high	97.6	Very high	106 Å²	106	94.6 Å²	94.6	54%	0.544	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-43.4	178.3	-69.8	168.6	0	0	0	110.6	C141 L142 K147 E148 T149	C141-I145 WeakPolarHBondContact O-CG1 3.38Å; C141-I145 PolarHBondContact O-N 3.23Å; L142-I145 PolarHBondContact O-N 3.49Å; L142-I145 VanDerWaalsContact O-N 3.08Å; I145-K147 VanDerWaalsContact C-N 3.33Å; I145-K147 PolarHBondContact O-N 3.25Å; I145-E148 PolarHBondContact O-N 3.48Å; I145-T149 WeakPolarHBondContact O-CB 3.48Å; I145-T149 PolarHBondContact O-N 3.26Å; I145-T149 PolarHBondContact O-OG1 3.07Å
146	E	97.9	Very high	97.6	Very high	110 Å²	110	94 Å²	94	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-59.8	-43.1	176.2	-71.5	171.5	161.2	0	0	111.6	L142 K144 T149 A150	L142-E146 HydrophobicContact CD1-CG 4.45Å; L142-E146 WeakPolarHBondContact O-CG 3.4Å; L142-E146 PolarHBondContact O-N 2.89Å; K144-E146 VanDerWaalsContact C-N 3.35Å; E146-T149 PolarHBondContact O-N 3.08Å; E146-A150 PolarHBondContact O-N 2.95Å
147	K	97.9	Very high	97.6	Very high	138 Å²	138	94.6 Å²	94.6	60%	0.6	50%	0.497	S	S	*	.	H	α-helix	trans	-63.3	-44.8	176.2	-174.6	178.5	-178.7	177.4	0	112.6	T143 K144 I145 A150 K151	T143-K147 WeakPolarHBondContact O-CB 3.34Å; T143-K147 PolarHBondContact O-N 3.27Å; T143-K147 VanDerWaalsContact O-N 3.11Å; K144-K147 PolarHBondContact O-N 2.7Å; I145-K147 VanDerWaalsContact C-N 3.33Å; I145-K147 PolarHBondContact O-N 3.25Å; K147-A150 PolarHBondContact O-N 3.14Å; K147-K151 WeakPolarHBondContact O-CG 3.25Å; K147-K151 PolarHBondContact O-N 2.94Å
148	E	97.2	Very high	97.6	Very high	93 Å²	93	94 Å²	94	44%	0.435	50%	0.495	S	S	.	.	H	α-helix	trans	-67.5	-37.5	177.1	-66.2	-51	133.7	0	0	111.7	K144 I145 A150 K151 I152	K144-E148 PolarHBondContact O-N 3.3Å; I145-E148 PolarHBondContact O-N 3.48Å; E148-A150 VanDerWaalsContact C-N 3.35Å; E148-A150 PolarHBondContact O-N 3.42Å; E148-K151 WeakPolarHBondContact O-CB 3.36Å; E148-K151 PolarHBondContact O-N 2.7Å; E148-K151 IonicContact OE1-NZ 2.69Å; E148-K151 PolarHBondContact OE1-NZ 3.44Å; E148-K151 WeakPolarHBondContact OE2-CD 3.32Å; E148-K151 IonicContact OE2-NZ 3.26Å; E148-K151 PolarHBondContact OE2-NZ 3.17Å; E148-I152 WeakPolarHBondContact O-CG1 3.47Å; E148-I152 PolarHBondContact O-N 3.24Å
149	T	97.4	Very high	97.6	Very high	65 Å²	65	93.5 Å²	93.5	40%	0.399	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175	-56.4	0	0	0	0	111.3	I145 E146 K151 I152 N153	I145-T149 WeakPolarHBondContact O-CB 3.48Å; I145-T149 PolarHBondContact O-N 3.26Å; I145-T149 PolarHBondContact O-OG1 3.07Å; E146-T149 PolarHBondContact O-N 3.08Å; T149-K151 VanDerWaalsContact C-N 3.33Å; T149-K151 PolarHBondContact O-N 3.05Å; T149-I152 PolarHBondContact O-N 2.75Å; T149-N153 PolarHBondContact O-N 3.09Å
150	A	97.4	Very high	97.6	Very high	60 Å²	60	93 Å²	93	50%	0.496	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-39.3	175.7	0	0	0	0	0	112.6	E146 K147 E148 N153 S154	E146-A150 PolarHBondContact O-N 2.95Å; K147-A150 PolarHBondContact O-N 3.14Å; E148-A150 VanDerWaalsContact C-N 3.35Å; E148-A150 PolarHBondContact O-N 3.42Å; A150-N153 PolarHBondContact O-N 3.35Å; A150-S154 PolarHBondContact O-N 3.41Å; A150-S154 VanDerWaalsContact O-N 3.12Å
151	K	97.7	Very high	97.5	Very high	98 Å²	98	94.6 Å²	94.6	43%	0.426	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-44.9	174.6	-68	173.4	-175.1	171.1	0	112	K147 E148 T149 N153 S154 I155	K147-K151 WeakPolarHBondContact O-CG 3.25Å; K147-K151 PolarHBondContact O-N 2.94Å; E148-K151 WeakPolarHBondContact O-CB 3.36Å; E148-K151 PolarHBondContact O-N 2.7Å; E148-K151 IonicContact OE1-NZ 2.69Å; E148-K151 PolarHBondContact OE1-NZ 3.44Å; E148-K151 WeakPolarHBondContact OE2-CD 3.32Å; E148-K151 IonicContact OE2-NZ 3.26Å; E148-K151 PolarHBondContact OE2-NZ 3.17Å; T149-K151 VanDerWaalsContact C-N 3.33Å; T149-K151 PolarHBondContact O-N 3.05Å; K151-N153 VanDerWaalsContact C-N 3.32Å; K151-N153 PolarHBondContact O-N 2.99Å; K151-S154 WeakPolarHBondContact O-CB 3.27Å; K151-S154 PolarHBondContact O-N 3.4Å; K151-I155 WeakPolarHBondContact O-CG1 3.28Å; K151-I155 PolarHBondContact O-N 3.29Å
152	I	97.6	Very high	97.5	Very high	100 Å²	100	98 Å²	98	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-59.7	-45.6	178	-69.6	168.6	0	0	0	110.1	E148 T149 S154 I155 V156	E148-I152 WeakPolarHBondContact O-CG1 3.47Å; E148-I152 PolarHBondContact O-N 3.24Å; T149-I152 PolarHBondContact O-N 2.75Å; I152-S154 VanDerWaalsContact C-N 3.32Å; I152-S154 PolarHBondContact O-N 3.08Å; I152-I155 PolarHBondContact O-N 3.32Å; I152-I155 VanDerWaalsContact O-N 3.11Å; I152-V156 HydrophobicContact CG2-CG2 4.3Å; I152-V156 WeakPolarHBondContact O-CG2 3.38Å; I152-V156 PolarHBondContact O-N 2.94Å
