A0A087YLI6_POEFO Loading...

DIX domain containing 1

AlphaFold DB , UniProt , Accession A0A087YLI6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 639 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	39.2	Very low	40.5	Very low	209 Å²	209	101.6 Å²	101.6	100%	1.03	60%	0.601	S	S	*	*				0	-63.8	0	-69.2	-168.3	-95.2	0	0	113	A3 S4	M1-A3 VanDerWaalsContact C-N 3.27Å; M1-A3 PolarHBondContact O-N 2.85Å; M1-S4 PolarHBondContact O-N 3.43Å; M1-S4 PolarHBondContact O-OG 2.99Å
2	I	41.6	Very low	40.6	Very low	66 Å²	66	102.5 Å²	102.5	34%	0.338	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-67	-23.3	-174.7	-58.7	166.4	0	0	0	114.2	S4 L5 W30	I2-S4 PolarHBondContact O-N 3.44Å; I2-L5 PolarHBondContact O-N 3.16Å; I2-L5 VanDerWaalsContact O-N 3.13Å; I2-W30 HydrophobicContact CD1-CB 3.59Å; I2-W30 HydrophobicContact CD1-CG 3.57Å
3	A	37.7	Very low	41	Very low	74 Å²	74	105.3 Å²	105.3	61%	0.612	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-54.8	-26.2	176.3	0	0	0	0	0	114.1	M1 L5 S6	M1-A3 VanDerWaalsContact C-N 3.27Å; M1-A3 PolarHBondContact O-N 2.85Å; A3-L5 VanDerWaalsContact C-N 3.35Å; A3-L5 PolarHBondContact O-N 2.96Å; A3-S6 WeakPolarHBondContact O-CB 3.3Å
4	S	38.3	Very low	41.6	Very low	89 Å²	89	100.2 Å²	100.2	62%	0.622	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-67.6	-29.4	179.9	-46.5	0	0	0	0	113.8	M1 I2 S6	M1-S4 PolarHBondContact O-N 3.43Å; M1-S4 PolarHBondContact O-OG 2.99Å; I2-S4 PolarHBondContact O-N 3.44Å; S4-S6 PolarHBondContact O-N 2.91Å
5	L	44.4	Very low	42	Very low	56 Å²	56	96.3 Å²	96.3	29%	0.293	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-82.2	9.5	-174.3	-61.3	175	0	0	0	113.7	I2 A3	I2-L5 PolarHBondContact O-N 3.16Å; I2-L5 VanDerWaalsContact O-N 3.13Å; A3-L5 VanDerWaalsContact C-N 3.35Å; A3-L5 PolarHBondContact O-N 2.96Å
6	S	39	Very low	42.2	Very low	71 Å²	71	100.4 Å²	100.4	50%	0.497	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-104.2	11.3	-164.6	-165.4	0	0	0	0	114.5	A3 S4	A3-S6 WeakPolarHBondContact O-CB 3.3Å; S4-S6 PolarHBondContact O-N 2.91Å
7	R	37.4	Very low	42.2	Very low	196 Å²	196	97.6 Å²	97.6	74%	0.74	56%	0.563	S	S	*	*			trans	-80.9	122.4	173.5	-62.9	-167.7	-169.4	-166.9	7.5	109.4	S9 L10	R7-S9 PolarHBondContact O-N 3.33Å; R7-L10 PolarHBondContact O-N 3.35Å; R7-L10 VanDerWaalsContact O-N 3.16Å
8	G	39.3	Very low	42.5	Very low	84 Å²	84	96.1 Å²	96.1	87%	0.866	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	12.1	-167.8	0	0	0	0	0	118.3
9	S	37.5	Very low	43.5	Very low	103 Å²	103	95.6 Å²	95.6	72%	0.72	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-17.2	173	-157.7	0	0	0	0	112.7	R7 L11	R7-S9 PolarHBondContact O-N 3.33Å; S9-L11 PolarHBondContact O-N 3.47Å
10	L	43.9	Very low	44.8	Very low	59 Å²	59	96.5 Å²	96.5	31%	0.309	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.6	28.8	-170	-131.3	170.8	0	0	0	113.7	R7 E13 V14	R7-L10 PolarHBondContact O-N 3.35Å; R7-L10 VanDerWaalsContact O-N 3.16Å; L10-E13 HydrophobicContact CD2-CB 4.06Å; L10-E13 WeakPolarHBondContact CG-OE2 3.19Å; L10-V14 HydrophobicContact CD2-CG2 3.71Å; L10-V14 VanDerWaalsContact O-CG2 3.27Å; L10-V14 WeakPolarHBondContact O-CG2 3.44Å
11	L	46.8	Very low	46.1	Very low	111 Å²	111	99.9 Å²	99.9	58%	0.581	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-21.9	173.3	-82.1	169.1	0	0	0	112.8	S9	S9-L11 PolarHBondContact O-N 3.47Å
12	D	42.5	Very low	47.8	Very low	112 Å²	112	98.1 Å²	98.1	60%	0.599	56%	0.562	S	S	*	*	S	Bend	trans	-99.8	-35.1	-174.4	-134.4	31.1	0	0	0	112.7	V14 L15 H16	D12-V14 VanDerWaalsContact C-N 3.28Å; D12-V14 PolarHBondContact O-N 2.93Å; D12-L15 VanDerWaalsContact O-CB 3.22Å; D12-L15 WeakPolarHBondContact O-CB 3.48Å; D12-L15 VanDerWaalsContact O-CG 3.31Å; D12-L15 WeakPolarHBondContact O-CG 3.39Å; D12-L15 PolarHBondContact O-N 2.83Å; D12-L15 VanDerWaalsContact OD1-CD1 3.29Å; D12-L15 WeakPolarHBondContact OD1-CD1 3.44Å; D12-H16 PolarHBondContact O-ND1 3.28Å
13	E	46	Very low	49.6	Very low	139 Å²	139	96.9 Å²	96.9	65%	0.65	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-64.6	-31.4	172.9	-67.4	179.7	116.9	0	0	112.6	L10 L15 H16	L10-E13 HydrophobicContact CD2-CB 4.06Å; L10-E13 WeakPolarHBondContact CG-OE2 3.19Å; E13-L15 PolarHBondContact O-N 3.4Å; E13-H16 PolarHBondContact O-N 2.98Å
14	V	48.8	Very low	51.7	Low	34 Å²	34	95.5 Å²	95.5	21%	0.206	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-63	-7	173.2	174	0	0	0	0	112.1	L10 D12	L10-V14 HydrophobicContact CD2-CG2 3.71Å; L10-V14 VanDerWaalsContact O-CG2 3.27Å; L10-V14 WeakPolarHBondContact O-CG2 3.44Å; D12-V14 VanDerWaalsContact C-N 3.28Å; D12-V14 PolarHBondContact O-N 2.93Å
15	L	47.2	Very low	53.9	Low	41 Å²	41	94 Å²	94	22%	0.215	53%	0.53	C	S	.	.	G	3₁₀ helix	trans	-91.3	-21.2	-177.9	-49.3	-173.3	0	0	0	114.6	D12 E13 K114	D12-L15 VanDerWaalsContact O-CB 3.22Å; D12-L15 WeakPolarHBondContact O-CB 3.48Å; D12-L15 VanDerWaalsContact O-CG 3.31Å; D12-L15 WeakPolarHBondContact O-CG 3.39Å; D12-L15 PolarHBondContact O-N 2.83Å; D12-L15 VanDerWaalsContact OD1-CD1 3.29Å; D12-L15 WeakPolarHBondContact OD1-CD1 3.44Å; E13-L15 PolarHBondContact O-N 3.4Å; L15-K114 PolarHBondContact O-NZ 3.33Å
16	H	45.8	Very low	55.8	Low	163 Å²	163	93 Å²	93	76%	0.755	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	-5.9	-162.1	-62.8	108.2	0	0	0	116.4	D12 E13	D12-H16 PolarHBondContact O-ND1 3.28Å; E13-H16 PolarHBondContact O-N 2.98Å
17	G	41.6	Very low	58.2	Low	53 Å²	53	90.2 Å²	90.2	55%	0.546	51%	0.508	S	S	.	.	S	Bend	trans	-100.9	155.1	174	0	0	0	0	0	113.6
18	G	48.8	Very low	60.6	Low	70 Å²	70	82.1 Å²	82.1	72%	0.722	48%	0.48	S	S	*	.			trans	-62.1	138	167.5	0	0	0	0	0	111.2	N20	G18-N20 PolarHBondContact O-N 3.01Å
19	Y	60.6	Low	63	Low	86 Å²	86	81.4 Å²	81.4	34%	0.337	46%	0.463	S	S	.	.			trans	-64.6	108.4	-174.7	-55.3	-82.2	0	0	0	111.4	E21 L113 K114 M117	Y19-E21 PolarHBondContact O-N 3.22Å; Y19-L113 HydrophobicContact CD1-CD2 4.44Å; Y19-L113 HydrophobicContact CD2-CD2 4.31Å; Y19-L113 HydrophobicContact CG-CD2 4.23Å; Y19-K114 HydrophobicContact CE1-CG 4.5Å; Y19-K114 WeakPolarHBondContact OH-CB 3.25Å; Y19-M117 HydrophobicContact CD1-CE 4.11Å; Y19-M117 HydrophobicContact CD1-SD 3.8Å; Y19-M117 HydrophobicContact CE1-SD 4.04Å
20	N	68.9	Low	65.5	Low	114 Å²	114	78.1 Å²	78.1	61%	0.61	43%	0.434	S	S	*	.			trans	-59.6	123.7	176.4	-75.3	-36.3	0	0	0	110.6	G18 Q22 Q23 L24	G18-N20 PolarHBondContact O-N 3.01Å; N20-Q22 PolarHBondContact O-N 3.03Å; N20-Q23 HydrophobicContact CB-CB 4.27Å; N20-Q23 WeakPolarHBondContact O-CA 3.44Å; N20-Q23 VanDerWaalsContact O-CB 3.23Å; N20-Q23 WeakPolarHBondContact O-CB 3.48Å; N20-Q23 PolarHBondContact O-N 3.38Å; N20-L24 PolarHBondContact O-N 2.83Å
21	E	73.1	Confident	67.7	Low	168 Å²	168	75.3 Å²	75.3	79%	0.785	42%	0.419	S	S	*	.	H	α-helix	trans	-55	-38.1	-178.4	-173.9	173.5	-150.8	0	0	112.3	Y19 Q23 L24 A25	Y19-E21 PolarHBondContact O-N 3.22Å; E21-Q23 VanDerWaalsContact C-N 3.27Å; E21-Q23 PolarHBondContact O-N 2.64Å; E21-L24 PolarHBondContact O-N 3.5Å; E21-L24 VanDerWaalsContact O-N 3.14Å; E21-A25 PolarHBondContact O-N 2.94Å
22	Q	75.1	Confident	69.8	Low	172 Å²	172	71 Å²	71	80%	0.804	40%	0.397	S	S	*	.	H	α-helix	trans	-58.1	-35.1	173.3	-60.6	179.8	1.9	0	0	113.3	N20 A26	N20-Q22 PolarHBondContact O-N 3.03Å; Q22-A26 WeakPolarHBondContact O-CB 3.38Å; Q22-A26 PolarHBondContact O-N 3.37Å
23	Q	78.9	Confident	72	Confident	40 Å²	40	68.8 Å²	68.8	19%	0.187	39%	0.39	C	S	.	.	H	α-helix	trans	-71.7	-39.7	177.5	-163.1	-169.2	16.6	0	0	110.8	N20 E21 A26 Y27 M117	N20-Q23 HydrophobicContact CB-CB 4.27Å; N20-Q23 WeakPolarHBondContact O-CA 3.44Å; N20-Q23 VanDerWaalsContact O-CB 3.23Å; N20-Q23 WeakPolarHBondContact O-CB 3.48Å; N20-Q23 PolarHBondContact O-N 3.38Å; E21-Q23 VanDerWaalsContact C-N 3.27Å; E21-Q23 PolarHBondContact O-N 2.64Å; Q23-A26 WeakPolarHBondContact O-CB 3.46Å; Q23-A26 PolarHBondContact O-N 3.01Å; Q23-Y27 HydrophobicContact CG-CD2 4.22Å; Q23-Y27 HydrophobicContact CG-CE2 3.8Å; Q23-Y27 WeakPolarHBondContact O-CD2 3.49Å; Q23-Y27 PolarHBondContact O-N 3.44Å; Q23-Y27 VanDerWaalsContact O-N 3.1Å; Q23-M117 HydrophobicContact CG-CE 4.37Å
24	L	82.8	Confident	73.9	Confident	44 Å²	44	63.5 Å²	63.5	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-65.4	-45.9	176.2	-55.9	-177.2	0	0	0	110.9	N20 E21 A26 Y27 V28 L113 M117	N20-L24 PolarHBondContact O-N 2.83Å; E21-L24 PolarHBondContact O-N 3.5Å; E21-L24 VanDerWaalsContact O-N 3.14Å; L24-A26 VanDerWaalsContact C-N 3.27Å; L24-A26 PolarHBondContact O-N 3.47Å; L24-Y27 PolarHBondContact O-N 3.48Å; L24-Y27 VanDerWaalsContact O-N 3.15Å; L24-V28 WeakPolarHBondContact O-CG2 3.44Å; L24-V28 PolarHBondContact O-N 3.1Å; L24-L113 HydrophobicContact CD1-CD2 4.18Å; L24-L113 HydrophobicContact CD2-CD1 4.26Å; L24-L113 HydrophobicContact CD2-CD2 3.88Å; L24-L113 HydrophobicContact CD2-CG 4.42Å; L24-M117 HydrophobicContact CD2-CE 3.78Å; L24-M117 HydrophobicContact CD2-CG 4.49Å; L24-M117 HydrophobicContact CD2-SD 3.62Å
25	A	83.3	Confident	75.7	Confident	58 Å²	58	62 Å²	62	48%	0.479	36%	0.357	S	S	.	.	H	α-helix	trans	-57.5	-38	173.1	0	0	0	0	0	112.4	E21 S29	E21-A25 PolarHBondContact O-N 2.94Å; A25-S29 WeakPolarHBondContact O-CB 3.43Å; A25-S29 PolarHBondContact O-N 3.01Å
26	A	85.6	Confident	77.6	Confident	34 Å²	34	68 Å²	68	28%	0.281	38%	0.381	S	S	.	.	H	α-helix	trans	-66.2	-40	175.7	0	0	0	0	0	113.1	Q22 Q23 L24 W30	Q22-A26 WeakPolarHBondContact O-CB 3.38Å; Q22-A26 PolarHBondContact O-N 3.37Å; Q23-A26 WeakPolarHBondContact O-CB 3.46Å; Q23-A26 PolarHBondContact O-N 3.01Å; L24-A26 VanDerWaalsContact C-N 3.27Å; L24-A26 PolarHBondContact O-N 3.47Å; A26-W30 PolarHBondContact O-N 3.29Å
27	Y	88.4	Confident	79.4	Confident	13 Å²	13	67.8 Å²	67.8	5%	0.051	37%	0.374	C	S	.	.	H	α-helix	trans	-68.7	-45.4	175.1	-76.9	-63	0	0	0	112.3	Q23 L24 S29 W30 V31 M117 I120 L121	Q23-Y27 HydrophobicContact CG-CD2 4.22Å; Q23-Y27 HydrophobicContact CG-CE2 3.8Å; Q23-Y27 WeakPolarHBondContact O-CD2 3.49Å; Q23-Y27 PolarHBondContact O-N 3.44Å; Q23-Y27 VanDerWaalsContact O-N 3.1Å; L24-Y27 PolarHBondContact O-N 3.48Å; L24-Y27 VanDerWaalsContact O-N 3.15Å; Y27-S29 VanDerWaalsContact C-N 3.33Å; Y27-S29 PolarHBondContact O-N 2.74Å; Y27-W30 PolarHBondContact O-N 3.39Å; Y27-W30 VanDerWaalsContact O-N 3.17Å; Y27-V31 PolarHBondContact O-N 3.33Å; Y27-M117 HydrophobicContact CD2-CE 3.85Å; Y27-M117 HydrophobicContact CD2-CG 4.18Å; Y27-M117 HydrophobicContact CE2-CB 4.32Å; Y27-M117 HydrophobicContact CE2-CE 3.44Å; Y27-M117 VanDerWaalsContact CE2-CE 3.44Å; Y27-M117 HydrophobicContact CE2-CG 4.23Å; Y27-I120 HydrophobicContact CD1-CB 4.24Å; Y27-I120 HydrophobicContact CD1-CG2 3.66Å; Y27-I120 HydrophobicContact CE1-CG2 4.32Å; Y27-L121 HydrophobicContact CE1-CB 4.04Å; Y27-L121 HydrophobicContact CE1-CD1 4.32Å
28	V	88.9	Confident	81.2	Confident	26 Å²	26	69.5 Å²	69.5	16%	0.158	37%	0.366	C	S	.	.	H	α-helix	trans	-56.8	-47.6	173.7	170.5	0	0	0	0	110.5	L24 W30 V31 N32 I44 L47	L24-V28 WeakPolarHBondContact O-CG2 3.44Å; L24-V28 PolarHBondContact O-N 3.1Å; V28-W30 VanDerWaalsContact C-N 3.32Å; V28-W30 PolarHBondContact O-N 2.73Å; V28-V31 PolarHBondContact O-N 3.17Å; V28-N32 WeakPolarHBondContact CG1-ND2 3.38Å; V28-N32 WeakPolarHBondContact O-CB 3.5Å; V28-N32 PolarHBondContact O-N 2.91Å; V28-N32 PolarHBondContact O-ND2 2.86Å; V28-I44 HydrophobicContact CG1-CG1 4.5Å; V28-L47 HydrophobicContact CB-CD2 4.45Å; V28-L47 HydrophobicContact CG2-CD1 4.23Å; V28-L47 HydrophobicContact CG2-CD2 3.6Å; V28-L47 HydrophobicContact CG2-CG 3.61Å
29	S	88.6	Confident	82.2	Confident	70 Å²	70	74.5 Å²	74.5	49%	0.49	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-38.5	177.1	-175.5	0	0	0	0	112.4	A25 Y27 S33	A25-S29 WeakPolarHBondContact O-CB 3.43Å; A25-S29 PolarHBondContact O-N 3.01Å; Y27-S29 VanDerWaalsContact C-N 3.33Å; Y27-S29 PolarHBondContact O-N 2.74Å; S29-S33 WeakPolarHBondContact O-CB 3.42Å; S29-S33 PolarHBondContact O-N 3.4Å; S29-S33 PolarHBondContact O-OG 3.16Å
30	W	90	Very high	82.8	Confident	33 Å²	33	74 Å²	74	13%	0.125	40%	0.396	C	S	.	.	H	α-helix	trans	-67.1	-48.7	176.1	-175	70	0	0	0	113.3	I2 A26 Y27 V28 N32 S33 Q34 L60 V64 I120 L123 A124	I2-W30 HydrophobicContact CD1-CB 3.59Å; I2-W30 HydrophobicContact CD1-CG 3.57Å; A26-W30 PolarHBondContact O-N 3.29Å; Y27-W30 PolarHBondContact O-N 3.39Å; Y27-W30 VanDerWaalsContact O-N 3.17Å; V28-W30 VanDerWaalsContact C-N 3.32Å; V28-W30 PolarHBondContact O-N 2.73Å; W30-N32 PolarHBondContact O-N 3.29Å; W30-S33 WeakPolarHBondContact O-CA 3.33Å; W30-S33 WeakPolarHBondContact O-CB 3.43Å; W30-S33 PolarHBondContact O-N 2.66Å; W30-Q34 HydrophobicContact CD2-CG 4.38Å; W30-Q34 HydrophobicContact CH2-CG 4.15Å; W30-Q34 HydrophobicContact CZ2-CG 3.83Å; W30-Q34 PolarHBondContact O-N 2.7Å; W30-Q34 VanDerWaalsContact O-N 3.09Å; W30-L60 HydrophobicContact CH2-CD1 4.06Å; W30-L60 HydrophobicContact CZ3-CD1 3.94Å; W30-L60 HydrophobicContact CZ3-CD2 4.03Å; W30-L60 HydrophobicContact CZ3-CG 4.48Å; W30-V64 HydrophobicContact CH2-CG2 4.44Å; W30-I120 HydrophobicContact CE3-CG2 3.55Å; W30-I120 HydrophobicContact CZ3-CG2 3.76Å; W30-L123 HydrophobicContact CH2-CB 4.38Å; W30-A124 HydrophobicContact CD2-CB 3.97Å; W30-A124 HydrophobicContact CE3-CB 4.07Å; W30-A124 HydrophobicContact CH2-CB 3.68Å; W30-A124 HydrophobicContact CZ2-CB 3.56Å; W30-A124 HydrophobicContact CZ3-CB 3.92Å
31	V	89.4	Confident	83.3	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-61.8	-47.1	179.7	177.6	0	0	0	0	109.6	Y27 V28 S33 Q34 L35 I44 V56 L60 I120	Y27-V31 PolarHBondContact O-N 3.33Å; V28-V31 PolarHBondContact O-N 3.17Å; V31-S33 PolarHBondContact O-N 3.01Å; V31-Q34 WeakPolarHBondContact O-CA 3.37Å; V31-Q34 PolarHBondContact O-N 3.31Å; V31-L35 HydrophobicContact CG1-CD1 3.95Å; V31-L35 HydrophobicContact CG1-CG 4.14Å; V31-L35 WeakPolarHBondContact O-CG 3.48Å; V31-L35 PolarHBondContact O-N 3Å; V31-I44 HydrophobicContact CB-CD1 3.85Å; V31-I44 HydrophobicContact CG1-CD1 3.6Å; V31-I44 HydrophobicContact CG1-CG1 4.33Å; V31-I44 HydrophobicContact CG2-CD1 4.45Å; V31-V56 HydrophobicContact CG1-CG1 4.24Å; V31-L60 HydrophobicContact CG2-CD2 4.45Å; V31-I120 HydrophobicContact CG2-CD1 4.12Å; V31-I120 HydrophobicContact CG2-CG1 4.2Å; V31-I120 HydrophobicContact CG2-CG2 3.81Å
32	N	91.3	Very high	83.7	Confident	22 Å²	22	70.3 Å²	70.3	12%	0.118	38%	0.376	C	S	.	.	H	α-helix	trans	-59.4	-30.3	173.3	-75.9	-28.7	0	0	0	113.9	V28 W30 Q34 K36 P43 I44	V28-N32 WeakPolarHBondContact CG1-ND2 3.38Å; V28-N32 WeakPolarHBondContact O-CB 3.5Å; V28-N32 PolarHBondContact O-N 2.91Å; V28-N32 PolarHBondContact O-ND2 2.86Å; W30-N32 PolarHBondContact O-N 3.29Å; N32-Q34 VanDerWaalsContact C-N 3.32Å; N32-K36 WeakPolarHBondContact O-CB 3.42Å; N32-K36 WeakPolarHBondContact O-CD 3.46Å; N32-K36 VanDerWaalsContact O-CG 3.24Å; N32-K36 WeakPolarHBondContact O-CG 3.44Å; N32-K36 PolarHBondContact O-N 3.33Å; N32-P43 WeakPolarHBondContact OD1-CA 3.41Å; N32-I44 PolarHBondContact ND2-O 2.99Å; N32-I44 WeakPolarHBondContact OD1-CG1 3.38Å; N32-I44 PolarHBondContact OD1-N 3.07Å
33	S	88.6	Confident	84.2	Confident	64 Å²	64	66.1 Å²	66.1	45%	0.448	36%	0.364	S	S	.	.	H	α-helix	trans	-73.1	-23.2	173.3	-59	0	0	0	0	113.1	S29 W30 V31	S29-S33 WeakPolarHBondContact O-CB 3.42Å; S29-S33 PolarHBondContact O-N 3.4Å; S29-S33 PolarHBondContact O-OG 3.16Å; W30-S33 WeakPolarHBondContact O-CA 3.33Å; W30-S33 WeakPolarHBondContact O-CB 3.43Å; W30-S33 PolarHBondContact O-N 2.66Å; V31-S33 PolarHBondContact O-N 3.01Å
34	Q	87.3	Confident	84.7	Confident	28 Å²	28	64.9 Å²	64.9	13%	0.131	36%	0.359	C	S	.	.	H	α-helix	trans	-81	-51.1	168.7	-56.7	-45.4	-46.5	0	0	110.8	W30 V31 N32 K36 R37 L60 I63 V64	W30-Q34 HydrophobicContact CD2-CG 4.38Å; W30-Q34 HydrophobicContact CH2-CG 4.15Å; W30-Q34 HydrophobicContact CZ2-CG 3.83Å; W30-Q34 PolarHBondContact O-N 2.7Å; W30-Q34 VanDerWaalsContact O-N 3.09Å; V31-Q34 WeakPolarHBondContact O-CA 3.37Å; V31-Q34 PolarHBondContact O-N 3.31Å; N32-Q34 VanDerWaalsContact C-N 3.32Å; Q34-K36 PolarHBondContact O-N 3.05Å; Q34-K36 VanDerWaalsContact O-N 3.12Å; Q34-R37 WeakPolarHBondContact O-CB 3.44Å; Q34-R37 WeakPolarHBondContact O-CG 3.29Å; Q34-R37 PolarHBondContact O-N 3.31Å; Q34-L60 HydrophobicContact CB-CD1 3.65Å; Q34-L60 HydrophobicContact CG-CD1 3.77Å; Q34-I63 HydrophobicContact CB-CG2 4.04Å; Q34-I63 WeakPolarHBondContact O-CG2 3.3Å; Q34-V64 HydrophobicContact CB-CG2 4.16Å; Q34-V64 HydrophobicContact CG-CG2 3.77Å
35	L	86.5	Confident	84.8	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-53.1	-39.6	-177.1	-63.2	174.4	0	0	0	112.3	V31 R37 K38 L41 I44 V56 Q59 I63	V31-L35 HydrophobicContact CG1-CD1 3.95Å; V31-L35 HydrophobicContact CG1-CG 4.14Å; V31-L35 WeakPolarHBondContact O-CG 3.48Å; V31-L35 PolarHBondContact O-N 3Å; L35-R37 PolarHBondContact O-N 2.86Å; L35-K38 PolarHBondContact O-N 2.92Å; L35-K38 VanDerWaalsContact O-O 3.12Å; L35-L41 HydrophobicContact CB-CB 4.35Å; L35-L41 HydrophobicContact CB-CD1 4.26Å; L35-L41 HydrophobicContact CD2-CD1 3.74Å; L35-I44 HydrophobicContact CD1-CG2 4.11Å; L35-V56 HydrophobicContact CD1-CG1 4.15Å; L35-V56 HydrophobicContact CD2-CG1 4.3Å; L35-Q59 HydrophobicContact CD2-CB 4.34Å; L35-I63 HydrophobicContact CD2-CD1 4.35Å
36	K	85.7	Confident	85	Confident	167 Å²	167	65.5 Å²	65.5	73%	0.726	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-12.6	173.7	-78.3	174.3	179.9	-177.2	0	115.9	N32 Q34 K38	N32-K36 WeakPolarHBondContact O-CB 3.42Å; N32-K36 WeakPolarHBondContact O-CD 3.46Å; N32-K36 VanDerWaalsContact O-CG 3.24Å; N32-K36 WeakPolarHBondContact O-CG 3.44Å; N32-K36 PolarHBondContact O-N 3.33Å; Q34-K36 PolarHBondContact O-N 3.05Å; Q34-K36 VanDerWaalsContact O-N 3.12Å; K36-K38 VanDerWaalsContact C-N 3.34Å
37	R	83.4	Confident	85.1	Confident	158 Å²	158	64 Å²	64	60%	0.596	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.7	175.4	-61.3	170	58.5	-153.1	-12.9	112.9	Q34 L35 I63	Q34-R37 WeakPolarHBondContact O-CB 3.44Å; Q34-R37 WeakPolarHBondContact O-CG 3.29Å; Q34-R37 PolarHBondContact O-N 3.31Å; L35-R37 PolarHBondContact O-N 2.86Å; R37-I63 HydrophobicContact CB-CG2 3.93Å; R37-I63 HydrophobicContact CG-CG2 4.46Å; R37-I63 PolarHBondContact NH1-O 3.09Å; R37-I63 VanDerWaalsContact NH1-O 3.13Å; R37-I63 PolarHBondContact NH2-O 3.29Å; R37-I63 VanDerWaalsContact NH2-O 3.12Å
38	K	79.8	Confident	85.1	Confident	89 Å²	89	68.5 Å²	68.5	39%	0.387	37%	0.373	S	S	.	.	S	Bend	trans	-117.2	121.6	174.5	-165.5	-180	-172.2	-172.7	0	108.3	L35 K36 L41 E62 I63	L35-K38 PolarHBondContact O-N 2.92Å; L35-K38 VanDerWaalsContact O-O 3.12Å; K36-K38 VanDerWaalsContact C-N 3.34Å; K38-L41 HydrophobicContact CB-CD1 3.87Å; K38-L41 HydrophobicContact CB-CG 4.12Å; K38-L41 HydrophobicContact CD-CD1 4.06Å; K38-L41 HydrophobicContact CD-CD2 4.49Å; K38-L41 HydrophobicContact CD-CG 4.36Å; K38-L41 HydrophobicContact CG-CD1 4.37Å; K38-L41 HydrophobicContact CG-CG 4.41Å; K38-E62 IonicContact NZ-OE2 2.66Å; K38-E62 PolarHBondContact NZ-OE2 3.28Å; K38-I63 HydrophobicContact CB-CD1 3.8Å; K38-I63 HydrophobicContact CB-CG1 4.05Å; K38-I63 HydrophobicContact CD-CD1 4.47Å; K38-I63 HydrophobicContact CD-CG1 4.44Å
39	L	70.2	Confident	85	Confident	174 Å²	174	76 Å²	76	91%	0.911	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	141.6	-177.8	-64.7	174.3	0	0	0	110.8
40	G	73.3	Confident	85	Confident	76 Å²	76	75.3 Å²	75.3	78%	0.784	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-4.2	176.8	0	0	0	0	0	116.4
41	L	80.1	Confident	85	Confident	47 Å²	47	73.8 Å²	73.8	25%	0.246	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-80	138.2	175.7	-58.2	-168.4	0	0	0	112.1	L35 K38 Q59 I63	L35-L41 HydrophobicContact CB-CB 4.35Å; L35-L41 HydrophobicContact CB-CD1 4.26Å; L35-L41 HydrophobicContact CD2-CD1 3.74Å; K38-L41 HydrophobicContact CB-CD1 3.87Å; K38-L41 HydrophobicContact CB-CG 4.12Å; K38-L41 HydrophobicContact CD-CD1 4.06Å; K38-L41 HydrophobicContact CD-CD2 4.49Å; K38-L41 HydrophobicContact CD-CG 4.36Å; K38-L41 HydrophobicContact CG-CD1 4.37Å; K38-L41 HydrophobicContact CG-CG 4.41Å; L41-Q59 HydrophobicContact CD1-CB 4.26Å; L41-I63 HydrophobicContact CD1-CD1 3.79Å
42	Q	79.8	Confident	85	Confident	157 Å²	157	76.9 Å²	76.9	73%	0.734	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-79.6	145.6	175.3	-64.8	-61.8	-22	0	0	111.4
43	P	85.7	Confident	84.8	Confident	85 Å²	85	78.2 Å²	78.2	55%	0.552	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-75.7	140	172.8	32.2	-33.5	0	0	0	111.2	N32	N32-P43 WeakPolarHBondContact OD1-CA 3.41Å
44	I	90.1	Very high	84.7	Confident	13 Å²	13	75.1 Å²	75.1	7%	0.067	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-82.6	151.8	174.3	65.6	170.5	0	0	0	111.9	V28 V31 N32 L35 L47 D50 L51 V56	V28-I44 HydrophobicContact CG1-CG1 4.5Å; V31-I44 HydrophobicContact CB-CD1 3.85Å; V31-I44 HydrophobicContact CG1-CD1 3.6Å; V31-I44 HydrophobicContact CG1-CG1 4.33Å; V31-I44 HydrophobicContact CG2-CD1 4.45Å; N32-I44 PolarHBondContact ND2-O 2.99Å; N32-I44 WeakPolarHBondContact OD1-CG1 3.38Å; N32-I44 PolarHBondContact OD1-N 3.07Å; L35-I44 HydrophobicContact CD1-CG2 4.11Å; I44-L47 HydrophobicContact CD1-CD2 3.73Å; I44-D50 WeakPolarHBondContact CA-OD2 3.29Å; I44-D50 HydrophobicContact CB-CB 3.76Å; I44-D50 WeakPolarHBondContact CB-OD2 3.49Å; I44-D50 HydrophobicContact CG2-CB 3.58Å; I44-L51 HydrophobicContact CD1-CD1 3.59Å; I44-V56 HydrophobicContact CG2-CG1 4.05Å; I44-V56 HydrophobicContact CG2-CG2 4.18Å
45	G	85.2	Confident	84.7	Confident	63 Å²	63	74 Å²	74	65%	0.649	38%	0.38	S	S	*	.	S	Bend	trans	-117	-38.8	177.5	0	0	0	0	0	114.1	D50	G45-D50 PolarHBondContact N-OD2 2.77Å
46	D	86.9	Confident	84.9	Confident	52 Å²	52	74.8 Å²	74.8	28%	0.278	39%	0.385	S	S	.	.			trans	-126.6	110.4	179.5	179.3	4.6	0	0	0	110.7	R48 R49 D50	D46-R48 PolarHBondContact O-N 3.24Å; D46-R48 VanDerWaalsContact OD1-CB 3.31Å; D46-R48 WeakPolarHBondContact OD1-CB 3.28Å; D46-R48 PolarHBondContact OD1-N 2.83Å; D46-R49 HydrophobicContact CB-CB 4.32Å; D46-R49 HydrophobicContact CB-CG 4.35Å; D46-R49 PolarHBondContact O-N 2.82Å; D46-R49 VanDerWaalsContact OD2-CD 3.27Å; D46-R49 WeakPolarHBondContact OD2-CD 3.13Å; D46-R49 WeakPolarHBondContact OD2-CG 3.25Å; D46-R49 IonicContact OD2-NE 3.11Å; D46-R49 PolarHBondContact OD2-NE 3.39Å; D46-R49 VanDerWaalsContact OD2-NE 3.11Å; D46-D50 PolarHBondContact N-OD2 2.9Å; D46-D50 PolarHBondContact O-N 2.89Å
47	L	87.8	Confident	85.1	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-31	176.9	-58.4	179.4	0	0	0	113.1	V28 I44 L113 I116 I120	V28-L47 HydrophobicContact CB-CD2 4.45Å; V28-L47 HydrophobicContact CG2-CD1 4.23Å; V28-L47 HydrophobicContact CG2-CD2 3.6Å; V28-L47 HydrophobicContact CG2-CG 3.61Å; I44-L47 HydrophobicContact CD1-CD2 3.73Å; L47-L113 HydrophobicContact CB-CD1 4.01Å; L47-L113 HydrophobicContact CD1-CD1 4.25Å; L47-I116 HydrophobicContact CB-CG2 4.25Å; L47-I120 HydrophobicContact CD1-CD1 4.12Å; L47-I120 HydrophobicContact CD2-CD1 3.82Å; L47-I120 HydrophobicContact CG-CD1 4.46Å
48	R	88	Confident	85.4	Confident	106 Å²	106	59.6 Å²	59.6	40%	0.4	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-32.8	-179.9	-61.9	-177.5	-175	-104.8	8.1	112.6	D46 Q52 L113	D46-R48 PolarHBondContact O-N 3.24Å; D46-R48 VanDerWaalsContact OD1-CB 3.31Å; D46-R48 WeakPolarHBondContact OD1-CB 3.28Å; D46-R48 PolarHBondContact OD1-N 2.83Å; R48-Q52 VanDerWaalsContact O-CG 3.3Å; R48-Q52 WeakPolarHBondContact O-CG 3.43Å; R48-Q52 PolarHBondContact O-NE2 3.11Å; R48-L113 HydrophobicContact CG-CB 4.01Å; R48-L113 HydrophobicContact CG-CD1 4.07Å; R48-L113 HydrophobicContact CG-CG 4.43Å
49	R	87.3	Confident	85.8	Confident	185 Å²	185	57.3 Å²	57.3	70%	0.698	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-49.5	-172.7	-66	172.5	-169.9	-153.9	-5.4	110.5	D46 L51 Q52	D46-R49 HydrophobicContact CB-CB 4.32Å; D46-R49 HydrophobicContact CB-CG 4.35Å; D46-R49 PolarHBondContact O-N 2.82Å; D46-R49 VanDerWaalsContact OD2-CD 3.27Å; D46-R49 WeakPolarHBondContact OD2-CD 3.13Å; D46-R49 WeakPolarHBondContact OD2-CG 3.25Å; D46-R49 IonicContact OD2-NE 3.11Å; D46-R49 PolarHBondContact OD2-NE 3.39Å; D46-R49 VanDerWaalsContact OD2-NE 3.11Å; R49-L51 PolarHBondContact O-N 3.08Å; R49-L51 VanDerWaalsContact O-N 3.13Å; R49-Q52 PolarHBondContact O-N 2.95Å
50	D	89.2	Confident	86.7	Confident	55 Å²	55	49.1 Å²	49.1	29%	0.294	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-3.9	-166.4	-50.9	-24.5	0	0	0	113.1	I44 G45 D46 V56	I44-D50 WeakPolarHBondContact CA-OD2 3.29Å; I44-D50 HydrophobicContact CB-CB 3.76Å; I44-D50 WeakPolarHBondContact CB-OD2 3.49Å; I44-D50 HydrophobicContact CG2-CB 3.58Å; G45-D50 PolarHBondContact N-OD2 2.77Å; D46-D50 PolarHBondContact N-OD2 2.9Å; D46-D50 PolarHBondContact O-N 2.89Å; D50-V56 WeakPolarHBondContact O-CB 3.19Å; D50-V56 WeakPolarHBondContact O-CG2 3.22Å
51	L	89.5	Confident	87.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-2.8	175.8	-79.2	67.9	0	0	0	113.6	I44 R49 D53 G54 V56 L57 I116 I120	I44-L51 HydrophobicContact CD1-CD1 3.59Å; R49-L51 PolarHBondContact O-N 3.08Å; R49-L51 VanDerWaalsContact O-N 3.13Å; L51-D53 PolarHBondContact O-N 3.02Å; L51-G54 PolarHBondContact O-N 2.94Å; L51-V56 HydrophobicContact CD1-CB 4.35Å; L51-V56 HydrophobicContact CD1-CG1 3.96Å; L51-V56 HydrophobicContact CG-CB 4.39Å; L51-V56 HydrophobicContact CG-CG1 4.27Å; L51-L57 HydrophobicContact CB-CD1 4.46Å; L51-L57 HydrophobicContact CB-CG 4.35Å; L51-L57 HydrophobicContact CD2-CD2 3.75Å; L51-L57 HydrophobicContact CD2-CG 3.99Å; L51-L57 HydrophobicContact CG-CD2 4.38Å; L51-L57 HydrophobicContact CG-CG 4.11Å; L51-I116 HydrophobicContact CB-CG2 4.35Å; L51-I116 HydrophobicContact CD2-CG2 3.65Å; L51-I120 HydrophobicContact CD2-CD1 3.88Å; L51-I120 HydrophobicContact CD2-CG1 4.13Å
52	Q	89.6	Confident	87.9	Confident	66 Å²	66	45.1 Å²	45.1	31%	0.308	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-29.9	180	-95.8	173.4	48.4	0	0	113.1	R48 R49 G54 I108 V109	R48-Q52 VanDerWaalsContact O-CG 3.3Å; R48-Q52 WeakPolarHBondContact O-CG 3.43Å; R48-Q52 PolarHBondContact O-NE2 3.11Å; R49-Q52 PolarHBondContact O-N 2.95Å; Q52-G54 VanDerWaalsContact C-N 3.31Å; Q52-I108 WeakPolarHBondContact CG-O 3.46Å; Q52-V109 WeakPolarHBondContact CG-O 3.49Å
53	D	87.1	Confident	88.2	Confident	49 Å²	49	38.5 Å²	38.5	26%	0.262	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-9.3	-175.9	78.8	-15.4	0	0	0	113.6	L51 A55 P76 N85	L51-D53 PolarHBondContact O-N 3.02Å; D53-A55 PolarHBondContact O-N 2.73Å; D53-A55 WeakPolarHBondContact OD1-CB 3.38Å; D53-A55 PolarHBondContact OD1-N 2.86Å; D53-A55 VanDerWaalsContact OD2-CB 3.28Å; D53-A55 WeakPolarHBondContact OD2-CB 3.38Å; D53-P76 HydrophobicContact CB-CG 3.76Å; D53-N85 WeakPolarHBondContact O-CB 3.37Å; D53-N85 PolarHBondContact O-ND2 2.86Å
54	G	86.4	Confident	88.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	71.1	-10.8	-173.7	0	0	0	0	0	115.5	L51 Q52 L57 V58	L51-G54 PolarHBondContact O-N 2.94Å; Q52-G54 VanDerWaalsContact C-N 3.31Å; G54-L57 PolarHBondContact O-N 3.18Å; G54-V58 WeakPolarHBondContact O-CG2 3.49Å; G54-V58 PolarHBondContact O-N 3.26Å
55	A	87.9	Confident	87.9	Confident	5 Å²	5	36.3 Å²	36.3	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-67.5	-43.7	-173.7	0	0	0	0	0	111.8	D53 L57 V58 Q59 T74	D53-A55 PolarHBondContact O-N 2.73Å; D53-A55 WeakPolarHBondContact OD1-CB 3.38Å; D53-A55 PolarHBondContact OD1-N 2.86Å; D53-A55 VanDerWaalsContact OD2-CB 3.28Å; D53-A55 WeakPolarHBondContact OD2-CB 3.38Å; A55-L57 VanDerWaalsContact C-N 3.3Å; A55-L57 PolarHBondContact O-N 2.91Å; A55-V58 PolarHBondContact O-N 3.4Å; A55-Q59 VanDerWaalsContact O-CG 3.29Å; A55-Q59 WeakPolarHBondContact O-CG 3.11Å; A55-Q59 PolarHBondContact O-N 2.97Å; A55-Q59 PolarHBondContact O-NE2 3.11Å; A55-T74 HydrophobicContact CB-CG2 4.05Å
56	V	89.6	Confident	87.7	Confident	20 Å²	20	36.5 Å²	36.5	12%	0.121	19%	0.19	C	C	.	.	H	α-helix	trans	-65.5	-34	174.9	175	0	0	0	0	111.5	V31 L35 I44 D50 L51 L60	V31-V56 HydrophobicContact CG1-CG1 4.24Å; L35-V56 HydrophobicContact CD1-CG1 4.15Å; L35-V56 HydrophobicContact CD2-CG1 4.3Å; I44-V56 HydrophobicContact CG2-CG1 4.05Å; I44-V56 HydrophobicContact CG2-CG2 4.18Å; D50-V56 WeakPolarHBondContact O-CB 3.19Å; D50-V56 WeakPolarHBondContact O-CG2 3.22Å; L51-V56 HydrophobicContact CD1-CB 4.35Å; L51-V56 HydrophobicContact CD1-CG1 3.96Å; L51-V56 HydrophobicContact CG-CB 4.39Å; L51-V56 HydrophobicContact CG-CG1 4.27Å; V56-L60 VanDerWaalsContact O-CB 3.23Å; V56-L60 WeakPolarHBondContact O-CB 3.49Å; V56-L60 PolarHBondContact O-N 3.17Å
57	L	90	Very high	87.5	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-68.9	-36.7	176.4	-77.3	172.4	0	0	0	112.4	L51 G54 A55 L60 I61 V89 I108 I119	L51-L57 HydrophobicContact CB-CD1 4.46Å; L51-L57 HydrophobicContact CB-CG 4.35Å; L51-L57 HydrophobicContact CD2-CD2 3.75Å; L51-L57 HydrophobicContact CD2-CG 3.99Å; L51-L57 HydrophobicContact CG-CD2 4.38Å; L51-L57 HydrophobicContact CG-CG 4.11Å; G54-L57 PolarHBondContact O-N 3.18Å; A55-L57 VanDerWaalsContact C-N 3.3Å; A55-L57 PolarHBondContact O-N 2.91Å; L57-L60 HydrophobicContact CD2-CD2 4.37Å; L57-I61 PolarHBondContact O-N 2.93Å; L57-I61 VanDerWaalsContact O-N 3.09Å; L57-V89 HydrophobicContact CB-CG1 4.17Å; L57-V89 HydrophobicContact CB-CG2 3.85Å; L57-V89 HydrophobicContact CD1-CG1 4.49Å; L57-I108 HydrophobicContact CD1-CG2 3.89Å; L57-I119 HydrophobicContact CD2-CG2 3.77Å
58	V	90.4	Very high	87.3	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-51.2	172.3	169.8	0	0	0	0	110.7	G54 A55 L60 I61 E62 L69 V72 V89	G54-V58 WeakPolarHBondContact O-CG2 3.49Å; G54-V58 PolarHBondContact O-N 3.26Å; A55-V58 PolarHBondContact O-N 3.4Å; V58-L60 PolarHBondContact O-N 3.31Å; V58-I61 WeakPolarHBondContact O-CA 3.37Å; V58-I61 WeakPolarHBondContact O-CB 3.42Å; V58-I61 PolarHBondContact O-N 2.86Å; V58-E62 HydrophobicContact CG1-CG 4.48Å; V58-E62 WeakPolarHBondContact O-CG 3.22Å; V58-E62 PolarHBondContact O-N 3.34Å; V58-L69 HydrophobicContact CG1-CB 4.14Å; V58-L69 HydrophobicContact CG1-CD1 4.24Å; V58-L69 HydrophobicContact CG2-CD1 4.09Å; V58-V72 HydrophobicContact CB-CG1 4.15Å; V58-V72 HydrophobicContact CB-CG2 4.48Å; V58-V72 HydrophobicContact CG1-CB 4.41Å; V58-V72 HydrophobicContact CG1-CG1 4.05Å; V58-V72 HydrophobicContact CG1-CG2 4.01Å; V58-V72 HydrophobicContact CG2-CB 4.4Å; V58-V72 HydrophobicContact CG2-CG1 3.74Å; V58-V72 HydrophobicContact CG2-CG2 3.74Å; V58-V89 HydrophobicContact CG2-CG2 3.64Å
59	Q	88.4	Confident	87	Confident	42 Å²	42	39.5 Å²	39.5	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-36.7	177.7	-67.3	164.6	30.8	0	0	112.1	L35 L41 A55 E62 I63	L35-Q59 HydrophobicContact CD2-CB 4.34Å; L41-Q59 HydrophobicContact CD1-CB 4.26Å; A55-Q59 VanDerWaalsContact O-CG 3.29Å; A55-Q59 WeakPolarHBondContact O-CG 3.11Å; A55-Q59 PolarHBondContact O-N 2.97Å; A55-Q59 PolarHBondContact O-NE2 3.11Å; Q59-E62 PolarHBondContact O-N 3.42Å; Q59-I63 WeakPolarHBondContact O-CD1 3.48Å; Q59-I63 VanDerWaalsContact O-CG1 3.29Å; Q59-I63 WeakPolarHBondContact O-CG1 3.14Å; Q59-I63 PolarHBondContact O-N 3.42Å; Q59-I63 VanDerWaalsContact O-N 3.1Å
60	L	89	Confident	86.5	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-44.6	173.4	-179.8	64.7	0	0	0	111.5	W30 V31 Q34 V56 L57 V58 I63 V64 L123	W30-L60 HydrophobicContact CH2-CD1 4.06Å; W30-L60 HydrophobicContact CZ3-CD1 3.94Å; W30-L60 HydrophobicContact CZ3-CD2 4.03Å; W30-L60 HydrophobicContact CZ3-CG 4.48Å; V31-L60 HydrophobicContact CG2-CD2 4.45Å; Q34-L60 HydrophobicContact CB-CD1 3.65Å; Q34-L60 HydrophobicContact CG-CD1 3.77Å; V56-L60 VanDerWaalsContact O-CB 3.23Å; V56-L60 WeakPolarHBondContact O-CB 3.49Å; V56-L60 PolarHBondContact O-N 3.17Å; L57-L60 HydrophobicContact CD2-CD2 4.37Å; V58-L60 PolarHBondContact O-N 3.31Å; L60-I63 PolarHBondContact O-N 3.23Å; L60-V64 HydrophobicContact CD1-CG2 3.82Å; L60-V64 HydrophobicContact CG-CG2 4.42Å; L60-V64 WeakPolarHBondContact O-CB 3.17Å; L60-V64 WeakPolarHBondContact O-CG2 3.47Å; L60-V64 PolarHBondContact O-N 3Å; L60-L123 HydrophobicContact CD2-CD1 3.88Å; L60-L123 HydrophobicContact CG-CD1 4.37Å
61	I	88.8	Confident	85.7	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-45.1	173.9	-75.2	171	0	0	0	111.2	L57 V58 I63 V64 A65 L69 V89 F92 L123	L57-I61 PolarHBondContact O-N 2.93Å; L57-I61 VanDerWaalsContact O-N 3.09Å; V58-I61 WeakPolarHBondContact O-CA 3.37Å; V58-I61 WeakPolarHBondContact O-CB 3.42Å; V58-I61 PolarHBondContact O-N 2.86Å; I61-I63 VanDerWaalsContact C-N 3.31Å; I61-I63 PolarHBondContact O-N 2.85Å; I61-V64 PolarHBondContact O-N 2.83Å; I61-A65 HydrophobicContact CG2-CB 4.34Å; I61-A65 WeakPolarHBondContact O-CB 3.2Å; I61-A65 PolarHBondContact O-N 2.94Å; I61-L69 HydrophobicContact CB-CD1 4.3Å; I61-L69 HydrophobicContact CD1-CD1 4.03Å; I61-L69 HydrophobicContact CG2-CD1 4.01Å; I61-L69 HydrophobicContact CG2-CD2 4.42Å; I61-L69 HydrophobicContact CG2-CG 4.15Å; I61-V89 HydrophobicContact CD1-CB 4.19Å; I61-V89 HydrophobicContact CD1-CG1 3.86Å; I61-V89 HydrophobicContact CD1-CG2 4.16Å; I61-F92 HydrophobicContact CD1-CB 4.33Å; I61-F92 HydrophobicContact CD1-CD1 3.67Å; I61-F92 HydrophobicContact CD1-CE1 4.35Å; I61-F92 HydrophobicContact CD1-CG 4.2Å; I61-F92 HydrophobicContact CG1-CD1 4.13Å; I61-F92 HydrophobicContact CG1-CE1 4.32Å; I61-F92 HydrophobicContact CG2-CD1 3.79Å; I61-F92 HydrophobicContact CG2-CD2 4.29Å; I61-F92 HydrophobicContact CG2-CE1 3.65Å; I61-F92 HydrophobicContact CG2-CE2 4.16Å; I61-F92 HydrophobicContact CG2-CG 4.11Å; I61-F92 HydrophobicContact CG2-CZ 3.85Å; I61-L123 HydrophobicContact CG1-CD1 4.26Å; I61-L123 HydrophobicContact CG1-CD2 4.15Å
62	E	88.9	Confident	85.3	Confident	39 Å²	39	41 Å²	41	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-54.7	-46.8	177.5	-64.8	-177.6	153.7	0	0	112.2	K38 V58 Q59 G66 E67	K38-E62 IonicContact NZ-OE2 2.66Å; K38-E62 PolarHBondContact NZ-OE2 3.28Å; V58-E62 HydrophobicContact CG1-CG 4.48Å; V58-E62 WeakPolarHBondContact O-CG 3.22Å; V58-E62 PolarHBondContact O-N 3.34Å; Q59-E62 PolarHBondContact O-N 3.42Å; E62-G66 WeakPolarHBondContact O-CA 3.27Å; E62-G66 PolarHBondContact O-N 3.24Å; E62-E67 WeakPolarHBondContact CA-O 3.32Å
63	I	86.6	Confident	84.8	Confident	18 Å²	18	42.2 Å²	42.2	9%	0.092	25%	0.25	C	S	.	.	H	α-helix	trans	-71.8	-32.5	-177.1	-70.2	164.3	0	0	0	112.5	Q34 L35 R37 K38 L41 Q59 L60 I61	Q34-I63 HydrophobicContact CB-CG2 4.04Å; Q34-I63 WeakPolarHBondContact O-CG2 3.3Å; L35-I63 HydrophobicContact CD2-CD1 4.35Å; R37-I63 HydrophobicContact CB-CG2 3.93Å; R37-I63 HydrophobicContact CG-CG2 4.46Å; R37-I63 PolarHBondContact NH1-O 3.09Å; R37-I63 VanDerWaalsContact NH1-O 3.13Å; R37-I63 PolarHBondContact NH2-O 3.29Å; R37-I63 VanDerWaalsContact NH2-O 3.12Å; K38-I63 HydrophobicContact CB-CD1 3.8Å; K38-I63 HydrophobicContact CB-CG1 4.05Å; K38-I63 HydrophobicContact CD-CD1 4.47Å; K38-I63 HydrophobicContact CD-CG1 4.44Å; L41-I63 HydrophobicContact CD1-CD1 3.79Å; Q59-I63 WeakPolarHBondContact O-CD1 3.48Å; Q59-I63 VanDerWaalsContact O-CG1 3.29Å; Q59-I63 WeakPolarHBondContact O-CG1 3.14Å; Q59-I63 PolarHBondContact O-N 3.42Å; Q59-I63 VanDerWaalsContact O-N 3.1Å; L60-I63 PolarHBondContact O-N 3.23Å; I61-I63 VanDerWaalsContact C-N 3.31Å; I61-I63 PolarHBondContact O-N 2.85Å
64	V	85.6	Confident	84.4	Confident	22 Å²	22	44.3 Å²	44.3	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-96.9	-32.9	-168.6	173.3	0	0	0	0	112.2	W30 Q34 L60 I61 F127	W30-V64 HydrophobicContact CH2-CG2 4.44Å; Q34-V64 HydrophobicContact CB-CG2 4.16Å; Q34-V64 HydrophobicContact CG-CG2 3.77Å; L60-V64 HydrophobicContact CD1-CG2 3.82Å; L60-V64 HydrophobicContact CG-CG2 4.42Å; L60-V64 WeakPolarHBondContact O-CB 3.17Å; L60-V64 WeakPolarHBondContact O-CG2 3.47Å; L60-V64 PolarHBondContact O-N 3Å; I61-V64 PolarHBondContact O-N 2.83Å; V64-F127 HydrophobicContact CG1-CB 3.18Å; V64-F127 HydrophobicContact CG1-CD1 4.25Å; V64-F127 HydrophobicContact CG1-CD2 3.63Å; V64-F127 HydrophobicContact CG1-CG 3.45Å; V64-F127 VanDerWaalsContact CG1-CG 3.45Å
65	A	83.6	Confident	83.6	Confident	29 Å²	29	49.7 Å²	49.7	24%	0.24	30%	0.3	C	S	.	.	H	α-helix	trans	-100	-23.5	174.7	0	0	0	0	0	113.9	I61 F92 F127	I61-A65 HydrophobicContact CG2-CB 4.34Å; I61-A65 WeakPolarHBondContact O-CB 3.2Å; I61-A65 PolarHBondContact O-N 2.94Å; A65-F92 HydrophobicContact CB-CE1 4.18Å; A65-F92 HydrophobicContact CB-CE2 4.49Å; A65-F92 HydrophobicContact CB-CZ 3.57Å; A65-F127 HydrophobicContact CB-CE1 3.79Å; A65-F127 HydrophobicContact CB-CZ 3.79Å
