A0A5K4FEA9_SCHMA Loading...

Zinc finger CW-type PWWP domain protein 1-like

AlphaFold DB , UniProt , Accession A0A5K4FEA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 582 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	43.1	Very low	170 Å²	170	122.1 Å²	122.1	84%	0.837	66%	0.662	S	S	*	*				0	128.5	0	-79.8	176.5	167.7	0	0	107	G5 L6	M1-G5 WeakPolarHBondContact CE-O 3.44Å; M1-G5 WeakPolarHBondContact CG-O 3.34Å; M1-L6 WeakPolarHBondContact CA-O 3.03Å
2	N	42.1	Very low	43.1	Very low	117 Å²	117	122.2 Å²	122.2	63%	0.626	66%	0.661	S	S	*	*			trans	-72.8	170.9	167.3	-84.4	-7.7	0	0	0	109.7	L4 G5 L6	N2-L4 CarbonylContact O-C 3.54Å; N2-L4 PolarHBondContact O-N 3.48Å; N2-G5 PolarHBondContact O-N 3.46Å; N2-L6 PolarHBondContact N-O 3.37Å
3	V	52.5	Low	43.8	Very low	153 Å²	153	124.1 Å²	124.1	93%	0.927	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-10	-170.4	-178.2	0	0	0	0	114.2
4	L	54.6	Low	44.7	Very low	106 Å²	106	122.2 Å²	122.2	56%	0.555	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	16.6	171.2	-60.7	176.6	0	0	0	114.8	N2 L6 I23	N2-L4 CarbonylContact O-C 3.54Å; N2-L4 PolarHBondContact O-N 3.48Å; L4-L6 VanDerWaalsContact C-N 3.25Å; L4-L6 PolarHBondContact O-N 3.37Å; L4-I23 HydrophobicContact CD1-CD1 4.3Å
5	G	37.6	Very low	45.7	Very low	38 Å²	38	120.5 Å²	120.5	39%	0.392	66%	0.659	S	S	.	*			trans	71.2	9.7	174.8	0	0	0	0	0	115.6	M1 N2	M1-G5 WeakPolarHBondContact CE-O 3.44Å; M1-G5 WeakPolarHBondContact CG-O 3.34Å; N2-G5 PolarHBondContact O-N 3.46Å
6	L	39.3	Very low	47.1	Very low	63 Å²	63	120 Å²	120	33%	0.33	65%	0.649	S	S	.	*			trans	-86.6	139.9	-177.2	-68.2	175.1	0	0	0	112.7	M1 N2 L4 I8 F19	M1-L6 WeakPolarHBondContact CA-O 3.03Å; N2-L6 PolarHBondContact N-O 3.37Å; L4-L6 VanDerWaalsContact C-N 3.25Å; L4-L6 PolarHBondContact O-N 3.37Å; L6-I8 PolarHBondContact O-N 2.91Å; L6-F19 HydrophobicContact CD1-CE2 4.13Å
7	P	39.4	Very low	48.5	Very low	91 Å²	91	119.6 Å²	119.6	59%	0.591	65%	0.646	S	S	*	*			trans	-66.7	129.6	170.7	26.6	-30.7	0	0	0	109.7	K9	P7-K9 PolarHBondContact O-N 3.32Å
8	I	42.7	Very low	49.9	Very low	130 Å²	130	121.4 Å²	121.4	67%	0.667	65%	0.647	S	S	*	*			trans	-69.1	98.2	176.9	-55.4	166.8	0	0	0	106.4	L6	L6-I8 PolarHBondContact O-N 2.91Å
9	K	44.1	Very low	51.3	Low	184 Å²	184	120.2 Å²	120.2	80%	0.8	64%	0.636	S	S	*	*			trans	-109.2	128.9	163.1	-77.4	-171.2	175.4	-175.8	0	107.4	P7	P7-K9 PolarHBondContact O-N 3.32Å
10	E	43.5	Very low	52.5	Low	184 Å²	184	116.7 Å²	116.7	86%	0.86	62%	0.619	S	S	*	*			trans	-53.3	129.9	-179.8	-70.2	176.9	159.1	0	0	110.3	N12	E10-N12 PolarHBondContact O-N 2.83Å; E10-N12 VanDerWaalsContact O-N 3.16Å
11	P	45.3	Very low	53.5	Low	107 Å²	107	116.1 Å²	116.1	70%	0.695	62%	0.616	S	S	*	*			trans	-75.1	110.8	-169.9	28.3	-32.2	0	0	0	110.4	I13	P11-I13 PolarHBondContact O-N 2.73Å
12	N	43	Very low	55.8	Low	123 Å²	123	112.7 Å²	112.7	66%	0.658	60%	0.598	S	S	*	*			trans	-71.7	123.2	162.7	-159.4	-14.2	0	0	0	108	E10 S14 N15	E10-N12 PolarHBondContact O-N 2.83Å; E10-N12 VanDerWaalsContact O-N 3.16Å; N12-S14 PolarHBondContact O-N 3.44Å; N12-N15 PolarHBondContact O-N 3.41Å
13	I	53	Low	57.4	Low	147 Å²	147	108.9 Å²	108.9	75%	0.754	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-55.8	-30.3	-162.1	-66.8	167.6	0	0	0	113	P11 N15 F16	P11-I13 PolarHBondContact O-N 2.73Å; I13-N15 PolarHBondContact O-N 3.22Å; I13-F16 PolarHBondContact O-N 3.44Å
14	S	56.3	Low	58.4	Low	98 Å²	98	106.4 Å²	106.4	69%	0.685	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-71	-12.5	179.2	94.9	0	0	0	0	114.7	N12	N12-S14 PolarHBondContact O-N 3.44Å
15	N	59	Low	59.5	Low	96 Å²	96	106.5 Å²	106.5	51%	0.513	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-99.2	-3	177.5	-88.3	-13.5	0	0	0	113	N12 I13 F19	N12-N15 PolarHBondContact O-N 3.41Å; I13-N15 PolarHBondContact O-N 3.22Å; N15-F19 WeakPolarHBondContact O-CB 3.27Å; N15-F19 PolarHBondContact O-N 3.48Å
16	F	68.1	Low	61.4	Low	113 Å²	113	110.7 Å²	110.7	50%	0.496	56%	0.564	S	S	.	*	H	α-helix	trans	-64.8	-45.8	-178.3	-174.9	-99.5	0	0	0	111.7	I13 K18 F19 V20	I13-F16 PolarHBondContact O-N 3.44Å; F16-K18 PolarHBondContact O-N 3.1Å; F16-F19 WeakPolarHBondContact O-CB 3.34Å; F16-F19 PolarHBondContact O-N 3.31Å; F16-F19 VanDerWaalsContact O-N 3.09Å; F16-V20 HydrophobicContact CD1-CG2 3.87Å; F16-V20 HydrophobicContact CE1-CG2 3.45Å; F16-V20 VanDerWaalsContact CE1-CG2 3.45Å; F16-V20 HydrophobicContact CE2-CG2 4.2Å; F16-V20 HydrophobicContact CG-CG2 4.42Å; F16-V20 HydrophobicContact CZ-CG2 3.64Å; F16-V20 WeakPolarHBondContact O-CG2 3.49Å; F16-V20 PolarHBondContact O-N 3.28Å
17	D	71.6	Confident	63.1	Low	113 Å²	113	111.5 Å²	111.5	60%	0.604	57%	0.567	S	S	*	*	H	α-helix	trans	-61.9	-44.5	-179.8	-62.9	-26.9	0	0	0	111.5	F19 V20 D21	D17-F19 VanDerWaalsContact C-N 3.3Å; D17-F19 PolarHBondContact O-N 2.87Å; D17-V20 PolarHBondContact O-N 2.82Å; D17-D21 PolarHBondContact O-N 3.12Å
18	K	73.4	Confident	64.7	Low	153 Å²	153	111.3 Å²	111.3	67%	0.665	57%	0.569	S	S	*	*	H	α-helix	trans	-60.8	-38.8	173.6	-82.6	-174.2	177.5	178.7	0	112.8	F16 E22	F16-K18 PolarHBondContact O-N 3.1Å; K18-E22 WeakPolarHBondContact O-CB 3.46Å; K18-E22 PolarHBondContact O-N 3.01Å
19	F	77.5	Confident	66.4	Low	97 Å²	97	109.9 Å²	109.9	43%	0.425	57%	0.566	S	S	.	*	H	α-helix	trans	-66.3	-43	176.7	174	-98.7	0	0	0	111.3	L6 N15 F16 D17 E22 I23	L6-F19 HydrophobicContact CD1-CE2 4.13Å; N15-F19 WeakPolarHBondContact O-CB 3.27Å; N15-F19 PolarHBondContact O-N 3.48Å; F16-F19 WeakPolarHBondContact O-CB 3.34Å; F16-F19 PolarHBondContact O-N 3.31Å; F16-F19 VanDerWaalsContact O-N 3.09Å; D17-F19 VanDerWaalsContact C-N 3.3Å; D17-F19 PolarHBondContact O-N 2.87Å; F19-E22 PolarHBondContact O-N 3.45Å; F19-I23 HydrophobicContact CD1-CG1 4.36Å; F19-I23 HydrophobicContact CD2-CG1 4.36Å; F19-I23 HydrophobicContact CE1-CG1 3.96Å; F19-I23 HydrophobicContact CE2-CD1 4.12Å; F19-I23 HydrophobicContact CE2-CG1 3.97Å; F19-I23 HydrophobicContact CZ-CD1 4.01Å; F19-I23 HydrophobicContact CZ-CG1 3.76Å; F19-I23 WeakPolarHBondContact O-CB 3.21Å; F19-I23 WeakPolarHBondContact O-CG1 3.49Å; F19-I23 PolarHBondContact O-N 3.13Å
20	V	73.7	Confident	67.9	Low	50 Å²	50	103.8 Å²	103.8	30%	0.303	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-47.2	176.1	173.2	0	0	0	0	110.4	F16 D17 E22 I23 L24	F16-V20 HydrophobicContact CD1-CG2 3.87Å; F16-V20 HydrophobicContact CE1-CG2 3.45Å; F16-V20 VanDerWaalsContact CE1-CG2 3.45Å; F16-V20 HydrophobicContact CE2-CG2 4.2Å; F16-V20 HydrophobicContact CG-CG2 4.42Å; F16-V20 HydrophobicContact CZ-CG2 3.64Å; F16-V20 WeakPolarHBondContact O-CG2 3.49Å; F16-V20 PolarHBondContact O-N 3.28Å; D17-V20 PolarHBondContact O-N 2.82Å; V20-E22 PolarHBondContact O-N 2.88Å; V20-I23 PolarHBondContact O-N 3.25Å; V20-L24 HydrophobicContact CG1-CD1 3.89Å; V20-L24 HydrophobicContact CG1-CG 4.27Å; V20-L24 WeakPolarHBondContact O-CB 3.47Å; V20-L24 VanDerWaalsContact O-CG 3.31Å; V20-L24 WeakPolarHBondContact O-CG 3.33Å; V20-L24 PolarHBondContact O-N 2.74Å
21	D	75.2	Confident	69.3	Low	105 Å²	105	98.4 Å²	98.4	56%	0.561	52%	0.523	S	S	*	.	H	α-helix	trans	-61.4	-42.4	177.9	-72.4	-22	0	0	0	111.9	D17 I23 L24 D25	D17-D21 PolarHBondContact O-N 3.12Å; D21-I23 VanDerWaalsContact C-N 3.34Å; D21-I23 PolarHBondContact O-N 3.24Å; D21-L24 PolarHBondContact O-N 2.82Å; D21-D25 WeakPolarHBondContact O-CB 3.34Å; D21-D25 PolarHBondContact O-N 3.01Å
22	E	79.9	Confident	70.3	Confident	98 Å²	98	100.2 Å²	100.2	46%	0.458	53%	0.526	S	S	.	.	H	α-helix	trans	-62.7	-40.5	175.9	-172.5	-172.8	159.8	0	0	111.9	K18 F19 V20 R26	K18-E22 WeakPolarHBondContact O-CB 3.46Å; K18-E22 PolarHBondContact O-N 3.01Å; F19-E22 PolarHBondContact O-N 3.45Å; V20-E22 PolarHBondContact O-N 2.88Å; E22-R26 WeakPolarHBondContact O-CB 3.27Å; E22-R26 WeakPolarHBondContact O-CG 3.38Å; E22-R26 PolarHBondContact O-N 3.27Å
23	I	75.7	Confident	71.2	Confident	37 Å²	37	99.7 Å²	99.7	19%	0.19	52%	0.523	C	S	.	.	H	α-helix	trans	-67.9	-42.8	177.1	-68.7	-68.3	0	0	0	110.8	L4 F19 V20 D21 R26 I27	L4-I23 HydrophobicContact CD1-CD1 4.3Å; F19-I23 HydrophobicContact CD1-CG1 4.36Å; F19-I23 HydrophobicContact CD2-CG1 4.36Å; F19-I23 HydrophobicContact CE1-CG1 3.96Å; F19-I23 HydrophobicContact CE2-CD1 4.12Å; F19-I23 HydrophobicContact CE2-CG1 3.97Å; F19-I23 HydrophobicContact CZ-CD1 4.01Å; F19-I23 HydrophobicContact CZ-CG1 3.76Å; F19-I23 WeakPolarHBondContact O-CB 3.21Å; F19-I23 WeakPolarHBondContact O-CG1 3.49Å; F19-I23 PolarHBondContact O-N 3.13Å; V20-I23 PolarHBondContact O-N 3.25Å; D21-I23 VanDerWaalsContact C-N 3.34Å; D21-I23 PolarHBondContact O-N 3.24Å; I23-R26 PolarHBondContact O-N 2.78Å; I23-I27 HydrophobicContact CG2-CD1 3.76Å; I23-I27 HydrophobicContact CG2-CG1 4.43Å; I23-I27 VanDerWaalsContact O-CG1 3.26Å; I23-I27 WeakPolarHBondContact O-CG1 3.46Å; I23-I27 PolarHBondContact O-N 3.03Å
24	L	73.8	Confident	71.8	Confident	102 Å²	102	96.3 Å²	96.3	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-43.3	177.7	-71.7	176.4	0	0	0	111.7	V20 D21 I27 S28	V20-L24 HydrophobicContact CG1-CD1 3.89Å; V20-L24 HydrophobicContact CG1-CG 4.27Å; V20-L24 WeakPolarHBondContact O-CB 3.47Å; V20-L24 VanDerWaalsContact O-CG 3.31Å; V20-L24 WeakPolarHBondContact O-CG 3.33Å; V20-L24 PolarHBondContact O-N 2.74Å; D21-L24 PolarHBondContact O-N 2.82Å; L24-I27 PolarHBondContact O-N 3.1Å; L24-S28 WeakPolarHBondContact O-CB 3.38Å; L24-S28 PolarHBondContact O-N 3.29Å
25	D	78.5	Confident	71.7	Confident	108 Å²	108	92.7 Å²	92.7	58%	0.578	48%	0.478	S	S	*	.	H	α-helix	trans	-60.7	-46.9	175.7	-170.5	58.6	0	0	0	110.6	D21 I27 S28 T29	D21-D25 WeakPolarHBondContact O-CB 3.34Å; D21-D25 PolarHBondContact O-N 3.01Å; D25-I27 PolarHBondContact O-N 2.77Å; D25-S28 WeakPolarHBondContact O-CB 3.34Å; D25-S28 PolarHBondContact O-N 2.9Å; D25-S28 VanDerWaalsContact O-N 3.13Å; D25-S28 PolarHBondContact O-OG 3.04Å; D25-T29 PolarHBondContact O-N 3.28Å
26	R	76.6	Confident	71.3	Confident	126 Å²	126	94.4 Å²	94.4	48%	0.475	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-45.6	174.6	-81	-179.7	164.4	-163.2	-1.3	113.2	E22 I23 S28 T29 I30	E22-R26 WeakPolarHBondContact O-CB 3.27Å; E22-R26 WeakPolarHBondContact O-CG 3.38Å; E22-R26 PolarHBondContact O-N 3.27Å; I23-R26 PolarHBondContact O-N 2.78Å; R26-S28 PolarHBondContact O-N 3.05Å; R26-T29 PolarHBondContact O-N 3.31Å; R26-T29 VanDerWaalsContact O-N 3.12Å; R26-T29 PolarHBondContact O-OG1 2.96Å; R26-I30 WeakPolarHBondContact O-CG1 3.44Å; R26-I30 PolarHBondContact O-N 3Å
27	I	74.3	Confident	70.4	Confident	79 Å²	79	93.9 Å²	93.9	41%	0.405	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-37.7	177.4	-69.4	166.5	0	0	0	110.3	I23 L24 D25 T29 I30 L35	I23-I27 HydrophobicContact CG2-CD1 3.76Å; I23-I27 HydrophobicContact CG2-CG1 4.43Å; I23-I27 VanDerWaalsContact O-CG1 3.26Å; I23-I27 WeakPolarHBondContact O-CG1 3.46Å; I23-I27 PolarHBondContact O-N 3.03Å; L24-I27 PolarHBondContact O-N 3.1Å; D25-I27 PolarHBondContact O-N 2.77Å; I27-T29 PolarHBondContact O-N 2.94Å; I27-I30 PolarHBondContact O-N 3Å; I27-I30 VanDerWaalsContact O-N 3.17Å; I27-L35 HydrophobicContact CG2-CD1 4.18Å; I27-L35 HydrophobicContact CG2-CD2 4.43Å
28	S	73.3	Confident	69.7	Low	88 Å²	88	93.8 Å²	93.8	62%	0.615	48%	0.477	S	S	*	.	H	α-helix	trans	-63.8	-28.3	177.8	85.3	0	0	0	0	113.5	L24 D25 R26	L24-S28 WeakPolarHBondContact O-CB 3.38Å; L24-S28 PolarHBondContact O-N 3.29Å; D25-S28 WeakPolarHBondContact O-CB 3.34Å; D25-S28 PolarHBondContact O-N 2.9Å; D25-S28 VanDerWaalsContact O-N 3.13Å; D25-S28 PolarHBondContact O-OG 3.04Å; R26-S28 PolarHBondContact O-N 3.05Å
29	T	77.7	Confident	68.9	Low	99 Å²	99	93.3 Å²	93.3	61%	0.607	47%	0.472	S	S	*	.	H	α-helix	trans	-80.2	-14.2	177	65.5	0	0	0	0	114	D25 R26 I27 P31	D25-T29 PolarHBondContact O-N 3.28Å; R26-T29 PolarHBondContact O-N 3.31Å; R26-T29 VanDerWaalsContact O-N 3.12Å; R26-T29 PolarHBondContact O-OG1 2.96Å; I27-T29 PolarHBondContact O-N 2.94Å; T29-P31 WeakPolarHBondContact O-CD 3.28Å
30	I	75.8	Confident	67.4	Low	57 Å²	57	94.7 Å²	94.7	29%	0.292	48%	0.478	S	S	.	.	S	Bend	trans	-82.6	124.5	-177.3	-59.8	170.1	0	0	0	109.6	R26 I27 L32 I34 L35	R26-I30 WeakPolarHBondContact O-CG1 3.44Å; R26-I30 PolarHBondContact O-N 3Å; I27-I30 PolarHBondContact O-N 3Å; I27-I30 VanDerWaalsContact O-N 3.17Å; I30-L32 PolarHBondContact O-N 3.4Å; I30-I34 HydrophobicContact CG2-CB 3.96Å; I30-I34 HydrophobicContact CG2-CG2 3.95Å; I30-L35 HydrophobicContact CB-CD1 4.42Å; I30-L35 HydrophobicContact CB-CD2 4.21Å; I30-L35 HydrophobicContact CB-CG 4.09Å; I30-L35 HydrophobicContact CD1-CD2 4.25Å; I30-L35 HydrophobicContact CG2-CD2 4.01Å; I30-L35 HydrophobicContact CG2-CG 3.78Å
31	P	74.7	Confident	65.8	Low	71 Å²	71	97.6 Å²	97.6	46%	0.461	49%	0.487	S	S	.	.			trans	-53	132.9	173.5	-28.1	35.6	0	0	0	112.7	T29 N33 I34 L35	T29-P31 WeakPolarHBondContact O-CD 3.28Å; P31-N33 WeakPolarHBondContact CB-OD1 3.14Å; P31-N33 PolarHBondContact O-N 2.57Å; P31-N33 VanDerWaalsContact O-N 3.11Å; P31-I34 HydrophobicContact CB-CD1 4.29Å; P31-I34 HydrophobicContact CB-CG1 4.38Å; P31-I34 HydrophobicContact CG-CD1 4.19Å; P31-I34 WeakPolarHBondContact O-CB 3.45Å; P31-I34 PolarHBondContact O-N 3.12Å; P31-L35 PolarHBondContact O-N 2.97Å
32	L	65.2	Low	64	Low	145 Å²	145	102.9 Å²	102.9	76%	0.759	50%	0.5	S	S	*	.	H	α-helix	trans	-57.7	-32	-171.4	-155.7	91.4	0	0	0	113.6	I30 I34 L35 Y36	I30-L32 PolarHBondContact O-N 3.4Å; L32-I34 VanDerWaalsContact C-N 3.31Å; L32-I34 PolarHBondContact O-N 3.23Å; L32-L35 PolarHBondContact O-N 3.48Å; L32-Y36 WeakPolarHBondContact O-CB 3.48Å; L32-Y36 PolarHBondContact O-N 3.16Å
33	N	62.3	Low	61.7	Low	112 Å²	112	103.7 Å²	103.7	60%	0.599	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-35.9	175.9	63.8	-38.5	0	0	0	112.3	P31 Y36 E37	P31-N33 WeakPolarHBondContact CB-OD1 3.14Å; P31-N33 PolarHBondContact O-N 2.57Å; P31-N33 VanDerWaalsContact O-N 3.11Å; N33-Y36 PolarHBondContact O-N 3.39Å; N33-E37 PolarHBondContact O-N 3.02Å
34	I	64.7	Low	59.3	Low	75 Å²	75	110.4 Å²	110.4	39%	0.385	55%	0.545	S	S	.	.	H	α-helix	trans	-71.3	-42.3	175.4	-60.9	178.9	0	0	0	110	I30 P31 L32 Y36 E37 N38	I30-I34 HydrophobicContact CG2-CB 3.96Å; I30-I34 HydrophobicContact CG2-CG2 3.95Å; P31-I34 HydrophobicContact CB-CD1 4.29Å; P31-I34 HydrophobicContact CB-CG1 4.38Å; P31-I34 HydrophobicContact CG-CD1 4.19Å; P31-I34 WeakPolarHBondContact O-CB 3.45Å; P31-I34 PolarHBondContact O-N 3.12Å; L32-I34 VanDerWaalsContact C-N 3.31Å; L32-I34 PolarHBondContact O-N 3.23Å; I34-Y36 VanDerWaalsContact C-N 3.28Å; I34-Y36 PolarHBondContact O-N 3.49Å; I34-E37 PolarHBondContact O-N 2.74Å; I34-N38 WeakPolarHBondContact O-CB 3.47Å; I34-N38 PolarHBondContact O-N 2.77Å
35	L	55.5	Low	57.2	Low	22 Å²	22	111.7 Å²	111.7	12%	0.115	56%	0.559	C	S	.	*	H	α-helix	trans	-59.5	-42.1	174.3	-73.2	173.3	0	0	0	111.2	I27 I30 P31 L32 Y39 F40	I27-L35 HydrophobicContact CG2-CD1 4.18Å; I27-L35 HydrophobicContact CG2-CD2 4.43Å; I30-L35 HydrophobicContact CB-CD1 4.42Å; I30-L35 HydrophobicContact CB-CD2 4.21Å; I30-L35 HydrophobicContact CB-CG 4.09Å; I30-L35 HydrophobicContact CD1-CD2 4.25Å; I30-L35 HydrophobicContact CG2-CD2 4.01Å; I30-L35 HydrophobicContact CG2-CG 3.78Å; P31-L35 PolarHBondContact O-N 2.97Å; L32-L35 PolarHBondContact O-N 3.48Å; L35-Y39 HydrophobicContact CD2-CD2 3.83Å; L35-Y39 HydrophobicContact CD2-CE2 3.8Å; L35-Y39 WeakPolarHBondContact O-CB 3.4Å; L35-Y39 WeakPolarHBondContact O-CD2 3.38Å; L35-Y39 PolarHBondContact O-N 3.5Å; L35-F40 WeakPolarHBondContact O-CD2 3.32Å
36	Y	50.1	Low	54.9	Low	132 Å²	132	115.4 Å²	115.4	52%	0.518	57%	0.573	S	S	.	*	I	π-helix	trans	-64.6	-49.2	178.9	-166.2	-94.1	0	0	0	112.8	L32 N33 I34 N38 F40 K41	L32-Y36 WeakPolarHBondContact O-CB 3.48Å; L32-Y36 PolarHBondContact O-N 3.16Å; N33-Y36 PolarHBondContact O-N 3.39Å; I34-Y36 VanDerWaalsContact C-N 3.28Å; I34-Y36 PolarHBondContact O-N 3.49Å; Y36-N38 PolarHBondContact O-N 3.08Å; Y36-F40 HydrophobicContact CD2-CB 3.73Å; Y36-F40 HydrophobicContact CD2-CD2 4.5Å; Y36-F40 HydrophobicContact CD2-CG 4.4Å; Y36-F40 HydrophobicContact CE2-CB 3.99Å; Y36-F40 HydrophobicContact CG-CB 4.29Å; Y36-F40 CarbonylContact O-C 3.58Å; Y36-F40 PolarHBondContact O-N 2.96Å; Y36-F40 VanDerWaalsContact O-N 3.1Å; Y36-K41 PolarHBondContact O-N 3.22Å
37	E	48.4	Very low	52.6	Low	103 Å²	103	112.2 Å²	112.2	48%	0.481	58%	0.579	S	S	.	*	I	π-helix	trans	-62.8	-40.3	178.9	-80.8	-70.8	149.4	0	0	112.7	N33 I34 K41	N33-E37 PolarHBondContact O-N 3.02Å; I34-E37 PolarHBondContact O-N 2.74Å; E37-K41 WeakPolarHBondContact O-CB 3.37Å; E37-K41 IonicContact OE1-NZ 3.87Å; E37-K41 PolarHBondContact OE1-NZ 2.85Å; E37-K41 WeakPolarHBondContact OE2-CD 3.21Å; E37-K41 IonicContact OE2-NZ 2.94Å; E37-K41 PolarHBondContact OE2-NZ 3.23Å
38	N	57.9	Low	50.4	Low	111 Å²	111	116.3 Å²	116.3	59%	0.594	60%	0.602	S	S	*	*	I	π-helix	trans	-85.6	-33.2	-173.8	-70.5	-14.9	0	0	0	114.2	I34 Y36	I34-N38 WeakPolarHBondContact O-CB 3.47Å; I34-N38 PolarHBondContact O-N 2.77Å; Y36-N38 PolarHBondContact O-N 3.08Å
39	Y	56.1	Low	48.2	Very low	143 Å²	143	120.8 Å²	120.8	56%	0.561	61%	0.613	S	S	*	*	I	π-helix	trans	-118.9	-26.8	-169.3	-57.4	-80.8	0	0	0	114.2	L35	L35-Y39 HydrophobicContact CD2-CD2 3.83Å; L35-Y39 HydrophobicContact CD2-CE2 3.8Å; L35-Y39 WeakPolarHBondContact O-CB 3.4Å; L35-Y39 WeakPolarHBondContact O-CD2 3.38Å; L35-Y39 PolarHBondContact O-N 3.5Å
40	F	46.4	Very low	45.7	Very low	126 Å²	126	121.5 Å²	121.5	55%	0.553	62%	0.622	S	S	*	*	I	π-helix	trans	-109.9	-18	-174.1	-63.3	-75.2	0	0	0	114.1	L35 Y36 Y42	L35-F40 WeakPolarHBondContact O-CD2 3.32Å; Y36-F40 HydrophobicContact CD2-CB 3.73Å; Y36-F40 HydrophobicContact CD2-CD2 4.5Å; Y36-F40 HydrophobicContact CD2-CG 4.4Å; Y36-F40 HydrophobicContact CE2-CB 3.99Å; Y36-F40 HydrophobicContact CG-CB 4.29Å; Y36-F40 CarbonylContact O-C 3.58Å; Y36-F40 PolarHBondContact O-N 2.96Å; Y36-F40 VanDerWaalsContact O-N 3.1Å; F40-Y42 VanDerWaalsContact C-N 3.34Å; F40-Y42 PolarHBondContact O-N 2.82Å
41	K	40.8	Very low	43.3	Very low	111 Å²	111	124.8 Å²	124.8	48%	0.483	65%	0.645	S	S	.	*	S	Bend	trans	-70.5	95.7	173.9	-166.9	169.2	-177.6	172.1	0	108.1	Y36 E37 S43	Y36-K41 PolarHBondContact O-N 3.22Å; E37-K41 WeakPolarHBondContact O-CB 3.37Å; E37-K41 IonicContact OE1-NZ 3.87Å; E37-K41 PolarHBondContact OE1-NZ 2.85Å; E37-K41 WeakPolarHBondContact OE2-CD 3.21Å; E37-K41 IonicContact OE2-NZ 2.94Å; E37-K41 PolarHBondContact OE2-NZ 3.23Å; K41-S43 PolarHBondContact O-N 2.85Å
42	Y	36.4	Very low	40.9	Very low	215 Å²	215	127.1 Å²	127.1	84%	0.843	66%	0.658	S	S	*	*			trans	-31.7	107.7	171.6	-69.9	-87.5	0	0	0	110	F40 K44	F40-Y42 VanDerWaalsContact C-N 3.34Å; F40-Y42 PolarHBondContact O-N 2.82Å; Y42-K44 VanDerWaalsContact C-N 3.35Å; Y42-K44 PolarHBondContact O-N 3.1Å
43	S	30.9	Very low	39	Very low	116 Å²	116	126 Å²	126	81%	0.811	66%	0.658	S	S	*	*			trans	-55.9	103.5	173.7	-39.3	0	0	0	0	106.1	K41	K41-S43 PolarHBondContact O-N 2.85Å
44	K	26.9	Very low	37.2	Very low	178 Å²	178	127.9 Å²	127.9	77%	0.774	67%	0.667	S	S	*	*			trans	-54	131	159.6	-87.4	-178.6	174.9	178.1	0	105.2	Y42 E46	Y42-K44 VanDerWaalsContact C-N 3.35Å; Y42-K44 PolarHBondContact O-N 3.1Å; K44-E46 VanDerWaalsContact C-N 3.27Å; K44-E46 PolarHBondContact O-N 3.3Å
45	P	29.6	Very low	35.2	Very low	128 Å²	128	133.7 Å²	133.7	83%	0.831	69%	0.69	S	S	*	*			trans	-67.2	94.1	-178.8	26.9	-31.2	0	0	0	107.5
46	E	28.6	Very low	33.6	Very low	186 Å²	186	137.7 Å²	137.7	87%	0.869	72%	0.715	S	S	*	*			trans	-76.4	131.7	168.8	-75.9	-169.8	170.9	0	0	108.2	K44	K44-E46 VanDerWaalsContact C-N 3.27Å; K44-E46 PolarHBondContact O-N 3.3Å
47	G	28.6	Very low	32.2	Very low	59 Å²	59	140.5 Å²	140.5	61%	0.608	73%	0.733	S	S	*	*			trans	-57.3	148.5	-161.2	0	0	0	0	0	115.6
48	N	27.6	Very low	31	Very low	165 Å²	165	145.2 Å²	145.2	88%	0.882	75%	0.747	S	S	*	*			trans	53.1	76.2	142.7	-54.7	-12.9	0	0	0	116.1
49	Q	27.4	Very low	29.2	Very low	182 Å²	182	143.5 Å²	143.5	85%	0.85	76%	0.756	S	S	*	*			trans	-109.4	105.8	151.8	-71.3	-174.1	8.6	0	0	108.9	V51	Q49-V51 PolarHBondContact O-N 3.41Å
50	S	25.6	Very low	27.8	Very low	114 Å²	114	145 Å²	145	80%	0.797	77%	0.768	S	S	*	*			trans	-59.1	100.5	171.6	50.8	0	0	0	0	109.3	T52	S50-T52 PolarHBondContact O-N 3.17Å
51	V	26.3	Very low	26.7	Very low	126 Å²	126	145.7 Å²	145.7	76%	0.764	78%	0.783	S	S	*	*			trans	-75.3	109.4	170.8	179.4	0	0	0	0	107.7	Q49 T53	Q49-V51 PolarHBondContact O-N 3.41Å; V51-T53 PolarHBondContact O-N 3.28Å
52	T	22.7	Very low	25.9	Very low	120 Å²	120	146.4 Å²	146.4	74%	0.736	79%	0.791	S	S	*	*			trans	-67.1	110.6	172.1	37.1	0	0	0	0	109.3	S50 N54	S50-T52 PolarHBondContact O-N 3.17Å; T52-N54 PolarHBondContact O-N 3.19Å
53	T	25.4	Very low	25.2	Very low	123 Å²	123	141 Å²	141	76%	0.755	78%	0.784	S	S	*	*			trans	-76.4	105.7	178.4	41.4	0	0	0	0	110	V51 K55	V51-T53 PolarHBondContact O-N 3.28Å; T53-K55 PolarHBondContact O-N 2.87Å; T53-K55 VanDerWaalsContact O-N 3.1Å
54	N	25.2	Very low	24.8	Very low	150 Å²	150	145.1 Å²	145.1	80%	0.802	78%	0.784	S	S	*	*			trans	-66.5	107.6	167.2	-76.7	-24.3	0	0	0	108.8	T52 V56	T52-N54 PolarHBondContact O-N 3.19Å; N54-V56 PolarHBondContact O-N 3.22Å; N54-V56 VanDerWaalsContact O-N 3.12Å
55	K	22.8	Very low	24.7	Very low	198 Å²	198	143.5 Å²	143.5	86%	0.861	78%	0.782	S	S	*	*			trans	-64.3	104.7	172.8	-70.4	-179.5	177.3	-179.8	0	109.1	T53	T53-K55 PolarHBondContact O-N 2.87Å; T53-K55 VanDerWaalsContact O-N 3.1Å
56	V	22.4	Very low	24.4	Very low	105 Å²	105	142.7 Å²	142.7	64%	0.636	78%	0.779	S	S	*	*			trans	-94.6	112.8	165.3	-173.7	0	0	0	0	107.5	N54 Y58	N54-V56 PolarHBondContact O-N 3.22Å; N54-V56 VanDerWaalsContact O-N 3.12Å; V56-Y58 HydrophobicContact CB-CD2 4.47Å; V56-Y58 HydrophobicContact CB-CE2 4.21Å; V56-Y58 HydrophobicContact CG1-CD2 3.73Å; V56-Y58 HydrophobicContact CG1-CE2 3.28Å; V56-Y58 PolarHBondContact O-N 3.22Å
57	Q	19.8	Very low	24.3	Very low	192 Å²	192	141 Å²	141	90%	0.897	78%	0.776	S	S	*	*			trans	-86.6	99.7	-177.6	-173.1	175.1	-3.2	0	0	108.5
58	Y	23.9	Very low	24.1	Very low	201 Å²	201	141.3 Å²	141.3	79%	0.788	78%	0.779	S	S	*	*			trans	-95.4	115.8	168.6	-78.1	-80.4	0	0	0	109	V56	V56-Y58 HydrophobicContact CB-CD2 4.47Å; V56-Y58 HydrophobicContact CB-CE2 4.21Å; V56-Y58 HydrophobicContact CG1-CD2 3.73Å; V56-Y58 HydrophobicContact CG1-CE2 3.28Å; V56-Y58 PolarHBondContact O-N 3.22Å
59	G	20.2	Very low	24.1	Very low	75 Å²	75	141.9 Å²	141.9	77%	0.773	78%	0.783	S	S	*	*			trans	-87.7	110.2	168.4	0	0	0	0	0	109
60	E	26.3	Very low	24	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.813	78%	0.783	S	S	*	*			trans	-113.3	119.5	167.9	-79.8	-174.6	159.7	0	0	109.6	I62	E60-I62 PolarHBondContact O-N 2.95Å
61	T	23.1	Very low	24.2	Very low	141 Å²	141	146.6 Å²	146.6	87%	0.865	78%	0.779	S	S	*	*			trans	-80	111.5	179.8	-39.8	0	0	0	0	108.8	S63	T61-S63 PolarHBondContact O-N 3.03Å
62	I	23.6	Very low	24.3	Very low	127 Å²	127	148.6 Å²	148.6	65%	0.651	79%	0.786	S	S	*	*			trans	-80.9	98.4	177.7	-58	173.7	0	0	0	108.6	E60 Y64	E60-I62 PolarHBondContact O-N 2.95Å; I62-Y64 HydrophobicContact CB-CE2 4.49Å; I62-Y64 HydrophobicContact CG2-CD2 4.19Å; I62-Y64 HydrophobicContact CG2-CE1 4.35Å; I62-Y64 HydrophobicContact CG2-CE2 3.79Å
63	S	23	Very low	24.7	Very low	101 Å²	101	150 Å²	150	71%	0.706	79%	0.789	S	S	*	*			trans	-85.9	111.8	167	60.1	0	0	0	0	110	T61 I65	T61-S63 PolarHBondContact O-N 3.03Å; S63-I65 PolarHBondContact O-N 3.27Å
64	Y	21.7	Very low	24.9	Very low	203 Å²	203	153.6 Å²	153.6	80%	0.796	79%	0.794	S	S	*	*			trans	-74.8	113.1	172.8	-65.9	-91.5	0	0	0	109.9	I62	I62-Y64 HydrophobicContact CB-CE2 4.49Å; I62-Y64 HydrophobicContact CG2-CD2 4.19Å; I62-Y64 HydrophobicContact CG2-CE1 4.35Å; I62-Y64 HydrophobicContact CG2-CE2 3.79Å
65	I	24.4	Very low	25	Very low	143 Å²	143	156.6 Å²	156.6	73%	0.733	80%	0.8	S	S	*	*			trans	-119.4	98	161.3	-60.1	178.4	0	0	0	107.7	S63 N67	S63-I65 PolarHBondContact O-N 3.27Å; I65-N67 PolarHBondContact O-N 3.42Å
66	S	24.2	Very low	25.1	Very low	112 Å²	112	157 Å²	157	78%	0.783	80%	0.796	S	S	*	*			trans	-80.5	103.4	169.5	53.7	0	0	0	0	109.3
67	N	26.9	Very low	25.1	Very low	150 Å²	150	157.5 Å²	157.5	80%	0.802	80%	0.804	S	S	*	*			trans	-119.7	103.6	160.6	-87.8	-20	0	0	0	109	I65	I65-N67 PolarHBondContact O-N 3.42Å
68	G	23.6	Very low	25.3	Very low	65 Å²	65	156.1 Å²	156.1	67%	0.67	80%	0.796	S	S	*	*			trans	-67.7	139.2	165.2	0	0	0	0	0	110
69	N	27.2	Very low	25.3	Very low	178 Å²	178	154.5 Å²	154.5	95%	0.952	80%	0.799	S	S	*	*				-160.1	128.9	119.2	-93.6	-32.4	0	0	0	109.8
70	R	26.6	Very low	25.5	Very low	229 Å²	229	158.7 Å²	158.7	86%	0.864	80%	0.8	S	S	*	*			trans	-109.3	148.2	-166.9	-129.9	179.8	-166.3	171.8	3.7	107.4
71	K	28.7	Very low	25.5	Very low	165 Å²	165	154.6 Å²	154.6	72%	0.717	79%	0.791	S	S	*	*			trans	93.5	108.5	157.1	-58.8	166.3	179.6	176.9	0	116
72	N	29.5	Very low	25.9	Very low	168 Å²	168	157 Å²	157	90%	0.898	79%	0.789	S	S	*	*			trans	-133.3	91.9	134.6	-90.6	-30.4	0	0	0	108.9	K74	N72-K74 PolarHBondContact O-N 2.97Å
73	N	29.5	Very low	26.1	Very low	149 Å²	149	152.5 Å²	152.5	80%	0.797	77%	0.774	S	S	*	*			trans	-75.9	95.4	170	-78	-22.8	0	0	0	108.9
74	K	29.3	Very low	26.6	Very low	199 Å²	199	151.6 Å²	151.6	87%	0.865	76%	0.756	S	S	*	*			trans	-91.4	108.4	160	-93.4	178.6	177.5	171	0	108.5	N72 R76	N72-K74 PolarHBondContact O-N 2.97Å; K74-R76 VanDerWaalsContact C-N 3.35Å; K74-R76 PolarHBondContact O-N 2.78Å
75	K	28	Very low	27.2	Very low	214 Å²	214	145 Å²	145	93%	0.93	74%	0.736	S	S	*	*			trans	-59	95.3	165.8	-76.7	179.1	176	176.5	0	108.5
76	R	24.2	Very low	27.5	Very low	205 Å²	205	138.8 Å²	138.8	77%	0.774	71%	0.705	S	S	*	*			trans	-83.7	113.4	156.4	-87.3	-178.9	171.6	167.4	-2.8	106.5	K74 F78	K74-R76 VanDerWaalsContact C-N 3.35Å; K74-R76 PolarHBondContact O-N 2.78Å; R76-F78 VanDerWaalsContact C-N 3.33Å; R76-F78 HydrophobicContact CB-CD2 4.13Å; R76-F78 HydrophobicContact CB-CE2 3.63Å; R76-F78 HydrophobicContact CB-CZ 4.08Å; R76-F78 VanDerWaalsContact O-CD2 3.26Å; R76-F78 WeakPolarHBondContact O-CD2 3.46Å; R76-F78 PolarHBondContact O-N 2.91Å
77	S	23.2	Very low	27.8	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	68%	0.681	S	S	*	*			trans	-65.2	96.5	167	49.8	0	0	0	0	107.6	I79	S77-I79 PolarHBondContact O-N 2.74Å
78	F	24.6	Very low	28	Very low	164 Å²	164	131.6 Å²	131.6	72%	0.719	66%	0.664	S	S	*	*			trans	-77.3	114.8	167	-70.5	-84.3	0	0	0	107.1	R76 M80	R76-F78 VanDerWaalsContact C-N 3.33Å; R76-F78 HydrophobicContact CB-CD2 4.13Å; R76-F78 HydrophobicContact CB-CE2 3.63Å; R76-F78 HydrophobicContact CB-CZ 4.08Å; R76-F78 VanDerWaalsContact O-CD2 3.26Å; R76-F78 WeakPolarHBondContact O-CD2 3.46Å; R76-F78 PolarHBondContact O-N 2.91Å; F78-M80 VanDerWaalsContact C-N 3.32Å; F78-M80 PolarHBondContact O-N 2.77Å
79	I	24.1	Very low	28.2	Very low	166 Å²	166	133.2 Å²	133.2	85%	0.851	67%	0.671	S	S	*	*			trans	-62	101.6	162.7	-61.8	170.9	0	0	0	104.7	S77 S81	S77-I79 PolarHBondContact O-N 2.74Å; I79-S81 PolarHBondContact O-N 3.24Å; I79-S81 VanDerWaalsContact O-N 3.15Å
80	M	24.2	Very low	28.6	Very low	164 Å²	164	131.2 Å²	131.2	81%	0.808	66%	0.66	S	S	*	*			trans	-69.7	110.1	176.5	-79.7	-169.6	50.3	0	0	108.6	F78 K82	F78-M80 VanDerWaalsContact C-N 3.32Å; F78-M80 PolarHBondContact O-N 2.77Å; M80-K82 PolarHBondContact O-N 3.04Å
81	S	26.1	Very low	28.9	Very low	88 Å²	88	124.3 Å²	124.3	62%	0.615	65%	0.647	S	S	*	*			trans	-54.6	121.7	162.7	11.9	0	0	0	0	108.3	I79 G83	I79-S81 PolarHBondContact O-N 3.24Å; I79-S81 VanDerWaalsContact O-N 3.15Å; S81-G83 PolarHBondContact O-N 3.11Å
82	K	31.4	Very low	29	Very low	191 Å²	191	122.5 Å²	122.5	83%	0.83	65%	0.65	S	S	*	*			trans	-87.1	104.9	-171.7	-142.2	174.9	-173.6	178.4	0	108	M80	M80-K82 PolarHBondContact O-N 3.04Å
83	G	28.3	Very low	29	Very low	32 Å²	32	124.5 Å²	124.5	33%	0.33	65%	0.646	S	S	.	*			trans	-64.2	152.8	178	0	0	0	0	0	113.8	S81 F211	S81-G83 PolarHBondContact O-N 3.11Å; G83-F211 CarbonylContact C-O 3.55Å; G83-F211 VanDerWaalsContact C-O 3.25Å; G83-F211 WeakPolarHBondContact CA-O 3.46Å
84	Y	32.6	Very low	29.1	Very low	83 Å²	83	124 Å²	124	33%	0.325	65%	0.653	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.7	174.2	-177.7	-79	-118.9	0	0	0	110.9	F211 A213 I298	Y84-F211 PolarHBondContact N-O 3.48Å; Y84-F211 WeakPolarHBondContact O-CD1 3.42Å; Y84-F211 WeakPolarHBondContact O-CE1 3.47Å; Y84-F211 WeakPolarHBondContact O-CZ 3.32Å; Y84-A213 HydrophobicContact CD2-CB 3.05Å; Y84-A213 HydrophobicContact CE2-CB 3.31Å; Y84-A213 HydrophobicContact CG-CB 3.79Å; Y84-I298 PolarHBondContact OH-O 3.45Å
85	V	34.2	Very low	29.1	Very low	63 Å²	63	119.1 Å²	119.1	38%	0.382	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.7	135.1	-149.7	170.4	0	0	0	0	113.2	R207 F211	V85-R207 VanDerWaalsContact CG1-NH2 3.35Å; V85-F211 VanDerWaalsContact N-CE1 3.28Å
86	I	30.3	Very low	29	Very low	14 Å²	14	120 Å²	120	7%	0.072	64%	0.639	C	S	.	*			trans	-112.6	130.5	163.2	-62.8	162.1	0	0	0	109.6	I176 R207 F211 I312 P313	I86-I176 HydrophobicContact CD1-CD1 3.18Å; I86-I176 HydrophobicContact CD1-CG1 3.85Å; I86-I176 HydrophobicContact CG1-CD1 3.62Å; I86-R207 VanDerWaalsContact O-CG 3.31Å; I86-R207 WeakPolarHBondContact O-CG 3.4Å; I86-F211 HydrophobicContact CD1-CE1 4.28Å; I86-F211 HydrophobicContact CG1-CE1 3.8Å; I86-F211 HydrophobicContact CG1-CZ 4.45Å; I86-I312 HydrophobicContact CD1-CD1 4.49Å; I86-I312 HydrophobicContact CD1-CG1 3.98Å; I86-I312 HydrophobicContact CG1-CB 4.43Å; I86-I312 HydrophobicContact CG1-CD1 3.94Å; I86-I312 HydrophobicContact CG1-CG1 3.79Å; I86-I312 HydrophobicContact CG1-CG2 3.98Å; I86-I312 HydrophobicContact CG2-CG2 4.24Å; I86-P313 HydrophobicContact CG2-CG 4.47Å
87	G	30.7	Very low	29.1	Very low	27 Å²	27	117.8 Å²	117.8	28%	0.278	64%	0.641	S	S	.	*			trans	147.3	134.8	161.4	0	0	0	0	0	115.2
88	D	31.2	Very low	29.2	Very low	83 Å²	83	119.3 Å²	119.3	44%	0.444	64%	0.64	S	S	.	*			trans	-69.7	143.4	-176.7	-63.9	-45	0	0	0	114.3	I315	D88-I315 WeakPolarHBondContact OD1-CA 3.49Å
89	A	28.9	Very low	29.4	Very low	99 Å²	99	117.8 Å²	117.8	82%	0.818	64%	0.638	S	S	*	*			trans	-110.8	80.4	165.9	0	0	0	0	0	108.7	S91	A89-S91 PolarHBondContact O-N 3.25Å
90	D	34.6	Very low	29.8	Very low	137 Å²	137	114 Å²	114	73%	0.733	62%	0.619	S	S	*	*			trans	-83.7	113	170.5	-147.4	0.3	0	0	0	108.9
91	S	33.3	Very low	30.2	Very low	83 Å²	83	114.1 Å²	114.1	58%	0.58	62%	0.617	S	S	*	*			trans	-103.9	135.5	-170.9	61.9	0	0	0	0	110.8	A89	A89-S91 PolarHBondContact O-N 3.25Å
92	T	30.1	Very low	30.7	Very low	127 Å²	127	117.7 Å²	117.7	78%	0.779	62%	0.624	S	S	*	*	S	Bend	trans	81.4	128.3	158.9	-18.2	0	0	0	0	114.9
93	Y	30.2	Very low	31.1	Very low	210 Å²	210	115.6 Å²	115.6	82%	0.824	62%	0.617	S	S	*	*			trans	77.7	104.6	-176.4	-96	-100.2	0	0	0	115.9	P95	Y93-P95 WeakPolarHBondContact O-CD 3.11Å
94	C	31.4	Very low	32.2	Very low	140 Å²	140	121.2 Å²	121.2	95%	0.946	64%	0.64	S	S	*	*			trans	-81.2	102.2	152.8	-87	0	0	0	0	108.6
95	P	29.9	Very low	33.3	Very low	96 Å²	96	119.8 Å²	119.8	62%	0.623	64%	0.637	S	S	*	*			trans	-116	131	148.7	34.8	-24.8	0	0	0	108.3	Y93	Y93-P95 WeakPolarHBondContact O-CD 3.11Å
96	R	25.7	Very low	34.9	Very low	232 Å²	232	118.6 Å²	118.6	88%	0.875	63%	0.631	S	S	*	*	S	Bend	trans	36.8	113.1	160.4	-74.1	-180	173	135.7	-0.9	116.1	N98	R96-N98 VanDerWaalsContact C-N 3.25Å; R96-N98 PolarHBondContact O-N 3.4Å
97	I	27.1	Very low	37.3	Very low	159 Å²	159	118 Å²	118	82%	0.815	63%	0.629	S	S	*	*			trans	-20.5	84.1	157.4	-57.3	162.5	0	0	0	111.2	I99	I97-I99 PolarHBondContact O-N 3.5Å
98	N	24.3	Very low	39.8	Very low	147 Å²	147	116.8 Å²	116.8	79%	0.786	62%	0.615	S	S	*	*			trans	-71.4	99.4	151	-83.6	-6.9	0	0	0	101.1	R96 I100	R96-N98 VanDerWaalsContact C-N 3.25Å; R96-N98 PolarHBondContact O-N 3.4Å; N98-I100 PolarHBondContact O-N 3.4Å
99	I	29.4	Very low	42.5	Very low	133 Å²	133	113.4 Å²	113.4	68%	0.682	60%	0.597	S	S	*	*			trans	-25.9	110.9	151.8	-61	163.3	0	0	0	104.3	I97 E101	I97-I99 PolarHBondContact O-N 3.5Å; I99-E101 WeakPolarHBondContact O-CA 3.47Å; I99-E101 WeakPolarHBondContact O-CB 3.41Å; I99-E101 PolarHBondContact O-N 2.71Å
100	I	32	Very low	45.3	Very low	87 Å²	87	108.7 Å²	108.7	45%	0.446	56%	0.558	S	S	.	*			trans	-61.3	96.3	175.9	-65.3	172.4	0	0	0	103.1	N98 E102 Q103	N98-I100 PolarHBondContact O-N 3.4Å; I100-E102 PolarHBondContact O-N 3.03Å; I100-Q103 HydrophobicContact CG2-CB 3.91Å; I100-Q103 HydrophobicContact CG2-CG 3.78Å
101	E	32.3	Very low	47.9	Very low	165 Å²	165	104.4 Å²	104.4	77%	0.771	53%	0.533	S	S	*	.			trans	-69.9	97.4	-160.2	179.4	177.8	-138.6	0	0	105.2	I99 Q103	I99-E101 WeakPolarHBondContact O-CA 3.47Å; I99-E101 WeakPolarHBondContact O-CB 3.41Å; I99-E101 PolarHBondContact O-N 2.71Å; E101-Q103 WeakPolarHBondContact O-CA 3.5Å; E101-Q103 PolarHBondContact O-N 3.33Å
102	E	36.2	Very low	50.6	Low	164 Å²	164	100.4 Å²	100.4	77%	0.766	51%	0.505	S	S	*	.			trans	30.1	39.7	178.2	-70.9	-169.5	134.2	0	0	114.2	I100 D104	I100-E102 PolarHBondContact O-N 3.03Å; E102-D104 PolarHBondContact O-N 2.92Å
103	Q	40.9	Very low	53.5	Low	146 Å²	146	97.4 Å²	97.4	68%	0.682	49%	0.49	S	S	*	.			trans	-61.8	112.5	-172.6	-83	-172.4	-11.9	0	0	104.1	I100 E101 L105	I100-Q103 HydrophobicContact CG2-CB 3.91Å; I100-Q103 HydrophobicContact CG2-CG 3.78Å; E101-Q103 WeakPolarHBondContact O-CA 3.5Å; E101-Q103 PolarHBondContact O-N 3.33Å; Q103-L105 VanDerWaalsContact C-N 3.27Å; Q103-L105 PolarHBondContact O-N 3.29Å
104	D	50.5	Low	56.3	Low	150 Å²	150	94.7 Å²	94.7	80%	0.802	48%	0.482	S	S	*	.			trans	-54.3	96.3	-167.5	-86.8	-43.5	0	0	0	107.1	E102 P106	E102-D104 PolarHBondContact O-N 2.92Å; D104-P106 WeakPolarHBondContact O-CD 3.48Å
105	L	56.5	Low	59.2	Low	53 Å²	53	89.8 Å²	89.8	28%	0.277	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-53.3	120.2	177.1	-83.6	167.9	0	0	0	104.8	Q103 G107 C125 K279	Q103-L105 VanDerWaalsContact C-N 3.27Å; Q103-L105 PolarHBondContact O-N 3.29Å; L105-G107 PolarHBondContact O-N 2.94Å; L105-C125 HydrophobicContact CB-CB 4.11Å; L105-C125 HydrophobicContact CD1-CB 4.1Å; L105-K279 HydrophobicContact CD1-CD 4.37Å; L105-K279 HydrophobicContact CD1-CG 3.49Å; L105-K279 VanDerWaalsContact CD1-CG 3.49Å
106	P	67.9	Low	62	Low	39 Å²	39	88.6 Å²	88.6	25%	0.253	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-58.3	128.9	-165.7	20.7	-32.6	0	0	0	108.1	D104 R310	D104-P106 WeakPolarHBondContact O-CD 3.48Å; P106-R310 PolarHBondContact O-NE 3.03Å; P106-R310 PolarHBondContact O-NH2 2.86Å
107	G	79.6	Confident	65.1	Low	2 Å²	2	80.1 Å²	80.1	2%	0.021	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-55.9	167	-179	0	0	0	0	0	112.4	L105 Y120 L121	L105-G107 PolarHBondContact O-N 2.94Å; G107-Y120 VanDerWaalsContact C-CE2 3.46Å; G107-Y120 VanDerWaalsContact CA-CE2 3.49Å; G107-Y120 WeakPolarHBondContact CA-OH 3.42Å; G107-Y120 PolarHBondContact N-OH 3.37Å; G107-L121 WeakPolarHBondContact CA-O 3.37Å
108	T	84.2	Confident	68.1	Low	0 Å²	0	74 Å²	74	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.5	-178.2	-60.6	0	0	0	0	110.6	L121 V124 P127 L130	T108-L121 PolarHBondContact N-O 3.31Å; T108-L121 WeakPolarHBondContact O-CB 3.36Å; T108-L121 PolarHBondContact O-N 2.77Å; T108-V124 WeakPolarHBondContact CB-O 3.14Å; T108-V124 PolarHBondContact N-O 2.72Å; T108-V124 VanDerWaalsContact N-O 3.1Å; T108-V124 PolarHBondContact OG1-O 3.1Å; T108-P127 HydrophobicContact CG2-CB 3.98Å; T108-P127 HydrophobicContact CG2-CG 3.8Å; T108-L130 HydrophobicContact CG2-CD1 3.9Å
109	W	87.7	Confident	71.2	Confident	12 Å²	12	67.1 Å²	67.1	5%	0.045	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.3	165.1	-67.7	84.4	0	0	0	109.4	W118 R119 Y120 D165 A168 F175 Y308 K309	W109-W118 HydrophobicContact CB-CE3 3.92Å; W109-W118 HydrophobicContact CB-CZ3 4.25Å; W109-W118 HydrophobicContact CE3-CB 4.18Å; W109-R119 WeakPolarHBondContact CA-O 3.48Å; W109-Y120 AromaticContact CD1-CD2 3.7Å; W109-Y120 AromaticContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CG 4.34Å; W109-Y120 AromaticContact CE2-CD2 3.43Å; W109-Y120 VanDerWaalsContact CE2-CD2 3.43Å; W109-Y120 AromaticContact CE2-CG 3.93Å; W109-Y120 HydrophobicContact CG-CD2 4.01Å; W109-Y120 HydrophobicContact CH2-CG 4.37Å; W109-Y120 AromaticContact CZ2-CD2 3.9Å; W109-Y120 HydrophobicContact CZ2-CD2 3.9Å; W109-Y120 AromaticContact CZ2-CG 3.95Å; W109-Y120 HydrophobicContact CZ2-CG 3.95Å; W109-Y120 AromaticContact NE1-CD2 3.32Å; W109-Y120 VanDerWaalsContact NE1-CD2 3.32Å; W109-Y120 AromaticContact NE1-CE2 3.7Å; W109-D165 HydrophobicContact CH2-CB 3.89Å; W109-D165 HydrophobicContact CZ3-CB 3.65Å; W109-A168 HydrophobicContact CE3-CB 4.03Å; W109-A168 HydrophobicContact CH2-CB 4.21Å; W109-A168 VanDerWaalsContact CH2-N 3.25Å; W109-A168 HydrophobicContact CZ3-CB 3.62Å; W109-F175 AromaticContact CD1-CE1 3.63Å; W109-F175 HydrophobicContact CG-CE1 4.27Å; W109-F175 AromaticContact NE1-CE1 3.61Å; W109-Y308 WeakPolarHBondContact O-CA 3.27Å; W109-K309 WeakPolarHBondContact CA-O 3.31Å; W109-K309 HydrophobicContact CB-CG 3.66Å; W109-K309 VanDerWaalsContact CB-O 3.25Å; W109-K309 WeakPolarHBondContact CB-O 3.26Å; W109-K309 HydrophobicContact CG-CG 4.32Å; W109-K309 PolarHBondContact N-O 3.49Å; W109-K309 PolarHBondContact O-N 2.81Å
110	V	87.8	Confident	74	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	138.7	179.7	61.3	0	0	0	0	110.2	W118 R119 L121 L130 W134 Y308	V110-W118 VanDerWaalsContact C-CE3 3.46Å; V110-W118 CarbonylContact O-C 3.56Å; V110-W118 WeakPolarHBondContact O-CA 3.44Å; V110-R119 HydrophobicContact CG1-CB 4.24Å; V110-R119 PolarHBondContact N-O 3.42Å; V110-R119 PolarHBondContact O-N 3.03Å; V110-L121 HydrophobicContact CB-CD1 4.47Å; V110-L121 HydrophobicContact CG1-CD1 3.65Å; V110-L121 HydrophobicContact CG1-CG 3.89Å; V110-L130 HydrophobicContact CB-CD1 4.01Å; V110-L130 HydrophobicContact CG2-CD1 4.12Å; V110-W134 HydrophobicContact CB-CD2 4.42Å; V110-W134 HydrophobicContact CB-CE3 4.28Å; V110-W134 HydrophobicContact CG1-CD2 3.69Å; V110-W134 HydrophobicContact CG1-CE3 3.52Å; V110-W134 HydrophobicContact CG1-CG 4.41Å; V110-W134 HydrophobicContact CG1-CH2 3.91Å; V110-W134 HydrophobicContact CG1-CZ2 4.05Å; V110-W134 HydrophobicContact CG1-CZ3 3.65Å; V110-W134 HydrophobicContact CG2-CB 3.77Å; V110-W134 HydrophobicContact CG2-CD2 3.81Å; V110-W134 HydrophobicContact CG2-CE3 3.74Å; V110-W134 HydrophobicContact CG2-CG 3.83Å; V110-Y308 HydrophobicContact CB-CD1 4.27Å; V110-Y308 HydrophobicContact CG2-CD1 3.81Å; V110-Y308 HydrophobicContact CG2-CE1 3.86Å
111	E	89.1	Confident	76.6	Confident	47 Å²	47	61.1 Å²	61.1	22%	0.22	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	134	170.9	-170.1	-176.7	173.6	0	0	110	S113 S116 W118 V307	E111-S113 PolarHBondContact O-N 3.13Å; E111-S116 WeakPolarHBondContact OE1-CA 3.37Å; E111-S116 WeakPolarHBondContact OE1-CB 3.48Å; E111-S116 PolarHBondContact OE1-OG 2.96Å; E111-W118 HydrophobicContact CB-CD2 4.17Å; E111-W118 HydrophobicContact CB-CE3 4.23Å; E111-W118 HydrophobicContact CB-CH2 4.05Å; E111-W118 HydrophobicContact CB-CZ2 3.98Å; E111-W118 HydrophobicContact CB-CZ3 4.17Å; E111-V307 PolarHBondContact N-O 3.37Å; E111-V307 VanDerWaalsContact N-O 3.12Å
112	C	90.5	Very high	79	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.			trans	-72.3	123.8	172.6	-178.3	0	0	0	0	111.2	F114 C115 S116 K117 W134 C136	C112-F114 PolarHBondContact O-N 3.25Å; C112-F114 VanDerWaalsContact O-N 3.16Å; C112-C115 VanDerWaalsContact CB-SG 3.55Å; C112-C115 PolarHBondContact SG-SG 3.42Å; C112-S116 VanDerWaalsContact O-CA 3.25Å; C112-S116 WeakPolarHBondContact O-CA 3.23Å; C112-S116 PolarHBondContact O-N 3.29Å; C112-K117 WeakPolarHBondContact CB-O 3.48Å; C112-K117 PolarHBondContact N-O 3.3Å; C112-W134 HydrophobicContact CB-CZ3 4.32Å; C112-C136 VanDerWaalsContact CB-SG 3.54Å; C112-C136 PolarHBondContact SG-N 2.86Å; C112-C136 PolarHBondContact SG-SG 2.98Å
113	S	89.9	Confident	81.1	Confident	64 Å²	64	56.3 Å²	56.3	45%	0.448	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26	176.7	51	0	0	0	0	115.1	E111 W134	E111-S113 PolarHBondContact O-N 3.13Å; S113-W134 WeakPolarHBondContact CB-O 3.41Å; S113-W134 PolarHBondContact N-O 2.89Å; S113-W134 PolarHBondContact OG-O 3.09Å
114	F	89.7	Confident	83.1	Confident	153 Å²	153	50.8 Å²	50.8	67%	0.671	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-39.4	-178.9	-68.2	-57.3	0	0	0	114.8	C112 Y135	C112-F114 PolarHBondContact O-N 3.25Å; C112-F114 VanDerWaalsContact O-N 3.16Å; F114-Y135 VanDerWaalsContact CD2-CB 3.45Å; F114-Y135 HydrophobicContact CD2-CD2 4.13Å; F114-Y135 AromaticContact CD2-CG 3.85Å; F114-Y135 HydrophobicContact CD2-CG 3.85Å; F114-Y135 HydrophobicContact CE2-CD1 4.01Å; F114-Y135 AromaticContact CE2-CD2 3.94Å; F114-Y135 HydrophobicContact CE2-CD2 3.94Å; F114-Y135 AromaticContact CE2-CG 3.65Å; F114-Y135 HydrophobicContact CE2-CG 3.65Å
115	C	91	Very high	84.4	Confident	37 Å²	37	44.6 Å²	44.6	25%	0.25	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-0.4	-173.9	69.6	0	0	0	0	114.1	C112 K117 C136 C160	C112-C115 VanDerWaalsContact CB-SG 3.55Å; C112-C115 PolarHBondContact SG-SG 3.42Å; C115-K117 HydrophobicContact CB-CG 4.4Å; C115-K117 PolarHBondContact O-N 2.79Å; C115-C136 VanDerWaalsContact SG-SG 3.69Å; C115-C160 HydrophobicContact CB-CB 3.93Å
116	S	89.2	Confident	85.5	Confident	71 Å²	71	42.2 Å²	42.2	50%	0.497	22%	0.221	S	C	.	.			trans	55.5	15	-178.4	-75.9	0	0	0	0	115.6	E111 C112	E111-S116 WeakPolarHBondContact OE1-CA 3.37Å; E111-S116 WeakPolarHBondContact OE1-CB 3.48Å; E111-S116 PolarHBondContact OE1-OG 2.96Å; C112-S116 VanDerWaalsContact O-CA 3.25Å; C112-S116 WeakPolarHBondContact O-CA 3.23Å; C112-S116 PolarHBondContact O-N 3.29Å
117	K	90.3	Very high	86.2	Confident	53 Å²	53	40.4 Å²	40.4	23%	0.23	21%	0.209	C	C	.	.			trans	-83.4	137.3	174.9	-63	176	-175.9	171.5	0	109.8	C112 C115 C160 E162 E164	C112-K117 WeakPolarHBondContact CB-O 3.48Å; C112-K117 PolarHBondContact N-O 3.3Å; C115-K117 HydrophobicContact CB-CG 4.4Å; C115-K117 PolarHBondContact O-N 2.79Å; K117-C160 PolarHBondContact NZ-O 3.41Å; K117-E162 VanDerWaalsContact CD-O 3.26Å; K117-E162 WeakPolarHBondContact CD-O 3.37Å; K117-E162 PolarHBondContact NZ-O 3.13Å; K117-E164 HydrophobicContact CB-CB 4.32Å; K117-E164 HydrophobicContact CB-CG 4.47Å; K117-E164 HydrophobicContact CG-CB 4.47Å
118	W	90.4	Very high	86.4	Confident	32 Å²	32	41 Å²	41	12%	0.121	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	140.2	173.6	-69.6	86.2	0	0	0	112.1	W109 V110 E111 E164 A168 F177 K309	W109-W118 HydrophobicContact CB-CE3 3.92Å; W109-W118 HydrophobicContact CB-CZ3 4.25Å; W109-W118 HydrophobicContact CE3-CB 4.18Å; V110-W118 VanDerWaalsContact C-CE3 3.46Å; V110-W118 CarbonylContact O-C 3.56Å; V110-W118 WeakPolarHBondContact O-CA 3.44Å; E111-W118 HydrophobicContact CB-CD2 4.17Å; E111-W118 HydrophobicContact CB-CE3 4.23Å; E111-W118 HydrophobicContact CB-CH2 4.05Å; E111-W118 HydrophobicContact CB-CZ2 3.98Å; E111-W118 HydrophobicContact CB-CZ3 4.17Å; W118-E164 HydrophobicContact CB-CG 4.19Å; W118-E164 WeakPolarHBondContact CB-OE1 3.34Å; W118-A168 HydrophobicContact CB-CB 3.65Å; W118-A168 HydrophobicContact CG-CB 4.24Å; W118-F177 HydrophobicContact CH2-CD1 4.48Å; W118-F177 AromaticContact CH2-CE1 3.93Å; W118-F177 HydrophobicContact CH2-CE1 3.93Å; W118-F177 HydrophobicContact CZ2-CE1 4.11Å; W118-K309 HydrophobicContact CD2-CD 4.32Å; W118-K309 HydrophobicContact CE3-CD 4.08Å; W118-K309 HydrophobicContact CE3-CG 4Å; W118-K309 HydrophobicContact CH2-CB 4.16Å; W118-K309 HydrophobicContact CH2-CD 3.92Å; W118-K309 HydrophobicContact CH2-CG 3.93Å; W118-K309 HydrophobicContact CZ2-CD 4.17Å; W118-K309 HydrophobicContact CZ3-CB 4.09Å; W118-K309 HydrophobicContact CZ3-CD 3.88Å; W118-K309 HydrophobicContact CZ3-CG 3.56Å
119	R	89.2	Confident	86.2	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.5	176.8	-60.2	-66.5	-177.2	-168.4	-18.8	109.9	W109 V110 W134 C136 P159 E162 S163 D165	W109-R119 WeakPolarHBondContact CA-O 3.48Å; V110-R119 HydrophobicContact CG1-CB 4.24Å; V110-R119 PolarHBondContact N-O 3.42Å; V110-R119 PolarHBondContact O-N 3.03Å; R119-W134 HydrophobicContact CB-CH2 3.72Å; R119-W134 HydrophobicContact CB-CZ3 4Å; R119-W134 HydrophobicContact CG-CH2 3.72Å; R119-W134 HydrophobicContact CG-CZ3 3.83Å; R119-C136 PolarHBondContact NE-SG 2.75Å; R119-P159 PolarHBondContact NH2-O 2.92Å; R119-E162 IonicContact CZ-OE2 2.79Å; R119-E162 IonicContact NH1-OE2 2.69Å; R119-E162 PolarHBondContact NH1-OE2 3.22Å; R119-E162 PolarHBondContact NH2-O 3.43Å; R119-S163 PolarHBondContact NH1-O 3.49Å; R119-S163 PolarHBondContact NH2-O 3.12Å; R119-D165 WeakPolarHBondContact CA-OD2 3.31Å
120	Y	88.9	Confident	86	Confident	86 Å²	86	46.9 Å²	46.9	34%	0.337	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.2	174.3	-174.8	-123.1	0	0	0	111.3	G107 W109 P122 D165	G107-Y120 VanDerWaalsContact C-CE2 3.46Å; G107-Y120 VanDerWaalsContact CA-CE2 3.49Å; G107-Y120 WeakPolarHBondContact CA-OH 3.42Å; G107-Y120 PolarHBondContact N-OH 3.37Å; W109-Y120 AromaticContact CD1-CD2 3.7Å; W109-Y120 AromaticContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CD2 3.84Å; W109-Y120 HydrophobicContact CD2-CG 4.34Å; W109-Y120 AromaticContact CE2-CD2 3.43Å; W109-Y120 VanDerWaalsContact CE2-CD2 3.43Å; W109-Y120 AromaticContact CE2-CG 3.93Å; W109-Y120 HydrophobicContact CG-CD2 4.01Å; W109-Y120 HydrophobicContact CH2-CG 4.37Å; W109-Y120 AromaticContact CZ2-CD2 3.9Å; W109-Y120 HydrophobicContact CZ2-CD2 3.9Å; W109-Y120 AromaticContact CZ2-CG 3.95Å; W109-Y120 HydrophobicContact CZ2-CG 3.95Å; W109-Y120 AromaticContact NE1-CD2 3.32Å; W109-Y120 VanDerWaalsContact NE1-CD2 3.32Å; W109-Y120 AromaticContact NE1-CE2 3.7Å; Y120-P122 HydrophobicContact CD1-CB 4.24Å; Y120-P122 HydrophobicContact CD1-CG 4.46Å; Y120-P122 HydrophobicContact CE1-CB 3.7Å; Y120-P122 HydrophobicContact CE1-CG 4.39Å; Y120-P122 VanDerWaalsContact O-CD 3.28Å; Y120-P122 WeakPolarHBondContact O-CD 3.4Å; Y120-D165 PolarHBondContact N-OD2 2.83Å
121	L	87.1	Confident	85.7	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.042	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	87.6	177.4	-56.7	-175.1	0	0	0	109.3	G107 T108 V110 K123 V124 L130 W134	G107-L121 WeakPolarHBondContact CA-O 3.37Å; T108-L121 PolarHBondContact N-O 3.31Å; T108-L121 WeakPolarHBondContact O-CB 3.36Å; T108-L121 PolarHBondContact O-N 2.77Å; V110-L121 HydrophobicContact CB-CD1 4.47Å; V110-L121 HydrophobicContact CG1-CD1 3.65Å; V110-L121 HydrophobicContact CG1-CG 3.89Å; L121-K123 PolarHBondContact O-N 3.09Å; L121-K123 VanDerWaalsContact O-N 3.14Å; L121-V124 HydrophobicContact CB-CB 3.89Å; L121-V124 HydrophobicContact CB-CG2 3.89Å; L121-V124 HydrophobicContact CD1-CB 4.41Å; L121-V124 HydrophobicContact CD1-CG2 4.01Å; L121-V124 PolarHBondContact O-N 2.88Å; L121-V124 VanDerWaalsContact O-N 3.16Å; L121-L130 HydrophobicContact CD1-CD1 3.96Å; L121-L130 HydrophobicContact CD1-CD2 3.67Å; L121-L130 HydrophobicContact CD1-CG 4.48Å; L121-W134 HydrophobicContact CD1-CZ2 4.33Å; L121-W134 HydrophobicContact CD2-CZ2 4.03Å
122	P	82.7	Confident	85.2	Confident	80 Å²	80	55.7 Å²	55.7	52%	0.519	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-26	-175.3	22.5	-33.2	0	0	0	113.4	Y120	Y120-P122 HydrophobicContact CD1-CB 4.24Å; Y120-P122 HydrophobicContact CD1-CG 4.46Å; Y120-P122 HydrophobicContact CE1-CB 3.7Å; Y120-P122 HydrophobicContact CE1-CG 4.39Å; Y120-P122 VanDerWaalsContact O-CD 3.28Å; Y120-P122 WeakPolarHBondContact O-CD 3.4Å
123	K	80.4	Confident	85	Confident	149 Å²	149	59.3 Å²	59.3	65%	0.648	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-14	-177.7	-62.6	-171	173.8	-158	0	113.9	L121 C125	L121-K123 PolarHBondContact O-N 3.09Å; L121-K123 VanDerWaalsContact O-N 3.14Å; K123-C125 PolarHBondContact O-N 2.97Å
124	V	82.3	Confident	85	Confident	30 Å²	30	56.8 Å²	56.8	18%	0.182	30%	0.296	C	S	.	.			trans	-93.1	102.7	-178.6	179.2	0	0	0	0	107.8	T108 L121 D126 L130	T108-V124 WeakPolarHBondContact CB-O 3.14Å; T108-V124 PolarHBondContact N-O 2.72Å; T108-V124 VanDerWaalsContact N-O 3.1Å; T108-V124 PolarHBondContact OG1-O 3.1Å; L121-V124 HydrophobicContact CB-CB 3.89Å; L121-V124 HydrophobicContact CB-CG2 3.89Å; L121-V124 HydrophobicContact CD1-CB 4.41Å; L121-V124 HydrophobicContact CD1-CG2 4.01Å; L121-V124 PolarHBondContact O-N 2.88Å; L121-V124 VanDerWaalsContact O-N 3.16Å; V124-D126 WeakPolarHBondContact CG1-O 3.49Å; V124-L130 HydrophobicContact CG1-CD1 4.23Å; V124-L130 HydrophobicContact CG1-CD2 3.95Å; V124-L130 HydrophobicContact CG1-CG 3.93Å; V124-L130 HydrophobicContact CG2-CD2 4.15Å
125	C	77.3	Confident	85	Confident	19 Å²	19	53.4 Å²	53.4	13%	0.128	28%	0.28	C	S	.	.			trans	-90.6	-6.4	-179.1	-63.1	0	0	0	0	113	L105 K123 S181 R310	L105-C125 HydrophobicContact CB-CB 4.11Å; L105-C125 HydrophobicContact CD1-CB 4.1Å; K123-C125 PolarHBondContact O-N 2.97Å; C125-S181 PolarHBondContact O-OG 2.9Å; C125-R310 VanDerWaalsContact CA-NH2 3.34Å; C125-R310 PolarHBondContact O-NH1 3.3Å; C125-R310 PolarHBondContact O-NH2 2.97Å
126	D	81	Confident	85	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.268	C	S	.	.			trans	-137.2	111.3	178.9	-176.6	-1.5	0	0	0	109.4	V124 S128 Q129 S181 S184 V278	V124-D126 WeakPolarHBondContact CG1-O 3.49Å; D126-S128 PolarHBondContact O-N 3.46Å; D126-S128 WeakPolarHBondContact OD1-CB 3.47Å; D126-S128 PolarHBondContact OD1-N 3.22Å; D126-S128 PolarHBondContact OD1-OG 3.41Å; D126-S128 PolarHBondContact OD2-OG 2.93Å; D126-Q129 HydrophobicContact CB-CG 3.93Å; D126-Q129 WeakPolarHBondContact O-CB 3.26Å; D126-Q129 PolarHBondContact O-N 3.46Å; D126-S181 WeakPolarHBondContact CA-OG 3.43Å; D126-S181 WeakPolarHBondContact CB-OG 3.4Å; D126-S181 VanDerWaalsContact CG-OG 3.25Å; D126-S181 PolarHBondContact OD1-OG 3.1Å; D126-S184 PolarHBondContact OD1-OG 2.97Å; D126-S184 WeakPolarHBondContact OD2-CB 3.34Å; D126-S184 PolarHBondContact OD2-OG 2.84Å; D126-V278 HydrophobicContact CB-CG1 4.43Å; D126-V278 HydrophobicContact CB-CG2 4.03Å
127	P	82.9	Confident	84.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-57	-29.6	178.5	-23.4	32.4	0	0	0	112.8	T108 Q129 L130 Q178 Y308 R310	T108-P127 HydrophobicContact CG2-CB 3.98Å; T108-P127 HydrophobicContact CG2-CG 3.8Å; P127-Q129 PolarHBondContact O-N 2.77Å; P127-Q129 VanDerWaalsContact O-N 3.12Å; P127-L130 WeakPolarHBondContact O-CB 3.44Å; P127-L130 PolarHBondContact O-N 2.91Å; P127-Q178 HydrophobicContact CG-CG 4.33Å; P127-Y308 HydrophobicContact CB-CG 4.26Å; P127-R310 HydrophobicContact CG-CG 4.47Å
128	S	82.3	Confident	84.7	Confident	16 Å²	16	50.3 Å²	50.3	11%	0.112	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-65.6	-16.5	179	74.4	0	0	0	0	112.8	D126 L130 H179 K243	D126-S128 PolarHBondContact O-N 3.46Å; D126-S128 WeakPolarHBondContact OD1-CB 3.47Å; D126-S128 PolarHBondContact OD1-N 3.22Å; D126-S128 PolarHBondContact OD1-OG 3.41Å; D126-S128 PolarHBondContact OD2-OG 2.93Å; S128-L130 VanDerWaalsContact C-N 3.27Å; S128-H179 WeakPolarHBondContact CA-O 3.45Å; S128-H179 WeakPolarHBondContact CB-O 3.42Å; S128-H179 PolarHBondContact N-O 3.41Å; S128-H179 VanDerWaalsContact N-O 3.08Å; S128-K243 VanDerWaalsContact O-CD 3.29Å; S128-K243 WeakPolarHBondContact O-CD 3.29Å; S128-K243 WeakPolarHBondContact O-CE 3.48Å; S128-K243 PolarHBondContact O-NZ 2.84Å
129	Q	81	Confident	84.6	Confident	115 Å²	115	49.1 Å²	49.1	54%	0.537	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-77.5	-13.6	174.3	-64.4	-177.9	-32.7	0	0	113.1	D126 P127	D126-Q129 HydrophobicContact CB-CG 3.93Å; D126-Q129 WeakPolarHBondContact O-CB 3.26Å; D126-Q129 PolarHBondContact O-N 3.46Å; P127-Q129 PolarHBondContact O-N 2.77Å; P127-Q129 VanDerWaalsContact O-N 3.12Å
130	L	84.1	Confident	84.2	Confident	19 Å²	19	52.1 Å²	52.1	10%	0.099	28%	0.279	C	S	.	.	S	Bend	trans	-81.5	153.6	176	-60.5	174.3	0	0	0	110.6	T108 V110 L121 V124 P127 S128 Y308	T108-L130 HydrophobicContact CG2-CD1 3.9Å; V110-L130 HydrophobicContact CB-CD1 4.01Å; V110-L130 HydrophobicContact CG2-CD1 4.12Å; L121-L130 HydrophobicContact CD1-CD1 3.96Å; L121-L130 HydrophobicContact CD1-CD2 3.67Å; L121-L130 HydrophobicContact CD1-CG 4.48Å; V124-L130 HydrophobicContact CG1-CD1 4.23Å; V124-L130 HydrophobicContact CG1-CD2 3.95Å; V124-L130 HydrophobicContact CG1-CG 3.93Å; V124-L130 HydrophobicContact CG2-CD2 4.15Å; P127-L130 WeakPolarHBondContact O-CB 3.44Å; P127-L130 PolarHBondContact O-N 2.91Å; S128-L130 VanDerWaalsContact C-N 3.27Å; L130-Y308 HydrophobicContact CB-CE1 3.95Å; L130-Y308 HydrophobicContact CD1-CD1 4.02Å; L130-Y308 HydrophobicContact CD1-CE1 4.03Å
131	N	81.4	Confident	83.9	Confident	101 Å²	101	52 Å²	52	54%	0.54	28%	0.28	S	S	.	.			trans	-78.2	143	170.6	-62.9	17.2	0	0	0	109	S133 W134 Y308	N131-S133 PolarHBondContact O-N 3.06Å; N131-W134 WeakPolarHBondContact O-CB 3.42Å; N131-W134 PolarHBondContact O-N 2.9Å; N131-Y308 PolarHBondContact O-OH 2.91Å
132	D	78.5	Confident	83.5	Confident	132 Å²	132	53.4 Å²	53.4	71%	0.706	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.9	177.7	-64.7	-32.2	0	0	0	113.5	W134 Y308	D132-W134 VanDerWaalsContact C-N 3.32Å; D132-W134 PolarHBondContact O-N 2.94Å; D132-Y308 WeakPolarHBondContact CA-OH 3.38Å; D132-Y308 PolarHBondContact N-OH 3.41Å; D132-Y308 PolarHBondContact OD1-OH 2.92Å
133	S	85.1	Confident	82.9	Confident	76 Å²	76	55.4 Å²	55.4	53%	0.531	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	43.7	173.6	66	0	0	0	0	111.7	N131 Y135	N131-S133 PolarHBondContact O-N 3.06Å; S133-Y135 WeakPolarHBondContact O-CD1 3.26Å; S133-Y135 PolarHBondContact O-N 2.83Å
134	W	90.2	Very high	82.1	Confident	10 Å²	10	55 Å²	55	4%	0.038	29%	0.285	C	S	.	.			trans	-63.3	139.9	177.9	-169.8	93	0	0	0	110.4	V110 C112 S113 R119 L121 N131 D132 L138 N139	V110-W134 HydrophobicContact CB-CD2 4.42Å; V110-W134 HydrophobicContact CB-CE3 4.28Å; V110-W134 HydrophobicContact CG1-CD2 3.69Å; V110-W134 HydrophobicContact CG1-CE3 3.52Å; V110-W134 HydrophobicContact CG1-CG 4.41Å; V110-W134 HydrophobicContact CG1-CH2 3.91Å; V110-W134 HydrophobicContact CG1-CZ2 4.05Å; V110-W134 HydrophobicContact CG1-CZ3 3.65Å; V110-W134 HydrophobicContact CG2-CB 3.77Å; V110-W134 HydrophobicContact CG2-CD2 3.81Å; V110-W134 HydrophobicContact CG2-CE3 3.74Å; V110-W134 HydrophobicContact CG2-CG 3.83Å; C112-W134 HydrophobicContact CB-CZ3 4.32Å; S113-W134 WeakPolarHBondContact CB-O 3.41Å; S113-W134 PolarHBondContact N-O 2.89Å; S113-W134 PolarHBondContact OG-O 3.09Å; R119-W134 HydrophobicContact CB-CH2 3.72Å; R119-W134 HydrophobicContact CB-CZ3 4Å; R119-W134 HydrophobicContact CG-CH2 3.72Å; R119-W134 HydrophobicContact CG-CZ3 3.83Å; L121-W134 HydrophobicContact CD1-CZ2 4.33Å; L121-W134 HydrophobicContact CD2-CZ2 4.03Å; N131-W134 WeakPolarHBondContact O-CB 3.42Å; N131-W134 PolarHBondContact O-N 2.9Å; D132-W134 VanDerWaalsContact C-N 3.32Å; D132-W134 PolarHBondContact O-N 2.94Å; W134-L138 HydrophobicContact CG-CD1 4.43Å; W134-N139 HydrophobicContact CH2-CB 4.16Å; W134-N139 HydrophobicContact CZ2-CB 3.84Å
135	Y	90.7	Very high	80.7	Confident	83 Å²	83	58.6 Å²	58.6	33%	0.325	31%	0.306	S	S	.	.			trans	-140.4	160.7	175.5	59.5	-81.1	0	0	0	111.4	F114 S133 A137 L138	F114-Y135 VanDerWaalsContact CD2-CB 3.45Å; F114-Y135 HydrophobicContact CD2-CD2 4.13Å; F114-Y135 AromaticContact CD2-CG 3.85Å; F114-Y135 HydrophobicContact CD2-CG 3.85Å; F114-Y135 HydrophobicContact CE2-CD1 4.01Å; F114-Y135 AromaticContact CE2-CD2 3.94Å; F114-Y135 HydrophobicContact CE2-CD2 3.94Å; F114-Y135 AromaticContact CE2-CG 3.65Å; F114-Y135 HydrophobicContact CE2-CG 3.65Å; S133-Y135 WeakPolarHBondContact O-CD1 3.26Å; S133-Y135 PolarHBondContact O-N 2.83Å; Y135-A137 HydrophobicContact CD2-CB 3.77Å; Y135-A137 HydrophobicContact CE2-CB 3.59Å; Y135-A137 PolarHBondContact O-N 3.47Å; Y135-L138 HydrophobicContact CD1-CD1 3.71Å; Y135-L138 HydrophobicContact CD1-CG 3.86Å; Y135-L138 HydrophobicContact CD2-CG 4.45Å; Y135-L138 HydrophobicContact CE1-CD1 3.57Å; Y135-L138 HydrophobicContact CE1-CD2 3.93Å; Y135-L138 HydrophobicContact CE1-CG 3.59Å; Y135-L138 HydrophobicContact CE2-CD2 4.49Å; Y135-L138 HydrophobicContact CE2-CG 4.25Å; Y135-L138 HydrophobicContact CG-CD1 4.47Å; Y135-L138 HydrophobicContact CG-CG 4.26Å; Y135-L138 WeakPolarHBondContact O-CB 3.47Å; Y135-L138 PolarHBondContact O-N 2.74Å
136	C	90.6	Very high	79.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-52.4	-36.3	-169	-73.7	0	0	0	0	113.7	C112 C115 R119 L138 N139 Y142 P159	C112-C136 VanDerWaalsContact CB-SG 3.54Å; C112-C136 PolarHBondContact SG-N 2.86Å; C112-C136 PolarHBondContact SG-SG 2.98Å; C115-C136 VanDerWaalsContact SG-SG 3.69Å; R119-C136 PolarHBondContact NE-SG 2.75Å; C136-L138 PolarHBondContact O-N 2.93Å; C136-N139 VanDerWaalsContact O-CB 3.25Å; C136-N139 WeakPolarHBondContact O-CB 3.46Å; C136-N139 PolarHBondContact O-N 3.15Å; C136-Y142 WeakPolarHBondContact O-CE2 3.29Å; C136-P159 HydrophobicContact CB-CB 3.57Å
137	A	87.6	Confident	77.9	Confident	38 Å²	38	69.9 Å²	69.9	31%	0.314	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-68.2	-16.7	-179.3	0	0	0	0	0	114.1	Y135 N139 P159	Y135-A137 HydrophobicContact CD2-CB 3.77Å; Y135-A137 HydrophobicContact CE2-CB 3.59Å; Y135-A137 PolarHBondContact O-N 3.47Å; A137-N139 PolarHBondContact O-N 3.15Å; A137-P159 HydrophobicContact CB-CB 4.45Å; A137-P159 HydrophobicContact CB-CG 3.93Å
138	L	86.2	Confident	76.4	Confident	57 Å²	57	74.4 Å²	74.4	30%	0.298	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-78.5	-1.6	172.3	-59.1	-179.5	0	0	0	112.9	W134 Y135 C136 S140	W134-L138 HydrophobicContact CG-CD1 4.43Å; Y135-L138 HydrophobicContact CD1-CD1 3.71Å; Y135-L138 HydrophobicContact CD1-CG 3.86Å; Y135-L138 HydrophobicContact CD2-CG 4.45Å; Y135-L138 HydrophobicContact CE1-CD1 3.57Å; Y135-L138 HydrophobicContact CE1-CD2 3.93Å; Y135-L138 HydrophobicContact CE1-CG 3.59Å; Y135-L138 HydrophobicContact CE2-CD2 4.49Å; Y135-L138 HydrophobicContact CE2-CG 4.25Å; Y135-L138 HydrophobicContact CG-CD1 4.47Å; Y135-L138 HydrophobicContact CG-CG 4.26Å; Y135-L138 WeakPolarHBondContact O-CB 3.47Å; Y135-L138 PolarHBondContact O-N 2.74Å; C136-L138 PolarHBondContact O-N 2.93Å; L138-S140 PolarHBondContact O-N 3.43Å
139	N	87.4	Confident	74.9	Confident	8 Å²	8	80.9 Å²	80.9	4%	0.043	44%	0.44	C	S	.	.			trans	-67.1	125	176.9	-167.5	-32.1	0	0	0	110.8	W134 C136 A137 K141 Y142	W134-N139 HydrophobicContact CH2-CB 4.16Å; W134-N139 HydrophobicContact CZ2-CB 3.84Å; C136-N139 VanDerWaalsContact O-CB 3.25Å; C136-N139 WeakPolarHBondContact O-CB 3.46Å; C136-N139 PolarHBondContact O-N 3.15Å; A137-N139 PolarHBondContact O-N 3.15Å; N139-K141 HydrophobicContact CB-CG 4.28Å; N139-K141 PolarHBondContact O-N 3.47Å; N139-K141 PolarHBondContact OD1-N 3.45Å; N139-Y142 HydrophobicContact CB-CD2 3.91Å; N139-Y142 HydrophobicContact CB-CE2 3.71Å; N139-Y142 WeakPolarHBondContact O-CD2 3.49Å; N139-Y142 PolarHBondContact O-N 2.93Å; N139-Y142 VanDerWaalsContact O-N 3.11Å
140	S	81.4	Confident	73.5	Confident	63 Å²	63	80 Å²	80	44%	0.441	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-51.1	-25.2	-178.7	67.9	0	0	0	0	115.2	L138 Y142 F143	L138-S140 PolarHBondContact O-N 3.43Å; S140-Y142 PolarHBondContact O-N 3.35Å; S140-F143 PolarHBondContact O-N 3.14Å
141	K	81.3	Confident	72	Confident	83 Å²	83	85.4 Å²	85.4	36%	0.361	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-62.4	-27	-179.5	72.4	-174	-175.2	174.4	0	113.7	N139 E162	N139-K141 HydrophobicContact CB-CG 4.28Å; N139-K141 PolarHBondContact O-N 3.47Å; N139-K141 PolarHBondContact OD1-N 3.45Å; K141-E162 IonicContact NZ-OE1 2.89Å; K141-E162 PolarHBondContact NZ-OE1 2.94Å; K141-E162 IonicContact NZ-OE2 3.06Å; K141-E162 PolarHBondContact NZ-OE2 3.35Å
142	Y	79.2	Confident	70.5	Confident	39 Å²	39	88.3 Å²	88.3	15%	0.153	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-84.8	-20.9	-178.4	-54.2	-58.3	0	0	0	114.1	C136 N139 S140 T145 H157 P159 E162	C136-Y142 WeakPolarHBondContact O-CE2 3.29Å; N139-Y142 HydrophobicContact CB-CD2 3.91Å; N139-Y142 HydrophobicContact CB-CE2 3.71Å; N139-Y142 WeakPolarHBondContact O-CD2 3.49Å; N139-Y142 PolarHBondContact O-N 2.93Å; N139-Y142 VanDerWaalsContact O-N 3.11Å; S140-Y142 PolarHBondContact O-N 3.35Å; Y142-T145 PolarHBondContact O-OG1 2.97Å; Y142-T145 VanDerWaalsContact O-OG1 3.08Å; Y142-H157 AromaticContact CD1-CE1 3.96Å; Y142-H157 AromaticContact CD1-ND1 3.81Å; Y142-H157 AromaticContact CE1-CE1 3.11Å; Y142-H157 WeakPolarHBondContact CE1-CE1 3.4Å; Y142-H157 AromaticContact CE1-ND1 3.42Å; Y142-H157 WeakPolarHBondContact CE1-ND1 3.23Å; Y142-H157 AromaticContact CZ-CE1 3.58Å; Y142-P159 HydrophobicContact CD2-CB 4.32Å; Y142-P159 HydrophobicContact CD2-CG 4.23Å; Y142-P159 HydrophobicContact CE2-CB 3.59Å; Y142-P159 HydrophobicContact CE2-CG 3.95Å; Y142-E162 VanDerWaalsContact CE1-OE1 3.31Å; Y142-E162 WeakPolarHBondContact CE1-OE1 3.44Å; Y142-E162 VanDerWaalsContact CZ-OE1 3.32Å; Y142-E162 PolarHBondContact OH-OE1 3.23Å; Y142-E162 PolarHBondContact OH-OE2 3.28Å
143	F	69.2	Low	69	Low	122 Å²	122	89.7 Å²	89.7	54%	0.535	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-24	179.9	-61.1	-69	0	0	0	112.8	S140 T145	S140-F143 PolarHBondContact O-N 3.14Å; F143-T145 VanDerWaalsContact C-N 3.31Å; F143-T145 PolarHBondContact O-N 3.44Å
144	K	63.9	Low	67.3	Low	141 Å²	141	94.7 Å²	94.7	61%	0.613	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-69.6	-26.9	179.6	-72.4	-174.9	173.8	-172.7	0	113.5	L146	K144-L146 VanDerWaalsContact C-N 3.25Å; K144-L146 PolarHBondContact O-N 3.4Å
145	T	54.1	Low	65.6	Low	104 Å²	104	104 Å²	104	64%	0.638	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-76.3	-7.7	-173.8	6	0	0	0	0	114.1	Y142 F143 T147	Y142-T145 PolarHBondContact O-OG1 2.97Å; Y142-T145 VanDerWaalsContact O-OG1 3.08Å; F143-T145 VanDerWaalsContact C-N 3.31Å; F143-T145 PolarHBondContact O-N 3.44Å; T145-T147 VanDerWaalsContact C-N 3.34Å; T145-T147 PolarHBondContact O-N 3.47Å
146	L	52.4	Low	64.4	Low	144 Å²	144	107.8 Å²	107.8	75%	0.754	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-87.3	8.2	-176.1	-77.1	145	0	0	0	114.4	K144 A148	K144-L146 VanDerWaalsContact C-N 3.25Å; K144-L146 PolarHBondContact O-N 3.4Å; L146-A148 PolarHBondContact O-N 3.5Å; L146-A148 VanDerWaalsContact O-N 3.08Å
147	T	46.5	Very low	63.4	Low	117 Å²	117	112.4 Å²	112.4	72%	0.718	60%	0.597	S	S	*	*	S	Bend	trans	-74.8	103.6	179.6	50.5	0	0	0	0	112.9	T145 N149	T145-T147 VanDerWaalsContact C-N 3.34Å; T145-T147 PolarHBondContact O-N 3.47Å; T147-N149 PolarHBondContact O-N 2.87Å
148	A	51.6	Low	63.2	Low	94 Å²	94	115.9 Å²	115.9	78%	0.777	61%	0.609	S	S	*	*	S	Bend	trans	60.7	-38.2	153.3	0	0	0	0	0	121.9	L146	L146-A148 PolarHBondContact O-N 3.5Å; L146-A148 VanDerWaalsContact O-N 3.08Å
149	N	49.7	Very low	63.2	Low	152 Å²	152	114.2 Å²	114.2	81%	0.813	60%	0.602	S	S	*	*			trans	-131.4	17.8	-166.8	-69.4	-13.4	0	0	0	115.7	T147 T151	T147-N149 PolarHBondContact O-N 2.87Å; N149-T151 PolarHBondContact O-N 2.86Å
150	S	52.9	Low	63.3	Low	97 Å²	97	115.5 Å²	115.5	68%	0.678	61%	0.611	S	S	*	*			trans	-81.7	104.7	175.2	-158.7	0	0	0	0	109.7	I152	S150-I152 PolarHBondContact O-N 3.33Å; S150-I152 VanDerWaalsContact O-N 3.08Å
151	T	53.1	Low	63.6	Low	132 Å²	132	115.2 Å²	115.2	81%	0.81	62%	0.617	S	S	*	*			trans	-44.9	115.6	169.2	14.1	0	0	0	0	109.8	N149 N153	N149-T151 PolarHBondContact O-N 2.86Å; T151-N153 VanDerWaalsContact C-N 3.32Å; T151-N153 PolarHBondContact O-N 3.24Å
152	I	49.5	Very low	63.8	Low	163 Å²	163	113.4 Å²	113.4	84%	0.836	61%	0.61	S	S	*	*	S	Bend	trans	-57	86.4	-179.9	-59.7	160.2	0	0	0	109	S150	S150-I152 PolarHBondContact O-N 3.33Å; S150-I152 VanDerWaalsContact O-N 3.08Å
153	N	46.4	Very low	64.2	Low	160 Å²	160	116.1 Å²	116.1	86%	0.856	64%	0.635	S	S	*	*			trans	172.1	60.8	153.6	-101	-20.8	0	0	0	113.5	T151	T151-N153 VanDerWaalsContact C-N 3.32Å; T151-N153 PolarHBondContact O-N 3.24Å
154	K	49.9	Very low	65	Low	181 Å²	181	113.4 Å²	113.4	79%	0.787	62%	0.624	S	S	*	*	S	Bend	trans	-140	84.6	167.8	-152.2	160	-176.7	178.9	0	112.4
155	Y	53.7	Low	65.8	Low	205 Å²	205	108.9 Å²	108.9	80%	0.804	61%	0.607	S	S	*	*			trans	64.6	116.7	171.1	-60.4	-88.5	0	0	0	114.4	H157	Y155-H157 PolarHBondContact O-N 3.39Å
156	L	65.5	Low	66.6	Low	164 Å²	164	111.5 Å²	111.5	86%	0.859	62%	0.616	S	S	*	*			trans	-54.9	93.2	156.4	-179.9	68.1	0	0	0	106.7	I158	L156-I158 PolarHBondContact O-N 3.36Å; L156-I158 VanDerWaalsContact O-N 3.15Å
157	H	71	Confident	67.3	Low	97 Å²	97	105.7 Å²	105.7	45%	0.449	59%	0.591	S	S	.	*			trans	-69.7	114	-177.5	177.3	-88.1	0	0	0	107.5	Y142 Y155 P159 E162	Y142-H157 AromaticContact CD1-CE1 3.96Å; Y142-H157 AromaticContact CD1-ND1 3.81Å; Y142-H157 AromaticContact CE1-CE1 3.11Å; Y142-H157 WeakPolarHBondContact CE1-CE1 3.4Å; Y142-H157 AromaticContact CE1-ND1 3.42Å; Y142-H157 WeakPolarHBondContact CE1-ND1 3.23Å; Y142-H157 AromaticContact CZ-CE1 3.58Å; Y155-H157 PolarHBondContact O-N 3.39Å; H157-P159 WeakPolarHBondContact O-CD 3.21Å; H157-E162 IonicContact CE1-OE1 2.65Å; H157-E162 PolarHBondContact CE1-OE1 3.31Å; H157-E162 IonicContact NE2-OE1 3.3Å; H157-E162 PolarHBondContact NE2-OE1 2.9Å
158	I	83.3	Confident	67.9	Low	111 Å²	111	100.4 Å²	100.4	57%	0.569	56%	0.559	S	S	*	*			trans	-90.3	103.3	179.2	-56.5	174	0	0	0	107.9	L156 C160 G161	L156-I158 PolarHBondContact O-N 3.36Å; L156-I158 VanDerWaalsContact O-N 3.15Å; I158-C160 VanDerWaalsContact C-N 3.27Å; I158-C160 PolarHBondContact O-N 3.01Å; I158-G161 WeakPolarHBondContact O-CA 3.2Å; I158-G161 PolarHBondContact O-N 2.63Å
159	P	85.7	Confident	68	Low	22 Å²	22	100.6 Å²	100.6	14%	0.143	55%	0.55	C	S	.	*	G	3₁₀ helix	trans	-61.7	-33.6	-172.9	-27.8	41.4	0	0	0	113.7	R119 C136 A137 Y142 H157 G161 E162	R119-P159 PolarHBondContact NH2-O 2.92Å; C136-P159 HydrophobicContact CB-CB 3.57Å; A137-P159 HydrophobicContact CB-CB 4.45Å; A137-P159 HydrophobicContact CB-CG 3.93Å; Y142-P159 HydrophobicContact CD2-CB 4.32Å; Y142-P159 HydrophobicContact CD2-CG 4.23Å; Y142-P159 HydrophobicContact CE2-CB 3.59Å; Y142-P159 HydrophobicContact CE2-CG 3.95Å; H157-P159 WeakPolarHBondContact O-CD 3.21Å; P159-G161 PolarHBondContact O-N 3.19Å; P159-E162 PolarHBondContact O-N 3.31Å
160	C	89.8	Confident	68.2	Low	35 Å²	35	101.5 Å²	101.5	24%	0.236	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-69.7	-18.2	175.1	-72.9	0	0	0	0	113.3	C115 K117 I158	C115-C160 HydrophobicContact CB-CB 3.93Å; K117-C160 PolarHBondContact NZ-O 3.41Å; I158-C160 VanDerWaalsContact C-N 3.27Å; I158-C160 PolarHBondContact O-N 3.01Å
161	G	86.7	Confident	68	Low	56 Å²	56	105.8 Å²	105.8	58%	0.577	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-74.2	-26.2	178.4	0	0	0	0	0	113.2	I158 P159	I158-G161 WeakPolarHBondContact O-CA 3.2Å; I158-G161 PolarHBondContact O-N 2.63Å; P159-G161 PolarHBondContact O-N 3.19Å
162	E	86.1	Confident	67.7	Low	46 Å²	46	108.4 Å²	108.4	22%	0.215	56%	0.555	C	S	.	*	S	Bend	trans	-59.3	147.8	176.9	-66.1	-178.3	-178.9	0	0	112	K117 R119 K141 Y142 H157 P159	K117-E162 VanDerWaalsContact CD-O 3.26Å; K117-E162 WeakPolarHBondContact CD-O 3.37Å; K117-E162 PolarHBondContact NZ-O 3.13Å; R119-E162 IonicContact CZ-OE2 2.79Å; R119-E162 IonicContact NH1-OE2 2.69Å; R119-E162 PolarHBondContact NH1-OE2 3.22Å; R119-E162 PolarHBondContact NH2-O 3.43Å; K141-E162 IonicContact NZ-OE1 2.89Å; K141-E162 PolarHBondContact NZ-OE1 2.94Å; K141-E162 IonicContact NZ-OE2 3.06Å; K141-E162 PolarHBondContact NZ-OE2 3.35Å; Y142-E162 VanDerWaalsContact CE1-OE1 3.31Å; Y142-E162 WeakPolarHBondContact CE1-OE1 3.44Å; Y142-E162 VanDerWaalsContact CZ-OE1 3.32Å; Y142-E162 PolarHBondContact OH-OE1 3.23Å; Y142-E162 PolarHBondContact OH-OE2 3.28Å; H157-E162 IonicContact CE1-OE1 2.65Å; H157-E162 PolarHBondContact CE1-OE1 3.31Å; H157-E162 IonicContact NE2-OE1 3.3Å; H157-E162 PolarHBondContact NE2-OE1 2.9Å; P159-E162 PolarHBondContact O-N 3.31Å
163	S	86.4	Confident	67.9	Low	96 Å²	96	102.8 Å²	102.8	67%	0.671	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-57.6	154.4	169.5	56.7	0	0	0	0	111.4	R119	R119-S163 PolarHBondContact NH1-O 3.49Å; R119-S163 PolarHBondContact NH2-O 3.12Å
164	E	87.5	Confident	68.9	Low	64 Å²	64	100.1 Å²	100.1	30%	0.299	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-61.8	144.9	169.8	-173.2	169.9	169.2	0	0	110.6	K117 W118 L166 A168	K117-E164 HydrophobicContact CB-CB 4.32Å; K117-E164 HydrophobicContact CB-CG 4.47Å; K117-E164 HydrophobicContact CG-CB 4.47Å; W118-E164 HydrophobicContact CB-CG 4.19Å; W118-E164 WeakPolarHBondContact CB-OE1 3.34Å; E164-L166 PolarHBondContact O-N 2.69Å; E164-A168 HydrophobicContact CG-CB 4.16Å; E164-A168 VanDerWaalsContact OE1-CB 3.27Å; E164-A168 WeakPolarHBondContact OE1-CB 3.29Å
165	D	80.8	Confident	69.8	Low	47 Å²	47	92.2 Å²	92.2	25%	0.251	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-66.1	121	178.1	-74.1	-23.1	0	0	0	109.2	W109 R119 Y120 G167 A168	W109-D165 HydrophobicContact CH2-CB 3.89Å; W109-D165 HydrophobicContact CZ3-CB 3.65Å; R119-D165 WeakPolarHBondContact CA-OD2 3.31Å; Y120-D165 PolarHBondContact N-OD2 2.83Å; D165-G167 PolarHBondContact O-N 2.92Å; D165-A168 VanDerWaalsContact O-CB 3.31Å; D165-A168 WeakPolarHBondContact O-CB 3.39Å; D165-A168 PolarHBondContact O-N 3.46Å
166	L	70.5	Confident	70.5	Confident	158 Å²	158	82.6 Å²	82.6	83%	0.827	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-52.9	-26.4	-172.7	-64.5	174.2	0	0	0	114.4	E164 A168	E164-L166 PolarHBondContact O-N 2.69Å; L166-A168 PolarHBondContact O-N 3.41Å
167	G	67.1	Low	70.9	Confident	22 Å²	22	77 Å²	77	23%	0.227	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-67.6	-15.2	177.3	0	0	0	0	0	114.5	D165 V169	D165-G167 PolarHBondContact O-N 2.92Å; G167-V169 VanDerWaalsContact C-N 3.29Å; G167-V169 PolarHBondContact O-N 3.02Å
168	A	58.1	Low	71.1	Confident	7 Å²	7	72.5 Å²	72.5	6%	0.058	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-71.1	-25.4	180	0	0	0	0	0	113.3	W109 W118 E164 D165 L166 K309	W109-A168 HydrophobicContact CE3-CB 4.03Å; W109-A168 HydrophobicContact CH2-CB 4.21Å; W109-A168 VanDerWaalsContact CH2-N 3.25Å; W109-A168 HydrophobicContact CZ3-CB 3.62Å; W118-A168 HydrophobicContact CB-CB 3.65Å; W118-A168 HydrophobicContact CG-CB 4.24Å; E164-A168 HydrophobicContact CG-CB 4.16Å; E164-A168 VanDerWaalsContact OE1-CB 3.27Å; E164-A168 WeakPolarHBondContact OE1-CB 3.29Å; D165-A168 VanDerWaalsContact O-CB 3.31Å; D165-A168 WeakPolarHBondContact O-CB 3.39Å; D165-A168 PolarHBondContact O-N 3.46Å; L166-A168 PolarHBondContact O-N 3.41Å; A168-K309 PolarHBondContact O-NZ 3.41Å
169	V	54.7	Low	70.8	Confident	98 Å²	98	71.8 Å²	71.8	59%	0.594	38%	0.379	S	S	*	.			trans	-101.1	-4.7	-168.6	-175.6	0	0	0	0	113	G167 Q171	G167-V169 VanDerWaalsContact C-N 3.29Å; G167-V169 PolarHBondContact O-N 3.02Å; V169-Q171 PolarHBondContact O-N 2.85Å
170	R	53.3	Low	70.9	Confident	170 Å²	170	71.5 Å²	71.5	64%	0.642	38%	0.376	S	S	*	.			trans	-64	98.3	175.3	-68.1	-162.3	-177.5	-149.2	1.9	109.2	E172 D173	R170-E172 PolarHBondContact O-N 2.97Å; R170-E172 VanDerWaalsContact O-N 3.1Å; R170-D173 VanDerWaalsContact CB-OD2 3.27Å; R170-D173 WeakPolarHBondContact CB-OD2 3.03Å; R170-D173 PolarHBondContact O-N 3.48Å; R170-D173 VanDerWaalsContact O-N 3.11Å
171	Q	48.6	Very low	70.7	Confident	187 Å²	187	70.1 Å²	70.1	87%	0.874	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.7	-177.8	-71.9	178.8	-8.3	0	0	112.5	V169	V169-Q171 PolarHBondContact O-N 2.85Å
172	E	47.3	Very low	70.7	Confident	188 Å²	188	68 Å²	68	88%	0.879	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-20.7	180	-62	174	-176.9	0	0	113.5	R170 E174	R170-E172 PolarHBondContact O-N 2.97Å; R170-E172 VanDerWaalsContact O-N 3.1Å; E172-E174 PolarHBondContact O-N 3.34Å
173	D	53.7	Low	70.7	Confident	45 Å²	45	66 Å²	66	24%	0.241	33%	0.334	C	S	.	.	S	Bend	trans	-79.4	112.6	175.3	-72	-63.7	0	0	0	108.7	R170 F175 K311	R170-D173 VanDerWaalsContact CB-OD2 3.27Å; R170-D173 WeakPolarHBondContact CB-OD2 3.03Å; R170-D173 PolarHBondContact O-N 3.48Å; R170-D173 VanDerWaalsContact O-N 3.11Å; D173-F175 HydrophobicContact CB-CD2 4.16Å; D173-F175 HydrophobicContact CB-CE2 3.53Å; D173-F175 HydrophobicContact CB-CZ 3.81Å; D173-F175 WeakPolarHBondContact O-CD2 3.44Å; D173-F175 WeakPolarHBondContact O-CE2 3.45Å; D173-F175 PolarHBondContact O-N 3.39Å; D173-K311 HydrophobicContact CB-CD 4.46Å; D173-K311 VanDerWaalsContact CG-CE 3.48Å; D173-K311 IonicContact OD1-NZ 3.63Å; D173-K311 PolarHBondContact OD1-NZ 3.22Å; D173-K311 VanDerWaalsContact OD2-CE 3.29Å; D173-K311 WeakPolarHBondContact OD2-CE 3.4Å; D173-K311 IonicContact OD2-NZ 2.98Å; D173-K311 PolarHBondContact OD2-NZ 2.91Å
174	E	66.8	Low	70.8	Confident	103 Å²	103	61.5 Å²	61.5	48%	0.481	30%	0.302	S	S	.	.			trans	-70.4	105.2	176.9	-156.9	176.6	-171.1	0	0	108.1	E172 I312	E172-E174 PolarHBondContact O-N 3.34Å; E174-I312 HydrophobicContact CB-CD1 3.67Å; E174-I312 HydrophobicContact CB-CG1 4.26Å; E174-I312 VanDerWaalsContact CD-CD1 3.47Å; E174-I312 HydrophobicContact CG-CD1 3.46Å; E174-I312 VanDerWaalsContact CG-CD1 3.46Å; E174-I312 HydrophobicContact CG-CG1 4.47Å; E174-I312 WeakPolarHBondContact O-CG1 3.36Å; E174-I312 PolarHBondContact O-N 3.04Å; E174-I312 WeakPolarHBondContact OE2-CD1 3.4Å
175	F	70.1	Confident	71	Confident	16 Å²	16	58.8 Å²	58.8	7%	0.07	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	143.8	177.2	-65.8	-86.4	0	0	0	111.1	W109 D173 K216 K309 R310 K311	W109-F175 AromaticContact CD1-CE1 3.63Å; W109-F175 HydrophobicContact CG-CE1 4.27Å; W109-F175 AromaticContact NE1-CE1 3.61Å; D173-F175 HydrophobicContact CB-CD2 4.16Å; D173-F175 HydrophobicContact CB-CE2 3.53Å; D173-F175 HydrophobicContact CB-CZ 3.81Å; D173-F175 WeakPolarHBondContact O-CD2 3.44Å; D173-F175 WeakPolarHBondContact O-CE2 3.45Å; D173-F175 PolarHBondContact O-N 3.39Å; F175-K216 WeakPolarHBondContact O-CD 3.44Å; F175-K309 HydrophobicContact CB-CB 4.11Å; F175-K309 HydrophobicContact CB-CD 3.98Å; F175-K309 HydrophobicContact CB-CG 4.15Å; F175-K309 HydrophobicContact CD1-CB 4.45Å; F175-K309 HydrophobicContact CD1-CD 3.98Å; F175-K309 HydrophobicContact CD1-CG 3.81Å; F175-K309 HydrophobicContact CD2-CD 4.37Å; F175-K309 HydrophobicContact CE1-CG 4.49Å; F175-K309 HydrophobicContact CG-CD 3.88Å; F175-K309 HydrophobicContact CG-CG 4.13Å; F175-R310 CarbonylContact C-O 3.57Å; F175-R310 VanDerWaalsContact CA-O 3.23Å; F175-R310 WeakPolarHBondContact CA-O 3.29Å; F175-K311 HydrophobicContact CD1-CG 3.89Å; F175-K311 HydrophobicContact CE1-CB 4.43Å; F175-K311 HydrophobicContact CE1-CD 4.35Å; F175-K311 HydrophobicContact CE1-CG 3.34Å; F175-K311 HydrophobicContact CZ-CG 3.92Å
176	I	68.2	Low	71.7	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.015	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.2	173.7	-47.6	-145.3	0	0	0	109.9	I86 Q178 F211 K216 V218 K309 R310 I312	I86-I176 HydrophobicContact CD1-CD1 3.18Å; I86-I176 HydrophobicContact CD1-CG1 3.85Å; I86-I176 HydrophobicContact CG1-CD1 3.62Å; I176-Q178 PolarHBondContact O-N 2.71Å; I176-F211 HydrophobicContact CD1-CB 4.38Å; I176-F211 HydrophobicContact CD1-CD1 3.22Å; I176-F211 HydrophobicContact CD1-CD2 3.73Å; I176-F211 HydrophobicContact CD1-CE1 3.15Å; I176-F211 HydrophobicContact CD1-CE2 3.65Å; I176-F211 HydrophobicContact CD1-CG 3.51Å; I176-F211 HydrophobicContact CD1-CZ 3.36Å; I176-F211 HydrophobicContact CG2-CB 4.05Å; I176-F211 HydrophobicContact CG2-CG 4.21Å; I176-K216 WeakPolarHBondContact CG2-O 3.44Å; I176-V218 HydrophobicContact CG2-CG2 3.96Å; I176-K309 VanDerWaalsContact O-CA 3.28Å; I176-K309 WeakPolarHBondContact O-CA 3.39Å; I176-R310 PolarHBondContact N-O 3.31Å; I176-R310 PolarHBondContact O-N 3.29Å; I176-I312 HydrophobicContact CD1-CD1 3.72Å; I176-I312 HydrophobicContact CD1-CG1 3.89Å; I176-I312 HydrophobicContact CG1-CD1 3.84Å; I176-I312 HydrophobicContact CG1-CG1 3.65Å
177	F	72.7	Confident	72.9	Confident	45 Å²	45	49.7 Å²	49.7	20%	0.197	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	110.7	172.3	-60.6	-80.1	0	0	0	109.5	W118 K216 E217 V218 Y308 K309	W118-F177 HydrophobicContact CH2-CD1 4.48Å; W118-F177 AromaticContact CH2-CE1 3.93Å; W118-F177 HydrophobicContact CH2-CE1 3.93Å; W118-F177 HydrophobicContact CZ2-CE1 4.11Å; F177-K216 HydrophobicContact CD2-CB 4.04Å; F177-K216 HydrophobicContact CE2-CB 4.32Å; F177-K216 PolarHBondContact N-O 3.4Å; F177-E217 HydrophobicContact CB-CG 4.34Å; F177-V218 PolarHBondContact O-N 3.32Å; F177-Y308 VanDerWaalsContact CA-O 3.28Å; F177-Y308 WeakPolarHBondContact CA-O 3.46Å; F177-Y308 VanDerWaalsContact CD1-O 3.29Å; F177-Y308 WeakPolarHBondContact CD1-O 3.46Å; F177-K309 HydrophobicContact CD1-CB 3.91Å; F177-K309 HydrophobicContact CE1-CB 3.96Å; F177-K309 HydrophobicContact CE1-CD 4.39Å
178	Q	75	Confident	74.2	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.019	23%	0.23	C	C	.	.			trans	-139.1	144.7	-172.9	63.8	-176.9	72.4	0	0	111.3	P127 I176 F180 Y208 V218	P127-Q178 HydrophobicContact CG-CG 4.33Å; I176-Q178 PolarHBondContact O-N 2.71Å; Q178-F180 PolarHBondContact NE2-O 3Å; Q178-Y208 VanDerWaalsContact CD-OH 3.32Å; Q178-Y208 PolarHBondContact NE2-OH 3.22Å; Q178-Y208 PolarHBondContact OE1-OH 3.22Å; Q178-V218 HydrophobicContact CB-CG2 3.83Å
179	H	78.9	Confident	75.9	Confident	96 Å²	96	51.9 Å²	51.9	44%	0.444	24%	0.243	S	C	.	.	S	Bend	trans	-97.6	-33.9	176.7	-64.6	86.9	0	0	0	111.7	S128 Y221	S128-H179 WeakPolarHBondContact CA-O 3.45Å; S128-H179 WeakPolarHBondContact CB-O 3.42Å; S128-H179 PolarHBondContact N-O 3.41Å; S128-H179 VanDerWaalsContact N-O 3.08Å; H179-Y221 PolarHBondContact N-OH 2.94Å
180	F	87.3	Confident	77.7	Confident	16 Å²	16	48.8 Å²	48.8	7%	0.07	22%	0.224	C	C	.	.			trans	-120.7	153.3	-176.8	-53.1	-71	0	0	0	111.7	Q178 V186 V200 Y221 I241 K243	Q178-F180 PolarHBondContact NE2-O 3Å; F180-V186 HydrophobicContact CD1-CG1 3.47Å; F180-V186 VanDerWaalsContact CD1-CG1 3.47Å; F180-V186 HydrophobicContact CD2-CG1 4.25Å; F180-V186 HydrophobicContact CE1-CG1 3.65Å; F180-V186 HydrophobicContact CE2-CG1 4.39Å; F180-V186 HydrophobicContact CG-CG1 3.81Å; F180-V186 HydrophobicContact CZ-CG1 4.12Å; F180-V200 HydrophobicContact CB-CG2 4.02Å; F180-Y221 HydrophobicContact CB-CE1 3.91Å; F180-Y221 HydrophobicContact CD2-CD2 4.49Å; F180-Y221 AromaticContact CD2-CE2 3.9Å; F180-Y221 HydrophobicContact CD2-CE2 3.9Å; F180-Y221 AromaticContact CD2-CZ 3.99Å; F180-Y221 PolarHBondContact N-OH 2.86Å; F180-Y221 VanDerWaalsContact N-OH 3.14Å; F180-Y221 WeakPolarHBondContact O-CE1 3.47Å; F180-I241 HydrophobicContact CD2-CG2 4.24Å; F180-I241 HydrophobicContact CE2-CG2 3.98Å; F180-K243 HydrophobicContact CE1-CB 3.91Å; F180-K243 HydrophobicContact CZ-CB 4.31Å
181	S	86.1	Confident	79.5	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.042	23%	0.231	C	C	.	.			trans	-125.2	173.8	175.6	63.4	0	0	0	0	110.7	C125 D126 G183 S184 V200 R310	C125-S181 PolarHBondContact O-OG 2.9Å; D126-S181 WeakPolarHBondContact CA-OG 3.43Å; D126-S181 WeakPolarHBondContact CB-OG 3.4Å; D126-S181 VanDerWaalsContact CG-OG 3.25Å; D126-S181 PolarHBondContact OD1-OG 3.1Å; S181-G183 PolarHBondContact O-N 3.2Å; S181-S184 PolarHBondContact N-OG 2.9Å; S181-S184 VanDerWaalsContact O-CB 3.23Å; S181-S184 WeakPolarHBondContact O-CB 3.34Å; S181-S184 PolarHBondContact O-N 3.11Å; S181-S184 PolarHBondContact O-OG 3.44Å; S181-S184 PolarHBondContact OG-OG 2.79Å; S181-V200 VanDerWaalsContact O-CB 3.28Å; S181-V200 WeakPolarHBondContact O-CB 3.33Å; S181-V200 WeakPolarHBondContact O-CG1 3.45Å; S181-R310 VanDerWaalsContact CB-NH1 3.29Å
182	V	85	Confident	81.5	Confident	11 Å²	11	42.1 Å²	42.1	7%	0.067	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	131.7	178.3	-172.6	0	0	0	0	110.2	S184 Y202 Y208 V278 S282	V182-S184 VanDerWaalsContact C-N 3.33Å; V182-Y202 HydrophobicContact CB-CD2 4.31Å; V182-Y202 HydrophobicContact CB-CE2 3.86Å; V182-Y202 HydrophobicContact CG1-CD2 3.64Å; V182-Y202 HydrophobicContact CG1-CE2 3.61Å; V182-Y202 HydrophobicContact CG1-CG 4.33Å; V182-Y202 HydrophobicContact CG2-CD1 3.98Å; V182-Y202 HydrophobicContact CG2-CD2 4Å; V182-Y202 HydrophobicContact CG2-CE1 3.61Å; V182-Y202 HydrophobicContact CG2-CE2 3.6Å; V182-Y202 HydrophobicContact CG2-CG 4.18Å; V182-Y208 HydrophobicContact CG2-CD1 3.68Å; V182-Y208 HydrophobicContact CG2-CD2 4Å; V182-Y208 HydrophobicContact CG2-CE1 4.46Å; V182-Y208 HydrophobicContact CG2-CG 3.4Å; V182-V278 WeakPolarHBondContact O-CG1 3.16Å; V182-S282 WeakPolarHBondContact CG1-OG 3.15Å; V182-S282 PolarHBondContact O-OG 2.87Å
183	G	86	Confident	83.7	Confident	4 Å²	4	38.5 Å²	38.5	4%	0.041	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	-10	-174.9	0	0	0	0	0	114.1	S181 V185 V200	S181-G183 PolarHBondContact O-N 3.2Å; G183-V185 PolarHBondContact O-N 3.17Å; G183-V200 PolarHBondContact N-O 3.45Å
184	S	89.9	Confident	85.5	Confident	1 Å²	1	37 Å²	37	1%	0.007	19%	0.186	C	C	.	.			trans	-61.5	131.2	171.8	-58.8	0	0	0	0	110.3	D126 S181 V182 M199 V200	D126-S184 PolarHBondContact OD1-OG 2.97Å; D126-S184 WeakPolarHBondContact OD2-CB 3.34Å; D126-S184 PolarHBondContact OD2-OG 2.84Å; S181-S184 PolarHBondContact N-OG 2.9Å; S181-S184 VanDerWaalsContact O-CB 3.23Å; S181-S184 WeakPolarHBondContact O-CB 3.34Å; S181-S184 PolarHBondContact O-N 3.11Å; S181-S184 PolarHBondContact O-OG 3.44Å; S181-S184 PolarHBondContact OG-OG 2.79Å; V182-S184 VanDerWaalsContact C-N 3.33Å; S184-M199 WeakPolarHBondContact O-CA 3.49Å; S184-V200 PolarHBondContact O-N 3.12Å
185	V	91.4	Very high	86.9	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.048	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.4	174.9	-169.3	0	0	0	0	108.4	G183 A198 L226 F244 A270 A273 L274	G183-V185 PolarHBondContact O-N 3.17Å; V185-A198 WeakPolarHBondContact CA-O 3.43Å; V185-L226 HydrophobicContact CG1-CD1 4.37Å; V185-F244 HydrophobicContact CB-CB 4.19Å; V185-F244 HydrophobicContact CG1-CB 3.78Å; V185-F244 HydrophobicContact CG1-CD1 3.9Å; V185-F244 HydrophobicContact CG1-CG 3.82Å; V185-F244 WeakPolarHBondContact O-CB 3.33Å; V185-F244 PolarHBondContact O-N 2.79Å; V185-F244 VanDerWaalsContact O-N 3.17Å; V185-A270 HydrophobicContact CG1-CB 3.83Å; V185-A273 HydrophobicContact CG2-CB 3.78Å; V185-L274 HydrophobicContact CB-CD2 3.93Å; V185-L274 HydrophobicContact CB-CG 4.5Å; V185-L274 HydrophobicContact CG2-CD2 3.98Å; V185-L274 HydrophobicContact CG2-CG 4.43Å
186	V	94.4	Very high	88.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	153.2	-170.2	-62.9	0	0	0	0	111.4	F180 P197 A198 V200 I223 I241 H242	F180-V186 HydrophobicContact CD1-CG1 3.47Å; F180-V186 VanDerWaalsContact CD1-CG1 3.47Å; F180-V186 HydrophobicContact CD2-CG1 4.25Å; F180-V186 HydrophobicContact CE1-CG1 3.65Å; F180-V186 HydrophobicContact CE2-CG1 4.39Å; F180-V186 HydrophobicContact CG-CG1 3.81Å; F180-V186 HydrophobicContact CZ-CG1 4.12Å; V186-P197 CarbonylContact O-C 3.53Å; V186-P197 WeakPolarHBondContact O-CA 3.29Å; V186-A198 HydrophobicContact CG2-CB 4.14Å; V186-A198 PolarHBondContact N-O 2.75Å; V186-A198 PolarHBondContact O-N 2.82Å; V186-V200 HydrophobicContact CG1-CG2 4.44Å; V186-I223 HydrophobicContact CG2-CG2 4.42Å; V186-I241 HydrophobicContact CB-CG2 3.46Å; V186-I241 VanDerWaalsContact CB-CG2 3.46Å; V186-I241 HydrophobicContact CG1-CG2 3.78Å; V186-I241 HydrophobicContact CG2-CG2 3.57Å; V186-H242 CarbonylContact C-O 3.58Å; V186-H242 VanDerWaalsContact CA-O 3.29Å; V186-H242 WeakPolarHBondContact CA-O 3.01Å; V186-H242 WeakPolarHBondContact CB-O 3.15Å
187	W	96.2	Very high	89.3	Confident	13 Å²	13	34.6 Å²	34.6	5%	0.049	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	132.4	160.6	-71.1	112.2	0	0	0	109.3	D195 P197 I241 H242 F244 F247 V250 L263	W187-D195 HydrophobicContact CE3-CB 4.16Å; W187-D195 WeakPolarHBondContact CZ3-O 3.24Å; W187-P197 HydrophobicContact CE3-CG 4.04Å; W187-P197 HydrophobicContact CH2-CG 3.74Å; W187-P197 HydrophobicContact CZ3-CB 4.4Å; W187-P197 VanDerWaalsContact CZ3-CD 3.42Å; W187-P197 HydrophobicContact CZ3-CG 3.44Å; W187-P197 VanDerWaalsContact CZ3-CG 3.44Å; W187-I241 CarbonylContact O-C 3.49Å; W187-I241 VanDerWaalsContact O-CA 3.23Å; W187-I241 WeakPolarHBondContact O-CA 3.45Å; W187-H242 WeakPolarHBondContact CB-CE1 3.31Å; W187-H242 WeakPolarHBondContact CB-ND1 3.33Å; W187-H242 VanDerWaalsContact CB-NE2 3.32Å; W187-H242 WeakPolarHBondContact CB-NE2 3.32Å; W187-H242 AromaticContact CD1-CE1 3.27Å; W187-H242 AromaticContact CD1-ND1 3.37Å; W187-H242 AromaticContact CG-CE1 3.29Å; W187-H242 AromaticContact CG-ND1 3.67Å; W187-H242 AromaticContact CG-NE2 3.96Å; W187-H242 PolarHBondContact N-O 2.9Å; W187-H242 PolarHBondContact O-N 2.9Å; W187-F244 AromaticContact CD1-CD2 3.99Å; W187-F244 AromaticContact CD2-CD2 3.79Å; W187-F244 HydrophobicContact CD2-CD2 3.79Å; W187-F244 HydrophobicContact CD2-CE2 4.35Å; W187-F244 AromaticContact CE2-CD2 3.26Å; W187-F244 AromaticContact CE2-CE2 3.58Å; W187-F244 HydrophobicContact CE3-CD2 4.46Å; W187-F244 HydrophobicContact CG-CD2 4.21Å; W187-F244 HydrophobicContact CH2-CD2 4.2Å; W187-F244 AromaticContact CH2-CE2 3.77Å; W187-F244 HydrophobicContact CH2-CE2 3.77Å; W187-F244 AromaticContact CZ2-CD2 3.49Å; W187-F244 HydrophobicContact CZ2-CD2 3.49Å; W187-F244 VanDerWaalsContact CZ2-CD2 3.49Å; W187-F244 AromaticContact CZ2-CE2 3.23Å; W187-F244 HydrophobicContact CZ2-CE2 3.23Å; W187-F244 HydrophobicContact CZ2-CZ 4.3Å; W187-F244 AromaticContact NE1-CD2 3.42Å; W187-F247 AromaticContact CH2-CD2 3.67Å; W187-F247 HydrophobicContact CH2-CD2 3.67Å; W187-F247 AromaticContact CH2-CE2 3.87Å; W187-F247 HydrophobicContact CH2-CE2 3.87Å; W187-F247 HydrophobicContact CZ2-CD2 4.13Å; W187-V250 HydrophobicContact CH2-CG2 3.43Å; W187-V250 VanDerWaalsContact CH2-CG2 3.43Å; W187-V250 HydrophobicContact CZ2-CG2 3.47Å; W187-V250 VanDerWaalsContact CZ2-CG2 3.47Å; W187-V250 HydrophobicContact CZ3-CG2 4.4Å; W187-L263 HydrophobicContact CZ3-CD1 4.25Å
188	A	95.8	Very high	90.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.6	178.6	0	0	0	0	0	111.9	W196 A198 I223 F225 R240 I241	A188-W196 PolarHBondContact N-O 2.81Å; A188-W196 PolarHBondContact O-N 3.17Å; A188-A198 HydrophobicContact CB-CB 4.14Å; A188-I223 HydrophobicContact CB-CD1 3.24Å; A188-F225 HydrophobicContact CB-CE1 3.7Å; A188-F225 HydrophobicContact CB-CZ 4.14Å; A188-R240 WeakPolarHBondContact CA-O 2.92Å; A188-I241 HydrophobicContact CB-CG1 4.4Å
189	K	93.8	Very high	91.3	Very high	76 Å²	76	33.3 Å²	33.3	33%	0.33	17%	0.171	S	C	.	.			trans	-105	123.2	-177.3	-178.9	52.2	141.1	-142.5	0	112.7	Y193 D195 R240	K189-Y193 WeakPolarHBondContact CD-O 3.45Å; K189-Y193 WeakPolarHBondContact CE-O 3.42Å; K189-Y193 PolarHBondContact NZ-O 3.47Å; K189-D195 WeakPolarHBondContact CD-OD1 3.32Å; K189-D195 VanDerWaalsContact CE-OD1 3.28Å; K189-D195 WeakPolarHBondContact CE-OD1 3.34Å; K189-D195 IonicContact NZ-OD1 2.86Å; K189-D195 PolarHBondContact NZ-OD1 2.68Å; K189-R240 HydrophobicContact CB-CB 4.31Å; K189-R240 PolarHBondContact N-O 2.92Å
190	T	91.9	Very high	91.8	Very high	32 Å²	32	28.8 Å²	28.8	20%	0.196	15%	0.15	C	C	.	.			trans	-120.1	155.8	170	54.3	0	0	0	0	111.5	G192 Y193 F225 I236	T190-G192 PolarHBondContact O-N 3.09Å; T190-Y193 PolarHBondContact O-N 2.95Å; T190-F225 HydrophobicContact CG2-CE2 4.17Å; T190-F225 HydrophobicContact CG2-CZ 3.61Å; T190-I236 HydrophobicContact CG2-CD1 3.51Å
191	Q	91.5	Very high	91.8	Very high	167 Å²	167	29.6 Å²	29.6	78%	0.78	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	129.6	-178.9	-173.3	62.7	34.7	0	0	110.6	Y193	Q191-Y193 VanDerWaalsContact C-N 3.33Å
192	G	90.6	Very high	91.7	Very high	51 Å²	51	32.9 Å²	32.9	53%	0.526	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	-3	177.5	0	0	0	0	0	115.6	T190	T190-G192 PolarHBondContact O-N 3.09Å
193	Y	92	Very high	91.7	Very high	112 Å²	112	33.1 Å²	33.1	44%	0.439	17%	0.166	S	C	.	.	S	Bend	trans	-119.1	151.3	178.2	-68.7	-92.9	0	0	0	111.2	K189 T190 Q191 F259	K189-Y193 WeakPolarHBondContact CD-O 3.45Å; K189-Y193 WeakPolarHBondContact CE-O 3.42Å; K189-Y193 PolarHBondContact NZ-O 3.47Å; T190-Y193 PolarHBondContact O-N 2.95Å; Q191-Y193 VanDerWaalsContact C-N 3.33Å; Y193-F259 HydrophobicContact CD1-CD1 4.37Å; Y193-F259 AromaticContact CD1-CE1 3.57Å; Y193-F259 HydrophobicContact CD1-CE1 3.57Å; Y193-F259 AromaticContact CD1-CZ 3.95Å; Y193-F259 HydrophobicContact CD1-CZ 3.95Å; Y193-F259 AromaticContact CE1-CE1 3.69Å; Y193-F259 HydrophobicContact CE1-CE1 3.69Å; Y193-F259 HydrophobicContact CE1-CZ 4.25Å
194	P	93	Very high	91.5	Very high	14 Å²	14	35.7 Å²	35.7	9%	0.091	18%	0.183	C	C	.	.			trans	-61.9	170.1	164.3	30.2	-34.5	0	0	0	109.7	W196 I255 F259 L263	P194-W196 HydrophobicContact CG-CE3 4.07Å; P194-W196 HydrophobicContact CG-CZ3 4.23Å; P194-W196 PolarHBondContact O-N 2.93Å; P194-I255 HydrophobicContact CB-CD1 4.19Å; P194-I255 HydrophobicContact CB-CG1 4.42Å; P194-I255 HydrophobicContact CB-CG2 4.05Å; P194-I255 HydrophobicContact CG-CG2 4.03Å; P194-F259 HydrophobicContact CG-CB 4.22Å; P194-F259 HydrophobicContact CG-CD2 4.08Å; P194-F259 HydrophobicContact CG-CG 4.13Å; P194-L263 HydrophobicContact CG-CD2 4.34Å
195	D	94.5	Very high	91.1	Very high	55 Å²	55	39.3 Å²	39.3	29%	0.294	20%	0.2	S	C	.	.			trans	-60.3	131.3	170.1	-67.9	15.2	0	0	0	107.6	W187 K189 H242	W187-D195 HydrophobicContact CE3-CB 4.16Å; W187-D195 WeakPolarHBondContact CZ3-O 3.24Å; K189-D195 WeakPolarHBondContact CD-OD1 3.32Å; K189-D195 VanDerWaalsContact CE-OD1 3.28Å; K189-D195 WeakPolarHBondContact CE-OD1 3.34Å; K189-D195 IonicContact NZ-OD1 2.86Å; K189-D195 PolarHBondContact NZ-OD1 2.68Å; D195-H242 IonicContact OD2-CD2 2.7Å; D195-H242 IonicContact OD2-CE1 3.17Å; D195-H242 IonicContact OD2-NE2 2.93Å; D195-H242 PolarHBondContact OD2-NE2 3.47Å
196	W	95.1	Very high	90.6	Very high	16 Å²	16	40.2 Å²	40.2	6%	0.061	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.9	-168.7	-157.9	-78.2	0	0	0	110.5	A188 P194 A198 F225 L226 F259 R262 L263 A266	A188-W196 PolarHBondContact N-O 2.81Å; A188-W196 PolarHBondContact O-N 3.17Å; P194-W196 HydrophobicContact CG-CE3 4.07Å; P194-W196 HydrophobicContact CG-CZ3 4.23Å; P194-W196 PolarHBondContact O-N 2.93Å; W196-A198 PolarHBondContact O-N 3.39Å; W196-F225 HydrophobicContact CB-CD1 3.83Å; W196-F225 HydrophobicContact CB-CE1 3.98Å; W196-F225 AromaticContact CD1-CD1 3.77Å; W196-F225 HydrophobicContact CG-CD1 4.04Å; W196-L226 PolarHBondContact NE1-O 3.33Å; W196-F259 HydrophobicContact CZ3-CB 4.34Å; W196-F259 HydrophobicContact CZ3-CD1 4.07Å; W196-F259 HydrophobicContact CZ3-CG 4.49Å; W196-R262 HydrophobicContact CH2-CB 3.57Å; W196-R262 HydrophobicContact CZ2-CB 3.94Å; W196-L263 HydrophobicContact CD2-CD1 4.14Å; W196-L263 HydrophobicContact CE3-CD1 4Å; W196-L263 HydrophobicContact CH2-CB 4.25Å; W196-L263 HydrophobicContact CZ3-CB 4.28Å; W196-L263 HydrophobicContact CZ3-CD1 4.26Å; W196-A266 HydrophobicContact CZ2-CB 4.13Å
197	P	95.2	Very high	90.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	135.2	179.2	-16.8	30	0	0	0	111.2	V186 W187 L226 F244 A266 A270	V186-P197 CarbonylContact O-C 3.53Å; V186-P197 WeakPolarHBondContact O-CA 3.29Å; W187-P197 HydrophobicContact CE3-CG 4.04Å; W187-P197 HydrophobicContact CH2-CG 3.74Å; W187-P197 HydrophobicContact CZ3-CB 4.4Å; W187-P197 VanDerWaalsContact CZ3-CD 3.42Å; W187-P197 HydrophobicContact CZ3-CG 3.44Å; W187-P197 VanDerWaalsContact CZ3-CG 3.44Å; P197-L226 HydrophobicContact CB-CB 4.45Å; P197-L226 HydrophobicContact CB-CD1 4.18Å; P197-L226 WeakPolarHBondContact O-CB 3.46Å; P197-L226 PolarHBondContact O-N 3.27Å; P197-F244 HydrophobicContact CB-CD2 4.19Å; P197-F244 HydrophobicContact CB-CE2 4.12Å; P197-F244 HydrophobicContact CG-CE2 4.12Å; P197-A266 HydrophobicContact CG-CB 4.09Å; P197-A270 HydrophobicContact CB-CB 3.64Å; P197-A270 HydrophobicContact CG-CB 4.37Å
198	A	94.6	Very high	89.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	168.7	-177.4	0	0	0	0	0	110.3	V185 V186 A188 W196 I223 V224 F225	V185-A198 WeakPolarHBondContact CA-O 3.43Å; V186-A198 HydrophobicContact CG2-CB 4.14Å; V186-A198 PolarHBondContact N-O 2.75Å; V186-A198 PolarHBondContact O-N 2.82Å; A188-A198 HydrophobicContact CB-CB 4.14Å; W196-A198 PolarHBondContact O-N 3.39Å; A198-I223 HydrophobicContact CB-CB 4.21Å; A198-I223 HydrophobicContact CB-CD1 3.8Å; A198-I223 HydrophobicContact CB-CG1 4.43Å; A198-V224 CarbonylContact C-O 3.56Å; A198-V224 WeakPolarHBondContact CA-O 2.99Å; A198-V224 WeakPolarHBondContact CB-O 3.39Å; A198-F225 HydrophobicContact CB-CD1 4.01Å; A198-F225 HydrophobicContact CB-CE1 4.43Å
199	M	93.5	Very high	89.3	Confident	21 Å²	21	43.8 Å²	43.8	10%	0.103	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	138.5	175.5	-174.1	176.5	66.1	0	0	110.1	S184 I223 V224 L226	S184-M199 WeakPolarHBondContact O-CA 3.49Å; M199-I223 CarbonylContact O-C 3.25Å; M199-I223 VanDerWaalsContact O-CA 3.29Å; M199-I223 WeakPolarHBondContact O-CA 3.45Å; M199-V224 HydrophobicContact CB-CG1 4.11Å; M199-V224 HydrophobicContact CE-CG1 4.3Å; M199-V224 PolarHBondContact N-O 2.77Å; M199-V224 WeakPolarHBondContact O-CG1 3.44Å; M199-V224 PolarHBondContact O-N 2.98Å; M199-L226 HydrophobicContact CB-CD2 4.5Å
200	V	89.5	Confident	89.1	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.3	173.9	178.2	0	0	0	0	109.4	F180 S181 G183 S184 V186 Y208 Y221 Y222 I223	F180-V200 HydrophobicContact CB-CG2 4.02Å; S181-V200 VanDerWaalsContact O-CB 3.28Å; S181-V200 WeakPolarHBondContact O-CB 3.33Å; S181-V200 WeakPolarHBondContact O-CG1 3.45Å; G183-V200 PolarHBondContact N-O 3.45Å; S184-V200 PolarHBondContact O-N 3.12Å; V186-V200 HydrophobicContact CG1-CG2 4.44Å; V200-Y208 HydrophobicContact CG1-CD2 3.9Å; V200-Y208 HydrophobicContact CG1-CG 4.42Å; V200-Y221 HydrophobicContact CG1-CD1 4.15Å; V200-Y221 HydrophobicContact CG2-CD1 4.26Å; V200-Y222 WeakPolarHBondContact CA-O 3.46Å; V200-I223 HydrophobicContact CG2-CG2 4.25Å
201	Y	86.8	Confident	88.8	Confident	34 Å²	34	40.9 Å²	40.9	13%	0.133	21%	0.211	C	C	.	.			trans	-137	160.1	-175.7	85.1	-70.4	0	0	0	111.9	N203 Y208 Y222 I223 V224 K233	Y201-N203 HydrophobicContact CE2-CB 4.48Å; Y201-Y208 WeakPolarHBondContact O-CA 3.41Å; Y201-Y208 WeakPolarHBondContact O-CB 3.31Å; Y201-Y222 WeakPolarHBondContact CD1-O 3.42Å; Y201-Y222 PolarHBondContact N-O 3.04Å; Y201-I223 VanDerWaalsContact CE1-C 3.46Å; Y201-I223 VanDerWaalsContact CE1-O 3.24Å; Y201-I223 WeakPolarHBondContact CE1-O 3.33Å; Y201-V224 HydrophobicContact CD1-CB 4.11Å; Y201-V224 HydrophobicContact CD1-CG1 4.38Å; Y201-V224 HydrophobicContact CG-CB 4.47Å; Y201-V224 HydrophobicContact CG-CG1 4.44Å; Y201-K233 HydrophobicContact CE1-CB 4.29Å; Y201-K233 HydrophobicContact CE1-CG 4.16Å; Y201-K233 HydrophobicContact CE2-CD 3.81Å; Y201-K233 HydrophobicContact CE2-CG 4.2Å
202	Y	85.2	Confident	88.5	Confident	75 Å²	75	34.4 Å²	34.4	29%	0.294	18%	0.181	S	C	.	.			trans	-75.9	121.7	168.4	-68.2	-69.5	0	0	0	110.8	V182 G206 R207 Y208	V182-Y202 HydrophobicContact CB-CD2 4.31Å; V182-Y202 HydrophobicContact CB-CE2 3.86Å; V182-Y202 HydrophobicContact CG1-CD2 3.64Å; V182-Y202 HydrophobicContact CG1-CE2 3.61Å; V182-Y202 HydrophobicContact CG1-CG 4.33Å; V182-Y202 HydrophobicContact CG2-CD1 3.98Å; V182-Y202 HydrophobicContact CG2-CD2 4Å; V182-Y202 HydrophobicContact CG2-CE1 3.61Å; V182-Y202 HydrophobicContact CG2-CE2 3.6Å; V182-Y202 HydrophobicContact CG2-CG 4.18Å; Y202-G206 WeakPolarHBondContact CD1-O 3.28Å; Y202-R207 CarbonylContact C-O 3.51Å; Y202-R207 WeakPolarHBondContact CA-O 3.4Å; Y202-Y208 HydrophobicContact CD1-CD1 4.26Å; Y202-Y208 AromaticContact CE1-CD1 3.78Å; Y202-Y208 HydrophobicContact CE1-CD1 3.78Å
203	N	85	Confident	88	Confident	16 Å²	16	33.1 Å²	33.1	9%	0.086	17%	0.166	C	C	.	.			trans	-65.6	178.3	170.4	78.3	4.1	0	0	0	111.6	Y201 Q205 G206 R207 Y222	Y201-N203 HydrophobicContact CE2-CB 4.48Å; N203-Q205 PolarHBondContact O-N 3.2Å; N203-Q205 VanDerWaalsContact O-N 3.11Å; N203-Q205 VanDerWaalsContact OD1-CA 3.29Å; N203-Q205 WeakPolarHBondContact OD1-CA 3.23Å; N203-Q205 WeakPolarHBondContact OD1-CB 3.47Å; N203-Q205 PolarHBondContact OD1-N 3.37Å; N203-G206 PolarHBondContact O-N 3.17Å; N203-G206 PolarHBondContact OD1-N 3.32Å; N203-R207 WeakPolarHBondContact CB-O 3.22Å; N203-R207 PolarHBondContact N-O 3.38Å; N203-R207 PolarHBondContact OD1-N 3.1Å; N203-R207 PolarHBondContact OD1-O 3.33Å; N203-Y222 HydrophobicContact CB-CD1 3.78Å; N203-Y222 HydrophobicContact CB-CD2 4.42Å; N203-Y222 HydrophobicContact CB-CE1 4.11Å; N203-Y222 HydrophobicContact CB-CG 3.93Å; N203-Y222 WeakPolarHBondContact ND2-CE1 3.47Å; N203-Y222 WeakPolarHBondContact ND2-CE2 3.41Å
204	S	80.8	Confident	87.6	Confident	58 Å²	58	30.4 Å²	30.4	41%	0.406	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-16	179.5	51.4	0	0	0	0	114.2	S288 P290	S204-S288 WeakPolarHBondContact CB-O 3.22Å; S204-P290 WeakPolarHBondContact O-CB 3.38Å
205	Q	82.2	Confident	87	Confident	77 Å²	77	30.8 Å²	30.8	36%	0.36	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	9	175.6	-56.7	179	-43.8	0	0	112.3	N203 R207	N203-Q205 PolarHBondContact O-N 3.2Å; N203-Q205 VanDerWaalsContact O-N 3.11Å; N203-Q205 VanDerWaalsContact OD1-CA 3.29Å; N203-Q205 WeakPolarHBondContact OD1-CA 3.23Å; N203-Q205 WeakPolarHBondContact OD1-CB 3.47Å; N203-Q205 PolarHBondContact OD1-N 3.37Å; Q205-R207 VanDerWaalsContact C-N 3.28Å; Q205-R207 HydrophobicContact CB-CG 3.93Å; Q205-R207 PolarHBondContact O-N 2.89Å
206	G	81.7	Confident	86.3	Confident	26 Å²	26	31.7 Å²	31.7	27%	0.268	16%	0.163	S	C	.	.	S	Bend	trans	72.9	17.4	-177.6	0	0	0	0	0	114.1	Y202 N203	Y202-G206 WeakPolarHBondContact CD1-O 3.28Å; N203-G206 PolarHBondContact O-N 3.17Å; N203-G206 PolarHBondContact OD1-N 3.32Å
207	R	83	Confident	85.7	Confident	63 Å²	63	34.4 Å²	34.4	24%	0.238	18%	0.177	C	C	.	.			trans	-108.2	142.1	-176.6	-42.9	-178.3	179.4	176.2	-4.8	111	V85 I86 Y202 N203 Q205 Y222	V85-R207 VanDerWaalsContact CG1-NH2 3.35Å; I86-R207 VanDerWaalsContact O-CG 3.31Å; I86-R207 WeakPolarHBondContact O-CG 3.4Å; Y202-R207 CarbonylContact C-O 3.51Å; Y202-R207 WeakPolarHBondContact CA-O 3.4Å; N203-R207 WeakPolarHBondContact CB-O 3.22Å; N203-R207 PolarHBondContact N-O 3.38Å; N203-R207 PolarHBondContact OD1-N 3.1Å; N203-R207 PolarHBondContact OD1-O 3.33Å; Q205-R207 VanDerWaalsContact C-N 3.28Å; Q205-R207 HydrophobicContact CB-CG 3.93Å; Q205-R207 PolarHBondContact O-N 2.89Å; R207-Y222 HydrophobicContact CB-CE2 4.31Å
208	Y	85.8	Confident	85.4	Confident	21 Å²	21	35.2 Å²	35.2	8%	0.082	18%	0.181	C	C	.	.	S	Bend	trans	-116.5	-14.9	176.6	71.4	-86.1	0	0	0	113.8	Q178 V182 V200 Y201 Y202 Y221 Y222	Q178-Y208 VanDerWaalsContact CD-OH 3.32Å; Q178-Y208 PolarHBondContact NE2-OH 3.22Å; Q178-Y208 PolarHBondContact OE1-OH 3.22Å; V182-Y208 HydrophobicContact CG2-CD1 3.68Å; V182-Y208 HydrophobicContact CG2-CD2 4Å; V182-Y208 HydrophobicContact CG2-CE1 4.46Å; V182-Y208 HydrophobicContact CG2-CG 3.4Å; V200-Y208 HydrophobicContact CG1-CD2 3.9Å; V200-Y208 HydrophobicContact CG1-CG 4.42Å; Y201-Y208 WeakPolarHBondContact O-CA 3.41Å; Y201-Y208 WeakPolarHBondContact O-CB 3.31Å; Y202-Y208 HydrophobicContact CD1-CD1 4.26Å; Y202-Y208 AromaticContact CE1-CD1 3.78Å; Y202-Y208 HydrophobicContact CE1-CD1 3.78Å; Y208-Y221 HydrophobicContact CD2-CD1 4.44Å; Y208-Y221 HydrophobicContact CD2-CE1 4.41Å; Y208-Y221 HydrophobicContact CE2-CE1 4.4Å; Y208-Y222 PolarHBondContact O-N 2.91Å
209	A	88.8	Confident	85.3	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.041	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	155.4	177.5	0	0	0	0	0	111	V218 D220 Y221	A209-V218 HydrophobicContact CB-CG1 3.76Å; A209-V218 HydrophobicContact CB-CG2 4.13Å; A209-D220 CarbonylContact C-O 3.51Å; A209-D220 WeakPolarHBondContact CA-O 3.49Å; A209-Y221 HydrophobicContact CB-CD1 3.86Å; A209-Y221 HydrophobicContact CB-CE1 3.93Å
210	E	89.8	Confident	85.3	Confident	42 Å²	42	38 Å²	38	20%	0.196	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.4	164.2	-64.8	177.3	-172.3	0	0	108	V218 T219 D220 Y222 K235	E210-V218 CarbonylContact O-C 3.49Å; E210-V218 WeakPolarHBondContact O-CA 3.16Å; E210-V218 WeakPolarHBondContact O-CG1 3.2Å; E210-T219 PolarHBondContact O-N 3.29Å; E210-T219 PolarHBondContact O-OG1 2.84Å; E210-D220 HydrophobicContact CB-CB 4.33Å; E210-D220 PolarHBondContact N-O 2.95Å; E210-D220 PolarHBondContact O-N 2.82Å; E210-Y222 HydrophobicContact CG-CE2 3.98Å; E210-Y222 PolarHBondContact OE1-OH 2.84Å; E210-K235 WeakPolarHBondContact OE1-CD 3.48Å; E210-K235 IonicContact OE1-NZ 2.68Å; E210-K235 PolarHBondContact OE1-NZ 3.41Å; E210-K235 IonicContact OE2-NZ 3.93Å; E210-K235 PolarHBondContact OE2-NZ 2.93Å
211	F	86.3	Confident	85.5	Confident	5 Å²	5	38 Å²	38	2%	0.022	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.1	-177.7	59.1	-85.2	0	0	0	111.4	G83 Y84 V85 I86 I176 E217 I312	G83-F211 CarbonylContact C-O 3.55Å; G83-F211 VanDerWaalsContact C-O 3.25Å; G83-F211 WeakPolarHBondContact CA-O 3.46Å; Y84-F211 PolarHBondContact N-O 3.48Å; Y84-F211 WeakPolarHBondContact O-CD1 3.42Å; Y84-F211 WeakPolarHBondContact O-CE1 3.47Å; Y84-F211 WeakPolarHBondContact O-CZ 3.32Å; V85-F211 VanDerWaalsContact N-CE1 3.28Å; I86-F211 HydrophobicContact CD1-CE1 4.28Å; I86-F211 HydrophobicContact CG1-CE1 3.8Å; I86-F211 HydrophobicContact CG1-CZ 4.45Å; I176-F211 HydrophobicContact CD1-CB 4.38Å; I176-F211 HydrophobicContact CD1-CD1 3.22Å; I176-F211 HydrophobicContact CD1-CD2 3.73Å; I176-F211 HydrophobicContact CD1-CE1 3.15Å; I176-F211 HydrophobicContact CD1-CE2 3.65Å; I176-F211 HydrophobicContact CD1-CG 3.51Å; I176-F211 HydrophobicContact CD1-CZ 3.36Å; I176-F211 HydrophobicContact CG2-CB 4.05Å; I176-F211 HydrophobicContact CG2-CG 4.21Å; F211-E217 CarbonylContact C-O 3.59Å; F211-E217 WeakPolarHBondContact CA-O 3.42Å; F211-E217 VanDerWaalsContact CB-O 3.27Å; F211-E217 WeakPolarHBondContact CB-O 3.27Å; F211-I312 HydrophobicContact CZ-CD1 4.4Å
212	D	86	Confident	85.8	Confident	30 Å²	30	37.7 Å²	37.7	16%	0.16	20%	0.198	C	C	.	.			trans	-73.7	132.8	172.9	-179.4	64.8	0	0	0	110	N214 S215 K216 E217 T219	D212-N214 PolarHBondContact O-N 2.91Å; D212-N214 WeakPolarHBondContact OD2-CB 3.5Å; D212-N214 PolarHBondContact OD2-N 3.03Å; D212-N214 VanDerWaalsContact OD2-N 3.12Å; D212-S215 WeakPolarHBondContact CB-OG 3.47Å; D212-S215 PolarHBondContact OD2-N 3.49Å; D212-S215 PolarHBondContact OD2-OG 2.68Å; D212-K216 WeakPolarHBondContact O-CA 3.41Å; D212-K216 PolarHBondContact O-N 3.11Å; D212-E217 PolarHBondContact N-O 2.89Å; D212-T219 HydrophobicContact CB-CG2 4.02Å
213	A	79.5	Confident	86.2	Confident	25 Å²	25	34.1 Å²	34.1	21%	0.207	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-34.7	-176.7	0	0	0	0	0	112.6	Y84	Y84-A213 HydrophobicContact CD2-CB 3.05Å; Y84-A213 HydrophobicContact CE2-CB 3.31Å; Y84-A213 HydrophobicContact CG-CB 3.79Å
214	N	82.4	Confident	86.4	Confident	54 Å²	54	33.5 Å²	33.5	29%	0.289	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-46.5	-165.5	-54	-19.6	0	0	0	109.6	D212 N300	D212-N214 PolarHBondContact O-N 2.91Å; D212-N214 WeakPolarHBondContact OD2-CB 3.5Å; D212-N214 PolarHBondContact OD2-N 3.03Å; D212-N214 VanDerWaalsContact OD2-N 3.12Å; N214-N300 WeakPolarHBondContact CB-O 3.4Å; N214-N300 PolarHBondContact ND2-O 2.85Å; N214-N300 PolarHBondContact OD1-O 3.01Å
215	S	80.4	Confident	87	Confident	22 Å²	22	31.8 Å²	31.8	15%	0.154	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-22.4	176.3	75.4	0	0	0	0	113	D212 E217	D212-S215 WeakPolarHBondContact CB-OG 3.47Å; D212-S215 PolarHBondContact OD2-N 3.49Å; D212-S215 PolarHBondContact OD2-OG 2.68Å; S215-E217 PolarHBondContact O-N 3.45Å; S215-E217 WeakPolarHBondContact OG-CB 3.36Å; S215-E217 PolarHBondContact OG-N 2.79Å; S215-E217 VanDerWaalsContact OG-N 3.14Å
216	K	79.9	Confident	87.3	Confident	74 Å²	74	28.5 Å²	28.5	32%	0.322	15%	0.15	S	C	.	.			trans	60.4	21.8	-169.7	-50.3	-173.4	-178.9	-169.5	0	113.3	F175 I176 F177 D212	F175-K216 WeakPolarHBondContact O-CD 3.44Å; I176-K216 WeakPolarHBondContact CG2-O 3.44Å; F177-K216 HydrophobicContact CD2-CB 4.04Å; F177-K216 HydrophobicContact CE2-CB 4.32Å; F177-K216 PolarHBondContact N-O 3.4Å; D212-K216 WeakPolarHBondContact O-CA 3.41Å; D212-K216 PolarHBondContact O-N 3.11Å
217	E	83.7	Confident	87.3	Confident	73 Å²	73	27.8 Å²	27.8	34%	0.341	14%	0.143	S	C	.	.	B	Isolated β-bridge	trans	-94.2	143.4	176.3	-63.6	-175.6	157.4	0	0	111.5	F177 F211 D212 S215 T219	F177-E217 HydrophobicContact CB-CG 4.34Å; F211-E217 CarbonylContact C-O 3.59Å; F211-E217 WeakPolarHBondContact CA-O 3.42Å; F211-E217 VanDerWaalsContact CB-O 3.27Å; F211-E217 WeakPolarHBondContact CB-O 3.27Å; D212-E217 PolarHBondContact N-O 2.89Å; S215-E217 PolarHBondContact O-N 3.45Å; S215-E217 WeakPolarHBondContact OG-CB 3.36Å; S215-E217 PolarHBondContact OG-N 2.79Å; S215-E217 VanDerWaalsContact OG-N 3.14Å; E217-T219 PolarHBondContact O-N 3.39Å
218	V	88.4	Confident	86.6	Confident	17 Å²	17	27.4 Å²	27.4	10%	0.103	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	122.8	175.8	176.2	0	0	0	0	111.2	I176 F177 Q178 A209 E210 D220 Y221 A238	I176-V218 HydrophobicContact CG2-CG2 3.96Å; F177-V218 PolarHBondContact O-N 3.32Å; Q178-V218 HydrophobicContact CB-CG2 3.83Å; A209-V218 HydrophobicContact CB-CG1 3.76Å; A209-V218 HydrophobicContact CB-CG2 4.13Å; E210-V218 CarbonylContact O-C 3.49Å; E210-V218 WeakPolarHBondContact O-CA 3.16Å; E210-V218 WeakPolarHBondContact O-CG1 3.2Å; V218-D220 WeakPolarHBondContact CG1-O 3.44Å; V218-Y221 HydrophobicContact CB-CE2 4.1Å; V218-Y221 HydrophobicContact CG1-CD1 4.26Å; V218-Y221 HydrophobicContact CG1-CD2 3.74Å; V218-Y221 HydrophobicContact CG1-CE1 3.93Å; V218-Y221 HydrophobicContact CG1-CE2 3.38Å; V218-Y221 HydrophobicContact CG1-CG 4.19Å; V218-Y221 VanDerWaalsContact CG1-CZ 3.48Å; V218-A238 WeakPolarHBondContact O-CB 3.14Å
219	T	91.5	Very high	85.7	Confident	55 Å²	55	37.8 Å²	37.8	34%	0.337	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-40.4	175.9	63.4	0	0	0	0	111.7	E210 D212 E217 Q237 A238	E210-T219 PolarHBondContact O-N 3.29Å; E210-T219 PolarHBondContact O-OG1 2.84Å; D212-T219 HydrophobicContact CB-CG2 4.02Å; E217-T219 PolarHBondContact O-N 3.39Å; T219-Q237 CarbonylContact O-C 3.6Å; T219-Q237 WeakPolarHBondContact O-CA 3.39Å; T219-A238 PolarHBondContact O-N 2.99Å
220	D	94	Very high	84.6	Confident	25 Å²	25	48.3 Å²	48.3	13%	0.134	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	145.7	-173.1	-60.3	-93.5	0	0	0	111.2	A209 E210 V218 K235 I236 Q237	A209-D220 CarbonylContact C-O 3.51Å; A209-D220 WeakPolarHBondContact CA-O 3.49Å; E210-D220 HydrophobicContact CB-CB 4.33Å; E210-D220 PolarHBondContact N-O 2.95Å; E210-D220 PolarHBondContact O-N 2.82Å; V218-D220 WeakPolarHBondContact CG1-O 3.44Å; D220-K235 HydrophobicContact CB-CD 3.87Å; D220-K235 HydrophobicContact CB-CG 3.72Å; D220-I236 CarbonylContact C-O 3.52Å; D220-I236 WeakPolarHBondContact CA-O 3.48Å; D220-Q237 WeakPolarHBondContact OD1-CA 3.45Å; D220-Q237 WeakPolarHBondContact OD1-CG 3.37Å
221	Y	93.8	Very high	84	Confident	1 Å²	1	48.3 Å²	48.3	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	144.6	171.5	-74.2	-83.3	0	0	0	111.1	H179 F180 V200 Y208 A209 V218 K235 I236 A238 I241	H179-Y221 PolarHBondContact N-OH 2.94Å; F180-Y221 HydrophobicContact CB-CE1 3.91Å; F180-Y221 HydrophobicContact CD2-CD2 4.49Å; F180-Y221 AromaticContact CD2-CE2 3.9Å; F180-Y221 HydrophobicContact CD2-CE2 3.9Å; F180-Y221 AromaticContact CD2-CZ 3.99Å; F180-Y221 PolarHBondContact N-OH 2.86Å; F180-Y221 VanDerWaalsContact N-OH 3.14Å; F180-Y221 WeakPolarHBondContact O-CE1 3.47Å; V200-Y221 HydrophobicContact CG1-CD1 4.15Å; V200-Y221 HydrophobicContact CG2-CD1 4.26Å; Y208-Y221 HydrophobicContact CD2-CD1 4.44Å; Y208-Y221 HydrophobicContact CD2-CE1 4.41Å; Y208-Y221 HydrophobicContact CE2-CE1 4.4Å; A209-Y221 HydrophobicContact CB-CD1 3.86Å; A209-Y221 HydrophobicContact CB-CE1 3.93Å; V218-Y221 HydrophobicContact CB-CE2 4.1Å; V218-Y221 HydrophobicContact CG1-CD1 4.26Å; V218-Y221 HydrophobicContact CG1-CD2 3.74Å; V218-Y221 HydrophobicContact CG1-CE1 3.93Å; V218-Y221 HydrophobicContact CG1-CE2 3.38Å; V218-Y221 HydrophobicContact CG1-CG 4.19Å; V218-Y221 VanDerWaalsContact CG1-CZ 3.48Å; Y221-K235 WeakPolarHBondContact O-CA 3.5Å; Y221-I236 PolarHBondContact N-O 2.62Å; Y221-I236 PolarHBondContact O-N 2.93Å; Y221-A238 HydrophobicContact CD2-CB 4.18Å; Y221-A238 HydrophobicContact CE2-CB 4.05Å; Y221-I241 HydrophobicContact CD2-CD1 3.93Å; Y221-I241 HydrophobicContact CG-CD1 4.17Å
222	Y	93.3	Very high	83.9	Confident	27 Å²	27	50.8 Å²	50.8	11%	0.106	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	115.3	167.2	-69.1	-82.6	0	0	0	108.7	V200 Y201 N203 R207 Y208 E210 K235	V200-Y222 WeakPolarHBondContact CA-O 3.46Å; Y201-Y222 WeakPolarHBondContact CD1-O 3.42Å; Y201-Y222 PolarHBondContact N-O 3.04Å; N203-Y222 HydrophobicContact CB-CD1 3.78Å; N203-Y222 HydrophobicContact CB-CD2 4.42Å; N203-Y222 HydrophobicContact CB-CE1 4.11Å; N203-Y222 HydrophobicContact CB-CG 3.93Å; N203-Y222 WeakPolarHBondContact ND2-CE1 3.47Å; N203-Y222 WeakPolarHBondContact ND2-CE2 3.41Å; R207-Y222 HydrophobicContact CB-CE2 4.31Å; Y208-Y222 PolarHBondContact O-N 2.91Å; E210-Y222 HydrophobicContact CG-CE2 3.98Å; E210-Y222 PolarHBondContact OE1-OH 2.84Å; Y222-K235 HydrophobicContact CD1-CB 4.31Å; Y222-K235 HydrophobicContact CE1-CB 4.17Å; Y222-K235 HydrophobicContact CE1-CD 4.07Å; Y222-K235 HydrophobicContact CE1-CG 4.3Å
223	I	92.8	Very high	84.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	156	-176.3	67.7	168.4	0	0	0	111.7	V186 A188 A198 M199 V200 Y201 F225 K233 S234 I236 I241	V186-I223 HydrophobicContact CG2-CG2 4.42Å; A188-I223 HydrophobicContact CB-CD1 3.24Å; A198-I223 HydrophobicContact CB-CB 4.21Å; A198-I223 HydrophobicContact CB-CD1 3.8Å; A198-I223 HydrophobicContact CB-CG1 4.43Å; M199-I223 CarbonylContact O-C 3.25Å; M199-I223 VanDerWaalsContact O-CA 3.29Å; M199-I223 WeakPolarHBondContact O-CA 3.45Å; V200-I223 HydrophobicContact CG2-CG2 4.25Å; Y201-I223 VanDerWaalsContact CE1-C 3.46Å; Y201-I223 VanDerWaalsContact CE1-O 3.24Å; Y201-I223 WeakPolarHBondContact CE1-O 3.33Å; I223-F225 HydrophobicContact CD1-CE1 4.01Å; I223-F225 HydrophobicContact CD1-CE2 4.09Å; I223-F225 HydrophobicContact CD1-CZ 3.72Å; I223-K233 WeakPolarHBondContact O-CA 3.34Å; I223-S234 PolarHBondContact N-O 3.39Å; I223-S234 PolarHBondContact O-N 3.08Å; I223-I236 HydrophobicContact CD1-CB 4.08Å; I223-I236 HydrophobicContact CD1-CG1 3.48Å; I223-I236 VanDerWaalsContact CD1-CG1 3.48Å; I223-I236 HydrophobicContact CG1-CB 4.48Å; I223-I236 HydrophobicContact CG1-CG1 3.89Å; I223-I241 HydrophobicContact CG2-CD1 4.04Å
224	V	90.6	Very high	84.7	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.018	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.9	169.2	60.7	0	0	0	0	108.8	A198 M199 Y201 A232 K233	A198-V224 CarbonylContact C-O 3.56Å; A198-V224 WeakPolarHBondContact CA-O 2.99Å; A198-V224 WeakPolarHBondContact CB-O 3.39Å; M199-V224 HydrophobicContact CB-CG1 4.11Å; M199-V224 HydrophobicContact CE-CG1 4.3Å; M199-V224 PolarHBondContact N-O 2.77Å; M199-V224 WeakPolarHBondContact O-CG1 3.44Å; M199-V224 PolarHBondContact O-N 2.98Å; Y201-V224 HydrophobicContact CD1-CB 4.11Å; Y201-V224 HydrophobicContact CD1-CG1 4.38Å; Y201-V224 HydrophobicContact CG-CB 4.47Å; Y201-V224 HydrophobicContact CG-CG1 4.44Å; V224-A232 CarbonylContact C-O 3.57Å; V224-A232 WeakPolarHBondContact CA-O 3.34Å; V224-K233 HydrophobicContact CB-CG 4.41Å; V224-K233 HydrophobicContact CG2-CG 4.31Å
225	F	92.8	Very high	85.2	Confident	23 Å²	23	56.4 Å²	56.4	10%	0.101	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	131.5	175.9	-71.1	-76.4	0	0	0	110.1	A188 T190 W196 A198 I223 S231 A232 I236	A188-F225 HydrophobicContact CB-CE1 3.7Å; A188-F225 HydrophobicContact CB-CZ 4.14Å; T190-F225 HydrophobicContact CG2-CE2 4.17Å; T190-F225 HydrophobicContact CG2-CZ 3.61Å; W196-F225 HydrophobicContact CB-CD1 3.83Å; W196-F225 HydrophobicContact CB-CE1 3.98Å; W196-F225 AromaticContact CD1-CD1 3.77Å; W196-F225 HydrophobicContact CG-CD1 4.04Å; A198-F225 HydrophobicContact CB-CD1 4.01Å; A198-F225 HydrophobicContact CB-CE1 4.43Å; I223-F225 HydrophobicContact CD1-CE1 4.01Å; I223-F225 HydrophobicContact CD1-CE2 4.09Å; I223-F225 HydrophobicContact CD1-CZ 3.72Å; F225-S231 WeakPolarHBondContact O-CA 3.3Å; F225-S231 VanDerWaalsContact O-CB 3.29Å; F225-S231 WeakPolarHBondContact O-CB 3.36Å; F225-A232 HydrophobicContact CD2-CB 4.33Å; F225-A232 WeakPolarHBondContact CD2-O 3.45Å; F225-A232 PolarHBondContact N-O 3.01Å; F225-I236 HydrophobicContact CZ-CD1 4.47Å; F225-I236 HydrophobicContact CZ-CG1 4.4Å
226	L	89.1	Confident	85.9	Confident	7 Å²	7	55.9 Å²	55.9	4%	0.037	27%	0.269	C	S	.	.			trans	-77.8	146.8	175.9	-58.3	178.1	0	0	0	109.3	V185 W196 P197 M199 A266 E269 A270	V185-L226 HydrophobicContact CG1-CD1 4.37Å; W196-L226 PolarHBondContact NE1-O 3.33Å; P197-L226 HydrophobicContact CB-CB 4.45Å; P197-L226 HydrophobicContact CB-CD1 4.18Å; P197-L226 WeakPolarHBondContact O-CB 3.46Å; P197-L226 PolarHBondContact O-N 3.27Å; M199-L226 HydrophobicContact CB-CD2 4.5Å; L226-A266 HydrophobicContact CB-CB 4.42Å; L226-A266 WeakPolarHBondContact O-CB 3.42Å; L226-E269 HydrophobicContact CB-CB 4.39Å; L226-E269 HydrophobicContact CB-CG 4.27Å; L226-E269 HydrophobicContact CD2-CG 4.31Å; L226-A270 HydrophobicContact CD1-CB 3.66Å
227	G	81.1	Confident	86.6	Confident	11 Å²	11	56.3 Å²	56.3	11%	0.113	27%	0.272	C	S	.	.			trans	167.9	155.5	-179.4	0	0	0	0	0	113.6	R229 E269	G227-R229 VanDerWaalsContact C-N 3.3Å; G227-R229 PolarHBondContact O-N 2.9Å; G227-R229 VanDerWaalsContact O-N 3.15Å; G227-E269 WeakPolarHBondContact CA-OE2 3.21Å; G227-E269 PolarHBondContact N-OE2 2.76Å
228	P	69.1	Low	87	Confident	55 Å²	55	54.2 Å²	54.2	36%	0.357	27%	0.268	S	S	.	.	S	Bend	trans	-70.4	-21.7	-162.5	25.8	-36	0	0	0	114.8	A265	P228-A265 HydrophobicContact CB-CB 4.28Å; P228-A265 HydrophobicContact CG-CB 4.15Å
229	R	67.4	Low	87.2	Confident	239 Å²	239	61.6 Å²	61.6	90%	0.902	30%	0.298	S	S	*	.	S	Bend	trans	-110.4	-44.1	-171.5	-68.1	-169.5	178.3	-177.2	-0.8	113.3	G227	G227-R229 VanDerWaalsContact C-N 3.3Å; G227-R229 PolarHBondContact O-N 2.9Å; G227-R229 VanDerWaalsContact O-N 3.15Å
230	R	64.8	Low	87.4	Confident	227 Å²	227	64 Å²	64	86%	0.857	30%	0.301	S	S	*	.			trans	-154.8	135	-176.8	-65.8	-168.4	-179.1	118.7	2	109.1
231	S	76.9	Confident	87.4	Confident	42 Å²	42	63.5 Å²	63.5	29%	0.294	30%	0.298	S	S	.	.			trans	-88.2	111.4	170.7	-34.9	0	0	0	0	109.3	F225 K285	F225-S231 WeakPolarHBondContact O-CA 3.3Å; F225-S231 VanDerWaalsContact O-CB 3.29Å; F225-S231 WeakPolarHBondContact O-CB 3.36Å; S231-K285 PolarHBondContact OG-NZ 3.02Å
232	A	84.4	Confident	87.3	Confident	57 Å²	57	67.6 Å²	67.6	47%	0.471	32%	0.317	S	S	.	.			trans	-82.4	129.5	177.9	0	0	0	0	0	109.6	V224 F225	V224-A232 CarbonylContact C-O 3.57Å; V224-A232 WeakPolarHBondContact CA-O 3.34Å; F225-A232 HydrophobicContact CD2-CB 4.33Å; F225-A232 WeakPolarHBondContact CD2-O 3.45Å; F225-A232 PolarHBondContact N-O 3.01Å
233	K	89.8	Confident	87.3	Confident	91 Å²	91	70.5 Å²	70.5	40%	0.396	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.2	174.9	-67.8	172.2	177.1	178.5	0	109.4	Y201 I223 V224	Y201-K233 HydrophobicContact CE1-CB 4.29Å; Y201-K233 HydrophobicContact CE1-CG 4.16Å; Y201-K233 HydrophobicContact CE2-CD 3.81Å; Y201-K233 HydrophobicContact CE2-CG 4.2Å; I223-K233 WeakPolarHBondContact O-CA 3.34Å; V224-K233 HydrophobicContact CB-CG 4.41Å; V224-K233 HydrophobicContact CG2-CG 4.31Å
234	S	91.7	Very high	87.2	Confident	43 Å²	43	70.6 Å²	70.6	30%	0.301	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	160.1	176.8	-161.8	0	0	0	0	111.6	I223	I223-S234 PolarHBondContact N-O 3.39Å; I223-S234 PolarHBondContact O-N 3.08Å
235	K	94.3	Very high	87.1	Confident	92 Å²	92	73.1 Å²	73.1	40%	0.4	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.3	167.5	-176.4	171.7	77.4	165.9	0	108.1	E210 D220 Y221 Y222	E210-K235 WeakPolarHBondContact OE1-CD 3.48Å; E210-K235 IonicContact OE1-NZ 2.68Å; E210-K235 PolarHBondContact OE1-NZ 3.41Å; E210-K235 IonicContact OE2-NZ 3.93Å; E210-K235 PolarHBondContact OE2-NZ 2.93Å; D220-K235 HydrophobicContact CB-CD 3.87Å; D220-K235 HydrophobicContact CB-CG 3.72Å; Y221-K235 WeakPolarHBondContact O-CA 3.5Å; Y222-K235 HydrophobicContact CD1-CB 4.31Å; Y222-K235 HydrophobicContact CE1-CB 4.17Å; Y222-K235 HydrophobicContact CE1-CD 4.07Å; Y222-K235 HydrophobicContact CE1-CG 4.3Å
236	I	94	Very high	87	Confident	12 Å²	12	73.5 Å²	73.5	6%	0.062	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.7	-175.2	-59.3	-62	0	0	0	109.8	T190 D220 Y221 I223 F225 R240 I241	T190-I236 HydrophobicContact CG2-CD1 3.51Å; D220-I236 CarbonylContact C-O 3.52Å; D220-I236 WeakPolarHBondContact CA-O 3.48Å; Y221-I236 PolarHBondContact N-O 2.62Å; Y221-I236 PolarHBondContact O-N 2.93Å; I223-I236 HydrophobicContact CD1-CB 4.08Å; I223-I236 HydrophobicContact CD1-CG1 3.48Å; I223-I236 VanDerWaalsContact CD1-CG1 3.48Å; I223-I236 HydrophobicContact CG1-CB 4.48Å; I223-I236 HydrophobicContact CG1-CG1 3.89Å; F225-I236 HydrophobicContact CZ-CD1 4.47Å; F225-I236 HydrophobicContact CZ-CG1 4.4Å; I236-R240 HydrophobicContact CG2-CB 3.75Å; I236-I241 HydrophobicContact CB-CD1 3.93Å; I236-I241 HydrophobicContact CB-CG1 4.19Å; I236-I241 HydrophobicContact CG2-CD1 3.9Å; I236-I241 HydrophobicContact CG2-CG1 3.61Å
237	Q	95.2	Very high	87	Confident	83 Å²	83	74.3 Å²	74.3	39%	0.388	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	139.4	176.9	-68.3	179.4	-23.7	0	0	111.1	T219 D220 K239 R240	T219-Q237 CarbonylContact O-C 3.6Å; T219-Q237 WeakPolarHBondContact O-CA 3.39Å; D220-Q237 WeakPolarHBondContact OD1-CA 3.45Å; D220-Q237 WeakPolarHBondContact OD1-CG 3.37Å; Q237-K239 HydrophobicContact CB-CG 4.14Å; Q237-K239 PolarHBondContact O-N 2.99Å; Q237-K239 VanDerWaalsContact O-N 3.11Å; Q237-R240 PolarHBondContact O-N 3.03Å
238	A	92.2	Very high	87.3	Confident	29 Å²	29	80.7 Å²	80.7	24%	0.24	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-53.1	-38	-177.4	0	0	0	0	0	113	V218 T219 Y221 R240 I241	V218-A238 WeakPolarHBondContact O-CB 3.14Å; T219-A238 PolarHBondContact O-N 2.99Å; Y221-A238 HydrophobicContact CD2-CB 4.18Å; Y221-A238 HydrophobicContact CE2-CB 4.05Å; A238-R240 PolarHBondContact O-N 2.88Å; A238-R240 VanDerWaalsContact O-N 3.1Å; A238-I241 PolarHBondContact O-N 2.93Å; A238-I241 VanDerWaalsContact O-N 3.12Å
239	K	92.6	Very high	88.1	Confident	171 Å²	171	84.7 Å²	84.7	74%	0.743	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-64.5	-11.2	176.3	68.2	179.9	174.3	-175.5	0	115.8	Q237	Q237-K239 HydrophobicContact CB-CG 4.14Å; Q237-K239 PolarHBondContact O-N 2.99Å; Q237-K239 VanDerWaalsContact O-N 3.11Å
240	R	95.2	Very high	89.1	Confident	107 Å²	107	75.1 Å²	75.1	40%	0.404	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-107.2	15	178.6	-68.7	-173.6	171.5	-173.4	-3	112	A188 K189 I236 Q237 A238	A188-R240 WeakPolarHBondContact CA-O 2.92Å; K189-R240 HydrophobicContact CB-CB 4.31Å; K189-R240 PolarHBondContact N-O 2.92Å; I236-R240 HydrophobicContact CG2-CB 3.75Å; Q237-R240 PolarHBondContact O-N 3.03Å; A238-R240 PolarHBondContact O-N 2.88Å; A238-R240 VanDerWaalsContact O-N 3.1Å
241	I	94.1	Very high	90.2	Very high	14 Å²	14	67.5 Å²	67.5	7%	0.072	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.6	-178.3	-54.9	179.2	0	0	0	108.1	F180 V186 W187 A188 Y221 I223 I236 A238	F180-I241 HydrophobicContact CD2-CG2 4.24Å; F180-I241 HydrophobicContact CE2-CG2 3.98Å; V186-I241 HydrophobicContact CB-CG2 3.46Å; V186-I241 VanDerWaalsContact CB-CG2 3.46Å; V186-I241 HydrophobicContact CG1-CG2 3.78Å; V186-I241 HydrophobicContact CG2-CG2 3.57Å; W187-I241 CarbonylContact O-C 3.49Å; W187-I241 VanDerWaalsContact O-CA 3.23Å; W187-I241 WeakPolarHBondContact O-CA 3.45Å; A188-I241 HydrophobicContact CB-CG1 4.4Å; Y221-I241 HydrophobicContact CD2-CD1 3.93Å; Y221-I241 HydrophobicContact CG-CD1 4.17Å; I223-I241 HydrophobicContact CG2-CD1 4.04Å; I236-I241 HydrophobicContact CB-CD1 3.93Å; I236-I241 HydrophobicContact CB-CG1 4.19Å; I236-I241 HydrophobicContact CG2-CD1 3.9Å; I236-I241 HydrophobicContact CG2-CG1 3.61Å; A238-I241 PolarHBondContact O-N 2.93Å; A238-I241 VanDerWaalsContact O-N 3.12Å
242	H	92.9	Very high	90.7	Very high	86 Å²	86	68 Å²	68	40%	0.398	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	162	173.4	58.4	93.8	0	0	0	110.7	V186 W187 D195 F244	V186-H242 CarbonylContact C-O 3.58Å; V186-H242 VanDerWaalsContact CA-O 3.29Å; V186-H242 WeakPolarHBondContact CA-O 3.01Å; V186-H242 WeakPolarHBondContact CB-O 3.15Å; W187-H242 WeakPolarHBondContact CB-CE1 3.31Å; W187-H242 WeakPolarHBondContact CB-ND1 3.33Å; W187-H242 VanDerWaalsContact CB-NE2 3.32Å; W187-H242 WeakPolarHBondContact CB-NE2 3.32Å; W187-H242 AromaticContact CD1-CE1 3.27Å; W187-H242 AromaticContact CD1-ND1 3.37Å; W187-H242 AromaticContact CG-CE1 3.29Å; W187-H242 AromaticContact CG-ND1 3.67Å; W187-H242 AromaticContact CG-NE2 3.96Å; W187-H242 PolarHBondContact N-O 2.9Å; W187-H242 PolarHBondContact O-N 2.9Å; D195-H242 IonicContact OD2-CD2 2.7Å; D195-H242 IonicContact OD2-CE1 3.17Å; D195-H242 IonicContact OD2-NE2 2.93Å; D195-H242 PolarHBondContact OD2-NE2 3.47Å; H242-F244 PolarHBondContact O-N 2.74Å
243	K	91.8	Very high	90.9	Very high	88 Å²	88	69.8 Å²	69.8	38%	0.383	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	132.2	-173.8	-178.3	-179.1	172.7	179.5	0	110.3	S128 F180	S128-K243 VanDerWaalsContact O-CD 3.29Å; S128-K243 WeakPolarHBondContact O-CD 3.29Å; S128-K243 WeakPolarHBondContact O-CE 3.48Å; S128-K243 PolarHBondContact O-NZ 2.84Å; F180-K243 HydrophobicContact CE1-CB 3.91Å; F180-K243 HydrophobicContact CZ-CB 4.31Å
244	F	92	Very high	90.9	Very high	2 Å²	2	73.5 Å²	73.5	1%	0.009	37%	0.37	C	S	.	.			trans	-83.8	119.7	168.7	-175.8	-80.9	0	0	0	108.8	V185 W187 P197 H242 F247 A270 E271 L274	V185-F244 HydrophobicContact CB-CB 4.19Å; V185-F244 HydrophobicContact CG1-CB 3.78Å; V185-F244 HydrophobicContact CG1-CD1 3.9Å; V185-F244 HydrophobicContact CG1-CG 3.82Å; V185-F244 WeakPolarHBondContact O-CB 3.33Å; V185-F244 PolarHBondContact O-N 2.79Å; V185-F244 VanDerWaalsContact O-N 3.17Å; W187-F244 AromaticContact CD1-CD2 3.99Å; W187-F244 AromaticContact CD2-CD2 3.79Å; W187-F244 HydrophobicContact CD2-CD2 3.79Å; W187-F244 HydrophobicContact CD2-CE2 4.35Å; W187-F244 AromaticContact CE2-CD2 3.26Å; W187-F244 AromaticContact CE2-CE2 3.58Å; W187-F244 HydrophobicContact CE3-CD2 4.46Å; W187-F244 HydrophobicContact CG-CD2 4.21Å; W187-F244 HydrophobicContact CH2-CD2 4.2Å; W187-F244 AromaticContact CH2-CE2 3.77Å; W187-F244 HydrophobicContact CH2-CE2 3.77Å; W187-F244 AromaticContact CZ2-CD2 3.49Å; W187-F244 HydrophobicContact CZ2-CD2 3.49Å; W187-F244 VanDerWaalsContact CZ2-CD2 3.49Å; W187-F244 AromaticContact CZ2-CE2 3.23Å; W187-F244 HydrophobicContact CZ2-CE2 3.23Å; W187-F244 HydrophobicContact CZ2-CZ 4.3Å; W187-F244 AromaticContact NE1-CD2 3.42Å; P197-F244 HydrophobicContact CB-CD2 4.19Å; P197-F244 HydrophobicContact CB-CE2 4.12Å; P197-F244 HydrophobicContact CG-CE2 4.12Å; H242-F244 PolarHBondContact O-N 2.74Å; F244-F247 HydrophobicContact CZ-CB 4.14Å; F244-A270 HydrophobicContact CD1-CB 4.1Å; F244-A270 HydrophobicContact CD2-CB 4.01Å; F244-A270 HydrophobicContact CE1-CB 3.67Å; F244-A270 HydrophobicContact CE2-CB 3.55Å; F244-A270 HydrophobicContact CG-CB 4.29Å; F244-A270 HydrophobicContact CZ-CB 3.38Å; F244-E271 HydrophobicContact CE1-CG 4.39Å; F244-E271 HydrophobicContact CZ-CG 4.35Å; F244-L274 HydrophobicContact CD1-CD1 3.68Å; F244-L274 HydrophobicContact CD1-CD2 4.47Å; F244-L274 HydrophobicContact CD1-CG 4.09Å; F244-L274 HydrophobicContact CE1-CD1 3.77Å; F244-L274 HydrophobicContact CE1-CG 4.35Å
245	S	88.5	Confident	90.9	Very high	57 Å²	57	72.7 Å²	72.7	40%	0.399	36%	0.362	S	S	.	.			trans	-106.7	-54.7	177.7	-61.1	0	0	0	0	111.5	L274	S245-L274 VanDerWaalsContact O-CD1 3.23Å; S245-L274 WeakPolarHBondContact O-CD1 3.29Å
246	T	89.8	Confident	90.7	Very high	31 Å²	31	71.3 Å²	71.3	19%	0.19	36%	0.363	C	S	.	.			trans	-152.5	154.8	173.7	179.7	0	0	0	0	110.3	N248 E249 E271	T246-N248 VanDerWaalsContact C-N 3.29Å; T246-N248 HydrophobicContact CG2-CB 4.22Å; T246-N248 PolarHBondContact OG1-N 3.21Å; T246-E249 HydrophobicContact CG2-CB 4.47Å; T246-E249 HydrophobicContact CG2-CG 3.72Å; T246-E271 WeakPolarHBondContact CA-OE1 3.28Å; T246-E271 WeakPolarHBondContact CB-OE1 3.42Å; T246-E271 PolarHBondContact OG1-OE1 3.4Å
247	F	89.7	Confident	90.6	Very high	24 Å²	24	77.7 Å²	77.7	11%	0.105	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-74.3	-20.9	172.2	-168	-107.8	0	0	0	113.1	W187 F244 E249 V250 L252 L263 Q264 E271	W187-F247 AromaticContact CH2-CD2 3.67Å; W187-F247 HydrophobicContact CH2-CD2 3.67Å; W187-F247 AromaticContact CH2-CE2 3.87Å; W187-F247 HydrophobicContact CH2-CE2 3.87Å; W187-F247 HydrophobicContact CZ2-CD2 4.13Å; F244-F247 HydrophobicContact CZ-CB 4.14Å; F247-E249 PolarHBondContact O-N 3.23Å; F247-E249 VanDerWaalsContact O-N 3.13Å; F247-V250 HydrophobicContact CD2-CG2 4.05Å; F247-V250 HydrophobicContact CE2-CB 4.37Å; F247-V250 HydrophobicContact CE2-CG2 4.06Å; F247-V250 WeakPolarHBondContact O-CB 3.28Å; F247-V250 WeakPolarHBondContact O-CG2 3.18Å; F247-V250 PolarHBondContact O-N 2.98Å; F247-V250 VanDerWaalsContact O-N 3.09Å; F247-L252 HydrophobicContact CZ-CD2 4.39Å; F247-L263 HydrophobicContact CE2-CD1 4.4Å; F247-L263 HydrophobicContact CE2-CG 3.96Å; F247-L263 WeakPolarHBondContact CE2-O 3.39Å; F247-L263 HydrophobicContact CZ-CG 4.09Å; F247-Q264 HydrophobicContact CE1-CB 4.32Å; F247-Q264 HydrophobicContact CE1-CG 4.27Å; F247-Q264 HydrophobicContact CZ-CB 4.41Å; F247-E271 HydrophobicContact CB-CG 4.29Å; F247-E271 PolarHBondContact N-OE1 3.02Å
248	N	87.9	Confident	90.4	Very high	145 Å²	145	82.5 Å²	82.5	78%	0.775	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-65	-18.5	-176.2	-67.2	-28	0	0	0	113.7	T246 V250	T246-N248 VanDerWaalsContact C-N 3.29Å; T246-N248 HydrophobicContact CG2-CB 4.22Å; T246-N248 PolarHBondContact OG1-N 3.21Å; N248-V250 PolarHBondContact O-N 3.47Å
249	E	85.4	Confident	90.3	Very high	139 Å²	139	81.8 Å²	81.8	65%	0.65	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-75.9	-9.6	177.1	-71.9	168.8	-168.8	0	0	113.2	T246 F247 D251	T246-E249 HydrophobicContact CG2-CB 4.47Å; T246-E249 HydrophobicContact CG2-CG 3.72Å; F247-E249 PolarHBondContact O-N 3.23Å; F247-E249 VanDerWaalsContact O-N 3.13Å; E249-D251 PolarHBondContact O-N 3.02Å
250	V	87.1	Confident	90.3	Very high	38 Å²	38	77.9 Å²	77.9	23%	0.23	38%	0.379	C	S	.	.			trans	-83.6	114.7	-176.8	-177.6	0	0	0	0	111.3	W187 F247 N248 L252 I255 L263	W187-V250 HydrophobicContact CH2-CG2 3.43Å; W187-V250 VanDerWaalsContact CH2-CG2 3.43Å; W187-V250 HydrophobicContact CZ2-CG2 3.47Å; W187-V250 VanDerWaalsContact CZ2-CG2 3.47Å; W187-V250 HydrophobicContact CZ3-CG2 4.4Å; F247-V250 HydrophobicContact CD2-CG2 4.05Å; F247-V250 HydrophobicContact CE2-CB 4.37Å; F247-V250 HydrophobicContact CE2-CG2 4.06Å; F247-V250 WeakPolarHBondContact O-CB 3.28Å; F247-V250 WeakPolarHBondContact O-CG2 3.18Å; F247-V250 PolarHBondContact O-N 2.98Å; F247-V250 VanDerWaalsContact O-N 3.09Å; N248-V250 PolarHBondContact O-N 3.47Å; V250-L252 HydrophobicContact CG1-CD2 4.21Å; V250-L252 PolarHBondContact O-N 2.81Å; V250-I255 HydrophobicContact CG1-CD1 3.58Å; V250-L263 HydrophobicContact CG1-CD2 4.38Å
251	D	89.7	Confident	90	Very high	67 Å²	67	83.3 Å²	83.3	36%	0.358	40%	0.4	S	S	.	.			trans	-78.3	96.4	169.7	-177.7	2.9	0	0	0	110.9	E249 S253 K254	E249-D251 PolarHBondContact O-N 3.02Å; D251-S253 VanDerWaalsContact CG-OG 3.29Å; D251-S253 PolarHBondContact O-N 2.88Å; D251-S253 WeakPolarHBondContact OD1-CB 3.16Å; D251-S253 PolarHBondContact OD1-N 3.12Å; D251-S253 VanDerWaalsContact OD1-N 3.12Å; D251-S253 PolarHBondContact OD1-OG 3Å; D251-S253 PolarHBondContact OD2-OG 3.18Å; D251-K254 HydrophobicContact CB-CD 4.25Å; D251-K254 PolarHBondContact O-N 3.43Å; D251-K254 VanDerWaalsContact OD2-CD 3.27Å; D251-K254 WeakPolarHBondContact OD2-CD 3.25Å; D251-K254 WeakPolarHBondContact OD2-CE 3.37Å; D251-K254 IonicContact OD2-NZ 3Å; D251-K254 PolarHBondContact OD2-NZ 3.5Å
252	L	86.7	Confident	89.8	Confident	52 Å²	52	89.2 Å²	89.2	27%	0.272	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-62.3	-23.8	-180	-67.8	176.9	0	0	0	113.2	F247 V250 K254 I255 W260 L263	F247-L252 HydrophobicContact CZ-CD2 4.39Å; V250-L252 HydrophobicContact CG1-CD2 4.21Å; V250-L252 PolarHBondContact O-N 2.81Å; L252-K254 PolarHBondContact O-N 3.18Å; L252-I255 HydrophobicContact CD2-CD1 4.44Å; L252-I255 PolarHBondContact O-N 3.45Å; L252-W260 PolarHBondContact O-NE1 3.15Å; L252-L263 HydrophobicContact CD2-CD2 4.32Å
253	S	88.1	Confident	89.7	Confident	94 Å²	94	85.1 Å²	85.1	66%	0.657	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-64.8	-27	-179.7	74.1	0	0	0	0	112.5	D251 I255	D251-S253 VanDerWaalsContact CG-OG 3.29Å; D251-S253 PolarHBondContact O-N 2.88Å; D251-S253 WeakPolarHBondContact OD1-CB 3.16Å; D251-S253 PolarHBondContact OD1-N 3.12Å; D251-S253 VanDerWaalsContact OD1-N 3.12Å; D251-S253 PolarHBondContact OD1-OG 3Å; D251-S253 PolarHBondContact OD2-OG 3.18Å; S253-I255 VanDerWaalsContact C-N 3.29Å
254	K	90.3	Very high	89.6	Confident	170 Å²	170	86.4 Å²	86.4	74%	0.739	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-82.8	-5.4	176.7	-67.8	173.2	-178	149	0	113.4	D251 L252	D251-K254 HydrophobicContact CB-CD 4.25Å; D251-K254 PolarHBondContact O-N 3.43Å; D251-K254 VanDerWaalsContact OD2-CD 3.27Å; D251-K254 WeakPolarHBondContact OD2-CD 3.25Å; D251-K254 WeakPolarHBondContact OD2-CE 3.37Å; D251-K254 IonicContact OD2-NZ 3Å; D251-K254 PolarHBondContact OD2-NZ 3.5Å; L252-K254 PolarHBondContact O-N 3.18Å
255	I	91.2	Very high	89.4	Confident	25 Å²	25	87.7 Å²	87.7	13%	0.128	42%	0.421	C	S	.	.	S	Bend	trans	-106.5	136	-173.4	-59.7	-176.6	0	0	0	109.2	P194 V250 L252 S253 E257 F259 W260 L263	P194-I255 HydrophobicContact CB-CD1 4.19Å; P194-I255 HydrophobicContact CB-CG1 4.42Å; P194-I255 HydrophobicContact CB-CG2 4.05Å; P194-I255 HydrophobicContact CG-CG2 4.03Å; V250-I255 HydrophobicContact CG1-CD1 3.58Å; L252-I255 HydrophobicContact CD2-CD1 4.44Å; L252-I255 PolarHBondContact O-N 3.45Å; S253-I255 VanDerWaalsContact C-N 3.29Å; I255-E257 PolarHBondContact O-N 3.1Å; I255-F259 HydrophobicContact CG2-CB 4.08Å; I255-F259 HydrophobicContact CG2-CD2 4.41Å; I255-W260 PolarHBondContact O-NE1 3.29Å; I255-L263 HydrophobicContact CD1-CD2 3.32Å; I255-L263 HydrophobicContact CG2-CD2 4.24Å
256	P	91.5	Very high	89.5	Confident	64 Å²	64	85 Å²	85	42%	0.416	40%	0.402	S	S	.	.			trans	-56.7	130.5	174.2	-25.5	34.1	0	0	0	112.2	R258 F259	P256-R258 HydrophobicContact CB-CG 4.23Å; P256-R258 PolarHBondContact O-N 3.25Å; P256-F259 HydrophobicContact CB-CD2 4Å; P256-F259 HydrophobicContact CB-CE2 4.27Å; P256-F259 HydrophobicContact CG-CD2 4.26Å; P256-F259 HydrophobicContact CG-CE2 4.31Å; P256-F259 PolarHBondContact O-N 3.24Å
257	E	90.9	Very high	89.6	Confident	146 Å²	146	83.5 Å²	83.5	68%	0.682	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-50.4	-34.1	-174.5	-68.9	-174.4	172.2	0	0	114.2	I255 F259 W260	I255-E257 PolarHBondContact O-N 3.1Å; E257-F259 PolarHBondContact O-N 2.83Å; E257-W260 HydrophobicContact CB-CD2 4.31Å; E257-W260 HydrophobicContact CG-CD2 4.18Å; E257-W260 HydrophobicContact CG-CE3 4.32Å; E257-W260 HydrophobicContact CG-CH2 3.74Å; E257-W260 HydrophobicContact CG-CZ2 3.59Å; E257-W260 HydrophobicContact CG-CZ3 4.11Å; E257-W260 WeakPolarHBondContact O-CB 3.25Å; E257-W260 PolarHBondContact O-N 2.89Å
258	R	91	Very high	89.5	Confident	183 Å²	183	86.8 Å²	86.8	69%	0.691	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-54.4	-22	177.6	71.1	178.9	-178	-129.3	1.3	114.2	P256	P256-R258 HydrophobicContact CB-CG 4.23Å; P256-R258 PolarHBondContact O-N 3.25Å
259	F	90.7	Very high	89.5	Confident	14 Å²	14	82.8 Å²	82.8	6%	0.061	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-97	-19.7	-179.4	-62.3	-61.1	0	0	0	113.9	Y193 P194 W196 I255 P256 E257 R261 R262 L263	Y193-F259 HydrophobicContact CD1-CD1 4.37Å; Y193-F259 AromaticContact CD1-CE1 3.57Å; Y193-F259 HydrophobicContact CD1-CE1 3.57Å; Y193-F259 AromaticContact CD1-CZ 3.95Å; Y193-F259 HydrophobicContact CD1-CZ 3.95Å; Y193-F259 AromaticContact CE1-CE1 3.69Å; Y193-F259 HydrophobicContact CE1-CE1 3.69Å; Y193-F259 HydrophobicContact CE1-CZ 4.25Å; P194-F259 HydrophobicContact CG-CB 4.22Å; P194-F259 HydrophobicContact CG-CD2 4.08Å; P194-F259 HydrophobicContact CG-CG 4.13Å; W196-F259 HydrophobicContact CZ3-CB 4.34Å; W196-F259 HydrophobicContact CZ3-CD1 4.07Å; W196-F259 HydrophobicContact CZ3-CG 4.49Å; I255-F259 HydrophobicContact CG2-CB 4.08Å; I255-F259 HydrophobicContact CG2-CD2 4.41Å; P256-F259 HydrophobicContact CB-CD2 4Å; P256-F259 HydrophobicContact CB-CE2 4.27Å; P256-F259 HydrophobicContact CG-CD2 4.26Å; P256-F259 HydrophobicContact CG-CE2 4.31Å; P256-F259 PolarHBondContact O-N 3.24Å; E257-F259 PolarHBondContact O-N 2.83Å; F259-R261 PolarHBondContact O-N 3.34Å; F259-R262 PolarHBondContact O-N 3.43Å; F259-R262 VanDerWaalsContact O-N 3.1Å; F259-L263 WeakPolarHBondContact O-CB 3.49Å; F259-L263 PolarHBondContact O-N 2.92Å
260	W	91.1	Very high	89.7	Confident	89 Å²	89	76.1 Å²	76.1	34%	0.337	35%	0.354	S	S	.	.	H	α-helix	trans	-51.7	-56	-165.8	-70.9	3	0	0	0	113.5	L252 I255 E257 R262 L263 Q264	L252-W260 PolarHBondContact O-NE1 3.15Å; I255-W260 PolarHBondContact O-NE1 3.29Å; E257-W260 HydrophobicContact CB-CD2 4.31Å; E257-W260 HydrophobicContact CG-CD2 4.18Å; E257-W260 HydrophobicContact CG-CE3 4.32Å; E257-W260 HydrophobicContact CG-CH2 3.74Å; E257-W260 HydrophobicContact CG-CZ2 3.59Å; E257-W260 HydrophobicContact CG-CZ3 4.11Å; E257-W260 WeakPolarHBondContact O-CB 3.25Å; E257-W260 PolarHBondContact O-N 2.89Å; W260-R262 VanDerWaalsContact C-N 3.3Å; W260-R262 PolarHBondContact O-N 3.37Å; W260-L263 PolarHBondContact O-N 3.02Å; W260-Q264 WeakPolarHBondContact O-CB 3.28Å; W260-Q264 PolarHBondContact O-N 3.45Å
261	R	89.3	Confident	89.9	Confident	222 Å²	222	76.6 Å²	76.6	84%	0.838	35%	0.353	S	S	*	.	H	α-helix	trans	-58.6	-41.4	-178.1	-67.2	-177.4	67.4	-171.8	3.7	112.8	F259 A265	F259-R261 PolarHBondContact O-N 3.34Å; R261-A265 WeakPolarHBondContact O-CB 3.42Å; R261-A265 PolarHBondContact O-N 3.37Å
262	R	89.5	Confident	89.7	Confident	138 Å²	138	77.4 Å²	77.4	52%	0.521	36%	0.357	S	S	.	.	H	α-helix	trans	-74.9	-37	-178	-71	174.8	62.2	176	-0.2	111.4	W196 F259 W260 A266	W196-R262 HydrophobicContact CH2-CB 3.57Å; W196-R262 HydrophobicContact CZ2-CB 3.94Å; F259-R262 PolarHBondContact O-N 3.43Å; F259-R262 VanDerWaalsContact O-N 3.1Å; W260-R262 VanDerWaalsContact C-N 3.3Å; W260-R262 PolarHBondContact O-N 3.37Å; R262-A266 WeakPolarHBondContact O-CB 3.42Å; R262-A266 PolarHBondContact O-N 2.98Å
263	L	91.2	Very high	89.6	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-70	-42.2	178.8	-175.2	61.3	0	0	0	111	W187 P194 W196 F247 V250 L252 I255 F259 W260 A266 G267	W187-L263 HydrophobicContact CZ3-CD1 4.25Å; P194-L263 HydrophobicContact CG-CD2 4.34Å; W196-L263 HydrophobicContact CD2-CD1 4.14Å; W196-L263 HydrophobicContact CE3-CD1 4Å; W196-L263 HydrophobicContact CH2-CB 4.25Å; W196-L263 HydrophobicContact CZ3-CB 4.28Å; W196-L263 HydrophobicContact CZ3-CD1 4.26Å; F247-L263 HydrophobicContact CE2-CD1 4.4Å; F247-L263 HydrophobicContact CE2-CG 3.96Å; F247-L263 WeakPolarHBondContact CE2-O 3.39Å; F247-L263 HydrophobicContact CZ-CG 4.09Å; V250-L263 HydrophobicContact CG1-CD2 4.38Å; L252-L263 HydrophobicContact CD2-CD2 4.32Å; I255-L263 HydrophobicContact CD1-CD2 3.32Å; I255-L263 HydrophobicContact CG2-CD2 4.24Å; F259-L263 WeakPolarHBondContact O-CB 3.49Å; F259-L263 PolarHBondContact O-N 2.92Å; W260-L263 PolarHBondContact O-N 3.02Å; L263-A266 PolarHBondContact O-N 3.14Å; L263-G267 PolarHBondContact O-N 3.25Å
264	Q	90.6	Very high	89.4	Confident	114 Å²	114	74.5 Å²	74.5	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-61.4	-43.7	174.1	-171.8	179.6	2.7	0	0	111.9	F247 W260 G267 Q268	F247-Q264 HydrophobicContact CE1-CB 4.32Å; F247-Q264 HydrophobicContact CE1-CG 4.27Å; F247-Q264 HydrophobicContact CZ-CB 4.41Å; W260-Q264 WeakPolarHBondContact O-CB 3.28Å; W260-Q264 PolarHBondContact O-N 3.45Å; Q264-G267 PolarHBondContact O-N 3.27Å; Q264-Q268 PolarHBondContact O-N 2.78Å
265	A	88.4	Confident	88.8	Confident	30 Å²	30	73.4 Å²	73.4	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-62.9	-43.4	175.1	0	0	0	0	0	112.3	P228 R261 G267 Q268 E269	P228-A265 HydrophobicContact CB-CB 4.28Å; P228-A265 HydrophobicContact CG-CB 4.15Å; R261-A265 WeakPolarHBondContact O-CB 3.42Å; R261-A265 PolarHBondContact O-N 3.37Å; A265-G267 VanDerWaalsContact C-N 3.32Å; A265-Q268 PolarHBondContact O-N 3.34Å; A265-E269 PolarHBondContact O-N 2.69Å
266	A	90.3	Very high	88	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-35.7	175.7	0	0	0	0	0	112.2	W196 P197 L226 R262 L263 E269 A270	W196-A266 HydrophobicContact CZ2-CB 4.13Å; P197-A266 HydrophobicContact CG-CB 4.09Å; L226-A266 HydrophobicContact CB-CB 4.42Å; L226-A266 WeakPolarHBondContact O-CB 3.42Å; R262-A266 WeakPolarHBondContact O-CB 3.42Å; R262-A266 PolarHBondContact O-N 2.98Å; L263-A266 PolarHBondContact O-N 3.14Å; A266-E269 PolarHBondContact O-N 2.58Å; A266-A270 WeakPolarHBondContact O-CB 3.31Å; A266-A270 PolarHBondContact O-N 3.45Å
267	G	91.1	Very high	86.5	Confident	0 Å²	0	77 Å²	77	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.2	-46.5	174.3	0	0	0	0	0	112.2	L263 Q264 A265 E269 A270 E271	L263-G267 PolarHBondContact O-N 3.25Å; Q264-G267 PolarHBondContact O-N 3.27Å; A265-G267 VanDerWaalsContact C-N 3.32Å; G267-E269 VanDerWaalsContact C-N 3.32Å; G267-E269 PolarHBondContact O-N 3.34Å; G267-A270 WeakPolarHBondContact O-CB 3.11Å; G267-A270 PolarHBondContact O-N 3.18Å; G267-A270 VanDerWaalsContact O-N 3.15Å; G267-E271 WeakPolarHBondContact O-CG 3.37Å; G267-E271 PolarHBondContact O-N 3.37Å
268	Q	88.3	Confident	84.9	Confident	93 Å²	93	71 Å²	71	44%	0.435	33%	0.332	S	S	.	.	H	α-helix	trans	-64.1	-38.2	174.9	-165.5	66.2	30.6	0	0	112.1	Q264 A265 A270 E271 N272 P455	Q264-Q268 PolarHBondContact O-N 2.78Å; A265-Q268 PolarHBondContact O-N 3.34Å; Q268-A270 VanDerWaalsContact C-N 3.29Å; Q268-A270 PolarHBondContact O-N 3.14Å; Q268-E271 PolarHBondContact O-N 3.21Å; Q268-N272 WeakPolarHBondContact O-CB 3.17Å; Q268-N272 PolarHBondContact O-N 3.33Å; Q268-N272 PolarHBondContact O-ND2 3.44Å; Q268-P455 HydrophobicContact CG-CG 4.39Å
269	E	87	Confident	83.2	Confident	60 Å²	60	66.9 Å²	66.9	28%	0.28	32%	0.319	S	S	.	.	H	α-helix	trans	-62.4	-38.1	173.7	-170.8	-179.8	173.6	0	0	111.4	L226 G227 A265 A266 G267 N272 A273	L226-E269 HydrophobicContact CB-CB 4.39Å; L226-E269 HydrophobicContact CB-CG 4.27Å; L226-E269 HydrophobicContact CD2-CG 4.31Å; G227-E269 WeakPolarHBondContact CA-OE2 3.21Å; G227-E269 PolarHBondContact N-OE2 2.76Å; A265-E269 PolarHBondContact O-N 2.69Å; A266-E269 PolarHBondContact O-N 2.58Å; G267-E269 VanDerWaalsContact C-N 3.32Å; G267-E269 PolarHBondContact O-N 3.34Å; E269-N272 PolarHBondContact O-N 2.83Å; E269-A273 WeakPolarHBondContact O-CB 3.25Å; E269-A273 PolarHBondContact O-N 3.24Å
270	A	90.8	Very high	80.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.6	-43.8	176.1	0	0	0	0	0	112.6	V185 P197 L226 F244 A266 G267 Q268 N272 A273 L274	V185-A270 HydrophobicContact CG1-CB 3.83Å; P197-A270 HydrophobicContact CB-CB 3.64Å; P197-A270 HydrophobicContact CG-CB 4.37Å; L226-A270 HydrophobicContact CD1-CB 3.66Å; F244-A270 HydrophobicContact CD1-CB 4.1Å; F244-A270 HydrophobicContact CD2-CB 4.01Å; F244-A270 HydrophobicContact CE1-CB 3.67Å; F244-A270 HydrophobicContact CE2-CB 3.55Å; F244-A270 HydrophobicContact CG-CB 4.29Å; F244-A270 HydrophobicContact CZ-CB 3.38Å; A266-A270 WeakPolarHBondContact O-CB 3.31Å; A266-A270 PolarHBondContact O-N 3.45Å; G267-A270 WeakPolarHBondContact O-CB 3.11Å; G267-A270 PolarHBondContact O-N 3.18Å; G267-A270 VanDerWaalsContact O-N 3.15Å; Q268-A270 VanDerWaalsContact C-N 3.29Å; Q268-A270 PolarHBondContact O-N 3.14Å; A270-N272 VanDerWaalsContact C-N 3.33Å; A270-N272 PolarHBondContact O-N 2.98Å; A270-A273 WeakPolarHBondContact O-CB 3.46Å; A270-A273 PolarHBondContact O-N 3.12Å; A270-A273 VanDerWaalsContact O-N 3.09Å; A270-L274 PolarHBondContact O-N 3.34Å
271	E	89.4	Confident	78.8	Confident	47 Å²	47	64.2 Å²	64.2	22%	0.22	32%	0.319	C	S	.	.	H	α-helix	trans	-58.2	-45.6	173	-70	-74	-175.6	0	0	111	F244 T246 F247 G267 Q268 A273 L274 L275	F244-E271 HydrophobicContact CE1-CG 4.39Å; F244-E271 HydrophobicContact CZ-CG 4.35Å; T246-E271 WeakPolarHBondContact CA-OE1 3.28Å; T246-E271 WeakPolarHBondContact CB-OE1 3.42Å; T246-E271 PolarHBondContact OG1-OE1 3.4Å; F247-E271 HydrophobicContact CB-CG 4.29Å; F247-E271 PolarHBondContact N-OE1 3.02Å; G267-E271 WeakPolarHBondContact O-CG 3.37Å; G267-E271 PolarHBondContact O-N 3.37Å; Q268-E271 PolarHBondContact O-N 3.21Å; E271-A273 VanDerWaalsContact C-N 3.28Å; E271-A273 PolarHBondContact O-N 3.26Å; E271-L274 WeakPolarHBondContact O-CB 3.35Å; E271-L274 PolarHBondContact O-N 3.49Å; E271-L275 PolarHBondContact O-N 3.16Å
272	N	85.9	Confident	76.7	Confident	84 Å²	84	55.1 Å²	55.1	45%	0.449	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-36.8	174.9	-67.1	-24.3	0	0	0	112	Q268 E269 A270 L274 L275	Q268-N272 WeakPolarHBondContact O-CB 3.17Å; Q268-N272 PolarHBondContact O-N 3.33Å; Q268-N272 PolarHBondContact O-ND2 3.44Å; E269-N272 PolarHBondContact O-N 2.83Å; A270-N272 VanDerWaalsContact C-N 3.33Å; A270-N272 PolarHBondContact O-N 2.98Å; N272-L274 VanDerWaalsContact C-N 3.34Å; N272-L275 WeakPolarHBondContact O-CB 3.39Å; N272-L275 PolarHBondContact O-N 2.93Å
273	A	85.8	Confident	74.2	Confident	12 Å²	12	54.7 Å²	54.7	10%	0.099	29%	0.293	C	S	.	.	H	α-helix	trans	-69	-30.3	177.3	0	0	0	0	0	112.8	V185 E269 A270 E271 L275 L276	V185-A273 HydrophobicContact CG2-CB 3.78Å; E269-A273 WeakPolarHBondContact O-CB 3.25Å; E269-A273 PolarHBondContact O-N 3.24Å; A270-A273 WeakPolarHBondContact O-CB 3.46Å; A270-A273 PolarHBondContact O-N 3.12Å; A270-A273 VanDerWaalsContact O-N 3.09Å; E271-A273 VanDerWaalsContact C-N 3.28Å; E271-A273 PolarHBondContact O-N 3.26Å; A273-L275 VanDerWaalsContact C-N 3.3Å; A273-L276 WeakPolarHBondContact O-CB 3.39Å; A273-L276 PolarHBondContact O-N 3.44Å
274	L	82.9	Confident	71.7	Confident	74 Å²	74	59.9 Å²	59.9	39%	0.387	32%	0.324	S	S	.	.	H	α-helix	trans	-66.6	-30.5	172	-72	-179.4	0	0	0	112.8	V185 F244 S245 A270 E271 N272 L276	V185-L274 HydrophobicContact CB-CD2 3.93Å; V185-L274 HydrophobicContact CB-CG 4.5Å; V185-L274 HydrophobicContact CG2-CD2 3.98Å; V185-L274 HydrophobicContact CG2-CG 4.43Å; F244-L274 HydrophobicContact CD1-CD1 3.68Å; F244-L274 HydrophobicContact CD1-CD2 4.47Å; F244-L274 HydrophobicContact CD1-CG 4.09Å; F244-L274 HydrophobicContact CE1-CD1 3.77Å; F244-L274 HydrophobicContact CE1-CG 4.35Å; S245-L274 VanDerWaalsContact O-CD1 3.23Å; S245-L274 WeakPolarHBondContact O-CD1 3.29Å; A270-L274 PolarHBondContact O-N 3.34Å; E271-L274 WeakPolarHBondContact O-CB 3.35Å; E271-L274 PolarHBondContact O-N 3.49Å; N272-L274 VanDerWaalsContact C-N 3.34Å; L274-L276 PolarHBondContact O-N 2.81Å
275	L	78.8	Confident	69.5	Low	146 Å²	146	58.3 Å²	58.3	76%	0.764	32%	0.315	S	S	*	.	H	α-helix	trans	-71.5	-20.4	175.5	-61.2	175.5	0	0	0	112.5	E271 N272 A273	E271-L275 PolarHBondContact O-N 3.16Å; N272-L275 WeakPolarHBondContact O-CB 3.39Å; N272-L275 PolarHBondContact O-N 2.93Å; A273-L275 VanDerWaalsContact C-N 3.3Å
276	L	74.2	Confident	67.1	Low	93 Å²	93	63 Å²	63	49%	0.487	33%	0.33	S	S	.	.	S	Bend	trans	-83	134.2	174.4	-61.1	175.5	0	0	0	109.4	A273 L274 V278 S281	A273-L276 WeakPolarHBondContact O-CB 3.39Å; A273-L276 PolarHBondContact O-N 3.44Å; L274-L276 PolarHBondContact O-N 2.81Å; L276-V278 PolarHBondContact O-N 2.86Å; L276-S281 VanDerWaalsContact CB-OG 3.31Å; L276-S281 WeakPolarHBondContact CB-OG 3.23Å
277	S	58.6	Low	64	Low	72 Å²	72	70.8 Å²	70.8	50%	0.503	37%	0.371	S	S	.	.			trans	-58.3	141.6	170.9	72.6	0	0	0	0	110.2	K279 A280 S281	S277-K279 PolarHBondContact O-N 3.33Å; S277-A280 WeakPolarHBondContact O-CA 3.47Å; S277-A280 WeakPolarHBondContact O-CB 3Å; S277-A280 PolarHBondContact O-N 2.72Å; S277-A280 PolarHBondContact OG-N 3.11Å; S277-S281 PolarHBondContact O-N 3.29Å; S277-S281 VanDerWaalsContact O-N 3.11Å; S277-S281 PolarHBondContact O-OG 3.24Å
278	V	58.8	Low	61	Low	19 Å²	19	74.2 Å²	74.2	12%	0.115	40%	0.395	C	S	.	.	H	α-helix	trans	-49.9	-33.8	177.8	179.7	0	0	0	0	111.9	D126 V182 L276 S282	D126-V278 HydrophobicContact CB-CG1 4.43Å; D126-V278 HydrophobicContact CB-CG2 4.03Å; V182-V278 WeakPolarHBondContact O-CG1 3.16Å; L276-V278 PolarHBondContact O-N 2.86Å; V278-S282 PolarHBondContact O-N 3.49Å; V278-S282 PolarHBondContact O-OG 2.85Å; V278-S282 VanDerWaalsContact O-OG 3.11Å
279	K	54.3	Low	58.1	Low	97 Å²	97	81.4 Å²	81.4	42%	0.422	42%	0.418	S	S	.	.	H	α-helix	trans	-60.1	-45.3	173.4	-74.6	-177.6	177.1	-168.2	0	113	L105 S277	L105-K279 HydrophobicContact CD1-CD 4.37Å; L105-K279 HydrophobicContact CD1-CG 3.49Å; L105-K279 VanDerWaalsContact CD1-CG 3.49Å; S277-K279 PolarHBondContact O-N 3.33Å
280	A	43.4	Very low	55.6	Low	42 Å²	42	83.3 Å²	83.3	35%	0.347	44%	0.436	S	S	.	.	H	α-helix	trans	-73.4	-40.6	-179.3	0	0	0	0	0	112.2	S277 S282 Q283	S277-A280 WeakPolarHBondContact O-CA 3.47Å; S277-A280 WeakPolarHBondContact O-CB 3Å; S277-A280 PolarHBondContact O-N 2.72Å; S277-A280 PolarHBondContact OG-N 3.11Å; A280-S282 VanDerWaalsContact C-N 3.26Å; A280-S282 PolarHBondContact O-N 3.11Å; A280-Q283 PolarHBondContact O-N 2.82Å
281	S	46.1	Very low	52.5	Low	6 Å²	6	92.3 Å²	92.3	4%	0.042	47%	0.471	C	S	.	.	H	α-helix	trans	-63	-30.1	-176.3	-58.4	0	0	0	0	113.6	L276 S277 Q283	L276-S281 VanDerWaalsContact CB-OG 3.31Å; L276-S281 WeakPolarHBondContact CB-OG 3.23Å; S277-S281 PolarHBondContact O-N 3.29Å; S277-S281 VanDerWaalsContact O-N 3.11Å; S277-S281 PolarHBondContact O-OG 3.24Å; S281-Q283 VanDerWaalsContact C-N 3.3Å; S281-Q283 PolarHBondContact O-N 3.01Å
282	S	45.1	Very low	49.6	Very low	30 Å²	30	100.7 Å²	100.7	21%	0.21	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.8	-179	-63.9	0	0	0	0	114.5	V182 V278 A280	V182-S282 WeakPolarHBondContact CG1-OG 3.15Å; V182-S282 PolarHBondContact O-OG 2.87Å; V278-S282 PolarHBondContact O-N 3.49Å; V278-S282 PolarHBondContact O-OG 2.85Å; V278-S282 VanDerWaalsContact O-OG 3.11Å; A280-S282 VanDerWaalsContact C-N 3.26Å; A280-S282 PolarHBondContact O-N 3.11Å
283	Q	37.5	Very low	47.1	Very low	129 Å²	129	106 Å²	106	60%	0.603	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-19	-170	-64.1	-176	2	0	0	114.2	A280 S281 K285	A280-Q283 PolarHBondContact O-N 2.82Å; S281-Q283 VanDerWaalsContact C-N 3.3Å; S281-Q283 PolarHBondContact O-N 3.01Å; Q283-K285 PolarHBondContact O-N 3.33Å
284	V	39.2	Very low	44.3	Very low	109 Å²	109	115.6 Å²	115.6	66%	0.661	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-13	-159.2	-179.6	0	0	0	0	115.2
285	K	43.1	Very low	41.6	Very low	81 Å²	81	119.9 Å²	119.9	35%	0.352	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-137.7	21.5	-169.3	-68.5	-176.6	-178.4	166.8	0	117.4	S231 Q283 L287	S231-K285 PolarHBondContact OG-NZ 3.02Å; Q283-K285 PolarHBondContact O-N 3.33Å; K285-L287 VanDerWaalsContact C-N 3.35Å; K285-L287 PolarHBondContact O-N 2.88Å
286	K	38.3	Very low	39.1	Very low	128 Å²	128	122.3 Å²	122.3	56%	0.557	59%	0.589	S	S	*	*			trans	-74.8	76.2	174	-76.3	-174	178.2	-178.3	0	112
287	L	25.6	Very low	36.9	Very low	164 Å²	164	123.4 Å²	123.4	86%	0.859	60%	0.6	S	S	*	*			trans	-148.2	90.6	165.7	-111.3	112.1	0	0	0	110	K285	K285-L287 VanDerWaalsContact C-N 3.35Å; K285-L287 PolarHBondContact O-N 2.88Å
288	S	28.2	Very low	35.5	Very low	73 Å²	73	127.1 Å²	127.1	51%	0.51	61%	0.613	S	S	.	*			trans	-174.7	129.6	157.5	53	0	0	0	0	111.8	S204	S204-S288 WeakPolarHBondContact CB-O 3.22Å
289	R	27.3	Very low	34.1	Very low	243 Å²	243	129.7 Å²	129.7	92%	0.917	63%	0.632	S	S	*	*			trans	-63.1	150.5	-165.4	-67.6	171.6	170.1	149.5	-3.9	115.7
290	P	34.4	Very low	33	Very low	100 Å²	100	130.9 Å²	130.9	65%	0.649	64%	0.643	S	S	*	*			trans	-104.8	154.1	-175	9.3	14	0	0	0	114.7	S204	S204-P290 WeakPolarHBondContact O-CB 3.38Å
291	Y	26.4	Very low	32.4	Very low	190 Å²	190	134.5 Å²	134.5	75%	0.745	66%	0.656	S	S	*	*			trans	-119.3	153.8	172.9	-175.4	-95.6	0	0	0	111.3
292	R	28.1	Very low	31.7	Very low	223 Å²	223	139.7 Å²	139.7	84%	0.842	69%	0.687	S	S	*	*			trans	-103.9	137.7	-159.9	-164.4	-177	-164.2	-178.6	5.8	111.8
293	K	32.4	Very low	30.8	Very low	194 Å²	194	147.1 Å²	147.1	84%	0.843	72%	0.716	S	S	*	*			trans	-167.1	155.1	151.1	-115.7	168.9	-175.3	175	0	114.8
294	K	27	Very low	30.5	Very low	214 Å²	214	148.4 Å²	148.4	93%	0.93	72%	0.722	S	S	*	*			trans	-85.6	149.9	-159.9	-121.7	172.5	179.7	178.7	0	114.6
295	L	26.1	Very low	30.4	Very low	164 Å²	164	152.8 Å²	152.8	86%	0.859	73%	0.732	S	S	*	*			trans	-89.1	153.8	-176.6	-71	130.7	0	0	0	113.4
296	Q	27.9	Very low	30.7	Very low	198 Å²	198	149.4 Å²	149.4	93%	0.925	72%	0.72	S	S	*	*			trans	-163.4	151.4	154.3	-104.8	167.4	25.9	0	0	110.9
297	T	26.5	Very low	31.8	Very low	115 Å²	115	146 Å²	146	71%	0.706	71%	0.709	S	S	*	*			trans	-102.6	154.3	-153.5	-26	0	0	0	0	113.8
298	I	29.6	Very low	34.1	Very low	151 Å²	151	138.5 Å²	138.5	77%	0.774	67%	0.67	S	S	*	*				174.1	141.6	126.9	-82.3	153.5	0	0	0	110.9	Y84	Y84-I298 PolarHBondContact OH-O 3.45Å
299	S	29	Very low	36.1	Very low	73 Å²	73	136 Å²	136	51%	0.51	65%	0.65	S	S	.	*			trans	-68.2	156.3	-174.4	156.9	0	0	0	0	116.9
300	N	31	Very low	37.6	Very low	122 Å²	122	125 Å²	125	65%	0.652	61%	0.608	S	S	*	*				-178.7	130	125.5	-84.6	-14.3	0	0	0	114.8	N214	N214-N300 WeakPolarHBondContact CB-O 3.4Å; N214-N300 PolarHBondContact ND2-O 2.85Å; N214-N300 PolarHBondContact OD1-O 3.01Å
301	D	30.7	Very low	38.5	Very low	117 Å²	117	123.6 Å²	123.6	63%	0.626	59%	0.592	S	S	*	*			trans	-70.3	144.5	-170.3	-57.6	-64.9	0	0	0	118.4
302	V	31.6	Very low	39.8	Very low	116 Å²	116	116 Å²	116	70%	0.703	56%	0.564	S	S	*	*			trans	-152.9	131.4	148.2	-179.3	0	0	0	0	109.6
303	K	28	Very low	40.5	Very low	186 Å²	186	107.7 Å²	107.7	81%	0.809	54%	0.539	S	S	*	.			trans	-100.7	134.1	-172.4	-64.9	176.2	179.5	175.9	0	113.5
304	Q	29.7	Very low	40.6	Very low	156 Å²	156	103.2 Å²	103.2	73%	0.729	53%	0.529	S	S	*	.			trans	-133	160.9	154.5	-80.1	-166.7	-2.7	0	0	110.6
305	K	37.4	Very low	40.8	Very low	201 Å²	201	98.7 Å²	98.7	87%	0.874	51%	0.514	S	S	*	.			trans	-84	114.9	-158.6	-68.8	-178.7	175.5	-175.8	0	112.9
306	G	49	Very low	40.8	Very low	9 Å²	9	98.9 Å²	98.9	9%	0.093	51%	0.51	C	S	.	.			trans	-99.2	140.7	168.6	0	0	0	0	0	113
307	V	61.8	Low	40.7	Very low	56 Å²	56	94.6 Å²	94.6	34%	0.339	50%	0.502	S	S	.	.	S	Bend	trans	-76.7	-28.1	-175.5	-177.2	0	0	0	0	113.1	E111	E111-V307 PolarHBondContact N-O 3.37Å; E111-V307 VanDerWaalsContact N-O 3.12Å
308	Y	73.6	Confident	40.7	Very low	7 Å²	7	93.2 Å²	93.2	3%	0.027	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142.9	-174.8	-43.2	-77.1	0	0	0	110.3	W109 V110 P127 L130 N131 D132 F177	W109-Y308 WeakPolarHBondContact O-CA 3.27Å; V110-Y308 HydrophobicContact CB-CD1 4.27Å; V110-Y308 HydrophobicContact CG2-CD1 3.81Å; V110-Y308 HydrophobicContact CG2-CE1 3.86Å; P127-Y308 HydrophobicContact CB-CG 4.26Å; L130-Y308 HydrophobicContact CB-CE1 3.95Å; L130-Y308 HydrophobicContact CD1-CD1 4.02Å; L130-Y308 HydrophobicContact CD1-CE1 4.03Å; N131-Y308 PolarHBondContact O-OH 2.91Å; D132-Y308 WeakPolarHBondContact CA-OH 3.38Å; D132-Y308 PolarHBondContact N-OH 3.41Å; D132-Y308 PolarHBondContact OD1-OH 2.92Å; F177-Y308 VanDerWaalsContact CA-O 3.28Å; F177-Y308 WeakPolarHBondContact CA-O 3.46Å; F177-Y308 VanDerWaalsContact CD1-O 3.29Å; F177-Y308 WeakPolarHBondContact CD1-O 3.46Å
309	K	71.1	Confident	40.5	Very low	21 Å²	21	91.7 Å²	91.7	9%	0.091	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.8	174.2	76	-173.9	-176.8	-179.9	0	112.1	W109 W118 A168 F175 I176 F177	W109-K309 WeakPolarHBondContact CA-O 3.31Å; W109-K309 HydrophobicContact CB-CG 3.66Å; W109-K309 VanDerWaalsContact CB-O 3.25Å; W109-K309 WeakPolarHBondContact CB-O 3.26Å; W109-K309 HydrophobicContact CG-CG 4.32Å; W109-K309 PolarHBondContact N-O 3.49Å; W109-K309 PolarHBondContact O-N 2.81Å; W118-K309 HydrophobicContact CD2-CD 4.32Å; W118-K309 HydrophobicContact CE3-CD 4.08Å; W118-K309 HydrophobicContact CE3-CG 4Å; W118-K309 HydrophobicContact CH2-CB 4.16Å; W118-K309 HydrophobicContact CH2-CD 3.92Å; W118-K309 HydrophobicContact CH2-CG 3.93Å; W118-K309 HydrophobicContact CZ2-CD 4.17Å; W118-K309 HydrophobicContact CZ3-CB 4.09Å; W118-K309 HydrophobicContact CZ3-CD 3.88Å; W118-K309 HydrophobicContact CZ3-CG 3.56Å; A168-K309 PolarHBondContact O-NZ 3.41Å; F175-K309 HydrophobicContact CB-CB 4.11Å; F175-K309 HydrophobicContact CB-CD 3.98Å; F175-K309 HydrophobicContact CB-CG 4.15Å; F175-K309 HydrophobicContact CD1-CB 4.45Å; F175-K309 HydrophobicContact CD1-CD 3.98Å; F175-K309 HydrophobicContact CD1-CG 3.81Å; F175-K309 HydrophobicContact CD2-CD 4.37Å; F175-K309 HydrophobicContact CE1-CG 4.49Å; F175-K309 HydrophobicContact CG-CD 3.88Å; F175-K309 HydrophobicContact CG-CG 4.13Å; I176-K309 VanDerWaalsContact O-CA 3.28Å; I176-K309 WeakPolarHBondContact O-CA 3.39Å; F177-K309 HydrophobicContact CD1-CB 3.91Å; F177-K309 HydrophobicContact CE1-CB 3.96Å; F177-K309 HydrophobicContact CE1-CD 4.39Å
310	R	58.9	Low	40.5	Very low	12 Å²	12	95.2 Å²	95.2	5%	0.045	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.8	173.2	-73.5	-179.2	100.1	164.7	3.2	111.2	P106 C125 P127 F175 I176 S181	P106-R310 PolarHBondContact O-NE 3.03Å; P106-R310 PolarHBondContact O-NH2 2.86Å; C125-R310 VanDerWaalsContact CA-NH2 3.34Å; C125-R310 PolarHBondContact O-NH1 3.3Å; C125-R310 PolarHBondContact O-NH2 2.97Å; P127-R310 HydrophobicContact CG-CG 4.47Å; F175-R310 CarbonylContact C-O 3.57Å; F175-R310 VanDerWaalsContact CA-O 3.23Å; F175-R310 WeakPolarHBondContact CA-O 3.29Å; I176-R310 PolarHBondContact N-O 3.31Å; I176-R310 PolarHBondContact O-N 3.29Å; S181-R310 VanDerWaalsContact CB-NH1 3.29Å
311	K	52.2	Low	40.3	Very low	71 Å²	71	97 Å²	97	31%	0.309	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.5	171.6	-69.3	-167.9	171.2	-152.2	0	109.2	D173 F175	D173-K311 HydrophobicContact CB-CD 4.46Å; D173-K311 VanDerWaalsContact CG-CE 3.48Å; D173-K311 IonicContact OD1-NZ 3.63Å; D173-K311 PolarHBondContact OD1-NZ 3.22Å; D173-K311 VanDerWaalsContact OD2-CE 3.29Å; D173-K311 WeakPolarHBondContact OD2-CE 3.4Å; D173-K311 IonicContact OD2-NZ 2.98Å; D173-K311 PolarHBondContact OD2-NZ 2.91Å; F175-K311 HydrophobicContact CD1-CG 3.89Å; F175-K311 HydrophobicContact CE1-CB 4.43Å; F175-K311 HydrophobicContact CE1-CD 4.35Å; F175-K311 HydrophobicContact CE1-CG 3.34Å; F175-K311 HydrophobicContact CZ-CG 3.92Å
312	I	53.4	Low	40.1	Very low	29 Å²	29	99.8 Å²	99.8	15%	0.149	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-60.8	128.8	166.5	-67.4	-178.9	0	0	0	108.2	I86 E174 I176 F211	I86-I312 HydrophobicContact CD1-CD1 4.49Å; I86-I312 HydrophobicContact CD1-CG1 3.98Å; I86-I312 HydrophobicContact CG1-CB 4.43Å; I86-I312 HydrophobicContact CG1-CD1 3.94Å; I86-I312 HydrophobicContact CG1-CG1 3.79Å; I86-I312 HydrophobicContact CG1-CG2 3.98Å; I86-I312 HydrophobicContact CG2-CG2 4.24Å; E174-I312 HydrophobicContact CB-CD1 3.67Å; E174-I312 HydrophobicContact CB-CG1 4.26Å; E174-I312 VanDerWaalsContact CD-CD1 3.47Å; E174-I312 HydrophobicContact CG-CD1 3.46Å; E174-I312 VanDerWaalsContact CG-CD1 3.46Å; E174-I312 HydrophobicContact CG-CG1 4.47Å; E174-I312 WeakPolarHBondContact O-CG1 3.36Å; E174-I312 PolarHBondContact O-N 3.04Å; E174-I312 WeakPolarHBondContact OE2-CD1 3.4Å; I176-I312 HydrophobicContact CD1-CD1 3.72Å; I176-I312 HydrophobicContact CD1-CG1 3.89Å; I176-I312 HydrophobicContact CG1-CD1 3.84Å; I176-I312 HydrophobicContact CG1-CG1 3.65Å; F211-I312 HydrophobicContact CZ-CD1 4.4Å
313	P	43.9	Very low	40	Very low	49 Å²	49	101.5 Å²	101.5	32%	0.318	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-55	137.3	174.5	-22.8	31.7	0	0	0	111.3	I86 I315	I86-P313 HydrophobicContact CG2-CG 4.47Å; P313-I315 PolarHBondContact O-N 2.9Å
314	P	34.7	Very low	39.9	Very low	100 Å²	100	97.7 Å²	97.7	65%	0.649	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-61.9	128.5	177.7	-19	29.9	0	0	0	112.1	H316	P314-H316 PolarHBondContact O-N 3.43Å
315	I	30.4	Very low	39.9	Very low	119 Å²	119	97 Å²	97	61%	0.61	53%	0.531	S	S	*	.			trans	-79.5	102.6	175.1	-56.4	169.3	0	0	0	108.1	D88 P313 S317	D88-I315 WeakPolarHBondContact OD1-CA 3.49Å; P313-I315 PolarHBondContact O-N 2.9Å; I315-S317 PolarHBondContact O-N 3.08Å
316	H	26.4	Very low	39.5	Very low	168 Å²	168	98.6 Å²	98.6	78%	0.778	53%	0.532	S	S	*	.			trans	-77	94.3	173.5	-75.8	-78	0	0	0	109.6	P314 C318	P314-H316 PolarHBondContact O-N 3.43Å; H316-C318 PolarHBondContact O-N 2.93Å
317	S	25.9	Very low	38.6	Very low	108 Å²	108	106.6 Å²	106.6	76%	0.755	57%	0.571	S	S	*	*			trans	-70.7	105.7	170.9	58.7	0	0	0	0	109.9	I315	I315-S317 PolarHBondContact O-N 3.08Å
318	C	26	Very low	37	Very low	86 Å²	86	111.5 Å²	111.5	58%	0.581	59%	0.594	S	S	*	*			trans	-84.1	133.4	164.8	60.6	0	0	0	0	109.5	H316 I320	H316-C318 PolarHBondContact O-N 2.93Å; C318-I320 PolarHBondContact O-N 2.89Å
319	S	27.1	Very low	34.8	Very low	119 Å²	119	118.1 Å²	118.1	83%	0.832	63%	0.63	S	S	*	*			trans	-60.4	130.3	-168.8	-50.1	0	0	0	0	113.1	N321	S319-N321 PolarHBondContact O-N 2.9Å
320	I	26.9	Very low	32.6	Very low	148 Å²	148	122.8 Å²	122.8	76%	0.759	66%	0.664	S	S	*	*			trans	-70.5	113.9	179.2	-60	165.2	0	0	0	109.1	C318 E322	C318-I320 PolarHBondContact O-N 2.89Å; I320-E322 HydrophobicContact CG2-CG 4.04Å
321	N	27.7	Very low	31.1	Very low	159 Å²	159	130.3 Å²	130.3	85%	0.85	70%	0.7	S	S	*	*			trans	-91.6	108.2	155.9	-86.1	-3.6	0	0	0	108.1	S319 I323	S319-N321 PolarHBondContact O-N 2.9Å; N321-I323 PolarHBondContact O-N 3.04Å
322	E	26.6	Very low	30	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	73%	0.728	S	S	*	*			trans	-63.6	112.6	176.8	-68.7	-179.6	143.7	0	0	110.8	I320	I320-E322 HydrophobicContact CG2-CG 4.04Å
323	I	28.6	Very low	28.7	Very low	152 Å²	152	141 Å²	141	78%	0.779	76%	0.76	S	S	*	*			trans	-125	100.6	151.1	-55.7	179.5	0	0	0	106.7	N321 D325	N321-I323 PolarHBondContact O-N 3.04Å; I323-D325 PolarHBondContact O-N 2.86Å
324	S	27.5	Very low	27.8	Very low	106 Å²	106	143.2 Å²	143.2	74%	0.741	78%	0.782	S	S	*	*			trans	-77.4	97.7	177.3	156	0	0	0	0	109.4
325	D	29.9	Very low	27.2	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	79%	0.785	S	S	*	*			trans	-109.4	125.2	162.5	-79.9	-32.8	0	0	0	111.7	I323	I323-D325 PolarHBondContact O-N 2.86Å
326	R	27.8	Very low	26.9	Very low	235 Å²	235	144.8 Å²	144.8	89%	0.887	79%	0.794	S	S	*	*			trans	-62.4	124.4	-172.6	-62.6	171.5	173.9	-175.3	-2.7	110.9
327	L	30.8	Very low	26.8	Very low	176 Å²	176	143.2 Å²	143.2	92%	0.921	79%	0.791	S	S	*	*			trans	-122.1	126.7	164.6	-85.9	164	0	0	0	109.6
328	I	28.1	Very low	26.8	Very low	159 Å²	159	146.8 Å²	146.8	82%	0.815	80%	0.796	S	S	*	*			trans	-76.3	133.4	-165.8	-67.1	162.6	0	0	0	110.6	C330	I328-C330 PolarHBondContact O-N 2.9Å
329	D	26.2	Very low	26.7	Very low	147 Å²	147	148.6 Å²	148.6	79%	0.786	80%	0.804	S	S	*	*			trans	-63.3	118	174.7	-95.7	-34.3	0	0	0	111.2
330	C	25.8	Very low	26.6	Very low	119 Å²	119	148.7 Å²	148.7	80%	0.804	81%	0.805	S	S	*	*			trans	-95.1	95.6	160	-68.3	0	0	0	0	108.3	I328 L332	I328-C330 PolarHBondContact O-N 2.9Å; C330-L332 PolarHBondContact O-N 3.25Å
331	Q	27.6	Very low	26.5	Very low	169 Å²	169	148.6 Å²	148.6	79%	0.79	81%	0.806	S	S	*	*			trans	-66.7	119.6	166.9	-72.8	-179.8	-24.8	0	0	108.9
332	L	28.7	Very low	26.3	Very low	172 Å²	172	146.8 Å²	146.8	90%	0.901	80%	0.801	S	S	*	*			trans	-94.4	114	170.6	-85	162.8	0	0	0	108.4	C330 A334	C330-L332 PolarHBondContact O-N 3.25Å; L332-A334 PolarHBondContact O-N 3.47Å
333	D	26.6	Very low	26.2	Very low	153 Å²	153	145.6 Å²	145.6	82%	0.818	80%	0.798	S	S	*	*			trans	-61.6	123.7	-175.8	-67.2	-47.8	0	0	0	112.7
334	A	24	Very low	25.9	Very low	95 Å²	95	146.3 Å²	146.3	79%	0.785	80%	0.803	S	S	*	*			trans	-90.8	101.7	169.4	0	0	0	0	0	109.1	L332	L332-A334 PolarHBondContact O-N 3.47Å
335	N	22.7	Very low	25.7	Very low	134 Å²	134	146.4 Å²	146.4	72%	0.717	80%	0.803	S	S	*	*			trans	-153.3	100.2	165.1	-100.3	-22.6	0	0	0	110.9
336	C	24.4	Very low	25.6	Very low	119 Å²	119	144.2 Å²	144.2	80%	0.804	80%	0.8	S	S	*	*			trans	-147.4	88.1	153.7	-107.8	0	0	0	0	108.5
337	N	24	Very low	25.4	Very low	134 Å²	134	142 Å²	142	72%	0.717	80%	0.796	S	S	*	*			trans	-88	119.2	168.9	-68.7	-42.5	0	0	0	108.3
338	H	26.7	Very low	25.2	Very low	183 Å²	183	143 Å²	143	85%	0.847	80%	0.796	S	S	*	*			trans	-122.6	102.4	161	-79.7	-60.4	0	0	0	109.7
339	T	22.7	Very low	24.9	Very low	124 Å²	124	142.1 Å²	142.1	76%	0.761	79%	0.793	S	S	*	*			trans	-84.5	138.6	168	23.5	0	0	0	0	110.3
340	S	26.2	Very low	24.8	Very low	122 Å²	122	143 Å²	143	85%	0.853	80%	0.797	S	S	*	*			trans	-156.5	141.2	149	43.9	0	0	0	0	109.4
341	N	23.5	Very low	24.6	Very low	145 Å²	145	141.9 Å²	141.9	78%	0.775	79%	0.79	S	S	*	*			trans	-101	170.2	-149.3	-69.5	-47.3	0	0	0	113.8
342	V	24.8	Very low	24.6	Very low	121 Å²	121	140.6 Å²	140.6	73%	0.733	79%	0.789	S	S	*	*			trans	128.4	103.2	133.5	-178	0	0	0	0	116.7
343	I	23.4	Very low	24.4	Very low	150 Å²	150	139.4 Å²	139.4	77%	0.769	78%	0.782	S	S	*	*			trans	52.2	112.3	133.1	-49.9	173.8	0	0	0	118.4
344	L	22.8	Very low	24.2	Very low	167 Å²	167	139.3 Å²	139.3	87%	0.874	78%	0.78	S	S	*	*				77.4	109.3	52	-149.6	96.9	0	0	0	116.5
345	S	23.8	Very low	24.4	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	79%	0.785	S	S	*	*			trans	-158.2	97.8	155	174	0	0	0	0	108
346	S	27.1	Very low	24.4	Very low	97 Å²	97	144.7 Å²	144.7	68%	0.678	79%	0.789	S	S	*	*				66.6	99.8	106.6	78.5	0	0	0	0	114.1
347	K	23.6	Very low	24.5	Very low	187 Å²	187	142.6 Å²	142.6	81%	0.813	79%	0.788	S	S	*	*				77.6	100.3	80.3	-88.1	-168.6	178.8	178.4	0	113.7
348	E	25.9	Very low	24.4	Very low	197 Å²	197	143 Å²	143	92%	0.921	79%	0.79	S	S	*	*			trans	-126.3	122.7	145.7	-82.3	-176	155.7	0	0	109.2
349	N	22.8	Very low	24.5	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	79%	0.789	S	S	*	*			trans	-85.2	135	178.8	-78.8	-33.1	0	0	0	109.4
350	L	23.3	Very low	24.5	Very low	166 Å²	166	141.5 Å²	141.5	87%	0.869	79%	0.788	S	S	*	*			trans	-133.8	99.6	154.8	-99.3	126.9	0	0	0	108.9
351	S	23.1	Very low	24.6	Very low	95 Å²	95	141.1 Å²	141.1	66%	0.664	79%	0.786	S	S	*	*			trans	-67.9	140.7	162.5	47.3	0	0	0	0	110.7
352	N	26.7	Very low	24.6	Very low	143 Å²	143	142.8 Å²	142.8	77%	0.765	79%	0.789	S	S	*	*			trans	-161.7	91	153.3	-82.8	-30.9	0	0	0	106.3
353	I	25.4	Very low	24.8	Very low	147 Å²	147	147.1 Å²	147.1	75%	0.754	80%	0.798	S	S	*	*				68.6	108.9	96.9	-62.3	172	0	0	0	112.4
354	I	22.3	Very low	24.9	Very low	150 Å²	150	143.4 Å²	143.4	77%	0.769	80%	0.797	S	S	*	*			trans	-78.2	132.4	172	-67.6	164.3	0	0	0	107.7	E356	I354-E356 HydrophobicContact CG2-CG 4.34Å
355	L	27.2	Very low	24.9	Very low	170 Å²	170	142.7 Å²	142.7	89%	0.89	79%	0.792	S	S	*	*			trans	-103.1	108.8	165.1	-81.2	165.2	0	0	0	108.2
356	E	23.1	Very low	25	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	80%	0.795	S	S	*	*			trans	-71.1	134.1	165.8	-71.2	175.2	153.3	0	0	109.3	I354	I354-E356 HydrophobicContact CG2-CG 4.34Å
357	G	25.6	Very low	24.7	Very low	75 Å²	75	144.5 Å²	144.5	77%	0.773	80%	0.797	S	S	*	*			trans	-124.8	92.8	171.7	0	0	0	0	0	109
358	D	22.3	Very low	24.9	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	80%	0.798	S	S	*	*			trans	-66.9	125.1	168.9	-79.8	-37	0	0	0	110.6
359	T	28	Very low	25	Very low	137 Å²	137	138.3 Å²	138.3	84%	0.84	79%	0.788	S	S	*	*			trans	-134.2	94.2	153.2	56.9	0	0	0	0	109.6	S361	T359-S361 PolarHBondContact O-N 3.41Å
360	N	23.8	Very low	25	Very low	139 Å²	139	139.3 Å²	139.3	74%	0.743	79%	0.788	S	S	*	*			trans	-60.1	122.2	161.7	-77.8	-45.5	0	0	0	110.3
361	S	27.8	Very low	25.1	Very low	115 Å²	115	139.4 Å²	139.4	80%	0.804	79%	0.788	S	S	*	*			trans	-142.7	89.4	154.8	68.7	0	0	0	0	110.1	T359	T359-S361 PolarHBondContact O-N 3.41Å
362	H	24.9	Very low	25.1	Very low	179 Å²	179	142.7 Å²	142.7	83%	0.829	79%	0.79	S	S	*	*			trans	-63.4	124.1	160	-76.1	-76.4	0	0	0	109.6
363	K	28.8	Very low	25.2	Very low	212 Å²	212	143 Å²	143	92%	0.922	79%	0.792	S	S	*	*			trans	-148.1	96.1	155.6	-107.2	178	-175	179.1	0	110.7
364	G	24.6	Very low	25.2	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	78%	0.784	S	S	*	*			trans	52.4	99.1	131.3	0	0	0	0	0	118.9
365	I	22.2	Very low	25.4	Very low	151 Å²	151	141.5 Å²	141.5	77%	0.774	78%	0.78	S	S	*	*			trans	-62.4	129.2	157.9	-60.6	162.2	0	0	0	109.3	V367	I365-V367 HydrophobicContact CG2-CG2 3.73Å
366	P	25.6	Very low	25.3	Very low	126 Å²	126	140.6 Å²	140.6	82%	0.818	77%	0.77	S	S	*	*			trans	-90.3	102.9	157.4	30.9	-21.8	0	0	0	108.7
367	V	22.3	Very low	25.5	Very low	117 Å²	117	141.4 Å²	141.4	71%	0.709	77%	0.774	S	S	*	*			trans	-78.2	120.1	159.5	177.2	0	0	0	0	106.4	I365	I365-V367 HydrophobicContact CG2-CG2 3.73Å
368	S	26.8	Very low	25.4	Very low	121 Å²	121	146.5 Å²	146.5	85%	0.846	78%	0.778	S	S	*	*			trans	-138.9	130.9	158.1	-170.1	0	0	0	0	109.3
369	N	27.9	Very low	25.6	Very low	133 Å²	133	148.2 Å²	148.2	71%	0.711	78%	0.781	S	S	*	*			trans	-79.8	153.6	-159.9	-67.2	-39.1	0	0	0	113.4
370	H	22.6	Very low	25.4	Very low	163 Å²	163	146.4 Å²	146.4	76%	0.755	77%	0.774	S	S	*	*			trans	-27.4	130.2	151.4	-72.7	-85.8	0	0	0	114.8
371	I	26.3	Very low	25.7	Very low	167 Å²	167	147 Å²	147	86%	0.856	78%	0.777	S	S	*	*			trans	-141.3	114.5	136.6	-62.1	-172.9	0	0	0	107.3
372	F	22.6	Very low	25.5	Very low	164 Å²	164	150.5 Å²	150.5	72%	0.719	78%	0.781	S	S	*	*			trans	-70.1	141.7	159.6	-94.5	-103	0	0	0	108.6
373	D	29.5	Very low	25.7	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	78%	0.779	S	S	*	*				-178.5	113.8	125.5	-92.4	-23.8	0	0	0	112.3
374	D	25.9	Very low	25.6	Very low	112 Å²	112	143.5 Å²	143.5	60%	0.599	77%	0.77	S	S	*	*				42.3	121.4	125.8	-88.4	4.3	0	0	0	122.7
375	K	25.8	Very low	25.6	Very low	154 Å²	154	147.6 Å²	147.6	67%	0.67	77%	0.774	S	S	*	*				89.2	122.2	123.4	-76.5	177.6	-178.9	130.3	0	120.8
376	H	24	Very low	25.8	Very low	151 Å²	151	147.9 Å²	147.9	70%	0.699	78%	0.777	S	S	*	*			trans	59.1	116.3	142.3	-64.5	-64.2	0	0	0	118
377	H	29	Very low	25.8	Very low	191 Å²	191	149.6 Å²	149.6	88%	0.884	78%	0.779	S	S	*	*				-167	122.6	104.6	-96.5	-70.6	0	0	0	110
378	Q	22.5	Very low	26.1	Very low	181 Å²	181	148.4 Å²	148.4	85%	0.846	78%	0.776	S	S	*	*			trans	-63.3	135.3	155.3	-77.1	165.8	-43	0	0	107.8
379	E	26.3	Very low	26	Very low	177 Å²	177	148.6 Å²	148.6	83%	0.827	78%	0.777	S	S	*	*			trans	-160.8	119.1	135.4	-112.4	167.1	-160.3	0	0	110.6
380	S	23.6	Very low	25.9	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	78%	0.781	S	S	*	*			trans	-60.2	130	168.7	49.3	0	0	0	0	110.9
381	N	29.9	Very low	26	Very low	151 Å²	151	150.2 Å²	150.2	81%	0.807	78%	0.784	S	S	*	*			trans	-134.6	99.6	155.6	-82.7	-47.4	0	0	0	109.5
382	H	24	Very low	25.9	Very low	188 Å²	188	153.4 Å²	153.4	87%	0.87	79%	0.787	S	S	*	*			trans	-63	120.5	158.5	-86.1	-86.6	0	0	0	109.4
383	V	28.5	Very low	25.9	Very low	133 Å²	133	154.2 Å²	154.2	81%	0.806	79%	0.793	S	S	*	*			trans	-142.5	137.4	154.6	-179.6	0	0	0	0	108.3
384	P	28.1	Very low	25.7	Very low	112 Å²	112	154.9 Å²	154.9	73%	0.727	79%	0.792	S	S	*	*			trans	-90.1	154.6	-153	12.8	4	0	0	0	114.4	N386	P384-N386 PolarHBondContact O-N 2.89Å
385	L	24.1	Very low	25.5	Very low	159 Å²	159	156.5 Å²	156.5	83%	0.832	80%	0.799	S	S	*	*			trans	-48.5	112	165.9	-87.9	76.2	0	0	0	110.9
386	N	26.7	Very low	25.3	Very low	157 Å²	157	155.4 Å²	155.4	84%	0.84	80%	0.801	S	S	*	*			trans	-96	115	156.1	-95.7	-15	0	0	0	108.8	P384 S388	P384-N386 PolarHBondContact O-N 2.89Å; N386-S388 PolarHBondContact O-N 2.87Å
387	N	26.3	Very low	25.3	Very low	161 Å²	161	154.3 Å²	154.3	86%	0.861	80%	0.799	S	S	*	*			trans	-49.9	102.5	169.8	-69.5	-26.3	0	0	0	109.9
388	S	27.1	Very low	25.1	Very low	93 Å²	93	149.4 Å²	149.4	65%	0.65	79%	0.786	S	S	*	*			trans	-113.1	112.5	157.9	48.4	0	0	0	0	107.1	N386 I390	N386-S388 PolarHBondContact O-N 2.87Å; S388-I390 PolarHBondContact O-N 3.12Å
389	S	25	Very low	25.2	Very low	124 Å²	124	148 Å²	148	87%	0.867	78%	0.784	S	S	*	*			trans	-47.6	99.6	166.4	43.1	0	0	0	0	110.2
390	I	26.4	Very low	25.2	Very low	152 Å²	152	147.2 Å²	147.2	78%	0.779	78%	0.778	S	S	*	*			trans	-96.1	103.3	166.9	-62.6	177.4	0	0	0	106.6	S388	S388-I390 PolarHBondContact O-N 3.12Å
391	E	24.2	Very low	25.3	Very low	178 Å²	178	147.7 Å²	147.7	83%	0.832	78%	0.781	S	S	*	*			trans	-53.7	133.8	172.9	-160.9	169.1	-167.7	0	0	110.5	Q393	E391-Q393 PolarHBondContact O-N 3.31Å
392	Y	23.6	Very low	25	Very low	234 Å²	234	147.1 Å²	147.1	92%	0.918	78%	0.778	S	S	*	*			trans	-58.6	107.6	-174.1	-74.8	-95.8	0	0	0	111.3	Q394	Y392-Q394 PolarHBondContact O-N 2.88Å
393	Q	24.2	Very low	25.1	Very low	182 Å²	182	146.1 Å²	146.1	85%	0.85	78%	0.778	S	S	*	*			trans	-78.3	102.8	157.6	-72.9	-170.5	-7.1	0	0	107.9	E391 L395	E391-Q393 PolarHBondContact O-N 3.31Å; Q393-L395 VanDerWaalsContact C-N 3.33Å; Q393-L395 PolarHBondContact O-N 2.86Å
394	Q	23.6	Very low	24.8	Very low	162 Å²	162	145.1 Å²	145.1	76%	0.757	78%	0.777	S	S	*	*			trans	-55.1	95.7	166.9	-175.9	168.6	-21	0	0	108.7	Y392 D396	Y392-Q394 PolarHBondContact O-N 2.88Å; Q394-D396 VanDerWaalsContact C-N 3.28Å; Q394-D396 PolarHBondContact NE2-OD1 3.33Å; Q394-D396 PolarHBondContact O-N 2.85Å
395	L	22.9	Very low	24.6	Very low	146 Å²	146	143.7 Å²	143.7	76%	0.764	77%	0.774	S	S	*	*			trans	-73	89.8	169.2	-81	163.6	0	0	0	107.2	Q393 I397	Q393-L395 VanDerWaalsContact C-N 3.33Å; Q393-L395 PolarHBondContact O-N 2.86Å; L395-I397 HydrophobicContact CB-CG1 4.23Å; L395-I397 PolarHBondContact O-N 2.88Å
396	D	22.3	Very low	24.5	Very low	131 Å²	131	144.8 Å²	144.8	70%	0.701	77%	0.773	S	S	*	*			trans	-63.7	82.7	161.7	-79	-21.9	0	0	0	108	Q394 S398	Q394-D396 VanDerWaalsContact C-N 3.28Å; Q394-D396 PolarHBondContact NE2-OD1 3.33Å; Q394-D396 PolarHBondContact O-N 2.85Å; D396-S398 PolarHBondContact O-N 3.4Å
397	I	24.1	Very low	24.4	Very low	129 Å²	129	144.2 Å²	144.2	66%	0.662	77%	0.769	S	S	*	*			trans	-75.5	74.5	166.2	-52.7	175.9	0	0	0	106.1	L395 L399	L395-I397 HydrophobicContact CB-CG1 4.23Å; L395-I397 PolarHBondContact O-N 2.88Å; I397-L399 HydrophobicContact CG2-CD1 4.48Å; I397-L399 HydrophobicContact CG2-CG 4.07Å; I397-L399 PolarHBondContact O-N 2.87Å
398	S	23.4	Very low	24.4	Very low	88 Å²	88	142.4 Å²	142.4	62%	0.615	76%	0.759	S	S	*	*			trans	-60.6	88	155.8	149.2	0	0	0	0	106.2	D396 K400	D396-S398 PolarHBondContact O-N 3.4Å; S398-K400 PolarHBondContact O-N 3.18Å
399	L	25.7	Very low	24.3	Very low	152 Å²	152	144.7 Å²	144.7	80%	0.796	76%	0.764	S	S	*	*			trans	-61.4	82	161.7	-92.8	156	0	0	0	107.1	I397 S401	I397-L399 HydrophobicContact CG2-CD1 4.48Å; I397-L399 HydrophobicContact CG2-CG 4.07Å; I397-L399 PolarHBondContact O-N 2.87Å; L399-S401 PolarHBondContact O-N 2.97Å
400	K	25	Very low	24.3	Very low	160 Å²	160	144 Å²	144	70%	0.696	76%	0.755	S	S	*	*			trans	-60.8	96	159	-90	178.4	176.4	174.5	0	105.5	S398 N402	S398-K400 PolarHBondContact O-N 3.18Å; K400-N402 PolarHBondContact O-N 2.86Å
401	S	25.3	Very low	24.2	Very low	110 Å²	110	141.9 Å²	141.9	77%	0.769	75%	0.749	S	S	*	*			trans	-63.2	68.1	165.1	46.1	0	0	0	0	109.6	L399 L403	L399-S401 PolarHBondContact O-N 2.97Å; S401-L403 PolarHBondContact O-N 3.11Å
402	N	24.7	Very low	24.2	Very low	139 Å²	139	142.6 Å²	142.6	74%	0.743	75%	0.75	S	S	*	*			trans	-83.5	61.9	166.8	-72.1	-16.8	0	0	0	108.9	K400	K400-N402 PolarHBondContact O-N 2.86Å
403	L	25.5	Very low	24.2	Very low	166 Å²	166	137 Å²	137	87%	0.869	74%	0.735	S	S	*	*			trans	-118.6	64.9	156.1	-85.6	163.3	0	0	0	106.8	S401 A405	S401-L403 PolarHBondContact O-N 3.11Å; L403-A405 PolarHBondContact O-N 3.04Å
404	S	22.5	Very low	24.2	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	73%	0.725	S	S	*	*			trans	-68.1	76.1	158.8	162.2	0	0	0	0	107.6	K406	S404-K406 PolarHBondContact O-N 2.83Å
405	A	23.1	Very low	24.2	Very low	82 Å²	82	134.1 Å²	134.1	68%	0.678	72%	0.724	S	S	*	*			trans	-71	106.4	158.7	0	0	0	0	0	106	L403 L407	L403-A405 PolarHBondContact O-N 3.04Å; A405-L407 VanDerWaalsContact C-N 3.28Å; A405-L407 PolarHBondContact O-N 3.07Å
406	K	23.9	Very low	24.3	Very low	183 Å²	183	135.9 Å²	135.9	80%	0.796	72%	0.721	S	S	*	*			trans	-59.4	91.9	175.4	-149.9	175.5	-172.3	-178.9	0	107.3	S404 N408	S404-K406 PolarHBondContact O-N 2.83Å; K406-N408 PolarHBondContact O-N 2.89Å
407	L	23.7	Very low	24.3	Very low	145 Å²	145	136.2 Å²	136.2	76%	0.759	72%	0.723	S	S	*	*			trans	-69.1	101.9	168.8	-136.6	102.1	0	0	0	104.6	A405 D409	A405-L407 VanDerWaalsContact C-N 3.28Å; A405-L407 PolarHBondContact O-N 3.07Å; L407-D409 VanDerWaalsContact C-N 3.34Å; L407-D409 PolarHBondContact O-N 2.99Å
408	N	26.3	Very low	24.3	Very low	122 Å²	122	136.1 Å²	136.1	65%	0.652	73%	0.729	S	S	*	*			trans	-67.1	104.9	166.5	-72.8	-20.4	0	0	0	105.5	K406 T410	K406-N408 PolarHBondContact O-N 2.89Å; N408-T410 PolarHBondContact O-N 3Å; N408-T410 PolarHBondContact O-OG1 2.66Å
409	D	25.4	Very low	24.3	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	73%	0.734	S	S	*	*			trans	-55.9	81	164.1	-69.3	-36.6	0	0	0	108.3	L407 T411	L407-D409 VanDerWaalsContact C-N 3.34Å; L407-D409 PolarHBondContact O-N 2.99Å; D409-T411 VanDerWaalsContact C-N 3.31Å
410	T	24.9	Very low	24.1	Very low	111 Å²	111	136.9 Å²	136.9	68%	0.681	73%	0.731	S	S	*	*			trans	-97.3	81.3	158.6	37.6	0	0	0	0	104.4	N408 F412	N408-T410 PolarHBondContact O-N 3Å; N408-T410 PolarHBondContact O-OG1 2.66Å; T410-F412 VanDerWaalsContact C-N 3.27Å; T410-F412 PolarHBondContact O-N 3.02Å
411	T	24.6	Very low	24.3	Very low	106 Å²	106	138.6 Å²	138.6	65%	0.65	74%	0.744	S	S	*	*			trans	-44.4	100.9	158.2	-34.4	0	0	0	0	106.1	D409 D413	D409-T411 VanDerWaalsContact C-N 3.31Å; T411-D413 PolarHBondContact O-N 2.98Å
412	F	23.8	Very low	24.2	Very low	193 Å²	193	140.1 Å²	140.1	85%	0.846	74%	0.744	S	S	*	*			trans	-74.2	73.8	170.5	-123.9	-91.4	0	0	0	105.3	T410 M414	T410-F412 VanDerWaalsContact C-N 3.27Å; T410-F412 PolarHBondContact O-N 3.02Å; F412-M414 PolarHBondContact O-N 3.41Å
413	D	24.1	Very low	24.1	Very low	116 Å²	116	138.4 Å²	138.4	62%	0.62	74%	0.738	S	S	*	*			trans	-64.2	94.5	163.1	-78.3	-28.8	0	0	0	105.3	T411 Q415	T411-D413 PolarHBondContact O-N 2.98Å; D413-Q415 HydrophobicContact CB-CG 4.37Å; D413-Q415 PolarHBondContact O-N 3.49Å
414	M	23	Very low	24	Very low	130 Å²	130	136.5 Å²	136.5	64%	0.64	73%	0.729	S	S	*	*			trans	-68.7	78.9	166.1	-158.4	-178.2	75	0	0	106.2	F412 Y416	F412-M414 PolarHBondContact O-N 3.41Å; M414-Y416 HydrophobicContact CE-CD2 4.39Å; M414-Y416 HydrophobicContact CE-CE1 4.34Å; M414-Y416 HydrophobicContact CE-CE2 3.56Å; M414-Y416 WeakPolarHBondContact CE-OH 3.37Å; M414-Y416 PolarHBondContact O-N 2.97Å
415	Q	23	Very low	24.3	Very low	154 Å²	154	138.7 Å²	138.7	72%	0.72	73%	0.732	S	S	*	*			trans	-61.3	104.6	169.8	-73.9	-179.5	-7.2	0	0	106.7	D413 N417	D413-Q415 HydrophobicContact CB-CG 4.37Å; D413-Q415 PolarHBondContact O-N 3.49Å; Q415-N417 PolarHBondContact O-N 2.97Å
416	Y	25.1	Very low	24.3	Very low	183 Å²	183	142 Å²	142	72%	0.718	74%	0.738	S	S	*	*			trans	-57.9	106.4	159.7	-77.6	-89.1	0	0	0	106.7	M414 T418	M414-Y416 HydrophobicContact CE-CD2 4.39Å; M414-Y416 HydrophobicContact CE-CE1 4.34Å; M414-Y416 HydrophobicContact CE-CE2 3.56Å; M414-Y416 WeakPolarHBondContact CE-OH 3.37Å; M414-Y416 PolarHBondContact O-N 2.97Å; Y416-T418 PolarHBondContact O-N 2.97Å
417	N	22.9	Very low	24.5	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	73%	0.731	S	S	*	*			trans	-65.7	82.2	166.4	-80.1	-19.5	0	0	0	108.3	Q415 T419	Q415-N417 PolarHBondContact O-N 2.97Å; N417-T419 VanDerWaalsContact C-N 3.25Å; N417-T419 PolarHBondContact O-N 2.85Å
418	T	23.8	Very low	24.4	Very low	127 Å²	127	138 Å²	138	78%	0.779	73%	0.728	S	S	*	*			trans	-82.7	78.6	157.1	39.5	0	0	0	0	107.5	Y416 D420	Y416-T418 PolarHBondContact O-N 2.97Å; T418-D420 PolarHBondContact O-N 2.79Å
419	T	24	Very low	24.5	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.724	74%	0.736	S	S	*	*			trans	-82.9	101.6	161.4	32.9	0	0	0	0	108.3	N417	N417-T419 VanDerWaalsContact C-N 3.25Å; N417-T419 PolarHBondContact O-N 2.85Å
420	D	22.5	Very low	24.6	Very low	137 Å²	137	141.5 Å²	141.5	73%	0.733	74%	0.738	S	S	*	*			trans	31.4	102.2	138.2	-58.1	-31.7	0	0	0	117.2	T418	T418-D420 PolarHBondContact O-N 2.79Å
421	M	27.8	Very low	24.6	Very low	196 Å²	196	143.2 Å²	143.2	97%	0.966	74%	0.743	S	S	*	*			trans	-130.6	106.9	137	-78.4	-60.4	-122.4	0	0	109.2
422	N	23.1	Very low	24.6	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	75%	0.748	S	S	*	*			trans	-49.6	146.2	177.8	-101.6	-25.8	0	0	0	116.2
423	V	23.6	Very low	25	Very low	103 Å²	103	143.9 Å²	143.9	62%	0.624	75%	0.75	S	S	*	*				83.6	108.7	127.5	172.9	0	0	0	0	118.3
424	D	22.7	Very low	25.1	Very low	126 Å²	126	145 Å²	145	67%	0.674	75%	0.754	S	S	*	*			trans	56	117.5	131.1	-52.3	-16.2	0	0	0	119.3
425	N	29.1	Very low	25.3	Very low	159 Å²	159	143.6 Å²	143.6	85%	0.85	76%	0.758	S	S	*	*				-154.8	112.8	121	-84.9	-47.9	0	0	0	109.5	V427	N425-V427 PolarHBondContact O-N 2.72Å
426	D	23.5	Very low	25.4	Very low	151 Å²	151	143 Å²	143	81%	0.807	76%	0.759	S	S	*	*			trans	-49.9	127.7	164.3	-66	-54.4	0	0	0	111.1
427	V	26.6	Very low	25.5	Very low	107 Å²	107	140 Å²	140	65%	0.648	76%	0.761	S	S	*	*			trans	-135	93.5	159.9	-175.5	0	0	0	0	107.7	N425 F429	N425-V427 PolarHBondContact O-N 2.72Å; V427-F429 HydrophobicContact CG1-CD2 3.34Å; V427-F429 HydrophobicContact CG1-CE2 3.15Å; V427-F429 HydrophobicContact CG1-CG 4.36Å; V427-F429 HydrophobicContact CG1-CZ 4.04Å; V427-F429 PolarHBondContact O-N 3.1Å
428	I	22	Very low	25.6	Very low	137 Å²	137	139.2 Å²	139.2	70%	0.703	76%	0.764	S	S	*	*			trans	-63.1	119.9	161.7	-61.9	166.4	0	0	0	106.7
429	F	28.7	Very low	25.7	Very low	188 Å²	188	142.2 Å²	142.2	83%	0.825	77%	0.77	S	S	*	*			trans	-125.8	113.7	156.8	-83.4	-63.8	0	0	0	108	V427	V427-F429 HydrophobicContact CG1-CD2 3.34Å; V427-F429 HydrophobicContact CG1-CE2 3.15Å; V427-F429 HydrophobicContact CG1-CG 4.36Å; V427-F429 HydrophobicContact CG1-CZ 4.04Å; V427-F429 PolarHBondContact O-N 3.1Å
430	D	27.6	Very low	25.9	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	78%	0.776	S	S	*	*			trans	-56	149.6	179.7	-72.3	-55.5	0	0	0	113.1
431	D	24.3	Very low	25.9	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	78%	0.781	S	S	*	*			trans	-53.9	165.9	166.2	-74.3	-51.3	0	0	0	113.6
432	D	26.3	Very low	25.8	Very low	140 Å²	140	145.9 Å²	145.9	75%	0.749	77%	0.774	S	S	*	*			trans	82.4	79.6	159.5	-61.2	-25.9	0	0	0	119.2
433	I	30.6	Very low	26	Very low	173 Å²	173	145.3 Å²	145.3	89%	0.887	77%	0.771	S	S	*	*			trans	-137.8	100.3	131.8	-58.1	-174.9	0	0	0	110.6
434	I	26.2	Very low	26.1	Very low	139 Å²	139	148.4 Å²	148.4	71%	0.713	78%	0.784	S	S	*	*			trans	-51.5	129.9	161.4	-64.4	160.8	0	0	0	110.7
435	S	27.8	Very low	26.4	Very low	102 Å²	102	149.6 Å²	149.6	71%	0.713	79%	0.791	S	S	*	*			trans	-158.5	100.8	145.2	-172.3	0	0	0	0	111.5	T437	S435-T437 PolarHBondContact O-N 3.06Å
436	N	25.8	Very low	26.4	Very low	140 Å²	140	149.5 Å²	149.5	75%	0.749	79%	0.785	S	S	*	*			trans	-52.6	120.7	165	-70.8	-54.1	0	0	0	111.3
437	T	26.8	Very low	26.6	Very low	122 Å²	122	149.9 Å²	149.9	75%	0.748	79%	0.785	S	S	*	*			trans	-151.1	133.8	151.5	-36.9	0	0	0	0	109.2	S435	S435-T437 PolarHBondContact O-N 3.06Å
438	C	24.8	Very low	26.6	Very low	122 Å²	122	150.9 Å²	150.9	82%	0.824	79%	0.787	S	S	*	*			trans	98.5	40	176.9	-53.5	0	0	0	0	117.4
439	Q	25.7	Very low	27	Very low	190 Å²	190	148.5 Å²	148.5	89%	0.888	78%	0.783	S	S	*	*			trans	-87.8	86.3	143.7	-81.6	177.2	-11.6	0	0	108.8
440	K	28	Very low	26.9	Very low	195 Å²	195	146.3 Å²	146.3	85%	0.848	78%	0.778	S	S	*	*			trans	-97.5	100.1	161.6	-97.8	-175.2	175.4	177.5	0	108.2	I442	K440-I442 PolarHBondContact O-N 2.64Å
441	M	22.4	Very low	26.8	Very low	173 Å²	173	145.2 Å²	145.2	85%	0.852	77%	0.772	S	S	*	*			trans	-50.1	121.6	159.9	-66.4	171.6	167.8	0	0	109.3
442	I	26.2	Very low	26.8	Very low	159 Å²	159	143.4 Å²	143.4	82%	0.815	77%	0.77	S	S	*	*			trans	-125.9	123.3	155.2	-63.3	-178.5	0	0	0	106.3	K440	K440-I442 PolarHBondContact O-N 2.64Å
443	N	27.2	Very low	26.7	Very low	130 Å²	130	147.1 Å²	147.1	70%	0.695	78%	0.775	S	S	*	*			trans	-66.2	149.7	-164.5	-67.1	-41.3	0	0	0	112.9	D445	N443-D445 VanDerWaalsContact C-N 3.3Å; N443-D445 PolarHBondContact O-N 3.36Å
444	N	25.2	Very low	26.3	Very low	168 Å²	168	143.1 Å²	143.1	90%	0.898	76%	0.762	S	S	*	*			trans	-61.3	85.8	167	-73.4	-32.7	0	0	0	110.3
445	D	29.4	Very low	26.3	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	76%	0.755	S	S	*	*			trans	-82.9	126.1	162	-77.2	-29.5	0	0	0	109.3	N443	N443-D445 VanDerWaalsContact C-N 3.3Å; N443-D445 PolarHBondContact O-N 3.36Å
446	Q	29.3	Very low	26.1	Very low	157 Å²	157	138.6 Å²	138.6	73%	0.734	74%	0.741	S	S	*	*			trans	-46	133.1	-173.3	-68	168.5	-13.7	0	0	112.2	N448	Q446-N448 PolarHBondContact O-N 2.87Å
447	I	27.1	Very low	26.1	Very low	159 Å²	159	140.1 Å²	140.1	82%	0.815	74%	0.741	S	S	*	*			trans	-61.7	79.2	168.7	-57.7	168.6	0	0	0	107.6
448	N	26.8	Very low	26	Very low	128 Å²	128	141 Å²	141	68%	0.684	74%	0.741	S	S	*	*			trans	-94.7	124.1	172.8	-80.4	-21.1	0	0	0	108.3	Q446	Q446-N448 PolarHBondContact O-N 2.87Å
449	S	30.7	Very low	26.1	Very low	87 Å²	87	143.2 Å²	143.2	61%	0.608	74%	0.736	S	S	*	*			trans	60.2	90.5	166.1	-159.7	0	0	0	0	115.2	D451	S449-D451 PolarHBondContact O-N 2.78Å; S449-D451 PolarHBondContact OG-OD1 3.21Å
450	I	27.6	Very low	26.2	Very low	142 Å²	142	139.9 Å²	139.9	73%	0.728	73%	0.731	S	S	*	*			trans	-61.1	96.4	148.2	-65.6	169.1	0	0	0	105	C452	I450-C452 PolarHBondContact O-N 3.47Å
451	D	24.6	Very low	26.3	Very low	125 Å²	125	136.6 Å²	136.6	67%	0.668	72%	0.721	S	S	*	*			trans	-63.6	88.5	166.8	-72.9	-17.4	0	0	0	106.8	S449 Y453	S449-D451 PolarHBondContact O-N 2.78Å; S449-D451 PolarHBondContact OG-OD1 3.21Å; D451-Y453 PolarHBondContact O-N 3.4Å
452	C	25	Very low	26.5	Very low	108 Å²	108	136 Å²	136	73%	0.73	72%	0.717	S	S	*	*			trans	-60.7	84.9	169.6	-70.9	0	0	0	0	107.8	I450 S454	I450-C452 PolarHBondContact O-N 3.47Å; C452-S454 VanDerWaalsContact C-N 3.33Å; C452-S454 PolarHBondContact O-N 3.33Å
453	Y	23.2	Very low	26.8	Very low	219 Å²	219	132.9 Å²	132.9	86%	0.859	71%	0.707	S	S	*	*			trans	-61	98.6	163.6	-109.7	-90	0	0	0	107	D451 P455	D451-Y453 PolarHBondContact O-N 3.4Å; Y453-P455 VanDerWaalsContact O-CD 3.27Å; Y453-P455 WeakPolarHBondContact O-CD 3.46Å
454	S	23.5	Very low	27	Very low	89 Å²	89	132.8 Å²	132.8	62%	0.622	71%	0.707	S	S	*	*			trans	-61.3	120.3	163	-73.4	0	0	0	0	107.5	C452 S456	C452-S454 VanDerWaalsContact C-N 3.33Å; C452-S454 PolarHBondContact O-N 3.33Å; S454-S456 WeakPolarHBondContact CB-OG 3.28Å; S454-S456 PolarHBondContact O-N 3.42Å
455	P	24.6	Very low	27.3	Very low	86 Å²	86	132.1 Å²	132.1	56%	0.558	70%	0.698	S	S	*	*			trans	-76	65.8	173.3	31.3	-29.4	0	0	0	108.4	Q268 Y453 F457	Q268-P455 HydrophobicContact CG-CG 4.39Å; Y453-P455 VanDerWaalsContact O-CD 3.27Å; Y453-P455 WeakPolarHBondContact O-CD 3.46Å; P455-F457 VanDerWaalsContact C-N 3.32Å; P455-F457 PolarHBondContact O-N 3.16Å; P455-F457 VanDerWaalsContact O-N 3.1Å
456	S	24.6	Very low	27.3	Very low	59 Å²	59	129.2 Å²	129.2	41%	0.413	68%	0.683	S	S	.	*			trans	-82.5	78.9	175.6	-52.5	0	0	0	0	108.5	S454 L458	S454-S456 WeakPolarHBondContact CB-OG 3.28Å; S454-S456 PolarHBondContact O-N 3.42Å; S456-L458 PolarHBondContact O-N 3.14Å
457	F	25.9	Very low	27.2	Very low	173 Å²	173	128.2 Å²	128.2	76%	0.759	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	29.3	155.2	-75.6	-77.5	0	0	0	111.6	P455	P455-F457 VanDerWaalsContact C-N 3.32Å; P455-F457 PolarHBondContact O-N 3.16Å; P455-F457 VanDerWaalsContact O-N 3.1Å
458	L	25.1	Very low	27.5	Very low	141 Å²	141	129.5 Å²	129.5	74%	0.738	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	28.3	-179.2	-66.9	176.3	0	0	0	111.5	S456 P460	S456-L458 PolarHBondContact O-N 3.14Å; L458-P460 WeakPolarHBondContact O-CD 3.32Å
459	K	26.4	Very low	27.6	Very low	167 Å²	167	131.5 Å²	131.5	73%	0.726	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-83.5	119.3	163.5	-73	-170.2	178.8	-175.1	0	108.1	I461	K459-I461 PolarHBondContact O-N 3.25Å
460	P	28.5	Very low	27.5	Very low	120 Å²	120	134 Å²	134	78%	0.779	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.1	169.5	-16.7	28.9	0	0	0	108.1	L458 E462	L458-P460 WeakPolarHBondContact O-CD 3.32Å; P460-E462 PolarHBondContact O-N 2.9Å
461	I	28.6	Very low	27.3	Very low	126 Å²	126	133.9 Å²	133.9	65%	0.646	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-63.6	119.2	171.1	-62.5	168.9	0	0	0	105.8	K459 C463	K459-I461 PolarHBondContact O-N 3.25Å; I461-C463 PolarHBondContact O-N 3.22Å
462	E	27.5	Very low	27.3	Very low	162 Å²	162	132.7 Å²	132.7	76%	0.757	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-57.1	129.2	174.3	-74.4	176.3	169.1	0	0	108.8	P460 D464 Q465	P460-E462 PolarHBondContact O-N 2.9Å; E462-D464 PolarHBondContact O-N 2.95Å; E462-Q465 PolarHBondContact O-N 2.55Å
463	C	31.1	Very low	27.4	Very low	92 Å²	92	133 Å²	133	62%	0.622	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-53.5	-20.9	-173.2	-78.5	0	0	0	0	114.1	I461 Q465 L466 M467	I461-C463 PolarHBondContact O-N 3.22Å; C463-Q465 VanDerWaalsContact C-N 3.3Å; C463-Q465 PolarHBondContact O-N 2.92Å; C463-L466 PolarHBondContact O-N 3.15Å; C463-L466 VanDerWaalsContact O-N 3.14Å; C463-M467 PolarHBondContact O-N 2.75Å
464	D	31.5	Very low	27.6	Very low	129 Å²	129	129.9 Å²	129.9	69%	0.69	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-73.9	-20	-169.4	-61.3	-3.2	0	0	0	113.1	E462	E462-D464 PolarHBondContact O-N 2.95Å
465	Q	31.8	Very low	27.7	Very low	153 Å²	153	132.7 Å²	132.7	72%	0.715	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-81	-27.1	171.2	-93.4	167.8	-6.5	0	0	113.3	E462 C463 M467 K468	E462-Q465 PolarHBondContact O-N 2.55Å; C463-Q465 VanDerWaalsContact C-N 3.3Å; C463-Q465 PolarHBondContact O-N 2.92Å; Q465-M467 VanDerWaalsContact C-N 3.32Å; Q465-M467 PolarHBondContact O-N 3.11Å; Q465-K468 PolarHBondContact O-N 3.05Å
466	L	29.9	Very low	27.8	Very low	92 Å²	92	135.1 Å²	135.1	48%	0.482	70%	0.702	S	S	.	*	H	α-helix	trans	-70.2	-30.2	177.6	-74	168.3	0	0	0	112.3	C463 K468	C463-L466 PolarHBondContact O-N 3.15Å; C463-L466 VanDerWaalsContact O-N 3.14Å; L466-K468 VanDerWaalsContact C-N 3.3Å; L466-K468 PolarHBondContact O-N 3.34Å
467	M	27.4	Very low	27.9	Very low	136 Å²	136	138.5 Å²	138.5	67%	0.67	72%	0.724	S	S	*	*	H	α-helix	trans	-73.5	-18.8	-180	-69.7	-64.6	-74.9	0	0	113.7	C463 Q465	C463-M467 PolarHBondContact O-N 2.75Å; Q465-M467 VanDerWaalsContact C-N 3.32Å; Q465-M467 PolarHBondContact O-N 3.11Å
468	K	32.7	Very low	28	Very low	186 Å²	186	134.6 Å²	134.6	81%	0.809	72%	0.719	S	S	*	*	H	α-helix	trans	-85.4	-27.5	176.5	-78.4	-174.3	178.6	177.5	0	113.8	Q465 L466	Q465-K468 PolarHBondContact O-N 3.05Å; L466-K468 VanDerWaalsContact C-N 3.3Å; L466-K468 PolarHBondContact O-N 3.34Å
469	E	30.2	Very low	28	Very low	169 Å²	169	134.3 Å²	134.3	79%	0.79	72%	0.718	S	S	*	*	H	α-helix	trans	-90.3	-18.1	-177.7	-71.5	-161.7	161.8	0	0	114.3
470	L	28.4	Very low	28.3	Very low	140 Å²	140	130.8 Å²	130.8	73%	0.733	71%	0.712	S	S	*	*	S	Bend	trans	-92.2	1.8	-178.1	-78	162	0	0	0	115	C472	L470-C472 VanDerWaalsContact C-N 3.34Å; L470-C472 PolarHBondContact O-N 3.08Å
471	I	23.3	Very low	28.3	Very low	140 Å²	140	132.5 Å²	132.5	72%	0.718	71%	0.714	S	S	*	*			trans	-97.2	64.3	168.5	-45.7	177.5	0	0	0	108.8
472	C	24.5	Very low	28.3	Very low	100 Å²	100	132.8 Å²	132.8	68%	0.676	72%	0.716	S	S	*	*	S	Bend	trans	-105.7	127.2	151.9	-79.5	0	0	0	0	106.5	L470 I474	L470-C472 VanDerWaalsContact C-N 3.34Å; L470-C472 PolarHBondContact O-N 3.08Å; C472-I474 PolarHBondContact O-N 3.28Å
473	P	27.6	Very low	28.2	Very low	114 Å²	114	134.3 Å²	134.3	74%	0.74	72%	0.723	S	S	*	*			trans	-62.4	122.8	-162.9	25.6	-32.1	0	0	0	109.1	D475	P473-D475 PolarHBondContact O-N 3.32Å
474	I	25.8	Very low	28.1	Very low	153 Å²	153	135.5 Å²	135.5	79%	0.785	73%	0.728	S	S	*	*			trans	-57.9	106.3	167.1	-65.4	169.2	0	0	0	105.5	C472 I476	C472-I474 PolarHBondContact O-N 3.28Å; I474-I476 VanDerWaalsContact C-N 3.34Å; I474-I476 WeakPolarHBondContact O-CG1 3.49Å; I474-I476 PolarHBondContact O-N 3.43Å
475	D	26.6	Very low	27.9	Very low	148 Å²	148	136 Å²	136	79%	0.791	74%	0.735	S	S	*	*			trans	-56.3	103.7	166.7	-86.9	-37.4	0	0	0	107.1	P473 C477	P473-D475 PolarHBondContact O-N 3.32Å; D475-C477 VanDerWaalsContact C-N 3.33Å; D475-C477 PolarHBondContact O-N 3.45Å
476	I	27.1	Very low	27.5	Very low	138 Å²	138	136.1 Å²	136.1	71%	0.708	74%	0.741	S	S	*	*			trans	-65.5	97.4	177	-55.5	176.3	0	0	0	105.8	I474 S478	I474-I476 VanDerWaalsContact C-N 3.34Å; I474-I476 WeakPolarHBondContact O-CG1 3.49Å; I474-I476 PolarHBondContact O-N 3.43Å; I476-S478 VanDerWaalsContact CG2-OG 3.3Å; I476-S478 WeakPolarHBondContact CG2-OG 3.43Å; I476-S478 PolarHBondContact O-N 3.08Å; I476-S478 PolarHBondContact O-OG 2.96Å
477	C	25.4	Very low	27.3	Very low	129 Å²	129	137.7 Å²	137.7	87%	0.872	76%	0.758	S	S	*	*			trans	-65.1	79.4	155.3	-78.3	0	0	0	0	107.3	D475 N479	D475-C477 VanDerWaalsContact C-N 3.33Å; D475-C477 PolarHBondContact O-N 3.45Å; C477-N479 PolarHBondContact O-N 2.81Å
478	S	28	Very low	27.1	Very low	92 Å²	92	140.2 Å²	140.2	64%	0.643	77%	0.768	S	S	*	*			trans	-59.4	101.6	173.2	-60.3	0	0	0	0	108.1	I476 P480	I476-S478 VanDerWaalsContact CG2-OG 3.3Å; I476-S478 WeakPolarHBondContact CG2-OG 3.43Å; I476-S478 PolarHBondContact O-N 3.08Å; I476-S478 PolarHBondContact O-OG 2.96Å; S478-P480 VanDerWaalsContact O-CD 3.28Å; S478-P480 WeakPolarHBondContact O-CD 3.37Å
479	N	26.5	Very low	26.8	Very low	135 Å²	135	138.6 Å²	138.6	72%	0.722	77%	0.767	S	S	*	*			trans	-82.9	104	154.8	-161	3.6	0	0	0	105.5	C477 N481	C477-N479 PolarHBondContact O-N 2.81Å; N479-N481 PolarHBondContact O-N 3.2Å
480	P	32.8	Very low	26.4	Very low	93 Å²	93	135.5 Å²	135.5	60%	0.604	76%	0.764	S	S	*	*	S	Bend	trans	-69.8	130.8	178.6	30.2	-29.6	0	0	0	107.1	S478	S478-P480 VanDerWaalsContact O-CD 3.28Å; S478-P480 WeakPolarHBondContact O-CD 3.37Å
481	N	27.8	Very low	26.3	Very low	155 Å²	155	136.4 Å²	136.4	83%	0.829	77%	0.769	S	S	*	*			trans	119.4	32.6	169.6	-53.7	-21.1	0	0	0	116.5	N479	N479-N481 PolarHBondContact O-N 3.2Å
482	I	28.1	Very low	26.4	Very low	133 Å²	133	136 Å²	136	68%	0.682	77%	0.774	S	S	*	*			trans	-121.7	93.4	161.2	-55	178.3	0	0	0	108.7	T484	I482-T484 HydrophobicContact CG2-CG2 4.37Å; I482-T484 PolarHBondContact O-N 3.2Å
483	E	26.4	Very low	26.3	Very low	194 Å²	194	140 Å²	140	91%	0.907	78%	0.782	S	S	*	*			trans	-69.3	110.1	164.6	-68.3	176.4	160.8	0	0	108.8
484	T	27.7	Very low	26.1	Very low	117 Å²	117	140.9 Å²	140.9	72%	0.718	79%	0.79	S	S	*	*			trans	-142	97.3	161.5	44.9	0	0	0	0	110.2	I482	I482-T484 HydrophobicContact CG2-CG2 4.37Å; I482-T484 PolarHBondContact O-N 3.2Å
485	T	27.4	Very low	25.9	Very low	138 Å²	138	139.2 Å²	139.2	85%	0.847	79%	0.792	S	S	*	*			trans	-9	125.4	160.6	50.1	0	0	0	0	118.9
486	D	24.4	Very low	25.9	Very low	156 Å²	156	135.7 Å²	135.7	83%	0.834	79%	0.791	S	S	*	*			trans	-58	126.4	168.9	-63.7	-49.6	0	0	0	113.4
487	C	26.1	Very low	25.8	Very low	125 Å²	125	136.9 Å²	136.9	85%	0.845	79%	0.794	S	S	*	*			trans	-103.5	108.8	157.3	-88.7	0	0	0	0	108.5	I489	C487-I489 PolarHBondContact O-N 3.1Å
488	Q	22.6	Very low	25.8	Very low	189 Å²	189	138.5 Å²	138.5	88%	0.883	79%	0.793	S	S	*	*			trans	-69.4	116.8	176.2	-63.8	-179.9	-17.9	0	0	110
489	I	25.5	Very low	25.6	Very low	153 Å²	153	140.8 Å²	140.8	79%	0.785	80%	0.798	S	S	*	*			trans	-105.9	115.3	164.5	-65.5	176.2	0	0	0	107.1	C487 N491	C487-I489 PolarHBondContact O-N 3.1Å; I489-N491 PolarHBondContact O-N 3.06Å
490	S	23.5	Very low	25.5	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	81%	0.806	S	S	*	*			trans	-65.3	116.4	-177.2	50.3	0	0	0	0	112.1	T492	S490-T492 PolarHBondContact O-N 2.95Å
491	N	24.6	Very low	25.2	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	81%	0.811	S	S	*	*			trans	-76.6	105.9	167.4	-73.5	-26.3	0	0	0	109.3	I489 E493	I489-N491 PolarHBondContact O-N 3.06Å; N491-E493 PolarHBondContact O-N 3.44Å
492	T	25.8	Very low	25	Very low	132 Å²	132	142.5 Å²	142.5	81%	0.81	81%	0.808	S	S	*	*			trans	-79.4	111.2	166.9	19.8	0	0	0	0	109.6	S490 C494	S490-T492 PolarHBondContact O-N 2.95Å; T492-C494 PolarHBondContact O-N 3.48Å
493	E	23.3	Very low	24.9	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	81%	0.81	S	S	*	*			trans	-57.6	120.5	172.7	-66.2	171.2	147.3	0	0	111.1	N491	N491-E493 PolarHBondContact O-N 3.44Å
494	C	23.1	Very low	25	Very low	134 Å²	134	141.4 Å²	141.4	91%	0.905	80%	0.804	S	S	*	*			trans	-104.9	86.5	161.2	-85.6	0	0	0	0	108.4	T492	T492-C494 PolarHBondContact O-N 3.48Å
495	S	22.2	Very low	24.8	Very low	117 Å²	117	146.2 Å²	146.2	82%	0.818	81%	0.811	S	S	*	*			trans	-76.1	126.3	165.2	64	0	0	0	0	109.7
496	G	25.1	Very low	24.8	Very low	75 Å²	75	147.7 Å²	147.7	77%	0.773	81%	0.808	S	S	*	*			trans	-157	68.4	174.8	0	0	0	0	0	110.5
497	Q	24.8	Very low	24.9	Very low	163 Å²	163	147.2 Å²	147.2	76%	0.762	81%	0.805	S	S	*	*			trans	-60.7	128.9	170.3	-71.5	169.2	-31.4	0	0	110.1
498	N	26.3	Very low	25.1	Very low	162 Å²	162	149.3 Å²	149.3	87%	0.866	81%	0.808	S	S	*	*			trans	-132.4	87.4	153.4	-87.7	-26.2	0	0	0	107.4	L500	N498-L500 PolarHBondContact O-N 2.96Å
499	N	24.6	Very low	25.4	Very low	140 Å²	140	149.1 Å²	149.1	75%	0.749	81%	0.807	S	S	*	*			trans	-72.1	117.1	168.5	-67.3	-38.2	0	0	0	108.2
500	L	24.5	Very low	25.7	Very low	167 Å²	167	147.7 Å²	147.7	87%	0.874	81%	0.808	S	S	*	*			trans	-109.4	119	165.1	-100.1	149	0	0	0	108	N498	N498-L500 PolarHBondContact O-N 2.96Å
501	S	25.8	Very low	25.9	Very low	103 Å²	103	152.1 Å²	152.1	72%	0.72	81%	0.814	S	S	*	*			trans	-59.1	136.1	-168.8	-53	0	0	0	0	113.9
502	I	23.6	Very low	26	Very low	150 Å²	150	149.3 Å²	149.3	77%	0.769	81%	0.807	S	S	*	*			trans	-93.6	108.2	170.2	-68.1	166.4	0	0	0	106.5
503	D	25.1	Very low	26	Very low	133 Å²	133	150.4 Å²	150.4	71%	0.711	81%	0.808	S	S	*	*			trans	-111.1	133.3	172.9	-77.9	-33	0	0	0	110.8
504	H	29.3	Very low	26.1	Very low	171 Å²	171	149.9 Å²	149.9	79%	0.792	81%	0.81	S	S	*	*			trans	70.4	85.4	162.2	-69.9	-63.6	0	0	0	119.9
505	Y	22.4	Very low	26.3	Very low	218 Å²	218	148.4 Å²	148.4	86%	0.855	80%	0.796	S	S	*	*			trans	-80.7	120.6	149	-96.9	-101	0	0	0	109.6
506	E	27.9	Very low	26.5	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	79%	0.789	S	S	*	*			trans	-129.1	110.7	156.9	-86.4	-173.3	168.6	0	0	109.2
507	D	27	Very low	26.5	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	79%	0.785	S	S	*	*			trans	24.7	101.6	145	-60.1	-24.6	0	0	0	118.6
508	N	30.6	Very low	26.5	Very low	170 Å²	170	149.1 Å²	149.1	91%	0.909	79%	0.788	S	S	*	*			trans	-154	125.4	141.1	-84.2	-57.7	0	0	0	110.4
509	E	28	Very low	26.5	Very low	185 Å²	185	147 Å²	147	86%	0.864	78%	0.777	S	S	*	*			trans	-55.5	157.4	-176.3	-90.6	-169.4	150.5	0	0	115.9	K511	E509-K511 PolarHBondContact O-N 3.06Å
510	P	32.2	Very low	26.5	Very low	122 Å²	122	151 Å²	151	79%	0.792	78%	0.783	S	S	*	*			trans	-86.7	108.3	-154.8	33.9	-32	0	0	0	111.9
511	K	28.2	Very low	26.6	Very low	198 Å²	198	151.7 Å²	151.7	86%	0.861	78%	0.779	S	S	*	*			trans	-98	98.5	164.7	-74.3	-177.7	-179.5	173.1	0	110	E509	E509-K511 PolarHBondContact O-N 3.06Å
512	S	26.8	Very low	26.6	Very low	99 Å²	99	155.9 Å²	155.9	69%	0.692	78%	0.784	S	S	*	*			trans	41.4	87.7	150.9	61.1	0	0	0	0	116.1	L514	S512-L514 PolarHBondContact O-N 2.95Å
513	N	25.9	Very low	26.6	Very low	154 Å²	154	155.5 Å²	155.5	82%	0.824	78%	0.783	S	S	*	*			trans	-12.8	80.7	151.3	-63.6	-17.8	0	0	0	115.9	V515	N513-V515 HydrophobicContact CB-CG2 4.11Å; N513-V515 PolarHBondContact O-N 2.93Å
514	L	25.7	Very low	26.6	Very low	172 Å²	172	153.3 Å²	153.3	90%	0.901	78%	0.775	S	S	*	*			trans	-83.5	75	148.1	-86.6	157.1	0	0	0	106.5	S512 G516	S512-L514 PolarHBondContact O-N 2.95Å; L514-G516 PolarHBondContact O-N 2.99Å
515	V	26.4	Very low	26.6	Very low	103 Å²	103	154.5 Å²	154.5	62%	0.624	77%	0.774	S	S	*	*			trans	-74.5	81.7	170.5	179.8	0	0	0	0	107	N513 N517	N513-V515 HydrophobicContact CB-CG2 4.11Å; N513-V515 PolarHBondContact O-N 2.93Å; V515-N517 WeakPolarHBondContact CG1-OD1 2.96Å; V515-N517 PolarHBondContact O-N 2.89Å; V515-N517 VanDerWaalsContact O-N 3.13Å
516	G	26.3	Very low	26.9	Very low	64 Å²	64	149.6 Å²	149.6	66%	0.66	76%	0.762	S	S	*	*			trans	-66.7	99.4	159.8	0	0	0	0	0	107.7	L514 Q518	L514-G516 PolarHBondContact O-N 2.99Å; G516-Q518 PolarHBondContact O-N 2.68Å
517	N	25.2	Very low	26.9	Very low	130 Å²	130	145.2 Å²	145.2	70%	0.695	74%	0.744	S	S	*	*			trans	-66.9	82.8	173.2	-82.7	-23.1	0	0	0	109.8	V515 N519	V515-N517 WeakPolarHBondContact CG1-OD1 2.96Å; V515-N517 PolarHBondContact O-N 2.89Å; V515-N517 VanDerWaalsContact O-N 3.13Å; N517-N519 VanDerWaalsContact C-N 3.25Å; N517-N519 PolarHBondContact O-N 3.17Å; N517-N519 VanDerWaalsContact O-N 3.1Å
518	Q	25.6	Very low	27	Very low	176 Å²	176	144.3 Å²	144.3	82%	0.822	74%	0.739	S	S	*	*			trans	-77.4	75.5	163.5	-68.6	-170.4	-7.1	0	0	109.3	G516	G516-Q518 PolarHBondContact O-N 2.68Å
519	N	24.7	Very low	26.9	Very low	118 Å²	118	139 Å²	139	63%	0.631	72%	0.715	S	S	*	*			trans	-99.6	72.2	169.8	-77.5	-15.2	0	0	0	109.9	N517	N517-N519 VanDerWaalsContact C-N 3.25Å; N517-N519 PolarHBondContact O-N 3.17Å; N517-N519 VanDerWaalsContact O-N 3.1Å
520	Y	25.2	Very low	27	Very low	224 Å²	224	136.4 Å²	136.4	88%	0.878	71%	0.705	S	S	*	*			trans	-102.1	86.4	161.9	-72.5	-80.1	0	0	0	108.4	K522	Y520-K522 PolarHBondContact O-N 2.76Å; Y520-K522 VanDerWaalsContact O-N 3.08Å
521	F	26.1	Very low	26.8	Very low	181 Å²	181	140.5 Å²	140.5	79%	0.794	71%	0.707	S	S	*	*			trans	-72.5	100.1	164.7	-77	-82.4	0	0	0	108.2	L523	F521-L523 PolarHBondContact O-N 2.92Å
522	K	25.8	Very low	26.8	Very low	191 Å²	191	135.9 Å²	135.9	83%	0.83	70%	0.699	S	S	*	*			trans	-71.5	92.1	171.7	-170.2	176.7	-175.4	178.9	0	107.7	Y520 T524	Y520-K522 PolarHBondContact O-N 2.76Å; Y520-K522 VanDerWaalsContact O-N 3.08Å; K522-T524 PolarHBondContact O-N 3.02Å
523	L	24.6	Very low	26.7	Very low	143 Å²	143	134.9 Å²	134.9	75%	0.749	69%	0.692	S	S	*	*			trans	-52.6	123.2	173.7	-68.7	166.7	0	0	0	109	F521 D527	F521-L523 PolarHBondContact O-N 2.92Å; L523-D527 HydrophobicContact CD2-CB 4.27Å
524	T	24.9	Very low	26.7	Very low	86 Å²	86	135.4 Å²	135.4	53%	0.528	70%	0.695	S	S	.	*			trans	-95.6	156.7	177.8	62.9	0	0	0	0	109.2	K522 N526 D527	K522-T524 PolarHBondContact O-N 3.02Å; T524-N526 PolarHBondContact O-N 3.42Å; T524-D527 PolarHBondContact N-OD2 2.65Å; T524-D527 VanDerWaalsContact N-OD2 3.11Å; T524-D527 WeakPolarHBondContact O-CB 3.29Å; T524-D527 PolarHBondContact O-N 2.81Å
525	Y	28.8	Very low	26.8	Very low	196 Å²	196	133 Å²	133	77%	0.769	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-26.1	-173.8	-174.1	-96.2	0	0	0	114.3	D527 L528	Y525-D527 VanDerWaalsContact C-N 3.31Å; Y525-D527 PolarHBondContact O-N 2.78Å; Y525-L528 PolarHBondContact O-N 2.93Å
526	N	29.1	Very low	26.8	Very low	116 Å²	116	135.1 Å²	135.1	62%	0.62	70%	0.7	S	S	*	*	H	α-helix	trans	-68.1	-26.4	177.6	-71.5	-3.8	0	0	0	113.6	T524 L528 S529	T524-N526 PolarHBondContact O-N 3.42Å; N526-L528 PolarHBondContact O-N 2.61Å; N526-S529 PolarHBondContact O-N 2.94Å; N526-S529 PolarHBondContact O-OG 3.45Å
527	D	27.3	Very low	26.8	Very low	75 Å²	75	136.8 Å²	136.8	40%	0.401	70%	0.698	S	S	.	*	H	α-helix	trans	-68.1	-24.4	178.6	-58.6	-38.3	0	0	0	111.5	L523 T524 Y525	L523-D527 HydrophobicContact CD2-CB 4.27Å; T524-D527 PolarHBondContact N-OD2 2.65Å; T524-D527 VanDerWaalsContact N-OD2 3.11Å; T524-D527 WeakPolarHBondContact O-CB 3.29Å; T524-D527 PolarHBondContact O-N 2.81Å; Y525-D527 VanDerWaalsContact C-N 3.31Å; Y525-D527 PolarHBondContact O-N 2.78Å
528	L	29.1	Very low	26.9	Very low	127 Å²	127	135.8 Å²	135.8	67%	0.665	69%	0.692	S	S	*	*	H	α-helix	trans	-82.4	-21.8	177.4	-71.9	167.7	0	0	0	113.2	Y525 N526 I530 Y531	Y525-L528 PolarHBondContact O-N 2.93Å; N526-L528 PolarHBondContact O-N 2.61Å; L528-I530 VanDerWaalsContact C-N 3.3Å; L528-I530 PolarHBondContact O-N 2.97Å; L528-Y531 PolarHBondContact O-N 2.64Å
529	S	28.1	Very low	27.1	Very low	58 Å²	58	132.5 Å²	132.5	41%	0.406	68%	0.684	S	S	.	*	H	α-helix	trans	-71.9	-20.2	-178.7	40.4	0	0	0	0	114.5	N526 Y531 S532	N526-S529 PolarHBondContact O-N 2.94Å; N526-S529 PolarHBondContact O-OG 3.45Å; S529-Y531 PolarHBondContact O-N 2.7Å; S529-S532 PolarHBondContact O-N 3.17Å; S529-S532 PolarHBondContact O-OG 3.06Å
530	I	30.5	Very low	27.4	Very low	131 Å²	131	133.7 Å²	133.7	67%	0.672	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-26.2	176.4	-60	178.4	0	0	0	111.3	L528	L528-I530 VanDerWaalsContact C-N 3.3Å; L528-I530 PolarHBondContact O-N 2.97Å
531	Y	28.3	Very low	27.6	Very low	209 Å²	209	129.9 Å²	129.9	82%	0.82	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-6.1	-177.4	-70.6	-79.8	0	0	0	114.5	L528 S529	L528-Y531 PolarHBondContact O-N 2.64Å; S529-Y531 PolarHBondContact O-N 2.7Å
532	S	27.3	Very low	27.6	Very low	100 Å²	100	127 Å²	127	70%	0.699	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-7.2	-177.1	60.2	0	0	0	0	115.8	S529	S529-S532 PolarHBondContact O-N 3.17Å; S529-S532 PolarHBondContact O-OG 3.06Å
533	S	25	Very low	27.6	Very low	79 Å²	79	126 Å²	126	55%	0.552	68%	0.68	S	S	*	*			trans	-114.9	83.4	-177.3	58.4	0	0	0	0	111.1
534	N	26.6	Very low	27.7	Very low	165 Å²	165	126 Å²	126	88%	0.882	68%	0.679	S	S	*	*			trans	-173.9	58.3	152.2	-87.9	-20.7	0	0	0	109.9
535	V	28.1	Very low	27.8	Very low	122 Å²	122	127.2 Å²	127.2	74%	0.739	69%	0.691	S	S	*	*			trans	-134.3	91.6	158.6	-173	0	0	0	0	106.9	V537	V535-V537 HydrophobicContact CG1-CG2 3.74Å; V535-V537 PolarHBondContact O-N 3.38Å
536	T	25.7	Very low	27.7	Very low	146 Å²	146	122.1 Å²	122.1	90%	0.896	68%	0.684	S	S	*	*			trans	-64.3	86.7	161.8	19.2	0	0	0	0	107.6	N538	T536-N538 PolarHBondContact O-N 3.3Å
537	V	26.4	Very low	27.6	Very low	99 Å²	99	124 Å²	124	60%	0.6	69%	0.694	S	S	*	*			trans	-68.3	111.7	169.4	179.1	0	0	0	0	106.8	V535 V539	V535-V537 HydrophobicContact CG1-CG2 3.74Å; V535-V537 PolarHBondContact O-N 3.38Å; V537-V539 WeakPolarHBondContact O-CG2 3.27Å; V537-V539 PolarHBondContact O-N 3Å; V537-V539 VanDerWaalsContact O-N 3.1Å
538	N	26.7	Very low	27.6	Very low	110 Å²	110	128.6 Å²	128.6	59%	0.588	71%	0.713	S	S	*	*			trans	-66.6	104.8	171.2	-169.2	-2.3	0	0	0	108	T536 N540	T536-N538 PolarHBondContact O-N 3.3Å; N538-N540 PolarHBondContact O-N 3.46Å
539	V	31.2	Very low	27.5	Very low	107 Å²	107	129.1 Å²	129.1	65%	0.648	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-70	-0.5	-171	-179	0	0	0	0	113.1	V537 D541	V537-V539 WeakPolarHBondContact O-CG2 3.27Å; V537-V539 PolarHBondContact O-N 3Å; V537-V539 VanDerWaalsContact O-N 3.1Å; V539-D541 PolarHBondContact O-N 3.01Å
540	N	30.2	Very low	27.4	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-83.4	-5.9	-176	-69.6	-15.6	0	0	0	115.5	N538	N538-N540 PolarHBondContact O-N 3.46Å
541	D	28.8	Very low	27.2	Very low	144 Å²	144	137 Å²	137	77%	0.77	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-96.4	9.9	-178.4	-69.3	-26.8	0	0	0	114.5	V539 L543	V539-D541 PolarHBondContact O-N 3.01Å; D541-L543 PolarHBondContact O-N 3.36Å
542	I	27	Very low	27.1	Very low	120 Å²	120	134.8 Å²	134.8	62%	0.615	75%	0.754	S	S	*	*			trans	-97.4	85.9	176.4	-51.2	179.5	0	0	0	109.2	I544	I542-I544 HydrophobicContact CG2-CG1 3.93Å; I542-I544 PolarHBondContact O-N 3.25Å
543	L	26	Very low	27	Very low	171 Å²	171	135.4 Å²	135.4	90%	0.895	75%	0.753	S	S	*	*			trans	-69.5	94.3	167.2	-154.9	86.1	0	0	0	108.4	D541 S545	D541-L543 PolarHBondContact O-N 3.36Å; L543-S545 PolarHBondContact O-N 3.44Å
544	I	25.6	Very low	26.9	Very low	144 Å²	144	139 Å²	139	74%	0.738	77%	0.765	S	S	*	*			trans	-71.2	95.2	177.4	-59.2	171.9	0	0	0	108.1	I542 S546	I542-I544 HydrophobicContact CG2-CG1 3.93Å; I542-I544 PolarHBondContact O-N 3.25Å; I544-S546 PolarHBondContact O-N 2.77Å
545	S	27.2	Very low	26.9	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	76%	0.758	S	S	*	*			trans	-74.4	104.3	161.5	173.9	0	0	0	0	107.8	L543 D547	L543-S545 PolarHBondContact O-N 3.44Å; S545-D547 PolarHBondContact O-N 3.1Å
546	S	26.7	Very low	26.7	Very low	90 Å²	90	141.3 Å²	141.3	63%	0.629	76%	0.762	S	S	*	*			trans	-73.5	105.6	172.5	51.2	0	0	0	0	109.6	I544	I544-S546 PolarHBondContact O-N 2.77Å
547	D	28.4	Very low	26.6	Very low	155 Å²	155	141.5 Å²	141.5	83%	0.829	76%	0.757	S	S	*	*			trans	-148.3	126	148.1	-94.3	-33.1	0	0	0	110.4	S545	S545-D547 PolarHBondContact O-N 3.1Å
548	H	26.2	Very low	26.5	Very low	171 Å²	171	141.8 Å²	141.8	79%	0.792	76%	0.763	S	S	*	*			trans	-66.7	135.3	-167.3	-68.2	-88.8	0	0	0	112.9
549	T	28	Very low	26.4	Very low	139 Å²	139	142.8 Å²	142.8	85%	0.853	77%	0.768	S	S	*	*				175.7	117.2	114	32.9	0	0	0	0	110.9	K551	T549-K551 PolarHBondContact O-N 3.11Å
550	N	25.2	Very low	26	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	77%	0.773	S	S	*	*			trans	-51.8	113.3	174.2	-102.3	-27.9	0	0	0	113
551	K	27.5	Very low	25.9	Very low	192 Å²	192	146.4 Å²	146.4	84%	0.835	77%	0.771	S	S	*	*			trans	-143.6	114.3	143.6	-78.4	-167.2	178.7	171.3	0	110	T549 T553	T549-K551 PolarHBondContact O-N 3.11Å; K551-T553 PolarHBondContact O-N 3.33Å; K551-T553 PolarHBondContact O-OG1 3.29Å; K551-T553 VanDerWaalsContact O-OG1 3.04Å
552	N	26.3	Very low	25.7	Very low	162 Å²	162	146.7 Å²	146.7	87%	0.866	77%	0.773	S	S	*	*			trans	-22.9	91.6	170.8	-66.9	-23.6	0	0	0	113.9
553	T	24	Very low	25.7	Very low	113 Å²	113	149.7 Å²	149.7	69%	0.693	78%	0.781	S	S	*	*			trans	-108.8	92.8	167.2	-44.8	0	0	0	0	106.1	K551 Q555	K551-T553 PolarHBondContact O-N 3.33Å; K551-T553 PolarHBondContact O-OG1 3.29Å; K551-T553 VanDerWaalsContact O-OG1 3.04Å; T553-Q555 HydrophobicContact CG2-CG 4.36Å; T553-Q555 PolarHBondContact O-N 3.41Å
554	I	23.6	Very low	25.7	Very low	155 Å²	155	150.9 Å²	150.9	80%	0.795	78%	0.779	S	S	*	*			trans	-64.1	90.1	166.7	-62.8	172.9	0	0	0	105.5	Q556	I554-Q556 PolarHBondContact O-N 3.45Å
555	Q	25.5	Very low	25.9	Very low	156 Å²	156	148.8 Å²	148.8	73%	0.729	77%	0.769	S	S	*	*			trans	-69.4	98.3	170.3	-80.6	-178.6	-9.3	0	0	107.3	T553 L557	T553-Q555 HydrophobicContact CG2-CG 4.36Å; T553-Q555 PolarHBondContact O-N 3.41Å; Q555-L557 VanDerWaalsContact C-N 3.26Å; Q555-L557 PolarHBondContact O-N 3.3Å
556	Q	24.5	Very low	25.7	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	77%	0.767	S	S	*	*			trans	-61.3	92.9	162.7	-76.2	-178.1	-28.7	0	0	108	I554 S558	I554-Q556 PolarHBondContact O-N 3.45Å; Q556-S558 VanDerWaalsContact C-N 3.28Å; Q556-S558 PolarHBondContact O-N 2.65Å
557	L	24.8	Very low	25.7	Very low	150 Å²	150	155 Å²	155	79%	0.785	77%	0.773	S	S	*	*			trans	-65.2	91.3	165.5	-79.5	154.3	0	0	0	107.7	Q555 L559	Q555-L557 VanDerWaalsContact C-N 3.26Å; Q555-L557 PolarHBondContact O-N 3.3Å; L557-L559 VanDerWaalsContact C-N 3.31Å; L557-L559 PolarHBondContact O-N 2.9Å
558	S	23.4	Very low	25.6	Very low	105 Å²	105	154.3 Å²	154.3	73%	0.734	76%	0.764	S	S	*	*			trans	-66.6	92.8	169.6	59.1	0	0	0	0	108.5	Q556 N560	Q556-S558 VanDerWaalsContact C-N 3.28Å; Q556-S558 PolarHBondContact O-N 2.65Å; S558-N560 VanDerWaalsContact C-N 3.33Å; S558-N560 PolarHBondContact O-N 3.27Å
559	L	24.3	Very low	25.5	Very low	130 Å²	130	152.9 Å²	152.9	68%	0.681	76%	0.763	S	S	*	*			trans	-62.6	94.5	170.5	-82.3	151.3	0	0	0	109	L557 Y561	L557-L559 VanDerWaalsContact C-N 3.31Å; L557-L559 PolarHBondContact O-N 2.9Å; L559-Y561 HydrophobicContact CB-CD2 3.73Å; L559-Y561 HydrophobicContact CB-CE2 3.6Å; L559-Y561 HydrophobicContact CD1-CE2 4.12Å; L559-Y561 HydrophobicContact CD2-CE2 3.83Å; L559-Y561 HydrophobicContact CG-CE2 4.06Å; L559-Y561 PolarHBondContact O-N 2.89Å
560	N	23.8	Very low	25.4	Very low	143 Å²	143	152.8 Å²	152.8	77%	0.765	76%	0.755	S	S	*	*			trans	-74	74	175.7	-138.6	-3.1	0	0	0	108.5	S558 N562	S558-N560 VanDerWaalsContact C-N 3.33Å; S558-N560 PolarHBondContact O-N 3.27Å; N560-N562 PolarHBondContact O-N 3.02Å
561	Y	26.6	Very low	25.4	Very low	183 Å²	183	149.9 Å²	149.9	72%	0.718	75%	0.745	S	S	*	*			trans	-70.3	100.1	175.9	-83.6	-80.7	0	0	0	109.5	L559 K563	L559-Y561 HydrophobicContact CB-CD2 3.73Å; L559-Y561 HydrophobicContact CB-CE2 3.6Å; L559-Y561 HydrophobicContact CD1-CE2 4.12Å; L559-Y561 HydrophobicContact CD2-CE2 3.83Å; L559-Y561 HydrophobicContact CG-CE2 4.06Å; L559-Y561 PolarHBondContact O-N 2.89Å; Y561-K563 VanDerWaalsContact C-N 3.27Å; Y561-K563 PolarHBondContact O-N 2.92Å
562	N	24.6	Very low	25.4	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	74%	0.743	S	S	*	*			trans	-61.3	83	168.5	-76.2	-38.9	0	0	0	110.7	N560 K564	N560-N562 PolarHBondContact O-N 3.02Å; N562-K564 PolarHBondContact O-N 3.34Å
563	K	26.7	Very low	25.2	Very low	184 Å²	184	152.2 Å²	152.2	80%	0.8	74%	0.744	S	S	*	*			trans	-70.6	79.8	164.8	-84.1	-176.1	176.2	178.2	0	109.3	Y561 I565	Y561-K563 VanDerWaalsContact C-N 3.27Å; Y561-K563 PolarHBondContact O-N 2.92Å; K563-I565 VanDerWaalsContact C-N 3.32Å; K563-I565 HydrophobicContact CB-CG1 4.32Å; K563-I565 PolarHBondContact O-N 3.49Å; K563-I565 VanDerWaalsContact O-N 3.1Å
564	K	27.7	Very low	25.1	Very low	196 Å²	196	157.9 Å²	157.9	85%	0.852	75%	0.754	S	S	*	*			trans	-79.4	81.9	170.2	-151.1	177.3	-172.3	-179.2	0	107.8	N562 L566	N562-K564 PolarHBondContact O-N 3.34Å; K564-L566 PolarHBondContact O-N 3.07Å
565	I	28.1	Very low	25	Very low	100 Å²	100	158.2 Å²	158.2	51%	0.513	75%	0.752	S	S	.	*			trans	-76.5	108.2	-178.2	-58.3	175.9	0	0	0	108.7	K563 Y567	K563-I565 VanDerWaalsContact C-N 3.32Å; K563-I565 HydrophobicContact CB-CG1 4.32Å; K563-I565 PolarHBondContact O-N 3.49Å; K563-I565 VanDerWaalsContact O-N 3.1Å; I565-Y567 HydrophobicContact CB-CD2 4.37Å; I565-Y567 HydrophobicContact CB-CE2 3.99Å; I565-Y567 HydrophobicContact CG2-CD2 3.76Å; I565-Y567 HydrophobicContact CG2-CE1 4.42Å; I565-Y567 HydrophobicContact CG2-CE2 3.33Å; I565-Y567 HydrophobicContact CG2-CG 4.46Å; I565-Y567 PolarHBondContact O-N 3.21Å
566	L	25	Very low	24.9	Very low	141 Å²	141	160.9 Å²	160.9	74%	0.738	76%	0.757	S	S	*	*			trans	-65.6	98.9	170.4	-81	142.3	0	0	0	109.8	K564 E568	K564-L566 PolarHBondContact O-N 3.07Å; L566-E568 VanDerWaalsContact C-N 3.32Å
567	Y	25.6	Very low	24.9	Very low	189 Å²	189	161 Å²	161	74%	0.741	76%	0.755	S	S	*	*			trans	-96.9	60.6	162.1	-69.2	-80.9	0	0	0	109	I565	I565-Y567 HydrophobicContact CB-CD2 4.37Å; I565-Y567 HydrophobicContact CB-CE2 3.99Å; I565-Y567 HydrophobicContact CG2-CD2 3.76Å; I565-Y567 HydrophobicContact CG2-CE1 4.42Å; I565-Y567 HydrophobicContact CG2-CE2 3.33Å; I565-Y567 HydrophobicContact CG2-CG 4.46Å; I565-Y567 PolarHBondContact O-N 3.21Å
568	E	25.6	Very low	25.2	Very low	141 Å²	141	155.6 Å²	155.6	66%	0.659	74%	0.736	S	S	*	*			trans	-96.9	127.4	169.5	-78.7	-175.4	159.9	0	0	108.7	L566	L566-E568 VanDerWaalsContact C-N 3.32Å
569	N	25	Very low	25.6	Very low	141 Å²	141	155.6 Å²	155.6	75%	0.754	74%	0.736	S	S	*	*			trans	76.3	81.2	162	-49.5	-35.3	0	0	0	117.3
570	I	24.9	Very low	25.8	Very low	136 Å²	136	157.1 Å²	157.1	70%	0.697	75%	0.745	S	S	*	*			trans	-126.1	94	149.2	-48.2	-178.4	0	0	0	109.5	F572	I570-F572 HydrophobicContact CB-CE2 4.4Å; I570-F572 HydrophobicContact CG2-CD2 3.48Å; I570-F572 VanDerWaalsContact CG2-CD2 3.48Å; I570-F572 HydrophobicContact CG2-CE2 3.01Å; I570-F572 HydrophobicContact CG2-CG 4.44Å; I570-F572 HydrophobicContact CG2-CZ 3.59Å
571	P	25.3	Very low	26.1	Very low	102 Å²	102	158.6 Å²	158.6	66%	0.662	75%	0.747	S	S	*	*			trans	-80.2	127.2	174.3	30.7	-28.7	0	0	0	109.9
572	F	27.4	Very low	26.5	Very low	181 Å²	181	159.6 Å²	159.6	79%	0.794	78%	0.776	S	S	*	*			trans	-133.3	130.9	172.1	-75.9	-57.8	0	0	0	113.8	I570	I570-F572 HydrophobicContact CB-CE2 4.4Å; I570-F572 HydrophobicContact CG2-CD2 3.48Å; I570-F572 VanDerWaalsContact CG2-CD2 3.48Å; I570-F572 HydrophobicContact CG2-CE2 3.01Å; I570-F572 HydrophobicContact CG2-CG 4.44Å; I570-F572 HydrophobicContact CG2-CZ 3.59Å
573	Y	22.8	Very low	26.6	Very low	223 Å²	223	160.2 Å²	160.2	88%	0.875	78%	0.775	S	S	*	*			trans	-75.8	150.4	179.9	-71	-95.3	0	0	0	112.1
574	Y	21.7	Very low	26.6	Very low	231 Å²	231	158.9 Å²	158.9	91%	0.906	77%	0.774	S	S	*	*			trans	-73.8	138.9	178.2	-75.1	-96.5	0	0	0	111.7
575	Q	22.2	Very low	26.6	Very low	163 Å²	163	156.8 Å²	156.8	76%	0.762	77%	0.769	S	S	*	*			trans	-140.1	115.9	147.4	-160.4	165.4	19.3	0	0	108.8	F577	Q575-F577 HydrophobicContact CG-CE2 4.37Å
576	Y	23.5	Very low	26.5	Very low	212 Å²	212	160.2 Å²	160.2	83%	0.831	78%	0.784	S	S	*	*			trans	-84.9	113.8	-179.4	-171.7	-94.8	0	0	0	108.4	G578	Y576-G578 VanDerWaalsContact CD1-N 3.34Å; Y576-G578 PolarHBondContact O-N 3Å
577	F	25.2	Very low	26.6	Very low	180 Å²	180	161.4 Å²	161.4	79%	0.789	79%	0.787	S	S	*	*			trans	-93	83.4	165.5	-70.7	-81.6	0	0	0	107.6	Q575 S579	Q575-F577 HydrophobicContact CG-CE2 4.37Å; F577-S579 PolarHBondContact O-N 3.27Å
578	G	29.2	Very low	26.6	Very low	37 Å²	37	159.5 Å²	159.5	38%	0.381	79%	0.79	S	S	.	*			trans	-63.1	128.8	161.2	0	0	0	0	0	107.6	Y576 N580	Y576-G578 VanDerWaalsContact CD1-N 3.34Å; Y576-G578 PolarHBondContact O-N 3Å; G578-N580 PolarHBondContact O-N 3.36Å
579	S	32.4	Very low	26.7	Very low	106 Å²	106	160.9 Å²	160.9	74%	0.741	80%	0.8	S	S	*	*			trans	-49.8	120.7	177.9	41	0	0	0	0	111	F577 E581	F577-S579 PolarHBondContact O-N 3.27Å; S579-E581 PolarHBondContact O-N 3.17Å
580	N	29.5	Very low	26.9	Very low	162 Å²	162	162.4 Å²	162.4	87%	0.866	80%	0.803	S	S	*	*			trans	-58.6	98.9	163.1	-65.1	-23.7	0	0	0	107.9	G578	G578-N580 PolarHBondContact O-N 3.36Å
581	E	29.2	Very low	27	Very low	174 Å²	174	164.6 Å²	164.6	81%	0.813	81%	0.812	S	S	*	*			trans	-91.6	129.8	153.8	-77.6	-176.7	161.9	0	0	106.7	S579	S579-E581 PolarHBondContact O-N 3.17Å
582	P	36	Very low	27.2	Very low	204 Å²	204	170.3 Å²	170.3	100%	1.325	83%	0.826	S	S	*	*			trans	-68	0	-170.7	27.8	-35	0	0	0	114.5

Retrieved 582 of 582 residues in 218.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).