153	N	97.6	Very high	97.4	Very high	90 Å²	90	99.6 Å²	99.6	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-59.3	-42.7	177.5	-72.6	-20	0	0	0	112	T149 A150 K151 I155 V156 D157	T149-N153 PolarHBondContact O-N 3.09Å; A150-N153 PolarHBondContact O-N 3.35Å; K151-N153 VanDerWaalsContact C-N 3.32Å; K151-N153 PolarHBondContact O-N 2.99Å; N153-I155 VanDerWaalsContact C-N 3.34Å; N153-I155 PolarHBondContact O-N 3Å; N153-V156 PolarHBondContact O-N 3.25Å; N153-D157 PolarHBondContact O-N 3.49Å
154	S	97.5	Very high	97.2	Very high	63 Å²	63	99.2 Å²	99.2	44%	0.441	51%	0.506	S	S	.	.	H	α-helix	trans	-60.8	-40.2	174.5	177.9	0	0	0	0	112.8	A150 K151 I152 D157 N158	A150-S154 PolarHBondContact O-N 3.41Å; A150-S154 VanDerWaalsContact O-N 3.12Å; K151-S154 WeakPolarHBondContact O-CB 3.27Å; K151-S154 PolarHBondContact O-N 3.4Å; I152-S154 VanDerWaalsContact C-N 3.32Å; I152-S154 PolarHBondContact O-N 3.08Å; S154-D157 PolarHBondContact O-N 3.39Å; S154-N158 WeakPolarHBondContact O-CB 3.33Å; S154-N158 PolarHBondContact O-N 3.12Å; S154-N158 PolarHBondContact O-ND2 2.47Å
155	I	97.5	Very high	97	Very high	97 Å²	97	98.5 Å²	98.5	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-43.8	175.4	-66.4	167.3	0	0	0	110.8	K151 I152 N153 D157 N158 I159	K151-I155 WeakPolarHBondContact O-CG1 3.28Å; K151-I155 PolarHBondContact O-N 3.29Å; I152-I155 PolarHBondContact O-N 3.32Å; I152-I155 VanDerWaalsContact O-N 3.11Å; N153-I155 VanDerWaalsContact C-N 3.34Å; N153-I155 PolarHBondContact O-N 3Å; I155-D157 VanDerWaalsContact C-N 3.34Å; I155-D157 PolarHBondContact O-N 3.41Å; I155-N158 PolarHBondContact O-N 2.81Å; I155-I159 HydrophobicContact CG2-CD1 3.81Å; I155-I159 HydrophobicContact CG2-CG1 4.39Å; I155-I159 WeakPolarHBondContact O-CG1 3.4Å; I155-I159 PolarHBondContact O-N 2.87Å
156	V	97.9	Very high	96.8	Very high	78 Å²	78	97.3 Å²	97.3	47%	0.473	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-44.7	177.5	170.1	0	0	0	0	110.9	I152 N153 I159 K160	I152-V156 HydrophobicContact CG2-CG2 4.3Å; I152-V156 WeakPolarHBondContact O-CG2 3.38Å; I152-V156 PolarHBondContact O-N 2.94Å; N153-V156 PolarHBondContact O-N 3.25Å; V156-I159 PolarHBondContact O-N 3.28Å; V156-K160 WeakPolarHBondContact O-CB 3.26Å; V156-K160 PolarHBondContact O-N 3.48Å
157	D	97.5	Very high	96.5	Very high	90 Å²	90	95 Å²	95	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-42.5	176.4	-72.9	-26.5	0	0	0	111.7	N153 S154 I155 I159 K160 N161	N153-D157 PolarHBondContact O-N 3.49Å; S154-D157 PolarHBondContact O-N 3.39Å; I155-D157 VanDerWaalsContact C-N 3.34Å; I155-D157 PolarHBondContact O-N 3.41Å; D157-I159 PolarHBondContact O-N 3.39Å; D157-K160 PolarHBondContact O-N 2.81Å; D157-N161 WeakPolarHBondContact O-CB 3.39Å; D157-N161 VanDerWaalsContact O-CG 3.23Å; D157-N161 PolarHBondContact O-N 3.5Å; D157-N161 PolarHBondContact O-ND2 3.3Å
158	N	97.5	Very high	96.2	Very high	96 Å²	96	93.8 Å²	93.8	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-61.8	-43.3	175.5	-73.3	-23.5	0	0	0	112.4	S154 I155 N161 M162	S154-N158 WeakPolarHBondContact O-CB 3.33Å; S154-N158 PolarHBondContact O-N 3.12Å; S154-N158 PolarHBondContact O-ND2 2.47Å; I155-N158 PolarHBondContact O-N 2.81Å; N158-N161 PolarHBondContact O-N 3.01Å; N158-M162 WeakPolarHBondContact O-CB 3.26Å; N158-M162 PolarHBondContact O-N 2.92Å
159	I	97.6	Very high	96	Very high	108 Å²	108	91.7 Å²	91.7	55%	0.554	48%	0.479	S	S	*	.	H	α-helix	trans	-64.2	-41.8	176.3	-69.5	168.9	0	0	0	110.5	I155 V156 D157 M162 K163	I155-I159 HydrophobicContact CG2-CD1 3.81Å; I155-I159 HydrophobicContact CG2-CG1 4.39Å; I155-I159 WeakPolarHBondContact O-CG1 3.4Å; I155-I159 PolarHBondContact O-N 2.87Å; V156-I159 PolarHBondContact O-N 3.28Å; D157-I159 PolarHBondContact O-N 3.39Å; I159-M162 PolarHBondContact O-N 3.46Å; I159-K163 WeakPolarHBondContact O-CB 3.44Å; I159-K163 PolarHBondContact O-N 2.93Å
160	K	97.3	Very high	95.8	Very high	129 Å²	129	89 Å²	89	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-62.5	-43	176.8	-171.6	179	179.3	-176.9	0	111.4	V156 D157 K163 N164	V156-K160 WeakPolarHBondContact O-CB 3.26Å; V156-K160 PolarHBondContact O-N 3.48Å; D157-K160 PolarHBondContact O-N 2.81Å; K160-K163 PolarHBondContact O-N 2.89Å; K160-N164 WeakPolarHBondContact O-CB 3.48Å; K160-N164 VanDerWaalsContact O-CG 3.25Å; K160-N164 PolarHBondContact O-N 3.4Å; K160-N164 PolarHBondContact O-ND2 3.21Å
161	N	96.7	Very high	95.6	Very high	99 Å²	99	91.8 Å²	91.8	53%	0.529	47%	0.465	S	S	.	.	H	α-helix	trans	-63.6	-43.8	175.2	-71.1	-21.4	0	0	0	111.7	D157 N158 N164 H165	D157-N161 WeakPolarHBondContact O-CB 3.39Å; D157-N161 VanDerWaalsContact O-CG 3.23Å; D157-N161 PolarHBondContact O-N 3.5Å; D157-N161 PolarHBondContact O-ND2 3.3Å; N158-N161 PolarHBondContact O-N 3.01Å; N161-N164 PolarHBondContact O-N 3.11Å; N161-H165 WeakPolarHBondContact O-CB 3.43Å; N161-H165 PolarHBondContact O-N 2.93Å