66	G	81.6	Confident	83.2	Confident	67 Å²	67	50.5 Å²	50.5	69%	0.691	31%	0.305	S	S	*	.	S	Bend	trans	84.5	13.3	-177.7	0	0	0	0	0	115	E62	E62-G66 WeakPolarHBondContact O-CA 3.27Å; E62-G66 PolarHBondContact O-N 3.24Å
67	E	82.1	Confident	82.8	Confident	89 Å²	89	56.9 Å²	56.9	42%	0.416	34%	0.337	S	S	.	.			trans	-124.9	137.1	-173.9	-70.2	176.6	165.7	0	0	111.9	E62 F92 R96	E62-E67 WeakPolarHBondContact CA-O 3.32Å; E67-F92 WeakPolarHBondContact OE2-CE2 3.3Å; E67-R96 IonicContact OE1-CZ 3.96Å; E67-R96 IonicContact OE1-NH2 2.77Å; E67-R96 PolarHBondContact OE1-NH2 3Å; E67-R96 IonicContact OE2-CZ 3.22Å; E67-R96 IonicContact OE2-NE 3.73Å; E67-R96 IonicContact OE2-NH2 3.67Å; E67-R96 PolarHBondContact OE2-NH2 2.87Å
68	V	82.8	Confident	82.6	Confident	109 Å²	109	61.3 Å²	61.3	66%	0.661	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-86	121.9	178.3	179.4	0	0	0	0	110.2
69	L	82.4	Confident	82.3	Confident	28 Å²	28	67.9 Å²	67.9	15%	0.147	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-76.9	124.7	173.6	-63.2	179.9	0	0	0	110.2	V58 I61 V72 V89 F92	V58-L69 HydrophobicContact CG1-CB 4.14Å; V58-L69 HydrophobicContact CG1-CD1 4.24Å; V58-L69 HydrophobicContact CG2-CD1 4.09Å; I61-L69 HydrophobicContact CB-CD1 4.3Å; I61-L69 HydrophobicContact CD1-CD1 4.03Å; I61-L69 HydrophobicContact CG2-CD1 4.01Å; I61-L69 HydrophobicContact CG2-CD2 4.42Å; I61-L69 HydrophobicContact CG2-CG 4.15Å; L69-V72 HydrophobicContact CB-CG2 3.94Å; L69-V89 HydrophobicContact CD1-CG2 4.49Å; L69-F92 HydrophobicContact CD2-CB 4Å; L69-F92 HydrophobicContact CD2-CD2 3.7Å; L69-F92 HydrophobicContact CD2-CG 4.06Å
70	Q	76.9	Confident	82.2	Confident	173 Å²	173	70.2 Å²	70.2	81%	0.808	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	152.7	179.3	-59.3	-175.3	18.2	0	0	111.1
71	G	72.4	Confident	82.1	Confident	64 Å²	64	71.7 Å²	71.7	66%	0.66	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	11.7	178	0	0	0	0	0	115.7
72	V	80.2	Confident	82.1	Confident	33 Å²	33	72.2 Å²	72.2	20%	0.2	41%	0.411	C	S	.	.			trans	-85.8	140.3	179.4	177.6	0	0	0	0	111.3	V58 L69 T74 N85	V58-V72 HydrophobicContact CB-CG1 4.15Å; V58-V72 HydrophobicContact CB-CG2 4.48Å; V58-V72 HydrophobicContact CG1-CB 4.41Å; V58-V72 HydrophobicContact CG1-CG1 4.05Å; V58-V72 HydrophobicContact CG1-CG2 4.01Å; V58-V72 HydrophobicContact CG2-CB 4.4Å; V58-V72 HydrophobicContact CG2-CG1 3.74Å; V58-V72 HydrophobicContact CG2-CG2 3.74Å; L69-V72 HydrophobicContact CB-CG2 3.94Å; V72-T74 HydrophobicContact CG1-CG2 4.06Å; V72-N85 WeakPolarHBondContact CG1-OD1 3.38Å
73	Y	81.1	Confident	82.2	Confident	92 Å²	92	73.9 Å²	73.9	36%	0.361	42%	0.416	S	S	.	.			trans	-95.4	118.9	175.7	-58.5	-93.3	0	0	0	110.7	P76 E81 K84 N85	Y73-P76 WeakPolarHBondContact O-CD 3.33Å; Y73-E81 HydrophobicContact CD1-CB 4.32Å; Y73-E81 HydrophobicContact CD1-CG 3.94Å; Y73-E81 HydrophobicContact CD2-CB 3.88Å; Y73-E81 HydrophobicContact CD2-CG 4.11Å; Y73-E81 HydrophobicContact CE1-CG 4.04Å; Y73-E81 HydrophobicContact CE2-CB 4.37Å; Y73-E81 HydrophobicContact CE2-CG 4.21Å; Y73-E81 HydrophobicContact CG-CB 3.86Å; Y73-E81 HydrophobicContact CG-CG 3.98Å; Y73-K84 HydrophobicContact CE2-CB 4.16Å; Y73-K84 HydrophobicContact CE2-CD 3.71Å; Y73-N85 PolarHBondContact N-OD1 3.13Å; Y73-N85 PolarHBondContact O-ND2 3.06Å
74	T	77.8	Confident	82.3	Confident	93 Å²	93	76.3 Å²	76.3	57%	0.571	43%	0.425	S	S	*	.	S	Bend	trans	-136	114.2	177.4	50.3	0	0	0	0	112.4	A55 V72	A55-T74 HydrophobicContact CB-CG2 4.05Å; V72-T74 HydrophobicContact CG1-CG2 4.06Å
75	P	70.6	Confident	82.6	Confident	113 Å²	113	75.3 Å²	75.3	73%	0.734	42%	0.419	S	S	*	.	S	Bend	cis	-70.5	149	-15.5	32.1	-34.6	0	0	0	111.3
76	P	78.9	Confident	83	Confident	22 Å²	22	73.9 Å²	73.9	14%	0.143	41%	0.408	C	S	.	.			trans	-73.3	138.7	169.9	30.8	-32.4	0	0	0	110.7	D53 Y73 E81	D53-P76 HydrophobicContact CB-CG 3.76Å; Y73-P76 WeakPolarHBondContact O-CD 3.33Å; P76-E81 HydrophobicContact CB-CB 3.68Å
77	L	79.9	Confident	83.5	Confident	155 Å²	155	73.6 Å²	73.6	81%	0.812	39%	0.388	S	S	*	.	S	Bend	trans	-87.5	-28.3	180	-70.4	151.4	0	0	0	112.2	E81	L77-E81 PolarHBondContact N-OE2 3.11Å
78	N	85.9	Confident	83.8	Confident	93 Å²	93	72 Å²	72	50%	0.497	38%	0.381	S	S	.	.	S	Bend	trans	-129	150.5	-173.2	-65.5	-70.7	0	0	0	111.9	E80 E81 S82	N78-E80 PolarHBondContact O-N 2.86Å; N78-E81 HydrophobicContact CB-CG 4.49Å; N78-E81 PolarHBondContact ND2-OE1 2.77Å; N78-E81 WeakPolarHBondContact O-CA 3.31Å; N78-E81 WeakPolarHBondContact O-CB 3.41Å; N78-E81 PolarHBondContact O-N 2.86Å; N78-S82 PolarHBondContact O-N 2.74Å; N78-S82 VanDerWaalsContact O-N 3.07Å; N78-S82 PolarHBondContact O-OG 3.23Å
79	K	84.7	Confident	84.2	Confident	142 Å²	142	66.9 Å²	66.9	62%	0.617	35%	0.35	S	S	*	.	H	α-helix	trans	-54.1	-27.9	172.7	-74.1	-164.2	169.4	-156.8	0	113.7	S82 R83 V109	K79-S82 WeakPolarHBondContact O-CB 3.48Å; K79-R83 WeakPolarHBondContact O-CB 3.49Å; K79-R83 PolarHBondContact O-N 2.91Å; K79-V109 HydrophobicContact CB-CG1 4.37Å; K79-V109 HydrophobicContact CD-CG1 4.46Å; K79-V109 HydrophobicContact CG-CG1 4.46Å
80	E	86.4	Confident	84.6	Confident	92 Å²	92	66.8 Å²	66.8	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-71.2	-31.4	176.2	176.7	61.4	-176.4	0	0	112.8	N78 R83 K84	N78-E80 PolarHBondContact O-N 2.86Å; E80-R83 VanDerWaalsContact CD-NH2 3.25Å; E80-R83 IonicContact OE1-CZ 2.66Å; E80-R83 IonicContact OE1-NE 3.38Å; E80-R83 IonicContact OE1-NH2 3.93Å; E80-R83 PolarHBondContact OE1-NH2 2.86Å; E80-R83 IonicContact OE2-CZ 2.61Å; E80-R83 IonicContact OE2-NE 2.74Å; E80-R83 PolarHBondContact OE2-NE 3.13Å; E80-R83 IonicContact OE2-NH2 2.66Å; E80-R83 PolarHBondContact OE2-NH2 3.33Å; E80-R83 VanDerWaalsContact OE2-NH2 3.17Å; E80-K84 WeakPolarHBondContact O-CG 3.42Å; E80-K84 PolarHBondContact O-N 2.92Å; E80-K84 VanDerWaalsContact O-N 3.17Å
81	E	88.1	Confident	85.1	Confident	31 Å²	31	63.8 Å²	63.8	15%	0.145	33%	0.333	C	S	.	.	H	α-helix	trans	-76.7	-39.4	172.2	-67.9	156.4	-144.9	0	0	110.5	Y73 P76 L77 N78 R83 K84 N85	Y73-E81 HydrophobicContact CD1-CB 4.32Å; Y73-E81 HydrophobicContact CD1-CG 3.94Å; Y73-E81 HydrophobicContact CD2-CB 3.88Å; Y73-E81 HydrophobicContact CD2-CG 4.11Å; Y73-E81 HydrophobicContact CE1-CG 4.04Å; Y73-E81 HydrophobicContact CE2-CB 4.37Å; Y73-E81 HydrophobicContact CE2-CG 4.21Å; Y73-E81 HydrophobicContact CG-CB 3.86Å; Y73-E81 HydrophobicContact CG-CG 3.98Å; P76-E81 HydrophobicContact CB-CB 3.68Å; L77-E81 PolarHBondContact N-OE2 3.11Å; N78-E81 HydrophobicContact CB-CG 4.49Å; N78-E81 PolarHBondContact ND2-OE1 2.77Å; N78-E81 WeakPolarHBondContact O-CA 3.31Å; N78-E81 WeakPolarHBondContact O-CB 3.41Å; N78-E81 PolarHBondContact O-N 2.86Å; E81-R83 VanDerWaalsContact C-N 3.3Å; E81-R83 PolarHBondContact O-N 3.23Å; E81-K84 PolarHBondContact O-N 3.07Å; E81-N85 PolarHBondContact O-N 2.88Å; E81-N85 PolarHBondContact O-OD1 3.04Å
82	S	88.4	Confident	86	Confident	13 Å²	13	61.3 Å²	61.3	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-56.8	-42.7	169.2	-48.4	0	0	0	0	112.1	N78 K79 N85 V86	N78-S82 PolarHBondContact O-N 2.74Å; N78-S82 VanDerWaalsContact O-N 3.07Å; N78-S82 PolarHBondContact O-OG 3.23Å; K79-S82 WeakPolarHBondContact O-CB 3.48Å; S82-N85 WeakPolarHBondContact O-CB 3.38Å; S82-N85 PolarHBondContact O-N 3.35Å; S82-V86 WeakPolarHBondContact O-CG2 3.46Å; S82-V86 PolarHBondContact O-N 3.26Å; S82-V86 VanDerWaalsContact O-N 3.1Å
83	R	90.3	Very high	86.3	Confident	74 Å²	74	59.9 Å²	59.9	28%	0.279	30%	0.296	S	S	.	.	H	α-helix	trans	-60.2	-46.9	174.6	-172.2	-175.3	66.3	75.4	4.8	111.4	K79 E80 E81 V86 E87 A105 V109	K79-R83 WeakPolarHBondContact O-CB 3.49Å; K79-R83 PolarHBondContact O-N 2.91Å; E80-R83 VanDerWaalsContact CD-NH2 3.25Å; E80-R83 IonicContact OE1-CZ 2.66Å; E80-R83 IonicContact OE1-NE 3.38Å; E80-R83 IonicContact OE1-NH2 3.93Å; E80-R83 PolarHBondContact OE1-NH2 2.86Å; E80-R83 IonicContact OE2-CZ 2.61Å; E80-R83 IonicContact OE2-NE 2.74Å; E80-R83 PolarHBondContact OE2-NE 3.13Å; E80-R83 IonicContact OE2-NH2 2.66Å; E80-R83 PolarHBondContact OE2-NH2 3.33Å; E80-R83 VanDerWaalsContact OE2-NH2 3.17Å; E81-R83 VanDerWaalsContact C-N 3.3Å; E81-R83 PolarHBondContact O-N 3.23Å; R83-V86 PolarHBondContact O-N 3.29Å; R83-E87 IonicContact CZ-OE1 2.75Å; R83-E87 IonicContact CZ-OE2 3.52Å; R83-E87 IonicContact NH1-OE1 3.55Å; R83-E87 PolarHBondContact NH1-OE1 2.94Å; R83-E87 IonicContact NH1-OE2 3.44Å; R83-E87 PolarHBondContact NH1-OE2 2.94Å; R83-E87 WeakPolarHBondContact O-CG 3.4Å; R83-E87 PolarHBondContact O-N 2.8Å; R83-A105 HydrophobicContact CG-CB 4.1Å; R83-V109 HydrophobicContact CB-CG2 4.35Å
84	K	89.8	Confident	86.6	Confident	69 Å²	69	59.7 Å²	59.7	30%	0.3	31%	0.308	S	S	.	.	H	α-helix	trans	-60.6	-43.9	176.4	-71.3	169.2	-174.7	174.6	0	112.4	Y73 E80 E81 V86 E87 E88	Y73-K84 HydrophobicContact CE2-CB 4.16Å; Y73-K84 HydrophobicContact CE2-CD 3.71Å; E80-K84 WeakPolarHBondContact O-CG 3.42Å; E80-K84 PolarHBondContact O-N 2.92Å; E80-K84 VanDerWaalsContact O-N 3.17Å; E81-K84 PolarHBondContact O-N 3.07Å; K84-V86 VanDerWaalsContact C-N 3.32Å; K84-V86 PolarHBondContact O-N 3.01Å; K84-E87 PolarHBondContact O-N 2.66Å; K84-E87 VanDerWaalsContact O-N 3.07Å; K84-E88 PolarHBondContact O-N 2.66Å
85	N	90.8	Very high	87.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-55.3	-47.8	175.4	-71.3	-10.2	0	0	0	111.5	D53 V72 Y73 E81 S82 E87 E88 V89	D53-N85 WeakPolarHBondContact O-CB 3.37Å; D53-N85 PolarHBondContact O-ND2 2.86Å; V72-N85 WeakPolarHBondContact CG1-OD1 3.38Å; Y73-N85 PolarHBondContact N-OD1 3.13Å; Y73-N85 PolarHBondContact O-ND2 3.06Å; E81-N85 PolarHBondContact O-N 2.88Å; E81-N85 PolarHBondContact O-OD1 3.04Å; S82-N85 WeakPolarHBondContact O-CB 3.38Å; S82-N85 PolarHBondContact O-N 3.35Å; N85-E87 VanDerWaalsContact C-N 3.33Å; N85-E87 PolarHBondContact O-N 3.09Å; N85-E88 PolarHBondContact O-N 2.96Å; N85-V89 WeakPolarHBondContact O-CG2 3.43Å; N85-V89 PolarHBondContact O-N 3.1Å
86	V	91.8	Very high	87.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-67.7	-32	177.1	178.6	0	0	0	0	111.9	S82 R83 K84 V89 L90 A105 I108 V109	S82-V86 WeakPolarHBondContact O-CG2 3.46Å; S82-V86 PolarHBondContact O-N 3.26Å; S82-V86 VanDerWaalsContact O-N 3.1Å; R83-V86 PolarHBondContact O-N 3.29Å; K84-V86 VanDerWaalsContact C-N 3.32Å; K84-V86 PolarHBondContact O-N 3.01Å; V86-V89 WeakPolarHBondContact O-CB 3.23Å; V86-V89 PolarHBondContact O-N 3.34Å; V86-L90 HydrophobicContact CG1-CD1 4.01Å; V86-L90 HydrophobicContact CG1-CG 4.28Å; V86-L90 WeakPolarHBondContact O-CG 3.21Å; V86-L90 PolarHBondContact O-N 2.92Å; V86-A105 HydrophobicContact CB-CB 4.05Å; V86-A105 HydrophobicContact CG1-CB 3.79Å; V86-I108 HydrophobicContact CG1-CB 3.82Å; V86-I108 HydrophobicContact CG1-CG1 3.75Å; V86-I108 HydrophobicContact CG1-CG2 4.18Å; V86-I108 HydrophobicContact CG2-CB 4.08Å; V86-I108 HydrophobicContact CG2-CG2 3.77Å; V86-V109 HydrophobicContact CG2-CG2 4.32Å
87	E	91.4	Very high	87.7	Confident	61 Å²	61	65.2 Å²	65.2	29%	0.285	33%	0.326	S	S	.	.	H	α-helix	trans	-67.1	-37.7	175.1	-75.1	177.6	179.2	0	0	112.7	R83 K84 N85 L90 K91 A105	R83-E87 IonicContact CZ-OE1 2.75Å; R83-E87 IonicContact CZ-OE2 3.52Å; R83-E87 IonicContact NH1-OE1 3.55Å; R83-E87 PolarHBondContact NH1-OE1 2.94Å; R83-E87 IonicContact NH1-OE2 3.44Å; R83-E87 PolarHBondContact NH1-OE2 2.94Å; R83-E87 WeakPolarHBondContact O-CG 3.4Å; R83-E87 PolarHBondContact O-N 2.8Å; K84-E87 PolarHBondContact O-N 2.66Å; K84-E87 VanDerWaalsContact O-N 3.07Å; N85-E87 VanDerWaalsContact C-N 3.33Å; N85-E87 PolarHBondContact O-N 3.09Å; E87-L90 PolarHBondContact O-N 2.96Å; E87-K91 WeakPolarHBondContact O-CB 3.35Å; E87-K91 WeakPolarHBondContact O-CD 3.49Å; E87-K91 WeakPolarHBondContact O-CG 3.45Å; E87-K91 PolarHBondContact O-N 2.81Å; E87-A105 HydrophobicContact CG-CB 3.45Å; E87-A105 VanDerWaalsContact CG-CB 3.45Å
88	E	90.4	Very high	87.8	Confident	56 Å²	56	58.6 Å²	58.6	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-37.7	171.7	-59.3	-45.4	136.6	0	0	112.4	K84 N85 L90 K91 F92	K84-E88 PolarHBondContact O-N 2.66Å; N85-E88 PolarHBondContact O-N 2.96Å; E88-L90 PolarHBondContact O-N 3.01Å; E88-K91 PolarHBondContact O-N 3.26Å; E88-K91 IonicContact OE1-NZ 2.77Å; E88-K91 PolarHBondContact OE1-NZ 2.81Å; E88-K91 WeakPolarHBondContact OE2-CD 3.26Å; E88-K91 IonicContact OE2-NZ 3.17Å; E88-F92 WeakPolarHBondContact O-CB 3.47Å; E88-F92 PolarHBondContact O-N 3.14Å
89	V	90.3	Very high	87.1	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.5	-46.9	171.3	168.5	0	0	0	0	111.2	L57 V58 I61 L69 N85 V86 F92 I93	L57-V89 HydrophobicContact CB-CG1 4.17Å; L57-V89 HydrophobicContact CB-CG2 3.85Å; L57-V89 HydrophobicContact CD1-CG1 4.49Å; V58-V89 HydrophobicContact CG2-CG2 3.64Å; I61-V89 HydrophobicContact CD1-CB 4.19Å; I61-V89 HydrophobicContact CD1-CG1 3.86Å; I61-V89 HydrophobicContact CD1-CG2 4.16Å; L69-V89 HydrophobicContact CD1-CG2 4.49Å; N85-V89 WeakPolarHBondContact O-CG2 3.43Å; N85-V89 PolarHBondContact O-N 3.1Å; V86-V89 WeakPolarHBondContact O-CB 3.23Å; V86-V89 PolarHBondContact O-N 3.34Å; V89-F92 PolarHBondContact O-N 3.3Å; V89-I93 HydrophobicContact CG1-CD1 3.99Å; V89-I93 WeakPolarHBondContact O-CD1 3.16Å; V89-I93 VanDerWaalsContact O-CG1 3.28Å; V89-I93 WeakPolarHBondContact O-CG1 3.44Å; V89-I93 PolarHBondContact O-N 2.97Å; V89-I93 VanDerWaalsContact O-N 3.07Å
90	L	89.9	Confident	86.5	Confident	26 Å²	26	61.3 Å²	61.3	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-71.5	-35.3	179.8	-69.9	172.5	0	0	0	112.7	V86 E87 E88 I93 S94 M100 A105 I119	V86-L90 HydrophobicContact CG1-CD1 4.01Å; V86-L90 HydrophobicContact CG1-CG 4.28Å; V86-L90 WeakPolarHBondContact O-CG 3.21Å; V86-L90 PolarHBondContact O-N 2.92Å; E87-L90 PolarHBondContact O-N 2.96Å; E88-L90 PolarHBondContact O-N 3.01Å; L90-I93 PolarHBondContact O-N 2.93Å; L90-S94 WeakPolarHBondContact O-CB 3.47Å; L90-S94 PolarHBondContact O-N 2.91Å; L90-S94 PolarHBondContact O-OG 3.29Å; L90-M100 HydrophobicContact CD2-SD 4.32Å; L90-A105 HydrophobicContact CD1-CB 4.12Å; L90-I119 HydrophobicContact CD2-CD1 3.97Å
91	K	89.1	Confident	85.6	Confident	110 Å²	110	60.1 Å²	60.1	48%	0.478	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-43	171.8	-75.1	163	-176	176.8	0	111.3	E87 E88 S94 S95	E87-K91 WeakPolarHBondContact O-CB 3.35Å; E87-K91 WeakPolarHBondContact O-CD 3.49Å; E87-K91 WeakPolarHBondContact O-CG 3.45Å; E87-K91 PolarHBondContact O-N 2.81Å; E88-K91 PolarHBondContact O-N 3.26Å; E88-K91 IonicContact OE1-NZ 2.77Å; E88-K91 PolarHBondContact OE1-NZ 2.81Å; E88-K91 WeakPolarHBondContact OE2-CD 3.26Å; E88-K91 IonicContact OE2-NZ 3.17Å; K91-S94 WeakPolarHBondContact O-CB 3.46Å; K91-S94 PolarHBondContact O-N 2.86Å; K91-S95 PolarHBondContact O-N 2.75Å; K91-S95 PolarHBondContact O-OG 2.86Å
92	F	89.4	Confident	85.1	Confident	12 Å²	12	68.1 Å²	68.1	5%	0.053	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-45.9	176.1	177.4	-90.6	0	0	0	112.4	I61 A65 E67 L69 E88 V89 S94 S95 R96 F127	I61-F92 HydrophobicContact CD1-CB 4.33Å; I61-F92 HydrophobicContact CD1-CD1 3.67Å; I61-F92 HydrophobicContact CD1-CE1 4.35Å; I61-F92 HydrophobicContact CD1-CG 4.2Å; I61-F92 HydrophobicContact CG1-CD1 4.13Å; I61-F92 HydrophobicContact CG1-CE1 4.32Å; I61-F92 HydrophobicContact CG2-CD1 3.79Å; I61-F92 HydrophobicContact CG2-CD2 4.29Å; I61-F92 HydrophobicContact CG2-CE1 3.65Å; I61-F92 HydrophobicContact CG2-CE2 4.16Å; I61-F92 HydrophobicContact CG2-CG 4.11Å; I61-F92 HydrophobicContact CG2-CZ 3.85Å; A65-F92 HydrophobicContact CB-CE1 4.18Å; A65-F92 HydrophobicContact CB-CE2 4.49Å; A65-F92 HydrophobicContact CB-CZ 3.57Å; E67-F92 WeakPolarHBondContact OE2-CE2 3.3Å; L69-F92 HydrophobicContact CD2-CB 4Å; L69-F92 HydrophobicContact CD2-CD2 3.7Å; L69-F92 HydrophobicContact CD2-CG 4.06Å; E88-F92 WeakPolarHBondContact O-CB 3.47Å; E88-F92 PolarHBondContact O-N 3.14Å; V89-F92 PolarHBondContact O-N 3.3Å; F92-S94 PolarHBondContact O-N 3.28Å; F92-S95 PolarHBondContact O-N 3.36Å; F92-S95 PolarHBondContact O-OG 3.04Å; F92-S95 VanDerWaalsContact O-OG 3.11Å; F92-R96 HydrophobicContact CD1-CG 4.32Å; F92-R96 HydrophobicContact CD2-CG 4.48Å; F92-R96 HydrophobicContact CE1-CG 3.85Å; F92-R96 HydrophobicContact CE2-CG 4.04Å; F92-R96 HydrophobicContact CZ-CG 3.69Å; F92-R96 WeakPolarHBondContact O-CB 2.82Å; F92-R96 WeakPolarHBondContact O-CG 3.34Å; F92-R96 PolarHBondContact O-N 3.49Å; F92-F127 HydrophobicContact CE1-CE2 4.37Å; F92-F127 HydrophobicContact CE1-CZ 4.08Å; F92-F127 HydrophobicContact CZ-CZ 4.28Å
93	I	88.3	Confident	85	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-58.5	-39.9	175.6	-70.4	166.6	0	0	0	110.7	V89 L90 N97 I98 M100 I119 L123	V89-I93 HydrophobicContact CG1-CD1 3.99Å; V89-I93 WeakPolarHBondContact O-CD1 3.16Å; V89-I93 VanDerWaalsContact O-CG1 3.28Å; V89-I93 WeakPolarHBondContact O-CG1 3.44Å; V89-I93 PolarHBondContact O-N 2.97Å; V89-I93 VanDerWaalsContact O-N 3.07Å; L90-I93 PolarHBondContact O-N 2.93Å; I93-N97 PolarHBondContact O-N 3.4Å; I93-I98 HydrophobicContact CG2-CB 3.89Å; I93-I98 HydrophobicContact CG2-CG2 4.21Å; I93-I98 WeakPolarHBondContact O-CB 3.49Å; I93-I98 PolarHBondContact O-N 3.22Å; I93-I98 VanDerWaalsContact O-N 3.09Å; I93-M100 HydrophobicContact CD1-CE 4.13Å; I93-M100 HydrophobicContact CG2-CB 4.33Å; I93-M100 HydrophobicContact CG2-CE 3.9Å; I93-M100 HydrophobicContact CG2-SD 3.89Å; I93-I119 HydrophobicContact CD1-CG2 4.03Å; I93-L123 HydrophobicContact CD1-CD2 4.34Å; I93-L123 HydrophobicContact CG1-CD2 4.09Å
94	S	86.6	Confident	84.9	Confident	88 Å²	88	68 Å²	68	62%	0.615	34%	0.339	S	S	*	.	H	α-helix	trans	-69	-45.3	176.8	-55.4	0	0	0	0	112.9	L90 K91 F92 R96 N97	L90-S94 WeakPolarHBondContact O-CB 3.47Å; L90-S94 PolarHBondContact O-N 2.91Å; L90-S94 PolarHBondContact O-OG 3.29Å; K91-S94 WeakPolarHBondContact O-CB 3.46Å; K91-S94 PolarHBondContact O-N 2.86Å; F92-S94 PolarHBondContact O-N 3.28Å; S94-R96 VanDerWaalsContact C-N 3.28Å; S94-R96 PolarHBondContact O-N 3.42Å; S94-N97 WeakPolarHBondContact O-CA 3.37Å; S94-N97 PolarHBondContact O-N 3.27Å
95	S	87.3	Confident	84.9	Confident	93 Å²	93	64.9 Å²	64.9	65%	0.65	33%	0.326	S	S	*	.	H	α-helix	trans	-68.7	-26.9	-179.5	68.9	0	0	0	0	112.8	K91 F92 N97	K91-S95 PolarHBondContact O-N 2.75Å; K91-S95 PolarHBondContact O-OG 2.86Å; F92-S95 PolarHBondContact O-N 3.36Å; F92-S95 PolarHBondContact O-OG 3.04Å; F92-S95 VanDerWaalsContact O-OG 3.11Å; S95-N97 PolarHBondContact O-N 3.21Å
96	R	82.3	Confident	84.9	Confident	106 Å²	106	71 Å²	71	40%	0.4	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2.7	169.2	-67.1	-58.5	-171.6	173.1	-1.3	114.4	E67 F92 S94 I98	E67-R96 IonicContact OE1-CZ 3.96Å; E67-R96 IonicContact OE1-NH2 2.77Å; E67-R96 PolarHBondContact OE1-NH2 3Å; E67-R96 IonicContact OE2-CZ 3.22Å; E67-R96 IonicContact OE2-NE 3.73Å; E67-R96 IonicContact OE2-NH2 3.67Å; E67-R96 PolarHBondContact OE2-NH2 2.87Å; F92-R96 HydrophobicContact CD1-CG 4.32Å; F92-R96 HydrophobicContact CD2-CG 4.48Å; F92-R96 HydrophobicContact CE1-CG 3.85Å; F92-R96 HydrophobicContact CE2-CG 4.04Å; F92-R96 HydrophobicContact CZ-CG 3.69Å; F92-R96 WeakPolarHBondContact O-CB 2.82Å; F92-R96 WeakPolarHBondContact O-CG 3.34Å; F92-R96 PolarHBondContact O-N 3.49Å; S94-R96 VanDerWaalsContact C-N 3.28Å; S94-R96 PolarHBondContact O-N 3.42Å; R96-I98 HydrophobicContact CB-CD1 3.97Å; R96-I98 HydrophobicContact CB-CG1 3.81Å; R96-I98 PolarHBondContact O-N 2.83Å
97	N	80.3	Confident	84.8	Confident	145 Å²	145	73.3 Å²	73.3	78%	0.775	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	35.1	-179	-163	18.7	0	0	0	113.1	I93 S94 S95 R99	I93-N97 PolarHBondContact O-N 3.4Å; S94-N97 WeakPolarHBondContact O-CA 3.37Å; S94-N97 PolarHBondContact O-N 3.27Å; S95-N97 PolarHBondContact O-N 3.21Å; N97-R99 PolarHBondContact O-N 3.18Å
98	I	83	Confident	84.9	Confident	16 Å²	16	70.4 Å²	70.4	8%	0.082	35%	0.351	C	S	.	.			trans	-75.9	110.1	179.1	-59.8	178.5	0	0	0	107.7	I93 R96 M100 A122 L123 H126 F127	I93-I98 HydrophobicContact CG2-CB 3.89Å; I93-I98 HydrophobicContact CG2-CG2 4.21Å; I93-I98 WeakPolarHBondContact O-CB 3.49Å; I93-I98 PolarHBondContact O-N 3.22Å; I93-I98 VanDerWaalsContact O-N 3.09Å; R96-I98 HydrophobicContact CB-CD1 3.97Å; R96-I98 HydrophobicContact CB-CG1 3.81Å; R96-I98 PolarHBondContact O-N 2.83Å; I98-M100 PolarHBondContact O-N 2.91Å; I98-A122 HydrophobicContact CG2-CB 4.08Å; I98-L123 HydrophobicContact CD1-CD2 4.49Å; I98-H126 HydrophobicContact CD1-CB 4.04Å; I98-H126 HydrophobicContact CG1-CB 4.24Å; I98-H126 HydrophobicContact CG2-CB 4.28Å; I98-F127 HydrophobicContact CD1-CE2 3.87Å; I98-F127 HydrophobicContact CD1-CZ 4.44Å
99	R	70.4	Confident	84.9	Confident	248 Å²	248	68.3 Å²	68.3	94%	0.936	34%	0.342	S	S	*	.			trans	-60.9	97.9	-175.8	-172.2	-178.2	-179.3	-151.6	-0.9	111.7	N97	N97-R99 PolarHBondContact O-N 3.18Å
100	M	72.1	Confident	84.9	Confident	44 Å²	44	72.7 Å²	72.7	22%	0.217	37%	0.366	C	S	.	.			trans	-128	139.5	-175.2	174.9	171.4	-71.8	0	0	110.7	L90 I93 I98 I103 I119 A122	L90-M100 HydrophobicContact CD2-SD 4.32Å; I93-M100 HydrophobicContact CD1-CE 4.13Å; I93-M100 HydrophobicContact CG2-CB 4.33Å; I93-M100 HydrophobicContact CG2-CE 3.9Å; I93-M100 HydrophobicContact CG2-SD 3.89Å; I98-M100 PolarHBondContact O-N 2.91Å; M100-I103 HydrophobicContact CG-CD1 4.32Å; M100-I103 HydrophobicContact SD-CD1 4.03Å; M100-I119 HydrophobicContact CE-CB 4.42Å; M100-I119 HydrophobicContact CE-CG1 4.05Å; M100-I119 HydrophobicContact SD-CG1 4.28Å; M100-A122 HydrophobicContact CE-CB 3.32Å
101	P	67.9	Low	84.8	Confident	68 Å²	68	71.8 Å²	71.8	44%	0.442	36%	0.363	S	S	.	.			trans	-64.4	152.8	169	-18.8	32.1	0	0	0	111.7	I103	P101-I103 PolarHBondContact O-N 2.89Å; P101-I103 VanDerWaalsContact O-N 3.14Å
102	H	77	Confident	84.8	Confident	199 Å²	199	69.5 Å²	69.5	92%	0.921	36%	0.356	S	S	*	.			trans	-55.7	121.6	177.1	-63.6	-68.6	0	0	0	112
103	I	87	Confident	84.7	Confident	21 Å²	21	69.1 Å²	69.1	11%	0.108	35%	0.354	C	S	.	.			trans	-127.6	133.6	174.5	-70.3	170.4	0	0	0	106.5	M100 P101 D107 I108 R118 I119	M100-I103 HydrophobicContact CG-CD1 4.32Å; M100-I103 HydrophobicContact SD-CD1 4.03Å; P101-I103 PolarHBondContact O-N 2.89Å; P101-I103 VanDerWaalsContact O-N 3.14Å; I103-D107 HydrophobicContact CG2-CB 4.29Å; I103-I108 HydrophobicContact CG2-CD1 4.12Å; I103-I108 HydrophobicContact CG2-CG1 4.34Å; I103-R118 HydrophobicContact CD1-CB 3.76Å; I103-I119 HydrophobicContact CD1-CG1 4.16Å; I103-I119 HydrophobicContact CG2-CD1 4.47Å
104	S	88.3	Confident	84.6	Confident	62 Å²	62	71.5 Å²	71.5	43%	0.434	36%	0.364	S	S	.	.			trans	-84	148.2	173.1	-173.3	0	0	0	0	110.4	K106 D107	S104-K106 PolarHBondContact O-N 3.4Å; S104-K106 PolarHBondContact OG-N 2.85Å; S104-D107 WeakPolarHBondContact CB-OD2 3.28Å; S104-D107 PolarHBondContact N-OD2 3.17Å; S104-D107 WeakPolarHBondContact O-CB 3.32Å; S104-D107 PolarHBondContact O-N 3.18Å
105	A	90.2	Very high	84.8	Confident	4 Å²	4	67.5 Å²	67.5	3%	0.033	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-30.9	167.7	0	0	0	0	0	112.1	R83 V86 E87 L90 D107 I108 V109	R83-A105 HydrophobicContact CG-CB 4.1Å; V86-A105 HydrophobicContact CB-CB 4.05Å; V86-A105 HydrophobicContact CG1-CB 3.79Å; E87-A105 HydrophobicContact CG-CB 3.45Å; E87-A105 VanDerWaalsContact CG-CB 3.45Å; L90-A105 HydrophobicContact CD1-CB 4.12Å; A105-D107 VanDerWaalsContact C-N 3.32Å; A105-D107 PolarHBondContact O-N 3.48Å; A105-I108 PolarHBondContact O-N 2.77Å; A105-V109 WeakPolarHBondContact O-CG2 3.48Å; A105-V109 PolarHBondContact O-N 2.87Å
106	K	90.1	Very high	84.9	Confident	129 Å²	129	63.1 Å²	63.1	56%	0.561	31%	0.306	S	S	*	.	H	α-helix	trans	-59.3	-39.3	173.2	-179.1	175.9	173.6	-179.8	0	112.6	S104 I108 V109 D110	S104-K106 PolarHBondContact O-N 3.4Å; S104-K106 PolarHBondContact OG-N 2.85Å; K106-I108 PolarHBondContact O-N 2.91Å; K106-V109 PolarHBondContact O-N 3.46Å; K106-D110 WeakPolarHBondContact CE-OD2 3.43Å; K106-D110 WeakPolarHBondContact CG-OD2 3.48Å; K106-D110 IonicContact NZ-OD2 3.51Å; K106-D110 WeakPolarHBondContact O-CB 3.44Å; K106-D110 PolarHBondContact O-N 3.2Å
107	D	90.8	Very high	85.2	Confident	49 Å²	49	58.4 Å²	58.4	26%	0.262	29%	0.288	S	S	.	.	H	α-helix	trans	-57.9	-37.2	180	-69.5	-62	0	0	0	111.7	I103 S104 A105 G111 N112	I103-D107 HydrophobicContact CG2-CB 4.29Å; S104-D107 WeakPolarHBondContact CB-OD2 3.28Å; S104-D107 PolarHBondContact N-OD2 3.17Å; S104-D107 WeakPolarHBondContact O-CB 3.32Å; S104-D107 PolarHBondContact O-N 3.18Å; A105-D107 VanDerWaalsContact C-N 3.32Å; A105-D107 PolarHBondContact O-N 3.48Å; D107-G111 PolarHBondContact O-N 2.81Å; D107-N112 HydrophobicContact CB-CB 4.11Å; D107-N112 WeakPolarHBondContact O-CA 3.34Å; D107-N112 WeakPolarHBondContact O-CB 3.35Å; D107-N112 PolarHBondContact O-N 2.77Å; D107-N112 PolarHBondContact OD1-ND2 2.63Å
108	I	91.6	Very high	85.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-76.3	-44.7	-178.7	-51.8	-54.1	0	0	0	110.7	Q52 L57 V86 I103 A105 K106 D110 G111 I116 I119	Q52-I108 WeakPolarHBondContact CG-O 3.46Å; L57-I108 HydrophobicContact CD1-CG2 3.89Å; V86-I108 HydrophobicContact CG1-CB 3.82Å; V86-I108 HydrophobicContact CG1-CG1 3.75Å; V86-I108 HydrophobicContact CG1-CG2 4.18Å; V86-I108 HydrophobicContact CG2-CB 4.08Å; V86-I108 HydrophobicContact CG2-CG2 3.77Å; I103-I108 HydrophobicContact CG2-CD1 4.12Å; I103-I108 HydrophobicContact CG2-CG1 4.34Å; A105-I108 PolarHBondContact O-N 2.77Å; K106-I108 PolarHBondContact O-N 2.91Å; I108-D110 VanDerWaalsContact C-N 3.28Å; I108-D110 PolarHBondContact O-N 2.71Å; I108-G111 PolarHBondContact O-N 3.22Å; I108-I116 HydrophobicContact CD1-CB 4.49Å; I108-I116 HydrophobicContact CD1-CG1 3.72Å; I108-I116 HydrophobicContact CG2-CG1 4.23Å; I108-I119 HydrophobicContact CD1-CD1 3.52Å; I108-I119 HydrophobicContact CD1-CG1 4.4Å; I108-I119 HydrophobicContact CG1-CD1 3.75Å
109	V	91.1	Very high	85.9	Confident	11 Å²	11	53.9 Å²	53.9	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-26.8	177.8	179	0	0	0	0	112.6	Q52 K79 R83 V86 A105 K106 G111	Q52-V109 WeakPolarHBondContact CG-O 3.49Å; K79-V109 HydrophobicContact CB-CG1 4.37Å; K79-V109 HydrophobicContact CD-CG1 4.46Å; K79-V109 HydrophobicContact CG-CG1 4.46Å; R83-V109 HydrophobicContact CB-CG2 4.35Å; V86-V109 HydrophobicContact CG2-CG2 4.32Å; A105-V109 WeakPolarHBondContact O-CG2 3.48Å; A105-V109 PolarHBondContact O-N 2.87Å; K106-V109 PolarHBondContact O-N 3.46Å; V109-G111 VanDerWaalsContact C-N 3.31Å
110	D	89.8	Confident	86.8	Confident	92 Å²	92	42.1 Å²	42.1	49%	0.492	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	5.3	171.7	-72	-16.8	0	0	0	113	K106 I108	K106-D110 WeakPolarHBondContact CE-OD2 3.43Å; K106-D110 WeakPolarHBondContact CG-OD2 3.48Å; K106-D110 IonicContact NZ-OD2 3.51Å; K106-D110 WeakPolarHBondContact O-CB 3.44Å; K106-D110 PolarHBondContact O-N 3.2Å; I108-D110 VanDerWaalsContact C-N 3.28Å; I108-D110 PolarHBondContact O-N 2.71Å
111	G	87.8	Confident	87.5	Confident	7 Å²	7	41.9 Å²	41.9	7%	0.072	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	24.5	173.5	0	0	0	0	0	115.1	D107 I108 V109 L113	D107-G111 PolarHBondContact O-N 2.81Å; I108-G111 PolarHBondContact O-N 3.22Å; V109-G111 VanDerWaalsContact C-N 3.31Å; G111-L113 PolarHBondContact O-N 2.99Å
112	N	90.1	Very high	88.4	Confident	62 Å²	62	39.5 Å²	39.5	33%	0.332	20%	0.2	S	C	.	.			trans	-68.9	93.3	179.8	-173.3	-10.4	0	0	0	110.9	D107 K114 S115 I116	D107-N112 HydrophobicContact CB-CB 4.11Å; D107-N112 WeakPolarHBondContact O-CA 3.34Å; D107-N112 WeakPolarHBondContact O-CB 3.35Å; D107-N112 PolarHBondContact O-N 2.77Å; D107-N112 PolarHBondContact OD1-ND2 2.63Å; N112-K114 PolarHBondContact O-N 2.94Å; N112-K114 WeakPolarHBondContact OD1-CB 3.49Å; N112-K114 PolarHBondContact OD1-N 3.28Å; N112-S115 PolarHBondContact O-N 3.37Å; N112-I116 WeakPolarHBondContact O-CG1 3.4Å; N112-I116 PolarHBondContact O-N 2.88Å
113	L	87.4	Confident	88.9	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-49.1	-35.9	-179.5	-176.3	60.6	0	0	0	113.4	Y19 L24 L47 R48 G111 S115 I116 M117	Y19-L113 HydrophobicContact CD1-CD2 4.44Å; Y19-L113 HydrophobicContact CD2-CD2 4.31Å; Y19-L113 HydrophobicContact CG-CD2 4.23Å; L24-L113 HydrophobicContact CD1-CD2 4.18Å; L24-L113 HydrophobicContact CD2-CD1 4.26Å; L24-L113 HydrophobicContact CD2-CD2 3.88Å; L24-L113 HydrophobicContact CD2-CG 4.42Å; L47-L113 HydrophobicContact CB-CD1 4.01Å; L47-L113 HydrophobicContact CD1-CD1 4.25Å; R48-L113 HydrophobicContact CG-CB 4.01Å; R48-L113 HydrophobicContact CG-CD1 4.07Å; R48-L113 HydrophobicContact CG-CG 4.43Å; G111-L113 PolarHBondContact O-N 2.99Å; L113-S115 VanDerWaalsContact C-N 3.32Å; L113-S115 PolarHBondContact O-N 3.42Å; L113-I116 PolarHBondContact O-N 3.46Å; L113-M117 HydrophobicContact CD1-CG 3.85Å; L113-M117 HydrophobicContact CD1-SD 3.93Å; L113-M117 HydrophobicContact CD2-SD 4.18Å; L113-M117 HydrophobicContact CG-CG 4.13Å; L113-M117 HydrophobicContact CG-SD 3.63Å; L113-M117 WeakPolarHBondContact O-CB 3.4Å; L113-M117 VanDerWaalsContact O-CG 3.25Å; L113-M117 WeakPolarHBondContact O-CG 3.47Å; L113-M117 PolarHBondContact O-N 2.9Å
114	K	86.1	Confident	88.8	Confident	54 Å²	54	29.9 Å²	29.9	24%	0.235	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-37.7	-179.9	-152.1	172.1	-164.8	170.1	0	111.7	L15 Y19 N112 R118	L15-K114 PolarHBondContact O-NZ 3.33Å; Y19-K114 HydrophobicContact CE1-CG 4.5Å; Y19-K114 WeakPolarHBondContact OH-CB 3.25Å; N112-K114 PolarHBondContact O-N 2.94Å; N112-K114 WeakPolarHBondContact OD1-CB 3.49Å; N112-K114 PolarHBondContact OD1-N 3.28Å; K114-R118 VanDerWaalsContact O-CD 3.26Å; K114-R118 WeakPolarHBondContact O-CD 3.16Å; K114-R118 WeakPolarHBondContact O-CG 3.46Å; K114-R118 PolarHBondContact O-N 2.8Å
115	S	89.6	Confident	88.6	Confident	4 Å²	4	29.8 Å²	29.8	3%	0.028	16%	0.161	C	C	.	.	H	α-helix	trans	-78	-40.1	175.3	-64.9	0	0	0	0	111.7	N112 L113 R118 I119	N112-S115 PolarHBondContact O-N 3.37Å; L113-S115 VanDerWaalsContact C-N 3.32Å; L113-S115 PolarHBondContact O-N 3.42Å; S115-R118 WeakPolarHBondContact O-CB 3.4Å; S115-R118 PolarHBondContact O-N 3.09Å; S115-I119 PolarHBondContact O-N 3.24Å; S115-I119 VanDerWaalsContact O-N 3.08Å
116	I	90.3	Very high	88.1	Confident	1 Å²	1	34 Å²	34	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-48.9	177.1	-64.6	167.2	0	0	0	111.2	L47 L51 I108 N112 L113 R118 I119 I120	L47-I116 HydrophobicContact CB-CG2 4.25Å; L51-I116 HydrophobicContact CB-CG2 4.35Å; L51-I116 HydrophobicContact CD2-CG2 3.65Å; I108-I116 HydrophobicContact CD1-CB 4.49Å; I108-I116 HydrophobicContact CD1-CG1 3.72Å; I108-I116 HydrophobicContact CG2-CG1 4.23Å; N112-I116 WeakPolarHBondContact O-CG1 3.4Å; N112-I116 PolarHBondContact O-N 2.88Å; L113-I116 PolarHBondContact O-N 3.46Å; I116-R118 VanDerWaalsContact C-N 3.28Å; I116-R118 PolarHBondContact O-N 3.3Å; I116-I119 PolarHBondContact O-N 3.25Å; I116-I120 HydrophobicContact CG2-CD1 3.94Å; I116-I120 WeakPolarHBondContact O-CG1 3.27Å; I116-I120 PolarHBondContact O-N 3.03Å; I116-I120 VanDerWaalsContact O-N 3.07Å
117	M	88.8	Confident	87.7	Confident	6 Å²	6	30.4 Å²	30.4	3%	0.03	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-37.1	176.4	-71.7	167.3	75.5	0	0	112.3	Y19 Q23 L24 Y27 L113 I120 L121	Y19-M117 HydrophobicContact CD1-CE 4.11Å; Y19-M117 HydrophobicContact CD1-SD 3.8Å; Y19-M117 HydrophobicContact CE1-SD 4.04Å; Q23-M117 HydrophobicContact CG-CE 4.37Å; L24-M117 HydrophobicContact CD2-CE 3.78Å; L24-M117 HydrophobicContact CD2-CG 4.49Å; L24-M117 HydrophobicContact CD2-SD 3.62Å; Y27-M117 HydrophobicContact CD2-CE 3.85Å; Y27-M117 HydrophobicContact CD2-CG 4.18Å; Y27-M117 HydrophobicContact CE2-CB 4.32Å; Y27-M117 HydrophobicContact CE2-CE 3.44Å; Y27-M117 VanDerWaalsContact CE2-CE 3.44Å; Y27-M117 HydrophobicContact CE2-CG 4.23Å; L113-M117 HydrophobicContact CD1-CG 3.85Å; L113-M117 HydrophobicContact CD1-SD 3.93Å; L113-M117 HydrophobicContact CD2-SD 4.18Å; L113-M117 HydrophobicContact CG-CG 4.13Å; L113-M117 HydrophobicContact CG-SD 3.63Å; L113-M117 WeakPolarHBondContact O-CB 3.4Å; L113-M117 VanDerWaalsContact O-CG 3.25Å; L113-M117 WeakPolarHBondContact O-CG 3.47Å; L113-M117 PolarHBondContact O-N 2.9Å; M117-I120 PolarHBondContact O-N 3.35Å; M117-L121 VanDerWaalsContact O-CB 3.23Å; M117-L121 WeakPolarHBondContact O-CB 3.38Å; M117-L121 PolarHBondContact O-N 3.04Å
118	R	87.5	Confident	86.7	Confident	67 Å²	67	33.3 Å²	33.3	25%	0.253	18%	0.175	S	C	.	.	H	α-helix	trans	-65.8	-40.4	176.1	-75.8	165.7	175.3	166.4	-11.9	112.5	I103 K114 S115 I116 L121 A122	I103-R118 HydrophobicContact CD1-CB 3.76Å; K114-R118 VanDerWaalsContact O-CD 3.26Å; K114-R118 WeakPolarHBondContact O-CD 3.16Å; K114-R118 WeakPolarHBondContact O-CG 3.46Å; K114-R118 PolarHBondContact O-N 2.8Å; S115-R118 WeakPolarHBondContact O-CB 3.4Å; S115-R118 PolarHBondContact O-N 3.09Å; I116-R118 VanDerWaalsContact C-N 3.28Å; I116-R118 PolarHBondContact O-N 3.3Å; R118-L121 PolarHBondContact O-N 3.18Å; R118-A122 WeakPolarHBondContact O-CB 3.29Å; R118-A122 PolarHBondContact O-N 3.32Å
119	I	89.4	Confident	84.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-48.9	175	-67.1	-178.6	0	0	0	110.4	L57 L90 I93 M100 I103 I108 S115 I116 L121 A122 L123	L57-I119 HydrophobicContact CD2-CG2 3.77Å; L90-I119 HydrophobicContact CD2-CD1 3.97Å; I93-I119 HydrophobicContact CD1-CG2 4.03Å; M100-I119 HydrophobicContact CE-CB 4.42Å; M100-I119 HydrophobicContact CE-CG1 4.05Å; M100-I119 HydrophobicContact SD-CG1 4.28Å; I103-I119 HydrophobicContact CD1-CG1 4.16Å; I103-I119 HydrophobicContact CG2-CD1 4.47Å; I108-I119 HydrophobicContact CD1-CD1 3.52Å; I108-I119 HydrophobicContact CD1-CG1 4.4Å; I108-I119 HydrophobicContact CG1-CD1 3.75Å; S115-I119 PolarHBondContact O-N 3.24Å; S115-I119 VanDerWaalsContact O-N 3.08Å; I116-I119 PolarHBondContact O-N 3.25Å; I119-L121 PolarHBondContact O-N 3.29Å; I119-A122 PolarHBondContact O-N 3.1Å; I119-L123 HydrophobicContact CG2-CD1 3.98Å; I119-L123 WeakPolarHBondContact O-CG 3.32Å; I119-L123 PolarHBondContact O-N 2.9Å
120	I	89.3	Confident	82.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.2	-46.5	178.1	-60.5	166.2	0	0	0	110.6	Y27 W30 V31 L47 L51 I116 M117 L123 A124	Y27-I120 HydrophobicContact CD1-CB 4.24Å; Y27-I120 HydrophobicContact CD1-CG2 3.66Å; Y27-I120 HydrophobicContact CE1-CG2 4.32Å; W30-I120 HydrophobicContact CE3-CG2 3.55Å; W30-I120 HydrophobicContact CZ3-CG2 3.76Å; V31-I120 HydrophobicContact CG2-CD1 4.12Å; V31-I120 HydrophobicContact CG2-CG1 4.2Å; V31-I120 HydrophobicContact CG2-CG2 3.81Å; L47-I120 HydrophobicContact CD1-CD1 4.12Å; L47-I120 HydrophobicContact CD2-CD1 3.82Å; L47-I120 HydrophobicContact CG-CD1 4.46Å; L51-I120 HydrophobicContact CD2-CD1 3.88Å; L51-I120 HydrophobicContact CD2-CG1 4.13Å; I116-I120 HydrophobicContact CG2-CD1 3.94Å; I116-I120 WeakPolarHBondContact O-CG1 3.27Å; I116-I120 PolarHBondContact O-N 3.03Å; I116-I120 VanDerWaalsContact O-N 3.07Å; M117-I120 PolarHBondContact O-N 3.35Å; I120-L123 PolarHBondContact O-N 3.29Å; I120-A124 WeakPolarHBondContact O-CB 3.49Å; I120-A124 PolarHBondContact O-N 2.84Å
121	L	88.3	Confident	80.3	Confident	40 Å²	40	41.1 Å²	41.1	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-42.5	179.7	-177.8	61.8	0	0	0	112.5	Y27 M117 R118 I119 A124 A125	Y27-L121 HydrophobicContact CE1-CB 4.04Å; Y27-L121 HydrophobicContact CE1-CD1 4.32Å; M117-L121 VanDerWaalsContact O-CB 3.23Å; M117-L121 WeakPolarHBondContact O-CB 3.38Å; M117-L121 PolarHBondContact O-N 3.04Å; R118-L121 PolarHBondContact O-N 3.18Å; I119-L121 PolarHBondContact O-N 3.29Å; L121-A124 PolarHBondContact O-N 3.05Å; L121-A125 VanDerWaalsContact O-CB 3.23Å; L121-A125 WeakPolarHBondContact O-CB 3.46Å; L121-A125 PolarHBondContact O-N 3.47Å
122	A	85.8	Confident	77.8	Confident	17 Å²	17	45.2 Å²	45.2	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-66.4	-43.7	179.4	0	0	0	0	0	112.2	I98 M100 R118 I119 A125 H126	I98-A122 HydrophobicContact CG2-CB 4.08Å; M100-A122 HydrophobicContact CE-CB 3.32Å; R118-A122 WeakPolarHBondContact O-CB 3.29Å; R118-A122 PolarHBondContact O-N 3.32Å; I119-A122 PolarHBondContact O-N 3.1Å; A122-A125 PolarHBondContact O-N 3.15Å; A122-H126 WeakPolarHBondContact O-CB 3.23Å; A122-H126 PolarHBondContact O-N 3.01Å
123	L	87	Confident	75.4	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-45.7	173.9	-68	173.3	0	0	0	111.1	W30 L60 I61 I93 I98 I119 I120 A125 H126 F127	W30-L123 HydrophobicContact CH2-CB 4.38Å; L60-L123 HydrophobicContact CD2-CD1 3.88Å; L60-L123 HydrophobicContact CG-CD1 4.37Å; I61-L123 HydrophobicContact CG1-CD1 4.26Å; I61-L123 HydrophobicContact CG1-CD2 4.15Å; I93-L123 HydrophobicContact CD1-CD2 4.34Å; I93-L123 HydrophobicContact CG1-CD2 4.09Å; I98-L123 HydrophobicContact CD1-CD2 4.49Å; I119-L123 HydrophobicContact CG2-CD1 3.98Å; I119-L123 WeakPolarHBondContact O-CG 3.32Å; I119-L123 PolarHBondContact O-N 2.9Å; I120-L123 PolarHBondContact O-N 3.29Å; L123-A125 VanDerWaalsContact C-N 3.31Å; L123-A125 PolarHBondContact O-N 2.93Å; L123-H126 PolarHBondContact O-N 2.91Å; L123-F127 HydrophobicContact CD2-CD2 4.38Å; L123-F127 HydrophobicContact CD2-CE2 4.08Å; L123-F127 WeakPolarHBondContact O-CD2 3.43Å; L123-F127 PolarHBondContact O-N 3.4Å
124	A	86	Confident	73	Confident	16 Å²	16	60.3 Å²	60.3	13%	0.132	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-31.2	178.4	0	0	0	0	0	113.7	W30 I120 L121 K128	W30-A124 HydrophobicContact CD2-CB 3.97Å; W30-A124 HydrophobicContact CE3-CB 4.07Å; W30-A124 HydrophobicContact CH2-CB 3.68Å; W30-A124 HydrophobicContact CZ2-CB 3.56Å; W30-A124 HydrophobicContact CZ3-CB 3.92Å; I120-A124 WeakPolarHBondContact O-CB 3.49Å; I120-A124 PolarHBondContact O-N 2.84Å; L121-A124 PolarHBondContact O-N 3.05Å; A124-K128 PolarHBondContact O-N 3.26Å
125	A	83.3	Confident	70.8	Confident	61 Å²	61	61.7 Å²	61.7	50%	0.504	35%	0.348	S	S	.	.	H	α-helix	trans	-77	-46.7	176.1	0	0	0	0	0	112	L121 A122 L123 K128	L121-A125 VanDerWaalsContact O-CB 3.23Å; L121-A125 WeakPolarHBondContact O-CB 3.46Å; L121-A125 PolarHBondContact O-N 3.47Å; A122-A125 PolarHBondContact O-N 3.15Å; L123-A125 VanDerWaalsContact C-N 3.31Å; L123-A125 PolarHBondContact O-N 2.93Å; A125-K128 WeakPolarHBondContact O-CB 3.17Å
126	H	81.1	Confident	68.4	Low	92 Å²	92	66.1 Å²	66.1	43%	0.426	38%	0.384	S	S	.	.	H	α-helix	trans	-66.7	-45.9	-177.6	-177.7	-100.7	0	0	0	112.4	I98 A122 L123 K128	I98-H126 HydrophobicContact CD1-CB 4.04Å; I98-H126 HydrophobicContact CG1-CB 4.24Å; I98-H126 HydrophobicContact CG2-CB 4.28Å; A122-H126 WeakPolarHBondContact O-CB 3.23Å; A122-H126 PolarHBondContact O-N 3.01Å; L123-H126 PolarHBondContact O-N 2.91Å; H126-K128 VanDerWaalsContact C-N 3.34Å
127	F	80.8	Confident	66	Low	53 Å²	53	71.1 Å²	71.1	23%	0.232	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	26.4	-178.2	-59.7	-83.9	0	0	0	112.7	V64 A65 F92 I98 L123	V64-F127 HydrophobicContact CG1-CB 3.18Å; V64-F127 HydrophobicContact CG1-CD1 4.25Å; V64-F127 HydrophobicContact CG1-CD2 3.63Å; V64-F127 HydrophobicContact CG1-CG 3.45Å; V64-F127 VanDerWaalsContact CG1-CG 3.45Å; A65-F127 HydrophobicContact CB-CE1 3.79Å; A65-F127 HydrophobicContact CB-CZ 3.79Å; F92-F127 HydrophobicContact CE1-CE2 4.37Å; F92-F127 HydrophobicContact CE1-CZ 4.08Å; F92-F127 HydrophobicContact CZ-CZ 4.28Å; I98-F127 HydrophobicContact CD1-CE2 3.87Å; I98-F127 HydrophobicContact CD1-CZ 4.44Å; L123-F127 HydrophobicContact CD2-CD2 4.38Å; L123-F127 HydrophobicContact CD2-CE2 4.08Å; L123-F127 WeakPolarHBondContact O-CD2 3.43Å; L123-F127 PolarHBondContact O-N 3.4Å
128	K	70.2	Confident	63.7	Low	110 Å²	110	74.3 Å²	74.3	48%	0.478	46%	0.46	S	S	.	.			trans	-58.4	126.4	170	-175.4	176.4	-178.5	178.6	0	108.6	A124 A125 H126 S130	A124-K128 PolarHBondContact O-N 3.26Å; A125-K128 WeakPolarHBondContact O-CB 3.17Å; H126-K128 VanDerWaalsContact C-N 3.34Å; K128-S130 PolarHBondContact O-N 3.39Å
129	P	54.2	Low	61.1	Low	102 Å²	102	74.9 Å²	74.9	66%	0.662	49%	0.487	S	S	*	.			trans	-67.6	97.3	-174.8	25.9	-34.4	0	0	0	111.1
130	S	39.9	Very low	58.4	Low	80 Å²	80	78.7 Å²	78.7	56%	0.559	53%	0.526	S	S	*	.			trans	-60.1	143.1	163.4	-175.8	0	0	0	0	109.2	K128 S132 Q133	K128-S130 PolarHBondContact O-N 3.39Å; S130-S132 PolarHBondContact O-N 3.02Å; S130-Q133 PolarHBondContact O-N 3.39Å
131	A	44.4	Very low	56	Low	86 Å²	86	90.7 Å²	90.7	71%	0.711	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-57.3	-25.8	-172	0	0	0	0	0	113.5	Q133	A131-Q133 PolarHBondContact O-N 3.17Å
132	S	34.2	Very low	53.1	Low	92 Å²	92	94 Å²	94	64%	0.643	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-62.5	-30.3	-176.8	-43.2	0	0	0	0	115.1	S130 R134 A135	S130-S132 PolarHBondContact O-N 3.02Å; S132-R134 VanDerWaalsContact C-N 3.28Å; S132-R134 PolarHBondContact O-N 2.97Å; S132-A135 PolarHBondContact O-N 3.45Å
133	Q	40.8	Very low	50.8	Low	155 Å²	155	101.6 Å²	101.6	72%	0.724	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-73.8	-13.9	-171.4	-80.2	-175.4	-18.5	0	0	114.6	S130 A131 A135	S130-Q133 PolarHBondContact O-N 3.39Å; A131-Q133 PolarHBondContact O-N 3.17Å; Q133-A135 VanDerWaalsContact C-N 3.25Å; Q133-A135 PolarHBondContact O-N 2.95Å
134	R	35.9	Very low	48.3	Very low	228 Å²	228	107.7 Å²	107.7	86%	0.86	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-78.1	-3.3	174.3	-92.4	-175.8	-85.5	158.5	-6.7	114.6	S132	S132-R134 VanDerWaalsContact C-N 3.28Å; S132-R134 PolarHBondContact O-N 2.97Å
135	A	40.3	Very low	45.7	Very low	84 Å²	84	118.9 Å²	118.9	69%	0.694	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-89.9	-9.1	174.8	0	0	0	0	0	114.2	S132 Q133	S132-A135 PolarHBondContact O-N 3.45Å; Q133-A135 VanDerWaalsContact C-N 3.25Å; Q133-A135 PolarHBondContact O-N 2.95Å
136	A	39.3	Very low	43.1	Very low	96 Å²	96	119.3 Å²	119.3	79%	0.793	72%	0.722	S	S	*	*	S	Bend	trans	-89.4	0.8	-170.4	0	0	0	0	0	115.3
137	A	39.1	Very low	41	Very low	106 Å²	106	122.7 Å²	122.7	88%	0.876	74%	0.743	S	S	*	*	S	Bend	trans	-120.7	47.5	-175	0	0	0	0	0	112.4
138	G	40.9	Very low	38.8	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	77%	0.766	S	S	*	*			trans	175.9	81	-179.9	0	0	0	0	0	112.1
139	G	32.1	Very low	37.4	Very low	79 Å²	79	127 Å²	127	81%	0.814	78%	0.783	S	S	*	*			trans	-167.8	59	-171.3	0	0	0	0	0	114	R141	G139-R141 PolarHBondContact O-N 3.06Å
140	G	33.5	Very low	36.5	Very low	80 Å²	80	129.9 Å²	129.9	83%	0.825	79%	0.788	S	S	*	*			trans	-70.6	123.7	173.2	0	0	0	0	0	112
141	R	38.8	Very low	36.4	Very low	253 Å²	253	132.2 Å²	132.2	96%	0.955	79%	0.794	S	S	*	*			trans	26.9	106.1	159.4	-72.2	178.1	162.2	-172.4	-5.3	117.9	G139	G139-R141 PolarHBondContact O-N 3.06Å
142	S	27.9	Very low	36.2	Very low	109 Å²	109	134 Å²	134	76%	0.762	80%	0.798	S	S	*	*			trans	-146	138.5	137.1	-168.2	0	0	0	0	110.9
143	L	36.9	Very low	36.5	Very low	176 Å²	176	137.1 Å²	137.1	92%	0.921	81%	0.807	S	S	*	*			trans	-128.7	85.7	-177.3	-86.6	168.3	0	0	0	109.7
144	T	35.7	Very low	37	Very low	131 Å²	131	132.7 Å²	132.7	80%	0.804	79%	0.793	S	S	*	*			trans	-136.2	105.6	170.6	32.1	0	0	0	0	112.8
145	R	30.8	Very low	37.5	Very low	251 Å²	251	127.4 Å²	127.4	95%	0.947	79%	0.786	S	S	*	*			trans	-39.1	132.7	168.8	176.5	179.4	72.9	-172	6.2	115
146	G	28.7	Very low	37.9	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	78%	0.777	S	S	*	*			trans	-170.7	96.1	166.9	0	0	0	0	0	114.4
147	N	35.9	Very low	38.5	Very low	164 Å²	164	125.5 Å²	125.5	88%	0.877	76%	0.762	S	S	*	*			trans	-79.6	120.7	173.1	-84.4	9.4	0	0	0	111.2
148	T	35	Very low	39.1	Very low	117 Å²	117	127 Å²	127	72%	0.718	76%	0.755	S	S	*	*			trans	-143.7	134.9	150.7	44.1	0	0	0	0	110
149	T	40.1	Very low	39.6	Very low	137 Å²	137	126.5 Å²	126.5	84%	0.84	74%	0.743	S	S	*	*			trans	-106.7	104	-176.3	48.4	0	0	0	0	110.5
150	H	35.4	Very low	40.9	Very low	162 Å²	162	129 Å²	129	75%	0.75	73%	0.733	S	S	*	*			trans	-130.1	139.4	178.3	-62.5	-63.7	0	0	0	112.4
151	N	38.6	Very low	41.7	Very low	128 Å²	128	127.2 Å²	127.2	68%	0.684	72%	0.715	S	S	*	*			trans	-88.1	123.8	-165.7	-175.3	8.7	0	0	0	111.3	L153	N151-L153 PolarHBondContact O-N 3.23Å
152	P	40	Very low	42.5	Very low	124 Å²	124	118 Å²	118	81%	0.805	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	37.6	-167.4	34.3	-39.4	0	0	0	115.1
153	L	40.8	Very low	43.7	Very low	157 Å²	157	115.8 Å²	115.8	82%	0.822	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	23.5	-177	-74.7	172.8	0	0	0	114	N151	N151-L153 PolarHBondContact O-N 3.23Å
154	S	50.8	Low	44.7	Very low	62 Å²	62	110.2 Å²	110.2	43%	0.434	66%	0.661	S	S	.	*			trans	-98	118.6	173.1	-176.1	0	0	0	0	112	V156 A157	S154-V156 PolarHBondContact O-N 3.21Å; S154-V156 PolarHBondContact OG-N 3.5Å; S154-A157 PolarHBondContact O-N 3.12Å
155	T	47.9	Very low	45.7	Very low	117 Å²	117	106.9 Å²	106.9	72%	0.718	65%	0.647	S	S	*	*	H	α-helix	trans	-59.1	-27.1	172.2	47.8	0	0	0	0	112.8	L158 A159	T155-L158 PolarHBondContact O-N 2.87Å; T155-A159 PolarHBondContact O-N 3.37Å
156	V	48.6	Very low	47	Very low	82 Å²	82	99.6 Å²	99.6	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-64.6	-39.3	177.4	-176.4	0	0	0	0	111.5	S154 L158 A159 Q160	S154-V156 PolarHBondContact O-N 3.21Å; S154-V156 PolarHBondContact OG-N 3.5Å; V156-L158 VanDerWaalsContact C-N 3.35Å; V156-A159 PolarHBondContact O-N 3.25Å; V156-Q160 HydrophobicContact CG1-CG 4.5Å; V156-Q160 WeakPolarHBondContact O-CB 3.13Å; V156-Q160 WeakPolarHBondContact O-CG 3.32Å; V156-Q160 PolarHBondContact O-N 3.47Å
157	A	51.8	Low	48.3	Very low	59 Å²	59	98.8 Å²	98.8	49%	0.488	61%	0.612	S	S	.	*	H	α-helix	trans	-67.4	-37.2	178.2	0	0	0	0	0	111.7	S154 Q160 G161	S154-A157 PolarHBondContact O-N 3.12Å; A157-Q160 PolarHBondContact O-N 2.76Å; A157-G161 PolarHBondContact O-N 2.85Å
158	L	51.3	Low	49.3	Very low	138 Å²	138	94.5 Å²	94.5	72%	0.723	60%	0.595	S	S	*	*	H	α-helix	trans	-64.4	-43.2	172.8	-110.6	169.1	0	0	0	111.7	T155 V156 G161 A162	T155-L158 PolarHBondContact O-N 2.87Å; V156-L158 VanDerWaalsContact C-N 3.35Å; L158-G161 PolarHBondContact O-N 3.49Å; L158-A162 WeakPolarHBondContact O-CB 3.5Å; L158-A162 PolarHBondContact O-N 3.25Å
159	A	51.6	Low	50.1	Low	61 Å²	61	91.7 Å²	91.7	50%	0.504	58%	0.584	S	S	.	*	H	α-helix	trans	-64.1	-40.4	176.1	0	0	0	0	0	112.5	T155 V156 A162 A163	T155-A159 PolarHBondContact O-N 3.37Å; V156-A159 PolarHBondContact O-N 3.25Å; A159-A162 PolarHBondContact O-N 3.34Å; A159-A163 WeakPolarHBondContact O-CB 3.45Å; A159-A163 PolarHBondContact O-N 3.43Å
160	Q	59.4	Low	50.7	Low	131 Å²	131	94 Å²	94	61%	0.612	58%	0.577	S	S	*	*	H	α-helix	trans	-66.5	-43.2	175.7	-74.3	173.1	-31.5	0	0	112.2	V156 A157 A163 A164	V156-Q160 HydrophobicContact CG1-CG 4.5Å; V156-Q160 WeakPolarHBondContact O-CB 3.13Å; V156-Q160 WeakPolarHBondContact O-CG 3.32Å; V156-Q160 PolarHBondContact O-N 3.47Å; A157-Q160 PolarHBondContact O-N 2.76Å; Q160-A163 PolarHBondContact O-N 2.89Å; Q160-A164 WeakPolarHBondContact O-CB 3.47Å; Q160-A164 PolarHBondContact O-N 3.03Å
161	G	50.6	Low	51.4	Low	43 Å²	43	92.1 Å²	92.1	44%	0.443	57%	0.572	S	S	.	*	H	α-helix	trans	-62.2	-42.5	174.2	0	0	0	0	0	112.8	A157 L158 A164 A165	A157-G161 PolarHBondContact O-N 2.85Å; L158-G161 PolarHBondContact O-N 3.49Å; G161-A164 PolarHBondContact O-N 3.05Å; G161-A165 WeakPolarHBondContact O-CB 3.33Å; G161-A165 PolarHBondContact O-N 3.38Å
162	A	53.7	Low	51.9	Low	60 Å²	60	91.9 Å²	91.9	50%	0.496	57%	0.571	S	S	.	*	H	α-helix	trans	-64.7	-41.3	175	0	0	0	0	0	112.3	L158 A159 A165 L166	L158-A162 WeakPolarHBondContact O-CB 3.5Å; L158-A162 PolarHBondContact O-N 3.25Å; A159-A162 PolarHBondContact O-N 3.34Å; A162-A165 PolarHBondContact O-N 3Å; A162-L166 VanDerWaalsContact O-CB 3.3Å; A162-L166 WeakPolarHBondContact O-CB 3.47Å; A162-L166 PolarHBondContact O-N 3.22Å
163	A	54.3	Low	52.1	Low	62 Å²	62	90.1 Å²	90.1	51%	0.512	57%	0.566	S	S	.	*	H	α-helix	trans	-64.2	-41.1	176.6	0	0	0	0	0	112.2	A159 Q160 L166 A167	A159-A163 WeakPolarHBondContact O-CB 3.45Å; A159-A163 PolarHBondContact O-N 3.43Å; Q160-A163 PolarHBondContact O-N 2.89Å; A163-L166 PolarHBondContact O-N 3.45Å; A163-A167 WeakPolarHBondContact O-CB 3.24Å; A163-A167 PolarHBondContact O-N 2.61Å
164	A	57.8	Low	52.2	Low	59 Å²	59	86.5 Å²	86.5	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-63.5	-47.4	174.7	0	0	0	0	0	111.8	Q160 G161 L166 A167 S168	Q160-A164 WeakPolarHBondContact O-CB 3.47Å; Q160-A164 PolarHBondContact O-N 3.03Å; G161-A164 PolarHBondContact O-N 3.05Å; A164-L166 VanDerWaalsContact C-N 3.31Å; A164-L166 PolarHBondContact O-N 3.03Å; A164-A167 WeakPolarHBondContact O-CB 3.45Å; A164-A167 PolarHBondContact O-N 2.85Å; A164-S168 PolarHBondContact O-N 3.26Å; A164-S168 PolarHBondContact O-OG 3.42Å
165	A	56.2	Low	52	Low	62 Å²	62	89 Å²	89	51%	0.512	56%	0.562	S	S	.	*	H	α-helix	trans	-61	-38.2	176.5	0	0	0	0	0	112.6	G161 A162 S168 A169	G161-A165 WeakPolarHBondContact O-CB 3.33Å; G161-A165 PolarHBondContact O-N 3.38Å; A162-A165 PolarHBondContact O-N 3Å; A165-S168 PolarHBondContact O-N 2.94Å; A165-A169 WeakPolarHBondContact O-CB 3.25Å; A165-A169 PolarHBondContact O-N 3.22Å
166	L	58.3	Low	51.4	Low	98 Å²	98	89.2 Å²	89.2	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-71.4	-31.9	177.3	-160.8	153.1	0	0	0	111.9	A162 A163 A164 R170	A162-L166 VanDerWaalsContact O-CB 3.3Å; A162-L166 WeakPolarHBondContact O-CB 3.47Å; A162-L166 PolarHBondContact O-N 3.22Å; A163-L166 PolarHBondContact O-N 3.45Å; A164-L166 VanDerWaalsContact C-N 3.31Å; A164-L166 PolarHBondContact O-N 3.03Å; L166-R170 HydrophobicContact CD2-CG 4.28Å; L166-R170 WeakPolarHBondContact O-CB 3.46Å; L166-R170 WeakPolarHBondContact O-CG 3.36Å; L166-R170 PolarHBondContact O-N 2.91Å
167	A	55.7	Low	50.8	Low	51 Å²	51	92.5 Å²	92.5	42%	0.421	58%	0.579	S	S	.	*	H	α-helix	trans	-66.2	-45	170.5	0	0	0	0	0	111.9	A163 A164 R170 L171	A163-A167 WeakPolarHBondContact O-CB 3.24Å; A163-A167 PolarHBondContact O-N 2.61Å; A164-A167 WeakPolarHBondContact O-CB 3.45Å; A164-A167 PolarHBondContact O-N 2.85Å; A167-R170 PolarHBondContact O-N 2.99Å; A167-L171 PolarHBondContact O-N 3.17Å; A167-L171 VanDerWaalsContact O-N 3.16Å
168	S	57.4	Low	49.8	Very low	74 Å²	74	101 Å²	101	52%	0.517	60%	0.598	S	S	.	*	H	α-helix	trans	-60.8	-46	173.5	-61.1	0	0	0	0	112.2	A164 A165 R170 L171 D172	A164-S168 PolarHBondContact O-N 3.26Å; A164-S168 PolarHBondContact O-OG 3.42Å; A165-S168 PolarHBondContact O-N 2.94Å; S168-R170 VanDerWaalsContact C-N 3.26Å; S168-R170 PolarHBondContact O-N 3.33Å; S168-L171 WeakPolarHBondContact O-CB 3.42Å; S168-L171 PolarHBondContact O-N 2.91Å; S168-D172 PolarHBondContact O-N 3.03Å; S168-D172 VanDerWaalsContact O-N 3.07Å
169	A	52.7	Low	48.9	Very low	58 Å²	58	103.6 Å²	103.6	48%	0.479	60%	0.604	S	S	.	*	H	α-helix	trans	-62.8	-30.6	177.3	0	0	0	0	0	113.1	A165 A173	A165-A169 WeakPolarHBondContact O-CB 3.25Å; A165-A169 PolarHBondContact O-N 3.22Å; A169-A173 WeakPolarHBondContact O-CB 3.43Å; A169-A173 PolarHBondContact O-N 3.29Å
170	R	52.9	Low	47.8	Very low	185 Å²	185	105.4 Å²	105.4	70%	0.698	62%	0.619	S	S	*	*	H	α-helix	trans	-70.8	-30.8	172.4	-82	179	171.2	-172.5	-2.5	113.3	L166 A167 S168 S174	L166-R170 HydrophobicContact CD2-CG 4.28Å; L166-R170 WeakPolarHBondContact O-CB 3.46Å; L166-R170 WeakPolarHBondContact O-CG 3.36Å; L166-R170 PolarHBondContact O-N 2.91Å; A167-R170 PolarHBondContact O-N 2.99Å; S168-R170 VanDerWaalsContact C-N 3.26Å; S168-R170 PolarHBondContact O-N 3.33Å; R170-S174 PolarHBondContact O-N 3.27Å
171	L	50.1	Low	46.3	Very low	123 Å²	123	110.7 Å²	110.7	64%	0.644	63%	0.633	S	S	*	*	H	α-helix	trans	-71.9	-48.1	174.9	-71.2	166	0	0	0	110.7	A167 S168 A173 S174	A167-L171 PolarHBondContact O-N 3.17Å; A167-L171 VanDerWaalsContact O-N 3.16Å; S168-L171 WeakPolarHBondContact O-CB 3.42Å; S168-L171 PolarHBondContact O-N 2.91Å; L171-A173 VanDerWaalsContact C-N 3.32Å; L171-A173 PolarHBondContact O-N 3.39Å; L171-S174 PolarHBondContact O-N 3.1Å; L171-S174 PolarHBondContact O-OG 3.4Å
172	D	48.8	Very low	45.3	Very low	124 Å²	124	116.4 Å²	116.4	66%	0.663	65%	0.652	S	S	*	*	H	α-helix	trans	-57.2	-44.5	173.5	-89.9	-17.8	0	0	0	111.9	S168 S174 L175	S168-D172 PolarHBondContact O-N 3.03Å; S168-D172 VanDerWaalsContact O-N 3.07Å; D172-S174 PolarHBondContact O-N 3.19Å; D172-S174 VanDerWaalsContact O-N 3.15Å; D172-L175 PolarHBondContact O-N 3.49Å
173	A	42.7	Very low	44	Very low	86 Å²	86	120.2 Å²	120.2	71%	0.711	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-7.9	178.6	0	0	0	0	0	114.6	A169 L171	A169-A173 WeakPolarHBondContact O-CB 3.43Å; A169-A173 PolarHBondContact O-N 3.29Å; L171-A173 VanDerWaalsContact C-N 3.32Å; L171-A173 PolarHBondContact O-N 3.39Å
174	S	43.6	Very low	42.6	Very low	81 Å²	81	122.8 Å²	122.8	57%	0.566	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-8.1	177.4	73.7	0	0	0	0	114.1	R170 L171 D172	R170-S174 PolarHBondContact O-N 3.27Å; L171-S174 PolarHBondContact O-N 3.1Å; L171-S174 PolarHBondContact O-OG 3.4Å; D172-S174 PolarHBondContact O-N 3.19Å; D172-S174 VanDerWaalsContact O-N 3.15Å
175	L	47.2	Very low	41.1	Very low	115 Å²	115	122.7 Å²	122.7	60%	0.602	68%	0.684	S	S	*	*	S	Bend	trans	-82.9	131.9	-179.2	-65.2	174.5	0	0	0	111.7	D172 I177	D172-L175 PolarHBondContact O-N 3.49Å; L175-I177 PolarHBondContact O-N 3.36Å; L175-I177 VanDerWaalsContact O-N 3.09Å
176	P	34	Very low	39.8	Very low	122 Å²	122	132.8 Å²	132.8	79%	0.792	71%	0.709	S	S	*	*			trans	-66.6	109	-175.4	-24.1	35	0	0	0	114.5	R178	P176-R178 PolarHBondContact O-N 3.01Å
177	I	36.1	Very low	38.2	Very low	150 Å²	150	131.9 Å²	131.9	77%	0.769	72%	0.723	S	S	*	*			trans	-68.3	109.7	176.2	-58.9	173.1	0	0	0	110.3	L175	L175-I177 PolarHBondContact O-N 3.36Å; L175-I177 VanDerWaalsContact O-N 3.09Å
178	R	31.7	Very low	37.1	Very low	238 Å²	238	138 Å²	138	90%	0.898	75%	0.747	S	S	*	*			trans	-83	116.7	166.2	-65.6	-167.5	-172.4	-143.5	4.2	109.9	P176 A180	P176-R178 PolarHBondContact O-N 3.01Å; R178-A180 PolarHBondContact O-N 3.07Å
179	F	31.8	Very low	35.8	Very low	193 Å²	193	142.5 Å²	142.5	85%	0.846	77%	0.766	S	S	*	*			trans	-65.4	116.7	176	-85	-103.8	0	0	0	112	R181	F179-R181 PolarHBondContact O-N 2.84Å
180	A	28.8	Very low	34.7	Very low	99 Å²	99	142.8 Å²	142.8	82%	0.818	77%	0.774	S	S	*	*			trans	-88.2	93.1	165.3	0	0	0	0	0	109.9	R178 I182	R178-A180 PolarHBondContact O-N 3.07Å; A180-I182 PolarHBondContact O-N 2.78Å
181	R	28.2	Very low	33.9	Very low	241 Å²	241	143.2 Å²	143.2	91%	0.909	78%	0.784	S	S	*	*			trans	-85.2	106.6	-178	-168.4	-175.6	-163.6	174.1	5.2	110.6	F179 N183	F179-R181 PolarHBondContact O-N 2.84Å; R181-N183 PolarHBondContact O-N 2.65Å
182	I	30.2	Very low	33	Very low	163 Å²	163	148.7 Å²	148.7	84%	0.836	80%	0.796	S	S	*	*			trans	-77.4	113.3	175.4	-57.7	173.5	0	0	0	109.8	A180	A180-I182 PolarHBondContact O-N 2.78Å
183	N	24.8	Very low	32.3	Very low	141 Å²	141	148 Å²	148	75%	0.754	80%	0.801	S	S	*	*				176.1	151.1	118	-163.5	11.2	0	0	0	111	R181	R181-N183 PolarHBondContact O-N 2.65Å
184	S	26.6	Very low	32.1	Very low	115 Å²	115	151.1 Å²	151.1	80%	0.804	80%	0.804	S	S	*	*			trans	59.7	141.4	176	65.7	0	0	0	0	117.3
185	G	25	Very low	31.9	Very low	58 Å²	58	151.4 Å²	151.4	60%	0.598	81%	0.805	S	S	*	*			cis	154	142.6	-9.6	0	0	0	0	0	112.4
186	W	28.3	Very low	31.5	Very low	274 Å²	274	151.4 Å²	151.4	100%	1.038	81%	0.81	S	S	*	*			trans	66.9	141.6	-180	-50.9	78.4	0	0	0	115.4
187	G	25.5	Very low	32	Very low	79 Å²	79	155.4 Å²	155.4	81%	0.814	81%	0.809	S	S	*	*			trans	147.3	121.5	-179.4	0	0	0	0	0	111.1
188	L	33.6	Very low	32.7	Very low	178 Å²	178	151 Å²	151	93%	0.932	80%	0.795	S	S	*	*			trans	-95.6	171.5	174.6	-80.3	159.6	0	0	0	110.5
189	D	29.3	Very low	33.3	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	78%	0.784	S	S	*	*			trans	86.4	153.9	153.8	-155.4	17.1	0	0	0	118.3
190	G	29.8	Very low	33.9	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	77%	0.766	S	S	*	*			trans	93.8	83.3	173.6	0	0	0	0	0	115.9
191	E	35	Very low	34.5	Very low	194 Å²	194	141.6 Å²	141.6	91%	0.907	76%	0.755	S	S	*	*			trans	-61.2	142.8	162.3	-63.5	-177.6	107.8	0	0	111.8
192	R	32.6	Very low	35.1	Very low	239 Å²	239	137.9 Å²	137.9	90%	0.902	75%	0.749	S	S	*	*			trans	-155	108.5	136.3	-122.3	170.9	-172.3	176.5	3.5	113.4
193	S	33.5	Very low	35.6	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	75%	0.75	S	S	*	*			trans	-59.2	145.7	166.3	-175.7	0	0	0	0	111	C195	S193-C195 PolarHBondContact O-N 2.69Å; S193-C195 VanDerWaalsContact O-N 3.13Å
194	I	38.1	Very low	36.3	Very low	151 Å²	151	141.4 Å²	141.4	77%	0.774	75%	0.749	S	S	*	*			trans	-77.6	100.8	-176.9	-62.2	169.9	0	0	0	108.8	V196	I194-V196 PolarHBondContact O-N 2.84Å
195	C	39.3	Very low	36.7	Very low	86 Å²	86	146.9 Å²	146.9	58%	0.581	75%	0.752	S	S	*	*			trans	-61.5	121.7	-177.9	-61.8	0	0	0	0	112.2	S193 R197 A198	S193-C195 PolarHBondContact O-N 2.69Å; S193-C195 VanDerWaalsContact O-N 3.13Å; C195-R197 PolarHBondContact O-N 2.84Å; C195-A198 WeakPolarHBondContact O-CB 3.35Å; C195-A198 PolarHBondContact O-N 2.83Å
196	V	40.1	Very low	37	Very low	116 Å²	116	147.3 Å²	147.3	70%	0.703	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	-29.1	178.6	-178.5	0	0	0	0	113.3	I194 A198 L199	I194-V196 PolarHBondContact O-N 2.84Å; V196-A198 PolarHBondContact O-N 2.88Å; V196-A198 VanDerWaalsContact O-N 3.13Å; V196-L199 PolarHBondContact O-N 2.87Å
197	R	44.6	Very low	37	Very low	206 Å²	206	141.1 Å²	141.1	78%	0.777	75%	0.749	S	S	*	*	H	α-helix	trans	-53.9	-28.6	173.8	-174.7	176	-73.5	-173.9	-2.1	113.7	C195	C195-R197 PolarHBondContact O-N 2.84Å
198	A	50	Low	37	Very low	57 Å²	57	142.6 Å²	142.6	47%	0.471	74%	0.742	S	S	.	*	H	α-helix	trans	-72.9	-29.8	177.5	0	0	0	0	0	113.2	C195 V196	C195-A198 WeakPolarHBondContact O-CB 3.35Å; C195-A198 PolarHBondContact O-N 2.83Å; V196-A198 PolarHBondContact O-N 2.88Å; V196-A198 VanDerWaalsContact O-N 3.13Å
199	L	44.8	Very low	36.7	Very low	127 Å²	127	140.5 Å²	140.5	67%	0.665	73%	0.732	S	S	*	*	H	α-helix	trans	-73.7	-36.8	-177.5	-135	75.7	0	0	0	111.9	V196 Q202	V196-L199 PolarHBondContact O-N 2.87Å; L199-Q202 PolarHBondContact O-N 3.03Å
200	V	43.6	Very low	36.6	Very low	77 Å²	77	139.8 Å²	139.8	47%	0.467	72%	0.723	S	S	.	*	H	α-helix	trans	-66.7	-41.5	179.9	-177.4	0	0	0	0	111.3	Q202 Y203	V200-Q202 PolarHBondContact O-N 2.8Å; V200-Q202 VanDerWaalsContact O-N 3.1Å; V200-Y203 PolarHBondContact O-N 2.98Å
201	Q	41.8	Very low	36.5	Very low	128 Å²	128	144 Å²	144	60%	0.598	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-13.5	-179	-70.6	-172.8	-27.3	0	0	114.5
202	Q	41.6	Very low	36	Very low	164 Å²	164	143.5 Å²	143.5	77%	0.766	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-12.6	171.6	-70.4	-158.2	-103.7	0	0	114.1	L199 V200	L199-Q202 PolarHBondContact O-N 3.03Å; V200-Q202 PolarHBondContact O-N 2.8Å; V200-Q202 VanDerWaalsContact O-N 3.1Å
203	Y	40.2	Very low	35.6	Very low	220 Å²	220	139.2 Å²	139.2	86%	0.863	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-17.3	178.9	-122.4	-89.5	0	0	0	113.7	V200	V200-Y203 PolarHBondContact O-N 2.98Å
204	E	39.1	Very low	36	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	71%	0.711	S	S	*	*	S	Bend	trans	-97	6.9	-178.7	-62.5	-176.4	133.8	0	0	113.9
205	R	35.1	Very low	35.4	Very low	229 Å²	229	138.7 Å²	138.7	86%	0.864	71%	0.708	S	S	*	*			trans	-137.2	85.8	-169.9	-156.9	177.8	-140.9	-139.6	2	114.3
206	G	31.2	Very low	34.9	Very low	67 Å²	67	141.7 Å²	141.7	69%	0.691	72%	0.718	S	S	*	*			trans	-138.5	126.9	167.9	0	0	0	0	0	112.6
207	V	28.5	Very low	34.2	Very low	145 Å²	145	141.2 Å²	141.2	88%	0.879	72%	0.72	S	S	*	*			trans	65.8	136.9	164.2	-171	0	0	0	0	115.1
208	T	24.7	Very low	33.2	Very low	109 Å²	109	136.1 Å²	136.1	67%	0.669	72%	0.716	S	S	*	*			cis	-91.8	-150.5	2.6	50.2	0	0	0	0	111.4
209	D	27.8	Very low	32	Very low	135 Å²	135	138.1 Å²	138.1	72%	0.722	73%	0.726	S	S	*	*			cis	-156.5	172.2	1.2	-116.9	-39.6	0	0	0	107.1
210	E	27.9	Very low	31.2	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	74%	0.735	S	S	*	*			cis	-113.3	-152.2	2.6	-61.3	176.8	-121.2	0	0	109.5
211	Q	26.5	Very low	30.2	Very low	152 Å²	152	141.1 Å²	141.1	71%	0.71	75%	0.749	S	S	*	*			cis	-161.3	174.5	7.5	-151.6	158.8	60.4	0	0	112
212	E	25.7	Very low	30	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.864	76%	0.757	S	S	*	*			trans	66.9	89	174.8	-56.5	-144.6	134.1	0	0	118.4
213	D	24.5	Very low	29.1	Very low	148 Å²	148	140.2 Å²	140.2	79%	0.791	76%	0.76	S	S	*	*			trans	-60.8	177.1	158.5	-125	-19.9	0	0	0	112
214	P	40.4	Very low	28.9	Very low	95 Å²	95	135.3 Å²	135.3	62%	0.617	76%	0.755	S	S	*	*			cis	-137.4	153.8	31.2	30.4	-6.6	0	0	0	118.3
215	H	25.1	Very low	28.3	Very low	156 Å²	156	132.9 Å²	132.9	72%	0.722	76%	0.755	S	S	*	*				166.5	138.2	105.3	-91	-64.5	0	0	0	116.4
216	L	28.8	Very low	28.7	Very low	148 Å²	148	127.4 Å²	127.4	78%	0.775	75%	0.749	S	S	*	*			trans	73.3	107.6	151.2	-66.9	165.3	0	0	0	120.9
217	S	25.6	Very low	28.4	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	76%	0.763	S	S	*	*			trans	69.9	142.7	131.4	-58.8	0	0	0	0	120.6
218	S	24.6	Very low	28.3	Very low	99 Å²	99	134.8 Å²	134.8	69%	0.692	76%	0.757	S	S	*	*			cis	-169.1	149.3	-11.6	50	0	0	0	0	112.3
219	S	25.4	Very low	28.3	Very low	99 Å²	99	138.7 Å²	138.7	69%	0.692	77%	0.768	S	S	*	*			trans	58.5	116.6	144.3	64.3	0	0	0	0	122.8
220	V	26.2	Very low	28.1	Very low	142 Å²	142	140.6 Å²	140.6	86%	0.861	77%	0.772	S	S	*	*				86.5	137	124.5	174.3	0	0	0	0	120.9
221	T	23.9	Very low	27.9	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	78%	0.777	S	S	*	*			trans	-82.9	-179.6	176.1	29.9	0	0	0	0	114
222	P	36.5	Very low	27.8	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	77%	0.773	S	S	*	*			cis	-133.2	-160	-18.1	31.5	-8	0	0	0	113.7
223	L	23.6	Very low	27.8	Very low	157 Å²	157	134.2 Å²	134.2	82%	0.822	77%	0.77	S	S	*	*			trans	-27.3	160.6	159.9	-103	63.7	0	0	0	117.6
224	P	35.7	Very low	27.9	Very low	118 Å²	118	132 Å²	132	77%	0.766	77%	0.767	S	S	*	*			cis	-143.1	-171.9	23.3	41	-19.8	0	0	0	118.1
225	S	25.6	Very low	27.2	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	78%	0.779	S	S	*	*			trans	-69.9	-171.5	170.5	-25.4	0	0	0	0	113.9
226	P	44.2	Very low	27.5	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	78%	0.784	S	S	*	*			cis	-135.7	171.9	-12.7	40.9	-25.6	0	0	0	115.1
227	R	24.5	Very low	27.6	Very low	258 Å²	258	139.3 Å²	139.3	97%	0.974	79%	0.789	S	S	*	*			trans	-176.2	164.7	139.1	-108.7	169.6	-176	-175.7	1.2	113.5
228	S	27.1	Very low	27.8	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	79%	0.787	S	S	*	*			trans	-121	150.7	179.2	52.5	0	0	0	0	111.8
229	Q	24.5	Very low	28	Very low	190 Å²	190	142 Å²	142	89%	0.888	79%	0.793	S	S	*	*			trans	-167.9	168.6	140.2	-111.3	169.2	0.7	0	0	113.5
230	Q	24.1	Very low	28	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	80%	0.799	S	S	*	*			trans	-90.7	168.7	-158.8	-57.8	147.1	-57.5	0	0	114.6
231	S	23.8	Very low	28.2	Very low	117 Å²	117	141.8 Å²	141.8	82%	0.818	79%	0.786	S	S	*	*			trans	143.7	150.2	137.1	62.8	0	0	0	0	111.6
232	S	24.5	Very low	28.5	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	79%	0.79	S	S	*	*			cis	-162.6	173.4	-10.6	40.4	0	0	0	0	110.7
233	N	25.9	Very low	28.1	Very low	151 Å²	151	146.2 Å²	146.2	81%	0.807	79%	0.792	S	S	*	*			trans	76.6	145.2	163.3	-51.6	-44	0	0	0	117.6
234	S	25.6	Very low	28.3	Very low	103 Å²	103	146.4 Å²	146.4	72%	0.72	79%	0.788	S	S	*	*			cis	-165.1	147.9	-23.3	-173.9	0	0	0	0	109.4
235	V	27.2	Very low	27.8	Very low	144 Å²	144	147.8 Å²	147.8	87%	0.873	79%	0.785	S	S	*	*			trans	-132.7	145.4	170.3	177.1	0	0	0	0	108.5
236	R	31.3	Very low	28	Very low	222 Å²	222	149.9 Å²	149.9	84%	0.838	78%	0.783	S	S	*	*			trans	-149	148.9	179.7	-119.4	-174.9	176.3	-151.4	-4.2	113.4
237	Q	29.2	Very low	27.1	Very low	186 Å²	186	151.8 Å²	151.8	87%	0.869	78%	0.782	S	S	*	*			trans	68.6	147.4	172.3	-61.4	175.8	-44.8	0	0	116.5
238	A	30.3	Very low	27.2	Very low	85 Å²	85	144.6 Å²	144.6	70%	0.702	77%	0.771	S	S	*	*			cis	-161.7	130.8	-28.5	0	0	0	0	0	106.6
239	H	30	Very low	27.5	Very low	178 Å²	178	145 Å²	145	82%	0.824	77%	0.774	S	S	*	*				64.3	104.7	73.7	-110	-74.4	0	0	0	115.4
240	D	24.7	Very low	28	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	77%	0.772	S	S	*	*				-178.2	159.6	129	-103.3	-3.6	0	0	0	111
241	S	31.2	Very low	28.7	Very low	84 Å²	84	143.2 Å²	143.2	59%	0.587	78%	0.775	S	S	*	*			cis	-172	158.1	-37.9	-104	0	0	0	0	111.1
242	L	29	Very low	29.6	Very low	161 Å²	161	143.1 Å²	143.1	84%	0.843	77%	0.774	S	S	*	*			trans	100	155.3	165.1	-64.4	169.6	0	0	0	120.5
243	Q	28.2	Very low	30.4	Very low	172 Å²	172	143 Å²	143	80%	0.804	77%	0.773	S	S	*	*			trans	-85.1	175.8	-169.7	-68.2	151.1	-42	0	0	110.1
244	Q	27.5	Very low	31.3	Very low	160 Å²	160	142.2 Å²	142.2	75%	0.748	77%	0.769	S	S	*	*				-173.8	136.3	55.3	-174.7	170.7	-7.3	0	0	113.9
245	E	26.6	Very low	32.4	Very low	148 Å²	148	141 Å²	141	69%	0.692	77%	0.766	S	S	*	*			trans	52.7	150.4	149.9	-66.6	175.5	128.5	0	0	125.2
246	Q	27.9	Very low	33.5	Very low	150 Å²	150	139.8 Å²	139.8	70%	0.701	76%	0.758	S	S	*	*			trans	77	114.6	150.5	-79.5	176.4	-67.2	0	0	122.9
247	E	25.7	Very low	34.4	Very low	155 Å²	155	133.7 Å²	133.7	72%	0.724	75%	0.745	S	S	*	*				85.3	116.3	126.6	-74.4	172.1	-149.7	0	0	123.2
248	S	27	Very low	35.3	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	73%	0.732	S	S	*	*			trans	86.4	106.6	134.1	72.2	0	0	0	0	120.5
249	S	33.8	Very low	36.5	Very low	118 Å²	118	133.2 Å²	133.2	83%	0.825	73%	0.73	S	S	*	*				26.8	93.8	125.2	-49.6	0	0	0	0	119.9
250	V	34.3	Very low	37.6	Very low	141 Å²	141	127.5 Å²	127.5	86%	0.855	71%	0.714	S	S	*	*			trans	-137.2	90	132.3	-172.7	0	0	0	0	109.1
251	E	38.6	Very low	39.1	Very low	186 Å²	186	125.4 Å²	125.4	87%	0.869	70%	0.702	S	S	*	*			trans	-98.2	168.9	168.5	-156.1	166.7	-146.5	0	0	109.7
252	S	42.2	Very low	40.2	Very low	115 Å²	115	127.1 Å²	127.1	80%	0.804	70%	0.701	S	S	*	*	S	Bend	trans	73.3	43.9	174.6	-166	0	0	0	0	118.7
253	S	42.6	Very low	41.7	Very low	86 Å²	86	124.7 Å²	124.7	60%	0.601	69%	0.689	S	S	*	*	S	Bend	trans	-129	-36.5	159.2	-70	0	0	0	0	115.2
254	N	45.2	Very low	43.4	Very low	135 Å²	135	119.6 Å²	119.6	72%	0.722	67%	0.672	S	S	*	*	S	Bend	trans	-86.2	-19	-169.4	-69.6	-5.2	0	0	0	115.4	V256 V257	N254-V256 PolarHBondContact O-N 2.69Å; N254-V257 PolarHBondContact O-N 3.43Å
255	A	47	Very low	45.2	Very low	78 Å²	78	117.8 Å²	117.8	65%	0.645	67%	0.667	S	S	*	*	H	α-helix	trans	-64.4	-37.5	-174.3	0	0	0	0	0	113.7	V257 Q258 M259	A255-V257 PolarHBondContact O-N 3.25Å; A255-Q258 PolarHBondContact O-N 3.35Å; A255-M259 PolarHBondContact O-N 3.12Å
256	V	50.6	Low	47.2	Very low	117 Å²	117	113.7 Å²	113.7	71%	0.709	66%	0.655	S	S	*	*	H	α-helix	trans	-68.4	-35.9	-175.9	-177.1	0	0	0	0	112	N254 A260	N254-V256 PolarHBondContact O-N 2.69Å; V256-A260 PolarHBondContact O-N 3.46Å
257	V	50.3	Low	49.4	Very low	95 Å²	95	113.4 Å²	113.4	58%	0.576	65%	0.653	S	S	*	*	H	α-helix	trans	-72.1	-36.4	-178.4	-177	0	0	0	0	111.3	N254 A255 L261	N254-V257 PolarHBondContact O-N 3.43Å; A255-V257 PolarHBondContact O-N 3.25Å; V257-L261 HydrophobicContact CG1-CD1 4.27Å; V257-L261 WeakPolarHBondContact O-CG 3.45Å; V257-L261 PolarHBondContact O-N 3.24Å
258	Q	47.6	Very low	51.7	Low	126 Å²	126	109.6 Å²	109.6	59%	0.589	64%	0.641	S	S	*	*	H	α-helix	trans	-71.5	-40.2	-178.8	-169.4	162.1	-17.5	0	0	112	A255 A260 L261 E262	A255-Q258 PolarHBondContact O-N 3.35Å; Q258-A260 PolarHBondContact O-N 2.93Å; Q258-L261 PolarHBondContact O-N 3.41Å; Q258-E262 PolarHBondContact O-N 2.96Å; Q258-E262 VanDerWaalsContact O-N 3.11Å
259	M	55.6	Low	53.9	Low	134 Å²	134	109.5 Å²	109.5	66%	0.66	63%	0.632	S	S	*	*	H	α-helix	trans	-62.6	-42.2	177.1	-154.6	168.8	-158.9	0	0	112.2	A255 L261 E262 D263	A255-M259 PolarHBondContact O-N 3.12Å; M259-L261 VanDerWaalsContact C-N 3.3Å; M259-L261 PolarHBondContact O-N 2.99Å; M259-E262 PolarHBondContact O-N 2.89Å; M259-D263 PolarHBondContact O-N 2.91Å
260	A	53.3	Low	56.1	Low	59 Å²	59	110.5 Å²	110.5	49%	0.488	62%	0.623	S	S	.	*	H	α-helix	trans	-67.1	-26.9	177.4	0	0	0	0	0	113.9	V256 Q258 S264	V256-A260 PolarHBondContact O-N 3.46Å; Q258-A260 PolarHBondContact O-N 2.93Å; A260-S264 WeakPolarHBondContact O-CB 3.04Å; A260-S264 PolarHBondContact O-N 2.66Å
261	L	56.3	Low	58.3	Low	108 Å²	108	110.1 Å²	110.1	57%	0.565	61%	0.61	S	S	*	*	H	α-helix	trans	-77	-36.6	174	-74.5	166.9	0	0	0	111.9	V257 Q258 M259 L265	V257-L261 HydrophobicContact CG1-CD1 4.27Å; V257-L261 WeakPolarHBondContact O-CG 3.45Å; V257-L261 PolarHBondContact O-N 3.24Å; Q258-L261 PolarHBondContact O-N 3.41Å; M259-L261 VanDerWaalsContact C-N 3.3Å; M259-L261 PolarHBondContact O-N 2.99Å; L261-L265 WeakPolarHBondContact O-CB 3.48Å; L261-L265 WeakPolarHBondContact O-CG 3.23Å; L261-L265 PolarHBondContact O-N 3.39Å; L261-L265 VanDerWaalsContact O-N 3.09Å
262	E	55.2	Low	60	Low	119 Å²	119	107 Å²	107	56%	0.556	60%	0.595	S	S	*	*	H	α-helix	trans	-69.2	-43	175.5	-71.5	177.7	165.6	0	0	111.6	Q258 M259 S264 L265 S266	Q258-E262 PolarHBondContact O-N 2.96Å; Q258-E262 VanDerWaalsContact O-N 3.11Å; M259-E262 PolarHBondContact O-N 2.89Å; E262-S264 PolarHBondContact O-N 2.91Å; E262-L265 PolarHBondContact O-N 2.82Å; E262-S266 WeakPolarHBondContact O-CB 3.29Å; E262-S266 PolarHBondContact O-N 3.5Å
263	D	59.3	Low	61.7	Low	111 Å²	111	105.4 Å²	105.4	59%	0.594	58%	0.58	S	S	*	*	H	α-helix	trans	-60.1	-44.5	173.3	-83.8	-20.8	0	0	0	112	M259 L265 S266 E267	M259-D263 PolarHBondContact O-N 2.91Å; D263-L265 VanDerWaalsContact C-N 3.35Å; D263-L265 PolarHBondContact O-N 3.1Å; D263-S266 WeakPolarHBondContact O-CB 3.15Å; D263-S266 PolarHBondContact O-N 3.36Å; D263-S266 VanDerWaalsContact O-N 3.15Å; D263-E267 PolarHBondContact O-N 2.99Å
264	S	65	Low	63.5	Low	64 Å²	64	105.7 Å²	105.7	45%	0.448	57%	0.572	S	S	.	*	H	α-helix	trans	-67.4	-33.8	-179.9	-173.2	0	0	0	0	112.9	A260 E262 T268	A260-S264 WeakPolarHBondContact O-CB 3.04Å; A260-S264 PolarHBondContact O-N 2.66Å; E262-S264 PolarHBondContact O-N 2.91Å; S264-T268 WeakPolarHBondContact O-CB 3.5Å; S264-T268 PolarHBondContact O-N 3.03Å; S264-T268 VanDerWaalsContact O-N 3.1Å; S264-T268 PolarHBondContact O-OG1 2.92Å
265	L	65.3	Low	64.9	Low	123 Å²	123	103.5 Å²	103.5	64%	0.644	56%	0.558	S	S	*	*	H	α-helix	trans	-69.5	-37.5	170.5	-75.8	167.8	0	0	0	111.8	L261 E262 D263 T268 L269	L261-L265 WeakPolarHBondContact O-CB 3.48Å; L261-L265 WeakPolarHBondContact O-CG 3.23Å; L261-L265 PolarHBondContact O-N 3.39Å; L261-L265 VanDerWaalsContact O-N 3.09Å; E262-L265 PolarHBondContact O-N 2.82Å; D263-L265 VanDerWaalsContact C-N 3.35Å; D263-L265 PolarHBondContact O-N 3.1Å; L265-T268 PolarHBondContact O-N 3.38Å; L265-L269 WeakPolarHBondContact O-CB 3.36Å; L265-L269 PolarHBondContact O-N 2.83Å
266	S	69.1	Low	66.3	Low	62 Å²	62	103.3 Å²	103.3	43%	0.434	55%	0.549	S	S	.	.	H	α-helix	trans	-64.7	-47.5	175.7	-166.3	0	0	0	0	111.8	E262 D263 T268 L269 E270	E262-S266 WeakPolarHBondContact O-CB 3.29Å; E262-S266 PolarHBondContact O-N 3.5Å; D263-S266 WeakPolarHBondContact O-CB 3.15Å; D263-S266 PolarHBondContact O-N 3.36Å; D263-S266 VanDerWaalsContact O-N 3.15Å; S266-T268 VanDerWaalsContact C-N 3.32Å; S266-T268 PolarHBondContact O-N 3.09Å; S266-L269 PolarHBondContact O-N 2.99Å; S266-E270 PolarHBondContact O-N 3.43Å
267	E	73.9	Confident	67.7	Low	143 Å²	143	105.7 Å²	105.7	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-62.8	-38	176.4	-172.8	178.7	-153.3	0	0	111.9	D263 K271	D263-E267 PolarHBondContact O-N 2.99Å; E267-K271 WeakPolarHBondContact O-CB 3.37Å; E267-K271 PolarHBondContact O-N 2.88Å
268	T	72.8	Confident	69	Low	76 Å²	76	107.7 Å²	107.7	47%	0.466	55%	0.546	S	S	.	.	H	α-helix	trans	-64.1	-44.3	173.6	-57.2	0	0	0	0	111.3	S264 L265 S266 K271 E272	S264-T268 WeakPolarHBondContact O-CB 3.5Å; S264-T268 PolarHBondContact O-N 3.03Å; S264-T268 VanDerWaalsContact O-N 3.1Å; S264-T268 PolarHBondContact O-OG1 2.92Å; L265-T268 PolarHBondContact O-N 3.38Å; S266-T268 VanDerWaalsContact C-N 3.32Å; S266-T268 PolarHBondContact O-N 3.09Å; T268-K271 WeakPolarHBondContact O-CB 3.44Å; T268-K271 PolarHBondContact O-N 2.95Å; T268-E272 PolarHBondContact O-N 3.08Å
269	L	74	Confident	70.3	Confident	104 Å²	104	107 Å²	107	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-67.4	-41.4	178.2	-177.5	63.1	0	0	0	112.1	L265 S266 K271 E272 V273	L265-L269 WeakPolarHBondContact O-CB 3.36Å; L265-L269 PolarHBondContact O-N 2.83Å; S266-L269 PolarHBondContact O-N 2.99Å; L269-K271 VanDerWaalsContact C-N 3.26Å; L269-K271 PolarHBondContact O-N 2.83Å; L269-E272 PolarHBondContact O-N 3.46Å; L269-V273 HydrophobicContact CD1-CG2 4.38Å; L269-V273 HydrophobicContact CG-CG2 4.45Å; L269-V273 WeakPolarHBondContact O-CB 3.46Å; L269-V273 VanDerWaalsContact O-CG2 3.24Å; L269-V273 WeakPolarHBondContact O-CG2 3.41Å; L269-V273 PolarHBondContact O-N 2.88Å
270	E	79.1	Confident	71.3	Confident	139 Å²	139	104.9 Å²	104.9	65%	0.65	54%	0.538	S	S	*	.	H	α-helix	trans	-60.6	-37.7	173.3	-75.3	-159.4	144.6	0	0	111.6	S266 V273 Q274	S266-E270 PolarHBondContact O-N 3.43Å; E270-V273 PolarHBondContact O-N 3.48Å; E270-Q274 VanDerWaalsContact O-CB 3.28Å; E270-Q274 WeakPolarHBondContact O-CB 3.48Å; E270-Q274 PolarHBondContact O-N 3.43Å
271	K	80.4	Confident	72.4	Confident	132 Å²	132	105.3 Å²	105.3	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-65.9	-46.8	174.8	-171.8	-176.5	172.7	-167.9	0	112.2	E267 T268 L269 V273 Q274 E275	E267-K271 WeakPolarHBondContact O-CB 3.37Å; E267-K271 PolarHBondContact O-N 2.88Å; T268-K271 WeakPolarHBondContact O-CB 3.44Å; T268-K271 PolarHBondContact O-N 2.95Å; L269-K271 VanDerWaalsContact C-N 3.26Å; L269-K271 PolarHBondContact O-N 2.83Å; K271-V273 VanDerWaalsContact C-N 3.33Å; K271-V273 PolarHBondContact O-N 3.49Å; K271-Q274 PolarHBondContact O-N 3.49Å; K271-E275 WeakPolarHBondContact CE-OE1 3.49Å; K271-E275 WeakPolarHBondContact O-CG 3.43Å; K271-E275 PolarHBondContact O-N 2.91Å
272	E	74.6	Confident	73.1	Confident	121 Å²	121	101.7 Å²	101.7	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-63.2	-38	175	-72.4	-168.5	156.2	0	0	112.4	T268 L269 E275 T276	T268-E272 PolarHBondContact O-N 3.08Å; L269-E272 PolarHBondContact O-N 3.46Å; E272-E275 PolarHBondContact O-N 3.24Å; E272-T276 WeakPolarHBondContact O-CB 3.48Å; E272-T276 PolarHBondContact O-N 3.18Å; E272-T276 PolarHBondContact O-OG1 3.32Å
273	V	79.2	Confident	73.9	Confident	81 Å²	81	101 Å²	101	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-39.6	173.1	166.9	0	0	0	0	111	L269 E270 K271 T276 R277	L269-V273 HydrophobicContact CD1-CG2 4.38Å; L269-V273 HydrophobicContact CG-CG2 4.45Å; L269-V273 WeakPolarHBondContact O-CB 3.46Å; L269-V273 VanDerWaalsContact O-CG2 3.24Å; L269-V273 WeakPolarHBondContact O-CG2 3.41Å; L269-V273 PolarHBondContact O-N 2.88Å; E270-V273 PolarHBondContact O-N 3.48Å; K271-V273 VanDerWaalsContact C-N 3.33Å; K271-V273 PolarHBondContact O-N 3.49Å; V273-T276 WeakPolarHBondContact CA-OG1 3.42Å; V273-T276 PolarHBondContact O-OG1 2.91Å; V273-T276 VanDerWaalsContact O-OG1 3.06Å; V273-R277 WeakPolarHBondContact O-CB 3.33Å; V273-R277 PolarHBondContact O-N 3.47Å
274	Q	79.3	Confident	74.5	Confident	93 Å²	93	101.1 Å²	101.1	44%	0.435	52%	0.52	S	S	.	.	H	α-helix	trans	-75.4	-30.4	178.1	-170.4	68.3	-14.6	0	0	112.5	E270 K271 K278	E270-Q274 VanDerWaalsContact O-CB 3.28Å; E270-Q274 WeakPolarHBondContact O-CB 3.48Å; E270-Q274 PolarHBondContact O-N 3.43Å; K271-Q274 PolarHBondContact O-N 3.49Å; Q274-K278 WeakPolarHBondContact O-CG 3.22Å; Q274-K278 PolarHBondContact O-N 3.48Å
275	E	74.3	Confident	74.6	Confident	89 Å²	89	99 Å²	99	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-72.8	-42.2	171.8	-74.9	-179	-165.4	0	0	112.1	K271 E272 R277 K278 M279	K271-E275 WeakPolarHBondContact CE-OE1 3.49Å; K271-E275 WeakPolarHBondContact O-CG 3.43Å; K271-E275 PolarHBondContact O-N 2.91Å; E272-E275 PolarHBondContact O-N 3.24Å; E275-R277 VanDerWaalsContact C-N 3.32Å; E275-R277 PolarHBondContact O-N 2.87Å; E275-K278 WeakPolarHBondContact O-CB 3.32Å; E275-K278 PolarHBondContact O-N 3.07Å; E275-M279 PolarHBondContact O-N 3.08Å
276	T	78	Confident	75	Confident	73 Å²	73	96.9 Å²	96.9	45%	0.448	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-36.9	169.9	46.1	0	0	0	0	112	E272 V273 K278 M279 V280	E272-T276 WeakPolarHBondContact O-CB 3.48Å; E272-T276 PolarHBondContact O-N 3.18Å; E272-T276 PolarHBondContact O-OG1 3.32Å; V273-T276 WeakPolarHBondContact CA-OG1 3.42Å; V273-T276 PolarHBondContact O-OG1 2.91Å; V273-T276 VanDerWaalsContact O-OG1 3.06Å; T276-K278 PolarHBondContact O-N 3.27Å; T276-M279 HydrophobicContact CG2-CE 3.99Å; T276-M279 PolarHBondContact O-N 3.09Å; T276-V280 WeakPolarHBondContact O-CB 3.19Å; T276-V280 VanDerWaalsContact O-CG2 3.31Å; T276-V280 WeakPolarHBondContact O-CG2 3.14Å; T276-V280 PolarHBondContact O-N 3.41Å
277	R	78.3	Confident	75	Confident	168 Å²	168	101.1 Å²	101.1	63%	0.634	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-40.2	171.7	-166.7	-179.5	-167	173.7	4.4	112.4	V273 E275 S281	V273-R277 WeakPolarHBondContact O-CB 3.33Å; V273-R277 PolarHBondContact O-N 3.47Å; E275-R277 VanDerWaalsContact C-N 3.32Å; E275-R277 PolarHBondContact O-N 2.87Å; R277-S281 WeakPolarHBondContact O-CB 3.23Å; R277-S281 PolarHBondContact O-N 2.92Å; R277-S281 PolarHBondContact O-OG 2.97Å; R277-S281 VanDerWaalsContact O-OG 3.08Å
278	K	77.4	Confident	74.7	Confident	136 Å²	136	99.8 Å²	99.8	59%	0.591	51%	0.509	S	S	*	.	H	α-helix	trans	-62.9	-46.6	171.9	-75.2	171.1	179.6	179.2	0	111.8	Q274 E275 T276 V280 S281 A282	Q274-K278 WeakPolarHBondContact O-CG 3.22Å; Q274-K278 PolarHBondContact O-N 3.48Å; E275-K278 WeakPolarHBondContact O-CB 3.32Å; E275-K278 PolarHBondContact O-N 3.07Å; T276-K278 PolarHBondContact O-N 3.27Å; K278-V280 PolarHBondContact O-N 3.21Å; K278-S281 PolarHBondContact O-N 2.99Å; K278-A282 WeakPolarHBondContact O-CB 3.41Å; K278-A282 PolarHBondContact O-N 3.05Å
279	M	76.1	Confident	74	Confident	112 Å²	112	102.9 Å²	102.9	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-62.7	-39.8	177.8	-73	-173.2	-80.9	0	0	112.3	E275 T276 A282 L283	E275-M279 PolarHBondContact O-N 3.08Å; T276-M279 HydrophobicContact CG2-CE 3.99Å; T276-M279 PolarHBondContact O-N 3.09Å; M279-A282 PolarHBondContact O-N 3.45Å; M279-L283 WeakPolarHBondContact O-CB 3.47Å; M279-L283 WeakPolarHBondContact O-CG 3.43Å; M279-L283 PolarHBondContact O-N 2.85Å
280	V	76.3	Confident	73.2	Confident	89 Å²	89	100.8 Å²	100.8	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-42.5	173.8	169.7	0	0	0	0	111.3	T276 K278 A282 L283 Q284	T276-V280 WeakPolarHBondContact O-CB 3.19Å; T276-V280 VanDerWaalsContact O-CG2 3.31Å; T276-V280 WeakPolarHBondContact O-CG2 3.14Å; T276-V280 PolarHBondContact O-N 3.41Å; K278-V280 PolarHBondContact O-N 3.21Å; V280-A282 PolarHBondContact O-N 3.24Å; V280-L283 PolarHBondContact O-N 2.84Å; V280-Q284 WeakPolarHBondContact O-CB 3.49Å; V280-Q284 PolarHBondContact O-N 3.48Å
281	S	77.6	Confident	72.2	Confident	68 Å²	68	95.9 Å²	95.9	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-40.5	173.6	-66	0	0	0	0	112.6	R277 K278 Q284 A285	R277-S281 WeakPolarHBondContact O-CB 3.23Å; R277-S281 PolarHBondContact O-N 2.92Å; R277-S281 PolarHBondContact O-OG 2.97Å; R277-S281 VanDerWaalsContact O-OG 3.08Å; K278-S281 PolarHBondContact O-N 2.99Å; S281-Q284 PolarHBondContact O-N 3.48Å; S281-A285 PolarHBondContact O-N 2.78Å
282	A	69.6	Low	70.8	Confident	32 Å²	32	92.7 Å²	92.7	26%	0.264	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-45.1	176.8	0	0	0	0	0	111.6	K278 M279 V280 Q284 A285 L286	K278-A282 WeakPolarHBondContact O-CB 3.41Å; K278-A282 PolarHBondContact O-N 3.05Å; M279-A282 PolarHBondContact O-N 3.45Å; V280-A282 PolarHBondContact O-N 3.24Å; A282-Q284 VanDerWaalsContact C-N 3.32Å; A282-Q284 PolarHBondContact O-N 3.1Å; A282-A285 PolarHBondContact O-N 3.32Å; A282-L286 WeakPolarHBondContact O-CB 3.45Å; A282-L286 PolarHBondContact O-N 3.19Å
283	L	72.8	Confident	69.8	Low	104 Å²	104	90.9 Å²	90.9	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-62.6	-38.1	173.3	-75.1	166.9	0	0	0	112.1	M279 V280 L286 L287	M279-L283 WeakPolarHBondContact O-CB 3.47Å; M279-L283 WeakPolarHBondContact O-CG 3.43Å; M279-L283 PolarHBondContact O-N 2.85Å; V280-L283 PolarHBondContact O-N 2.84Å; L283-L286 PolarHBondContact O-N 2.86Å; L283-L287 WeakPolarHBondContact O-CB 3.33Å; L283-L287 VanDerWaalsContact O-CG 3.23Å; L283-L287 WeakPolarHBondContact O-CG 3.49Å; L283-L287 PolarHBondContact O-N 3.36Å
284	Q	70.5	Confident	68.5	Low	115 Å²	115	94.4 Å²	94.4	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-39.6	175.2	-179.5	174.1	-12.6	0	0	111.5	V280 S281 A282 L288	V280-Q284 WeakPolarHBondContact O-CB 3.49Å; V280-Q284 PolarHBondContact O-N 3.48Å; S281-Q284 PolarHBondContact O-N 3.48Å; A282-Q284 VanDerWaalsContact C-N 3.32Å; A282-Q284 PolarHBondContact O-N 3.1Å; Q284-L288 HydrophobicContact CG-CD1 3.77Å; Q284-L288 WeakPolarHBondContact O-CB 3.23Å; Q284-L288 WeakPolarHBondContact O-CD1 3.23Å; Q284-L288 VanDerWaalsContact O-CG 3.23Å; Q284-L288 WeakPolarHBondContact O-CG 3.34Å; Q284-L288 PolarHBondContact O-N 2.9Å; Q284-L288 VanDerWaalsContact O-N 3.1Å
285	A	68.2	Low	67	Low	19 Å²	19	95.5 Å²	95.5	16%	0.157	51%	0.51	C	S	.	.	H	α-helix	trans	-63.7	-47.9	172.3	0	0	0	0	0	111.4	S281 A282 L287 L288 H289 P293	S281-A285 PolarHBondContact O-N 2.78Å; A282-A285 PolarHBondContact O-N 3.32Å; A285-L287 VanDerWaalsContact C-N 3.29Å; A285-L287 PolarHBondContact O-N 3.42Å; A285-L288 PolarHBondContact O-N 2.85Å; A285-L288 VanDerWaalsContact O-N 3.09Å; A285-H289 WeakPolarHBondContact O-CB 3.22Å; A285-H289 PolarHBondContact O-N 3.5Å; A285-P293 HydrophobicContact CB-CG 3.82Å
286	L	73.2	Confident	65.7	Low	79 Å²	79	98.1 Å²	98.1	41%	0.414	52%	0.522	S	S	.	.	H	α-helix	trans	-58.3	-38.7	177.7	-127.6	166.2	0	0	0	112.3	A282 L283 G290 L292	A282-L286 WeakPolarHBondContact O-CB 3.45Å; A282-L286 PolarHBondContact O-N 3.19Å; L283-L286 PolarHBondContact O-N 2.86Å; L286-G290 VanDerWaalsContact O-CA 3.27Å; L286-G290 WeakPolarHBondContact O-CA 3.27Å; L286-G290 PolarHBondContact O-N 3.14Å; L286-L292 HydrophobicContact CD1-CD1 3.82Å; L286-L292 HydrophobicContact CG-CD1 4.44Å
287	L	68.5	Low	64.1	Low	150 Å²	150	102.1 Å²	102.1	79%	0.785	54%	0.536	S	S	*	.	H	α-helix	trans	-78	-18.6	177.8	-72.5	168.6	0	0	0	114.6	L283 A285	L283-L287 WeakPolarHBondContact O-CB 3.33Å; L283-L287 VanDerWaalsContact O-CG 3.23Å; L283-L287 WeakPolarHBondContact O-CG 3.49Å; L283-L287 PolarHBondContact O-N 3.36Å; A285-L287 VanDerWaalsContact C-N 3.29Å; A285-L287 PolarHBondContact O-N 3.42Å
288	L	69.6	Low	62.4	Low	115 Å²	115	100.3 Å²	100.3	60%	0.602	54%	0.539	S	S	*	.	H	α-helix	trans	-102.1	-28.9	179.7	-72	172.4	0	0	0	113.5	Q284 A285	Q284-L288 HydrophobicContact CG-CD1 3.77Å; Q284-L288 WeakPolarHBondContact O-CB 3.23Å; Q284-L288 WeakPolarHBondContact O-CD1 3.23Å; Q284-L288 VanDerWaalsContact O-CG 3.23Å; Q284-L288 WeakPolarHBondContact O-CG 3.34Å; Q284-L288 PolarHBondContact O-N 2.9Å; Q284-L288 VanDerWaalsContact O-N 3.1Å; A285-L288 PolarHBondContact O-N 2.85Å; A285-L288 VanDerWaalsContact O-N 3.09Å
289	H	57.3	Low	60.7	Low	141 Å²	141	99.6 Å²	99.6	65%	0.653	55%	0.545	S	S	*	.	H	α-helix	trans	-128	-18.1	-170	-57.5	-75	0	0	0	113.9	A285	A285-H289 WeakPolarHBondContact O-CB 3.22Å; A285-H289 PolarHBondContact O-N 3.5Å
290	G	56	Low	59.1	Low	60 Å²	60	98.4 Å²	98.4	62%	0.619	55%	0.548	S	S	*	.	S	Bend	trans	86.6	-4.4	175	0	0	0	0	0	116.3	L286	L286-G290 VanDerWaalsContact O-CA 3.27Å; L286-G290 WeakPolarHBondContact O-CA 3.27Å; L286-G290 PolarHBondContact O-N 3.14Å
291	S	58.2	Low	57.2	Low	36 Å²	36	100.2 Å²	100.2	25%	0.252	55%	0.554	S	S	.	*	S	Bend	trans	-131	168.5	-178.7	51.7	0	0	0	0	111.8
292	L	52.7	Low	55.7	Low	65 Å²	65	103.8 Å²	103.8	34%	0.34	57%	0.573	S	S	.	*			trans	-82.2	149.9	170.2	-127.7	78	0	0	0	110.4	L286 E294 D295	L286-L292 HydrophobicContact CD1-CD1 3.82Å; L286-L292 HydrophobicContact CG-CD1 4.44Å; L292-E294 PolarHBondContact O-N 3.31Å; L292-D295 VanDerWaalsContact CB-OD2 3.23Å; L292-D295 WeakPolarHBondContact CB-OD2 3.39Å; L292-D295 PolarHBondContact N-OD2 3.03Å; L292-D295 WeakPolarHBondContact O-CB 3.46Å; L292-D295 PolarHBondContact O-N 2.98Å
293	P	53.3	Low	54.5	Low	83 Å²	83	107.4 Å²	107.4	54%	0.539	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.6	-8.7	174.6	-24.8	36	0	0	0	115.5	A285	A285-P293 HydrophobicContact CB-CG 3.82Å
294	E	51.8	Low	53.4	Low	156 Å²	156	110.5 Å²	110.5	73%	0.729	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-17.9	173.4	-62.8	-176	151	0	0	112.2	L292 Q297	L292-E294 PolarHBondContact O-N 3.31Å; E294-Q297 WeakPolarHBondContact O-CB 3.49Å; E294-Q297 PolarHBondContact O-N 3.39Å
295	D	47.9	Very low	52.3	Low	116 Å²	116	111.5 Å²	111.5	62%	0.62	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-21.7	174.6	-59.9	-48.1	0	0	0	112.3	L292 Q297	L292-D295 VanDerWaalsContact CB-OD2 3.23Å; L292-D295 WeakPolarHBondContact CB-OD2 3.39Å; L292-D295 PolarHBondContact N-OD2 3.03Å; L292-D295 WeakPolarHBondContact O-CB 3.46Å; L292-D295 PolarHBondContact O-N 2.98Å; D295-Q297 PolarHBondContact O-N 3.29Å
296	E	46.9	Very low	51.6	Low	144 Å²	144	112.7 Å²	112.7	67%	0.673	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	9.1	167.7	-67.1	-164.3	156.3	0	0	112.7	D298	E296-D298 PolarHBondContact O-N 2.84Å
297	Q	44.8	Very low	51.3	Low	156 Å²	156	113.1 Å²	113.1	73%	0.729	62%	0.624	S	S	*	*	S	Bend	trans	-71.7	70.3	158.4	-156.3	93.8	119.1	0	0	109.4	E294 D295 V299	E294-Q297 WeakPolarHBondContact O-CB 3.49Å; E294-Q297 PolarHBondContact O-N 3.39Å; D295-Q297 PolarHBondContact O-N 3.29Å; Q297-V299 WeakPolarHBondContact O-CG2 3.4Å; Q297-V299 PolarHBondContact O-N 2.92Å; Q297-V299 VanDerWaalsContact O-N 3.11Å
298	D	41.9	Very low	51.7	Low	131 Å²	131	109.2 Å²	109.2	70%	0.701	61%	0.613	S	S	*	*			trans	-46.8	119.4	174.9	-162.9	-0.8	0	0	0	108.7	E296 S300	E296-D298 PolarHBondContact O-N 2.84Å; D298-S300 PolarHBondContact O-N 3.34Å
299	V	41.2	Very low	52.1	Low	120 Å²	120	109.8 Å²	109.8	73%	0.727	61%	0.613	S	S	*	*			trans	-79.4	55.8	-174.9	-176.3	0	0	0	0	109.2	Q297 L301	Q297-V299 WeakPolarHBondContact O-CG2 3.4Å; Q297-V299 PolarHBondContact O-N 2.92Å; Q297-V299 VanDerWaalsContact O-N 3.11Å; V299-L301 HydrophobicContact CG1-CD1 4.23Å; V299-L301 HydrophobicContact CG1-CG 3.85Å; V299-L301 PolarHBondContact O-N 3.41Å
300	S	42.1	Very low	53.3	Low	88 Å²	88	108.3 Å²	108.3	62%	0.615	61%	0.606	S	S	*	*			trans	-61	73.2	152.8	-74	0	0	0	0	108.4	D298 T302	D298-S300 PolarHBondContact O-N 3.34Å; S300-T302 VanDerWaalsContact C-N 3.31Å; S300-T302 PolarHBondContact O-N 2.74Å
301	L	37.5	Very low	54.6	Low	127 Å²	127	110.8 Å²	110.8	67%	0.665	60%	0.602	S	S	*	*			trans	-56.1	101.1	159.5	-79.3	167.7	0	0	0	107	V299 L303	V299-L301 HydrophobicContact CG1-CD1 4.23Å; V299-L301 HydrophobicContact CG1-CG 3.85Å; V299-L301 PolarHBondContact O-N 3.41Å; L301-L303 HydrophobicContact CB-CD1 4.2Å; L301-L303 HydrophobicContact CB-CG 4.17Å; L301-L303 PolarHBondContact O-N 3.1Å
302	T	46.2	Very low	56	Low	142 Å²	142	114.5 Å²	114.5	87%	0.871	62%	0.618	S	S	*	*			trans	-68.2	66.6	167	-51.1	0	0	0	0	108.8	S300 E304	S300-T302 VanDerWaalsContact C-N 3.31Å; S300-T302 PolarHBondContact O-N 2.74Å; T302-E304 PolarHBondContact O-N 3.42Å
303	L	44.3	Very low	57.8	Low	109 Å²	109	116.6 Å²	116.6	57%	0.571	63%	0.629	S	S	*	*			trans	-68.3	117.9	167.2	-77.4	162.1	0	0	0	107	L301 V306	L301-L303 HydrophobicContact CB-CD1 4.2Å; L301-L303 HydrophobicContact CB-CG 4.17Å; L301-L303 PolarHBondContact O-N 3.1Å; L303-V306 HydrophobicContact CB-CG2 4.2Å; L303-V306 HydrophobicContact CD2-CG2 4.48Å
304	E	48.9	Very low	59.5	Low	169 Å²	169	116.8 Å²	116.8	79%	0.79	63%	0.628	S	S	*	*			trans	-41.2	154.5	157.9	-80.8	-143.7	125	0	0	111.6	T302 V306	T302-E304 PolarHBondContact O-N 3.42Å; E304-V306 VanDerWaalsContact C-N 3.3Å; E304-V306 WeakPolarHBondContact O-CG2 3.33Å; E304-V306 PolarHBondContact O-N 3.47Å
305	P	48.1	Very low	61.3	Low	135 Å²	135	113.6 Å²	113.6	88%	0.877	62%	0.619	S	S	*	*	S	Bend	trans	-55.5	83	-160.9	21.2	-35.6	0	0	0	115.3
306	V	53.5	Low	63.4	Low	44 Å²	44	115.6 Å²	115.6	27%	0.267	62%	0.618	S	S	.	*			trans	-69.7	133.4	173.6	158.9	0	0	0	0	108.5	L303 E304 A308 Q310 Q311	L303-V306 HydrophobicContact CB-CG2 4.2Å; L303-V306 HydrophobicContact CD2-CG2 4.48Å; E304-V306 VanDerWaalsContact C-N 3.3Å; E304-V306 WeakPolarHBondContact O-CG2 3.33Å; E304-V306 PolarHBondContact O-N 3.47Å; V306-A308 PolarHBondContact O-N 2.87Å; V306-Q310 HydrophobicContact CG1-CB 3.64Å; V306-Q310 HydrophobicContact CG1-CG 4.42Å; V306-Q311 HydrophobicContact CG1-CG 4.36Å
307	N	67.6	Low	65.7	Low	88 Å²	88	112.3 Å²	112.3	47%	0.471	61%	0.611	S	S	.	*			trans	-45.4	124.9	174.6	175.6	15	0	0	0	110.3	E309 Q310	N307-E309 WeakPolarHBondContact ND2-CB 3.4Å; N307-E309 PolarHBondContact ND2-OE2 2.93Å; N307-E309 PolarHBondContact O-N 3.47Å; N307-E309 PolarHBondContact OD1-N 2.61Å; N307-Q310 PolarHBondContact O-N 3.17Å
308	A	76.9	Confident	68	Low	69 Å²	69	113.7 Å²	113.7	57%	0.57	61%	0.609	S	S	*	*	H	α-helix	trans	-54.1	-28.1	-173.9	0	0	0	0	0	113.2	V306 Q310 Q311 L312	V306-A308 PolarHBondContact O-N 2.87Å; A308-Q310 VanDerWaalsContact C-N 3.32Å; A308-Q310 PolarHBondContact O-N 3.02Å; A308-Q311 PolarHBondContact O-N 2.98Å; A308-L312 WeakPolarHBondContact O-CB 3.49Å; A308-L312 PolarHBondContact O-N 2.89Å
309	E	77.3	Confident	70.5	Confident	126 Å²	126	112.3 Å²	112.3	59%	0.589	60%	0.602	S	S	*	*	H	α-helix	trans	-54.5	-40.5	171.3	-168	171.5	-149.4	0	0	113.5	N307 L312 I313	N307-E309 WeakPolarHBondContact ND2-CB 3.4Å; N307-E309 PolarHBondContact ND2-OE2 2.93Å; N307-E309 PolarHBondContact O-N 3.47Å; N307-E309 PolarHBondContact OD1-N 2.61Å; E309-L312 PolarHBondContact O-N 3.45Å; E309-I313 VanDerWaalsContact O-CG1 3.3Å; E309-I313 WeakPolarHBondContact O-CG1 3.23Å; E309-I313 PolarHBondContact O-N 3.17Å
310	Q	82.1	Confident	73.1	Confident	110 Å²	110	110.3 Å²	110.3	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-73.2	-37.4	178.2	-66.9	-177	-4.3	0	0	112	V306 N307 A308 L312 I313 V314	V306-Q310 HydrophobicContact CG1-CB 3.64Å; V306-Q310 HydrophobicContact CG1-CG 4.42Å; N307-Q310 PolarHBondContact O-N 3.17Å; A308-Q310 VanDerWaalsContact C-N 3.32Å; A308-Q310 PolarHBondContact O-N 3.02Å; Q310-L312 VanDerWaalsContact C-N 3.28Å; Q310-L312 PolarHBondContact O-N 3.38Å; Q310-I313 PolarHBondContact O-N 3.2Å; Q310-V314 WeakPolarHBondContact O-CG2 3.26Å; Q310-V314 PolarHBondContact O-N 2.66Å
311	Q	83.8	Confident	75.6	Confident	113 Å²	113	111.3 Å²	111.3	53%	0.528	58%	0.581	S	S	.	*	H	α-helix	trans	-63.3	-37.9	171.1	-67.4	-172.6	-13	0	0	111.1	V306 A308 V314 T315	V306-Q311 HydrophobicContact CG1-CG 4.36Å; A308-Q311 PolarHBondContact O-N 2.98Å; Q311-V314 PolarHBondContact O-N 3.43Å; Q311-T315 WeakPolarHBondContact O-CB 3.38Å; Q311-T315 WeakPolarHBondContact O-CG2 3.38Å; Q311-T315 PolarHBondContact O-N 2.79Å; Q311-T315 PolarHBondContact O-OG1 2.89Å
312	L	86.8	Confident	78.4	Confident	113 Å²	113	108 Å²	108	59%	0.592	57%	0.569	S	S	*	*	H	α-helix	trans	-66.3	-38.2	176.2	-161.4	152.5	0	0	0	111.9	A308 E309 Q310 T315 R316	A308-L312 WeakPolarHBondContact O-CB 3.49Å; A308-L312 PolarHBondContact O-N 2.89Å; E309-L312 PolarHBondContact O-N 3.45Å; Q310-L312 VanDerWaalsContact C-N 3.28Å; Q310-L312 PolarHBondContact O-N 3.38Å; L312-T315 WeakPolarHBondContact CA-OG1 3.45Å; L312-T315 PolarHBondContact O-OG1 2.94Å; L312-R316 WeakPolarHBondContact O-CB 3.47Å; L312-R316 PolarHBondContact O-N 2.87Å
313	I	90.3	Very high	80.7	Confident	110 Å²	110	106.5 Å²	106.5	56%	0.564	55%	0.554	S	S	*	*	H	α-helix	trans	-63.7	-47.5	172.3	-69.7	162.1	0	0	0	111.4	E309 Q310 R316 S317	E309-I313 VanDerWaalsContact O-CG1 3.3Å; E309-I313 WeakPolarHBondContact O-CG1 3.23Å; E309-I313 PolarHBondContact O-N 3.17Å; Q310-I313 PolarHBondContact O-N 3.2Å; I313-R316 PolarHBondContact O-N 3.41Å; I313-S317 WeakPolarHBondContact O-CB 3.21Å; I313-S317 PolarHBondContact O-N 2.89Å
314	V	90	Very high	83.2	Confident	86 Å²	86	108.1 Å²	108.1	52%	0.521	56%	0.558	S	S	.	*	H	α-helix	trans	-65.4	-46.3	-179.3	171.7	0	0	0	0	111.6	Q310 Q311 R316 S317 R318	Q310-V314 WeakPolarHBondContact O-CG2 3.26Å; Q310-V314 PolarHBondContact O-N 2.66Å; Q311-V314 PolarHBondContact O-N 3.43Å; V314-R316 VanDerWaalsContact C-N 3.34Å; V314-R316 PolarHBondContact O-N 3.4Å; V314-S317 PolarHBondContact O-N 3Å; V314-R318 WeakPolarHBondContact O-CG 3.2Å; V314-R318 PolarHBondContact O-N 3.02Å
315	T	89.1	Confident	85.4	Confident	89 Å²	89	104.6 Å²	104.6	55%	0.546	54%	0.542	S	S	.	.	H	α-helix	trans	-63.4	-38.9	177.4	47.1	0	0	0	0	112.3	Q311 L312 R318 L319	Q311-T315 WeakPolarHBondContact O-CB 3.38Å; Q311-T315 WeakPolarHBondContact O-CG2 3.38Å; Q311-T315 PolarHBondContact O-N 2.79Å; Q311-T315 PolarHBondContact O-OG1 2.89Å; L312-T315 WeakPolarHBondContact CA-OG1 3.45Å; L312-T315 PolarHBondContact O-OG1 2.94Å; T315-R318 PolarHBondContact O-N 3.38Å; T315-L319 WeakPolarHBondContact O-CB 3.49Å; T315-L319 PolarHBondContact O-N 3.33Å
316	R	92.3	Very high	87.7	Confident	159 Å²	159	101.2 Å²	101.2	60%	0.6	52%	0.518	S	S	*	.	H	α-helix	trans	-63.9	-45.5	172.5	-178.3	169.9	-178.1	165	4.4	112.4	L312 I313 V314 R318 L319 D320	L312-R316 WeakPolarHBondContact O-CB 3.47Å; L312-R316 PolarHBondContact O-N 2.87Å; I313-R316 PolarHBondContact O-N 3.41Å; V314-R316 VanDerWaalsContact C-N 3.34Å; V314-R316 PolarHBondContact O-N 3.4Å; R316-R318 VanDerWaalsContact C-N 3.31Å; R316-R318 PolarHBondContact O-N 2.78Å; R316-L319 WeakPolarHBondContact O-CB 3.2Å; R316-L319 PolarHBondContact O-N 3.23Å; R316-L319 VanDerWaalsContact O-N 3.1Å; R316-D320 WeakPolarHBondContact CG-OD2 3.48Å; R316-D320 IonicContact NE-OD2 3.59Å; R316-D320 PolarHBondContact O-N 3.04Å
317	S	94.3	Very high	89.8	Confident	74 Å²	74	102.1 Å²	102.1	52%	0.517	52%	0.524	S	S	.	.	H	α-helix	trans	-58.4	-42.3	177.2	-170.3	0	0	0	0	112.2	I313 V314 D320 Q321	I313-S317 WeakPolarHBondContact O-CB 3.21Å; I313-S317 PolarHBondContact O-N 2.89Å; V314-S317 PolarHBondContact O-N 3Å; S317-D320 PolarHBondContact O-N 3.49Å; S317-Q321 WeakPolarHBondContact O-CB 3.29Å; S317-Q321 PolarHBondContact O-N 2.96Å
318	R	94.4	Very high	91.2	Very high	185 Å²	185	101.9 Å²	101.9	70%	0.698	52%	0.52	S	S	*	.	H	α-helix	trans	-67.6	-33.6	175.5	-65.7	179.8	85.6	-177.3	6.8	112.7	V314 T315 R316 S322	V314-R318 WeakPolarHBondContact O-CG 3.2Å; V314-R318 PolarHBondContact O-N 3.02Å; T315-R318 PolarHBondContact O-N 3.38Å; R316-R318 VanDerWaalsContact C-N 3.31Å; R316-R318 PolarHBondContact O-N 2.78Å; R318-S322 VanDerWaalsContact O-CB 3.29Å; R318-S322 WeakPolarHBondContact O-CB 3.46Å; R318-S322 PolarHBondContact O-N 2.92Å
319	L	93.9	Very high	92.2	Very high	103 Å²	103	103.7 Å²	103.7	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-69.2	-46.3	173.6	178.5	63.1	0	0	0	111.6	T315 R316 Q321 S322 M323	T315-L319 WeakPolarHBondContact O-CB 3.49Å; T315-L319 PolarHBondContact O-N 3.33Å; R316-L319 WeakPolarHBondContact O-CB 3.2Å; R316-L319 PolarHBondContact O-N 3.23Å; R316-L319 VanDerWaalsContact O-N 3.1Å; L319-Q321 PolarHBondContact O-N 3.19Å; L319-S322 PolarHBondContact O-N 2.88Å; L319-M323 HydrophobicContact CD1-CG 4.37Å; L319-M323 HydrophobicContact CD1-SD 4.36Å; L319-M323 HydrophobicContact CG-SD 4.21Å; L319-M323 WeakPolarHBondContact O-CB 3.41Å; L319-M323 WeakPolarHBondContact O-CG 3.28Å; L319-M323 PolarHBondContact O-N 2.88Å
320	D	95.4	Very high	93.1	Very high	78 Å²	78	103.5 Å²	103.5	42%	0.417	52%	0.517	S	S	.	.	H	α-helix	trans	-62.1	-42.9	178.5	-69.6	-31.2	0	0	0	110.3	R316 S317 M323 E324	R316-D320 WeakPolarHBondContact CG-OD2 3.48Å; R316-D320 IonicContact NE-OD2 3.59Å; R316-D320 PolarHBondContact O-N 3.04Å; S317-D320 PolarHBondContact O-N 3.49Å; D320-M323 PolarHBondContact O-N 3.49Å; D320-E324 PolarHBondContact O-N 3.4Å
321	Q	95.9	Very high	93.9	Very high	108 Å²	108	104.8 Å²	104.8	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-59.1	-51.5	171.1	179.1	-174.3	-17.7	0	0	112.2	S317 L319 M323 E324 E325	S317-Q321 WeakPolarHBondContact O-CB 3.29Å; S317-Q321 PolarHBondContact O-N 2.96Å; L319-Q321 PolarHBondContact O-N 3.19Å; Q321-M323 PolarHBondContact O-N 3.3Å; Q321-E324 WeakPolarHBondContact O-CB 3.35Å; Q321-E324 PolarHBondContact O-N 3.13Å; Q321-E325 HydrophobicContact CG-CG 4.47Å; Q321-E325 WeakPolarHBondContact CG-OE1 3.37Å; Q321-E325 PolarHBondContact NE2-OE1 3.31Å; Q321-E325 WeakPolarHBondContact O-CG 3.4Å; Q321-E325 PolarHBondContact O-N 3.16Å
322	S	94.7	Very high	94.6	Very high	57 Å²	57	104.4 Å²	104.4	40%	0.399	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-33.4	-179.6	-175.1	0	0	0	0	112.1	R318 L319 V326	R318-S322 VanDerWaalsContact O-CB 3.29Å; R318-S322 WeakPolarHBondContact O-CB 3.46Å; R318-S322 PolarHBondContact O-N 2.92Å; L319-S322 PolarHBondContact O-N 2.88Å; S322-V326 VanDerWaalsContact O-CB 3.29Å; S322-V326 WeakPolarHBondContact O-CB 3.43Å; S322-V326 VanDerWaalsContact O-CG2 3.22Å; S322-V326 WeakPolarHBondContact O-CG2 3.48Å; S322-V326 PolarHBondContact O-N 3.2Å
323	M	95.6	Very high	95.1	Very high	112 Å²	112	103.4 Å²	103.4	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-65.8	-41.2	171.9	-76.6	179.6	54.5	0	0	112.1	L319 D320 Q321 V326 T327	L319-M323 HydrophobicContact CD1-CG 4.37Å; L319-M323 HydrophobicContact CD1-SD 4.36Å; L319-M323 HydrophobicContact CG-SD 4.21Å; L319-M323 WeakPolarHBondContact O-CB 3.41Å; L319-M323 WeakPolarHBondContact O-CG 3.28Å; L319-M323 PolarHBondContact O-N 2.88Å; D320-M323 PolarHBondContact O-N 3.49Å; Q321-M323 PolarHBondContact O-N 3.3Å; M323-V326 PolarHBondContact O-N 3.02Å; M323-T327 WeakPolarHBondContact O-CG2 3.17Å; M323-T327 PolarHBondContact O-N 3.48Å; M323-T327 VanDerWaalsContact O-N 3.07Å
324	E	96.3	Very high	95.4	Very high	143 Å²	143	103.5 Å²	103.5	67%	0.668	51%	0.511	S	S	*	.	H	α-helix	trans	-64.8	-48	175.8	-175.1	161.2	-144.6	0	0	111.8	D320 Q321 V326 T327 E328	D320-E324 PolarHBondContact O-N 3.4Å; Q321-E324 WeakPolarHBondContact O-CB 3.35Å; Q321-E324 PolarHBondContact O-N 3.13Å; E324-V326 VanDerWaalsContact C-N 3.28Å; E324-V326 PolarHBondContact O-N 3.13Å; E324-T327 WeakPolarHBondContact O-CA 3.49Å; E324-T327 WeakPolarHBondContact O-CB 3.47Å; E324-T327 PolarHBondContact O-N 3.13Å; E324-T327 PolarHBondContact O-OG1 3.42Å; E324-E328 PolarHBondContact O-N 3.4Å
325	E	96.1	Very high	95.8	Very high	94 Å²	94	105.1 Å²	105.1	44%	0.439	52%	0.516	S	S	.	.	H	α-helix	trans	-53.8	-44	172.8	-70.3	168.5	-179.7	0	0	111.7	Q321 T327 E328 L329	Q321-E325 HydrophobicContact CG-CG 4.47Å; Q321-E325 WeakPolarHBondContact CG-OE1 3.37Å; Q321-E325 PolarHBondContact NE2-OE1 3.31Å; Q321-E325 WeakPolarHBondContact O-CG 3.4Å; Q321-E325 PolarHBondContact O-N 3.16Å; E325-T327 VanDerWaalsContact C-N 3.26Å; E325-T327 PolarHBondContact O-N 3.22Å; E325-E328 PolarHBondContact O-N 2.87Å; E325-E328 VanDerWaalsContact O-N 3.16Å; E325-L329 WeakPolarHBondContact O-CB 3.36Å; E325-L329 WeakPolarHBondContact O-CG 3.42Å; E325-L329 PolarHBondContact O-N 3.4Å
326	V	96	Very high	96.2	Very high	64 Å²	64	104 Å²	104	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-67.2	-20.6	174.7	163.6	0	0	0	0	113	S322 M323 E324 K330	S322-V326 VanDerWaalsContact O-CB 3.29Å; S322-V326 WeakPolarHBondContact O-CB 3.43Å; S322-V326 VanDerWaalsContact O-CG2 3.22Å; S322-V326 WeakPolarHBondContact O-CG2 3.48Å; S322-V326 PolarHBondContact O-N 3.2Å; M323-V326 PolarHBondContact O-N 3.02Å; E324-V326 VanDerWaalsContact C-N 3.28Å; E324-V326 PolarHBondContact O-N 3.13Å; V326-K330 VanDerWaalsContact CG1-NZ 3.27Å; V326-K330 WeakPolarHBondContact O-CD 3.18Å; V326-K330 VanDerWaalsContact O-CE 3.25Å; V326-K330 WeakPolarHBondContact O-CE 3.39Å; V326-K330 WeakPolarHBondContact O-CG 3.4Å
327	T	96.7	Very high	96.5	Very high	63 Å²	63	101.1 Å²	101.1	39%	0.387	50%	0.503	S	S	.	.	H	α-helix	trans	-80.4	-35.9	168	69.3	0	0	0	0	112.9	M323 E324 E325 K330 R331	M323-T327 WeakPolarHBondContact O-CG2 3.17Å; M323-T327 PolarHBondContact O-N 3.48Å; M323-T327 VanDerWaalsContact O-N 3.07Å; E324-T327 WeakPolarHBondContact O-CA 3.49Å; E324-T327 WeakPolarHBondContact O-CB 3.47Å; E324-T327 PolarHBondContact O-N 3.13Å; E324-T327 PolarHBondContact O-OG1 3.42Å; E325-T327 VanDerWaalsContact C-N 3.26Å; E325-T327 PolarHBondContact O-N 3.22Å; T327-K330 WeakPolarHBondContact O-CB 3.41Å; T327-K330 PolarHBondContact O-N 3.05Å; T327-R331 PolarHBondContact O-N 2.95Å; T327-R331 VanDerWaalsContact O-N 3.17Å
328	E	97.4	Very high	96.7	Very high	84 Å²	84	101.6 Å²	101.6	39%	0.393	50%	0.497	S	S	.	.	H	α-helix	trans	-75.8	-41.5	-178.5	-160.4	55	-140.2	0	0	112	E324 E325 K330 R331 E332	E324-E328 PolarHBondContact O-N 3.4Å; E325-E328 PolarHBondContact O-N 2.87Å; E325-E328 VanDerWaalsContact O-N 3.16Å; E328-K330 PolarHBondContact O-N 2.94Å; E328-K330 VanDerWaalsContact O-N 3.08Å; E328-R331 CarbonylContact O-C 3.56Å; E328-R331 WeakPolarHBondContact O-CA 3.49Å; E328-R331 WeakPolarHBondContact O-CB 3.32Å; E328-R331 PolarHBondContact O-N 3.34Å; E328-R331 WeakPolarHBondContact OE1-CD 3.3Å; E328-R331 WeakPolarHBondContact OE2-CD 3.29Å; E328-R331 IonicContact OE2-CZ 3.59Å; E328-R331 IonicContact OE2-NE 3.86Å; E328-R331 IonicContact OE2-NH1 2.66Å; E328-R331 PolarHBondContact OE2-NH1 3.47Å; E328-E332 PolarHBondContact O-N 3.12Å
329	L	97.4	Very high	96.8	Very high	107 Å²	107	98.2 Å²	98.2	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-56.1	-28.7	169.7	-70.1	170.4	0	0	0	112.3	E325 L333	E325-L329 WeakPolarHBondContact O-CB 3.36Å; E325-L329 WeakPolarHBondContact O-CG 3.42Å; E325-L329 PolarHBondContact O-N 3.4Å; L329-L333 WeakPolarHBondContact O-CB 3.4Å; L329-L333 PolarHBondContact O-N 3.05Å
330	K	97.6	Very high	97	Very high	121 Å²	121	98.6 Å²	98.6	53%	0.526	49%	0.491	S	S	.	.	H	α-helix	trans	-75	-32.5	172.1	-72.1	168.1	-167.3	161.3	0	112.8	V326 T327 E328 L334	V326-K330 VanDerWaalsContact CG1-NZ 3.27Å; V326-K330 WeakPolarHBondContact O-CD 3.18Å; V326-K330 VanDerWaalsContact O-CE 3.25Å; V326-K330 WeakPolarHBondContact O-CE 3.39Å; V326-K330 WeakPolarHBondContact O-CG 3.4Å; T327-K330 WeakPolarHBondContact O-CB 3.41Å; T327-K330 PolarHBondContact O-N 3.05Å; E328-K330 PolarHBondContact O-N 2.94Å; E328-K330 VanDerWaalsContact O-N 3.08Å; K330-L334 VanDerWaalsContact O-CG 3.28Å; K330-L334 WeakPolarHBondContact O-CG 3.17Å; K330-L334 PolarHBondContact O-N 2.95Å
331	R	98	Very high	97.1	Very high	137 Å²	137	101.1 Å²	101.1	52%	0.517	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-50.9	171.1	-67.9	-164.5	180	85.6	1.6	110.6	T327 E328 L333 L334 L335	T327-R331 PolarHBondContact O-N 2.95Å; T327-R331 VanDerWaalsContact O-N 3.17Å; E328-R331 CarbonylContact O-C 3.56Å; E328-R331 WeakPolarHBondContact O-CA 3.49Å; E328-R331 WeakPolarHBondContact O-CB 3.32Å; E328-R331 PolarHBondContact O-N 3.34Å; E328-R331 WeakPolarHBondContact OE1-CD 3.3Å; E328-R331 WeakPolarHBondContact OE2-CD 3.29Å; E328-R331 IonicContact OE2-CZ 3.59Å; E328-R331 IonicContact OE2-NE 3.86Å; E328-R331 IonicContact OE2-NH1 2.66Å; E328-R331 PolarHBondContact OE2-NH1 3.47Å; R331-L333 VanDerWaalsContact C-N 3.34Å; R331-L333 PolarHBondContact O-N 3.43Å; R331-L334 WeakPolarHBondContact O-CA 3.44Å; R331-L334 WeakPolarHBondContact O-CB 3.32Å; R331-L334 PolarHBondContact O-N 3.13Å; R331-L335 WeakPolarHBondContact O-CG 3.47Å; R331-L335 PolarHBondContact O-N 3.03Å
332	E	97.8	Very high	97.2	Very high	105 Å²	105	100.1 Å²	100.1	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-57.1	-46.1	177.6	-66	-170.1	144.1	0	0	111.6	E328 L334 L335 C336	E328-E332 PolarHBondContact O-N 3.12Å; E332-L334 PolarHBondContact O-N 2.8Å; E332-L335 PolarHBondContact O-N 3.23Å; E332-L335 VanDerWaalsContact O-N 3.09Å; E332-C336 PolarHBondContact O-N 2.95Å; E332-C336 PolarHBondContact O-SG 3.06Å; E332-C336 VanDerWaalsContact O-SG 3.42Å
333	L	97.3	Very high	97.4	Very high	92 Å²	92	102.3 Å²	102.3	48%	0.482	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-32.9	175.5	-178.3	62.1	0	0	0	113	L329 R331 K337	L329-L333 WeakPolarHBondContact O-CB 3.4Å; L329-L333 PolarHBondContact O-N 3.05Å; R331-L333 VanDerWaalsContact C-N 3.34Å; R331-L333 PolarHBondContact O-N 3.43Å; L333-K337 HydrophobicContact CD1-CD 4.42Å; L333-K337 HydrophobicContact CG-CD 4.25Å; L333-K337 VanDerWaalsContact O-CB 3.3Å; L333-K337 WeakPolarHBondContact O-CB 3.45Å; L333-K337 WeakPolarHBondContact O-CD 3.43Å; L333-K337 WeakPolarHBondContact O-CG 3.16Å; L333-K337 PolarHBondContact O-N 3.07Å; L333-K337 VanDerWaalsContact O-N 3.11Å
334	L	97.9	Very high	97.5	Very high	113 Å²	113	100.8 Å²	100.8	59%	0.592	49%	0.491	S	S	*	.	H	α-helix	trans	-74.9	-37.8	174.8	-74.1	169	0	0	0	112.2	K330 R331 E332 K337 Q338	K330-L334 VanDerWaalsContact O-CG 3.28Å; K330-L334 WeakPolarHBondContact O-CG 3.17Å; K330-L334 PolarHBondContact O-N 2.95Å; R331-L334 WeakPolarHBondContact O-CA 3.44Å; R331-L334 WeakPolarHBondContact O-CB 3.32Å; R331-L334 PolarHBondContact O-N 3.13Å; E332-L334 PolarHBondContact O-N 2.8Å; L334-K337 PolarHBondContact O-N 3.46Å; L334-Q338 PolarHBondContact O-N 2.82Å
335	L	98	Very high	97.6	Very high	119 Å²	119	96.7 Å²	96.7	62%	0.623	48%	0.481	S	S	*	.	H	α-helix	trans	-63.6	-51.1	173.8	-66.8	174.5	0	0	0	111	R331 E332 K337 Q338 E339	R331-L335 WeakPolarHBondContact O-CG 3.47Å; R331-L335 PolarHBondContact O-N 3.03Å; E332-L335 PolarHBondContact O-N 3.23Å; E332-L335 VanDerWaalsContact O-N 3.09Å; L335-K337 VanDerWaalsContact C-N 3.29Å; L335-K337 PolarHBondContact O-N 3.43Å; L335-Q338 CarbonylContact O-C 3.45Å; L335-Q338 WeakPolarHBondContact O-CA 3.41Å; L335-Q338 WeakPolarHBondContact O-CB 3.29Å; L335-Q338 PolarHBondContact O-N 3.19Å; L335-E339 PolarHBondContact O-N 2.84Å
336	C	97.5	Very high	97.6	Very high	66 Å²	66	95.7 Å²	95.7	45%	0.446	48%	0.481	S	S	.	.	H	α-helix	trans	-57.9	-40.2	174.9	-67.3	0	0	0	0	111.9	E332 Q338 E339 I340	E332-C336 PolarHBondContact O-N 2.95Å; E332-C336 PolarHBondContact O-SG 3.06Å; E332-C336 VanDerWaalsContact O-SG 3.42Å; C336-Q338 VanDerWaalsContact C-N 3.29Å; C336-Q338 PolarHBondContact O-N 2.93Å; C336-E339 PolarHBondContact O-N 2.86Å; C336-I340 WeakPolarHBondContact O-CD1 3.24Å; C336-I340 VanDerWaalsContact O-CG1 3.26Å; C336-I340 WeakPolarHBondContact O-CG1 3.48Å; C336-I340 PolarHBondContact O-N 2.9Å
337	K	98	Very high	97.7	Very high	99 Å²	99	98.5 Å²	98.5	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-65.2	-29	173.3	-78.4	169.3	-177.1	170.1	0	113.3	L333 L334 L335 R341	L333-K337 HydrophobicContact CD1-CD 4.42Å; L333-K337 HydrophobicContact CG-CD 4.25Å; L333-K337 VanDerWaalsContact O-CB 3.3Å; L333-K337 WeakPolarHBondContact O-CB 3.45Å; L333-K337 WeakPolarHBondContact O-CD 3.43Å; L333-K337 WeakPolarHBondContact O-CG 3.16Å; L333-K337 PolarHBondContact O-N 3.07Å; L333-K337 VanDerWaalsContact O-N 3.11Å; L334-K337 PolarHBondContact O-N 3.46Å; L335-K337 VanDerWaalsContact C-N 3.29Å; L335-K337 PolarHBondContact O-N 3.43Å; K337-R341 VanDerWaalsContact O-CZ 3.23Å; K337-R341 PolarHBondContact O-NE 3.09Å; K337-R341 PolarHBondContact O-NH2 3.48Å; K337-R341 VanDerWaalsContact O-NH2 3.17Å
338	Q	98.1	Very high	97.8	Very high	83 Å²	83	100.8 Å²	100.8	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-76.1	-43	173.7	-176.6	62	50	0	0	110.9	L334 L335 C336 R341 N342	L334-Q338 PolarHBondContact O-N 2.82Å; L335-Q338 CarbonylContact O-C 3.45Å; L335-Q338 WeakPolarHBondContact O-CA 3.41Å; L335-Q338 WeakPolarHBondContact O-CB 3.29Å; L335-Q338 PolarHBondContact O-N 3.19Å; C336-Q338 VanDerWaalsContact C-N 3.29Å; C336-Q338 PolarHBondContact O-N 2.93Å; Q338-R341 PolarHBondContact O-N 2.78Å; Q338-N342 PolarHBondContact NE2-OD1 2.99Å; Q338-N342 VanDerWaalsContact O-CG 3.24Å; Q338-N342 PolarHBondContact O-N 3.41Å; Q338-N342 PolarHBondContact O-OD1 3.27Å
339	E	97.7	Very high	97.8	Very high	114 Å²	114	98.5 Å²	98.5	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-62.2	-44.9	177.7	-176.2	166.7	-158.1	0	0	112	L335 C336 R341 N342 L343	L335-E339 PolarHBondContact O-N 2.84Å; C336-E339 PolarHBondContact O-N 2.86Å; E339-R341 PolarHBondContact O-N 3.45Å; E339-N342 WeakPolarHBondContact O-CB 3.45Å; E339-N342 PolarHBondContact O-N 3.25Å; E339-L343 HydrophobicContact CG-CD1 3.88Å; E339-L343 HydrophobicContact CG-CG 4.15Å; E339-L343 WeakPolarHBondContact O-CB 3.39Å; E339-L343 WeakPolarHBondContact O-CG 3.49Å; E339-L343 PolarHBondContact O-N 3.31Å
340	I	97.6	Very high	97.9	Very high	112 Å²	112	98.9 Å²	98.9	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-55.4	-41	173.9	-70.4	164.5	0	0	0	111.4	C336 Q344	C336-I340 WeakPolarHBondContact O-CD1 3.24Å; C336-I340 VanDerWaalsContact O-CG1 3.26Å; C336-I340 WeakPolarHBondContact O-CG1 3.48Å; C336-I340 PolarHBondContact O-N 2.9Å; I340-Q344 WeakPolarHBondContact O-CB 3.46Å; I340-Q344 PolarHBondContact O-N 3.15Å
341	R	97.3	Very high	97.9	Very high	131 Å²	131	98.2 Å²	98.2	49%	0.494	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-39.1	176.6	-78.4	178.1	-81	117.1	-1.3	112.2	K337 Q338 E339 A345	K337-R341 VanDerWaalsContact O-CZ 3.23Å; K337-R341 PolarHBondContact O-NE 3.09Å; K337-R341 PolarHBondContact O-NH2 3.48Å; K337-R341 VanDerWaalsContact O-NH2 3.17Å; Q338-R341 PolarHBondContact O-N 2.78Å; E339-R341 PolarHBondContact O-N 3.45Å; R341-A345 PolarHBondContact O-N 3.35Å; R341-A345 VanDerWaalsContact O-N 3.13Å
342	N	98.1	Very high	97.9	Very high	87 Å²	87	98.5 Å²	98.5	47%	0.465	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-46.9	174.6	-64.9	-8.3	0	0	0	111.4	Q338 E339 A345 V346	Q338-N342 PolarHBondContact NE2-OD1 2.99Å; Q338-N342 VanDerWaalsContact O-CG 3.24Å; Q338-N342 PolarHBondContact O-N 3.41Å; Q338-N342 PolarHBondContact O-OD1 3.27Å; E339-N342 WeakPolarHBondContact O-CB 3.45Å; E339-N342 PolarHBondContact O-N 3.25Å; N342-A345 PolarHBondContact O-N 3.38Å; N342-V346 WeakPolarHBondContact O-CG2 3.49Å; N342-V346 PolarHBondContact O-N 3.11Å
343	L	98.2	Very high	97.9	Very high	103 Å²	103	100.3 Å²	100.3	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-40.8	179.5	-70.9	173.2	0	0	0	112.1	E339 V346 K347	E339-L343 HydrophobicContact CG-CD1 3.88Å; E339-L343 HydrophobicContact CG-CG 4.15Å; E339-L343 WeakPolarHBondContact O-CB 3.39Å; E339-L343 WeakPolarHBondContact O-CG 3.49Å; E339-L343 PolarHBondContact O-N 3.31Å; L343-V346 PolarHBondContact O-N 3.38Å; L343-K347 WeakPolarHBondContact O-CB 3.31Å; L343-K347 PolarHBondContact O-N 3.47Å
344	Q	98.1	Very high	97.9	Very high	80 Å²	80	99.7 Å²	99.7	37%	0.374	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-42.5	174.9	-179.6	63.7	20.6	0	0	111.7	I340 K347 E348	I340-Q344 WeakPolarHBondContact O-CB 3.46Å; I340-Q344 PolarHBondContact O-N 3.15Å; Q344-K347 WeakPolarHBondContact O-CB 3.46Å; Q344-K347 PolarHBondContact O-N 3.24Å; Q344-E348 WeakPolarHBondContact CG-OE1 3.22Å; Q344-E348 PolarHBondContact NE2-OE1 2.97Å; Q344-E348 WeakPolarHBondContact O-CG 3.22Å; Q344-E348 PolarHBondContact O-N 3.49Å
345	A	97.9	Very high	97.9	Very high	56 Å²	56	97 Å²	97	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-38.9	174.8	0	0	0	0	0	112.7	R341 N342 E348 A349	R341-A345 PolarHBondContact O-N 3.35Å; R341-A345 VanDerWaalsContact O-N 3.13Å; N342-A345 PolarHBondContact O-N 3.38Å; A345-E348 PolarHBondContact O-N 3.48Å; A345-A349 WeakPolarHBondContact O-CB 3.31Å; A345-A349 PolarHBondContact O-N 3.37Å
346	V	97.9	Very high	97.9	Very high	73 Å²	73	95.7 Å²	95.7	44%	0.442	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-42.9	174.4	168.9	0	0	0	0	111.3	N342 L343 A349 Q350	N342-V346 WeakPolarHBondContact O-CG2 3.49Å; N342-V346 PolarHBondContact O-N 3.11Å; L343-V346 PolarHBondContact O-N 3.38Å; V346-A349 PolarHBondContact O-N 3.42Å; V346-Q350 HydrophobicContact CG1-CG 4.49Å; V346-Q350 WeakPolarHBondContact O-CB 3.43Å; V346-Q350 VanDerWaalsContact O-CG 3.29Å; V346-Q350 WeakPolarHBondContact O-CG 3.33Å; V346-Q350 PolarHBondContact O-N 3.06Å
347	K	98.1	Very high	97.9	Very high	124 Å²	124	98.8 Å²	98.8	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-46	175.3	170.4	-174.3	165.6	-165.1	0	112	L343 Q344 Q350 Q351	L343-K347 WeakPolarHBondContact O-CB 3.31Å; L343-K347 PolarHBondContact O-N 3.47Å; Q344-K347 WeakPolarHBondContact O-CB 3.46Å; Q344-K347 PolarHBondContact O-N 3.24Å; K347-Q350 PolarHBondContact O-N 2.81Å; K347-Q351 WeakPolarHBondContact O-CB 3.23Å; K347-Q351 PolarHBondContact O-N 3.39Å
348	E	98.1	Very high	97.9	Very high	111 Å²	111	98.8 Å²	98.8	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-44.6	176.5	-73.2	169.8	-168.3	0	0	111.7	Q344 A345 Q350 Q351 Q352	Q344-E348 WeakPolarHBondContact CG-OE1 3.22Å; Q344-E348 PolarHBondContact NE2-OE1 2.97Å; Q344-E348 WeakPolarHBondContact O-CG 3.22Å; Q344-E348 PolarHBondContact O-N 3.49Å; A345-E348 PolarHBondContact O-N 3.48Å; E348-Q350 VanDerWaalsContact C-N 3.33Å; E348-Q350 PolarHBondContact O-N 3.49Å; E348-Q351 PolarHBondContact O-N 3Å; E348-Q352 PolarHBondContact O-N 3.42Å
349	A	98.3	Very high	97.9	Very high	36 Å²	36	97.6 Å²	97.6	30%	0.298	50%	0.495	S	S	.	.	H	α-helix	trans	-65.9	-31.1	175.2	0	0	0	0	0	113.4	A345 V346 R353	A345-A349 WeakPolarHBondContact O-CB 3.31Å; A345-A349 PolarHBondContact O-N 3.37Å; V346-A349 PolarHBondContact O-N 3.42Å; A349-R353 WeakPolarHBondContact O-CG 3.29Å; A349-R353 PolarHBondContact O-N 2.81Å; A349-R353 PolarHBondContact O-NE 2.96Å
350	Q	97.8	Very high	97.9	Very high	114 Å²	114	94.8 Å²	94.8	53%	0.533	49%	0.488	S	S	.	.	H	α-helix	trans	-68.4	-46.5	170.5	-76.1	175.1	0.3	0	0	111.3	V346 K347 E348 Q352 R353 L354	V346-Q350 HydrophobicContact CG1-CG 4.49Å; V346-Q350 WeakPolarHBondContact O-CB 3.43Å; V346-Q350 VanDerWaalsContact O-CG 3.29Å; V346-Q350 WeakPolarHBondContact O-CG 3.33Å; V346-Q350 PolarHBondContact O-N 3.06Å; K347-Q350 PolarHBondContact O-N 2.81Å; E348-Q350 VanDerWaalsContact C-N 3.33Å; E348-Q350 PolarHBondContact O-N 3.49Å; Q350-Q352 PolarHBondContact O-N 3.29Å; Q350-R353 PolarHBondContact O-N 2.74Å; Q350-L354 PolarHBondContact O-N 3.21Å
351	Q	98.3	Very high	97.9	Very high	107 Å²	107	93.3 Å²	93.3	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-43.8	178.6	-171.7	63.5	45	0	0	112	K347 E348 R353 L354 C355	K347-Q351 WeakPolarHBondContact O-CB 3.23Å; K347-Q351 PolarHBondContact O-N 3.39Å; E348-Q351 PolarHBondContact O-N 3Å; Q351-R353 VanDerWaalsContact C-N 3.34Å; Q351-R353 PolarHBondContact O-N 2.78Å; Q351-L354 PolarHBondContact O-N 2.91Å; Q351-C355 PolarHBondContact NE2-SG 2.98Å; Q351-C355 VanDerWaalsContact NE2-SG 3.4Å; Q351-C355 PolarHBondContact O-N 3.18Å; Q351-C355 PolarHBondContact O-SG 2.89Å
352	Q	98.1	Very high	98	Very high	144 Å²	144	92.4 Å²	92.4	67%	0.673	49%	0.485	S	S	*	.	H	α-helix	trans	-62.1	-40.1	177.4	-170.9	-176.8	11.8	0	0	112.2	E348 Q350 T356	E348-Q352 PolarHBondContact O-N 3.42Å; Q350-Q352 PolarHBondContact O-N 3.29Å; Q352-T356 WeakPolarHBondContact O-CB 3.33Å; Q352-T356 PolarHBondContact O-N 2.65Å; Q352-T356 VanDerWaalsContact O-N 3.12Å; Q352-T356 PolarHBondContact O-OG1 2.96Å
353	R	98.3	Very high	98	Very high	143 Å²	143	93.4 Å²	93.4	54%	0.54	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-39.7	174.2	-74.8	-176.7	-65.4	-117	-3.3	111.9	A349 Q350 Q351 T356 Q357	A349-R353 WeakPolarHBondContact O-CG 3.29Å; A349-R353 PolarHBondContact O-N 2.81Å; A349-R353 PolarHBondContact O-NE 2.96Å; Q350-R353 PolarHBondContact O-N 2.74Å; Q351-R353 VanDerWaalsContact C-N 3.34Å; Q351-R353 PolarHBondContact O-N 2.78Å; R353-T356 WeakPolarHBondContact O-CB 3.17Å; R353-T356 PolarHBondContact O-N 3.16Å; R353-Q357 WeakPolarHBondContact O-CG 3.33Å; R353-Q357 PolarHBondContact O-N 3.45Å
354	L	97.4	Very high	97.9	Very high	78 Å²	78	93.3 Å²	93.3	41%	0.408	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-51.2	177.2	-177.4	141	0	0	0	111.2	Q350 Q351 T356 Q357 E358	Q350-L354 PolarHBondContact O-N 3.21Å; Q351-L354 PolarHBondContact O-N 2.91Å; L354-T356 PolarHBondContact O-N 2.96Å; L354-Q357 WeakPolarHBondContact O-CA 3.35Å; L354-Q357 WeakPolarHBondContact O-CB 3.24Å; L354-Q357 PolarHBondContact O-N 3.39Å; L354-E358 HydrophobicContact CD2-CG 4.24Å; L354-E358 WeakPolarHBondContact CD2-OE2 3.13Å; L354-E358 WeakPolarHBondContact O-CG 3.48Å; L354-E358 PolarHBondContact O-N 2.77Å
355	C	98	Very high	97.9	Very high	57 Å²	57	95.7 Å²	95.7	39%	0.385	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-30	177.5	-64.1	0	0	0	0	113.2	Q351 E358 A359	Q351-C355 PolarHBondContact NE2-SG 2.98Å; Q351-C355 VanDerWaalsContact NE2-SG 3.4Å; Q351-C355 PolarHBondContact O-N 3.18Å; Q351-C355 PolarHBondContact O-SG 2.89Å; C355-E358 WeakPolarHBondContact CA-OE2 3.13Å; C355-E358 PolarHBondContact O-N 2.95Å; C355-A359 PolarHBondContact O-N 3.43Å
356	T	97.3	Very high	98	Very high	91 Å²	91	98.4 Å²	98.4	56%	0.558	50%	0.497	S	S	*	.	H	α-helix	trans	-68.4	-39.9	173.1	-55.3	0	0	0	0	111.6	Q352 R353 L354 S360	Q352-T356 WeakPolarHBondContact O-CB 3.33Å; Q352-T356 PolarHBondContact O-N 2.65Å; Q352-T356 VanDerWaalsContact O-N 3.12Å; Q352-T356 PolarHBondContact O-OG1 2.96Å; R353-T356 WeakPolarHBondContact O-CB 3.17Å; R353-T356 PolarHBondContact O-N 3.16Å; L354-T356 PolarHBondContact O-N 2.96Å; T356-S360 PolarHBondContact O-N 2.78Å; T356-S360 VanDerWaalsContact O-N 3.13Å
357	Q	98.1	Very high	97.9	Very high	132 Å²	132	98.6 Å²	98.6	62%	0.617	49%	0.493	S	S	*	.	H	α-helix	trans	-67.8	-39.9	173.5	-72.2	179.8	-2.9	0	0	111.8	R353 L354 S360 I361	R353-Q357 WeakPolarHBondContact O-CG 3.33Å; R353-Q357 PolarHBondContact O-N 3.45Å; L354-Q357 WeakPolarHBondContact O-CA 3.35Å; L354-Q357 WeakPolarHBondContact O-CB 3.24Å; L354-Q357 PolarHBondContact O-N 3.39Å; Q357-S360 PolarHBondContact O-N 3.24Å; Q357-I361 WeakPolarHBondContact O-CB 3.34Å; Q357-I361 WeakPolarHBondContact O-CD1 3.28Å; Q357-I361 VanDerWaalsContact O-CG1 3.24Å; Q357-I361 WeakPolarHBondContact O-CG1 3.49Å; Q357-I361 PolarHBondContact O-N 3.46Å
358	E	97.8	Very high	97.9	Very high	99 Å²	99	98.7 Å²	98.7	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-46.8	174.9	-69.6	175.8	136.8	0	0	111.6	L354 C355 S360 I361 L362	L354-E358 HydrophobicContact CD2-CG 4.24Å; L354-E358 WeakPolarHBondContact CD2-OE2 3.13Å; L354-E358 WeakPolarHBondContact O-CG 3.48Å; L354-E358 PolarHBondContact O-N 2.77Å; C355-E358 WeakPolarHBondContact CA-OE2 3.13Å; C355-E358 PolarHBondContact O-N 2.95Å; E358-S360 PolarHBondContact O-N 2.96Å; E358-I361 PolarHBondContact O-N 2.94Å; E358-L362 WeakPolarHBondContact O-CG 3.48Å; E358-L362 PolarHBondContact O-N 3.24Å
359	A	97.6	Very high	97.9	Very high	58 Å²	58	98.7 Å²	98.7	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-45.1	175.3	0	0	0	0	0	112.3	C355 I361 L362 Q363	C355-A359 PolarHBondContact O-N 3.43Å; A359-I361 PolarHBondContact O-N 3.36Å; A359-L362 PolarHBondContact O-N 2.8Å; A359-Q363 PolarHBondContact O-N 3.47Å
360	S	97.6	Very high	97.9	Very high	55 Å²	55	102.7 Å²	102.7	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-39.1	175.8	-179.1	0	0	0	0	112.6	T356 Q357 E358 Q363 M364	T356-S360 PolarHBondContact O-N 2.78Å; T356-S360 VanDerWaalsContact O-N 3.13Å; Q357-S360 PolarHBondContact O-N 3.24Å; E358-S360 PolarHBondContact O-N 2.96Å; S360-Q363 PolarHBondContact O-N 3.25Å; S360-M364 WeakPolarHBondContact O-CG 3.43Å; S360-M364 PolarHBondContact O-N 2.98Å
361	I	98.1	Very high	97.9	Very high	80 Å²	80	99.9 Å²	99.9	41%	0.41	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-38.8	175.2	-71.5	163.8	0	0	0	111.3	Q357 E358 A359 M364 K365	Q357-I361 WeakPolarHBondContact O-CB 3.34Å; Q357-I361 WeakPolarHBondContact O-CD1 3.28Å; Q357-I361 VanDerWaalsContact O-CG1 3.24Å; Q357-I361 WeakPolarHBondContact O-CG1 3.49Å; Q357-I361 PolarHBondContact O-N 3.46Å; E358-I361 PolarHBondContact O-N 2.94Å; A359-I361 PolarHBondContact O-N 3.36Å; I361-M364 HydrophobicContact CG1-CE 4.21Å; I361-K365 HydrophobicContact CG2-CD 4.3Å; I361-K365 VanDerWaalsContact O-CG 3.28Å; I361-K365 WeakPolarHBondContact O-CG 3.41Å; I361-K365 PolarHBondContact O-N 3.03Å
362	L	98.2	Very high	97.9	Very high	113 Å²	113	97.3 Å²	97.3	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-66.7	-41.7	175.3	-70	170.3	0	0	0	111.8	E358 A359 K365 Q366	E358-L362 WeakPolarHBondContact O-CG 3.48Å; E358-L362 PolarHBondContact O-N 3.24Å; A359-L362 PolarHBondContact O-N 2.8Å; L362-K365 PolarHBondContact O-N 3.16Å; L362-Q366 PolarHBondContact O-N 2.83Å; L362-Q366 VanDerWaalsContact O-N 3.07Å
363	Q	98.3	Very high	97.9	Very high	108 Å²	108	95.5 Å²	95.5	51%	0.505	49%	0.492	S	S	.	.	H	α-helix	trans	-59.2	-51.6	173.1	179.2	-178.4	-14.2	0	0	111.5	A359 S360 K365 Q366 E367	A359-Q363 PolarHBondContact O-N 3.47Å; S360-Q363 PolarHBondContact O-N 3.25Å; Q363-K365 VanDerWaalsContact C-N 3.27Å; Q363-K365 PolarHBondContact O-N 2.92Å; Q363-Q366 WeakPolarHBondContact O-CB 3.48Å; Q363-Q366 PolarHBondContact O-N 2.88Å; Q363-E367 VanDerWaalsContact CG-OE1 3.27Å; Q363-E367 WeakPolarHBondContact CG-OE1 3.41Å; Q363-E367 PolarHBondContact NE2-OE1 3Å; Q363-E367 PolarHBondContact O-N 3.24Å
364	M	97.8	Very high	97.9	Very high	101 Å²	101	92.6 Å²	92.6	50%	0.498	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-33.9	179.1	-74.2	-174.3	-72.2	0	0	112.7	S360 I361 L368	S360-M364 WeakPolarHBondContact O-CG 3.43Å; S360-M364 PolarHBondContact O-N 2.98Å; I361-M364 HydrophobicContact CG1-CE 4.21Å; M364-L368 VanDerWaalsContact O-CB 3.31Å; M364-L368 WeakPolarHBondContact O-CB 3.36Å; M364-L368 PolarHBondContact O-N 3.27Å
365	K	98	Very high	98	Very high	129 Å²	129	94.8 Å²	94.8	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-40.4	172.1	-76.9	171.5	179.5	179.1	0	112.1	I361 L362 Q363 L369	I361-K365 HydrophobicContact CG2-CD 4.3Å; I361-K365 VanDerWaalsContact O-CG 3.28Å; I361-K365 WeakPolarHBondContact O-CG 3.41Å; I361-K365 PolarHBondContact O-N 3.03Å; L362-K365 PolarHBondContact O-N 3.16Å; Q363-K365 VanDerWaalsContact C-N 3.27Å; Q363-K365 PolarHBondContact O-N 2.92Å; K365-L369 PolarHBondContact O-N 2.86Å
366	Q	98.2	Very high	98	Very high	113 Å²	113	95.5 Å²	95.5	53%	0.528	50%	0.496	S	S	.	.	H	α-helix	trans	-68.9	-38.8	177.4	-159	-169.9	31	0	0	111.7	L362 Q363 L369 R370	L362-Q366 PolarHBondContact O-N 2.83Å; L362-Q366 VanDerWaalsContact O-N 3.07Å; Q363-Q366 WeakPolarHBondContact O-CB 3.48Å; Q363-Q366 PolarHBondContact O-N 2.88Å; Q366-L369 PolarHBondContact O-N 3.22Å; Q366-R370 VanDerWaalsContact CD-NH2 3.3Å; Q366-R370 WeakPolarHBondContact O-CG 3.49Å; Q366-R370 PolarHBondContact O-N 3.09Å; Q366-R370 VanDerWaalsContact O-N 3.1Å
367	E	97	Very high	98	Very high	78 Å²	78	95.9 Å²	95.9	36%	0.364	49%	0.492	S	S	.	.	H	α-helix	trans	-64.3	-44.4	173.8	-74.9	164.3	-173	0	0	112.1	Q363 L369 R370 A371	Q363-E367 VanDerWaalsContact CG-OE1 3.27Å; Q363-E367 WeakPolarHBondContact CG-OE1 3.41Å; Q363-E367 PolarHBondContact NE2-OE1 3Å; Q363-E367 PolarHBondContact O-N 3.24Å; E367-L369 VanDerWaalsContact C-N 3.3Å; E367-L369 PolarHBondContact O-N 3.48Å; E367-R370 VanDerWaalsContact CG-NH1 3.28Å; E367-R370 PolarHBondContact O-N 2.97Å; E367-A371 WeakPolarHBondContact O-CB 3.41Å; E367-A371 PolarHBondContact O-N 3.46Å
368	L	98.4	Very high	98	Very high	126 Å²	126	95.2 Å²	95.2	66%	0.66	49%	0.492	S	S	*	.	H	α-helix	trans	-59.8	-39	174.4	-179.4	63.2	0	0	0	112.3	M364 A371 S372	M364-L368 VanDerWaalsContact O-CB 3.31Å; M364-L368 WeakPolarHBondContact O-CB 3.36Å; M364-L368 PolarHBondContact O-N 3.27Å; L368-A371 PolarHBondContact O-N 3.31Å; L368-S372 PolarHBondContact O-N 2.71Å
369	L	98.6	Very high	98	Very high	111 Å²	111	94 Å²	94	58%	0.581	49%	0.489	S	S	*	.	H	α-helix	trans	-64.9	-47.6	176.7	-176.9	63.1	0	0	0	111.6	K365 Q366 E367 A371 S372 M373	K365-L369 PolarHBondContact O-N 2.86Å; Q366-L369 PolarHBondContact O-N 3.22Å; E367-L369 VanDerWaalsContact C-N 3.3Å; E367-L369 PolarHBondContact O-N 3.48Å; L369-A371 VanDerWaalsContact C-N 3.33Å; L369-A371 PolarHBondContact O-N 2.67Å; L369-S372 PolarHBondContact O-N 3.33Å; L369-M373 WeakPolarHBondContact O-CG 3.36Å; L369-M373 PolarHBondContact O-N 3.01Å; L369-M373 VanDerWaalsContact O-N 3.09Å
370	R	98.3	Very high	98	Very high	120 Å²	120	96.7 Å²	96.7	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-58.7	-45.3	175.1	-66.7	-173.4	-131.3	104.5	-0.7	111.2	Q366 E367 S372 M373 T374	Q366-R370 VanDerWaalsContact CD-NH2 3.3Å; Q366-R370 WeakPolarHBondContact O-CG 3.49Å; Q366-R370 PolarHBondContact O-N 3.09Å; Q366-R370 VanDerWaalsContact O-N 3.1Å; E367-R370 VanDerWaalsContact CG-NH1 3.28Å; E367-R370 PolarHBondContact O-N 2.97Å; R370-S372 VanDerWaalsContact C-N 3.29Å; R370-S372 PolarHBondContact O-N 3.38Å; R370-M373 PolarHBondContact O-N 3.11Å; R370-T374 PolarHBondContact O-N 3.37Å; R370-T374 PolarHBondContact O-OG1 2.82Å
371	A	97.7	Very high	98	Very high	55 Å²	55	99 Å²	99	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-64	-31	178.6	0	0	0	0	0	113.4	E367 L368 L369 T374 K375	E367-A371 WeakPolarHBondContact O-CB 3.41Å; E367-A371 PolarHBondContact O-N 3.46Å; L368-A371 PolarHBondContact O-N 3.31Å; L369-A371 VanDerWaalsContact C-N 3.33Å; L369-A371 PolarHBondContact O-N 2.67Å; A371-T374 WeakPolarHBondContact CA-OG1 3.33Å; A371-T374 PolarHBondContact O-OG1 2.83Å; A371-K375 VanDerWaalsContact O-CB 3.28Å; A371-K375 WeakPolarHBondContact O-CB 3.44Å; A371-K375 PolarHBondContact O-N 3.23Å; A371-K375 VanDerWaalsContact O-N 3.16Å
372	S	98.3	Very high	98	Very high	53 Å²	53	101.3 Å²	101.3	37%	0.371	51%	0.508	S	S	.	.	H	α-helix	trans	-67.8	-47.7	171.5	-161	0	0	0	0	111	L368 L369 R370 T374 K375 D376	L368-S372 PolarHBondContact O-N 2.71Å; L369-S372 PolarHBondContact O-N 3.33Å; R370-S372 VanDerWaalsContact C-N 3.29Å; R370-S372 PolarHBondContact O-N 3.38Å; S372-T374 PolarHBondContact O-N 3.44Å; S372-K375 WeakPolarHBondContact O-CB 3.39Å; S372-K375 PolarHBondContact O-N 3.46Å; S372-K375 VanDerWaalsContact O-N 3.12Å; S372-D376 VanDerWaalsContact O-CG 3.28Å; S372-D376 PolarHBondContact O-N 2.89Å; S372-D376 VanDerWaalsContact O-OD2 3.09Å; S372-D376 PolarHBondContact OG-OD2 2.87Å
373	M	98.2	Very high	98	Very high	105 Å²	105	98.6 Å²	98.6	52%	0.517	50%	0.502	S	S	.	.	H	α-helix	trans	-58.1	-48.7	179.3	-66.6	175.7	64.4	0	0	111.7	L369 R370 K375 D376 E377	L369-M373 WeakPolarHBondContact O-CG 3.36Å; L369-M373 PolarHBondContact O-N 3.01Å; L369-M373 VanDerWaalsContact O-N 3.09Å; R370-M373 PolarHBondContact O-N 3.11Å; M373-K375 VanDerWaalsContact C-N 3.26Å; M373-K375 PolarHBondContact O-N 3.34Å; M373-D376 PolarHBondContact O-N 3.4Å; M373-D376 VanDerWaalsContact O-N 3.09Å; M373-E377 WeakPolarHBondContact O-CG 3.46Å; M373-E377 PolarHBondContact O-N 2.71Å
374	T	98	Very high	98	Very high	82 Å²	82	97.6 Å²	97.6	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-29.9	177.5	55.4	0	0	0	0	113.2	R370 A371 S372 L378	R370-T374 PolarHBondContact O-N 3.37Å; R370-T374 PolarHBondContact O-OG1 2.82Å; A371-T374 WeakPolarHBondContact CA-OG1 3.33Å; A371-T374 PolarHBondContact O-OG1 2.83Å; S372-T374 PolarHBondContact O-N 3.44Å; T374-L378 WeakPolarHBondContact O-CB 3.42Å; T374-L378 PolarHBondContact O-N 2.84Å; T374-L378 VanDerWaalsContact O-N 3.08Å
375	K	98.1	Very high	98.1	Very high	124 Å²	124	98 Å²	98	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-70	-41	173.2	-179.1	-162.6	170.4	-153.6	0	110.9	A371 S372 M373 L378 N379	A371-K375 VanDerWaalsContact O-CB 3.28Å; A371-K375 WeakPolarHBondContact O-CB 3.44Å; A371-K375 PolarHBondContact O-N 3.23Å; A371-K375 VanDerWaalsContact O-N 3.16Å; S372-K375 WeakPolarHBondContact O-CB 3.39Å; S372-K375 PolarHBondContact O-N 3.46Å; S372-K375 VanDerWaalsContact O-N 3.12Å; M373-K375 VanDerWaalsContact C-N 3.26Å; M373-K375 PolarHBondContact O-N 3.34Å; K375-L378 PolarHBondContact O-N 3.3Å; K375-N379 PolarHBondContact O-N 3.39Å; K375-N379 PolarHBondContact O-ND2 3.43Å; K375-N379 VanDerWaalsContact O-ND2 3.13Å
376	D	97.9	Very high	98.1	Very high	72 Å²	72	97 Å²	97	39%	0.385	50%	0.497	S	S	.	.	H	α-helix	trans	-73.6	-34.2	-178.7	-63	-35.5	0	0	0	111.6	S372 M373 N379 N380	S372-D376 VanDerWaalsContact O-CG 3.28Å; S372-D376 PolarHBondContact O-N 2.89Å; S372-D376 VanDerWaalsContact O-OD2 3.09Å; S372-D376 PolarHBondContact OG-OD2 2.87Å; M373-D376 PolarHBondContact O-N 3.4Å; M373-D376 VanDerWaalsContact O-N 3.09Å; D376-N379 PolarHBondContact O-N 3.1Å; D376-N379 PolarHBondContact OD1-ND2 3.29Å; D376-N380 PolarHBondContact O-N 3.07Å; D376-N380 PolarHBondContact O-ND2 3.35Å; D376-N380 VanDerWaalsContact O-ND2 3.12Å
377	E	98.2	Very high	98.1	Very high	99 Å²	99	99.2 Å²	99.2	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-56.9	-49.4	164.5	-71.2	160.6	-169.4	0	0	111.7	M373 N379 N380 H381	M373-E377 WeakPolarHBondContact O-CG 3.46Å; M373-E377 PolarHBondContact O-N 2.71Å; E377-N379 PolarHBondContact O-N 3Å; E377-N380 WeakPolarHBondContact O-CB 3.46Å; E377-N380 PolarHBondContact O-N 3.1Å; E377-H381 PolarHBondContact O-CD2 3.02Å; E377-H381 VanDerWaalsContact O-CD2 3.26Å; E377-H381 PolarHBondContact O-N 2.92Å
378	L	97.8	Very high	98.1	Very high	118 Å²	118	99.9 Å²	99.9	62%	0.618	50%	0.502	S	S	*	.	H	α-helix	trans	-64.8	-36.7	177.2	-174.2	64	0	0	0	112.7	T374 K375 N380 H381 H382	T374-L378 WeakPolarHBondContact O-CB 3.42Å; T374-L378 PolarHBondContact O-N 2.84Å; T374-L378 VanDerWaalsContact O-N 3.08Å; K375-L378 PolarHBondContact O-N 3.3Å; L378-N380 VanDerWaalsContact C-N 3.33Å; L378-N380 PolarHBondContact O-N 3.4Å; L378-H381 PolarHBondContact O-N 2.93Å; L378-H382 WeakPolarHBondContact O-CB 3.48Å; L378-H382 PolarHBondContact O-N 2.91Å
379	N	97.8	Very high	98.1	Very high	75 Å²	75	99.1 Å²	99.1	40%	0.401	50%	0.498	S	S	.	.	H	α-helix	trans	-61.4	-41.7	173.6	-67.7	-33.7	0	0	0	111.2	K375 D376 E377 H382 A383	K375-N379 PolarHBondContact O-N 3.39Å; K375-N379 PolarHBondContact O-ND2 3.43Å; K375-N379 VanDerWaalsContact O-ND2 3.13Å; D376-N379 PolarHBondContact O-N 3.1Å; D376-N379 PolarHBondContact OD1-ND2 3.29Å; E377-N379 PolarHBondContact O-N 3Å; N379-H382 PolarHBondContact O-N 3.13Å; N379-A383 PolarHBondContact O-N 3.07Å
380	N	97.9	Very high	98.1	Very high	113 Å²	113	98.4 Å²	98.4	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-64.9	-45.7	177.5	-68.4	-30.7	0	0	0	111.5	D376 E377 L378 H382 A383 E384	D376-N380 PolarHBondContact O-N 3.07Å; D376-N380 PolarHBondContact O-ND2 3.35Å; D376-N380 VanDerWaalsContact O-ND2 3.12Å; E377-N380 WeakPolarHBondContact O-CB 3.46Å; E377-N380 PolarHBondContact O-N 3.1Å; L378-N380 VanDerWaalsContact C-N 3.33Å; L378-N380 PolarHBondContact O-N 3.4Å; N380-H382 VanDerWaalsContact C-N 3.33Å; N380-H382 PolarHBondContact O-N 3.34Å; N380-A383 PolarHBondContact O-N 3.29Å; N380-E384 PolarHBondContact O-N 3.32Å
381	H	98.1	Very high	98.1	Very high	105 Å²	105	95.4 Å²	95.4	49%	0.486	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-37.6	174	-69.5	-50.9	0	0	0	112.7	E377 L378 E384 L385	E377-H381 PolarHBondContact O-CD2 3.02Å; E377-H381 VanDerWaalsContact O-CD2 3.26Å; E377-H381 PolarHBondContact O-N 2.92Å; L378-H381 PolarHBondContact O-N 2.93Å; H381-E384 IonicContact ND1-OE2 3.79Å; H381-E384 PolarHBondContact O-N 3Å; H381-L385 WeakPolarHBondContact O-CB 3.46Å; H381-L385 VanDerWaalsContact O-CG 3.29Å; H381-L385 WeakPolarHBondContact O-CG 3.4Å; H381-L385 PolarHBondContact O-N 3.39Å
382	H	98	Very high	98.1	Very high	127 Å²	127	96.6 Å²	96.6	59%	0.588	49%	0.487	S	S	*	.	H	α-helix	trans	-64.3	-41.4	174.5	-176.1	77.5	0	0	0	112	L378 N379 N380 K386	L378-H382 WeakPolarHBondContact O-CB 3.48Å; L378-H382 PolarHBondContact O-N 2.91Å; N379-H382 PolarHBondContact O-N 3.13Å; N380-H382 VanDerWaalsContact C-N 3.33Å; N380-H382 PolarHBondContact O-N 3.34Å; H382-K386 VanDerWaalsContact O-CB 3.29Å; H382-K386 WeakPolarHBondContact O-CB 3.18Å; H382-K386 PolarHBondContact O-N 3.05Å
383	A	98.3	Very high	98.1	Very high	56 Å²	56	98.5 Å²	98.5	46%	0.463	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-41.8	174.8	0	0	0	0	0	112.2	N379 N380 K386 W387	N379-A383 PolarHBondContact O-N 3.07Å; N380-A383 PolarHBondContact O-N 3.29Å; A383-K386 PolarHBondContact O-N 3.09Å; A383-W387 PolarHBondContact O-N 3.18Å
384	E	98.3	Very high	98.1	Very high	87 Å²	87	98.8 Å²	98.8	41%	0.407	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-46	176.1	-167.5	-161.6	162.1	0	0	112	N380 H381 W387 K388	N380-E384 PolarHBondContact O-N 3.32Å; H381-E384 IonicContact ND1-OE2 3.79Å; H381-E384 PolarHBondContact O-N 3Å; E384-W387 PolarHBondContact O-N 3.27Å; E384-K388 WeakPolarHBondContact O-CG 3.5Å; E384-K388 PolarHBondContact O-N 3.31Å; E384-K388 VanDerWaalsContact OE1-CE 3.24Å; E384-K388 WeakPolarHBondContact OE1-CE 3.28Å; E384-K388 IonicContact OE1-NZ 2.63Å; E384-K388 PolarHBondContact OE1-NZ 3.16Å
385	L	98.2	Very high	98.2	Very high	110 Å²	110	98.8 Å²	98.8	58%	0.576	49%	0.485	S	S	*	.	H	α-helix	trans	-64.6	-38.6	176	-73	170.5	0	0	0	112	H381 K388 L389	H381-L385 WeakPolarHBondContact O-CB 3.46Å; H381-L385 VanDerWaalsContact O-CG 3.29Å; H381-L385 WeakPolarHBondContact O-CG 3.4Å; H381-L385 PolarHBondContact O-N 3.39Å; L385-K388 PolarHBondContact O-N 3.01Å; L385-L389 WeakPolarHBondContact O-CB 3.26Å; L385-L389 PolarHBondContact O-N 3.31Å
386	K	98.3	Very high	98.1	Very high	109 Å²	109	101.4 Å²	101.4	47%	0.474	49%	0.491	S	S	.	.	H	α-helix	trans	-63.6	-45.2	174.8	-173	177.8	-177	-88.7	0	111.5	H382 A383 L389 E390	H382-K386 VanDerWaalsContact O-CB 3.29Å; H382-K386 WeakPolarHBondContact O-CB 3.18Å; H382-K386 PolarHBondContact O-N 3.05Å; A383-K386 PolarHBondContact O-N 3.09Å; K386-L389 WeakPolarHBondContact O-CB 3.27Å; K386-L389 PolarHBondContact O-N 3.29Å; K386-E390 WeakPolarHBondContact CE-OE1 3.47Å; K386-E390 IonicContact NZ-OE1 2.7Å; K386-E390 PolarHBondContact NZ-OE1 3.46Å; K386-E390 WeakPolarHBondContact O-CG 3.47Å; K386-E390 PolarHBondContact O-N 3.02Å
387	W	98.4	Very high	98.1	Very high	158 Å²	158	99.3 Å²	99.3	60%	0.598	49%	0.487	S	S	*	.	H	α-helix	trans	-62.3	-43.4	175.7	179.1	79.1	0	0	0	111.8	A383 E384 L389 E390 E391	A383-W387 PolarHBondContact O-N 3.18Å; E384-W387 PolarHBondContact O-N 3.27Å; W387-L389 VanDerWaalsContact C-N 3.3Å; W387-L389 PolarHBondContact O-N 3.08Å; W387-E390 PolarHBondContact O-N 3.44Å; W387-E391 WeakPolarHBondContact O-CB 3.35Å; W387-E391 PolarHBondContact O-N 3.18Å
388	K	98.5	Very high	98.1	Very high	92 Å²	92	98 Å²	98	40%	0.4	48%	0.481	S	S	.	.	H	α-helix	trans	-59	-40	173.2	-74.2	172.3	-178.7	171.6	0	112.2	E384 L385 C392	E384-K388 WeakPolarHBondContact O-CG 3.5Å; E384-K388 PolarHBondContact O-N 3.31Å; E384-K388 VanDerWaalsContact OE1-CE 3.24Å; E384-K388 WeakPolarHBondContact OE1-CE 3.28Å; E384-K388 IonicContact OE1-NZ 2.63Å; E384-K388 PolarHBondContact OE1-NZ 3.16Å; L385-K388 PolarHBondContact O-N 3.01Å; K388-C392 WeakPolarHBondContact O-CB 3.45Å; K388-C392 PolarHBondContact O-N 3.16Å; K388-C392 PolarHBondContact O-SG 3.1Å
389	L	98.3	Very high	98.1	Very high	110 Å²	110	95.6 Å²	95.6	58%	0.576	47%	0.473	S	S	*	.	H	α-helix	trans	-67	-42.2	176	-179.1	63	0	0	0	112.1	L385 K386 W387 C392 N393	L385-L389 WeakPolarHBondContact O-CB 3.26Å; L385-L389 PolarHBondContact O-N 3.31Å; K386-L389 WeakPolarHBondContact O-CB 3.27Å; K386-L389 PolarHBondContact O-N 3.29Å; W387-L389 VanDerWaalsContact C-N 3.3Å; W387-L389 PolarHBondContact O-N 3.08Å; L389-C392 PolarHBondContact O-N 2.97Å; L389-N393 WeakPolarHBondContact O-CB 3.35Å; L389-N393 PolarHBondContact O-N 3.46Å; L389-N393 PolarHBondContact O-ND2 3.43Å
390	E	98.3	Very high	98.2	Very high	96 Å²	96	99.2 Å²	99.2	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-43.4	175.6	-72.6	168.5	-179.5	0	0	111.2	K386 W387 N393 R394	K386-E390 WeakPolarHBondContact CE-OE1 3.47Å; K386-E390 IonicContact NZ-OE1 2.7Å; K386-E390 PolarHBondContact NZ-OE1 3.46Å; K386-E390 WeakPolarHBondContact O-CG 3.47Å; K386-E390 PolarHBondContact O-N 3.02Å; W387-E390 PolarHBondContact O-N 3.44Å; E390-N393 PolarHBondContact O-N 3.28Å; E390-R394 PolarHBondContact O-N 3.38Å
391	E	98.3	Very high	98.2	Very high	58 Å²	58	100.2 Å²	100.2	27%	0.271	48%	0.484	S	S	.	.	H	α-helix	trans	-66.7	-41.9	176.3	178	61	-174.5	0	0	112.8	W387 N393 R394 L395	W387-E391 WeakPolarHBondContact O-CB 3.35Å; W387-E391 PolarHBondContact O-N 3.18Å; E391-N393 VanDerWaalsContact C-N 3.31Å; E391-N393 PolarHBondContact O-N 3.04Å; E391-R394 WeakPolarHBondContact O-CB 3.42Å; E391-R394 PolarHBondContact O-N 3.37Å; E391-R394 IonicContact OE1-CZ 3.76Å; E391-R394 IonicContact OE1-NE 3.88Å; E391-R394 IonicContact OE1-NH2 2.73Å; E391-R394 PolarHBondContact OE1-NH2 3.09Å; E391-R394 IonicContact OE2-CZ 3.78Å; E391-R394 IonicContact OE2-NE 3.15Å; E391-R394 PolarHBondContact OE2-NE 3.2Å; E391-R394 IonicContact OE2-NH2 2.73Å; E391-R394 PolarHBondContact OE2-NH2 3.12Å; E391-L395 HydrophobicContact CG-CD1 4.39Å; E391-L395 WeakPolarHBondContact O-CG 3.48Å; E391-L395 PolarHBondContact O-N 2.89Å
392	C	97.8	Very high	98.2	Very high	80 Å²	80	99 Å²	99	54%	0.541	48%	0.481	S	S	.	.	H	α-helix	trans	-61.7	-38.7	172.3	-72.5	0	0	0	0	112.2	K388 L389 W396	K388-C392 WeakPolarHBondContact O-CB 3.45Å; K388-C392 PolarHBondContact O-N 3.16Å; K388-C392 PolarHBondContact O-SG 3.1Å; L389-C392 PolarHBondContact O-N 2.97Å; C392-W396 VanDerWaalsContact O-CB 3.31Å; C392-W396 WeakPolarHBondContact O-CB 3.28Å; C392-W396 PolarHBondContact O-N 3.43Å
393	N	98.4	Very high	98.2	Very high	92 Å²	92	96.4 Å²	96.4	49%	0.492	47%	0.474	S	S	.	.	H	α-helix	trans	-67.5	-35.8	174.4	-81.2	-69.3	0	0	0	112.4	L389 E390 E391 G397	L389-N393 WeakPolarHBondContact O-CB 3.35Å; L389-N393 PolarHBondContact O-N 3.46Å; L389-N393 PolarHBondContact O-ND2 3.43Å; E390-N393 PolarHBondContact O-N 3.28Å; E391-N393 VanDerWaalsContact C-N 3.31Å; E391-N393 PolarHBondContact O-N 3.04Å; N393-G397 PolarHBondContact O-N 2.84Å
394	R	98.4	Very high	98.1	Very high	111 Å²	111	94.7 Å²	94.7	42%	0.419	46%	0.462	S	S	.	.	H	α-helix	trans	-60.8	-52.2	173.4	-170.9	-170.7	66.9	72.6	3.2	111	E390 E391 W396 G397 E398	E390-R394 PolarHBondContact O-N 3.38Å; E391-R394 WeakPolarHBondContact O-CB 3.42Å; E391-R394 PolarHBondContact O-N 3.37Å; E391-R394 IonicContact OE1-CZ 3.76Å; E391-R394 IonicContact OE1-NE 3.88Å; E391-R394 IonicContact OE1-NH2 2.73Å; E391-R394 PolarHBondContact OE1-NH2 3.09Å; E391-R394 IonicContact OE2-CZ 3.78Å; E391-R394 IonicContact OE2-NE 3.15Å; E391-R394 PolarHBondContact OE2-NE 3.2Å; E391-R394 IonicContact OE2-NH2 2.73Å; E391-R394 PolarHBondContact OE2-NH2 3.12Å; R394-W396 PolarHBondContact O-N 3.46Å; R394-G397 CarbonylContact O-C 3.6Å; R394-G397 WeakPolarHBondContact O-CA 3.46Å; R394-G397 PolarHBondContact O-N 2.89Å; R394-G397 VanDerWaalsContact O-N 3.13Å; R394-E398 IonicContact CZ-OE1 3.58Å; R394-E398 IonicContact CZ-OE2 2.69Å; R394-E398 IonicContact NH1-OE1 3.75Å; R394-E398 PolarHBondContact NH1-OE1 3.26Å; R394-E398 IonicContact NH1-OE2 3.35Å; R394-E398 PolarHBondContact NH1-OE2 3.21Å; R394-E398 PolarHBondContact O-N 3.5Å
395	L	98.4	Very high	98.1	Very high	82 Å²	82	95.1 Å²	95.1	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-40.1	178.7	-69.5	169.8	0	0	0	112.4	E391 G397 E398 C399	E391-L395 HydrophobicContact CG-CD1 4.39Å; E391-L395 WeakPolarHBondContact O-CG 3.48Å; E391-L395 PolarHBondContact O-N 2.89Å; L395-G397 VanDerWaalsContact C-N 3.34Å; L395-E398 PolarHBondContact O-N 3.09Å; L395-C399 PolarHBondContact O-N 3.3Å
396	W	97.1	Very high	98.1	Very high	179 Å²	179	96.3 Å²	96.3	68%	0.678	46%	0.464	S	S	*	.	H	α-helix	trans	-62	-41.5	172.3	177.8	-110.7	0	0	0	112.1	C392 R394 E398 C399 K400	C392-W396 VanDerWaalsContact O-CB 3.31Å; C392-W396 WeakPolarHBondContact O-CB 3.28Å; C392-W396 PolarHBondContact O-N 3.43Å; R394-W396 PolarHBondContact O-N 3.46Å; W396-E398 VanDerWaalsContact C-N 3.27Å; W396-E398 PolarHBondContact O-N 3.31Å; W396-C399 PolarHBondContact O-N 3.37Å; W396-K400 VanDerWaalsContact O-CB 3.3Å; W396-K400 WeakPolarHBondContact O-CB 3.41Å; W396-K400 PolarHBondContact O-N 3.18Å
397	G	98.1	Very high	98.1	Very high	28 Å²	28	94.7 Å²	94.7	29%	0.289	46%	0.461	S	S	.	.	H	α-helix	trans	-63.7	-28.6	174.2	0	0	0	0	0	113.9	N393 R394 L395 K401	N393-G397 PolarHBondContact O-N 2.84Å; R394-G397 CarbonylContact O-C 3.6Å; R394-G397 WeakPolarHBondContact O-CA 3.46Å; R394-G397 PolarHBondContact O-N 2.89Å; R394-G397 VanDerWaalsContact O-N 3.13Å; L395-G397 VanDerWaalsContact C-N 3.34Å; G397-K401 WeakPolarHBondContact O-CD 3.45Å; G397-K401 VanDerWaalsContact O-CG 3.3Å; G397-K401 WeakPolarHBondContact O-CG 3.41Å; G397-K401 PolarHBondContact O-N 3.42Å
398	E	98	Very high	98	Very high	73 Å²	73	94 Å²	94	34%	0.341	46%	0.458	S	S	.	.	H	α-helix	trans	-77	-50.8	172.9	-77.2	161.2	-167.8	0	0	111.5	R394 L395 W396 K400 K401 D402	R394-E398 IonicContact CZ-OE1 3.58Å; R394-E398 IonicContact CZ-OE2 2.69Å; R394-E398 IonicContact NH1-OE1 3.75Å; R394-E398 PolarHBondContact NH1-OE1 3.26Å; R394-E398 IonicContact NH1-OE2 3.35Å; R394-E398 PolarHBondContact NH1-OE2 3.21Å; R394-E398 PolarHBondContact O-N 3.5Å; L395-E398 PolarHBondContact O-N 3.09Å; W396-E398 VanDerWaalsContact C-N 3.27Å; W396-E398 PolarHBondContact O-N 3.31Å; E398-K400 PolarHBondContact O-N 2.97Å; E398-K401 WeakPolarHBondContact O-CA 3.34Å; E398-K401 WeakPolarHBondContact O-CB 3.15Å; E398-K401 PolarHBondContact O-N 3.04Å; E398-D402 PolarHBondContact O-N 2.67Å
399	C	97.9	Very high	98	Very high	67 Å²	67	93.8 Å²	93.8	45%	0.453	46%	0.461	S	S	.	.	H	α-helix	trans	-54.1	-39.5	174.3	-172.7	0	0	0	0	112.2	L395 W396 K401 D402 V403	L395-C399 PolarHBondContact O-N 3.3Å; W396-C399 PolarHBondContact O-N 3.37Å; C399-K401 PolarHBondContact O-N 2.9Å; C399-D402 PolarHBondContact O-N 3.13Å; C399-V403 WeakPolarHBondContact O-CG2 3.43Å; C399-V403 PolarHBondContact O-N 3.4Å
400	K	98.4	Very high	98	Very high	150 Å²	150	94 Å²	94	65%	0.652	46%	0.462	S	S	*	.	H	α-helix	trans	-64.9	-34.5	175.6	-174.2	174.8	-179.4	178	0	113.2	W396 E398 G404	W396-K400 VanDerWaalsContact O-CB 3.3Å; W396-K400 WeakPolarHBondContact O-CB 3.41Å; W396-K400 PolarHBondContact O-N 3.18Å; E398-K400 PolarHBondContact O-N 2.97Å; K400-G404 PolarHBondContact O-N 3.33Å; K400-G404 VanDerWaalsContact O-N 3.15Å
401	K	98.2	Very high	97.9	Very high	135 Å²	135	95.6 Å²	95.6	59%	0.587	47%	0.469	S	S	*	.	H	α-helix	trans	-67.7	-41	173.1	-69.4	162.3	-170.1	168.4	0	110.7	G397 E398 C399 G404 Q405	G397-K401 WeakPolarHBondContact O-CD 3.45Å; G397-K401 VanDerWaalsContact O-CG 3.3Å; G397-K401 WeakPolarHBondContact O-CG 3.41Å; G397-K401 PolarHBondContact O-N 3.42Å; E398-K401 WeakPolarHBondContact O-CA 3.34Å; E398-K401 WeakPolarHBondContact O-CB 3.15Å; E398-K401 PolarHBondContact O-N 3.04Å; C399-K401 PolarHBondContact O-N 2.9Å; K401-G404 CarbonylContact O-C 3.55Å; K401-G404 PolarHBondContact O-N 3.03Å; K401-Q405 WeakPolarHBondContact O-CG 3.21Å; K401-Q405 PolarHBondContact O-N 3.16Å
402	D	98	Very high	97.9	Very high	79 Å²	79	98.1 Å²	98.1	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-70.1	-38.7	-178.2	-70.9	-2.6	0	0	0	112.6	E398 C399 Q405 K406	E398-D402 PolarHBondContact O-N 2.67Å; C399-D402 PolarHBondContact O-N 3.13Å; D402-Q405 WeakPolarHBondContact O-CB 3.38Å; D402-Q405 PolarHBondContact O-N 3.05Å; D402-Q405 PolarHBondContact OD1-NE2 3.15Å; D402-Q405 VanDerWaalsContact OD1-NE2 3.11Å; D402-K406 WeakPolarHBondContact O-CG 3.45Å; D402-K406 PolarHBondContact O-N 3.27Å
403	V	97.8	Very high	97.9	Very high	73 Å²	73	101.7 Å²	101.7	44%	0.442	48%	0.484	S	S	.	.	H	α-helix	trans	-58	-51.7	168.1	171.6	0	0	0	0	109.7	C399 Q405 K406 D407	C399-V403 WeakPolarHBondContact O-CG2 3.43Å; C399-V403 PolarHBondContact O-N 3.4Å; V403-Q405 PolarHBondContact O-N 3.3Å; V403-Q405 VanDerWaalsContact O-N 3.15Å; V403-K406 CarbonylContact O-C 3.6Å; V403-K406 WeakPolarHBondContact O-CA 3.36Å; V403-K406 PolarHBondContact O-N 2.92Å; V403-D407 VanDerWaalsContact O-CG 3.3Å; V403-D407 PolarHBondContact O-N 3.42Å
404	G	97.7	Very high	97.8	Very high	19 Å²	19	102.9 Å²	102.9	20%	0.196	49%	0.485	C	S	.	.	H	α-helix	trans	-62.9	-21.9	177.5	0	0	0	0	0	115.1	K400 K401 R408	K400-G404 PolarHBondContact O-N 3.33Å; K400-G404 VanDerWaalsContact O-N 3.15Å; K401-G404 CarbonylContact O-C 3.55Å; K401-G404 PolarHBondContact O-N 3.03Å; G404-R408 WeakPolarHBondContact O-CG 3.48Å; G404-R408 PolarHBondContact O-NH1 3.04Å
405	Q	98	Very high	97.8	Very high	96 Å²	96	102.7 Å²	102.7	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-74.9	-46.2	168.9	-74.3	175.8	68.6	0	0	111.3	K401 D402 V403 D407 R408 L409	K401-Q405 WeakPolarHBondContact O-CG 3.21Å; K401-Q405 PolarHBondContact O-N 3.16Å; D402-Q405 WeakPolarHBondContact O-CB 3.38Å; D402-Q405 PolarHBondContact O-N 3.05Å; D402-Q405 PolarHBondContact OD1-NE2 3.15Å; D402-Q405 VanDerWaalsContact OD1-NE2 3.11Å; V403-Q405 PolarHBondContact O-N 3.3Å; V403-Q405 VanDerWaalsContact O-N 3.15Å; Q405-D407 VanDerWaalsContact C-N 3.34Å; Q405-D407 PolarHBondContact O-N 2.93Å; Q405-R408 PolarHBondContact O-N 3.43Å; Q405-L409 PolarHBondContact O-N 2.99Å; Q405-L409 VanDerWaalsContact O-N 3.12Å
406	K	96.9	Very high	97.7	Very high	135 Å²	135	105.1 Å²	105.1	59%	0.587	50%	0.496	S	S	*	.	H	α-helix	trans	-62.3	-40.1	177.3	-71.3	167.6	-178.2	172.6	0	111.5	D402 V403 R408 L409 L410	D402-K406 WeakPolarHBondContact O-CG 3.45Å; D402-K406 PolarHBondContact O-N 3.27Å; V403-K406 CarbonylContact O-C 3.6Å; V403-K406 WeakPolarHBondContact O-CA 3.36Å; V403-K406 PolarHBondContact O-N 2.92Å; K406-R408 VanDerWaalsContact C-N 3.34Å; K406-R408 PolarHBondContact O-N 3.01Å; K406-L409 PolarHBondContact O-N 3.07Å; K406-L409 VanDerWaalsContact O-N 3.16Å; K406-L410 WeakPolarHBondContact O-CG 3.41Å; K406-L410 PolarHBondContact O-N 3.38Å
407	D	98.3	Very high	97.7	Very high	76 Å²	76	101.7 Å²	101.7	41%	0.406	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-42.3	175	-66.5	-28.4	0	0	0	112.1	V403 Q405 L410 Q411	V403-D407 VanDerWaalsContact O-CG 3.3Å; V403-D407 PolarHBondContact O-N 3.42Å; Q405-D407 VanDerWaalsContact C-N 3.34Å; Q405-D407 PolarHBondContact O-N 2.93Å; D407-L410 PolarHBondContact O-N 3.42Å; D407-Q411 VanDerWaalsContact O-CG 3.29Å; D407-Q411 WeakPolarHBondContact O-CG 3.37Å; D407-Q411 PolarHBondContact O-N 3.39Å
408	R	98.1	Very high	97.6	Very high	143 Å²	143	104.8 Å²	104.8	54%	0.54	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-38.4	175.5	-73.9	-173	-65.3	-89.6	4.5	112.4	G404 Q405 K406 Q411 Q412	G404-R408 WeakPolarHBondContact O-CG 3.48Å; G404-R408 PolarHBondContact O-NH1 3.04Å; Q405-R408 PolarHBondContact O-N 3.43Å; K406-R408 VanDerWaalsContact C-N 3.34Å; K406-R408 PolarHBondContact O-N 3.01Å; R408-Q411 PolarHBondContact O-N 2.93Å; R408-Q412 WeakPolarHBondContact O-CG 3.39Å; R408-Q412 PolarHBondContact O-N 3.37Å
409	L	97.9	Very high	97.6	Very high	88 Å²	88	105.9 Å²	105.9	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-42.6	174.3	-69.6	170	0	0	0	111.4	Q405 K406 Q411 Q412 Y413	Q405-L409 PolarHBondContact O-N 2.99Å; Q405-L409 VanDerWaalsContact O-N 3.12Å; K406-L409 PolarHBondContact O-N 3.07Å; K406-L409 VanDerWaalsContact O-N 3.16Å; L409-Q411 VanDerWaalsContact C-N 3.33Å; L409-Q411 PolarHBondContact O-N 3.44Å; L409-Q412 WeakPolarHBondContact O-CB 3.31Å; L409-Q412 PolarHBondContact O-N 2.91Å; L409-Q412 VanDerWaalsContact O-N 3.16Å; L409-Y413 WeakPolarHBondContact O-CD2 3.15Å; L409-Y413 PolarHBondContact O-N 3.35Å
410	L	97.6	Very high	97.5	Very high	113 Å²	113	104.4 Å²	104.4	59%	0.592	50%	0.498	S	S	*	.	H	α-helix	trans	-61.5	-40.1	175	-72	171	0	0	0	111.8	K406 D407 Y413 K414	K406-L410 WeakPolarHBondContact O-CG 3.41Å; K406-L410 PolarHBondContact O-N 3.38Å; D407-L410 PolarHBondContact O-N 3.42Å; L410-Y413 PolarHBondContact O-N 3.24Å; L410-K414 VanDerWaalsContact O-CB 3.3Å; L410-K414 WeakPolarHBondContact O-CB 3.4Å; L410-K414 PolarHBondContact O-N 2.94Å
411	Q	97.6	Very high	97.3	Very high	131 Å²	131	102.4 Å²	102.4	61%	0.612	49%	0.492	S	S	*	.	H	α-helix	trans	-61.6	-41.7	172.3	-73.4	169.8	1.5	0	0	112.2	D407 R408 L409 K414 H415	D407-Q411 VanDerWaalsContact O-CG 3.29Å; D407-Q411 WeakPolarHBondContact O-CG 3.37Å; D407-Q411 PolarHBondContact O-N 3.39Å; R408-Q411 PolarHBondContact O-N 2.93Å; L409-Q411 VanDerWaalsContact C-N 3.33Å; L409-Q411 PolarHBondContact O-N 3.44Å; Q411-K414 PolarHBondContact O-N 3.12Å; Q411-H415 PolarHBondContact O-N 2.93Å
412	Q	97.8	Very high	97.2	Very high	111 Å²	111	101.9 Å²	101.9	52%	0.519	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-40.5	175.2	-72	175.7	3.4	0	0	112.8	R408 L409 K416	R408-Q412 WeakPolarHBondContact O-CG 3.39Å; R408-Q412 PolarHBondContact O-N 3.37Å; L409-Q412 WeakPolarHBondContact O-CB 3.31Å; L409-Q412 PolarHBondContact O-N 2.91Å; L409-Q412 VanDerWaalsContact O-N 3.16Å; Q412-K416 WeakPolarHBondContact O-CG 3.49Å; Q412-K416 PolarHBondContact O-N 3.41Å
413	Y	96.9	Very high	97.1	Very high	155 Å²	155	103.5 Å²	103.5	61%	0.608	50%	0.497	S	S	*	.	H	α-helix	trans	-68.1	-38	174.7	-74.8	-64	0	0	0	112.2	L409 L410 K416 L417	L409-Y413 WeakPolarHBondContact O-CD2 3.15Å; L409-Y413 PolarHBondContact O-N 3.35Å; L410-Y413 PolarHBondContact O-N 3.24Å; Y413-K416 PolarHBondContact O-N 3.01Å; Y413-L417 WeakPolarHBondContact O-CB 3.43Å; Y413-L417 PolarHBondContact O-N 3.38Å
414	K	97.6	Very high	96.9	Very high	117 Å²	117	106.4 Å²	106.4	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-46.5	174.9	-175.5	174.7	177.6	-69.9	0	111.7	L410 Q411 K416 L417 E418	L410-K414 VanDerWaalsContact O-CB 3.3Å; L410-K414 WeakPolarHBondContact O-CB 3.4Å; L410-K414 PolarHBondContact O-N 2.94Å; Q411-K414 PolarHBondContact O-N 3.12Å; K414-K416 PolarHBondContact O-N 2.91Å; K414-L417 WeakPolarHBondContact O-CB 3.47Å; K414-L417 PolarHBondContact O-N 2.8Å; K414-L417 VanDerWaalsContact O-N 3.16Å; K414-E418 IonicContact NZ-OE1 3.72Å; K414-E418 PolarHBondContact NZ-OE1 3.18Å; K414-E418 IonicContact NZ-OE2 2.78Å; K414-E418 PolarHBondContact NZ-OE2 2.95Å; K414-E418 WeakPolarHBondContact O-CG 3.4Å; K414-E418 PolarHBondContact O-N 2.85Å
415	H	97.5	Very high	96.8	Very high	106 Å²	106	107.8 Å²	107.8	49%	0.491	52%	0.515	S	S	.	.	H	α-helix	trans	-57.5	-48	175.5	-170.4	-78.3	0	0	0	111.9	Q411 L417 E418 E419	Q411-H415 PolarHBondContact O-N 2.93Å; H415-L417 VanDerWaalsContact C-N 3.28Å; H415-L417 PolarHBondContact O-N 2.68Å; H415-E418 PolarHBondContact O-N 3.39Å; H415-E418 VanDerWaalsContact O-N 3.16Å; H415-E419 IonicContact CE1-OE1 2.64Å; H415-E419 PolarHBondContact CE1-OE1 3Å; H415-E419 IonicContact CE1-OE2 3.36Å; H415-E419 PolarHBondContact CE1-OE2 2.9Å; H415-E419 IonicContact CG-OE2 3.82Å; H415-E419 IonicContact ND1-OE1 2.92Å; H415-E419 IonicContact ND1-OE2 3.67Å; H415-E419 PolarHBondContact ND1-OE2 3.29Å; H415-E419 WeakPolarHBondContact O-CG 3.31Å; H415-E419 PolarHBondContact O-N 2.59Å
416	K	97.4	Very high	96.7	Very high	133 Å²	133	106.6 Å²	106.6	58%	0.578	51%	0.51	S	S	*	.	H	α-helix	trans	-61.5	-34.2	177.1	-71.8	173.2	179.6	179.3	0	113.2	Q412 Y413 K414 G420	Q412-K416 WeakPolarHBondContact O-CG 3.49Å; Q412-K416 PolarHBondContact O-N 3.41Å; Y413-K416 PolarHBondContact O-N 3.01Å; K414-K416 PolarHBondContact O-N 2.91Å; K416-G420 PolarHBondContact O-N 3.34Å
417	L	95.5	Very high	96.5	Very high	108 Å²	108	102.9 Å²	102.9	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-70.2	-41.7	175	-174.2	66.4	0	0	0	111.4	Y413 K414 H415 G420 Q421	Y413-L417 WeakPolarHBondContact O-CB 3.43Å; Y413-L417 PolarHBondContact O-N 3.38Å; K414-L417 WeakPolarHBondContact O-CB 3.47Å; K414-L417 PolarHBondContact O-N 2.8Å; K414-L417 VanDerWaalsContact O-N 3.16Å; H415-L417 VanDerWaalsContact C-N 3.28Å; H415-L417 PolarHBondContact O-N 2.68Å; L417-G420 PolarHBondContact O-N 3.06Å; L417-Q421 WeakPolarHBondContact O-CB 3.4Å; L417-Q421 VanDerWaalsContact O-CG 3.3Å; L417-Q421 WeakPolarHBondContact O-CG 3.28Å; L417-Q421 PolarHBondContact O-N 3.48Å
418	E	97.2	Very high	96.3	Very high	93 Å²	93	103.9 Å²	103.9	44%	0.435	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-39.8	176.3	-70.6	172.3	148.1	0	0	111.6	K414 H415 Q421 K422	K414-E418 IonicContact NZ-OE1 3.72Å; K414-E418 PolarHBondContact NZ-OE1 3.18Å; K414-E418 IonicContact NZ-OE2 2.78Å; K414-E418 PolarHBondContact NZ-OE2 2.95Å; K414-E418 WeakPolarHBondContact O-CG 3.4Å; K414-E418 PolarHBondContact O-N 2.85Å; H415-E418 PolarHBondContact O-N 3.39Å; H415-E418 VanDerWaalsContact O-N 3.16Å; E418-Q421 PolarHBondContact O-N 2.93Å; E418-K422 WeakPolarHBondContact O-CB 3.48Å; E418-K422 PolarHBondContact O-N 3.38Å
419	E	96.7	Very high	96.1	Very high	95 Å²	95	104 Å²	104	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-45.1	170.4	-72.1	174.8	120.1	0	0	112.1	H415 Q421 K422 L423	H415-E419 IonicContact CE1-OE1 2.64Å; H415-E419 PolarHBondContact CE1-OE1 3Å; H415-E419 IonicContact CE1-OE2 3.36Å; H415-E419 PolarHBondContact CE1-OE2 2.9Å; H415-E419 IonicContact CG-OE2 3.82Å; H415-E419 IonicContact ND1-OE1 2.92Å; H415-E419 IonicContact ND1-OE2 3.67Å; H415-E419 PolarHBondContact ND1-OE2 3.29Å; H415-E419 WeakPolarHBondContact O-CG 3.31Å; H415-E419 PolarHBondContact O-N 2.59Å; E419-Q421 PolarHBondContact O-N 3.44Å; E419-K422 PolarHBondContact O-N 2.95Å; E419-L423 WeakPolarHBondContact O-CG 3.5Å; E419-L423 PolarHBondContact O-N 3.34Å
420	G	95.7	Very high	95.9	Very high	36 Å²	36	105 Å²	105	37%	0.371	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-42.9	176.3	0	0	0	0	0	112.9	K416 L417 L423 Q424	K416-G420 PolarHBondContact O-N 3.34Å; L417-G420 PolarHBondContact O-N 3.06Å; G420-L423 PolarHBondContact O-N 2.95Å; G420-Q424 WeakPolarHBondContact O-CB 3.21Å; G420-Q424 PolarHBondContact O-N 3.29Å
421	Q	95.5	Very high	95.6	Very high	109 Å²	109	105 Å²	105	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-39.4	174.1	-74.3	173.7	-2.5	0	0	112.1	L417 E418 E419 Q424 A425	L417-Q421 WeakPolarHBondContact O-CB 3.4Å; L417-Q421 VanDerWaalsContact O-CG 3.3Å; L417-Q421 WeakPolarHBondContact O-CG 3.28Å; L417-Q421 PolarHBondContact O-N 3.48Å; E418-Q421 PolarHBondContact O-N 2.93Å; E419-Q421 PolarHBondContact O-N 3.44Å; Q421-Q424 PolarHBondContact O-N 3.44Å; Q421-A425 WeakPolarHBondContact O-CB 3.32Å; Q421-A425 PolarHBondContact O-N 2.97Å
422	K	96.1	Very high	95.4	Very high	124 Å²	124	103.1 Å²	103.1	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-46	175.3	-176.6	178.9	179.1	-74.3	0	111.9	E418 E419 Q424 A425 E426	E418-K422 WeakPolarHBondContact O-CB 3.48Å; E418-K422 PolarHBondContact O-N 3.38Å; E419-K422 PolarHBondContact O-N 2.95Å; K422-Q424 VanDerWaalsContact C-N 3.34Å; K422-A425 CarbonylContact O-C 3.57Å; K422-A425 PolarHBondContact O-N 3.47Å; K422-E426 WeakPolarHBondContact CE-OE1 3.48Å; K422-E426 IonicContact NZ-OE1 3.17Å; K422-E426 PolarHBondContact NZ-OE1 2.79Å; K422-E426 IonicContact NZ-OE2 3.84Å; K422-E426 WeakPolarHBondContact O-CG 3.39Å; K422-E426 PolarHBondContact O-N 2.91Å
423	L	95.6	Very high	95.2	Very high	113 Å²	113	103 Å²	103	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-63.3	-39.7	176	-70.2	170.7	0	0	0	111.7	E419 G420 E426 A427	E419-L423 WeakPolarHBondContact O-CG 3.5Å; E419-L423 PolarHBondContact O-N 3.34Å; G420-L423 PolarHBondContact O-N 2.95Å; L423-E426 PolarHBondContact O-N 2.99Å; L423-A427 PolarHBondContact O-N 3.43Å
424	Q	94.1	Very high	94.9	Very high	133 Å²	133	100.2 Å²	100.2	62%	0.621	49%	0.491	S	S	*	.	H	α-helix	trans	-61.4	-44.5	173	-174.4	178.3	-2.2	0	0	111.4	G420 Q421 K422 E426 A427 Q428	G420-Q424 WeakPolarHBondContact O-CB 3.21Å; G420-Q424 PolarHBondContact O-N 3.29Å; Q421-Q424 PolarHBondContact O-N 3.44Å; K422-Q424 VanDerWaalsContact C-N 3.34Å; Q424-E426 VanDerWaalsContact C-N 3.27Å; Q424-E426 PolarHBondContact O-N 3.24Å; Q424-A427 PolarHBondContact O-N 2.94Å; Q424-Q428 VanDerWaalsContact O-CB 3.22Å; Q424-Q428 WeakPolarHBondContact O-CB 3.37Å; Q424-Q428 PolarHBondContact O-N 2.9Å
425	A	95.1	Very high	94.6	Very high	48 Å²	48	98.9 Å²	98.9	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-71.5	-17	176.7	0	0	0	0	0	114	Q421 K422 R429	Q421-A425 WeakPolarHBondContact O-CB 3.32Å; Q421-A425 PolarHBondContact O-N 2.97Å; K422-A425 CarbonylContact O-C 3.57Å; K422-A425 PolarHBondContact O-N 3.47Å; A425-R429 WeakPolarHBondContact O-CG 3.48Å; A425-R429 PolarHBondContact O-NE 3.45Å
426	E	95.2	Very high	94.4	Very high	72 Å²	72	98.3 Å²	98.3	34%	0.336	49%	0.49	S	S	.	.	H	α-helix	trans	-79.2	-48.5	168.9	-78.7	165.3	-176.3	0	0	110.7	K422 L423 Q424 Q428 R429 E430	K422-E426 WeakPolarHBondContact CE-OE1 3.48Å; K422-E426 IonicContact NZ-OE1 3.17Å; K422-E426 PolarHBondContact NZ-OE1 2.79Å; K422-E426 IonicContact NZ-OE2 3.84Å; K422-E426 WeakPolarHBondContact O-CG 3.39Å; K422-E426 PolarHBondContact O-N 2.91Å; L423-E426 PolarHBondContact O-N 2.99Å; Q424-E426 VanDerWaalsContact C-N 3.27Å; Q424-E426 PolarHBondContact O-N 3.24Å; E426-Q428 VanDerWaalsContact C-N 3.33Å; E426-Q428 PolarHBondContact O-N 3.39Å; E426-R429 PolarHBondContact O-N 2.66Å; E426-E430 PolarHBondContact O-N 3.25Å
427	A	93.4	Very high	93.9	Very high	57 Å²	57	96.1 Å²	96.1	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-62.3	-37.6	175	0	0	0	0	0	113	L423 Q424 E430 L431	L423-A427 PolarHBondContact O-N 3.43Å; Q424-A427 PolarHBondContact O-N 2.94Å; A427-E430 PolarHBondContact O-N 2.9Å; A427-L431 WeakPolarHBondContact O-CB 3.48Å; A427-L431 PolarHBondContact O-N 3.24Å
428	Q	93.4	Very high	93.4	Very high	96 Å²	96	95.8 Å²	95.8	45%	0.449	48%	0.481	S	S	.	.	H	α-helix	trans	-57.2	-49.5	174.2	-176.1	77.4	29.8	0	0	111.2	Q424 E426 E430 L431 E432	Q424-Q428 VanDerWaalsContact O-CB 3.22Å; Q424-Q428 WeakPolarHBondContact O-CB 3.37Å; Q424-Q428 PolarHBondContact O-N 2.9Å; E426-Q428 VanDerWaalsContact C-N 3.33Å; E426-Q428 PolarHBondContact O-N 3.39Å; Q428-E430 PolarHBondContact O-N 3.2Å; Q428-L431 WeakPolarHBondContact O-CB 3.39Å; Q428-L431 PolarHBondContact O-N 2.94Å; Q428-E432 WeakPolarHBondContact CG-OE1 3.44Å; Q428-E432 PolarHBondContact NE2-OE1 3.42Å; Q428-E432 VanDerWaalsContact NE2-OE1 3.1Å; Q428-E432 WeakPolarHBondContact O-CG 3.39Å; Q428-E432 PolarHBondContact O-N 2.89Å
429	R	94.6	Very high	92.8	Very high	147 Å²	147	96.6 Å²	96.6	56%	0.555	49%	0.485	S	S	*	.	H	α-helix	trans	-68.8	-32.4	178.4	-74.4	179.5	-68.8	145.7	-2.9	113.2	A425 E426 H433	A425-R429 WeakPolarHBondContact O-CG 3.48Å; A425-R429 PolarHBondContact O-NE 3.45Å; E426-R429 PolarHBondContact O-N 2.66Å; R429-H433 WeakPolarHBondContact O-CB 3.47Å; R429-H433 PolarHBondContact O-N 2.94Å
430	E	93.9	Very high	92.1	Very high	107 Å²	107	96.8 Å²	96.8	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-69.5	-35.8	173.8	-158.4	-164.4	163.6	0	0	111.6	E426 A427 Q428 K434	E426-E430 PolarHBondContact O-N 3.25Å; A427-E430 PolarHBondContact O-N 2.9Å; Q428-E430 PolarHBondContact O-N 3.2Å; E430-K434 WeakPolarHBondContact O-CB 3.29Å; E430-K434 VanDerWaalsContact O-CG 3.27Å; E430-K434 WeakPolarHBondContact O-CG 3.39Å; E430-K434 PolarHBondContact O-N 2.99Å; E430-K434 WeakPolarHBondContact OE1-CE 3.32Å; E430-K434 IonicContact OE1-NZ 3.67Å; E430-K434 PolarHBondContact OE1-NZ 3.17Å; E430-K434 IonicContact OE2-NZ 2.62Å
431	L	91.2	Very high	91.2	Very high	114 Å²	114	100.1 Å²	100.1	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-66.9	-45.5	173.4	-178.8	65.4	0	0	0	111.5	A427 Q428 K434 N435	A427-L431 WeakPolarHBondContact O-CB 3.48Å; A427-L431 PolarHBondContact O-N 3.24Å; Q428-L431 WeakPolarHBondContact O-CB 3.39Å; Q428-L431 PolarHBondContact O-N 2.94Å; L431-K434 PolarHBondContact O-N 3.01Å; L431-N435 WeakPolarHBondContact O-CB 3.28Å; L431-N435 PolarHBondContact O-N 2.72Å
432	E	92.8	Very high	90.2	Very high	91 Å²	91	100.6 Å²	100.6	43%	0.425	50%	0.498	S	S	.	.	H	α-helix	trans	-56.9	-51.6	174	-73.3	158.8	-174.8	0	0	110.6	Q428 K434 N435 D436	Q428-E432 WeakPolarHBondContact CG-OE1 3.44Å; Q428-E432 PolarHBondContact NE2-OE1 3.42Å; Q428-E432 VanDerWaalsContact NE2-OE1 3.1Å; Q428-E432 WeakPolarHBondContact O-CG 3.39Å; Q428-E432 PolarHBondContact O-N 2.89Å; E432-K434 VanDerWaalsContact C-N 3.34Å; E432-K434 PolarHBondContact O-N 2.94Å; E432-N435 WeakPolarHBondContact O-CA 3.29Å; E432-N435 WeakPolarHBondContact O-CB 3.3Å; E432-N435 PolarHBondContact O-N 3.48Å; E432-D436 PolarHBondContact O-N 3.25Å
433	H	93	Very high	89	Confident	108 Å²	108	98.2 Å²	98.2	50%	0.5	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-38.1	177.7	179.3	47.7	0	0	0	113.7	R429 D436 M437	R429-H433 WeakPolarHBondContact O-CB 3.47Å; R429-H433 PolarHBondContact O-N 2.94Å; H433-D436 PolarHBondContact O-N 3.25Å; H433-M437 WeakPolarHBondContact O-CG 3.47Å; H433-M437 PolarHBondContact O-N 3.41Å
434	K	91.4	Very high	87.7	Confident	98 Å²	98	101.4 Å²	101.4	43%	0.426	50%	0.501	S	S	.	.	H	α-helix	trans	-68.1	-36.6	173.8	-75.4	168.6	-174.3	166.5	0	112.1	E430 L431 E432 M437 L438	E430-K434 WeakPolarHBondContact O-CB 3.29Å; E430-K434 VanDerWaalsContact O-CG 3.27Å; E430-K434 WeakPolarHBondContact O-CG 3.39Å; E430-K434 PolarHBondContact O-N 2.99Å; E430-K434 WeakPolarHBondContact OE1-CE 3.32Å; E430-K434 IonicContact OE1-NZ 3.67Å; E430-K434 PolarHBondContact OE1-NZ 3.17Å; E430-K434 IonicContact OE2-NZ 2.62Å; L431-K434 PolarHBondContact O-N 3.01Å; E432-K434 VanDerWaalsContact C-N 3.34Å; E432-K434 PolarHBondContact O-N 2.94Å; K434-M437 HydrophobicContact CG-CE 4.32Å; K434-M437 PolarHBondContact O-N 2.83Å; K434-L438 WeakPolarHBondContact O-CB 3.32Å; K434-L438 WeakPolarHBondContact O-CG 3.39Å; K434-L438 PolarHBondContact O-N 3.07Å
435	N	92.4	Very high	85.8	Confident	89 Å²	89	102 Å²	102	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-41.7	175.1	-173.6	79.6	0	0	0	111.2	L431 E432 L438 Q439	L431-N435 WeakPolarHBondContact O-CB 3.28Å; L431-N435 PolarHBondContact O-N 2.72Å; E432-N435 WeakPolarHBondContact O-CA 3.29Å; E432-N435 WeakPolarHBondContact O-CB 3.3Å; E432-N435 PolarHBondContact O-N 3.48Å; N435-L438 PolarHBondContact O-N 3.28Å; N435-Q439 WeakPolarHBondContact O-CB 3.46Å; N435-Q439 PolarHBondContact O-N 2.78Å
436	D	91.8	Very high	83.6	Confident	94 Å²	94	106.2 Å²	106.2	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-45.6	173.9	-65.6	-20.7	0	0	0	111.5	E432 H433 L438 Q439 E440	E432-D436 PolarHBondContact O-N 3.25Å; H433-D436 PolarHBondContact O-N 3.25Å; D436-L438 PolarHBondContact O-N 3.34Å; D436-Q439 PolarHBondContact O-N 2.83Å; D436-E440 PolarHBondContact O-N 2.97Å
437	M	88.1	Confident	81.2	Confident	86 Å²	86	111.7 Å²	111.7	42%	0.424	55%	0.549	S	S	.	.	H	α-helix	trans	-63	-39.3	174.9	-74.2	-164.3	-65.2	0	0	112.7	H433 K434 Q439 E440 L441	H433-M437 WeakPolarHBondContact O-CG 3.47Å; H433-M437 PolarHBondContact O-N 3.41Å; K434-M437 HydrophobicContact CG-CE 4.32Å; K434-M437 PolarHBondContact O-N 2.83Å; M437-Q439 VanDerWaalsContact C-N 3.35Å; M437-E440 PolarHBondContact O-N 2.91Å; M437-L441 WeakPolarHBondContact O-CB 3.24Å; M437-L441 VanDerWaalsContact O-CG 3.31Å; M437-L441 WeakPolarHBondContact O-CG 3.35Å; M437-L441 PolarHBondContact O-N 3.46Å
438	L	84.3	Confident	78.6	Confident	101 Å²	101	117.8 Å²	117.8	53%	0.529	57%	0.568	S	S	.	*	H	α-helix	trans	-64.9	-39.8	173.8	-75.8	169.4	0	0	0	111.4	K434 N435 D436 L441 M442	K434-L438 WeakPolarHBondContact O-CB 3.32Å; K434-L438 WeakPolarHBondContact O-CG 3.39Å; K434-L438 PolarHBondContact O-N 3.07Å; N435-L438 PolarHBondContact O-N 3.28Å; D436-L438 PolarHBondContact O-N 3.34Å; L438-L441 PolarHBondContact O-N 3.19Å; L438-M442 WeakPolarHBondContact O-CB 3.47Å; L438-M442 WeakPolarHBondContact O-CG 3.5Å; L438-M442 PolarHBondContact O-N 3.4Å
439	Q	84.6	Confident	76.1	Confident	111 Å²	111	120.9 Å²	120.9	52%	0.519	59%	0.586	S	S	.	*	H	α-helix	trans	-67.1	-37.1	175.7	-174.4	169.2	-15.4	0	0	111.9	N435 D436 M437 S443	N435-Q439 WeakPolarHBondContact O-CB 3.46Å; N435-Q439 PolarHBondContact O-N 2.78Å; D436-Q439 PolarHBondContact O-N 2.83Å; M437-Q439 VanDerWaalsContact C-N 3.35Å; Q439-S443 WeakPolarHBondContact O-CB 3.37Å; Q439-S443 PolarHBondContact O-N 3.22Å; Q439-S443 PolarHBondContact O-OG 3.2Å
440	E	83.1	Confident	74	Confident	98 Å²	98	119.5 Å²	119.5	46%	0.458	60%	0.596	S	S	.	*	H	α-helix	trans	-66.6	-43.8	172.9	-156.6	-161.2	155.8	0	0	111.4	D436 M437 S443 R444	D436-E440 PolarHBondContact O-N 2.97Å; M437-E440 PolarHBondContact O-N 2.91Å; E440-S443 WeakPolarHBondContact O-CB 3.31Å; E440-S443 PolarHBondContact O-N 2.99Å; E440-R444 WeakPolarHBondContact O-CG 3.41Å; E440-R444 PolarHBondContact O-N 3.44Å; E440-R444 IonicContact OE1-CZ 2.78Å; E440-R444 IonicContact OE1-NE 2.65Å; E440-R444 PolarHBondContact OE1-NE 2.75Å; E440-R444 IonicContact OE1-NH2 3.8Å; E440-R444 PolarHBondContact OE1-NH2 2.69Å
441	L	76.8	Confident	71.7	Confident	107 Å²	107	120.8 Å²	120.8	56%	0.56	61%	0.611	S	S	*	*	H	α-helix	trans	-62.3	-42.6	175.5	-73.7	170.9	0	0	0	112.2	M437 L438 S443 R444 N445	M437-L441 WeakPolarHBondContact O-CB 3.24Å; M437-L441 VanDerWaalsContact O-CG 3.31Å; M437-L441 WeakPolarHBondContact O-CG 3.35Å; M437-L441 PolarHBondContact O-N 3.46Å; L438-L441 PolarHBondContact O-N 3.19Å; L441-S443 VanDerWaalsContact C-N 3.34Å; L441-R444 PolarHBondContact O-N 3.23Å; L441-N445 PolarHBondContact O-N 3.18Å; L441-N445 VanDerWaalsContact O-N 3.12Å
442	M	72.8	Confident	68.7	Low	118 Å²	118	121.2 Å²	121.2	58%	0.581	62%	0.623	S	S	*	*	H	α-helix	trans	-62.5	-41.2	172.7	-73.9	-172.4	-66.1	0	0	111.7	L438 R444 N445 L446	L438-M442 WeakPolarHBondContact O-CB 3.47Å; L438-M442 WeakPolarHBondContact O-CG 3.5Å; L438-M442 PolarHBondContact O-N 3.4Å; M442-R444 PolarHBondContact O-N 3.47Å; M442-N445 PolarHBondContact O-N 2.92Å; M442-N445 VanDerWaalsContact O-N 3.14Å; M442-L446 PolarHBondContact O-N 2.95Å
443	S	72.7	Confident	66.1	Low	74 Å²	74	121.3 Å²	121.3	52%	0.517	64%	0.64	S	S	.	*	H	α-helix	trans	-64.3	-38.5	177.4	-57.5	0	0	0	0	112.4	Q439 E440 L441 N445 L446	Q439-S443 WeakPolarHBondContact O-CB 3.37Å; Q439-S443 PolarHBondContact O-N 3.22Å; Q439-S443 PolarHBondContact O-OG 3.2Å; E440-S443 WeakPolarHBondContact O-CB 3.31Å; E440-S443 PolarHBondContact O-N 2.99Å; L441-S443 VanDerWaalsContact C-N 3.34Å; S443-N445 VanDerWaalsContact C-N 3.28Å; S443-N445 PolarHBondContact O-N 2.92Å; S443-L446 PolarHBondContact O-N 3.26Å
444	R	67.6	Low	63.3	Low	180 Å²	180	124.5 Å²	124.5	68%	0.679	66%	0.655	S	S	*	*	H	α-helix	trans	-68.9	-23.2	173.8	-70.3	173.4	-179.3	-149.6	7.1	113.3	E440 L441 M442	E440-R444 WeakPolarHBondContact O-CG 3.41Å; E440-R444 PolarHBondContact O-N 3.44Å; E440-R444 IonicContact OE1-CZ 2.78Å; E440-R444 IonicContact OE1-NE 2.65Å; E440-R444 PolarHBondContact OE1-NE 2.75Å; E440-R444 IonicContact OE1-NH2 3.8Å; E440-R444 PolarHBondContact OE1-NH2 2.69Å; L441-R444 PolarHBondContact O-N 3.23Å; M442-R444 PolarHBondContact O-N 3.47Å
445	N	54.4	Low	60.4	Low	146 Å²	146	126.2 Å²	126.2	78%	0.781	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-1.2	176.4	-126	4.9	0	0	0	113.3	L441 M442 S443 Q447	L441-N445 PolarHBondContact O-N 3.18Å; L441-N445 VanDerWaalsContact O-N 3.12Å; M442-N445 PolarHBondContact O-N 2.92Å; M442-N445 VanDerWaalsContact O-N 3.14Å; S443-N445 VanDerWaalsContact C-N 3.28Å; S443-N445 PolarHBondContact O-N 2.92Å; N445-Q447 PolarHBondContact O-N 3.48Å
446	L	48.3	Very low	57.7	Low	137 Å²	137	129.7 Å²	129.7	72%	0.717	69%	0.688	S	S	*	*			trans	-98.4	40.3	-169.4	-121.2	160.8	0	0	0	113.1	M442 S443	M442-L446 PolarHBondContact O-N 2.95Å; S443-L446 PolarHBondContact O-N 3.26Å
447	Q	45	Very low	54.9	Low	186 Å²	186	127.8 Å²	127.8	87%	0.869	69%	0.69	S	S	*	*			trans	-121.9	33.1	-179.9	-161.6	150.8	25.9	0	0	114.2	N445	N445-Q447 PolarHBondContact O-N 3.48Å
448	E	39.3	Very low	52.4	Low	186 Å²	186	133.9 Å²	133.9	87%	0.869	71%	0.71	S	S	*	*	S	Bend	trans	-143.6	168	155.9	-110.9	165.2	-150.5	0	0	110.1
449	I	39.3	Very low	49.9	Very low	160 Å²	160	134.5 Å²	134.5	82%	0.821	72%	0.723	S	S	*	*			trans	-124.6	171	-153.1	0.2	175	0	0	0	111.4
450	P	52.2	Low	47.5	Very low	118 Å²	118	139.5 Å²	139.5	77%	0.766	74%	0.739	S	S	*	*			cis	-130.8	-172.5	-19.5	38.9	-20.2	0	0	0	114.7
451	V	44.8	Very low	45	Very low	134 Å²	134	139.7 Å²	139.7	81%	0.812	75%	0.751	S	S	*	*			trans	-49.8	142.8	171.7	-177.6	0	0	0	0	115.1
452	S	28.6	Very low	42.7	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	76%	0.757	S	S	*	*			trans	-156.9	168.9	148.8	-82.4	0	0	0	0	111.2
453	A	38.5	Very low	40.7	Very low	93 Å²	93	139.1 Å²	139.1	77%	0.769	77%	0.766	S	S	*	*			trans	-116	-172.2	-163.6	0	0	0	0	0	114.6
454	E	33	Very low	39.1	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	78%	0.779	S	S	*	*			trans	92.1	133.4	169.1	-53.6	-164.4	167.4	0	0	119.1
455	N	31.1	Very low	37.5	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	78%	0.781	S	S	*	*			trans	34.9	128.3	149.2	-58	-37.9	0	0	0	119.3
456	N	35.9	Very low	36.8	Very low	163 Å²	163	137.2 Å²	137.2	87%	0.872	78%	0.782	S	S	*	*				-160	166.7	53	-119.8	-42.9	0	0	0	113.3
457	G	32.4	Very low	36.5	Very low	54 Å²	54	134.9 Å²	134.9	56%	0.557	78%	0.777	S	S	*	*			trans	-83.2	167	-170	0	0	0	0	0	116.5
458	Y	35.4	Very low	36.8	Very low	213 Å²	213	131.3 Å²	131.3	84%	0.835	77%	0.767	S	S	*	*			trans	-162	77.4	138.1	-98.9	-64.5	0	0	0	110	Y460	Y458-Y460 PolarHBondContact O-N 3.39Å
459	S	32.4	Very low	37.5	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	75%	0.745	S	S	*	*			trans	-77.2	99.2	172.8	-59.6	0	0	0	0	110.3	S461	S459-S461 PolarHBondContact O-N 3Å
460	Y	33.4	Very low	38.3	Very low	216 Å²	216	118.8 Å²	118.8	85%	0.847	72%	0.719	S	S	*	*			trans	-71.4	77.8	167.5	-88.2	-88.5	0	0	0	110.5	Y458 G462	Y458-Y460 PolarHBondContact O-N 3.39Å; Y460-G462 PolarHBondContact O-N 3.13Å
461	S	30.8	Very low	38.6	Very low	102 Å²	102	119 Å²	119	71%	0.713	71%	0.709	S	S	*	*			trans	-72.7	73.2	167.7	61.2	0	0	0	0	109.9	S459 N463	S459-S461 PolarHBondContact O-N 3Å; S461-N463 PolarHBondContact O-N 3.41Å
462	G	28.7	Very low	39.3	Very low	68 Å²	68	115.3 Å²	115.3	70%	0.701	69%	0.694	S	S	*	*			trans	-69.6	76.4	175.9	0	0	0	0	0	111.6	Y460 P464	Y460-G462 PolarHBondContact O-N 3.13Å; G462-P464 WeakPolarHBondContact O-CD 3.48Å
463	N	31.3	Very low	41.2	Very low	144 Å²	144	114.6 Å²	114.6	77%	0.77	68%	0.676	S	S	*	*			trans	-57.7	120.5	164.4	-80.6	-14.1	0	0	0	108.2	S461 T465	S461-N463 PolarHBondContact O-N 3.41Å; N463-T465 PolarHBondContact O-N 2.92Å; N463-T465 VanDerWaalsContact O-N 3.09Å
464	P	37.9	Very low	42.7	Very low	120 Å²	120	116.3 Å²	116.3	78%	0.779	67%	0.669	S	S	*	*			trans	-66.5	114.1	174.4	26.6	-32.2	0	0	0	108.8	G462	G462-P464 WeakPolarHBondContact O-CD 3.48Å
465	T	35.4	Very low	44.5	Very low	118 Å²	118	109.1 Å²	109.1	72%	0.724	64%	0.636	S	S	*	*			trans	-55.4	129	160.7	47.1	0	0	0	0	108	N463 S467	N463-T465 PolarHBondContact O-N 2.92Å; N463-T465 VanDerWaalsContact O-N 3.09Å; T465-S467 PolarHBondContact O-N 3.44Å
466	P	39.9	Very low	46.6	Very low	123 Å²	123	106.2 Å²	106.2	80%	0.799	62%	0.619	S	S	*	*			trans	-66	98.7	177.4	26.4	-33.3	0	0	0	109.3	V468	P466-V468 PolarHBondContact O-N 3.15Å
467	S	40.3	Very low	48.7	Very low	88 Å²	88	104 Å²	104	62%	0.615	61%	0.606	S	S	*	*			trans	-69.7	109.3	178.6	46.6	0	0	0	0	109.3	T465 S469 G470	T465-S467 PolarHBondContact O-N 3.44Å; S467-S469 PolarHBondContact O-N 3.08Å; S467-G470 PolarHBondContact O-N 2.92Å
468	V	51.4	Low	50.9	Low	110 Å²	110	106.2 Å²	106.2	67%	0.667	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-1.2	-171.7	-174.4	0	0	0	0	113.4	P466	P466-V468 PolarHBondContact O-N 3.15Å
469	S	55.6	Low	53.1	Low	58 Å²	58	100.1 Å²	100.1	41%	0.406	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.7	-33.9	176.8	69.6	0	0	0	0	113.5	S467 Q471 A472 E473	S467-S469 PolarHBondContact O-N 3.08Å; S469-Q471 VanDerWaalsContact C-N 3.31Å; S469-Q471 PolarHBondContact O-N 2.95Å; S469-A472 WeakPolarHBondContact O-CA 3.39Å; S469-A472 WeakPolarHBondContact O-CB 3.28Å; S469-A472 PolarHBondContact O-N 3.31Å; S469-E473 WeakPolarHBondContact CB-OE1 3.4Å; S469-E473 WeakPolarHBondContact O-CG 3.38Å; S469-E473 PolarHBondContact O-N 3.37Å; S469-E473 PolarHBondContact OG-OE1 2.85Å
470	G	55.7	Low	55.3	Low	26 Å²	26	97.6 Å²	97.6	27%	0.268	56%	0.558	S	S	.	*	H	α-helix	trans	-56.2	-39.4	-172.8	0	0	0	0	0	114.4	S467 A472 E473 E474	S467-G470 PolarHBondContact O-N 2.92Å; G470-A472 VanDerWaalsContact C-N 3.31Å; G470-A472 PolarHBondContact O-N 3.04Å; G470-E473 PolarHBondContact O-N 3.42Å; G470-E474 WeakPolarHBondContact O-CB 3.44Å; G470-E474 WeakPolarHBondContact O-CG 3.41Å; G470-E474 PolarHBondContact O-N 3.43Å
471	Q	57	Low	57.6	Low	121 Å²	121	90.1 Å²	90.1	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-74.9	-18.5	178.6	-163.1	170	41.1	0	0	113.4	S469 V475	S469-Q471 VanDerWaalsContact C-N 3.31Å; S469-Q471 PolarHBondContact O-N 2.95Å; Q471-V475 VanDerWaalsContact O-CG2 3.27Å; Q471-V475 WeakPolarHBondContact O-CG2 3.4Å
472	A	59.8	Low	60	Low	58 Å²	58	86.2 Å²	86.2	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-83.9	-38.6	168.7	0	0	0	0	0	111.2	S469 G470 V475 Q476	S469-A472 WeakPolarHBondContact O-CA 3.39Å; S469-A472 WeakPolarHBondContact O-CB 3.28Å; S469-A472 PolarHBondContact O-N 3.31Å; G470-A472 VanDerWaalsContact C-N 3.31Å; G470-A472 PolarHBondContact O-N 3.04Å; A472-V475 PolarHBondContact O-N 3.06Å; A472-Q476 WeakPolarHBondContact O-CB 3.5Å; A472-Q476 PolarHBondContact O-N 2.89Å
473	E	68.2	Low	62.6	Low	107 Å²	107	87.8 Å²	87.8	50%	0.5	50%	0.496	S	S	.	.	H	α-helix	trans	-61.2	-47.5	174.8	-69.4	164.5	-142.1	0	0	111.6	S469 G470 V475 Q476 L477	S469-E473 WeakPolarHBondContact CB-OE1 3.4Å; S469-E473 WeakPolarHBondContact O-CG 3.38Å; S469-E473 PolarHBondContact O-N 3.37Å; S469-E473 PolarHBondContact OG-OE1 2.85Å; G470-E473 PolarHBondContact O-N 3.42Å; E473-V475 VanDerWaalsContact C-N 3.34Å; E473-V475 PolarHBondContact O-N 2.85Å; E473-Q476 PolarHBondContact O-N 3.22Å; E473-L477 WeakPolarHBondContact O-CB 3.39Å; E473-L477 VanDerWaalsContact O-CG 3.26Å; E473-L477 WeakPolarHBondContact O-CG 3.35Å; E473-L477 PolarHBondContact O-N 3.49Å
474	E	71.2	Confident	65.1	Low	129 Å²	129	84.4 Å²	84.4	60%	0.603	48%	0.484	S	S	*	.	H	α-helix	trans	-55.7	-45.2	175.4	-78.2	176.2	174.6	0	0	112.6	G470 L477 L478	G470-E474 WeakPolarHBondContact O-CB 3.44Å; G470-E474 WeakPolarHBondContact O-CG 3.41Å; G470-E474 PolarHBondContact O-N 3.43Å; E474-L477 PolarHBondContact O-N 2.83Å; E474-L478 PolarHBondContact O-N 2.86Å
475	V	70.1	Confident	67	Low	24 Å²	24	82.5 Å²	82.5	15%	0.145	47%	0.467	C	S	.	.	H	α-helix	trans	-75.6	-31.1	-177.1	-178.2	0	0	0	0	111.5	Q471 A472 E473 L478 R479 I506 I510	Q471-V475 VanDerWaalsContact O-CG2 3.27Å; Q471-V475 WeakPolarHBondContact O-CG2 3.4Å; A472-V475 PolarHBondContact O-N 3.06Å; E473-V475 VanDerWaalsContact C-N 3.34Å; E473-V475 PolarHBondContact O-N 2.85Å; V475-L478 PolarHBondContact O-N 3.36Å; V475-R479 PolarHBondContact O-N 2.87Å; V475-R479 VanDerWaalsContact O-N 3.17Å; V475-I506 HydrophobicContact CG1-CG2 3.71Å; V475-I510 HydrophobicContact CB-CG1 4.48Å; V475-I510 HydrophobicContact CG1-CD1 3.91Å; V475-I510 HydrophobicContact CG1-CG1 3.51Å
476	Q	76.3	Confident	69.3	Low	73 Å²	73	79.9 Å²	79.9	34%	0.341	44%	0.444	S	S	.	.	H	α-helix	trans	-69.8	-42.7	170.7	177.9	57.2	37.2	0	0	111.6	A472 E473 L478 R479 D480	A472-Q476 WeakPolarHBondContact O-CB 3.5Å; A472-Q476 PolarHBondContact O-N 2.89Å; E473-Q476 PolarHBondContact O-N 3.22Å; Q476-L478 VanDerWaalsContact C-N 3.28Å; Q476-L478 PolarHBondContact O-N 3.39Å; Q476-R479 CarbonylContact O-C 3.59Å; Q476-R479 WeakPolarHBondContact O-CA 3.5Å; Q476-R479 WeakPolarHBondContact O-CB 3.44Å; Q476-R479 PolarHBondContact O-N 2.82Å; Q476-D480 VanDerWaalsContact NE2-CG 3.33Å; Q476-D480 PolarHBondContact NE2-OD1 3.15Å; Q476-D480 PolarHBondContact NE2-OD2 3.37Å; Q476-D480 PolarHBondContact O-N 2.7Å
477	L	79.8	Confident	71.2	Confident	117 Å²	117	80.9 Å²	80.9	61%	0.613	44%	0.441	S	S	*	.	H	α-helix	trans	-58.3	-39.6	172.3	-75.9	166.8	0	0	0	111.5	E473 E474 R479 D480 A481	E473-L477 WeakPolarHBondContact O-CB 3.39Å; E473-L477 VanDerWaalsContact O-CG 3.26Å; E473-L477 WeakPolarHBondContact O-CG 3.35Å; E473-L477 PolarHBondContact O-N 3.49Å; E474-L477 PolarHBondContact O-N 2.83Å; L477-R479 VanDerWaalsContact C-N 3.31Å; L477-R479 PolarHBondContact O-N 3.24Å; L477-D480 PolarHBondContact O-N 2.73Å; L477-A481 WeakPolarHBondContact O-CB 3.39Å; L477-A481 PolarHBondContact O-N 3.45Å
478	L	78.6	Confident	73.2	Confident	101 Å²	101	82.7 Å²	82.7	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-64.1	-35.9	175.4	-140.3	121.5	0	0	0	112.2	E474 V475 Q476 L482 I506	E474-L478 PolarHBondContact O-N 2.86Å; V475-L478 PolarHBondContact O-N 3.36Å; Q476-L478 VanDerWaalsContact C-N 3.28Å; Q476-L478 PolarHBondContact O-N 3.39Å; L478-L482 WeakPolarHBondContact O-CG 3.3Å; L478-L482 PolarHBondContact O-N 3.43Å; L478-I506 HydrophobicContact CD2-CD1 3.54Å; L478-I506 HydrophobicContact CD2-CG1 4.37Å
479	R	80.6	Confident	74.5	Confident	85 Å²	85	80.1 Å²	80.1	32%	0.321	42%	0.424	S	S	.	.	H	α-helix	trans	-72.4	-36.9	175.2	-166.8	-177.7	-175.3	-173	5.7	112.6	V475 Q476 L477 L482 R483	V475-R479 PolarHBondContact O-N 2.87Å; V475-R479 VanDerWaalsContact O-N 3.17Å; Q476-R479 CarbonylContact O-C 3.59Å; Q476-R479 WeakPolarHBondContact O-CA 3.5Å; Q476-R479 WeakPolarHBondContact O-CB 3.44Å; Q476-R479 PolarHBondContact O-N 2.82Å; L477-R479 VanDerWaalsContact C-N 3.31Å; L477-R479 PolarHBondContact O-N 3.24Å; R479-L482 PolarHBondContact O-N 3.06Å; R479-R483 PolarHBondContact O-N 3.29Å
480	D	79.2	Confident	75.6	Confident	62 Å²	62	87.3 Å²	87.3	33%	0.332	44%	0.442	S	S	.	.	H	α-helix	trans	-69.8	-36.8	174.1	-69.6	-38.7	0	0	0	111.3	Q476 L477 R483 S484	Q476-D480 VanDerWaalsContact NE2-CG 3.33Å; Q476-D480 PolarHBondContact NE2-OD1 3.15Å; Q476-D480 PolarHBondContact NE2-OD2 3.37Å; Q476-D480 PolarHBondContact O-N 2.7Å; L477-D480 PolarHBondContact O-N 2.73Å; D480-R483 PolarHBondContact O-N 2.83Å; D480-R483 IonicContact OD1-CZ 2.61Å; D480-R483 IonicContact OD1-NH1 2.66Å; D480-R483 PolarHBondContact OD1-NH1 2.97Å; D480-R483 IonicContact OD1-NH2 3.37Å; D480-R483 PolarHBondContact OD1-NH2 3.19Å; D480-S484 WeakPolarHBondContact O-CB 3.41Å; D480-S484 PolarHBondContact O-N 3.17Å
481	A	82.5	Confident	76.4	Confident	58 Å²	58	93.2 Å²	93.2	48%	0.479	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-42.8	171.4	0	0	0	0	0	112.4	L477 S484 L485	L477-A481 WeakPolarHBondContact O-CB 3.39Å; L477-A481 PolarHBondContact O-N 3.45Å; A481-S484 PolarHBondContact O-N 3.03Å; A481-L485 WeakPolarHBondContact O-CB 3.47Å; A481-L485 PolarHBondContact O-N 3.49Å
482	L	81.4	Confident	77.2	Confident	21 Å²	21	96.3 Å²	96.3	11%	0.11	48%	0.481	C	S	.	.	H	α-helix	trans	-64.6	-41.4	174.9	-76.8	169.4	0	0	0	112.7	L478 R479 S484 L485 R486 L499 L502 E503 I506	L478-L482 WeakPolarHBondContact O-CG 3.3Å; L478-L482 PolarHBondContact O-N 3.43Å; R479-L482 PolarHBondContact O-N 3.06Å; L482-S484 VanDerWaalsContact C-N 3.33Å; L482-S484 PolarHBondContact O-N 3.48Å; L482-L485 HydrophobicContact CD2-CD2 4.45Å; L482-L485 PolarHBondContact O-N 3.26Å; L482-R486 WeakPolarHBondContact O-CB 3.48Å; L482-R486 PolarHBondContact O-N 2.93Å; L482-L499 HydrophobicContact CD2-CD2 3.85Å; L482-L502 HydrophobicContact CD1-CB 4.39Å; L482-E503 HydrophobicContact CB-CG 4.36Å; L482-E503 HydrophobicContact CD1-CG 4.17Å; L482-I506 HydrophobicContact CD1-CD1 3.31Å
483	R	82.1	Confident	78.2	Confident	100 Å²	100	95.8 Å²	95.8	38%	0.377	47%	0.47	S	S	.	.	H	α-helix	trans	-65.2	-34.6	173.1	-84.9	-170.2	-89	90.7	5.8	113	R479 D480 E503	R479-R483 PolarHBondContact O-N 3.29Å; D480-R483 PolarHBondContact O-N 2.83Å; D480-R483 IonicContact OD1-CZ 2.61Å; D480-R483 IonicContact OD1-NH1 2.66Å; D480-R483 PolarHBondContact OD1-NH1 2.97Å; D480-R483 IonicContact OD1-NH2 3.37Å; D480-R483 PolarHBondContact OD1-NH2 3.19Å; R483-E503 WeakPolarHBondContact CG-OE1 3.32Å
484	S	83.4	Confident	78.4	Confident	74 Å²	74	95.6 Å²	95.6	52%	0.517	48%	0.478	S	S	.	.	H	α-helix	trans	-68.2	-40.4	172.2	-167.5	0	0	0	0	111.9	D480 A481 L482 I487 N488	D480-S484 WeakPolarHBondContact O-CB 3.41Å; D480-S484 PolarHBondContact O-N 3.17Å; A481-S484 PolarHBondContact O-N 3.03Å; L482-S484 VanDerWaalsContact C-N 3.33Å; L482-S484 PolarHBondContact O-N 3.48Å; S484-I487 PolarHBondContact O-N 3.07Å; S484-N488 PolarHBondContact O-ND2 3.36Å; S484-N488 VanDerWaalsContact O-ND2 3.07Å
485	L	79.3	Confident	78.7	Confident	80 Å²	80	94.3 Å²	94.3	42%	0.419	47%	0.473	S	S	.	.	H	α-helix	trans	-62.3	-44.1	176.4	-177.9	61.6	0	0	0	111.7	A481 L482 I487 N488 F489 L499	A481-L485 WeakPolarHBondContact O-CB 3.47Å; A481-L485 PolarHBondContact O-N 3.49Å; L482-L485 HydrophobicContact CD2-CD2 4.45Å; L482-L485 PolarHBondContact O-N 3.26Å; L485-I487 PolarHBondContact O-N 3.14Å; L485-I487 VanDerWaalsContact O-N 3.14Å; L485-N488 WeakPolarHBondContact O-CB 3.3Å; L485-N488 PolarHBondContact O-N 2.73Å; L485-N488 PolarHBondContact O-ND2 2.72Å; L485-N488 VanDerWaalsContact O-ND2 3.08Å; L485-F489 HydrophobicContact CD1-CE2 4.15Å; L485-F489 HydrophobicContact CG-CE2 4.07Å; L485-L499 HydrophobicContact CD2-CD2 4.05Å
486	R	82.5	Confident	79.2	Confident	63 Å²	63	94.4 Å²	94.4	24%	0.238	47%	0.471	C	S	.	.	H	α-helix	trans	-52	-33.4	177.5	174.3	170.7	-92.2	151.4	-16.1	113.8	L482 N488 F489 L499 D500 E503	L482-R486 WeakPolarHBondContact O-CB 3.48Å; L482-R486 PolarHBondContact O-N 2.93Å; R486-N488 PolarHBondContact O-N 3.08Å; R486-F489 PolarHBondContact O-N 2.96Å; R486-F489 VanDerWaalsContact O-N 3.17Å; R486-L499 HydrophobicContact CB-CD1 4.2Å; R486-D500 IonicContact CZ-OD1 3.19Å; R486-D500 IonicContact NH2-OD1 2.56Å; R486-D500 PolarHBondContact NH2-OD1 2.88Å; R486-D500 IonicContact NH2-OD2 2.72Å; R486-D500 PolarHBondContact NH2-OD2 2.98Å; R486-E503 IonicContact CZ-OE2 2.67Å; R486-E503 IonicContact NH1-OE1 3.99Å; R486-E503 PolarHBondContact NH1-OE1 3.5Å; R486-E503 VanDerWaalsContact NH1-OE1 3.15Å; R486-E503 IonicContact NH1-OE2 3.11Å; R486-E503 PolarHBondContact NH1-OE2 2.79Å
487	I	80.1	Confident	79.3	Confident	143 Å²	143	96.9 Å²	96.9	73%	0.733	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.8	179	-62.2	167.7	0	0	0	112.4	S484 L485	S484-I487 PolarHBondContact O-N 3.07Å; L485-I487 PolarHBondContact O-N 3.14Å; L485-I487 VanDerWaalsContact O-N 3.14Å
488	N	81.8	Confident	79.4	Confident	127 Å²	127	94.4 Å²	94.4	68%	0.679	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-6.5	178.9	-57.3	-90.2	0	0	0	113.3	S484 L485 R486	S484-N488 PolarHBondContact O-ND2 3.36Å; S484-N488 VanDerWaalsContact O-ND2 3.07Å; L485-N488 WeakPolarHBondContact O-CB 3.3Å; L485-N488 PolarHBondContact O-N 2.73Å; L485-N488 PolarHBondContact O-ND2 2.72Å; L485-N488 VanDerWaalsContact O-ND2 3.08Å; R486-N488 PolarHBondContact O-N 3.08Å
489	F	79.6	Confident	79.7	Confident	55 Å²	55	90.2 Å²	90.2	24%	0.241	45%	0.451	C	S	.	.	S	Bend	trans	-109.2	140.7	180	-67.7	-80.1	0	0	0	111.1	L485 R486 D493 Q495 L499	L485-F489 HydrophobicContact CD1-CE2 4.15Å; L485-F489 HydrophobicContact CG-CE2 4.07Å; R486-F489 PolarHBondContact O-N 2.96Å; R486-F489 VanDerWaalsContact O-N 3.17Å; F489-D493 HydrophobicContact CB-CB 4.23Å; F489-D493 HydrophobicContact CD1-CB 4.43Å; F489-Q495 HydrophobicContact CE1-CB 4.36Å; F489-Q495 VanDerWaalsContact CE1-OE1 3.27Å; F489-L499 HydrophobicContact CD2-CD1 4.12Å; F489-L499 HydrophobicContact CE2-CD1 4.4Å
490	R	79.3	Confident	79.8	Confident	210 Å²	210	89.2 Å²	89.2	79%	0.792	45%	0.452	S	S	*	.			trans	-68.5	151.2	177.3	-63.8	179.6	177.6	-176	-1.9	110.5	H492 D493 H496	R490-H492 PolarHBondContact O-N 2.96Å; R490-D493 WeakPolarHBondContact O-CB 3.22Å; R490-D493 PolarHBondContact O-N 3Å; R490-H496 PolarHBondContact O-CD2 3.47Å; R490-H496 PolarHBondContact O-NE2 3.26Å
491	D	72.6	Confident	80.1	Confident	149 Å²	149	90.4 Å²	90.4	80%	0.797	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-7.7	-170.6	-52.4	-71.2	0	0	0	116.3
492	H	72.3	Confident	80.1	Confident	186 Å²	186	92.3 Å²	92.3	86%	0.861	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.4	17.8	-179.8	-58.5	-4.8	0	0	0	112.4	R490	R490-H492 PolarHBondContact O-N 2.96Å
493	D	80.5	Confident	80.3	Confident	47 Å²	47	92.7 Å²	92.7	25%	0.251	46%	0.464	S	S	.	.			trans	-69.2	129.2	176.5	-162.4	-58.6	0	0	0	111.2	F489 R490 Q495 H496	F489-D493 HydrophobicContact CB-CB 4.23Å; F489-D493 HydrophobicContact CD1-CB 4.43Å; R490-D493 WeakPolarHBondContact O-CB 3.22Å; R490-D493 PolarHBondContact O-N 3Å; D493-Q495 PolarHBondContact O-N 3.05Å; D493-Q495 VanDerWaalsContact OD1-CB 3.28Å; D493-Q495 WeakPolarHBondContact OD1-CB 3.44Å; D493-Q495 VanDerWaalsContact OD1-CG 3.32Å; D493-Q495 WeakPolarHBondContact OD1-CG 3.26Å; D493-Q495 PolarHBondContact OD1-N 2.92Å; D493-H496 PolarHBondContact O-CD2 3.41Å; D493-H496 VanDerWaalsContact O-CD2 3.28Å; D493-H496 PolarHBondContact O-N 2.9Å; D493-H496 VanDerWaalsContact O-N 3.07Å
494	P	74.3	Confident	80.2	Confident	103 Å²	103	94.3 Å²	94.3	67%	0.669	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.6	177.6	25.4	-35.5	0	0	0	113.6	H496 H497	P494-H496 VanDerWaalsContact C-N 3.25Å; P494-H496 PolarHBondContact O-N 3.11Å; P494-H497 PolarHBondContact O-ND1 3.35Å
495	Q	76.8	Confident	80	Confident	103 Å²	103	92.6 Å²	92.6	48%	0.481	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.2	176.2	-60.8	-176.6	27.4	0	0	113.6	F489 D493 H497 T498 L499	F489-Q495 HydrophobicContact CE1-CB 4.36Å; F489-Q495 VanDerWaalsContact CE1-OE1 3.27Å; D493-Q495 PolarHBondContact O-N 3.05Å; D493-Q495 VanDerWaalsContact OD1-CB 3.28Å; D493-Q495 WeakPolarHBondContact OD1-CB 3.44Å; D493-Q495 VanDerWaalsContact OD1-CG 3.32Å; D493-Q495 WeakPolarHBondContact OD1-CG 3.26Å; D493-Q495 PolarHBondContact OD1-N 2.92Å; Q495-H497 VanDerWaalsContact C-N 3.32Å; Q495-H497 PolarHBondContact O-N 3.26Å; Q495-T498 WeakPolarHBondContact CA-OG1 3.28Å; Q495-T498 PolarHBondContact O-N 2.84Å; Q495-T498 PolarHBondContact O-OG1 2.84Å; Q495-L499 PolarHBondContact O-N 3.49Å; Q495-L499 VanDerWaalsContact O-N 3.17Å
496	H	80.6	Confident	80.1	Confident	26 Å²	26	89.8 Å²	89.8	12%	0.12	46%	0.455	C	S	.	.	H	α-helix	trans	-61	-38.4	173	-75.6	-63.8	0	0	0	112.5	R490 D493 P494 T498 L499 D500	R490-H496 PolarHBondContact O-CD2 3.47Å; R490-H496 PolarHBondContact O-NE2 3.26Å; D493-H496 PolarHBondContact O-CD2 3.41Å; D493-H496 VanDerWaalsContact O-CD2 3.28Å; D493-H496 PolarHBondContact O-N 2.9Å; D493-H496 VanDerWaalsContact O-N 3.07Å; P494-H496 VanDerWaalsContact C-N 3.25Å; P494-H496 PolarHBondContact O-N 3.11Å; H496-T498 PolarHBondContact O-N 3.16Å; H496-L499 CarbonylContact O-C 3.56Å; H496-L499 WeakPolarHBondContact O-CA 3.24Å; H496-L499 WeakPolarHBondContact O-CB 3.34Å; H496-L499 PolarHBondContact O-N 3.15Å; H496-D500 PolarHBondContact O-N 3.46Å; H496-D500 VanDerWaalsContact O-OD2 3.1Å
497	H	78.8	Confident	80	Confident	124 Å²	124	89.1 Å²	89.1	57%	0.574	46%	0.458	S	S	*	.	H	α-helix	trans	-63.5	-31.5	179.8	96.2	-77.4	0	0	0	112.4	P494 Q495 T501	P494-H497 PolarHBondContact O-ND1 3.35Å; Q495-H497 VanDerWaalsContact C-N 3.32Å; Q495-H497 PolarHBondContact O-N 3.26Å; H497-T501 WeakPolarHBondContact O-CB 3.41Å; H497-T501 PolarHBondContact O-N 3.29Å; H497-T501 PolarHBondContact O-OG1 2.87Å
498	T	81.3	Confident	79.9	Confident	65 Å²	65	84.8 Å²	84.8	40%	0.399	44%	0.441	S	S	.	.	H	α-helix	trans	-71	-37.8	172.3	22.6	0	0	0	0	111.8	Q495 H496 T501 L502	Q495-T498 WeakPolarHBondContact CA-OG1 3.28Å; Q495-T498 PolarHBondContact O-N 2.84Å; Q495-T498 PolarHBondContact O-OG1 2.84Å; H496-T498 PolarHBondContact O-N 3.16Å; T498-T501 PolarHBondContact O-N 3.19Å; T498-L502 WeakPolarHBondContact O-CB 3.37Å; T498-L502 VanDerWaalsContact O-CG 3.28Å; T498-L502 WeakPolarHBondContact O-CG 3.37Å; T498-L502 PolarHBondContact O-N 3.4Å
499	L	85.4	Confident	79.7	Confident	14 Å²	14	82.3 Å²	82.3	7%	0.073	43%	0.427	C	S	.	.	H	α-helix	trans	-64.3	-43.7	172.1	-63.9	174.1	0	0	0	111.3	L482 L485 R486 F489 Q495 H496 T501 L502 E503	L482-L499 HydrophobicContact CD2-CD2 3.85Å; L485-L499 HydrophobicContact CD2-CD2 4.05Å; R486-L499 HydrophobicContact CB-CD1 4.2Å; F489-L499 HydrophobicContact CD2-CD1 4.12Å; F489-L499 HydrophobicContact CE2-CD1 4.4Å; Q495-L499 PolarHBondContact O-N 3.49Å; Q495-L499 VanDerWaalsContact O-N 3.17Å; H496-L499 CarbonylContact O-C 3.56Å; H496-L499 WeakPolarHBondContact O-CA 3.24Å; H496-L499 WeakPolarHBondContact O-CB 3.34Å; H496-L499 PolarHBondContact O-N 3.15Å; L499-T501 PolarHBondContact O-N 2.56Å; L499-L502 PolarHBondContact O-N 3.46Å; L499-E503 WeakPolarHBondContact O-CB 3.45Å; L499-E503 WeakPolarHBondContact O-CG 3.47Å; L499-E503 PolarHBondContact O-N 3.49Å
500	D	81.6	Confident	79.5	Confident	64 Å²	64	81.3 Å²	81.3	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-61.1	-42.3	174.3	-74.4	-54.4	0	0	0	112.3	R486 H496 L502 E503 Q504	R486-D500 IonicContact CZ-OD1 3.19Å; R486-D500 IonicContact NH2-OD1 2.56Å; R486-D500 PolarHBondContact NH2-OD1 2.88Å; R486-D500 IonicContact NH2-OD2 2.72Å; R486-D500 PolarHBondContact NH2-OD2 2.98Å; H496-D500 PolarHBondContact O-N 3.46Å; H496-D500 VanDerWaalsContact O-OD2 3.1Å; D500-L502 VanDerWaalsContact C-N 3.32Å; D500-L502 PolarHBondContact O-N 2.93Å; D500-E503 PolarHBondContact O-N 3.48Å; D500-Q504 WeakPolarHBondContact O-CB 3.27Å; D500-Q504 VanDerWaalsContact O-CG 3.24Å; D500-Q504 WeakPolarHBondContact O-CG 3.49Å; D500-Q504 PolarHBondContact O-N 3.01Å
501	T	85.1	Confident	79.2	Confident	87 Å²	87	75.9 Å²	75.9	53%	0.534	41%	0.41	S	S	.	.	H	α-helix	trans	-63.6	-38.4	176.9	-57.1	0	0	0	0	111.5	H497 T498 L499 G505	H497-T501 WeakPolarHBondContact O-CB 3.41Å; H497-T501 PolarHBondContact O-N 3.29Å; H497-T501 PolarHBondContact O-OG1 2.87Å; T498-T501 PolarHBondContact O-N 3.19Å; L499-T501 PolarHBondContact O-N 2.56Å; T501-G505 PolarHBondContact O-N 3.47Å
502	L	83.8	Confident	78.9	Confident	98 Å²	98	75 Å²	75	51%	0.513	40%	0.396	S	S	.	.	H	α-helix	trans	-71.3	-43.5	175.3	-70.7	169.6	0	0	0	112.1	L482 T498 L499 D500 Q504 G505 I506	L482-L502 HydrophobicContact CD1-CB 4.39Å; T498-L502 WeakPolarHBondContact O-CB 3.37Å; T498-L502 VanDerWaalsContact O-CG 3.28Å; T498-L502 WeakPolarHBondContact O-CG 3.37Å; T498-L502 PolarHBondContact O-N 3.4Å; L499-L502 PolarHBondContact O-N 3.46Å; D500-L502 VanDerWaalsContact C-N 3.32Å; D500-L502 PolarHBondContact O-N 2.93Å; L502-Q504 PolarHBondContact O-N 3.27Å; L502-G505 PolarHBondContact O-N 2.84Å; L502-I506 WeakPolarHBondContact O-CB 3.49Å; L502-I506 WeakPolarHBondContact O-CD1 3.4Å; L502-I506 VanDerWaalsContact O-CG1 3.32Å; L502-I506 WeakPolarHBondContact O-CG1 3.43Å; L502-I506 PolarHBondContact O-N 3.29Å
503	E	84.5	Confident	78.6	Confident	28 Å²	28	68.3 Å²	68.3	13%	0.131	37%	0.366	C	S	.	.	H	α-helix	trans	-61.9	-41.6	175.1	-76.8	-172.4	163.3	0	0	111.7	L482 R483 R486 L499 D500 I506 V507	L482-E503 HydrophobicContact CB-CG 4.36Å; L482-E503 HydrophobicContact CD1-CG 4.17Å; R483-E503 WeakPolarHBondContact CG-OE1 3.32Å; R486-E503 IonicContact CZ-OE2 2.67Å; R486-E503 IonicContact NH1-OE1 3.99Å; R486-E503 PolarHBondContact NH1-OE1 3.5Å; R486-E503 VanDerWaalsContact NH1-OE1 3.15Å; R486-E503 IonicContact NH1-OE2 3.11Å; R486-E503 PolarHBondContact NH1-OE2 2.79Å; L499-E503 WeakPolarHBondContact O-CB 3.45Å; L499-E503 WeakPolarHBondContact O-CG 3.47Å; L499-E503 PolarHBondContact O-N 3.49Å; D500-E503 PolarHBondContact O-N 3.48Å; E503-I506 PolarHBondContact O-N 2.95Å; E503-V507 WeakPolarHBondContact O-CB 3.33Å; E503-V507 WeakPolarHBondContact O-CG2 3.5Å; E503-V507 PolarHBondContact O-N 3.43Å
504	Q	80.1	Confident	77.8	Confident	134 Å²	134	71.5 Å²	71.5	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-65.2	-41	173	-72.2	175.6	29.7	0	0	112	D500 L502 I506 V507 S508	D500-Q504 WeakPolarHBondContact O-CB 3.27Å; D500-Q504 VanDerWaalsContact O-CG 3.24Å; D500-Q504 WeakPolarHBondContact O-CG 3.49Å; D500-Q504 PolarHBondContact O-N 3.01Å; L502-Q504 PolarHBondContact O-N 3.27Å; Q504-I506 VanDerWaalsContact C-N 3.3Å; Q504-I506 PolarHBondContact O-N 3.22Å; Q504-V507 PolarHBondContact O-N 3.49Å; Q504-S508 VanDerWaalsContact O-CB 3.28Å; Q504-S508 WeakPolarHBondContact O-CB 3.5Å; Q504-S508 PolarHBondContact O-N 3.37Å
505	G	79.4	Confident	76.9	Confident	38 Å²	38	70.6 Å²	70.6	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-59	-41.2	173.9	0	0	0	0	0	112.6	T501 L502 L509	T501-G505 PolarHBondContact O-N 3.47Å; L502-G505 PolarHBondContact O-N 2.84Å; G505-L509 WeakPolarHBondContact O-CB 3.34Å; G505-L509 PolarHBondContact O-N 3.25Å
506	I	81.3	Confident	75.8	Confident	21 Å²	21	71 Å²	71	11%	0.108	38%	0.381	C	S	.	.	H	α-helix	trans	-70.2	-47.1	176.5	-73.4	161.4	0	0	0	111.6	V475 L478 L482 L502 E503 Q504 S508 L509 I510	V475-I506 HydrophobicContact CG1-CG2 3.71Å; L478-I506 HydrophobicContact CD2-CD1 3.54Å; L478-I506 HydrophobicContact CD2-CG1 4.37Å; L482-I506 HydrophobicContact CD1-CD1 3.31Å; L502-I506 WeakPolarHBondContact O-CB 3.49Å; L502-I506 WeakPolarHBondContact O-CD1 3.4Å; L502-I506 VanDerWaalsContact O-CG1 3.32Å; L502-I506 WeakPolarHBondContact O-CG1 3.43Å; L502-I506 PolarHBondContact O-N 3.29Å; E503-I506 PolarHBondContact O-N 2.95Å; Q504-I506 VanDerWaalsContact C-N 3.3Å; Q504-I506 PolarHBondContact O-N 3.22Å; I506-S508 VanDerWaalsContact C-N 3.28Å; I506-S508 PolarHBondContact O-N 2.87Å; I506-L509 CarbonylContact O-C 3.54Å; I506-L509 WeakPolarHBondContact O-CA 3.42Å; I506-L509 WeakPolarHBondContact O-CB 3.37Å; I506-L509 PolarHBondContact O-N 3.18Å; I506-I510 HydrophobicContact CG2-CD1 3.99Å; I506-I510 HydrophobicContact CG2-CG1 4.44Å; I506-I510 WeakPolarHBondContact O-CG1 3.49Å; I506-I510 PolarHBondContact O-N 2.9Å
507	V	80.6	Confident	74.4	Confident	49 Å²	49	75.8 Å²	75.8	30%	0.297	40%	0.403	S	S	.	.	H	α-helix	trans	-57.7	-43.7	174.7	168	0	0	0	0	110.6	E503 Q504 L509 I510 D511	E503-V507 WeakPolarHBondContact O-CB 3.33Å; E503-V507 WeakPolarHBondContact O-CG2 3.5Å; E503-V507 PolarHBondContact O-N 3.43Å; Q504-V507 PolarHBondContact O-N 3.49Å; V507-L509 PolarHBondContact O-N 2.9Å; V507-I510 WeakPolarHBondContact O-CB 3.37Å; V507-I510 PolarHBondContact O-N 3.25Å; V507-D511 PolarHBondContact O-N 2.95Å
508	S	78.9	Confident	72.9	Confident	53 Å²	53	74.3 Å²	74.3	37%	0.371	40%	0.403	S	S	.	.	H	α-helix	trans	-65.3	-26.3	174.7	-167.1	0	0	0	0	113	Q504 I506 R512	Q504-S508 VanDerWaalsContact O-CB 3.28Å; Q504-S508 WeakPolarHBondContact O-CB 3.5Å; Q504-S508 PolarHBondContact O-N 3.37Å; I506-S508 VanDerWaalsContact C-N 3.28Å; I506-S508 PolarHBondContact O-N 2.87Å; S508-R512 WeakPolarHBondContact O-CB 3.37Å; S508-R512 VanDerWaalsContact O-CG 3.26Å; S508-R512 WeakPolarHBondContact O-CG 3.5Å; S508-R512 VanDerWaalsContact O-CZ 3.31Å; S508-R512 PolarHBondContact O-N 2.85Å; S508-R512 PolarHBondContact O-NH1 2.9Å; S508-R512 VanDerWaalsContact O-NH1 3.08Å; S508-R512 PolarHBondContact OG-NH1 3.42Å
509	L	77.8	Confident	70.8	Confident	75 Å²	75	77.7 Å²	77.7	39%	0.393	41%	0.414	S	S	.	.	H	α-helix	trans	-77.8	-39.6	174.4	-154.9	153.4	0	0	0	111.5	G505 I506 V507 R512 L513	G505-L509 WeakPolarHBondContact O-CB 3.34Å; G505-L509 PolarHBondContact O-N 3.25Å; I506-L509 CarbonylContact O-C 3.54Å; I506-L509 WeakPolarHBondContact O-CA 3.42Å; I506-L509 WeakPolarHBondContact O-CB 3.37Å; I506-L509 PolarHBondContact O-N 3.18Å; V507-L509 PolarHBondContact O-N 2.9Å; L509-R512 PolarHBondContact O-N 3.42Å; L509-L513 HydrophobicContact CD2-CD1 3.71Å; L509-L513 HydrophobicContact CD2-CG 4.16Å; L509-L513 WeakPolarHBondContact O-CG 3.49Å; L509-L513 PolarHBondContact O-N 3.28Å
510	I	75.6	Confident	68.8	Low	34 Å²	34	89.6 Å²	89.6	17%	0.174	46%	0.458	C	S	.	.	H	α-helix	trans	-59.4	-47.5	170.1	-65.5	167.7	0	0	0	110.2	V475 I506 V507 L513 H514	V475-I510 HydrophobicContact CB-CG1 4.48Å; V475-I510 HydrophobicContact CG1-CD1 3.91Å; V475-I510 HydrophobicContact CG1-CG1 3.51Å; I506-I510 HydrophobicContact CG2-CD1 3.99Å; I506-I510 HydrophobicContact CG2-CG1 4.44Å; I506-I510 WeakPolarHBondContact O-CG1 3.49Å; I506-I510 PolarHBondContact O-N 2.9Å; V507-I510 WeakPolarHBondContact O-CB 3.37Å; V507-I510 PolarHBondContact O-N 3.25Å; I510-L513 PolarHBondContact O-N 3.5Å; I510-H514 WeakPolarHBondContact CG2-ND1 3.36Å; I510-H514 PolarHBondContact O-N 3.38Å; I510-H514 PolarHBondContact O-ND1 3.3Å
511	D	71.3	Confident	66.4	Low	96 Å²	96	89.4 Å²	89.4	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-62.8	-43.6	177.1	-82.2	-9.4	0	0	0	111.5	V507 L513 H514 V515	V507-D511 PolarHBondContact O-N 2.95Å; D511-L513 VanDerWaalsContact C-N 3.33Å; D511-L513 PolarHBondContact O-N 3.17Å; D511-H514 PolarHBondContact O-N 2.87Å; D511-V515 WeakPolarHBondContact O-CB 3.49Å; D511-V515 VanDerWaalsContact O-CG2 3.26Å; D511-V515 WeakPolarHBondContact O-CG2 3.37Å; D511-V515 PolarHBondContact O-N 2.81Å
512	R	68	Low	63.9	Low	129 Å²	129	97.2 Å²	97.2	49%	0.487	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-40.9	174.2	-77.6	-173.9	-53.6	-89	4.2	112.1	S508 L509 V515 V516	S508-R512 WeakPolarHBondContact O-CB 3.37Å; S508-R512 VanDerWaalsContact O-CG 3.26Å; S508-R512 WeakPolarHBondContact O-CG 3.5Å; S508-R512 VanDerWaalsContact O-CZ 3.31Å; S508-R512 PolarHBondContact O-N 2.85Å; S508-R512 PolarHBondContact O-NH1 2.9Å; S508-R512 VanDerWaalsContact O-NH1 3.08Å; S508-R512 PolarHBondContact OG-NH1 3.42Å; L509-R512 PolarHBondContact O-N 3.42Å; R512-V515 PolarHBondContact O-N 2.67Å; R512-V516 WeakPolarHBondContact O-CB 3.47Å; R512-V516 WeakPolarHBondContact O-CG2 3.3Å; R512-V516 PolarHBondContact O-N 3.06Å
513	L	64.6	Low	61.6	Low	47 Å²	47	96 Å²	96	25%	0.246	50%	0.501	C	S	.	.	H	α-helix	trans	-63.5	-44.3	176	-77.3	169.7	0	0	0	111.5	L509 I510 D511 V516 H517	L509-L513 HydrophobicContact CD2-CD1 3.71Å; L509-L513 HydrophobicContact CD2-CG 4.16Å; L509-L513 WeakPolarHBondContact O-CG 3.49Å; L509-L513 PolarHBondContact O-N 3.28Å; I510-L513 PolarHBondContact O-N 3.5Å; D511-L513 VanDerWaalsContact C-N 3.33Å; D511-L513 PolarHBondContact O-N 3.17Å; L513-V516 PolarHBondContact O-N 2.92Å; L513-H517 PolarHBondContact O-N 3.33Å; L513-H517 PolarHBondContact O-ND1 3.4Å
514	H	63.3	Low	59.1	Low	114 Å²	114	104.8 Å²	104.8	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-64.5	-45	175.7	-73.5	96.3	0	0	0	112.4	I510 D511 V516 H517 T518	I510-H514 WeakPolarHBondContact CG2-ND1 3.36Å; I510-H514 PolarHBondContact O-N 3.38Å; I510-H514 PolarHBondContact O-ND1 3.3Å; D511-H514 PolarHBondContact O-N 2.87Å; H514-V516 VanDerWaalsContact C-N 3.32Å; H514-V516 PolarHBondContact O-N 2.99Å; H514-H517 WeakPolarHBondContact O-CA 3.29Å; H514-H517 PolarHBondContact O-N 3.16Å; H514-T518 PolarHBondContact O-N 2.86Å
515	V	56.8	Low	57.1	Low	84 Å²	84	103.6 Å²	103.6	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-64.3	-34	178.5	169.1	0	0	0	0	112.3	D511 R512 H517 T518 H519	D511-V515 WeakPolarHBondContact O-CB 3.49Å; D511-V515 VanDerWaalsContact O-CG2 3.26Å; D511-V515 WeakPolarHBondContact O-CG2 3.37Å; D511-V515 PolarHBondContact O-N 2.81Å; R512-V515 PolarHBondContact O-N 2.67Å; V515-H517 VanDerWaalsContact C-N 3.3Å; V515-H517 PolarHBondContact O-N 2.85Å; V515-T518 PolarHBondContact O-N 3.32Å; V515-T518 PolarHBondContact O-OG1 2.86Å; V515-H519 PolarHBondContact O-N 3.44Å
516	V	53.4	Low	55.3	Low	111 Å²	111	107.8 Å²	107.8	67%	0.673	57%	0.566	S	S	*	*	H	α-helix	trans	-65.1	-33.8	171.6	164	0	0	0	0	111.6	R512 L513 H514	R512-V516 WeakPolarHBondContact O-CB 3.47Å; R512-V516 WeakPolarHBondContact O-CG2 3.3Å; R512-V516 PolarHBondContact O-N 3.06Å; L513-V516 PolarHBondContact O-N 2.92Å; H514-V516 VanDerWaalsContact C-N 3.32Å; H514-V516 PolarHBondContact O-N 2.99Å
517	H	50.3	Low	52.8	Low	127 Å²	127	117 Å²	117	59%	0.588	60%	0.6	S	S	*	*	H	α-helix	trans	-80.7	-24.4	177.7	-74.6	86.6	0	0	0	114.1	L513 H514 V515	L513-H517 PolarHBondContact O-N 3.33Å; L513-H517 PolarHBondContact O-ND1 3.4Å; H514-H517 WeakPolarHBondContact O-CA 3.29Å; H514-H517 PolarHBondContact O-N 3.16Å; V515-H517 VanDerWaalsContact C-N 3.3Å; V515-H517 PolarHBondContact O-N 2.85Å
518	T	47.8	Very low	50.7	Low	93 Å²	93	125.1 Å²	125.1	57%	0.571	63%	0.625	S	S	*	*	H	α-helix	trans	-85.1	-17.1	179.4	55.4	0	0	0	0	115	H514 V515	H514-T518 PolarHBondContact O-N 2.86Å; V515-T518 PolarHBondContact O-N 3.32Å; V515-T518 PolarHBondContact O-OG1 2.86Å
519	H	37.5	Very low	48.4	Very low	136 Å²	136	131.5 Å²	131.5	63%	0.63	65%	0.646	S	S	*	*			trans	-123.6	64.5	-168.2	-66.2	-61.5	0	0	0	116.1	V515 G521	V515-H519 PolarHBondContact O-N 3.44Å; H519-G521 PolarHBondContact O-N 3.38Å
520	R	42.9	Very low	45.8	Very low	264 Å²	264	131.3 Å²	131.3	100%	0.996	66%	0.662	S	S	*	*			trans	-73.5	55.3	162.1	-157.8	-179	-159.1	-101.3	4	112
521	G	30.9	Very low	43.6	Very low	59 Å²	59	137.4 Å²	137.4	61%	0.608	69%	0.69	S	S	*	*	S	Bend	trans	-161.8	96.3	-169	0	0	0	0	0	118.8	H519 G523	H519-G521 PolarHBondContact O-N 3.38Å; G521-G523 PolarHBondContact O-N 3.36Å
522	R	32.7	Very low	41.4	Very low	251 Å²	251	140.6 Å²	140.6	95%	0.947	70%	0.701	S	S	*	*			trans	61.4	44.8	133.2	-147.9	-167.3	-174.4	-166.4	3.8	121.9
523	G	35	Very low	39.6	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	71%	0.705	S	S	*	*			trans	64.2	-178.5	130.2	0	0	0	0	0	123.1	G521	G521-G523 PolarHBondContact O-N 3.36Å
524	K	32.3	Very low	37.7	Very low	214 Å²	214	144.2 Å²	144.2	93%	0.93	73%	0.729	S	S	*	*			trans	78.7	125.1	-174.9	-59.8	-175.6	178.4	-178.1	0	117.3
525	S	37.9	Very low	36	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	75%	0.746	S	S	*	*			trans	-88.8	154.1	164	156.6	0	0	0	0	111
526	P	41.9	Very low	34.5	Very low	126 Å²	126	149.4 Å²	149.4	82%	0.818	76%	0.757	S	S	*	*			trans	-125.8	-174.2	137.6	35.6	-25.2	0	0	0	113
527	R	29.1	Very low	33	Very low	214 Å²	214	150 Å²	150	81%	0.808	77%	0.766	S	S	*	*			trans	-147.7	120.7	-152.9	169.2	-172.5	176.6	-166	1.7	113.4
528	R	36.3	Very low	31.9	Very low	220 Å²	220	155.4 Å²	155.4	83%	0.83	78%	0.781	S	S	*	*			trans	65.5	173.6	171.9	-57	-175.5	176.4	-158.8	-0.8	113.9
529	K	30.5	Very low	30.9	Very low	187 Å²	187	154.4 Å²	154.4	81%	0.813	78%	0.782	S	S	*	*			cis	-161.5	160.9	17.3	-159.1	-178.2	177.3	-168.3	0	111.8
530	G	24	Very low	30.5	Very low	70 Å²	70	152.6 Å²	152.6	72%	0.722	79%	0.785	S	S	*	*			trans	108.3	123.6	168.3	0	0	0	0	0	114.2
531	Q	29.6	Very low	29.5	Very low	163 Å²	163	150.6 Å²	150.6	76%	0.762	78%	0.784	S	S	*	*			cis	100.2	80.7	-3.1	-153.8	179.9	2.8	0	0	119.3
532	H	25.3	Very low	29.6	Very low	162 Å²	162	156.7 Å²	156.7	75%	0.75	80%	0.797	S	S	*	*			trans	-165.2	141.1	144.7	-125.3	-102.8	0	0	0	106.6
533	I	30.4	Very low	29.3	Very low	110 Å²	110	150.3 Å²	150.3	56%	0.564	79%	0.791	S	S	*	*			cis	69.5	113.6	40.4	-57.6	170.8	0	0	0	109.3
534	D	24.5	Very low	28.8	Very low	142 Å²	142	152.2 Å²	152.2	76%	0.759	79%	0.791	S	S	*	*			cis	-140.6	165.9	24.5	-91.7	-50.8	0	0	0	113.6
535	L	27.1	Very low	28.5	Very low	167 Å²	167	151.2 Å²	151.2	87%	0.874	79%	0.79	S	S	*	*				168.8	133.2	108.1	-169.4	62	0	0	0	112.9
536	D	24.8	Very low	28.1	Very low	141 Å²	141	150.7 Å²	150.7	75%	0.754	79%	0.786	S	S	*	*			trans	-74.1	149.2	176.7	-68.9	-71.3	0	0	0	114.7
537	S	22.8	Very low	27.7	Very low	122 Å²	122	152.3 Å²	152.3	85%	0.853	78%	0.783	S	S	*	*			trans	-159.4	104.8	132.7	-143.7	0	0	0	0	113.6
538	W	26	Very low	27.9	Very low	241 Å²	241	148.9 Å²	148.9	91%	0.913	78%	0.78	S	S	*	*			trans	-89.3	153.4	152.5	-85.7	53.8	0	0	0	107.9
539	A	27.5	Very low	28	Very low	72 Å²	72	142.5 Å²	142.5	60%	0.595	78%	0.783	S	S	*	*			cis	-168	-178.6	-8	0	0	0	0	0	109.7
540	S	28.1	Very low	28.3	Very low	98 Å²	98	138 Å²	138	69%	0.685	78%	0.776	S	S	*	*			trans	63.9	120.8	149.9	-63.1	0	0	0	0	121.3
541	F	22.5	Very low	29.5	Very low	223 Å²	223	140.2 Å²	140.2	98%	0.978	78%	0.777	S	S	*	*	S	Bend		-122.9	80.8	127.9	-86.7	-70.7	0	0	0	110.6
542	Q	33	Very low	31.3	Very low	186 Å²	186	134.9 Å²	134.9	87%	0.869	76%	0.758	S	S	*	*	S	Bend	trans	-147.3	148.5	148.4	-113.6	175.5	10.7	0	0	109.1
543	S	26.1	Very low	34	Very low	117 Å²	117	129.5 Å²	129.5	82%	0.818	74%	0.738	S	S	*	*			trans	-72.9	153.3	-162	-165.1	0	0	0	0	113.7
544	C	24.6	Very low	36.7	Very low	112 Å²	112	124.6 Å²	124.6	76%	0.757	71%	0.713	S	S	*	*			trans	-39.3	149	166.7	-55	0	0	0	0	112.8
545	Q	27.4	Very low	39.8	Very low	194 Å²	194	123.3 Å²	123.3	91%	0.907	70%	0.701	S	S	*	*			cis	-139.7	142.5	43.1	-63.2	175.3	5.3	0	0	115.4
546	S	28.8	Very low	42.8	Very low	98 Å²	98	115.3 Å²	115.3	69%	0.685	66%	0.659	S	S	*	*			trans	-45.5	140.9	179.9	-174.6	0	0	0	0	118.1
547	Q	32.5	Very low	46	Very low	160 Å²	160	111.4 Å²	111.4	75%	0.748	64%	0.638	S	S	*	*				-173.9	156.7	106.5	-94.3	-62.4	-18.4	0	0	113.3
548	N	33.7	Very low	49.2	Very low	141 Å²	141	106.4 Å²	106.4	75%	0.754	60%	0.601	S	S	*	*			trans	-52	142.4	-165.1	-73.9	-24.8	0	0	0	118	S550	N548-S550 PolarHBondContact O-N 2.92Å
549	G	39.3	Very low	52.1	Low	86 Å²	86	97.8 Å²	97.8	89%	0.887	57%	0.57	S	S	*	*			trans	-71	111.9	167.7	0	0	0	0	0	113.1
550	S	35.8	Very low	54.7	Low	94 Å²	94	94.8 Å²	94.8	66%	0.657	54%	0.544	S	S	*	.			trans	-98.1	163.9	160.5	-62	0	0	0	0	109.7	N548 S552	N548-S550 PolarHBondContact O-N 2.92Å; S550-S552 PolarHBondContact O-N 3.16Å
551	P	50.4	Low	56.7	Low	116 Å²	116	93.9 Å²	93.9	75%	0.753	55%	0.55	S	S	*	*			trans	-54.1	116.4	156.7	25.5	-33.5	0	0	0	107.8	S553	P551-S553 PolarHBondContact O-N 3.12Å; P551-S553 PolarHBondContact O-OG 2.91Å
552	S	66.8	Low	59	Low	51 Å²	51	90.6 Å²	90.6	36%	0.357	54%	0.535	S	S	.	.			trans	-71.3	89.8	-166.7	48.5	0	0	0	0	110.3	S550 K573 R574	S550-S552 PolarHBondContact O-N 3.16Å; S552-K573 CarbonylContact O-C 3.59Å; S552-K573 VanDerWaalsContact O-O 3.05Å; S552-R574 PolarHBondContact O-N 3.06Å; S552-R574 WeakPolarHBondContact OG-CG 3.48Å; S552-R574 PolarHBondContact OG-NE 3.1Å
553	S	80.9	Confident	60.8	Low	48 Å²	48	83.7 Å²	83.7	34%	0.336	51%	0.508	S	S	.	.			trans	-107.7	130.5	-174.6	52.4	0	0	0	0	111.2	P551 N570 I571	P551-S553 PolarHBondContact O-N 3.12Å; P551-S553 PolarHBondContact O-OG 2.91Å; S553-N570 VanDerWaalsContact CB-ND2 3.33Å; S553-N570 WeakPolarHBondContact CB-ND2 3.36Å; S553-N570 WeakPolarHBondContact CB-OD1 3.43Å; S553-N570 PolarHBondContact OG-ND2 2.84Å; S553-N570 PolarHBondContact OG-OD1 3.4Å; S553-I571 CarbonylContact C-O 3.59Å; S553-I571 WeakPolarHBondContact CA-O 3.36Å; S553-I571 WeakPolarHBondContact CB-O 3.12Å
554	T	88.7	Confident	63	Low	7 Å²	7	83.9 Å²	83.9	4%	0.043	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.6	-176.3	-60.4	0	0	0	0	110	N570 I571 K573 R574 L575 V578 I625	T554-N570 PolarHBondContact O-OD1 2.92Å; T554-I571 PolarHBondContact N-O 3.09Å; T554-I571 PolarHBondContact O-N 3.39Å; T554-K573 WeakPolarHBondContact CB-O 3.3Å; T554-K573 PolarHBondContact N-O 2.96Å; T554-K573 PolarHBondContact OG1-O 2.88Å; T554-R574 VanDerWaalsContact OG1-C 3.25Å; T554-L575 HydrophobicContact CG2-CD1 3.71Å; T554-L575 PolarHBondContact OG1-N 3.24Å; T554-L575 VanDerWaalsContact OG1-N 3.1Å; T554-V578 HydrophobicContact CG2-CG2 4.17Å; T554-I625 HydrophobicContact CG2-CD1 3.74Å; T554-I625 HydrophobicContact CG2-CG1 3.87Å
555	K	88.6	Confident	65.6	Low	115 Å²	115	82.8 Å²	82.8	50%	0.5	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.5	172.2	-65.8	-178.6	-179.2	-179.7	0	109.9	M568 I569 I625	K555-M568 HydrophobicContact CD-SD 4.15Å; K555-I569 WeakPolarHBondContact CA-O 3.26Å; K555-I625 PolarHBondContact O-N 2.84Å
556	I	91	Very high	68.4	Low	0 Å²	0	76.3 Å²	76.3	0%	0	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.8	176.4	-46.7	-168	0	0	0	108.1	M568 I569 I571 V578 V583 I625	I556-M568 WeakPolarHBondContact O-CA 3.48Å; I556-I569 HydrophobicContact CB-CD1 4.45Å; I556-I569 HydrophobicContact CB-CG1 3.83Å; I556-I569 HydrophobicContact CG1-CG1 4.41Å; I556-I569 PolarHBondContact N-O 3.19Å; I556-I569 PolarHBondContact O-N 3.01Å; I556-I571 HydrophobicContact CD1-CD1 3.51Å; I556-I571 HydrophobicContact CD1-CG1 3.94Å; I556-V578 HydrophobicContact CD1-CG1 4.19Å; I556-V583 HydrophobicContact CD1-CB 4.45Å; I556-V583 HydrophobicContact CD1-CG1 4.26Å; I556-V583 HydrophobicContact CD1-CG2 3.67Å; I556-I625 WeakPolarHBondContact CA-O 3.27Å; I556-I625 HydrophobicContact CB-CB 4.35Å; I556-I625 HydrophobicContact CD1-CD1 4.05Å; I556-I625 HydrophobicContact CG1-CB 4.08Å; I556-I625 HydrophobicContact CG1-CD1 4.21Å; I556-I625 HydrophobicContact CG2-CB 4.04Å; I556-I625 HydrophobicContact CG2-CG2 3.89Å
557	L	91.1	Very high	71.1	Confident	59 Å²	59	73.4 Å²	73.4	31%	0.309	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.2	173	-171	74.5	0	0	0	108.2	F559 P566 S567 M568 I625 V626 A627	L557-F559 HydrophobicContact CD2-CE2 4.41Å; L557-F559 HydrophobicContact CD2-CZ 4.49Å; L557-P566 HydrophobicContact CD1-CB 3.72Å; L557-P566 HydrophobicContact CD1-CG 4.08Å; L557-P566 HydrophobicContact CD2-CB 4.29Å; L557-P566 HydrophobicContact CD2-CG 4.48Å; L557-P566 HydrophobicContact CG-CB 3.81Å; L557-P566 HydrophobicContact CG-CG 4.41Å; L557-S567 WeakPolarHBondContact CA-O 3.46Å; L557-M568 HydrophobicContact CD1-CB 4.29Å; L557-I625 PolarHBondContact N-O 3.22Å; L557-V626 CarbonylContact O-C 3.6Å; L557-V626 WeakPolarHBondContact O-CA 3.37Å; L557-A627 PolarHBondContact O-N 3.49Å
558	Y	89.9	Confident	73.7	Confident	17 Å²	17	71.8 Å²	71.8	7%	0.067	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.1	-177.9	77.7	-88.4	0	0	0	112.8	T560 P566 S567 I569 V587 A627 L629	Y558-T560 HydrophobicContact CD2-CG2 3.69Å; Y558-T560 HydrophobicContact CE2-CG2 3.53Å; Y558-P566 CarbonylContact O-C 3.58Å; Y558-P566 WeakPolarHBondContact O-CA 3.46Å; Y558-S567 WeakPolarHBondContact CD1-O 3.36Å; Y558-S567 VanDerWaalsContact CZ-CB 3.4Å; Y558-S567 PolarHBondContact N-O 2.87Å; Y558-S567 PolarHBondContact O-N 2.96Å; Y558-I569 HydrophobicContact CD1-CD1 4.35Å; Y558-I569 HydrophobicContact CD1-CG1 4.37Å; Y558-I569 HydrophobicContact CE1-CD1 4.35Å; Y558-I569 HydrophobicContact CE1-CG1 4.46Å; Y558-I569 HydrophobicContact CE1-CG2 4.14Å; Y558-V587 HydrophobicContact CD1-CG2 4.37Å; Y558-V587 HydrophobicContact CE1-CG2 4.21Å; Y558-V587 HydrophobicContact CE2-CG1 4.25Å; Y558-A627 CarbonylContact C-O 3.57Å; Y558-A627 WeakPolarHBondContact CA-O 3.26Å; Y558-L629 HydrophobicContact CD2-CD1 4.23Å; Y558-L629 HydrophobicContact CD2-CD2 4.35Å
559	F	87.7	Confident	76.3	Confident	59 Å²	59	66.7 Å²	66.7	26%	0.259	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	145.9	171.4	-61.1	-95.1	0	0	0	109.3	L557 P566 V626 A627 W628 L629	L557-F559 HydrophobicContact CD2-CE2 4.41Å; L557-F559 HydrophobicContact CD2-CZ 4.49Å; F559-P566 HydrophobicContact CD1-CB 3.79Å; F559-P566 HydrophobicContact CD1-CG 4.36Å; F559-P566 HydrophobicContact CD2-CB 4.42Å; F559-P566 HydrophobicContact CE1-CB 3.59Å; F559-P566 HydrophobicContact CE1-CG 3.76Å; F559-P566 HydrophobicContact CE2-CB 4.22Å; F559-P566 HydrophobicContact CG-CB 4.21Å; F559-P566 HydrophobicContact CZ-CB 3.81Å; F559-P566 HydrophobicContact CZ-CG 4.05Å; F559-V626 HydrophobicContact CE2-CG1 4.05Å; F559-A627 PolarHBondContact N-O 2.88Å; F559-W628 HydrophobicContact CB-CG 4.37Å; F559-W628 AromaticContact CD2-CD1 3.85Å; F559-W628 HydrophobicContact CD2-CG 4.49Å; F559-W628 AromaticContact CD2-NE1 3.5Å; F559-W628 AromaticContact CG-CD1 3.93Å; F559-W628 AromaticContact CG-NE1 3.86Å; F559-L629 PolarHBondContact O-N 3.5Å
560	T	81.9	Confident	78.6	Confident	10 Å²	10	66.6 Å²	66.6	6%	0.061	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.9	175.2	58.1	0	0	0	0	108.9	Y558 K562 S563 L629	Y558-T560 HydrophobicContact CD2-CG2 3.69Å; Y558-T560 HydrophobicContact CE2-CG2 3.53Å; T560-K562 PolarHBondContact O-N 2.87Å; T560-S563 PolarHBondContact O-N 3.16Å; T560-L629 HydrophobicContact CG2-CB 4.33Å
561	G	70.8	Confident	81.1	Confident	79 Å²	79	62.6 Å²	62.6	81%	0.814	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-23	-175.5	0	0	0	0	0	116	L629	G561-L629 PolarHBondContact N-O 3.31Å
562	K	70.3	Confident	82.8	Confident	153 Å²	153	62.5 Å²	62.5	67%	0.665	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8	177.5	-70.1	174.3	175.9	156.2	0	115.9	T560 E631	T560-K562 PolarHBondContact O-N 2.87Å; K562-E631 WeakPolarHBondContact CD-OE1 3.35Å; K562-E631 WeakPolarHBondContact CE-OE1 3.36Å; K562-E631 VanDerWaalsContact CE-OE2 3.22Å; K562-E631 WeakPolarHBondContact CE-OE2 3.49Å; K562-E631 IonicContact NZ-OE1 3.86Å; K562-E631 PolarHBondContact NZ-OE1 2.64Å; K562-E631 IonicContact NZ-OE2 2.69Å; K562-E631 PolarHBondContact NZ-OE2 2.92Å
563	S	70.4	Confident	83.7	Confident	42 Å²	42	63.4 Å²	63.4	29%	0.294	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	136.2	173.7	-175.9	0	0	0	0	113	T560 T565	T560-S563 PolarHBondContact O-N 3.16Å; S563-T565 PolarHBondContact O-N 3.45Å; S563-T565 PolarHBondContact OG-N 3.18Å; S563-T565 PolarHBondContact OG-OG1 2.93Å
564	P	72.4	Confident	83.9	Confident	120 Å²	120	68.1 Å²	68.1	78%	0.779	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	-11.9	173.1	31.3	-36.7	0	0	0	113.6	P566	P564-P566 WeakPolarHBondContact O-CD 3.35Å
565	T	79.3	Confident	83.5	Confident	90 Å²	90	71.3 Å²	71.3	55%	0.552	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	114.7	178	60.3	0	0	0	0	110.8	S563	S563-T565 PolarHBondContact O-N 3.45Å; S563-T565 PolarHBondContact OG-N 3.18Å; S563-T565 PolarHBondContact OG-OG1 2.93Å
566	P	85.8	Confident	83.1	Confident	58 Å²	58	67.8 Å²	67.8	38%	0.377	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	140.9	176	27.4	-32.7	0	0	0	111.4	L557 Y558 F559 P564	L557-P566 HydrophobicContact CD1-CB 3.72Å; L557-P566 HydrophobicContact CD1-CG 4.08Å; L557-P566 HydrophobicContact CD2-CB 4.29Å; L557-P566 HydrophobicContact CD2-CG 4.48Å; L557-P566 HydrophobicContact CG-CB 3.81Å; L557-P566 HydrophobicContact CG-CG 4.41Å; Y558-P566 CarbonylContact O-C 3.58Å; Y558-P566 WeakPolarHBondContact O-CA 3.46Å; F559-P566 HydrophobicContact CD1-CB 3.79Å; F559-P566 HydrophobicContact CD1-CG 4.36Å; F559-P566 HydrophobicContact CD2-CB 4.42Å; F559-P566 HydrophobicContact CE1-CB 3.59Å; F559-P566 HydrophobicContact CE1-CG 3.76Å; F559-P566 HydrophobicContact CE2-CB 4.22Å; F559-P566 HydrophobicContact CG-CB 4.21Å; F559-P566 HydrophobicContact CZ-CB 3.81Å; F559-P566 HydrophobicContact CZ-CG 4.05Å; P564-P566 WeakPolarHBondContact O-CD 3.35Å
567	S	85.2	Confident	82.9	Confident	36 Å²	36	72.6 Å²	72.6	25%	0.252	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	148.4	171.8	-64.3	0	0	0	0	110	L557 Y558	L557-S567 WeakPolarHBondContact CA-O 3.46Å; Y558-S567 WeakPolarHBondContact CD1-O 3.36Å; Y558-S567 VanDerWaalsContact CZ-CB 3.4Å; Y558-S567 PolarHBondContact N-O 2.87Å; Y558-S567 PolarHBondContact O-N 2.96Å
568	M	87.7	Confident	82.7	Confident	127 Å²	127	69.8 Å²	69.8	63%	0.626	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.6	178.9	-176	177.8	62.3	0	0	111	K555 I556 L557	K555-M568 HydrophobicContact CD-SD 4.15Å; I556-M568 WeakPolarHBondContact O-CA 3.48Å; L557-M568 HydrophobicContact CD1-CB 4.29Å
569	I	88.7	Confident	82.8	Confident	34 Å²	34	70.3 Å²	70.3	17%	0.174	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	163.8	171	55.6	-177.8	0	0	0	110.5	K555 I556 Y558 A586 V587	K555-I569 WeakPolarHBondContact CA-O 3.26Å; I556-I569 HydrophobicContact CB-CD1 4.45Å; I556-I569 HydrophobicContact CB-CG1 3.83Å; I556-I569 HydrophobicContact CG1-CG1 4.41Å; I556-I569 PolarHBondContact N-O 3.19Å; I556-I569 PolarHBondContact O-N 3.01Å; Y558-I569 HydrophobicContact CD1-CD1 4.35Å; Y558-I569 HydrophobicContact CD1-CG1 4.37Å; Y558-I569 HydrophobicContact CE1-CD1 4.35Å; Y558-I569 HydrophobicContact CE1-CG1 4.46Å; Y558-I569 HydrophobicContact CE1-CG2 4.14Å; I569-A586 HydrophobicContact CD1-CB 3.81Å; I569-V587 HydrophobicContact CD1-CG2 3.76Å
570	N	88.3	Confident	82.8	Confident	83 Å²	83	67.5 Å²	67.5	44%	0.444	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	116.4	-177.4	-168.5	44.1	0	0	0	110.3	S553 T554	S553-N570 VanDerWaalsContact CB-ND2 3.33Å; S553-N570 WeakPolarHBondContact CB-ND2 3.36Å; S553-N570 WeakPolarHBondContact CB-OD1 3.43Å; S553-N570 PolarHBondContact OG-ND2 2.84Å; S553-N570 PolarHBondContact OG-OD1 3.4Å; T554-N570 PolarHBondContact O-OD1 2.92Å
571	I	88	Confident	83.1	Confident	11 Å²	11	73.4 Å²	73.4	6%	0.056	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.4	-178.8	-59.4	-167	0	0	0	109.2	S553 T554 I556 K573 V578 D582 V583 A586	S553-I571 CarbonylContact C-O 3.59Å; S553-I571 WeakPolarHBondContact CA-O 3.36Å; S553-I571 WeakPolarHBondContact CB-O 3.12Å; T554-I571 PolarHBondContact N-O 3.09Å; T554-I571 PolarHBondContact O-N 3.39Å; I556-I571 HydrophobicContact CD1-CD1 3.51Å; I556-I571 HydrophobicContact CD1-CG1 3.94Å; I571-K573 HydrophobicContact CG2-CB 4.17Å; I571-K573 HydrophobicContact CG2-CG 4.16Å; I571-K573 PolarHBondContact O-N 2.6Å; I571-V578 HydrophobicContact CD1-CG1 4.1Å; I571-V578 HydrophobicContact CG2-CG2 4.44Å; I571-D582 HydrophobicContact CD1-CB 3.93Å; I571-D582 WeakPolarHBondContact CD1-O 3.43Å; I571-D582 HydrophobicContact CG2-CB 4.27Å; I571-V583 HydrophobicContact CD1-CG2 4.41Å; I571-A586 HydrophobicContact CD1-CB 3.8Å; I571-A586 HydrophobicContact CG1-CB 3.96Å
572	P	85.8	Confident	84	Confident	114 Å²	114	71.3 Å²	71.3	74%	0.74	38%	0.383	S	S	*	.	S	Bend	trans	-77.3	53.9	-179.2	34	-37.2	0	0	0	113.1
573	K	86.1	Confident	84.8	Confident	70 Å²	70	64 Å²	64	30%	0.304	35%	0.351	S	S	.	.	S	Bend	trans	-138.7	153.9	175.3	-68.7	-168.8	177.6	-174.8	0	110.3	S552 T554 I571 E577 V578 D582	S552-K573 CarbonylContact O-C 3.59Å; S552-K573 VanDerWaalsContact O-O 3.05Å; T554-K573 WeakPolarHBondContact CB-O 3.3Å; T554-K573 PolarHBondContact N-O 2.96Å; T554-K573 PolarHBondContact OG1-O 2.88Å; I571-K573 HydrophobicContact CG2-CB 4.17Å; I571-K573 HydrophobicContact CG2-CG 4.16Å; I571-K573 PolarHBondContact O-N 2.6Å; K573-E577 HydrophobicContact CB-CB 4.14Å; K573-E577 HydrophobicContact CD-CB 4.48Å; K573-E577 WeakPolarHBondContact CD-O 3.48Å; K573-V578 HydrophobicContact CB-CG2 4.03Å; K573-D582 WeakPolarHBondContact CE-OD1 3.47Å; K573-D582 IonicContact NZ-OD1 3.24Å; K573-D582 PolarHBondContact NZ-OD1 2.92Å; K573-D582 IonicContact NZ-OD2 3.6Å; K573-D582 PolarHBondContact NZ-OD2 3.23Å
574	R	85.4	Confident	85.7	Confident	147 Å²	147	65.5 Å²	65.5	56%	0.555	35%	0.352	S	S	*	.			trans	-69.2	156.4	177.1	-61.2	-177.8	167.3	-153	-3.4	111.7	S552 T554 G576 E577 V578	S552-R574 PolarHBondContact O-N 3.06Å; S552-R574 WeakPolarHBondContact OG-CG 3.48Å; S552-R574 PolarHBondContact OG-NE 3.1Å; T554-R574 VanDerWaalsContact OG1-C 3.25Å; R574-G576 PolarHBondContact O-N 2.69Å; R574-E577 HydrophobicContact CB-CB 4.41Å; R574-E577 VanDerWaalsContact CB-CD 3.45Å; R574-E577 HydrophobicContact CB-CG 3.99Å; R574-E577 VanDerWaalsContact CB-OE2 3.31Å; R574-E577 WeakPolarHBondContact CB-OE2 3.4Å; R574-E577 WeakPolarHBondContact CD-OE1 3.37Å; R574-E577 WeakPolarHBondContact CG-OE2 3.46Å; R574-E577 PolarHBondContact N-OE2 3.19Å; R574-E577 WeakPolarHBondContact O-CB 3.47Å; R574-E577 PolarHBondContact O-N 2.86Å; R574-V578 PolarHBondContact O-N 2.87Å
575	L	78.8	Confident	86.3	Confident	73 Å²	73	64 Å²	64	38%	0.382	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	124.2	167.6	-166.4	69.7	0	0	0	108	T554 K624 I625	T554-L575 HydrophobicContact CG2-CD1 3.71Å; T554-L575 PolarHBondContact OG1-N 3.24Å; T554-L575 VanDerWaalsContact OG1-N 3.1Å; L575-K624 WeakPolarHBondContact CD1-O 3.44Å; L575-I625 HydrophobicContact CD1-CD1 4.23Å; L575-I625 HydrophobicContact CD1-CG1 3.7Å
576	G	81.1	Confident	86.6	Confident	42 Å²	42	61.5 Å²	61.5	43%	0.433	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	-9.4	-167.5	0	0	0	0	0	115.4	R574 I617	R574-G576 PolarHBondContact O-N 2.69Å; G576-I617 WeakPolarHBondContact O-CG2 3.38Å
577	E	85.8	Confident	86.5	Confident	100 Å²	100	59 Å²	59	47%	0.467	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-13.1	171.7	-65	169.1	179.5	0	0	112.9	K573 R574 T579	K573-E577 HydrophobicContact CB-CB 4.14Å; K573-E577 HydrophobicContact CD-CB 4.48Å; K573-E577 WeakPolarHBondContact CD-O 3.48Å; R574-E577 HydrophobicContact CB-CB 4.41Å; R574-E577 VanDerWaalsContact CB-CD 3.45Å; R574-E577 HydrophobicContact CB-CG 3.99Å; R574-E577 VanDerWaalsContact CB-OE2 3.31Å; R574-E577 WeakPolarHBondContact CB-OE2 3.4Å; R574-E577 WeakPolarHBondContact CD-OE1 3.37Å; R574-E577 WeakPolarHBondContact CG-OE2 3.46Å; R574-E577 PolarHBondContact N-OE2 3.19Å; R574-E577 WeakPolarHBondContact O-CB 3.47Å; R574-E577 PolarHBondContact O-N 2.86Å; E577-T579 PolarHBondContact O-N 3.26Å
578	V	87.8	Confident	85.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.353	C	S	.	.			trans	-73.7	119.3	177.4	-179.3	0	0	0	0	109.7	T554 I556 I571 K573 R574 D582 V583 I617 V618 I625	T554-V578 HydrophobicContact CG2-CG2 4.17Å; I556-V578 HydrophobicContact CD1-CG1 4.19Å; I571-V578 HydrophobicContact CD1-CG1 4.1Å; I571-V578 HydrophobicContact CG2-CG2 4.44Å; K573-V578 HydrophobicContact CB-CG2 4.03Å; R574-V578 PolarHBondContact O-N 2.87Å; V578-D582 HydrophobicContact CG1-CB 4.29Å; V578-V583 HydrophobicContact CG1-CG2 3.77Å; V578-I617 WeakPolarHBondContact O-CA 3.43Å; V578-V618 PolarHBondContact O-N 2.87Å; V578-I625 HydrophobicContact CB-CD1 3.85Å; V578-I625 HydrophobicContact CG1-CD1 3.77Å; V578-I625 HydrophobicContact CG2-CD1 4.11Å
579	T	91.5	Very high	84.6	Confident	28 Å²	28	63.5 Å²	63.5	17%	0.172	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-97.2	161.5	173.5	65.8	0	0	0	0	112.1	E577 K581 D582 V583 A616	E577-T579 PolarHBondContact O-N 3.26Å; T579-K581 PolarHBondContact O-N 2.85Å; T579-D582 WeakPolarHBondContact CB-OD2 3.39Å; T579-D582 PolarHBondContact N-OD2 2.94Å; T579-D582 WeakPolarHBondContact O-CB 3.43Å; T579-D582 PolarHBondContact O-N 3.37Å; T579-D582 PolarHBondContact OG1-N 3.39Å; T579-D582 PolarHBondContact OG1-OD2 3.4Å; T579-V583 PolarHBondContact O-N 2.94Å; T579-A616 CarbonylContact C-O 3.08Å; T579-A616 WeakPolarHBondContact CA-O 3.37Å; T579-A616 WeakPolarHBondContact CB-O 3.42Å
580	L	88.7	Confident	83.1	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-54.2	-38.2	174.6	177.2	67.1	0	0	0	111.6	D582 V583 K584 Y595 F597 V611 L613 A616 V618	L580-D582 VanDerWaalsContact C-N 3.31Å; L580-D582 PolarHBondContact O-N 3.5Å; L580-V583 PolarHBondContact O-N 2.98Å; L580-V583 VanDerWaalsContact O-N 3.17Å; L580-K584 HydrophobicContact CD1-CG 4.44Å; L580-K584 HydrophobicContact CD2-CD 4.48Å; L580-K584 HydrophobicContact CG-CD 4.11Å; L580-K584 HydrophobicContact CG-CG 4.38Å; L580-K584 WeakPolarHBondContact O-CG 3.4Å; L580-K584 PolarHBondContact O-N 2.78Å; L580-Y595 HydrophobicContact CD1-CD1 4.04Å; L580-Y595 HydrophobicContact CD1-CD2 4.24Å; L580-Y595 HydrophobicContact CD1-CG 3.71Å; L580-F597 HydrophobicContact CD1-CE2 3.92Å; L580-F597 HydrophobicContact CD1-CZ 3.98Å; L580-V611 HydrophobicContact CB-CG1 4.28Å; L580-V611 HydrophobicContact CD2-CG1 4.39Å; L580-V611 WeakPolarHBondContact CD2-O 3.46Å; L580-L613 WeakPolarHBondContact CB-O 3.37Å; L580-L613 WeakPolarHBondContact CD2-O 3.49Å; L580-A616 PolarHBondContact N-O 2.93Å; L580-V618 HydrophobicContact CB-CG2 4.36Å
581	K	88.2	Confident	82	Confident	135 Å²	135	69.8 Å²	69.8	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-59.5	-38.3	175.2	-175.1	173.5	-179.4	175.4	0	113	T579 A585 D614	T579-K581 PolarHBondContact O-N 2.85Å; K581-A585 VanDerWaalsContact O-CB 3.3Å; K581-A585 WeakPolarHBondContact O-CB 3.33Å; K581-A585 PolarHBondContact O-N 2.87Å; K581-D614 HydrophobicContact CB-CB 4.17Å; K581-D614 VanDerWaalsContact CB-O 3.28Å; K581-D614 WeakPolarHBondContact CB-O 2.99Å; K581-D614 PolarHBondContact N-O 3.42Å
582	D	89.1	Confident	81.3	Confident	35 Å²	35	75.5 Å²	75.5	19%	0.187	41%	0.41	C	S	.	.	H	α-helix	trans	-67.3	-39.9	175.9	-56.6	-66.1	0	0	0	111	I571 K573 V578 T579 L580 A585 A586	I571-D582 HydrophobicContact CD1-CB 3.93Å; I571-D582 WeakPolarHBondContact CD1-O 3.43Å; I571-D582 HydrophobicContact CG2-CB 4.27Å; K573-D582 WeakPolarHBondContact CE-OD1 3.47Å; K573-D582 IonicContact NZ-OD1 3.24Å; K573-D582 PolarHBondContact NZ-OD1 2.92Å; K573-D582 IonicContact NZ-OD2 3.6Å; K573-D582 PolarHBondContact NZ-OD2 3.23Å; V578-D582 HydrophobicContact CG1-CB 4.29Å; T579-D582 WeakPolarHBondContact CB-OD2 3.39Å; T579-D582 PolarHBondContact N-OD2 2.94Å; T579-D582 WeakPolarHBondContact O-CB 3.43Å; T579-D582 PolarHBondContact O-N 3.37Å; T579-D582 PolarHBondContact OG1-N 3.39Å; T579-D582 PolarHBondContact OG1-OD2 3.4Å; L580-D582 VanDerWaalsContact C-N 3.31Å; L580-D582 PolarHBondContact O-N 3.5Å; D582-A585 PolarHBondContact O-N 3.24Å; D582-A586 VanDerWaalsContact O-CB 3.29Å; D582-A586 WeakPolarHBondContact O-CB 3.46Å; D582-A586 PolarHBondContact O-N 3.48Å
583	V	87.7	Confident	81.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-64.9	-46.6	176.1	-171.9	0	0	0	0	110.8	I556 I571 V578 T579 L580 A585 A586 V587 Y595 F597 V618	I556-V583 HydrophobicContact CD1-CB 4.45Å; I556-V583 HydrophobicContact CD1-CG1 4.26Å; I556-V583 HydrophobicContact CD1-CG2 3.67Å; I571-V583 HydrophobicContact CD1-CG2 4.41Å; V578-V583 HydrophobicContact CG1-CG2 3.77Å; T579-V583 PolarHBondContact O-N 2.94Å; L580-V583 PolarHBondContact O-N 2.98Å; L580-V583 VanDerWaalsContact O-N 3.17Å; V583-A585 VanDerWaalsContact C-N 3.33Å; V583-A585 PolarHBondContact O-N 3.35Å; V583-A586 PolarHBondContact O-N 3.05Å; V583-V587 HydrophobicContact CG1-CG2 4.37Å; V583-V587 WeakPolarHBondContact O-CG2 3.22Å; V583-V587 PolarHBondContact O-N 3.32Å; V583-Y595 HydrophobicContact CG1-CD1 4.48Å; V583-Y595 HydrophobicContact CG1-CE1 4.46Å; V583-F597 HydrophobicContact CG1-CE1 4.34Å; V583-F597 HydrophobicContact CG1-CZ 4.34Å; V583-F597 HydrophobicContact CG2-CE1 4.47Å; V583-F597 HydrophobicContact CG2-CZ 4.45Å; V583-V618 HydrophobicContact CG2-CG2 3.97Å
584	K	88	Confident	81.2	Confident	72 Å²	72	72.8 Å²	72.8	31%	0.313	38%	0.384	S	S	.	.	H	α-helix	trans	-58.6	-42.1	175.1	-74.4	176.9	176.6	178.2	0	112.2	L580 A586 Y595 D614	L580-K584 HydrophobicContact CD1-CG 4.44Å; L580-K584 HydrophobicContact CD2-CD 4.48Å; L580-K584 HydrophobicContact CG-CD 4.11Å; L580-K584 HydrophobicContact CG-CG 4.38Å; L580-K584 WeakPolarHBondContact O-CG 3.4Å; L580-K584 PolarHBondContact O-N 2.78Å; K584-A586 VanDerWaalsContact C-N 3.32Å; K584-A586 PolarHBondContact O-N 2.68Å; K584-Y595 HydrophobicContact CD-CE2 4.31Å; K584-Y595 HydrophobicContact CG-CD2 4.47Å; K584-Y595 HydrophobicContact CG-CE1 4.09Å; K584-Y595 HydrophobicContact CG-CE2 3.84Å; K584-D614 WeakPolarHBondContact CD-OD1 3.31Å; K584-D614 IonicContact NZ-OD1 2.69Å; K584-D614 PolarHBondContact NZ-OD1 3.49Å
585	A	86.1	Confident	81.4	Confident	89 Å²	89	66.6 Å²	66.6	74%	0.736	36%	0.36	S	S	*	.	H	α-helix	trans	-72.8	-20.8	178.2	0	0	0	0	0	114	K581 D582 V583	K581-A585 VanDerWaalsContact O-CB 3.3Å; K581-A585 WeakPolarHBondContact O-CB 3.33Å; K581-A585 PolarHBondContact O-N 2.87Å; D582-A585 PolarHBondContact O-N 3.24Å; V583-A585 VanDerWaalsContact C-N 3.33Å; V583-A585 PolarHBondContact O-N 3.35Å
586	A	84.4	Confident	81.9	Confident	38 Å²	38	64 Å²	64	31%	0.314	35%	0.346	S	S	.	.	H	α-helix	trans	-98.9	-11.1	178.4	0	0	0	0	0	113.7	I569 I571 D582 V583 K584	I569-A586 HydrophobicContact CD1-CB 3.81Å; I571-A586 HydrophobicContact CD1-CB 3.8Å; I571-A586 HydrophobicContact CG1-CB 3.96Å; D582-A586 VanDerWaalsContact O-CB 3.29Å; D582-A586 WeakPolarHBondContact O-CB 3.46Å; D582-A586 PolarHBondContact O-N 3.48Å; V583-A586 PolarHBondContact O-N 3.05Å; K584-A586 VanDerWaalsContact C-N 3.32Å; K584-A586 PolarHBondContact O-N 2.68Å
587	V	83.4	Confident	82.4	Confident	6 Å²	6	62 Å²	62	4%	0.036	33%	0.325	C	S	.	.	S	Bend	trans	-92.1	94.9	166.3	177.8	0	0	0	0	108.4	Y558 I569 V583 R589 L629	Y558-V587 HydrophobicContact CD1-CG2 4.37Å; Y558-V587 HydrophobicContact CE1-CG2 4.21Å; Y558-V587 HydrophobicContact CE2-CG1 4.25Å; I569-V587 HydrophobicContact CD1-CG2 3.76Å; V583-V587 HydrophobicContact CG1-CG2 4.37Å; V583-V587 WeakPolarHBondContact O-CG2 3.22Å; V583-V587 PolarHBondContact O-N 3.32Å; V587-R589 HydrophobicContact CG1-CB 4.1Å; V587-R589 HydrophobicContact CG1-CG 3.93Å; V587-R589 PolarHBondContact O-N 2.96Å; V587-L629 HydrophobicContact CG1-CD2 3.81Å; V587-L629 HydrophobicContact CG2-CD2 4.39Å
588	D	66.4	Low	82.7	Confident	164 Å²	164	59.5 Å²	59.5	88%	0.877	31%	0.313	S	S	*	.			trans	-71.1	74.7	176.8	-170.6	22.8	0	0	0	111.3
589	R	68.2	Low	82.7	Confident	93 Å²	93	59.8 Å²	59.8	35%	0.351	32%	0.316	S	S	.	.			trans	-148.3	120.8	177.8	-62.2	-172.5	-175.2	-138.5	3	111.3	V587 Y593	V587-R589 HydrophobicContact CG1-CB 4.1Å; V587-R589 HydrophobicContact CG1-CG 3.93Å; V587-R589 PolarHBondContact O-N 2.96Å; R589-Y593 HydrophobicContact CB-CE2 4.12Å
590	E	55.7	Low	82.3	Confident	196 Å²	196	64.4 Å²	64.4	92%	0.916	34%	0.338	S	S	*	.			trans	-70.6	130.9	171.5	-59.8	178.6	150.8	0	0	110.4	Y593	E590-Y593 PolarHBondContact O-OH 3.03Å
591	G	65.1	Low	82	Confident	53 Å²	53	67 Å²	67	55%	0.546	35%	0.352	S	S	.	.	S	Bend	trans	145.7	159.5	176	0	0	0	0	0	114.4	Y593	G591-Y593 VanDerWaalsContact O-CD2 3.25Å; G591-Y593 WeakPolarHBondContact O-CD2 3.42Å
592	N	74.6	Confident	81.4	Confident	130 Å²	130	66.8 Å²	66.8	70%	0.695	37%	0.365	S	S	*	.			trans	-82.1	117	168.6	-76.2	-3.1	0	0	0	109.2	D632	N592-D632 HydrophobicContact CB-CB 4.04Å; N592-D632 PolarHBondContact O-N 3.44Å
593	Y	83.3	Confident	80.6	Confident	33 Å²	33	72.5 Å²	72.5	13%	0.129	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.3	175.4	-58.6	-91.7	0	0	0	110.3	R589 E590 G591 Y595 L629 E630 E631	R589-Y593 HydrophobicContact CB-CE2 4.12Å; E590-Y593 PolarHBondContact O-OH 3.03Å; G591-Y593 VanDerWaalsContact O-CD2 3.25Å; G591-Y593 WeakPolarHBondContact O-CD2 3.42Å; Y593-Y595 WeakPolarHBondContact O-CD2 3.41Å; Y593-Y595 WeakPolarHBondContact O-CE2 3.49Å; Y593-L629 HydrophobicContact CD1-CB 4.11Å; Y593-L629 HydrophobicContact CD1-CD2 4.43Å; Y593-L629 HydrophobicContact CG-CB 4.47Å; Y593-L629 HydrophobicContact CG-CD2 4.26Å; Y593-E630 CarbonylContact C-O 3.46Å; Y593-E630 WeakPolarHBondContact CA-O 3.41Å; Y593-E631 HydrophobicContact CD1-CG 3.62Å; Y593-E631 HydrophobicContact CE1-CG 3.34Å
594	R	85.9	Confident	80	Confident	95 Å²	95	80 Å²	80	36%	0.358	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.3	165.2	-59.1	-169	-54.6	-170.8	6.8	109.2	E630 D632	R594-E630 IonicContact CZ-OE2 3.99Å; R594-E630 PolarHBondContact N-O 3.28Å; R594-E630 IonicContact NE-OE2 2.71Å; R594-E630 IonicContact NH2-OE2 2.67Å; R594-E630 PolarHBondContact NH2-OE2 3.05Å; R594-E630 PolarHBondContact O-N 2.96Å; R594-D632 HydrophobicContact CG-CB 3.99Å
595	Y	89.1	Confident	79.8	Confident	17 Å²	17	77.9 Å²	77.9	7%	0.067	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	103.8	-172	-72.1	-99.7	0	0	0	110.1	L580 V583 K584 Y593 F597 V611 L629	L580-Y595 HydrophobicContact CD1-CD1 4.04Å; L580-Y595 HydrophobicContact CD1-CD2 4.24Å; L580-Y595 HydrophobicContact CD1-CG 3.71Å; V583-Y595 HydrophobicContact CG1-CD1 4.48Å; V583-Y595 HydrophobicContact CG1-CE1 4.46Å; K584-Y595 HydrophobicContact CD-CE2 4.31Å; K584-Y595 HydrophobicContact CG-CD2 4.47Å; K584-Y595 HydrophobicContact CG-CE1 4.09Å; K584-Y595 HydrophobicContact CG-CE2 3.84Å; Y593-Y595 WeakPolarHBondContact O-CD2 3.41Å; Y593-Y595 WeakPolarHBondContact O-CE2 3.49Å; Y595-F597 HydrophobicContact CD1-CZ 4.26Å; Y595-V611 PolarHBondContact O-N 2.66Å; Y595-L629 HydrophobicContact CD1-CD1 3.76Å; Y595-L629 HydrophobicContact CD1-CD2 4.44Å; Y595-L629 HydrophobicContact CD1-CG 3.93Å; Y595-L629 HydrophobicContact CE1-CD1 3.82Å; Y595-L629 HydrophobicContact CE1-CD2 3.72Å; Y595-L629 HydrophobicContact CE1-CG 3.7Å
596	H	90.1	Very high	79.8	Confident	17 Å²	17	77.9 Å²	77.9	8%	0.079	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	145.6	174.9	-56.1	87.7	0	0	0	110.8	K608 E609 A627 W628 E630	H596-K608 HydrophobicContact CB-CD 4.21Å; H596-K608 HydrophobicContact CB-CG 3.77Å; H596-E609 CarbonylContact C-O 3.49Å; H596-E609 VanDerWaalsContact CA-O 3.23Å; H596-E609 WeakPolarHBondContact CA-O 3.35Å; H596-A627 CarbonylContact O-C 3.54Å; H596-A627 WeakPolarHBondContact O-CA 3.14Å; H596-W628 HydrophobicContact CB-CB 4.38Å; H596-W628 PolarHBondContact N-O 3.25Å; H596-W628 PolarHBondContact O-N 3.48Å; H596-E630 VanDerWaalsContact CE1-CD 3.46Å; H596-E630 IonicContact CE1-OE1 3.75Å; H596-E630 IonicContact CE1-OE2 2.78Å; H596-E630 PolarHBondContact CE1-OE2 3.02Å; H596-E630 IonicContact ND1-OE1 2.59Å; H596-E630 IonicContact ND1-OE2 3.69Å
597	F	92.5	Very high	79.9	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	153	-177	-61	-83.6	0	0	0	112.1	L580 V583 Y595 A599 K608 E609 V611 V618 P619 I625 V626 A627	L580-F597 HydrophobicContact CD1-CE2 3.92Å; L580-F597 HydrophobicContact CD1-CZ 3.98Å; V583-F597 HydrophobicContact CG1-CE1 4.34Å; V583-F597 HydrophobicContact CG1-CZ 4.34Å; V583-F597 HydrophobicContact CG2-CE1 4.47Å; V583-F597 HydrophobicContact CG2-CZ 4.45Å; Y595-F597 HydrophobicContact CD1-CZ 4.26Å; F597-A599 PolarHBondContact O-N 2.91Å; F597-K608 CarbonylContact O-C 3.51Å; F597-K608 WeakPolarHBondContact O-CA 3.48Å; F597-E609 PolarHBondContact N-O 3.14Å; F597-E609 PolarHBondContact O-N 3.36Å; F597-V611 HydrophobicContact CD2-CB 3.9Å; F597-V611 HydrophobicContact CD2-CG2 3.75Å; F597-V611 HydrophobicContact CE2-CB 3.9Å; F597-V611 HydrophobicContact CE2-CG2 4.26Å; F597-V618 HydrophobicContact CB-CG1 4.35Å; F597-V618 HydrophobicContact CD1-CG1 3.3Å; F597-V618 HydrophobicContact CD2-CG1 4.05Å; F597-V618 HydrophobicContact CE1-CG1 3.41Å; F597-V618 VanDerWaalsContact CE1-CG1 3.41Å; F597-V618 HydrophobicContact CE1-CG2 4.34Å; F597-V618 HydrophobicContact CE2-CG1 4.15Å; F597-V618 HydrophobicContact CE2-CG2 4.21Å; F597-V618 HydrophobicContact CG-CG1 3.63Å; F597-V618 HydrophobicContact CZ-CG1 3.84Å; F597-V618 HydrophobicContact CZ-CG2 3.99Å; F597-P619 HydrophobicContact CB-CG 3.64Å; F597-P619 HydrophobicContact CG-CG 4.48Å; F597-I625 HydrophobicContact CD1-CG2 3.61Å; F597-I625 HydrophobicContact CE1-CG2 3.97Å; F597-V626 CarbonylContact C-O 3.58Å; F597-V626 VanDerWaalsContact CA-O 3.32Å; F597-V626 WeakPolarHBondContact CA-O 3.34Å; F597-A627 HydrophobicContact CD1-CB 3.53Å; F597-A627 HydrophobicContact CE1-CB 3.5Å; F597-A627 VanDerWaalsContact CE1-CB 3.5Å; F597-A627 HydrophobicContact CZ-CB 4.48Å
598	K	90.9	Very high	80.2	Confident	49 Å²	49	82.8 Å²	82.8	21%	0.213	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	107.8	176.6	-165.5	-175.9	176.7	-167.9	0	109.3	T606 W621 V626 W628	K598-T606 HydrophobicContact CD-CG2 4.28Å; K598-T606 HydrophobicContact CG-CG2 4.03Å; K598-W621 HydrophobicContact CB-CB 4.43Å; K598-W621 HydrophobicContact CD-CB 4.39Å; K598-W621 HydrophobicContact CD-CD2 3.57Å; K598-W621 HydrophobicContact CD-CE3 3.98Å; K598-W621 HydrophobicContact CD-CG 3.68Å; K598-W621 VanDerWaalsContact CE-CD2 3.45Å; K598-W621 HydrophobicContact CG-CD2 3.9Å; K598-W621 HydrophobicContact CG-CE3 3.8Å; K598-W621 HydrophobicContact CG-CG 4.17Å; K598-W621 HydrophobicContact CG-CZ3 4.46Å; K598-V626 HydrophobicContact CB-CB 3.86Å; K598-V626 HydrophobicContact CB-CG1 4.37Å; K598-V626 HydrophobicContact CD-CB 4.44Å; K598-V626 PolarHBondContact N-O 2.83Å; K598-W628 HydrophobicContact CB-CH2 3.81Å; K598-W628 HydrophobicContact CB-CZ3 3.78Å; K598-W628 HydrophobicContact CD-CH2 4.45Å; K598-W628 HydrophobicContact CG-CH2 4.16Å; K598-W628 HydrophobicContact CG-CZ3 4.5Å
599	A	88.3	Confident	81.4	Confident	6 Å²	6	79.2 Å²	79.2	5%	0.05	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	160.3	177.8	0	0	0	0	0	111.6	F597 V607 E609 P619 W621	F597-A599 PolarHBondContact O-N 2.91Å; A599-V607 HydrophobicContact CB-CG2 3.87Å; A599-V607 PolarHBondContact N-O 3.3Å; A599-V607 PolarHBondContact O-N 3.19Å; A599-E609 HydrophobicContact CB-CB 4.11Å; A599-E609 VanDerWaalsContact CB-OE2 3.26Å; A599-E609 WeakPolarHBondContact CB-OE2 3.47Å; A599-P619 HydrophobicContact CB-CB 3.78Å; A599-P619 HydrophobicContact CB-CG 4Å; A599-W621 WeakPolarHBondContact O-CZ3 3.46Å
600	L	82.1	Confident	82.4	Confident	124 Å²	124	78.7 Å²	78.7	65%	0.649	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	103.4	168.6	-175.5	72	0	0	0	108.6	G605 W621	L600-G605 CarbonylContact C-O 3.45Å; L600-G605 WeakPolarHBondContact CA-O 3.43Å; L600-W621 HydrophobicContact CB-CE3 4.31Å; L600-W621 HydrophobicContact CB-CZ3 3.78Å; L600-W621 HydrophobicContact CD1-CH2 3.93Å; L600-W621 HydrophobicContact CD1-CZ3 3.84Å; L600-W621 HydrophobicContact CG-CZ3 4.42Å
601	D	83.6	Confident	83.9	Confident	54 Å²	54	69.8 Å²	69.8	29%	0.289	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	134.8	172.5	-176.9	-82.6	0	0	0	110.5	E603 F604 G605 V607	D601-E603 VanDerWaalsContact C-N 3.32Å; D601-E603 PolarHBondContact O-N 3.32Å; D601-E603 WeakPolarHBondContact OD1-CA 3.44Å; D601-E603 PolarHBondContact OD1-N 2.93Å; D601-F604 HydrophobicContact CB-CB 4.29Å; D601-F604 WeakPolarHBondContact OD1-CD2 3.44Å; D601-F604 PolarHBondContact OD1-N 2.89Å; D601-G605 PolarHBondContact N-O 3.37Å; D601-G605 VanDerWaalsContact O-CA 3.29Å; D601-G605 WeakPolarHBondContact O-CA 3.34Å; D601-G605 PolarHBondContact O-N 3.34Å; D601-V607 HydrophobicContact CB-CB 4.48Å; D601-V607 HydrophobicContact CB-CG1 3.72Å; D601-V607 HydrophobicContact CB-CG2 3.91Å
602	P	75.9	Confident	84.9	Confident	132 Å²	132	73.7 Å²	73.7	86%	0.857	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.2	-179	-23.7	35	0	0	0	116.1
603	E	72.1	Confident	85.4	Confident	155 Å²	155	72.6 Å²	72.6	72%	0.724	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-35	-177.9	-57.8	-157.2	141.2	0	0	112.5	D601	D601-E603 VanDerWaalsContact C-N 3.32Å; D601-E603 PolarHBondContact O-N 3.32Å; D601-E603 WeakPolarHBondContact OD1-CA 3.44Å; D601-E603 PolarHBondContact OD1-N 2.93Å
604	F	74.8	Confident	85.6	Confident	158 Å²	158	74.7 Å²	74.7	69%	0.693	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-9.2	-174.5	-60.7	-77.6	0	0	0	114.5	D601 V607	D601-F604 HydrophobicContact CB-CB 4.29Å; D601-F604 WeakPolarHBondContact OD1-CD2 3.44Å; D601-F604 PolarHBondContact OD1-N 2.89Å; F604-V607 HydrophobicContact CB-CG1 3.92Å
605	G	83.1	Confident	85.4	Confident	27 Å²	27	73.3 Å²	73.3	28%	0.278	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79	-120.3	176.8	0	0	0	0	0	112.8	L600 D601 V607	L600-G605 CarbonylContact C-O 3.45Å; L600-G605 WeakPolarHBondContact CA-O 3.43Å; D601-G605 PolarHBondContact N-O 3.37Å; D601-G605 VanDerWaalsContact O-CA 3.29Å; D601-G605 WeakPolarHBondContact O-CA 3.34Å; D601-G605 PolarHBondContact O-N 3.34Å; G605-V607 PolarHBondContact O-N 3.31Å
606	T	85.6	Confident	85.4	Confident	88 Å²	88	74 Å²	74	54%	0.54	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	113.8	-178	-58.1	0	0	0	0	110.8	K598 W621	K598-T606 HydrophobicContact CD-CG2 4.28Å; K598-T606 HydrophobicContact CG-CG2 4.03Å; T606-W621 HydrophobicContact CG2-CH2 4.12Å; T606-W621 HydrophobicContact CG2-CZ3 4.13Å; T606-W621 WeakPolarHBondContact OG1-CH2 3.33Å
607	V	87.9	Confident	85.2	Confident	46 Å²	46	78.1 Å²	78.1	28%	0.279	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	162.2	179.2	-56.5	0	0	0	0	112.4	A599 D601 F604 G605	A599-V607 HydrophobicContact CB-CG2 3.87Å; A599-V607 PolarHBondContact N-O 3.3Å; A599-V607 PolarHBondContact O-N 3.19Å; D601-V607 HydrophobicContact CB-CB 4.48Å; D601-V607 HydrophobicContact CB-CG1 3.72Å; D601-V607 HydrophobicContact CB-CG2 3.91Å; F604-V607 HydrophobicContact CB-CG1 3.92Å; G605-V607 PolarHBondContact O-N 3.31Å
608	K	89.6	Confident	85	Confident	101 Å²	101	78.3 Å²	78.3	44%	0.439	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	97.6	173.3	-180	-173.1	175	-153.6	0	107.8	H596 F597 W628 E630	H596-K608 HydrophobicContact CB-CD 4.21Å; H596-K608 HydrophobicContact CB-CG 3.77Å; F597-K608 CarbonylContact O-C 3.51Å; F597-K608 WeakPolarHBondContact O-CA 3.48Å; K608-W628 HydrophobicContact CD-CE3 4.48Å; K608-W628 HydrophobicContact CG-CE3 4.13Å; K608-W628 HydrophobicContact CG-CZ3 4.26Å; K608-E630 IonicContact NZ-OE1 3.91Å; K608-E630 PolarHBondContact NZ-OE1 3.47Å
609	E	90.3	Very high	84.8	Confident	89 Å²	89	77.2 Å²	77.2	42%	0.416	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	130.8	-175.5	-175.1	-176.8	166.4	0	0	110.3	H596 F597 A599 V611	H596-E609 CarbonylContact C-O 3.49Å; H596-E609 VanDerWaalsContact CA-O 3.23Å; H596-E609 WeakPolarHBondContact CA-O 3.35Å; F597-E609 PolarHBondContact N-O 3.14Å; F597-E609 PolarHBondContact O-N 3.36Å; A599-E609 HydrophobicContact CB-CB 4.11Å; A599-E609 VanDerWaalsContact CB-OE2 3.26Å; A599-E609 WeakPolarHBondContact CB-OE2 3.47Å; E609-V611 HydrophobicContact CG-CG2 4.29Å
610	E	90.2	Very high	84.5	Confident	83 Å²	83	78.6 Å²	78.6	39%	0.388	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.3	171.9	-172.7	176.4	-170.8	0	0	110.4
611	V	87	Confident	84.4	Confident	9 Å²	9	74.3 Å²	74.3	6%	0.055	41%	0.413	C	S	.	.			trans	-114.1	108.3	178	-176.3	0	0	0	0	108.9	L580 Y595 F597 E609 A616	L580-V611 HydrophobicContact CB-CG1 4.28Å; L580-V611 HydrophobicContact CD2-CG1 4.39Å; L580-V611 WeakPolarHBondContact CD2-O 3.46Å; Y595-V611 PolarHBondContact O-N 2.66Å; F597-V611 HydrophobicContact CD2-CB 3.9Å; F597-V611 HydrophobicContact CD2-CG2 3.75Å; F597-V611 HydrophobicContact CE2-CB 3.9Å; F597-V611 HydrophobicContact CE2-CG2 4.26Å; E609-V611 HydrophobicContact CG-CG2 4.29Å; V611-A616 HydrophobicContact CG1-CB 3.69Å
612	F	85.7	Confident	83.9	Confident	135 Å²	135	78.6 Å²	78.6	59%	0.592	43%	0.431	S	S	*	.			trans	-102.8	-18.8	-174.4	57.8	-87.6	0	0	0	114.2
613	L	86.4	Confident	83.7	Confident	107 Å²	107	75.1 Å²	75.1	56%	0.56	42%	0.419	S	S	*	.			trans	-87.8	121.1	-179	-65	177.2	0	0	0	111.8	L580 G615 A616	L580-L613 WeakPolarHBondContact CB-O 3.37Å; L580-L613 WeakPolarHBondContact CD2-O 3.49Å; L613-G615 PolarHBondContact O-N 2.9Å; L613-G615 VanDerWaalsContact O-N 3.16Å; L613-A616 HydrophobicContact CB-CB 4.06Å; L613-A616 WeakPolarHBondContact O-CB 3.5Å; L613-A616 PolarHBondContact O-N 3.2Å
614	D	85.6	Confident	84.3	Confident	77 Å²	77	72.8 Å²	72.8	41%	0.412	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.3	-178.5	-82.9	3.6	0	0	0	114.4	K581 K584	K581-D614 HydrophobicContact CB-CB 4.17Å; K581-D614 VanDerWaalsContact CB-O 3.28Å; K581-D614 WeakPolarHBondContact CB-O 2.99Å; K581-D614 PolarHBondContact N-O 3.42Å; K584-D614 WeakPolarHBondContact CD-OD1 3.31Å; K584-D614 IonicContact NZ-OD1 2.69Å; K584-D614 PolarHBondContact NZ-OD1 3.49Å
615	G	83.5	Confident	85	Confident	66 Å²	66	65.3 Å²	65.3	68%	0.68	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.3	178.6	0	0	0	0	0	115.2	L613	L613-G615 PolarHBondContact O-N 2.9Å; L613-G615 VanDerWaalsContact O-N 3.16Å
616	A	87.3	Confident	85.3	Confident	31 Å²	31	65 Å²	65	26%	0.256	37%	0.367	S	S	.	.	S	Bend	trans	-73.1	139.8	178.7	0	0	0	0	0	111.1	T579 L580 V611 L613	T579-A616 CarbonylContact C-O 3.08Å; T579-A616 WeakPolarHBondContact CA-O 3.37Å; T579-A616 WeakPolarHBondContact CB-O 3.42Å; L580-A616 PolarHBondContact N-O 2.93Å; V611-A616 HydrophobicContact CG1-CB 3.69Å; L613-A616 HydrophobicContact CB-CB 4.06Å; L613-A616 WeakPolarHBondContact O-CB 3.5Å; L613-A616 PolarHBondContact O-N 3.2Å
617	I	87	Confident	85.6	Confident	104 Å²	104	60.8 Å²	60.8	53%	0.533	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-71.3	133.2	171.5	-63.7	164.1	0	0	0	108.1	G576 V578	G576-I617 WeakPolarHBondContact O-CG2 3.38Å; V578-I617 WeakPolarHBondContact O-CA 3.43Å
618	V	89	Confident	85.7	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.018	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-82.7	132.6	-177.4	173.1	0	0	0	0	110.3	V578 L580 V583 F597 I625	V578-V618 PolarHBondContact O-N 2.87Å; L580-V618 HydrophobicContact CB-CG2 4.36Å; V583-V618 HydrophobicContact CG2-CG2 3.97Å; F597-V618 HydrophobicContact CB-CG1 4.35Å; F597-V618 HydrophobicContact CD1-CG1 3.3Å; F597-V618 HydrophobicContact CD2-CG1 4.05Å; F597-V618 HydrophobicContact CE1-CG1 3.41Å; F597-V618 VanDerWaalsContact CE1-CG1 3.41Å; F597-V618 HydrophobicContact CE1-CG2 4.34Å; F597-V618 HydrophobicContact CE2-CG1 4.15Å; F597-V618 HydrophobicContact CE2-CG2 4.21Å; F597-V618 HydrophobicContact CG-CG1 3.63Å; F597-V618 HydrophobicContact CZ-CG1 3.84Å; F597-V618 HydrophobicContact CZ-CG2 3.99Å; V618-I625 HydrophobicContact CB-CD1 4.19Å; V618-I625 HydrophobicContact CG1-CD1 3.89Å; V618-I625 HydrophobicContact CG1-CG1 4.28Å; V618-I625 HydrophobicContact CG1-CG2 3.54Å
619	P	86.2	Confident	85.7	Confident	26 Å²	26	57.8 Å²	57.8	17%	0.169	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-64.1	141.2	-178.2	27	-36.7	0	0	0	112.1	F597 A599	F597-P619 HydrophobicContact CB-CG 3.64Å; F597-P619 HydrophobicContact CG-CG 4.48Å; A599-P619 HydrophobicContact CB-CB 3.78Å; A599-P619 HydrophobicContact CB-CG 4Å
620	G	81.4	Confident	85.5	Confident	35 Å²	35	56.2 Å²	56.2	36%	0.361	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-98.3	143.7	-179.3	0	0	0	0	0	113.2	K624	G620-K624 WeakPolarHBondContact CA-O 3.49Å
621	W	79.4	Confident	85	Confident	34 Å²	34	55 Å²	55	13%	0.129	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-129.8	121.2	175.2	-171.6	-83.9	0	0	0	110.8	K598 A599 L600 T606 G623 K624	K598-W621 HydrophobicContact CB-CB 4.43Å; K598-W621 HydrophobicContact CD-CB 4.39Å; K598-W621 HydrophobicContact CD-CD2 3.57Å; K598-W621 HydrophobicContact CD-CE3 3.98Å; K598-W621 HydrophobicContact CD-CG 3.68Å; K598-W621 VanDerWaalsContact CE-CD2 3.45Å; K598-W621 HydrophobicContact CG-CD2 3.9Å; K598-W621 HydrophobicContact CG-CE3 3.8Å; K598-W621 HydrophobicContact CG-CG 4.17Å; K598-W621 HydrophobicContact CG-CZ3 4.46Å; A599-W621 WeakPolarHBondContact O-CZ3 3.46Å; L600-W621 HydrophobicContact CB-CE3 4.31Å; L600-W621 HydrophobicContact CB-CZ3 3.78Å; L600-W621 HydrophobicContact CD1-CH2 3.93Å; L600-W621 HydrophobicContact CD1-CZ3 3.84Å; L600-W621 HydrophobicContact CG-CZ3 4.42Å; T606-W621 HydrophobicContact CG2-CH2 4.12Å; T606-W621 HydrophobicContact CG2-CZ3 4.13Å; T606-W621 WeakPolarHBondContact OG1-CH2 3.33Å; W621-G623 VanDerWaalsContact C-N 3.29Å; W621-G623 PolarHBondContact O-N 2.87Å; W621-K624 PolarHBondContact N-O 3.4Å; W621-K624 CarbonylContact O-C 3.41Å; W621-K624 WeakPolarHBondContact O-CA 3.34Å; W621-K624 PolarHBondContact O-N 3.38Å; W621-K624 VanDerWaalsContact O-O 3.09Å
622	E	74.4	Confident	84.3	Confident	144 Å²	144	56.6 Å²	56.6	67%	0.673	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	43.6	176.6	-68.7	168.1	-150.3	0	0	114.4	K624	E622-K624 VanDerWaalsContact C-N 3.28Å; E622-K624 PolarHBondContact O-N 2.93Å
623	G	71.9	Confident	83	Confident	59 Å²	59	57.8 Å²	57.8	61%	0.608	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	10.7	-179.7	0	0	0	0	0	115	W621	W621-G623 VanDerWaalsContact C-N 3.29Å; W621-G623 PolarHBondContact O-N 2.87Å
624	K	84.3	Confident	81.5	Confident	107 Å²	107	55.7 Å²	55.7	47%	0.465	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-135.1	-178.8	-178.3	-58.3	165.8	-163.6	153.5	0	109.5	L575 G620 W621 E622	L575-K624 WeakPolarHBondContact CD1-O 3.44Å; G620-K624 WeakPolarHBondContact CA-O 3.49Å; W621-K624 PolarHBondContact N-O 3.4Å; W621-K624 CarbonylContact O-C 3.41Å; W621-K624 WeakPolarHBondContact O-CA 3.34Å; W621-K624 PolarHBondContact O-N 3.38Å; W621-K624 VanDerWaalsContact O-O 3.09Å; E622-K624 VanDerWaalsContact C-N 3.28Å; E622-K624 PolarHBondContact O-N 2.93Å
625	I	89.6	Confident	79.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.9	163.4	-63.1	169.1	0	0	0	107.8	T554 K555 I556 L557 L575 V578 F597 V618	T554-I625 HydrophobicContact CG2-CD1 3.74Å; T554-I625 HydrophobicContact CG2-CG1 3.87Å; K555-I625 PolarHBondContact O-N 2.84Å; I556-I625 WeakPolarHBondContact CA-O 3.27Å; I556-I625 HydrophobicContact CB-CB 4.35Å; I556-I625 HydrophobicContact CD1-CD1 4.05Å; I556-I625 HydrophobicContact CG1-CB 4.08Å; I556-I625 HydrophobicContact CG1-CD1 4.21Å; I556-I625 HydrophobicContact CG2-CB 4.04Å; I556-I625 HydrophobicContact CG2-CG2 3.89Å; L557-I625 PolarHBondContact N-O 3.22Å; L575-I625 HydrophobicContact CD1-CD1 4.23Å; L575-I625 HydrophobicContact CD1-CG1 3.7Å; V578-I625 HydrophobicContact CB-CD1 3.85Å; V578-I625 HydrophobicContact CG1-CD1 3.77Å; V578-I625 HydrophobicContact CG2-CD1 4.11Å; F597-I625 HydrophobicContact CD1-CG2 3.61Å; F597-I625 HydrophobicContact CE1-CG2 3.97Å; V618-I625 HydrophobicContact CB-CD1 4.19Å; V618-I625 HydrophobicContact CG1-CD1 3.89Å; V618-I625 HydrophobicContact CG1-CG1 4.28Å; V618-I625 HydrophobicContact CG1-CG2 3.54Å
626	V	90.2	Very high	78	Confident	21 Å²	21	64.7 Å²	64.7	13%	0.127	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.2	172.1	-178.5	0	0	0	0	108.3	L557 F559 F597 K598 W628	L557-V626 CarbonylContact O-C 3.6Å; L557-V626 WeakPolarHBondContact O-CA 3.37Å; F559-V626 HydrophobicContact CE2-CG1 4.05Å; F597-V626 CarbonylContact C-O 3.58Å; F597-V626 VanDerWaalsContact CA-O 3.32Å; F597-V626 WeakPolarHBondContact CA-O 3.34Å; K598-V626 HydrophobicContact CB-CB 3.86Å; K598-V626 HydrophobicContact CB-CG1 4.37Å; K598-V626 HydrophobicContact CD-CB 4.44Å; K598-V626 PolarHBondContact N-O 2.83Å; V626-W628 HydrophobicContact CG1-CH2 4.06Å; V626-W628 HydrophobicContact CG1-CZ2 4.19Å; V626-W628 HydrophobicContact CG1-CZ3 4.48Å
627	A	90.8	Very high	75.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.2	-171	0	0	0	0	0	113.2	L557 Y558 F559 H596 F597 L629	L557-A627 PolarHBondContact O-N 3.49Å; Y558-A627 CarbonylContact C-O 3.57Å; Y558-A627 WeakPolarHBondContact CA-O 3.26Å; F559-A627 PolarHBondContact N-O 2.88Å; H596-A627 CarbonylContact O-C 3.54Å; H596-A627 WeakPolarHBondContact O-CA 3.14Å; F597-A627 HydrophobicContact CD1-CB 3.53Å; F597-A627 HydrophobicContact CE1-CB 3.5Å; F597-A627 VanDerWaalsContact CE1-CB 3.5Å; F597-A627 HydrophobicContact CZ-CB 4.48Å; A627-L629 HydrophobicContact CB-CD1 4.41Å
628	W	90.7	Very high	73.9	Confident	80 Å²	80	72.6 Å²	72.6	30%	0.303	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	120.8	169.9	-61.7	-95.1	0	0	0	109.4	F559 H596 K598 K608 V626	F559-W628 HydrophobicContact CB-CG 4.37Å; F559-W628 AromaticContact CD2-CD1 3.85Å; F559-W628 HydrophobicContact CD2-CG 4.49Å; F559-W628 AromaticContact CD2-NE1 3.5Å; F559-W628 AromaticContact CG-CD1 3.93Å; F559-W628 AromaticContact CG-NE1 3.86Å; H596-W628 HydrophobicContact CB-CB 4.38Å; H596-W628 PolarHBondContact N-O 3.25Å; H596-W628 PolarHBondContact O-N 3.48Å; K598-W628 HydrophobicContact CB-CH2 3.81Å; K598-W628 HydrophobicContact CB-CZ3 3.78Å; K598-W628 HydrophobicContact CD-CH2 4.45Å; K598-W628 HydrophobicContact CG-CH2 4.16Å; K598-W628 HydrophobicContact CG-CZ3 4.5Å; K608-W628 HydrophobicContact CD-CE3 4.48Å; K608-W628 HydrophobicContact CG-CE3 4.13Å; K608-W628 HydrophobicContact CG-CZ3 4.26Å; V626-W628 HydrophobicContact CG1-CH2 4.06Å; V626-W628 HydrophobicContact CG1-CZ2 4.19Å; V626-W628 HydrophobicContact CG1-CZ3 4.48Å
629	L	89	Confident	71.7	Confident	3 Å²	3	84.2 Å²	84.2	2%	0.016	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	115	173.7	-83.5	66.6	0	0	0	108.9	Y558 F559 T560 G561 V587 Y593 Y595 A627	Y558-L629 HydrophobicContact CD2-CD1 4.23Å; Y558-L629 HydrophobicContact CD2-CD2 4.35Å; F559-L629 PolarHBondContact O-N 3.5Å; T560-L629 HydrophobicContact CG2-CB 4.33Å; G561-L629 PolarHBondContact N-O 3.31Å; V587-L629 HydrophobicContact CG1-CD2 3.81Å; V587-L629 HydrophobicContact CG2-CD2 4.39Å; Y593-L629 HydrophobicContact CD1-CB 4.11Å; Y593-L629 HydrophobicContact CD1-CD2 4.43Å; Y593-L629 HydrophobicContact CG-CB 4.47Å; Y593-L629 HydrophobicContact CG-CD2 4.26Å; Y595-L629 HydrophobicContact CD1-CD1 3.76Å; Y595-L629 HydrophobicContact CD1-CD2 4.44Å; Y595-L629 HydrophobicContact CD1-CG 3.93Å; Y595-L629 HydrophobicContact CE1-CD1 3.82Å; Y595-L629 HydrophobicContact CE1-CD2 3.72Å; Y595-L629 HydrophobicContact CE1-CG 3.7Å; A627-L629 HydrophobicContact CB-CD1 4.41Å
630	E	86.2	Confident	70.9	Confident	57 Å²	57	87.1 Å²	87.1	27%	0.266	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.7	171.7	-69.3	168.5	-161.4	0	0	108.6	Y593 R594 H596 K608	Y593-E630 CarbonylContact C-O 3.46Å; Y593-E630 WeakPolarHBondContact CA-O 3.41Å; R594-E630 IonicContact CZ-OE2 3.99Å; R594-E630 PolarHBondContact N-O 3.28Å; R594-E630 IonicContact NE-OE2 2.71Å; R594-E630 IonicContact NH2-OE2 2.67Å; R594-E630 PolarHBondContact NH2-OE2 3.05Å; R594-E630 PolarHBondContact O-N 2.96Å; H596-E630 VanDerWaalsContact CE1-CD 3.46Å; H596-E630 IonicContact CE1-OE1 3.75Å; H596-E630 IonicContact CE1-OE2 2.78Å; H596-E630 PolarHBondContact CE1-OE2 3.02Å; H596-E630 IonicContact ND1-OE1 2.59Å; H596-E630 IonicContact ND1-OE2 3.69Å; K608-E630 IonicContact NZ-OE1 3.91Å; K608-E630 PolarHBondContact NZ-OE1 3.47Å
631	E	80.1	Confident	70.4	Confident	58 Å²	58	89.8 Å²	89.8	27%	0.271	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	127.4	176.8	-76.4	170.9	-157.9	0	0	109.7	K562 Y593 H633	K562-E631 WeakPolarHBondContact CD-OE1 3.35Å; K562-E631 WeakPolarHBondContact CE-OE1 3.36Å; K562-E631 VanDerWaalsContact CE-OE2 3.22Å; K562-E631 WeakPolarHBondContact CE-OE2 3.49Å; K562-E631 IonicContact NZ-OE1 3.86Å; K562-E631 PolarHBondContact NZ-OE1 2.64Å; K562-E631 IonicContact NZ-OE2 2.69Å; K562-E631 PolarHBondContact NZ-OE2 2.92Å; Y593-E631 HydrophobicContact CD1-CG 3.62Å; Y593-E631 HydrophobicContact CE1-CG 3.34Å; E631-H633 PolarHBondContact O-N 2.87Å; E631-H633 VanDerWaalsContact O-N 3.1Å
632	D	71.6	Confident	69.9	Low	42 Å²	42	92.9 Å²	92.9	23%	0.225	49%	0.487	C	S	.	.			trans	-81.2	91.9	-175.4	-161.7	-2.3	0	0	0	108.9	N592 R594 G634 R637	N592-D632 HydrophobicContact CB-CB 4.04Å; N592-D632 PolarHBondContact O-N 3.44Å; R594-D632 HydrophobicContact CG-CB 3.99Å; D632-G634 PolarHBondContact O-N 3.12Å; D632-G634 VanDerWaalsContact O-N 3.09Å; D632-R637 IonicContact OD2-NH2 2.66Å; D632-R637 PolarHBondContact OD2-NH2 3.38Å
633	H	59.2	Low	69.6	Low	159 Å²	159	89.9 Å²	89.9	74%	0.736	48%	0.476	S	S	*	.			trans	-74.3	13.1	-176.9	-68.7	-46.1	0	0	0	114.5	E631 D635	E631-H633 PolarHBondContact O-N 2.87Å; E631-H633 VanDerWaalsContact O-N 3.1Å; H633-D635 VanDerWaalsContact C-N 3.33Å; H633-D635 PolarHBondContact O-N 2.62Å
634	G	55.2	Low	69.5	Low	64 Å²	64	91.9 Å²	91.9	66%	0.66	47%	0.468	S	S	*	.			trans	81.2	1.5	164.6	0	0	0	0	0	116.3	D632	D632-G634 PolarHBondContact O-N 3.12Å; D632-G634 VanDerWaalsContact O-N 3.09Å
635	D	45.2	Very low	68.5	Low	142 Å²	142	90.9 Å²	90.9	76%	0.759	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-66.2	150.6	174.5	-79.6	-36.3	0	0	0	112.2	H633	H633-D635 VanDerWaalsContact C-N 3.33Å; H633-D635 PolarHBondContact O-N 2.62Å
636	E	48.7	Very low	67	Low	189 Å²	189	97.4 Å²	97.4	88%	0.883	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-60.8	136.3	-159.2	-59.2	-179.4	126.3	0	0	114.7
637	R	42.6	Very low	65.2	Low	174 Å²	174	103.2 Å²	103.2	66%	0.657	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-87.2	124.1	165.5	-61.7	-177	-171.8	-173.4	0.7	109.6	D632	D632-R637 IonicContact OD2-NH2 2.66Å; D632-R637 PolarHBondContact OD2-NH2 3.38Å
638	P	46.2	Very low	63.1	Low	128 Å²	128	111.8 Å²	111.8	83%	0.831	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-59.6	142	157.9	-18.5	32.4	0	0	0	109.9
639	L	42.1	Very low	60.6	Low	246 Å²	246	114.7 Å²	114.7	100%	1.288	60%	0.599	S	S	*	*			trans	-90.3	0	175	-75.7	167.1	0	0	0	111.8

Retrieved 639 of 639 residues in 477.7 ms (Link to these results)

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