A0A3Q0KIW9_SCHMA Loading...

Ashwin AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KIW9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 204 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	48.9	Very low	67.1	Low	246 Å²	246	112.8 Å²	112.8	100%	1.212	55%	0.547	S	S	*	.				0	114.7	0	-116.2	167.5	169.6	0	0	107.2
2	M	60.7	Low	67.4	Low	107 Å²	107	109.1 Å²	109.1	53%	0.527	53%	0.526	S	S	.	.			trans	-79	131.3	174.1	-68	-164.9	-170.2	0	0	108.7	F4 E45	M2-F4 PolarHBondContact O-N 3.22Å; M2-E45 HydrophobicContact CE-CB 3.88Å; M2-E45 HydrophobicContact SD-CB 4.36Å
3	H	63	Low	67.7	Low	175 Å²	175	110.3 Å²	110.3	81%	0.81	53%	0.531	S	S	*	.			trans	-85.2	109	-179.7	-133.4	-60.5	0	0	0	108.2
4	F	65.6	Low	67.7	Low	105 Å²	105	108.9 Å²	108.9	46%	0.461	52%	0.518	S	S	.	.			trans	-88.3	128.6	170.7	177.7	-107.6	0	0	0	109.4	M2 L35 H38 Y39	M2-F4 PolarHBondContact O-N 3.22Å; F4-L35 WeakPolarHBondContact CE2-O 3.47Å; F4-L35 HydrophobicContact CZ-CD2 4.46Å; F4-H38 AromaticContact CD2-ND1 3.88Å; F4-Y39 AromaticContact CD2-CD2 3.98Å; F4-Y39 HydrophobicContact CD2-CD2 3.98Å; F4-Y39 HydrophobicContact CE1-CD2 4.41Å; F4-Y39 AromaticContact CE2-CD2 3.72Å; F4-Y39 HydrophobicContact CE2-CD2 3.72Å; F4-Y39 HydrophobicContact CE2-CG 4.05Å; F4-Y39 HydrophobicContact CG-CD2 4.49Å; F4-Y39 AromaticContact CZ-CD2 3.92Å; F4-Y39 HydrophobicContact CZ-CD2 3.92Å; F4-Y39 HydrophobicContact CZ-CG 4.33Å
5	G	70.5	Confident	67.7	Low	31 Å²	31	102.1 Å²	102.1	32%	0.32	49%	0.486	S	S	.	.	S	Bend	trans	131.3	159.3	176.8	0	0	0	0	0	112.6
6	L	70.4	Confident	67.7	Low	41 Å²	41	106.9 Å²	106.9	22%	0.215	51%	0.508	C	S	.	.			trans	-80	135	172.8	-68.8	163.5	0	0	0	109.1	E10 L11 Y14 V31 V34 L35	L6-E10 HydrophobicContact CB-CB 4.24Å; L6-E10 HydrophobicContact CD2-CB 3.78Å; L6-L11 HydrophobicContact CD1-CD1 4.5Å; L6-Y14 HydrophobicContact CD1-CD2 4.42Å; L6-Y14 HydrophobicContact CD2-CD2 4.46Å; L6-Y14 HydrophobicContact CD2-CE2 4.11Å; L6-V31 HydrophobicContact CD1-CG1 3.76Å; L6-V34 HydrophobicContact CD2-CG1 4.04Å; L6-L35 HydrophobicContact CB-CD2 4.43Å; L6-L35 HydrophobicContact CD1-CD1 4.38Å; L6-L35 HydrophobicContact CD1-CD2 3.97Å; L6-L35 HydrophobicContact CD1-CG 3.88Å; L6-L35 HydrophobicContact CG-CD2 3.7Å; L6-L35 HydrophobicContact CG-CG 4.17Å
7	T	72.5	Confident	67.2	Low	78 Å²	78	104.3 Å²	104.3	48%	0.479	50%	0.501	S	S	.	.			trans	-62.7	154.5	165.2	62.6	0	0	0	0	109.5	R9 E10 L11	T7-R9 PolarHBondContact O-N 2.65Å; T7-R9 VanDerWaalsContact O-N 3.09Å; T7-E10 WeakPolarHBondContact CB-OE2 3.33Å; T7-E10 PolarHBondContact N-OE2 3.18Å; T7-E10 PolarHBondContact O-N 2.97Å; T7-E10 VanDerWaalsContact OG1-CD 3.22Å; T7-E10 VanDerWaalsContact OG1-CG 3.27Å; T7-E10 WeakPolarHBondContact OG1-CG 3.45Å; T7-E10 PolarHBondContact OG1-N 3.39Å; T7-E10 PolarHBondContact OG1-OE2 3.45Å; T7-L11 PolarHBondContact O-N 3.17Å
8	Q	69.4	Low	66.9	Low	144 Å²	144	105.7 Å²	105.7	67%	0.673	52%	0.517	S	S	*	.	H	α-helix	trans	-53.1	-35.9	177.5	-173	-178.8	7.7	0	0	111.8	F12	Q8-F12 HydrophobicContact CG-CD2 3.82Å; Q8-F12 HydrophobicContact CG-CE2 3.47Å; Q8-F12 VanDerWaalsContact CG-CE2 3.47Å; Q8-F12 HydrophobicContact CG-CZ 4.41Å; Q8-F12 WeakPolarHBondContact O-CD2 3.44Å; Q8-F12 WeakPolarHBondContact O-CG 3.27Å; Q8-F12 PolarHBondContact O-N 3.22Å
9	R	72.8	Confident	66.3	Low	190 Å²	190	107.2 Å²	107.2	72%	0.717	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-44.4	176.9	-173.7	-178.6	179.1	-166	-0.6	112.7	T7 F12 Q13	T7-R9 PolarHBondContact O-N 2.65Å; T7-R9 VanDerWaalsContact O-N 3.09Å; R9-F12 PolarHBondContact O-N 3.19Å; R9-Q13 PolarHBondContact O-N 3.32Å
10	E	73.8	Confident	65.7	Low	76 Å²	76	104.7 Å²	104.7	36%	0.355	52%	0.516	S	S	.	.	H	α-helix	trans	-67.9	-42	178.7	-68.7	161.2	146.5	0	0	110.8	L6 T7 F12 Q13 Y14	L6-E10 HydrophobicContact CB-CB 4.24Å; L6-E10 HydrophobicContact CD2-CB 3.78Å; T7-E10 WeakPolarHBondContact CB-OE2 3.33Å; T7-E10 PolarHBondContact N-OE2 3.18Å; T7-E10 PolarHBondContact O-N 2.97Å; T7-E10 VanDerWaalsContact OG1-CD 3.22Å; T7-E10 VanDerWaalsContact OG1-CG 3.27Å; T7-E10 WeakPolarHBondContact OG1-CG 3.45Å; T7-E10 PolarHBondContact OG1-N 3.39Å; T7-E10 PolarHBondContact OG1-OE2 3.45Å; E10-F12 VanDerWaalsContact C-N 3.28Å; E10-F12 PolarHBondContact O-N 3.49Å; E10-Q13 WeakPolarHBondContact O-CB 3.48Å; E10-Q13 PolarHBondContact O-N 2.84Å; E10-Y14 WeakPolarHBondContact O-CD2 3.43Å; E10-Y14 PolarHBondContact O-N 3.03Å; E10-Y14 VanDerWaalsContact O-N 3.07Å
11	L	70.7	Confident	65.3	Low	48 Å²	48	106.3 Å²	106.3	25%	0.251	53%	0.526	S	S	.	.	H	α-helix	trans	-57.5	-43.6	173.6	-174	69.9	0	0	0	111.1	L6 T7 Q13 Y14 T15 V31	L6-L11 HydrophobicContact CD1-CD1 4.5Å; T7-L11 PolarHBondContact O-N 3.17Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-Q13 PolarHBondContact O-N 3.26Å; L11-Y14 PolarHBondContact O-N 3.38Å; L11-T15 HydrophobicContact CD1-CG2 3.98Å; L11-T15 HydrophobicContact CG-CG2 4.17Å; L11-T15 WeakPolarHBondContact O-CB 3.28Å; L11-T15 WeakPolarHBondContact O-CG2 3.18Å; L11-T15 PolarHBondContact O-N 2.92Å; L11-T15 PolarHBondContact O-OG1 3.15Å; L11-V31 HydrophobicContact CD1-CG1 3.86Å; L11-V31 HydrophobicContact CD1-CG2 4.16Å
12	F	70.2	Confident	65.7	Low	68 Å²	68	99.8 Å²	99.8	30%	0.298	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-36.4	175.3	-81	-55.4	0	0	0	113.3	Q8 R9 E10 Q16 T17 T18	Q8-F12 HydrophobicContact CG-CD2 3.82Å; Q8-F12 HydrophobicContact CG-CE2 3.47Å; Q8-F12 VanDerWaalsContact CG-CE2 3.47Å; Q8-F12 HydrophobicContact CG-CZ 4.41Å; Q8-F12 WeakPolarHBondContact O-CD2 3.44Å; Q8-F12 WeakPolarHBondContact O-CG 3.27Å; Q8-F12 PolarHBondContact O-N 3.22Å; R9-F12 PolarHBondContact O-N 3.19Å; E10-F12 VanDerWaalsContact C-N 3.28Å; E10-F12 PolarHBondContact O-N 3.49Å; F12-Q16 WeakPolarHBondContact O-CA 3.33Å; F12-Q16 PolarHBondContact O-N 2.86Å; F12-T17 WeakPolarHBondContact CD1-O 3.36Å; F12-T17 VanDerWaalsContact CE1-O 3.28Å; F12-T17 WeakPolarHBondContact CE1-O 3.32Å; F12-T18 WeakPolarHBondContact CE1-O 3.07Å
13	Q	72	Confident	65.7	Low	125 Å²	125	97 Å²	97	58%	0.584	49%	0.487	S	S	*	.	H	α-helix	trans	-64.9	-42.7	176.9	-77.8	-179.1	-29.7	0	0	112.4	R9 E10 L11	R9-Q13 PolarHBondContact O-N 3.32Å; E10-Q13 WeakPolarHBondContact O-CB 3.48Å; E10-Q13 PolarHBondContact O-N 2.84Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-Q13 PolarHBondContact O-N 3.26Å
14	Y	67.8	Low	65.9	Low	90 Å²	90	96 Å²	96	35%	0.353	48%	0.48	S	S	.	.	H	α-helix	trans	-70.2	-39.5	177.8	-75.8	-67.6	0	0	0	112.5	L6 E10 L11 V34	L6-Y14 HydrophobicContact CD1-CD2 4.42Å; L6-Y14 HydrophobicContact CD2-CD2 4.46Å; L6-Y14 HydrophobicContact CD2-CE2 4.11Å; E10-Y14 WeakPolarHBondContact O-CD2 3.43Å; E10-Y14 PolarHBondContact O-N 3.03Å; E10-Y14 VanDerWaalsContact O-N 3.07Å; L11-Y14 PolarHBondContact O-N 3.38Å; Y14-V34 HydrophobicContact CD1-CG2 4.25Å; Y14-V34 HydrophobicContact CE1-CG2 3.62Å; Y14-V34 HydrophobicContact CE2-CB 4.48Å; Y14-V34 HydrophobicContact CE2-CG1 3.8Å; Y14-V34 HydrophobicContact CE2-CG2 4.28Å
15	T	67.6	Low	65.9	Low	7 Å²	7	97.2 Å²	97.2	4%	0.043	50%	0.499	C	S	.	.	H	α-helix	trans	-86.3	-17.5	-171	61.9	0	0	0	0	112.5	L11 T17 L23 V27 V31	L11-T15 HydrophobicContact CD1-CG2 3.98Å; L11-T15 HydrophobicContact CG-CG2 4.17Å; L11-T15 WeakPolarHBondContact O-CB 3.28Å; L11-T15 WeakPolarHBondContact O-CG2 3.18Å; L11-T15 PolarHBondContact O-N 2.92Å; L11-T15 PolarHBondContact O-OG1 3.15Å; T15-T17 WeakPolarHBondContact O-CB 3.47Å; T15-T17 PolarHBondContact O-N 3.04Å; T15-T17 PolarHBondContact O-OG1 3.12Å; T15-L23 HydrophobicContact CG2-CD2 3.21Å; T15-V27 HydrophobicContact CG2-CG1 3.88Å; T15-V31 HydrophobicContact CG2-CG2 4.08Å
16	Q	67.4	Low	65.9	Low	179 Å²	179	97.5 Å²	97.5	84%	0.836	50%	0.501	S	S	*	.			trans	48.7	18.5	-173.6	-57.7	-176.1	12.6	0	0	113.7	F12	F12-Q16 WeakPolarHBondContact O-CA 3.33Å; F12-Q16 PolarHBondContact O-N 2.86Å
17	T	59.6	Low	66	Low	63 Å²	63	97.2 Å²	97.2	39%	0.387	50%	0.502	S	S	.	.			trans	-125.4	119.5	-168.1	-50.9	0	0	0	0	109.1	F12 T15 Q19	F12-T17 WeakPolarHBondContact CD1-O 3.36Å; F12-T17 VanDerWaalsContact CE1-O 3.28Å; F12-T17 WeakPolarHBondContact CE1-O 3.32Å; T15-T17 WeakPolarHBondContact O-CB 3.47Å; T15-T17 PolarHBondContact O-N 3.04Å; T15-T17 PolarHBondContact O-OG1 3.12Å; T17-Q19 WeakPolarHBondContact CG2-O 3.38Å; T17-Q19 PolarHBondContact O-N 3.42Å; T17-Q19 VanDerWaalsContact O-N 3.16Å
18	T	61.6	Low	66	Low	129 Å²	129	97.1 Å²	97.1	79%	0.791	50%	0.497	S	S	*	.	S	Bend	trans	-65.3	-16.7	179.6	-33.3	0	0	0	0	112.8	F12	F12-T18 WeakPolarHBondContact CE1-O 3.07Å
19	Q	55.2	Low	66.4	Low	135 Å²	135	95.5 Å²	95.5	63%	0.631	49%	0.493	S	S	*	.			trans	-110.1	109.5	172.1	-67.2	-151.8	-2.2	0	0	110.9	T17 N21	T17-Q19 WeakPolarHBondContact CG2-O 3.38Å; T17-Q19 PolarHBondContact O-N 3.42Å; T17-Q19 VanDerWaalsContact O-N 3.16Å; Q19-N21 PolarHBondContact O-N 3.16Å
20	P	55	Low	66.7	Low	57 Å²	57	91.7 Å²	91.7	37%	0.37	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-72	-8.6	-179.5	28.8	-34.4	0	0	0	113.6	V22	P20-V22 VanDerWaalsContact C-N 3.25Å; P20-V22 PolarHBondContact O-N 2.74Å
21	N	57.3	Low	67.1	Low	139 Å²	139	88.6 Å²	88.6	74%	0.743	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-71.3	-15.1	-169.7	-70.5	-7.8	0	0	0	114.6	Q19	Q19-N21 PolarHBondContact O-N 3.16Å
22	V	56.6	Low	67.7	Low	109 Å²	109	89.6 Å²	89.6	66%	0.661	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-135.3	69.4	-177.8	-163	0	0	0	0	109.6	P20 K24	P20-V22 VanDerWaalsContact C-N 3.25Å; P20-V22 PolarHBondContact O-N 2.74Å; V22-K24 PolarHBondContact O-N 2.89Å
23	L	60.8	Low	68.3	Low	48 Å²	48	90.3 Å²	90.3	25%	0.251	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-62.4	118.5	165.2	-61.9	-177.7	0	0	0	108.1	T15 V27 I28	T15-L23 HydrophobicContact CG2-CD2 3.21Å; L23-V27 HydrophobicContact CD2-CG1 4.12Å; L23-I28 HydrophobicContact CB-CD1 3.92Å; L23-I28 HydrophobicContact CB-CG1 3.31Å; L23-I28 HydrophobicContact CD1-CG1 3.94Å; L23-I28 HydrophobicContact CG-CG1 4.26Å
24	K	66.6	Low	69	Low	154 Å²	154	85.9 Å²	85.9	67%	0.67	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-62.1	145.1	175.6	-65.7	179.9	-177.8	174.4	0	109.2	V22 G26 V27	V22-K24 PolarHBondContact O-N 2.89Å; K24-G26 PolarHBondContact O-N 2.97Å; K24-V27 HydrophobicContact CB-CG2 4.32Å; K24-V27 PolarHBondContact O-N 2.99Å
25	P	66.6	Low	69.8	Low	131 Å²	131	83.8 Å²	83.8	85%	0.851	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	123.5	168.6	-21.2	31.4	0	0	0	108.9
26	G	69.4	Low	70.8	Confident	36 Å²	36	87.9 Å²	87.9	37%	0.371	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	110	-45.7	-170.1	0	0	0	0	0	114.6	K24 I28 D29 E30	K24-G26 PolarHBondContact O-N 2.97Å; G26-I28 VanDerWaalsContact C-N 3.31Å; G26-D29 WeakPolarHBondContact CA-OD2 3.34Å; G26-D29 PolarHBondContact N-OD2 3.25Å; G26-D29 PolarHBondContact O-N 3.33Å; G26-E30 PolarHBondContact O-N 2.93Å
27	V	72.5	Confident	71.8	Confident	36 Å²	36	85.5 Å²	85.5	22%	0.218	47%	0.469	C	S	.	.	H	α-helix	trans	-70	-35.6	174.3	-178.9	0	0	0	0	110.2	T15 L23 K24 D29 E30 V31	T15-V27 HydrophobicContact CG2-CG1 3.88Å; L23-V27 HydrophobicContact CD2-CG1 4.12Å; K24-V27 HydrophobicContact CB-CG2 4.32Å; K24-V27 PolarHBondContact O-N 2.99Å; V27-D29 VanDerWaalsContact C-N 3.31Å; V27-D29 PolarHBondContact O-N 2.92Å; V27-E30 PolarHBondContact O-N 3.03Å; V27-V31 WeakPolarHBondContact O-CG2 3.35Å; V27-V31 PolarHBondContact O-N 3.38Å
28	I	73.7	Confident	73	Confident	75 Å²	75	85.9 Å²	85.9	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-58.6	-46.6	173.2	-59.2	177.4	0	0	0	110.1	L23 G26 E30 V31 V32	L23-I28 HydrophobicContact CB-CD1 3.92Å; L23-I28 HydrophobicContact CB-CG1 3.31Å; L23-I28 HydrophobicContact CD1-CG1 3.94Å; L23-I28 HydrophobicContact CG-CG1 4.26Å; G26-I28 VanDerWaalsContact C-N 3.31Å; I28-E30 VanDerWaalsContact C-N 3.3Å; I28-E30 PolarHBondContact O-N 2.84Å; I28-V31 PolarHBondContact O-N 3.46Å; I28-V32 HydrophobicContact CG2-CG2 4.16Å; I28-V32 WeakPolarHBondContact O-CB 3.49Å; I28-V32 VanDerWaalsContact O-CG2 3.27Å; I28-V32 WeakPolarHBondContact O-CG2 3.41Å; I28-V32 PolarHBondContact O-N 3.49Å
29	D	77.8	Confident	74.2	Confident	110 Å²	110	84.9 Å²	84.9	59%	0.588	45%	0.449	S	S	*	.	H	α-helix	trans	-63.5	-38.8	-177.3	-58.2	-43.9	0	0	0	111.2	G26 V27 V32 N33	G26-D29 WeakPolarHBondContact CA-OD2 3.34Å; G26-D29 PolarHBondContact N-OD2 3.25Å; G26-D29 PolarHBondContact O-N 3.33Å; V27-D29 VanDerWaalsContact C-N 3.31Å; V27-D29 PolarHBondContact O-N 2.92Å; D29-V32 PolarHBondContact O-N 3.13Å; D29-N33 WeakPolarHBondContact O-CB 3.47Å; D29-N33 PolarHBondContact O-N 2.98Å
30	E	79.6	Confident	75.8	Confident	111 Å²	111	84.3 Å²	84.3	52%	0.519	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-46.6	175.3	-172	167.3	-166.9	0	0	112.1	G26 V27 I28 V32 N33 V34	G26-E30 PolarHBondContact O-N 2.93Å; V27-E30 PolarHBondContact O-N 3.03Å; I28-E30 VanDerWaalsContact C-N 3.3Å; I28-E30 PolarHBondContact O-N 2.84Å; E30-V32 VanDerWaalsContact C-N 3.35Å; E30-V32 PolarHBondContact O-N 3.24Å; E30-N33 PolarHBondContact O-N 3.47Å; E30-V34 WeakPolarHBondContact O-CG2 3.38Å; E30-V34 PolarHBondContact O-N 3.43Å
31	V	80.3	Confident	77.4	Confident	10 Å²	10	87.5 Å²	87.5	6%	0.061	45%	0.454	C	S	.	.	H	α-helix	trans	-61.8	-42.6	176.4	171	0	0	0	0	111.3	L6 L11 T15 V27 I28 V34 L35	L6-V31 HydrophobicContact CD1-CG1 3.76Å; L11-V31 HydrophobicContact CD1-CG1 3.86Å; L11-V31 HydrophobicContact CD1-CG2 4.16Å; T15-V31 HydrophobicContact CG2-CG2 4.08Å; V27-V31 WeakPolarHBondContact O-CG2 3.35Å; V27-V31 PolarHBondContact O-N 3.38Å; I28-V31 PolarHBondContact O-N 3.46Å; V31-V34 PolarHBondContact O-N 3.05Å; V31-L35 HydrophobicContact CG1-CD1 4.02Å; V31-L35 WeakPolarHBondContact O-CB 3.43Å; V31-L35 WeakPolarHBondContact O-CG 3.3Å; V31-L35 PolarHBondContact O-N 3.01Å
32	V	83.1	Confident	78.8	Confident	69 Å²	69	81.8 Å²	81.8	42%	0.418	42%	0.424	S	S	.	.	H	α-helix	trans	-62.4	-43.6	176.2	169.1	0	0	0	0	110.6	I28 D29 E30 V34 L35 L36	I28-V32 HydrophobicContact CG2-CG2 4.16Å; I28-V32 WeakPolarHBondContact O-CB 3.49Å; I28-V32 VanDerWaalsContact O-CG2 3.27Å; I28-V32 WeakPolarHBondContact O-CG2 3.41Å; I28-V32 PolarHBondContact O-N 3.49Å; D29-V32 PolarHBondContact O-N 3.13Å; E30-V32 VanDerWaalsContact C-N 3.35Å; E30-V32 PolarHBondContact O-N 3.24Å; V32-V34 VanDerWaalsContact C-N 3.33Å; V32-V34 PolarHBondContact O-N 2.95Å; V32-L35 PolarHBondContact O-N 2.66Å; V32-L36 HydrophobicContact CG1-CD1 3.97Å; V32-L36 HydrophobicContact CG1-CG 4.32Å; V32-L36 WeakPolarHBondContact O-CB 3.28Å; V32-L36 WeakPolarHBondContact O-CG 3.5Å; V32-L36 PolarHBondContact O-N 2.93Å
33	N	84.9	Confident	80.2	Confident	84 Å²	84	79 Å²	79	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-62.9	-39.7	177.9	-168.5	22.7	0	0	0	112	D29 E30 L36 K37	D29-N33 WeakPolarHBondContact O-CB 3.47Å; D29-N33 PolarHBondContact O-N 2.98Å; E30-N33 PolarHBondContact O-N 3.47Å; N33-L36 PolarHBondContact O-N 3.45Å; N33-K37 WeakPolarHBondContact O-CG 3.24Å; N33-K37 PolarHBondContact O-N 2.64Å
34	V	85.2	Confident	81.5	Confident	32 Å²	32	81.3 Å²	81.3	19%	0.194	42%	0.417	C	S	.	.	H	α-helix	trans	-64.4	-44.6	174	172.7	0	0	0	0	111.1	L6 Y14 E30 V31 V32 L36 K37 H38	L6-V34 HydrophobicContact CD2-CG1 4.04Å; Y14-V34 HydrophobicContact CD1-CG2 4.25Å; Y14-V34 HydrophobicContact CE1-CG2 3.62Å; Y14-V34 HydrophobicContact CE2-CB 4.48Å; Y14-V34 HydrophobicContact CE2-CG1 3.8Å; Y14-V34 HydrophobicContact CE2-CG2 4.28Å; E30-V34 WeakPolarHBondContact O-CG2 3.38Å; E30-V34 PolarHBondContact O-N 3.43Å; V31-V34 PolarHBondContact O-N 3.05Å; V32-V34 VanDerWaalsContact C-N 3.33Å; V32-V34 PolarHBondContact O-N 2.95Å; V34-L36 VanDerWaalsContact C-N 3.35Å; V34-L36 PolarHBondContact O-N 3.35Å; V34-K37 PolarHBondContact O-N 3.37Å; V34-H38 WeakPolarHBondContact O-CB 3.17Å; V34-H38 PolarHBondContact O-N 3.39Å
35	L	85.7	Confident	82.6	Confident	45 Å²	45	78.3 Å²	78.3	24%	0.236	41%	0.405	C	S	.	.	H	α-helix	trans	-63.3	-39.5	177.5	-77.5	169.9	0	0	0	112.2	F4 L6 V31 V32 H38 Y39	F4-L35 WeakPolarHBondContact CE2-O 3.47Å; F4-L35 HydrophobicContact CZ-CD2 4.46Å; L6-L35 HydrophobicContact CB-CD2 4.43Å; L6-L35 HydrophobicContact CD1-CD1 4.38Å; L6-L35 HydrophobicContact CD1-CD2 3.97Å; L6-L35 HydrophobicContact CD1-CG 3.88Å; L6-L35 HydrophobicContact CG-CD2 3.7Å; L6-L35 HydrophobicContact CG-CG 4.17Å; V31-L35 HydrophobicContact CG1-CD1 4.02Å; V31-L35 WeakPolarHBondContact O-CB 3.43Å; V31-L35 WeakPolarHBondContact O-CG 3.3Å; V31-L35 PolarHBondContact O-N 3.01Å; V32-L35 PolarHBondContact O-N 2.66Å; L35-H38 PolarHBondContact O-N 3.38Å; L35-Y39 WeakPolarHBondContact O-CB 3.37Å; L35-Y39 PolarHBondContact O-N 2.98Å
36	L	88.3	Confident	83.6	Confident	93 Å²	93	77 Å²	77	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-46.4	175.5	-74.9	171.7	0	0	0	111.3	V32 N33 V34 H38 Y39 E40	V32-L36 HydrophobicContact CG1-CD1 3.97Å; V32-L36 HydrophobicContact CG1-CG 4.32Å; V32-L36 WeakPolarHBondContact O-CB 3.28Å; V32-L36 WeakPolarHBondContact O-CG 3.5Å; V32-L36 PolarHBondContact O-N 2.93Å; N33-L36 PolarHBondContact O-N 3.45Å; V34-L36 VanDerWaalsContact C-N 3.35Å; V34-L36 PolarHBondContact O-N 3.35Å; L36-H38 VanDerWaalsContact C-N 3.3Å; L36-H38 PolarHBondContact O-N 3.18Å; L36-Y39 WeakPolarHBondContact O-CB 3.45Å; L36-Y39 PolarHBondContact O-N 3.42Å; L36-Y39 VanDerWaalsContact O-N 3.14Å; L36-E40 WeakPolarHBondContact O-CG 3.04Å; L36-E40 PolarHBondContact O-N 3.25Å
37	K	87.6	Confident	84.7	Confident	129 Å²	129	79.7 Å²	79.7	56%	0.561	39%	0.388	S	S	*	.	H	α-helix	trans	-61.3	-39.6	174.8	-72.8	179.5	-178.3	-178.4	0	112.5	N33 V34 Y39 K41	N33-K37 WeakPolarHBondContact O-CG 3.24Å; N33-K37 PolarHBondContact O-N 2.64Å; V34-K37 PolarHBondContact O-N 3.37Å; K37-Y39 VanDerWaalsContact C-N 3.34Å; K37-K41 PolarHBondContact O-N 2.77Å; K37-K41 VanDerWaalsContact O-N 3.16Å
38	H	85.8	Confident	85.7	Confident	71 Å²	71	84.2 Å²	84.2	33%	0.329	41%	0.407	S	S	.	.	H	α-helix	trans	-66.2	-38.9	175.5	-171.8	-90.1	0	0	0	111.4	F4 V34 L35 L36 K41 C42	F4-H38 AromaticContact CD2-ND1 3.88Å; V34-H38 WeakPolarHBondContact O-CB 3.17Å; V34-H38 PolarHBondContact O-N 3.39Å; L35-H38 PolarHBondContact O-N 3.38Å; L36-H38 VanDerWaalsContact C-N 3.3Å; L36-H38 PolarHBondContact O-N 3.18Å; H38-K41 PolarHBondContact O-N 3.23Å; H38-C42 PolarHBondContact CE1-SG 3.01Å; H38-C42 WeakPolarHBondContact O-CB 3.4Å; H38-C42 PolarHBondContact O-N 2.87Å; H38-C42 PolarHBondContact O-SG 3.01Å; H38-C42 VanDerWaalsContact O-SG 3.33Å
39	Y	86.2	Confident	86.6	Confident	109 Å²	109	83.5 Å²	83.5	43%	0.427	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-52.1	176.3	-178.3	-98.9	0	0	0	111.4	F4 L35 L36 K37 K41 C42 E43	F4-Y39 AromaticContact CD2-CD2 3.98Å; F4-Y39 HydrophobicContact CD2-CD2 3.98Å; F4-Y39 HydrophobicContact CE1-CD2 4.41Å; F4-Y39 AromaticContact CE2-CD2 3.72Å; F4-Y39 HydrophobicContact CE2-CD2 3.72Å; F4-Y39 HydrophobicContact CE2-CG 4.05Å; F4-Y39 HydrophobicContact CG-CD2 4.49Å; F4-Y39 AromaticContact CZ-CD2 3.92Å; F4-Y39 HydrophobicContact CZ-CD2 3.92Å; F4-Y39 HydrophobicContact CZ-CG 4.33Å; L35-Y39 WeakPolarHBondContact O-CB 3.37Å; L35-Y39 PolarHBondContact O-N 2.98Å; L36-Y39 WeakPolarHBondContact O-CB 3.45Å; L36-Y39 PolarHBondContact O-N 3.42Å; L36-Y39 VanDerWaalsContact O-N 3.14Å; K37-Y39 VanDerWaalsContact C-N 3.34Å; Y39-K41 VanDerWaalsContact C-N 3.3Å; Y39-K41 PolarHBondContact O-N 3.08Å; Y39-C42 PolarHBondContact O-N 2.78Å; Y39-C42 VanDerWaalsContact O-N 3.14Å; Y39-E43 HydrophobicContact CD1-CG 4.16Å; Y39-E43 HydrophobicContact CE1-CG 3.63Å; Y39-E43 HydrophobicContact CE2-CG 4.11Å; Y39-E43 PolarHBondContact O-N 2.99Å
40	E	88.8	Confident	87.3	Confident	122 Å²	122	82.7 Å²	82.7	57%	0.57	40%	0.404	S	S	*	.	H	α-helix	trans	-55.9	-46.9	178.9	-73.2	176	175.3	0	0	110.9	L36 C42 E43 D44	L36-E40 WeakPolarHBondContact O-CG 3.04Å; L36-E40 PolarHBondContact O-N 3.25Å; E40-C42 PolarHBondContact O-N 3.19Å; E40-E43 PolarHBondContact O-N 3.07Å; E40-D44 PolarHBondContact O-N 3.2Å