162	M	96.2	Very high	95.4	Very high	126 Å²	126	93.4 Å²	93.4	62%	0.621	48%	0.478	S	S	*	.	H	α-helix	trans	-62.7	-44.2	176.3	-172.6	-179.3	-67.6	0	0	111.7	N158 I159 N164 H165 I166	N158-M162 WeakPolarHBondContact O-CB 3.26Å; N158-M162 PolarHBondContact O-N 2.92Å; I159-M162 PolarHBondContact O-N 3.46Å; M162-N164 PolarHBondContact O-N 3.34Å; M162-H165 PolarHBondContact O-N 2.84Å; M162-I166 HydrophobicContact CG-CD1 4.12Å; M162-I166 WeakPolarHBondContact O-CG1 3.14Å; M162-I166 PolarHBondContact O-N 2.96Å
163	K	95.1	Very high	95	Very high	129 Å²	129	93.4 Å²	93.4	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-58.7	-46.6	174.7	179.6	-178.4	176.7	179.2	0	111.5	I159 K160 H165 I166 N167	I159-K163 WeakPolarHBondContact O-CB 3.44Å; I159-K163 PolarHBondContact O-N 2.93Å; K160-K163 PolarHBondContact O-N 2.89Å; K163-H165 VanDerWaalsContact C-N 3.33Å; K163-H165 PolarHBondContact O-N 3.19Å; K163-I166 PolarHBondContact O-N 2.75Å; K163-N167 PolarHBondContact O-N 3.31Å
164	N	93.8	Very high	94.6	Very high	72 Å²	72	94.7 Å²	94.7	39%	0.385	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-42.1	177.1	-72.1	-14.5	0	0	0	111.4	K160 N161 M162 N167 Q168	K160-N164 WeakPolarHBondContact O-CB 3.48Å; K160-N164 VanDerWaalsContact O-CG 3.25Å; K160-N164 PolarHBondContact O-N 3.4Å; K160-N164 PolarHBondContact O-ND2 3.21Å; N161-N164 PolarHBondContact O-N 3.11Å; M162-N164 PolarHBondContact O-N 3.34Å; N164-N167 PolarHBondContact O-N 2.99Å; N164-Q168 WeakPolarHBondContact O-CB 3.3Å; N164-Q168 VanDerWaalsContact O-CG 3.28Å; N164-Q168 WeakPolarHBondContact O-CG 3.48Å; N164-Q168 PolarHBondContact O-N 3Å
165	H	93.9	Very high	94.2	Very high	121 Å²	121	94.9 Å²	94.9	56%	0.56	49%	0.494	S	S	*	.	H	α-helix	trans	-63.8	-43.2	176.7	-170.9	-6.3	0	0	0	111.8	N161 M162 K163 Q168 T169	N161-H165 WeakPolarHBondContact O-CB 3.43Å; N161-H165 PolarHBondContact O-N 2.93Å; M162-H165 PolarHBondContact O-N 2.84Å; K163-H165 VanDerWaalsContact C-N 3.33Å; K163-H165 PolarHBondContact O-N 3.19Å; H165-Q168 PolarHBondContact O-N 2.89Å; H165-T169 PolarHBondContact CE1-OG1 3.47Å; H165-T169 PolarHBondContact ND1-OG1 2.76Å; H165-T169 WeakPolarHBondContact O-CB 3.48Å; H165-T169 PolarHBondContact O-N 3.39Å; H165-T169 PolarHBondContact O-OG1 3.23Å
166	I	93.1	Very high	93.8	Very high	81 Å²	81	91 Å²	91	42%	0.415	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-48.5	175.6	-70.7	166.7	0	0	0	110.2	M162 K163 Q168 T169 L170	M162-I166 HydrophobicContact CG-CD1 4.12Å; M162-I166 WeakPolarHBondContact O-CG1 3.14Å; M162-I166 PolarHBondContact O-N 2.96Å; K163-I166 PolarHBondContact O-N 2.75Å; I166-Q168 PolarHBondContact O-N 3.38Å; I166-T169 PolarHBondContact O-N 2.96Å; I166-L170 HydrophobicContact CG2-CD1 3.86Å; I166-L170 HydrophobicContact CG2-CG 4.3Å; I166-L170 VanDerWaalsContact O-CG 3.31Å; I166-L170 WeakPolarHBondContact O-CG 3.47Å; I166-L170 PolarHBondContact O-N 2.84Å
167	N	91.6	Very high	93.4	Very high	61 Å²	61	94.8 Å²	94.8	33%	0.326	49%	0.485	S	S	.	.	H	α-helix	trans	-60.9	-44.6	179	-72.4	-7.6	0	0	0	111.9	K163 N164 T169 L170 E171	K163-N167 PolarHBondContact O-N 3.31Å; N164-N167 PolarHBondContact O-N 2.99Å; N167-T169 VanDerWaalsContact C-N 3.33Å; N167-T169 PolarHBondContact O-N 3.47Å; N167-L170 PolarHBondContact O-N 3.23Å; N167-E171 WeakPolarHBondContact O-CG 3.49Å; N167-E171 PolarHBondContact O-N 3.41Å
168	Q	92.6	Very high	92.9	Very high	114 Å²	114	92.2 Å²	92.2	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175	-75.1	174.1	-11.6	0	0	112	N164 H165 I166 N172	N164-Q168 WeakPolarHBondContact O-CB 3.3Å; N164-Q168 VanDerWaalsContact O-CG 3.28Å; N164-Q168 WeakPolarHBondContact O-CG 3.48Å; N164-Q168 PolarHBondContact O-N 3Å; H165-Q168 PolarHBondContact O-N 2.89Å; I166-Q168 PolarHBondContact O-N 3.38Å; Q168-N172 WeakPolarHBondContact O-CB 3.12Å; Q168-N172 PolarHBondContact O-N 2.9Å; Q168-N172 PolarHBondContact O-ND2 2.79Å
169	T	93.4	Very high	92.6	Very high	48 Å²	48	91.4 Å²	91.4	29%	0.294	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-41.3	177.3	-60.3	0	0	0	0	111.4	H165 I166 N167 V173 Y174	H165-T169 PolarHBondContact CE1-OG1 3.47Å; H165-T169 PolarHBondContact ND1-OG1 2.76Å; H165-T169 WeakPolarHBondContact O-CB 3.48Å; H165-T169 PolarHBondContact O-N 3.39Å; H165-T169 PolarHBondContact O-OG1 3.23Å; I166-T169 PolarHBondContact O-N 2.96Å; N167-T169 VanDerWaalsContact C-N 3.33Å; N167-T169 PolarHBondContact O-N 3.47Å; T169-V173 HydrophobicContact CG2-CB 4.42Å; T169-V173 HydrophobicContact CG2-CG2 4Å; T169-V173 VanDerWaalsContact O-CB 3.24Å; T169-V173 WeakPolarHBondContact O-CB 3.43Å; T169-V173 PolarHBondContact O-N 2.87Å; T169-Y174 HydrophobicContact CG2-CE2 4.4Å
