A0A5K4FD19_SCHMA Loading...

Pepsin A

AlphaFold DB , UniProt , Accession A0A5K4FD19, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 255 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.3	Very low	40.5	Very low	229 Å²	229	140.2 Å²	140.2	100%	1.128	73%	0.727	S	S	*	*				0	93.8	0	-170.3	176	79.2	0	0	107	L3	M1-L3 PolarHBondContact O-N 3.46Å
2	I	39	Very low	41.1	Very low	144 Å²	144	147.3 Å²	147.3	74%	0.738	74%	0.74	S	S	*	*			trans	-87.9	108	-179.2	-65.7	171.5	0	0	0	106.5	F4	I2-F4 HydrophobicContact CG2-CD2 4.31Å; I2-F4 HydrophobicContact CG2-CE2 4Å; I2-F4 HydrophobicContact CG2-CZ 4.27Å; I2-F4 PolarHBondContact O-N 3.25Å
3	L	34	Very low	42.1	Very low	135 Å²	135	145 Å²	145	71%	0.707	73%	0.73	S	S	*	*			trans	-78.4	107.6	175.8	-174	74.8	0	0	0	107.9	M1 I5	M1-L3 PolarHBondContact O-N 3.46Å; L3-I5 HydrophobicContact CD2-CD1 4.45Å; L3-I5 HydrophobicContact CD2-CG1 4.12Å; L3-I5 HydrophobicContact CG-CG1 4.32Å; L3-I5 PolarHBondContact O-N 3.4Å
4	F	36.6	Very low	43.7	Very low	173 Å²	173	146.4 Å²	146.4	76%	0.759	74%	0.74	S	S	*	*			trans	-78.1	101.2	169.3	-75	-86.8	0	0	0	108.6	I2 I6	I2-F4 HydrophobicContact CG2-CD2 4.31Å; I2-F4 HydrophobicContact CG2-CE2 4Å; I2-F4 HydrophobicContact CG2-CZ 4.27Å; I2-F4 PolarHBondContact O-N 3.25Å; F4-I6 PolarHBondContact O-N 3.16Å; F4-I6 VanDerWaalsContact O-N 3.16Å
5	I	36.1	Very low	45.7	Very low	129 Å²	129	138.3 Å²	138.3	66%	0.662	71%	0.708	S	S	*	*			trans	-78.4	93.7	164.6	-55.5	178.4	0	0	0	106.1	L3 V7	L3-I5 HydrophobicContact CD2-CD1 4.45Å; L3-I5 HydrophobicContact CD2-CG1 4.12Å; L3-I5 HydrophobicContact CG-CG1 4.32Å; L3-I5 PolarHBondContact O-N 3.4Å; I5-V7 HydrophobicContact CG2-CG2 3.61Å; I5-V7 PolarHBondContact O-N 2.56Å
6	I	38.9	Very low	48.2	Very low	147 Å²	147	134.2 Å²	134.2	75%	0.754	69%	0.685	S	S	*	*			trans	-72.3	88.1	163.8	-57.8	175.8	0	0	0	105.3	F4 S8	F4-I6 PolarHBondContact O-N 3.16Å; F4-I6 VanDerWaalsContact O-N 3.16Å; I6-S8 PolarHBondContact O-N 2.81Å
7	V	39.3	Very low	50.8	Low	98 Å²	98	131.4 Å²	131.4	59%	0.594	67%	0.671	S	S	*	*			trans	-67.7	91.3	159.4	-175.6	0	0	0	0	104	I5 F9	I5-V7 HydrophobicContact CG2-CG2 3.61Å; I5-V7 PolarHBondContact O-N 2.56Å; V7-F9 PolarHBondContact O-N 3.37Å
8	S	41.4	Very low	53.2	Low	85 Å²	85	124.3 Å²	124.3	59%	0.594	64%	0.635	S	S	*	*			trans	-58	96.9	161	55.4	0	0	0	0	104.8	I6 L10	I6-S8 PolarHBondContact O-N 2.81Å; S8-L10 PolarHBondContact O-N 2.85Å
9	F	43.8	Very low	55.4	Low	180 Å²	180	122.2 Å²	122.2	79%	0.789	62%	0.621	S	S	*	*			trans	-50.7	98.9	149.6	-76	-94.1	0	0	0	103	V7 P11	V7-F9 PolarHBondContact O-N 3.37Å; F9-P11 WeakPolarHBondContact O-CD 3.46Å
10	L	41	Very low	57.3	Low	136 Å²	136	116.2 Å²	116.2	71%	0.712	59%	0.59	S	S	*	*			trans	-52	109.7	150.9	-98	101.5	0	0	0	101	S8 Y12	S8-L10 PolarHBondContact O-N 2.85Å; L10-Y12 PolarHBondContact O-N 3.37Å
11	P	46.2	Very low	59	Low	86 Å²	86	113.2 Å²	113.2	56%	0.558	58%	0.579	S	S	*	*			trans	-51.9	124.4	166.9	22.9	-25.6	0	0	0	102.2	F9 L13	F9-P11 WeakPolarHBondContact O-CD 3.46Å; P11-L13 HydrophobicContact CG-CD2 4.07Å; P11-L13 HydrophobicContact CG-CG 4.26Å; P11-L13 PolarHBondContact O-N 3.45Å
12	Y	47.5	Very low	61	Low	225 Å²	225	102.4 Å²	102.4	88%	0.882	53%	0.525	S	S	*	.			trans	-53	94.1	159.4	-73.6	-93.1	0	0	0	102.5	L10 L14	L10-Y12 PolarHBondContact O-N 3.37Å; Y12-L14 PolarHBondContact O-N 3.4Å
13	L	54.6	Low	63.3	Low	118 Å²	118	98 Å²	98	62%	0.618	50%	0.501	S	S	*	.			trans	-63.7	102.4	-175.5	-77.9	162.3	0	0	0	100.8	P11 G15 N203	P11-L13 HydrophobicContact CG-CD2 4.07Å; P11-L13 HydrophobicContact CG-CG 4.26Å; P11-L13 PolarHBondContact O-N 3.45Å; L13-G15 PolarHBondContact O-N 3.5Å; L13-G15 VanDerWaalsContact O-N 3.11Å; L13-N203 PolarHBondContact O-ND2 3.21Å
14	L	63.9	Low	65.6	Low	164 Å²	164	94.5 Å²	94.5	86%	0.859	49%	0.487	S	S	*	.			trans	-43.7	126.4	171.8	-72	167.3	0	0	0	105.3	Y12 E16	Y12-L14 PolarHBondContact O-N 3.4Å; L14-E16 PolarHBondContact O-N 3.44Å
15	G	74.1	Confident	67.6	Low	26 Å²	26	87.4 Å²	87.4	27%	0.268	46%	0.457	S	S	.	.			trans	-48.2	136.4	-177.8	0	0	0	0	0	109.2	L13 I17 N203	L13-G15 PolarHBondContact O-N 3.5Å; L13-G15 VanDerWaalsContact O-N 3.11Å; G15-I17 PolarHBondContact O-N 3.16Å; G15-N203 CarbonylContact C-O 3.34Å; G15-N203 VanDerWaalsContact CA-O 3.28Å; G15-N203 WeakPolarHBondContact CA-O 3.45Å
16	E	85.8	Confident	69.3	Low	72 Å²	72	88.3 Å²	88.3	34%	0.336	46%	0.458	S	S	.	.			trans	-58	124.1	175.6	-170.7	174.1	174.5	0	0	107.6	L14 V18 S150 L151 V202 N203 M204	L14-E16 PolarHBondContact O-N 3.44Å; E16-V18 HydrophobicContact CG-CG2 4.02Å; E16-S150 WeakPolarHBondContact OE1-CB 3.28Å; E16-S150 PolarHBondContact OE1-OG 3.46Å; E16-L151 HydrophobicContact CG-CD2 4.46Å; E16-L151 WeakPolarHBondContact OE1-CD2 3.39Å; E16-V202 HydrophobicContact CB-CG1 4.48Å; E16-N203 PolarHBondContact N-O 3.12Å; E16-M204 HydrophobicContact CB-CE 4.41Å; E16-M204 HydrophobicContact CG-CE 4.5Å; E16-M204 WeakPolarHBondContact O-CE 3.37Å; E16-M204 WeakPolarHBondContact O-CG 3.5Å
17	I	91.6	Very high	70.8	Confident	87 Å²	87	89 Å²	89	45%	0.446	45%	0.452	S	S	.	.			trans	-111.7	126.3	174.6	-68.2	176.9	0	0	0	107	G15 K19 V225 L226	G15-I17 PolarHBondContact O-N 3.16Å; I17-K19 HydrophobicContact CG2-CG 4.41Å; I17-V225 HydrophobicContact CG2-CG1 3.44Å; I17-V225 VanDerWaalsContact CG2-CG1 3.44Å; I17-L226 WeakPolarHBondContact CA-O 3.21Å
18	V	94.3	Very high	72.3	Confident	4 Å²	4	84.9 Å²	84.9	2%	0.024	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.5	179.5	178.2	0	0	0	0	110	E16 I20 I148 N149 S150 L151 M204 V225 L226	E16-V18 HydrophobicContact CG-CG2 4.02Å; V18-I20 HydrophobicContact CG1-CG1 4.47Å; V18-I148 HydrophobicContact CG1-CG2 4.48Å; V18-N149 HydrophobicContact CG1-CB 3.92Å; V18-S150 WeakPolarHBondContact CG2-OG 3.48Å; V18-L151 HydrophobicContact CB-CD1 3.96Å; V18-L151 HydrophobicContact CB-CG 4.18Å; V18-L151 HydrophobicContact CG1-CD1 4.14Å; V18-L151 HydrophobicContact CG1-CG 4.25Å; V18-L151 HydrophobicContact CG2-CD1 3.91Å; V18-L151 HydrophobicContact CG2-CD2 3.68Å; V18-L151 HydrophobicContact CG2-CG 3.65Å; V18-M204 HydrophobicContact CB-CE 4.18Å; V18-M204 HydrophobicContact CG2-CE 3.91Å; V18-V225 WeakPolarHBondContact O-CA 3.27Å; V18-L226 HydrophobicContact CB-CB 4.43Å; V18-L226 PolarHBondContact N-O 3.09Å; V18-L226 PolarHBondContact O-N 2.92Å
19	K	94.7	Very high	73.9	Confident	83 Å²	83	85.9 Å²	85.9	36%	0.361	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.2	178.8	-61.3	-178.5	177	-164.5	0	109.8	I17 N149 E223 M224 V225 N230	I17-K19 HydrophobicContact CG2-CG 4.41Å; K19-N149 PolarHBondContact O-ND2 3.39Å; K19-E223 HydrophobicContact CB-CG 4.24Å; K19-E223 WeakPolarHBondContact CB-OE2 3.44Å; K19-E223 WeakPolarHBondContact CD-OE2 3.41Å; K19-M224 CarbonylContact C-O 3.5Å; K19-V225 HydrophobicContact CG-CG2 4.35Å; K19-N230 PolarHBondContact NZ-ND2 2.94Å; K19-N230 PolarHBondContact NZ-OD1 2.88Å
20	I	94.3	Very high	75.2	Confident	2 Å²	2	80.3 Å²	80.3	1%	0.01	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.9	-179	-50.9	165	0	0	0	106.8	V18 L22 F86 I148 E223 M224 L226	V18-I20 HydrophobicContact CG1-CG1 4.47Å; I20-L22 PolarHBondContact O-N 2.91Å; I20-F86 HydrophobicContact CD1-CE1 4.31Å; I20-F86 HydrophobicContact CD1-CE2 4.39Å; I20-F86 HydrophobicContact CD1-CZ 3.77Å; I20-F86 HydrophobicContact CG2-CE2 4.23Å; I20-F86 HydrophobicContact CG2-CZ 4.32Å; I20-I148 HydrophobicContact CD1-CG2 3.36Å; I20-I148 HydrophobicContact CG1-CG2 3.67Å; I20-E223 WeakPolarHBondContact O-CA 3.39Å; I20-M224 HydrophobicContact CB-CB 4.31Å; I20-M224 HydrophobicContact CD1-CG 4.48Å; I20-M224 HydrophobicContact CD1-SD 3.91Å; I20-M224 PolarHBondContact N-O 3.24Å; I20-M224 PolarHBondContact O-N 2.82Å; I20-L226 HydrophobicContact CD1-CD1 4.09Å; I20-L226 HydrophobicContact CD1-CG 4.34Å
21	P	92.8	Very high	76.6	Confident	54 Å²	54	74.2 Å²	74.2	35%	0.351	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	135.5	174.9	27.1	-33.1	0	0	0	109.3	I220	P21-I220 HydrophobicContact CB-CG2 4.38Å
22	L	91.5	Very high	77.8	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.01	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.3	177.8	-64.8	-178.3	0	0	0	109.8	I20 Y69 Y70 F86 F210 L212 G221 G222 M224	I20-L22 PolarHBondContact O-N 2.91Å; L22-Y69 HydrophobicContact CB-CD1 4.31Å; L22-Y70 WeakPolarHBondContact CA-O 3.36Å; L22-F86 HydrophobicContact CD2-CD2 3.92Å; L22-F86 HydrophobicContact CD2-CE2 3.95Å; L22-F210 HydrophobicContact CD1-CD1 3.85Å; L22-F210 HydrophobicContact CD1-CE1 4.25Å; L22-L212 HydrophobicContact CD1-CD2 4.09Å; L22-G221 PolarHBondContact O-N 3.04Å; L22-G222 PolarHBondContact N-O 2.97Å; L22-G222 PolarHBondContact O-N 3.33Å; L22-G222 VanDerWaalsContact O-N 3.09Å; L22-M224 HydrophobicContact CD1-CB 4.06Å; L22-M224 HydrophobicContact CD2-CB 4.13Å; L22-M224 HydrophobicContact CG-CB 4.19Å
23	H	87	Confident	79.1	Confident	51 Å²	51	63.6 Å²	63.6	24%	0.236	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.2	178.8	-60.7	-75.6	0	0	0	109.5	Y69 Y70 P219	H23-Y69 CarbonylContact O-C 3.59Å; H23-Y69 VanDerWaalsContact O-CA 3.26Å; H23-Y69 WeakPolarHBondContact O-CA 3.44Å; H23-Y70 HydrophobicContact CB-CD1 4.09Å; H23-Y70 HydrophobicContact CB-CD2 4.5Å; H23-Y70 HydrophobicContact CB-CE1 3.56Å; H23-Y70 HydrophobicContact CB-CE2 4.02Å; H23-Y70 PolarHBondContact N-O 2.78Å; H23-Y70 VanDerWaalsContact O-CD1 3.31Å; H23-Y70 WeakPolarHBondContact O-CD1 3.47Å; H23-Y70 PolarHBondContact O-N 2.9Å; H23-P219 PolarHBondContact ND1-O 3.07Å; H23-P219 VanDerWaalsContact ND1-O 3.13Å
24	P	82.4	Confident	79.9	Confident	62 Å²	62	60.5 Å²	60.5	40%	0.403	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	139.4	176.8	29.9	-29.7	0	0	0	108.9	Y69	P24-Y69 HydrophobicContact CB-CD1 4.13Å; P24-Y69 HydrophobicContact CB-CE1 3.94Å
25	L	77.7	Confident	80.4	Confident	25 Å²	25	55 Å²	55	13%	0.131	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-74.3	151.6	165.8	-71.7	-178.1	0	0	0	110.3	R27 Q68 Y70 L85 N172 Y174	L25-R27 PolarHBondContact O-N 3.14Å; L25-Q68 HydrophobicContact CB-CB 4.26Å; L25-Q68 HydrophobicContact CD1-CB 3.67Å; L25-Q68 HydrophobicContact CG-CB 4.19Å; L25-Q68 PolarHBondContact N-O 3.03Å; L25-Y70 HydrophobicContact CD2-CD1 3.32Å; L25-Y70 HydrophobicContact CD2-CE1 3.67Å; L25-Y70 HydrophobicContact CD2-CG 4.33Å; L25-Y70 HydrophobicContact CG-CD1 3.88Å; L25-L85 HydrophobicContact CD1-CD2 4.1Å; L25-N172 HydrophobicContact CD1-CB 4.35Å; L25-Y174 HydrophobicContact CD1-CD1 3.65Å; L25-Y174 HydrophobicContact CD1-CE1 4.38Å; L25-Y174 HydrophobicContact CD1-CG 4.49Å
26	E	72.8	Confident	80.3	Confident	147 Å²	147	55.7 Å²	55.7	69%	0.687	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-60.2	133.1	175.8	-170.7	173.9	-175.6	0	0	109.8	S28	E26-S28 PolarHBondContact O-N 2.57Å
27	R	69.4	Low	79.7	Confident	163 Å²	163	54.7 Å²	54.7	62%	0.615	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-59.1	130.1	-179.3	178.7	177.8	166.1	155.7	0.1	110	L25 D29	L25-R27 PolarHBondContact O-N 3.14Å; R27-D29 IonicContact CZ-OD1 2.92Å; R27-D29 VanDerWaalsContact CZ-OD1 3.31Å; R27-D29 IonicContact NE-OD1 3.76Å; R27-D29 PolarHBondContact NE-OD1 3.09Å; R27-D29 IonicContact NH2-OD1 3.49Å; R27-D29 PolarHBondContact NH2-OD1 2.84Å
28	S	72.3	Confident	78.5	Confident	11 Å²	11	52.3 Å²	52.3	8%	0.077	28%	0.275	C	S	.	.			trans	-119.6	106.2	174.4	179.2	0	0	0	0	109.2	E26 S30 L31 L32 T171	E26-S28 PolarHBondContact O-N 2.57Å; S28-S30 PolarHBondContact O-N 3.09Å; S28-S30 PolarHBondContact OG-OG 3.2Å; S28-L31 PolarHBondContact O-N 2.8Å; S28-L31 PolarHBondContact OG-N 3.48Å; S28-L32 WeakPolarHBondContact O-CB 3.38Å; S28-L32 PolarHBondContact O-N 2.85Å; S28-T171 VanDerWaalsContact CB-OG1 3.23Å; S28-T171 WeakPolarHBondContact CB-OG1 3.3Å; S28-T171 PolarHBondContact OG-OG1 3.26Å; S28-T171 VanDerWaalsContact OG-OG1 3.12Å
29	D	73.3	Confident	77.2	Confident	105 Å²	105	55.3 Å²	55.3	56%	0.561	29%	0.288	S	S	*	.	H	α-helix	trans	-63.2	-29.1	179.9	-73.5	-32.8	0	0	0	111.9	R27 A33	R27-D29 IonicContact CZ-OD1 2.92Å; R27-D29 VanDerWaalsContact CZ-OD1 3.31Å; R27-D29 IonicContact NE-OD1 3.76Å; R27-D29 PolarHBondContact NE-OD1 3.09Å; R27-D29 IonicContact NH2-OD1 3.49Å; R27-D29 PolarHBondContact NH2-OD1 2.84Å; D29-A33 VanDerWaalsContact O-CB 3.27Å; D29-A33 WeakPolarHBondContact O-CB 3.42Å; D29-A33 PolarHBondContact O-N 3.48Å
30	S	71.3	Confident	75.9	Confident	64 Å²	64	56 Å²	56	45%	0.448	29%	0.294	S	S	.	.	H	α-helix	trans	-68.3	-44.7	174.2	66.6	0	0	0	0	111.7	S28 L32 A33 H34 D168	S28-S30 PolarHBondContact O-N 3.09Å; S28-S30 PolarHBondContact OG-OG 3.2Å; S30-L32 VanDerWaalsContact C-N 3.35Å; S30-A33 PolarHBondContact O-N 3.38Å; S30-H34 WeakPolarHBondContact O-CB 3.46Å; S30-H34 PolarHBondContact O-N 3.03Å; S30-D168 WeakPolarHBondContact CB-OD1 3.49Å; S30-D168 PolarHBondContact OG-OD1 3.12Å
31	L	71.1	Confident	74.2	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-46.5	175.6	-168.1	84.3	0	0	0	110.2	S28 A33 H34 Y35 F67 D168	S28-L31 PolarHBondContact O-N 2.8Å; S28-L31 PolarHBondContact OG-N 3.48Å; L31-A33 PolarHBondContact O-N 3.21Å; L31-H34 WeakPolarHBondContact O-CB 3.39Å; L31-H34 PolarHBondContact O-N 3.11Å; L31-H34 VanDerWaalsContact O-N 3.17Å; L31-Y35 HydrophobicContact CD1-CD2 4.21Å; L31-Y35 HydrophobicContact CD1-CE2 3.7Å; L31-Y35 HydrophobicContact CD2-CE2 4.14Å; L31-Y35 HydrophobicContact CG-CD2 3.87Å; L31-Y35 HydrophobicContact CG-CE2 3.69Å; L31-Y35 VanDerWaalsContact O-CD2 3.27Å; L31-Y35 WeakPolarHBondContact O-CD2 3.42Å; L31-Y35 PolarHBondContact O-N 2.9Å; L31-F67 HydrophobicContact CD2-CD1 3.69Å; L31-F67 HydrophobicContact CD2-CE1 4.18Å; L31-F67 HydrophobicContact CG-CD1 4.43Å; L31-F67 HydrophobicContact CG-CE1 4.48Å; L31-D168 HydrophobicContact CB-CB 4.29Å; L31-D168 HydrophobicContact CD1-CB 3.56Å
32	L	71.8	Confident	72.5	Confident	31 Å²	31	62.8 Å²	62.8	16%	0.162	34%	0.34	C	S	.	.	H	α-helix	trans	-57.4	-48.9	177.1	169.7	56.1	0	0	0	111.1	S28 S30 H34 Y35 T36 F64 F67	S28-L32 WeakPolarHBondContact O-CB 3.38Å; S28-L32 PolarHBondContact O-N 2.85Å; S30-L32 VanDerWaalsContact C-N 3.35Å; L32-H34 VanDerWaalsContact C-N 3.33Å; L32-H34 PolarHBondContact O-N 3.01Å; L32-Y35 PolarHBondContact O-N 3.34Å; L32-T36 VanDerWaalsContact O-CB 3.3Å; L32-T36 WeakPolarHBondContact O-CB 3.46Å; L32-T36 PolarHBondContact O-N 3.23Å; L32-T36 PolarHBondContact O-OG1 2.79Å; L32-F64 HydrophobicContact CD1-CB 3.63Å; L32-F64 HydrophobicContact CD1-CD1 3.51Å; L32-F64 HydrophobicContact CD1-CG 3.99Å; L32-F67 HydrophobicContact CB-CE2 4.46Å; L32-F67 HydrophobicContact CD1-CD2 4.09Å; L32-F67 HydrophobicContact CD1-CE2 3.49Å; L32-F67 VanDerWaalsContact CD1-CE2 3.49Å; L32-F67 HydrophobicContact CD1-CZ 4.34Å
33	A	73.4	Confident	70.7	Confident	58 Å²	58	67 Å²	67	48%	0.479	36%	0.358	S	S	.	.	H	α-helix	trans	-62.8	-39.6	176.7	0	0	0	0	0	112.1	D29 S30 L31 T36 S37	D29-A33 VanDerWaalsContact O-CB 3.27Å; D29-A33 WeakPolarHBondContact O-CB 3.42Å; D29-A33 PolarHBondContact O-N 3.48Å; S30-A33 PolarHBondContact O-N 3.38Å; L31-A33 PolarHBondContact O-N 3.21Å; A33-T36 PolarHBondContact O-N 3.33Å; A33-S37 WeakPolarHBondContact O-CB 3.12Å; A33-S37 PolarHBondContact O-N 2.71Å
34	H	73	Confident	68.9	Low	52 Å²	52	68.3 Å²	68.3	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-53.6	177.8	-173.9	100.6	0	0	0	111.1	S30 L31 L32 T36 S37 Y38	S30-H34 WeakPolarHBondContact O-CB 3.46Å; S30-H34 PolarHBondContact O-N 3.03Å; L31-H34 WeakPolarHBondContact O-CB 3.39Å; L31-H34 PolarHBondContact O-N 3.11Å; L31-H34 VanDerWaalsContact O-N 3.17Å; L32-H34 VanDerWaalsContact C-N 3.33Å; L32-H34 PolarHBondContact O-N 3.01Å; H34-T36 PolarHBondContact O-N 3.33Å; H34-S37 PolarHBondContact O-N 2.86Å; H34-S37 PolarHBondContact O-OG 2.93Å; H34-Y38 WeakPolarHBondContact O-CB 3.16Å; H34-Y38 PolarHBondContact O-N 2.85Å
35	Y	73	Confident	67.1	Low	49 Å²	49	74.4 Å²	74.4	19%	0.192	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-44.2	177.7	-86.4	-114.4	0	0	0	112	L31 L32 S37 Y38 F39 F67 Q68 L133	L31-Y35 HydrophobicContact CD1-CD2 4.21Å; L31-Y35 HydrophobicContact CD1-CE2 3.7Å; L31-Y35 HydrophobicContact CD2-CE2 4.14Å; L31-Y35 HydrophobicContact CG-CD2 3.87Å; L31-Y35 HydrophobicContact CG-CE2 3.69Å; L31-Y35 VanDerWaalsContact O-CD2 3.27Å; L31-Y35 WeakPolarHBondContact O-CD2 3.42Å; L31-Y35 PolarHBondContact O-N 2.9Å; L32-Y35 PolarHBondContact O-N 3.34Å; Y35-S37 VanDerWaalsContact C-N 3.26Å; Y35-S37 PolarHBondContact O-N 2.77Å; Y35-Y38 PolarHBondContact O-N 2.53Å; Y35-Y38 VanDerWaalsContact O-N 3.08Å; Y35-F39 HydrophobicContact CD1-CD2 4.1Å; Y35-F39 AromaticContact CD1-CE2 3.47Å; Y35-F39 HydrophobicContact CD1-CE2 3.47Å; Y35-F39 VanDerWaalsContact CD1-CE2 3.47Å; Y35-F39 HydrophobicContact CE1-CE2 4.09Å; Y35-F39 HydrophobicContact CG-CE2 4.23Å; Y35-F39 WeakPolarHBondContact O-CD2 3.04Å; Y35-F39 PolarHBondContact O-N 2.85Å; Y35-F67 AromaticContact CD1-CE1 3.34Å; Y35-F67 HydrophobicContact CD1-CE1 3.34Å; Y35-F67 AromaticContact CD1-CZ 3.64Å; Y35-F67 HydrophobicContact CD1-CZ 3.64Å; Y35-F67 HydrophobicContact CD2-CD1 4.5Å; Y35-F67 AromaticContact CD2-CE1 3.46Å; Y35-F67 HydrophobicContact CD2-CE1 3.46Å; Y35-F67 VanDerWaalsContact CD2-CE1 3.46Å; Y35-F67 HydrophobicContact CD2-CZ 4.02Å; Y35-F67 AromaticContact CE1-CE1 3.73Å; Y35-F67 HydrophobicContact CE1-CE1 3.73Å; Y35-F67 HydrophobicContact CE1-CZ 4.45Å; Y35-F67 AromaticContact CE2-CE1 3.78Å; Y35-F67 HydrophobicContact CE2-CE1 3.78Å; Y35-F67 AromaticContact CG-CE1 3.23Å; Y35-F67 HydrophobicContact CG-CE1 3.23Å; Y35-F67 AromaticContact CG-CZ 3.42Å; Y35-F67 HydrophobicContact CG-CZ 3.42Å; Y35-F67 VanDerWaalsContact CG-CZ 3.42Å; Y35-F67 AromaticContact CZ-CE1 3.92Å; Y35-Q68 PolarHBondContact OH-NE2 3.18Å; Y35-L133 HydrophobicContact CD1-CD1 4.19Å; Y35-L133 HydrophobicContact CD1-CD2 4.47Å; Y35-L133 HydrophobicContact CD2-CD1 3.57Å; Y35-L133 HydrophobicContact CE1-CD1 3.86Å; Y35-L133 HydrophobicContact CE1-CD2 4.38Å; Y35-L133 HydrophobicContact CE2-CD1 3.25Å; Y35-L133 HydrophobicContact CG-CD1 4.03Å
36	T	71.9	Confident	65.5	Low	40 Å²	40	77.8 Å²	77.8	25%	0.245	41%	0.407	C	S	.	.	H	α-helix	trans	-54.8	-47.4	174.8	-56	0	0	0	0	109.9	L32 A33 H34 Y38 M40 F64	L32-T36 VanDerWaalsContact O-CB 3.3Å; L32-T36 WeakPolarHBondContact O-CB 3.46Å; L32-T36 PolarHBondContact O-N 3.23Å; L32-T36 PolarHBondContact O-OG1 2.79Å; A33-T36 PolarHBondContact O-N 3.33Å; H34-T36 PolarHBondContact O-N 3.33Å; T36-Y38 VanDerWaalsContact C-N 3.34Å; T36-Y38 PolarHBondContact O-N 2.79Å; T36-M40 HydrophobicContact CG2-CE 3.85Å; T36-M40 WeakPolarHBondContact O-CB 3.3Å; T36-M40 WeakPolarHBondContact O-CG 3.44Å; T36-M40 PolarHBondContact O-N 2.75Å; T36-M40 VanDerWaalsContact O-N 3.15Å; T36-F64 HydrophobicContact CG2-CE1 4.41Å; T36-F64 WeakPolarHBondContact OG1-CD1 3.13Å; T36-F64 VanDerWaalsContact OG1-CE1 3.29Å; T36-F64 WeakPolarHBondContact OG1-CE1 3.13Å
37	S	73.2	Confident	64	Low	51 Å²	51	75.7 Å²	75.7	36%	0.357	40%	0.398	S	S	.	.	H	α-helix	trans	-65.9	-34.4	178.1	82.7	0	0	0	0	113.4	A33 H34 Y35	A33-S37 WeakPolarHBondContact O-CB 3.12Å; A33-S37 PolarHBondContact O-N 2.71Å; H34-S37 PolarHBondContact O-N 2.86Å; H34-S37 PolarHBondContact O-OG 2.93Å; Y35-S37 VanDerWaalsContact C-N 3.26Å; Y35-S37 PolarHBondContact O-N 2.77Å
38	Y	67.5	Low	62.5	Low	38 Å²	38	73.9 Å²	73.9	15%	0.149	39%	0.393	C	S	.	.	H	α-helix	trans	-71.8	-44.6	-177.5	-172.5	-92.1	0	0	0	111.8	H34 Y35 T36 M47 L133 D134	H34-Y38 WeakPolarHBondContact O-CB 3.16Å; H34-Y38 PolarHBondContact O-N 2.85Å; Y35-Y38 PolarHBondContact O-N 2.53Å; Y35-Y38 VanDerWaalsContact O-N 3.08Å; T36-Y38 VanDerWaalsContact C-N 3.34Å; T36-Y38 PolarHBondContact O-N 2.79Å; Y38-M47 HydrophobicContact CE1-CE 4.29Å; Y38-M47 WeakPolarHBondContact OH-CE 3.47Å; Y38-L133 HydrophobicContact CD1-CD2 3.29Å; Y38-L133 HydrophobicContact CD2-CB 4.01Å; Y38-L133 HydrophobicContact CD2-CD2 4.19Å; Y38-L133 HydrophobicContact CE1-CD2 3.55Å; Y38-L133 HydrophobicContact CE2-CB 4.02Å; Y38-L133 HydrophobicContact CE2-CD2 4.41Å; Y38-L133 WeakPolarHBondContact CE2-O 3.16Å; Y38-L133 HydrophobicContact CG-CB 4.27Å; Y38-L133 HydrophobicContact CG-CD2 3.62Å; Y38-L133 VanDerWaalsContact CZ-CA 3.43Å; Y38-L133 PolarHBondContact OH-O 2.85Å; Y38-D134 VanDerWaalsContact CE2-OD1 3.3Å; Y38-D134 WeakPolarHBondContact CE2-OD1 3.5Å
39	F	67.7	Low	60.6	Low	66 Å²	66	81.5 Å²	81.5	29%	0.289	43%	0.427	S	S	.	.	H	α-helix	trans	-86.6	-5.2	-177.3	-67.6	-67.4	0	0	0	114	Y35 I62 L133	Y35-F39 HydrophobicContact CD1-CD2 4.1Å; Y35-F39 AromaticContact CD1-CE2 3.47Å; Y35-F39 HydrophobicContact CD1-CE2 3.47Å; Y35-F39 VanDerWaalsContact CD1-CE2 3.47Å; Y35-F39 HydrophobicContact CE1-CE2 4.09Å; Y35-F39 HydrophobicContact CG-CE2 4.23Å; Y35-F39 WeakPolarHBondContact O-CD2 3.04Å; Y35-F39 PolarHBondContact O-N 2.85Å; F39-I62 HydrophobicContact CB-CD1 3.21Å; F39-I62 HydrophobicContact CD1-CD1 4.1Å; F39-I62 HydrophobicContact CD2-CD1 3.83Å; F39-I62 HydrophobicContact CG-CD1 3.44Å; F39-I62 VanDerWaalsContact CG-CD1 3.44Å; F39-L133 HydrophobicContact CE2-CD2 3.65Å; F39-L133 HydrophobicContact CZ-CD2 3.65Å
40	M	66.7	Low	58.7	Low	99 Å²	99	84.8 Å²	84.8	49%	0.488	43%	0.431	S	S	.	.	S	Bend	trans	-61.6	142	172.3	-82.8	-87.6	170.3	0	0	111.8	T36 S42 K43	T36-M40 HydrophobicContact CG2-CE 3.85Å; T36-M40 WeakPolarHBondContact O-CB 3.3Å; T36-M40 WeakPolarHBondContact O-CG 3.44Å; T36-M40 PolarHBondContact O-N 2.75Å; T36-M40 VanDerWaalsContact O-N 3.15Å; M40-S42 PolarHBondContact O-N 3.4Å; M40-K43 PolarHBondContact O-N 2.6Å
41	P	58.2	Low	57.2	Low	93 Å²	93	88.9 Å²	88.9	60%	0.604	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-56.6	-25.2	-170.4	-26.3	32.7	0	0	0	116	K43 R44	P41-K43 PolarHBondContact O-N 2.56Å; P41-R44 WeakPolarHBondContact O-CB 3.41Å; P41-R44 PolarHBondContact O-N 2.81Å
42	S	56.5	Low	55.8	Low	104 Å²	104	96 Å²	96	73%	0.727	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-66.7	-33.8	-176.4	57.4	0	0	0	0	113.2	M40 R44	M40-S42 PolarHBondContact O-N 3.4Å; S42-R44 VanDerWaalsContact C-N 3.34Å
43	K	53.9	Low	54.4	Low	92 Å²	92	105 Å²	105	40%	0.4	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-80.9	-13.1	175.7	-76.1	-168	176	-175.4	0	113.4	M40 P41 K45 S46 D134	M40-K43 PolarHBondContact O-N 2.6Å; P41-K43 PolarHBondContact O-N 2.56Å; K43-K45 PolarHBondContact O-N 2.96Å; K43-S46 PolarHBondContact O-OG 3.45Å; K43-D134 IonicContact NZ-OD2 2.83Å; K43-D134 PolarHBondContact NZ-OD2 2.85Å
44	R	49.2	Very low	53	Low	77 Å²	77	109 Å²	109	29%	0.291	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-70.2	-26	-172.2	-164.8	179	166	165.6	5.2	114.8	P41 S42 S46 M47 T57 P58	P41-R44 WeakPolarHBondContact O-CB 3.41Å; P41-R44 PolarHBondContact O-N 2.81Å; S42-R44 VanDerWaalsContact C-N 3.34Å; R44-S46 PolarHBondContact O-N 3.34Å; R44-S46 VanDerWaalsContact O-N 3.07Å; R44-M47 PolarHBondContact O-N 3.19Å; R44-T57 VanDerWaalsContact NH2-CB 3.32Å; R44-P58 VanDerWaalsContact CZ-O 3.24Å; R44-P58 PolarHBondContact NH1-O 2.8Å; R44-P58 VanDerWaalsContact NH2-CD 3.32Å; R44-P58 VanDerWaalsContact NH2-N 3.13Å; R44-P58 PolarHBondContact NH2-O 3.17Å
45	K	43.9	Very low	51.7	Low	191 Å²	191	113.3 Å²	113.3	83%	0.83	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-62.5	-18.8	-170.6	-76.1	-171	178.1	-178.5	0	114.6	K43	K43-K45 PolarHBondContact O-N 2.96Å
46	S	45.7	Very low	50.5	Low	95 Å²	95	115.5 Å²	115.5	66%	0.664	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-92.1	-26.1	-177.9	57.7	0	0	0	0	114.7	K43 R44	K43-S46 PolarHBondContact O-OG 3.45Å; R44-S46 PolarHBondContact O-N 3.34Å; R44-S46 VanDerWaalsContact O-N 3.07Å
47	M	40.9	Very low	49.5	Very low	103 Å²	103	117.9 Å²	117.9	51%	0.507	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-31	-164.2	-160.9	177.7	-67.9	0	0	114.4	Y38 R44	Y38-M47 HydrophobicContact CE1-CE 4.29Å; Y38-M47 WeakPolarHBondContact OH-CE 3.47Å; R44-M47 PolarHBondContact O-N 3.19Å
48	Y	37.9	Very low	48.3	Very low	126 Å²	126	119.3 Å²	119.3	49%	0.494	61%	0.607	S	S	.	*			trans	-122.7	67.6	-178.6	-62.2	-83.6	0	0	0	109.4	W50	Y48-W50 PolarHBondContact O-N 3.06Å
49	Q	33	Very low	47.5	Very low	171 Å²	171	125.3 Å²	125.3	80%	0.799	64%	0.636	S	S	*	*			trans	-68.2	69.2	154.9	-67.9	-173.5	13.3	0	0	107.8	N51	Q49-N51 PolarHBondContact O-N 3.21Å
50	W	32.7	Very low	46.6	Very low	173 Å²	173	127.5 Å²	127.5	66%	0.655	65%	0.648	S	S	*	*			trans	-76.1	117.5	175	-133.7	84.9	0	0	0	106.4	Y48 N52	Y48-W50 PolarHBondContact O-N 3.06Å; W50-N52 PolarHBondContact O-N 3.31Å
51	N	39.4	Very low	45.6	Very low	151 Å²	151	130.1 Å²	130.1	81%	0.807	66%	0.663	S	S	*	*			trans	-48.8	126.6	-176.9	-89.8	-33.3	0	0	0	111	Q49 R53	Q49-N51 PolarHBondContact O-N 3.21Å; N51-R53 PolarHBondContact O-N 3.46Å
52	N	41.2	Very low	45.1	Very low	156 Å²	156	128.1 Å²	128.1	83%	0.834	65%	0.646	S	S	*	*	S	Bend	trans	-40	101	175.6	-88.1	-15.1	0	0	0	112.3	W50	W50-N52 PolarHBondContact O-N 3.31Å
53	R	42.5	Very low	44.8	Very low	220 Å²	220	127 Å²	127	83%	0.83	63%	0.633	S	S	*	*	S	Bend	trans	177.1	112.8	146.1	-93.6	161.5	-140.9	-146.6	8.2	106.8	N51	N51-R53 PolarHBondContact O-N 3.46Å
54	N	45.5	Very low	44.6	Very low	143 Å²	143	126.2 Å²	126.2	77%	0.765	63%	0.629	S	S	*	*			trans	90.9	93.5	-176.4	-53.2	-15.6	0	0	0	114.5	S56	N54-S56 PolarHBondContact O-N 2.85Å
55	T	44.5	Very low	44.8	Very low	141 Å²	141	129.6 Å²	129.6	87%	0.865	65%	0.648	S	S	*	*			trans	-74.9	35.5	179.2	50.3	0	0	0	0	113.7	T57	T55-T57 PolarHBondContact O-N 2.83Å; T55-T57 VanDerWaalsContact O-N 3.12Å
56	S	49.1	Very low	45.4	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	62%	0.615	S	S	*	*			trans	-78.5	92.7	164.9	53	0	0	0	0	107.3	N54 P58	N54-S56 PolarHBondContact O-N 2.85Å; S56-P58 WeakPolarHBondContact O-CD 3.42Å
57	T	49.5	Very low	46.2	Very low	90 Å²	90	119.8 Å²	119.8	55%	0.552	60%	0.595	S	S	*	*			trans	-65.2	112.3	169.9	40.5	0	0	0	0	107.7	R44 T55 E59	R44-T57 VanDerWaalsContact NH2-CB 3.32Å; T55-T57 PolarHBondContact O-N 2.83Å; T55-T57 VanDerWaalsContact O-N 3.12Å; T57-E59 PolarHBondContact O-N 2.97Å
58	P	49.7	Very low	47.9	Very low	82 Å²	82	115.8 Å²	115.8	53%	0.532	58%	0.575	S	S	.	*			trans	-58.1	109.2	176.2	20.6	-32.1	0	0	0	109.4	R44 S56	R44-P58 VanDerWaalsContact CZ-O 3.24Å; R44-P58 PolarHBondContact NH1-O 2.8Å; R44-P58 VanDerWaalsContact NH2-CD 3.32Å; R44-P58 VanDerWaalsContact NH2-N 3.13Å; R44-P58 PolarHBondContact NH2-O 3.17Å; S56-P58 WeakPolarHBondContact O-CD 3.42Å
59	E	50.5	Low	50.2	Low	163 Å²	163	111 Å²	111	76%	0.762	56%	0.556	S	S	*	*			trans	-86.9	121.9	169.7	-71.4	-169.9	175.2	0	0	107.1	T57	T57-E59 PolarHBondContact O-N 2.97Å
60	Q	48.5	Very low	52.9	Low	113 Å²	113	105 Å²	105	53%	0.528	53%	0.527	S	S	.	.			trans	-79.1	125.2	172.2	-73.3	-175	-11	0	0	107.8	I62	Q60-I62 HydrophobicContact CB-CD1 4.37Å; Q60-I62 HydrophobicContact CB-CG1 4.05Å; Q60-I62 PolarHBondContact O-N 2.62Å
61	L	45.6	Very low	55.7	Low	153 Å²	153	96.8 Å²	96.8	80%	0.801	50%	0.496	S	S	*	.			trans	-68.9	112.6	164.3	-66.8	169.5	0	0	0	107	M253	L61-M253 HydrophobicContact CD1-SD 4.5Å
62	I	47.3	Very low	58.3	Low	51 Å²	51	94.3 Å²	94.3	26%	0.262	48%	0.479	S	S	.	.			trans	-113.1	112.7	-179.8	-57.9	162.8	0	0	0	107.2	F39 Q60 F64	F39-I62 HydrophobicContact CB-CD1 3.21Å; F39-I62 HydrophobicContact CD1-CD1 4.1Å; F39-I62 HydrophobicContact CD2-CD1 3.83Å; F39-I62 HydrophobicContact CG-CD1 3.44Å; F39-I62 VanDerWaalsContact CG-CD1 3.44Å; Q60-I62 HydrophobicContact CB-CD1 4.37Å; Q60-I62 HydrophobicContact CB-CG1 4.05Å; Q60-I62 PolarHBondContact O-N 2.62Å; I62-F64 HydrophobicContact CB-CD2 4.32Å; I62-F64 HydrophobicContact CB-CE1 4.27Å; I62-F64 HydrophobicContact CB-CE2 3.74Å; I62-F64 HydrophobicContact CB-CZ 3.71Å; I62-F64 HydrophobicContact CD1-CZ 4.08Å; I62-F64 HydrophobicContact CG2-CD1 3.75Å; I62-F64 HydrophobicContact CG2-CD2 3.98Å; I62-F64 HydrophobicContact CG2-CE1 3.4Å; I62-F64 HydrophobicContact CG2-CE2 3.67Å; I62-F64 HydrophobicContact CG2-CG 4.03Å; I62-F64 HydrophobicContact CG2-CZ 3.36Å; I62-F64 WeakPolarHBondContact O-CD2 3.38Å
63	N	50.4	Low	61	Low	82 Å²	82	87.1 Å²	87.1	44%	0.439	44%	0.44	S	S	.	.			trans	-84.9	112.7	168.5	-176.1	-11.6	0	0	0	108.3	E65 N66	N63-E65 PolarHBondContact OD1-N 2.77Å; N63-E65 VanDerWaalsContact OD1-N 3.12Å; N63-N66 PolarHBondContact OD1-N 3.2Å
64	F	49.4	Very low	63.6	Low	74 Å²	74	77.7 Å²	77.7	33%	0.325	41%	0.409	S	S	.	.	S	Bend	trans	-91.2	-11.8	-175.2	-68.7	-79.3	0	0	0	114.4	L32 T36 I62 F67	L32-F64 HydrophobicContact CD1-CB 3.63Å; L32-F64 HydrophobicContact CD1-CD1 3.51Å; L32-F64 HydrophobicContact CD1-CG 3.99Å; T36-F64 HydrophobicContact CG2-CE1 4.41Å; T36-F64 WeakPolarHBondContact OG1-CD1 3.13Å; T36-F64 VanDerWaalsContact OG1-CE1 3.29Å; T36-F64 WeakPolarHBondContact OG1-CE1 3.13Å; I62-F64 HydrophobicContact CB-CD2 4.32Å; I62-F64 HydrophobicContact CB-CE1 4.27Å; I62-F64 HydrophobicContact CB-CE2 3.74Å; I62-F64 HydrophobicContact CB-CZ 3.71Å; I62-F64 HydrophobicContact CD1-CZ 4.08Å; I62-F64 HydrophobicContact CG2-CD1 3.75Å; I62-F64 HydrophobicContact CG2-CD2 3.98Å; I62-F64 HydrophobicContact CG2-CE1 3.4Å; I62-F64 HydrophobicContact CG2-CE2 3.67Å; I62-F64 HydrophobicContact CG2-CG 4.03Å; I62-F64 HydrophobicContact CG2-CZ 3.36Å; I62-F64 WeakPolarHBondContact O-CD2 3.38Å; F64-F67 HydrophobicContact CB-CE2 4.26Å; F64-F67 AromaticContact CD1-CE2 3.79Å; F64-F67 HydrophobicContact CD1-CE2 3.79Å; F64-F67 HydrophobicContact CD1-CZ 4.28Å; F64-F67 HydrophobicContact CG-CE2 4.42Å; F64-F67 VanDerWaalsContact O-CD2 3.27Å; F64-F67 WeakPolarHBondContact O-CD2 3.24Å
65	E	52.9	Low	66.1	Low	148 Å²	148	70.9 Å²	70.9	69%	0.692	37%	0.372	S	S	*	.	S	Bend	trans	-94.3	-29.5	-177.9	-62.5	-159	149.8	0	0	112.3	N63	N63-E65 PolarHBondContact OD1-N 2.77Å; N63-E65 VanDerWaalsContact OD1-N 3.12Å
66	N	56.7	Low	68.7	Low	27 Å²	27	64.2 Å²	64.2	14%	0.144	33%	0.331	C	S	.	.	S	Bend	trans	-113.3	51.6	-173.9	-67.4	-15.4	0	0	0	111.9	N63 Q68 Y69	N63-N66 PolarHBondContact OD1-N 3.2Å; N66-Q68 PolarHBondContact O-N 2.91Å; N66-Y69 HydrophobicContact CB-CE2 3.79Å; N66-Y69 VanDerWaalsContact CB-OH 3.29Å; N66-Y69 WeakPolarHBondContact CB-OH 3.28Å; N66-Y69 VanDerWaalsContact O-CE2 3.3Å; N66-Y69 WeakPolarHBondContact O-CE2 3.41Å
67	F	63.7	Low	71	Confident	53 Å²	53	61.3 Å²	61.3	23%	0.232	31%	0.309	C	S	.	.			trans	-55.5	-43.9	-154.9	-130.9	-96.7	0	0	0	115.7	L31 L32 Y35 F64	L31-F67 HydrophobicContact CD2-CD1 3.69Å; L31-F67 HydrophobicContact CD2-CE1 4.18Å; L31-F67 HydrophobicContact CG-CD1 4.43Å; L31-F67 HydrophobicContact CG-CE1 4.48Å; L32-F67 HydrophobicContact CB-CE2 4.46Å; L32-F67 HydrophobicContact CD1-CD2 4.09Å; L32-F67 HydrophobicContact CD1-CE2 3.49Å; L32-F67 VanDerWaalsContact CD1-CE2 3.49Å; L32-F67 HydrophobicContact CD1-CZ 4.34Å; Y35-F67 AromaticContact CD1-CE1 3.34Å; Y35-F67 HydrophobicContact CD1-CE1 3.34Å; Y35-F67 AromaticContact CD1-CZ 3.64Å; Y35-F67 HydrophobicContact CD1-CZ 3.64Å; Y35-F67 HydrophobicContact CD2-CD1 4.5Å; Y35-F67 AromaticContact CD2-CE1 3.46Å; Y35-F67 HydrophobicContact CD2-CE1 3.46Å; Y35-F67 VanDerWaalsContact CD2-CE1 3.46Å; Y35-F67 HydrophobicContact CD2-CZ 4.02Å; Y35-F67 AromaticContact CE1-CE1 3.73Å; Y35-F67 HydrophobicContact CE1-CE1 3.73Å; Y35-F67 HydrophobicContact CE1-CZ 4.45Å; Y35-F67 AromaticContact CE2-CE1 3.78Å; Y35-F67 HydrophobicContact CE2-CE1 3.78Å; Y35-F67 AromaticContact CG-CE1 3.23Å; Y35-F67 HydrophobicContact CG-CE1 3.23Å; Y35-F67 AromaticContact CG-CZ 3.42Å; Y35-F67 HydrophobicContact CG-CZ 3.42Å; Y35-F67 VanDerWaalsContact CG-CZ 3.42Å; Y35-F67 AromaticContact CZ-CE1 3.92Å; F64-F67 HydrophobicContact CB-CE2 4.26Å; F64-F67 AromaticContact CD1-CE2 3.79Å; F64-F67 HydrophobicContact CD1-CE2 3.79Å; F64-F67 HydrophobicContact CD1-CZ 4.28Å; F64-F67 HydrophobicContact CG-CE2 4.42Å; F64-F67 VanDerWaalsContact O-CD2 3.27Å; F64-F67 WeakPolarHBondContact O-CD2 3.24Å
68	Q	76.3	Confident	73.3	Confident	20 Å²	20	61.2 Å²	61.2	9%	0.093	31%	0.31	C	S	.	.			trans	-153.1	131.8	-171.8	-66.6	-175.3	-35.7	0	0	110.1	L25 Y35 N66 L85	L25-Q68 HydrophobicContact CB-CB 4.26Å; L25-Q68 HydrophobicContact CD1-CB 3.67Å; L25-Q68 HydrophobicContact CG-CB 4.19Å; L25-Q68 PolarHBondContact N-O 3.03Å; Y35-Q68 PolarHBondContact OH-NE2 3.18Å; N66-Q68 PolarHBondContact O-N 2.91Å; Q68-L85 HydrophobicContact CB-CD2 4.16Å; Q68-L85 HydrophobicContact CG-CD1 4.44Å
69	Y	85.4	Confident	75.6	Confident	24 Å²	24	60.8 Å²	60.8	9%	0.094	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.8	172.3	-62.5	-98.1	0	0	0	109.6	L22 H23 P24 N66 L85 L212 N213 G221	L22-Y69 HydrophobicContact CB-CD1 4.31Å; H23-Y69 CarbonylContact O-C 3.59Å; H23-Y69 VanDerWaalsContact O-CA 3.26Å; H23-Y69 WeakPolarHBondContact O-CA 3.44Å; P24-Y69 HydrophobicContact CB-CD1 4.13Å; P24-Y69 HydrophobicContact CB-CE1 3.94Å; N66-Y69 HydrophobicContact CB-CE2 3.79Å; N66-Y69 VanDerWaalsContact CB-OH 3.29Å; N66-Y69 WeakPolarHBondContact CB-OH 3.28Å; N66-Y69 VanDerWaalsContact O-CE2 3.3Å; N66-Y69 WeakPolarHBondContact O-CE2 3.41Å; Y69-L85 WeakPolarHBondContact O-CD2 3.28Å; Y69-L212 HydrophobicContact CD2-CD2 3.74Å; Y69-L212 HydrophobicContact CE2-CB 4.27Å; Y69-L212 HydrophobicContact CE2-CD1 4.15Å; Y69-L212 HydrophobicContact CE2-CD2 3.76Å; Y69-L212 HydrophobicContact CE2-CG 4.28Å; Y69-L212 HydrophobicContact CG-CD2 4.15Å; Y69-N213 PolarHBondContact OH-O 2.75Å; Y69-G221 VanDerWaalsContact CE1-C 3.48Å; Y69-G221 WeakPolarHBondContact CE1-O 3.41Å
70	Y	90.1	Very high	77.9	Confident	47 Å²	47	54.4 Å²	54.4	18%	0.184	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.2	173.8	71.6	-86.6	0	0	0	111	L22 H23 L25 R83 V84	L22-Y70 WeakPolarHBondContact CA-O 3.36Å; H23-Y70 HydrophobicContact CB-CD1 4.09Å; H23-Y70 HydrophobicContact CB-CD2 4.5Å; H23-Y70 HydrophobicContact CB-CE1 3.56Å; H23-Y70 HydrophobicContact CB-CE2 4.02Å; H23-Y70 PolarHBondContact N-O 2.78Å; H23-Y70 VanDerWaalsContact O-CD1 3.31Å; H23-Y70 WeakPolarHBondContact O-CD1 3.47Å; H23-Y70 PolarHBondContact O-N 2.9Å; L25-Y70 HydrophobicContact CD2-CD1 3.32Å; L25-Y70 HydrophobicContact CD2-CE1 3.67Å; L25-Y70 HydrophobicContact CD2-CG 4.33Å; L25-Y70 HydrophobicContact CG-CD1 3.88Å; Y70-R83 HydrophobicContact CD2-CB 3.54Å; Y70-R83 HydrophobicContact CD2-CG 3.58Å; Y70-R83 HydrophobicContact CE2-CB 4.1Å; Y70-R83 HydrophobicContact CE2-CG 3.62Å; Y70-R83 HydrophobicContact CG-CB 4.12Å; Y70-V84 WeakPolarHBondContact CA-O 3.3Å
71	G	92.5	Very high	80.1	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	164	162.2	0	0	0	0	0	110.6	R83 V84	G71-R83 CarbonylContact O-C 3.59Å; G71-R83 WeakPolarHBondContact O-CA 3.49Å; G71-V84 PolarHBondContact N-O 2.78Å; G71-V84 PolarHBondContact O-N 2.62Å
72	E	94	Very high	82.5	Confident	98 Å²	98	48.9 Å²	48.9	46%	0.458	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.7	172.7	-64.2	-164.5	127.7	0	0	110.9	R83	E72-R83 HydrophobicContact CG-CG 4.43Å
73	I	96.3	Very high	84.6	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	178.6	171.7	67.7	167.1	0	0	0	109.5	V75 K81 L82 V84 F86 F95 I146 I148 I178	I73-V75 HydrophobicContact CD1-CG2 4.02Å; I73-K81 WeakPolarHBondContact O-CA 3.36Å; I73-L82 HydrophobicContact CG1-CB 4.26Å; I73-L82 PolarHBondContact N-O 3.44Å; I73-L82 PolarHBondContact O-N 2.79Å; I73-V84 HydrophobicContact CD1-CB 4.43Å; I73-V84 HydrophobicContact CD1-CG1 3.56Å; I73-V84 HydrophobicContact CD1-CG2 4.06Å; I73-V84 HydrophobicContact CG1-CG1 3.79Å; I73-V84 HydrophobicContact CG1-CG2 4.06Å; I73-V84 HydrophobicContact CG2-CG2 3.72Å; I73-F86 HydrophobicContact CG2-CZ 4.34Å; I73-F95 HydrophobicContact CD1-CE1 3.82Å; I73-F95 HydrophobicContact CD1-CZ 3.84Å; I73-I146 HydrophobicContact CD1-CG2 4.14Å; I73-I148 HydrophobicContact CB-CG1 4.37Å; I73-I148 HydrophobicContact CG2-CD1 4.21Å; I73-I148 HydrophobicContact CG2-CG1 3.83Å; I73-I178 HydrophobicContact CD1-CD1 3.86Å; I73-I178 HydrophobicContact CG2-CD1 4.42Å
74	S	97.7	Very high	86.7	Confident	23 Å²	23	44.8 Å²	44.8	16%	0.161	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.7	165.6	-58.1	0	0	0	0	112.7	Q80 I146 R147	S74-Q80 CarbonylContact C-O 3.48Å; S74-Q80 WeakPolarHBondContact CA-O 3.4Å; S74-I146 CarbonylContact O-C 3.54Å; S74-R147 PolarHBondContact N-O 3Å; S74-R147 PolarHBondContact O-N 2.73Å
75	V	98.5	Very high	88.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.7	-177.5	-172	0	0	0	0	110.2	I73 Q80 L82 F95 Y113 D144 T145 I146 F158	I73-V75 HydrophobicContact CD1-CG2 4.02Å; V75-Q80 PolarHBondContact N-O 2.68Å; V75-Q80 WeakPolarHBondContact O-CB 3.21Å; V75-Q80 PolarHBondContact O-N 3.04Å; V75-L82 HydrophobicContact CB-CD1 4.33Å; V75-L82 HydrophobicContact CG2-CD1 3.76Å; V75-F95 HydrophobicContact CG1-CE2 4.29Å; V75-F95 HydrophobicContact CG2-CD2 4.17Å; V75-F95 HydrophobicContact CG2-CE2 3.68Å; V75-F95 HydrophobicContact CG2-CZ 3.97Å; V75-Y113 HydrophobicContact CB-CD2 4.01Å; V75-Y113 HydrophobicContact CB-CE2 4.3Å; V75-Y113 HydrophobicContact CG1-CD2 3.79Å; V75-Y113 HydrophobicContact CG1-CE2 3.71Å; V75-D144 HydrophobicContact CG1-CB 4.24Å; V75-T145 CarbonylContact C-O 3.56Å; V75-T145 WeakPolarHBondContact CA-O 3.31Å; V75-I146 HydrophobicContact CG1-CG1 4.44Å; V75-I146 HydrophobicContact CG2-CG1 4.19Å; V75-F158 HydrophobicContact CG1-CE1 3.92Å; V75-F158 HydrophobicContact CG1-CZ 3.94Å
76	G	98.4	Very high	90.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-178.3	175.7	0	0	0	0	0	115.7	P78 P79 S118 D144 T145 R147	G76-P78 CarbonylContact C-O 3.56Å; G76-P78 CarbonylContact O-C 3.58Å; G76-P79 WeakPolarHBondContact O-CA 3.43Å; G76-S118 WeakPolarHBondContact CA-OG 3.38Å; G76-D144 VanDerWaalsContact CA-CG 3.5Å; G76-D144 WeakPolarHBondContact CA-OD1 3.06Å; G76-D144 WeakPolarHBondContact CA-OD2 3.1Å; G76-T145 PolarHBondContact N-O 3.22Å; G76-R147 PolarHBondContact O-NH1 2.99Å
77	T	98.3	Very high	92.2	Very high	35 Å²	35	37 Å²	37	22%	0.215	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.7	108	-179.6	-55	0	0	0	0	110.6	S118 S119 T120 R147	T77-S118 PolarHBondContact N-OG 3.15Å; T77-S118 CarbonylContact O-C 3.46Å; T77-S118 WeakPolarHBondContact O-CA 3.02Å; T77-S119 WeakPolarHBondContact CB-OG 2.93Å; T77-S119 WeakPolarHBondContact CG2-OG 3.35Å; T77-S119 PolarHBondContact O-N 3.31Å; T77-S119 PolarHBondContact O-OG 3.17Å; T77-T120 WeakPolarHBondContact CB-OG1 3.39Å; T77-T120 PolarHBondContact N-OG1 3.25Å; T77-T120 VanDerWaalsContact OG1-CG2 3.28Å; T77-T120 WeakPolarHBondContact OG1-CG2 3Å; T77-T120 PolarHBondContact OG1-OG1 3.35Å; T77-R147 PolarHBondContact OG1-NH2 3.29Å
78	P	97.9	Very high	93.4	Very high	87 Å²	87	37.3 Å²	37.3	57%	0.565	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	cis	-67.7	156.2	7.3	29.2	-36.2	0	0	0	113	G76 Q80 K117	G76-P78 CarbonylContact C-O 3.56Å; G76-P78 CarbonylContact O-C 3.58Å; P78-Q80 PolarHBondContact O-N 3.15Å; P78-K117 WeakPolarHBondContact CD-O 3.43Å
79	P	98	Very high	93.8	Very high	73 Å²	73	39.4 Å²	39.4	47%	0.474	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	129.4	-178	-21.1	32.8	0	0	0	112.6	G76	G76-P79 WeakPolarHBondContact O-CA 3.43Å
80	Q	97.5	Very high	93.8	Very high	29 Å²	29	39.1 Å²	39.1	14%	0.136	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.7	175.7	-56.5	176.8	57.4	0	0	108.9	S74 V75 P78 D114	S74-Q80 CarbonylContact C-O 3.48Å; S74-Q80 WeakPolarHBondContact CA-O 3.4Å; V75-Q80 PolarHBondContact N-O 2.68Å; V75-Q80 WeakPolarHBondContact O-CB 3.21Å; V75-Q80 PolarHBondContact O-N 3.04Å; P78-Q80 PolarHBondContact O-N 3.15Å; Q80-D114 PolarHBondContact NE2-O 3.18Å
81	K	96.4	Very high	93.9	Very high	147 Å²	147	37.6 Å²	37.6	64%	0.639	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	137	-176.8	-70.4	-171.9	174.3	-164.9	0	111.7	I73	I73-K81 WeakPolarHBondContact O-CA 3.36Å
82	L	94.9	Very high	94	Very high	3 Å²	3	38 Å²	38	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	145.4	176.7	-60.7	173.5	0	0	0	109.8	I73 V75 V84 F95 D175	I73-L82 HydrophobicContact CG1-CB 4.26Å; I73-L82 PolarHBondContact N-O 3.44Å; I73-L82 PolarHBondContact O-N 2.79Å; V75-L82 HydrophobicContact CB-CD1 4.33Å; V75-L82 HydrophobicContact CG2-CD1 3.76Å; L82-V84 HydrophobicContact CB-CG1 4.38Å; L82-F95 HydrophobicContact CD1-CB 3.91Å; L82-F95 HydrophobicContact CD1-CD1 3.7Å; L82-F95 HydrophobicContact CD1-CD2 4.06Å; L82-F95 HydrophobicContact CD1-CE1 4.33Å; L82-F95 HydrophobicContact CD1-CG 3.59Å; L82-D175 HydrophobicContact CB-CB 4.2Å; L82-D175 HydrophobicContact CD2-CB 3.91Å
83	R	92.4	Very high	94.1	Very high	47 Å²	47	33.4 Å²	33.4	18%	0.177	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.4	170.2	-63.4	166.1	-64.8	172.9	8.4	109.3	Y70 G71 E72 K173 D175 G176	Y70-R83 HydrophobicContact CD2-CB 3.54Å; Y70-R83 HydrophobicContact CD2-CG 3.58Å; Y70-R83 HydrophobicContact CE2-CB 4.1Å; Y70-R83 HydrophobicContact CE2-CG 3.62Å; Y70-R83 HydrophobicContact CG-CB 4.12Å; G71-R83 CarbonylContact O-C 3.59Å; G71-R83 WeakPolarHBondContact O-CA 3.49Å; E72-R83 HydrophobicContact CG-CG 4.43Å; R83-K173 PolarHBondContact NE-O 2.94Å; R83-K173 VanDerWaalsContact NE-O 3.16Å; R83-K173 PolarHBondContact NH1-O 3.49Å; R83-K173 PolarHBondContact NH2-O 3.15Å; R83-D175 WeakPolarHBondContact CB-OD2 3.37Å; R83-D175 IonicContact CZ-OD1 3.85Å; R83-D175 IonicContact CZ-OD2 2.86Å; R83-D175 PolarHBondContact N-OD2 3.27Å; R83-D175 IonicContact NE-OD1 3.66Å; R83-D175 IonicContact NE-OD2 3.04Å; R83-D175 PolarHBondContact NE-OD2 2.82Å; R83-D175 IonicContact NH2-OD1 2.91Å; R83-D175 PolarHBondContact NH2-OD1 2.88Å; R83-D175 IonicContact NH2-OD2 3.31Å; R83-D175 PolarHBondContact NH2-OD2 3.42Å; R83-D175 WeakPolarHBondContact O-CA 3.25Å; R83-D175 PolarHBondContact O-N 3.13Å; R83-G176 PolarHBondContact O-N 2.89Å
84	V	93.2	Very high	94	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	143.4	-172.7	-61.8	0	0	0	0	112.4	Y70 G71 I73 L82 F86 F95 G176 I178	Y70-V84 WeakPolarHBondContact CA-O 3.3Å; G71-V84 PolarHBondContact N-O 2.78Å; G71-V84 PolarHBondContact O-N 2.62Å; I73-V84 HydrophobicContact CD1-CB 4.43Å; I73-V84 HydrophobicContact CD1-CG1 3.56Å; I73-V84 HydrophobicContact CD1-CG2 4.06Å; I73-V84 HydrophobicContact CG1-CG1 3.79Å; I73-V84 HydrophobicContact CG1-CG2 4.06Å; I73-V84 HydrophobicContact CG2-CG2 3.72Å; L82-V84 HydrophobicContact CB-CG1 4.38Å; V84-F86 HydrophobicContact CG2-CE1 4.24Å; V84-F86 HydrophobicContact CG2-CE2 4.2Å; V84-F86 HydrophobicContact CG2-CZ 3.91Å; V84-F95 HydrophobicContact CG1-CD1 4.09Å; V84-F95 HydrophobicContact CG1-CE1 3.68Å; V84-G176 VanDerWaalsContact CA-O 3.3Å; V84-G176 WeakPolarHBondContact CA-O 3.43Å; V84-I178 HydrophobicContact CB-CG1 4.39Å; V84-I178 HydrophobicContact CG2-CD1 4.01Å; V84-I178 HydrophobicContact CG2-CG1 4.29Å
85	L	91.3	Very high	93.8	Very high	18 Å²	18	32.3 Å²	32.3	9%	0.094	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.2	165.9	-53.2	-178.3	0	0	0	109.4	L25 Q68 Y69 D87 Y174 G176 V177 I178	L25-L85 HydrophobicContact CD1-CD2 4.1Å; Q68-L85 HydrophobicContact CB-CD2 4.16Å; Q68-L85 HydrophobicContact CG-CD1 4.44Å; Y69-L85 WeakPolarHBondContact O-CD2 3.28Å; L85-D87 PolarHBondContact O-N 3.11Å; L85-Y174 HydrophobicContact CD1-CD1 3.88Å; L85-Y174 HydrophobicContact CD1-CD2 3.86Å; L85-Y174 HydrophobicContact CD1-CE1 3.74Å; L85-Y174 HydrophobicContact CD1-CE2 3.71Å; L85-Y174 HydrophobicContact CD1-CG 3.92Å; L85-Y174 HydrophobicContact CD2-CD1 4.31Å; L85-Y174 HydrophobicContact CD2-CG 4.15Å; L85-Y174 HydrophobicContact CG-CD1 4.13Å; L85-Y174 HydrophobicContact CG-CD2 3.79Å; L85-Y174 HydrophobicContact CG-CE1 4.48Å; L85-Y174 HydrophobicContact CG-CE2 4.15Å; L85-Y174 HydrophobicContact CG-CG 3.76Å; L85-G176 PolarHBondContact N-O 2.93Å; L85-V177 HydrophobicContact CB-CG2 4.24Å; L85-V177 HydrophobicContact CD1-CG2 4.46Å; L85-V177 CarbonylContact O-C 3.59Å; L85-V177 WeakPolarHBondContact O-CA 3.46Å; L85-I178 PolarHBondContact O-N 3.2Å
86	F	92.6	Very high	93.5	Very high	20 Å²	20	32.3 Å²	32.3	9%	0.088	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	96.1	171.5	-63	-80.4	0	0	0	109.2	I20 L22 I73 V84 I178 M180 F210 M224	I20-F86 HydrophobicContact CD1-CE1 4.31Å; I20-F86 HydrophobicContact CD1-CE2 4.39Å; I20-F86 HydrophobicContact CD1-CZ 3.77Å; I20-F86 HydrophobicContact CG2-CE2 4.23Å; I20-F86 HydrophobicContact CG2-CZ 4.32Å; L22-F86 HydrophobicContact CD2-CD2 3.92Å; L22-F86 HydrophobicContact CD2-CE2 3.95Å; I73-F86 HydrophobicContact CG2-CZ 4.34Å; V84-F86 HydrophobicContact CG2-CE1 4.24Å; V84-F86 HydrophobicContact CG2-CE2 4.2Å; V84-F86 HydrophobicContact CG2-CZ 3.91Å; F86-I178 HydrophobicContact CD1-CB 4.07Å; F86-I178 HydrophobicContact CD1-CD1 4.39Å; F86-I178 HydrophobicContact CD1-CG2 4.26Å; F86-I178 HydrophobicContact CE1-CB 4.43Å; F86-I178 HydrophobicContact CE1-CD1 3.88Å; F86-M180 HydrophobicContact CB-CG 4.04Å; F86-M180 HydrophobicContact CD1-CG 4.35Å; F86-M180 HydrophobicContact CD1-SD 4.33Å; F86-F210 HydrophobicContact CB-CE1 3.88Å; F86-F210 HydrophobicContact CB-CZ 3.73Å; F86-M224 HydrophobicContact CB-CE 4.39Å; F86-M224 HydrophobicContact CB-SD 3.93Å; F86-M224 HydrophobicContact CD1-CE 3.81Å; F86-M224 HydrophobicContact CD1-SD 3.33Å; F86-M224 WeakPolarHBondContact CD1-SD 3.3Å; F86-M224 HydrophobicContact CD2-SD 3.52Å; F86-M224 VanDerWaalsContact CD2-SD 3.52Å; F86-M224 HydrophobicContact CE1-CE 4.27Å; F86-M224 HydrophobicContact CE1-SD 3.56Å; F86-M224 VanDerWaalsContact CE1-SD 3.56Å; F86-M224 HydrophobicContact CE2-SD 3.74Å; F86-M224 HydrophobicContact CG-CE 4.13Å; F86-M224 HydrophobicContact CG-SD 3.3Å; F86-M224 WeakPolarHBondContact CG-SD 3.33Å; F86-M224 HydrophobicContact CZ-SD 3.76Å
87	D	89.9	Confident	93.2	Very high	47 Å²	47	32.3 Å²	32.3	25%	0.251	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	104.4	-169.9	174.7	21.1	0	0	0	111.6	L85 G89 S90 V177 I178 G179 M180	L85-D87 PolarHBondContact O-N 3.11Å; D87-G89 PolarHBondContact O-N 3.06Å; D87-G89 WeakPolarHBondContact OD1-CA 3.37Å; D87-G89 PolarHBondContact OD1-N 2.86Å; D87-S90 PolarHBondContact O-N 2.69Å; D87-S90 WeakPolarHBondContact OD2-CB 3.46Å; D87-S90 PolarHBondContact OD2-OG 2.93Å; D87-V177 HydrophobicContact CB-CG1 3.46Å; D87-V177 VanDerWaalsContact CB-CG1 3.46Å; D87-I178 PolarHBondContact N-O 3.2Å; D87-G179 CarbonylContact O-C 3.56Å; D87-G179 WeakPolarHBondContact O-CA 3.45Å; D87-M180 PolarHBondContact O-N 2.93Å
88	T	89.3	Confident	92.8	Very high	61 Å²	61	35.7 Å²	35.7	37%	0.374	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-14.2	176.6	57.7	0	0	0	0	113.2	M180 S181 F208 F210	T88-M180 HydrophobicContact CG2-CB 4.2Å; T88-S181 WeakPolarHBondContact O-CA 3.28Å; T88-S181 WeakPolarHBondContact O-CB 3.43Å; T88-F208 HydrophobicContact CG2-CE2 4.08Å; T88-F208 HydrophobicContact CG2-CZ 4.41Å; T88-F210 HydrophobicContact CG2-CE2 3.83Å; T88-F210 HydrophobicContact CG2-CZ 4.43Å
89	G	84.4	Confident	92.3	Very high	64 Å²	64	34.9 Å²	34.9	66%	0.66	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.1	179.6	0	0	0	0	0	114.7	D87	D87-G89 PolarHBondContact O-N 3.06Å; D87-G89 WeakPolarHBondContact OD1-CA 3.37Å; D87-G89 PolarHBondContact OD1-N 2.86Å
90	S	87.3	Confident	91.6	Very high	17 Å²	17	31.9 Å²	31.9	12%	0.119	17%	0.17	C	C	.	.			trans	-136	163.9	-177.7	74	0	0	0	0	114.1	D87 G179 M180 S181	D87-S90 PolarHBondContact O-N 2.69Å; D87-S90 WeakPolarHBondContact OD2-CB 3.46Å; D87-S90 PolarHBondContact OD2-OG 2.93Å; S90-G179 CarbonylContact O-C 3.59Å; S90-G179 VanDerWaalsContact O-C 3.25Å; S90-G179 WeakPolarHBondContact O-CA 3.44Å; S90-M180 PolarHBondContact O-N 3.36Å; S90-S181 VanDerWaalsContact O-CB 3.3Å; S90-S181 WeakPolarHBondContact O-CB 3.49Å; S90-S181 PolarHBondContact O-N 3.11Å; S90-S181 PolarHBondContact O-OG 3.43Å
91	T	91.2	Very high	90.6	Very high	16 Å²	16	36.1 Å²	36.1	10%	0.098	19%	0.185	C	C	.	.			trans	-95.3	-18	172.9	44.3	0	0	0	0	113.6	S181 R183 S186 P192	T91-S181 WeakPolarHBondContact CG2-OG 3.26Å; T91-R183 HydrophobicContact CG2-CB 3.6Å; T91-R183 HydrophobicContact CG2-CG 4.13Å; T91-S186 WeakPolarHBondContact OG1-CB 3.41Å; T91-P192 HydrophobicContact CG2-CG 4.02Å; T91-P192 WeakPolarHBondContact O-CB 3.29Å
92	D	93.5	Very high	89.5	Confident	8 Å²	8	36.1 Å²	36.1	4%	0.043	19%	0.185	C	C	.	.			trans	-92.1	132.3	-159.9	-61.3	-11.5	0	0	0	109.2	Y128 G179 S186 F188	D92-Y128 HydrophobicContact CB-CE2 4.1Å; D92-Y128 WeakPolarHBondContact CB-OH 3.42Å; D92-G179 PolarHBondContact O-N 3.27Å; D92-G179 VanDerWaalsContact O-N 3.12Å; D92-S186 WeakPolarHBondContact OD1-CB 3.39Å; D92-F188 WeakPolarHBondContact OD2-CE2 3.4Å
93	T	96.3	Very high	88.4	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.012	21%	0.209	C	C	.	.			trans	-97.6	134	170.8	-59.3	0	0	0	0	108.7	F95 I146 F158 A159 V177 I178	T93-F95 HydrophobicContact CG2-CE1 3.95Å; T93-F95 HydrophobicContact CG2-CE2 3.96Å; T93-F95 HydrophobicContact CG2-CZ 3.41Å; T93-F95 VanDerWaalsContact CG2-CZ 3.41Å; T93-I146 HydrophobicContact CG2-CD1 4.3Å; T93-F158 HydrophobicContact CG2-CB 3.68Å; T93-F158 CarbonylContact O-C 3.55Å; T93-F158 WeakPolarHBondContact O-CA 3.21Å; T93-F158 WeakPolarHBondContact O-CB 3.3Å; T93-A159 PolarHBondContact O-N 3.01Å; T93-V177 CarbonylContact C-O 3.59Å; T93-V177 VanDerWaalsContact CA-O 3.26Å; T93-V177 WeakPolarHBondContact CA-O 3.42Å; T93-V177 WeakPolarHBondContact CG2-O 3.45Å; T93-I178 HydrophobicContact CG2-CG1 3.97Å
94	W	95.2	Very high	87.4	Confident	3 Å²	3	38.4 Å²	38.4	1%	0.011	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	151.4	174.9	62.2	-98.3	0	0	0	112	Y132 A159 M161 I164 Y169 Y174 G176 V177	W94-Y132 HydrophobicContact CZ2-CE2 4.37Å; W94-Y132 AromaticContact NE1-CE2 3.35Å; W94-Y132 VanDerWaalsContact NE1-CE2 3.35Å; W94-Y132 AromaticContact NE1-CZ 3.63Å; W94-Y132 PolarHBondContact NE1-OH 3.2Å; W94-A159 CarbonylContact C-O 3.51Å; W94-A159 WeakPolarHBondContact CA-O 3.34Å; W94-A159 HydrophobicContact CB-CB 4.12Å; W94-A159 WeakPolarHBondContact CB-O 3.44Å; W94-M161 HydrophobicContact CB-CE 3.88Å; W94-M161 HydrophobicContact CB-CG 4Å; W94-M161 HydrophobicContact CB-SD 4.2Å; W94-M161 HydrophobicContact CD2-CG 3.78Å; W94-M161 HydrophobicContact CD2-SD 4.45Å; W94-M161 HydrophobicContact CE3-CB 4.34Å; W94-M161 HydrophobicContact CE3-CG 3.34Å; W94-M161 HydrophobicContact CG-CG 4.09Å; W94-M161 HydrophobicContact CG-SD 4.34Å; W94-M161 HydrophobicContact CZ3-CG 4.04Å; W94-I164 HydrophobicContact CZ3-CD1 4.25Å; W94-Y169 WeakPolarHBondContact CH2-OH 3.35Å; W94-Y174 AromaticContact CH2-CE2 3.77Å; W94-Y174 HydrophobicContact CH2-CE2 3.77Å; W94-Y174 HydrophobicContact CZ2-CE2 4.23Å; W94-G176 CarbonylContact O-C 3.5Å; W94-G176 WeakPolarHBondContact O-CA 3.24Å; W94-V177 HydrophobicContact CD2-CB 4.27Å; W94-V177 HydrophobicContact CD2-CG2 4.4Å; W94-V177 VanDerWaalsContact CE2-CG2 3.47Å; W94-V177 HydrophobicContact CH2-CG2 4.01Å; W94-V177 HydrophobicContact CZ2-CB 4Å; W94-V177 HydrophobicContact CZ2-CG2 3.26Å; W94-V177 PolarHBondContact N-O 2.73Å; W94-V177 PolarHBondContact O-N 2.89Å
95	F	93.8	Very high	86.2	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.9	177.6	-52.6	-54	0	0	0	110.4	I73 V75 L82 V84 T93 S97 I146 F158 A159 M161 D175 I178	I73-F95 HydrophobicContact CD1-CE1 3.82Å; I73-F95 HydrophobicContact CD1-CZ 3.84Å; V75-F95 HydrophobicContact CG1-CE2 4.29Å; V75-F95 HydrophobicContact CG2-CD2 4.17Å; V75-F95 HydrophobicContact CG2-CE2 3.68Å; V75-F95 HydrophobicContact CG2-CZ 3.97Å; L82-F95 HydrophobicContact CD1-CB 3.91Å; L82-F95 HydrophobicContact CD1-CD1 3.7Å; L82-F95 HydrophobicContact CD1-CD2 4.06Å; L82-F95 HydrophobicContact CD1-CE1 4.33Å; L82-F95 HydrophobicContact CD1-CG 3.59Å; V84-F95 HydrophobicContact CG1-CD1 4.09Å; V84-F95 HydrophobicContact CG1-CE1 3.68Å; T93-F95 HydrophobicContact CG2-CE1 3.95Å; T93-F95 HydrophobicContact CG2-CE2 3.96Å; T93-F95 HydrophobicContact CG2-CZ 3.41Å; T93-F95 VanDerWaalsContact CG2-CZ 3.41Å; F95-S97 PolarHBondContact O-N 2.86Å; F95-I146 HydrophobicContact CE2-CD1 4.03Å; F95-I146 HydrophobicContact CZ-CD1 3.77Å; F95-F158 HydrophobicContact CD2-CB 4.25Å; F95-F158 HydrophobicContact CD2-CD1 4.32Å; F95-F158 AromaticContact CD2-CD2 3.36Å; F95-F158 HydrophobicContact CD2-CD2 3.36Å; F95-F158 AromaticContact CD2-CE2 3.68Å; F95-F158 HydrophobicContact CD2-CE2 3.68Å; F95-F158 AromaticContact CD2-CG 3.72Å; F95-F158 HydrophobicContact CD2-CG 3.72Å; F95-F158 HydrophobicContact CD2-CZ 4.29Å; F95-F158 HydrophobicContact CE2-CB 3.91Å; F95-F158 AromaticContact CE2-CD1 3.89Å; F95-F158 HydrophobicContact CE2-CD1 3.89Å; F95-F158 AromaticContact CE2-CD2 3.75Å; F95-F158 HydrophobicContact CE2-CD2 3.75Å; F95-F158 HydrophobicContact CE2-CE1 4.34Å; F95-F158 HydrophobicContact CE2-CE2 4.22Å; F95-F158 AromaticContact CE2-CG 3.56Å; F95-F158 HydrophobicContact CE2-CG 3.56Å; F95-F158 HydrophobicContact CE2-CZ 4.49Å; F95-F158 HydrophobicContact CG-CD2 4.41Å; F95-A159 PolarHBondContact N-O 3.29Å; F95-M161 PolarHBondContact O-N 2.82Å; F95-D175 CarbonylContact C-O 3.25Å; F95-D175 WeakPolarHBondContact CA-O 3.18Å; F95-I178 HydrophobicContact CE1-CG1 4.48Å
96	A	91.3	Very high	85	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	133.3	167.2	0	0	0	0	0	109.8	F110 F112 Y113 I164 D175	A96-F110 HydrophobicContact CB-CB 4.38Å; A96-F112 WeakPolarHBondContact O-CA 3.35Å; A96-Y113 PolarHBondContact O-N 2.86Å; A96-I164 HydrophobicContact CB-CD1 3.85Å; A96-D175 PolarHBondContact N-O 2.86Å
97	S	92.3	Very high	83.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-103.5	145	-174.4	-179	0	0	0	0	112.1	F95 N99 C100 E160 M161	F95-S97 PolarHBondContact O-N 2.86Å; S97-N99 PolarHBondContact O-N 3Å; S97-N99 VanDerWaalsContact O-N 3.15Å; S97-N99 WeakPolarHBondContact OG-CB 3.17Å; S97-N99 PolarHBondContact OG-N 3.05Å; S97-C100 WeakPolarHBondContact O-CB 3.48Å; S97-C100 PolarHBondContact O-N 3.06Å; S97-C100 VanDerWaalsContact O-N 3.15Å; S97-C100 PolarHBondContact O-SG 3.39Å; S97-E160 PolarHBondContact OG-OE2 2.84Å; S97-M161 VanDerWaalsContact CB-O 3.26Å; S97-M161 WeakPolarHBondContact CB-O 3.39Å; S97-M161 PolarHBondContact N-O 2.8Å
98	R	89.5	Confident	82.8	Confident	105 Å²	105	47 Å²	47	40%	0.396	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.2	166.7	-178.4	57.7	176.6	-167.3	2	112.4	C100 F112 Y113 D114	R98-C100 PolarHBondContact O-N 3.22Å; R98-F112 HydrophobicContact CB-CD2 4.46Å; R98-F112 VanDerWaalsContact NH1-CE2 3.32Å; R98-Y113 PolarHBondContact N-O 3.45Å; R98-D114 HydrophobicContact CB-CB 3.92Å; R98-D114 HydrophobicContact CG-CB 4.28Å
99	N	87	Confident	81.8	Confident	70 Å²	70	49.1 Å²	49.1	37%	0.374	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	20.8	177.5	-61.7	-49.1	0	0	0	113.4	S97 F140 R162	S97-N99 PolarHBondContact O-N 3Å; S97-N99 VanDerWaalsContact O-N 3.15Å; S97-N99 WeakPolarHBondContact OG-CB 3.17Å; S97-N99 PolarHBondContact OG-N 3.05Å; N99-F140 HydrophobicContact CB-CE1 4.45Å; N99-R162 HydrophobicContact CB-CG 4.46Å; N99-R162 PolarHBondContact O-NE 2.57Å
100	C	84.3	Confident	81	Confident	11 Å²	11	46.9 Å²	46.9	7%	0.074	22%	0.216	C	C	.	.			trans	-56.8	152.6	175.1	-90.8	0	0	0	0	113.4	S97 R98 F102 C107 M161 R162	S97-C100 WeakPolarHBondContact O-CB 3.48Å; S97-C100 PolarHBondContact O-N 3.06Å; S97-C100 VanDerWaalsContact O-N 3.15Å; S97-C100 PolarHBondContact O-SG 3.39Å; R98-C100 PolarHBondContact O-N 3.22Å; C100-F102 PolarHBondContact O-N 2.84Å; C100-C107 HydrophobicContact CB-CB 3.48Å; C100-C107 VanDerWaalsContact CB-CB 3.48Å; C100-C107 WeakPolarHBondContact CB-SG 3.41Å; C100-C107 WeakPolarHBondContact SG-CB 3.46Å; C100-C107 CovalentContact SG-SG 1.99Å; C100-C107 PolarHBondContact SG-SG 3.2Å; C100-M161 PolarHBondContact SG-O 3.27Å; C100-R162 WeakPolarHBondContact CA-O 3.23Å
101	W	76.4	Confident	80.8	Confident	118 Å²	118	48.9 Å²	48.9	45%	0.447	23%	0.23	S	C	.	.			trans	-63.7	135.5	178.9	-169.2	53	0	0	0	110.5	L103 D104 W108 R162 F165	W101-L103 HydrophobicContact CD2-CB 4.19Å; W101-L103 HydrophobicContact CE3-CB 3.77Å; W101-L103 HydrophobicContact CH2-CB 3.83Å; W101-L103 HydrophobicContact CH2-CD1 3.65Å; W101-L103 HydrophobicContact CH2-CG 4.21Å; W101-L103 HydrophobicContact CZ2-CB 4.23Å; W101-L103 HydrophobicContact CZ2-CD1 3.78Å; W101-L103 HydrophobicContact CZ2-CG 4.27Å; W101-L103 HydrophobicContact CZ3-CB 3.59Å; W101-L103 HydrophobicContact CZ3-CD1 4.29Å; W101-L103 HydrophobicContact CZ3-CG 4.45Å; W101-L103 PolarHBondContact O-N 2.97Å; W101-L103 VanDerWaalsContact O-N 3.11Å; W101-D104 HydrophobicContact CB-CB 4.22Å; W101-D104 WeakPolarHBondContact O-CB 3.46Å; W101-D104 PolarHBondContact O-N 2.96Å; W101-W108 PolarHBondContact O-NE1 3.37Å; W101-R162 PolarHBondContact N-O 3.46Å; W101-F165 HydrophobicContact CE3-CZ 4Å; W101-F165 HydrophobicContact CZ3-CZ 4.03Å
102	F	72.6	Confident	80.7	Confident	146 Å²	146	50.3 Å²	50.3	64%	0.64	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.4	-170.2	72.6	-82	0	0	0	113.9	C100	C100-F102 PolarHBondContact O-N 2.84Å
103	L	72.1	Confident	80.8	Confident	98 Å²	98	50 Å²	50	51%	0.513	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.5	176	-62.1	178.9	0	0	0	113.5	W101 I105	W101-L103 HydrophobicContact CD2-CB 4.19Å; W101-L103 HydrophobicContact CE3-CB 3.77Å; W101-L103 HydrophobicContact CH2-CB 3.83Å; W101-L103 HydrophobicContact CH2-CD1 3.65Å; W101-L103 HydrophobicContact CH2-CG 4.21Å; W101-L103 HydrophobicContact CZ2-CB 4.23Å; W101-L103 HydrophobicContact CZ2-CD1 3.78Å; W101-L103 HydrophobicContact CZ2-CG 4.27Å; W101-L103 HydrophobicContact CZ3-CB 3.59Å; W101-L103 HydrophobicContact CZ3-CD1 4.29Å; W101-L103 HydrophobicContact CZ3-CG 4.45Å; W101-L103 PolarHBondContact O-N 2.97Å; W101-L103 VanDerWaalsContact O-N 3.11Å; L103-I105 VanDerWaalsContact C-N 3.26Å; L103-I105 PolarHBondContact O-N 2.99Å
104	D	71.8	Confident	80.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	24%	0.235	C	C	.	.			trans	-82.4	74.3	175.8	-166.4	-17.6	0	0	0	109.6	W101 F106 C107 W108 I164	W101-D104 HydrophobicContact CB-CB 4.22Å; W101-D104 WeakPolarHBondContact O-CB 3.46Å; W101-D104 PolarHBondContact O-N 2.96Å; D104-F106 PolarHBondContact O-N 3.38Å; D104-F106 VanDerWaalsContact O-N 3.1Å; D104-F106 WeakPolarHBondContact OD1-CB 3.07Å; D104-F106 PolarHBondContact OD1-N 3.38Å; D104-C107 HydrophobicContact CB-CB 4.2Å; D104-C107 PolarHBondContact O-N 2.86Å; D104-C107 PolarHBondContact OD1-N 3.17Å; D104-C107 VanDerWaalsContact OD1-N 3.14Å; D104-W108 PolarHBondContact O-N 3.41Å; D104-I164 PolarHBondContact OD2-N 2.93Å
105	I	69.1	Low	81	Confident	124 Å²	124	50.7 Å²	50.7	64%	0.636	24%	0.238	S	C	*	.	H	α-helix	trans	-52.3	-33.4	179.6	-61.3	170	0	0	0	110.8	L103 W108 M109	L103-I105 VanDerWaalsContact C-N 3.26Å; L103-I105 PolarHBondContact O-N 2.99Å; I105-W108 PolarHBondContact O-N 3.13Å; I105-M109 WeakPolarHBondContact O-CG 3.39Å; I105-M109 PolarHBondContact O-N 3.09Å
106	F	64.2	Low	81.2	Confident	42 Å²	42	55.6 Å²	55.6	18%	0.184	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-49.6	177.2	-62.8	-79.8	0	0	0	111.1	D104 W108 M109 F110 F170	D104-F106 PolarHBondContact O-N 3.38Å; D104-F106 VanDerWaalsContact O-N 3.1Å; D104-F106 WeakPolarHBondContact OD1-CB 3.07Å; D104-F106 PolarHBondContact OD1-N 3.38Å; F106-W108 PolarHBondContact O-N 2.91Å; F106-M109 WeakPolarHBondContact O-CB 3.39Å; F106-M109 PolarHBondContact O-N 2.94Å; F106-F110 WeakPolarHBondContact O-CD2 3.46Å; F106-F110 WeakPolarHBondContact O-CE2 3.46Å; F106-F170 HydrophobicContact CD1-CE1 4.4Å; F106-F170 HydrophobicContact CD1-CE2 4.49Å; F106-F170 HydrophobicContact CD1-CZ 4.32Å; F106-F170 HydrophobicContact CE1-CD1 4.07Å; F106-F170 AromaticContact CE1-CD2 3.69Å; F106-F170 HydrophobicContact CE1-CD2 3.69Å; F106-F170 AromaticContact CE1-CE1 3.64Å; F106-F170 HydrophobicContact CE1-CE1 3.64Å; F106-F170 AromaticContact CE1-CE2 3.24Å; F106-F170 HydrophobicContact CE1-CE2 3.24Å; F106-F170 HydrophobicContact CE1-CG 4.1Å; F106-F170 AromaticContact CE1-CZ 3.21Å; F106-F170 HydrophobicContact CE1-CZ 3.21Å; F106-F170 HydrophobicContact CZ-CD2 4.36Å; F106-F170 HydrophobicContact CZ-CE1 4.3Å; F106-F170 AromaticContact CZ-CE2 3.52Å; F106-F170 HydrophobicContact CZ-CE2 3.52Å; F106-F170 AromaticContact CZ-CZ 3.48Å; F106-F170 HydrophobicContact CZ-CZ 3.48Å; F106-F170 VanDerWaalsContact CZ-CZ 3.48Å
107	C	67.1	Low	81.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-35.3	178	-172.9	0	0	0	0	112.7	C100 D104 M109 F110 F112	C100-C107 HydrophobicContact CB-CB 3.48Å; C100-C107 VanDerWaalsContact CB-CB 3.48Å; C100-C107 WeakPolarHBondContact CB-SG 3.41Å; C100-C107 WeakPolarHBondContact SG-CB 3.46Å; C100-C107 CovalentContact SG-SG 1.99Å; C100-C107 PolarHBondContact SG-SG 3.2Å; D104-C107 HydrophobicContact CB-CB 4.2Å; D104-C107 PolarHBondContact O-N 2.86Å; D104-C107 PolarHBondContact OD1-N 3.17Å; D104-C107 VanDerWaalsContact OD1-N 3.14Å; C107-M109 PolarHBondContact O-N 2.9Å; C107-F110 PolarHBondContact O-N 2.83Å; C107-F112 WeakPolarHBondContact O-CD1 3.43Å; C107-F112 WeakPolarHBondContact O-CE1 3.26Å
108	W	70.2	Confident	81.8	Confident	98 Å²	98	62.1 Å²	62.1	37%	0.371	30%	0.302	S	S	.	.	H	α-helix	trans	-69.3	-12.8	177.7	-64.6	104.7	0	0	0	114.6	W101 D104 I105 F106 F112	W101-W108 PolarHBondContact O-NE1 3.37Å; D104-W108 PolarHBondContact O-N 3.41Å; I105-W108 PolarHBondContact O-N 3.13Å; F106-W108 PolarHBondContact O-N 2.91Å; W108-F112 HydrophobicContact CE3-CE1 4.36Å; W108-F112 HydrophobicContact CE3-CZ 4.21Å
109	M	69.1	Low	82.2	Confident	107 Å²	107	61.8 Å²	61.8	53%	0.527	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-11.1	176.4	-67.6	179.1	58.2	0	0	114	I105 F106 C107	I105-M109 WeakPolarHBondContact O-CG 3.39Å; I105-M109 PolarHBondContact O-N 3.09Å; F106-M109 WeakPolarHBondContact O-CB 3.39Å; F106-M109 PolarHBondContact O-N 2.94Å; C107-M109 PolarHBondContact O-N 2.9Å
110	F	67.2	Low	82.7	Confident	17 Å²	17	60.5 Å²	60.5	8%	0.075	31%	0.311	C	S	.	.	S	Bend	trans	-91.7	166.9	-175.8	-67.7	-82.4	0	0	0	113.1	A96 F106 C107 F112 Y169 Y174	A96-F110 HydrophobicContact CB-CB 4.38Å; F106-F110 WeakPolarHBondContact O-CD2 3.46Å; F106-F110 WeakPolarHBondContact O-CE2 3.46Å; C107-F110 PolarHBondContact O-N 2.83Å; F110-F112 VanDerWaalsContact O-CD1 3.28Å; F110-F112 WeakPolarHBondContact O-CD1 3.48Å; F110-F112 WeakPolarHBondContact O-CE1 3.35Å; F110-F112 WeakPolarHBondContact O-CZ 3.16Å; F110-Y169 AromaticContact CE1-CD1 3.69Å; F110-Y169 HydrophobicContact CE1-CD1 3.69Å; F110-Y169 HydrophobicContact CE1-CE1 4.01Å; F110-Y169 HydrophobicContact CE2-CD1 4.09Å; F110-Y169 HydrophobicContact CE2-CG 4.21Å; F110-Y169 AromaticContact CZ-CD1 3.17Å; F110-Y169 HydrophobicContact CZ-CD1 3.17Å; F110-Y169 AromaticContact CZ-CE1 3.83Å; F110-Y169 HydrophobicContact CZ-CE1 3.83Å; F110-Y169 AromaticContact CZ-CG 3.64Å; F110-Y169 HydrophobicContact CZ-CG 3.64Å; F110-Y174 VanDerWaalsContact CD1-O 3.23Å; F110-Y174 WeakPolarHBondContact CD1-O 3.4Å; F110-Y174 VanDerWaalsContact CE1-O 3.25Å; F110-Y174 WeakPolarHBondContact CE1-O 3.3Å
111	S	83.1	Confident	83.4	Confident	59 Å²	59	63.2 Å²	63.2	41%	0.413	32%	0.32	S	S	.	.			trans	-75.3	134.2	152.4	-62	0	0	0	0	107.2	D175	S111-D175 PolarHBondContact N-OD1 3.45Å; S111-D175 VanDerWaalsContact N-OD1 3.08Å; S111-D175 WeakPolarHBondContact O-CB 3.36Å
112	F	89.5	Confident	84.5	Confident	46 Å²	46	61.3 Å²	61.3	20%	0.202	32%	0.321	C	S	.	.			trans	-118.8	147.2	-179.5	8.3	-95	0	0	0	110	A96 R98 C107 W108 F110	A96-F112 WeakPolarHBondContact O-CA 3.35Å; R98-F112 HydrophobicContact CB-CD2 4.46Å; R98-F112 VanDerWaalsContact NH1-CE2 3.32Å; C107-F112 WeakPolarHBondContact O-CD1 3.43Å; C107-F112 WeakPolarHBondContact O-CE1 3.26Å; W108-F112 HydrophobicContact CE3-CE1 4.36Å; W108-F112 HydrophobicContact CE3-CZ 4.21Å; F110-F112 VanDerWaalsContact O-CD1 3.28Å; F110-F112 WeakPolarHBondContact O-CD1 3.48Å; F110-F112 WeakPolarHBondContact O-CE1 3.35Å; F110-F112 WeakPolarHBondContact O-CZ 3.16Å
113	Y	95.8	Very high	85.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-70.5	130.5	163.4	172.7	-106.4	0	0	0	109.9	V75 A96 R98 S115 Y121 D144 F158 E160	V75-Y113 HydrophobicContact CB-CD2 4.01Å; V75-Y113 HydrophobicContact CB-CE2 4.3Å; V75-Y113 HydrophobicContact CG1-CD2 3.79Å; V75-Y113 HydrophobicContact CG1-CE2 3.71Å; A96-Y113 PolarHBondContact O-N 2.86Å; R98-Y113 PolarHBondContact N-O 3.45Å; Y113-S115 WeakPolarHBondContact OH-CA 3.36Å; Y113-Y121 WeakPolarHBondContact OH-CD2 3.36Å; Y113-D144 PolarHBondContact OH-OD2 2.99Å; Y113-F158 AromaticContact CD1-CE2 3.72Å; Y113-F158 HydrophobicContact CD1-CE2 3.72Å; Y113-F158 AromaticContact CD1-CZ 4Å; Y113-F158 HydrophobicContact CD1-CZ 4Å; Y113-F158 AromaticContact CE1-CE2 3.67Å; Y113-F158 HydrophobicContact CE1-CE2 3.67Å; Y113-F158 AromaticContact CE1-CZ 3.56Å; Y113-F158 HydrophobicContact CE1-CZ 3.56Å; Y113-F158 HydrophobicContact CE2-CZ 4.23Å; Y113-F158 HydrophobicContact CG-CE2 4.32Å; Y113-F158 HydrophobicContact CG-CZ 4.46Å; Y113-F158 AromaticContact CZ-CZ 3.7Å; Y113-E160 HydrophobicContact CD1-CG 3.78Å; Y113-E160 HydrophobicContact CE1-CG 4.02Å; Y113-E160 WeakPolarHBondContact CE1-OE1 3.09Å
114	D	96.6	Very high	86.9	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.053	31%	0.311	C	S	.	.			trans	-118.2	95.6	178.8	-171.5	-15.1	0	0	0	109.4	Q80 R98 S116 K117	Q80-D114 PolarHBondContact NE2-O 3.18Å; R98-D114 HydrophobicContact CB-CB 3.92Å; R98-D114 HydrophobicContact CG-CB 4.28Å; D114-S116 PolarHBondContact O-N 1.99Å; D114-S116 WeakPolarHBondContact OD1-CB 3.14Å; D114-S116 PolarHBondContact OD1-N 2.9Å; D114-S116 PolarHBondContact OD1-OG 3.3Å; D114-K117 HydrophobicContact CB-CD 4.12Å; D114-K117 HydrophobicContact CB-CG 4.35Å; D114-K117 PolarHBondContact O-N 3.11Å; D114-K117 VanDerWaalsContact O-N 3.14Å; D114-K117 WeakPolarHBondContact OD2-CD 3.49Å; D114-K117 WeakPolarHBondContact OD2-CE 3.45Å; D114-K117 IonicContact OD2-NZ 3.77Å; D114-K117 PolarHBondContact OD2-NZ 3.01Å
115	S	97.7	Very high	88	Confident	11 Å²	11	58.5 Å²	58.5	8%	0.077	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-58.9	-29.8	179.2	39.1	0	0	0	0	113.1	Y113 K117 S118 E160	Y113-S115 WeakPolarHBondContact OH-CA 3.36Å; S115-K117 PolarHBondContact O-N 2.82Å; S115-K117 VanDerWaalsContact O-N 3.16Å; S115-S118 PolarHBondContact O-N 3.03Å; S115-S118 VanDerWaalsContact O-N 3.09Å; S115-E160 PolarHBondContact OG-OE1 3.31Å
116	S	97.5	Very high	89.4	Confident	103 Å²	103	54.9 Å²	54.9	72%	0.72	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-65.3	-19.8	179.7	77.7	0	0	0	0	113.6	D114	D114-S116 PolarHBondContact O-N 1.99Å; D114-S116 WeakPolarHBondContact OD1-CB 3.14Å; D114-S116 PolarHBondContact OD1-N 2.9Å; D114-S116 PolarHBondContact OD1-OG 3.3Å
117	K	97.8	Very high	90.9	Very high	127 Å²	127	56.2 Å²	56.2	55%	0.552	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-93.5	-9.5	178.1	-67.6	179.1	-178.8	135.7	0	113.2	P78 D114 S115	P78-K117 WeakPolarHBondContact CD-O 3.43Å; D114-K117 HydrophobicContact CB-CD 4.12Å; D114-K117 HydrophobicContact CB-CG 4.35Å; D114-K117 PolarHBondContact O-N 3.11Å; D114-K117 VanDerWaalsContact O-N 3.14Å; D114-K117 WeakPolarHBondContact OD2-CD 3.49Å; D114-K117 WeakPolarHBondContact OD2-CE 3.45Å; D114-K117 IonicContact OD2-NZ 3.77Å; D114-K117 PolarHBondContact OD2-NZ 3.01Å; S115-K117 PolarHBondContact O-N 2.82Å; S115-K117 VanDerWaalsContact O-N 3.16Å
118	S	98.5	Very high	92.2	Very high	12 Å²	12	56.2 Å²	56.2	8%	0.084	34%	0.335	C	S	.	.			trans	-98.7	120.1	-174.3	-175.4	0	0	0	0	112.1	G76 T77 S115 T120 Y121 D144	G76-S118 WeakPolarHBondContact CA-OG 3.38Å; T77-S118 PolarHBondContact N-OG 3.15Å; T77-S118 CarbonylContact O-C 3.46Å; T77-S118 WeakPolarHBondContact O-CA 3.02Å; S115-S118 PolarHBondContact O-N 3.03Å; S115-S118 VanDerWaalsContact O-N 3.09Å; S118-T120 VanDerWaalsContact C-N 3.26Å; S118-T120 PolarHBondContact O-N 2.97Å; S118-T120 PolarHBondContact OG-N 3.21Å; S118-T120 PolarHBondContact OG-OG1 3.31Å; S118-Y121 WeakPolarHBondContact O-CB 3.45Å; S118-Y121 PolarHBondContact O-N 2.77Å; S118-Y121 PolarHBondContact OG-N 2.93Å; S118-D144 WeakPolarHBondContact CB-OD2 3.33Å; S118-D144 PolarHBondContact OG-OD1 3.01Å; S118-D144 PolarHBondContact OG-OD2 2.86Å
119	S	98.5	Very high	93.3	Very high	98 Å²	98	57 Å²	57	69%	0.685	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.3	172.8	55.3	0	0	0	0	113.9	T77	T77-S119 WeakPolarHBondContact CB-OG 2.93Å; T77-S119 WeakPolarHBondContact CG2-OG 3.35Å; T77-S119 PolarHBondContact O-N 3.31Å; T77-S119 PolarHBondContact O-OG 3.17Å
120	T	98.6	Very high	94.1	Very high	43 Å²	43	52.6 Å²	52.6	26%	0.264	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	1.8	177.4	48.3	0	0	0	0	113.3	T77 S118 D144	T77-T120 WeakPolarHBondContact CB-OG1 3.39Å; T77-T120 PolarHBondContact N-OG1 3.25Å; T77-T120 VanDerWaalsContact OG1-CG2 3.28Å; T77-T120 WeakPolarHBondContact OG1-CG2 3Å; T77-T120 PolarHBondContact OG1-OG1 3.35Å; S118-T120 VanDerWaalsContact C-N 3.26Å; S118-T120 PolarHBondContact O-N 2.97Å; S118-T120 PolarHBondContact OG-N 3.21Å; S118-T120 PolarHBondContact OG-OG1 3.31Å; T120-D144 WeakPolarHBondContact CB-OD1 3.47Å; T120-D144 PolarHBondContact OG1-OD1 3.23Å
121	Y	98.7	Very high	94.8	Very high	68 Å²	68	55.7 Å²	55.7	27%	0.267	34%	0.342	S	S	.	.			trans	-66.6	136.9	176.1	166.7	-113.1	0	0	0	111.5	Y113 S118 A123 D144	Y113-Y121 WeakPolarHBondContact OH-CD2 3.36Å; S118-Y121 WeakPolarHBondContact O-CB 3.45Å; S118-Y121 PolarHBondContact O-N 2.77Å; S118-Y121 PolarHBondContact OG-N 2.93Å; Y121-A123 HydrophobicContact CE1-CB 4.17Å; Y121-A123 WeakPolarHBondContact OH-CA 3.38Å; Y121-A123 WeakPolarHBondContact OH-CB 3.39Å; Y121-D144 PolarHBondContact N-OD1 3.03Å
122	V	98.6	Very high	94.3	Very high	78 Å²	78	55.4 Å²	55.4	47%	0.473	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.3	171.6	179.2	0	0	0	0	108.1	V143	V122-V143 HydrophobicContact CB-CB 4.08Å; V122-V143 HydrophobicContact CB-CG1 4.39Å; V122-V143 PolarHBondContact N-O 2.85Å; V122-V143 PolarHBondContact O-N 2.86Å
123	A	98	Very high	93.6	Very high	73 Å²	73	54.6 Å²	54.6	60%	0.603	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	133.9	178	0	0	0	0	0	111.1	Y121	Y121-A123 HydrophobicContact CE1-CB 4.17Å; Y121-A123 WeakPolarHBondContact OH-CA 3.38Å; Y121-A123 WeakPolarHBondContact OH-CB 3.39Å
124	D	97.5	Very high	92.4	Very high	63 Å²	63	58.8 Å²	58.8	34%	0.337	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-55.7	166.7	175.4	-38.9	0	0	0	108.6	S126 W141 K190	D124-S126 PolarHBondContact O-N 2.92Å; D124-S126 VanDerWaalsContact OD1-CB 3.24Å; D124-S126 WeakPolarHBondContact OD1-CB 3.41Å; D124-S126 PolarHBondContact OD1-N 3.49Å; D124-S126 VanDerWaalsContact OD1-N 3.09Å; D124-S126 PolarHBondContact OD1-OG 3.17Å; D124-W141 HydrophobicContact CB-CB 4.08Å; D124-W141 WeakPolarHBondContact CB-O 2.95Å; D124-K190 IonicContact OD1-NZ 2.6Å; D124-K190 IonicContact OD2-NZ 2.75Å; D124-K190 PolarHBondContact OD2-NZ 2.74Å
125	G	95.5	Very high	91.4	Very high	49 Å²	49	59.5 Å²	59.5	51%	0.505	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76.5	-5.8	170.9	0	0	0	0	0	115	W141	G125-W141 PolarHBondContact N-O 3.08Å
126	S	97.2	Very high	90.8	Very high	49 Å²	49	64.1 Å²	64.1	34%	0.343	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	144	174	59.5	0	0	0	0	111.3	D124 F140 W141	D124-S126 PolarHBondContact O-N 2.92Å; D124-S126 VanDerWaalsContact OD1-CB 3.24Å; D124-S126 WeakPolarHBondContact OD1-CB 3.41Å; D124-S126 PolarHBondContact OD1-N 3.49Å; D124-S126 VanDerWaalsContact OD1-N 3.09Å; D124-S126 PolarHBondContact OD1-OG 3.17Å; S126-F140 CarbonylContact O-C 3.51Å; S126-F140 VanDerWaalsContact O-CA 3.28Å; S126-F140 WeakPolarHBondContact O-CA 3.4Å; S126-W141 PolarHBondContact O-N 3.14Å; S126-W141 VanDerWaalsContact OG-CD1 3.26Å
127	S	95.9	Very high	90.2	Very high	70 Å²	70	59.7 Å²	59.7	49%	0.49	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	143.9	-173.8	-166.1	0	0	0	0	112.4	H129	S127-H129 PolarHBondContact OG-CD2 3.07Å; S127-H129 PolarHBondContact OG-NE2 2.76Å
128	Y	95.3	Very high	89.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.9	171.2	177	-93.6	0	0	0	110.7	D92 V130 S138 G139 W141 A159 M161 F188	D92-Y128 HydrophobicContact CB-CE2 4.1Å; D92-Y128 WeakPolarHBondContact CB-OH 3.42Å; Y128-V130 HydrophobicContact CD1-CG1 4.45Å; Y128-V130 HydrophobicContact CE1-CB 3.88Å; Y128-V130 HydrophobicContact CE1-CG1 3.42Å; Y128-V130 VanDerWaalsContact CE1-CG1 3.42Å; Y128-V130 WeakPolarHBondContact OH-CG1 3.35Å; Y128-S138 WeakPolarHBondContact O-CA 3.28Å; Y128-G139 PolarHBondContact N-O 3.22Å; Y128-G139 PolarHBondContact O-N 3.06Å; Y128-W141 AromaticContact CD2-CE2 3.58Å; Y128-W141 HydrophobicContact CD2-CH2 4.13Å; Y128-W141 AromaticContact CD2-CZ2 3.33Å; Y128-W141 HydrophobicContact CD2-CZ2 3.33Å; Y128-W141 AromaticContact CD2-NE1 3.73Å; Y128-W141 HydrophobicContact CE2-CH2 4.1Å; Y128-W141 AromaticContact CE2-CZ2 3.65Å; Y128-W141 HydrophobicContact CE2-CZ2 3.65Å; Y128-W141 HydrophobicContact CG-CZ2 4.42Å; Y128-A159 HydrophobicContact CD1-CB 3.65Å; Y128-A159 HydrophobicContact CD2-CB 3.92Å; Y128-A159 HydrophobicContact CE1-CB 4.03Å; Y128-A159 HydrophobicContact CE2-CB 4.32Å; Y128-A159 HydrophobicContact CG-CB 3.51Å; Y128-M161 HydrophobicContact CD1-CE 3.37Å; Y128-M161 HydrophobicContact CD1-SD 3.85Å; Y128-M161 HydrophobicContact CE1-CE 3.65Å; Y128-M161 HydrophobicContact CE1-SD 3.75Å; Y128-M161 HydrophobicContact CG-CE 4.27Å; Y128-F188 AromaticContact CD2-CD2 3.99Å; Y128-F188 HydrophobicContact CD2-CD2 3.99Å; Y128-F188 HydrophobicContact CD2-CE1 4.43Å; Y128-F188 AromaticContact CD2-CE2 3.44Å; Y128-F188 HydrophobicContact CD2-CE2 3.44Å; Y128-F188 VanDerWaalsContact CD2-CE2 3.44Å; Y128-F188 AromaticContact CD2-CZ 3.71Å; Y128-F188 HydrophobicContact CD2-CZ 3.71Å; Y128-F188 AromaticContact CE2-CD2 3.93Å; Y128-F188 HydrophobicContact CE2-CD2 3.93Å; Y128-F188 AromaticContact CE2-CE2 3.3Å; Y128-F188 HydrophobicContact CE2-CE2 3.3Å; Y128-F188 AromaticContact CE2-CZ 3.95Å; Y128-F188 HydrophobicContact CE2-CZ 3.95Å
129	H	92.4	Very high	89.7	Confident	115 Å²	115	55.3 Å²	55.3	53%	0.532	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	130.3	174.7	-63.3	-84.1	0	0	0	110	S127 S138 F188	S127-H129 PolarHBondContact OG-CD2 3.07Å; S127-H129 PolarHBondContact OG-NE2 2.76Å; H129-S138 VanDerWaalsContact ND1-CB 3.31Å; H129-S138 WeakPolarHBondContact ND1-CB 3.45Å; H129-F188 WeakPolarHBondContact O-CZ 3.45Å
130	V	86	Confident	89.6	Confident	13 Å²	13	52.2 Å²	52.2	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	146.2	176.4	68.8	0	0	0	0	109.9	Y128 Y132 Y137	Y128-V130 HydrophobicContact CD1-CG1 4.45Å; Y128-V130 HydrophobicContact CE1-CB 3.88Å; Y128-V130 HydrophobicContact CE1-CG1 3.42Å; Y128-V130 VanDerWaalsContact CE1-CG1 3.42Å; Y128-V130 WeakPolarHBondContact OH-CG1 3.35Å; V130-Y132 HydrophobicContact CB-CE2 4.3Å; V130-Y132 HydrophobicContact CG1-CD2 3.82Å; V130-Y132 HydrophobicContact CG1-CE2 3.39Å; V130-Y132 HydrophobicContact CG2-CD2 4.28Å; V130-Y132 HydrophobicContact CG2-CE1 4.29Å; V130-Y132 HydrophobicContact CG2-CE2 3.9Å; V130-Y137 HydrophobicContact CG1-CG 4.48Å; V130-Y137 PolarHBondContact N-O 3.12Å; V130-Y137 PolarHBondContact O-N 2.93Å
131	T	81.6	Confident	89.6	Confident	83 Å²	83	50.4 Å²	50.4	51%	0.509	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.1	171.3	-49.9	0	0	0	0	106.8	S135 N136	T131-S135 CarbonylContact C-O 3.59Å; T131-S135 WeakPolarHBondContact CA-O 2.9Å; T131-N136 PolarHBondContact OG1-OD1 3.12Å
132	Y	73.7	Confident	89.6	Confident	52 Å²	52	47.1 Å²	47.1	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125	167.7	-66.6	-73.6	0	0	0	107.7	W94 V130 D134 S135 Y137	W94-Y132 HydrophobicContact CZ2-CE2 4.37Å; W94-Y132 AromaticContact NE1-CE2 3.35Å; W94-Y132 VanDerWaalsContact NE1-CE2 3.35Å; W94-Y132 AromaticContact NE1-CZ 3.63Å; W94-Y132 PolarHBondContact NE1-OH 3.2Å; V130-Y132 HydrophobicContact CB-CE2 4.3Å; V130-Y132 HydrophobicContact CG1-CD2 3.82Å; V130-Y132 HydrophobicContact CG1-CE2 3.39Å; V130-Y132 HydrophobicContact CG2-CD2 4.28Å; V130-Y132 HydrophobicContact CG2-CE1 4.29Å; V130-Y132 HydrophobicContact CG2-CE2 3.9Å; Y132-D134 PolarHBondContact O-N 2.78Å; Y132-S135 PolarHBondContact N-O 2.8Å; Y132-S135 PolarHBondContact O-N 3.18Å; Y132-S135 VanDerWaalsContact O-O 3.12Å; Y132-Y137 AromaticContact CD2-CD2 3.7Å; Y132-Y137 HydrophobicContact CD2-CD2 3.7Å; Y132-Y137 AromaticContact CD2-CE2 3.82Å; Y132-Y137 HydrophobicContact CD2-CE2 3.82Å; Y132-Y137 HydrophobicContact CD2-CG 4.29Å; Y132-Y137 HydrophobicContact CG-CE2 4.34Å
133	L	73.2	Confident	89.6	Confident	29 Å²	29	44.4 Å²	44.4	15%	0.152	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	-122	-173.3	-53.3	172.5	0	0	0	111.2	Y35 Y38 F39	Y35-L133 HydrophobicContact CD1-CD1 4.19Å; Y35-L133 HydrophobicContact CD1-CD2 4.47Å; Y35-L133 HydrophobicContact CD2-CD1 3.57Å; Y35-L133 HydrophobicContact CE1-CD1 3.86Å; Y35-L133 HydrophobicContact CE1-CD2 4.38Å; Y35-L133 HydrophobicContact CE2-CD1 3.25Å; Y35-L133 HydrophobicContact CG-CD1 4.03Å; Y38-L133 HydrophobicContact CD1-CD2 3.29Å; Y38-L133 HydrophobicContact CD2-CB 4.01Å; Y38-L133 HydrophobicContact CD2-CD2 4.19Å; Y38-L133 HydrophobicContact CE1-CD2 3.55Å; Y38-L133 HydrophobicContact CE2-CB 4.02Å; Y38-L133 HydrophobicContact CE2-CD2 4.41Å; Y38-L133 WeakPolarHBondContact CE2-O 3.16Å; Y38-L133 HydrophobicContact CG-CB 4.27Å; Y38-L133 HydrophobicContact CG-CD2 3.62Å; Y38-L133 VanDerWaalsContact CZ-CA 3.43Å; Y38-L133 PolarHBondContact OH-O 2.85Å; F39-L133 HydrophobicContact CE2-CD2 3.65Å; F39-L133 HydrophobicContact CZ-CD2 3.65Å
134	D	72.3	Confident	89.6	Confident	89 Å²	89	41 Å²	41	48%	0.476	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	8.5	175.6	-66.8	-31.9	0	0	0	112.1	Y38 K43 Y132	Y38-D134 VanDerWaalsContact CE2-OD1 3.3Å; Y38-D134 WeakPolarHBondContact CE2-OD1 3.5Å; K43-D134 IonicContact NZ-OD2 2.83Å; K43-D134 PolarHBondContact NZ-OD2 2.85Å; Y132-D134 PolarHBondContact O-N 2.78Å
135	S	75.2	Confident	89.7	Confident	25 Å²	25	38.2 Å²	38.2	18%	0.175	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.2	-177.1	-79.5	0	0	0	0	112.9	T131 Y132 Y137 F165	T131-S135 CarbonylContact C-O 3.59Å; T131-S135 WeakPolarHBondContact CA-O 2.9Å; Y132-S135 PolarHBondContact N-O 2.8Å; Y132-S135 PolarHBondContact O-N 3.18Å; Y132-S135 VanDerWaalsContact O-O 3.12Å; S135-Y137 WeakPolarHBondContact O-CD2 3.07Å; S135-Y137 WeakPolarHBondContact O-CE2 3.38Å; S135-F165 PolarHBondContact OG-O 3.49Å
136	N	84	Confident	89.8	Confident	108 Å²	108	35.9 Å²	35.9	58%	0.578	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.5	176	-69.2	-61.8	0	0	0	111.2	T131	T131-N136 PolarHBondContact OG1-OD1 3.12Å
137	Y	85.6	Confident	89.8	Confident	10 Å²	10	36.2 Å²	36.2	4%	0.039	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.5	178.1	-59	-106.5	0	0	0	107.8	V130 Y132 S135 I164 N166 Y169	V130-Y137 HydrophobicContact CG1-CG 4.48Å; V130-Y137 PolarHBondContact N-O 3.12Å; V130-Y137 PolarHBondContact O-N 2.93Å; Y132-Y137 AromaticContact CD2-CD2 3.7Å; Y132-Y137 HydrophobicContact CD2-CD2 3.7Å; Y132-Y137 AromaticContact CD2-CE2 3.82Å; Y132-Y137 HydrophobicContact CD2-CE2 3.82Å; Y132-Y137 HydrophobicContact CD2-CG 4.29Å; Y132-Y137 HydrophobicContact CG-CE2 4.34Å; S135-Y137 WeakPolarHBondContact O-CD2 3.07Å; S135-Y137 WeakPolarHBondContact O-CE2 3.38Å; Y137-I164 HydrophobicContact CD1-CB 4.34Å; Y137-I164 HydrophobicContact CD1-CG1 4.44Å; Y137-I164 HydrophobicContact CD1-CG2 3.8Å; Y137-I164 HydrophobicContact CE1-CG2 3.55Å; Y137-N166 PolarHBondContact OH-ND2 3.22Å; Y137-N166 VanDerWaalsContact OH-ND2 3.14Å; Y137-Y169 HydrophobicContact CE1-CE2 4.14Å
138	S	91.3	Very high	89.7	Confident	36 Å²	36	32.9 Å²	32.9	25%	0.252	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	149.9	179	63.1	0	0	0	0	112.9	Y128 H129 R162 S163	Y128-S138 WeakPolarHBondContact O-CA 3.28Å; H129-S138 VanDerWaalsContact ND1-CB 3.31Å; H129-S138 WeakPolarHBondContact ND1-CB 3.45Å; S138-R162 PolarHBondContact O-N 2.84Å; S138-S163 PolarHBondContact N-O 2.9Å; S138-S163 PolarHBondContact O-N 2.94Å; S138-S163 VanDerWaalsContact O-N 3.13Å
139	G	94.4	Very high	89.6	Confident	10 Å²	10	37.9 Å²	37.9	10%	0.103	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	-153.3	-173.7	0	0	0	0	0	111.4	Y128 E160	Y128-G139 PolarHBondContact N-O 3.22Å; Y128-G139 PolarHBondContact O-N 3.06Å; G139-E160 WeakPolarHBondContact CA-O 3.25Å
140	F	97	Very high	89.5	Confident	33 Å²	33	36 Å²	36	15%	0.145	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.8	178.2	59.2	-84.4	0	0	0	110.1	N99 S126 S142 A159 E160 R162	N99-F140 HydrophobicContact CB-CE1 4.45Å; S126-F140 CarbonylContact O-C 3.51Å; S126-F140 VanDerWaalsContact O-CA 3.28Å; S126-F140 WeakPolarHBondContact O-CA 3.4Å; F140-S142 WeakPolarHBondContact CE2-OG 3.49Å; F140-A159 CarbonylContact O-C 3.48Å; F140-A159 VanDerWaalsContact O-CA 3.3Å; F140-A159 WeakPolarHBondContact O-CA 3.31Å; F140-E160 HydrophobicContact CD1-CB 4.32Å; F140-E160 HydrophobicContact CD2-CB 4.36Å; F140-E160 HydrophobicContact CE1-CB 3.86Å; F140-E160 HydrophobicContact CE2-CB 3.91Å; F140-E160 HydrophobicContact CE2-CG 4.24Å; F140-E160 HydrophobicContact CZ-CB 3.64Å; F140-E160 HydrophobicContact CZ-CG 4.17Å; F140-E160 PolarHBondContact N-O 3.41Å; F140-E160 PolarHBondContact O-N 3.39Å; F140-R162 HydrophobicContact CD1-CG 4.01Å; F140-R162 HydrophobicContact CE1-CG 3.8Å
141	W	98.1	Very high	89.8	Confident	5 Å²	5	35.6 Å²	35.6	2%	0.019	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	143.6	176	-72.6	100.9	0	0	0	111.5	D124 G125 S126 Y128 F158 A159 F188 K190	D124-W141 HydrophobicContact CB-CB 4.08Å; D124-W141 WeakPolarHBondContact CB-O 2.95Å; G125-W141 PolarHBondContact N-O 3.08Å; S126-W141 PolarHBondContact O-N 3.14Å; S126-W141 VanDerWaalsContact OG-CD1 3.26Å; Y128-W141 AromaticContact CD2-CE2 3.58Å; Y128-W141 HydrophobicContact CD2-CH2 4.13Å; Y128-W141 AromaticContact CD2-CZ2 3.33Å; Y128-W141 HydrophobicContact CD2-CZ2 3.33Å; Y128-W141 AromaticContact CD2-NE1 3.73Å; Y128-W141 HydrophobicContact CE2-CH2 4.1Å; Y128-W141 AromaticContact CE2-CZ2 3.65Å; Y128-W141 HydrophobicContact CE2-CZ2 3.65Å; Y128-W141 HydrophobicContact CG-CZ2 4.42Å; W141-F158 VanDerWaalsContact CE3-C 3.42Å; W141-A159 HydrophobicContact CD2-CB 4.33Å; W141-A159 HydrophobicContact CE3-CB 4.21Å; W141-A159 HydrophobicContact CZ3-CB 4.37Å; W141-F188 HydrophobicContact CH2-CD2 4.49Å; W141-F188 HydrophobicContact CZ2-CB 3.67Å; W141-F188 AromaticContact CZ2-CD2 3.53Å; W141-F188 HydrophobicContact CZ2-CD2 3.53Å; W141-F188 HydrophobicContact CZ2-CE2 4.21Å; W141-F188 AromaticContact CZ2-CG 3.73Å; W141-F188 HydrophobicContact CZ2-CG 3.73Å; W141-F188 AromaticContact NE1-CG 3.92Å; W141-K190 HydrophobicContact CD2-CD 4.3Å; W141-K190 HydrophobicContact CD2-CG 3.95Å; W141-K190 HydrophobicContact CE3-CD 4.33Å; W141-K190 HydrophobicContact CE3-CG 3.84Å; W141-K190 HydrophobicContact CH2-CB 4.15Å; W141-K190 HydrophobicContact CH2-CG 3.73Å; W141-K190 HydrophobicContact CZ2-CG 3.8Å; W141-K190 HydrophobicContact CZ3-CB 4.14Å; W141-K190 HydrophobicContact CZ3-CG 3.74Å
142	S	98.6	Very high	90.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	160.7	176	-73.5	0	0	0	0	109.1	F140 S157 F158 E160	F140-S142 WeakPolarHBondContact CE2-OG 3.49Å; S142-S157 WeakPolarHBondContact O-CA 3.3Å; S142-F158 PolarHBondContact N-O 2.97Å; S142-F158 PolarHBondContact O-N 3.4Å; S142-E160 WeakPolarHBondContact CB-OE1 3.09Å; S142-E160 PolarHBondContact OG-OE1 3Å
143	V	98.7	Very high	91.5	Very high	21 Å²	21	31.8 Å²	31.8	13%	0.127	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.6	174.8	176.3	0	0	0	0	108.9	V122 N155 Q156	V122-V143 HydrophobicContact CB-CB 4.08Å; V122-V143 HydrophobicContact CB-CG1 4.39Å; V122-V143 PolarHBondContact N-O 2.85Å; V122-V143 PolarHBondContact O-N 2.86Å; V143-N155 HydrophobicContact CG1-CB 4.31Å; V143-Q156 WeakPolarHBondContact CA-O 3.16Å
144	D	98.7	Very high	92.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	-173.6	172.7	-150.2	-26.2	0	0	0	111.2	V75 G76 Y113 S118 T120 Y121 Q156 F158	V75-D144 HydrophobicContact CG1-CB 4.24Å; G76-D144 VanDerWaalsContact CA-CG 3.5Å; G76-D144 WeakPolarHBondContact CA-OD1 3.06Å; G76-D144 WeakPolarHBondContact CA-OD2 3.1Å; Y113-D144 PolarHBondContact OH-OD2 2.99Å; S118-D144 WeakPolarHBondContact CB-OD2 3.33Å; S118-D144 PolarHBondContact OG-OD1 3.01Å; S118-D144 PolarHBondContact OG-OD2 2.86Å; T120-D144 WeakPolarHBondContact CB-OD1 3.47Å; T120-D144 PolarHBondContact OG1-OD1 3.23Å; Y121-D144 PolarHBondContact N-OD1 3.03Å; D144-Q156 PolarHBondContact N-O 2.85Å; D144-Q156 VanDerWaalsContact N-O 3.11Å; D144-Q156 PolarHBondContact O-N 2.86Å; D144-F158 HydrophobicContact CB-CE1 3.66Å; D144-F158 HydrophobicContact CB-CZ 3.99Å
145	T	98.3	Very high	93.8	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.6	176	-57.6	0	0	0	0	110.3	V75 G76 R147 V152 I153 R154	V75-T145 CarbonylContact C-O 3.56Å; V75-T145 WeakPolarHBondContact CA-O 3.31Å; G76-T145 PolarHBondContact N-O 3.22Å; T145-R147 HydrophobicContact CG2-CG 4.34Å; T145-V152 HydrophobicContact CG2-CG1 3.62Å; T145-I153 CarbonylContact C-O 3.56Å; T145-I153 VanDerWaalsContact CA-O 3.3Å; T145-I153 WeakPolarHBondContact CA-O 3.49Å; T145-R154 HydrophobicContact CG2-CG 4.43Å
146	I	98.1	Very high	94.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	141.6	167.8	-61.2	-169.7	0	0	0	108.9	I73 S74 V75 T93 F95 I148 I153 Q156	I73-I146 HydrophobicContact CD1-CG2 4.14Å; S74-I146 CarbonylContact O-C 3.54Å; V75-I146 HydrophobicContact CG1-CG1 4.44Å; V75-I146 HydrophobicContact CG2-CG1 4.19Å; T93-I146 HydrophobicContact CG2-CD1 4.3Å; F95-I146 HydrophobicContact CE2-CD1 4.03Å; F95-I146 HydrophobicContact CZ-CD1 3.77Å; I146-I148 HydrophobicContact CG2-CD1 4.38Å; I146-I148 HydrophobicContact CG2-CG1 3.96Å; I146-I153 HydrophobicContact CB-CB 4.3Å; I146-I153 HydrophobicContact CG2-CD1 4.41Å; I146-I153 PolarHBondContact N-O 3.04Å; I146-I153 PolarHBondContact O-N 3.41Å; I146-Q156 HydrophobicContact CD1-CB 4.16Å; I146-Q156 HydrophobicContact CD1-CG 3.55Å; I146-Q156 HydrophobicContact CG1-CB 4Å; I146-Q156 HydrophobicContact CG1-CG 3.98Å
147	R	96.5	Very high	95.6	Very high	55 Å²	55	32.6 Å²	32.6	21%	0.208	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.1	172.7	-64.3	-179.8	-177.3	77	-9.1	109.9	S74 G76 T77 T145 L151 V152	S74-R147 PolarHBondContact N-O 3Å; S74-R147 PolarHBondContact O-N 2.73Å; G76-R147 PolarHBondContact O-NH1 2.99Å; T77-R147 PolarHBondContact OG1-NH2 3.29Å; T145-R147 HydrophobicContact CG2-CG 4.34Å; R147-L151 VanDerWaalsContact CA-O 3.24Å; R147-L151 WeakPolarHBondContact CA-O 3.47Å; R147-V152 HydrophobicContact CG-CG1 4.45Å; R147-V152 HydrophobicContact CG-CG2 4.32Å
148	I	95.2	Very high	96.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	101.2	177.7	-52.8	-176.3	0	0	0	106.3	V18 I20 I73 I146 S150 L151 I153 I178 M193 L226	V18-I148 HydrophobicContact CG1-CG2 4.48Å; I20-I148 HydrophobicContact CD1-CG2 3.36Å; I20-I148 HydrophobicContact CG1-CG2 3.67Å; I73-I148 HydrophobicContact CB-CG1 4.37Å; I73-I148 HydrophobicContact CG2-CD1 4.21Å; I73-I148 HydrophobicContact CG2-CG1 3.83Å; I146-I148 HydrophobicContact CG2-CD1 4.38Å; I146-I148 HydrophobicContact CG2-CG1 3.96Å; I148-S150 PolarHBondContact O-N 3.1Å; I148-S150 VanDerWaalsContact O-N 3.11Å; I148-L151 HydrophobicContact CB-CB 4.42Å; I148-L151 PolarHBondContact N-O 2.9Å; I148-L151 WeakPolarHBondContact O-CB 3.39Å; I148-L151 PolarHBondContact O-N 2.76Å; I148-I153 HydrophobicContact CD1-CD1 4.17Å; I148-I178 HydrophobicContact CD1-CD1 4.48Å; I148-M193 HydrophobicContact CD1-CE 3.91Å; I148-M193 HydrophobicContact CD1-SD 4.21Å; I148-L226 HydrophobicContact CD1-CD1 4.36Å
149	N	91.8	Very high	96.5	Very high	106 Å²	106	30.4 Å²	30.4	57%	0.567	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	-115.2	-172	-62.6	-19.8	0	0	0	112.1	V18 K19 L151	V18-N149 HydrophobicContact CG1-CB 3.92Å; K19-N149 PolarHBondContact O-ND2 3.39Å; N149-L151 VanDerWaalsContact C-N 3.33Å
150	S	90.1	Very high	96.5	Very high	76 Å²	76	30 Å²	30	53%	0.531	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-19.9	177.6	54.7	0	0	0	0	113.8	E16 V18 I148	E16-S150 WeakPolarHBondContact OE1-CB 3.28Å; E16-S150 PolarHBondContact OE1-OG 3.46Å; V18-S150 WeakPolarHBondContact CG2-OG 3.48Å; I148-S150 PolarHBondContact O-N 3.1Å; I148-S150 VanDerWaalsContact O-N 3.11Å
151	L	93	Very high	96.2	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.016	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136.5	-174.5	-54.1	177.2	0	0	0	111.4	E16 V18 R147 I148 N149 L197 V202 M204 L226	E16-L151 HydrophobicContact CG-CD2 4.46Å; E16-L151 WeakPolarHBondContact OE1-CD2 3.39Å; V18-L151 HydrophobicContact CB-CD1 3.96Å; V18-L151 HydrophobicContact CB-CG 4.18Å; V18-L151 HydrophobicContact CG1-CD1 4.14Å; V18-L151 HydrophobicContact CG1-CG 4.25Å; V18-L151 HydrophobicContact CG2-CD1 3.91Å; V18-L151 HydrophobicContact CG2-CD2 3.68Å; V18-L151 HydrophobicContact CG2-CG 3.65Å; R147-L151 VanDerWaalsContact CA-O 3.24Å; R147-L151 WeakPolarHBondContact CA-O 3.47Å; I148-L151 HydrophobicContact CB-CB 4.42Å; I148-L151 PolarHBondContact N-O 2.9Å; I148-L151 WeakPolarHBondContact O-CB 3.39Å; I148-L151 PolarHBondContact O-N 2.76Å; N149-L151 VanDerWaalsContact C-N 3.33Å; L151-L197 HydrophobicContact CB-CD1 4.1Å; L151-L197 HydrophobicContact CD1-CD1 3.89Å; L151-L197 HydrophobicContact CD1-CD2 3.86Å; L151-L197 HydrophobicContact CD2-CD1 4.19Å; L151-L197 HydrophobicContact CG-CD1 4.27Å; L151-V202 HydrophobicContact CD2-CG1 3.89Å; L151-M204 HydrophobicContact CD1-CE 4.12Å; L151-M204 HydrophobicContact CD2-CE 4.12Å; L151-L226 HydrophobicContact CD1-CD1 3.57Å
152	V	94.5	Very high	95.8	Very high	55 Å²	55	34 Å²	34	33%	0.333	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	108.6	172.1	-175.7	0	0	0	0	108.6	T145 R147 R154	T145-V152 HydrophobicContact CG2-CG1 3.62Å; R147-V152 HydrophobicContact CG-CG1 4.45Å; R147-V152 HydrophobicContact CG-CG2 4.32Å; V152-R154 HydrophobicContact CG1-CG 4.23Å
153	I	96	Very high	95.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	101.1	-176.9	-50.2	171.5	0	0	0	107.6	T145 I146 I148 Q156 M193 N196 L197	T145-I153 CarbonylContact C-O 3.56Å; T145-I153 VanDerWaalsContact CA-O 3.3Å; T145-I153 WeakPolarHBondContact CA-O 3.49Å; I146-I153 HydrophobicContact CB-CB 4.3Å; I146-I153 HydrophobicContact CG2-CD1 4.41Å; I146-I153 PolarHBondContact N-O 3.04Å; I146-I153 PolarHBondContact O-N 3.41Å; I148-I153 HydrophobicContact CD1-CD1 4.17Å; I153-Q156 HydrophobicContact CG2-CB 4.28Å; I153-M193 HydrophobicContact CD1-CG 3.67Å; I153-M193 HydrophobicContact CD1-SD 3.37Å; I153-M193 WeakPolarHBondContact CD1-SD 3.45Å; I153-N196 HydrophobicContact CG2-CB 4.44Å; I153-N196 WeakPolarHBondContact CG2-ND2 3.4Å; I153-L197 HydrophobicContact CD1-CB 4.14Å; I153-L197 HydrophobicContact CD1-CD1 4.01Å; I153-L197 HydrophobicContact CG1-CB 4.22Å; I153-L197 HydrophobicContact CG1-CD1 3.62Å; I153-L197 HydrophobicContact CG1-CG 4.49Å
154	R	97.3	Very high	94.1	Very high	133 Å²	133	34.1 Å²	34.1	50%	0.502	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	156.4	-178.5	-59.7	178.1	-178.1	-85.9	1.6	110.5	T145 V152 Q156 N196 N200	T145-R154 HydrophobicContact CG2-CG 4.43Å; V152-R154 HydrophobicContact CG1-CG 4.23Å; R154-Q156 PolarHBondContact O-N 2.98Å; R154-N196 PolarHBondContact O-ND2 3.16Å; R154-N200 PolarHBondContact O-ND2 2.84Å
155	N	97.5	Very high	92.5	Very high	112 Å²	112	39 Å²	39	60%	0.599	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	53.8	37.6	174.8	-55	-35.4	0	0	0	113.3	V143 S157	V143-N155 HydrophobicContact CG1-CB 4.31Å; N155-S157 PolarHBondContact O-N 3.19Å
156	Q	98.3	Very high	90.9	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122	178	-177.2	54.7	48.6	0	0	109.9	V143 D144 I146 I153 R154 F158 I191 N196	V143-Q156 WeakPolarHBondContact CA-O 3.16Å; D144-Q156 PolarHBondContact N-O 2.85Å; D144-Q156 VanDerWaalsContact N-O 3.11Å; D144-Q156 PolarHBondContact O-N 2.86Å; I146-Q156 HydrophobicContact CD1-CB 4.16Å; I146-Q156 HydrophobicContact CD1-CG 3.55Å; I146-Q156 HydrophobicContact CG1-CB 4Å; I146-Q156 HydrophobicContact CG1-CG 3.98Å; I153-Q156 HydrophobicContact CG2-CB 4.28Å; R154-Q156 PolarHBondContact O-N 2.98Å; Q156-F158 WeakPolarHBondContact O-CD1 3.33Å; Q156-I191 PolarHBondContact NE2-O 3.09Å; Q156-N196 PolarHBondContact OE1-ND2 2.92Å
157	S	98.2	Very high	88.9	Confident	23 Å²	23	49.7 Å²	49.7	16%	0.161	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	134	168.6	-56.9	0	0	0	0	110.7	S142 N155	S142-S157 WeakPolarHBondContact O-CA 3.3Å; N155-S157 PolarHBondContact O-N 3.19Å
158	F	98.3	Very high	87.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	162	170	59.4	-90.5	0	0	0	109.1	V75 T93 F95 Y113 W141 S142 D144 Q156 E160	V75-F158 HydrophobicContact CG1-CE1 3.92Å; V75-F158 HydrophobicContact CG1-CZ 3.94Å; T93-F158 HydrophobicContact CG2-CB 3.68Å; T93-F158 CarbonylContact O-C 3.55Å; T93-F158 WeakPolarHBondContact O-CA 3.21Å; T93-F158 WeakPolarHBondContact O-CB 3.3Å; F95-F158 HydrophobicContact CD2-CB 4.25Å; F95-F158 HydrophobicContact CD2-CD1 4.32Å; F95-F158 AromaticContact CD2-CD2 3.36Å; F95-F158 HydrophobicContact CD2-CD2 3.36Å; F95-F158 AromaticContact CD2-CE2 3.68Å; F95-F158 HydrophobicContact CD2-CE2 3.68Å; F95-F158 AromaticContact CD2-CG 3.72Å; F95-F158 HydrophobicContact CD2-CG 3.72Å; F95-F158 HydrophobicContact CD2-CZ 4.29Å; F95-F158 HydrophobicContact CE2-CB 3.91Å; F95-F158 AromaticContact CE2-CD1 3.89Å; F95-F158 HydrophobicContact CE2-CD1 3.89Å; F95-F158 AromaticContact CE2-CD2 3.75Å; F95-F158 HydrophobicContact CE2-CD2 3.75Å; F95-F158 HydrophobicContact CE2-CE1 4.34Å; F95-F158 HydrophobicContact CE2-CE2 4.22Å; F95-F158 AromaticContact CE2-CG 3.56Å; F95-F158 HydrophobicContact CE2-CG 3.56Å; F95-F158 HydrophobicContact CE2-CZ 4.49Å; F95-F158 HydrophobicContact CG-CD2 4.41Å; Y113-F158 AromaticContact CD1-CE2 3.72Å; Y113-F158 HydrophobicContact CD1-CE2 3.72Å; Y113-F158 AromaticContact CD1-CZ 4Å; Y113-F158 HydrophobicContact CD1-CZ 4Å; Y113-F158 AromaticContact CE1-CE2 3.67Å; Y113-F158 HydrophobicContact CE1-CE2 3.67Å; Y113-F158 AromaticContact CE1-CZ 3.56Å; Y113-F158 HydrophobicContact CE1-CZ 3.56Å; Y113-F158 HydrophobicContact CE2-CZ 4.23Å; Y113-F158 HydrophobicContact CG-CE2 4.32Å; Y113-F158 HydrophobicContact CG-CZ 4.46Å; Y113-F158 AromaticContact CZ-CZ 3.7Å; W141-F158 VanDerWaalsContact CE3-C 3.42Å; S142-F158 PolarHBondContact N-O 2.97Å; S142-F158 PolarHBondContact O-N 3.4Å; D144-F158 HydrophobicContact CB-CE1 3.66Å; D144-F158 HydrophobicContact CB-CZ 3.99Å; Q156-F158 WeakPolarHBondContact O-CD1 3.33Å; F158-E160 HydrophobicContact CD2-CG 4.47Å; F158-E160 HydrophobicContact CE2-CG 3.91Å
159	A	97.3	Very high	85.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134.6	175.9	0	0	0	0	0	111.4	T93 W94 F95 Y128 F140 W141 M161	T93-A159 PolarHBondContact O-N 3.01Å; W94-A159 CarbonylContact C-O 3.51Å; W94-A159 WeakPolarHBondContact CA-O 3.34Å; W94-A159 HydrophobicContact CB-CB 4.12Å; W94-A159 WeakPolarHBondContact CB-O 3.44Å; F95-A159 PolarHBondContact N-O 3.29Å; Y128-A159 HydrophobicContact CD1-CB 3.65Å; Y128-A159 HydrophobicContact CD2-CB 3.92Å; Y128-A159 HydrophobicContact CE1-CB 4.03Å; Y128-A159 HydrophobicContact CE2-CB 4.32Å; Y128-A159 HydrophobicContact CG-CB 3.51Å; F140-A159 CarbonylContact O-C 3.48Å; F140-A159 VanDerWaalsContact O-CA 3.3Å; F140-A159 WeakPolarHBondContact O-CA 3.31Å; W141-A159 HydrophobicContact CD2-CB 4.33Å; W141-A159 HydrophobicContact CE3-CB 4.21Å; W141-A159 HydrophobicContact CZ3-CB 4.37Å; A159-M161 HydrophobicContact CB-CE 3.18Å
160	E	95.6	Very high	83.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	105.2	171.8	-80.9	-166.3	-118.8	0	0	109.5	S97 Y113 S115 G139 F140 S142 F158 R162	S97-E160 PolarHBondContact OG-OE2 2.84Å; Y113-E160 HydrophobicContact CD1-CG 3.78Å; Y113-E160 HydrophobicContact CE1-CG 4.02Å; Y113-E160 WeakPolarHBondContact CE1-OE1 3.09Å; S115-E160 PolarHBondContact OG-OE1 3.31Å; G139-E160 WeakPolarHBondContact CA-O 3.25Å; F140-E160 HydrophobicContact CD1-CB 4.32Å; F140-E160 HydrophobicContact CD2-CB 4.36Å; F140-E160 HydrophobicContact CE1-CB 3.86Å; F140-E160 HydrophobicContact CE2-CB 3.91Å; F140-E160 HydrophobicContact CE2-CG 4.24Å; F140-E160 HydrophobicContact CZ-CB 3.64Å; F140-E160 HydrophobicContact CZ-CG 4.17Å; F140-E160 PolarHBondContact N-O 3.41Å; F140-E160 PolarHBondContact O-N 3.39Å; S142-E160 WeakPolarHBondContact CB-OE1 3.09Å; S142-E160 PolarHBondContact OG-OE1 3Å; F158-E160 HydrophobicContact CD2-CG 4.47Å; F158-E160 HydrophobicContact CE2-CG 3.91Å; E160-R162 PolarHBondContact O-N 2.73Å
161	M	90.8	Very high	82.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	119.8	-177.2	-65.1	-53.2	87.9	0	0	110.5	W94 F95 S97 C100 Y128 A159 I164	W94-M161 HydrophobicContact CB-CE 3.88Å; W94-M161 HydrophobicContact CB-CG 4Å; W94-M161 HydrophobicContact CB-SD 4.2Å; W94-M161 HydrophobicContact CD2-CG 3.78Å; W94-M161 HydrophobicContact CD2-SD 4.45Å; W94-M161 HydrophobicContact CE3-CB 4.34Å; W94-M161 HydrophobicContact CE3-CG 3.34Å; W94-M161 HydrophobicContact CG-CG 4.09Å; W94-M161 HydrophobicContact CG-SD 4.34Å; W94-M161 HydrophobicContact CZ3-CG 4.04Å; F95-M161 PolarHBondContact O-N 2.82Å; S97-M161 VanDerWaalsContact CB-O 3.26Å; S97-M161 WeakPolarHBondContact CB-O 3.39Å; S97-M161 PolarHBondContact N-O 2.8Å; C100-M161 PolarHBondContact SG-O 3.27Å; Y128-M161 HydrophobicContact CD1-CE 3.37Å; Y128-M161 HydrophobicContact CD1-SD 3.85Å; Y128-M161 HydrophobicContact CE1-CE 3.65Å; Y128-M161 HydrophobicContact CE1-SD 3.75Å; Y128-M161 HydrophobicContact CG-CE 4.27Å; A159-M161 HydrophobicContact CB-CE 3.18Å; M161-I164 HydrophobicContact CB-CD1 3.63Å; M161-I164 HydrophobicContact CB-CG1 3.6Å; M161-I164 HydrophobicContact CG-CD1 4.37Å; M161-I164 HydrophobicContact CG-CG1 4.38Å
162	R	88.8	Confident	80.7	Confident	122 Å²	122	48.2 Å²	48.2	46%	0.46	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-21.7	178	-62.8	-175.6	69.5	-172.2	-1.5	113.2	N99 C100 W101 S138 F140 E160	N99-R162 HydrophobicContact CB-CG 4.46Å; N99-R162 PolarHBondContact O-NE 2.57Å; C100-R162 WeakPolarHBondContact CA-O 3.23Å; W101-R162 PolarHBondContact N-O 3.46Å; S138-R162 PolarHBondContact O-N 2.84Å; F140-R162 HydrophobicContact CD1-CG 4.01Å; F140-R162 HydrophobicContact CE1-CG 3.8Å; E160-R162 PolarHBondContact O-N 2.73Å
163	S	85.4	Confident	79.6	Confident	22 Å²	22	51.3 Å²	51.3	15%	0.154	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	115.3	179.4	175.1	0	0	0	0	108.4	S138 F165	S138-S163 PolarHBondContact N-O 2.9Å; S138-S163 PolarHBondContact O-N 2.94Å; S138-S163 VanDerWaalsContact O-N 3.13Å; S163-F165 WeakPolarHBondContact OG-CD2 3.06Å; S163-F165 WeakPolarHBondContact OG-CE2 3.02Å
164	I	75.5	Confident	79.1	Confident	3 Å²	3	52 Å²	52	2%	0.015	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	70.5	-177.2	-53.9	-176.7	0	0	0	106.4	W94 A96 D104 Y137 M161 N166 Y169	W94-I164 HydrophobicContact CZ3-CD1 4.25Å; A96-I164 HydrophobicContact CB-CD1 3.85Å; D104-I164 PolarHBondContact OD2-N 2.93Å; Y137-I164 HydrophobicContact CD1-CB 4.34Å; Y137-I164 HydrophobicContact CD1-CG1 4.44Å; Y137-I164 HydrophobicContact CD1-CG2 3.8Å; Y137-I164 HydrophobicContact CE1-CG2 3.55Å; M161-I164 HydrophobicContact CB-CD1 3.63Å; M161-I164 HydrophobicContact CB-CG1 3.6Å; M161-I164 HydrophobicContact CG-CD1 4.37Å; M161-I164 HydrophobicContact CG-CG1 4.38Å; I164-N166 PolarHBondContact O-N 3.14Å; I164-N166 VanDerWaalsContact O-N 3.12Å; I164-Y169 HydrophobicContact CG2-CD2 3.9Å; I164-Y169 HydrophobicContact CG2-CE2 3.23Å
165	F	66.1	Low	78.6	Confident	102 Å²	102	45.7 Å²	45.7	45%	0.447	21%	0.207	S	C	.	.			trans	-82.9	93.6	178.4	-73.6	-68.9	0	0	0	110.6	W101 S135 S163	W101-F165 HydrophobicContact CE3-CZ 4Å; W101-F165 HydrophobicContact CZ3-CZ 4.03Å; S135-F165 PolarHBondContact OG-O 3.49Å; S163-F165 WeakPolarHBondContact OG-CD2 3.06Å; S163-F165 WeakPolarHBondContact OG-CE2 3.02Å
166	N	63.9	Low	78.3	Confident	17 Å²	17	40.4 Å²	40.4	9%	0.091	18%	0.179	C	C	.	.			trans	-141.4	117.4	170	161.5	6.9	0	0	0	109.1	Y137 I164 D168 Y169	Y137-N166 PolarHBondContact OH-ND2 3.22Å; Y137-N166 VanDerWaalsContact OH-ND2 3.14Å; I164-N166 PolarHBondContact O-N 3.14Å; I164-N166 VanDerWaalsContact O-N 3.12Å; N166-D168 PolarHBondContact O-N 3.18Å; N166-D168 WeakPolarHBondContact OD1-CB 3.39Å; N166-D168 PolarHBondContact OD1-N 3.24Å; N166-Y169 HydrophobicContact CB-CD2 3.4Å; N166-Y169 VanDerWaalsContact CB-CD2 3.4Å; N166-Y169 HydrophobicContact CB-CE2 3.53Å; N166-Y169 WeakPolarHBondContact ND2-CE2 3.39Å; N166-Y169 WeakPolarHBondContact O-CB 3.48Å; N166-Y169 WeakPolarHBondContact O-CD2 3.44Å; N166-Y169 PolarHBondContact O-N 3.28Å
167	R	56.6	Low	78	Confident	214 Å²	214	40.7 Å²	40.7	81%	0.808	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-67.7	-20.4	-174.5	-66	-176.8	87.6	-131.5	6.8	112.6	Y169 F170	R167-Y169 PolarHBondContact O-N 3.14Å; R167-F170 WeakPolarHBondContact O-CD2 3.5Å
168	D	58.6	Low	77.9	Confident	24 Å²	24	39.6 Å²	39.6	13%	0.128	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-79.2	-1	179	-59.1	-46.4	0	0	0	112.6	S30 L31 N166 F170 T171 N172	S30-D168 WeakPolarHBondContact CB-OD1 3.49Å; S30-D168 PolarHBondContact OG-OD1 3.12Å; L31-D168 HydrophobicContact CB-CB 4.29Å; L31-D168 HydrophobicContact CD1-CB 3.56Å; N166-D168 PolarHBondContact O-N 3.18Å; N166-D168 WeakPolarHBondContact OD1-CB 3.39Å; N166-D168 PolarHBondContact OD1-N 3.24Å; D168-F170 PolarHBondContact O-N 3.35Å; D168-T171 PolarHBondContact O-N 3.27Å; D168-T171 PolarHBondContact O-OG1 3.23Å; D168-N172 PolarHBondContact O-ND2 2.88Å
169	Y	61.8	Low	77.7	Confident	6 Å²	6	39.6 Å²	39.6	2%	0.024	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-71.1	-12.1	177.9	-91.2	-61.9	0	0	0	115	W94 F110 Y137 I164 N166 R167 T171 N172 Y174	W94-Y169 WeakPolarHBondContact CH2-OH 3.35Å; F110-Y169 AromaticContact CE1-CD1 3.69Å; F110-Y169 HydrophobicContact CE1-CD1 3.69Å; F110-Y169 HydrophobicContact CE1-CE1 4.01Å; F110-Y169 HydrophobicContact CE2-CD1 4.09Å; F110-Y169 HydrophobicContact CE2-CG 4.21Å; F110-Y169 AromaticContact CZ-CD1 3.17Å; F110-Y169 HydrophobicContact CZ-CD1 3.17Å; F110-Y169 AromaticContact CZ-CE1 3.83Å; F110-Y169 HydrophobicContact CZ-CE1 3.83Å; F110-Y169 AromaticContact CZ-CG 3.64Å; F110-Y169 HydrophobicContact CZ-CG 3.64Å; Y137-Y169 HydrophobicContact CE1-CE2 4.14Å; I164-Y169 HydrophobicContact CG2-CD2 3.9Å; I164-Y169 HydrophobicContact CG2-CE2 3.23Å; N166-Y169 HydrophobicContact CB-CD2 3.4Å; N166-Y169 VanDerWaalsContact CB-CD2 3.4Å; N166-Y169 HydrophobicContact CB-CE2 3.53Å; N166-Y169 WeakPolarHBondContact ND2-CE2 3.39Å; N166-Y169 WeakPolarHBondContact O-CB 3.48Å; N166-Y169 WeakPolarHBondContact O-CD2 3.44Å; N166-Y169 PolarHBondContact O-N 3.28Å; R167-Y169 PolarHBondContact O-N 3.14Å; Y169-T171 PolarHBondContact O-N 2.86Å; Y169-T171 VanDerWaalsContact O-N 3.15Å; Y169-N172 HydrophobicContact CD1-CB 4.45Å; Y169-N172 VanDerWaalsContact CD1-O 3.24Å; Y169-N172 WeakPolarHBondContact CD1-O 3.5Å; Y169-N172 PolarHBondContact O-N 2.82Å; Y169-Y174 HydrophobicContact CE1-CD1 4.17Å; Y169-Y174 AromaticContact CE1-CE1 3.66Å; Y169-Y174 HydrophobicContact CE1-CE1 3.66Å; Y169-Y174 HydrophobicContact CE1-CE2 4.09Å; Y169-Y174 AromaticContact CE1-CZ 3.63Å; Y169-Y174 AromaticContact CZ-CZ 3.7Å; Y169-Y174 VanDerWaalsContact OH-CE2 3.28Å; Y169-Y174 WeakPolarHBondContact OH-CE2 3.32Å; Y169-Y174 PolarHBondContact OH-OH 3.39Å
170	F	54.7	Low	77.5	Confident	126 Å²	126	39.7 Å²	39.7	55%	0.553	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	-57.2	-28.6	172.7	-77.2	-65.5	0	0	0	112.6	F106 R167 D168	F106-F170 HydrophobicContact CD1-CE1 4.4Å; F106-F170 HydrophobicContact CD1-CE2 4.49Å; F106-F170 HydrophobicContact CD1-CZ 4.32Å; F106-F170 HydrophobicContact CE1-CD1 4.07Å; F106-F170 AromaticContact CE1-CD2 3.69Å; F106-F170 HydrophobicContact CE1-CD2 3.69Å; F106-F170 AromaticContact CE1-CE1 3.64Å; F106-F170 HydrophobicContact CE1-CE1 3.64Å; F106-F170 AromaticContact CE1-CE2 3.24Å; F106-F170 HydrophobicContact CE1-CE2 3.24Å; F106-F170 HydrophobicContact CE1-CG 4.1Å; F106-F170 AromaticContact CE1-CZ 3.21Å; F106-F170 HydrophobicContact CE1-CZ 3.21Å; F106-F170 HydrophobicContact CZ-CD2 4.36Å; F106-F170 HydrophobicContact CZ-CE1 4.3Å; F106-F170 AromaticContact CZ-CE2 3.52Å; F106-F170 HydrophobicContact CZ-CE2 3.52Å; F106-F170 AromaticContact CZ-CZ 3.48Å; F106-F170 HydrophobicContact CZ-CZ 3.48Å; F106-F170 VanDerWaalsContact CZ-CZ 3.48Å; R167-F170 WeakPolarHBondContact O-CD2 3.5Å; D168-F170 PolarHBondContact O-N 3.35Å
171	T	57.2	Low	77.2	Confident	49 Å²	49	40.4 Å²	40.4	30%	0.301	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-24.5	-178.1	56.6	0	0	0	0	113.3	S28 D168 Y169	S28-T171 VanDerWaalsContact CB-OG1 3.23Å; S28-T171 WeakPolarHBondContact CB-OG1 3.3Å; S28-T171 PolarHBondContact OG-OG1 3.26Å; S28-T171 VanDerWaalsContact OG-OG1 3.12Å; D168-T171 PolarHBondContact O-N 3.27Å; D168-T171 PolarHBondContact O-OG1 3.23Å; Y169-T171 PolarHBondContact O-N 2.86Å; Y169-T171 VanDerWaalsContact O-N 3.15Å
172	N	63.2	Low	76.9	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	19%	0.188	C	C	.	.			trans	-101.8	96.5	-170.6	-67	-48.1	0	0	0	112.2	L25 D168 Y169 Y174	L25-N172 HydrophobicContact CD1-CB 4.35Å; D168-N172 PolarHBondContact O-ND2 2.88Å; Y169-N172 HydrophobicContact CD1-CB 4.45Å; Y169-N172 VanDerWaalsContact CD1-O 3.24Å; Y169-N172 WeakPolarHBondContact CD1-O 3.5Å; Y169-N172 PolarHBondContact O-N 2.82Å; N172-Y174 HydrophobicContact CB-CD1 4.25Å; N172-Y174 HydrophobicContact CB-CE1 4.13Å; N172-Y174 PolarHBondContact O-N 2.83Å
173	K	70.7	Confident	76.8	Confident	119 Å²	119	40.6 Å²	40.6	52%	0.517	18%	0.183	S	C	.	.			trans	-94	66.3	-175.1	-57	-175.3	-178.8	173.1	0	112.6	R83	R83-K173 PolarHBondContact NE-O 2.94Å; R83-K173 VanDerWaalsContact NE-O 3.16Å; R83-K173 PolarHBondContact NH1-O 3.49Å; R83-K173 PolarHBondContact NH2-O 3.15Å
174	Y	84.3	Confident	76.9	Confident	14 Å²	14	49 Å²	49	6%	0.055	21%	0.212	C	C	.	.			trans	-108.6	146.6	163.2	65.3	-85.9	0	0	0	109.9	L25 L85 W94 F110 Y169 N172 G176 V177	L25-Y174 HydrophobicContact CD1-CD1 3.65Å; L25-Y174 HydrophobicContact CD1-CE1 4.38Å; L25-Y174 HydrophobicContact CD1-CG 4.49Å; L85-Y174 HydrophobicContact CD1-CD1 3.88Å; L85-Y174 HydrophobicContact CD1-CD2 3.86Å; L85-Y174 HydrophobicContact CD1-CE1 3.74Å; L85-Y174 HydrophobicContact CD1-CE2 3.71Å; L85-Y174 HydrophobicContact CD1-CG 3.92Å; L85-Y174 HydrophobicContact CD2-CD1 4.31Å; L85-Y174 HydrophobicContact CD2-CG 4.15Å; L85-Y174 HydrophobicContact CG-CD1 4.13Å; L85-Y174 HydrophobicContact CG-CD2 3.79Å; L85-Y174 HydrophobicContact CG-CE1 4.48Å; L85-Y174 HydrophobicContact CG-CE2 4.15Å; L85-Y174 HydrophobicContact CG-CG 3.76Å; W94-Y174 AromaticContact CH2-CE2 3.77Å; W94-Y174 HydrophobicContact CH2-CE2 3.77Å; W94-Y174 HydrophobicContact CZ2-CE2 4.23Å; F110-Y174 VanDerWaalsContact CD1-O 3.23Å; F110-Y174 WeakPolarHBondContact CD1-O 3.4Å; F110-Y174 VanDerWaalsContact CE1-O 3.25Å; F110-Y174 WeakPolarHBondContact CE1-O 3.3Å; Y169-Y174 HydrophobicContact CE1-CD1 4.17Å; Y169-Y174 AromaticContact CE1-CE1 3.66Å; Y169-Y174 HydrophobicContact CE1-CE1 3.66Å; Y169-Y174 HydrophobicContact CE1-CE2 4.09Å; Y169-Y174 AromaticContact CE1-CZ 3.63Å; Y169-Y174 AromaticContact CZ-CZ 3.7Å; Y169-Y174 VanDerWaalsContact OH-CE2 3.28Å; Y169-Y174 WeakPolarHBondContact OH-CE2 3.32Å; Y169-Y174 PolarHBondContact OH-OH 3.39Å; N172-Y174 HydrophobicContact CB-CD1 4.25Å; N172-Y174 HydrophobicContact CB-CE1 4.13Å; N172-Y174 PolarHBondContact O-N 2.83Å; Y174-G176 WeakPolarHBondContact CD2-O 3.19Å; Y174-V177 HydrophobicContact CD2-CG2 4.5Å; Y174-V177 HydrophobicContact CE2-CG2 4.02Å
175	D	88.4	Confident	77.5	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.011	24%	0.235	C	C	.	.			trans	-101.9	-4.1	-172.1	-48.8	-54.7	0	0	0	111.8	L82 R83 F95 A96 S111	L82-D175 HydrophobicContact CB-CB 4.2Å; L82-D175 HydrophobicContact CD2-CB 3.91Å; R83-D175 WeakPolarHBondContact CB-OD2 3.37Å; R83-D175 IonicContact CZ-OD1 3.85Å; R83-D175 IonicContact CZ-OD2 2.86Å; R83-D175 PolarHBondContact N-OD2 3.27Å; R83-D175 IonicContact NE-OD1 3.66Å; R83-D175 IonicContact NE-OD2 3.04Å; R83-D175 PolarHBondContact NE-OD2 2.82Å; R83-D175 IonicContact NH2-OD1 2.91Å; R83-D175 PolarHBondContact NH2-OD1 2.88Å; R83-D175 IonicContact NH2-OD2 3.31Å; R83-D175 PolarHBondContact NH2-OD2 3.42Å; R83-D175 WeakPolarHBondContact O-CA 3.25Å; R83-D175 PolarHBondContact O-N 3.13Å; F95-D175 CarbonylContact C-O 3.25Å; F95-D175 WeakPolarHBondContact CA-O 3.18Å; A96-D175 PolarHBondContact N-O 2.86Å; S111-D175 PolarHBondContact N-OD1 3.45Å; S111-D175 VanDerWaalsContact N-OD1 3.08Å; S111-D175 WeakPolarHBondContact O-CB 3.36Å
176	G	90.8	Very high	78.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-171.8	172.9	0	0	0	0	0	115.2	R83 V84 L85 W94 Y174	R83-G176 PolarHBondContact O-N 2.89Å; V84-G176 VanDerWaalsContact CA-O 3.3Å; V84-G176 WeakPolarHBondContact CA-O 3.43Å; L85-G176 PolarHBondContact N-O 2.93Å; W94-G176 CarbonylContact O-C 3.5Å; W94-G176 WeakPolarHBondContact O-CA 3.24Å; Y174-G176 WeakPolarHBondContact CD2-O 3.19Å
177	V	92.3	Very high	79.8	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.7	-178.9	175.5	0	0	0	0	109.3	L85 D87 T93 W94 Y174	L85-V177 HydrophobicContact CB-CG2 4.24Å; L85-V177 HydrophobicContact CD1-CG2 4.46Å; L85-V177 CarbonylContact O-C 3.59Å; L85-V177 WeakPolarHBondContact O-CA 3.46Å; D87-V177 HydrophobicContact CB-CG1 3.46Å; D87-V177 VanDerWaalsContact CB-CG1 3.46Å; T93-V177 CarbonylContact C-O 3.59Å; T93-V177 VanDerWaalsContact CA-O 3.26Å; T93-V177 WeakPolarHBondContact CA-O 3.42Å; T93-V177 WeakPolarHBondContact CG2-O 3.45Å; W94-V177 HydrophobicContact CD2-CB 4.27Å; W94-V177 HydrophobicContact CD2-CG2 4.4Å; W94-V177 VanDerWaalsContact CE2-CG2 3.47Å; W94-V177 HydrophobicContact CH2-CG2 4.01Å; W94-V177 HydrophobicContact CZ2-CB 4Å; W94-V177 HydrophobicContact CZ2-CG2 3.26Å; W94-V177 PolarHBondContact N-O 2.73Å; W94-V177 PolarHBondContact O-N 2.89Å; Y174-V177 HydrophobicContact CD2-CG2 4.5Å; Y174-V177 HydrophobicContact CE2-CG2 4.02Å
178	I	95.6	Very high	81.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.9	165.7	-67.6	-177.5	0	0	0	108	I73 V84 L85 F86 D87 T93 F95 I148 M180 M193	I73-I178 HydrophobicContact CD1-CD1 3.86Å; I73-I178 HydrophobicContact CG2-CD1 4.42Å; V84-I178 HydrophobicContact CB-CG1 4.39Å; V84-I178 HydrophobicContact CG2-CD1 4.01Å; V84-I178 HydrophobicContact CG2-CG1 4.29Å; L85-I178 PolarHBondContact O-N 3.2Å; F86-I178 HydrophobicContact CD1-CB 4.07Å; F86-I178 HydrophobicContact CD1-CD1 4.39Å; F86-I178 HydrophobicContact CD1-CG2 4.26Å; F86-I178 HydrophobicContact CE1-CB 4.43Å; F86-I178 HydrophobicContact CE1-CD1 3.88Å; D87-I178 PolarHBondContact N-O 3.2Å; T93-I178 HydrophobicContact CG2-CG1 3.97Å; F95-I178 HydrophobicContact CE1-CG1 4.48Å; I148-I178 HydrophobicContact CD1-CD1 4.48Å; I178-M180 HydrophobicContact CG2-CG 4.35Å; I178-M180 HydrophobicContact CG2-SD 3.74Å; I178-M193 HydrophobicContact CD1-CE 4.39Å; I178-M193 HydrophobicContact CG2-CB 3.83Å; I178-M193 HydrophobicContact CG2-CE 3.67Å; I178-M193 HydrophobicContact CG2-CG 4.23Å
179	G	93.6	Very high	83.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	128.6	171	0	0	0	0	0	112.9	D87 S90 D92	D87-G179 CarbonylContact O-C 3.56Å; D87-G179 WeakPolarHBondContact O-CA 3.45Å; S90-G179 CarbonylContact O-C 3.59Å; S90-G179 VanDerWaalsContact O-C 3.25Å; S90-G179 WeakPolarHBondContact O-CA 3.44Å; D92-G179 PolarHBondContact O-N 3.27Å; D92-G179 VanDerWaalsContact O-N 3.12Å
180	M	92.5	Very high	84.7	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.015	24%	0.244	C	C	.	.			trans	-123.5	17.8	-176.4	-61.9	-60.3	-58.5	0	0	112.6	F86 D87 T88 S90 I178 M193 F194 F208 M224 L226 W249	F86-M180 HydrophobicContact CB-CG 4.04Å; F86-M180 HydrophobicContact CD1-CG 4.35Å; F86-M180 HydrophobicContact CD1-SD 4.33Å; D87-M180 PolarHBondContact O-N 2.93Å; T88-M180 HydrophobicContact CG2-CB 4.2Å; S90-M180 PolarHBondContact O-N 3.36Å; I178-M180 HydrophobicContact CG2-CG 4.35Å; I178-M180 HydrophobicContact CG2-SD 3.74Å; M180-M193 HydrophobicContact CE-CE 4.43Å; M180-M193 HydrophobicContact SD-CE 3.7Å; M180-F194 HydrophobicContact CE-CB 4.03Å; M180-F194 HydrophobicContact CE-CG 4.26Å; M180-F208 HydrophobicContact CB-CE1 4.45Å; M180-F208 HydrophobicContact CB-CE2 4.45Å; M180-F208 HydrophobicContact CB-CZ 4.07Å; M180-F208 HydrophobicContact CE-CB 4.36Å; M180-F208 HydrophobicContact CE-CD1 3.46Å; M180-F208 VanDerWaalsContact CE-CD1 3.46Å; M180-F208 HydrophobicContact CE-CD2 4.18Å; M180-F208 HydrophobicContact CE-CE1 3.7Å; M180-F208 HydrophobicContact CE-CE2 4.41Å; M180-F208 HydrophobicContact CE-CG 3.72Å; M180-F208 HydrophobicContact CE-CZ 4.18Å; M180-F208 VanDerWaalsContact O-CZ 3.25Å; M180-F208 WeakPolarHBondContact O-CZ 3.42Å; M180-M224 HydrophobicContact CE-CE 3.36Å; M180-M224 HydrophobicContact CG-CE 4.35Å; M180-M224 HydrophobicContact SD-CE 3.97Å; M180-L226 HydrophobicContact CE-CD2 4.25Å; M180-W249 PolarHBondContact O-NE1 2.83Å
181	S	90.2	Very high	86.7	Confident	15 Å²	15	48.8 Å²	48.8	11%	0.105	24%	0.238	C	C	.	.			trans	-65.1	161.6	175.9	81.2	0	0	0	0	112.6	T88 S90 T91 R183	T88-S181 WeakPolarHBondContact O-CA 3.28Å; T88-S181 WeakPolarHBondContact O-CB 3.43Å; S90-S181 VanDerWaalsContact O-CB 3.3Å; S90-S181 WeakPolarHBondContact O-CB 3.49Å; S90-S181 PolarHBondContact O-N 3.11Å; S90-S181 PolarHBondContact O-OG 3.43Å; T91-S181 WeakPolarHBondContact CG2-OG 3.26Å; S181-R183 PolarHBondContact O-N 2.82Å
182	S	84.9	Confident	88.5	Confident	28 Å²	28	46.7 Å²	46.7	20%	0.196	23%	0.225	C	C	.	.	S	Bend	trans	-69.3	-9.2	-179.6	57.7	0	0	0	0	114.9	N247 I248	S182-N247 VanDerWaalsContact OG-C 3.26Å; S182-I248 VanDerWaalsContact OG-C 3.32Å; S182-I248 WeakPolarHBondContact OG-CA 3.39Å; S182-I248 PolarHBondContact OG-N 2.91Å; S182-I248 PolarHBondContact OG-O 2.9Å
183	R	86.4	Confident	90	Very high	97 Å²	97	46.5 Å²	46.5	37%	0.366	22%	0.224	S	C	.	.			trans	-74.9	130.2	-178.1	-172.4	-171.8	-74	-129.3	-0.5	110.9	T91 S181 I185 N247	T91-R183 HydrophobicContact CG2-CB 3.6Å; T91-R183 HydrophobicContact CG2-CG 4.13Å; S181-R183 PolarHBondContact O-N 2.82Å; R183-I185 WeakPolarHBondContact CD-O 3.24Å; R183-I185 WeakPolarHBondContact CG-O 3.22Å; R183-N247 HydrophobicContact CB-CB 4.09Å; R183-N247 HydrophobicContact CG-CB 4.2Å; R183-N247 PolarHBondContact NH2-ND2 2.9Å
184	R	86.9	Confident	91.1	Very high	199 Å²	199	41.8 Å²	41.8	75%	0.751	20%	0.204	S	C	*	.	S	Bend	trans	-78.9	-16.2	-176.6	-63.7	-177.9	179.3	-114.1	-1	115.6	P192	R184-P192 WeakPolarHBondContact O-CD 3.47Å
185	I	89.6	Confident	91.5	Very high	100 Å²	100	42.7 Å²	42.7	51%	0.513	21%	0.211	S	C	.	.	S	Bend	trans	-140.4	131.1	-179.5	-58.4	178.4	0	0	0	108	R183	R183-I185 WeakPolarHBondContact CD-O 3.24Å; R183-I185 WeakPolarHBondContact CG-O 3.22Å
186	S	89.5	Confident	91.9	Very high	8 Å²	8	43.4 Å²	43.4	6%	0.056	22%	0.215	C	C	.	.			trans	-67.5	167.5	177.2	73.9	0	0	0	0	112.9	T91 D92 F188 G189 K190	T91-S186 WeakPolarHBondContact OG1-CB 3.41Å; D92-S186 WeakPolarHBondContact OD1-CB 3.39Å; S186-F188 PolarHBondContact O-N 3.06Å; S186-F188 PolarHBondContact OG-N 3.16Å; S186-G189 PolarHBondContact O-N 3.43Å; S186-K190 PolarHBondContact N-O 3.19Å; S186-K190 WeakPolarHBondContact OG-CB 3.34Å; S186-K190 PolarHBondContact OG-N 3.31Å; S186-K190 PolarHBondContact OG-O 3.35Å
187	K	87.9	Confident	92	Very high	134 Å²	134	43.4 Å²	43.4	58%	0.583	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19	171.7	71.2	-178.2	-176.6	-178.9	0	113.3
188	F	91.3	Very high	92	Very high	68 Å²	68	45.5 Å²	45.5	30%	0.298	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	9.5	178.7	-61.1	-79.8	0	0	0	113.3	D92 Y128 H129 W141 S186 K190	D92-F188 WeakPolarHBondContact OD2-CE2 3.4Å; Y128-F188 AromaticContact CD2-CD2 3.99Å; Y128-F188 HydrophobicContact CD2-CD2 3.99Å; Y128-F188 HydrophobicContact CD2-CE1 4.43Å; Y128-F188 AromaticContact CD2-CE2 3.44Å; Y128-F188 HydrophobicContact CD2-CE2 3.44Å; Y128-F188 VanDerWaalsContact CD2-CE2 3.44Å; Y128-F188 AromaticContact CD2-CZ 3.71Å; Y128-F188 HydrophobicContact CD2-CZ 3.71Å; Y128-F188 AromaticContact CE2-CD2 3.93Å; Y128-F188 HydrophobicContact CE2-CD2 3.93Å; Y128-F188 AromaticContact CE2-CE2 3.3Å; Y128-F188 HydrophobicContact CE2-CE2 3.3Å; Y128-F188 AromaticContact CE2-CZ 3.95Å; Y128-F188 HydrophobicContact CE2-CZ 3.95Å; H129-F188 WeakPolarHBondContact O-CZ 3.45Å; W141-F188 HydrophobicContact CH2-CD2 4.49Å; W141-F188 HydrophobicContact CZ2-CB 3.67Å; W141-F188 AromaticContact CZ2-CD2 3.53Å; W141-F188 HydrophobicContact CZ2-CD2 3.53Å; W141-F188 HydrophobicContact CZ2-CE2 4.21Å; W141-F188 AromaticContact CZ2-CG 3.73Å; W141-F188 HydrophobicContact CZ2-CG 3.73Å; W141-F188 AromaticContact NE1-CG 3.92Å; S186-F188 PolarHBondContact O-N 3.06Å; S186-F188 PolarHBondContact OG-N 3.16Å; F188-K190 VanDerWaalsContact C-N 3.27Å; F188-K190 HydrophobicContact CB-CG 4.17Å; F188-K190 PolarHBondContact O-N 2.71Å
189	G	93.3	Very high	91.8	Very high	56 Å²	56	49.2 Å²	49.2	58%	0.577	26%	0.257	S	S	*	.	S	Bend	trans	73.1	17	-179.8	0	0	0	0	0	114.2	S186	S186-G189 PolarHBondContact O-N 3.43Å
190	K	95.5	Very high	91.7	Very high	38 Å²	38	52 Å²	52	17%	0.165	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-96	147.3	179.2	-49.4	-60.7	179	178.1	0	110.3	D124 W141 S186 F188 P192	D124-K190 IonicContact OD1-NZ 2.6Å; D124-K190 IonicContact OD2-NZ 2.75Å; D124-K190 PolarHBondContact OD2-NZ 2.74Å; W141-K190 HydrophobicContact CD2-CD 4.3Å; W141-K190 HydrophobicContact CD2-CG 3.95Å; W141-K190 HydrophobicContact CE3-CD 4.33Å; W141-K190 HydrophobicContact CE3-CG 3.84Å; W141-K190 HydrophobicContact CH2-CB 4.15Å; W141-K190 HydrophobicContact CH2-CG 3.73Å; W141-K190 HydrophobicContact CZ2-CG 3.8Å; W141-K190 HydrophobicContact CZ3-CB 4.14Å; W141-K190 HydrophobicContact CZ3-CG 3.74Å; S186-K190 PolarHBondContact N-O 3.19Å; S186-K190 WeakPolarHBondContact OG-CB 3.34Å; S186-K190 PolarHBondContact OG-N 3.31Å; S186-K190 PolarHBondContact OG-O 3.35Å; F188-K190 VanDerWaalsContact C-N 3.27Å; F188-K190 HydrophobicContact CB-CG 4.17Å; F188-K190 PolarHBondContact O-N 2.71Å; K190-P192 WeakPolarHBondContact O-CD 3.5Å
191	I	96	Very high	91.4	Very high	84 Å²	84	55.1 Å²	55.1	43%	0.431	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-83.6	120.8	177.5	-56.4	178.2	0	0	0	108.4	Q156 P195 N196	Q156-I191 PolarHBondContact NE2-O 3.09Å; I191-P195 HydrophobicContact CG2-CB 3.89Å; I191-N196 HydrophobicContact CG2-CB 3.86Å
192	P	95.8	Very high	91.3	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.032	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-62.3	162.2	175.9	-23.5	36.9	0	0	0	112.1	T91 R184 K190 F194 P195 N196	T91-P192 HydrophobicContact CG2-CG 4.02Å; T91-P192 WeakPolarHBondContact O-CB 3.29Å; R184-P192 WeakPolarHBondContact O-CD 3.47Å; K190-P192 WeakPolarHBondContact O-CD 3.5Å; P192-F194 PolarHBondContact O-N 3.02Å; P192-P195 HydrophobicContact CB-CG 4.31Å; P192-P195 WeakPolarHBondContact O-CD 3.31Å; P192-N196 WeakPolarHBondContact O-CB 3.26Å; P192-N196 PolarHBondContact O-N 2.89Å; P192-N196 VanDerWaalsContact O-N 3.09Å
193	M	95.2	Very high	91.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-55.5	-51.5	-172.3	-177.1	-79.8	-74.6	0	0	113.3	I148 I153 I178 M180 N196 L197	I148-M193 HydrophobicContact CD1-CE 3.91Å; I148-M193 HydrophobicContact CD1-SD 4.21Å; I153-M193 HydrophobicContact CD1-CG 3.67Å; I153-M193 HydrophobicContact CD1-SD 3.37Å; I153-M193 WeakPolarHBondContact CD1-SD 3.45Å; I178-M193 HydrophobicContact CD1-CE 4.39Å; I178-M193 HydrophobicContact CG2-CB 3.83Å; I178-M193 HydrophobicContact CG2-CE 3.67Å; I178-M193 HydrophobicContact CG2-CG 4.23Å; M180-M193 HydrophobicContact CE-CE 4.43Å; M180-M193 HydrophobicContact SD-CE 3.7Å; M193-N196 PolarHBondContact O-N 3.29Å; M193-N196 VanDerWaalsContact O-N 3.17Å; M193-L197 WeakPolarHBondContact O-CB 3.11Å; M193-L197 PolarHBondContact O-N 3.41Å; M193-L197 HydrophobicContact SD-CB 4.43Å
194	F	93.5	Very high	91.7	Very high	19 Å²	19	54.8 Å²	54.8	8%	0.083	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-45	-173.4	-168.4	-119.7	0	0	0	113.3	M180 P192 N196 L197 L198 M204 I207 F208 L226	M180-F194 HydrophobicContact CE-CB 4.03Å; M180-F194 HydrophobicContact CE-CG 4.26Å; P192-F194 PolarHBondContact O-N 3.02Å; F194-N196 VanDerWaalsContact C-N 3.31Å; F194-N196 PolarHBondContact O-N 3.4Å; F194-L197 HydrophobicContact CD2-CD2 3.89Å; F194-L197 HydrophobicContact CE2-CD2 4.06Å; F194-L197 WeakPolarHBondContact O-CB 3.46Å; F194-L197 PolarHBondContact O-N 2.78Å; F194-L198 HydrophobicContact CD1-CD1 4.5Å; F194-L198 HydrophobicContact CE1-CD1 4.25Å; F194-L198 HydrophobicContact CZ-CD1 4.5Å; F194-L198 WeakPolarHBondContact O-CG 3.21Å; F194-L198 PolarHBondContact O-N 3.35Å; F194-M204 HydrophobicContact CE2-SD 4.29Å; F194-I207 WeakPolarHBondContact CZ-O 3.4Å; F194-F208 HydrophobicContact CD1-CD1 4Å; F194-F208 HydrophobicContact CD1-CE1 4.45Å; F194-F208 AromaticContact CE1-CD1 3.99Å; F194-F208 HydrophobicContact CE1-CD1 3.99Å; F194-F208 HydrophobicContact CG-CD1 4.45Å; F194-F208 HydrophobicContact CZ-CD1 4.44Å; F194-L226 HydrophobicContact CD2-CD2 3.79Å; F194-L226 HydrophobicContact CE2-CD2 3.79Å
195	P	93.2	Very high	92	Very high	33 Å²	33	49.8 Å²	49.8	21%	0.214	30%	0.295	C	S	.	.	H	α-helix	trans	-56.8	-39.5	168.2	-27.1	34.6	0	0	0	114.3	I191 P192 A199	I191-P195 HydrophobicContact CG2-CB 3.89Å; P192-P195 HydrophobicContact CB-CG 4.31Å; P192-P195 WeakPolarHBondContact O-CD 3.31Å; P195-A199 WeakPolarHBondContact O-CB 3.02Å; P195-A199 PolarHBondContact O-N 3.04Å
196	N	95.5	Very high	92	Very high	17 Å²	17	49.5 Å²	49.5	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-69.6	-38.1	178.7	-170.8	38.4	0	0	0	112	I153 R154 Q156 I191 P192 M193 F194 L198 A199 N200	I153-N196 HydrophobicContact CG2-CB 4.44Å; I153-N196 WeakPolarHBondContact CG2-ND2 3.4Å; R154-N196 PolarHBondContact O-ND2 3.16Å; Q156-N196 PolarHBondContact OE1-ND2 2.92Å; I191-N196 HydrophobicContact CG2-CB 3.86Å; P192-N196 WeakPolarHBondContact O-CB 3.26Å; P192-N196 PolarHBondContact O-N 2.89Å; P192-N196 VanDerWaalsContact O-N 3.09Å; M193-N196 PolarHBondContact O-N 3.29Å; M193-N196 VanDerWaalsContact O-N 3.17Å; F194-N196 VanDerWaalsContact C-N 3.31Å; F194-N196 PolarHBondContact O-N 3.4Å; N196-L198 VanDerWaalsContact C-N 3.34Å; N196-L198 PolarHBondContact O-N 3.49Å; N196-A199 PolarHBondContact O-N 2.91Å; N196-N200 PolarHBondContact O-N 3.49Å; N196-N200 PolarHBondContact O-ND2 3.44Å; N196-N200 PolarHBondContact OD1-ND2 2.9Å
197	L	93.4	Very high	92.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-54.6	-50.4	173.3	171.2	70	0	0	0	111	L151 I153 M193 F194 A199 N200 V202 M204 L226	L151-L197 HydrophobicContact CB-CD1 4.1Å; L151-L197 HydrophobicContact CD1-CD1 3.89Å; L151-L197 HydrophobicContact CD1-CD2 3.86Å; L151-L197 HydrophobicContact CD2-CD1 4.19Å; L151-L197 HydrophobicContact CG-CD1 4.27Å; I153-L197 HydrophobicContact CD1-CB 4.14Å; I153-L197 HydrophobicContact CD1-CD1 4.01Å; I153-L197 HydrophobicContact CG1-CB 4.22Å; I153-L197 HydrophobicContact CG1-CD1 3.62Å; I153-L197 HydrophobicContact CG1-CG 4.49Å; M193-L197 WeakPolarHBondContact O-CB 3.11Å; M193-L197 PolarHBondContact O-N 3.41Å; M193-L197 HydrophobicContact SD-CB 4.43Å; F194-L197 HydrophobicContact CD2-CD2 3.89Å; F194-L197 HydrophobicContact CE2-CD2 4.06Å; F194-L197 WeakPolarHBondContact O-CB 3.46Å; F194-L197 PolarHBondContact O-N 2.78Å; L197-A199 VanDerWaalsContact C-N 3.32Å; L197-A199 PolarHBondContact O-N 3.5Å; L197-N200 WeakPolarHBondContact O-CB 3.35Å; L197-N200 PolarHBondContact O-N 3.17Å; L197-V202 HydrophobicContact CD1-CB 4.21Å; L197-V202 HydrophobicContact CD1-CG1 4.46Å; L197-V202 HydrophobicContact CD1-CG2 3.67Å; L197-V202 HydrophobicContact CG-CG2 4.41Å; L197-M204 HydrophobicContact CD2-SD 3.9Å; L197-L226 HydrophobicContact CD2-CD1 4.31Å
198	L	91.8	Very high	92.5	Very high	51 Å²	51	48.1 Å²	48.1	27%	0.267	30%	0.296	S	S	.	.	H	α-helix	trans	-64.2	-38.5	178.1	-61.7	171.2	0	0	0	111.7	F194 N196 N200 G201 M204 P206	F194-L198 HydrophobicContact CD1-CD1 4.5Å; F194-L198 HydrophobicContact CE1-CD1 4.25Å; F194-L198 HydrophobicContact CZ-CD1 4.5Å; F194-L198 WeakPolarHBondContact O-CG 3.21Å; F194-L198 PolarHBondContact O-N 3.35Å; N196-L198 VanDerWaalsContact C-N 3.34Å; N196-L198 PolarHBondContact O-N 3.49Å; L198-N200 PolarHBondContact O-N 3.46Å; L198-G201 PolarHBondContact O-N 3.41Å; L198-G201 VanDerWaalsContact O-N 3.09Å; L198-M204 HydrophobicContact CD2-CB 4.42Å; L198-M204 WeakPolarHBondContact CD2-O 3.42Å; L198-P206 HydrophobicContact CD1-CB 3.7Å
199	A	92.3	Very high	92.7	Very high	79 Å²	79	46.2 Å²	46.2	65%	0.653	29%	0.291	S	S	*	.	H	α-helix	trans	-67.5	-21.9	176.6	0	0	0	0	0	113.7	P195 N196 L197 G201	P195-A199 WeakPolarHBondContact O-CB 3.02Å; P195-A199 PolarHBondContact O-N 3.04Å; N196-A199 PolarHBondContact O-N 2.91Å; L197-A199 VanDerWaalsContact C-N 3.32Å; L197-A199 PolarHBondContact O-N 3.5Å; A199-G201 PolarHBondContact O-N 3.19Å
200	N	90.7	Very high	92.7	Very high	59 Å²	59	47.1 Å²	47.1	32%	0.316	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	2.4	172.1	-84.2	-93.9	0	0	0	112.9	R154 N196 L197 L198	R154-N200 PolarHBondContact O-ND2 2.84Å; N196-N200 PolarHBondContact O-N 3.49Å; N196-N200 PolarHBondContact O-ND2 3.44Å; N196-N200 PolarHBondContact OD1-ND2 2.9Å; L197-N200 WeakPolarHBondContact O-CB 3.35Å; L197-N200 PolarHBondContact O-N 3.17Å; L198-N200 PolarHBondContact O-N 3.46Å
201	G	86.6	Confident	92.4	Very high	67 Å²	67	48.9 Å²	48.9	69%	0.691	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	17.6	175	0	0	0	0	0	114.3	L198 A199 N203	L198-G201 PolarHBondContact O-N 3.41Å; L198-G201 VanDerWaalsContact O-N 3.09Å; A199-G201 PolarHBondContact O-N 3.19Å; G201-N203 PolarHBondContact O-N 3.36Å
202	V	87.6	Confident	92	Very high	28 Å²	28	48.2 Å²	48.2	17%	0.17	28%	0.282	C	S	.	.			trans	-65.5	123.5	172	-177.2	0	0	0	0	108.4	E16 L151 L197 M204	E16-V202 HydrophobicContact CB-CG1 4.48Å; L151-V202 HydrophobicContact CD2-CG1 3.89Å; L197-V202 HydrophobicContact CD1-CB 4.21Å; L197-V202 HydrophobicContact CD1-CG1 4.46Å; L197-V202 HydrophobicContact CD1-CG2 3.67Å; L197-V202 HydrophobicContact CG-CG2 4.41Å; V202-M204 VanDerWaalsContact C-N 3.25Å; V202-M204 HydrophobicContact CG1-CB 3.87Å; V202-M204 PolarHBondContact O-N 3.3Å
203	N	88.9	Confident	91.3	Very high	92 Å²	92	49.6 Å²	49.6	49%	0.492	29%	0.289	S	S	.	.			trans	-76	78.2	178.8	-179.3	46.6	0	0	0	109.6	L13 G15 E16 G201	L13-N203 PolarHBondContact O-ND2 3.21Å; G15-N203 CarbonylContact C-O 3.34Å; G15-N203 VanDerWaalsContact CA-O 3.28Å; G15-N203 WeakPolarHBondContact CA-O 3.45Å; E16-N203 PolarHBondContact N-O 3.12Å; G201-N203 PolarHBondContact O-N 3.36Å
204	M	91.1	Very high	90.2	Very high	14 Å²	14	56.5 Å²	56.5	7%	0.069	32%	0.322	C	S	.	.			trans	-138.6	140.6	-172.5	176	177.2	-80.3	0	0	109.2	E16 V18 L151 F194 L197 L198 V202 L226 G227	E16-M204 HydrophobicContact CB-CE 4.41Å; E16-M204 HydrophobicContact CG-CE 4.5Å; E16-M204 WeakPolarHBondContact O-CE 3.37Å; E16-M204 WeakPolarHBondContact O-CG 3.5Å; V18-M204 HydrophobicContact CB-CE 4.18Å; V18-M204 HydrophobicContact CG2-CE 3.91Å; L151-M204 HydrophobicContact CD1-CE 4.12Å; L151-M204 HydrophobicContact CD2-CE 4.12Å; F194-M204 HydrophobicContact CE2-SD 4.29Å; L197-M204 HydrophobicContact CD2-SD 3.9Å; L198-M204 HydrophobicContact CD2-CB 4.42Å; L198-M204 WeakPolarHBondContact CD2-O 3.42Å; V202-M204 VanDerWaalsContact C-N 3.25Å; V202-M204 HydrophobicContact CG1-CB 3.87Å; V202-M204 PolarHBondContact O-N 3.3Å; M204-L226 HydrophobicContact CE-CB 3.82Å; M204-L226 WeakPolarHBondContact CE-O 3.45Å; M204-L226 VanDerWaalsContact SD-C 3.59Å; M204-L226 HydrophobicContact SD-CB 3.69Å; M204-G227 VanDerWaalsContact SD-CA 3.6Å; M204-G227 PolarHBondContact SD-N 2.95Å; M204-G227 VanDerWaalsContact SD-N 3.45Å
205	D	92.6	Very high	89.1	Confident	94 Å²	94	62.2 Å²	62.2	50%	0.503	35%	0.349	S	S	.	.			trans	-65.1	144.7	175.2	-73.5	-28.6	0	0	0	110.6	I207	D205-I207 HydrophobicContact CB-CD1 4.29Å; D205-I207 HydrophobicContact CB-CG1 3.91Å; D205-I207 PolarHBondContact O-N 3.28Å
206	P	91.5	Very high	87.8	Confident	93 Å²	93	67.6 Å²	67.6	60%	0.604	38%	0.375	S	S	*	.	S	Bend	trans	-77.9	45.6	-176.7	35.1	-38.5	0	0	0	112.4	L198	L198-P206 HydrophobicContact CD1-CB 3.7Å
207	I	92.9	Very high	86.4	Confident	75 Å²	75	70.6 Å²	70.6	39%	0.385	41%	0.41	S	S	.	.			trans	-128.3	150.9	179.8	62.5	175.9	0	0	0	110.5	F194 D205 G227	F194-I207 WeakPolarHBondContact CZ-O 3.4Å; D205-I207 HydrophobicContact CB-CD1 4.29Å; D205-I207 HydrophobicContact CB-CG1 3.91Å; D205-I207 PolarHBondContact O-N 3.28Å; I207-G227 PolarHBondContact O-N 3.42Å
208	F	94.5	Very high	85.2	Confident	38 Å²	38	71.2 Å²	71.2	17%	0.167	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	153.7	166	62.1	-96.6	0	0	0	108.9	T88 M180 F194 F210 M224 V225 L226 W249	T88-F208 HydrophobicContact CG2-CE2 4.08Å; T88-F208 HydrophobicContact CG2-CZ 4.41Å; M180-F208 HydrophobicContact CB-CE1 4.45Å; M180-F208 HydrophobicContact CB-CE2 4.45Å; M180-F208 HydrophobicContact CB-CZ 4.07Å; M180-F208 HydrophobicContact CE-CB 4.36Å; M180-F208 HydrophobicContact CE-CD1 3.46Å; M180-F208 VanDerWaalsContact CE-CD1 3.46Å; M180-F208 HydrophobicContact CE-CD2 4.18Å; M180-F208 HydrophobicContact CE-CE1 3.7Å; M180-F208 HydrophobicContact CE-CE2 4.41Å; M180-F208 HydrophobicContact CE-CG 3.72Å; M180-F208 HydrophobicContact CE-CZ 4.18Å; M180-F208 VanDerWaalsContact O-CZ 3.25Å; M180-F208 WeakPolarHBondContact O-CZ 3.42Å; F194-F208 HydrophobicContact CD1-CD1 4Å; F194-F208 HydrophobicContact CD1-CE1 4.45Å; F194-F208 AromaticContact CE1-CD1 3.99Å; F194-F208 HydrophobicContact CE1-CD1 3.99Å; F194-F208 HydrophobicContact CG-CD1 4.45Å; F194-F208 HydrophobicContact CZ-CD1 4.44Å; F208-F210 HydrophobicContact CD2-CD2 4.17Å; F208-F210 AromaticContact CD2-CE2 3.61Å; F208-F210 HydrophobicContact CD2-CE2 3.61Å; F208-F210 HydrophobicContact CD2-CZ 4.41Å; F208-F210 HydrophobicContact CE2-CD2 4.3Å; F208-F210 AromaticContact CE2-CE2 3.61Å; F208-F210 HydrophobicContact CE2-CE2 3.61Å; F208-M224 HydrophobicContact CB-CE 4.24Å; F208-M224 HydrophobicContact CD2-CE 4.45Å; F208-M224 HydrophobicContact CG-CE 4.4Å; F208-V225 CarbonylContact C-O 3.48Å; F208-V225 WeakPolarHBondContact CA-O 3.04Å; F208-V225 VanDerWaalsContact CB-O 3.31Å; F208-V225 WeakPolarHBondContact CB-O 3.01Å; F208-L226 HydrophobicContact CB-CD2 3.99Å; F208-W249 AromaticContact CE1-CZ2 3.86Å; F208-W249 HydrophobicContact CE1-CZ2 3.86Å; F208-W249 AromaticContact CZ-CE2 3.89Å; F208-W249 AromaticContact CZ-CZ2 3.77Å; F208-W249 HydrophobicContact CZ-CZ2 3.77Å; F208-W249 AromaticContact CZ-NE1 3.7Å
209	S	95.2	Very high	84.1	Confident	29 Å²	29	74.4 Å²	74.4	20%	0.203	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	155.2	179.6	70.7	0	0	0	0	111.7	M224 V225 G228	S209-M224 CarbonylContact O-C 3.58Å; S209-M224 WeakPolarHBondContact O-CA 3.45Å; S209-V225 PolarHBondContact N-O 3.31Å; S209-V225 PolarHBondContact O-N 3.15Å; S209-V225 WeakPolarHBondContact OG-CB 3.43Å; S209-G228 PolarHBondContact OG-O 3.08Å
210	F	92.8	Very high	83.3	Confident	75 Å²	75	74.8 Å²	74.8	33%	0.329	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.8	173.5	-68.2	-86.5	0	0	0	109.6	L22 F86 T88 F208 L212 E223 M224	L22-F210 HydrophobicContact CD1-CD1 3.85Å; L22-F210 HydrophobicContact CD1-CE1 4.25Å; F86-F210 HydrophobicContact CB-CE1 3.88Å; F86-F210 HydrophobicContact CB-CZ 3.73Å; T88-F210 HydrophobicContact CG2-CE2 3.83Å; T88-F210 HydrophobicContact CG2-CZ 4.43Å; F208-F210 HydrophobicContact CD2-CD2 4.17Å; F208-F210 AromaticContact CD2-CE2 3.61Å; F208-F210 HydrophobicContact CD2-CE2 3.61Å; F208-F210 HydrophobicContact CD2-CZ 4.41Å; F208-F210 HydrophobicContact CE2-CD2 4.3Å; F208-F210 AromaticContact CE2-CE2 3.61Å; F208-F210 HydrophobicContact CE2-CE2 3.61Å; F210-L212 HydrophobicContact CB-CD2 4.45Å; F210-L212 HydrophobicContact CB-CG 4.48Å; F210-E223 WeakPolarHBondContact CA-O 3.32Å; F210-M224 HydrophobicContact CD1-CB 3.99Å; F210-M224 HydrophobicContact CD1-CG 4.08Å; F210-M224 HydrophobicContact CE1-CB 3.82Å; F210-M224 HydrophobicContact CE1-CG 3.62Å; F210-M224 HydrophobicContact CE1-SD 3.99Å; F210-M224 HydrophobicContact CZ-CE 4.05Å; F210-M224 HydrophobicContact CZ-CG 3.98Å; F210-M224 HydrophobicContact CZ-SD 4.08Å
211	Y	90.4	Very high	83	Confident	75 Å²	75	72.1 Å²	72.1	29%	0.294	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128	157.3	168.2	-105.9	0	0	0	107.8	N213 G222 E223 Y233	Y211-N213 HydrophobicContact CE1-CB 3.93Å; Y211-G222 CarbonylContact O-C 3.41Å; Y211-G222 WeakPolarHBondContact O-CA 3.44Å; Y211-E223 PolarHBondContact N-O 3.26Å; Y211-E223 PolarHBondContact O-N 3.26Å; Y211-Y233 VanDerWaalsContact CB-CD2 3.46Å; Y211-Y233 AromaticContact CD1-CD1 3.9Å; Y211-Y233 HydrophobicContact CD1-CD1 3.9Å; Y211-Y233 AromaticContact CD1-CD2 3.83Å; Y211-Y233 HydrophobicContact CD1-CD2 3.83Å; Y211-Y233 AromaticContact CD1-CE1 3.72Å; Y211-Y233 HydrophobicContact CD1-CE1 3.72Å; Y211-Y233 AromaticContact CD1-CE2 3.65Å; Y211-Y233 HydrophobicContact CD1-CE2 3.65Å; Y211-Y233 AromaticContact CD1-CG 3.97Å; Y211-Y233 HydrophobicContact CD1-CG 3.97Å; Y211-Y233 AromaticContact CD1-CZ 3.61Å; Y211-Y233 AromaticContact CD2-CD1 3.83Å; Y211-Y233 HydrophobicContact CD2-CD1 3.83Å; Y211-Y233 HydrophobicContact CD2-CD2 4.07Å; Y211-Y233 HydrophobicContact CD2-CE1 4.48Å; Y211-Y233 AromaticContact CD2-CG 3.61Å; Y211-Y233 HydrophobicContact CD2-CG 3.61Å; Y211-Y233 AromaticContact CE1-CD1 3.89Å; Y211-Y233 HydrophobicContact CE1-CD1 3.89Å; Y211-Y233 AromaticContact CE1-CE1 3.6Å; Y211-Y233 HydrophobicContact CE1-CE1 3.6Å; Y211-Y233 HydrophobicContact CE1-CE2 4.38Å; Y211-Y233 HydrophobicContact CE1-CG 4.41Å; Y211-Y233 AromaticContact CE1-CZ 3.88Å; Y211-Y233 AromaticContact CE2-CD1 3.81Å; Y211-Y233 HydrophobicContact CE2-CD1 3.81Å; Y211-Y233 HydrophobicContact CE2-CE1 4.38Å; