A0A087X4M3_POEFO Loading...

TRIO and F-actin binding protein b

AlphaFold DB , UniProt , Accession A0A087X4M3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 540 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	33	Very low	52.6	Low	238 Å²	238	123.3 Å²	123.3	100%	1.172	63%	0.629	S	S	*	*				0	118.1	0	-57.1	-44.3	-173.5	0	0	108.1
2	Q	26	Very low	55.9	Low	178 Å²	178	122 Å²	122	83%	0.832	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-93.9	140.5	165.4	-71.2	172.7	-88.7	0	0	107.5
3	P	38.4	Very low	58.8	Low	116 Å²	116	113 Å²	113	75%	0.753	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-71.6	140.1	169.3	30.4	-32.8	0	0	0	109.8	L5	P3-L5 PolarHBondContact O-N 3Å
4	D	32.3	Very low	61.2	Low	140 Å²	140	106.1 Å²	106.1	75%	0.749	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-66	123.1	-176	-71.7	-62.4	0	0	0	112.4	L6	D4-L6 PolarHBondContact O-N 3.03Å
5	L	39.6	Very low	63.4	Low	155 Å²	155	100.2 Å²	100.2	81%	0.812	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	16	-176.2	-75.2	162.9	0	0	0	114.4	P3	P3-L5 PolarHBondContact O-N 3Å
6	L	44.8	Very low	65.2	Low	150 Å²	150	97.2 Å²	97.2	79%	0.785	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-16.9	-166	-124.1	73.8	0	0	0	115.3	D4	D4-L6 PolarHBondContact O-N 3.03Å
7	N	47.8	Very low	66.5	Low	81 Å²	81	93.1 Å²	93.1	43%	0.433	47%	0.468	S	S	.	.	S	Bend	trans	-106.2	-21.6	-162.1	-63.5	-11.9	0	0	0	115.1	K9	N7-K9 PolarHBondContact O-N 3.42Å
8	F	54.8	Low	67.4	Low	150 Å²	150	97 Å²	97	66%	0.658	49%	0.491	S	S	*	.			trans	-87.2	70.5	-170.3	-60.9	-67.1	0	0	0	113.4
9	K	81.3	Confident	68	Low	33 Å²	33	97.8 Å²	97.8	14%	0.143	51%	0.506	C	S	.	.			trans	-88.8	124.4	171.4	-168.2	-179.8	-178.2	-172.8	0	111.3	N7 L29 N92 W93 V96	N7-K9 PolarHBondContact O-N 3.42Å; K9-L29 HydrophobicContact CB-CB 4.1Å; K9-L29 HydrophobicContact CB-CD2 4.18Å; K9-L29 WeakPolarHBondContact O-CB 3.4Å; K9-L29 PolarHBondContact O-N 3.04Å; K9-N92 WeakPolarHBondContact CE-OD1 3.42Å; K9-N92 PolarHBondContact NZ-O 3.24Å; K9-N92 PolarHBondContact NZ-OD1 2.61Å; K9-W93 HydrophobicContact CB-CH2 4.32Å; K9-W93 HydrophobicContact CB-CZ3 4.33Å; K9-W93 HydrophobicContact CD-CD2 3.85Å; K9-W93 HydrophobicContact CD-CE3 3.74Å; K9-W93 HydrophobicContact CD-CH2 3.95Å; K9-W93 HydrophobicContact CD-CZ2 4.04Å; K9-W93 HydrophobicContact CD-CZ3 3.79Å; K9-W93 VanDerWaalsContact CE-CE2 3.45Å; K9-W93 HydrophobicContact CG-CE3 4.48Å; K9-W93 HydrophobicContact CG-CH2 3.82Å; K9-W93 HydrophobicContact CG-CZ2 4.06Å; K9-W93 HydrophobicContact CG-CZ3 4.05Å; K9-W93 VanDerWaalsContact NZ-CA 3.35Å; K9-W93 VanDerWaalsContact NZ-CD1 3.27Å; K9-W93 VanDerWaalsContact NZ-N 3.18Å; K9-V96 HydrophobicContact CD-CB 4.37Å; K9-V96 HydrophobicContact CD-CG1 4.43Å; K9-V96 HydrophobicContact CD-CG2 4.27Å
10	K	90.1	Very high	68.7	Low	101 Å²	101	95.4 Å²	95.4	44%	0.439	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	157.8	173.4	-52.7	-169.5	-176.1	-171.5	0	111.8	W26 F27 V28 E43	K10-W26 HydrophobicContact CB-CH2 4.37Å; K10-W26 HydrophobicContact CB-CZ2 3.84Å; K10-W26 HydrophobicContact CD-CZ2 4.29Å; K10-F27 CarbonylContact C-O 3.52Å; K10-F27 VanDerWaalsContact CA-O 3.23Å; K10-F27 WeakPolarHBondContact CA-O 3.45Å; K10-V28 HydrophobicContact CD-CG1 4.42Å; K10-V28 HydrophobicContact CD-CG2 4.22Å; K10-V28 HydrophobicContact CG-CG1 4.22Å; K10-V28 HydrophobicContact CG-CG2 4.22Å; K10-E43 WeakPolarHBondContact CE-OE1 3.34Å; K10-E43 VanDerWaalsContact NZ-CD 3.26Å; K10-E43 IonicContact NZ-OE1 3.98Å; K10-E43 PolarHBondContact NZ-OE1 3.1Å; K10-E43 IonicContact NZ-OE2 3.62Å; K10-E43 PolarHBondContact NZ-OE2 3.35Å
11	G	90.3	Very high	69.6	Low	14 Å²	14	96.1 Å²	96.1	14%	0.144	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.3	162.7	169.3	0	0	0	0	0	115.9	F27	G11-F27 PolarHBondContact N-O 3.4Å; G11-F27 PolarHBondContact O-N 3.18Å
12	W	91.9	Very high	72.4	Confident	108 Å²	108	87.1 Å²	87.1	41%	0.409	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	133.5	175.9	-72	109	0	0	0	112.7	K24 H25 W26 R38 D39	W12-K24 HydrophobicContact CD2-CD 4.49Å; W12-K24 VanDerWaalsContact CD2-CE 3.49Å; W12-K24 HydrophobicContact CE3-CD 3.98Å; W12-K24 VanDerWaalsContact CE3-CE 3.45Å; W12-K24 HydrophobicContact CE3-CG 3.72Å; W12-K24 HydrophobicContact CZ3-CD 4.3Å; W12-K24 HydrophobicContact CZ3-CG 4.12Å; W12-H25 VanDerWaalsContact CE3-C 3.43Å; W12-W26 AromaticContact CD1-CE3 3.65Å; W12-W26 AromaticContact CD1-CZ3 3.6Å; W12-W26 AromaticContact CD2-CE3 3.8Å; W12-W26 HydrophobicContact CD2-CE3 3.8Å; W12-W26 AromaticContact CE2-CE3 3.77Å; W12-W26 HydrophobicContact CE3-CB 4.16Å; W12-W26 AromaticContact CG-CE3 3.77Å; W12-W26 HydrophobicContact CG-CE3 3.77Å; W12-W26 HydrophobicContact CG-CZ3 4.11Å; W12-W26 HydrophobicContact CH2-CB 4.36Å; W12-W26 HydrophobicContact CZ3-CB 4.09Å; W12-W26 AromaticContact NE1-CE3 3.61Å; W12-W26 AromaticContact NE1-CZ3 3.71Å; W12-R38 WeakPolarHBondContact CH2-O 3.39Å; W12-R38 WeakPolarHBondContact CZ3-O 3.04Å; W12-D39 HydrophobicContact CH2-CB 3.9Å; W12-D39 HydrophobicContact CZ2-CB 4.43Å
13	M	93.6	Very high	75.5	Confident	5 Å²	5	82.8 Å²	82.8	3%	0.025	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	166.2	171.5	-38.1	-175.5	68.4	0	0	110.5	K24 H25 F27 F71 A84 W93	M13-K24 WeakPolarHBondContact O-CA 3.35Å; M13-H25 PolarHBondContact N-O 3.06Å; M13-H25 PolarHBondContact O-N 2.98Å; M13-H25 VanDerWaalsContact O-O 3.1Å; M13-F27 HydrophobicContact CB-CD2 3.53Å; M13-F27 HydrophobicContact CB-CE2 3.66Å; M13-F27 HydrophobicContact CB-CG 4.42Å; M13-F27 HydrophobicContact CG-CB 4.29Å; M13-F27 HydrophobicContact CG-CD2 3.6Å; M13-F27 HydrophobicContact CG-CE2 4.23Å; M13-F27 HydrophobicContact CG-CG 4.09Å; M13-F27 HydrophobicContact SD-CB 4.19Å; M13-F27 HydrophobicContact SD-CD2 4.06Å; M13-F27 HydrophobicContact SD-CG 4.01Å; M13-F71 HydrophobicContact CE-CE1 3.38Å; M13-F71 HydrophobicContact CE-CZ 3.51Å; M13-A84 HydrophobicContact CE-CB 4.26Å; M13-W93 HydrophobicContact CE-CB 4.11Å; M13-W93 HydrophobicContact CE-CD2 4.06Å; M13-W93 HydrophobicContact CE-CG 3.6Å; M13-W93 HydrophobicContact CG-CZ2 4.46Å; M13-W93 HydrophobicContact SD-CD2 3.62Å; M13-W93 HydrophobicContact SD-CE3 4.26Å; M13-W93 HydrophobicContact SD-CG 3.84Å; M13-W93 HydrophobicContact SD-CZ2 3.9Å; M13-W93 PolarHBondContact SD-NE1 2.81Å
14	S	93.2	Very high	78.1	Confident	17 Å²	17	83.4 Å²	83.4	12%	0.119	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.5	170	-58.7	0	0	0	0	110.3	K23 L82 S83	S14-K23 WeakPolarHBondContact CA-O 3.42Å; S14-L82 CarbonylContact O-C 3.55Å; S14-L82 VanDerWaalsContact O-CA 3.26Å; S14-L82 WeakPolarHBondContact O-CA 3.42Å; S14-S83 PolarHBondContact N-O 2.97Å; S14-S83 PolarHBondContact O-N 3.11Å
15	K	93.8	Very high	81	Confident	17 Å²	17	77.7 Å²	77.7	7%	0.074	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.5	168	172.9	177.2	-177.5	-58.2	0	108.9	W22 K23 F27 Y36 L82	K15-W22 WeakPolarHBondContact O-CA 3.37Å; K15-K23 PolarHBondContact N-O 3.02Å; K15-K23 PolarHBondContact O-N 3.37Å; K15-F27 HydrophobicContact CB-CZ 4.23Å; K15-Y36 HydrophobicContact CD-CE1 4.33Å; K15-Y36 HydrophobicContact CD-CE2 4.48Å; K15-L82 HydrophobicContact CB-CD2 3.69Å; K15-L82 HydrophobicContact CG-CD2 3.98Å
16	L	92.1	Very high	83.5	Confident	52 Å²	52	72.4 Å²	72.4	27%	0.272	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	125.5	162.5	-169.1	66.7	0	0	0	108.7	G20 W22 T81	L16-G20 VanDerWaalsContact CD1-C 3.5Å; L16-G20 VanDerWaalsContact CD1-O 3.31Å; L16-G20 WeakPolarHBondContact CD1-O 3.49Å; L16-W22 HydrophobicContact CB-CD2 4.49Å; L16-W22 HydrophobicContact CB-CE3 4.23Å; L16-W22 HydrophobicContact CB-CH2 4.13Å; L16-W22 HydrophobicContact CB-CZ2 4.34Å; L16-W22 HydrophobicContact CB-CZ3 4.06Å; L16-W22 HydrophobicContact CD1-CD2 4.06Å; L16-W22 HydrophobicContact CD1-CG 4.32Å; L16-W22 HydrophobicContact CD1-CZ2 4.16Å; L16-T81 PolarHBondContact N-O 3.41Å
17	D	86.9	Confident	85.8	Confident	27 Å²	27	65.2 Å²	65.2	14%	0.144	33%	0.329	C	S	.	.			trans	-90.7	177	172.9	76.7	11.5	0	0	0	112.7	C19 G20 E21 K23	D17-C19 PolarHBondContact O-N 3.44Å; D17-C19 WeakPolarHBondContact OD1-CA 3.35Å; D17-C19 WeakPolarHBondContact OD1-CB 3.42Å; D17-C19 PolarHBondContact OD1-N 3.33Å; D17-G20 PolarHBondContact O-N 3.07Å; D17-G20 PolarHBondContact OD1-N 3.1Å; D17-G20 VanDerWaalsContact OD1-N 3.1Å; D17-E21 PolarHBondContact N-O 2.94Å; D17-E21 PolarHBondContact OD1-N 2.92Å; D17-K23 WeakPolarHBondContact OD2-CD 3.21Å; D17-K23 WeakPolarHBondContact OD2-CE 3.29Å; D17-K23 IonicContact OD2-NZ 3.81Å; D17-K23 PolarHBondContact OD2-NZ 2.95Å
18	D	83.1	Confident	87.9	Confident	164 Å²	164	61.8 Å²	61.8	88%	0.877	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.3	-173.5	-43.3	-47.6	0	0	0	112.3
19	C	78.9	Confident	89.6	Confident	113 Å²	113	54.7 Å²	54.7	76%	0.764	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-6.5	168.9	-62	0	0	0	0	112.5	D17	D17-C19 PolarHBondContact O-N 3.44Å; D17-C19 WeakPolarHBondContact OD1-CA 3.35Å; D17-C19 WeakPolarHBondContact OD1-CB 3.42Å; D17-C19 PolarHBondContact OD1-N 3.33Å
20	G	82.5	Confident	89.7	Confident	49 Å²	49	54.5 Å²	54.5	51%	0.505	28%	0.281	S	S	.	.	S	Bend	trans	84	10.1	-174.1	0	0	0	0	0	114.4	L16 D17	L16-G20 VanDerWaalsContact CD1-C 3.5Å; L16-G20 VanDerWaalsContact CD1-O 3.31Å; L16-G20 WeakPolarHBondContact CD1-O 3.49Å; D17-G20 PolarHBondContact O-N 3.07Å; D17-G20 PolarHBondContact OD1-N 3.1Å; D17-G20 VanDerWaalsContact OD1-N 3.1Å
21	E	88.1	Confident	89	Confident	111 Å²	111	56.2 Å²	56.2	52%	0.519	30%	0.295	S	S	.	.			trans	-88.3	145.5	177.6	-63.7	-164.7	127.8	0	0	112.4	D17 K23	D17-E21 PolarHBondContact N-O 2.94Å; D17-E21 PolarHBondContact OD1-N 2.92Å; E21-K23 PolarHBondContact O-N 2.92Å; E21-K23 WeakPolarHBondContact OE2-CE 3.5Å; E21-K23 IonicContact OE2-NZ 2.68Å; E21-K23 PolarHBondContact OE2-NZ 3.3Å
22	W	90.8	Very high	88	Confident	48 Å²	48	57.3 Å²	57.3	18%	0.182	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	95.6	178.4	-76.7	102.1	0	0	0	111.9	K15 L16 V65 K67 T81	K15-W22 WeakPolarHBondContact O-CA 3.37Å; L16-W22 HydrophobicContact CB-CD2 4.49Å; L16-W22 HydrophobicContact CB-CE3 4.23Å; L16-W22 HydrophobicContact CB-CH2 4.13Å; L16-W22 HydrophobicContact CB-CZ2 4.34Å; L16-W22 HydrophobicContact CB-CZ3 4.06Å; L16-W22 HydrophobicContact CD1-CD2 4.06Å; L16-W22 HydrophobicContact CD1-CG 4.32Å; L16-W22 HydrophobicContact CD1-CZ2 4.16Å; W22-V65 HydrophobicContact CH2-CB 4.22Å; W22-V65 HydrophobicContact CH2-CG1 4.02Å; W22-V65 HydrophobicContact CH2-CG2 4.14Å; W22-V65 HydrophobicContact CZ2-CB 3.8Å; W22-V65 HydrophobicContact CZ2-CG1 3.92Å; W22-V65 HydrophobicContact CZ2-CG2 4.04Å; W22-K67 HydrophobicContact CB-CD 3.55Å; W22-K67 HydrophobicContact CD2-CB 4.35Å; W22-K67 HydrophobicContact CD2-CD 4.32Å; W22-K67 HydrophobicContact CG-CB 4.25Å; W22-K67 HydrophobicContact CG-CD 3.57Å; W22-T81 HydrophobicContact CH2-CG2 3.94Å
23	K	91.6	Very high	87.7	Confident	87 Å²	87	52.1 Å²	52.1	38%	0.378	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.5	-178.6	-75.3	169.4	-179.8	142	0	111.7	S14 K15 D17 E21 H25	S14-K23 WeakPolarHBondContact CA-O 3.42Å; K15-K23 PolarHBondContact N-O 3.02Å; K15-K23 PolarHBondContact O-N 3.37Å; D17-K23 WeakPolarHBondContact OD2-CD 3.21Å; D17-K23 WeakPolarHBondContact OD2-CE 3.29Å; D17-K23 IonicContact OD2-NZ 3.81Å; D17-K23 PolarHBondContact OD2-NZ 2.95Å; E21-K23 PolarHBondContact O-N 2.92Å; E21-K23 WeakPolarHBondContact OE2-CE 3.5Å; E21-K23 IonicContact OE2-NZ 2.68Å; E21-K23 PolarHBondContact OE2-NZ 3.3Å; K23-H25 PolarHBondContact O-CE1 3.34Å; K23-H25 PolarHBondContact O-ND1 3.07Å
24	K	93.6	Very high	87.6	Confident	129 Å²	129	51.9 Å²	51.9	56%	0.561	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	126.2	-178.5	-174.5	-170.9	179.2	-167.1	0	109.4	W12 M13	W12-K24 HydrophobicContact CD2-CD 4.49Å; W12-K24 VanDerWaalsContact CD2-CE 3.49Å; W12-K24 HydrophobicContact CE3-CD 3.98Å; W12-K24 VanDerWaalsContact CE3-CE 3.45Å; W12-K24 HydrophobicContact CE3-CG 3.72Å; W12-K24 HydrophobicContact CZ3-CD 4.3Å; W12-K24 HydrophobicContact CZ3-CG 4.12Å; M13-K24 WeakPolarHBondContact O-CA 3.35Å
25	H	92.9	Very high	87.6	Confident	20 Å²	20	53.1 Å²	53.1	9%	0.093	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.9	178.7	-55.4	85.8	0	0	0	110.6	W12 M13 K23 F27 Y36 Y37 D49	W12-H25 VanDerWaalsContact CE3-C 3.43Å; M13-H25 PolarHBondContact N-O 3.06Å; M13-H25 PolarHBondContact O-N 2.98Å; M13-H25 VanDerWaalsContact O-O 3.1Å; K23-H25 PolarHBondContact O-CE1 3.34Å; K23-H25 PolarHBondContact O-ND1 3.07Å; H25-F27 HydrophobicContact CB-CD2 4.28Å; H25-F27 HydrophobicContact CB-CE2 3.75Å; H25-F27 HydrophobicContact CB-CZ 4.33Å; H25-F27 WeakPolarHBondContact O-CD2 3.25Å; H25-Y36 HydrophobicContact CB-CD2 4.12Å; H25-Y36 AromaticContact CD2-CD2 3.61Å; H25-Y36 AromaticContact CD2-CE2 3.99Å; H25-Y36 AromaticContact CG-CD2 3.87Å; H25-Y37 CarbonylContact C-O 3.57Å; H25-Y37 WeakPolarHBondContact CA-O 3.38Å; H25-Y37 WeakPolarHBondContact CB-O 3.48Å; H25-D49 IonicContact CD2-OD2 3.67Å; H25-D49 PolarHBondContact CD2-OD2 2.78Å; H25-D49 IonicContact NE2-OD2 2.7Å
26	W	92.5	Very high	87.5	Confident	44 Å²	44	53.8 Å²	53.8	17%	0.167	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.5	171.9	179.9	-112	0	0	0	109.1	K10 W12 Y36 Y37 E43	K10-W26 HydrophobicContact CB-CH2 4.37Å; K10-W26 HydrophobicContact CB-CZ2 3.84Å; K10-W26 HydrophobicContact CD-CZ2 4.29Å; W12-W26 AromaticContact CD1-CE3 3.65Å; W12-W26 AromaticContact CD1-CZ3 3.6Å; W12-W26 AromaticContact CD2-CE3 3.8Å; W12-W26 HydrophobicContact CD2-CE3 3.8Å; W12-W26 AromaticContact CE2-CE3 3.77Å; W12-W26 HydrophobicContact CE3-CB 4.16Å; W12-W26 AromaticContact CG-CE3 3.77Å; W12-W26 HydrophobicContact CG-CE3 3.77Å; W12-W26 HydrophobicContact CG-CZ3 4.11Å; W12-W26 HydrophobicContact CH2-CB 4.36Å; W12-W26 HydrophobicContact CZ3-CB 4.09Å; W12-W26 AromaticContact NE1-CE3 3.61Å; W12-W26 AromaticContact NE1-CZ3 3.71Å; W26-Y36 WeakPolarHBondContact O-CA 3.37Å; W26-Y37 PolarHBondContact N-O 3.48Å; W26-Y37 PolarHBondContact O-N 3.1Å; W26-E43 PolarHBondContact NE1-OE2 2.94Å
27	F	93.1	Very high	87.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	139.4	-177	-76.2	-97	0	0	0	111.5	K10 G11 M13 K15 H25 L34 K35 Y36 L82 W93	K10-F27 CarbonylContact C-O 3.52Å; K10-F27 VanDerWaalsContact CA-O 3.23Å; K10-F27 WeakPolarHBondContact CA-O 3.45Å; G11-F27 PolarHBondContact N-O 3.4Å; G11-F27 PolarHBondContact O-N 3.18Å; M13-F27 HydrophobicContact CB-CD2 3.53Å; M13-F27 HydrophobicContact CB-CE2 3.66Å; M13-F27 HydrophobicContact CB-CG 4.42Å; M13-F27 HydrophobicContact CG-CB 4.29Å; M13-F27 HydrophobicContact CG-CD2 3.6Å; M13-F27 HydrophobicContact CG-CE2 4.23Å; M13-F27 HydrophobicContact CG-CG 4.09Å; M13-F27 HydrophobicContact SD-CB 4.19Å; M13-F27 HydrophobicContact SD-CD2 4.06Å; M13-F27 HydrophobicContact SD-CG 4.01Å; K15-F27 HydrophobicContact CB-CZ 4.23Å; H25-F27 HydrophobicContact CB-CD2 4.28Å; H25-F27 HydrophobicContact CB-CE2 3.75Å; H25-F27 HydrophobicContact CB-CZ 4.33Å; H25-F27 WeakPolarHBondContact O-CD2 3.25Å; F27-L34 HydrophobicContact CB-CD1 4.34Å; F27-L34 HydrophobicContact CD1-CD1 4.13Å; F27-L34 HydrophobicContact CD1-CD2 3.95Å; F27-L34 HydrophobicContact CD1-CG 3.93Å; F27-L34 HydrophobicContact CE1-CD2 4.35Å; F27-K35 WeakPolarHBondContact CA-O 3.01Å; F27-Y36 AromaticContact CE1-CD1 3.98Å; F27-Y36 HydrophobicContact CE1-CD1 3.98Å; F27-Y36 HydrophobicContact CE1-CG 4.04Å; F27-Y36 HydrophobicContact CZ-CD1 4.45Å; F27-Y36 HydrophobicContact CZ-CG 4.23Å; F27-L82 HydrophobicContact CE1-CD1 4.03Å; F27-L82 HydrophobicContact CE1-CD2 4.08Å; F27-L82 HydrophobicContact CZ-CD1 4.32Å; F27-L82 HydrophobicContact CZ-CD2 3.71Å; F27-W93 HydrophobicContact CB-CH2 4.03Å; F27-W93 HydrophobicContact CB-CZ2 4.29Å
28	V	91	Very high	87.7	Confident	8 Å²	8	56.7 Å²	56.7	5%	0.048	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	114	-178.2	179.9	0	0	0	0	108.7	K10 T30 K35 Y37 E43	K10-V28 HydrophobicContact CD-CG1 4.42Å; K10-V28 HydrophobicContact CD-CG2 4.22Å; K10-V28 HydrophobicContact CG-CG1 4.22Å; K10-V28 HydrophobicContact CG-CG2 4.22Å; V28-T30 HydrophobicContact CG1-CG2 4.29Å; V28-K35 HydrophobicContact CB-CB 4.44Å; V28-K35 PolarHBondContact N-O 3.43Å; V28-K35 PolarHBondContact O-N 2.92Å; V28-Y37 HydrophobicContact CB-CE2 4.09Å; V28-Y37 HydrophobicContact CG2-CD2 3.9Å; V28-Y37 HydrophobicContact CG2-CE2 3.77Å; V28-E43 HydrophobicContact CG2-CG 4.33Å; V28-E43 VanDerWaalsContact CG2-OE1 3.28Å; V28-E43 WeakPolarHBondContact CG2-OE1 3.49Å
29	L	90.4	Very high	88	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.9	172.5	-175.9	64.6	0	0	0	110.2	K9 L34 L54 W93 V96 L97	K9-L29 HydrophobicContact CB-CB 4.1Å; K9-L29 HydrophobicContact CB-CD2 4.18Å; K9-L29 WeakPolarHBondContact O-CB 3.4Å; K9-L29 PolarHBondContact O-N 3.04Å; L29-L34 HydrophobicContact CB-CD1 4.34Å; L29-L34 HydrophobicContact CD1-CD1 4.37Å; L29-L54 HydrophobicContact CD1-CD1 3.43Å; L29-L54 VanDerWaalsContact CD1-CD1 3.43Å; L29-W93 HydrophobicContact CB-CZ3 4.39Å; L29-V96 HydrophobicContact CD2-CG1 3.3Å; L29-L97 HydrophobicContact CD1-CD2 4.14Å
30	T	83.9	Confident	88.1	Confident	28 Å²	28	48.5 Å²	48.5	17%	0.172	25%	0.245	C	C	.	.			trans	-127.2	176.5	174.2	67.7	0	0	0	0	110.3	V28 A32 G33 K35	V28-T30 HydrophobicContact CG1-CG2 4.29Å; T30-A32 VanDerWaalsContact C-N 3.29Å; T30-A32 PolarHBondContact OG1-N 3.15Å; T30-G33 PolarHBondContact N-O 3.5Å; T30-G33 PolarHBondContact OG1-N 3.48Å; T30-G33 PolarHBondContact OG1-O 3.37Å; T30-K35 HydrophobicContact CG2-CD 4.31Å
31	D	74.4	Confident	88.1	Confident	138 Å²	138	49.3 Å²	49.3	74%	0.738	24%	0.24	S	C	*	.	S	Bend	trans	-71.7	-23	167.4	64.5	-41.7	0	0	0	112.8
32	A	69.1	Low	87.8	Confident	36 Å²	36	44.3 Å²	44.3	30%	0.298	22%	0.218	S	C	.	.	S	Bend	trans	-78.7	-47.5	176.7	0	0	0	0	0	112.9	T30 K55	T30-A32 VanDerWaalsContact C-N 3.29Å; T30-A32 PolarHBondContact OG1-N 3.15Å; A32-K55 VanDerWaalsContact O-CE 3.31Å; A32-K55 WeakPolarHBondContact O-CE 3.31Å; A32-K55 PolarHBondContact O-NZ 2.73Å
33	G	86.5	Confident	87.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.			trans	-178.1	-171.1	-173	0	0	0	0	0	113.4	T30 E51	T30-G33 PolarHBondContact N-O 3.5Å; T30-G33 PolarHBondContact OG1-N 3.48Å; T30-G33 PolarHBondContact OG1-O 3.37Å; G33-E51 WeakPolarHBondContact CA-OE1 3.46Å; G33-E51 PolarHBondContact N-OE1 3.28Å
34	L	91.7	Very high	87	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	100.3	174	177.7	68.5	0	0	0	109.5	F27 L29 I52 L54 I73 L82 W93 L97	F27-L34 HydrophobicContact CB-CD1 4.34Å; F27-L34 HydrophobicContact CD1-CD1 4.13Å; F27-L34 HydrophobicContact CD1-CD2 3.95Å; F27-L34 HydrophobicContact CD1-CG 3.93Å; F27-L34 HydrophobicContact CE1-CD2 4.35Å; L29-L34 HydrophobicContact CB-CD1 4.34Å; L29-L34 HydrophobicContact CD1-CD1 4.37Å; L34-I52 HydrophobicContact CB-CB 4.3Å; L34-I52 HydrophobicContact CD2-CD1 4.4Å; L34-I52 PolarHBondContact N-O 3.27Å; L34-I52 PolarHBondContact O-N 3.26Å; L34-L54 HydrophobicContact CB-CD1 4.18Å; L34-L54 HydrophobicContact CB-CD2 4.16Å; L34-L54 HydrophobicContact CB-CG 4.23Å; L34-I73 HydrophobicContact CD2-CD1 3.69Å; L34-L82 HydrophobicContact CD2-CD1 4.33Å; L34-W93 HydrophobicContact CD1-CH2 4.39Å; L34-W93 HydrophobicContact CD1-CZ3 3.79Å; L34-L97 HydrophobicContact CD2-CD2 4.07Å
35	K	92.2	Very high	86.4	Confident	42 Å²	42	48.2 Å²	48.2	18%	0.183	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	152.2	177.9	-70.9	-172.7	159.3	-162.7	0	111.5	F27 V28 T30 Y37 D46 L48 E51	F27-K35 WeakPolarHBondContact CA-O 3.01Å; V28-K35 HydrophobicContact CB-CB 4.44Å; V28-K35 PolarHBondContact N-O 3.43Å; V28-K35 PolarHBondContact O-N 2.92Å; T30-K35 HydrophobicContact CG2-CD 4.31Å; K35-Y37 HydrophobicContact CB-CE2 3.97Å; K35-D46 IonicContact NZ-OD1 3.34Å; K35-L48 HydrophobicContact CB-CD1 3.71Å; K35-L48 HydrophobicContact CD-CD1 3.58Å; K35-L48 HydrophobicContact CG-CD1 3.65Å; K35-E51 WeakPolarHBondContact CE-OE2 3.32Å; K35-E51 HydrophobicContact CG-CB 4.17Å; K35-E51 HydrophobicContact CG-CG 3.82Å
36	Y	92.9	Very high	85.8	Confident	31 Å²	31	51.9 Å²	51.9	12%	0.122	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.8	170.2	66.4	-95.1	0	0	0	113.3	K15 H25 W26 F27 D49 G50 I52	K15-Y36 HydrophobicContact CD-CE1 4.33Å; K15-Y36 HydrophobicContact CD-CE2 4.48Å; H25-Y36 HydrophobicContact CB-CD2 4.12Å; H25-Y36 AromaticContact CD2-CD2 3.61Å; H25-Y36 AromaticContact CD2-CE2 3.99Å; H25-Y36 AromaticContact CG-CD2 3.87Å; W26-Y36 WeakPolarHBondContact O-CA 3.37Å; F27-Y36 AromaticContact CE1-CD1 3.98Å; F27-Y36 HydrophobicContact CE1-CD1 3.98Å; F27-Y36 HydrophobicContact CE1-CG 4.04Å; F27-Y36 HydrophobicContact CZ-CD1 4.45Å; F27-Y36 HydrophobicContact CZ-CG 4.23Å; Y36-D49 HydrophobicContact CD2-CB 3.9Å; Y36-D49 VanDerWaalsContact CE2-C 3.41Å; Y36-D49 HydrophobicContact CE2-CB 3.89Å; Y36-D49 VanDerWaalsContact CE2-O 3.29Å; Y36-D49 WeakPolarHBondContact CE2-O 3.4Å; Y36-D49 PolarHBondContact O-N 3.27Å; Y36-D49 PolarHBondContact OH-O 3.38Å; Y36-G50 WeakPolarHBondContact CD1-O 3.3Å; Y36-G50 VanDerWaalsContact CZ-CA 3.5Å; Y36-G50 PolarHBondContact N-O 2.95Å; Y36-G50 PolarHBondContact O-N 2.68Å; Y36-I52 HydrophobicContact CE1-CG1 4.42Å
37	Y	92.9	Very high	85.4	Confident	9 Å²	9	53.6 Å²	53.6	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	159.2	-172.7	-59.1	-91.8	0	0	0	110	H25 W26 V28 K35 E43 D46 D47 L48	H25-Y37 CarbonylContact C-O 3.57Å; H25-Y37 WeakPolarHBondContact CA-O 3.38Å; H25-Y37 WeakPolarHBondContact CB-O 3.48Å; W26-Y37 PolarHBondContact N-O 3.48Å; W26-Y37 PolarHBondContact O-N 3.1Å; V28-Y37 HydrophobicContact CB-CE2 4.09Å; V28-Y37 HydrophobicContact CG2-CD2 3.9Å; V28-Y37 HydrophobicContact CG2-CE2 3.77Å; K35-Y37 HydrophobicContact CB-CE2 3.97Å; Y37-E43 HydrophobicContact CD1-CB 4.34Å; Y37-E43 HydrophobicContact CD2-CB 4.12Å; Y37-E43 HydrophobicContact CD2-CG 4.32Å; Y37-E43 HydrophobicContact CE2-CB 4.3Å; Y37-E43 HydrophobicContact CE2-CG 4.06Å; Y37-E43 HydrophobicContact CG-CB 4.14Å; Y37-D46 PolarHBondContact OH-OD1 3.49Å; Y37-D47 WeakPolarHBondContact CD1-O 3.43Å; Y37-L48 HydrophobicContact CE1-CB 4.14Å; Y37-L48 HydrophobicContact CE1-CD1 3.98Å; Y37-L48 HydrophobicContact CE2-CD1 4.36Å
38	R	90.6	Very high	85.1	Confident	131 Å²	131	56.7 Å²	56.7	49%	0.494	29%	0.288	S	S	.	.	S	Bend	trans	-63.4	-43.5	175.7	-65.8	177.3	-164.6	127.2	10.4	112	W12 D47 D49	W12-R38 WeakPolarHBondContact CH2-O 3.39Å; W12-R38 WeakPolarHBondContact CZ3-O 3.04Å; R38-D47 IonicContact NH1-OD2 3.41Å; R38-D47 PolarHBondContact NH1-OD2 3.26Å; R38-D49 HydrophobicContact CG-CB 4.4Å; R38-D49 WeakPolarHBondContact CG-OD2 3.47Å; R38-D49 IonicContact CZ-OD1 2.84Å; R38-D49 IonicContact NE-OD1 2.68Å; R38-D49 PolarHBondContact NE-OD1 3.24Å; R38-D49 IonicContact NE-OD2 2.82Å; R38-D49 PolarHBondContact NE-OD2 3.05Å; R38-D49 IonicContact NH2-OD1 3.54Å; R38-D49 PolarHBondContact NH2-OD1 3.01Å
39	D	87.6	Confident	84.9	Confident	59 Å²	59	58.7 Å²	58.7	32%	0.316	30%	0.298	S	S	.	.	S	Bend	trans	-155	179.5	178	62.8	66.4	0	0	0	112	W12 T41 A42 E43	W12-D39 HydrophobicContact CH2-CB 3.9Å; W12-D39 HydrophobicContact CZ2-CB 4.43Å; D39-T41 VanDerWaalsContact C-N 3.27Å; D39-T41 PolarHBondContact O-N 3.09Å; D39-T41 VanDerWaalsContact OD1-CA 3.27Å; D39-T41 WeakPolarHBondContact OD1-CA 3.39Å; D39-T41 VanDerWaalsContact OD1-CB 3.27Å; D39-T41 WeakPolarHBondContact OD1-CB 3.29Å; D39-T41 PolarHBondContact OD1-N 3.16Å; D39-T41 PolarHBondContact OD1-OG1 3.35Å; D39-A42 WeakPolarHBondContact O-CB 3.47Å; D39-A42 PolarHBondContact O-N 2.98Å; D39-A42 PolarHBondContact OD1-N 2.77Å; D39-E43 PolarHBondContact O-N 2.99Å
40	S	82.4	Confident	84.8	Confident	47 Å²	47	59.2 Å²	59.2	33%	0.329	31%	0.305	S	S	.	.	H	α-helix	trans	-68.2	-21.6	-179.1	-165.5	0	0	0	0	113.9	E44	S40-E44 WeakPolarHBondContact O-CG 3.02Å; S40-E44 PolarHBondContact O-N 3.48Å
41	T	81	Confident	85.1	Confident	66 Å²	66	61.6 Å²	61.6	41%	0.405	31%	0.314	S	S	.	.	H	α-helix	trans	-84.8	-20.5	176.5	83.8	0	0	0	0	112.1	D39 K45	D39-T41 VanDerWaalsContact C-N 3.27Å; D39-T41 PolarHBondContact O-N 3.09Å; D39-T41 VanDerWaalsContact OD1-CA 3.27Å; D39-T41 WeakPolarHBondContact OD1-CA 3.39Å; D39-T41 VanDerWaalsContact OD1-CB 3.27Å; D39-T41 WeakPolarHBondContact OD1-CB 3.29Å; D39-T41 PolarHBondContact OD1-N 3.16Å; D39-T41 PolarHBondContact OD1-OG1 3.35Å; T41-K45 WeakPolarHBondContact O-CD 3.27Å; T41-K45 WeakPolarHBondContact O-CE 3.44Å; T41-K45 VanDerWaalsContact O-CG 3.29Å; T41-K45 WeakPolarHBondContact O-CG 3.27Å; T41-K45 PolarHBondContact O-NZ 2.98Å; T41-K45 PolarHBondContact OG1-NZ 2.98Å
42	A	82.8	Confident	85.9	Confident	5 Å²	5	55.1 Å²	55.1	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-73.1	-37.2	166.2	0	0	0	0	0	110.8	D39 K45 D46 D47	D39-A42 WeakPolarHBondContact O-CB 3.47Å; D39-A42 PolarHBondContact O-N 2.98Å; D39-A42 PolarHBondContact OD1-N 2.77Å; A42-K45 CarbonylContact O-C 3.6Å; A42-K45 PolarHBondContact O-N 3.26Å; A42-D46 PolarHBondContact O-N 3.48Å; A42-D46 VanDerWaalsContact O-N 3.07Å; A42-D47 HydrophobicContact CB-CB 4.2Å; A42-D47 PolarHBondContact O-N 2.85Å
43	E	86.3	Confident	86.7	Confident	35 Å²	35	56.1 Å²	56.1	16%	0.164	28%	0.279	C	S	.	.	H	α-helix	trans	-58.9	-47.1	170.4	-175.1	-177.3	-163.3	0	0	111.6	K10 W26 V28 Y37 D39 K45 D46	K10-E43 WeakPolarHBondContact CE-OE1 3.34Å; K10-E43 VanDerWaalsContact NZ-CD 3.26Å; K10-E43 IonicContact NZ-OE1 3.98Å; K10-E43 PolarHBondContact NZ-OE1 3.1Å; K10-E43 IonicContact NZ-OE2 3.62Å; K10-E43 PolarHBondContact NZ-OE2 3.35Å; W26-E43 PolarHBondContact NE1-OE2 2.94Å; V28-E43 HydrophobicContact CG2-CG 4.33Å; V28-E43 VanDerWaalsContact CG2-OE1 3.28Å; V28-E43 WeakPolarHBondContact CG2-OE1 3.49Å; Y37-E43 HydrophobicContact CD1-CB 4.34Å; Y37-E43 HydrophobicContact CD2-CB 4.12Å; Y37-E43 HydrophobicContact CD2-CG 4.32Å; Y37-E43 HydrophobicContact CE2-CB 4.3Å; Y37-E43 HydrophobicContact CE2-CG 4.06Å; Y37-E43 HydrophobicContact CG-CB 4.14Å; D39-E43 PolarHBondContact O-N 2.99Å; E43-K45 PolarHBondContact O-N 3.48Å; E43-D46 PolarHBondContact O-N 3.33Å
44	E	78.8	Confident	86.7	Confident	160 Å²	160	56.7 Å²	56.7	75%	0.748	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-14.5	177.9	-72.1	175.5	168.8	0	0	114.4	S40	S40-E44 WeakPolarHBondContact O-CG 3.02Å; S40-E44 PolarHBondContact O-N 3.48Å
45	K	80.9	Confident	86.1	Confident	152 Å²	152	63.7 Å²	63.7	66%	0.661	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-1.7	178.8	-63.7	165.2	-165	147.4	0	113.2	T41 A42 E43 D47	T41-K45 WeakPolarHBondContact O-CD 3.27Å; T41-K45 WeakPolarHBondContact O-CE 3.44Å; T41-K45 VanDerWaalsContact O-CG 3.29Å; T41-K45 WeakPolarHBondContact O-CG 3.27Å; T41-K45 PolarHBondContact O-NZ 2.98Å; T41-K45 PolarHBondContact OG1-NZ 2.98Å; A42-K45 CarbonylContact O-C 3.6Å; A42-K45 PolarHBondContact O-N 3.26Å; E43-K45 PolarHBondContact O-N 3.48Å; K45-D47 HydrophobicContact CB-CB 4.5Å; K45-D47 PolarHBondContact O-N 3.16Å
46	D	81.1	Confident	85.6	Confident	97 Å²	97	62.4 Å²	62.4	52%	0.519	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	32.3	-166.7	-150.4	25.2	0	0	0	114.3	K35 Y37 A42 E43 L48	K35-D46 IonicContact NZ-OD1 3.34Å; Y37-D46 PolarHBondContact OH-OD1 3.49Å; A42-D46 PolarHBondContact O-N 3.48Å; A42-D46 VanDerWaalsContact O-N 3.07Å; E43-D46 PolarHBondContact O-N 3.33Å; D46-L48 VanDerWaalsContact C-N 3.29Å; D46-L48 PolarHBondContact O-N 3Å
47	D	84.3	Confident	85.3	Confident	79 Å²	79	61.4 Å²	61.4	42%	0.422	31%	0.306	S	S	.	.			trans	-78.9	76.5	175	-175.7	34.5	0	0	0	110.1	Y37 R38 A42 K45	Y37-D47 WeakPolarHBondContact CD1-O 3.43Å; R38-D47 IonicContact NH1-OD2 3.41Å; R38-D47 PolarHBondContact NH1-OD2 3.26Å; A42-D47 HydrophobicContact CB-CB 4.2Å; A42-D47 PolarHBondContact O-N 2.85Å; K45-D47 HydrophobicContact CB-CB 4.5Å; K45-D47 PolarHBondContact O-N 3.16Å
48	L	87	Confident	84.9	Confident	65 Å²	65	66 Å²	66	34%	0.34	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.6	-171.1	-172.5	102	0	0	0	112.9	K35 Y37 D46 E51	K35-L48 HydrophobicContact CB-CD1 3.71Å; K35-L48 HydrophobicContact CD-CD1 3.58Å; K35-L48 HydrophobicContact CG-CD1 3.65Å; Y37-L48 HydrophobicContact CE1-CB 4.14Å; Y37-L48 HydrophobicContact CE1-CD1 3.98Å; Y37-L48 HydrophobicContact CE2-CD1 4.36Å; D46-L48 VanDerWaalsContact C-N 3.29Å; D46-L48 PolarHBondContact O-N 3Å; L48-E51 HydrophobicContact CD2-CB 4.26Å
49	D	85.6	Confident	84.7	Confident	50 Å²	50	65 Å²	65	27%	0.267	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-15	175.8	-127.8	15.6	0	0	0	112.4	H25 Y36 R38	H25-D49 IonicContact CD2-OD2 3.67Å; H25-D49 PolarHBondContact CD2-OD2 2.78Å; H25-D49 IonicContact NE2-OD2 2.7Å; Y36-D49 HydrophobicContact CD2-CB 3.9Å; Y36-D49 VanDerWaalsContact CE2-C 3.41Å; Y36-D49 HydrophobicContact CE2-CB 3.89Å; Y36-D49 VanDerWaalsContact CE2-O 3.29Å; Y36-D49 WeakPolarHBondContact CE2-O 3.4Å; Y36-D49 PolarHBondContact O-N 3.27Å; Y36-D49 PolarHBondContact OH-O 3.38Å; R38-D49 HydrophobicContact CG-CB 4.4Å; R38-D49 WeakPolarHBondContact CG-OD2 3.47Å; R38-D49 IonicContact CZ-OD1 2.84Å; R38-D49 IonicContact NE-OD1 2.68Å; R38-D49 PolarHBondContact NE-OD1 3.24Å; R38-D49 IonicContact NE-OD2 2.82Å; R38-D49 PolarHBondContact NE-OD2 3.05Å; R38-D49 IonicContact NH2-OD1 3.54Å; R38-D49 PolarHBondContact NH2-OD1 3.01Å
50	G	88.9	Confident	84.9	Confident	14 Å²	14	62.5 Å²	62.5	14%	0.144	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.1	172.2	165.2	0	0	0	0	0	114	Y36	Y36-G50 WeakPolarHBondContact CD1-O 3.3Å; Y36-G50 VanDerWaalsContact CZ-CA 3.5Å; Y36-G50 PolarHBondContact N-O 2.95Å; Y36-G50 PolarHBondContact O-N 2.68Å
51	E	90.8	Very high	85.2	Confident	78 Å²	78	61.8 Å²	61.8	36%	0.364	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.9	176.5	-176.4	166.5	176.8	0	0	110.6	G33 K35 L48	G33-E51 WeakPolarHBondContact CA-OE1 3.46Å; G33-E51 PolarHBondContact N-OE1 3.28Å; K35-E51 WeakPolarHBondContact CE-OE2 3.32Å; K35-E51 HydrophobicContact CG-CB 4.17Å; K35-E51 HydrophobicContact CG-CG 3.82Å; L48-E51 HydrophobicContact CD2-CB 4.26Å
52	I	90	Very high	85.8	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	106.5	173.1	-61.6	169.3	0	0	0	107.1	L34 Y36 L54 I73 T75 F80	L34-I52 HydrophobicContact CB-CB 4.3Å; L34-I52 HydrophobicContact CD2-CD1 4.4Å; L34-I52 PolarHBondContact N-O 3.27Å; L34-I52 PolarHBondContact O-N 3.26Å; Y36-I52 HydrophobicContact CE1-CG1 4.42Å; I52-L54 HydrophobicContact CG2-CD2 4.41Å; I52-L54 PolarHBondContact O-N 3.43Å; I52-I73 HydrophobicContact CD1-CD1 4.44Å; I52-I73 HydrophobicContact CG2-CG2 4.09Å; I52-T75 HydrophobicContact CG2-CG2 4.14Å; I52-F80 HydrophobicContact CB-CD2 4.37Å; I52-F80 HydrophobicContact CB-CE2 4.31Å; I52-F80 HydrophobicContact CD1-CB 3.82Å; I52-F80 HydrophobicContact CD1-CD1 3.97Å; I52-F80 HydrophobicContact CD1-CD2 3.94Å; I52-F80 HydrophobicContact CD1-CG 3.62Å; I52-F80 HydrophobicContact CG1-CD1 4.06Å; I52-F80 HydrophobicContact CG1-CD2 3.87Å; I52-F80 HydrophobicContact CG1-CE1 4.13Å; I52-F80 HydrophobicContact CG1-CE2 3.95Å; I52-F80 HydrophobicContact CG1-CG 3.92Å; I52-F80 HydrophobicContact CG1-CZ 4.06Å; I52-F80 HydrophobicContact CG2-CD2 3.63Å; I52-F80 HydrophobicContact CG2-CE2 3.72Å; I52-F80 HydrophobicContact CG2-CG 4.43Å
53	D	86.7	Confident	86.1	Confident	58 Å²	58	67.2 Å²	67.2	31%	0.31	33%	0.331	S	S	.	.			trans	-61.5	125.6	174.5	169	46.4	0	0	0	110.9	K55 S56	D53-K55 VanDerWaalsContact OD1-CB 3.28Å; D53-K55 WeakPolarHBondContact OD1-CB 3.42Å; D53-K55 PolarHBondContact OD1-N 2.69Å; D53-S56 WeakPolarHBondContact OD2-CB 3.28Å; D53-S56 PolarHBondContact OD2-N 3.48Å; D53-S56 PolarHBondContact OD2-OG 3.05Å
54	L	86	Confident	86	Confident	11 Å²	11	72.4 Å²	72.4	6%	0.058	36%	0.36	C	S	.	.	S	Bend	trans	-91.5	-12.9	178.7	-61.1	-177.7	0	0	0	112.9	L29 L34 I52 C57 L97	L29-L54 HydrophobicContact CD1-CD1 3.43Å; L29-L54 VanDerWaalsContact CD1-CD1 3.43Å; L34-L54 HydrophobicContact CB-CD1 4.18Å; L34-L54 HydrophobicContact CB-CD2 4.16Å; L34-L54 HydrophobicContact CB-CG 4.23Å; I52-L54 HydrophobicContact CG2-CD2 4.41Å; I52-L54 PolarHBondContact O-N 3.43Å; L54-C57 HydrophobicContact CD2-CB 4.41Å; L54-C57 WeakPolarHBondContact O-CB 3.38Å; L54-C57 PolarHBondContact O-N 2.97Å; L54-L97 HydrophobicContact CD1-CD2 3.78Å; L54-L97 HydrophobicContact CD2-CD2 4.01Å
55	K	79.6	Confident	86.3	Confident	148 Å²	148	66.5 Å²	66.5	64%	0.643	33%	0.334	S	S	*	.	S	Bend	trans	-74.7	-31.2	178.3	-60.7	155.1	-175.1	150.6	0	111.5	A32 D53	A32-K55 VanDerWaalsContact O-CE 3.31Å; A32-K55 WeakPolarHBondContact O-CE 3.31Å; A32-K55 PolarHBondContact O-NZ 2.73Å; D53-K55 VanDerWaalsContact OD1-CB 3.28Å; D53-K55 WeakPolarHBondContact OD1-CB 3.42Å; D53-K55 PolarHBondContact OD1-N 2.69Å
56	S	81.6	Confident	86.1	Confident	15 Å²	15	68.8 Å²	68.8	11%	0.105	35%	0.348	C	S	.	.	S	Bend	trans	-88.3	-0	168.7	64.2	0	0	0	0	113.7	D53 L58 T75 R76	D53-S56 WeakPolarHBondContact OD2-CB 3.28Å; D53-S56 PolarHBondContact OD2-N 3.48Å; D53-S56 PolarHBondContact OD2-OG 3.05Å; S56-L58 PolarHBondContact O-N 2.97Å; S56-T75 CarbonylContact O-C 3.57Å; S56-T75 WeakPolarHBondContact O-CA 3.36Å; S56-R76 PolarHBondContact O-N 3.48Å; S56-R76 VanDerWaalsContact O-N 3.08Å
57	C	85.6	Confident	85.6	Confident	9 Å²	9	68.9 Å²	68.9	6%	0.061	34%	0.343	C	S	.	.			trans	-71	121.5	178.5	-177	0	0	0	0	111.8	L54 I73 Q74 T75 I101	L54-C57 HydrophobicContact CD2-CB 4.41Å; L54-C57 WeakPolarHBondContact O-CB 3.38Å; L54-C57 PolarHBondContact O-N 2.97Å; C57-I73 HydrophobicContact CB-CG2 4.48Å; C57-I73 VanDerWaalsContact SG-CG2 3.56Å; C57-Q74 PolarHBondContact SG-O 2.96Å; C57-T75 HydrophobicContact CB-CG2 4.4Å; C57-I101 HydrophobicContact CB-CD1 4.04Å; C57-I101 HydrophobicContact CB-CG1 3.96Å; C57-I101 WeakPolarHBondContact O-CG2 3.42Å; C57-I101 WeakPolarHBondContact SG-CD1 3.24Å
58	L	85.7	Confident	85.8	Confident	105 Å²	105	69 Å²	69	55%	0.55	34%	0.344	S	S	.	.			trans	-91.3	-36.9	-177.6	-58.1	177.8	0	0	0	112.2	S56 Q74 R76	S56-L58 PolarHBondContact O-N 2.97Å; L58-Q74 PolarHBondContact N-O 2.92Å; L58-R76 HydrophobicContact CD1-CG 4.2Å; L58-R76 HydrophobicContact CD2-CG 3.9Å; L58-R76 HydrophobicContact CG-CG 4.12Å
59	K	86.1	Confident	85.9	Confident	111 Å²	111	70 Å²	70	48%	0.483	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	143.4	-171.8	-174.5	-176.1	175.8	-166.2	0	111.6	S61 Q74	K59-S61 WeakPolarHBondContact CE-OG 3.46Å; K59-Q74 HydrophobicContact CB-CB 4.32Å; K59-Q74 PolarHBondContact N-O 3.39Å; K59-Q74 PolarHBondContact O-N 3.18Å
60	V	91.3	Very high	86.2	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.042	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.7	164.3	-176.8	0	0	0	0	108.9	F71 Q72 I73 I94 L97 K98 I101	V60-F71 HydrophobicContact CG1-CD2 3.93Å; V60-F71 HydrophobicContact CG1-CE2 4.38Å; V60-Q72 VanDerWaalsContact CA-O 3.32Å; V60-Q72 WeakPolarHBondContact CA-O 3.47Å; V60-I73 HydrophobicContact CG2-CG1 4.31Å; V60-I73 HydrophobicContact CG2-CG2 4.26Å; V60-I94 HydrophobicContact CG1-CB 4.33Å; V60-I94 HydrophobicContact CG1-CG1 4.04Å; V60-I94 HydrophobicContact CG1-CG2 4.09Å; V60-L97 HydrophobicContact CG2-CB 4.15Å; V60-K98 HydrophobicContact CB-CG 4.29Å; V60-K98 WeakPolarHBondContact O-CE 3.44Å; V60-I101 HydrophobicContact CG2-CD1 3.52Å
61	S	90	Very high	86.5	Confident	32 Å²	32	67 Å²	67	22%	0.224	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.3	-178.3	38.2	0	0	0	0	112.4	K59 F71 Q72	K59-S61 WeakPolarHBondContact CE-OG 3.46Å; S61-F71 CarbonylContact O-C 3.48Å; S61-F71 WeakPolarHBondContact O-CA 3.14Å; S61-F71 WeakPolarHBondContact O-CB 3.19Å; S61-Q72 PolarHBondContact N-O 3.45Å; S61-Q72 VanDerWaalsContact N-O 3.12Å; S61-Q72 PolarHBondContact O-N 3.35Å
62	E	92.2	Very high	86.7	Confident	98 Å²	98	65.2 Å²	65.2	46%	0.458	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	140.5	170.8	-65.3	-178.4	-143.3	0	0	109.5	R90 I94	E62-R90 IonicContact OE2-CZ 2.61Å; E62-R90 IonicContact OE2-NE 3.49Å; E62-R90 PolarHBondContact OE2-NE 3.06Å; E62-R90 IonicContact OE2-NH2 3.64Å; E62-R90 PolarHBondContact OE2-NH2 2.9Å; E62-I94 HydrophobicContact CB-CD1 4.37Å; E62-I94 HydrophobicContact CG-CD1 3.26Å
63	F	89.9	Confident	86.9	Confident	87 Å²	87	65.2 Å²	65.2	38%	0.382	32%	0.316	S	S	.	.			trans	-145.3	126.8	-174.2	-175.8	-103.9	0	0	0	108.5	V65 G70 Q72 T81	F63-V65 HydrophobicContact CD1-CG1 3.54Å; F63-V65 HydrophobicContact CE1-CG1 3.89Å; F63-G70 PolarHBondContact N-O 3.05Å; F63-G70 CarbonylContact O-C 3.54Å; F63-G70 WeakPolarHBondContact O-CA 3.29Å; F63-Q72 HydrophobicContact CB-CB 4.45Å; F63-Q72 HydrophobicContact CB-CG 3.92Å; F63-Q72 HydrophobicContact CD1-CG 4.07Å; F63-Q72 HydrophobicContact CD2-CG 4.42Å; F63-Q72 HydrophobicContact CG-CG 3.88Å; F63-T81 HydrophobicContact CD1-CG2 3.91Å; F63-T81 HydrophobicContact CE1-CG2 4.29Å
64	N	84.6	Confident	87.1	Confident	143 Å²	143	66.3 Å²	66.3	77%	0.765	32%	0.319	S	S	*	.			trans	-76.5	131.2	-177.3	-67.3	-9.6	0	0	0	109.4
65	V	84.9	Confident	87.2	Confident	36 Å²	36	66.3 Å²	66.3	22%	0.218	32%	0.32	C	S	.	.			trans	-138.3	155.2	-179.4	-58.9	0	0	0	0	109.3	W22 F63 K67 N68 T81	W22-V65 HydrophobicContact CH2-CB 4.22Å; W22-V65 HydrophobicContact CH2-CG1 4.02Å; W22-V65 HydrophobicContact CH2-CG2 4.14Å; W22-V65 HydrophobicContact CZ2-CB 3.8Å; W22-V65 HydrophobicContact CZ2-CG1 3.92Å; W22-V65 HydrophobicContact CZ2-CG2 4.04Å; F63-V65 HydrophobicContact CD1-CG1 3.54Å; F63-V65 HydrophobicContact CE1-CG1 3.89Å; V65-K67 PolarHBondContact O-N 3.45Å; V65-N68 VanDerWaalsContact CG2-O 3.22Å; V65-N68 WeakPolarHBondContact CG2-O 3.43Å; V65-T81 HydrophobicContact CG1-CG2 3.94Å
66	E	75.4	Confident	87.5	Confident	201 Å²	201	68.1 Å²	68.1	94%	0.939	32%	0.323	S	S	*	.	S	Bend	trans	-66	-20.9	180	-60.1	172.3	171.6	0	0	113.3
67	K	71.9	Confident	87.7	Confident	98 Å²	98	75.9 Å²	75.9	43%	0.426	36%	0.357	S	S	.	.	S	Bend	trans	-121	90.4	-172.3	-160	177.6	-170.4	175.2	0	112.3	W22 V65 S83	W22-K67 HydrophobicContact CB-CD 3.55Å; W22-K67 HydrophobicContact CD2-CB 4.35Å; W22-K67 HydrophobicContact CD2-CD 4.32Å; W22-K67 HydrophobicContact CG-CB 4.25Å; W22-K67 HydrophobicContact CG-CD 3.57Å; V65-K67 PolarHBondContact O-N 3.45Å; K67-S83 WeakPolarHBondContact O-CB 3.45Å; K67-S83 PolarHBondContact O-OG 3.34Å
68	N	88.1	Confident	87.8	Confident	82 Å²	82	77.4 Å²	77.4	44%	0.439	37%	0.371	S	S	.	.	S	Bend	trans	64.5	-163.7	-180	-43	-46.6	0	0	0	114.2	V65 G70 A84	V65-N68 VanDerWaalsContact CG2-O 3.22Å; V65-N68 WeakPolarHBondContact CG2-O 3.43Å; N68-G70 PolarHBondContact O-N 3.24Å; N68-A84 WeakPolarHBondContact CB-O 3.28Å
69	Y	90.1	Very high	88.1	Confident	86 Å²	86	76 Å²	76	34%	0.337	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	90.8	-170.3	-61.2	-87.8	0	0	0	111.4	A84 T86 A87	Y69-A84 PolarHBondContact N-O 2.98Å; Y69-A84 PolarHBondContact O-N 3.29Å; Y69-T86 VanDerWaalsContact CD2-CA 3.43Å; Y69-A87 HydrophobicContact CD1-CB 3.66Å; Y69-A87 HydrophobicContact CD2-CB 4.49Å; Y69-A87 HydrophobicContact CE1-CB 3.68Å; Y69-A87 HydrophobicContact CG-CB 4.07Å
70	G	92	Very high	88.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	155.3	-178.2	0	0	0	0	0	115.8	F63 N68 L82 R90	F63-G70 PolarHBondContact N-O 3.05Å; F63-G70 CarbonylContact O-C 3.54Å; F63-G70 WeakPolarHBondContact O-CA 3.29Å; N68-G70 PolarHBondContact O-N 3.24Å; G70-L82 CarbonylContact C-O 3.49Å; G70-L82 VanDerWaalsContact CA-O 3.32Å; G70-L82 WeakPolarHBondContact CA-O 3.33Å; G70-R90 WeakPolarHBondContact O-CD 3.43Å; G70-R90 PolarHBondContact O-NH1 2.81Å
71	F	94.4	Very high	88.5	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	162.9	166.9	69.5	-81.6	0	0	0	110.8	M13 V60 S61 I73 L82 R90 W93 I94 L97	M13-F71 HydrophobicContact CE-CE1 3.38Å; M13-F71 HydrophobicContact CE-CZ 3.51Å; V60-F71 HydrophobicContact CG1-CD2 3.93Å; V60-F71 HydrophobicContact CG1-CE2 4.38Å; S61-F71 CarbonylContact O-C 3.48Å; S61-F71 WeakPolarHBondContact O-CA 3.14Å; S61-F71 WeakPolarHBondContact O-CB 3.19Å; F71-I73 HydrophobicContact CD2-CG1 4.34Å; F71-I73 HydrophobicContact CE2-CD1 4.19Å; F71-I73 HydrophobicContact CE2-CG1 3.92Å; F71-L82 HydrophobicContact CD1-CB 4.39Å; F71-L82 HydrophobicContact CE1-CB 3.86Å; F71-L82 HydrophobicContact CE2-CB 4.26Å; F71-L82 HydrophobicContact CE2-CD1 4.09Å; F71-L82 HydrophobicContact CZ-CB 3.79Å; F71-L82 HydrophobicContact CZ-CD1 3.8Å; F71-L82 HydrophobicContact CZ-CG 4.37Å; F71-L82 PolarHBondContact N-O 2.75Å; F71-L82 PolarHBondContact O-N 3.24Å; F71-R90 HydrophobicContact CB-CG 4.43Å; F71-R90 HydrophobicContact CD1-CG 4.06Å; F71-W93 HydrophobicContact CE1-CB 4.43Å; F71-W93 HydrophobicContact CZ-CB 4.07Å; F71-I94 HydrophobicContact CB-CD1 3.59Å; F71-I94 HydrophobicContact CB-CG1 3.99Å; F71-I94 HydrophobicContact CD1-CG1 4.39Å; F71-I94 HydrophobicContact CD2-CD1 4.4Å; F71-I94 HydrophobicContact CD2-CG1 3.83Å; F71-I94 HydrophobicContact CE2-CG1 4.41Å; F71-I94 HydrophobicContact CG-CD1 3.97Å; F71-I94 HydrophobicContact CG-CG1 3.82Å; F71-L97 HydrophobicContact CE2-CD1 3.85Å; F71-L97 HydrophobicContact CZ-CD1 4.39Å
72	Q	94.6	Very high	88.7	Confident	42 Å²	42	71.6 Å²	71.6	20%	0.196	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.6	179.9	-78	175.5	-21.4	0	0	111.6	V60 S61 F63 V79 F80 T81	V60-Q72 VanDerWaalsContact CA-O 3.32Å; V60-Q72 WeakPolarHBondContact CA-O 3.47Å; S61-Q72 PolarHBondContact N-O 3.45Å; S61-Q72 VanDerWaalsContact N-O 3.12Å; S61-Q72 PolarHBondContact O-N 3.35Å; F63-Q72 HydrophobicContact CB-CB 4.45Å; F63-Q72 HydrophobicContact CB-CG 3.92Å; F63-Q72 HydrophobicContact CD1-CG 4.07Å; F63-Q72 HydrophobicContact CD2-CG 4.42Å; F63-Q72 HydrophobicContact CG-CG 3.88Å; Q72-V79 HydrophobicContact CB-CG1 4.11Å; Q72-V79 HydrophobicContact CG-CG1 4.06Å; Q72-F80 WeakPolarHBondContact CA-O 3.48Å; Q72-T81 HydrophobicContact CG-CG2 3.98Å; Q72-T81 WeakPolarHBondContact CG-OG1 3.46Å; Q72-T81 PolarHBondContact NE2-OG1 3.01Å
73	I	93.6	Very high	88.8	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.8	167.3	-53.1	176.4	0	0	0	106.9	L34 I52 C57 V60 F71 F80 L82 L97	L34-I73 HydrophobicContact CD2-CD1 3.69Å; I52-I73 HydrophobicContact CD1-CD1 4.44Å; I52-I73 HydrophobicContact CG2-CG2 4.09Å; C57-I73 HydrophobicContact CB-CG2 4.48Å; C57-I73 VanDerWaalsContact SG-CG2 3.56Å; V60-I73 HydrophobicContact CG2-CG1 4.31Å; V60-I73 HydrophobicContact CG2-CG2 4.26Å; F71-I73 HydrophobicContact CD2-CG1 4.34Å; F71-I73 HydrophobicContact CE2-CD1 4.19Å; F71-I73 HydrophobicContact CE2-CG1 3.92Å; I73-F80 HydrophobicContact CB-CB 4.41Å; I73-F80 PolarHBondContact N-O 3.27Å; I73-F80 PolarHBondContact O-N 2.63Å; I73-L82 HydrophobicContact CD1-CD1 3.71Å; I73-L82 HydrophobicContact CG1-CD1 4.45Å; I73-L97 HydrophobicContact CD1-CD1 3.71Å; I73-L97 HydrophobicContact CG1-CD1 4.18Å
74	Q	91.4	Very high	88.9	Confident	81 Å²	81	62.8 Å²	62.8	38%	0.379	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.4	178.3	176.1	170.9	31.4	0	0	109.3	C57 L58 K59 V79	C57-Q74 PolarHBondContact SG-O 2.96Å; L58-Q74 PolarHBondContact N-O 2.92Å; K59-Q74 HydrophobicContact CB-CB 4.32Å; K59-Q74 PolarHBondContact N-O 3.39Å; K59-Q74 PolarHBondContact O-N 3.18Å; Q74-V79 HydrophobicContact CB-CG2 4.34Å; Q74-V79 HydrophobicContact CG-CG2 4.1Å
75	T	89.4	Confident	89.1	Confident	11 Å²	11	62.4 Å²	62.4	7%	0.067	30%	0.299	C	S	.	.			trans	-92.4	-176.1	168.8	74.1	0	0	0	0	110.8	I52 S56 C57 E77 A78 F80	I52-T75 HydrophobicContact CG2-CG2 4.14Å; S56-T75 CarbonylContact O-C 3.57Å; S56-T75 WeakPolarHBondContact O-CA 3.36Å; C57-T75 HydrophobicContact CB-CG2 4.4Å; T75-E77 PolarHBondContact O-N 3.04Å; T75-E77 PolarHBondContact OG1-N 3.24Å; T75-A78 PolarHBondContact N-O 2.96Å; T75-A78 PolarHBondContact OG1-N 3.4Å; T75-A78 PolarHBondContact OG1-O 3.39Å; T75-F80 HydrophobicContact CG2-CD2 4.24Å; T75-F80 HydrophobicContact CG2-CE2 3.9Å
76	R	85.5	Confident	89.2	Confident	187 Å²	187	63.3 Å²	63.3	71%	0.706	31%	0.305	S	S	*	.	S	Bend	trans	-69.2	-19	171.7	-69	173.1	-169.4	-166.8	3.3	113.2	S56 L58	S56-R76 PolarHBondContact O-N 3.48Å; S56-R76 VanDerWaalsContact O-N 3.08Å; L58-R76 HydrophobicContact CD1-CG 4.2Å; L58-R76 HydrophobicContact CD2-CG 3.9Å; L58-R76 HydrophobicContact CG-CG 4.12Å
77	E	84.8	Confident	89.7	Confident	178 Å²	178	55.1 Å²	55.1	83%	0.832	27%	0.271	S	S	*	.	S	Bend	trans	-118.1	-31.7	-167.2	-65.9	172.2	-165.6	0	0	112.5	T75	T75-E77 PolarHBondContact O-N 3.04Å; T75-E77 PolarHBondContact OG1-N 3.24Å
78	A	87.8	Confident	90.4	Very high	41 Å²	41	52.1 Å²	52.1	34%	0.339	27%	0.268	S	S	.	.			trans	-147.8	163.8	-177.2	0	0	0	0	0	113.1	T75 F80	T75-A78 PolarHBondContact N-O 2.96Å; T75-A78 PolarHBondContact OG1-N 3.4Å; T75-A78 PolarHBondContact OG1-O 3.39Å; A78-F80 HydrophobicContact CB-CD2 4.49Å; A78-F80 HydrophobicContact CB-CE1 4.24Å; A78-F80 HydrophobicContact CB-CE2 3.84Å; A78-F80 HydrophobicContact CB-CZ 3.71Å
79	V	91.4	Very high	90.4	Very high	75 Å²	75	51.5 Å²	51.5	46%	0.455	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	109	169.9	-179.2	0	0	0	0	108.9	Q72 Q74	Q72-V79 HydrophobicContact CB-CG1 4.11Å; Q72-V79 HydrophobicContact CG-CG1 4.06Å; Q74-V79 HydrophobicContact CB-CG2 4.34Å; Q74-V79 HydrophobicContact CG-CG2 4.1Å
80	F	92.4	Very high	90.6	Very high	43 Å²	43	49 Å²	49	19%	0.189	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	114.8	178.6	-56.5	-79.7	0	0	0	109.7	I52 Q72 I73 T75 A78	I52-F80 HydrophobicContact CB-CD2 4.37Å; I52-F80 HydrophobicContact CB-CE2 4.31Å; I52-F80 HydrophobicContact CD1-CB 3.82Å; I52-F80 HydrophobicContact CD1-CD1 3.97Å; I52-F80 HydrophobicContact CD1-CD2 3.94Å; I52-F80 HydrophobicContact CD1-CG 3.62Å; I52-F80 HydrophobicContact CG1-CD1 4.06Å; I52-F80 HydrophobicContact CG1-CD2 3.87Å; I52-F80 HydrophobicContact CG1-CE1 4.13Å; I52-F80 HydrophobicContact CG1-CE2 3.95Å; I52-F80 HydrophobicContact CG1-CG 3.92Å; I52-F80 HydrophobicContact CG1-CZ 4.06Å; I52-F80 HydrophobicContact CG2-CD2 3.63Å; I52-F80 HydrophobicContact CG2-CE2 3.72Å; I52-F80 HydrophobicContact CG2-CG 4.43Å; Q72-F80 WeakPolarHBondContact CA-O 3.48Å; I73-F80 HydrophobicContact CB-CB 4.41Å; I73-F80 PolarHBondContact N-O 3.27Å; I73-F80 PolarHBondContact O-N 2.63Å; T75-F80 HydrophobicContact CG2-CD2 4.24Å; T75-F80 HydrophobicContact CG2-CE2 3.9Å; A78-F80 HydrophobicContact CB-CD2 4.49Å; A78-F80 HydrophobicContact CB-CE1 4.24Å; A78-F80 HydrophobicContact CB-CE2 3.84Å; A78-F80 HydrophobicContact CB-CZ 3.71Å
81	T	93.7	Very high	90.6	Very high	14 Å²	14	55.5 Å²	55.5	9%	0.086	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.3	172.9	-51.2	0	0	0	0	109.2	L16 W22 F63 V65 Q72	L16-T81 PolarHBondContact N-O 3.41Å; W22-T81 HydrophobicContact CH2-CG2 3.94Å; F63-T81 HydrophobicContact CD1-CG2 3.91Å; F63-T81 HydrophobicContact CE1-CG2 4.29Å; V65-T81 HydrophobicContact CG1-CG2 3.94Å; Q72-T81 HydrophobicContact CG-CG2 3.98Å; Q72-T81 WeakPolarHBondContact CG-OG1 3.46Å; Q72-T81 PolarHBondContact NE2-OG1 3.01Å
82	L	94.6	Very high	90.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	154.3	178.6	-58.1	-176.6	0	0	0	109.8	S14 K15 F27 L34 G70 F71 I73	S14-L82 CarbonylContact O-C 3.55Å; S14-L82 VanDerWaalsContact O-CA 3.26Å; S14-L82 WeakPolarHBondContact O-CA 3.42Å; K15-L82 HydrophobicContact CB-CD2 3.69Å; K15-L82 HydrophobicContact CG-CD2 3.98Å; F27-L82 HydrophobicContact CE1-CD1 4.03Å; F27-L82 HydrophobicContact CE1-CD2 4.08Å; F27-L82 HydrophobicContact CZ-CD1 4.32Å; F27-L82 HydrophobicContact CZ-CD2 3.71Å; L34-L82 HydrophobicContact CD2-CD1 4.33Å; G70-L82 CarbonylContact C-O 3.49Å; G70-L82 VanDerWaalsContact CA-O 3.32Å; G70-L82 WeakPolarHBondContact CA-O 3.33Å; F71-L82 HydrophobicContact CD1-CB 4.39Å; F71-L82 HydrophobicContact CE1-CB 3.86Å; F71-L82 HydrophobicContact CE2-CB 4.26Å; F71-L82 HydrophobicContact CE2-CD1 4.09Å; F71-L82 HydrophobicContact CZ-CB 3.79Å; F71-L82 HydrophobicContact CZ-CD1 3.8Å; F71-L82 HydrophobicContact CZ-CG 4.37Å; F71-L82 PolarHBondContact N-O 2.75Å; F71-L82 PolarHBondContact O-N 3.24Å; I73-L82 HydrophobicContact CD1-CD1 3.71Å; I73-L82 HydrophobicContact CG1-CD1 4.45Å
83	S	93.9	Very high	90.3	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.007	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.5	168.4	85.3	0	0	0	0	112.9	S14 K67	S14-S83 PolarHBondContact N-O 2.97Å; S14-S83 PolarHBondContact O-N 3.11Å; K67-S83 WeakPolarHBondContact O-CB 3.45Å; K67-S83 PolarHBondContact O-OG 3.34Å
84	A	93.2	Very high	90.2	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143.8	176.8	0	0	0	0	0	110	M13 N68 Y69 T86 I89 R90	M13-A84 HydrophobicContact CE-CB 4.26Å; N68-A84 WeakPolarHBondContact CB-O 3.28Å; Y69-A84 PolarHBondContact N-O 2.98Å; Y69-A84 PolarHBondContact O-N 3.29Å; A84-T86 PolarHBondContact O-N 2.94Å; A84-I89 HydrophobicContact CB-CB 4.06Å; A84-I89 HydrophobicContact CB-CG2 3.75Å; A84-R90 HydrophobicContact CB-CB 4.03Å
85	M	88.4	Confident	90.1	Very high	134 Å²	134	58.3 Å²	58.3	66%	0.66	29%	0.294	S	S	*	.	S	Bend	trans	-62.6	-25.5	-177.5	-162.6	175.1	125.1	0	0	113.3
86	T	86.9	Confident	90.1	Very high	56 Å²	56	59 Å²	59	34%	0.344	30%	0.298	S	S	.	.	S	Bend	trans	-137	154.6	175.9	75.1	0	0	0	0	112.7	Y69 A84 G88 I89 R90	Y69-T86 VanDerWaalsContact CD2-CA 3.43Å; A84-T86 PolarHBondContact O-N 2.94Å; T86-G88 PolarHBondContact O-N 2.73Å; T86-I89 HydrophobicContact CG2-CD1 4.36Å; T86-I89 PolarHBondContact O-N 2.91Å; T86-I89 VanDerWaalsContact O-N 3.11Å; T86-I89 WeakPolarHBondContact OG1-CG1 3.15Å; T86-I89 PolarHBondContact OG1-N 2.84Å; T86-R90 PolarHBondContact O-N 2.88Å
87	A	86.6	Confident	90.2	Very high	29 Å²	29	50.1 Å²	50.1	24%	0.24	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-25.6	174.8	0	0	0	0	0	113.6	Y69 R91	Y69-A87 HydrophobicContact CD1-CB 3.66Å; Y69-A87 HydrophobicContact CD2-CB 4.49Å; Y69-A87 HydrophobicContact CE1-CB 3.68Å; Y69-A87 HydrophobicContact CG-CB 4.07Å; A87-R91 WeakPolarHBondContact O-CG 3.01Å; A87-R91 PolarHBondContact O-N 2.88Å; A87-R91 PolarHBondContact O-NE 3.3Å
88	G	85.9	Confident	90.4	Very high	34 Å²	34	46.1 Å²	46.1	35%	0.351	25%	0.245	S	C	.	.	H	α-helix	trans	-69	-48.8	172.4	0	0	0	0	0	111.5	T86 R90 R91 N92	T86-G88 PolarHBondContact O-N 2.73Å; G88-R90 PolarHBondContact O-N 2.93Å; G88-R91 PolarHBondContact O-N 3.31Å; G88-N92 WeakPolarHBondContact O-CB 3.38Å; G88-N92 PolarHBondContact O-N 2.86Å
89	I	88.9	Confident	90.2	Very high	70 Å²	70	50.6 Å²	50.6	36%	0.359	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-42.4	177	-63.7	166.9	0	0	0	110.2	A84 T86 N92 W93	A84-I89 HydrophobicContact CB-CB 4.06Å; A84-I89 HydrophobicContact CB-CG2 3.75Å; T86-I89 HydrophobicContact CG2-CD1 4.36Å; T86-I89 PolarHBondContact O-N 2.91Å; T86-I89 VanDerWaalsContact O-N 3.11Å; T86-I89 WeakPolarHBondContact OG1-CG1 3.15Å; T86-I89 PolarHBondContact OG1-N 2.84Å; I89-N92 PolarHBondContact O-N 2.86Å; I89-W93 VanDerWaalsContact O-CD1 3.22Å; I89-W93 PolarHBondContact O-N 3.49Å
90	R	93.8	Very high	89.4	Confident	33 Å²	33	49.4 Å²	49.4	13%	0.125	25%	0.251	C	S	.	.	H	α-helix	trans	-53.1	-61.4	173.7	177.3	172.8	75.8	-160.5	2.3	111.6	E62 G70 F71 A84 T86 G88 N92 W93 I94	E62-R90 IonicContact OE2-CZ 2.61Å; E62-R90 IonicContact OE2-NE 3.49Å; E62-R90 PolarHBondContact OE2-NE 3.06Å; E62-R90 IonicContact OE2-NH2 3.64Å; E62-R90 PolarHBondContact OE2-NH2 2.9Å; G70-R90 WeakPolarHBondContact O-CD 3.43Å; G70-R90 PolarHBondContact O-NH1 2.81Å; F71-R90 HydrophobicContact CB-CG 4.43Å; F71-R90 HydrophobicContact CD1-CG 4.06Å; A84-R90 HydrophobicContact CB-CB 4.03Å; T86-R90 PolarHBondContact O-N 2.88Å; G88-R90 PolarHBondContact O-N 2.93Å; R90-N92 VanDerWaalsContact C-N 3.28Å; R90-N92 PolarHBondContact O-N 2.78Å; R90-W93 PolarHBondContact O-N 3.39Å; R90-I94 HydrophobicContact CG-CD1 3.61Å; R90-I94 HydrophobicContact CG-CG1 4.3Å; R90-I94 WeakPolarHBondContact O-CG1 3.35Å; R90-I94 PolarHBondContact O-N 2.9Å
91	R	90.8	Very high	88.6	Confident	136 Å²	136	49.6 Å²	49.6	51%	0.513	25%	0.254	S	S	.	.	H	α-helix	trans	-55.5	-45.8	-176.3	-75.6	177.7	-69.6	157.3	-5.8	111.2	A87 G88 W93 I94 E95	A87-R91 WeakPolarHBondContact O-CG 3.01Å; A87-R91 PolarHBondContact O-N 2.88Å; A87-R91 PolarHBondContact O-NE 3.3Å; G88-R91 PolarHBondContact O-N 3.31Å; R91-W93 VanDerWaalsContact C-N 3.31Å; R91-W93 PolarHBondContact O-N 3.43Å; R91-I94 PolarHBondContact O-N 3.37Å; R91-E95 WeakPolarHBondContact O-CB 3.21Å; R91-E95 WeakPolarHBondContact O-CG 3.35Å; R91-E95 PolarHBondContact O-N 2.66Å
92	N	91.6	Very high	87	Confident	77 Å²	77	58.1 Å²	58.1	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-69	-21.8	179.7	-174.7	-99.2	0	0	0	114	K9 G88 I89 R90 V96	K9-N92 WeakPolarHBondContact CE-OD1 3.42Å; K9-N92 PolarHBondContact NZ-O 3.24Å; K9-N92 PolarHBondContact NZ-OD1 2.61Å; G88-N92 WeakPolarHBondContact O-CB 3.38Å; G88-N92 PolarHBondContact O-N 2.86Å; I89-N92 PolarHBondContact O-N 2.86Å; R90-N92 VanDerWaalsContact C-N 3.28Å; R90-N92 PolarHBondContact O-N 2.78Å; N92-V96 VanDerWaalsContact O-CG2 3.26Å; N92-V96 WeakPolarHBondContact O-CG2 3.39Å
93	W	91.8	Very high	84.8	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.015	32%	0.322	C	S	.	.	H	α-helix	trans	-78.5	-46	167.6	-83.5	106.6	0	0	0	111.4	K9 M13 F27 L29 L34 F71 I89 R90 R91 E95 V96 L97	K9-W93 HydrophobicContact CB-CH2 4.32Å; K9-W93 HydrophobicContact CB-CZ3 4.33Å; K9-W93 HydrophobicContact CD-CD2 3.85Å; K9-W93 HydrophobicContact CD-CE3 3.74Å; K9-W93 HydrophobicContact CD-CH2 3.95Å; K9-W93 HydrophobicContact CD-CZ2 4.04Å; K9-W93 HydrophobicContact CD-CZ3 3.79Å; K9-W93 VanDerWaalsContact CE-CE2 3.45Å; K9-W93 HydrophobicContact CG-CE3 4.48Å; K9-W93 HydrophobicContact CG-CH2 3.82Å; K9-W93 HydrophobicContact CG-CZ2 4.06Å; K9-W93 HydrophobicContact CG-CZ3 4.05Å; K9-W93 VanDerWaalsContact NZ-CA 3.35Å; K9-W93 VanDerWaalsContact NZ-CD1 3.27Å; K9-W93 VanDerWaalsContact NZ-N 3.18Å; M13-W93 HydrophobicContact CE-CB 4.11Å; M13-W93 HydrophobicContact CE-CD2 4.06Å; M13-W93 HydrophobicContact CE-CG 3.6Å; M13-W93 HydrophobicContact CG-CZ2 4.46Å; M13-W93 HydrophobicContact SD-CD2 3.62Å; M13-W93 HydrophobicContact SD-CE3 4.26Å; M13-W93 HydrophobicContact SD-CG 3.84Å; M13-W93 HydrophobicContact SD-CZ2 3.9Å; M13-W93 PolarHBondContact SD-NE1 2.81Å; F27-W93 HydrophobicContact CB-CH2 4.03Å; F27-W93 HydrophobicContact CB-CZ2 4.29Å; L29-W93 HydrophobicContact CB-CZ3 4.39Å; L34-W93 HydrophobicContact CD1-CH2 4.39Å; L34-W93 HydrophobicContact CD1-CZ3 3.79Å; F71-W93 HydrophobicContact CE1-CB 4.43Å; F71-W93 HydrophobicContact CZ-CB 4.07Å; I89-W93 VanDerWaalsContact O-CD1 3.22Å; I89-W93 PolarHBondContact O-N 3.49Å; R90-W93 PolarHBondContact O-N 3.39Å; R91-W93 VanDerWaalsContact C-N 3.31Å; R91-W93 PolarHBondContact O-N 3.43Å; W93-E95 VanDerWaalsContact C-N 3.32Å; W93-E95 PolarHBondContact O-N 2.7Å; W93-V96 PolarHBondContact O-N 2.86Å; W93-L97 WeakPolarHBondContact O-CB 3.43Å; W93-L97 VanDerWaalsContact O-CG 3.26Å; W93-L97 WeakPolarHBondContact O-CG 3.21Å; W93-L97 PolarHBondContact O-N 3.42Å
94	I	90.8	Very high	82.1	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-42.9	178.5	-66.2	176.3	0	0	0	111.6	V60 E62 F71 R90 R91 K98	V60-I94 HydrophobicContact CG1-CB 4.33Å; V60-I94 HydrophobicContact CG1-CG1 4.04Å; V60-I94 HydrophobicContact CG1-CG2 4.09Å; E62-I94 HydrophobicContact CB-CD1 4.37Å; E62-I94 HydrophobicContact CG-CD1 3.26Å; F71-I94 HydrophobicContact CB-CD1 3.59Å; F71-I94 HydrophobicContact CB-CG1 3.99Å; F71-I94 HydrophobicContact CD1-CG1 4.39Å; F71-I94 HydrophobicContact CD2-CD1 4.4Å; F71-I94 HydrophobicContact CD2-CG1 3.83Å; F71-I94 HydrophobicContact CE2-CG1 4.41Å; F71-I94 HydrophobicContact CG-CD1 3.97Å; F71-I94 HydrophobicContact CG-CG1 3.82Å; R90-I94 HydrophobicContact CG-CD1 3.61Å; R90-I94 HydrophobicContact CG-CG1 4.3Å; R90-I94 WeakPolarHBondContact O-CG1 3.35Å; R90-I94 PolarHBondContact O-N 2.9Å; R91-I94 PolarHBondContact O-N 3.37Å; I94-K98 HydrophobicContact CG2-CD 3.78Å; I94-K98 VanDerWaalsContact CG2-CE 3.44Å; I94-K98 HydrophobicContact CG2-CG 4.38Å; I94-K98 VanDerWaalsContact O-CB 3.23Å; I94-K98 WeakPolarHBondContact O-CB 3.42Å; I94-K98 WeakPolarHBondContact O-CG 3.28Å; I94-K98 PolarHBondContact O-N 3.45Å
95	E	89.9	Confident	79.5	Confident	96 Å²	96	74.8 Å²	74.8	45%	0.449	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-46.3	176.6	-79.8	176.7	-139.3	0	0	113	R91 W93 K98 K99	R91-E95 WeakPolarHBondContact O-CB 3.21Å; R91-E95 WeakPolarHBondContact O-CG 3.35Å; R91-E95 PolarHBondContact O-N 2.66Å; W93-E95 VanDerWaalsContact C-N 3.32Å; W93-E95 PolarHBondContact O-N 2.7Å; E95-K98 PolarHBondContact O-N 3.26Å; E95-K99 WeakPolarHBondContact O-CD 3.34Å; E95-K99 VanDerWaalsContact O-CG 3.28Å; E95-K99 WeakPolarHBondContact O-CG 3.41Å; E95-K99 PolarHBondContact O-N 2.92Å; E95-K99 IonicContact OE2-NZ 3.24Å
96	V	89.1	Confident	76.8	Confident	26 Å²	26	73.1 Å²	73.1	16%	0.158	40%	0.399	C	S	.	.	H	α-helix	trans	-71.2	-43.4	-176.7	176.4	0	0	0	0	110	K9 L29 N92 W93 K98 K99 S100	K9-V96 HydrophobicContact CD-CB 4.37Å; K9-V96 HydrophobicContact CD-CG1 4.43Å; K9-V96 HydrophobicContact CD-CG2 4.27Å; L29-V96 HydrophobicContact CD2-CG1 3.3Å; N92-V96 VanDerWaalsContact O-CG2 3.26Å; N92-V96 WeakPolarHBondContact O-CG2 3.39Å; W93-V96 PolarHBondContact O-N 2.86Å; V96-K98 PolarHBondContact O-N 3.39Å; V96-K99 WeakPolarHBondContact O-CA 3.44Å; V96-K99 WeakPolarHBondContact O-CB 3.39Å; V96-K99 PolarHBondContact O-N 2.98Å; V96-S100 PolarHBondContact O-N 3.2Å; V96-S100 PolarHBondContact O-OG 2.98Å
97	L	88.8	Confident	74.5	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-60.7	-43.6	174	-64.2	168	0	0	0	111.5	L29 L34 L54 V60 F71 I73 W93 K99 S100 I101	L29-L97 HydrophobicContact CD1-CD2 4.14Å; L34-L97 HydrophobicContact CD2-CD2 4.07Å; L54-L97 HydrophobicContact CD1-CD2 3.78Å; L54-L97 HydrophobicContact CD2-CD2 4.01Å; V60-L97 HydrophobicContact CG2-CB 4.15Å; F71-L97 HydrophobicContact CE2-CD1 3.85Å; F71-L97 HydrophobicContact CZ-CD1 4.39Å; I73-L97 HydrophobicContact CD1-CD1 3.71Å; I73-L97 HydrophobicContact CG1-CD1 4.18Å; W93-L97 WeakPolarHBondContact O-CB 3.43Å; W93-L97 VanDerWaalsContact O-CG 3.26Å; W93-L97 WeakPolarHBondContact O-CG 3.21Å; W93-L97 PolarHBondContact O-N 3.42Å; L97-K99 PolarHBondContact O-N 3.47Å; L97-S100 PolarHBondContact O-N 3.06Å; L97-I101 VanDerWaalsContact O-CD1 3.24Å; L97-I101 WeakPolarHBondContact O-CD1 3.36Å; L97-I101 WeakPolarHBondContact O-CG1 3.48Å; L97-I101 PolarHBondContact O-N 3.44Å
98	K	87.5	Confident	71.8	Confident	95 Å²	95	80.3 Å²	80.3	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-21.2	173.5	-77.3	175.3	179.7	171.4	0	114.4	V60 I94 E95 V96	V60-K98 HydrophobicContact CB-CG 4.29Å; V60-K98 WeakPolarHBondContact O-CE 3.44Å; I94-K98 HydrophobicContact CG2-CD 3.78Å; I94-K98 VanDerWaalsContact CG2-CE 3.44Å; I94-K98 HydrophobicContact CG2-CG 4.38Å; I94-K98 VanDerWaalsContact O-CB 3.23Å; I94-K98 WeakPolarHBondContact O-CB 3.42Å; I94-K98 WeakPolarHBondContact O-CG 3.28Å; I94-K98 PolarHBondContact O-N 3.45Å; E95-K98 PolarHBondContact O-N 3.26Å; V96-K98 PolarHBondContact O-N 3.39Å
99	K	83.6	Confident	69.3	Low	134 Å²	134	86.8 Å²	86.8	58%	0.583	46%	0.463	S	S	*	.	H	α-helix	trans	-79.8	-48.7	171.1	-72	161.6	-176.5	168	0	110	E95 V96 L97 I101 R102	E95-K99 WeakPolarHBondContact O-CD 3.34Å; E95-K99 VanDerWaalsContact O-CG 3.28Å; E95-K99 WeakPolarHBondContact O-CG 3.41Å; E95-K99 PolarHBondContact O-N 2.92Å; E95-K99 IonicContact OE2-NZ 3.24Å; V96-K99 WeakPolarHBondContact O-CA 3.44Å; V96-K99 WeakPolarHBondContact O-CB 3.39Å; V96-K99 PolarHBondContact O-N 2.98Å; L97-K99 PolarHBondContact O-N 3.47Å; K99-I101 VanDerWaalsContact C-N 3.26Å; K99-I101 PolarHBondContact O-N 3.43Å; K99-R102 PolarHBondContact O-N 2.91Å; K99-R102 VanDerWaalsContact O-N 3.12Å
100	S	76.2	Confident	66.9	Low	50 Å²	50	88.6 Å²	88.6	35%	0.35	48%	0.478	S	S	.	.	H	α-helix	trans	-59.3	-29.8	177.8	-55.5	0	0	0	0	114.5	V96 L97 R102	V96-S100 PolarHBondContact O-N 3.2Å; V96-S100 PolarHBondContact O-OG 2.98Å; L97-S100 PolarHBondContact O-N 3.06Å; S100-R102 VanDerWaalsContact C-N 3.33Å
101	I	75.1	Confident	63.9	Low	47 Å²	47	96.1 Å²	96.1	24%	0.241	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-21.2	179	-67	158.5	0	0	0	112.7	C57 V60 L97 K99	C57-I101 HydrophobicContact CB-CD1 4.04Å; C57-I101 HydrophobicContact CB-CG1 3.96Å; C57-I101 WeakPolarHBondContact O-CG2 3.42Å; C57-I101 WeakPolarHBondContact SG-CD1 3.24Å; V60-I101 HydrophobicContact CG2-CD1 3.52Å; L97-I101 VanDerWaalsContact O-CD1 3.24Å; L97-I101 WeakPolarHBondContact O-CD1 3.36Å; L97-I101 WeakPolarHBondContact O-CG1 3.48Å; L97-I101 PolarHBondContact O-N 3.44Å; K99-I101 VanDerWaalsContact C-N 3.26Å; K99-I101 PolarHBondContact O-N 3.43Å
102	R	59.4	Low	61.1	Low	194 Å²	194	97.3 Å²	97.3	73%	0.732	53%	0.53	S	S	*	.	S	Bend	trans	-85.6	124.7	170.8	-82.5	-174.7	-112.9	-175.7	-6.5	109	K99 S100 S104	K99-R102 PolarHBondContact O-N 2.91Å; K99-R102 VanDerWaalsContact O-N 3.12Å; S100-R102 VanDerWaalsContact C-N 3.33Å; R102-S104 PolarHBondContact O-N 3.41Å
103	P	48.8	Very low	58.5	Low	121 Å²	121	99.5 Å²	99.5	79%	0.786	55%	0.548	S	S	*	.			trans	-54.7	129.1	170.8	-24.7	34.4	0	0	0	110.3	S105	P103-S105 PolarHBondContact O-N 2.84Å
104	S	37.6	Very low	55.5	Low	120 Å²	120	107.3 Å²	107.3	84%	0.839	59%	0.591	S	S	*	*			trans	-69.7	97.8	171.1	-171.1	0	0	0	0	108.7	R102 S106	R102-S104 PolarHBondContact O-N 3.41Å; S104-S106 VanDerWaalsContact C-N 3.32Å; S104-S106 PolarHBondContact O-N 3.21Å
105	S	37.9	Very low	52.6	Low	109 Å²	109	114.2 Å²	114.2	76%	0.762	63%	0.628	S	S	*	*			trans	-69.8	91.8	169.8	56.7	0	0	0	0	108.6	P103	P103-S105 PolarHBondContact O-N 2.84Å
106	S	32.2	Very low	49.7	Very low	99 Å²	99	116.5 Å²	116.5	69%	0.692	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-51.4	128.6	174.7	178	0	0	0	0	110.6	S104 D108	S104-S106 VanDerWaalsContact C-N 3.32Å; S104-S106 PolarHBondContact O-N 3.21Å; S106-D108 PolarHBondContact O-N 2.9Å
107	P	38.1	Very low	46.9	Very low	109 Å²	109	119.8 Å²	119.8	71%	0.708	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-71	119.9	164.2	29.9	-30.8	0	0	0	108.7
108	D	29.9	Very low	44.2	Very low	128 Å²	128	127 Å²	127	68%	0.684	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-75.4	124.5	175	-166.9	-29	0	0	0	109.8	S106 T110	S106-D108 PolarHBondContact O-N 2.9Å; D108-T110 VanDerWaalsContact C-N 3.26Å; D108-T110 PolarHBondContact O-N 3.11Å; D108-T110 VanDerWaalsContact O-N 3.1Å; D108-T110 PolarHBondContact OD1-OG1 2.78Å
109	L	33.6	Very low	41.6	Very low	169 Å²	169	130.8 Å²	130.8	89%	0.885	72%	0.722	S	S	*	*	S	Bend	trans	-87.4	49.9	-172.8	-73.7	172.1	0	0	0	112.4
110	T	39.7	Very low	38.9	Very low	108 Å²	108	131.3 Å²	131.3	66%	0.663	73%	0.727	S	S	*	*			trans	-136.2	24.5	-173.3	54.6	0	0	0	0	116.3	D108	D108-T110 VanDerWaalsContact C-N 3.26Å; D108-T110 PolarHBondContact O-N 3.11Å; D108-T110 VanDerWaalsContact O-N 3.1Å; D108-T110 PolarHBondContact OD1-OG1 2.78Å
111	Q	30.8	Very low	36.6	Very low	191 Å²	191	135.9 Å²	135.9	89%	0.893	75%	0.747	S	S	*	*			trans	-129.1	124.6	168.7	-65.1	-167.3	6.9	0	0	113.7
112	L	31.5	Very low	34.4	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	76%	0.764	S	S	*	*			trans	-85.2	150.9	168.9	-70.7	166.7	0	0	0	109.8	D114	L112-D114 PolarHBondContact O-N 2.67Å
113	P	36.1	Very low	33.1	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	77%	0.766	S	S	*	*			trans	-88.1	92.6	177.5	34.2	-32.6	0	0	0	111.7
114	D	29.1	Very low	32.2	Very low	169 Å²	169	139.2 Å²	139.2	90%	0.904	77%	0.766	S	S	*	*			trans	-78.2	144.6	159.9	-82.6	-42.6	0	0	0	110.3	L112	L112-D114 PolarHBondContact O-N 2.67Å
115	N	30.5	Very low	31.7	Very low	150 Å²	150	144.8 Å²	144.8	80%	0.802	77%	0.769	S	S	*	*			trans	-124.9	155	-165.6	-161	9.1	0	0	0	112.4
116	N	29.1	Very low	31.3	Very low	143 Å²	143	147.3 Å²	147.3	77%	0.765	77%	0.773	S	S	*	*			trans	79.9	133.1	173.2	-90.5	-3.4	0	0	0	122.1
117	S	30.1	Very low	32.2	Very low	95 Å²	95	147.8 Å²	147.8	66%	0.664	77%	0.773	S	S	*	*			trans	75.8	115.2	140.7	57.2	0	0	0	0	122.3
118	D	31	Very low	32.6	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	78%	0.777	S	S	*	*				84.4	94.5	125.2	-65.8	3.3	0	0	0	122.5
119	K	33	Very low	32.4	Very low	174 Å²	174	147.9 Å²	147.9	76%	0.757	78%	0.784	S	S	*	*				94.6	138.1	111	-145.4	-173.6	-171.9	-133.9	0	119.7
120	E	28.5	Very low	32	Very low	144 Å²	144	144.4 Å²	144.4	67%	0.673	77%	0.774	S	S	*	*			trans	73.6	109.6	154.2	-97	175	84.8	0	0	122.5
121	N	26	Very low	31.4	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	79%	0.785	S	S	*	*				91	149.7	127.7	-148.2	3.9	0	0	0	119.4
122	S	30.2	Very low	31.3	Very low	86 Å²	86	152.8 Å²	152.8	60%	0.601	79%	0.785	S	S	*	*			trans	-88.7	152.7	-178.4	-68.3	0	0	0	0	112.2
123	H	31.3	Very low	32.2	Very low	165 Å²	165	150.1 Å²	150.1	76%	0.764	78%	0.777	S	S	*	*				176.9	143.5	108.2	-83.7	-36.4	0	0	0	113.8
124	K	31.1	Very low	31.7	Very low	181 Å²	181	151.8 Å²	151.8	79%	0.787	78%	0.779	S	S	*	*			trans	17.6	128.2	147.2	-51.1	174.8	-176	176.8	0	116.8
125	R	27.1	Very low	31.6	Very low	236 Å²	236	147.9 Å²	147.9	89%	0.891	77%	0.765	S	S	*	*				-177.9	170.9	69.9	-165.7	173.7	-67.1	-137.3	3.9	111.5
126	L	29.1	Very low	31.6	Very low	162 Å²	162	151.1 Å²	151.1	85%	0.848	77%	0.766	S	S	*	*			trans	-77.2	160.6	-178.9	-75.3	162.7	0	0	0	115.1
127	P	51.1	Low	31.6	Very low	109 Å²	109	152.9 Å²	152.9	71%	0.708	77%	0.769	S	S	*	*			trans	-94.5	-178.6	-179.5	42.4	-38.7	0	0	0	112.8
128	P	45.3	Very low	31.6	Very low	121 Å²	121	151.4 Å²	151.4	79%	0.786	76%	0.763	S	S	*	*				-160.6	151.6	90.6	41.3	-20.5	0	0	0	120.2
129	S	26.4	Very low	31.4	Very low	118 Å²	118	151.6 Å²	151.6	83%	0.825	76%	0.764	S	S	*	*			trans	76.5	148.4	135.1	-158.2	0	0	0	0	125.1
130	S	26	Very low	31.3	Very low	96 Å²	96	147.9 Å²	147.9	67%	0.671	76%	0.76	S	S	*	*			trans	83.3	112.6	146.8	-158.5	0	0	0	0	121.3
131	R	26.7	Very low	31.3	Very low	239 Å²	239	149.6 Å²	149.6	90%	0.902	77%	0.768	S	S	*	*				-171.2	139.1	102.7	-93.1	156.7	-152.5	-102.9	3.3	114
132	R	27.5	Very low	31.5	Very low	236 Å²	236	147.6 Å²	147.6	89%	0.891	77%	0.765	S	S	*	*			trans	-106.9	177.8	155.6	-120.9	-174.8	-177.8	-178.1	1.7	106.7
133	P	50.8	Low	31.4	Very low	106 Å²	106	152.6 Å²	152.6	69%	0.688	78%	0.779	S	S	*	*			cis	-128.8	-162.8	-20.8	40.7	-23.9	0	0	0	111.2
134	L	26.1	Very low	31.4	Very low	158 Å²	158	151 Å²	151	83%	0.827	78%	0.781	S	S	*	*				162.5	148.6	110.8	-166.4	68.4	0	0	0	112.7
135	S	27.7	Very low	32.1	Very low	87 Å²	87	147.9 Å²	147.9	61%	0.608	78%	0.779	S	S	*	*			trans	72.7	138	154.3	159.2	0	0	0	0	117.8
136	R	28.8	Very low	32	Very low	218 Å²	218	141.9 Å²	141.9	82%	0.823	77%	0.774	S	S	*	*			cis	-156.1	162.6	2.6	-112.3	163.7	-157.1	-177.3	6.3	111.8
137	H	30	Very low	31.9	Very low	179 Å²	179	139.5 Å²	139.5	83%	0.829	77%	0.771	S	S	*	*			trans	-10.6	158.8	148.6	-68.7	-99.8	0	0	0	119.9
138	A	30	Very low	30.8	Very low	65 Å²	65	138.6 Å²	138.6	54%	0.537	77%	0.772	S	S	.	*			cis	-177.7	164.6	-15.3	0	0	0	0	0	109.6
139	D	27.8	Very low	30.1	Very low	157 Å²	157	141.9 Å²	141.9	84%	0.84	78%	0.777	S	S	*	*			trans	56.6	155.4	157.3	-49.4	-25.8	0	0	0	117.9
140	S	29.9	Very low	30.8	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	77%	0.773	S	S	*	*			cis	-155.6	177.9	-2.6	-138.3	0	0	0	0	107.5
141	Q	29	Very low	31.1	Very low	179 Å²	179	141 Å²	141	84%	0.836	77%	0.773	S	S	*	*			cis	-153	-163.5	4.9	-153.1	151.4	-28	0	0	108.9
142	S	30.6	Very low	31.3	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	77%	0.771	S	S	*	*			trans	-147.1	138.5	174.8	60.6	0	0	0	0	112.6
143	E	27.9	Very low	31.5	Very low	191 Å²	191	139 Å²	139	89%	0.893	77%	0.773	S	S	*	*			trans	-143	160.3	166.4	-73.8	-156.7	132.5	0	0	113.2
144	T	29.9	Very low	30.4	Very low	130 Å²	130	144 Å²	144	80%	0.798	78%	0.778	S	S	*	*			trans	-148.3	-175	175.3	63.6	0	0	0	0	106.7
145	P	46.3	Very low	30.5	Very low	116 Å²	116	146.1 Å²	146.1	75%	0.753	78%	0.781	S	S	*	*			cis	-134.5	-168.6	-5	42	-24.1	0	0	0	113.7
146	S	24.7	Very low	30.6	Very low	111 Å²	111	147.9 Å²	147.9	78%	0.776	78%	0.784	S	S	*	*				149.3	132.9	120.7	-164.4	0	0	0	0	116.9
147	S	27.4	Very low	30.5	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	79%	0.785	S	S	*	*			trans	52.7	116.9	147.4	-162.4	0	0	0	0	123.1
148	A	27.1	Very low	30.6	Very low	90 Å²	90	145.4 Å²	145.4	74%	0.744	78%	0.783	S	S	*	*				178.3	147.4	107.8	0	0	0	0	0	114.6
149	H	30.8	Very low	30.7	Very low	190 Å²	190	149.5 Å²	149.5	88%	0.88	79%	0.791	S	S	*	*			trans	-132.4	172.2	165.7	-82.4	-63	0	0	0	107
150	P	42.5	Very low	30.9	Very low	115 Å²	115	150.1 Å²	150.1	75%	0.747	79%	0.793	S	S	*	*			cis	-147.5	-165.1	23.9	44.6	-23.4	0	0	0	117.1
151	A	30.7	Very low	30.9	Very low	80 Å²	80	150.8 Å²	150.8	66%	0.661	80%	0.798	S	S	*	*			trans	65.9	107.3	148.1	0	0	0	0	0	119.2
152	E	31.9	Very low	32.2	Very low	186 Å²	186	147.7 Å²	147.7	87%	0.869	79%	0.793	S	S	*	*				88.6	129.3	79.7	-84.8	-166.6	165.5	0	0	115
153	R	31.5	Very low	32.2	Very low	247 Å²	247	149.4 Å²	149.4	93%	0.932	80%	0.799	S	S	*	*				-165.9	147.2	125.5	-107.6	165.5	-163.6	-176.2	4.8	113.6
154	R	28.1	Very low	32.7	Very low	212 Å²	212	145.9 Å²	145.9	80%	0.8	79%	0.793	S	S	*	*			trans	-96.8	162	174.4	-170.8	-176.7	-168.4	135.8	-0.6	108.8	D156	R154-D156 IonicContact NE-OD1 3.79Å
155	F	27.4	Very low	32.5	Very low	201 Å²	201	143.9 Å²	143.9	88%	0.882	79%	0.789	S	S	*	*			trans	-137	137.7	166.8	-115.9	-88.9	0	0	0	110
156	D	29.6	Very low	31.6	Very low	125 Å²	125	143.9 Å²	143.9	67%	0.668	79%	0.792	S	S	*	*			trans	-107.7	160.2	-172.4	-56.7	-61.9	0	0	0	111.6	R154	R154-D156 IonicContact NE-OD1 3.79Å
157	Y	27.9	Very low	31.7	Very low	217 Å²	217	143.7 Å²	143.7	85%	0.851	79%	0.79	S	S	*	*			trans	-111.7	141.1	178.7	-177.2	-91	0	0	0	109.8
158	V	30.8	Very low	31.8	Very low	128 Å²	128	144.3 Å²	144.3	78%	0.776	80%	0.795	S	S	*	*			trans	-126.4	133.4	179.5	177.9	0	0	0	0	110.3
159	E	33.8	Very low	32	Very low	151 Å²	151	144.4 Å²	144.4	71%	0.706	80%	0.796	S	S	*	*			trans	-103.3	142.3	-177.1	173.6	-172.3	177.4	0	0	110.5
160	L	31.2	Very low	32.8	Very low	170 Å²	170	140.5 Å²	140.5	89%	0.89	79%	0.787	S	S	*	*			trans	-145.8	151	163.7	-76.3	-178	0	0	0	111.4
161	S	30.1	Very low	32.2	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	79%	0.791	S	S	*	*			trans	-119.2	165.8	-173.7	-91.8	0	0	0	0	113.6
162	P	56.5	Low	33.1	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	79%	0.793	S	S	*	*			trans	-105.6	170	-164.6	40.8	-36.8	0	0	0	115.4
163	V	29.6	Very low	32.7	Very low	142 Å²	142	140.9 Å²	140.9	86%	0.861	79%	0.792	S	S	*	*			trans	166.4	150.7	158.5	135.3	0	0	0	0	111
164	P	39.2	Very low	32.5	Very low	117 Å²	117	133.9 Å²	133.9	76%	0.76	78%	0.782	S	S	*	*			cis	-136.5	-167.1	-30.9	44.3	-25.6	0	0	0	115
165	A	26.6	Very low	32.6	Very low	88 Å²	88	133 Å²	133	73%	0.727	79%	0.786	S	S	*	*			trans	-54.4	161.7	-177.1	0	0	0	0	0	121.4
166	S	27.1	Very low	33.1	Very low	115 Å²	115	134.4 Å²	134.4	80%	0.804	79%	0.786	S	S	*	*				-173.2	136.1	115.5	-79	0	0	0	0	117.2
167	S	27.2	Very low	33.4	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	80%	0.798	S	S	*	*			trans	3.3	132.7	159.4	58.9	0	0	0	0	124.2
168	S	28.9	Very low	33.9	Very low	125 Å²	125	132 Å²	132	87%	0.874	80%	0.795	S	S	*	*				173.6	173.9	104.9	52	0	0	0	0	112.9
169	A	30.7	Very low	34.1	Very low	93 Å²	93	129.6 Å²	129.6	77%	0.769	80%	0.795	S	S	*	*			trans	-163.7	174.4	-170.1	0	0	0	0	0	110.8
170	P	47.2	Very low	34.4	Very low	108 Å²	108	131.9 Å²	131.9	70%	0.701	81%	0.806	S	S	*	*			cis	-137.4	-171.2	-24.6	36.9	-17.1	0	0	0	114.7
171	L	30.9	Very low	34.9	Very low	159 Å²	159	127.5 Å²	127.5	83%	0.832	80%	0.803	S	S	*	*			trans	75.6	164.6	160.3	-58.9	170.7	0	0	0	117.8
172	P	48.1	Very low	35.4	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	81%	0.809	S	S	*	*				-139.6	162.6	-64.2	40.2	-24.3	0	0	0	115
173	S	25.2	Very low	34.7	Very low	122 Å²	122	129.1 Å²	129.1	85%	0.853	81%	0.805	S	S	*	*				158.1	139.5	123.7	57	0	0	0	0	116.5
174	S	27.5	Very low	35.7	Very low	101 Å²	101	132.7 Å²	132.7	71%	0.706	80%	0.803	S	S	*	*			trans	4	122.4	156.2	-164.9	0	0	0	0	121.4
175	Q	29.9	Very low	35.7	Very low	192 Å²	192	135.4 Å²	135.4	90%	0.897	81%	0.806	S	S	*	*				-156.7	173.2	99.6	-108.7	177.3	74.6	0	0	112.7
176	R	37.1	Very low	36.1	Very low	231 Å²	231	138.1 Å²	138.1	87%	0.872	80%	0.803	S	S	*	*			trans	-104.4	151.9	-169	-54.6	171.9	174.6	-173.5	-3.8	111.4
177	E	35.8	Very low	36.8	Very low	197 Å²	197	135.8 Å²	135.8	92%	0.921	79%	0.787	S	S	*	*				-159.8	-180	113.3	-120.9	-176.7	156	0	0	113.7
178	A	38.7	Very low	37.4	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	78%	0.782	S	S	*	*			trans	-80.5	163.3	-155.3	0	0	0	0	0	116.5
179	G	34.2	Very low	37.8	Very low	77 Å²	77	140.8 Å²	140.8	79%	0.794	78%	0.776	S	S	*	*			trans	-173.3	53.9	178	0	0	0	0	0	112.4
180	E	40.6	Very low	38	Very low	199 Å²	199	142.6 Å²	142.6	93%	0.93	77%	0.769	S	S	*	*			trans	-74.1	128.1	-177.3	-60.6	-176.1	126.9	0	0	111.8
181	G	42.6	Very low	37.9	Very low	79 Å²	79	144 Å²	144	81%	0.814	77%	0.766	S	S	*	*			trans	179.2	17.2	-178.9	0	0	0	0	0	118.9
182	Q	40.9	Very low	38.2	Very low	194 Å²	194	142.5 Å²	142.5	91%	0.907	76%	0.755	S	S	*	*			trans	-140.9	17.9	-171.6	-123.5	171.2	-12.1	0	0	115.5
183	G	41.8	Very low	38	Very low	64 Å²	64	146.7 Å²	146.7	66%	0.66	76%	0.757	S	S	*	*			trans	-105.6	29.6	-164.8	0	0	0	0	0	118
184	R	49.8	Very low	38.6	Very low	217 Å²	217	144.4 Å²	144.4	82%	0.819	74%	0.741	S	S	*	*	S	Bend	trans	-126.8	-18.5	179.9	-73.9	-168.7	-179.4	-103.3	1	117.3
185	E	38.9	Very low	39.4	Very low	173 Å²	173	142.7 Å²	142.7	81%	0.808	73%	0.726	S	S	*	*	S	Bend	trans	-84.8	-23.8	176.5	-63.3	-176.5	140.2	0	0	112.9
186	H	36.1	Very low	40	Very low	145 Å²	145	136.8 Å²	136.8	67%	0.671	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-19.3	-176	-155.9	-62.1	0	0	0	113.7
187	S	40.5	Very low	40.4	Very low	67 Å²	67	128.6 Å²	128.6	47%	0.469	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	-38.2	-177.9	-53.3	0	0	0	0	112.8	W189 Q190 E191	S187-W189 PolarHBondContact O-N 3.34Å; S187-Q190 WeakPolarHBondContact O-CA 3.09Å; S187-Q190 WeakPolarHBondContact O-CB 3.32Å; S187-Q190 PolarHBondContact O-N 3.19Å; S187-E191 PolarHBondContact O-N 2.73Å; S187-E191 VanDerWaalsContact O-N 3.12Å
188	Q	40.5	Very low	40.8	Very low	137 Å²	137	125 Å²	125	64%	0.64	67%	0.667	S	S	*	*	H	α-helix	trans	-63.2	-42.7	-174.2	-166.8	168.4	20.2	0	0	112	Q190 E191 E192	Q188-Q190 PolarHBondContact O-N 3.1Å; Q188-E191 PolarHBondContact O-N 3.23Å; Q188-E192 PolarHBondContact O-N 2.78Å
189	W	36.2	Very low	40.8	Very low	199 Å²	199	129.2 Å²	129.2	75%	0.754	66%	0.663	S	S	*	*	H	α-helix	trans	-65.7	-22.1	173.5	-73.8	95.1	0	0	0	114.1	S187	S187-W189 PolarHBondContact O-N 3.34Å
190	Q	36.5	Very low	41.2	Very low	132 Å²	132	131.3 Å²	131.3	62%	0.617	65%	0.652	S	S	*	*	H	α-helix	trans	-84.2	-29.9	178.4	-165.7	169.3	-1.5	0	0	111.6	S187 Q188 R193 S194	S187-Q190 WeakPolarHBondContact O-CA 3.09Å; S187-Q190 WeakPolarHBondContact O-CB 3.32Å; S187-Q190 PolarHBondContact O-N 3.19Å; Q188-Q190 PolarHBondContact O-N 3.1Å; Q190-R193 PolarHBondContact O-N 2.89Å; Q190-S194 VanDerWaalsContact O-CB 3.3Å; Q190-S194 WeakPolarHBondContact O-CB 3.27Å; Q190-S194 PolarHBondContact O-N 3.08Å
191	E	43.5	Very low	41.6	Very low	138 Å²	138	124.6 Å²	124.6	65%	0.645	63%	0.631	S	S	*	*	H	α-helix	trans	-74.1	-41.7	179.7	-166.3	165.9	-157.2	0	0	112.6	S187 Q188 R193 S194 T195	S187-E191 PolarHBondContact O-N 2.73Å; S187-E191 VanDerWaalsContact O-N 3.12Å; Q188-E191 PolarHBondContact O-N 3.23Å; E191-R193 VanDerWaalsContact C-N 3.29Å; E191-R193 PolarHBondContact O-N 3.32Å; E191-S194 PolarHBondContact O-N 3.2Å; E191-T195 PolarHBondContact O-N 3.03Å; E191-T195 PolarHBondContact O-OG1 2.9Å
192	E	38.3	Very low	41.9	Very low	127 Å²	127	125.3 Å²	125.3	59%	0.593	62%	0.619	S	S	*	*	H	α-helix	trans	-61.5	-37	170.9	-67.2	-172.6	162.2	0	0	112	Q188 T195 S196	Q188-E192 PolarHBondContact O-N 2.78Å; E192-T195 PolarHBondContact O-OG1 3.37Å; E192-T195 VanDerWaalsContact O-OG1 3.04Å; E192-S196 PolarHBondContact O-N 3.39Å
193	R	43	Very low	42.2	Very low	194 Å²	194	123 Å²	123	73%	0.732	61%	0.612	S	S	*	*	H	α-helix	trans	-73	-38.3	176	-157.5	175.6	-167.9	-172.9	4.3	112.1	Q190 E191 S196 S197	Q190-R193 PolarHBondContact O-N 2.89Å; E191-R193 VanDerWaalsContact C-N 3.29Å; E191-R193 PolarHBondContact O-N 3.32Å; R193-S196 PolarHBondContact O-N 3.48Å; R193-S197 PolarHBondContact O-N 3.24Å; R193-S197 PolarHBondContact O-OG 3.46Å
194	S	38.5	Very low	42.4	Very low	75 Å²	75	124.5 Å²	124.5	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-63.6	-44.4	177.6	-167.2	0	0	0	0	111.7	Q190 E191 S197 Q198	Q190-S194 VanDerWaalsContact O-CB 3.3Å; Q190-S194 WeakPolarHBondContact O-CB 3.27Å; Q190-S194 PolarHBondContact O-N 3.08Å; E191-S194 PolarHBondContact O-N 3.2Å; S194-S197 PolarHBondContact O-N 3.06Å; S194-Q198 WeakPolarHBondContact O-CB 3.31Å; S194-Q198 PolarHBondContact O-N 3.3Å
195	T	43.4	Very low	42.2	Very low	65 Å²	65	125.2 Å²	125.2	40%	0.399	62%	0.615	S	S	.	*	H	α-helix	trans	-65	-38.5	175.7	46.1	0	0	0	0	112.2	E191 E192 Q198 W199	E191-T195 PolarHBondContact O-N 3.03Å; E191-T195 PolarHBondContact O-OG1 2.9Å; E192-T195 PolarHBondContact O-OG1 3.37Å; E192-T195 VanDerWaalsContact O-OG1 3.04Å; T195-Q198 WeakPolarHBondContact O-CB 3.37Å; T195-Q198 PolarHBondContact O-N 2.94Å; T195-W199 PolarHBondContact O-N 2.94Å
196	S	43.9	Very low	42.4	Very low	68 Å²	68	126.8 Å²	126.8	48%	0.476	62%	0.619	S	S	.	*	H	α-helix	trans	-59.4	-49.7	171	-170.5	0	0	0	0	112.2	E192 R193 Q198 W199 E200	E192-S196 PolarHBondContact O-N 3.39Å; R193-S196 PolarHBondContact O-N 3.48Å; S196-Q198 VanDerWaalsContact C-N 3.27Å; S196-Q198 PolarHBondContact O-N 2.93Å; S196-W199 PolarHBondContact O-N 2.88Å; S196-E200 PolarHBondContact O-N 3.01Å
197	S	45.8	Very low	42.3	Very low	58 Å²	58	123.1 Å²	123.1	41%	0.406	62%	0.62	S	S	.	*	H	α-helix	trans	-68.7	-22.7	178.6	-67.3	0	0	0	0	113.6	R193 S194 E200 A201	R193-S197 PolarHBondContact O-N 3.24Å; R193-S197 PolarHBondContact O-OG 3.46Å; S194-S197 PolarHBondContact O-N 3.06Å; S197-E200 PolarHBondContact O-N 2.89Å; S197-A201 VanDerWaalsContact O-CB 3.29Å; S197-A201 WeakPolarHBondContact O-CB 3.38Å; S197-A201 PolarHBondContact O-N 3.33Å
198	Q	43.1	Very low	42.4	Very low	121 Å²	121	126.8 Å²	126.8	57%	0.565	65%	0.646	S	S	*	*	H	α-helix	trans	-64.8	-41.1	171.8	-173.1	176.7	-1	0	0	111.4	S194 T195 S196 A201 V202	S194-Q198 WeakPolarHBondContact O-CB 3.31Å; S194-Q198 PolarHBondContact O-N 3.3Å; T195-Q198 WeakPolarHBondContact O-CB 3.37Å; T195-Q198 PolarHBondContact O-N 2.94Å; S196-Q198 VanDerWaalsContact C-N 3.27Å; S196-Q198 PolarHBondContact O-N 2.93Å; Q198-A201 PolarHBondContact O-N 3.09Å; Q198-V202 WeakPolarHBondContact O-CG2 3.24Å; Q198-V202 PolarHBondContact O-N 3.3Å
199	W	38.1	Very low	42.2	Very low	185 Å²	185	122.9 Å²	122.9	70%	0.701	64%	0.643	S	S	*	*	H	α-helix	trans	-68.3	-39.3	174.7	-66	110.7	0	0	0	112.3	T195 S196 A201 V202 L203	T195-W199 PolarHBondContact O-N 2.94Å; S196-W199 PolarHBondContact O-N 2.88Å; W199-A201 PolarHBondContact O-N 3.47Å; W199-V202 PolarHBondContact O-N 3.44Å; W199-L203 WeakPolarHBondContact O-CG 3.45Å; W199-L203 PolarHBondContact O-N 3.33Å; W199-L203 VanDerWaalsContact O-N 3.12Å
200	E	43	Very low	42.3	Very low	120 Å²	120	119.9 Å²	119.9	56%	0.561	65%	0.646	S	S	*	*	H	α-helix	trans	-62.7	-40.3	172.6	-66.7	-173.4	124	0	0	112.5	S196 S197 L203 S204	S196-E200 PolarHBondContact O-N 3.01Å; S197-E200 PolarHBondContact O-N 2.89Å; E200-L203 PolarHBondContact O-N 2.87Å; E200-S204 WeakPolarHBondContact O-CB 3.38Å; E200-S204 PolarHBondContact O-N 3.25Å; E200-S204 PolarHBondContact O-OG 2.91Å
201	A	48.4	Very low	42.4	Very low	59 Å²	59	116.6 Å²	116.6	49%	0.488	65%	0.648	S	S	.	*	H	α-helix	trans	-65.9	-37.2	177.3	0	0	0	0	0	112.4	S197 Q198 W199 S204 R205	S197-A201 VanDerWaalsContact O-CB 3.29Å; S197-A201 WeakPolarHBondContact O-CB 3.38Å; S197-A201 PolarHBondContact O-N 3.33Å; Q198-A201 PolarHBondContact O-N 3.09Å; W199-A201 PolarHBondContact O-N 3.47Å; A201-S204 PolarHBondContact O-N 2.83Å; A201-R205 PolarHBondContact O-N 3Å
202	V	49.4	Very low	42.7	Very low	94 Å²	94	115.1 Å²	115.1	57%	0.57	65%	0.653	S	S	*	*	H	α-helix	trans	-63.6	-45.1	173.7	168	0	0	0	0	111.1	Q198 W199 S204 R205	Q198-V202 WeakPolarHBondContact O-CG2 3.24Å; Q198-V202 PolarHBondContact O-N 3.3Å; W199-V202 PolarHBondContact O-N 3.44Å; V202-S204 VanDerWaalsContact C-N 3.27Å; V202-S204 PolarHBondContact O-N 3.39Å; V202-R205 PolarHBondContact O-N 3.42Å
203	L	47.9	Very low	42.8	Very low	145 Å²	145	115.5 Å²	115.5	76%	0.759	66%	0.659	S	S	*	*	H	α-helix	trans	-64	-32.2	175.9	-68.4	172	0	0	0	112.5	W199 E200	W199-L203 WeakPolarHBondContact O-CG 3.45Å; W199-L203 PolarHBondContact O-N 3.33Å; W199-L203 VanDerWaalsContact O-N 3.12Å; E200-L203 PolarHBondContact O-N 2.87Å
204	S	45.3	Very low	42.9	Very low	95 Å²	95	111.9 Å²	111.9	66%	0.664	65%	0.65	S	S	*	*	H	α-helix	trans	-77.2	-16.8	179.9	-58.4	0	0	0	0	114.3	E200 A201 V202 K206	E200-S204 WeakPolarHBondContact O-CB 3.38Å; E200-S204 PolarHBondContact O-N 3.25Å; E200-S204 PolarHBondContact O-OG 2.91Å; A201-S204 PolarHBondContact O-N 2.83Å; V202-S204 VanDerWaalsContact C-N 3.27Å; V202-S204 PolarHBondContact O-N 3.39Å; S204-K206 VanDerWaalsContact C-N 3.33Å; S204-K206 PolarHBondContact O-N 2.89Å
205	R	46.1	Very low	43.5	Very low	232 Å²	232	116.2 Å²	116.2	88%	0.875	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	9.8	-167.8	-147.6	174.6	-175.1	-116.2	-0.2	115.7	A201 V202	A201-R205 PolarHBondContact O-N 3Å; V202-R205 PolarHBondContact O-N 3.42Å
206	K	43.9	Very low	44	Very low	207 Å²	207	116.1 Å²	116.1	90%	0.9	66%	0.66	S	S	*	*	S	Bend	trans	-125.5	63.8	177.9	-161.1	173.5	-179.4	178.4	0	113	S204	S204-K206 VanDerWaalsContact C-N 3.33Å; S204-K206 PolarHBondContact O-N 2.89Å
207	G	33.3	Very low	44.8	Very low	67 Å²	67	117.5 Å²	117.5	69%	0.691	66%	0.659	S	S	*	*			trans	-175.3	67.3	177.4	0	0	0	0	0	113.7	G209	G207-G209 PolarHBondContact O-N 2.91Å; G207-G209 VanDerWaalsContact O-N 3.07Å
208	S	42	Very low	45.7	Very low	145 Å²	145	119.5 Å²	119.5	100%	1.014	66%	0.664	S	S	*	*			trans	-80.6	83.8	174.8	-168.3	0	0	0	0	110.6
209	G	36.6	Very low	46.7	Very low	55 Å²	55	118.3 Å²	118.3	57%	0.567	66%	0.662	S	S	*	*	S	Bend	trans	173.9	99.7	179	0	0	0	0	0	114.8	G207	G207-G209 PolarHBondContact O-N 2.91Å; G207-G209 VanDerWaalsContact O-N 3.07Å
210	V	39.2	Very low	48.3	Very low	135 Å²	135	114.3 Å²	114.3	82%	0.818	65%	0.654	S	S	*	*			trans	52.8	102.3	157.9	-170	0	0	0	0	118.1	Q214	V210-Q214 PolarHBondContact O-NE2 3.28Å
211	G	37.5	Very low	49.7	Very low	64 Å²	64	112 Å²	112	66%	0.66	64%	0.643	S	S	*	*				64.7	97.1	124.6	0	0	0	0	0	120.3
212	S	49.9	Very low	50.6	Low	106 Å²	106	113.3 Å²	113.3	74%	0.741	64%	0.641	S	S	*	*	S	Bend	trans	62.1	146.8	145.9	-150.2	0	0	0	0	120.8	Q214	S212-Q214 VanDerWaalsContact C-N 3.29Å; S212-Q214 PolarHBondContact O-N 2.88Å
213	N	40	Very low	51.9	Low	136 Å²	136	114.8 Å²	114.8	73%	0.727	64%	0.642	S	S	*	*			trans	57.8	4.7	161.7	-113.6	32.1	0	0	0	121	K215 P216	N213-K215 VanDerWaalsContact C-N 3.3Å; N213-K215 PolarHBondContact O-N 3.01Å; N213-P216 WeakPolarHBondContact O-CD 3.39Å; N213-P216 WeakPolarHBondContact O-CG 3.35Å
214	Q	45.9	Very low	53.4	Low	118 Å²	118	112.8 Å²	112.8	55%	0.551	62%	0.624	S	S	*	*	H	α-helix	trans	-69.8	-17.7	-178.2	-66	-179.5	41.4	0	0	115.4	V210 S212 H217 L218	V210-Q214 PolarHBondContact O-NE2 3.28Å; S212-Q214 VanDerWaalsContact C-N 3.29Å; S212-Q214 PolarHBondContact O-N 2.88Å; Q214-H217 PolarHBondContact O-N 2.98Å; Q214-L218 PolarHBondContact O-N 3.1Å; Q214-L218 VanDerWaalsContact O-N 3.09Å
215	K	50.1	Low	54.6	Low	166 Å²	166	113.3 Å²	113.3	72%	0.722	62%	0.615	S	S	*	*	H	α-helix	trans	-64.3	-54.5	-175.5	-159.7	175.5	-176.1	-177.7	0	113.7	N213 H217 L218 D219	N213-K215 VanDerWaalsContact C-N 3.3Å; N213-K215 PolarHBondContact O-N 3.01Å; K215-H217 VanDerWaalsContact C-N 3.28Å; K215-H217 PolarHBondContact O-N 2.94Å; K215-L218 PolarHBondContact O-N 2.91Å; K215-D219 PolarHBondContact O-N 2.94Å
216	P	55	Low	55.4	Low	62 Å²	62	109.3 Å²	109.3	40%	0.403	60%	0.6	S	S	.	*	H	α-helix	trans	-60.7	-36.2	172.9	24.2	-34.8	0	0	0	112.4	N213 L218 D219 D220	N213-P216 WeakPolarHBondContact O-CD 3.39Å; N213-P216 WeakPolarHBondContact O-CG 3.35Å; P216-L218 VanDerWaalsContact C-N 3.29Å; P216-L218 PolarHBondContact O-N 2.88Å; P216-D219 PolarHBondContact O-N 2.84Å; P216-D219 VanDerWaalsContact O-N 3.15Å; P216-D220 WeakPolarHBondContact O-CB 3.45Å; P216-D220 VanDerWaalsContact O-CG 3.24Å; P216-D220 PolarHBondContact O-N 3.36Å
217	H	60.9	Low	56.6	Low	98 Å²	98	101.3 Å²	101.3	45%	0.454	57%	0.57	S	S	.	*	H	α-helix	trans	-60.6	-36.3	178.7	-173.2	-73.9	0	0	0	113	Q214 K215 E221	Q214-H217 PolarHBondContact O-N 2.98Å; K215-H217 VanDerWaalsContact C-N 3.28Å; K215-H217 PolarHBondContact O-N 2.94Å; H217-E221 IonicContact CE1-OE1 2.62Å; H217-E221 IonicContact CE1-OE2 3.42Å; H217-E221 PolarHBondContact CE1-OE2 3.03Å; H217-E221 VanDerWaalsContact CE1-OE2 3.29Å; H217-E221 IonicContact ND1-OE2 3.72Å; H217-E221 WeakPolarHBondContact O-CB 3.23Å; H217-E221 PolarHBondContact O-N 2.83Å
218	L	63.3	Low	58.3	Low	100 Å²	100	102.7 Å²	102.7	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-68.8	-42	176.1	-76.3	165.5	0	0	0	111.6	Q214 K215 P216 E221 I222	Q214-L218 PolarHBondContact O-N 3.1Å; Q214-L218 VanDerWaalsContact O-N 3.09Å; K215-L218 PolarHBondContact O-N 2.91Å; P216-L218 VanDerWaalsContact C-N 3.29Å; P216-L218 PolarHBondContact O-N 2.88Å; L218-E221 PolarHBondContact O-N 3.23Å; L218-I222 WeakPolarHBondContact O-CB 3.32Å; L218-I222 WeakPolarHBondContact O-CD1 3.37Å; L218-I222 VanDerWaalsContact O-CG1 3.23Å; L218-I222 WeakPolarHBondContact O-CG1 3.39Å; L218-I222 PolarHBondContact O-N 3.09Å
219	D	65.4	Low	59.1	Low	96 Å²	96	101.2 Å²	101.2	51%	0.513	54%	0.538	S	S	.	.	H	α-helix	trans	-66	-45.3	175.4	-64.3	-32.6	0	0	0	110.6	K215 P216 E221 I222 E223	K215-D219 PolarHBondContact O-N 2.94Å; P216-D219 PolarHBondContact O-N 2.84Å; P216-D219 VanDerWaalsContact O-N 3.15Å; D219-E221 VanDerWaalsContact C-N 3.26Å; D219-E221 PolarHBondContact O-N 3.48Å; D219-I222 PolarHBondContact O-N 2.83Å; D219-E223 WeakPolarHBondContact O-CB 3.46Å; D219-E223 PolarHBondContact O-N 2.86Å
220	D	71.3	Confident	60.2	Low	100 Å²	100	105.1 Å²	105.1	54%	0.535	54%	0.542	S	S	.	.	H	α-helix	trans	-59.9	-31.3	173.7	-71.6	-36.1	0	0	0	113.1	P216 R224	P216-D220 WeakPolarHBondContact O-CB 3.45Å; P216-D220 VanDerWaalsContact O-CG 3.24Å; P216-D220 PolarHBondContact O-N 3.36Å; D220-R224 WeakPolarHBondContact O-CB 3.36Å; D220-R224 PolarHBondContact O-N 3.43Å; D220-R224 VanDerWaalsContact O-N 3.1Å
221	E	72	Confident	61.3	Low	72 Å²	72	107.8 Å²	107.8	34%	0.336	54%	0.537	S	S	.	.	H	α-helix	trans	-82.5	-32.2	178.4	-170.6	143.4	-110.5	0	0	111.9	H217 L218 D219 R224 K225	H217-E221 IonicContact CE1-OE1 2.62Å; H217-E221 IonicContact CE1-OE2 3.42Å; H217-E221 PolarHBondContact CE1-OE2 3.03Å; H217-E221 VanDerWaalsContact CE1-OE2 3.29Å; H217-E221 IonicContact ND1-OE2 3.72Å; H217-E221 WeakPolarHBondContact O-CB 3.23Å; H217-E221 PolarHBondContact O-N 2.83Å; L218-E221 PolarHBondContact O-N 3.23Å; D219-E221 VanDerWaalsContact C-N 3.26Å; D219-E221 PolarHBondContact O-N 3.48Å; E221-R224 IonicContact OE1-CZ 3.65Å; E221-R224 IonicContact OE1-NH1 3.67Å; E221-R224 PolarHBondContact OE1-NH1 2.93Å; E221-R224 IonicContact OE1-NH2 2.7Å; E221-K225 WeakPolarHBondContact O-CB 3.5Å; E221-K225 VanDerWaalsContact O-CG 3.25Å; E221-K225 WeakPolarHBondContact O-CG 3.43Å; E221-K225 PolarHBondContact O-N 3.32Å
222	I	67.9	Low	61.6	Low	87 Å²	87	111 Å²	111	45%	0.446	54%	0.537	S	S	.	.	H	α-helix	trans	-66.1	-50.1	168.4	-72	164.1	0	0	0	110.1	L218 D219 R224 K225 W226	L218-I222 WeakPolarHBondContact O-CB 3.32Å; L218-I222 WeakPolarHBondContact O-CD1 3.37Å; L218-I222 VanDerWaalsContact O-CG1 3.23Å; L218-I222 WeakPolarHBondContact O-CG1 3.39Å; L218-I222 PolarHBondContact O-N 3.09Å; D219-I222 PolarHBondContact O-N 2.83Å; I222-R224 VanDerWaalsContact C-N 3.26Å; I222-R224 PolarHBondContact O-N 3.48Å; I222-K225 PolarHBondContact O-N 2.77Å; I222-W226 PolarHBondContact O-N 3.23Å
223	E	77.3	Confident	61.2	Low	124 Å²	124	111.6 Å²	111.6	58%	0.579	54%	0.538	S	S	*	.	H	α-helix	trans	-59.4	-38.1	178	-155.6	71.9	-152.8	0	0	111.3	D219 S227	D219-E223 WeakPolarHBondContact O-CB 3.46Å; D219-E223 PolarHBondContact O-N 2.86Å; E223-S227 VanDerWaalsContact O-CB 3.24Å; E223-S227 WeakPolarHBondContact O-CB 3.44Å; E223-S227 PolarHBondContact O-N 3.3Å; E223-S227 PolarHBondContact O-OG 2.77Å
224	R	78.3	Confident	61.3	Low	104 Å²	104	112.4 Å²	112.4	39%	0.392	54%	0.542	S	S	.	.	H	α-helix	trans	-66.6	-38.7	173	-167	-168.4	-39.5	146.4	13.3	112.5	D220 E221 I222 S227 E228	D220-R224 WeakPolarHBondContact O-CB 3.36Å; D220-R224 PolarHBondContact O-N 3.43Å; D220-R224 VanDerWaalsContact O-N 3.1Å; E221-R224 IonicContact OE1-CZ 3.65Å; E221-R224 IonicContact OE1-NH1 3.67Å; E221-R224 PolarHBondContact OE1-NH1 2.93Å; E221-R224 IonicContact OE1-NH2 2.7Å; I222-R224 VanDerWaalsContact C-N 3.26Å; I222-R224 PolarHBondContact O-N 3.48Å; R224-S227 CarbonylContact O-C 3.57Å; R224-S227 WeakPolarHBondContact O-CB 3.41Å; R224-S227 PolarHBondContact O-N 3.13Å; R224-E228 WeakPolarHBondContact O-CG 3.47Å; R224-E228 PolarHBondContact O-N 2.92Å
225	K	71.1	Confident	61.2	Low	106 Å²	106	115.5 Å²	115.5	46%	0.461	55%	0.553	S	S	.	*	H	α-helix	trans	-71.4	-35.6	175.9	-73.8	-72	159.1	-147.1	0	112.7	E221 I222 E228 L229	E221-K225 WeakPolarHBondContact O-CB 3.5Å; E221-K225 VanDerWaalsContact O-CG 3.25Å; E221-K225 WeakPolarHBondContact O-CG 3.43Å; E221-K225 PolarHBondContact O-N 3.32Å; I222-K225 PolarHBondContact O-N 2.77Å; K225-E228 WeakPolarHBondContact CD-OE2 3.23Å; K225-E228 IonicContact NZ-OE1 3.97Å; K225-E228 PolarHBondContact NZ-OE1 2.98Å; K225-E228 IonicContact NZ-OE2 2.64Å; K225-E228 PolarHBondContact NZ-OE2 2.96Å; K225-E228 PolarHBondContact O-N 3.38Å; K225-L229 PolarHBondContact O-N 3.26Å; K225-L229 VanDerWaalsContact O-N 3.1Å
226	W	61.6	Low	60.4	Low	148 Å²	148	114.5 Å²	114.5	56%	0.561	56%	0.555	S	S	*	*	H	α-helix	trans	-63	-45.1	166.6	-71.8	114.5	0	0	0	111.2	I222 E228 L229 E230	I222-W226 PolarHBondContact O-N 3.23Å; W226-E228 PolarHBondContact O-N 3.16Å; W226-L229 WeakPolarHBondContact O-CB 3.39Å; W226-L229 PolarHBondContact O-N 2.86Å; W226-E230 WeakPolarHBondContact O-CG 3.48Å; W226-E230 PolarHBondContact O-N 3.24Å
227	S	69.7	Low	59.8	Low	38 Å²	38	119.4 Å²	119.4	27%	0.266	58%	0.575	S	S	.	*	H	α-helix	trans	-64.5	-16.9	176.7	-66.1	0	0	0	0	115.2	E223 R224 R231	E223-S227 VanDerWaalsContact O-CB 3.24Å; E223-S227 WeakPolarHBondContact O-CB 3.44Å; E223-S227 PolarHBondContact O-N 3.3Å; E223-S227 PolarHBondContact O-OG 2.77Å; R224-S227 CarbonylContact O-C 3.57Å; R224-S227 WeakPolarHBondContact O-CB 3.41Å; R224-S227 PolarHBondContact O-N 3.13Å; S227-R231 WeakPolarHBondContact O-CB 3.47Å; S227-R231 PolarHBondContact O-NE 3.19Å; S227-R231 VanDerWaalsContact O-NE 3.08Å; S227-R231 PolarHBondContact O-NH2 3Å
228	E	68.8	Low	58.6	Low	96 Å²	96	120.1 Å²	120.1	45%	0.449	59%	0.591	S	S	.	*	H	α-helix	trans	-84.5	-43.8	168.6	-77	173.3	-164.5	0	0	110.9	R224 K225 W226 R231 M232	R224-E228 WeakPolarHBondContact O-CG 3.47Å; R224-E228 PolarHBondContact O-N 2.92Å; K225-E228 WeakPolarHBondContact CD-OE2 3.23Å; K225-E228 IonicContact NZ-OE1 3.97Å; K225-E228 PolarHBondContact NZ-OE1 2.98Å; K225-E228 IonicContact NZ-OE2 2.64Å; K225-E228 PolarHBondContact NZ-OE2 2.96Å; K225-E228 PolarHBondContact O-N 3.38Å; W226-E228 PolarHBondContact O-N 3.16Å; E228-R231 PolarHBondContact O-N 2.94Å; E228-M232 PolarHBondContact O-N 3.14Å
229	L	59.4	Low	57.3	Low	115 Å²	115	120.4 Å²	120.4	60%	0.602	60%	0.602	S	S	*	*	H	α-helix	trans	-61.7	-45.7	176.4	-101.7	150.7	0	0	0	112.6	K225 W226 R231 M232	K225-L229 PolarHBondContact O-N 3.26Å; K225-L229 VanDerWaalsContact O-N 3.1Å; W226-L229 WeakPolarHBondContact O-CB 3.39Å; W226-L229 PolarHBondContact O-N 2.86Å; L229-R231 PolarHBondContact O-N 3.12Å; L229-M232 WeakPolarHBondContact O-CB 3.42Å; L229-M232 PolarHBondContact O-N 3.01Å
230	E	60	Low	55.8	Low	136 Å²	136	123.9 Å²	123.9	64%	0.636	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-14.9	176.6	-68.5	-178.8	161.7	0	0	113	W226	W226-E230 WeakPolarHBondContact O-CG 3.48Å; W226-E230 PolarHBondContact O-N 3.24Å
231	R	61.9	Low	54	Low	191 Å²	191	123.7 Å²	123.7	72%	0.721	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-4.5	178.1	-133	174.5	-59.3	-149.8	-5.1	113.9	S227 E228 L229 P233	S227-R231 WeakPolarHBondContact O-CB 3.47Å; S227-R231 PolarHBondContact O-NE 3.19Å; S227-R231 VanDerWaalsContact O-NE 3.08Å; S227-R231 PolarHBondContact O-NH2 3Å; E228-R231 PolarHBondContact O-N 2.94Å; L229-R231 PolarHBondContact O-N 3.12Å; R231-P233 WeakPolarHBondContact O-CD 3.35Å
232	M	42.8	Very low	52.4	Low	133 Å²	133	125.3 Å²	125.3	66%	0.655	65%	0.645	S	S	*	*	S	Bend	trans	-67.7	123.3	168.9	-72.2	-67.6	-68.6	0	0	108.8	E228 L229 L234	E228-M232 PolarHBondContact O-N 3.14Å; L229-M232 WeakPolarHBondContact O-CB 3.42Å; L229-M232 PolarHBondContact O-N 3.01Å; M232-L234 PolarHBondContact O-N 2.72Å
233	P	42.3	Very low	50.9	Low	118 Å²	118	129.7 Å²	129.7	77%	0.766	67%	0.666	S	S	*	*			trans	-62.6	110.9	178.1	-22.7	34	0	0	0	110.6	R231 K235	R231-P233 WeakPolarHBondContact O-CD 3.35Å; P233-K235 PolarHBondContact O-N 3.44Å; P233-K235 VanDerWaalsContact O-N 3.13Å
234	L	42.3	Very low	48.8	Very low	153 Å²	153	127 Å²	127	80%	0.801	67%	0.671	S	S	*	*			trans	-58.4	117	161.1	-70.7	175.5	0	0	0	106.6	M232 D236	M232-L234 PolarHBondContact O-N 2.72Å; L234-D236 PolarHBondContact O-N 2.89Å; L234-D236 VanDerWaalsContact O-N 3.08Å
235	K	43.4	Very low	47.1	Very low	183 Å²	183	127.9 Å²	127.9	80%	0.796	69%	0.693	S	S	*	*			trans	-86.8	85.8	-172.4	-168.2	170.4	-176.4	175.9	0	108.8	P233 M237	P233-K235 PolarHBondContact O-N 3.44Å; P233-K235 VanDerWaalsContact O-N 3.13Å; K235-M237 PolarHBondContact O-N 3.31Å
236	D	33.4	Very low	45.4	Very low	144 Å²	144	133.9 Å²	133.9	77%	0.77	71%	0.713	S	S	*	*			trans	-58.2	99.7	-177.5	-64.2	-34.9	0	0	0	111.9	L234 S238	L234-D236 PolarHBondContact O-N 2.89Å; L234-D236 VanDerWaalsContact O-N 3.08Å; D236-S238 PolarHBondContact O-N 2.77Å
237	M	42.4	Very low	44.7	Very low	166 Å²	166	133.5 Å²	133.5	82%	0.818	73%	0.727	S	S	*	*			trans	-84.2	53.3	175.7	-68.6	-72.8	-76.2	0	0	110.7	K235	K235-M237 PolarHBondContact O-N 3.31Å
238	S	35.8	Very low	43.7	Very low	112 Å²	112	137.2 Å²	137.2	78%	0.783	75%	0.753	S	S	*	*			trans	-154.4	69.2	174.9	-82.2	0	0	0	0	113.9	D236	D236-S238 PolarHBondContact O-N 2.77Å
239	S	37.1	Very low	42.7	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	76%	0.758	S	S	*	*			trans	-134.5	144.4	138.9	60.4	0	0	0	0	107.1
240	L	32.5	Very low	42.4	Very low	168 Å²	168	138.5 Å²	138.5	88%	0.88	77%	0.765	S	S	*	*			cis	-133	149.7	23	-65.9	152.7	0	0	0	111.6
241	S	33.4	Very low	42.3	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	77%	0.766	S	S	*	*			trans	-91.2	149	167	-115.1	0	0	0	0	112.1
242	S	39.7	Very low	41.9	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	76%	0.755	S	S	*	*			trans	-50.2	137.8	-173.1	-178.4	0	0	0	0	116.6
243	M	36.2	Very low	42.6	Very low	178 Å²	178	128.5 Å²	128.5	88%	0.877	75%	0.746	S	S	*	*			trans	-157.4	143.4	149.5	-102.3	-52	108.8	0	0	113.3
244	G	33	Very low	43.9	Very low	68 Å²	68	127.6 Å²	127.6	70%	0.701	73%	0.732	S	S	*	*			trans	73	99.1	149.5	0	0	0	0	0	119.1	R246	G244-R246 PolarHBondContact O-N 3.49Å
245	S	41.9	Very low	45.3	Very low	122 Å²	122	122.2 Å²	122.2	85%	0.853	71%	0.71	S	S	*	*			trans	-64.6	120.1	169.6	-179.6	0	0	0	0	113
246	R	36.7	Very low	46.4	Very low	232 Å²	232	118.9 Å²	118.9	88%	0.875	70%	0.7	S	S	*	*			trans	-143	130.9	157.5	-65.2	-170.8	73.1	158.5	0.2	110.3	G244 S248	G244-R246 PolarHBondContact O-N 3.49Å; R246-S248 PolarHBondContact O-N 2.88Å
247	T	45.6	Very low	48.4	Very low	140 Å²	140	117.7 Å²	117.7	86%	0.859	69%	0.69	S	S	*	*	S	Bend	trans	-79	99.6	-173.4	49.2	0	0	0	0	112.7
248	S	49	Very low	50.2	Low	116 Å²	116	117 Å²	117	81%	0.811	68%	0.678	S	S	*	*			trans	-160.9	5.1	171.3	-157.8	0	0	0	0	117.3	R246	R246-S248 PolarHBondContact O-N 2.88Å
249	S	48.1	Very low	52.1	Low	79 Å²	79	117.9 Å²	117.9	55%	0.552	67%	0.67	S	S	*	*			trans	-109.2	7.3	-157.7	54.1	0	0	0	0	117.8	A252 N253	S249-A252 PolarHBondContact O-N 3.23Å; S249-N253 PolarHBondContact O-N 3.2Å
250	Q	53.1	Low	54.1	Low	160 Å²	160	115.8 Å²	115.8	75%	0.748	65%	0.653	S	S	*	*	H	α-helix	trans	-48.5	-53.6	-173.9	-80.3	172.9	-98.5	0	0	116	A252 N253 E254	Q250-A252 VanDerWaalsContact C-N 3.28Å; Q250-A252 PolarHBondContact O-N 3.02Å; Q250-N253 PolarHBondContact O-N 3.45Å; Q250-E254 PolarHBondContact O-N 2.93Å
251	P	58.8	Low	56.5	Low	101 Å²	101	110.6 Å²	110.6	66%	0.656	63%	0.634	S	S	*	*	H	α-helix	trans	-67.9	-25.9	-174.8	26.2	-34.9	0	0	0	113.8	A255	P251-A255 PolarHBondContact O-N 3.05Å
252	A	51.9	Low	59	Low	58 Å²	58	108.8 Å²	108.8	48%	0.479	62%	0.621	S	S	.	*	H	α-helix	trans	-75.7	-35.6	175.6	0	0	0	0	0	111.9	S249 Q250 A255 L256	S249-A252 PolarHBondContact O-N 3.23Å; Q250-A252 VanDerWaalsContact C-N 3.28Å; Q250-A252 PolarHBondContact O-N 3.02Å; A252-A255 PolarHBondContact O-N 3.43Å; A252-L256 PolarHBondContact O-N 2.86Å
253	N	58.3	Low	60.8	Low	90 Å²	90	108 Å²	108	48%	0.481	61%	0.608	S	S	.	*	H	α-helix	trans	-65.9	-44.3	177.8	-164.1	-18.1	0	0	0	111.1	S249 Q250 A255 L256 Q257	S249-N253 PolarHBondContact O-N 3.2Å; Q250-N253 PolarHBondContact O-N 3.45Å; N253-A255 VanDerWaalsContact C-N 3.29Å; N253-A255 PolarHBondContact O-N 2.86Å; N253-L256 PolarHBondContact O-N 3.23Å; N253-Q257 WeakPolarHBondContact O-CG 3.45Å; N253-Q257 PolarHBondContact O-N 3.32Å; N253-Q257 PolarHBondContact OD1-NE2 3.38Å; N253-Q257 VanDerWaalsContact OD1-NE2 3.11Å
254	E	69.8	Low	62.6	Low	99 Å²	99	107.9 Å²	107.9	46%	0.463	60%	0.598	S	S	.	*	H	α-helix	trans	-62.8	-33.7	174.3	-63.4	-178.8	-162.6	0	0	113.5	Q250 Q257 R258	Q250-E254 PolarHBondContact O-N 2.93Å; E254-Q257 PolarHBondContact O-N 3.46Å; E254-R258 WeakPolarHBondContact O-CG 3.24Å; E254-R258 PolarHBondContact O-N 3.18Å; E254-R258 PolarHBondContact O-NE 2.86Å; E254-R258 IonicContact OE2-NH2 3.85Å; E254-R258 PolarHBondContact OE2-NH2 2.89Å
255	A	70.5	Confident	64.9	Low	41 Å²	41	110.1 Å²	110.1	34%	0.339	59%	0.59	S	S	.	*	H	α-helix	trans	-64.8	-48.9	175	0	0	0	0	0	111	P251 A252 N253 Q257 R258 E259	P251-A255 PolarHBondContact O-N 3.05Å; A252-A255 PolarHBondContact O-N 3.43Å; N253-A255 VanDerWaalsContact C-N 3.29Å; N253-A255 PolarHBondContact O-N 2.86Å; A255-Q257 VanDerWaalsContact C-N 3.33Å; A255-Q257 PolarHBondContact O-N 3.33Å; A255-R258 PolarHBondContact O-N 2.85Å; A255-E259 PolarHBondContact O-N 3.42Å
256	L	68.1	Low	66.3	Low	113 Å²	113	109.5 Å²	109.5	59%	0.592	57%	0.574	S	S	*	*	H	α-helix	trans	-59.3	-41.3	173.5	-102.4	86.7	0	0	0	112.2	A252 N253 R258 E259 V260	A252-L256 PolarHBondContact O-N 2.86Å; N253-L256 PolarHBondContact O-N 3.23Å; L256-R258 VanDerWaalsContact C-N 3.3Å; L256-R258 PolarHBondContact O-N 3.44Å; L256-E259 PolarHBondContact O-N 2.85Å; L256-V260 WeakPolarHBondContact O-CB 3.36Å; L256-V260 VanDerWaalsContact O-CG2 3.29Å; L256-V260 WeakPolarHBondContact O-CG2 3.32Å; L256-V260 PolarHBondContact O-N 2.87Å
257	Q	74.4	Confident	67.8	Low	119 Å²	119	103.3 Å²	103.3	56%	0.556	56%	0.557	S	S	*	*	H	α-helix	trans	-62.2	-37.9	178.1	-73.6	178.3	12.4	0	0	112.2	N253 E254 A255 A261	N253-Q257 WeakPolarHBondContact O-CG 3.45Å; N253-Q257 PolarHBondContact O-N 3.32Å; N253-Q257 PolarHBondContact OD1-NE2 3.38Å; N253-Q257 VanDerWaalsContact OD1-NE2 3.11Å; E254-Q257 PolarHBondContact O-N 3.46Å; A255-Q257 VanDerWaalsContact C-N 3.33Å; A255-Q257 PolarHBondContact O-N 3.33Å; Q257-A261 WeakPolarHBondContact O-CB 3.18Å; Q257-A261 PolarHBondContact O-N 2.83Å
258	R	79.6	Confident	69	Low	151 Å²	151	103 Å²	103	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-68.5	-39	174.9	-72.9	179.5	-114.2	113.6	-6.5	112.3	E254 A255 L256 S262	E254-R258 WeakPolarHBondContact O-CG 3.24Å; E254-R258 PolarHBondContact O-N 3.18Å; E254-R258 PolarHBondContact O-NE 2.86Å; E254-R258 IonicContact OE2-NH2 3.85Å; E254-R258 PolarHBondContact OE2-NH2 2.89Å; A255-R258 PolarHBondContact O-N 2.85Å; L256-R258 VanDerWaalsContact C-N 3.3Å; L256-R258 PolarHBondContact O-N 3.44Å; R258-S262 WeakPolarHBondContact O-CB 3.44Å; R258-S262 PolarHBondContact O-N 2.69Å
259	E	77.4	Confident	69.8	Low	131 Å²	131	104.1 Å²	104.1	61%	0.612	54%	0.537	S	S	*	.	H	α-helix	trans	-67.6	-43.6	172.8	-70.9	-167.2	166.5	0	0	112.5	A255 L256 A261 S262 L263	A255-E259 PolarHBondContact O-N 3.42Å; L256-E259 PolarHBondContact O-N 2.85Å; E259-A261 VanDerWaalsContact C-N 3.31Å; E259-A261 PolarHBondContact O-N 2.95Å; E259-S262 WeakPolarHBondContact O-CB 3.41Å; E259-S262 PolarHBondContact O-N 2.91Å; E259-S262 VanDerWaalsContact O-N 3.15Å; E259-L263 WeakPolarHBondContact O-CB 3.41Å; E259-L263 VanDerWaalsContact O-CG 3.31Å; E259-L263 WeakPolarHBondContact O-CG 3.31Å; E259-L263 PolarHBondContact O-N 3.07Å
260	V	78.5	Confident	70.4	Confident	63 Å²	63	105.6 Å²	105.6	38%	0.382	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-38.4	176.3	169.1	0	0	0	0	111.4	L256 R264	L256-V260 WeakPolarHBondContact O-CB 3.36Å; L256-V260 VanDerWaalsContact O-CG2 3.29Å; L256-V260 WeakPolarHBondContact O-CG2 3.32Å; L256-V260 PolarHBondContact O-N 2.87Å; V260-R264 WeakPolarHBondContact O-CB 3.36Å; V260-R264 VanDerWaalsContact O-CG 3.24Å; V260-R264 WeakPolarHBondContact O-CG 3.26Å; V260-R264 PolarHBondContact O-N 2.81Å
261	A	82.2	Confident	70.5	Confident	59 Å²	59	104.4 Å²	104.4	49%	0.488	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-43.8	172.9	0	0	0	0	0	112.1	Q257 E259 R264 Q265	Q257-A261 WeakPolarHBondContact O-CB 3.18Å; Q257-A261 PolarHBondContact O-N 2.83Å; E259-A261 VanDerWaalsContact C-N 3.31Å; E259-A261 PolarHBondContact O-N 2.95Å; A261-R264 PolarHBondContact O-N 3.09Å; A261-Q265 PolarHBondContact O-N 3.04Å
262	S	85.3	Confident	70.2	Confident	58 Å²	58	104 Å²	104	41%	0.406	53%	0.531	S	S	.	.	H	α-helix	trans	-62.3	-46.5	176.1	-172.6	0	0	0	0	112.2	R258 E259 R264 Q265 Q266	R258-S262 WeakPolarHBondContact O-CB 3.44Å; R258-S262 PolarHBondContact O-N 2.69Å; E259-S262 WeakPolarHBondContact O-CB 3.41Å; E259-S262 PolarHBondContact O-N 2.91Å; E259-S262 VanDerWaalsContact O-N 3.15Å; S262-R264 PolarHBondContact O-N 3.28Å; S262-Q265 PolarHBondContact O-N 2.9Å; S262-Q265 VanDerWaalsContact O-N 3.17Å; S262-Q266 WeakPolarHBondContact O-CG 3.4Å; S262-Q266 PolarHBondContact O-N 2.95Å
263	L	77.5	Confident	70.3	Confident	89 Å²	89	106.7 Å²	106.7	47%	0.466	54%	0.542	S	S	.	.	H	α-helix	trans	-64.4	-37.4	177.9	-71.7	168.6	0	0	0	112.2	E259 Q266 L267	E259-L263 WeakPolarHBondContact O-CB 3.41Å; E259-L263 VanDerWaalsContact O-CG 3.31Å; E259-L263 WeakPolarHBondContact O-CG 3.31Å; E259-L263 PolarHBondContact O-N 3.07Å; L263-Q266 PolarHBondContact O-N 3.37Å; L263-L267 WeakPolarHBondContact O-CB 3.27Å; L263-L267 WeakPolarHBondContact O-CG 3.36Å; L263-L267 PolarHBondContact O-N 2.9Å
264	R	75.7	Confident	70	Confident	177 Å²	177	112.8 Å²	112.8	67%	0.668	56%	0.558	S	S	*	*	H	α-helix	trans	-61.5	-45.1	171	-76.9	171.9	179.1	-172	-0.5	111.5	V260 A261 S262 Q266 L267 E268	V260-R264 WeakPolarHBondContact O-CB 3.36Å; V260-R264 VanDerWaalsContact O-CG 3.24Å; V260-R264 WeakPolarHBondContact O-CG 3.26Å; V260-R264 PolarHBondContact O-N 2.81Å; A261-R264 PolarHBondContact O-N 3.09Å; S262-R264 PolarHBondContact O-N 3.28Å; R264-Q266 VanDerWaalsContact C-N 3.31Å; R264-Q266 PolarHBondContact O-N 2.9Å; R264-L267 PolarHBondContact O-N 2.99Å; R264-E268 WeakPolarHBondContact O-CB 3.36Å; R264-E268 PolarHBondContact O-N 3.11Å
265	Q	79.8	Confident	69.1	Low	114 Å²	114	112.7 Å²	112.7	53%	0.533	57%	0.568	S	S	.	*	H	α-helix	trans	-69	-27.4	178.1	-160.1	-179.4	55.8	0	0	113.1	A261 S262 K269	A261-Q265 PolarHBondContact O-N 3.04Å; S262-Q265 PolarHBondContact O-N 2.9Å; S262-Q265 VanDerWaalsContact O-N 3.17Å; Q265-K269 WeakPolarHBondContact O-CG 3.22Å; Q265-K269 PolarHBondContact O-N 2.83Å
266	Q	71.9	Confident	68.3	Low	110 Å²	110	117.6 Å²	117.6	51%	0.514	59%	0.588	S	S	.	*	H	α-helix	trans	-72.5	-42.5	169.5	-73.2	-176.9	-12.6	0	0	112.1	S262 L263 R264 K269 L270	S262-Q266 WeakPolarHBondContact O-CG 3.4Å; S262-Q266 PolarHBondContact O-N 2.95Å; L263-Q266 PolarHBondContact O-N 3.37Å; R264-Q266 VanDerWaalsContact C-N 3.31Å; R264-Q266 PolarHBondContact O-N 2.9Å; Q266-K269 PolarHBondContact O-N 2.91Å; Q266-L270 WeakPolarHBondContact O-CG 3.36Å; Q266-L270 PolarHBondContact O-N 3.3Å
267	L	68.4	Low	67.9	Low	101 Å²	101	116.5 Å²	116.5	53%	0.529	59%	0.59	S	S	.	*	H	α-helix	trans	-62	-43	175.2	-80	165.1	0	0	0	111.9	L263 R264 K269 L270 Q271	L263-L267 WeakPolarHBondContact O-CB 3.27Å; L263-L267 WeakPolarHBondContact O-CG 3.36Å; L263-L267 PolarHBondContact O-N 2.9Å; R264-L267 PolarHBondContact O-N 2.99Å; L267-K269 PolarHBondContact O-N 3.47Å; L267-L270 CarbonylContact O-C 3.01Å; L267-L270 PolarHBondContact O-N 2.93Å; L267-L270 VanDerWaalsContact O-N 3.12Å; L267-Q271 WeakPolarHBondContact O-CG 3.46Å; L267-Q271 PolarHBondContact O-N 2.63Å
268	E	71	Confident	67.3	Low	134 Å²	134	112.2 Å²	112.2	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-60.6	-43.4	176.8	-171.5	171	-132.7	0	0	111.6	R264 L270 Q271 S272	R264-E268 WeakPolarHBondContact O-CB 3.36Å; R264-E268 PolarHBondContact O-N 3.11Å; E268-L270 PolarHBondContact O-N 3.42Å; E268-Q271 PolarHBondContact O-N 3.01Å; E268-S272 PolarHBondContact O-N 3Å
269	K	66.4	Low	66.4	Low	140 Å²	140	111 Å²	111	61%	0.609	59%	0.589	S	S	*	*	H	α-helix	trans	-62.7	-39.2	171.7	-75.4	174.3	178.5	173.8	0	112.8	Q265 Q266 L267 S272 V273	Q265-K269 WeakPolarHBondContact O-CG 3.22Å; Q265-K269 PolarHBondContact O-N 2.83Å; Q266-K269 PolarHBondContact O-N 2.91Å; L267-K269 PolarHBondContact O-N 3.47Å; K269-S272 WeakPolarHBondContact O-CB 3.26Å; K269-S272 PolarHBondContact O-N 2.92Å; K269-V273 PolarHBondContact O-N 3.19Å
270	L	60.2	Low	65.4	Low	110 Å²	110	111.2 Å²	111.2	58%	0.576	59%	0.59	S	S	*	*	H	α-helix	trans	-73.3	-32.2	177.7	-72.2	169.1	0	0	0	112.9	Q266 L267 E268 V273 R274	Q266-L270 WeakPolarHBondContact O-CG 3.36Å; Q266-L270 PolarHBondContact O-N 3.3Å; L267-L270 CarbonylContact O-C 3.01Å; L267-L270 PolarHBondContact O-N 2.93Å; L267-L270 VanDerWaalsContact O-N 3.12Å; E268-L270 PolarHBondContact O-N 3.42Å; L270-V273 PolarHBondContact O-N 3.07Å; L270-R274 PolarHBondContact O-N 2.91Å
271	Q	55.5	Low	65.3	Low	135 Å²	135	108.8 Å²	108.8	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-67.5	-40.6	171.4	-75.3	-179.3	-84.5	0	0	111.1	L267 E268 V273 R274 S275	L267-Q271 WeakPolarHBondContact O-CG 3.46Å; L267-Q271 PolarHBondContact O-N 2.63Å; E268-Q271 PolarHBondContact O-N 3.01Å; Q271-V273 PolarHBondContact O-N 2.89Å; Q271-R274 PolarHBondContact O-N 3.46Å; Q271-R274 VanDerWaalsContact O-N 3.11Å; Q271-S275 PolarHBondContact O-N 3.33Å
272	S	51.9	Low	65	Low	91 Å²	91	111 Å²	111	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-56.6	-38.3	173	-170.8	0	0	0	0	112.4	E268 K269	E268-S272 PolarHBondContact O-N 3Å; K269-S272 WeakPolarHBondContact O-CB 3.26Å; K269-S272 PolarHBondContact O-N 2.92Å
273	V	53.9	Low	64.6	Low	115 Å²	115	111.9 Å²	111.9	70%	0.697	59%	0.591	S	S	*	*	H	α-helix	trans	-76.4	-30.2	176.6	175.6	0	0	0	0	112.5	K269 L270 Q271	K269-V273 PolarHBondContact O-N 3.19Å; L270-V273 PolarHBondContact O-N 3.07Å; Q271-V273 PolarHBondContact O-N 2.89Å
274	R	51.6	Low	64.6	Low	219 Å²	219	109.2 Å²	109.2	83%	0.826	58%	0.58	S	S	*	*	H	α-helix	trans	-77.1	-18.7	175.6	-83.9	-173	167	-165.7	-3.5	114.4	L270 Q271 D276	L270-R274 PolarHBondContact O-N 2.91Å; Q271-R274 PolarHBondContact O-N 3.46Å; Q271-R274 VanDerWaalsContact O-N 3.11Å; R274-D276 VanDerWaalsContact C-N 3.29Å; R274-D276 PolarHBondContact O-N 3Å
275	S	50.8	Low	64.9	Low	97 Å²	97	108.1 Å²	108.1	68%	0.678	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-10.8	-173.9	-165.3	0	0	0	0	114.9	Q271 C277	Q271-S275 PolarHBondContact O-N 3.33Å; S275-C277 VanDerWaalsContact C-N 3.26Å; S275-C277 PolarHBondContact O-N 2.93Å
276	D	55	Low	65.1	Low	143 Å²	143	106 Å²	106	77%	0.765	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-10	-173.5	-141	29.3	0	0	0	113.5	R274 G278 A281	R274-D276 VanDerWaalsContact C-N 3.29Å; R274-D276 PolarHBondContact O-N 3Å; D276-G278 PolarHBondContact O-N 3.49Å; D276-A281 WeakPolarHBondContact O-CB 3.44Å
277	C	58.9	Low	65.7	Low	91 Å²	91	105.7 Å²	105.7	62%	0.615	58%	0.575	S	S	*	*			trans	-99.6	49.8	177.7	-71.5	0	0	0	0	113	S275	S275-C277 VanDerWaalsContact C-N 3.26Å; S275-C277 PolarHBondContact O-N 2.93Å
278	G	62.2	Low	66.6	Low	29 Å²	29	102.7 Å²	102.7	30%	0.299	57%	0.565	S	S	.	*			trans	-66.7	171.3	172.2	0	0	0	0	0	113.8	D276 E280 A281 S284	D276-G278 PolarHBondContact O-N 3.49Å; G278-E280 PolarHBondContact O-N 3.07Å; G278-A281 WeakPolarHBondContact O-CB 3.13Å; G278-A281 PolarHBondContact O-N 3.24Å; G278-S284 PolarHBondContact O-OG 2.97Å
279	P	59.4	Low	67.6	Low	126 Å²	126	98.5 Å²	98.5	82%	0.818	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-27.8	178.8	24.8	-34.2	0	0	0	113.2	A281 S284	P279-A281 VanDerWaalsContact C-N 3.34Å; P279-S284 WeakPolarHBondContact O-CB 3.31Å
280	E	57.9	Low	68.8	Low	134 Å²	134	96.6 Å²	96.6	63%	0.626	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-16	175	-80.8	-65.8	149.8	0	0	114.3	G278 R285	G278-E280 PolarHBondContact O-N 3.07Å; E280-R285 PolarHBondContact O-NE 3.3Å; E280-R285 IonicContact OE2-CZ 3.63Å; E280-R285 IonicContact OE2-NE 3.69Å; E280-R285 IonicContact OE2-NH2 3.2Å; E280-R285 PolarHBondContact OE2-NH2 3.33Å
281	A	75.1	Confident	70.3	Confident	12 Å²	12	96.8 Å²	96.8	10%	0.099	55%	0.546	C	S	.	.	S	Bend	trans	-66.6	152.7	-167	0	0	0	0	0	113.6	D276 G278 P279 C283 S284 R285	D276-A281 WeakPolarHBondContact O-CB 3.44Å; G278-A281 WeakPolarHBondContact O-CB 3.13Å; G278-A281 PolarHBondContact O-N 3.24Å; P279-A281 VanDerWaalsContact C-N 3.34Å; A281-C283 PolarHBondContact O-N 2.89Å; A281-S284 WeakPolarHBondContact O-CB 3.27Å; A281-S284 PolarHBondContact O-N 3.15Å; A281-R285 WeakPolarHBondContact O-CG 3.4Å; A281-R285 PolarHBondContact O-N 3.26Å
282	P	76.1	Confident	72.2	Confident	107 Å²	107	96.8 Å²	96.8	70%	0.695	54%	0.54	S	S	*	.	H	α-helix	trans	-55.2	-36.2	178.7	-27	35.6	0	0	0	113.9	R285 S286	P282-R285 PolarHBondContact O-N 3.46Å; P282-S286 WeakPolarHBondContact O-CB 3.39Å; P282-S286 PolarHBondContact O-N 2.9Å
283	C	76.6	Confident	74.3	Confident	76 Å²	76	95.4 Å²	95.4	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-62.9	-46.8	175.4	-58.5	0	0	0	0	111.9	A281 S286 L287	A281-C283 PolarHBondContact O-N 2.89Å; C283-S286 WeakPolarHBondContact O-CB 3.38Å; C283-S286 PolarHBondContact O-N 3.28Å; C283-L287 WeakPolarHBondContact O-CG 3.47Å; C283-L287 PolarHBondContact O-N 3.48Å
284	S	78.1	Confident	76.3	Confident	33 Å²	33	95.5 Å²	95.5	23%	0.231	53%	0.527	C	S	.	.	H	α-helix	trans	-62.5	-43	177.5	-49.2	0	0	0	0	111.6	G278 P279 A281 S286 L287 A288	G278-S284 PolarHBondContact O-OG 2.97Å; P279-S284 WeakPolarHBondContact O-CB 3.31Å; A281-S284 WeakPolarHBondContact O-CB 3.27Å; A281-S284 PolarHBondContact O-N 3.15Å; S284-S286 VanDerWaalsContact C-N 3.34Å; S284-S286 PolarHBondContact O-N 3.01Å; S284-L287 PolarHBondContact O-N 2.92Å; S284-A288 WeakPolarHBondContact O-CB 3.37Å; S284-A288 PolarHBondContact O-N 3.37Å
285	R	81.8	Confident	78.4	Confident	153 Å²	153	91.1 Å²	91.1	58%	0.577	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-37.4	174.5	-65.5	176.7	-179.8	-144.5	0.2	112.4	E280 A281 P282 A289	E280-R285 PolarHBondContact O-NE 3.3Å; E280-R285 IonicContact OE2-CZ 3.63Å; E280-R285 IonicContact OE2-NE 3.69Å; E280-R285 IonicContact OE2-NH2 3.2Å; E280-R285 PolarHBondContact OE2-NH2 3.33Å; A281-R285 WeakPolarHBondContact O-CG 3.4Å; A281-R285 PolarHBondContact O-N 3.26Å; P282-R285 PolarHBondContact O-N 3.46Å; R285-A289 WeakPolarHBondContact O-CB 3.32Å; R285-A289 PolarHBondContact O-N 2.87Å
286	S	85	Confident	80.6	Confident	70 Å²	70	92.2 Å²	92.2	49%	0.49	50%	0.504	S	S	.	.	H	α-helix	trans	-67.4	-47.5	176.4	-173.6	0	0	0	0	111.9	P282 C283 S284 A288 A289 M290	P282-S286 WeakPolarHBondContact O-CB 3.39Å; P282-S286 PolarHBondContact O-N 2.9Å; C283-S286 WeakPolarHBondContact O-CB 3.38Å; C283-S286 PolarHBondContact O-N 3.28Å; S284-S286 VanDerWaalsContact C-N 3.34Å; S284-S286 PolarHBondContact O-N 3.01Å; S286-A288 PolarHBondContact O-N 3.12Å; S286-A289 WeakPolarHBondContact O-CB 3.28Å; S286-A289 PolarHBondContact O-N 3.37Å; S286-A289 VanDerWaalsContact O-N 3.08Å; S286-M290 PolarHBondContact O-N 3.49Å
287	L	84.6	Confident	82.6	Confident	103 Å²	103	88.1 Å²	88.1	54%	0.539	49%	0.491	S	S	.	.	H	α-helix	trans	-58.8	-48.2	174.7	-71.4	168.2	0	0	0	111.3	C283 S284 A289 M290 E291	C283-L287 WeakPolarHBondContact O-CG 3.47Å; C283-L287 PolarHBondContact O-N 3.48Å; S284-L287 PolarHBondContact O-N 2.92Å; L287-A289 PolarHBondContact O-N 2.85Å; L287-M290 WeakPolarHBondContact O-CB 3.38Å; L287-M290 PolarHBondContact O-N 3.07Å; L287-M290 VanDerWaalsContact O-N 3.08Å; L287-E291 WeakPolarHBondContact O-CG 3.38Å; L287-E291 PolarHBondContact O-N 2.97Å
288	A	87.6	Confident	84.3	Confident	38 Å²	38	89.5 Å²	89.5	31%	0.314	49%	0.491	S	S	.	.	H	α-helix	trans	-64.3	-22.1	176.3	0	0	0	0	0	113.8	S284 S286 R292	S284-A288 WeakPolarHBondContact O-CB 3.37Å; S284-A288 PolarHBondContact O-N 3.37Å; S286-A288 PolarHBondContact O-N 3.12Å; A288-R292 WeakPolarHBondContact O-CG 2.91Å; A288-R292 PolarHBondContact O-NE 3Å; A288-R292 PolarHBondContact O-NH2 2.96Å
289	A	91.2	Very high	86	Confident	47 Å²	47	91.8 Å²	91.8	39%	0.388	49%	0.494	S	S	.	.	H	α-helix	trans	-78.4	-42.9	170	0	0	0	0	0	111.8	R285 S286 L287 R292 A293	R285-A289 WeakPolarHBondContact O-CB 3.32Å; R285-A289 PolarHBondContact O-N 2.87Å; S286-A289 WeakPolarHBondContact O-CB 3.28Å; S286-A289 PolarHBondContact O-N 3.37Å; S286-A289 VanDerWaalsContact O-N 3.08Å; L287-A289 PolarHBondContact O-N 2.85Å; A289-R292 PolarHBondContact O-N 3.33Å; A289-A293 PolarHBondContact O-N 2.76Å
290	M	92.1	Very high	87.8	Confident	100 Å²	100	89.2 Å²	89.2	49%	0.493	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-44	175.8	-174.1	179.4	-71.2	0	0	112	S286 L287 R292 A293 H294	S286-M290 PolarHBondContact O-N 3.49Å; L287-M290 WeakPolarHBondContact O-CB 3.38Å; L287-M290 PolarHBondContact O-N 3.07Å; L287-M290 VanDerWaalsContact O-N 3.08Å; M290-R292 VanDerWaalsContact C-N 3.35Å; M290-R292 PolarHBondContact O-N 3.03Å; M290-A293 PolarHBondContact O-N 2.69Å; M290-H294 WeakPolarHBondContact CG-NE2 3.19Å; M290-H294 PolarHBondContact O-CD2 3.37Å; M290-H294 VanDerWaalsContact O-CD2 3.24Å; M290-H294 PolarHBondContact O-N 3.23Å
291	E	91.5	Very high	89.6	Confident	113 Å²	113	87 Å²	87	53%	0.528	46%	0.463	S	S	.	.	H	α-helix	trans	-58.2	-43.3	173.5	-74.8	177.7	-164.5	0	0	112.7	L287 H294 R295	L287-E291 WeakPolarHBondContact O-CG 3.38Å; L287-E291 PolarHBondContact O-N 2.97Å; E291-H294 PolarHBondContact O-N 2.98Å; E291-R295 VanDerWaalsContact O-CB 3.29Å; E291-R295 WeakPolarHBondContact O-CB 3.49Å; E291-R295 PolarHBondContact O-N 3.33Å; E291-R295 IonicContact OE2-NH2 3.64Å
292	R	95.6	Very high	90.6	Very high	136 Å²	136	91.6 Å²	91.6	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-67.1	-39.8	176.6	-78.2	178.1	-71.9	171.2	0.2	111.7	A288 A289 M290 R295 H296	A288-R292 WeakPolarHBondContact O-CG 2.91Å; A288-R292 PolarHBondContact O-NE 3Å; A288-R292 PolarHBondContact O-NH2 2.96Å; A289-R292 PolarHBondContact O-N 3.33Å; M290-R292 VanDerWaalsContact C-N 3.35Å; M290-R292 PolarHBondContact O-N 3.03Å; R292-R295 PolarHBondContact O-N 2.93Å; R292-H296 PolarHBondContact O-CD2 3.02Å; R292-H296 PolarHBondContact O-N 3.49Å
293	A	95.7	Very high	91.6	Very high	62 Å²	62	93.1 Å²	93.1	51%	0.512	47%	0.474	S	S	.	.	H	α-helix	trans	-63.3	-44.7	175.1	0	0	0	0	0	111.9	A289 M290 H296 A297	A289-A293 PolarHBondContact O-N 2.76Å; M290-A293 PolarHBondContact O-N 2.69Å; A293-H296 PolarHBondContact O-N 3.16Å; A293-A297 WeakPolarHBondContact O-CB 3.32Å; A293-A297 PolarHBondContact O-N 2.93Å
294	H	94.9	Very high	92.5	Very high	116 Å²	116	93.7 Å²	93.7	54%	0.537	47%	0.469	S	S	.	.	H	α-helix	trans	-65.4	-39	174.8	-70.7	-46.1	0	0	0	112.6	M290 E291 A297 L298	M290-H294 WeakPolarHBondContact CG-NE2 3.19Å; M290-H294 PolarHBondContact O-CD2 3.37Å; M290-H294 VanDerWaalsContact O-CD2 3.24Å; M290-H294 PolarHBondContact O-N 3.23Å; E291-H294 PolarHBondContact O-N 2.98Å; H294-A297 PolarHBondContact O-N 3.38Å; H294-L298 WeakPolarHBondContact O-CG 3.23Å; H294-L298 PolarHBondContact O-N 2.95Å
295	R	95.4	Very high	93.4	Very high	128 Å²	128	96.8 Å²	96.8	48%	0.483	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-48.5	175.9	-164	177.8	-58.4	136.7	10.3	111.6	E291 R292 A297 L298 E299	E291-R295 VanDerWaalsContact O-CB 3.29Å; E291-R295 WeakPolarHBondContact O-CB 3.49Å; E291-R295 PolarHBondContact O-N 3.33Å; E291-R295 IonicContact OE2-NH2 3.64Å; R292-R295 PolarHBondContact O-N 2.93Å; R295-A297 VanDerWaalsContact C-N 3.35Å; R295-A297 PolarHBondContact O-N 3.37Å; R295-L298 PolarHBondContact O-N 3.46Å; R295-E299 VanDerWaalsContact O-CG 3.29Å; R295-E299 WeakPolarHBondContact O-CG 3.45Å; R295-E299 PolarHBondContact O-N 2.96Å
296	H	97.6	Very high	94	Very high	119 Å²	119	92.7 Å²	92.7	55%	0.551	47%	0.47	S	S	*	.	H	α-helix	trans	-65.2	-34.5	174.9	-72	-41	0	0	0	113.3	R292 A293 L298 E299 E300	R292-H296 PolarHBondContact O-CD2 3.02Å; R292-H296 PolarHBondContact O-N 3.49Å; A293-H296 PolarHBondContact O-N 3.16Å; H296-L298 VanDerWaalsContact C-N 3.35Å; H296-E299 IonicContact CE1-OE2 2.71Å; H296-E299 IonicContact CG-OE2 2.64Å; H296-E299 IonicContact ND1-OE2 2.78Å; H296-E299 PolarHBondContact ND1-OE2 3.39Å; H296-E299 PolarHBondContact O-N 3.06Å; H296-E300 WeakPolarHBondContact O-CB 3.26Å; H296-E300 PolarHBondContact O-N 2.86Å
297	A	97.1	Very high	94.7	Very high	58 Å²	58	94 Å²	94	48%	0.479	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-38.2	174.2	0	0	0	0	0	112.3	A293 H294 R295 L301	A293-A297 WeakPolarHBondContact O-CB 3.32Å; A293-A297 PolarHBondContact O-N 2.93Å; H294-A297 PolarHBondContact O-N 3.38Å; R295-A297 VanDerWaalsContact C-N 3.35Å; R295-A297 PolarHBondContact O-N 3.37Å; A297-L301 VanDerWaalsContact O-CB 3.3Å; A297-L301 WeakPolarHBondContact O-CB 3.18Å; A297-L301 PolarHBondContact O-N 2.98Å
298	L	94.8	Very high	95.3	Very high	119 Å²	119	94.3 Å²	94.3	62%	0.623	46%	0.462	S	S	*	.	H	α-helix	trans	-70.3	-41.6	173.4	-69.4	169.2	0	0	0	111.9	H294 R295 H296 E300 L301 Q302	H294-L298 WeakPolarHBondContact O-CG 3.23Å; H294-L298 PolarHBondContact O-N 2.95Å; R295-L298 PolarHBondContact O-N 3.46Å; H296-L298 VanDerWaalsContact C-N 3.35Å; L298-E300 VanDerWaalsContact C-N 3.34Å; L298-E300 PolarHBondContact O-N 3.48Å; L298-L301 PolarHBondContact O-N 3.2Å; L298-Q302 WeakPolarHBondContact O-CB 3.35Å; L298-Q302 PolarHBondContact O-N 3Å
299	E	97.3	Very high	95.6	Very high	77 Å²	77	97.5 Å²	97.5	36%	0.36	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-39	175.2	-73.5	165.6	-170.2	0	0	112.6	R295 H296 R303	R295-E299 VanDerWaalsContact O-CG 3.29Å; R295-E299 WeakPolarHBondContact O-CG 3.45Å; R295-E299 PolarHBondContact O-N 2.96Å; H296-E299 IonicContact CE1-OE2 2.71Å; H296-E299 IonicContact CG-OE2 2.64Å; H296-E299 IonicContact ND1-OE2 2.78Å; H296-E299 PolarHBondContact ND1-OE2 3.39Å; H296-E299 PolarHBondContact O-N 3.06Å; E299-R303 WeakPolarHBondContact O-CG 3.47Å; E299-R303 PolarHBondContact O-N 3.38Å
300	E	97.6	Very high	95.9	Very high	73 Å²	73	101.9 Å²	101.9	34%	0.341	48%	0.479	S	S	.	.	H	α-helix	trans	-77.3	-35.5	177.2	-179.6	53	-157.6	0	0	112	H296 L298 Q302 R303 Q304 R307	H296-E300 WeakPolarHBondContact O-CB 3.26Å; H296-E300 PolarHBondContact O-N 2.86Å; L298-E300 VanDerWaalsContact C-N 3.34Å; L298-E300 PolarHBondContact O-N 3.48Å; E300-Q302 VanDerWaalsContact C-N 3.32Å; E300-Q302 PolarHBondContact O-N 2.73Å; E300-R303 CarbonylContact O-C 3.56Å; E300-R303 PolarHBondContact O-N 3.48Å; E300-Q304 VanDerWaalsContact O-CG 3.27Å; E300-Q304 WeakPolarHBondContact O-CG 3.49Å; E300-Q304 PolarHBondContact O-N 3.39Å; E300-Q304 PolarHBondContact OE1-NE2 3.17Å; E300-R307 VanDerWaalsContact CD-NH2 3.33Å; E300-R307 IonicContact OE1-CZ 2.87Å; E300-R307 IonicContact OE1-NH1 3.73Å; E300-R307 IonicContact OE1-NH2 2.93Å; E300-R307 PolarHBondContact OE1-NH2 2.92Å; E300-R307 IonicContact OE2-NH2 3.86Å; E300-R307 PolarHBondContact OE2-NH2 3.05Å
301	L	96.5	Very high	96.2	Very high	86 Å²	86	102.4 Å²	102.4	45%	0.45	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-37.2	171.8	-176.3	62.5	0	0	0	112	A297 L298 Q304 H305	A297-L301 VanDerWaalsContact O-CB 3.3Å; A297-L301 WeakPolarHBondContact O-CB 3.18Å; A297-L301 PolarHBondContact O-N 2.98Å; L298-L301 PolarHBondContact O-N 3.2Å; L301-Q304 PolarHBondContact O-N 2.9Å; L301-H305 PolarHBondContact O-N 2.97Å; L301-H305 VanDerWaalsContact O-N 3.1Å; L301-H305 PolarHBondContact O-ND1 3.44Å
302	Q	94.6	Very high	96.4	Very high	109 Å²	109	102.7 Å²	102.7	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-50.9	170.5	-174.7	62.9	51.7	0	0	110.2	L298 E300 Q304 H305 D306	L298-Q302 WeakPolarHBondContact O-CB 3.35Å; L298-Q302 PolarHBondContact O-N 3Å; E300-Q302 VanDerWaalsContact C-N 3.32Å; E300-Q302 PolarHBondContact O-N 2.73Å; Q302-Q304 PolarHBondContact O-N 3.25Å; Q302-Q304 VanDerWaalsContact O-N 3.07Å; Q302-H305 PolarHBondContact O-N 2.86Å; Q302-D306 PolarHBondContact NE2-OD1 3.3Å; Q302-D306 PolarHBondContact O-N 3.03Å
303	R	98.1	Very high	96.4	Very high	139 Å²	139	101 Å²	101	53%	0.525	48%	0.483	S	S	.	.	H	α-helix	trans	-58	-24.5	175.7	-78.2	-179	164.3	85	2	113.9	E299 E300 R307	E299-R303 WeakPolarHBondContact O-CG 3.47Å; E299-R303 PolarHBondContact O-N 3.38Å; E300-R303 CarbonylContact O-C 3.56Å; E300-R303 PolarHBondContact O-N 3.48Å; R303-R307 WeakPolarHBondContact O-CG 3.49Å; R303-R307 PolarHBondContact O-N 3.42Å; R303-R307 PolarHBondContact O-NE 2.94Å; R303-R307 PolarHBondContact O-NH2 3.43Å
304	Q	96.5	Very high	96.5	Very high	88 Å²	88	103.9 Å²	103.9	41%	0.411	49%	0.487	S	S	.	.	H	α-helix	trans	-77.9	-45.2	174.8	-74.9	170.3	16.1	0	0	111.3	E300 L301 Q302 D306 R307 Q308	E300-Q304 VanDerWaalsContact O-CG 3.27Å; E300-Q304 WeakPolarHBondContact O-CG 3.49Å; E300-Q304 PolarHBondContact O-N 3.39Å; E300-Q304 PolarHBondContact OE1-NE2 3.17Å; L301-Q304 PolarHBondContact O-N 2.9Å; Q302-Q304 PolarHBondContact O-N 3.25Å; Q302-Q304 VanDerWaalsContact O-N 3.07Å; Q304-D306 VanDerWaalsContact C-N 3.34Å; Q304-D306 PolarHBondContact O-N 2.94Å; Q304-R307 PolarHBondContact O-N 3.17Å; Q304-R307 VanDerWaalsContact O-N 3.11Å; Q304-Q308 WeakPolarHBondContact O-CG 3.44Å; Q304-Q308 PolarHBondContact O-N 2.97Å
305	H	96.1	Very high	96.6	Very high	98 Å²	98	102.3 Å²	102.3	45%	0.454	48%	0.48	S	S	.	.	H	α-helix	trans	-58.6	-45.4	169.4	-73.9	83.4	0	0	0	111.4	L301 Q302 R307 Q308 M309	L301-H305 PolarHBondContact O-N 2.97Å; L301-H305 VanDerWaalsContact O-N 3.1Å; L301-H305 PolarHBondContact O-ND1 3.44Å; Q302-H305 PolarHBondContact O-N 2.86Å; H305-R307 PolarHBondContact O-N 3.26Å; H305-R307 VanDerWaalsContact O-N 3.14Å; H305-Q308 PolarHBondContact O-N 3.05Å; H305-M309 WeakPolarHBondContact O-CB 3.16Å; H305-M309 WeakPolarHBondContact O-CG 3.38Å; H305-M309 PolarHBondContact O-N 2.96Å
306	D	94.9	Very high	96.7	Very high	68 Å²	68	103.5 Å²	103.5	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-21.8	177.3	-58.2	-20.9	0	0	0	112.9	Q302 Q304 R310	Q302-D306 PolarHBondContact NE2-OD1 3.3Å; Q302-D306 PolarHBondContact O-N 3.03Å; Q304-D306 VanDerWaalsContact C-N 3.34Å; Q304-D306 PolarHBondContact O-N 2.94Å; D306-R310 VanDerWaalsContact O-CZ 3.27Å; D306-R310 PolarHBondContact O-NE 3.36Å; D306-R310 PolarHBondContact O-NH2 2.83Å
307	R	98.1	Very high	96.6	Very high	98 Å²	98	104.4 Å²	104.4	37%	0.37	49%	0.493	S	S	.	.	H	α-helix	trans	-83.6	-49.9	172.6	-86.7	172.7	-82.3	-170.6	1	110.7	E300 R303 Q304 H305 M309 R310 E311	E300-R307 VanDerWaalsContact CD-NH2 3.33Å; E300-R307 IonicContact OE1-CZ 2.87Å; E300-R307 IonicContact OE1-NH1 3.73Å; E300-R307 IonicContact OE1-NH2 2.93Å; E300-R307 PolarHBondContact OE1-NH2 2.92Å; E300-R307 IonicContact OE2-NH2 3.86Å; E300-R307 PolarHBondContact OE2-NH2 3.05Å; R303-R307 WeakPolarHBondContact O-CG 3.49Å; R303-R307 PolarHBondContact O-N 3.42Å; R303-R307 PolarHBondContact O-NE 2.94Å; R303-R307 PolarHBondContact O-NH2 3.43Å; Q304-R307 PolarHBondContact O-N 3.17Å; Q304-R307 VanDerWaalsContact O-N 3.11Å; H305-R307 PolarHBondContact O-N 3.26Å; H305-R307 VanDerWaalsContact O-N 3.14Å; R307-M309 VanDerWaalsContact C-N 3.32Å; R307-M309 PolarHBondContact O-N 3.49Å; R307-R310 PolarHBondContact O-N 3.23Å; R307-R310 VanDerWaalsContact O-N 3.16Å; R307-E311 WeakPolarHBondContact O-CG 3.42Å; R307-E311 PolarHBondContact O-N 2.91Å
308	Q	97.2	Very high	96.7	Very high	108 Å²	108	106.9 Å²	106.9	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-59.5	-39.2	178.4	-70.2	177.4	-39.9	0	0	112.9	Q304 H305 E311 L312	Q304-Q308 WeakPolarHBondContact O-CG 3.44Å; Q304-Q308 PolarHBondContact O-N 2.97Å; H305-Q308 PolarHBondContact O-N 3.05Å; Q308-E311 PolarHBondContact O-N 2.93Å; Q308-L312 WeakPolarHBondContact O-CB 3.36Å; Q308-L312 VanDerWaalsContact O-CG 3.28Å; Q308-L312 WeakPolarHBondContact O-CG 3.29Å; Q308-L312 PolarHBondContact O-N 2.8Å
309	M	95.1	Very high	96.8	Very high	105 Å²	105	105.3 Å²	105.3	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-47.8	174.7	-73	-58.4	-57.9	0	0	111.6	H305 R307 E311 L312 E313	H305-M309 WeakPolarHBondContact O-CB 3.16Å; H305-M309 WeakPolarHBondContact O-CG 3.38Å; H305-M309 PolarHBondContact O-N 2.96Å; R307-M309 VanDerWaalsContact C-N 3.32Å; R307-M309 PolarHBondContact O-N 3.49Å; M309-E311 PolarHBondContact O-N 2.85Å; M309-L312 PolarHBondContact O-N 3.44Å; M309-E313 WeakPolarHBondContact O-CB 3.42Å; M309-E313 VanDerWaalsContact O-CG 3.25Å; M309-E313 WeakPolarHBondContact O-CG 3.46Å; M309-E313 PolarHBondContact O-N 3.01Å
310	R	97.4	Very high	96.8	Very high	139 Å²	139	106.5 Å²	106.5	53%	0.525	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-34.5	177.4	-79.3	177.9	-70.6	148.6	1.3	113.2	D306 R307 E313 M314	D306-R310 VanDerWaalsContact O-CZ 3.27Å; D306-R310 PolarHBondContact O-NE 3.36Å; D306-R310 PolarHBondContact O-NH2 2.83Å; R307-R310 PolarHBondContact O-N 3.23Å; R307-R310 VanDerWaalsContact O-N 3.16Å; R310-E313 WeakPolarHBondContact CA-OE2 3.4Å; R310-E313 PolarHBondContact O-N 3.41Å; R310-M314 WeakPolarHBondContact O-CB 3.34Å; R310-M314 WeakPolarHBondContact O-CG 3.39Å; R310-M314 PolarHBondContact O-N 3.47Å
311	E	97.6	Very high	96.8	Very high	112 Å²	112	109 Å²	109	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-64.9	-42.3	173.9	-72.8	163.5	-165.5	0	0	111.3	R307 Q308 M309 M314 E315	R307-E311 WeakPolarHBondContact O-CG 3.42Å; R307-E311 PolarHBondContact O-N 2.91Å; Q308-E311 PolarHBondContact O-N 2.93Å; M309-E311 PolarHBondContact O-N 2.85Å; E311-M314 HydrophobicContact CG-CE 4.45Å; E311-E315 WeakPolarHBondContact O-CB 3.32Å; E311-E315 PolarHBondContact O-N 2.96Å
312	L	96.9	Very high	96.8	Very high	119 Å²	119	109.3 Å²	109.3	62%	0.623	50%	0.504	S	S	*	.	H	α-helix	trans	-68.6	-36.8	174.3	-69.6	168.7	0	0	0	112.8	Q308 M309 K316	Q308-L312 WeakPolarHBondContact O-CB 3.36Å; Q308-L312 VanDerWaalsContact O-CG 3.28Å; Q308-L312 WeakPolarHBondContact O-CG 3.29Å; Q308-L312 PolarHBondContact O-N 2.8Å; M309-L312 PolarHBondContact O-N 3.44Å; L312-K316 VanDerWaalsContact O-CB 3.28Å; L312-K316 WeakPolarHBondContact O-CB 3.22Å; L312-K316 PolarHBondContact O-N 3.25Å
313	E	95.1	Very high	96.8	Very high	101 Å²	101	109.7 Å²	109.7	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-47.9	174.4	-74.5	164.8	165.5	0	0	111.3	M309 R310 E315 K316 E317	M309-E313 WeakPolarHBondContact O-CB 3.42Å; M309-E313 VanDerWaalsContact O-CG 3.25Å; M309-E313 WeakPolarHBondContact O-CG 3.46Å; M309-E313 PolarHBondContact O-N 3.01Å; R310-E313 WeakPolarHBondContact CA-OE2 3.4Å; R310-E313 PolarHBondContact O-N 3.41Å; E313-E315 PolarHBondContact O-N 2.63Å; E313-K316 WeakPolarHBondContact O-CB 3.26Å; E313-K316 PolarHBondContact O-N 3.07Å; E313-E317 WeakPolarHBondContact O-CG 3.2Å; E313-E317 PolarHBondContact O-N 3.31Å
314	M	97.9	Very high	96.7	Very high	122 Å²	122	107 Å²	107	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-62.1	-41.5	175.6	-72.5	-172.1	-55.9	0	0	112.5	R310 E311 E317 R318	R310-M314 WeakPolarHBondContact O-CB 3.34Å; R310-M314 WeakPolarHBondContact O-CG 3.39Å; R310-M314 PolarHBondContact O-N 3.47Å; E311-M314 HydrophobicContact CG-CE 4.45Å; M314-E317 PolarHBondContact O-N 3.25Å; M314-R318 WeakPolarHBondContact O-CB 3.49Å; M314-R318 PolarHBondContact O-N 3.41Å
315	E	97.2	Very high	96.8	Very high	83 Å²	83	110.3 Å²	110.3	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-36.7	178.5	-178.1	58	-164.4	0	0	111.8	E311 E313 R318 L319	E311-E315 WeakPolarHBondContact O-CB 3.32Å; E311-E315 PolarHBondContact O-N 2.96Å; E313-E315 PolarHBondContact O-N 2.63Å; E315-R318 VanDerWaalsContact CD-NE 3.33Å; E315-R318 PolarHBondContact O-N 3.31Å; E315-R318 IonicContact OE1-CZ 3.92Å; E315-R318 IonicContact OE1-NE 2.65Å; E315-R318 PolarHBondContact OE1-NE 3.22Å; E315-R318 IonicContact OE1-NH2 3.29Å; E315-R318 PolarHBondContact OE1-NH2 3.39Å; E315-R318 WeakPolarHBondContact OE2-CD 3.37Å; E315-R318 IonicContact OE2-CZ 2.63Å; E315-R318 IonicContact OE2-NE 3.08Å; E315-R318 PolarHBondContact OE2-NE 3.42Å; E315-R318 IonicContact OE2-NH2 2.71Å; E315-L319 HydrophobicContact CG-CD1 4.13Å; E315-L319 WeakPolarHBondContact O-CB 3.16Å; E315-L319 WeakPolarHBondContact O-CG 3.37Å; E315-L319 PolarHBondContact O-N 3.01Å
316	K	96.9	Very high	96.6	Very high	152 Å²	152	109 Å²	109	66%	0.661	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-46.4	170.6	174.6	-171.8	171.2	-170.9	0	111.6	L312 E313 R318 L319 L320	L312-K316 VanDerWaalsContact O-CB 3.28Å; L312-K316 WeakPolarHBondContact O-CB 3.22Å; L312-K316 PolarHBondContact O-N 3.25Å; E313-K316 WeakPolarHBondContact O-CB 3.26Å; E313-K316 PolarHBondContact O-N 3.07Å; K316-R318 VanDerWaalsContact C-N 3.34Å; K316-L319 PolarHBondContact O-N 3.02Å; K316-L320 VanDerWaalsContact O-CB 3.32Å; K316-L320 WeakPolarHBondContact O-CB 3.36Å; K316-L320 PolarHBondContact O-N 2.9Å
317	E	96.4	Very high	96.6	Very high	138 Å²	138	109.6 Å²	109.6	65%	0.645	52%	0.516	S	S	*	.	H	α-helix	trans	-63.6	-40	176.2	-73.1	-174.4	168.3	0	0	111.9	E313 M314 L320 L321	E313-E317 WeakPolarHBondContact O-CG 3.2Å; E313-E317 PolarHBondContact O-N 3.31Å; M314-E317 PolarHBondContact O-N 3.25Å; E317-L320 PolarHBondContact O-N 3.25Å; E317-L321 WeakPolarHBondContact O-CB 3.21Å; E317-L321 PolarHBondContact O-N 3.05Å
318	R	98.1	Very high	96.4	Very high	110 Å²	110	107.4 Å²	107.4	42%	0.415	52%	0.519	S	S	.	.	H	α-helix	trans	-60.9	-47.3	176.1	-165.4	-161.3	68	66.3	1.8	111.7	M314 E315 K316 L321 E322	M314-R318 WeakPolarHBondContact O-CB 3.49Å; M314-R318 PolarHBondContact O-N 3.41Å; E315-R318 VanDerWaalsContact CD-NE 3.33Å; E315-R318 PolarHBondContact O-N 3.31Å; E315-R318 IonicContact OE1-CZ 3.92Å; E315-R318 IonicContact OE1-NE 2.65Å; E315-R318 PolarHBondContact OE1-NE 3.22Å; E315-R318 IonicContact OE1-NH2 3.29Å; E315-R318 PolarHBondContact OE1-NH2 3.39Å; E315-R318 WeakPolarHBondContact OE2-CD 3.37Å; E315-R318 IonicContact OE2-CZ 2.63Å; E315-R318 IonicContact OE2-NE 3.08Å; E315-R318 PolarHBondContact OE2-NE 3.42Å; E315-R318 IonicContact OE2-NH2 2.71Å; K316-R318 VanDerWaalsContact C-N 3.34Å; R318-L321 PolarHBondContact O-N 3.45Å; R318-E322 IonicContact CZ-OE2 2.69Å; R318-E322 IonicContact NH1-OE2 2.63Å; R318-E322 PolarHBondContact NH1-OE2 2.65Å; R318-E322 IonicContact NH2-OE2 3.98Å; R318-E322 PolarHBondContact O-N 3.24Å
319	L	97.3	Very high	96.3	Very high	86 Å²	86	108.2 Å²	108.2	45%	0.45	52%	0.518	S	S	.	.	H	α-helix	trans	-66.4	-41.4	177.9	-73.9	167.2	0	0	0	112.1	E315 K316 L321 E322 E323	E315-L319 HydrophobicContact CG-CD1 4.13Å; E315-L319 WeakPolarHBondContact O-CB 3.16Å; E315-L319 WeakPolarHBondContact O-CG 3.37Å; E315-L319 PolarHBondContact O-N 3.01Å; K316-L319 PolarHBondContact O-N 3.02Å; L319-L321 VanDerWaalsContact C-N 3.32Å; L319-L321 PolarHBondContact O-N 3.19Å; L319-E322 PolarHBondContact O-N 3.11Å; L319-E322 VanDerWaalsContact O-N 3.16Å; L319-E323 PolarHBondContact O-N 3.01Å
320	L	97.4	Very high	96.3	Very high	102 Å²	102	107.3 Å²	107.3	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-40.1	176.2	-175.5	68.8	0	0	0	111.8	K316 E317 E322 T324	K316-L320 VanDerWaalsContact O-CB 3.32Å; K316-L320 WeakPolarHBondContact O-CB 3.36Å; K316-L320 PolarHBondContact O-N 2.9Å; E317-L320 PolarHBondContact O-N 3.25Å; L320-E322 VanDerWaalsContact C-N 3.35Å; L320-T324 VanDerWaalsContact O-CB 3.27Å; L320-T324 WeakPolarHBondContact O-CB 3.42Å; L320-T324 PolarHBondContact O-N 3.18Å; L320-T324 PolarHBondContact O-OG1 2.78Å
321	L	97.7	Very high	95.8	Very high	127 Å²	127	105.6 Å²	105.6	67%	0.665	52%	0.517	S	S	*	.	H	α-helix	trans	-67.7	-35	175.4	-175.3	63.4	0	0	0	112.1	E317 R318 L319 R325	E317-L321 WeakPolarHBondContact O-CB 3.21Å; E317-L321 PolarHBondContact O-N 3.05Å; R318-L321 PolarHBondContact O-N 3.45Å; L319-L321 VanDerWaalsContact C-N 3.32Å; L319-L321 PolarHBondContact O-N 3.19Å; L321-R325 WeakPolarHBondContact O-CB 3.41Å; L321-R325 PolarHBondContact O-N 2.71Å
322	E	97.3	Very high	95.6	Very high	92 Å²	92	106.9 Å²	106.9	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-68.7	-48.6	175.8	-171.3	156.2	-137.2	0	0	111.8	R318 L319 L320 T324 R325 D326	R318-E322 IonicContact CZ-OE2 2.69Å; R318-E322 IonicContact NH1-OE2 2.63Å; R318-E322 PolarHBondContact NH1-OE2 2.65Å; R318-E322 IonicContact NH2-OE2 3.98Å; R318-E322 PolarHBondContact O-N 3.24Å; L319-E322 PolarHBondContact O-N 3.11Å; L319-E322 VanDerWaalsContact O-N 3.16Å; L320-E322 VanDerWaalsContact C-N 3.35Å; E322-T324 VanDerWaalsContact C-N 3.33Å; E322-T324 PolarHBondContact O-N 2.91Å; E322-R325 WeakPolarHBondContact O-CB 3.31Å; E322-R325 PolarHBondContact O-N 3.21Å; E322-R325 VanDerWaalsContact O-N 3.13Å; E322-D326 PolarHBondContact O-N 3.42Å
323	E	94.1	Very high	95.5	Very high	116 Å²	116	103.8 Å²	103.8	54%	0.542	51%	0.514	S	S	.	.	H	α-helix	trans	-60.1	-41.1	173.6	-174.6	-178.1	-176.5	0	0	111.7	L319 R325 D326 T327	L319-E323 PolarHBondContact O-N 3.01Å; E323-R325 VanDerWaalsContact C-N 3.32Å; E323-R325 PolarHBondContact O-N 2.91Å; E323-D326 PolarHBondContact O-N 2.86Å; E323-T327 VanDerWaalsContact O-CB 3.29Å; E323-T327 WeakPolarHBondContact O-CB 3.43Å; E323-T327 PolarHBondContact O-N 3.3Å; E323-T327 PolarHBondContact O-OG1 2.91Å
324	T	96.3	Very high	95.2	Very high	82 Å²	82	104.3 Å²	104.3	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-41.8	175.5	-61.5	0	0	0	0	111.2	L320 E322 A328	L320-T324 VanDerWaalsContact O-CB 3.27Å; L320-T324 WeakPolarHBondContact O-CB 3.42Å; L320-T324 PolarHBondContact O-N 3.18Å; L320-T324 PolarHBondContact O-OG1 2.78Å; E322-T324 VanDerWaalsContact C-N 3.33Å; E322-T324 PolarHBondContact O-N 2.91Å; T324-A328 WeakPolarHBondContact O-CB 3.5Å; T324-A328 PolarHBondContact O-N 3.06Å
325	R	96.9	Very high	94.9	Very high	158 Å²	158	105.1 Å²	105.1	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-67.6	-41	178.8	-173.1	-177.4	-171.5	-176.2	4.3	112.2	L321 E322 E323 A328 R329	L321-R325 WeakPolarHBondContact O-CB 3.41Å; L321-R325 PolarHBondContact O-N 2.71Å; E322-R325 WeakPolarHBondContact O-CB 3.31Å; E322-R325 PolarHBondContact O-N 3.21Å; E322-R325 VanDerWaalsContact O-N 3.13Å; E323-R325 VanDerWaalsContact C-N 3.32Å; E323-R325 PolarHBondContact O-N 2.91Å; R325-A328 PolarHBondContact O-N 3.04Å; R325-R329 WeakPolarHBondContact O-CD 3.33Å; R325-R329 WeakPolarHBondContact O-CG 3.34Å; R325-R329 PolarHBondContact O-N 3.39Å
326	D	93.8	Very high	94.8	Very high	72 Å²	72	107.5 Å²	107.5	39%	0.385	53%	0.529	S	S	.	.	H	α-helix	trans	-73.2	-37	178	-79.5	-14.3	0	0	0	112.4	E322 E323 A328 R329 V330	E322-D326 PolarHBondContact O-N 3.42Å; E323-D326 PolarHBondContact O-N 2.86Å; D326-A328 VanDerWaalsContact C-N 3.29Å; D326-A328 PolarHBondContact O-N 3.33Å; D326-R329 WeakPolarHBondContact O-CB 3.46Å; D326-R329 PolarHBondContact O-N 2.97Å; D326-R329 WeakPolarHBondContact OD1-CD 3.31Å; D326-R329 IonicContact OD1-CZ 2.69Å; D326-R329 IonicContact OD1-NE 3.19Å; D326-R329 IonicContact OD1-NH1 3.96Å; D326-R329 PolarHBondContact OD1-NH1 2.92Å; D326-V330 WeakPolarHBondContact O-CG2 3.2Å; D326-V330 PolarHBondContact O-N 3Å
327	T	93.6	Very high	94.7	Very high	80 Å²	80	105.9 Å²	105.9	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-58	-42.8	168.9	-58.8	0	0	0	0	111.1	E323 V330 M331	E323-T327 VanDerWaalsContact O-CB 3.29Å; E323-T327 WeakPolarHBondContact O-CB 3.43Å; E323-T327 PolarHBondContact O-N 3.3Å; E323-T327 PolarHBondContact O-OG1 2.91Å; T327-V330 PolarHBondContact O-N 2.99Å; T327-M331 WeakPolarHBondContact O-CB 3.41Å; T327-M331 WeakPolarHBondContact O-CG 3.43Å; T327-M331 PolarHBondContact O-N 3.49Å
328	A	94.3	Very high	94.3	Very high	52 Å²	52	105.3 Å²	105.3	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-44.3	174.7	0	0	0	0	0	112.5	T324 R325 D326 V330 M331 E332	T324-A328 WeakPolarHBondContact O-CB 3.5Å; T324-A328 PolarHBondContact O-N 3.06Å; R325-A328 PolarHBondContact O-N 3.04Å; D326-A328 VanDerWaalsContact C-N 3.29Å; D326-A328 PolarHBondContact O-N 3.33Å; A328-V330 PolarHBondContact O-N 3.18Å; A328-M331 WeakPolarHBondContact O-CB 3.21Å; A328-M331 PolarHBondContact O-N 2.75Å; A328-E332 PolarHBondContact O-N 2.95Å
329	R	95.1	Very high	94	Very high	125 Å²	125	105.9 Å²	105.9	47%	0.472	53%	0.525	S	S	.	.	H	α-helix	trans	-58.5	-45	175.4	-74.7	157.5	156.7	172	-7.2	112.2	R325 D326 E332 A333	R325-R329 WeakPolarHBondContact O-CD 3.33Å; R325-R329 WeakPolarHBondContact O-CG 3.34Å; R325-R329 PolarHBondContact O-N 3.39Å; D326-R329 WeakPolarHBondContact O-CB 3.46Å; D326-R329 PolarHBondContact O-N 2.97Å; D326-R329 WeakPolarHBondContact OD1-CD 3.31Å; D326-R329 IonicContact OD1-CZ 2.69Å; D326-R329 IonicContact OD1-NE 3.19Å; D326-R329 IonicContact OD1-NH1 3.96Å; D326-R329 PolarHBondContact OD1-NH1 2.92Å; R329-E332 PolarHBondContact O-N 3.24Å; R329-A333 WeakPolarHBondContact O-CB 3.4Å; R329-A333 PolarHBondContact O-N 3.23Å
330	V	94.8	Very high	93.7	Very high	86 Å²	86	103.6 Å²	103.6	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-44.7	176.5	172.2	0	0	0	0	110.8	D326 T327 A328 E332 A333 L334	D326-V330 WeakPolarHBondContact O-CG2 3.2Å; D326-V330 PolarHBondContact O-N 3Å; T327-V330 PolarHBondContact O-N 2.99Å; A328-V330 PolarHBondContact O-N 3.18Å; V330-E332 VanDerWaalsContact C-N 3.34Å; V330-E332 PolarHBondContact O-N 2.91Å; V330-A333 PolarHBondContact O-N 3.34Å; V330-L334 HydrophobicContact CG1-CD1 3.98Å; V330-L334 HydrophobicContact CG1-CG 4.41Å; V330-L334 WeakPolarHBondContact O-CB 3.49Å; V330-L334 WeakPolarHBondContact O-CG 3.34Å; V330-L334 PolarHBondContact O-N 3.43Å
331	M	87.2	Confident	93.3	Very high	103 Å²	103	104.5 Å²	104.5	51%	0.507	51%	0.513	S	S	.	.	H	α-helix	trans	-59.6	-40	175.5	-77.3	-92	-88.1	0	0	112.8	T327 A328 K335	T327-M331 WeakPolarHBondContact O-CB 3.41Å; T327-M331 WeakPolarHBondContact O-CG 3.43Å; T327-M331 PolarHBondContact O-N 3.49Å; A328-M331 WeakPolarHBondContact O-CB 3.21Å; A328-M331 PolarHBondContact O-N 2.75Å; M331-K335 WeakPolarHBondContact O-CB 3.17Å; M331-K335 WeakPolarHBondContact O-CD 3.44Å; M331-K335 WeakPolarHBondContact O-CG 3.42Å; M331-K335 PolarHBondContact O-N 2.7Å
332	E	93	Very high	92.7	Very high	138 Å²	138	103.6 Å²	103.6	65%	0.645	51%	0.508	S	S	*	.	H	α-helix	trans	-69.4	-40.5	174.3	-72.8	-167.7	150.7	0	0	112.7	A328 R329 V330 L334 K335 K336	A328-E332 PolarHBondContact O-N 2.95Å; R329-E332 PolarHBondContact O-N 3.24Å; V330-E332 VanDerWaalsContact C-N 3.34Å; V330-E332 PolarHBondContact O-N 2.91Å; E332-L334 PolarHBondContact O-N 2.87Å; E332-K335 PolarHBondContact O-N 3.11Å; E332-K336 WeakPolarHBondContact O-CB 3.46Å; E332-K336 PolarHBondContact O-N 3.21Å
333	A	94.6	Very high	92.2	Very high	54 Å²	54	104.2 Å²	104.2	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-43.1	175.9	0	0	0	0	0	111.9	R329 V330 K336 K337	R329-A333 WeakPolarHBondContact O-CB 3.4Å; R329-A333 PolarHBondContact O-N 3.23Å; V330-A333 PolarHBondContact O-N 3.34Å; A333-K336 PolarHBondContact O-N 3.26Å; A333-K337 WeakPolarHBondContact O-CB 3.41Å; A333-K337 WeakPolarHBondContact O-CG 3.29Å; A333-K337 PolarHBondContact O-N 2.83Å
334	L	88.7	Confident	92.1	Very high	113 Å²	113	105 Å²	105	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-63.6	-48.8	174.6	-71.2	171.1	0	0	0	111.7	V330 E332 K336 K337 H338	V330-L334 HydrophobicContact CG1-CD1 3.98Å; V330-L334 HydrophobicContact CG1-CG 4.41Å; V330-L334 WeakPolarHBondContact O-CB 3.49Å; V330-L334 WeakPolarHBondContact O-CG 3.34Å; V330-L334 PolarHBondContact O-N 3.43Å; E332-L334 PolarHBondContact O-N 2.87Å; L334-K336 VanDerWaalsContact C-N 3.3Å; L334-K336 PolarHBondContact O-N 2.88Å; L334-K337 PolarHBondContact O-N 3.3Å; L334-H338 WeakPolarHBondContact O-CB 3.02Å; L334-H338 PolarHBondContact O-N 3.33Å
335	K	92.6	Very high	91.4	Very high	138 Å²	138	105.2 Å²	105.2	60%	0.6	51%	0.505	S	S	*	.	H	α-helix	trans	-56.8	-42.7	175	-74.8	167.7	-175.6	176.3	0	111.9	M331 E332 K339	M331-K335 WeakPolarHBondContact O-CB 3.17Å; M331-K335 WeakPolarHBondContact O-CD 3.44Å; M331-K335 WeakPolarHBondContact O-CG 3.42Å; M331-K335 PolarHBondContact O-N 2.7Å; E332-K335 PolarHBondContact O-N 3.11Å; K335-K339 WeakPolarHBondContact O-CB 3.4Å; K335-K339 PolarHBondContact O-N 2.96Å
336	K	95.1	Very high	90.6	Very high	134 Å²	134	102.2 Å²	102.2	58%	0.583	50%	0.504	S	S	*	.	H	α-helix	trans	-64.3	-45.9	176.2	-176.8	-179.3	175.3	-176.9	0	111.5	E332 A333 L334 K339 E340	E332-K336 WeakPolarHBondContact O-CB 3.46Å; E332-K336 PolarHBondContact O-N 3.21Å; A333-K336 PolarHBondContact O-N 3.26Å; L334-K336 VanDerWaalsContact C-N 3.3Å; L334-K336 PolarHBondContact O-N 2.88Å; K336-K339 PolarHBondContact O-N 3.17Å; K336-E340 WeakPolarHBondContact CE-OE1 3.47Å; K336-E340 WeakPolarHBondContact O-CG 3.43Å; K336-E340 PolarHBondContact O-N 2.9Å
337	K	94.6	Very high	89.9	Confident	117 Å²	117	102.2 Å²	102.2	51%	0.509	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-45.1	179.7	-79.5	-72.8	158.9	-156	0	112.3	A333 L334 K339 E340 E341	A333-K337 WeakPolarHBondContact O-CB 3.41Å; A333-K337 WeakPolarHBondContact O-CG 3.29Å; A333-K337 PolarHBondContact O-N 2.83Å; L334-K337 PolarHBondContact O-N 3.3Å; K337-K339 VanDerWaalsContact C-N 3.32Å; K337-K339 PolarHBondContact O-N 3.39Å; K337-E340 IonicContact NZ-OE1 2.97Å; K337-E340 PolarHBondContact NZ-OE1 3.42Å; K337-E340 IonicContact NZ-OE2 2.62Å; K337-E340 PolarHBondContact NZ-OE2 3.35Å; K337-E340 PolarHBondContact O-N 3.41Å; K337-E341 WeakPolarHBondContact O-CB 3.35Å; K337-E341 PolarHBondContact O-N 3.5Å
338	H	88.8	Confident	89.3	Confident	127 Å²	127	103 Å²	103	59%	0.588	50%	0.498	S	S	*	.	H	α-helix	trans	-60.4	-39.5	174.3	-173.4	73.7	0	0	0	112.1	L334 E341 L342	L334-H338 WeakPolarHBondContact O-CB 3.02Å; L334-H338 PolarHBondContact O-N 3.33Å; H338-E341 PolarHBondContact O-N 3.48Å; H338-L342 WeakPolarHBondContact O-CB 3.46Å; H338-L342 PolarHBondContact O-N 3.27Å
339	K	90.1	Very high	88.4	Confident	122 Å²	122	104 Å²	104	53%	0.53	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-48	173.1	-176.4	176.3	-173.9	-81	0	112.5	K335 K336 K337 E341 L342 E343	K335-K339 WeakPolarHBondContact O-CB 3.4Å; K335-K339 PolarHBondContact O-N 2.96Å; K336-K339 PolarHBondContact O-N 3.17Å; K337-K339 VanDerWaalsContact C-N 3.32Å; K337-K339 PolarHBondContact O-N 3.39Å; K339-E341 PolarHBondContact O-N 2.96Å; K339-L342 PolarHBondContact O-N 2.91Å; K339-E343 WeakPolarHBondContact CE-OE1 3.32Å; K339-E343 IonicContact NZ-OE1 3.83Å; K339-E343 PolarHBondContact NZ-OE1 3.42Å; K339-E343 WeakPolarHBondContact O-CB 3.2Å; K339-E343 WeakPolarHBondContact O-CG 3.5Å; K339-E343 PolarHBondContact O-N 3.23Å
340	E	91.4	Very high	87.5	Confident	37 Å²	37	106.6 Å²	106.6	17%	0.173	51%	0.508	C	S	.	.	H	α-helix	trans	-59.7	-35.6	176.6	-69	173.7	-160.5	0	0	111.8	K336 K337 R344	K336-E340 WeakPolarHBondContact CE-OE1 3.47Å; K336-E340 WeakPolarHBondContact O-CG 3.43Å; K336-E340 PolarHBondContact O-N 2.9Å; K337-E340 IonicContact NZ-OE1 2.97Å; K337-E340 PolarHBondContact NZ-OE1 3.42Å; K337-E340 IonicContact NZ-OE2 2.62Å; K337-E340 PolarHBondContact NZ-OE2 3.35Å; K337-E340 PolarHBondContact O-N 3.41Å; E340-R344 VanDerWaalsContact C-NH1 3.3Å; E340-R344 VanDerWaalsContact O-CG 3.29Å; E340-R344 WeakPolarHBondContact O-CG 3.36Å; E340-R344 PolarHBondContact O-N 3.38Å; E340-R344 PolarHBondContact O-NH1 2.86Å; E340-R344 IonicContact OE2-CZ 3.39Å; E340-R344 IonicContact OE2-NH1 2.7Å; E340-R344 IonicContact OE2-NH2 2.66Å; E340-R344 PolarHBondContact OE2-NH2 3.3Å
341	E	88.6	Confident	86.6	Confident	122 Å²	122	109.7 Å²	109.7	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-72.1	-45.1	179.2	-173.3	158.7	-132.2	0	0	112.1	K337 H338 K339 E343 R344 E345	K337-E341 WeakPolarHBondContact O-CB 3.35Å; K337-E341 PolarHBondContact O-N 3.5Å; H338-E341 PolarHBondContact O-N 3.48Å; K339-E341 PolarHBondContact O-N 2.96Å; E341-E343 VanDerWaalsContact C-N 3.29Å; E341-E343 PolarHBondContact O-N 2.96Å; E341-R344 WeakPolarHBondContact O-CB 3.5Å; E341-R344 PolarHBondContact O-N 3.3Å; E341-R344 VanDerWaalsContact O-N 3.16Å; E341-E345 PolarHBondContact O-N 3.12Å
342	L	86.3	Confident	85.6	Confident	108 Å²	108	109.2 Å²	109.2	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-58.6	-41	171.6	-172.8	65.6	0	0	0	111.7	H338 K339 E345 V346	H338-L342 WeakPolarHBondContact O-CB 3.46Å; H338-L342 PolarHBondContact O-N 3.27Å; K339-L342 PolarHBondContact O-N 2.91Å; L342-E345 PolarHBondContact O-N 2.99Å; L342-V346 WeakPolarHBondContact O-CB 3.46Å; L342-V346 VanDerWaalsContact O-CG2 3.29Å; L342-V346 WeakPolarHBondContact O-CG2 3.45Å; L342-V346 PolarHBondContact O-N 3.48Å
343	E	86.9	Confident	84.1	Confident	105 Å²	105	107.6 Å²	107.6	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-63.9	-41.9	174.5	-75.3	171.7	172.1	0	0	112.4	K339 E341 E345 E347	K339-E343 WeakPolarHBondContact CE-OE1 3.32Å; K339-E343 IonicContact NZ-OE1 3.83Å; K339-E343 PolarHBondContact NZ-OE1 3.42Å; K339-E343 WeakPolarHBondContact O-CB 3.2Å; K339-E343 WeakPolarHBondContact O-CG 3.5Å; K339-E343 PolarHBondContact O-N 3.23Å; E341-E343 VanDerWaalsContact C-N 3.29Å; E341-E343 PolarHBondContact O-N 2.96Å; E343-E345 VanDerWaalsContact C-N 3.34Å; E343-E345 PolarHBondContact O-N 3.38Å; E343-E347 WeakPolarHBondContact O-CB 3.47Å; E343-E347 PolarHBondContact O-N 2.93Å
344	R	91.9	Very high	82.6	Confident	133 Å²	133	109.8 Å²	109.8	50%	0.502	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-40.1	174.5	-74.4	174.6	-159.3	102.1	7.6	112.1	E340 E341 E347 K348	E340-R344 VanDerWaalsContact C-NH1 3.3Å; E340-R344 VanDerWaalsContact O-CG 3.29Å; E340-R344 WeakPolarHBondContact O-CG 3.36Å; E340-R344 PolarHBondContact O-N 3.38Å; E340-R344 PolarHBondContact O-NH1 2.86Å; E340-R344 IonicContact OE2-CZ 3.39Å; E340-R344 IonicContact OE2-NH1 2.7Å; E340-R344 IonicContact OE2-NH2 2.66Å; E340-R344 PolarHBondContact OE2-NH2 3.3Å; E341-R344 WeakPolarHBondContact O-CB 3.5Å; E341-R344 PolarHBondContact O-N 3.3Å; E341-R344 VanDerWaalsContact O-N 3.16Å; R344-E347 PolarHBondContact O-N 3.23Å; R344-K348 PolarHBondContact O-N 3.49Å
345	E	80.6	Confident	81.2	Confident	86 Å²	86	107.2 Å²	107.2	40%	0.402	53%	0.527	S	S	.	.	H	α-helix	trans	-75.2	-41.1	-177	-156.4	57.7	-145.1	0	0	112	E341 L342 E343 E347 K348 V349	E341-E345 PolarHBondContact O-N 3.12Å; L342-E345 PolarHBondContact O-N 2.99Å; E343-E345 VanDerWaalsContact C-N 3.34Å; E343-E345 PolarHBondContact O-N 3.38Å; E345-E347 VanDerWaalsContact C-N 3.28Å; E345-E347 PolarHBondContact O-N 2.94Å; E345-K348 WeakPolarHBondContact O-CB 3.41Å; E345-K348 PolarHBondContact O-N 3.25Å; E345-K348 VanDerWaalsContact O-N 3.09Å; E345-K348 WeakPolarHBondContact OE1-CD 3.5Å; E345-K348 WeakPolarHBondContact OE1-CE 3.22Å; E345-K348 IonicContact OE1-NZ 2.79Å; E345-K348 PolarHBondContact OE1-NZ 2.88Å; E345-K348 WeakPolarHBondContact OE2-CE 3.38Å; E345-K348 IonicContact OE2-NZ 2.95Å; E345-K348 PolarHBondContact OE2-NZ 2.89Å; E345-V349 WeakPolarHBondContact O-CG2 3.46Å; E345-V349 PolarHBondContact O-N 3.48Å
346	V	80.3	Confident	79.5	Confident	95 Å²	95	110 Å²	110	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-56.9	-42.3	170.1	168.4	0	0	0	0	110.9	L342 V349 R350	L342-V346 WeakPolarHBondContact O-CB 3.46Å; L342-V346 VanDerWaalsContact O-CG2 3.29Å; L342-V346 WeakPolarHBondContact O-CG2 3.45Å; L342-V346 PolarHBondContact O-N 3.48Å; V346-V349 PolarHBondContact O-N 3.5Å; V346-R350 WeakPolarHBondContact O-CB 3.2Å; V346-R350 PolarHBondContact O-N 2.98Å
347	E	79.8	Confident	77.5	Confident	72 Å²	72	110.5 Å²	110.5	34%	0.336	55%	0.547	S	S	.	.	H	α-helix	trans	-73.4	-26.7	176.9	-172.6	52.7	-145.1	0	0	112.9	E343 R344 E345 R350 R351	E343-E347 WeakPolarHBondContact O-CB 3.47Å; E343-E347 PolarHBondContact O-N 2.93Å; R344-E347 PolarHBondContact O-N 3.23Å; E345-E347 VanDerWaalsContact C-N 3.28Å; E345-E347 PolarHBondContact O-N 2.94Å; E347-R350 WeakPolarHBondContact OE2-CD 3.47Å; E347-R351 WeakPolarHBondContact O-CG 3.2Å; E347-R351 PolarHBondContact O-N 2.93Å; E347-R351 VanDerWaalsContact O-N 3.11Å; E347-R351 PolarHBondContact O-NE 3.48Å; E347-R351 IonicContact OE1-NE 3.16Å
348	K	81.2	Confident	75.6	Confident	95 Å²	95	110 Å²	110	41%	0.413	55%	0.55	S	S	.	.	H	α-helix	trans	-65.3	-50	168.7	-162.6	-164.4	-58.4	160.6	0	110.5	R344 E345 R350 R351 L352	R344-K348 PolarHBondContact O-N 3.49Å; E345-K348 WeakPolarHBondContact O-CB 3.41Å; E345-K348 PolarHBondContact O-N 3.25Å; E345-K348 VanDerWaalsContact O-N 3.09Å; E345-K348 WeakPolarHBondContact OE1-CD 3.5Å; E345-K348 WeakPolarHBondContact OE1-CE 3.22Å; E345-K348 IonicContact OE1-NZ 2.79Å; E345-K348 PolarHBondContact OE1-NZ 2.88Å; E345-K348 WeakPolarHBondContact OE2-CE 3.38Å; E345-K348 IonicContact OE2-NZ 2.95Å; E345-K348 PolarHBondContact OE2-NZ 2.89Å; K348-R350 VanDerWaalsContact C-N 3.34Å; K348-R350 PolarHBondContact O-N 3.39Å; K348-R351 PolarHBondContact O-N 3.41Å; K348-L352 HydrophobicContact CG-CD1 4.31Å; K348-L352 WeakPolarHBondContact O-CG 3.3Å; K348-L352 PolarHBondContact O-N 3.15Å
349	V	74.8	Confident	74	Confident	74 Å²	74	107.8 Å²	107.8	45%	0.448	55%	0.549	S	S	.	.	H	α-helix	trans	-59.8	-42.7	175.7	173.5	0	0	0	0	111.2	E345 V346 R351 L352 S353	E345-V349 WeakPolarHBondContact O-CG2 3.46Å; E345-V349 PolarHBondContact O-N 3.48Å; V346-V349 PolarHBondContact O-N 3.5Å; V349-R351 PolarHBondContact O-N 3.28Å; V349-L352 PolarHBondContact O-N 3.06Å; V349-S353 WeakPolarHBondContact O-CB 3.48Å; V349-S353 PolarHBondContact O-N 3.38Å
350	R	77.1	Confident	72.4	Confident	179 Å²	179	109 Å²	109	68%	0.675	56%	0.556	S	S	*	*	H	α-helix	trans	-58	-46.1	176.5	-170	-174	-169.1	148	3.6	112.4	V346 E347 K348 S353 S354	V346-R350 WeakPolarHBondContact O-CB 3.2Å; V346-R350 PolarHBondContact O-N 2.98Å; E347-R350 WeakPolarHBondContact OE2-CD 3.47Å; K348-R350 VanDerWaalsContact C-N 3.34Å; K348-R350 PolarHBondContact O-N 3.39Å; R350-S353 PolarHBondContact O-N 3.07Å; R350-S354 PolarHBondContact O-N 2.91Å
351	R	76	Confident	70.8	Confident	151 Å²	151	111.4 Å²	111.4	57%	0.57	57%	0.574	S	S	*	*	H	α-helix	trans	-67.2	-42.5	178.4	-73.8	175.8	-67.1	-150	1.3	112.1	E347 K348 V349 S353 S354	E347-R351 WeakPolarHBondContact O-CG 3.2Å; E347-R351 PolarHBondContact O-N 2.93Å; E347-R351 VanDerWaalsContact O-N 3.11Å; E347-R351 PolarHBondContact O-NE 3.48Å; E347-R351 IonicContact OE1-NE 3.16Å; K348-R351 PolarHBondContact O-N 3.41Å; V349-R351 PolarHBondContact O-N 3.28Å; R351-S353 VanDerWaalsContact C-N 3.29Å; R351-S353 PolarHBondContact O-N 3.49Å; R351-S354 WeakPolarHBondContact O-CB 3.44Å; R351-S354 PolarHBondContact O-N 3.42Å; R351-S354 VanDerWaalsContact O-N 3.09Å
352	L	66.2	Low	69.3	Low	94 Å²	94	109.5 Å²	109.5	49%	0.492	57%	0.567	S	S	.	*	H	α-helix	trans	-60.1	-39.9	174.3	-69.9	168.4	0	0	0	111.7	K348 V349 S354	K348-L352 HydrophobicContact CG-CD1 4.31Å; K348-L352 WeakPolarHBondContact O-CG 3.3Å; K348-L352 PolarHBondContact O-N 3.15Å; V349-L352 PolarHBondContact O-N 3.06Å; L352-S354 PolarHBondContact O-N 2.88Å
353	S	60.4	Low	68.1	Low	103 Å²	103	108.9 Å²	108.9	72%	0.72	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-4.1	176.5	-170.7	0	0	0	0	114.7	V349 R350 R351	V349-S353 WeakPolarHBondContact O-CB 3.48Å; V349-S353 PolarHBondContact O-N 3.38Å; R350-S353 PolarHBondContact O-N 3.07Å; R351-S353 VanDerWaalsContact C-N 3.29Å; R351-S353 PolarHBondContact O-N 3.49Å
354	S	63	Low	66.8	Low	100 Å²	100	107.9 Å²	107.9	70%	0.699	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-18.7	-179.6	-160.3	0	0	0	0	113.2	R350 R351 L352	R350-S354 PolarHBondContact O-N 2.91Å; R351-S354 WeakPolarHBondContact O-CB 3.44Å; R351-S354 PolarHBondContact O-N 3.42Å; R351-S354 VanDerWaalsContact O-N 3.09Å; L352-S354 PolarHBondContact O-N 2.88Å
355	G	59.8	Low	65.2	Low	60 Å²	60	108.3 Å²	108.3	62%	0.619	57%	0.57	S	S	*	*	S	Bend	trans	-84.6	116.5	175.3	0	0	0	0	0	111.5
356	K	57.8	Low	64.3	Low	196 Å²	196	108.7 Å²	108.7	85%	0.852	57%	0.571	S	S	*	*			trans	-111.1	85.2	-171.2	-166.8	-178.1	179.8	-179.5	0	114.4
357	L	52.1	Low	63.6	Low	144 Å²	144	107.6 Å²	107.6	75%	0.754	56%	0.56	S	S	*	*	S	Bend	trans	-149.2	158.2	142.9	-151.6	58.5	0	0	0	108.8	S359	L357-S359 VanDerWaalsContact C-N 3.31Å; L357-S359 PolarHBondContact O-N 2.86Å
358	D	54.8	Low	63.1	Low	106 Å²	106	113.9 Å²	113.9	57%	0.567	58%	0.581	S	S	*	*			trans	53.4	38.6	-177.3	-76.2	24.4	0	0	0	116.6	H360 T361 L362	D358-H360 PolarHBondContact O-N 3.24Å; D358-T361 PolarHBondContact O-N 2.8Å; D358-L362 PolarHBondContact O-N 3.18Å; D358-L362 VanDerWaalsContact O-N 3.16Å
359	S	55.8	Low	62.9	Low	81 Å²	81	113.1 Å²	113.1	57%	0.566	59%	0.586	S	S	*	*	H	α-helix	trans	-53.4	-22.8	-179.7	-172.7	0	0	0	0	115.5	L357 Q363	L357-S359 VanDerWaalsContact C-N 3.31Å; L357-S359 PolarHBondContact O-N 2.86Å; S359-Q363 WeakPolarHBondContact O-CB 3.35Å
360	H	56.4	Low	62.9	Low	147 Å²	147	116.4 Å²	116.4	68%	0.681	59%	0.59	S	S	*	*	H	α-helix	trans	-92.3	-38.4	-177.9	-159.9	36.5	0	0	0	112.6	D358 T364	D358-H360 PolarHBondContact O-N 3.24Å; H360-T364 WeakPolarHBondContact O-CB 3.41Å; H360-T364 PolarHBondContact O-N 2.96Å; H360-T364 PolarHBondContact O-OG1 3.39Å
361	T	57.2	Low	63	Low	89 Å²	89	115.8 Å²	115.8	55%	0.546	59%	0.588	S	S	.	*	H	α-helix	trans	-69.3	-50.5	179.2	-32	0	0	0	0	110.6	D358 Q363 T364 Q365	D358-T361 PolarHBondContact O-N 2.8Å; T361-Q363 PolarHBondContact O-N 3.43Å; T361-T364 PolarHBondContact O-N 3.4Å; T361-Q365 WeakPolarHBondContact O-CB 3.41Å; T361-Q365 PolarHBondContact O-N 3.38Å
362	L	57.7	Low	63.4	Low	82 Å²	82	111.4 Å²	111.4	43%	0.429	58%	0.584	S	S	.	*	H	α-helix	trans	-60.9	-44	175.6	-86.1	159	0	0	0	112	D358 T364 Q365 Q366	D358-L362 PolarHBondContact O-N 3.18Å; D358-L362 VanDerWaalsContact O-N 3.16Å; L362-T364 PolarHBondContact O-N 2.98Å; L362-Q365 PolarHBondContact O-N 2.79Å; L362-Q366 WeakPolarHBondContact O-CB 3.46Å; L362-Q366 WeakPolarHBondContact O-CG 3.44Å; L362-Q366 PolarHBondContact O-N 3.06Å
363	Q	59.7	Low	64.3	Low	95 Å²	95	112.6 Å²	112.6	44%	0.444	59%	0.587	S	S	.	*	H	α-helix	trans	-62.9	-42.7	178.4	-176.1	171.2	32.6	0	0	111.6	S359 T361 Q365 H367	S359-Q363 WeakPolarHBondContact O-CB 3.35Å; T361-Q363 PolarHBondContact O-N 3.43Å; Q363-Q365 VanDerWaalsContact C-N 3.34Å; Q363-Q365 PolarHBondContact O-N 2.74Å; Q363-H367 WeakPolarHBondContact CG-CD2 3.48Å; Q363-H367 WeakPolarHBondContact O-CB 3.19Å; Q363-H367 PolarHBondContact O-CD2 2.86Å; Q363-H367 VanDerWaalsContact O-CD2 3.24Å; Q363-H367 PolarHBondContact O-N 2.7Å
364	T	60	Low	65.4	Low	83 Å²	83	109.6 Å²	109.6	51%	0.509	56%	0.564	S	S	.	*	H	α-helix	trans	-65.5	-38	176.6	-56.3	0	0	0	0	111.9	H360 T361 L362	H360-T364 WeakPolarHBondContact O-CB 3.41Å; H360-T364 PolarHBondContact O-N 2.96Å; H360-T364 PolarHBondContact O-OG1 3.39Å; T361-T364 PolarHBondContact O-N 3.4Å; L362-T364 PolarHBondContact O-N 2.98Å
365	Q	59.1	Low	66.8	Low	143 Å²	143	108.6 Å²	108.6	67%	0.668	55%	0.551	S	S	*	*	H	α-helix	trans	-74.2	-36	-179.9	-163	174.6	74.9	0	0	112.8	T361 L362 Q363 P369	T361-Q365 WeakPolarHBondContact O-CB 3.41Å; T361-Q365 PolarHBondContact O-N 3.38Å; L362-Q365 PolarHBondContact O-N 2.79Å; Q363-Q365 VanDerWaalsContact C-N 3.34Å; Q363-Q365 PolarHBondContact O-N 2.74Å; Q365-P369 WeakPolarHBondContact O-CD 3.35Å
366	Q	60.6	Low	68.3	Low	93 Å²	93	107.5 Å²	107.5	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-81.1	-34.9	177	-71.6	-175.5	-3.1	0	0	113.9	L362 R368 P369 W370	L362-Q366 WeakPolarHBondContact O-CB 3.46Å; L362-Q366 WeakPolarHBondContact O-CG 3.44Å; L362-Q366 PolarHBondContact O-N 3.06Å; Q366-R368 VanDerWaalsContact C-N 3.28Å; Q366-R368 PolarHBondContact O-N 3.38Å; Q366-P369 WeakPolarHBondContact O-CD 3.21Å; Q366-W370 PolarHBondContact O-N 3.47Å
367	H	66.5	Low	69.9	Low	72 Å²	72	103 Å²	103	33%	0.333	52%	0.521	S	S	.	.	H	α-helix	trans	-69	-22.4	177.8	-87.2	-74.2	0	0	0	113.5	Q363 R371	Q363-H367 WeakPolarHBondContact CG-CD2 3.48Å; Q363-H367 WeakPolarHBondContact O-CB 3.19Å; Q363-H367 PolarHBondContact O-CD2 2.86Å; Q363-H367 VanDerWaalsContact O-CD2 3.24Å; Q363-H367 PolarHBondContact O-N 2.7Å; H367-R371 WeakPolarHBondContact O-CB 3.33Å; H367-R371 WeakPolarHBondContact O-CG 3.38Å; H367-R371 PolarHBondContact O-N 2.96Å
368	R	69.5	Low	71.7	Confident	204 Å²	204	101.9 Å²	101.9	77%	0.77	51%	0.511	S	S	*	.	H	α-helix	trans	-64.4	-56.6	176.5	-100.3	-169.8	178.9	-133.7	4.8	111.9	Q366 R371 A372	Q366-R368 VanDerWaalsContact C-N 3.28Å; Q366-R368 PolarHBondContact O-N 3.38Å; R368-R371 PolarHBondContact O-N 2.95Å; R368-A372 PolarHBondContact O-N 3.44Å; R368-A372 VanDerWaalsContact O-N 3.1Å
369	P	75.9	Confident	73.6	Confident	80 Å²	80	105 Å²	105	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-54.8	-51.6	172.7	-27.3	35	0	0	0	112.5	Q365 Q366 R371 A372 E373	Q365-P369 WeakPolarHBondContact O-CD 3.35Å; Q366-P369 WeakPolarHBondContact O-CD 3.21Å; P369-R371 VanDerWaalsContact C-N 3.33Å; P369-R371 PolarHBondContact O-N 3.04Å; P369-A372 WeakPolarHBondContact O-CA 3.49Å; P369-A372 WeakPolarHBondContact O-CB 3.3Å; P369-A372 PolarHBondContact O-N 2.96Å; P369-E373 WeakPolarHBondContact O-CB 3.35Å; P369-E373 PolarHBondContact O-N 2.62Å
370	W	76.3	Confident	75.5	Confident	143 Å²	143	106.6 Å²	106.6	54%	0.542	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-36.1	-175.5	-169.1	84.2	0	0	0	113.3	Q366 T374	Q366-W370 PolarHBondContact O-N 3.47Å; W370-T374 VanDerWaalsContact O-CB 3.29Å; W370-T374 WeakPolarHBondContact O-CB 3.45Å; W370-T374 PolarHBondContact O-N 2.91Å; W370-T374 PolarHBondContact O-OG1 3.2Å
371	R	77.8	Confident	77.4	Confident	165 Å²	165	105.5 Å²	105.5	62%	0.623	51%	0.512	S	S	*	.	H	α-helix	trans	-68	-37.2	171.7	-74.7	175.5	-172.7	-164.1	4.8	112.3	H367 R368 P369 L375	H367-R371 WeakPolarHBondContact O-CB 3.33Å; H367-R371 WeakPolarHBondContact O-CG 3.38Å; H367-R371 PolarHBondContact O-N 2.96Å; R368-R371 PolarHBondContact O-N 2.95Å; P369-R371 VanDerWaalsContact C-N 3.33Å; P369-R371 PolarHBondContact O-N 3.04Å; R371-L375 WeakPolarHBondContact O-CB 3.26Å; R371-L375 PolarHBondContact O-N 3.42Å
372	A	84.3	Confident	79.2	Confident	60 Å²	60	103.8 Å²	103.8	50%	0.496	51%	0.507	S	S	.	.	H	α-helix	trans	-68.3	-42.1	178.2	0	0	0	0	0	111.6	R368 P369 L375 A376	R368-A372 PolarHBondContact O-N 3.44Å; R368-A372 VanDerWaalsContact O-N 3.1Å; P369-A372 WeakPolarHBondContact O-CA 3.49Å; P369-A372 WeakPolarHBondContact O-CB 3.3Å; P369-A372 PolarHBondContact O-N 2.96Å; A372-L375 PolarHBondContact O-N 2.88Å; A372-A376 PolarHBondContact O-N 2.93Å
373	E	86.1	Confident	81	Confident	119 Å²	119	100.8 Å²	100.8	56%	0.556	50%	0.496	S	S	*	.	H	α-helix	trans	-64.3	-45.4	174	-175.6	171.3	-140.6	0	0	111.7	P369 L375 A376 L377	P369-E373 WeakPolarHBondContact O-CB 3.35Å; P369-E373 PolarHBondContact O-N 2.62Å; E373-L375 VanDerWaalsContact C-N 3.28Å; E373-L375 PolarHBondContact O-N 3.11Å; E373-A376 WeakPolarHBondContact O-CB 3.36Å; E373-A376 PolarHBondContact O-N 3.38Å; E373-L377 HydrophobicContact CG-CD1 4.47Å; E373-L377 WeakPolarHBondContact O-CG 3.43Å; E373-L377 PolarHBondContact O-N 3.5Å
374	T	82.2	Confident	82.7	Confident	39 Å²	39	101 Å²	101	24%	0.239	50%	0.5	C	S	.	.	H	α-helix	trans	-58.7	-39.9	172.3	-58	0	0	0	0	111.6	W370 Q378	W370-T374 VanDerWaalsContact O-CB 3.29Å; W370-T374 WeakPolarHBondContact O-CB 3.45Å; W370-T374 PolarHBondContact O-N 2.91Å; W370-T374 PolarHBondContact O-OG1 3.2Å; T374-Q378 WeakPolarHBondContact O-CB 3.26Å; T374-Q378 VanDerWaalsContact O-CG 3.31Å; T374-Q378 WeakPolarHBondContact O-CG 3.47Å; T374-Q378 PolarHBondContact O-N 3.08Å
375	L	92.8	Very high	84.3	Confident	80 Å²	80	100.5 Å²	100.5	42%	0.419	50%	0.499	S	S	.	.	H	α-helix	trans	-69.4	-31.6	174.4	-111.9	72.2	0	0	0	113.3	R371 A372 E373 R379	R371-L375 WeakPolarHBondContact O-CB 3.26Å; R371-L375 PolarHBondContact O-N 3.42Å; A372-L375 PolarHBondContact O-N 2.88Å; E373-L375 VanDerWaalsContact C-N 3.28Å; E373-L375 PolarHBondContact O-N 3.11Å; L375-R379 WeakPolarHBondContact O-CD 3.43Å; L375-R379 VanDerWaalsContact O-CG 3.24Å; L375-R379 WeakPolarHBondContact O-CG 3.43Å; L375-R379 PolarHBondContact O-N 3.26Å; L375-R379 VanDerWaalsContact O-N 3.11Å
376	A	91.8	Very high	86.1	Confident	36 Å²	36	100.1 Å²	100.1	30%	0.298	50%	0.498	S	S	.	.	H	α-helix	trans	-67.2	-52.4	174.3	0	0	0	0	0	110.1	A372 E373 Q378 R379 E380	A372-A376 PolarHBondContact O-N 2.93Å; E373-A376 WeakPolarHBondContact O-CB 3.36Å; E373-A376 PolarHBondContact O-N 3.38Å; A376-Q378 VanDerWaalsContact C-N 3.29Å; A376-Q378 PolarHBondContact O-N 2.91Å; A376-R379 WeakPolarHBondContact O-CB 3.45Å; A376-R379 PolarHBondContact O-N 3.33Å; A376-E380 PolarHBondContact O-N 3.37Å
377	L	90.9	Very high	87.8	Confident	103 Å²	103	103 Å²	103	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-58.7	-38	176	-66.6	171.8	0	0	0	112.3	E373 E380 L381	E373-L377 HydrophobicContact CG-CD1 4.47Å; E373-L377 WeakPolarHBondContact O-CG 3.43Å; E373-L377 PolarHBondContact O-N 3.5Å; L377-E380 PolarHBondContact O-N 2.86Å; L377-L381 VanDerWaalsContact O-CB 3.24Å; L377-L381 WeakPolarHBondContact O-CB 3.3Å; L377-L381 PolarHBondContact O-N 3.43Å
378	Q	91.4	Very high	89.2	Confident	120 Å²	120	107.5 Å²	107.5	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-64.8	-38.8	173.2	-80.8	-177.7	-23.9	0	0	113.1	T374 A376 A382	T374-Q378 WeakPolarHBondContact O-CB 3.26Å; T374-Q378 VanDerWaalsContact O-CG 3.31Å; T374-Q378 WeakPolarHBondContact O-CG 3.47Å; T374-Q378 PolarHBondContact O-N 3.08Å; A376-Q378 VanDerWaalsContact C-N 3.29Å; A376-Q378 PolarHBondContact O-N 2.91Å; Q378-A382 VanDerWaalsContact O-CB 3.27Å; Q378-A382 WeakPolarHBondContact O-CB 3.48Å; Q378-A382 PolarHBondContact O-N 3.45Å
379	R	94.4	Very high	90.4	Very high	170 Å²	170	100.7 Å²	100.7	64%	0.642	50%	0.503	S	S	*	.	H	α-helix	trans	-69.1	-40.7	175.4	-72.8	166.7	-179	138	-6.4	112	L375 A376 A382 G383	L375-R379 WeakPolarHBondContact O-CD 3.43Å; L375-R379 VanDerWaalsContact O-CG 3.24Å; L375-R379 WeakPolarHBondContact O-CG 3.43Å; L375-R379 PolarHBondContact O-N 3.26Å; L375-R379 VanDerWaalsContact O-N 3.11Å; A376-R379 WeakPolarHBondContact O-CB 3.45Å; A376-R379 PolarHBondContact O-N 3.33Å; R379-A382 PolarHBondContact O-N 3Å; R379-G383 PolarHBondContact O-N 3.3Å
380	E	95.9	Very high	91.5	Very high	116 Å²	116	102 Å²	102	54%	0.542	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-45.8	175.9	-73.1	174	-156.5	0	0	111.3	A376 L377 A382 G383 L384	A376-E380 PolarHBondContact O-N 3.37Å; L377-E380 PolarHBondContact O-N 2.86Å; E380-A382 VanDerWaalsContact C-N 3.35Å; E380-A382 PolarHBondContact O-N 2.96Å; E380-G383 PolarHBondContact O-N 3.27Å; E380-L384 WeakPolarHBondContact O-CB 3.43Å; E380-L384 VanDerWaalsContact O-CG 3.27Å; E380-L384 WeakPolarHBondContact O-CG 3.29Å; E380-L384 PolarHBondContact O-N 3.28Å
381	L	94.6	Very high	92.5	Very high	124 Å²	124	100.4 Å²	100.4	65%	0.649	50%	0.5	S	S	*	.	H	α-helix	trans	-61.1	-42.8	174.6	-167	78.4	0	0	0	111.5	L377 L384 S385	L377-L381 VanDerWaalsContact O-CB 3.24Å; L377-L381 WeakPolarHBondContact O-CB 3.3Å; L377-L381 PolarHBondContact O-N 3.43Å; L381-L384 PolarHBondContact O-N 3.22Å; L381-S385 WeakPolarHBondContact O-CB 3.32Å; L381-S385 PolarHBondContact O-N 2.77Å; L381-S385 PolarHBondContact O-OG 2.93Å
382	A	94.8	Very high	93.3	Very high	52 Å²	52	94.5 Å²	94.5	43%	0.43	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-52.8	175.4	0	0	0	0	0	111.2	Q378 R379 E380 L384 S385 E386	Q378-A382 VanDerWaalsContact O-CB 3.27Å; Q378-A382 WeakPolarHBondContact O-CB 3.48Å; Q378-A382 PolarHBondContact O-N 3.45Å; R379-A382 PolarHBondContact O-N 3Å; E380-A382 VanDerWaalsContact C-N 3.35Å; E380-A382 PolarHBondContact O-N 2.96Å; A382-L384 VanDerWaalsContact C-N 3.3Å; A382-L384 PolarHBondContact O-N 2.85Å; A382-S385 PolarHBondContact O-N 3.27Å; A382-S385 PolarHBondContact O-OG 2.87Å; A382-E386 PolarHBondContact O-N 2.96Å
383	G	96.1	Very high	93.9	Very high	19 Å²	19	96.6 Å²	96.6	20%	0.196	49%	0.485	C	S	.	.	H	α-helix	trans	-65.6	-27.6	178.4	0	0	0	0	0	113.9	R379 E380 R387	R379-G383 PolarHBondContact O-N 3.3Å; E380-G383 PolarHBondContact O-N 3.27Å; G383-R387 WeakPolarHBondContact O-CB 3.48Å; G383-R387 WeakPolarHBondContact O-CG 3.47Å; G383-R387 PolarHBondContact O-N 3.32Å; G383-R387 PolarHBondContact O-NE 3.47Å
384	L	95.9	Very high	94.5	Very high	101 Å²	101	94.5 Å²	94.5	53%	0.529	48%	0.476	S	S	.	.	H	α-helix	trans	-69.9	-42.7	168.3	-75	168.2	0	0	0	111.6	E380 L381 A382 R387 Y388	E380-L384 WeakPolarHBondContact O-CB 3.43Å; E380-L384 VanDerWaalsContact O-CG 3.27Å; E380-L384 WeakPolarHBondContact O-CG 3.29Å; E380-L384 PolarHBondContact O-N 3.28Å; L381-L384 PolarHBondContact O-N 3.22Å; A382-L384 VanDerWaalsContact C-N 3.3Å; A382-L384 PolarHBondContact O-N 2.85Å; L384-R387 PolarHBondContact O-N 2.98Å; L384-Y388 VanDerWaalsContact O-CB 3.31Å; L384-Y388 WeakPolarHBondContact O-CB 3.42Å; L384-Y388 PolarHBondContact O-N 3.36Å
385	S	94.1	Very high	95.2	Very high	72 Å²	72	96.9 Å²	96.9	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-67.3	-34.6	177.7	75.6	0	0	0	0	113.2	L381 A382 S389	L381-S385 WeakPolarHBondContact O-CB 3.32Å; L381-S385 PolarHBondContact O-N 2.77Å; L381-S385 PolarHBondContact O-OG 2.93Å; A382-S385 PolarHBondContact O-N 3.27Å; A382-S385 PolarHBondContact O-OG 2.87Å; S385-S389 WeakPolarHBondContact O-CB 3.47Å; S385-S389 PolarHBondContact O-N 2.85Å; S385-S389 PolarHBondContact O-OG 3.17Å
386	E	96.6	Very high	95.3	Very high	135 Å²	135	97.9 Å²	97.9	63%	0.631	49%	0.492	S	S	*	.	H	α-helix	trans	-65.9	-52.1	173.4	-177.1	173.1	-149.3	0	0	110.5	A382 Y388 S389 Q390	A382-E386 PolarHBondContact O-N 2.96Å; E386-Y388 VanDerWaalsContact C-N 3.29Å; E386-Y388 PolarHBondContact O-N 3.39Å; E386-S389 PolarHBondContact O-N 2.84Å; E386-S389 PolarHBondContact O-OG 2.93Å; E386-Q390 WeakPolarHBondContact O-CB 3.32Å; E386-Q390 PolarHBondContact O-N 3.07Å
387	R	96.1	Very high	95.6	Very high	152 Å²	152	101.6 Å²	101.6	57%	0.574	50%	0.502	S	S	*	.	H	α-helix	trans	-60	-37	175.7	-74.2	175.2	-69.9	-171.2	-0	112.6	G383 L384 K391	G383-R387 WeakPolarHBondContact O-CB 3.48Å; G383-R387 WeakPolarHBondContact O-CG 3.47Å; G383-R387 PolarHBondContact O-N 3.32Å; G383-R387 PolarHBondContact O-NE 3.47Å; L384-R387 PolarHBondContact O-N 2.98Å; R387-K391 WeakPolarHBondContact O-CB 3.4Å; R387-K391 PolarHBondContact O-N 3.42Å
388	Y	95	Very high	95.9	Very high	167 Å²	167	99.1 Å²	99.1	66%	0.655	50%	0.496	S	S	*	.	H	α-helix	trans	-66.8	-48.4	175	-176.2	-99.4	0	0	0	111.9	L384 E386 Q390 K391 C392	L384-Y388 VanDerWaalsContact O-CB 3.31Å; L384-Y388 WeakPolarHBondContact O-CB 3.42Å; L384-Y388 PolarHBondContact O-N 3.36Å; E386-Y388 VanDerWaalsContact C-N 3.29Å; E386-Y388 PolarHBondContact O-N 3.39Å; Y388-Q390 PolarHBondContact O-N 3.16Å; Y388-K391 WeakPolarHBondContact O-CB 3.37Å; Y388-K391 PolarHBondContact O-N 3Å; Y388-K391 VanDerWaalsContact O-N 3.07Å; Y388-C392 VanDerWaalsContact CE1-SG 3.59Å; Y388-C392 PolarHBondContact O-N 2.66Å; Y388-C392 PolarHBondContact O-SG 2.95Å; Y388-C392 VanDerWaalsContact O-SG 3.37Å
389	S	96.3	Very high	96.1	Very high	61 Å²	61	99 Å²	99	43%	0.427	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-37.5	178.7	65.7	0	0	0	0	112.3	S385 E386 K391 C392 L393	S385-S389 WeakPolarHBondContact O-CB 3.47Å; S385-S389 PolarHBondContact O-N 2.85Å; S385-S389 PolarHBondContact O-OG 3.17Å; E386-S389 PolarHBondContact O-N 2.84Å; E386-S389 PolarHBondContact O-OG 2.93Å; S389-K391 PolarHBondContact O-N 3.01Å; S389-C392 PolarHBondContact O-N 3Å; S389-L393 WeakPolarHBondContact O-CG 3.4Å; S389-L393 PolarHBondContact O-N 3.45Å
390	Q	97.3	Very high	96.2	Very high	108 Å²	108	96.5 Å²	96.5	51%	0.505	49%	0.491	S	S	.	.	H	α-helix	trans	-58.4	-45.3	168.6	-178.3	179.4	-20.7	0	0	111.4	E386 Y388 C392 L393 E394	E386-Q390 WeakPolarHBondContact O-CB 3.32Å; E386-Q390 PolarHBondContact O-N 3.07Å; Y388-Q390 PolarHBondContact O-N 3.16Å; Q390-C392 PolarHBondContact O-N 3.44Å; Q390-L393 WeakPolarHBondContact O-CB 3.47Å; Q390-L393 PolarHBondContact O-N 2.94Å; Q390-L393 VanDerWaalsContact O-N 3.15Å; Q390-E394 PolarHBondContact NE2-OE1 2.92Å; Q390-E394 WeakPolarHBondContact O-CG 3.27Å; Q390-E394 PolarHBondContact O-N 2.8Å
391	K	97.4	Very high	96.3	Very high	110 Å²	110	98.1 Å²	98.1	48%	0.478	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-38.7	178	-161.2	73.4	-148.3	165.9	0	112.5	R387 Y388 S389 L393 E394 L395	R387-K391 WeakPolarHBondContact O-CB 3.4Å; R387-K391 PolarHBondContact O-N 3.42Å; Y388-K391 WeakPolarHBondContact O-CB 3.37Å; Y388-K391 PolarHBondContact O-N 3Å; Y388-K391 VanDerWaalsContact O-N 3.07Å; S389-K391 PolarHBondContact O-N 3.01Å; K391-L393 VanDerWaalsContact C-N 3.33Å; K391-L393 PolarHBondContact O-N 2.88Å; K391-E394 WeakPolarHBondContact CE-OE2 3.46Å; K391-E394 IonicContact NZ-OE2 3.52Å; K391-E394 PolarHBondContact NZ-OE2 3.44Å; K391-E394 PolarHBondContact O-N 3.01Å; K391-L395 HydrophobicContact CG-CD1 4.47Å; K391-L395 WeakPolarHBondContact O-CG 3.46Å; K391-L395 PolarHBondContact O-N 3.13Å
392	C	94.9	Very high	96.3	Very high	41 Å²	41	96 Å²	96	28%	0.277	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-40.9	172	-66.1	0	0	0	0	112.1	Y388 S389 Q390 L395 N396	Y388-C392 VanDerWaalsContact CE1-SG 3.59Å; Y388-C392 PolarHBondContact O-N 2.66Å; Y388-C392 PolarHBondContact O-SG 2.95Å; Y388-C392 VanDerWaalsContact O-SG 3.37Å; S389-C392 PolarHBondContact O-N 3Å; Q390-C392 PolarHBondContact O-N 3.44Å; C392-L395 PolarHBondContact O-N 3.08Å; C392-N396 PolarHBondContact O-N 2.91Å; C392-N396 PolarHBondContact O-ND2 3.42Å
393	L	97.8	Very high	96.4	Very high	104 Å²	104	94.8 Å²	94.8	55%	0.545	47%	0.471	S	S	.	.	H	α-helix	trans	-68.6	-32.6	175.6	-69	171.2	0	0	0	112.8	S389 Q390 K391 K397	S389-L393 WeakPolarHBondContact O-CG 3.4Å; S389-L393 PolarHBondContact O-N 3.45Å; Q390-L393 WeakPolarHBondContact O-CB 3.47Å; Q390-L393 PolarHBondContact O-N 2.94Å; Q390-L393 VanDerWaalsContact O-N 3.15Å; K391-L393 VanDerWaalsContact C-N 3.33Å; K391-L393 PolarHBondContact O-N 2.88Å; L393-K397 VanDerWaalsContact O-CD 3.26Å; L393-K397 WeakPolarHBondContact O-CD 3.42Å; L393-K397 WeakPolarHBondContact O-CG 3.43Å; L393-K397 PolarHBondContact O-N 2.65Å
394	E	97.8	Very high	96.5	Very high	75 Å²	75	98.2 Å²	98.2	35%	0.35	48%	0.482	S	S	.	.	H	α-helix	trans	-68	-43.9	171.7	-74	172.5	-163.8	0	0	112	Q390 K391 K397 A398	Q390-E394 PolarHBondContact NE2-OE1 2.92Å; Q390-E394 WeakPolarHBondContact O-CG 3.27Å; Q390-E394 PolarHBondContact O-N 2.8Å; K391-E394 WeakPolarHBondContact CE-OE2 3.46Å; K391-E394 IonicContact NZ-OE2 3.52Å; K391-E394 PolarHBondContact NZ-OE2 3.44Å; K391-E394 PolarHBondContact O-N 3.01Å; E394-K397 PolarHBondContact O-N 3.48Å; E394-A398 PolarHBondContact O-N 3.25Å
395	L	96.7	Very high	96.5	Very high	88 Å²	88	101.4 Å²	101.4	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-48.5	177.9	-73.1	167.8	0	0	0	111.6	K391 C392 K397 A398 E399	K391-L395 HydrophobicContact CG-CD1 4.47Å; K391-L395 WeakPolarHBondContact O-CG 3.46Å; K391-L395 PolarHBondContact O-N 3.13Å; C392-L395 PolarHBondContact O-N 3.08Å; L395-K397 VanDerWaalsContact C-N 3.26Å; L395-K397 PolarHBondContact O-N 2.85Å; L395-A398 CarbonylContact O-C 3.57Å; L395-A398 WeakPolarHBondContact O-CA 3.46Å; L395-A398 WeakPolarHBondContact O-CB 3.5Å; L395-A398 PolarHBondContact O-N 3.3Å; L395-E399 WeakPolarHBondContact O-CG 3.28Å; L395-E399 PolarHBondContact O-N 2.86Å
396	N	96.2	Very high	96.7	Very high	101 Å²	101	103.1 Å²	103.1	54%	0.54	49%	0.487	S	S	.	.	H	α-helix	trans	-56.8	-39.9	175.6	-84.5	-101.5	0	0	0	112.1	C392 A398 Q400	C392-N396 PolarHBondContact O-N 2.91Å; C392-N396 PolarHBondContact O-ND2 3.42Å; N396-A398 VanDerWaalsContact C-N 3.35Å; N396-Q400 WeakPolarHBondContact O-CB 3.31Å; N396-Q400 PolarHBondContact O-N 3.43Å
397	K	97.5	Very high	96.7	Very high	115 Å²	115	103.5 Å²	103.5	50%	0.5	48%	0.483	S	S	.	.	H	α-helix	trans	-68.2	-31.9	175.4	-71.4	165.9	-170.2	170.4	0	112.6	L393 E394 L395 R401	L393-K397 VanDerWaalsContact O-CD 3.26Å; L393-K397 WeakPolarHBondContact O-CD 3.42Å; L393-K397 WeakPolarHBondContact O-CG 3.43Å; L393-K397 PolarHBondContact O-N 2.65Å; E394-K397 PolarHBondContact O-N 3.48Å; L395-K397 VanDerWaalsContact C-N 3.26Å; L395-K397 PolarHBondContact O-N 2.85Å; K397-R401 WeakPolarHBondContact O-CD 3.33Å; K397-R401 WeakPolarHBondContact O-CG 3.24Å; K397-R401 PolarHBondContact O-N 3.23Å
398	A	96.4	Very high	96.8	Very high	51 Å²	51	100 Å²	100	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-73.5	-45.9	175.1	0	0	0	0	0	111.4	E394 L395 N396 Q400 R401 N402	E394-A398 PolarHBondContact O-N 3.25Å; L395-A398 CarbonylContact O-C 3.57Å; L395-A398 WeakPolarHBondContact O-CA 3.46Å; L395-A398 WeakPolarHBondContact O-CB 3.5Å; L395-A398 PolarHBondContact O-N 3.3Å; N396-A398 VanDerWaalsContact C-N 3.35Å; A398-Q400 PolarHBondContact O-N 2.81Å; A398-R401 PolarHBondContact O-N 3.32Å; A398-N402 PolarHBondContact O-N 3.34Å
399	E	96.1	Very high	96.9	Very high	118 Å²	118	95.6 Å²	95.6	55%	0.551	46%	0.463	S	S	*	.	H	α-helix	trans	-58.6	-45.9	175.9	-71.9	167.1	-176.6	0	0	111.7	L395 R401 N402 A403	L395-E399 WeakPolarHBondContact O-CG 3.28Å; L395-E399 PolarHBondContact O-N 2.86Å; E399-R401 PolarHBondContact O-N 3.12Å; E399-N402 PolarHBondContact O-N 3.37Å; E399-N402 VanDerWaalsContact O-N 3.17Å; E399-A403 PolarHBondContact O-N 3.4Å
400	Q	97.3	Very high	97	Very high	117 Å²	117	95.3 Å²	95.3	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-57.8	-48.6	174.9	-178.6	-177.9	-18.8	0	0	111.6	N396 A398 N402 A403 E404	N396-Q400 WeakPolarHBondContact O-CB 3.31Å; N396-Q400 PolarHBondContact O-N 3.43Å; A398-Q400 PolarHBondContact O-N 2.81Å; Q400-N402 PolarHBondContact O-N 2.95Å; Q400-A403 PolarHBondContact O-N 3.36Å; Q400-E404 WeakPolarHBondContact CG-OE1 3.44Å; Q400-E404 PolarHBondContact NE2-OE1 3.3Å; Q400-E404 WeakPolarHBondContact O-CB 3.27Å; Q400-E404 VanDerWaalsContact O-CG 3.31Å; Q400-E404 WeakPolarHBondContact O-CG 3.34Å; Q400-E404 PolarHBondContact O-N 3.04Å
401	R	97.3	Very high	97	Very high	150 Å²	150	96 Å²	96	57%	0.566	46%	0.459	S	S	*	.	H	α-helix	trans	-64.9	-26.9	178.5	-71.2	166.4	-178.3	166.3	-3.3	113.1	K397 A398 E399 R405	K397-R401 WeakPolarHBondContact O-CD 3.33Å; K397-R401 WeakPolarHBondContact O-CG 3.24Å; K397-R401 PolarHBondContact O-N 3.23Å; A398-R401 PolarHBondContact O-N 3.32Å; E399-R401 PolarHBondContact O-N 3.12Å; R401-R405 WeakPolarHBondContact O-CG 3.43Å; R401-R405 PolarHBondContact O-N 2.79Å
402	N	94.2	Very high	97.1	Very high	79 Å²	79	97.4 Å²	97.4	42%	0.422	46%	0.461	S	S	.	.	H	α-helix	trans	-75.4	-49	173.7	-171.8	60.5	0	0	0	110.8	A398 E399 Q400 E404 R405 E406	A398-N402 PolarHBondContact O-N 3.34Å; E399-N402 PolarHBondContact O-N 3.37Å; E399-N402 VanDerWaalsContact O-N 3.17Å; Q400-N402 PolarHBondContact O-N 2.95Å; N402-E404 PolarHBondContact O-N 2.81Å; N402-R405 CarbonylContact O-C 3.5Å; N402-R405 WeakPolarHBondContact O-CA 3.06Å; N402-R405 WeakPolarHBondContact O-CB 3.35Å; N402-R405 PolarHBondContact O-N 2.78Å; N402-E406 PolarHBondContact ND2-OE1 3.28Å; N402-E406 WeakPolarHBondContact O-CG 3.21Å; N402-E406 PolarHBondContact O-N 3.5Å
403	A	97.6	Very high	97.1	Very high	26 Å²	26	100.7 Å²	100.7	22%	0.215	47%	0.473	C	S	.	.	H	α-helix	trans	-61.6	-29.4	174.7	0	0	0	0	0	112.6	E399 Q400 R407	E399-A403 PolarHBondContact O-N 3.4Å; Q400-A403 PolarHBondContact O-N 3.36Å; A403-R407 WeakPolarHBondContact O-CD 3.47Å; A403-R407 WeakPolarHBondContact O-CG 3.32Å; A403-R407 PolarHBondContact O-N 2.9Å; A403-R407 PolarHBondContact O-NH1 3.45Å
404	E	97.1	Very high	97.2	Very high	91 Å²	91	102.5 Å²	102.5	43%	0.425	47%	0.472	S	S	.	.	H	α-helix	trans	-67.1	-43.7	169.7	-76.2	165.8	-174.2	0	0	111.7	Q400 N402 E408	Q400-E404 WeakPolarHBondContact CG-OE1 3.44Å; Q400-E404 PolarHBondContact NE2-OE1 3.3Å; Q400-E404 WeakPolarHBondContact O-CB 3.27Å; Q400-E404 VanDerWaalsContact O-CG 3.31Å; Q400-E404 WeakPolarHBondContact O-CG 3.34Å; Q400-E404 PolarHBondContact O-N 3.04Å; N402-E404 PolarHBondContact O-N 2.81Å; E404-E408 VanDerWaalsContact O-CB 3.3Å; E404-E408 WeakPolarHBondContact O-CB 3.45Å; E404-E408 PolarHBondContact O-N 2.96Å
405	R	97.4	Very high	97.2	Very high	169 Å²	169	102.7 Å²	102.7	64%	0.638	48%	0.476	S	S	*	.	H	α-helix	trans	-62.6	-45.7	173.2	-81.2	174.5	164.2	70.4	0.5	112.6	R401 N402 R407 E408 V409	R401-R405 WeakPolarHBondContact O-CG 3.43Å; R401-R405 PolarHBondContact O-N 2.79Å; N402-R405 CarbonylContact O-C 3.5Å; N402-R405 WeakPolarHBondContact O-CA 3.06Å; N402-R405 WeakPolarHBondContact O-CB 3.35Å; N402-R405 PolarHBondContact O-N 2.78Å; R405-R407 PolarHBondContact O-N 2.82Å; R405-E408 CarbonylContact O-C 3.55Å; R405-E408 WeakPolarHBondContact O-CA 3.26Å; R405-E408 WeakPolarHBondContact O-CB 3.41Å; R405-E408 PolarHBondContact O-N 3.15Å; R405-V409 WeakPolarHBondContact O-CG2 3.45Å; R405-V409 PolarHBondContact O-N 3.28Å
406	E	96.7	Very high	97.2	Very high	107 Å²	107	101.6 Å²	101.6	50%	0.5	47%	0.473	S	S	.	.	H	α-helix	trans	-59.4	-48	179.8	-72.7	169	174.3	0	0	111.6	N402 E408 V409 S410	N402-E406 PolarHBondContact ND2-OE1 3.28Å; N402-E406 WeakPolarHBondContact O-CG 3.21Å; N402-E406 PolarHBondContact O-N 3.5Å; E406-E408 PolarHBondContact O-N 3.28Å; E406-V409 PolarHBondContact O-N 3.38Å; E406-S410 PolarHBondContact O-N 3.28Å; E406-S410 PolarHBondContact O-OG 3.2Å
407	R	98.4	Very high	97.3	Very high	144 Å²	144	100.3 Å²	100.3	54%	0.543	46%	0.463	S	S	.	.	H	α-helix	trans	-58.1	-31.6	174.6	-69.2	172.3	-162.9	113.1	-9.3	112.7	A403 R405 R411	A403-R407 WeakPolarHBondContact O-CD 3.47Å; A403-R407 WeakPolarHBondContact O-CG 3.32Å; A403-R407 PolarHBondContact O-N 2.9Å; A403-R407 PolarHBondContact O-NH1 3.45Å; R405-R407 PolarHBondContact O-N 2.82Å; R407-R411 WeakPolarHBondContact O-CG 3.44Å; R407-R411 PolarHBondContact O-N 2.95Å; R407-R411 VanDerWaalsContact O-N 3.15Å
408	E	97.9	Very high	97.3	Very high	78 Å²	78	100.1 Å²	100.1	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-87.3	-25.1	-176.6	-171.2	56.7	-159.4	0	0	113.1	E404 R405 E406 R411 R412	E404-E408 VanDerWaalsContact O-CB 3.3Å; E404-E408 WeakPolarHBondContact O-CB 3.45Å; E404-E408 PolarHBondContact O-N 2.96Å; R405-E408 CarbonylContact O-C 3.55Å; R405-E408 WeakPolarHBondContact O-CA 3.26Å; R405-E408 WeakPolarHBondContact O-CB 3.41Å; R405-E408 PolarHBondContact O-N 3.15Å; E406-E408 PolarHBondContact O-N 3.28Å; E408-R411 WeakPolarHBondContact OE2-CD 3.18Å; E408-R411 IonicContact OE2-NE 3.72Å; E408-R411 PolarHBondContact OE2-NE 2.92Å; E408-R412 VanDerWaalsContact CD-NH1 3.32Å; E408-R412 VanDerWaalsContact CG-NH1 3.35Å; E408-R412 PolarHBondContact O-N 2.96Å; E408-R412 PolarHBondContact O-NH1 2.92Å; E408-R412 VanDerWaalsContact O-NH1 3.11Å; E408-R412 IonicContact OE1-CZ 3.79Å; E408-R412 IonicContact OE1-NH1 3.34Å; E408-R412 PolarHBondContact OE1-NH1 3.34Å; E408-R412 IonicContact OE1-NH2 2.78Å
409	V	97.3	Very high	97.3	Very high	75 Å²	75	102.8 Å²	102.8	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-68.3	-51	162.7	169.3	0	0	0	0	109.2	R405 E406 R411 R412 E413	R405-V409 WeakPolarHBondContact O-CG2 3.45Å; R405-V409 PolarHBondContact O-N 3.28Å; E406-V409 PolarHBondContact O-N 3.38Å; V409-R411 CarbonylContact O-C 3.52Å; V409-R411 PolarHBondContact O-N 3.41Å; V409-R411 VanDerWaalsContact O-N 3.07Å; V409-R412 CarbonylContact O-C 3.59Å; V409-R412 WeakPolarHBondContact O-CA 3.29Å; V409-R412 WeakPolarHBondContact O-CB 3.37Å; V409-R412 PolarHBondContact O-N 3.23Å; V409-E413 HydrophobicContact CG1-CG 4.1Å; V409-E413 WeakPolarHBondContact O-CG 3.35Å; V409-E413 PolarHBondContact O-N 3.38Å
410	S	97.6	Very high	97.4	Very high	54 Å²	54	104 Å²	104	38%	0.378	47%	0.47	S	S	.	.	H	α-helix	trans	-70.7	-2.4	177.7	-59.2	0	0	0	0	115.1	E406 E413 R414	E406-S410 PolarHBondContact O-N 3.28Å; E406-S410 PolarHBondContact O-OG 3.2Å; S410-E413 WeakPolarHBondContact CA-OE2 3.43Å; S410-E413 PolarHBondContact OG-OE2 2.97Å; S410-R414 PolarHBondContact O-NE 3.33Å; S410-R414 PolarHBondContact O-NH2 2.95Å
411	R	98.4	Very high	97.5	Very high	123 Å²	123	104.5 Å²	104.5	46%	0.464	47%	0.471	S	S	.	.	H	α-helix	trans	-76	-60.3	155.6	-73.8	-179.2	-138.3	-77.5	-4.6	110.4	R407 E408 V409 E413 R414 D415	R407-R411 WeakPolarHBondContact O-CG 3.44Å; R407-R411 PolarHBondContact O-N 2.95Å; R407-R411 VanDerWaalsContact O-N 3.15Å; E408-R411 WeakPolarHBondContact OE2-CD 3.18Å; E408-R411 IonicContact OE2-NE 3.72Å; E408-R411 PolarHBondContact OE2-NE 2.92Å; V409-R411 CarbonylContact O-C 3.52Å; V409-R411 PolarHBondContact O-N 3.41Å; V409-R411 VanDerWaalsContact O-N 3.07Å; R411-E413 PolarHBondContact O-N 3.31Å; R411-E413 VanDerWaalsContact O-N 3.17Å; R411-R414 WeakPolarHBondContact O-CA 3.36Å; R411-R414 WeakPolarHBondContact O-CB 3.37Å; R411-R414 PolarHBondContact O-N 3.35Å; R411-D415 PolarHBondContact O-N 3.35Å
412	R	97.6	Very high	97.5	Very high	139 Å²	139	101.1 Å²	101.1	53%	0.525	46%	0.461	S	S	.	.	H	α-helix	trans	-53	-38.3	179.7	-76.2	171.5	178.6	64.3	6.2	113.6	E408 V409 R414 D415 V416	E408-R412 VanDerWaalsContact CD-NH1 3.32Å; E408-R412 VanDerWaalsContact CG-NH1 3.35Å; E408-R412 PolarHBondContact O-N 2.96Å; E408-R412 PolarHBondContact O-NH1 2.92Å; E408-R412 VanDerWaalsContact O-NH1 3.11Å; E408-R412 IonicContact OE1-CZ 3.79Å; E408-R412 IonicContact OE1-NH1 3.34Å; E408-R412 PolarHBondContact OE1-NH1 3.34Å; E408-R412 IonicContact OE1-NH2 2.78Å; V409-R412 CarbonylContact O-C 3.59Å; V409-R412 WeakPolarHBondContact O-CA 3.29Å; V409-R412 WeakPolarHBondContact O-CB 3.37Å; V409-R412 PolarHBondContact O-N 3.23Å; R412-R414 VanDerWaalsContact C-N 3.35Å; R412-R414 PolarHBondContact O-N 2.87Å; R412-D415 PolarHBondContact O-N 2.88Å; R412-V416 WeakPolarHBondContact O-CB 3.43Å; R412-V416 VanDerWaalsContact O-CG2 3.24Å; R412-V416 WeakPolarHBondContact O-CG2 3.41Å; R412-V416 PolarHBondContact O-N 3.31Å
413	E	96.5	Very high	97.6	Very high	110 Å²	110	100.9 Å²	100.9	51%	0.514	46%	0.46	S	S	.	.	H	α-helix	trans	-60.2	-43.4	176.5	-69.1	173.8	139.6	0	0	112	V409 S410 R411 E417	V409-E413 HydrophobicContact CG1-CG 4.1Å; V409-E413 WeakPolarHBondContact O-CG 3.35Å; V409-E413 PolarHBondContact O-N 3.38Å; S410-E413 WeakPolarHBondContact CA-OE2 3.43Å; S410-E413 PolarHBondContact OG-OE2 2.97Å; R411-E413 PolarHBondContact O-N 3.31Å; R411-E413 VanDerWaalsContact O-N 3.17Å; E413-E417 WeakPolarHBondContact O-CB 3.3Å; E413-E417 PolarHBondContact O-N 3.02Å
414	R	98.4	Very high	97.6	Very high	142 Å²	142	104.4 Å²	104.4	54%	0.536	48%	0.479	S	S	.	.	H	α-helix	trans	-69.8	-40.2	175.4	-76.3	-178.6	-77.2	97.4	-3.4	112.1	S410 R411 R412 E417 Q418	S410-R414 PolarHBondContact O-NE 3.33Å; S410-R414 PolarHBondContact O-NH2 2.95Å; R411-R414 WeakPolarHBondContact O-CA 3.36Å; R411-R414 WeakPolarHBondContact O-CB 3.37Å; R411-R414 PolarHBondContact O-N 3.35Å; R412-R414 VanDerWaalsContact C-N 3.35Å; R412-R414 PolarHBondContact O-N 2.87Å; R414-E417 PolarHBondContact O-N 2.98Å; R414-Q418 PolarHBondContact O-N 3.48Å
415	D	97.8	Very high	97.7	Very high	80 Å²	80	104.7 Å²	104.7	43%	0.428	48%	0.48	S	S	.	.	H	α-helix	trans	-64.9	-43.6	179.3	-52.1	-25.5	0	0	0	110.5	R411 R412 Q418 L419	R411-D415 PolarHBondContact O-N 3.35Å; R412-D415 PolarHBondContact O-N 2.88Å; D415-Q418 PolarHBondContact O-N 3.43Å; D415-L419 VanDerWaalsContact O-CG 3.31Å; D415-L419 WeakPolarHBondContact O-CG 3.4Å; D415-L419 PolarHBondContact O-N 3.35Å
416	V	97.1	Very high	97.7	Very high	65 Å²	65	102 Å²	102	39%	0.394	48%	0.478	S	S	.	.	H	α-helix	trans	-64.9	-39.1	173.8	170.7	0	0	0	0	111.3	R412 L419 R420	R412-V416 WeakPolarHBondContact O-CB 3.43Å; R412-V416 VanDerWaalsContact O-CG2 3.24Å; R412-V416 WeakPolarHBondContact O-CG2 3.41Å; R412-V416 PolarHBondContact O-N 3.31Å; V416-L419 PolarHBondContact O-N 3.35Å; V416-R420 WeakPolarHBondContact O-CG 3.48Å; V416-R420 PolarHBondContact O-N 3.47Å
417	E	97.9	Very high	97.6	Very high	73 Å²	73	102.7 Å²	102.7	34%	0.341	48%	0.479	S	S	.	.	H	α-helix	trans	-70.6	-31	177.9	-175.2	54	-153.3	0	0	113	E413 R414 R420 K421	E413-E417 WeakPolarHBondContact O-CB 3.3Å; E413-E417 PolarHBondContact O-N 3.02Å; R414-E417 PolarHBondContact O-N 2.98Å; E417-R420 WeakPolarHBondContact OE2-CD 3.21Å; E417-R420 IonicContact OE2-CZ 2.68Å; E417-R420 IonicContact OE2-NH1 3.74Å; E417-R420 PolarHBondContact OE2-NH1 3.36Å; E417-K421 WeakPolarHBondContact O-CD 3.22Å; E417-K421 WeakPolarHBondContact O-CG 3.25Å; E417-K421 PolarHBondContact O-N 3.44Å; E417-K421 WeakPolarHBondContact OE1-CE 3.25Å; E417-K421 IonicContact OE1-NZ 2.65Å
418	Q	98.3	Very high	97.6	Very high	112 Å²	112	98.8 Å²	98.8	52%	0.523	47%	0.474	S	S	.	.	H	α-helix	trans	-65.9	-49.9	167.5	177.1	174.9	-25.4	0	0	110.8	R414 D415 R420 K421 E422	R414-Q418 PolarHBondContact O-N 3.48Å; D415-Q418 PolarHBondContact O-N 3.43Å; Q418-R420 PolarHBondContact O-N 2.85Å; Q418-K421 WeakPolarHBondContact O-CB 3.45Å; Q418-K421 PolarHBondContact O-N 2.96Å; Q418-E422 HydrophobicContact CG-CG 4.43Å; Q418-E422 VanDerWaalsContact CG-OE1 3.3Å; Q418-E422 WeakPolarHBondContact CG-OE1 3.48Å; Q418-E422 PolarHBondContact NE2-OE1 2.97Å; Q418-E422 PolarHBondContact O-N 2.94Å
419	L	97.6	Very high	97.5	Very high	106 Å²	106	101.5 Å²	101.5	56%	0.555	48%	0.481	S	S	*	.	H	α-helix	trans	-59.2	-32.4	178.2	-72.6	168.2	0	0	0	112.8	D415 V416 N423	D415-L419 VanDerWaalsContact O-CG 3.31Å; D415-L419 WeakPolarHBondContact O-CG 3.4Å; D415-L419 PolarHBondContact O-N 3.35Å; V416-L419 PolarHBondContact O-N 3.35Å; L419-N423 WeakPolarHBondContact O-CB 3.44Å; L419-N423 PolarHBondContact O-N 2.92Å
420	R	97.7	Very high	97.4	Very high	143 Å²	143	102.6 Å²	102.6	54%	0.54	48%	0.483	S	S	.	.	H	α-helix	trans	-63.3	-44.3	171.2	-76.1	-178.8	-167.6	125.5	1.9	112.3	V416 E417 Q418 N423 V424	V416-R420 WeakPolarHBondContact O-CG 3.48Å; V416-R420 PolarHBondContact O-N 3.47Å; E417-R420 WeakPolarHBondContact OE2-CD 3.21Å; E417-R420 IonicContact OE2-CZ 2.68Å; E417-R420 IonicContact OE2-NH1 3.74Å; E417-R420 PolarHBondContact OE2-NH1 3.36Å; Q418-R420 PolarHBondContact O-N 2.85Å; R420-N423 PolarHBondContact O-N 2.71Å; R420-V424 WeakPolarHBondContact O-CG2 3.48Å; R420-V424 PolarHBondContact O-N 2.84Å
421	K	98.3	Very high	97.2	Very high	128 Å²	128	103.9 Å²	103.9	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-65.6	-45.9	179.2	-70	163.1	-173.6	164.3	0	111.1	E417 Q418 N423 V424 E425	E417-K421 WeakPolarHBondContact O-CD 3.22Å; E417-K421 WeakPolarHBondContact O-CG 3.25Å; E417-K421 PolarHBondContact O-N 3.44Å; E417-K421 WeakPolarHBondContact OE1-CE 3.25Å; E417-K421 IonicContact OE1-NZ 2.65Å; Q418-K421 WeakPolarHBondContact O-CB 3.45Å; Q418-K421 PolarHBondContact O-N 2.96Å; K421-N423 VanDerWaalsContact C-N 3.31Å; K421-N423 PolarHBondContact O-N 2.78Å; K421-V424 PolarHBondContact O-N 2.68Å; K421-E425 PolarHBondContact O-N 2.91Å
422	E	97.9	Very high	97.1	Very high	79 Å²	79	101.3 Å²	101.3	37%	0.369	49%	0.485	S	S	.	.	H	α-helix	trans	-58.9	-41.7	173.2	-68.1	173.6	-171.5	0	0	111.5	Q418 V424 E425 L426	Q418-E422 HydrophobicContact CG-CG 4.43Å; Q418-E422 VanDerWaalsContact CG-OE1 3.3Å; Q418-E422 WeakPolarHBondContact CG-OE1 3.48Å; Q418-E422 PolarHBondContact NE2-OE1 2.97Å; Q418-E422 PolarHBondContact O-N 2.94Å; E422-V424 PolarHBondContact O-N 3.08Å; E422-E425 PolarHBondContact O-N 3.21Å; E422-L426 WeakPolarHBondContact O-CB 3.42Å; E422-L426 VanDerWaalsContact O-CG 3.25Å; E422-L426 WeakPolarHBondContact O-CG 3.45Å; E422-L426 PolarHBondContact O-N 3.33Å
423	N	96.6	Very high	96.9	Very high	75 Å²	75	99.7 Å²	99.7	40%	0.401	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-35.9	177.1	-168.1	-101.7	0	0	0	113.2	L419 R420 K421 K427	L419-N423 WeakPolarHBondContact O-CB 3.44Å; L419-N423 PolarHBondContact O-N 2.92Å; R420-N423 PolarHBondContact O-N 2.71Å; K421-N423 VanDerWaalsContact C-N 3.31Å; K421-N423 PolarHBondContact O-N 2.78Å; N423-K427 WeakPolarHBondContact O-CB 3.5Å; N423-K427 WeakPolarHBondContact O-CD 3.47Å; N423-K427 VanDerWaalsContact O-CG 3.27Å; N423-K427 WeakPolarHBondContact O-CG 3.28Å; N423-K427 PolarHBondContact O-N 2.83Å; N423-K427 VanDerWaalsContact O-N 3.07Å; N423-K427 VanDerWaalsContact OD1-CE 3.23Å; N423-K427 WeakPolarHBondContact OD1-CE 3.49Å; N423-K427 PolarHBondContact OD1-NZ 3.2Å
424	V	97.8	Very high	96.6	Very high	99 Å²	99	99.1 Å²	99.1	60%	0.6	48%	0.482	S	S	*	.	H	α-helix	trans	-68.8	-42.3	173	169.6	0	0	0	0	111	R420 K421 E422 K427 S428	R420-V424 WeakPolarHBondContact O-CG2 3.48Å; R420-V424 PolarHBondContact O-N 2.84Å; K421-V424 PolarHBondContact O-N 2.68Å; E422-V424 PolarHBondContact O-N 3.08Å; V424-K427 PolarHBondContact O-N 2.82Å; V424-S428 PolarHBondContact O-N 3.04Å
425	E	97.8	Very high	96.3	Very high	97 Å²	97	95.1 Å²	95.1	45%	0.453	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-45	177.5	-164.1	-168.6	146.8	0	0	111.6	K421 E422 K427 S428 R429	K421-E425 PolarHBondContact O-N 2.91Å; E422-E425 PolarHBondContact O-N 3.21Å; E425-K427 VanDerWaalsContact C-N 3.31Å; E425-K427 PolarHBondContact O-N 2.7Å; E425-S428 WeakPolarHBondContact O-CB 3.46Å; E425-S428 PolarHBondContact O-N 3.35Å; E425-S428 VanDerWaalsContact O-N 3.14Å; E425-R429 WeakPolarHBondContact O-CG 3.36Å; E425-R429 PolarHBondContact O-N 3.39Å; E425-R429 IonicContact OE1-CZ 2.66Å; E425-R429 IonicContact OE1-NE 3.56Å; E425-R429 PolarHBondContact OE1-NE 3.03Å; E425-R429 IonicContact OE1-NH2 3Å; E425-R429 PolarHBondContact OE1-NH2 3.32Å
426	L	97.4	Very high	96	Very high	113 Å²	113	98.2 Å²	98.2	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-61.4	-38.5	174.9	-72.2	169.9	0	0	0	112	E422 R429 L430	E422-L426 WeakPolarHBondContact O-CB 3.42Å; E422-L426 VanDerWaalsContact O-CG 3.25Å; E422-L426 WeakPolarHBondContact O-CG 3.45Å; E422-L426 PolarHBondContact O-N 3.33Å; L426-R429 PolarHBondContact O-N 2.88Å; L426-L430 VanDerWaalsContact O-CB 3.3Å; L426-L430 WeakPolarHBondContact O-CB 3.29Å; L426-L430 PolarHBondContact O-N 3.32Å
427	K	96.2	Very high	95.3	Very high	121 Å²	121	99.4 Å²	99.4	53%	0.526	49%	0.488	S	S	.	.	H	α-helix	trans	-64.2	-39.9	172.3	-80	166.1	173.9	161.5	0	112.4	N423 V424 E425 T431	N423-K427 WeakPolarHBondContact O-CB 3.5Å; N423-K427 WeakPolarHBondContact O-CD 3.47Å; N423-K427 VanDerWaalsContact O-CG 3.27Å; N423-K427 WeakPolarHBondContact O-CG 3.28Å; N423-K427 PolarHBondContact O-N 2.83Å; N423-K427 VanDerWaalsContact O-N 3.07Å; N423-K427 VanDerWaalsContact OD1-CE 3.23Å; N423-K427 WeakPolarHBondContact OD1-CE 3.49Å; N423-K427 PolarHBondContact OD1-NZ 3.2Å; V424-K427 PolarHBondContact O-N 2.82Å; E425-K427 VanDerWaalsContact C-N 3.31Å; E425-K427 PolarHBondContact O-N 2.7Å; K427-T431 WeakPolarHBondContact O-CB 3.5Å; K427-T431 PolarHBondContact O-N 3.29Å; K427-T431 PolarHBondContact O-OG1 3.08Å
428	S	96.8	Very high	94.7	Very high	62 Å²	62	103.6 Å²	103.6	43%	0.434	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-53.3	174.1	-164.4	0	0	0	0	110.6	V424 E425 L430 T431 D432	V424-S428 PolarHBondContact O-N 3.04Å; E425-S428 WeakPolarHBondContact O-CB 3.46Å; E425-S428 PolarHBondContact O-N 3.35Å; E425-S428 VanDerWaalsContact O-N 3.14Å; S428-L430 VanDerWaalsContact C-N 3.32Å; S428-L430 PolarHBondContact O-N 3.25Å; S428-T431 CarbonylContact O-C 3.55Å; S428-T431 WeakPolarHBondContact O-CA 3.32Å; S428-T431 WeakPolarHBondContact O-CB 3.47Å; S428-T431 PolarHBondContact O-N 3.19Å; S428-D432 PolarHBondContact O-N 3.2Å
429	R	96.9	Very high	93.8	Very high	136 Å²	136	101.8 Å²	101.8	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-54.4	-45.4	178.8	-70.6	167.4	174.3	-105.8	6.8	112.2	E425 L426 D432 E433	E425-R429 WeakPolarHBondContact O-CG 3.36Å; E425-R429 PolarHBondContact O-N 3.39Å; E425-R429 IonicContact OE1-CZ 2.66Å; E425-R429 IonicContact OE1-NE 3.56Å; E425-R429 PolarHBondContact OE1-NE 3.03Å; E425-R429 IonicContact OE1-NH2 3Å; E425-R429 PolarHBondContact OE1-NH2 3.32Å; L426-R429 PolarHBondContact O-N 2.88Å; R429-D432 PolarHBondContact O-N 2.99Å; R429-E433 WeakPolarHBondContact O-CG 3.24Å; R429-E433 PolarHBondContact O-N 2.98Å
430	L	94.2	Very high	92.9	Very high	97 Å²	97	99.3 Å²	99.3	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-40.6	175.3	179.4	62.1	0	0	0	112.1	L426 S428 D432 E433 M434	L426-L430 VanDerWaalsContact O-CB 3.3Å; L426-L430 WeakPolarHBondContact O-CB 3.29Å; L426-L430 PolarHBondContact O-N 3.32Å; S428-L430 VanDerWaalsContact C-N 3.32Å; S428-L430 PolarHBondContact O-N 3.25Å; L430-D432 VanDerWaalsContact C-N 3.32Å; L430-D432 PolarHBondContact O-N 3.4Å; L430-E433 PolarHBondContact O-N 3.1Å; L430-M434 HydrophobicContact CD1-CG 4.31Å; L430-M434 HydrophobicContact CD1-SD 4.42Å; L430-M434 HydrophobicContact CG-CG 4.49Å; L430-M434 HydrophobicContact CG-SD 4.16Å; L430-M434 WeakPolarHBondContact O-CB 3.46Å; L430-M434 VanDerWaalsContact O-CG 3.29Å; L430-M434 WeakPolarHBondContact O-CG 3.41Å; L430-M434 PolarHBondContact O-N 3.09Å
431	T	94.9	Very high	91.6	Very high	81 Å²	81	99.7 Å²	99.7	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-64.7	-38.6	176.3	-55.7	0	0	0	0	111.3	K427 S428 M434 S435	K427-T431 WeakPolarHBondContact O-CB 3.5Å; K427-T431 PolarHBondContact O-N 3.29Å; K427-T431 PolarHBondContact O-OG1 3.08Å; S428-T431 CarbonylContact O-C 3.55Å; S428-T431 WeakPolarHBondContact O-CA 3.32Å; S428-T431 WeakPolarHBondContact O-CB 3.47Å; S428-T431 PolarHBondContact O-N 3.19Å; T431-M434 PolarHBondContact O-N 3.36Å; T431-S435 WeakPolarHBondContact O-CB 3.5Å; T431-S435 PolarHBondContact O-N 2.82Å; T431-S435 PolarHBondContact O-OG 2.67Å
432	D	94.9	Very high	90	Very high	70 Å²	70	99.3 Å²	99.3	37%	0.374	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-39.1	174.8	-58.5	-39.5	0	0	0	111.6	S428 R429 L430 S435 R436	S428-D432 PolarHBondContact O-N 3.2Å; R429-D432 PolarHBondContact O-N 2.99Å; L430-D432 VanDerWaalsContact C-N 3.32Å; L430-D432 PolarHBondContact O-N 3.4Å; D432-S435 PolarHBondContact O-N 3.33Å; D432-R436 WeakPolarHBondContact O-CB 3.45Å; D432-R436 WeakPolarHBondContact O-CG 3.45Å; D432-R436 PolarHBondContact O-N 2.85Å
433	E	93.9	Very high	88.1	Confident	105 Å²	105	102.4 Å²	102.4	49%	0.491	54%	0.535	S	S	.	.	H	α-helix	trans	-68.8	-42.6	174.9	-72.1	-179.2	177.6	0	0	112.5	R429 L430 S435 R436 T437	R429-E433 WeakPolarHBondContact O-CG 3.24Å; R429-E433 PolarHBondContact O-N 2.98Å; L430-E433 PolarHBondContact O-N 3.1Å; E433-S435 PolarHBondContact O-N 2.93Å; E433-R436 PolarHBondContact O-N 3.34Å; E433-T437 WeakPolarHBondContact O-CB 3.23Å; E433-T437 WeakPolarHBondContact O-CG2 3.46Å; E433-T437 PolarHBondContact O-N 2.93Å; E433-T437 PolarHBondContact O-OG1 2.88Å
434	M	90.5	Very high	86.2	Confident	98 Å²	98	106.6 Å²	106.6	48%	0.483	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-19.7	171.9	-72.8	-179.7	68.1	0	0	113.2	L430 T431 T437 R438	L430-M434 HydrophobicContact CD1-CG 4.31Å; L430-M434 HydrophobicContact CD1-SD 4.42Å; L430-M434 HydrophobicContact CG-CG 4.49Å; L430-M434 HydrophobicContact CG-SD 4.16Å; L430-M434 WeakPolarHBondContact O-CB 3.46Å; L430-M434 VanDerWaalsContact O-CG 3.29Å; L430-M434 WeakPolarHBondContact O-CG 3.41Å; L430-M434 PolarHBondContact O-N 3.09Å; T431-M434 PolarHBondContact O-N 3.36Å; M434-T437 WeakPolarHBondContact CA-OG1 3.47Å; M434-R438 VanDerWaalsContact O-CB 3.32Å; M434-R438 WeakPolarHBondContact O-CB 3.45Å
435	S	91.4	Very high	84	Confident	58 Å²	58	105.7 Å²	105.7	41%	0.406	56%	0.556	S	S	.	*	H	α-helix	trans	-84.9	-48.5	172.1	-58.4	0	0	0	0	110.7	T431 D432 E433 T437 R438 S439	T431-S435 WeakPolarHBondContact O-CB 3.5Å; T431-S435 PolarHBondContact O-N 2.82Å; T431-S435 PolarHBondContact O-OG 2.67Å; D432-S435 PolarHBondContact O-N 3.33Å; E433-S435 PolarHBondContact O-N 2.93Å; S435-T437 PolarHBondContact O-N 2.88Å; S435-R438 PolarHBondContact O-N 3.14Å; S435-S439 PolarHBondContact O-N 3.29Å; S435-S439 PolarHBondContact O-OG 3.35Å
436	R	92.6	Very high	81.9	Confident	144 Å²	144	104.5 Å²	104.5	54%	0.543	56%	0.558	S	S	.	*	H	α-helix	trans	-57	-48	176.3	-77.7	-173.5	-73.5	-90.9	5.2	112.8	D432 E433 S439 A440	D432-R436 WeakPolarHBondContact O-CB 3.45Å; D432-R436 WeakPolarHBondContact O-CG 3.45Å; D432-R436 PolarHBondContact O-N 2.85Å; E433-R436 PolarHBondContact O-N 3.34Å; R436-S439 PolarHBondContact O-N 2.79Å; R436-A440 WeakPolarHBondContact O-CB 3.46Å; R436-A440 PolarHBondContact O-N 3.43Å
437	T	82.1	Confident	80	Confident	90 Å²	90	105.9 Å²	105.9	55%	0.552	56%	0.562	S	S	*	*	H	α-helix	trans	-63.1	-41.2	178.5	47	0	0	0	0	112.1	E433 M434 S435 A440 L441	E433-T437 WeakPolarHBondContact O-CB 3.23Å; E433-T437 WeakPolarHBondContact O-CG2 3.46Å; E433-T437 PolarHBondContact O-N 2.93Å; E433-T437 PolarHBondContact O-OG1 2.88Å; M434-T437 WeakPolarHBondContact CA-OG1 3.47Å; S435-T437 PolarHBondContact O-N 2.88Å; T437-A440 PolarHBondContact O-N 3.32Å; T437-L441 PolarHBondContact O-N 2.96Å
438	R	84.9	Confident	78	Confident	161 Å²	161	107.8 Å²	107.8	61%	0.608	58%	0.578	S	S	*	*	H	α-helix	trans	-63.4	-43.6	175.3	-168.3	-175	-49.3	-93.9	-6.6	112.2	M434 S435 L441 T442	M434-R438 VanDerWaalsContact O-CB 3.32Å; M434-R438 WeakPolarHBondContact O-CB 3.45Å; S435-R438 PolarHBondContact O-N 3.14Å; R438-L441 WeakPolarHBondContact O-CB 3.24Å; R438-L441 PolarHBondContact O-N 3.07Å; R438-T442 PolarHBondContact O-N 3.41Å; R438-T442 PolarHBondContact O-OG1 3.22Å
439	S	78.7	Confident	76	Confident	75 Å²	75	107.4 Å²	107.4	52%	0.524	57%	0.571	S	S	.	*	H	α-helix	trans	-64.8	-40.9	174.8	-64.2	0	0	0	0	112.6	S435 R436 L441 T442 D443	S435-S439 PolarHBondContact O-N 3.29Å; S435-S439 PolarHBondContact O-OG 3.35Å; R436-S439 PolarHBondContact O-N 2.79Å; S439-L441 VanDerWaalsContact C-N 3.3Å; S439-L441 PolarHBondContact O-N 2.73Å; S439-T442 WeakPolarHBondContact CA-OG1 3.15Å; S439-T442 PolarHBondContact O-N 3.02Å; S439-T442 PolarHBondContact O-OG1 3.08Å; S439-D443 PolarHBondContact O-N 3.35Å
440	A	79.6	Confident	74.2	Confident	54 Å²	54	105.5 Å²	105.5	45%	0.446	57%	0.567	S	S	.	*	H	α-helix	trans	-64.4	-34.8	175.3	0	0	0	0	0	112.4	R436 T437 T442 D443 R444	R436-A440 WeakPolarHBondContact O-CB 3.46Å; R436-A440 PolarHBondContact O-N 3.43Å; T437-A440 PolarHBondContact O-N 3.32Å; A440-T442 VanDerWaalsContact C-N 3.33Å; A440-T442 PolarHBondContact O-N 2.89Å; A440-D443 PolarHBondContact O-N 3.48Å; A440-R444 PolarHBondContact O-N 3.21Å; A440-R444 VanDerWaalsContact O-N 3.1Å
441	L	69.1	Low	72.5	Confident	150 Å²	150	107.3 Å²	107.3	79%	0.785	58%	0.577	S	S	*	*	H	α-helix	trans	-65.6	-34.5	175	-135.3	78.5	0	0	0	112.6	T437 R438 S439 D443	T437-L441 PolarHBondContact O-N 2.96Å; R438-L441 WeakPolarHBondContact O-CB 3.24Å; R438-L441 PolarHBondContact O-N 3.07Å; S439-L441 VanDerWaalsContact C-N 3.3Å; S439-L441 PolarHBondContact O-N 2.73Å; L441-D443 VanDerWaalsContact C-N 3.33Å
442	T	65.8	Low	70.9	Confident	121 Å²	121	110 Å²	110	74%	0.742	58%	0.582	S	S	*	*	H	α-helix	trans	-76.2	-18.3	173.9	43.5	0	0	0	0	114	R438 S439 A440	R438-T442 PolarHBondContact O-N 3.41Å; R438-T442 PolarHBondContact O-OG1 3.22Å; S439-T442 WeakPolarHBondContact CA-OG1 3.15Å; S439-T442 PolarHBondContact O-N 3.02Å; S439-T442 PolarHBondContact O-OG1 3.08Å; A440-T442 VanDerWaalsContact C-N 3.33Å; A440-T442 PolarHBondContact O-N 2.89Å
443	D	58.8	Low	69.6	Low	143 Å²	143	109.3 Å²	109.3	77%	0.765	58%	0.58	S	S	*	*	H	α-helix	trans	-91.6	-28.9	-178.7	-159.2	46.4	0	0	0	112.4	S439 A440 L441 G445	S439-D443 PolarHBondContact O-N 3.35Å; A440-D443 PolarHBondContact O-N 3.48Å; L441-D443 VanDerWaalsContact C-N 3.33Å; D443-G445 PolarHBondContact O-N 3.06Å
444	R	55.8	Low	68.4	Low	164 Å²	164	107.7 Å²	107.7	62%	0.619	58%	0.58	S	S	*	*			trans	-77	59.4	174	-81.4	-167.7	170.8	-127.3	-7.5	113.8	A440 S446 D449	A440-R444 PolarHBondContact O-N 3.21Å; A440-R444 VanDerWaalsContact O-N 3.1Å; R444-S446 PolarHBondContact O-N 2.84Å; R444-D449 IonicContact CZ-OD2 3.88Å; R444-D449 IonicContact NH1-OD1 3.6Å; R444-D449 PolarHBondContact NH1-OD1 3.16Å; R444-D449 IonicContact NH1-OD2 2.78Å; R444-D449 PolarHBondContact NH1-OD2 3.26Å
445	G	51	Low	67.8	Low	79 Å²	79	106.5 Å²	106.5	81%	0.814	58%	0.581	S	S	*	*			trans	-74.5	48.1	169.7	0	0	0	0	0	114.6	D443	D443-G445 PolarHBondContact O-N 3.06Å
446	S	55.4	Low	67.2	Low	72 Å²	72	109.2 Å²	109.2	50%	0.503	59%	0.587	S	S	.	*			trans	-128.6	142.7	176.1	-172.7	0	0	0	0	110.7	R444 K450	R444-S446 PolarHBondContact O-N 2.84Å; S446-K450 WeakPolarHBondContact O-CE 3.47Å
447	E	56.4	Low	66.7	Low	143 Å²	143	107.7 Å²	107.7	67%	0.668	59%	0.589	S	S	*	*	S	Bend	trans	-85.8	-32.3	-167.4	-50.8	-134.1	96.5	0	0	113.5	D449 K450	E447-D449 PolarHBondContact O-N 2.83Å; E447-D449 VanDerWaalsContact O-N 3.1Å; E447-K450 HydrophobicContact CB-CD 4.44Å; E447-K450 WeakPolarHBondContact O-CB 3.25Å; E447-K450 PolarHBondContact O-N 3.3Å; E447-K450 IonicContact OE1-NZ 3.36Å; E447-K450 PolarHBondContact OE1-NZ 3.46Å
448	D	54.6	Low	66.9	Low	161 Å²	161	107.1 Å²	107.1	86%	0.861	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-17.8	-174.9	-135.9	39.7	0	0	0	113.9
449	D	55	Low	67	Low	54 Å²	54	102.8 Å²	102.8	29%	0.289	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.9	-16.6	179.7	-162	76.2	0	0	0	112.6	R444 E447 T453	R444-D449 IonicContact CZ-OD2 3.88Å; R444-D449 IonicContact NH1-OD1 3.6Å; R444-D449 PolarHBondContact NH1-OD1 3.16Å; R444-D449 IonicContact NH1-OD2 2.78Å; R444-D449 PolarHBondContact NH1-OD2 3.26Å; E447-D449 PolarHBondContact O-N 2.83Å; E447-D449 VanDerWaalsContact O-N 3.1Å; D449-T453 WeakPolarHBondContact O-CG2 3.38Å; D449-T453 PolarHBondContact O-N 3.14Å; D449-T453 VanDerWaalsContact O-N 3.1Å; D449-T453 PolarHBondContact O-OG1 3.04Å
450	K	57.7	Low	67.6	Low	96 Å²	96	103.9 Å²	103.9	42%	0.417	57%	0.57	S	S	.	*	H	α-helix	trans	-68.5	-42.2	-176.5	-62.8	177.9	-173.6	175.1	0	111.9	S446 E447 K452 T453 S454	S446-K450 WeakPolarHBondContact O-CE 3.47Å; E447-K450 HydrophobicContact CB-CD 4.44Å; E447-K450 WeakPolarHBondContact O-CB 3.25Å; E447-K450 PolarHBondContact O-N 3.3Å; E447-K450 IonicContact OE1-NZ 3.36Å; E447-K450 PolarHBondContact OE1-NZ 3.46Å; K450-K452 VanDerWaalsContact C-N 3.32Å; K450-K452 PolarHBondContact O-N 2.84Å; K450-T453 WeakPolarHBondContact CA-OG1 3.43Å; K450-T453 PolarHBondContact O-OG1 2.94Å; K450-S454 WeakPolarHBondContact O-CB 3.38Å; K450-S454 PolarHBondContact O-N 3.32Å
451	D	58.4	Low	68	Low	135 Å²	135	106 Å²	106	72%	0.722	57%	0.574	S	S	*	*	H	α-helix	trans	-68.3	-34.7	-177.1	-73.6	-9.2	0	0	0	111.7	C455	D451-C455 PolarHBondContact O-N 3.13Å
452	K	62.4	Low	69.2	Low	138 Å²	138	104.3 Å²	104.3	60%	0.6	56%	0.557	S	S	*	*	H	α-helix	trans	-72.4	-48.4	176.5	-174.1	158.7	-176.3	172	0	112.2	K450 S454 C455 E456	K450-K452 VanDerWaalsContact C-N 3.32Å; K450-K452 PolarHBondContact O-N 2.84Å; K452-S454 VanDerWaalsContact C-N 3.28Å; K452-S454 PolarHBondContact O-N 3.36Å; K452-C455 PolarHBondContact O-N 2.95Å; K452-E456 VanDerWaalsContact CE-OE1 3.24Å; K452-E456 WeakPolarHBondContact CE-OE1 3.13Å; K452-E456 WeakPolarHBondContact O-CG 3.3Å; K452-E456 PolarHBondContact O-N 3.36Å
453	T	67.8	Low	70.4	Confident	55 Å²	55	104.5 Å²	104.5	34%	0.337	55%	0.551	S	S	.	*	H	α-helix	trans	-64.3	-32.9	175.2	50.6	0	0	0	0	112.2	D449 K450 E456 L457	D449-T453 WeakPolarHBondContact O-CG2 3.38Å; D449-T453 PolarHBondContact O-N 3.14Å; D449-T453 VanDerWaalsContact O-N 3.1Å; D449-T453 PolarHBondContact O-OG1 3.04Å; K450-T453 WeakPolarHBondContact CA-OG1 3.43Å; K450-T453 PolarHBondContact O-OG1 2.94Å; T453-E456 PolarHBondContact O-N 3.19Å; T453-L457 VanDerWaalsContact O-CB 3.3Å; T453-L457 WeakPolarHBondContact O-CB 3.49Å; T453-L457 WeakPolarHBondContact O-CD1 3.36Å; T453-L457 WeakPolarHBondContact O-CG 3.16Å; T453-L457 PolarHBondContact O-N 2.95Å
454	S	69.1	Low	72.1	Confident	70 Å²	70	102.3 Å²	102.3	49%	0.49	54%	0.535	S	S	.	.	H	α-helix	trans	-61.8	-46.1	171.3	-177.9	0	0	0	0	112.1	K450 K452 L457 E458	K450-S454 WeakPolarHBondContact O-CB 3.38Å; K450-S454 PolarHBondContact O-N 3.32Å; K452-S454 VanDerWaalsContact C-N 3.28Å; K452-S454 PolarHBondContact O-N 3.36Å; S454-L457 PolarHBondContact O-N 3.06Å; S454-E458 WeakPolarHBondContact O-CB 3.24Å; S454-E458 PolarHBondContact O-N 3.08Å
455	C	77.4	Confident	73.7	Confident	74 Å²	74	98 Å²	98	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-40.6	177.2	-167.6	0	0	0	0	112.3	D451 K452 E458 V459	D451-C455 PolarHBondContact O-N 3.13Å; K452-C455 PolarHBondContact O-N 2.95Å; C455-E458 PolarHBondContact O-N 2.98Å; C455-V459 WeakPolarHBondContact O-CG2 3.27Å; C455-V459 PolarHBondContact O-N 3.29Å; C455-V459 VanDerWaalsContact O-N 3.08Å
456	E	79.4	Confident	75.7	Confident	114 Å²	114	99.3 Å²	99.3	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-38.6	174.9	-70.1	171	-166.4	0	0	111.9	K452 T453 L460	K452-E456 VanDerWaalsContact CE-OE1 3.24Å; K452-E456 WeakPolarHBondContact CE-OE1 3.13Å; K452-E456 WeakPolarHBondContact O-CG 3.3Å; K452-E456 PolarHBondContact O-N 3.36Å; T453-E456 PolarHBondContact O-N 3.19Å; E456-L460 WeakPolarHBondContact O-CB 3.41Å; E456-L460 PolarHBondContact O-N 2.62Å
457	L	81.8	Confident	77.6	Confident	112 Å²	112	100.1 Å²	100.1	59%	0.586	51%	0.508	S	S	*	.	H	α-helix	trans	-68.3	-37.1	173.2	-75.9	168	0	0	0	112.9	T453 S454 L460 L461	T453-L457 VanDerWaalsContact O-CB 3.3Å; T453-L457 WeakPolarHBondContact O-CB 3.49Å; T453-L457 WeakPolarHBondContact O-CD1 3.36Å; T453-L457 WeakPolarHBondContact O-CG 3.16Å; T453-L457 PolarHBondContact O-N 2.95Å; S454-L457 PolarHBondContact O-N 3.06Å; L457-L460 PolarHBondContact O-N 3.07Å; L457-L461 VanDerWaalsContact O-CB 3.32Å; L457-L461 WeakPolarHBondContact O-CB 3.42Å; L457-L461 PolarHBondContact O-N 3.28Å
458	E	84.8	Confident	79.4	Confident	79 Å²	79	97.5 Å²	97.5	37%	0.369	50%	0.498	S	S	.	.	H	α-helix	trans	-67.6	-37.7	177.2	-161.1	-167.7	-163.5	0	0	111.5	S454 C455 R462	S454-E458 WeakPolarHBondContact O-CB 3.24Å; S454-E458 PolarHBondContact O-N 3.08Å; C455-E458 PolarHBondContact O-N 2.98Å; E458-R462 VanDerWaalsContact CD-CZ 3.45Å; E458-R462 VanDerWaalsContact O-CG 3.29Å; E458-R462 WeakPolarHBondContact O-CG 3.23Å; E458-R462 PolarHBondContact O-N 3.32Å; E458-R462 VanDerWaalsContact O-N 3.08Å; E458-R462 IonicContact OE1-CZ 3.74Å; E458-R462 IonicContact OE1-NE 2.95Å; E458-R462 IonicContact OE1-NH2 3.81Å; E458-R462 PolarHBondContact OE1-NH2 3.49Å; E458-R462 IonicContact OE2-CZ 3.05Å; E458-R462 IonicContact OE2-NH1 2.71Å; E458-R462 IonicContact OE2-NH2 2.78Å; E458-R462 PolarHBondContact OE2-NH2 2.85Å
459	V	87.4	Confident	81.3	Confident	70 Å²	70	94.6 Å²	94.6	42%	0.424	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-46.2	170.8	172.5	0	0	0	0	110.7	C455 L461 R462 M463	C455-V459 WeakPolarHBondContact O-CG2 3.27Å; C455-V459 PolarHBondContact O-N 3.29Å; C455-V459 VanDerWaalsContact O-N 3.08Å; V459-L461 VanDerWaalsContact C-N 3.33Å; V459-L461 PolarHBondContact O-N 3.27Å; V459-R462 PolarHBondContact O-N 3.32Å; V459-M463 HydrophobicContact CG1-SD 4.28Å; V459-M463 WeakPolarHBondContact O-CG 3.49Å; V459-M463 PolarHBondContact O-N 3.1Å
460	L	91.1	Very high	83.3	Confident	97 Å²	97	98.9 Å²	98.9	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-39.1	179	-172.8	67.5	0	0	0	112.4	E456 L457 M463 K464	E456-L460 WeakPolarHBondContact O-CB 3.41Å; E456-L460 PolarHBondContact O-N 2.62Å; L457-L460 PolarHBondContact O-N 3.07Å; L460-M463 PolarHBondContact O-N 2.97Å; L460-K464 WeakPolarHBondContact O-CG 3.48Å; L460-K464 PolarHBondContact O-N 2.95Å
461	L	89.5	Confident	85.1	Confident	99 Å²	99	98 Å²	98	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-60.6	-54.1	175.1	-177.9	61.9	0	0	0	110.3	L457 V459 M463 K464 D465	L457-L461 VanDerWaalsContact O-CB 3.32Å; L457-L461 WeakPolarHBondContact O-CB 3.42Å; L457-L461 PolarHBondContact O-N 3.28Å; V459-L461 VanDerWaalsContact C-N 3.33Å; V459-L461 PolarHBondContact O-N 3.27Å; L461-M463 VanDerWaalsContact C-N 3.25Å; L461-M463 PolarHBondContact O-N 2.93Å; L461-K464 CarbonylContact O-C 3.58Å; L461-K464 WeakPolarHBondContact O-CA 3.33Å; L461-K464 PolarHBondContact O-N 3.3Å; L461-D465 VanDerWaalsContact O-CG 3.26Å; L461-D465 PolarHBondContact O-N 3.5Å
462	R	93.5	Very high	86.9	Confident	115 Å²	115	97.6 Å²	97.6	43%	0.434	49%	0.485	S	S	.	.	H	α-helix	trans	-56.8	-37.1	176.4	-69	169.1	-174.2	156.4	2.4	112.6	E458 V459 N466	E458-R462 VanDerWaalsContact CD-CZ 3.45Å; E458-R462 VanDerWaalsContact O-CG 3.29Å; E458-R462 WeakPolarHBondContact O-CG 3.23Å; E458-R462 PolarHBondContact O-N 3.32Å; E458-R462 VanDerWaalsContact O-N 3.08Å; E458-R462 IonicContact OE1-CZ 3.74Å; E458-R462 IonicContact OE1-NE 2.95Å; E458-R462 IonicContact OE1-NH2 3.81Å; E458-R462 PolarHBondContact OE1-NH2 3.49Å; E458-R462 IonicContact OE2-CZ 3.05Å; E458-R462 IonicContact OE2-NH1 2.71Å; E458-R462 IonicContact OE2-NH2 2.78Å; E458-R462 PolarHBondContact OE2-NH2 2.85Å; V459-R462 PolarHBondContact O-N 3.32Å; R462-N466 PolarHBondContact O-N 2.93Å; R462-N466 VanDerWaalsContact O-N 3.08Å; R462-N466 PolarHBondContact O-ND2 2.72Å
463	M	91.8	Very high	88.5	Confident	125 Å²	125	96.7 Å²	96.7	62%	0.616	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-38.7	174.3	-70.7	-176	81.1	0	0	112	V459 L460 L461 E467	V459-M463 HydrophobicContact CG1-SD 4.28Å; V459-M463 WeakPolarHBondContact O-CG 3.49Å; V459-M463 PolarHBondContact O-N 3.1Å; L460-M463 PolarHBondContact O-N 2.97Å; L461-M463 VanDerWaalsContact C-N 3.25Å; L461-M463 PolarHBondContact O-N 2.93Å; M463-E467 WeakPolarHBondContact O-CB 3.46Å; M463-E467 PolarHBondContact O-N 2.88Å
464	K	93.6	Very high	89.8	Confident	97 Å²	97	98 Å²	98	42%	0.422	48%	0.483	S	S	.	.	H	α-helix	trans	-72.6	-34.5	175.9	-73.6	-70.2	167.4	-159.9	0	113.3	L460 L461 E467 I468	L460-K464 WeakPolarHBondContact O-CG 3.48Å; L460-K464 PolarHBondContact O-N 2.95Å; L461-K464 CarbonylContact O-C 3.58Å; L461-K464 WeakPolarHBondContact O-CA 3.33Å; L461-K464 PolarHBondContact O-N 3.3Å; K464-E467 WeakPolarHBondContact CE-OE2 3.34Å; K464-E467 IonicContact NZ-OE1 3.73Å; K464-E467 PolarHBondContact NZ-OE1 3.5Å; K464-E467 IonicContact NZ-OE2 2.83Å; K464-E467 PolarHBondContact NZ-OE2 2.98Å; K464-E467 PolarHBondContact O-N 3.29Å; K464-I468 WeakPolarHBondContact O-CB 3.45Å; K464-I468 WeakPolarHBondContact O-CD1 3.49Å; K464-I468 VanDerWaalsContact O-CG1 3.24Å; K464-I468 WeakPolarHBondContact O-CG1 3.28Å; K464-I468 PolarHBondContact O-N 2.71Å
465	D	89.4	Confident	91	Very high	74 Å²	74	98.4 Å²	98.4	40%	0.396	48%	0.479	S	S	.	.	H	α-helix	trans	-63.9	-42.3	172.7	-58.7	-35.3	0	0	0	110.8	L461 E467 I468 E469	L461-D465 VanDerWaalsContact O-CG 3.26Å; L461-D465 PolarHBondContact O-N 3.5Å; D465-E467 PolarHBondContact O-N 3.26Å; D465-I468 PolarHBondContact O-N 3.44Å; D465-E469 PolarHBondContact O-N 2.98Å
466	N	93	Very high	91.9	Very high	105 Å²	105	97.7 Å²	97.7	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-64.1	-36.9	173.1	-84.2	-92.9	0	0	0	112.8	R462 E469 Y470	R462-N466 PolarHBondContact O-N 2.93Å; R462-N466 VanDerWaalsContact O-N 3.08Å; R462-N466 PolarHBondContact O-ND2 2.72Å; N466-E469 PolarHBondContact O-N 3.3Å; N466-Y470 WeakPolarHBondContact O-CB 3.45Å; N466-Y470 PolarHBondContact O-N 2.83Å
467	E	95.4	Very high	92.7	Very high	90 Å²	90	96.1 Å²	96.1	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-68.3	-38.5	175	-167.4	176.5	149.8	0	0	111.5	M463 K464 D465 Y470 L471	M463-E467 WeakPolarHBondContact O-CB 3.46Å; M463-E467 PolarHBondContact O-N 2.88Å; K464-E467 WeakPolarHBondContact CE-OE2 3.34Å; K464-E467 IonicContact NZ-OE1 3.73Å; K464-E467 PolarHBondContact NZ-OE1 3.5Å; K464-E467 IonicContact NZ-OE2 2.83Å; K464-E467 PolarHBondContact NZ-OE2 2.98Å; K464-E467 PolarHBondContact O-N 3.29Å; D465-E467 PolarHBondContact O-N 3.26Å; E467-Y470 PolarHBondContact O-N 2.84Å; E467-L471 HydrophobicContact CG-CD1 4.43Å; E467-L471 WeakPolarHBondContact O-CB 3.46Å; E467-L471 VanDerWaalsContact O-CG 3.26Å; E467-L471 WeakPolarHBondContact O-CG 3.32Å; E467-L471 PolarHBondContact O-N 2.74Å
468	I	94.1	Very high	93.3	Very high	87 Å²	87	94.2 Å²	94.2	45%	0.446	47%	0.466	S	S	.	.	H	α-helix	trans	-65.2	-42	172.5	-70.9	163.9	0	0	0	110.8	K464 D465 L471 H472	K464-I468 WeakPolarHBondContact O-CB 3.45Å; K464-I468 WeakPolarHBondContact O-CD1 3.49Å; K464-I468 VanDerWaalsContact O-CG1 3.24Å; K464-I468 WeakPolarHBondContact O-CG1 3.28Å; K464-I468 PolarHBondContact O-N 2.71Å; D465-I468 PolarHBondContact O-N 3.44Å; I468-L471 PolarHBondContact O-N 2.79Å; I468-H472 PolarHBondContact O-N 2.8Å; I468-H472 PolarHBondContact O-ND1 3.17Å
469	E	94.9	Very high	93.8	Very high	101 Å²	101	97.1 Å²	97.1	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-60.5	-43.7	172.2	-94.7	-160.6	-133.7	0	0	112.4	D465 N466 H472 K473	D465-E469 PolarHBondContact O-N 2.98Å; N466-E469 PolarHBondContact O-N 3.3Å; E469-H472 PolarHBondContact O-N 3.1Å; E469-K473 WeakPolarHBondContact O-CD 3.43Å; E469-K473 VanDerWaalsContact O-CG 3.27Å; E469-K473 WeakPolarHBondContact O-CG 3.42Å; E469-K473 PolarHBondContact O-N 2.78Å; E469-K473 VanDerWaalsContact O-N 3.08Å; E469-K473 IonicContact OE2-NZ 2.67Å; E469-K473 PolarHBondContact OE2-NZ 2.81Å
470	Y	96	Very high	94.2	Very high	144 Å²	144	98.2 Å²	98.2	57%	0.565	48%	0.477	S	S	*	.	H	α-helix	trans	-61.8	-47.3	176.6	177.5	-86.4	0	0	0	111.1	N466 E467 H472 K473 E474	N466-Y470 WeakPolarHBondContact O-CB 3.45Å; N466-Y470 PolarHBondContact O-N 2.83Å; E467-Y470 PolarHBondContact O-N 2.84Å; Y470-H472 VanDerWaalsContact C-N 3.34Å; Y470-H472 PolarHBondContact O-N 2.88Å; Y470-K473 WeakPolarHBondContact O-CB 3.44Å; Y470-K473 PolarHBondContact O-N 3.47Å; Y470-K473 VanDerWaalsContact O-N 3.11Å; Y470-E474 HydrophobicContact CE1-CB 4.4Å; Y470-E474 WeakPolarHBondContact CE1-OE2 3.44Å; Y470-E474 PolarHBondContact O-N 2.95Å
471	L	95.7	Very high	94.5	Very high	78 Å²	78	97.9 Å²	97.9	41%	0.408	47%	0.473	S	S	.	.	H	α-helix	trans	-63.8	-36.2	178.5	-71	168.2	0	0	0	112.3	E467 I468 E474 I475	E467-L471 HydrophobicContact CG-CD1 4.43Å; E467-L471 WeakPolarHBondContact O-CB 3.46Å; E467-L471 VanDerWaalsContact O-CG 3.26Å; E467-L471 WeakPolarHBondContact O-CG 3.32Å; E467-L471 PolarHBondContact O-N 2.74Å; I468-L471 PolarHBondContact O-N 2.79Å; L471-E474 PolarHBondContact O-N 3.47Å; L471-I475 WeakPolarHBondContact O-CB 3.41Å; L471-I475 WeakPolarHBondContact O-CD1 3.41Å; L471-I475 WeakPolarHBondContact O-CG1 3.49Å; L471-I475 PolarHBondContact O-N 2.81Å
472	H	96.1	Very high	94.6	Very high	126 Å²	126	99 Å²	99	58%	0.583	48%	0.478	S	S	*	.	H	α-helix	trans	-64.3	-39.5	171.8	-79.9	95.9	0	0	0	112.5	I468 E469 Y470 I475 S476	I468-H472 PolarHBondContact O-N 2.8Å; I468-H472 PolarHBondContact O-ND1 3.17Å; E469-H472 PolarHBondContact O-N 3.1Å; Y470-H472 VanDerWaalsContact C-N 3.34Å; Y470-H472 PolarHBondContact O-N 2.88Å; H472-I475 PolarHBondContact O-N 3.43Å; H472-S476 WeakPolarHBondContact O-CB 3.4Å; H472-S476 PolarHBondContact O-N 3.29Å
473	K	96.6	Very high	94.7	Very high	118 Å²	118	100 Å²	100	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-43.8	175.7	-67.8	157.8	-166.2	166.7	0	110.8	E469 Y470 S476 C477	E469-K473 WeakPolarHBondContact O-CD 3.43Å; E469-K473 VanDerWaalsContact O-CG 3.27Å; E469-K473 WeakPolarHBondContact O-CG 3.42Å; E469-K473 PolarHBondContact O-N 2.78Å; E469-K473 VanDerWaalsContact O-N 3.08Å; E469-K473 IonicContact OE2-NZ 2.67Å; E469-K473 PolarHBondContact OE2-NZ 2.81Å; Y470-K473 WeakPolarHBondContact O-CB 3.44Å; Y470-K473 PolarHBondContact O-N 3.47Å; Y470-K473 VanDerWaalsContact O-N 3.11Å; K473-S476 WeakPolarHBondContact O-CB 3.42Å; K473-S476 PolarHBondContact O-N 3.26Å; K473-C477 PolarHBondContact O-N 3.07Å; K473-C477 PolarHBondContact O-SG 2.88Å; K473-C477 VanDerWaalsContact O-SG 3.38Å
474	E	96	Very high	95	Very high	83 Å²	83	99.9 Å²	99.9	39%	0.388	48%	0.484	S	S	.	.	H	α-helix	trans	-62	-46	174.7	-175	169	-158.3	0	0	112	Y470 L471 S476 C477 L478	Y470-E474 HydrophobicContact CE1-CB 4.4Å; Y470-E474 WeakPolarHBondContact CE1-OE2 3.44Å; Y470-E474 PolarHBondContact O-N 2.95Å; L471-E474 PolarHBondContact O-N 3.47Å; E474-S476 VanDerWaalsContact C-N 3.3Å; E474-S476 PolarHBondContact O-N 3.01Å; E474-C477 PolarHBondContact O-N 3.07Å; E474-L478 HydrophobicContact CG-CD1 3.99Å; E474-L478 HydrophobicContact CG-CG 4.48Å; E474-L478 WeakPolarHBondContact O-CB 3.39Å; E474-L478 VanDerWaalsContact O-CG 3.3Å; E474-L478 WeakPolarHBondContact O-CG 3.48Å; E474-L478 PolarHBondContact O-N 3.1Å
475	I	94.6	Very high	95.1	Very high	79 Å²	79	98.7 Å²	98.7	41%	0.405	48%	0.482	S	S	.	.	H	α-helix	trans	-59.7	-40.1	174.4	-71.5	164.1	0	0	0	111.3	L471 H472 L478 R479	L471-I475 WeakPolarHBondContact O-CB 3.41Å; L471-I475 WeakPolarHBondContact O-CD1 3.41Å; L471-I475 WeakPolarHBondContact O-CG1 3.49Å; L471-I475 PolarHBondContact O-N 2.81Å; H472-I475 PolarHBondContact O-N 3.43Å; I475-L478 PolarHBondContact O-N 3.36Å; I475-R479 HydrophobicContact CG2-CG 4.48Å; I475-R479 WeakPolarHBondContact O-CB 3.38Å; I475-R479 VanDerWaalsContact O-CG 3.28Å; I475-R479 WeakPolarHBondContact O-CG 3.29Å; I475-R479 PolarHBondContact O-N 2.93Å
476	S	95.1	Very high	95.3	Very high	58 Å²	58	99.8 Å²	99.8	41%	0.406	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-46.2	175.9	-173.4	0	0	0	0	111.9	H472 K473 E474 L478 R479 N480	H472-S476 WeakPolarHBondContact O-CB 3.4Å; H472-S476 PolarHBondContact O-N 3.29Å; K473-S476 WeakPolarHBondContact O-CB 3.42Å; K473-S476 PolarHBondContact O-N 3.26Å; E474-S476 VanDerWaalsContact C-N 3.3Å; E474-S476 PolarHBondContact O-N 3.01Å; S476-L478 PolarHBondContact O-N 2.88Å; S476-R479 PolarHBondContact O-N 3.3Å; S476-N480 VanDerWaalsContact O-CG 3.24Å; S476-N480 PolarHBondContact O-N 2.85Å; S476-N480 PolarHBondContact O-ND2 2.68Å
477	C	95.7	Very high	95.5	Very high	82 Å²	82	100.5 Å²	100.5	55%	0.554	49%	0.49	S	S	*	.	H	α-helix	trans	-59.3	-46	174.4	-70.2	0	0	0	0	112.2	K473 E474 R479 N480 E481	K473-C477 PolarHBondContact O-N 3.07Å; K473-C477 PolarHBondContact O-SG 2.88Å; K473-C477 VanDerWaalsContact O-SG 3.38Å; E474-C477 PolarHBondContact O-N 3.07Å; C477-R479 PolarHBondContact O-N 3.11Å; C477-N480 PolarHBondContact O-N 2.87Å; C477-E481 PolarHBondContact O-N 3.48Å
478	L	95.2	Very high	95.5	Very high	72 Å²	72	101 Å²	101	38%	0.377	49%	0.492	S	S	.	.	H	α-helix	trans	-66.1	-36	178.5	-69.6	170.1	0	0	0	112.6	E474 I475 S476 E481 L482	E474-L478 HydrophobicContact CG-CD1 3.99Å; E474-L478 HydrophobicContact CG-CG 4.48Å; E474-L478 WeakPolarHBondContact O-CB 3.39Å; E474-L478 VanDerWaalsContact O-CG 3.3Å; E474-L478 WeakPolarHBondContact O-CG 3.48Å; E474-L478 PolarHBondContact O-N 3.1Å; I475-L478 PolarHBondContact O-N 3.36Å; S476-L478 PolarHBondContact O-N 2.88Å; L478-E481 PolarHBondContact O-N 2.95Å; L478-L482 WeakPolarHBondContact O-CB 3.5Å; L478-L482 VanDerWaalsContact O-CG 3.26Å; L478-L482 WeakPolarHBondContact O-CG 3.2Å; L478-L482 PolarHBondContact O-N 3.26Å
479	R	95.8	Very high	95.7	Very high	140 Å²	140	103 Å²	103	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-60.7	-45.2	171.4	-78	173.7	179.3	-174.3	1	111.1	I475 S476 C477 L482 Q483	I475-R479 HydrophobicContact CG2-CG 4.48Å; I475-R479 WeakPolarHBondContact O-CB 3.38Å; I475-R479 VanDerWaalsContact O-CG 3.28Å; I475-R479 WeakPolarHBondContact O-CG 3.29Å; I475-R479 PolarHBondContact O-N 2.93Å; S476-R479 PolarHBondContact O-N 3.3Å; C477-R479 PolarHBondContact O-N 3.11Å; R479-L482 PolarHBondContact O-N 3.22Å; R479-Q483 WeakPolarHBondContact O-CG 3.49Å; R479-Q483 PolarHBondContact O-N 3.5Å
480	N	95.5	Very high	95.8	Very high	92 Å²	92	102.9 Å²	102.9	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-66.3	-41.3	178.9	-63.4	-22.7	0	0	0	112	S476 C477 Q483 F484	S476-N480 VanDerWaalsContact O-CG 3.24Å; S476-N480 PolarHBondContact O-N 2.85Å; S476-N480 PolarHBondContact O-ND2 2.68Å; C477-N480 PolarHBondContact O-N 2.87Å; N480-Q483 PolarHBondContact O-N 2.97Å; N480-F484 WeakPolarHBondContact O-CB 3.3Å; N480-F484 PolarHBondContact O-N 3.45Å
481	E	96.1	Very high	95.8	Very high	90 Å²	90	100.4 Å²	100.4	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-43	174.8	-171.1	-179.6	176.6	0	0	111.5	C477 L478 Q483 F484 L485	C477-E481 PolarHBondContact O-N 3.48Å; L478-E481 PolarHBondContact O-N 2.95Å; E481-Q483 PolarHBondContact O-N 3.1Å; E481-F484 PolarHBondContact O-N 3.34Å; E481-L485 HydrophobicContact CG-CD1 3.95Å; E481-L485 HydrophobicContact CG-CG 4.37Å; E481-L485 WeakPolarHBondContact O-CB 3.41Å; E481-L485 VanDerWaalsContact O-CG 3.32Å; E481-L485 WeakPolarHBondContact O-CG 3.43Å; E481-L485 PolarHBondContact O-N 3.37Å
482	L	93.1	Very high	95.8	Very high	122 Å²	122	99.5 Å²	99.5	64%	0.639	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-40	175.4	-76.2	168.6	0	0	0	112.7	L478 R479 N486	L478-L482 WeakPolarHBondContact O-CB 3.5Å; L478-L482 VanDerWaalsContact O-CG 3.26Å; L478-L482 WeakPolarHBondContact O-CG 3.2Å; L478-L482 PolarHBondContact O-N 3.26Å; R479-L482 PolarHBondContact O-N 3.22Å; L482-N486 VanDerWaalsContact O-CB 3.26Å; L482-N486 WeakPolarHBondContact O-CB 3.37Å; L482-N486 PolarHBondContact O-N 3.36Å
483	Q	96.1	Very high	95.8	Very high	138 Å²	138	96.7 Å²	96.7	65%	0.645	49%	0.491	S	S	*	.	H	α-helix	trans	-63.5	-44.9	174.1	-75.3	-178.2	-3.7	0	0	111.6	R479 N480 E481 N486 M487	R479-Q483 WeakPolarHBondContact O-CG 3.49Å; R479-Q483 PolarHBondContact O-N 3.5Å; N480-Q483 PolarHBondContact O-N 2.97Å; E481-Q483 PolarHBondContact O-N 3.1Å; Q483-N486 PolarHBondContact O-N 3.27Å; Q483-M487 PolarHBondContact O-N 3.25Å
484	F	96.7	Very high	95.8	Very high	121 Å²	121	95.8 Å²	95.8	53%	0.531	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-50.3	176.8	177.7	-96.1	0	0	0	112.1	N480 E481 N486 M487 E488	N480-F484 WeakPolarHBondContact O-CB 3.3Å; N480-F484 PolarHBondContact O-N 3.45Å; E481-F484 PolarHBondContact O-N 3.34Å; F484-N486 VanDerWaalsContact C-N 3.28Å; F484-N486 PolarHBondContact O-N 3.45Å; F484-M487 WeakPolarHBondContact O-CB 3.04Å; F484-M487 PolarHBondContact O-N 2.95Å; F484-E488 HydrophobicContact CD1-CG 4.3Å; F484-E488 HydrophobicContact CE1-CG 3.73Å; F484-E488 WeakPolarHBondContact CE1-OE2 3.43Å; F484-E488 HydrophobicContact CE2-CG 4.4Å; F484-E488 HydrophobicContact CZ-CG 3.77Å; F484-E488 WeakPolarHBondContact CZ-OE1 3.47Å; F484-E488 PolarHBondContact O-N 2.73Å
485	L	95.9	Very high	95.8	Very high	73 Å²	73	100.3 Å²	100.3	38%	0.382	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-32.4	178.5	-70.7	172.5	0	0	0	112.5	E481 K489	E481-L485 HydrophobicContact CG-CD1 3.95Å; E481-L485 HydrophobicContact CG-CG 4.37Å; E481-L485 WeakPolarHBondContact O-CB 3.41Å; E481-L485 VanDerWaalsContact O-CG 3.32Å; E481-L485 WeakPolarHBondContact O-CG 3.43Å; E481-L485 PolarHBondContact O-N 3.37Å; L485-K489 WeakPolarHBondContact O-CB 3.3Å; L485-K489 PolarHBondContact O-N 2.91Å
486	N	93.3	Very high	95.9	Very high	96 Å²	96	104.3 Å²	104.3	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-71.4	-32.5	174.1	-168.4	60.1	0	0	0	112.2	L482 Q483 F484 Q490	L482-N486 VanDerWaalsContact O-CB 3.26Å; L482-N486 WeakPolarHBondContact O-CB 3.37Å; L482-N486 PolarHBondContact O-N 3.36Å; Q483-N486 PolarHBondContact O-N 3.27Å; F484-N486 VanDerWaalsContact C-N 3.28Å; F484-N486 PolarHBondContact O-N 3.45Å; N486-Q490 WeakPolarHBondContact O-CB 3.48Å; N486-Q490 PolarHBondContact O-N 2.96Å
487	M	97	Very high	95.9	Very high	120 Å²	120	104.5 Å²	104.5	59%	0.591	52%	0.518	S	S	*	.	H	α-helix	trans	-68.6	-46	171.5	-169.9	66.5	71.7	0	0	111.7	Q483 F484 K489 Q490 L491	Q483-M487 PolarHBondContact O-N 3.25Å; F484-M487 WeakPolarHBondContact O-CB 3.04Å; F484-M487 PolarHBondContact O-N 2.95Å; M487-K489 VanDerWaalsContact C-N 3.33Å; M487-K489 PolarHBondContact O-N 3.04Å; M487-Q490 PolarHBondContact O-N 3.45Å; M487-L491 HydrophobicContact CG-CD1 4.41Å; M487-L491 WeakPolarHBondContact O-CG 3.32Å; M487-L491 PolarHBondContact O-N 3.37Å
488	E	97.1	Very high	96	Very high	100 Å²	100	106.3 Å²	106.3	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-42.5	174.2	-72.9	-162	133.2	0	0	111.8	F484 Q490 L491 A492	F484-E488 HydrophobicContact CD1-CG 4.3Å; F484-E488 HydrophobicContact CE1-CG 3.73Å; F484-E488 WeakPolarHBondContact CE1-OE2 3.43Å; F484-E488 HydrophobicContact CE2-CG 4.4Å; F484-E488 HydrophobicContact CZ-CG 3.77Å; F484-E488 WeakPolarHBondContact CZ-OE1 3.47Å; F484-E488 PolarHBondContact O-N 2.73Å; E488-Q490 PolarHBondContact O-N 2.96Å; E488-L491 PolarHBondContact O-N 3.1Å; E488-A492 VanDerWaalsContact O-CB 3.31Å; E488-A492 WeakPolarHBondContact O-CB 3.37Å; E488-A492 PolarHBondContact O-N 3.35Å
489	K	96.6	Very high	96.1	Very high	129 Å²	129	106.7 Å²	106.7	56%	0.561	52%	0.523	S	S	*	.	H	α-helix	trans	-58.3	-45.1	173.5	175.2	-164.9	166.1	-160	0	111.7	L485 M487 A492 C493	L485-K489 WeakPolarHBondContact O-CB 3.3Å; L485-K489 PolarHBondContact O-N 2.91Å; M487-K489 VanDerWaalsContact C-N 3.33Å; M487-K489 PolarHBondContact O-N 3.04Å; K489-A492 PolarHBondContact O-N 3Å; K489-C493 PolarHBondContact O-N 2.93Å; K489-C493 PolarHBondContact O-SG 3.25Å; K489-C493 VanDerWaalsContact O-SG 3.34Å
490	Q	96.9	Very high	96.1	Very high	99 Å²	99	104.2 Å²	104.2	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-49	179.5	-179.6	59.3	26.8	0	0	111	N486 M487 E488 A492 C493 E494	N486-Q490 WeakPolarHBondContact O-CB 3.48Å; N486-Q490 PolarHBondContact O-N 2.96Å; M487-Q490 PolarHBondContact O-N 3.45Å; E488-Q490 PolarHBondContact O-N 2.96Å; Q490-A492 VanDerWaalsContact C-N 3.31Å; Q490-A492 PolarHBondContact O-N 3.45Å; Q490-C493 WeakPolarHBondContact O-CB 3.35Å; Q490-C493 PolarHBondContact O-N 3.39Å; Q490-E494 WeakPolarHBondContact CG-OE1 3.44Å; Q490-E494 PolarHBondContact NE2-OE1 2.89Å; Q490-E494 WeakPolarHBondContact O-CG 3.36Å; Q490-E494 PolarHBondContact O-N 3.29Å
491	L	97.3	Very high	96.2	Very high	92 Å²	92	102 Å²	102	48%	0.482	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-37.5	175.8	-66.5	168.9	0	0	0	112.1	M487 E488 E494 R495	M487-L491 HydrophobicContact CG-CD1 4.41Å; M487-L491 WeakPolarHBondContact O-CG 3.32Å; M487-L491 PolarHBondContact O-N 3.37Å; E488-L491 PolarHBondContact O-N 3.1Å; L491-E494 PolarHBondContact O-N 2.9Å; L491-R495 VanDerWaalsContact O-CG 3.32Å; L491-R495 WeakPolarHBondContact O-CG 3.27Å; L491-R495 PolarHBondContact O-N 3.3Å
492	A	95.4	Very high	96.3	Very high	60 Å²	60	103.7 Å²	103.7	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-66.7	-39.7	175	0	0	0	0	0	112.5	E488 K489 Q490 Y496	E488-A492 VanDerWaalsContact O-CB 3.31Å; E488-A492 WeakPolarHBondContact O-CB 3.37Å; E488-A492 PolarHBondContact O-N 3.35Å; K489-A492 PolarHBondContact O-N 3Å; Q490-A492 VanDerWaalsContact C-N 3.31Å; Q490-A492 PolarHBondContact O-N 3.45Å; A492-Y496 WeakPolarHBondContact O-CB 3.45Å; A492-Y496 PolarHBondContact O-N 3.23Å
493	C	95.4	Very high	96.4	Very high	67 Å²	67	102.1 Å²	102.1	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-41	173.7	-74.3	0	0	0	0	112.2	K489 Q490 Y496 A497	K489-C493 PolarHBondContact O-N 2.93Å; K489-C493 PolarHBondContact O-SG 3.25Å; K489-C493 VanDerWaalsContact O-SG 3.34Å; Q490-C493 WeakPolarHBondContact O-CB 3.35Å; Q490-C493 PolarHBondContact O-N 3.39Å; C493-Y496 PolarHBondContact O-N 3.18Å; C493-A497 WeakPolarHBondContact O-CB 3.29Å; C493-A497 PolarHBondContact O-N 3Å
494	E	96.8	Very high	96.4	Very high	98 Å²	98	98.7 Å²	98.7	46%	0.458	50%	0.502	S	S	.	.	H	α-helix	trans	-63.6	-47.7	177.2	-73.7	166.5	-171.3	0	0	111.5	Q490 L491 Y496 A497 E498	Q490-E494 WeakPolarHBondContact CG-OE1 3.44Å; Q490-E494 PolarHBondContact NE2-OE1 2.89Å; Q490-E494 WeakPolarHBondContact O-CG 3.36Å; Q490-E494 PolarHBondContact O-N 3.29Å; L491-E494 PolarHBondContact O-N 2.9Å; E494-Y496 VanDerWaalsContact C-N 3.33Å; E494-Y496 PolarHBondContact O-N 3.31Å; E494-A497 WeakPolarHBondContact O-CB 3.35Å; E494-A497 PolarHBondContact O-N 2.71Å; E494-E498 PolarHBondContact O-N 3.24Å
495	R	97.2	Very high	96.4	Very high	178 Å²	178	94.3 Å²	94.3	67%	0.672	49%	0.491	S	S	*	.	H	α-helix	trans	-66.3	-32.6	176.1	-63.4	-175.5	93.1	-153.3	4	112.9	L491 V499	L491-R495 VanDerWaalsContact O-CG 3.32Å; L491-R495 WeakPolarHBondContact O-CG 3.27Å; L491-R495 PolarHBondContact O-N 3.3Å; R495-V499 WeakPolarHBondContact O-CG2 3.49Å; R495-V499 PolarHBondContact O-N 3.21Å
496	Y	95	Very high	96.4	Very high	164 Å²	164	96 Å²	96	64%	0.643	50%	0.498	S	S	*	.	H	α-helix	trans	-66.2	-41.1	171.8	179.5	-95.2	0	0	0	111.7	A492 C493 E494 H500	A492-Y496 WeakPolarHBondContact O-CB 3.45Å; A492-Y496 PolarHBondContact O-N 3.23Å; C493-Y496 PolarHBondContact O-N 3.18Å; E494-Y496 VanDerWaalsContact C-N 3.33Å; E494-Y496 PolarHBondContact O-N 3.31Å; Y496-H500 WeakPolarHBondContact O-CB 3.42Å; Y496-H500 PolarHBondContact O-N 3.19Å
497	A	96.8	Very high	96.6	Very high	61 Å²	61	98.1 Å²	98.1	50%	0.504	50%	0.499	S	S	.	.	H	α-helix	trans	-65.7	-39.8	176.4	0	0	0	0	0	112.3	C493 E494 G501	C493-A497 WeakPolarHBondContact O-CB 3.29Å; C493-A497 PolarHBondContact O-N 3Å; E494-A497 WeakPolarHBondContact O-CB 3.35Å; E494-A497 PolarHBondContact O-N 2.71Å; A497-G501 PolarHBondContact O-N 2.78Å
498	E	97.1	Very high	96.6	Very high	121 Å²	121	93.6 Å²	93.6	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-57.5	-59	172.7	-179.7	175.9	-133.6	0	0	111.3	E494 H500 G501 E502	E494-E498 PolarHBondContact O-N 3.24Å; E498-H500 VanDerWaalsContact C-N 3.3Å; E498-H500 PolarHBondContact O-N 2.74Å; E498-G501 WeakPolarHBondContact O-CA 3.49Å; E498-G501 PolarHBondContact O-N 3.06Å; E498-E502 PolarHBondContact O-N 3.27Å
499	V	97.2	Very high	96.6	Very high	79 Å²	79	94.4 Å²	94.4	48%	0.479	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-36.9	179.8	172.6	0	0	0	0	112	R495 E502 L503	R495-V499 WeakPolarHBondContact O-CG2 3.49Å; R495-V499 PolarHBondContact O-N 3.21Å; V499-E502 PolarHBondContact O-N 2.97Å; V499-L503 VanDerWaalsContact O-CB 3.27Å; V499-L503 WeakPolarHBondContact O-CB 3.36Å; V499-L503 PolarHBondContact O-N 2.87Å
500	H	96.4	Very high	96.5	Very high	89 Å²	89	91.5 Å²	91.5	41%	0.412	48%	0.475	S	S	.	.	H	α-helix	trans	-66.5	-37.3	174.7	-172	73.1	0	0	0	112.1	Y496 E498 N504	Y496-H500 WeakPolarHBondContact O-CB 3.42Å; Y496-H500 PolarHBondContact O-N 3.19Å; E498-H500 VanDerWaalsContact C-N 3.3Å; E498-H500 PolarHBondContact O-N 2.74Å; H500-N504 PolarHBondContact CD2-ND2 3.23Å; H500-N504 VanDerWaalsContact CD2-ND2 3.26Å; H500-N504 PolarHBondContact NE2-ND2 2.64Å; H500-N504 WeakPolarHBondContact O-CB 3.45Å; H500-N504 VanDerWaalsContact O-CG 3.26Å; H500-N504 PolarHBondContact O-N 3.36Å; H500-N504 PolarHBondContact O-ND2 3.24Å
501	G	97.6	Very high	96.5	Very high	44 Å²	44	91.9 Å²	91.9	45%	0.454	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-47.7	171.8	0	0	0	0	0	112.4	A497 E498 N504 G505	A497-G501 PolarHBondContact O-N 2.78Å; E498-G501 WeakPolarHBondContact O-CA 3.49Å; E498-G501 PolarHBondContact O-N 3.06Å; G501-N504 PolarHBondContact O-N 3.27Å; G501-G505 PolarHBondContact O-N 3.43Å
502	E	97.3	Very high	96.5	Very high	127 Å²	127	94.6 Å²	94.6	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-59.2	-47.6	175.3	-68	-164.9	132.1	0	0	112.2	E498 V499 N504 G505 M506	E498-E502 PolarHBondContact O-N 3.27Å; V499-E502 PolarHBondContact O-N 2.97Å; E502-N504 PolarHBondContact O-N 3.49Å; E502-G505 CarbonylContact O-C 3.48Å; E502-G505 WeakPolarHBondContact O-CA 3.29Å; E502-G505 PolarHBondContact O-N 3.39Å; E502-G505 VanDerWaalsContact O-N 3.09Å; E502-M506 WeakPolarHBondContact O-CG 3.47Å; E502-M506 PolarHBondContact O-N 3.5Å
503	L	96.1	Very high	96.6	Very high	89 Å²	89	96.6 Å²	96.6	47%	0.466	48%	0.48	S	S	.	.	H	α-helix	trans	-66.2	-38.5	-177.4	-162.9	160.5	0	0	0	111.3	V499 M506 R507	V499-L503 VanDerWaalsContact O-CB 3.27Å; V499-L503 WeakPolarHBondContact O-CB 3.36Å; V499-L503 PolarHBondContact O-N 2.87Å; L503-M506 PolarHBondContact O-N 2.97Å; L503-R507 WeakPolarHBondContact O-CB 3.29Å; L503-R507 PolarHBondContact O-N 2.93Å
504	N	94.9	Very high	96.6	Very high	65 Å²	65	97.8 Å²	97.8	35%	0.348	48%	0.481	S	S	.	.	H	α-helix	trans	-67.8	-36.5	170.8	-71.1	-26.7	0	0	0	112.1	H500 G501 E502 R507 G508	H500-N504 PolarHBondContact CD2-ND2 3.23Å; H500-N504 VanDerWaalsContact CD2-ND2 3.26Å; H500-N504 PolarHBondContact NE2-ND2 2.64Å; H500-N504 WeakPolarHBondContact O-CB 3.45Å; H500-N504 VanDerWaalsContact O-CG 3.26Å; H500-N504 PolarHBondContact O-N 3.36Å; H500-N504 PolarHBondContact O-ND2 3.24Å; G501-N504 PolarHBondContact O-N 3.27Å; E502-N504 PolarHBondContact O-N 3.49Å; N504-R507 PolarHBondContact O-N 2.88Å; N504-G508 PolarHBondContact O-N 3.11Å
505	G	97.3	Very high	96.6	Very high	30 Å²	30	98.2 Å²	98.2	31%	0.309	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-38.1	171.5	0	0	0	0	0	113.2	G501 E502 R509	G501-G505 PolarHBondContact O-N 3.43Å; E502-G505 CarbonylContact O-C 3.48Å; E502-G505 WeakPolarHBondContact O-CA 3.29Å; E502-G505 PolarHBondContact O-N 3.39Å; E502-G505 VanDerWaalsContact O-N 3.09Å; G505-R509 WeakPolarHBondContact O-CG 3.45Å; G505-R509 PolarHBondContact O-N 2.93Å; G505-R509 VanDerWaalsContact O-N 3.16Å; G505-R509 PolarHBondContact O-NH1 3.23Å
506	M	96.3	Very high	96.6	Very high	109 Å²	109	92.5 Å²	92.5	54%	0.537	47%	0.47	S	S	.	.	H	α-helix	trans	-67.2	-50.4	172.1	-74.4	178.3	68.5	0	0	111.4	E502 L503 G508 R509 T510	E502-M506 WeakPolarHBondContact O-CG 3.47Å; E502-M506 PolarHBondContact O-N 3.5Å; L503-M506 PolarHBondContact O-N 2.97Å; M506-G508 VanDerWaalsContact C-N 3.29Å; M506-G508 PolarHBondContact O-N 3.08Å; M506-R509 VanDerWaalsContact CG-NH2 3.27Å; M506-R509 WeakPolarHBondContact O-CA 3.48Å; M506-R509 WeakPolarHBondContact O-CB 3.24Å; M506-R509 PolarHBondContact O-N 2.84Å; M506-T510 PolarHBondContact O-N 3.46Å; M506-T510 PolarHBondContact O-OG1 3.04Å
507	R	96.3	Very high	96.7	Very high	139 Å²	139	90.4 Å²	90.4	53%	0.525	47%	0.469	S	S	.	.	H	α-helix	trans	-50.9	-51.1	176	-171.2	-165.8	-55.5	-96.2	-0.4	110.6	L503 N504 R509 T510 E511	L503-R507 WeakPolarHBondContact O-CB 3.29Å; L503-R507 PolarHBondContact O-N 2.93Å; N504-R507 PolarHBondContact O-N 2.88Å; R507-R509 VanDerWaalsContact C-N 3.28Å; R507-R509 PolarHBondContact O-N 3.36Å; R507-T510 WeakPolarHBondContact CA-OG1 3.35Å; R507-T510 PolarHBondContact O-N 2.9Å; R507-T510 PolarHBondContact O-OG1 3.4Å; R507-E511 WeakPolarHBondContact O-CB 3.38Å; R507-E511 PolarHBondContact O-N 3.21Å
508	G	96.8	Very high	96.7	Very high	26 Å²	26	94.3 Å²	94.3	27%	0.268	48%	0.475	S	S	.	.	H	α-helix	trans	-68.6	-15.8	177.6	0	0	0	0	0	115.3	N504 M506 R512	N504-G508 PolarHBondContact O-N 3.11Å; M506-G508 VanDerWaalsContact C-N 3.29Å; M506-G508 PolarHBondContact O-N 3.08Å; G508-R512 PolarHBondContact O-NE 2.97Å; G508-R512 PolarHBondContact O-NH2 3.24Å; G508-R512 VanDerWaalsContact O-NH2 3.13Å
509	R	97.2	Very high	96.6	Very high	117 Å²	117	92.4 Å²	92.4	44%	0.442	47%	0.466	S	S	.	.	H	α-helix	trans	-78.1	-55.7	165.3	-76	-174.2	-65.3	-91.8	18.3	110.3	G505 M506 R507 E511 R512 E513	G505-R509 WeakPolarHBondContact O-CG 3.45Å; G505-R509 PolarHBondContact O-N 2.93Å; G505-R509 VanDerWaalsContact O-N 3.16Å; G505-R509 PolarHBondContact O-NH1 3.23Å; M506-R509 VanDerWaalsContact CG-NH2 3.27Å; M506-R509 WeakPolarHBondContact O-CA 3.48Å; M506-R509 WeakPolarHBondContact O-CB 3.24Å; M506-R509 PolarHBondContact O-N 2.84Å; R507-R509 VanDerWaalsContact C-N 3.28Å; R507-R509 PolarHBondContact O-N 3.36Å; R509-E511 PolarHBondContact O-N 3.37Å; R509-R512 PolarHBondContact O-N 3.39Å; R509-E513 PolarHBondContact O-N 3.07Å
510	T	96	Very high	96.6	Very high	68 Å²	68	94.2 Å²	94.2	42%	0.417	47%	0.469	S	S	.	.	H	α-helix	trans	-58.6	-34.3	-179	52.8	0	0	0	0	113.1	M506 R507 E513 I514	M506-T510 PolarHBondContact O-N 3.46Å; M506-T510 PolarHBondContact O-OG1 3.04Å; R507-T510 WeakPolarHBondContact CA-OG1 3.35Å; R507-T510 PolarHBondContact O-N 2.9Å; R507-T510 PolarHBondContact O-OG1 3.4Å; T510-E513 PolarHBondContact O-N 3.29Å; T510-I514 WeakPolarHBondContact O-CB 3.4Å; T510-I514 WeakPolarHBondContact O-CD1 3.38Å; T510-I514 WeakPolarHBondContact O-CG1 3.4Å; T510-I514 PolarHBondContact O-N 3.25Å
511	E	96.6	Very high	96.6	Very high	106 Å²	106	95.1 Å²	95.1	50%	0.495	48%	0.477	S	S	.	.	H	α-helix	trans	-69.2	-39.3	177.3	-177.4	165.5	-157.6	0	0	112.4	R507 R509 I514 Q515	R507-E511 WeakPolarHBondContact O-CB 3.38Å; R507-E511 PolarHBondContact O-N 3.21Å; R509-E511 PolarHBondContact O-N 3.37Å; E511-I514 PolarHBondContact O-N 2.81Å; E511-Q515 WeakPolarHBondContact O-CB 3.44Å; E511-Q515 VanDerWaalsContact O-CG 3.23Å; E511-Q515 WeakPolarHBondContact O-CG 3.31Å; E511-Q515 PolarHBondContact O-N 3.48Å
512	R	96.8	Very high	96.5	Very high	149 Å²	149	99.5 Å²	99.5	56%	0.562	48%	0.479	S	S	*	.	H	α-helix	trans	-68.1	-35.8	173	-76.9	-179.5	-74.3	110.6	-6.6	112.1	G508 R509 Q515 S516	G508-R512 PolarHBondContact O-NE 2.97Å; G508-R512 PolarHBondContact O-NH2 3.24Å; G508-R512 VanDerWaalsContact O-NH2 3.13Å; R509-R512 PolarHBondContact O-N 3.39Å; R512-Q515 PolarHBondContact O-N 3.46Å; R512-S516 WeakPolarHBondContact O-CB 3.41Å; R512-S516 PolarHBondContact O-N 3.41Å
513	E	97.4	Very high	96.5	Very high	103 Å²	103	97.6 Å²	97.6	48%	0.481	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-45.7	173	-71.6	154	-157.4	0	0	111	R509 T510 Q515 S516 L517	R509-E513 PolarHBondContact O-N 3.07Å; T510-E513 PolarHBondContact O-N 3.29Å; E513-Q515 VanDerWaalsContact C-N 3.35Å; E513-Q515 PolarHBondContact O-N 3.47Å; E513-S516 PolarHBondContact O-N 2.81Å; E513-L517 WeakPolarHBondContact O-CB 3.41Å; E513-L517 WeakPolarHBondContact O-CG 3.43Å; E513-L517 PolarHBondContact O-N 3.15Å
514	I	96.3	Very high	96.4	Very high	91 Å²	91	95.8 Å²	95.8	47%	0.467	47%	0.47	S	S	.	.	H	α-helix	trans	-60.2	-42.3	173.9	-71.9	162.9	0	0	0	111.5	T510 E511 L517 K518	T510-I514 WeakPolarHBondContact O-CB 3.4Å; T510-I514 WeakPolarHBondContact O-CD1 3.38Å; T510-I514 WeakPolarHBondContact O-CG1 3.4Å; T510-I514 PolarHBondContact O-N 3.25Å; E511-I514 PolarHBondContact O-N 2.81Å; I514-L517 PolarHBondContact O-N 2.98Å; I514-K518 HydrophobicContact CG2-CD 4.17Å; I514-K518 WeakPolarHBondContact O-CB 3.42Å; I514-K518 VanDerWaalsContact O-CG 3.28Å; I514-K518 WeakPolarHBondContact O-CG 3.42Å; I514-K518 PolarHBondContact O-N 3.36Å
515	Q	96.1	Very high	96.3	Very high	108 Å²	108	97.5 Å²	97.5	51%	0.505	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-43.5	175.2	-72.5	168.2	11.4	0	0	111.5	E511 R512 E513 K518 E519	E511-Q515 WeakPolarHBondContact O-CB 3.44Å; E511-Q515 VanDerWaalsContact O-CG 3.23Å; E511-Q515 WeakPolarHBondContact O-CG 3.31Å; E511-Q515 PolarHBondContact O-N 3.48Å; R512-Q515 PolarHBondContact O-N 3.46Å; E513-Q515 VanDerWaalsContact C-N 3.35Å; E513-Q515 PolarHBondContact O-N 3.47Å; Q515-K518 PolarHBondContact O-N 3.04Å; Q515-E519 PolarHBondContact O-N 3.21Å; Q515-E519 VanDerWaalsContact O-N 3.11Å
516	S	97.3	Very high	96.1	Very high	58 Å²	58	97.9 Å²	97.9	41%	0.406	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-42.3	176.2	-172.3	0	0	0	0	112.5	R512 E513 E519 H520	R512-S516 WeakPolarHBondContact O-CB 3.41Å; R512-S516 PolarHBondContact O-N 3.41Å; E513-S516 PolarHBondContact O-N 2.81Å; S516-E519 PolarHBondContact O-N 3.5Å; S516-H520 PolarHBondContact O-N 2.79Å; S516-H520 PolarHBondContact O-ND1 2.96Å; S516-H520 PolarHBondContact OG-CE1 3.06Å; S516-H520 PolarHBondContact OG-ND1 3.17Å
517	L	96.8	Very high	95.9	Very high	119 Å²	119	95.6 Å²	95.6	62%	0.623	48%	0.476	S	S	*	.	H	α-helix	trans	-66	-38.7	177.2	-71.4	169.9	0	0	0	112.2	E513 I514 E519 H520 L521	E513-L517 WeakPolarHBondContact O-CB 3.41Å; E513-L517 WeakPolarHBondContact O-CG 3.43Å; E513-L517 PolarHBondContact O-N 3.15Å; I514-L517 PolarHBondContact O-N 2.98Å; L517-E519 VanDerWaalsContact C-N 3.33Å; L517-E519 PolarHBondContact O-N 3.08Å; L517-H520 PolarHBondContact O-N 3.07Å; L517-L521 WeakPolarHBondContact O-CB 3.43Å; L517-L521 PolarHBondContact O-N 3.2Å
518	K	96.4	Very high	95.6	Very high	143 Å²	143	94.7 Å²	94.7	62%	0.622	48%	0.481	S	S	*	.	H	α-helix	trans	-60.3	-41.3	172.5	-77.3	172.8	177.8	-179.3	0	112	I514 Q515 L521 R522	I514-K518 HydrophobicContact CG2-CD 4.17Å; I514-K518 WeakPolarHBondContact O-CB 3.42Å; I514-K518 VanDerWaalsContact O-CG 3.28Å; I514-K518 WeakPolarHBondContact O-CG 3.42Å; I514-K518 PolarHBondContact O-N 3.36Å; Q515-K518 PolarHBondContact O-N 3.04Å; K518-L521 PolarHBondContact O-N 2.93Å; K518-R522 PolarHBondContact O-N 3.46Å
519	E	96.4	Very high	95.2	Very high	81 Å²	81	98.4 Å²	98.4	38%	0.379	49%	0.491	S	S	.	.	H	α-helix	trans	-71.6	-41.5	179	-178.1	57.6	-166.3	0	0	112.4	Q515 S516 L517 L521 R522 L523	Q515-E519 PolarHBondContact O-N 3.21Å; Q515-E519 VanDerWaalsContact O-N 3.11Å; S516-E519 PolarHBondContact O-N 3.5Å; L517-E519 VanDerWaalsContact C-N 3.33Å; L517-E519 PolarHBondContact O-N 3.08Å; E519-L521 VanDerWaalsContact C-N 3.3Å; E519-L521 PolarHBondContact O-N 3.42Å; E519-R522 VanDerWaalsContact CD-NE 3.35Å; E519-R522 WeakPolarHBondContact O-CB 3.43Å; E519-R522 PolarHBondContact O-N 3.42Å; E519-R522 IonicContact OE1-CZ 3.56Å; E519-R522 IonicContact OE1-NE 2.67Å; E519-R522 PolarHBondContact OE1-NE 2.9Å; E519-R522 IonicContact OE1-NH2 3.15Å; E519-R522 PolarHBondContact OE1-NH2 2.92Å; E519-R522 WeakPolarHBondContact OE2-CD 3.33Å; E519-R522 IonicContact OE2-CZ 3.82Å; E519-R522 IonicContact OE2-NE 3.79Å; E519-R522 PolarHBondContact OE2-NE 3.4Å; E519-R522 IonicContact OE2-NH2 3.29Å; E519-L523 HydrophobicContact CG-CD1 4.35Å; E519-L523 WeakPolarHBondContact O-CG 3.43Å; E519-L523 PolarHBondContact O-N 3.35Å
520	H	96.5	Very high	94.6	Very high	118 Å²	118	98.7 Å²	98.7	55%	0.546	50%	0.498	S	S	.	.	H	α-helix	trans	-58.9	-41.5	171.5	-74.6	100.5	0	0	0	112	S516 L517 L523 A524	S516-H520 PolarHBondContact O-N 2.79Å; S516-H520 PolarHBondContact O-ND1 2.96Å; S516-H520 PolarHBondContact OG-CE1 3.06Å; S516-H520 PolarHBondContact OG-ND1 3.17Å; L517-H520 PolarHBondContact O-N 3.07Å; H520-L523 PolarHBondContact O-N 2.87Å; H520-A524 WeakPolarHBondContact O-CB 3.36Å; H520-A524 PolarHBondContact O-N 3.12Å
521	L	95.3	Very high	94	Very high	108 Å²	108	97.5 Å²	97.5	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-63.1	-43	175	-179.8	61.5	0	0	0	111.7	L517 K518 E519 L523 A524 M525	L517-L521 WeakPolarHBondContact O-CB 3.43Å; L517-L521 PolarHBondContact O-N 3.2Å; K518-L521 PolarHBondContact O-N 2.93Å; E519-L521 VanDerWaalsContact C-N 3.3Å; E519-L521 PolarHBondContact O-N 3.42Å; L521-L523 VanDerWaalsContact C-N 3.35Å; L521-L523 PolarHBondContact O-N 2.89Å; L521-A524 PolarHBondContact O-N 3.24Å; L521-M525 HydrophobicContact CD1-CG 4.29Å; L521-M525 HydrophobicContact CD1-SD 4.3Å; L521-M525 HydrophobicContact CG-SD 4.13Å; L521-M525 WeakPolarHBondContact O-CB 3.48Å; L521-M525 VanDerWaalsContact O-CG 3.3Å; L521-M525 WeakPolarHBondContact O-CG 3.4Å; L521-M525 PolarHBondContact O-N 2.96Å
522	R	96.8	Very high	93.1	Very high	136 Å²	136	98.6 Å²	98.6	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-58.6	-45.1	175.8	-168.5	-168.3	71.2	77.3	0.5	111.7	K518 E519 M525 A526	K518-R522 PolarHBondContact O-N 3.46Å; E519-R522 VanDerWaalsContact CD-NE 3.35Å; E519-R522 WeakPolarHBondContact O-CB 3.43Å; E519-R522 PolarHBondContact O-N 3.42Å; E519-R522 IonicContact OE1-CZ 3.56Å; E519-R522 IonicContact OE1-NE 2.67Å; E519-R522 PolarHBondContact OE1-NE 2.9Å; E519-R522 IonicContact OE1-NH2 3.15Å; E519-R522 PolarHBondContact OE1-NH2 2.92Å; E519-R522 WeakPolarHBondContact OE2-CD 3.33Å; E519-R522 IonicContact OE2-CZ 3.82Å; E519-R522 IonicContact OE2-NE 3.79Å; E519-R522 PolarHBondContact OE2-NE 3.4Å; E519-R522 IonicContact OE2-NH2 3.29Å; R522-M525 PolarHBondContact O-N 3.47Å; R522-A526 PolarHBondContact O-N 3.11Å
523	L	96.4	Very high	92.2	Very high	87 Å²	87	97.8 Å²	97.8	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-42.9	178.2	-68.2	170.5	0	0	0	112	E519 H520 L521 M525 A526 A527	E519-L523 HydrophobicContact CG-CD1 4.35Å; E519-L523 WeakPolarHBondContact O-CG 3.43Å; E519-L523 PolarHBondContact O-N 3.35Å; H520-L523 PolarHBondContact O-N 2.87Å; L521-L523 VanDerWaalsContact C-N 3.35Å; L521-L523 PolarHBondContact O-N 2.89Å; L523-M525 PolarHBondContact O-N 2.78Å; L523-A526 PolarHBondContact O-N 3.39Å; L523-A527 PolarHBondContact O-N 3.39Å
524	A	94.8	Very high	91	Very high	50 Å²	50	98.6 Å²	98.6	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-41.5	175.7	0	0	0	0	0	112.2	H520 L521 A527 L528	H520-A524 WeakPolarHBondContact O-CB 3.36Å; H520-A524 PolarHBondContact O-N 3.12Å; L521-A524 PolarHBondContact O-N 3.24Å; A524-A527 PolarHBondContact O-N 3.49Å; A524-L528 WeakPolarHBondContact O-CG 3.48Å; A524-L528 PolarHBondContact O-N 3.04Å
525	M	93.3	Very high	89.5	Confident	102 Å²	102	95.9 Å²	95.9	50%	0.502	51%	0.506	S	S	.	.	H	α-helix	trans	-64	-38.3	174.6	-72.2	177.3	69.7	0	0	112.4	L521 R522 L523 Q529	L521-M525 HydrophobicContact CD1-CG 4.29Å; L521-M525 HydrophobicContact CD1-SD 4.3Å; L521-M525 HydrophobicContact CG-SD 4.13Å; L521-M525 WeakPolarHBondContact O-CB 3.48Å; L521-M525 VanDerWaalsContact O-CG 3.3Å; L521-M525 WeakPolarHBondContact O-CG 3.4Å; L521-M525 PolarHBondContact O-N 2.96Å; R522-M525 PolarHBondContact O-N 3.47Å; L523-M525 PolarHBondContact O-N 2.78Å; M525-Q529 WeakPolarHBondContact O-CG 3.48Å; M525-Q529 PolarHBondContact O-N 3.3Å; M525-Q529 VanDerWaalsContact O-N 3.15Å
526	A	92.4	Very high	87.7	Confident	38 Å²	38	96.6 Å²	96.6	31%	0.314	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-47.1	175.2	0	0	0	0	0	111.8	R522 L523 L528 Q529 E530	R522-A526 PolarHBondContact O-N 3.11Å; L523-A526 PolarHBondContact O-N 3.39Å; A526-L528 VanDerWaalsContact C-N 3.32Å; A526-L528 PolarHBondContact O-N 2.93Å; A526-Q529 WeakPolarHBondContact O-CB 3.36Å; A526-Q529 PolarHBondContact O-N 2.9Å; A526-Q529 VanDerWaalsContact O-N 3.1Å; A526-E530 PolarHBondContact O-N 2.72Å
527	A	92.3	Very high	85.9	Confident	60 Å²	60	98 Å²	98	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-38.6	177.5	0	0	0	0	0	112.7	L523 A524 E530 G531	L523-A527 PolarHBondContact O-N 3.39Å; A524-A527 PolarHBondContact O-N 3.49Å; A527-E530 PolarHBondContact O-N 2.99Å; A527-G531 PolarHBondContact O-N 3.2Å
528	L	89.6	Confident	83.9	Confident	120 Å²	120	99.4 Å²	99.4	63%	0.628	53%	0.531	S	S	*	.	H	α-helix	trans	-63.8	-39.9	173.6	-73.6	169.2	0	0	0	112.4	A524 A526 G531 Q532	A524-L528 WeakPolarHBondContact O-CG 3.48Å; A524-L528 PolarHBondContact O-N 3.04Å; A526-L528 VanDerWaalsContact C-N 3.32Å; A526-L528 PolarHBondContact O-N 2.93Å; L528-G531 PolarHBondContact O-N 3.05Å; L528-Q532 WeakPolarHBondContact O-CG 3.4Å; L528-Q532 PolarHBondContact O-N 3.36Å
529	Q	88.2	Confident	81.7	Confident	104 Å²	104	99.2 Å²	99.2	49%	0.486	54%	0.537	S	S	.	.	H	α-helix	trans	-67.9	-34.8	175.5	-71.8	-179.9	11.4	0	0	112.8	M525 A526 K533	M525-Q529 WeakPolarHBondContact O-CG 3.48Å; M525-Q529 PolarHBondContact O-N 3.3Å; M525-Q529 VanDerWaalsContact O-N 3.15Å; A526-Q529 WeakPolarHBondContact O-CB 3.36Å; A526-Q529 PolarHBondContact O-N 2.9Å; A526-Q529 VanDerWaalsContact O-N 3.1Å; Q529-K533 WeakPolarHBondContact O-CD 3.45Å; Q529-K533 VanDerWaalsContact O-CG 3.25Å; Q529-K533 WeakPolarHBondContact O-CG 3.46Å; Q529-K533 PolarHBondContact O-N 3.18Å; Q529-K533 VanDerWaalsContact O-N 3.09Å
530	E	85.8	Confident	79.4	Confident	123 Å²	123	106.9 Å²	106.9	58%	0.575	57%	0.572	S	S	*	*	H	α-helix	trans	-70.4	-42.2	174.3	-69.8	-173.6	161.6	0	0	111.7	A526 A527 Q532 K533 L534	A526-E530 PolarHBondContact O-N 2.72Å; A527-E530 PolarHBondContact O-N 2.99Å; E530-Q532 VanDerWaalsContact C-N 3.31Å; E530-Q532 PolarHBondContact O-N 3.02Å; E530-K533 PolarHBondContact O-N 2.98Å; E530-K533 VanDerWaalsContact O-N 3.16Å; E530-L534 WeakPolarHBondContact O-CG 3.48Å; E530-L534 PolarHBondContact O-N 3.48Å
531	G	82.2	Confident	78.6	Confident	44 Å²	44	106.4 Å²	106.4	45%	0.454	57%	0.574	S	S	.	*	H	α-helix	trans	-57.2	-41.8	172.2	0	0	0	0	0	112.9	A527 L528 L534 G535	A527-G531 PolarHBondContact O-N 3.2Å; L528-G531 PolarHBondContact O-N 3.05Å; G531-L534 PolarHBondContact O-N 2.85Å; G531-G535 PolarHBondContact O-N 3.37Å
532	Q	78.9	Confident	77.7	Confident	128 Å²	128	106.3 Å²	106.3	60%	0.598	57%	0.574	S	S	*	*	H	α-helix	trans	-64.7	-41.6	174.4	-74.8	174.4	-12	0	0	112.9	L528 E530 N536	L528-Q532 WeakPolarHBondContact O-CG 3.4Å; L528-Q532 PolarHBondContact O-N 3.36Å; E530-Q532 VanDerWaalsContact C-N 3.31Å; E530-Q532 PolarHBondContact O-N 3.02Å; Q532-N536 WeakPolarHBondContact O-CB 3.19Å; Q532-N536 PolarHBondContact O-N 3.48Å; Q532-N536 PolarHBondContact O-OD1 3.28Å
533	K	76.3	Confident	76.6	Confident	132 Å²	132	104.6 Å²	104.6	57%	0.574	58%	0.577	S	S	*	*	H	α-helix	trans	-64.5	-39.7	176.3	-70.8	163.2	-169.7	168.1	0	112.2	Q529 E530 S537	Q529-K533 WeakPolarHBondContact O-CD 3.45Å; Q529-K533 VanDerWaalsContact O-CG 3.25Å; Q529-K533 WeakPolarHBondContact O-CG 3.46Å; Q529-K533 PolarHBondContact O-N 3.18Å; Q529-K533 VanDerWaalsContact O-N 3.09Å; E530-K533 PolarHBondContact O-N 2.98Å; E530-K533 VanDerWaalsContact O-N 3.16Å; K533-S537 PolarHBondContact O-N 3.47Å
534	L	73.1	Confident	75.4	Confident	120 Å²	120	105.6 Å²	105.6	63%	0.628	59%	0.585	S	S	*	*	H	α-helix	trans	-71.7	-40.8	179	-70	169.1	0	0	0	112.1	E530 G531 S537	E530-L534 WeakPolarHBondContact O-CG 3.48Å; E530-L534 PolarHBondContact O-N 3.48Å; G531-L534 PolarHBondContact O-N 2.85Å; L534-S537 WeakPolarHBondContact O-CB 3.38Å; L534-S537 PolarHBondContact O-N 2.64Å; L534-S537 VanDerWaalsContact O-N 3.1Å
535	G	64.9	Low	74.2	Confident	34 Å²	34	109.1 Å²	109.1	35%	0.351	60%	0.595	S	S	.	*	H	α-helix	trans	-58.9	-49.3	172.8	0	0	0	0	0	112	G531 S537 L538	G531-G535 PolarHBondContact O-N 3.37Å; G535-S537 PolarHBondContact O-N 3.31Å; G535-L538 PolarHBondContact O-N 2.98Å
536	N	59.3	Low	73	Confident	123 Å²	123	109.6 Å²	109.6	66%	0.658	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-8.6	176	-66.5	-3.6	0	0	0	114.2	Q532	Q532-N536 WeakPolarHBondContact O-CB 3.19Å; Q532-N536 PolarHBondContact O-N 3.48Å; Q532-N536 PolarHBondContact O-OD1 3.28Å
537	S	57.6	Low	71.6	Confident	89 Å²	89	114.7 Å²	114.7	62%	0.622	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	2.3	176.5	-170.1	0	0	0	0	113.4	K533 L534 G535	K533-S537 PolarHBondContact O-N 3.47Å; L534-S537 WeakPolarHBondContact O-CB 3.38Å; L534-S537 PolarHBondContact O-N 2.64Å; L534-S537 VanDerWaalsContact O-N 3.1Å; G535-S537 PolarHBondContact O-N 3.31Å
538	L	55	Low	70	Confident	147 Å²	147	118.9 Å²	118.9	77%	0.77	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-11.1	177.9	-77.9	161.5	0	0	0	113.5	G535	G535-L538 PolarHBondContact O-N 2.98Å
539	D	51.5	Low	68.4	Low	140 Å²	140	118.8 Å²	118.8	75%	0.749	63%	0.632	S	S	*	*			trans	-96.8	32.8	177	-73.9	-37.3	0	0	0	112.9
540	H	47.8	Very low	66.6	Low	242 Å²	242	120.2 Å²	120.2	100%	1.12	65%	0.645	S	S	*	*			trans	-136.1	0	179.8	-85.2	5.2	0	0	0	112.6

Retrieved 540 of 540 residues in 83.8 ms (Link to these results)

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