170	L	92.9	Very high	92.3	Very high	10 Å²	10	92 Å²	92	5%	0.052	48%	0.476	C	S	.	.	I	π-helix	trans	-60.4	-46.8	175.9	-72	170.1	0	0	0	111.4	I166 N167 Y174 G175 V176 V179 L182	I166-L170 HydrophobicContact CG2-CD1 3.86Å; I166-L170 HydrophobicContact CG2-CG 4.3Å; I166-L170 VanDerWaalsContact O-CG 3.31Å; I166-L170 WeakPolarHBondContact O-CG 3.47Å; I166-L170 PolarHBondContact O-N 2.84Å; N167-L170 PolarHBondContact O-N 3.23Å; L170-Y174 HydrophobicContact CD2-CD2 4.4Å; L170-Y174 CarbonylContact O-C 3.55Å; L170-Y174 WeakPolarHBondContact O-CB 3.48Å; L170-Y174 PolarHBondContact O-N 3.36Å; L170-G175 PolarHBondContact O-N 3.23Å; L170-V176 CarbonylContact C-O 3.53Å; L170-V176 HydrophobicContact CB-CG2 4.17Å; L170-V176 HydrophobicContact CD2-CG2 3.93Å; L170-V176 PolarHBondContact O-N 2.95Å; L170-V179 HydrophobicContact CD1-CG2 3.9Å; L170-V179 HydrophobicContact CD2-CG2 4.48Å; L170-L182 HydrophobicContact CD2-CB 4.35Å; L170-L182 HydrophobicContact CD2-CD2 3.87Å
171	E	92.4	Very high	91.9	Very high	117 Å²	117	90 Å²	90	55%	0.547	47%	0.469	S	S	.	.	I	π-helix	trans	-68.9	-49.3	179.4	-71.2	-179.8	174.9	0	0	112	N167 G175 V176	N167-E171 WeakPolarHBondContact O-CG 3.49Å; N167-E171 PolarHBondContact O-N 3.41Å; E171-G175 WeakPolarHBondContact O-CA 3.5Å; E171-G175 PolarHBondContact O-N 2.98Å; E171-V176 PolarHBondContact N-O 3.23Å
172	N	92.8	Very high	91.7	Very high	132 Å²	132	86.4 Å²	86.4	71%	0.706	45%	0.45	S	S	*	.	I	π-helix	trans	-77	-37.8	-172	-68.2	-26	0	0	0	113.9	Q168	Q168-N172 WeakPolarHBondContact O-CB 3.12Å; Q168-N172 PolarHBondContact O-N 2.9Å; Q168-N172 PolarHBondContact O-ND2 2.79Å
173	V	90.8	Very high	91.5	Very high	100 Å²	100	83.9 Å²	83.9	61%	0.606	44%	0.443	S	S	*	.	I	π-helix	trans	-94.4	-43.2	-174.2	-177.9	0	0	0	0	111.3	T169	T169-V173 HydrophobicContact CG2-CB 4.42Å; T169-V173 HydrophobicContact CG2-CG2 4Å; T169-V173 VanDerWaalsContact O-CB 3.24Å; T169-V173 WeakPolarHBondContact O-CB 3.43Å; T169-V173 PolarHBondContact O-N 2.87Å
174	Y	88.6	Confident	91.4	Very high	118 Å²	118	82.9 Å²	82.9	46%	0.463	44%	0.443	S	S	.	.	I	π-helix	trans	-103.9	-15.6	-171.5	-62.1	-76	0	0	0	113.6	T169 L170 V176 L182	T169-Y174 HydrophobicContact CG2-CE2 4.4Å; L170-Y174 HydrophobicContact CD2-CD2 4.4Å; L170-Y174 CarbonylContact O-C 3.55Å; L170-Y174 WeakPolarHBondContact O-CB 3.48Å; L170-Y174 PolarHBondContact O-N 3.36Å; Y174-V176 VanDerWaalsContact C-N 3.25Å; Y174-V176 PolarHBondContact O-N 3.44Å; Y174-L182 HydrophobicContact CD1-CD1 3.53Å; Y174-L182 HydrophobicContact CD1-CD2 4.42Å; Y174-L182 HydrophobicContact CD2-CD1 4.48Å; Y174-L182 HydrophobicContact CD2-CD2 4.2Å; Y174-L182 HydrophobicContact CE1-CD1 4.14Å; Y174-L182 HydrophobicContact CE1-CD2 4.5Å; Y174-L182 HydrophobicContact CE2-CD2 4.29Å; Y174-L182 HydrophobicContact CG-CD1 3.72Å; Y174-L182 HydrophobicContact CG-CD2 4.26Å
175	G	88.7	Confident	91.2	Very high	67 Å²	67	80.7 Å²	80.7	69%	0.691	43%	0.434	S	S	*	.			trans	67.6	25.8	-177.5	0	0	0	0	0	113.3	L170 E171	L170-G175 PolarHBondContact O-N 3.23Å; E171-G175 WeakPolarHBondContact O-CA 3.5Å; E171-G175 PolarHBondContact O-N 2.98Å
176	V	90.4	Very high	91.1	Very high	14 Å²	14	80.3 Å²	80.3	9%	0.085	43%	0.434	C	S	.	.			trans	-121.7	153.6	-177.8	-60.7	0	0	0	0	110.3	L170 E171 Y174 E181 L182	L170-V176 CarbonylContact C-O 3.53Å; L170-V176 HydrophobicContact CB-CG2 4.17Å; L170-V176 HydrophobicContact CD2-CG2 3.93Å; L170-V176 PolarHBondContact O-N 2.95Å; E171-V176 PolarHBondContact N-O 3.23Å; Y174-V176 VanDerWaalsContact C-N 3.25Å; Y174-V176 PolarHBondContact O-N 3.44Å; V176-E181 HydrophobicContact CB-CB 3.96Å; V176-E181 HydrophobicContact CG1-CB 4.32Å; V176-L182 HydrophobicContact CG2-CB 3.91Å; V176-L182 HydrophobicContact CG2-CD1 4.41Å
177	K	87.5	Confident	91.1	Very high	159 Å²	159	83.5 Å²	83.5	69%	0.691	44%	0.441	S	S	*	.	S	Bend	trans	-94.6	-16	-175.9	-62.7	-179.7	178.6	179.9	0	113.5	E181	K177-E181 WeakPolarHBondContact CB-OE2 3.45Å; K177-E181 PolarHBondContact N-OE2 3.3Å
178	S	88.8	Confident	91.1	Very high	36 Å²	36	86.7 Å²	86.7	25%	0.252	46%	0.455	S	S	.	.	S	Bend	trans	-146.2	161.8	-179.2	73.5	0	0	0	0	112.2	D180 E181 L182	S178-D180 PolarHBondContact O-N 3.01Å; S178-D180 PolarHBondContact OG-N 3.05Å; S178-E181 PolarHBondContact O-N 2.95Å; S178-E181 WeakPolarHBondContact OG-CG 3.37Å; S178-E181 PolarHBondContact OG-N 2.92Å; S178-L182 PolarHBondContact O-N 2.77Å; S178-L182 VanDerWaalsContact O-N 3.08Å
179	V	89.7	Confident	91	Very high	78 Å²	78	87.8 Å²	87.8	47%	0.473	45%	0.454	S	S	.	.	H	α-helix	trans	-62.6	-35	171.4	-179.4	0	0	0	0	110.4	L170 L182 C183	L170-V179 HydrophobicContact CD1-CG2 3.9Å; L170-V179 HydrophobicContact CD2-CG2 4.48Å; V179-L182 WeakPolarHBondContact O-CB 3.49Å; V179-L182 PolarHBondContact O-N 3.4Å; V179-C183 PolarHBondContact O-N 3.15Å; V179-C183 PolarHBondContact O-SG 2.84Å; V179-C183 VanDerWaalsContact O-SG 3.32Å
180	D	91.1	Very high	91.1	Very high	121 Å²	121	89.5 Å²	89.5	65%	0.647	46%	0.461	S	S	*	.	H	α-helix	trans	-65	-41.7	177.5	-59.3	-40.7	0	0	0	111.8	S178 L182 C183 L184	S178-D180 PolarHBondContact O-N 3.01Å; S178-D180 PolarHBondContact OG-N 3.05Å; D180-L182 VanDerWaalsContact C-N 3.33Å; D180-L182 PolarHBondContact O-N 3.33Å; D180-C183 PolarHBondContact O-N 3.09Å; D180-L184 WeakPolarHBondContact O-CG 3.45Å; D180-L184 PolarHBondContact O-N 3.24Å
181	E	90.3	Very high	91	Very high	87 Å²	87	91.5 Å²	91.5	41%	0.407	47%	0.472	S	S	.	.	H	α-helix	trans	-63.2	-39.4	173.2	-77.4	-179	-173.2	0	0	111.6	V176 K177 S178 S185	V176-E181 HydrophobicContact CB-CB 3.96Å; V176-E181 HydrophobicContact CG1-CB 4.32Å; K177-E181 WeakPolarHBondContact CB-OE2 3.45Å; K177-E181 PolarHBondContact N-OE2 3.3Å; S178-E181 PolarHBondContact O-N 2.95Å; S178-E181 WeakPolarHBondContact OG-CG 3.37Å; S178-E181 PolarHBondContact OG-N 2.92Å; E181-S185 WeakPolarHBondContact O-CB 3.41Å; E181-S185 PolarHBondContact O-N 2.59Å
182	L	92.1	Very high	91	Very high	24 Å²	24	88.8 Å²	88.8	13%	0.126	47%	0.466	C	S	.	.	H	α-helix	trans	-60.6	-48.7	174.2	-176.5	56.4	0	0	0	111.3	L170 Y174 V176 S178 V179 D180 L184 S185 M186	L170-L182 HydrophobicContact CD2-CB 4.35Å; L170-L182 HydrophobicContact CD2-CD2 3.87Å; Y174-L182 HydrophobicContact CD1-CD1 3.53Å; Y174-L182 HydrophobicContact CD1-CD2 4.42Å; Y174-L182 HydrophobicContact CD2-CD1 4.48Å; Y174-L182 HydrophobicContact CD2-CD2 4.2Å; Y174-L182 HydrophobicContact CE1-CD1 4.14Å; Y174-L182 HydrophobicContact CE1-CD2 4.5Å; Y174-L182 HydrophobicContact CE2-CD2 4.29Å; Y174-L182 HydrophobicContact CG-CD1 3.72Å; Y174-L182 HydrophobicContact CG-CD2 4.26Å; V176-L182 HydrophobicContact CG2-CB 3.91Å; V176-L182 HydrophobicContact CG2-CD1 4.41Å; S178-L182 PolarHBondContact O-N 2.77Å; S178-L182 VanDerWaalsContact O-N 3.08Å; V179-L182 WeakPolarHBondContact O-CB 3.49Å; V179-L182 PolarHBondContact O-N 3.4Å; D180-L182 VanDerWaalsContact C-N 3.33Å; D180-L182 PolarHBondContact O-N 3.33Å; L182-L184 PolarHBondContact O-N 3.16Å; L182-S185 PolarHBondContact O-N 3.01Å; L182-M186 HydrophobicContact CD1-CG 4.27Å; L182-M186 HydrophobicContact CD1-SD 4.36Å; L182-M186 HydrophobicContact CG-SD 4.26Å; L182-M186 WeakPolarHBondContact O-CG 3.48Å; L182-M186 PolarHBondContact O-N 3.47Å
183	C	92.3	Very high	91	Very high	73 Å²	73	87.4 Å²	87.4	49%	0.493	46%	0.458	S	S	.	.	H	α-helix	trans	-60	-45.9	179.4	-73.9	0	0	0	0	111.9	V179 D180 M186 Y187	V179-C183 PolarHBondContact O-N 3.15Å; V179-C183 PolarHBondContact O-SG 2.84Å; V179-C183 VanDerWaalsContact O-SG 3.32Å; D180-C183 PolarHBondContact O-N 3.09Å; C183-M186 PolarHBondContact O-N 2.9Å; C183-Y187 WeakPolarHBondContact O-CB 3.44Å; C183-Y187 PolarHBondContact O-N 3.47Å
184	L	92.1	Very high	90.9	Very high	107 Å²	107	86.3 Å²	86.3	56%	0.56	45%	0.448	S	S	*	.	H	α-helix	trans	-60.9	-46.6	175.3	-74	167.8	0	0	0	111.3	D180 L182 M186 Y187 E188	D180-L184 WeakPolarHBondContact O-CG 3.45Å; D180-L184 PolarHBondContact O-N 3.24Å; L182-L184 PolarHBondContact O-N 3.16Å; L184-M186 VanDerWaalsContact C-N 3.34Å; L184-M186 PolarHBondContact O-N 3.48Å; L184-Y187 PolarHBondContact O-N 3.1Å; L184-E188 WeakPolarHBondContact O-CG 3.5Å; L184-E188 PolarHBondContact O-N 2.93Å
185	S	89.9	Confident	90.9	Very high	26 Å²	26	89.5 Å²	89.5	18%	0.182	46%	0.459	C	S	.	.	H	α-helix	trans	-61.6	-41.3	178.3	-169.8	0	0	0	0	112.4	E181 L182 R189	E181-S185 WeakPolarHBondContact O-CB 3.41Å; E181-S185 PolarHBondContact O-N 2.59Å; L182-S185 PolarHBondContact O-N 3.01Å; S185-R189 VanDerWaalsContact O-CG 3.32Å; S185-R189 WeakPolarHBondContact O-CG 3.27Å; S185-R189 PolarHBondContact O-N 2.96Å; S185-R189 VanDerWaalsContact O-N 3.07Å; S185-R189 PolarHBondContact OG-NH2 3.1Å
186	M	92	Very high	90.9	Very high	113 Å²	113	91.8 Å²	91.8	56%	0.557	46%	0.455	S	S	*	.	H	α-helix	trans	-65.7	-41.3	175.5	-72.8	-174.3	74.7	0	0	111.9	L182 C183 L184 R189 N190	L182-M186 HydrophobicContact CD1-CG 4.27Å; L182-M186 HydrophobicContact CD1-SD 4.36Å; L182-M186 HydrophobicContact CG-SD 4.26Å; L182-M186 WeakPolarHBondContact O-CG 3.48Å; L182-M186 PolarHBondContact O-N 3.47Å; C183-M186 PolarHBondContact O-N 2.9Å; L184-M186 VanDerWaalsContact C-N 3.34Å; L184-M186 PolarHBondContact O-N 3.48Å; M186-R189 PolarHBondContact O-N 3.25Å; M186-N190 WeakPolarHBondContact O-CB 3.48Å; M186-N190 PolarHBondContact O-N 2.99Å
187	Y	93.4	Very high	90.7	Very high	148 Å²	148	98.6 Å²	98.6	58%	0.58	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-45	177.2	-178	-102.5	0	0	0	112.3	C183 L184 N190 N191	C183-Y187 WeakPolarHBondContact O-CB 3.44Å; C183-Y187 PolarHBondContact O-N 3.47Å; L184-Y187 PolarHBondContact O-N 3.1Å; Y187-N190 PolarHBondContact O-N 3.46Å; Y187-N191 WeakPolarHBondContact CD1-ND2 3.48Å; Y187-N191 WeakPolarHBondContact CE1-ND2 3.5Å; Y187-N191 VanDerWaalsContact CZ-ND2 3.26Å; Y187-N191 PolarHBondContact O-N 3.49Å; Y187-N191 PolarHBondContact O-ND2 2.88Å
188	E	91.8	Very high	90.5	Very high	129 Å²	129	94.3 Å²	94.3	60%	0.603	47%	0.468	S	S	*	.	H	α-helix	trans	-62.5	-41.7	175.9	-72.6	-179.3	168	0	0	112.6	L184 S192	L184-E188 WeakPolarHBondContact O-CG 3.5Å; L184-E188 PolarHBondContact O-N 2.93Å; E188-S192 WeakPolarHBondContact O-CB 3.31Å; E188-S192 PolarHBondContact O-N 3.49Å; E188-S192 PolarHBondContact O-OG 2.86Å
189	R	91.1	Very high	90.3	Very high	137 Å²	137	95.7 Å²	95.7	52%	0.517	47%	0.474	S	S	.	.	H	α-helix	trans	-64.1	-44.5	174.6	-73.7	177.2	-165	146.5	5.1	111.4	S185 M186 N191 S192 I193	S185-R189 VanDerWaalsContact O-CG 3.32Å; S185-R189 WeakPolarHBondContact O-CG 3.27Å; S185-R189 PolarHBondContact O-N 2.96Å; S185-R189 VanDerWaalsContact O-N 3.07Å; S185-R189 PolarHBondContact OG-NH2 3.1Å; M186-R189 PolarHBondContact O-N 3.25Å; R189-N191 PolarHBondContact O-N 3.27Å; R189-S192 WeakPolarHBondContact O-CB 3.13Å; R189-S192 PolarHBondContact O-N 3.32Å; R189-S192 VanDerWaalsContact O-N 3.16Å; R189-I193 WeakPolarHBondContact O-CG1 3.38Å; R189-I193 PolarHBondContact O-N 3.35Å
190	N	93.8	Very high	89.9	Confident	84 Å²	84	97.2 Å²	97.2	45%	0.449	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-44.5	178.9	-169.5	49.4	0	0	0	111.9	M186 Y187 S192 I193 N194	M186-N190 WeakPolarHBondContact O-CB 3.48Å; M186-N190 PolarHBondContact O-N 2.99Å; Y187-N190 PolarHBondContact O-N 3.46Å; N190-S192 VanDerWaalsContact C-N 3.29Å; N190-S192 PolarHBondContact O-N 3.47Å; N190-I193 PolarHBondContact O-N 3.19Å; N190-N194 WeakPolarHBondContact O-CB 3.32Å; N190-N194 PolarHBondContact O-N 2.96Å; N190-N194 PolarHBondContact O-ND2 2.98Å
191	N	92.3	Very high	89.4	Confident	51 Å²	51	94 Å²	94	27%	0.273	47%	0.465	S	S	.	.	H	α-helix	trans	-62.7	-37.6	174.6	-75	-23.6	0	0	0	112.2	Y187 R189 N194 R195	Y187-N191 WeakPolarHBondContact CD1-ND2 3.48Å; Y187-N191 WeakPolarHBondContact CE1-ND2 3.5Å; Y187-N191 VanDerWaalsContact CZ-ND2 3.26Å; Y187-N191 PolarHBondContact O-N 3.49Å; Y187-N191 PolarHBondContact O-ND2 2.88Å; R189-N191 PolarHBondContact O-N 3.27Å; N191-N194 PolarHBondContact O-N 3.05Å; N191-R195 VanDerWaalsContact O-CG 3.31Å; N191-R195 WeakPolarHBondContact O-CG 3.36Å; N191-R195 PolarHBondContact O-N 2.86Å
192	S	91.7	Very high	88.6	Confident	61 Å²	61	95 Å²	95	43%	0.427	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-41.6	175.9	-57.4	0	0	0	0	112	E188 R189 N190 R195 L196	E188-S192 WeakPolarHBondContact O-CB 3.31Å; E188-S192 PolarHBondContact O-N 3.49Å; E188-S192 PolarHBondContact O-OG 2.86Å; R189-S192 WeakPolarHBondContact O-CB 3.13Å; R189-S192 PolarHBondContact O-N 3.32Å; R189-S192 VanDerWaalsContact O-N 3.16Å; N190-S192 VanDerWaalsContact C-N 3.29Å; N190-S192 PolarHBondContact O-N 3.47Å; S192-R195 PolarHBondContact O-N 3.24Å; S192-L196 WeakPolarHBondContact O-CG 3.42Å; S192-L196 PolarHBondContact O-N 2.96Å; S192-L196 VanDerWaalsContact O-N 3.08Å
193	I	92.5	Very high	87	Confident	103 Å²	103	97.5 Å²	97.5	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-46.2	174.3	-69.1	164.5	0	0	0	110.7	R189 N190 R195 L196 Y197	R189-I193 WeakPolarHBondContact O-CG1 3.38Å; R189-I193 PolarHBondContact O-N 3.35Å; N190-I193 PolarHBondContact O-N 3.19Å; I193-R195 VanDerWaalsContact C-N 3.31Å; I193-R195 PolarHBondContact O-N 3.37Å; I193-L196 WeakPolarHBondContact O-CB 3.3Å; I193-L196 PolarHBondContact O-N 3.33Å; I193-L196 VanDerWaalsContact O-N 3.12Å; I193-Y197 WeakPolarHBondContact O-CB 3.39Å; I193-Y197 PolarHBondContact O-N 3.4Å
194	N	89.1	Confident	85.1	Confident	77 Å²	77	101.3 Å²	101.3	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-59.2	-42.5	177.3	-75.6	-25.4	0	0	0	111.6	N190 N191 L196 Y197 T198	N190-N194 WeakPolarHBondContact O-CB 3.32Å; N190-N194 PolarHBondContact O-N 2.96Å; N190-N194 PolarHBondContact O-ND2 2.98Å; N191-N194 PolarHBondContact O-N 3.05Å; N194-L196 PolarHBondContact O-N 2.91Å; N194-Y197 PolarHBondContact O-N 3.23Å; N194-T198 PolarHBondContact O-N 2.83Å; N194-T198 PolarHBondContact O-OG1 3.16Å
195	R	88.1	Confident	83.1	Confident	184 Å²	184	101.8 Å²	101.8	69%	0.694	51%	0.507	S	S	*	.	H	α-helix	trans	-58.8	-46.3	173.5	-74	173.3	-176	179.8	1.5	111.9	N191 S192 I193 Y197 T198 V199	N191-R195 VanDerWaalsContact O-CG 3.31Å; N191-R195 WeakPolarHBondContact O-CG 3.36Å; N191-R195 PolarHBondContact O-N 2.86Å; S192-R195 PolarHBondContact O-N 3.24Å; I193-R195 VanDerWaalsContact C-N 3.31Å; I193-R195 PolarHBondContact O-N 3.37Å; R195-Y197 VanDerWaalsContact C-N 3.34Å; R195-T198 PolarHBondContact O-N 3.18Å; R195-V199 WeakPolarHBondContact O-CB 3.46Å; R195-V199 VanDerWaalsContact O-CG2 3.22Å; R195-V199 WeakPolarHBondContact O-CG2 3.22Å; R195-V199 PolarHBondContact O-N 2.99Å
196	L	89	Confident	80.9	Confident	115 Å²	115	105.1 Å²	105.1	60%	0.602	53%	0.53	S	S	*	.	H	α-helix	trans	-62.6	-41.5	176.7	-71.9	171	0	0	0	112	S192 I193 N194 V199 L200	S192-L196 WeakPolarHBondContact O-CG 3.42Å; S192-L196 PolarHBondContact O-N 2.96Å; S192-L196 VanDerWaalsContact O-N 3.08Å; I193-L196 WeakPolarHBondContact O-CB 3.3Å; I193-L196 PolarHBondContact O-N 3.33Å; I193-L196 VanDerWaalsContact O-N 3.12Å; N194-L196 PolarHBondContact O-N 2.91Å; L196-V199 PolarHBondContact O-N 3.17Å; L196-L200 WeakPolarHBondContact O-CG 3.26Å; L196-L200 PolarHBondContact O-N 3.07Å
197	Y	85.6	Confident	78.5	Confident	157 Å²	157	106 Å²	106	62%	0.616	54%	0.537	S	S	*	.	H	α-helix	trans	-61.9	-47.8	176.9	-174.9	-95.6	0	0	0	111.4	I193 N194 R195 V199 L200 T201	I193-Y197 WeakPolarHBondContact O-CB 3.39Å; I193-Y197 PolarHBondContact O-N 3.4Å; N194-Y197 PolarHBondContact O-N 3.23Å; R195-Y197 VanDerWaalsContact C-N 3.34Å; Y197-V199 VanDerWaalsContact C-N 3.3Å; Y197-V199 PolarHBondContact O-N 3.46Å; Y197-L200 PolarHBondContact O-N 3.07Å; Y197-T201 HydrophobicContact CD1-CG2 4.12Å; Y197-T201 HydrophobicContact CE1-CG2 3.7Å; Y197-T201 HydrophobicContact CE2-CG2 4.44Å; Y197-T201 WeakPolarHBondContact O-CG2 3.2Å; Y197-T201 PolarHBondContact O-N 3.19Å; Y197-T201 PolarHBondContact O-OG1 3.01Å
198	T	84.5	Confident	76.1	Confident	69 Å²	69	104.5 Å²	104.5	42%	0.423	55%	0.545	S	S	.	.	H	α-helix	trans	-60.3	-39.6	176.3	-52.2	0	0	0	0	112.2	N194 R195 T201 N202	N194-T198 PolarHBondContact O-N 2.83Å; N194-T198 PolarHBondContact O-OG1 3.16Å; R195-T198 PolarHBondContact O-N 3.18Å; T198-T201 WeakPolarHBondContact CA-OG1 3.47Å; T198-T201 PolarHBondContact O-OG1 3.34Å; T198-N202 VanDerWaalsContact O-CB 3.29Å; T198-N202 WeakPolarHBondContact O-CB 3.33Å; T198-N202 PolarHBondContact O-N 3.46Å; T198-N202 PolarHBondContact O-ND2 3Å
199	V	84.5	Confident	74	Confident	65 Å²	65	105.1 Å²	105.1	39%	0.394	55%	0.553	S	S	.	*	H	α-helix	trans	-61.9	-50.6	174.7	168.4	0	0	0	0	109.9	R195 L196 Y197 T201 N202 M203	R195-V199 WeakPolarHBondContact O-CB 3.46Å; R195-V199 VanDerWaalsContact O-CG2 3.22Å; R195-V199 WeakPolarHBondContact O-CG2 3.22Å; R195-V199 PolarHBondContact O-N 2.99Å; L196-V199 PolarHBondContact O-N 3.17Å; Y197-V199 VanDerWaalsContact C-N 3.3Å; Y197-V199 PolarHBondContact O-N 3.46Å; V199-T201 PolarHBondContact O-N 2.94Å; V199-N202 PolarHBondContact O-N 3.29Å; V199-M203 HydrophobicContact CB-SD 4.33Å; V199-M203 HydrophobicContact CG1-CE 3.95Å; V199-M203 HydrophobicContact CG1-SD 3.25Å; V199-M203 WeakPolarHBondContact CG1-SD 3.47Å; V199-M203 WeakPolarHBondContact O-CB 3.45Å; V199-M203 PolarHBondContact O-N 3.5Å
200	L	81.4	Confident	72	Confident	110 Å²	110	104.9 Å²	104.9	58%	0.576	56%	0.556	S	S	*	*	H	α-helix	trans	-60	-41.6	178.5	-73.5	166.8	0	0	0	113	L196 Y197 N204	L196-L200 WeakPolarHBondContact O-CG 3.26Å; L196-L200 PolarHBondContact O-N 3.07Å; Y197-L200 PolarHBondContact O-N 3.07Å; L200-N204 PolarHBondContact O-N 2.77Å
201	T	79.1	Confident	69.6	Low	55 Å²	55	109.2 Å²	109.2	34%	0.337	58%	0.578	S	S	.	*	H	α-helix	trans	-68.7	-37.7	177.6	52.3	0	0	0	0	112.4	Y197 T198 V199 N204	Y197-T201 HydrophobicContact CD1-CG2 4.12Å; Y197-T201 HydrophobicContact CE1-CG2 3.7Å; Y197-T201 HydrophobicContact CE2-CG2 4.44Å; Y197-T201 WeakPolarHBondContact O-CG2 3.2Å; Y197-T201 PolarHBondContact O-N 3.19Å; Y197-T201 PolarHBondContact O-OG1 3.01Å; T198-T201 WeakPolarHBondContact CA-OG1 3.47Å; T198-T201 PolarHBondContact O-OG1 3.34Å; V199-T201 PolarHBondContact O-N 2.94Å; T201-N204 PolarHBondContact O-N 2.99Å
202	N	74.5	Confident	67.5	Low	108 Å²	108	112 Å²	112	58%	0.578	60%	0.602	S	S	*	*	H	α-helix	trans	-74.9	-32.6	178.7	-69.5	-11.9	0	0	0	112.1	T198 V199 N204 V205	T198-N202 VanDerWaalsContact O-CB 3.29Å; T198-N202 WeakPolarHBondContact O-CB 3.33Å; T198-N202 PolarHBondContact O-N 3.46Å; T198-N202 PolarHBondContact O-ND2 3Å; V199-N202 PolarHBondContact O-N 3.29Å; N202-N204 VanDerWaalsContact C-N 3.26Å; N202-N204 PolarHBondContact O-N 3.25Å; N202-V205 PolarHBondContact O-N 3.04Å
203	M	58.5	Low	65.2	Low	76 Å²	76	116.4 Å²	116.4	37%	0.374	62%	0.619	S	S	.	*	H	α-helix	trans	-62.6	-31.7	172.6	-101.1	97	-146.2	0	0	113.1	V199 V205 S206 F210	V199-M203 HydrophobicContact CB-SD 4.33Å; V199-M203 HydrophobicContact CG1-CE 3.95Å; V199-M203 HydrophobicContact CG1-SD 3.25Å; V199-M203 WeakPolarHBondContact CG1-SD 3.47Å; V199-M203 WeakPolarHBondContact O-CB 3.45Å; V199-M203 PolarHBondContact O-N 3.5Å; M203-V205 PolarHBondContact O-N 3.32Å; M203-V205 VanDerWaalsContact O-N 3.11Å; M203-S206 PolarHBondContact O-N 3.18Å; M203-F210 HydrophobicContact CB-CE2 4.44Å; M203-F210 HydrophobicContact CE-CD2 4.31Å; M203-F210 HydrophobicContact CE-CE2 3.12Å; M203-F210 HydrophobicContact CE-CZ 3.29Å; M203-F210 HydrophobicContact CG-CD2 3.44Å; M203-F210 VanDerWaalsContact CG-CD2 3.44Å; M203-F210 HydrophobicContact CG-CE1 4.2Å; M203-F210 HydrophobicContact CG-CE2 3.06Å; M203-F210 HydrophobicContact CG-CG 4.23Å; M203-F210 HydrophobicContact CG-CZ 3.48Å; M203-F210 VanDerWaalsContact CG-CZ 3.48Å; M203-F210 HydrophobicContact SD-CD2 4.19Å; M203-F210 HydrophobicContact SD-CE1 3.99Å; M203-F210 HydrophobicContact SD-CE2 3.23Å; M203-F210 WeakPolarHBondContact SD-CE2 3.28Å; M203-F210 HydrophobicContact SD-CZ 3.08Å; M203-F210 WeakPolarHBondContact SD-CZ 3.34Å
204	N	52.8	Low	62.8	Low	153 Å²	153	117.5 Å²	117.5	82%	0.818	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-0.8	177.2	-100.8	-6.2	0	0	0	113.9	L200 T201 N202	L200-N204 PolarHBondContact O-N 2.77Å; T201-N204 PolarHBondContact O-N 2.99Å; N202-N204 VanDerWaalsContact C-N 3.26Å; N202-N204 PolarHBondContact O-N 3.25Å
205	V	50.3	Low	60.9	Low	117 Å²	117	119.1 Å²	119.1	71%	0.709	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-9.8	179.3	-169.6	0	0	0	0	112.9	N202 M203	N202-V205 PolarHBondContact O-N 3.04Å; M203-V205 PolarHBondContact O-N 3.32Å; M203-V205 VanDerWaalsContact O-N 3.11Å
206	S	42.9	Very low	58.9	Low	95 Å²	95	116 Å²	116	66%	0.664	65%	0.653	S	S	*	*	S	Bend	trans	-160.5	110.4	177.6	-68.7	0	0	0	0	113.7	M203	M203-S206 PolarHBondContact O-N 3.18Å
207	N	42.1	Very low	56.9	Low	131 Å²	131	118.9 Å²	118.9	70%	0.701	67%	0.668	S	S	*	*			trans	87.5	116	154.5	-146	1.1	0	0	0	118.5	N209	N207-N209 PolarHBondContact O-N 2.9Å; N207-N209 VanDerWaalsContact O-N 3.11Å
208	P	42.6	Very low	55.1	Low	117 Å²	117	121 Å²	121	76%	0.76	68%	0.68	S	S	*	*	S	Bend	trans	-86.3	74.7	-176.8	36.1	-35.1	0	0	0	112.6
209	N	48.5	Very low	53.2	Low	143 Å²	143	127.5 Å²	127.5	77%	0.765	70%	0.702	S	S	*	*			trans	-139.1	50	171.5	-95.4	-24.5	0	0	0	112.8	N207 L211	N207-N209 PolarHBondContact O-N 2.9Å; N207-N209 VanDerWaalsContact O-N 3.11Å; N209-L211 VanDerWaalsContact C-N 3.35Å; N209-L211 PolarHBondContact O-N 3.06Å
210	F	48.4	Very low	51.5	Low	132 Å²	132	134.3 Å²	134.3	58%	0.579	73%	0.727	S	S	*	*			trans	-90.3	37.5	-168.9	-132.5	-101.9	0	0	0	116.4	M203	M203-F210 HydrophobicContact CB-CE2 4.44Å; M203-F210 HydrophobicContact CE-CD2 4.31Å; M203-F210 HydrophobicContact CE-CE2 3.12Å; M203-F210 HydrophobicContact CE-CZ 3.29Å; M203-F210 HydrophobicContact CG-CD2 3.44Å; M203-F210 VanDerWaalsContact CG-CD2 3.44Å; M203-F210 HydrophobicContact CG-CE1 4.2Å; M203-F210 HydrophobicContact CG-CE2 3.06Å; M203-F210 HydrophobicContact CG-CG 4.23Å; M203-F210 HydrophobicContact CG-CZ 3.48Å; M203-F210 VanDerWaalsContact CG-CZ 3.48Å; M203-F210 HydrophobicContact SD-CD2 4.19Å; M203-F210 HydrophobicContact SD-CE1 3.99Å; M203-F210 HydrophobicContact SD-CE2 3.23Å; M203-F210 WeakPolarHBondContact SD-CE2 3.28Å; M203-F210 HydrophobicContact SD-CZ 3.08Å; M203-F210 WeakPolarHBondContact SD-CZ 3.34Å
211	L	42.9	Very low	49.8	Very low	174 Å²	174	138.6 Å²	138.6	91%	0.911	74%	0.741	S	S	*	*			trans	-129.7	71.3	-180	-76.2	166.9	0	0	0	111.3	N209	N209-L211 VanDerWaalsContact C-N 3.35Å; N209-L211 PolarHBondContact O-N 3.06Å
212	S	47.9	Very low	48.1	Very low	110 Å²	110	145 Å²	145	77%	0.769	77%	0.767	S	S	*	*	S	Bend	trans	-160.9	10.6	161.4	81.8	0	0	0	0	118.8
213	I	45.1	Very low	46.7	Very low	153 Å²	153	149.7 Å²	149.7	79%	0.785	78%	0.782	S	S	*	*			trans	-127.9	68.7	-175.9	-41.8	179.8	0	0	0	111.9
214	C	42	Very low	45.7	Very low	127 Å²	127	151.5 Å²	151.5	86%	0.858	80%	0.802	S	S	*	*			trans	-127.9	102.4	151.4	-86.3	0	0	0	0	107.7
215	P	49.1	Very low	45.3	Very low	110 Å²	110	157.8 Å²	157.8	71%	0.714	82%	0.822	S	S	*	*			trans	-67.9	142	162	-2.6	19.1	0	0	0	108.2
216	P	46.1	Very low	45	Very low	120 Å²	120	159.9 Å²	159.9	78%	0.779	83%	0.828	S	S	*	*			trans	-68.2	142.7	-172.9	27.6	-32.9	0	0	0	111.7	K218	P216-K218 PolarHBondContact O-N 3.02Å
217	L	46.8	Very low	45.1	Very low	174 Å²	174	163.3 Å²	163.3	91%	0.911	84%	0.836	S	S	*	*			trans	-50.7	110.2	169.8	-89.1	124.3	0	0	0	110.7	K219	L217-K219 PolarHBondContact O-N 3.21Å
218	K	48.4	Very low	45.3	Very low	203 Å²	203	165.1 Å²	165.1	88%	0.883	84%	0.844	S	S	*	*			trans	-68.6	103.8	165.2	-77.1	-174.2	178.3	178.5	0	108.7	P216 K220	P216-K218 PolarHBondContact O-N 3.02Å; K218-K220 PolarHBondContact O-N 3.17Å; K218-K220 VanDerWaalsContact O-N 3.14Å
219	K	44	Very low	45.5	Very low	204 Å²	204	167.9 Å²	167.9	89%	0.887	85%	0.849	S	S	*	*			trans	-51.4	111.2	167.8	-66.9	179.6	177.4	179.3	0	110.1	L217	L217-K219 PolarHBondContact O-N 3.21Å
220	K	48.3	Very low	45.3	Very low	208 Å²	208	169.4 Å²	169.4	90%	0.904	85%	0.854	S	S	*	*			trans	-85.5	114.3	159.4	-90.7	-174.4	176.4	178.5	0	108.1	K218 H222	K218-K220 PolarHBondContact O-N 3.17Å; K218-K220 VanDerWaalsContact O-N 3.14Å; K220-H222 PolarHBondContact O-N 3.16Å
221	K	45.9	Very low	45.1	Very low	201 Å²	201	171.9 Å²	171.9	87%	0.874	87%	0.872	S	S	*	*			trans	-57.1	127.7	173.1	-75.3	178.6	172.8	178.2	0	110.2
222	H	43.6	Very low	45.2	Very low	190 Å²	190	171.8 Å²	171.8	88%	0.88	87%	0.87	S	S	*	*			trans	-55.1	130.8	152.9	-88.8	-75.9	0	0	0	109.4	K220	K220-H222 PolarHBondContact O-N 3.16Å
223	K	43.8	Very low	45	Very low	206 Å²	206	176.5 Å²	176.5	90%	0.896	88%	0.877	S	S	*	*			trans	-119.1	112.9	150.4	-93.2	-172.3	173.9	-177.3	0	107
224	S	39.3	Very low	45	Very low	114 Å²	114	178.5 Å²	178.5	80%	0.797	89%	0.885	S	S	*	*			trans	-70.7	132.1	163	59.2	0	0	0	0	109.7
225	K	43.1	Very low	45.3	Very low	285 Å²	285	183.2 Å²	183.2	100%	1.239	89%	0.888	S	S	*	*			trans	-157	0	137.7	-108.4	-172.4	-179.6	-172.8	0	107.3

Retrieved 225 of 225 residues in 385.2 ms (Link to these results)

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