41	K	88.1	Confident	87.9	Confident	124 Å²	124	79.2 Å²	79.2	54%	0.539	39%	0.394	S	S	.	.	H	α-helix	trans	-60.7	-44.6	176.6	-173.5	-177.8	174.5	-168.5	0	112.7	K37 H38 Y39 E43 D44 E45	K37-K41 PolarHBondContact O-N 2.77Å; K37-K41 VanDerWaalsContact O-N 3.16Å; H38-K41 PolarHBondContact O-N 3.23Å; Y39-K41 VanDerWaalsContact C-N 3.3Å; Y39-K41 PolarHBondContact O-N 3.08Å; K41-E43 VanDerWaalsContact C-N 3.32Å; K41-E43 PolarHBondContact O-N 3.07Å; K41-D44 PolarHBondContact O-N 2.84Å; K41-E45 WeakPolarHBondContact CE-OE1 3.19Å; K41-E45 IonicContact NZ-OE1 2.78Å; K41-E45 WeakPolarHBondContact O-CG 3.49Å; K41-E45 PolarHBondContact O-N 3.13Å
42	C	87.4	Confident	88.5	Confident	19 Å²	19	83 Å²	83	13%	0.128	41%	0.411	C	S	.	.	H	α-helix	trans	-63.5	-38.8	177.5	-75.3	0	0	0	0	112.1	H38 Y39 E40 E45 R46	H38-C42 PolarHBondContact CE1-SG 3.01Å; H38-C42 WeakPolarHBondContact O-CB 3.4Å; H38-C42 PolarHBondContact O-N 2.87Å; H38-C42 PolarHBondContact O-SG 3.01Å; H38-C42 VanDerWaalsContact O-SG 3.33Å; Y39-C42 PolarHBondContact O-N 2.78Å; Y39-C42 VanDerWaalsContact O-N 3.14Å; E40-C42 PolarHBondContact O-N 3.19Å; C42-E45 PolarHBondContact O-N 2.76Å; C42-R46 WeakPolarHBondContact O-CB 3.37Å; C42-R46 PolarHBondContact O-N 3.09Å
43	E	86	Confident	89	Confident	50 Å²	50	84.7 Å²	84.7	23%	0.234	42%	0.417	C	S	.	.	H	α-helix	trans	-66.7	-42.3	177	-79.5	-62.9	109.2	0	0	111.8	Y39 E40 K41 E45 R46 I47	Y39-E43 HydrophobicContact CD1-CG 4.16Å; Y39-E43 HydrophobicContact CE1-CG 3.63Å; Y39-E43 HydrophobicContact CE2-CG 4.11Å; Y39-E43 PolarHBondContact O-N 2.99Å; E40-E43 PolarHBondContact O-N 3.07Å; K41-E43 VanDerWaalsContact C-N 3.32Å; K41-E43 PolarHBondContact O-N 3.07Å; E43-E45 PolarHBondContact O-N 3.42Å; E43-R46 WeakPolarHBondContact O-CB 3.34Å; E43-R46 PolarHBondContact O-N 3.35Å; E43-R46 IonicContact OE1-CZ 3.73Å; E43-R46 IonicContact OE1-NE 3.95Å; E43-R46 PolarHBondContact OE1-NE 3.35Å; E43-R46 IonicContact OE1-NH2 3.87Å; E43-R46 IonicContact OE2-CZ 2.98Å; E43-R46 IonicContact OE2-NE 2.7Å; E43-R46 PolarHBondContact OE2-NE 2.81Å; E43-R46 VanDerWaalsContact OE2-NE 3.14Å; E43-R46 IonicContact OE2-NH2 3.33Å; E43-R46 PolarHBondContact OE2-NH2 3.22Å; E43-I47 WeakPolarHBondContact O-CB 3.5Å; E43-I47 VanDerWaalsContact O-CG1 3.24Å; E43-I47 WeakPolarHBondContact O-CG1 3.36Å; E43-I47 PolarHBondContact O-N 3.36Å
44	D	88.4	Confident	89.3	Confident	97 Å²	97	84 Å²	84	52%	0.519	41%	0.411	S	S	.	.	H	α-helix	trans	-59.6	-46.6	174.6	-74.1	-19.9	0	0	0	111.4	E40 K41 R46 I47 H48	E40-D44 PolarHBondContact O-N 3.2Å; K41-D44 PolarHBondContact O-N 2.84Å; D44-R46 VanDerWaalsContact C-N 3.34Å; D44-R46 PolarHBondContact O-N 3.23Å; D44-I47 PolarHBondContact O-N 2.9Å; D44-H48 WeakPolarHBondContact O-CB 3.12Å; D44-H48 PolarHBondContact O-CD2 3.48Å; D44-H48 PolarHBondContact O-N 3.49Å
45	E	88.9	Confident	89.7	Confident	92 Å²	92	88 Å²	88	43%	0.43	42%	0.422	S	S	.	.	H	α-helix	trans	-63	-39.5	176.3	-71.2	179.3	-167.4	0	0	112	M2 K41 C42 E43 H48 S49	M2-E45 HydrophobicContact CE-CB 3.88Å; M2-E45 HydrophobicContact SD-CB 4.36Å; K41-E45 WeakPolarHBondContact CE-OE1 3.19Å; K41-E45 IonicContact NZ-OE1 2.78Å; K41-E45 WeakPolarHBondContact O-CG 3.49Å; K41-E45 PolarHBondContact O-N 3.13Å; C42-E45 PolarHBondContact O-N 2.76Å; E43-E45 PolarHBondContact O-N 3.42Å; E45-H48 PolarHBondContact O-N 3.07Å; E45-S49 WeakPolarHBondContact O-CB 3.44Å; E45-S49 PolarHBondContact O-N 2.97Å
46	R	88.6	Confident	90.2	Very high	104 Å²	104	91.6 Å²	91.6	39%	0.392	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-45.6	175.3	-174.1	-173	67.9	70.9	2.2	111.3	C42 E43 D44 S49 L50	C42-R46 WeakPolarHBondContact O-CB 3.37Å; C42-R46 PolarHBondContact O-N 3.09Å; E43-R46 WeakPolarHBondContact O-CB 3.34Å; E43-R46 PolarHBondContact O-N 3.35Å; E43-R46 IonicContact OE1-CZ 3.73Å; E43-R46 IonicContact OE1-NE 3.95Å; E43-R46 PolarHBondContact OE1-NE 3.35Å; E43-R46 IonicContact OE1-NH2 3.87Å; E43-R46 IonicContact OE2-CZ 2.98Å; E43-R46 IonicContact OE2-NE 2.7Å; E43-R46 PolarHBondContact OE2-NE 2.81Å; E43-R46 VanDerWaalsContact OE2-NE 3.14Å; E43-R46 IonicContact OE2-NH2 3.33Å; E43-R46 PolarHBondContact OE2-NH2 3.22Å; D44-R46 VanDerWaalsContact C-N 3.34Å; D44-R46 PolarHBondContact O-N 3.23Å; R46-S49 PolarHBondContact O-N 3.13Å; R46-L50 HydrophobicContact CG-CD1 4.39Å; R46-L50 WeakPolarHBondContact O-CG 3.35Å; R46-L50 PolarHBondContact O-N 2.87Å
47	I	92	Very high	90.4	Very high	91 Å²	91	94.1 Å²	94.1	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-62.9	-45.1	177.4	-69.7	163.9	0	0	0	110.1	E43 D44 S49 L50 A51	E43-I47 WeakPolarHBondContact O-CB 3.5Å; E43-I47 VanDerWaalsContact O-CG1 3.24Å; E43-I47 WeakPolarHBondContact O-CG1 3.36Å; E43-I47 PolarHBondContact O-N 3.36Å; D44-I47 PolarHBondContact O-N 2.9Å; I47-S49 PolarHBondContact O-N 3.3Å; I47-L50 PolarHBondContact O-N 3.22Å; I47-A51 WeakPolarHBondContact O-CB 3.49Å; I47-A51 PolarHBondContact O-N 3.35Å
48	H	92.8	Very high	90.5	Very high	131 Å²	131	92.2 Å²	92.2	61%	0.606	43%	0.433	S	S	*	.	H	α-helix	trans	-60.6	-43.3	176.2	-86.7	-64.9	0	0	0	112.6	D44 E45 A51 E52	D44-H48 WeakPolarHBondContact O-CB 3.12Å; D44-H48 PolarHBondContact O-CD2 3.48Å; D44-H48 PolarHBondContact O-N 3.49Å; E45-H48 PolarHBondContact O-N 3.07Å; H48-A51 PolarHBondContact O-N 3.44Å; H48-E52 PolarHBondContact O-N 2.95Å
49	S	92.4	Very high	90.7	Very high	61 Å²	61	95 Å²	95	43%	0.427	45%	0.446	S	S	.	.	H	α-helix	trans	-62.2	-43.3	176.8	-175	0	0	0	0	111.9	E45 R46 I47 E52 I53	E45-S49 WeakPolarHBondContact O-CB 3.44Å; E45-S49 PolarHBondContact O-N 2.97Å; R46-S49 PolarHBondContact O-N 3.13Å; I47-S49 PolarHBondContact O-N 3.3Å; S49-E52 WeakPolarHBondContact O-CB 3.33Å; S49-E52 PolarHBondContact O-N 3.08Å; S49-I53 WeakPolarHBondContact O-CG1 3.45Å; S49-I53 PolarHBondContact O-N 2.7Å; S49-I53 VanDerWaalsContact O-N 3.08Å
50	L	92.8	Very high	91	Very high	92 Å²	92	94.5 Å²	94.5	48%	0.482	45%	0.451	S	S	.	.	H	α-helix	trans	-64.2	-41.1	175.5	-75.6	169.9	0	0	0	112.2	R46 I47 E52 I53 E54	R46-L50 HydrophobicContact CG-CD1 4.39Å; R46-L50 WeakPolarHBondContact O-CG 3.35Å; R46-L50 PolarHBondContact O-N 2.87Å; I47-L50 PolarHBondContact O-N 3.22Å; L50-E52 VanDerWaalsContact C-N 3.32Å; L50-E52 PolarHBondContact O-N 3.14Å; L50-I53 PolarHBondContact O-N 3.39Å; L50-E54 PolarHBondContact O-N 3.23Å
51	A	92.3	Very high	90.9	Very high	39 Å²	39	93.2 Å²	93.2	32%	0.322	45%	0.448	S	S	.	.	H	α-helix	trans	-63.4	-37.7	175.8	0	0	0	0	0	112	I47 H48 E54 R55	I47-A51 WeakPolarHBondContact O-CB 3.49Å; I47-A51 PolarHBondContact O-N 3.35Å; H48-A51 PolarHBondContact O-N 3.44Å; A51-E54 PolarHBondContact O-N 3.09Å; A51-R55 WeakPolarHBondContact O-CG 3.22Å; A51-R55 PolarHBondContact O-N 3.26Å
52	E	93.9	Very high	90.7	Very high	90 Å²	90	93 Å²	93	42%	0.421	45%	0.448	S	S	.	.	H	α-helix	trans	-61.8	-45.7	174.4	-166.2	83.8	-116.8	0	0	111.8	H48 S49 L50 E54 R55 K56	H48-E52 PolarHBondContact O-N 2.95Å; S49-E52 WeakPolarHBondContact O-CB 3.33Å; S49-E52 PolarHBondContact O-N 3.08Å; L50-E52 VanDerWaalsContact C-N 3.32Å; L50-E52 PolarHBondContact O-N 3.14Å; E52-E54 VanDerWaalsContact C-N 3.31Å; E52-E54 PolarHBondContact O-N 3.25Å; E52-R55 PolarHBondContact O-N 3.14Å; E52-R55 IonicContact OE1-CZ 2.73Å; E52-R55 IonicContact OE1-NE 3.83Å; E52-R55 IonicContact OE1-NH2 3.87Å; E52-R55 PolarHBondContact OE1-NH2 3.12Å; E52-R55 IonicContact OE2-NH2 2.64Å; E52-R55 PolarHBondContact OE2-NH2 3.25Å; E52-K56 WeakPolarHBondContact O-CG 3.44Å; E52-K56 PolarHBondContact O-N 2.76Å
53	I	92.9	Very high	90.7	Very high	104 Å²	104	94.1 Å²	94.1	53%	0.533	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-43.4	177.6	-66.8	164.7	0	0	0	109.9	S49 L50 K56 R57	S49-I53 WeakPolarHBondContact O-CG1 3.45Å; S49-I53 PolarHBondContact O-N 2.7Å; S49-I53 VanDerWaalsContact O-N 3.08Å; L50-I53 PolarHBondContact O-N 3.39Å; I53-K56 PolarHBondContact O-N 2.98Å; I53-R57 PolarHBondContact O-N 3.34Å
54	E	91.9	Very high	90.5	Very high	69 Å²	69	96.5 Å²	96.5	32%	0.322	47%	0.471	S	S	.	.	H	α-helix	trans	-65.9	-41.3	178.6	-173.5	62.8	-179.2	0	0	112.6	L50 A51 E52 K56 R57 M58	L50-E54 PolarHBondContact O-N 3.23Å; A51-E54 PolarHBondContact O-N 3.09Å; E52-E54 VanDerWaalsContact C-N 3.31Å; E52-E54 PolarHBondContact O-N 3.25Å; E54-K56 VanDerWaalsContact C-N 3.31Å; E54-K56 PolarHBondContact O-N 3.17Å; E54-R57 WeakPolarHBondContact O-CB 3.46Å; E54-R57 PolarHBondContact O-N 2.83Å; E54-R57 VanDerWaalsContact O-N 3.16Å; E54-R57 IonicContact OE1-CZ 3.14Å; E54-R57 IonicContact OE1-NH1 3.13Å; E54-R57 PolarHBondContact OE1-NH1 2.78Å; E54-R57 IonicContact OE1-NH2 3.99Å; E54-R57 PolarHBondContact OE1-NH2 3.24Å; E54-R57 IonicContact OE2-CZ 2.93Å; E54-R57 IonicContact OE2-NE 3.26Å; E54-R57 IonicContact OE2-NH1 3.42Å; E54-R57 PolarHBondContact OE2-NH1 2.97Å; E54-M58 HydrophobicContact CG-CE 4.39Å; E54-M58 WeakPolarHBondContact O-CG 3.27Å; E54-M58 PolarHBondContact O-N 3.42Å
55	R	93.3	Very high	90.1	Very high	116 Å²	116	95.4 Å²	95.4	44%	0.438	47%	0.467	S	S	.	.	H	α-helix	trans	-57.5	-44.8	173.2	-75.2	-169.2	-53.6	-103.2	7.5	111.6	A51 E52 M58 Q59	A51-R55 WeakPolarHBondContact O-CG 3.22Å; A51-R55 PolarHBondContact O-N 3.26Å; E52-R55 PolarHBondContact O-N 3.14Å; E52-R55 IonicContact OE1-CZ 2.73Å; E52-R55 IonicContact OE1-NE 3.83Å; E52-R55 IonicContact OE1-NH2 3.87Å; E52-R55 PolarHBondContact OE1-NH2 3.12Å; E52-R55 IonicContact OE2-NH2 2.64Å; E52-R55 PolarHBondContact OE2-NH2 3.25Å; R55-M58 HydrophobicContact CG-CE 4.35Å; R55-M58 PolarHBondContact O-N 3.43Å; R55-Q59 WeakPolarHBondContact O-CB 3.35Å; R55-Q59 PolarHBondContact O-N 3.27Å
56	K	94.8	Very high	89.4	Confident	120 Å²	120	96.7 Å²	96.7	52%	0.522	47%	0.474	S	S	.	.	H	α-helix	trans	-63.3	-40.4	176	-71.5	177.7	-178	178.7	0	112	E52 I53 E54 M58 Q59 N60	E52-K56 WeakPolarHBondContact O-CG 3.44Å; E52-K56 PolarHBondContact O-N 2.76Å; I53-K56 PolarHBondContact O-N 2.98Å; E54-K56 VanDerWaalsContact C-N 3.31Å; E54-K56 PolarHBondContact O-N 3.17Å; K56-M58 PolarHBondContact O-N 2.93Å; K56-Q59 PolarHBondContact O-N 2.98Å; K56-N60 WeakPolarHBondContact O-CB 3.41Å; K56-N60 VanDerWaalsContact O-CG 3.25Å; K56-N60 PolarHBondContact O-N 3.2Å
57	R	92.7	Very high	88.6	Confident	147 Å²	147	97.3 Å²	97.3	56%	0.555	48%	0.484	S	S	*	.	H	α-helix	trans	-60.1	-45.9	176.2	-163.2	-170.1	102	-143.1	-3.7	111.3	I53 E54 N60 L61	I53-R57 PolarHBondContact O-N 3.34Å; E54-R57 WeakPolarHBondContact O-CB 3.46Å; E54-R57 PolarHBondContact O-N 2.83Å; E54-R57 VanDerWaalsContact O-N 3.16Å; E54-R57 IonicContact OE1-CZ 3.14Å; E54-R57 IonicContact OE1-NH1 3.13Å; E54-R57 PolarHBondContact OE1-NH1 2.78Å; E54-R57 IonicContact OE1-NH2 3.99Å; E54-R57 PolarHBondContact OE1-NH2 3.24Å; E54-R57 IonicContact OE2-CZ 2.93Å; E54-R57 IonicContact OE2-NE 3.26Å; E54-R57 IonicContact OE2-NH1 3.42Å; E54-R57 PolarHBondContact OE2-NH1 2.97Å; R57-N60 PolarHBondContact O-N 2.97Å; R57-L61 WeakPolarHBondContact O-CB 3.48Å; R57-L61 PolarHBondContact O-N 3.37Å
58	M	90.4	Very high	87.5	Confident	89 Å²	89	99.4 Å²	99.4	44%	0.438	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-45.4	177.8	-69.4	-173.9	-62.3	0	0	111.8	E54 R55 K56 N60 L61 E62	E54-M58 HydrophobicContact CG-CE 4.39Å; E54-M58 WeakPolarHBondContact O-CG 3.27Å; E54-M58 PolarHBondContact O-N 3.42Å; R55-M58 HydrophobicContact CG-CE 4.35Å; R55-M58 PolarHBondContact O-N 3.43Å; K56-M58 PolarHBondContact O-N 2.93Å; M58-N60 VanDerWaalsContact C-N 3.32Å; M58-N60 PolarHBondContact O-N 3.17Å; M58-L61 WeakPolarHBondContact O-CB 3.48Å; M58-L61 PolarHBondContact O-N 3.29Å; M58-L61 VanDerWaalsContact O-N 3.15Å; M58-E62 WeakPolarHBondContact O-CG 3.45Å; M58-E62 PolarHBondContact O-N 3.21Å
59	Q	90.8	Very high	86.6	Confident	128 Å²	128	99.6 Å²	99.6	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-59.9	-42	177.5	-173.9	179.4	17.7	0	0	112.2	R55 K56 E62 A63	R55-Q59 WeakPolarHBondContact O-CB 3.35Å; R55-Q59 PolarHBondContact O-N 3.27Å; K56-Q59 PolarHBondContact O-N 2.98Å; Q59-E62 PolarHBondContact O-N 3.41Å; Q59-A63 WeakPolarHBondContact O-CB 3.24Å; Q59-A63 PolarHBondContact O-N 2.97Å
60	N	91.2	Very high	85.2	Confident	99 Å²	99	101.3 Å²	101.3	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-42	175.9	-72	-10	0	0	0	111.5	K56 R57 M58 A63 E64	K56-N60 WeakPolarHBondContact O-CB 3.41Å; K56-N60 VanDerWaalsContact O-CG 3.25Å; K56-N60 PolarHBondContact O-N 3.2Å; R57-N60 PolarHBondContact O-N 2.97Å; M58-N60 VanDerWaalsContact C-N 3.32Å; M58-N60 PolarHBondContact O-N 3.17Å; N60-A63 PolarHBondContact O-N 3.4Å; N60-E64 WeakPolarHBondContact O-CG 3.34Å; N60-E64 PolarHBondContact O-N 3.17Å
61	L	87.8	Confident	83.8	Confident	96 Å²	96	102.7 Å²	102.7	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-62.9	-43.2	177.8	-172.3	68.4	0	0	0	111.7	R57 M58 E64 T65	R57-L61 WeakPolarHBondContact O-CB 3.48Å; R57-L61 PolarHBondContact O-N 3.37Å; M58-L61 WeakPolarHBondContact O-CB 3.48Å; M58-L61 PolarHBondContact O-N 3.29Å; M58-L61 VanDerWaalsContact O-N 3.15Å; L61-E64 PolarHBondContact O-N 2.87Å; L61-T65 WeakPolarHBondContact O-CG2 3.43Å; L61-T65 PolarHBondContact O-N 2.98Å
62	E	83.7	Confident	82.2	Confident	118 Å²	118	107.1 Å²	107.1	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-59.7	-50.5	174.8	-73.4	173.5	-178.9	0	0	110.9	M58 Q59 E64 T65 E66	M58-E62 WeakPolarHBondContact O-CG 3.45Å; M58-E62 PolarHBondContact O-N 3.21Å; Q59-E62 PolarHBondContact O-N 3.41Å; E62-E64 VanDerWaalsContact C-N 3.31Å; E62-E64 PolarHBondContact O-N 3.42Å; E62-T65 PolarHBondContact O-N 3.42Å; E62-T65 PolarHBondContact O-OG1 3.08Å; E62-E66 PolarHBondContact O-N 2.77Å
63	A	86.1	Confident	80.7	Confident	44 Å²	44	107.9 Å²	107.9	36%	0.364	53%	0.53	S	S	.	.	H	α-helix	trans	-58.6	-40.4	177.5	0	0	0	0	0	112.7	Q59 N60 T65 E66 L67	Q59-A63 WeakPolarHBondContact O-CB 3.24Å; Q59-A63 PolarHBondContact O-N 2.97Å; N60-A63 PolarHBondContact O-N 3.4Å; A63-T65 VanDerWaalsContact C-N 3.34Å; A63-T65 PolarHBondContact O-N 2.88Å; A63-E66 PolarHBondContact O-N 3.33Å; A63-L67 WeakPolarHBondContact O-CB 3.42Å; A63-L67 VanDerWaalsContact O-CG 3.29Å; A63-L67 WeakPolarHBondContact O-CG 3.4Å; A63-L67 PolarHBondContact O-N 2.7Å
64	E	82.6	Confident	79.3	Confident	99 Å²	99	109.1 Å²	109.1	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-63.1	-39.5	173.7	-77.3	-178.2	-156.6	0	0	112.4	N60 L61 E62 K68	N60-E64 WeakPolarHBondContact O-CG 3.34Å; N60-E64 PolarHBondContact O-N 3.17Å; L61-E64 PolarHBondContact O-N 2.87Å; E62-E64 VanDerWaalsContact C-N 3.31Å; E62-E64 PolarHBondContact O-N 3.42Å; E64-K68 WeakPolarHBondContact O-CB 3.18Å; E64-K68 VanDerWaalsContact O-CG 3.26Å; E64-K68 WeakPolarHBondContact O-CG 3.44Å; E64-K68 PolarHBondContact O-N 3.14Å
65	T	79.4	Confident	77.6	Confident	74 Å²	74	112.9 Å²	112.9	45%	0.454	55%	0.552	S	S	.	*	H	α-helix	trans	-69.7	-39.3	178.6	65.1	0	0	0	0	112.4	L61 E62 A63 K68 Q69	L61-T65 WeakPolarHBondContact O-CG2 3.43Å; L61-T65 PolarHBondContact O-N 2.98Å; E62-T65 PolarHBondContact O-N 3.42Å; E62-T65 PolarHBondContact O-OG1 3.08Å; A63-T65 VanDerWaalsContact C-N 3.34Å; A63-T65 PolarHBondContact O-N 2.88Å; T65-K68 PolarHBondContact O-N 2.93Å; T65-Q69 PolarHBondContact O-N 2.92Å
66	E	74.7	Confident	75.6	Confident	120 Å²	120	117.8 Å²	117.8	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-63	-45	174	-70.1	-177.3	-178.1	0	0	111.2	E62 A63 K68 Q69 I70	E62-E66 PolarHBondContact O-N 2.77Å; A63-E66 PolarHBondContact O-N 3.33Å; E66-K68 VanDerWaalsContact C-N 3.33Å; E66-K68 PolarHBondContact O-N 2.86Å; E66-Q69 PolarHBondContact O-N 3.48Å; E66-I70 WeakPolarHBondContact O-CG1 3.38Å; E66-I70 PolarHBondContact O-N 3.38Å
67	L	72	Confident	74	Confident	116 Å²	116	120 Å²	120	61%	0.607	58%	0.582	S	S	*	*	H	α-helix	trans	-59.6	-42.6	174.6	-76.4	166.9	0	0	0	111.9	A63 Q69 I70 H71	A63-L67 WeakPolarHBondContact O-CB 3.42Å; A63-L67 VanDerWaalsContact O-CG 3.29Å; A63-L67 WeakPolarHBondContact O-CG 3.4Å; A63-L67 PolarHBondContact O-N 2.7Å; L67-Q69 VanDerWaalsContact C-N 3.35Å; L67-I70 PolarHBondContact O-N 3.49Å; L67-H71 WeakPolarHBondContact O-CB 3.46Å; L67-H71 PolarHBondContact O-N 3.44Å
68	K	70.1	Confident	72.3	Confident	136 Å²	136	118.1 Å²	118.1	59%	0.591	59%	0.589	S	S	*	*	H	α-helix	trans	-62.3	-41.4	175.3	-75.6	170	-173	168.3	0	111.6	E64 T65 E66 H71 L72	E64-K68 WeakPolarHBondContact O-CB 3.18Å; E64-K68 VanDerWaalsContact O-CG 3.26Å; E64-K68 WeakPolarHBondContact O-CG 3.44Å; E64-K68 PolarHBondContact O-N 3.14Å; T65-K68 PolarHBondContact O-N 2.93Å; E66-K68 VanDerWaalsContact C-N 3.33Å; E66-K68 PolarHBondContact O-N 2.86Å; K68-H71 PolarHBondContact O-N 3.23Å; K68-L72 PolarHBondContact O-N 3.48Å
69	Q	72.1	Confident	70.6	Confident	135 Å²	135	122.3 Å²	122.3	63%	0.631	61%	0.605	S	S	*	*	H	α-helix	trans	-65	-45	177.3	-170.7	176.1	19.5	0	0	111.7	T65 E66 L67 H71 L72 C73	T65-Q69 PolarHBondContact O-N 2.92Å; E66-Q69 PolarHBondContact O-N 3.48Å; L67-Q69 VanDerWaalsContact C-N 3.35Å; Q69-H71 VanDerWaalsContact C-N 3.32Å; Q69-H71 PolarHBondContact O-N 3.14Å; Q69-L72 WeakPolarHBondContact O-CB 3.35Å; Q69-L72 PolarHBondContact O-N 3.41Å; Q69-C73 PolarHBondContact O-N 3.16Å; Q69-C73 VanDerWaalsContact O-N 3.08Å; Q69-C73 PolarHBondContact O-SG 2.93Å; Q69-C73 VanDerWaalsContact O-SG 3.37Å
70	I	64.4	Low	68.5	Low	96 Å²	96	121.8 Å²	121.8	49%	0.492	62%	0.615	S	S	.	*	H	α-helix	trans	-60	-44.8	175.1	-65.9	167.6	0	0	0	110.3	E66 L67 L72 C73 L74	E66-I70 WeakPolarHBondContact O-CG1 3.38Å; E66-I70 PolarHBondContact O-N 3.38Å; L67-I70 PolarHBondContact O-N 3.49Å; I70-L72 VanDerWaalsContact C-N 3.29Å; I70-L72 PolarHBondContact O-N 3.37Å; I70-C73 PolarHBondContact O-N 3.24Å; I70-L74 HydrophobicContact CG2-CD1 3.75Å; I70-L74 HydrophobicContact CG2-CG 4.28Å; I70-L74 WeakPolarHBondContact O-CB 3.46Å; I70-L74 WeakPolarHBondContact O-CG 3.48Å; I70-L74 PolarHBondContact O-N 2.89Å
71	H	62.4	Low	66.5	Low	121 Å²	121	124.8 Å²	124.8	56%	0.56	63%	0.625	S	S	*	*	H	α-helix	trans	-62.7	-36.9	179	-164.3	96.7	0	0	0	112	L67 K68 Q69 L74 K75	L67-H71 WeakPolarHBondContact O-CB 3.46Å; L67-H71 PolarHBondContact O-N 3.44Å; K68-H71 PolarHBondContact O-N 3.23Å; Q69-H71 VanDerWaalsContact C-N 3.32Å; Q69-H71 PolarHBondContact O-N 3.14Å; H71-L74 PolarHBondContact O-N 2.96Å; H71-K75 WeakPolarHBondContact O-CG 3.38Å; H71-K75 PolarHBondContact O-N 3.05Å; H71-K75 VanDerWaalsContact O-N 3.16Å
72	L	58.6	Low	64.4	Low	132 Å²	132	126.8 Å²	126.8	69%	0.691	64%	0.642	S	S	*	*	H	α-helix	trans	-63.1	-44.2	175	-160.2	82.1	0	0	0	111.3	K68 Q69 I70 L74 K75	K68-L72 PolarHBondContact O-N 3.48Å; Q69-L72 WeakPolarHBondContact O-CB 3.35Å; Q69-L72 PolarHBondContact O-N 3.41Å; I70-L72 VanDerWaalsContact C-N 3.29Å; I70-L72 PolarHBondContact O-N 3.37Å; L72-L74 VanDerWaalsContact C-N 3.31Å; L72-L74 PolarHBondContact O-N 3.48Å; L72-K75 PolarHBondContact O-N 3.12Å
73	C	62.7	Low	62.9	Low	107 Å²	107	129.9 Å²	129.9	72%	0.723	65%	0.653	S	S	*	*	H	α-helix	trans	-67.5	-30	177.2	-65.4	0	0	0	0	113.1	Q69 I70	Q69-C73 PolarHBondContact O-N 3.16Å; Q69-C73 VanDerWaalsContact O-N 3.08Å; Q69-C73 PolarHBondContact O-SG 2.93Å; Q69-C73 VanDerWaalsContact O-SG 3.37Å; I70-C73 PolarHBondContact O-N 3.24Å
74	L	63.4	Low	61.3	Low	129 Å²	129	137.1 Å²	137.1	68%	0.675	68%	0.677	S	S	*	*	H	α-helix	trans	-84.1	-9.6	178.8	-72.7	174.6	0	0	0	114	I70 H71 L72 R76	I70-L74 HydrophobicContact CG2-CD1 3.75Å; I70-L74 HydrophobicContact CG2-CG 4.28Å; I70-L74 WeakPolarHBondContact O-CB 3.46Å; I70-L74 WeakPolarHBondContact O-CG 3.48Å; I70-L74 PolarHBondContact O-N 2.89Å; H71-L74 PolarHBondContact O-N 2.96Å; L72-L74 VanDerWaalsContact C-N 3.31Å; L72-L74 PolarHBondContact O-N 3.48Å; L74-R76 VanDerWaalsContact C-N 3.26Å; L74-R76 PolarHBondContact O-N 2.85Å
75	K	56.8	Low	59.6	Low	148 Å²	148	140.3 Å²	140.3	64%	0.643	70%	0.696	S	S	*	*			trans	-63.6	93.1	174.4	-72.7	-145.7	178.3	-178.3	0	109.2	H71 L72 E77	H71-K75 WeakPolarHBondContact O-CG 3.38Å; H71-K75 PolarHBondContact O-N 3.05Å; H71-K75 VanDerWaalsContact O-N 3.16Å; L72-K75 PolarHBondContact O-N 3.12Å; K75-E77 PolarHBondContact O-N 2.97Å; K75-E77 VanDerWaalsContact O-N 3.12Å
76	R	51.4	Low	58	Low	220 Å²	220	141.9 Å²	141.9	83%	0.83	71%	0.706	S	S	*	*			trans	-53.3	117	175.9	-161.8	176.9	-170.8	133.9	4.1	107.9	L74 P78	L74-R76 VanDerWaalsContact C-N 3.26Å; L74-R76 PolarHBondContact O-N 2.85Å; R76-P78 VanDerWaalsContact O-N 3.09Å
77	E	60.9	Low	56.5	Low	165 Å²	165	147.8 Å²	147.8	77%	0.771	72%	0.723	S	S	*	*			trans	-35.8	117.7	170.1	-85.9	-83.3	152.5	0	0	108.8	K75 K79	K75-E77 PolarHBondContact O-N 2.97Å; K75-E77 VanDerWaalsContact O-N 3.12Å; E77-K79 PolarHBondContact O-N 2.81Å
78	P	56.5	Low	55.3	Low	108 Å²	108	150.8 Å²	150.8	70%	0.701	73%	0.731	S	S	*	*			trans	-59.5	114.3	-175.1	21.5	-29.6	0	0	0	107.1	R76 C80	R76-P78 VanDerWaalsContact O-N 3.09Å; P78-C80 PolarHBondContact O-N 2.89Å
79	K	54.8	Low	54.4	Low	178 Å²	178	150.9 Å²	150.9	77%	0.774	74%	0.743	S	S	*	*			trans	-43.2	107.6	177.8	-92.1	176.5	172.9	175.4	0	107.9	E77 Q81	E77-K79 PolarHBondContact O-N 2.81Å; K79-Q81 PolarHBondContact O-N 3.25Å
80	C	47	Very low	53.2	Low	117 Å²	117	150.7 Å²	150.7	79%	0.791	75%	0.751	S	S	*	*			trans	-54.4	96.4	170.1	-82	0	0	0	0	107	P78 T82	P78-C80 PolarHBondContact O-N 2.89Å; C80-T82 VanDerWaalsContact C-N 3.32Å; C80-T82 PolarHBondContact O-N 3.13Å
81	Q	48.6	Very low	53.1	Low	162 Å²	162	155.1 Å²	155.1	76%	0.757	77%	0.766	S	S	*	*			trans	-64.6	104.8	167.5	-71	-173.4	17	0	0	104.8	K79 K83	K79-Q81 PolarHBondContact O-N 3.25Å; Q81-K83 PolarHBondContact O-N 3.5Å
82	T	44.8	Very low	52.8	Low	137 Å²	137	154.4 Å²	154.4	84%	0.84	77%	0.772	S	S	*	*			trans	-60.4	83.7	168.9	22.1	0	0	0	0	107.7	C80 K84	C80-T82 VanDerWaalsContact C-N 3.32Å; C80-T82 PolarHBondContact O-N 3.13Å; T82-K84 PolarHBondContact O-N 3Å; T82-K84 VanDerWaalsContact O-N 3.1Å
83	K	51.5	Low	53.3	Low	183 Å²	183	154 Å²	154	80%	0.796	78%	0.781	S	S	*	*			trans	-64.2	113.4	171.7	-71.3	-174	179.6	179.9	0	106.6	Q81 L85	Q81-K83 PolarHBondContact O-N 3.5Å; K83-L85 PolarHBondContact O-N 3.3Å
84	K	51.9	Low	53.6	Low	197 Å²	197	153.6 Å²	153.6	86%	0.857	77%	0.77	S	S	*	*			trans	-51.3	124.8	178.3	-67.9	-173.3	176.9	-177.7	0	109.1	T82 T86	T82-K84 PolarHBondContact O-N 3Å; T82-K84 VanDerWaalsContact O-N 3.1Å; K84-T86 VanDerWaalsContact C-N 3.33Å; K84-T86 PolarHBondContact O-N 3.31Å
85	L	47.3	Very low	54.2	Low	166 Å²	166	151.8 Å²	151.8	87%	0.869	76%	0.758	S	S	*	*			trans	-65	85.7	-176.9	-164.4	85.2	0	0	0	109.9	K83 R87	K83-L85 PolarHBondContact O-N 3.3Å; L85-R87 PolarHBondContact O-N 3.37Å
86	T	45.6	Very low	55.2	Low	107 Å²	107	152.9 Å²	152.9	66%	0.656	76%	0.759	S	S	*	*			trans	-67.6	113.8	165.3	42.4	0	0	0	0	107.8	K84 K88	K84-T86 VanDerWaalsContact C-N 3.33Å; K84-T86 PolarHBondContact O-N 3.31Å; T86-K88 VanDerWaalsContact C-N 3.31Å; T86-K88 PolarHBondContact O-N 3.45Å
87	R	43.5	Very low	56.2	Low	243 Å²	243	147.8 Å²	147.8	92%	0.917	75%	0.745	S	S	*	*			trans	-53.7	91.5	173.5	-77.1	179.1	174.2	162.8	-2.2	109.4	L85	L85-R87 PolarHBondContact O-N 3.37Å
88	K	47.4	Very low	56.7	Low	179 Å²	179	143.9 Å²	143.9	78%	0.778	73%	0.727	S	S	*	*			trans	-86.5	129.7	166.6	-70.8	-170.3	177.4	-177	0	107.3	T86 V90	T86-K88 VanDerWaalsContact C-N 3.31Å; T86-K88 PolarHBondContact O-N 3.45Å; K88-V90 PolarHBondContact O-N 2.89Å
89	T	51.1	Low	57.2	Low	138 Å²	138	140.9 Å²	140.9	85%	0.847	71%	0.707	S	S	*	*			trans	-38.5	120.4	176.3	-39.6	0	0	0	0	110	K91	T89-K91 PolarHBondContact O-N 3.39Å
90	V	47.6	Very low	57.8	Low	131 Å²	131	138.8 Å²	138.8	79%	0.794	70%	0.7	S	S	*	*			trans	-59.6	99.3	-176.1	178.6	0	0	0	0	107.9	K88	K88-V90 PolarHBondContact O-N 2.89Å
91	K	60.8	Low	58.8	Low	189 Å²	189	139.2 Å²	139.2	82%	0.822	69%	0.688	S	S	*	*			trans	-67.9	129.3	160.9	-76.3	-175.5	175.5	-175.5	0	106.1	T89 S93	T89-K91 PolarHBondContact O-N 3.39Å; K91-S93 PolarHBondContact O-N 2.9Å
92	P	57.3	Low	59.8	Low	106 Å²	106	138.1 Å²	138.1	69%	0.688	70%	0.695	S	S	*	*			trans	-53.1	131.2	178.9	8	-14.6	0	0	0	109.1	I94	P92-I94 VanDerWaalsContact C-N 3.32Å; P92-I94 PolarHBondContact O-N 2.89Å
93	S	69.2	Low	60.9	Low	125 Å²	125	134.9 Å²	134.9	87%	0.874	69%	0.69	S	S	*	*			trans	-66.8	92.6	179	173.3	0	0	0	0	108.7	K91	K91-S93 PolarHBondContact O-N 2.9Å
94	I	68.7	Low	61.6	Low	97 Å²	97	131.4 Å²	131.4	50%	0.497	68%	0.678	S	S	.	*			trans	-74	129.5	171.1	-65	169.4	0	0	0	107.4	P92 E98 T99	P92-I94 VanDerWaalsContact C-N 3.32Å; P92-I94 PolarHBondContact O-N 2.89Å; I94-E98 HydrophobicContact CG2-CB 3.72Å; I94-E98 WeakPolarHBondContact CG2-OE2 3.34Å; I94-T99 HydrophobicContact CG2-CG2 4.18Å
95	H	75.2	Confident	62	Low	91 Å²	91	128.1 Å²	128.1	42%	0.421	67%	0.665	S	S	.	*			trans	-64	136.4	-179.8	-176.9	-78.8	0	0	0	109.5	M97 E98	H95-M97 WeakPolarHBondContact CE1-CE 3.47Å; H95-M97 PolarHBondContact ND1-N 3.33Å; H95-M97 VanDerWaalsContact ND1-N 3.19Å; H95-M97 PolarHBondContact O-N 3.21Å; H95-M97 VanDerWaalsContact O-N 3.09Å; H95-E98 HydrophobicContact CB-CG 4.23Å; H95-E98 WeakPolarHBondContact O-CA 3.44Å; H95-E98 VanDerWaalsContact O-CB 3.28Å; H95-E98 WeakPolarHBondContact O-CB 3.46Å; H95-E98 PolarHBondContact O-N 3.22Å
96	W	77.1	Confident	62.8	Low	171 Å²	171	125.3 Å²	125.3	65%	0.648	66%	0.656	S	S	*	*	H	α-helix	trans	-58.2	-30.4	-171.9	72.9	-89.8	0	0	0	113.9	E98 T99	W96-E98 PolarHBondContact O-N 3.08Å; W96-T99 PolarHBondContact O-N 3.46Å; W96-T99 PolarHBondContact O-OG1 2.73Å
97	M	73.2	Confident	63.3	Low	113 Å²	113	125.7 Å²	125.7	56%	0.557	66%	0.661	S	S	*	*	H	α-helix	trans	-64.7	-28.2	172.9	-75.3	-171.1	-84.7	0	0	112.8	H95 T99 Q100	H95-M97 WeakPolarHBondContact CE1-CE 3.47Å; H95-M97 PolarHBondContact ND1-N 3.33Å; H95-M97 VanDerWaalsContact ND1-N 3.19Å; H95-M97 PolarHBondContact O-N 3.21Å; H95-M97 VanDerWaalsContact O-N 3.09Å; M97-T99 VanDerWaalsContact C-N 3.32Å; M97-Q100 PolarHBondContact O-N 2.64Å
98	E	72	Confident	64.2	Low	84 Å²	84	120 Å²	120	39%	0.393	66%	0.656	S	S	.	*	H	α-helix	trans	-72	-28.5	177.8	-63.2	-175.6	141.1	0	0	111.8	I94 H95 W96 Q100 K101 M104	I94-E98 HydrophobicContact CG2-CB 3.72Å; I94-E98 WeakPolarHBondContact CG2-OE2 3.34Å; H95-E98 HydrophobicContact CB-CG 4.23Å; H95-E98 WeakPolarHBondContact O-CA 3.44Å; H95-E98 VanDerWaalsContact O-CB 3.28Å; H95-E98 WeakPolarHBondContact O-CB 3.46Å; H95-E98 PolarHBondContact O-N 3.22Å; W96-E98 PolarHBondContact O-N 3.08Å; E98-Q100 PolarHBondContact O-N 3.29Å; E98-K101 WeakPolarHBondContact O-CB 3.46Å; E98-K101 PolarHBondContact O-N 3.38Å; E98-K101 VanDerWaalsContact O-N 3.08Å; E98-M104 WeakPolarHBondContact O-CG 3.44Å
99	T	66.4	Low	64.4	Low	44 Å²	44	117.8 Å²	117.8	27%	0.27	65%	0.652	S	S	.	*	H	α-helix	trans	-67.5	-18.1	175.7	67	0	0	0	0	112.8	I94 W96 M97 K101 H105	I94-T99 HydrophobicContact CG2-CG2 4.18Å; W96-T99 PolarHBondContact O-N 3.46Å; W96-T99 PolarHBondContact O-OG1 2.73Å; M97-T99 VanDerWaalsContact C-N 3.32Å; T99-K101 VanDerWaalsContact C-N 3.31Å; T99-H105 PolarHBondContact O-NE2 3.26Å; T99-H105 VanDerWaalsContact O-NE2 3.12Å
100	Q	67.6	Low	64.7	Low	134 Å²	134	116.1 Å²	116.1	63%	0.626	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-11.7	174.8	-53.1	-53.7	-60.2	0	0	113.1	M97 E98	M97-Q100 PolarHBondContact O-N 2.64Å; E98-Q100 PolarHBondContact O-N 3.29Å
101	K	68.6	Low	64.9	Low	126 Å²	126	118.3 Å²	118.3	55%	0.548	65%	0.648	S	S	.	*	S	Bend	trans	-70.5	129.2	180	-69.6	-179.4	179.3	170.8	0	109.8	E98 T99 G103 M104	E98-K101 WeakPolarHBondContact O-CB 3.46Å; E98-K101 PolarHBondContact O-N 3.38Å; E98-K101 VanDerWaalsContact O-N 3.08Å; T99-K101 VanDerWaalsContact C-N 3.31Å; K101-G103 PolarHBondContact O-N 2.92Å; K101-M104 HydrophobicContact CB-CG 4.07Å; K101-M104 WeakPolarHBondContact O-CB 3.45Å; K101-M104 PolarHBondContact O-N 3.48Å; K101-M104 VanDerWaalsContact O-N 3.17Å
102	P	69.8	Low	64.2	Low	139 Å²	139	119.2 Å²	119.2	90%	0.903	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	129.7	175.7	-26	33.7	0	0	0	111.2
103	G	67.5	Low	63.6	Low	70 Å²	70	125.5 Å²	125.5	72%	0.722	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.3	-3.9	-178.1	0	0	0	0	0	116.1	K101	K101-G103 PolarHBondContact O-N 2.92Å
104	M	66.3	Low	62.5	Low	110 Å²	110	128.1 Å²	128.1	54%	0.542	65%	0.652	S	S	.	*			trans	-84.6	-17.1	178.2	-71.2	-67	93.2	0	0	115.2	E98 K101	E98-M104 WeakPolarHBondContact O-CG 3.44Å; K101-M104 HydrophobicContact CB-CG 4.07Å; K101-M104 WeakPolarHBondContact O-CB 3.45Å; K101-M104 PolarHBondContact O-N 3.48Å; K101-M104 VanDerWaalsContact O-N 3.17Å
105	H	60.3	Low	61.4	Low	127 Å²	127	132.9 Å²	132.9	59%	0.588	67%	0.669	S	S	*	*	S	Bend	trans	-94.4	120.3	170.7	-64.3	-47.1	0	0	0	109.1	T99	T99-H105 PolarHBondContact O-NE2 3.26Å; T99-H105 VanDerWaalsContact O-NE2 3.12Å
106	P	63.4	Low	59.8	Low	107 Å²	107	135.3 Å²	135.3	70%	0.695	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-58.1	145.1	171.4	25.1	-31.7	0	0	0	108.7
107	P	56.9	Low	58.1	Low	115 Å²	115	135.6 Å²	135.6	75%	0.747	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-53.3	137.1	178.4	20.6	-30.6	0	0	0	109.6	D109	P107-D109 PolarHBondContact O-N 2.96Å
108	P	61.4	Low	56.8	Low	125 Å²	125	136.2 Å²	136.2	81%	0.812	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-58.2	128.8	-177.6	21.6	-31.1	0	0	0	110	S110	P108-S110 PolarHBondContact O-N 3.39Å; P108-S110 VanDerWaalsContact O-N 3.08Å
109	D	51.3	Low	55.7	Low	131 Å²	131	138.8 Å²	138.8	70%	0.701	71%	0.711	S	S	*	*			trans	-55.2	113.5	-177.5	-118.7	-21.5	0	0	0	110.4	P107 E111 R112	P107-D109 PolarHBondContact O-N 2.96Å; D109-E111 PolarHBondContact O-N 3.45Å; D109-R112 PolarHBondContact O-N 2.95Å
110	S	57.1	Low	54.4	Low	104 Å²	104	144.1 Å²	144.1	73%	0.727	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-63.7	-16.9	-171.6	64.8	0	0	0	0	113.9	P108 R112	P108-S110 PolarHBondContact O-N 3.39Å; P108-S110 VanDerWaalsContact O-N 3.08Å; S110-R112 VanDerWaalsContact C-N 3.34Å; S110-R112 PolarHBondContact O-N 3.3Å
111	E	52.6	Low	53.4	Low	176 Å²	176	143.4 Å²	143.4	82%	0.822	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-79.2	-10.3	-179.9	-66.7	-153.5	161.5	0	0	114.7	D109 R113	D109-E111 PolarHBondContact O-N 3.45Å; E111-R113 VanDerWaalsContact C-N 3.34Å; E111-R113 PolarHBondContact O-N 3.3Å
112	R	46.6	Very low	52.4	Low	209 Å²	209	140.5 Å²	140.5	79%	0.789	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-94.9	28.7	-179.9	-68.3	-163.6	-173	-165.1	4.6	114.7	D109 S110 K114	D109-R112 PolarHBondContact O-N 2.95Å; S110-R112 VanDerWaalsContact C-N 3.34Å; S110-R112 PolarHBondContact O-N 3.3Å; R112-K114 PolarHBondContact O-N 3.04Å
113	R	43.8	Very low	51.3	Low	237 Å²	237	137.8 Å²	137.8	89%	0.894	72%	0.723	S	S	*	*			trans	-70.5	55.1	156.6	-64.9	-164.8	-178.8	-157.5	2.1	110.6	E111 K115	E111-R113 VanDerWaalsContact C-N 3.34Å; E111-R113 PolarHBondContact O-N 3.3Å; R113-K115 PolarHBondContact O-N 3.08Å
114	K	46.6	Very low	50	Low	180 Å²	180	145.6 Å²	145.6	78%	0.783	73%	0.73	S	S	*	*			trans	-74.6	108.7	163.5	-71.5	-170.4	177.9	-175.4	0	105.8	R112 I116	R112-K114 PolarHBondContact O-N 3.04Å; K114-I116 PolarHBondContact O-N 3.48Å
115	K	44.5	Very low	49.1	Very low	198 Å²	198	144.4 Å²	144.4	86%	0.861	73%	0.73	S	S	*	*			trans	-37.3	112.6	172.6	-64.3	-175.3	176.5	-174.3	0	108.7	R113 K117	R113-K115 PolarHBondContact O-N 3.08Å; K115-K117 VanDerWaalsContact C-N 3.33Å; K115-K117 PolarHBondContact O-N 3.5Å
116	I	42.7	Very low	48.1	Very low	142 Å²	142	145.7 Å²	145.7	73%	0.728	74%	0.736	S	S	*	*			trans	-57.5	106.4	166.5	-66.3	165.2	0	0	0	104	K114	K114-I116 PolarHBondContact O-N 3.48Å
117	K	40.6	Very low	46.9	Very low	176 Å²	176	147.8 Å²	147.8	77%	0.765	74%	0.741	S	S	*	*			trans	-75.1	126.5	168.6	-90.7	-179.8	169.1	-176.1	0	105.2	K115 N119	K115-K117 VanDerWaalsContact C-N 3.33Å; K115-K117 PolarHBondContact O-N 3.5Å; K117-N119 PolarHBondContact O-N 3.36Å
118	D	47.7	Very low	46.1	Very low	127 Å²	127	150 Å²	150	68%	0.679	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	6.1	-174.3	-61	-49	0	0	0	115.4
119	N	47.3	Very low	45.1	Very low	137 Å²	137	150.6 Å²	150.6	73%	0.733	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-20.2	-177.1	-111	28.6	0	0	0	115	K117 L121	K117-N119 PolarHBondContact O-N 3.36Å; N119-L121 VanDerWaalsContact C-N 3.35Å
120	D	40.3	Very low	44.3	Very low	157 Å²	157	153.3 Å²	153.3	84%	0.84	75%	0.748	S	S	*	*	S	Bend	trans	-86.8	-6.3	-179.8	-83.1	-11.7	0	0	0	113.4
121	L	47.1	Very low	43.2	Very low	118 Å²	118	155.5 Å²	155.5	62%	0.618	75%	0.751	S	S	*	*	S	Bend	trans	-87.8	-21	174.7	-83.2	150.7	0	0	0	113	N119	N119-L121 VanDerWaalsContact C-N 3.35Å
122	S	47.1	Very low	42.1	Very low	65 Å²	65	156 Å²	156	46%	0.455	75%	0.753	S	S	.	*	G	3₁₀ helix	trans	-73.9	-29.4	-176.3	-51.2	0	0	0	0	113.8	R124	S122-R124 PolarHBondContact O-N 2.94Å
123	A	45.3	Very low	41.6	Very low	82 Å²	82	151 Å²	151	68%	0.678	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-75.1	-9.7	-176.2	0	0	0	0	0	114.3
124	R	41.9	Very low	41.2	Very low	234 Å²	234	148 Å²	148	88%	0.883	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-100.4	-11.2	-177.8	-132	179.3	-173.5	-156	-0	114.3	S122	S122-R124 PolarHBondContact O-N 2.94Å
125	T	46.4	Very low	40.7	Very low	86 Å²	86	146 Å²	146	53%	0.528	75%	0.746	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.1	-15.2	-173.3	-40.9	0	0	0	0	113.3	N127 I129	T125-N127 VanDerWaalsContact C-N 3.3Å; T125-N127 PolarHBondContact O-N 3.16Å; T125-I129 HydrophobicContact CG2-CD1 4.32Å
126	E	38.7	Very low	40.3	Very low	154 Å²	154	143.2 Å²	143.2	72%	0.72	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-9.8	-175.8	-70.5	-177.1	169.6	0	0	115.1
127	N	39.1	Very low	40.4	Very low	151 Å²	151	141.8 Å²	141.8	81%	0.807	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	1.8	-176.2	-70.9	-24.2	0	0	0	115.7	T125	T125-N127 VanDerWaalsContact C-N 3.3Å; T125-N127 PolarHBondContact O-N 3.16Å
128	D	40.3	Very low	40.1	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	74%	0.738	S	S	*	*	S	Bend	trans	-122.9	4	-179.3	-97.3	-23.8	0	0	0	115
129	I	40.3	Very low	39.8	Very low	137 Å²	137	145.1 Å²	145.1	70%	0.703	75%	0.751	S	S	*	*			trans	-118.3	50.9	178.2	-41.5	179.4	0	0	0	110.7	T125	T125-I129 HydrophobicContact CG2-CD1 4.32Å
130	F	34.7	Very low	39.3	Very low	187 Å²	187	148.9 Å²	148.9	82%	0.82	75%	0.754	S	S	*	*			trans	-132.2	55.2	168.8	-127.6	-80.1	0	0	0	110
131	N	32.9	Very low	39.1	Very low	151 Å²	151	150.6 Å²	150.6	81%	0.807	76%	0.757	S	S	*	*	S	Bend	trans	-162.5	77.1	165.8	-83.7	-40.4	0	0	0	109.2
132	Q	30.5	Very low	38.6	Very low	185 Å²	185	151 Å²	151	86%	0.864	77%	0.765	S	S	*	*			trans	174.4	109.6	153.6	-102	163.7	96.1	0	0	109.8
133	T	34.9	Very low	38.1	Very low	105 Å²	105	155.2 Å²	155.2	64%	0.644	78%	0.782	S	S	*	*				161.5	90.4	118.6	28.4	0	0	0	0	110.7	N135	T133-N135 WeakPolarHBondContact CB-ND2 3.45Å; T133-N135 WeakPolarHBondContact CG2-ND2 3.45Å
134	D	37.4	Very low	38	Very low	175 Å²	175	156.2 Å²	156.2	94%	0.936	78%	0.78	S	S	*	*			trans	-98.2	98.6	143	-83.5	-35.8	0	0	0	106.1	D136	D134-D136 PolarHBondContact O-N 2.93Å
135	N	35	Very low	37.8	Very low	137 Å²	137	152.9 Å²	152.9	73%	0.733	78%	0.779	S	S	*	*			trans	-77.1	112.3	177.2	-72.7	-69.8	0	0	0	109	T133	T133-N135 WeakPolarHBondContact CB-ND2 3.45Å; T133-N135 WeakPolarHBondContact CG2-ND2 3.45Å
136	D	35.1	Very low	37.8	Very low	140 Å²	140	155.7 Å²	155.7	75%	0.749	79%	0.786	S	S	*	*			trans	-112.7	111.3	160.4	-159	-7.6	0	0	0	109.3	D134 N138	D134-D136 PolarHBondContact O-N 2.93Å; D136-N138 PolarHBondContact O-N 3.4Å; D136-N138 VanDerWaalsContact O-N 3.08Å
137	P	44.8	Very low	38	Very low	112 Å²	112	153.1 Å²	153.1	73%	0.727	79%	0.785	S	S	*	*			trans	-82.3	85.3	-172.5	32.5	-33.9	0	0	0	111
138	N	36	Very low	38.3	Very low	132 Å²	132	153.6 Å²	153.6	71%	0.706	79%	0.788	S	S	*	*			trans	-148.8	28.5	167.3	-97.9	-40.6	0	0	0	115	D136 R140	D136-N138 PolarHBondContact O-N 3.4Å; D136-N138 VanDerWaalsContact O-N 3.08Å; N138-R140 PolarHBondContact O-N 2.96Å
139	Y	40.3	Very low	38.4	Very low	241 Å²	241	155.8 Å²	155.8	95%	0.945	78%	0.783	S	S	*	*			trans	-74.3	73.8	166.5	-112.7	-88.6	0	0	0	110.3
140	R	36.5	Very low	38.9	Very low	216 Å²	216	155.4 Å²	155.4	82%	0.815	79%	0.79	S	S	*	*			trans	-84.1	117.9	163.5	-76.7	-163.5	171.1	-164.3	-1.4	108.8	N138 T142	N138-R140 PolarHBondContact O-N 2.96Å; R140-T142 PolarHBondContact O-N 3.41Å
141	H	37.8	Very low	40	Very low	192 Å²	192	155 Å²	155	89%	0.889	79%	0.788	S	S	*	*			trans	-8.5	112.6	166.3	-84.6	-62.8	0	0	0	115.9
142	T	35.3	Very low	41.2	Very low	128 Å²	128	157.3 Å²	157.3	79%	0.785	79%	0.794	S	S	*	*			trans	-116.2	122.6	160.5	-11.1	0	0	0	0	108.8	R140 V144	R140-T142 PolarHBondContact O-N 3.41Å; T142-V144 PolarHBondContact O-N 3.29Å
143	D	36.3	Very low	42.6	Very low	153 Å²	153	155.8 Å²	155.8	82%	0.818	79%	0.791	S	S	*	*			trans	-53.2	115.3	-172.4	-70.8	-59.2	0	0	0	113.1	N145	D143-N145 PolarHBondContact O-N 2.96Å
144	V	43	Very low	43.9	Very low	103 Å²	103	155.5 Å²	155.5	62%	0.624	79%	0.786	S	S	*	*			trans	-75.9	109	168.1	-165.7	0	0	0	0	106.5	T142 H146	T142-V144 PolarHBondContact O-N 3.29Å; V144-H146 PolarHBondContact O-CD2 2.77Å; V144-H146 VanDerWaalsContact O-CD2 3.25Å; V144-H146 PolarHBondContact O-N 3.05Å
145	N	38.8	Very low	44.9	Very low	163 Å²	163	150.1 Å²	150.1	87%	0.872	76%	0.76	S	S	*	*			trans	-59.9	86	168.9	-87.9	-57.8	0	0	0	109.4	D143 S147	D143-N145 PolarHBondContact O-N 2.96Å; N145-S147 PolarHBondContact O-N 2.78Å; N145-S147 VanDerWaalsContact O-N 3.13Å
146	H	46	Very low	46.1	Very low	146 Å²	146	146.2 Å²	146.2	68%	0.676	74%	0.739	S	S	*	*			trans	-71.6	105.9	176.1	-69.2	-60	0	0	0	108.9	V144 N148	V144-H146 PolarHBondContact O-CD2 2.77Å; V144-H146 VanDerWaalsContact O-CD2 3.25Å; V144-H146 PolarHBondContact O-N 3.05Å; H146-N148 PolarHBondContact O-N 3.17Å; H146-N148 VanDerWaalsContact O-N 3.08Å
147	S	42.9	Very low	47.6	Very low	99 Å²	99	142 Å²	142	69%	0.692	72%	0.724	S	S	*	*			trans	-50.1	114.1	165	-177.6	0	0	0	0	109.5	N145 R149	N145-S147 PolarHBondContact O-N 2.78Å; N145-S147 VanDerWaalsContact O-N 3.13Å; S147-R149 PolarHBondContact O-N 2.91Å
148	N	45.5	Very low	48.4	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	70%	0.702	S	S	*	*			trans	-71.5	38.8	-179.7	-74.9	-42.7	0	0	0	113.4	H146 P150	H146-N148 PolarHBondContact O-N 3.17Å; H146-N148 VanDerWaalsContact O-N 3.08Å; N148-P150 WeakPolarHBondContact O-CD 3.39Å
149	R	42.8	Very low	49.7	Very low	207 Å²	207	134.1 Å²	134.1	78%	0.781	68%	0.678	S	S	*	*			trans	-88.4	117.9	162.8	-70.3	-165.9	-178.3	-163.3	1.7	107	S147 K151	S147-R149 PolarHBondContact O-N 2.91Å; R149-K151 VanDerWaalsContact C-N 3.25Å; R149-K151 PolarHBondContact O-N 3.29Å
150	P	49.7	Very low	51	Low	130 Å²	130	129.7 Å²	129.7	84%	0.844	67%	0.666	S	S	*	*			trans	-61.6	96.5	169.9	25	-30.1	0	0	0	106.9	N148 E152	N148-P150 WeakPolarHBondContact O-CD 3.39Å; P150-E152 PolarHBondContact O-N 3.12Å
151	K	58.6	Low	52.3	Low	178 Å²	178	122.1 Å²	122.1	77%	0.774	64%	0.641	S	S	*	*			trans	-61.1	120.2	168.2	-76.1	178.7	178.5	177.7	0	105.1	R149 L153	R149-K151 VanDerWaalsContact C-N 3.25Å; R149-K151 PolarHBondContact O-N 3.29Å; K151-L153 PolarHBondContact O-N 3.08Å
152	E	57.4	Low	53.7	Low	199 Å²	199	116.5 Å²	116.5	93%	0.93	62%	0.622	S	S	*	*			trans	-57.9	93.2	169.7	-167.6	168.5	-169.5	0	0	106.8	P150 D154	P150-E152 PolarHBondContact O-N 3.12Å; E152-D154 PolarHBondContact O-N 3.22Å
153	L	59.6	Low	54.8	Low	154 Å²	154	113 Å²	113	81%	0.806	60%	0.598	S	S	*	*			trans	-73.7	117.2	-177	-85.6	143	0	0	0	106.6	K151 P155	K151-L153 PolarHBondContact O-N 3.08Å; L153-P155 VanDerWaalsContact O-CD 3.28Å; L153-P155 WeakPolarHBondContact O-CD 3.47Å
154	D	64.2	Low	56.3	Low	99 Å²	99	108.7 Å²	108.7	53%	0.529	59%	0.589	S	S	.	*			trans	-53.3	112.5	172.8	178.1	-1.1	0	0	0	108.9	E152 D156 A157	E152-D154 PolarHBondContact O-N 3.22Å; D154-D156 PolarHBondContact O-N 3.32Å; D154-D156 PolarHBondContact OD1-N 3.22Å; D154-A157 HydrophobicContact CB-CB 4.1Å; D154-A157 WeakPolarHBondContact O-CB 3.43Å; D154-A157 PolarHBondContact O-N 3.02Å
155	P	57.2	Low	57.6	Low	62 Å²	62	109.5 Å²	109.5	40%	0.403	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.7	-19.4	-175.3	28.3	-35.5	0	0	0	112.6	L153 T170 T173	L153-P155 VanDerWaalsContact O-CD 3.28Å; L153-P155 WeakPolarHBondContact O-CD 3.47Å; P155-T170 HydrophobicContact CB-CG2 3.87Å; P155-T173 PolarHBondContact O-OG1 3.01Å
156	D	61.1	Low	59.1	Low	55 Å²	55	102.6 Å²	102.6	29%	0.294	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.5	-11.5	-178.6	-68.8	-10.5	0	0	0	111.7	D154 C158 L159 R172	D154-D156 PolarHBondContact O-N 3.32Å; D154-D156 PolarHBondContact OD1-N 3.22Å; D156-C158 PolarHBondContact O-N 2.78Å; D156-C158 VanDerWaalsContact O-N 3.12Å; D156-L159 HydrophobicContact CB-CD1 3.71Å; D156-L159 HydrophobicContact CB-CG 4.32Å; D156-L159 WeakPolarHBondContact O-CB 3.23Å; D156-L159 WeakPolarHBondContact O-CG 3.4Å; D156-L159 PolarHBondContact O-N 3.45Å; D156-L159 VanDerWaalsContact O-N 3.14Å; D156-R172 IonicContact OD1-CZ 3.71Å; D156-R172 IonicContact OD1-NH1 2.77Å; D156-R172 PolarHBondContact OD1-NH1 2.92Å; D156-R172 IonicContact OD2-CZ 3.67Å; D156-R172 IonicContact OD2-NH1 2.87Å; D156-R172 PolarHBondContact OD2-NH1 2.99Å; D156-R172 IonicContact OD2-NH2 3.71Å
157	A	65	Low	60.2	Low	51 Å²	51	107 Å²	107	42%	0.421	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.7	-20.3	175.5	0	0	0	0	0	113	D154 H160	D154-A157 HydrophobicContact CB-CB 4.1Å; D154-A157 WeakPolarHBondContact O-CB 3.43Å; D154-A157 PolarHBondContact O-N 3.02Å; A157-H160 PolarHBondContact O-CE1 3.22Å; A157-H160 PolarHBondContact O-ND1 3.42Å
158	C	63.4	Low	61.5	Low	41 Å²	41	109.6 Å²	109.6	28%	0.277	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	1.6	178.9	-60.6	0	0	0	0	114.5	D156 H160 L161 V166 T173	D156-C158 PolarHBondContact O-N 2.78Å; D156-C158 VanDerWaalsContact O-N 3.12Å; C158-H160 PolarHBondContact O-N 3.07Å; C158-L161 PolarHBondContact O-N 2.79Å; C158-L161 VanDerWaalsContact O-N 3.12Å; C158-V166 HydrophobicContact CB-CG1 3.86Å; C158-V166 HydrophobicContact CB-CG2 3.94Å; C158-T173 HydrophobicContact CB-CG2 4.29Å
159	L	62.6	Low	62.7	Low	38 Å²	38	103 Å²	103	20%	0.199	54%	0.536	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-19.2	-174.7	-64	173.5	0	0	0	114	D156 L161 T173 F176 L177	D156-L159 HydrophobicContact CB-CD1 3.71Å; D156-L159 HydrophobicContact CB-CG 4.32Å; D156-L159 WeakPolarHBondContact O-CB 3.23Å; D156-L159 WeakPolarHBondContact O-CG 3.4Å; D156-L159 PolarHBondContact O-N 3.45Å; D156-L159 VanDerWaalsContact O-N 3.14Å; L159-L161 VanDerWaalsContact C-N 3.33Å; L159-T173 HydrophobicContact CD2-CG2 4.08Å; L159-F176 HydrophobicContact CB-CD1 4.17Å; L159-F176 HydrophobicContact CB-CE1 3.99Å; L159-F176 HydrophobicContact CD2-CB 3.92Å; L159-F176 HydrophobicContact CD2-CD1 3.45Å; L159-F176 VanDerWaalsContact CD2-CD1 3.45Å; L159-F176 HydrophobicContact CD2-CE1 4.11Å; L159-F176 HydrophobicContact CD2-CG 3.74Å; L159-F176 HydrophobicContact CG-CD1 4.29Å; L159-F176 HydrophobicContact CG-CE1 4.49Å; L159-L177 WeakPolarHBondContact O-CD2 3.29Å
160	H	67.5	Low	64	Low	147 Å²	147	95.7 Å²	95.7	68%	0.681	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.6	175.4	65.4	-89.3	0	0	0	113.3	A157 C158	A157-H160 PolarHBondContact O-CE1 3.22Å; A157-H160 PolarHBondContact O-ND1 3.42Å; C158-H160 PolarHBondContact O-N 3.07Å
161	L	64.3	Low	65.4	Low	57 Å²	57	95 Å²	95	30%	0.298	51%	0.51	S	S	.	.	S	Bend	trans	-97.7	134.7	-176.6	-64.1	174.7	0	0	0	110.4	C158 L159 V166 L177	C158-L161 PolarHBondContact O-N 2.79Å; C158-L161 VanDerWaalsContact O-N 3.12Å; L159-L161 VanDerWaalsContact C-N 3.33Å; L161-V166 HydrophobicContact CB-CG2 3.94Å; L161-L177 WeakPolarHBondContact O-CD1 3.49Å; L161-L177 WeakPolarHBondContact O-CD2 3.43Å
162	P	65.9	Low	66	Low	74 Å²	74	94.2 Å²	94.2	48%	0.481	50%	0.502	S	S	.	.			trans	-52.1	146.4	169.9	-25.6	32.7	0	0	0	112.2	G164 L165	P162-G164 PolarHBondContact O-N 3.29Å; P162-L165 HydrophobicContact CG-CD1 4.45Å; P162-L165 PolarHBondContact O-N 3.25Å
163	L	59.9	Low	66.5	Low	55 Å²	55	84.8 Å²	84.8	29%	0.288	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-45.3	-41.8	179.6	-95.9	147.3	0	0	0	114.2	L165 V166 L177 T181	L163-L165 PolarHBondContact O-N 3.38Å; L163-V166 PolarHBondContact O-N 3.23Å; L163-L177 VanDerWaalsContact CD1-C 3.47Å; L163-L177 HydrophobicContact CD1-CB 3.74Å; L163-L177 HydrophobicContact CD2-CB 4.08Å; L163-L177 HydrophobicContact CD2-CD1 4.33Å; L163-L177 HydrophobicContact CG-CB 3.45Å; L163-L177 VanDerWaalsContact CG-CB 3.45Å; L163-L177 HydrophobicContact CG-CD1 4.03Å; L163-L177 HydrophobicContact CG-CG 4.4Å; L163-T181 HydrophobicContact CD1-CG2 3.94Å
164	G	67	Low	67.1	Low	62 Å²	62	82.8 Å²	82.8	64%	0.639	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-66.7	-16	-178	0	0	0	0	0	114.6	P162	P162-G164 PolarHBondContact O-N 3.29Å
165	L	70.5	Confident	67.4	Low	121 Å²	121	86.2 Å²	86.2	63%	0.634	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-100.7	-8.8	-178.7	-61.3	-174.7	0	0	0	113.3	P162 L163	P162-L165 HydrophobicContact CG-CD1 4.45Å; P162-L165 PolarHBondContact O-N 3.25Å; L163-L165 PolarHBondContact O-N 3.38Å
166	V	69.6	Low	68	Low	17 Å²	17	87.2 Å²	87.2	10%	0.103	45%	0.451	C	S	.	.			trans	-89.6	112	178.2	-169.5	0	0	0	0	109.3	C158 L161 L163 N168 P169 L177	C158-V166 HydrophobicContact CB-CG1 3.86Å; C158-V166 HydrophobicContact CB-CG2 3.94Å; L161-V166 HydrophobicContact CB-CG2 3.94Å; L163-V166 PolarHBondContact O-N 3.23Å; V166-N168 VanDerWaalsContact C-N 3.33Å; V166-N168 PolarHBondContact O-N 3.32Å; V166-P169 HydrophobicContact CB-CB 4.07Å; V166-P169 HydrophobicContact CB-CG 4.22Å; V166-P169 HydrophobicContact CG1-CB 3.64Å; V166-P169 HydrophobicContact CG1-CG 4.14Å; V166-P169 WeakPolarHBondContact O-CD 3.19Å; V166-L177 HydrophobicContact CG2-CD1 3.84Å
167	R	70.1	Confident	68.2	Low	238 Å²	238	84.9 Å²	84.9	90%	0.898	44%	0.439	S	S	*	.	S	Bend	trans	-67.6	-27.5	-174.6	-72.2	-176.6	173.6	-180	-2.4	114.1
168	N	69.1	Low	68.3	Low	154 Å²	154	85.5 Å²	85.5	82%	0.824	44%	0.44	S	S	*	.	S	Bend	trans	-150.8	69.1	178.6	-71.7	-53.4	0	0	0	111.5	V166 T170	V166-N168 VanDerWaalsContact C-N 3.33Å; V166-N168 PolarHBondContact O-N 3.32Å; N168-T170 PolarHBondContact O-N 2.92Å
169	P	71	Confident	68.4	Low	24 Å²	24	88 Å²	88	16%	0.156	46%	0.458	C	S	.	.			trans	-70.2	132.2	-176.2	23.9	-25.7	0	0	0	110	V166 T173 K174	V166-P169 HydrophobicContact CB-CB 4.07Å; V166-P169 HydrophobicContact CB-CG 4.22Å; V166-P169 HydrophobicContact CG1-CB 3.64Å; V166-P169 HydrophobicContact CG1-CG 4.14Å; V166-P169 WeakPolarHBondContact O-CD 3.19Å; P169-T173 HydrophobicContact CB-CG2 3.93Å; P169-K174 HydrophobicContact CB-CG 3.77Å; P169-K174 HydrophobicContact CG-CD 4.29Å; P169-K174 HydrophobicContact CG-CG 3.62Å
170	T	71.2	Confident	68.3	Low	53 Å²	53	91.1 Å²	91.1	33%	0.325	47%	0.472	S	S	.	.			trans	-59.8	158.8	172.6	72.7	0	0	0	0	110.3	P155 N168 R172 T173 K174	P155-T170 HydrophobicContact CB-CG2 3.87Å; N168-T170 PolarHBondContact O-N 2.92Å; T170-R172 PolarHBondContact O-N 3.15Å; T170-R172 VanDerWaalsContact O-N 3.12Å; T170-T173 PolarHBondContact O-N 3.36Å; T170-T173 PolarHBondContact OG1-N 3.5Å; T170-T173 PolarHBondContact OG1-OG1 3.01Å; T170-K174 PolarHBondContact O-N 3.39Å
171	P	78.1	Confident	67.7	Low	115 Å²	115	87.9 Å²	87.9	75%	0.747	46%	0.462	S	S	*	.	H	α-helix	trans	-52.7	-34.8	176.4	-28.4	36	0	0	0	113.7	K175	P171-K175 PolarHBondContact O-N 2.71Å; P171-K175 VanDerWaalsContact O-N 3.15Å
172	R	72.2	Confident	67.2	Low	162 Å²	162	91.1 Å²	91.1	61%	0.611	48%	0.48	S	S	*	.	H	α-helix	trans	-66.7	-50.5	174.5	-175.2	-178.3	179.4	-143.3	-1.4	111.5	D156 T170 K174 K175 F176	D156-R172 IonicContact OD1-CZ 3.71Å; D156-R172 IonicContact OD1-NH1 2.77Å; D156-R172 PolarHBondContact OD1-NH1 2.92Å; D156-R172 IonicContact OD2-CZ 3.67Å; D156-R172 IonicContact OD2-NH1 2.87Å; D156-R172 PolarHBondContact OD2-NH1 2.99Å; D156-R172 IonicContact OD2-NH2 3.71Å; T170-R172 PolarHBondContact O-N 3.15Å; T170-R172 VanDerWaalsContact O-N 3.12Å; R172-K174 VanDerWaalsContact C-N 3.32Å; R172-K174 PolarHBondContact O-N 2.93Å; R172-K175 PolarHBondContact O-N 3.44Å; R172-F176 PolarHBondContact O-N 3.28Å
173	T	67.6	Low	66.7	Low	2 Å²	2	96 Å²	96	1%	0.012	50%	0.496	C	S	.	.	H	α-helix	trans	-58	-43.6	177	-45.7	0	0	0	0	110.9	P155 C158 L159 P169 T170 K175 F176 L177	P155-T173 PolarHBondContact O-OG1 3.01Å; C158-T173 HydrophobicContact CB-CG2 4.29Å; L159-T173 HydrophobicContact CD2-CG2 4.08Å; P169-T173 HydrophobicContact CB-CG2 3.93Å; T170-T173 PolarHBondContact O-N 3.36Å; T170-T173 PolarHBondContact OG1-N 3.5Å; T170-T173 PolarHBondContact OG1-OG1 3.01Å; T173-K175 PolarHBondContact O-N 2.76Å; T173-F176 PolarHBondContact O-N 3.37Å; T173-L177 HydrophobicContact CG2-CD1 3.77Å; T173-L177 HydrophobicContact CG2-CG 4.22Å; T173-L177 WeakPolarHBondContact O-CB 3.45Å; T173-L177 VanDerWaalsContact O-CG 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.28Å; T173-L177 PolarHBondContact O-N 2.79Å
174	K	71	Confident	66.6	Low	112 Å²	112	97.2 Å²	97.2	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-57.8	-47.7	175.3	-75.8	-172.9	-179.1	179.9	0	111.9	P169 T170 R172 S178	P169-K174 HydrophobicContact CB-CG 3.77Å; P169-K174 HydrophobicContact CG-CD 4.29Å; P169-K174 HydrophobicContact CG-CG 3.62Å; T170-K174 PolarHBondContact O-N 3.39Å; R172-K174 VanDerWaalsContact C-N 3.32Å; R172-K174 PolarHBondContact O-N 2.93Å; K174-S178 VanDerWaalsContact O-CB 3.24Å; K174-S178 WeakPolarHBondContact O-CB 3.48Å; K174-S178 PolarHBondContact O-N 3.09Å; K174-S178 PolarHBondContact O-OG 3.17Å
175	K	71.4	Confident	66	Low	171 Å²	171	100.3 Å²	100.3	74%	0.743	51%	0.511	S	S	*	.	H	α-helix	trans	-64.4	-42.9	-179.1	-168.8	177.7	-179	-178.5	0	111.8	P171 R172 T173 S179	P171-K175 PolarHBondContact O-N 2.71Å; P171-K175 VanDerWaalsContact O-N 3.15Å; R172-K175 PolarHBondContact O-N 3.44Å; T173-K175 PolarHBondContact O-N 2.76Å; K175-S179 PolarHBondContact O-N 2.92Å; K175-S179 VanDerWaalsContact O-N 3.13Å; K175-S179 PolarHBondContact O-OG 3.38Å
176	F	69.5	Low	65.2	Low	82 Å²	82	101.2 Å²	101.2	36%	0.36	51%	0.507	S	S	.	.	H	α-helix	trans	-61.9	-56.3	177.2	-179	-92.4	0	0	0	111.2	L159 R172 T173 S178 S179 E180	L159-F176 HydrophobicContact CB-CD1 4.17Å; L159-F176 HydrophobicContact CB-CE1 3.99Å; L159-F176 HydrophobicContact CD2-CB 3.92Å; L159-F176 HydrophobicContact CD2-CD1 3.45Å; L159-F176 VanDerWaalsContact CD2-CD1 3.45Å; L159-F176 HydrophobicContact CD2-CE1 4.11Å; L159-F176 HydrophobicContact CD2-CG 3.74Å; L159-F176 HydrophobicContact CG-CD1 4.29Å; L159-F176 HydrophobicContact CG-CE1 4.49Å; R172-F176 PolarHBondContact O-N 3.28Å; T173-F176 PolarHBondContact O-N 3.37Å; F176-S178 PolarHBondContact O-N 3.19Å; F176-S179 PolarHBondContact O-N 2.97Å; F176-S179 PolarHBondContact O-OG 3.42Å; F176-E180 WeakPolarHBondContact CE1-OE2 3.26Å; F176-E180 PolarHBondContact O-N 3.29Å; F176-E180 VanDerWaalsContact O-N 3.09Å
177	L	66.1	Low	64.4	Low	7 Å²	7	103.2 Å²	103.2	4%	0.037	53%	0.525	C	S	.	.	H	α-helix	trans	-64.8	-31.2	-176.9	-64.2	175	0	0	0	112.3	L159 L161 L163 V166 T173 S179 E180 T181	L159-L177 WeakPolarHBondContact O-CD2 3.29Å; L161-L177 WeakPolarHBondContact O-CD1 3.49Å; L161-L177 WeakPolarHBondContact O-CD2 3.43Å; L163-L177 VanDerWaalsContact CD1-C 3.47Å; L163-L177 HydrophobicContact CD1-CB 3.74Å; L163-L177 HydrophobicContact CD2-CB 4.08Å; L163-L177 HydrophobicContact CD2-CD1 4.33Å; L163-L177 HydrophobicContact CG-CB 3.45Å; L163-L177 VanDerWaalsContact CG-CB 3.45Å; L163-L177 HydrophobicContact CG-CD1 4.03Å; L163-L177 HydrophobicContact CG-CG 4.4Å; V166-L177 HydrophobicContact CG2-CD1 3.84Å; T173-L177 HydrophobicContact CG2-CD1 3.77Å; T173-L177 HydrophobicContact CG2-CG 4.22Å; T173-L177 WeakPolarHBondContact O-CB 3.45Å; T173-L177 VanDerWaalsContact O-CG 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.28Å; T173-L177 PolarHBondContact O-N 2.79Å; L177-S179 VanDerWaalsContact C-N 3.32Å; L177-E180 PolarHBondContact O-N 2.99Å; L177-T181 WeakPolarHBondContact O-CG2 3.48Å; L177-T181 PolarHBondContact O-N 3.01Å
178	S	66.9	Low	63.6	Low	64 Å²	64	95.1 Å²	95.1	45%	0.448	50%	0.502	S	S	.	.	H	α-helix	trans	-71.8	-26.7	175.7	-54.9	0	0	0	0	112.5	K174 F176 E180 T181	K174-S178 VanDerWaalsContact O-CB 3.24Å; K174-S178 WeakPolarHBondContact O-CB 3.48Å; K174-S178 PolarHBondContact O-N 3.09Å; K174-S178 PolarHBondContact O-OG 3.17Å; F176-S178 PolarHBondContact O-N 3.19Å; S178-E180 VanDerWaalsContact C-N 3.34Å; S178-T181 PolarHBondContact O-OG1 2.9Å
179	S	65.7	Low	62.7	Low	94 Å²	94	90.1 Å²	90.1	66%	0.657	48%	0.482	S	S	*	.	H	α-helix	trans	-78.2	-23.6	171.8	62.6	0	0	0	0	112.6	K175 F176 L177	K175-S179 PolarHBondContact O-N 2.92Å; K175-S179 VanDerWaalsContact O-N 3.13Å; K175-S179 PolarHBondContact O-OG 3.38Å; F176-S179 PolarHBondContact O-N 2.97Å; F176-S179 PolarHBondContact O-OG 3.42Å; L177-S179 VanDerWaalsContact C-N 3.32Å
180	E	60.4	Low	61.6	Low	103 Å²	103	92.7 Å²	92.7	48%	0.481	50%	0.495	S	S	.	.	H	α-helix	trans	-89.9	-5	-178.4	-146.9	174.7	-153.8	0	0	113.1	F176 L177 S178 N182	F176-E180 WeakPolarHBondContact CE1-OE2 3.26Å; F176-E180 PolarHBondContact O-N 3.29Å; F176-E180 VanDerWaalsContact O-N 3.09Å; L177-E180 PolarHBondContact O-N 2.99Å; S178-E180 VanDerWaalsContact C-N 3.34Å; E180-N182 PolarHBondContact O-N 3.48Å
181	T	55.1	Low	60.9	Low	78 Å²	78	96.8 Å²	96.8	48%	0.479	51%	0.51	S	S	.	.			trans	-68.2	66.4	171.2	58.1	0	0	0	0	111.2	L163 L177 S178 E183	L163-T181 HydrophobicContact CD1-CG2 3.94Å; L177-T181 WeakPolarHBondContact O-CG2 3.48Å; L177-T181 PolarHBondContact O-N 3.01Å; S178-T181 PolarHBondContact O-OG1 2.9Å; T181-E183 PolarHBondContact O-N 3.16Å
182	N	53.1	Low	59.8	Low	126 Å²	126	97.3 Å²	97.3	67%	0.674	51%	0.505	S	S	*	.			trans	-64	114.1	153.4	-102	-49.4	0	0	0	106.7	E180 S184 L185	E180-N182 PolarHBondContact O-N 3.48Å; N182-S184 PolarHBondContact O-N 2.91Å; N182-L185 PolarHBondContact O-N 2.88Å; N182-L185 VanDerWaalsContact O-N 3.08Å
183	E	55.1	Low	58.9	Low	175 Å²	175	95 Å²	95	82%	0.818	51%	0.509	S	S	*	.	H	α-helix	trans	-41.8	-30.8	177.3	-81.8	-179.2	137.4	0	0	113.7	T181 L185 Y186 A187	T181-E183 PolarHBondContact O-N 3.16Å; E183-L185 VanDerWaalsContact C-N 3.28Å; E183-L185 PolarHBondContact O-N 3.35Å; E183-Y186 PolarHBondContact O-N 3.38Å; E183-Y186 VanDerWaalsContact O-N 3.13Å; E183-A187 PolarHBondContact O-N 3.23Å
184	S	57.7	Low	58	Low	82 Å²	82	103.9 Å²	103.9	57%	0.573	54%	0.544	S	S	*	.	H	α-helix	trans	-53.1	-39.1	179.6	-176.6	0	0	0	0	113.8	N182 T188	N182-S184 PolarHBondContact O-N 2.91Å; S184-T188 PolarHBondContact O-N 3.45Å; S184-T188 VanDerWaalsContact O-N 3.17Å; S184-T188 PolarHBondContact O-OG1 2.94Å
185	L	54.7	Low	56.5	Low	126 Å²	126	102.8 Å²	102.8	66%	0.66	55%	0.55	S	S	*	*	H	α-helix	trans	-73.9	-35.4	-178.8	-81.4	167.9	0	0	0	111.9	N182 E183 T188 A189	N182-L185 PolarHBondContact O-N 2.88Å; N182-L185 VanDerWaalsContact O-N 3.08Å; E183-L185 VanDerWaalsContact C-N 3.28Å; E183-L185 PolarHBondContact O-N 3.35Å; L185-T188 PolarHBondContact O-N 3.2Å; L185-A189 WeakPolarHBondContact O-CB 3.44Å; L185-A189 PolarHBondContact O-N 3.42Å
186	Y	53.2	Low	55.1	Low	140 Å²	140	98.8 Å²	98.8	55%	0.549	54%	0.543	S	S	.	.	H	α-helix	trans	-68.1	-39.6	175.6	-116.4	-79.7	0	0	0	111.5	E183 A189 N190	E183-Y186 PolarHBondContact O-N 3.38Å; E183-Y186 VanDerWaalsContact O-N 3.13Å; Y186-A189 PolarHBondContact O-N 2.87Å; Y186-N190 WeakPolarHBondContact O-CB 3.36Å; Y186-N190 VanDerWaalsContact O-CG 3.29Å; Y186-N190 PolarHBondContact O-N 3.37Å; Y186-N190 PolarHBondContact O-ND2 2.72Å
187	A	52.3	Low	54.2	Low	59 Å²	59	101.9 Å²	101.9	49%	0.488	57%	0.57	S	S	.	*	H	α-helix	trans	-59	-47.5	173.9	0	0	0	0	0	111.1	E183 N190 Q191	E183-A187 PolarHBondContact O-N 3.23Å; A187-N190 PolarHBondContact O-N 3.08Å; A187-Q191 WeakPolarHBondContact O-CB 3.32Å; A187-Q191 PolarHBondContact O-N 3.37Å
188	T	54.5	Low	53.4	Low	68 Å²	68	109.3 Å²	109.3	42%	0.417	60%	0.604	S	S	.	*	H	α-helix	trans	-63.2	-45.2	178.5	-52.8	0	0	0	0	112.2	S184 L185 Q191 I192	S184-T188 PolarHBondContact O-N 3.45Å; S184-T188 VanDerWaalsContact O-N 3.17Å; S184-T188 PolarHBondContact O-OG1 2.94Å; L185-T188 PolarHBondContact O-N 3.2Å; T188-Q191 PolarHBondContact O-N 3.22Å; T188-I192 HydrophobicContact CG2-CD1 4.31Å; T188-I192 WeakPolarHBondContact O-CG1 3.39Å; T188-I192 PolarHBondContact O-N 3.12Å; T188-I192 VanDerWaalsContact O-N 3.13Å
189	A	49.4	Very low	52.4	Low	49 Å²	49	113.7 Å²	113.7	41%	0.405	62%	0.622	S	S	.	*	H	α-helix	trans	-63.3	-43.6	178.9	0	0	0	0	0	112	L185 Y186 Q191 I192 V193	L185-A189 WeakPolarHBondContact O-CB 3.44Å; L185-A189 PolarHBondContact O-N 3.42Å; Y186-A189 PolarHBondContact O-N 2.87Å; A189-Q191 VanDerWaalsContact C-N 3.3Å; A189-Q191 PolarHBondContact O-N 2.81Å; A189-I192 PolarHBondContact O-N 3.46Å; A189-V193 WeakPolarHBondContact O-CG2 3.39Å; A189-V193 PolarHBondContact O-N 2.85Å; A189-V193 VanDerWaalsContact O-N 3.17Å
190	N	49.5	Very low	51.5	Low	78 Å²	78	118 Å²	118	42%	0.417	63%	0.632	S	S	.	*	H	α-helix	trans	-63.1	-38.1	175.9	-73.8	-15.6	0	0	0	111.5	Y186 A187 I192 V193 Y194	Y186-N190 WeakPolarHBondContact O-CB 3.36Å; Y186-N190 VanDerWaalsContact O-CG 3.29Å; Y186-N190 PolarHBondContact O-N 3.37Å; Y186-N190 PolarHBondContact O-ND2 2.72Å; A187-N190 PolarHBondContact O-N 3.08Å; N190-I192 VanDerWaalsContact C-N 3.3Å; N190-I192 PolarHBondContact O-N 3.24Å; N190-V193 PolarHBondContact O-N 2.73Å; N190-Y194 HydrophobicContact CB-CD2 4.45Å; N190-Y194 WeakPolarHBondContact O-CD2 3.49Å; N190-Y194 PolarHBondContact O-N 2.73Å
191	Q	55.6	Low	50.9	Low	139 Å²	139	117.6 Å²	117.6	65%	0.65	65%	0.646	S	S	*	*	H	α-helix	trans	-65.3	-34.3	179	-148.9	169.8	19.7	0	0	112.6	A187 T188 A189 S195	A187-Q191 WeakPolarHBondContact O-CB 3.32Å; A187-Q191 PolarHBondContact O-N 3.37Å; T188-Q191 PolarHBondContact O-N 3.22Å; A189-Q191 VanDerWaalsContact C-N 3.3Å; A189-Q191 PolarHBondContact O-N 2.81Å; Q191-S195 PolarHBondContact O-N 2.8Å; Q191-S195 PolarHBondContact O-OG 3.19Å
192	I	56.1	Low	50.2	Low	126 Å²	126	122.2 Å²	122.2	65%	0.646	66%	0.663	S	S	*	*	H	α-helix	trans	-68	-41.3	174.5	-65.4	165.6	0	0	0	110.6	T188 A189 N190	T188-I192 HydrophobicContact CG2-CD1 4.31Å; T188-I192 WeakPolarHBondContact O-CG1 3.39Å; T188-I192 PolarHBondContact O-N 3.12Å; T188-I192 VanDerWaalsContact O-N 3.13Å; A189-I192 PolarHBondContact O-N 3.46Å; N190-I192 VanDerWaalsContact C-N 3.3Å; N190-I192 PolarHBondContact O-N 3.24Å
193	V	52.2	Low	49.7	Very low	114 Å²	114	125.8 Å²	125.8	69%	0.691	67%	0.672	S	S	*	*	H	α-helix	trans	-71.7	-35	-178.7	176.4	0	0	0	0	112.3	A189 N190	A189-V193 WeakPolarHBondContact O-CG2 3.39Å; A189-V193 PolarHBondContact O-N 2.85Å; A189-V193 VanDerWaalsContact O-N 3.17Å; N190-V193 PolarHBondContact O-N 2.73Å
194	Y	48.2	Very low	48.8	Very low	189 Å²	189	130 Å²	130	74%	0.741	69%	0.691	S	S	*	*	H	α-helix	trans	-86.7	-6.5	-179.4	-77	-70	0	0	0	114.9	N190 S196	N190-Y194 HydrophobicContact CB-CD2 4.45Å; N190-Y194 WeakPolarHBondContact O-CD2 3.49Å; N190-Y194 PolarHBondContact O-N 2.73Å; Y194-S196 PolarHBondContact O-N 2.93Å
195	S	40.7	Very low	48.3	Very low	89 Å²	89	132.4 Å²	132.4	62%	0.622	70%	0.697	S	S	*	*			trans	-76.4	72.6	170.2	-60.2	0	0	0	0	109.2	Q191	Q191-S195 PolarHBondContact O-N 2.8Å; Q191-S195 PolarHBondContact O-OG 3.19Å
196	S	40.8	Very low	48	Very low	86 Å²	86	132.7 Å²	132.7	60%	0.601	70%	0.699	S	S	*	*			trans	-67.3	135.4	173.4	-161.3	0	0	0	0	109.6	Y194 E198	Y194-S196 PolarHBondContact O-N 2.93Å; S196-E198 PolarHBondContact O-N 3.22Å
197	T	51	Low	47.7	Very low	148 Å²	148	132.3 Å²	132.3	91%	0.908	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	9	-165.2	8.8	0	0	0	0	116
198	E	48.8	Very low	47.5	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-22.9	-178	-92.5	170.9	154.9	0	0	114.6	S196 Q200	S196-E198 PolarHBondContact O-N 3.22Å; E198-Q200 VanDerWaalsContact C-N 3.34Å; E198-Q200 PolarHBondContact O-N 2.93Å
199	D	46.6	Very low	47	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	11.1	-169.8	-82.7	-14.9	0	0	0	116.2
200	Q	46.3	Very low	46.9	Very low	186 Å²	186	147.1 Å²	147.1	87%	0.869	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	6.9	169.6	-71.6	-157.6	6.5	0	0	115.2	E198 Q202	E198-Q200 VanDerWaalsContact C-N 3.34Å; E198-Q200 PolarHBondContact O-N 2.93Å; Q200-Q202 PolarHBondContact O-N 3.1Å
201	A	47.2	Very low	46.7	Very low	94 Å²	94	152 Å²	152	78%	0.777	79%	0.786	S	S	*	*	S	Bend	trans	-75.5	-1.8	166.7	0	0	0	0	0	113.5
202	Q	42.4	Very low	46	Very low	175 Å²	175	153 Å²	153	82%	0.818	80%	0.797	S	S	*	*			trans	-132	68.7	179.3	-70.7	-173.6	-17.3	0	0	112.8	Q200	Q200-Q202 PolarHBondContact O-N 3.1Å
203	K	41.6	Very low	45.1	Very low	201 Å²	201	155.3 Å²	155.3	87%	0.874	81%	0.809	S	S	*	*			trans	-131.1	101.9	146	-77.8	-171.3	179.1	171.1	0	109.2
204	H	35.9	Very low	44.5	Very low	263 Å²	263	159 Å²	159	100%	1.218	82%	0.82	S	S	*	*			trans	-38.4	0	166	-89.3	-87.1	0	0	0	114.3

Retrieved 204 of 204 residues in 303.3 ms (Link to these results)

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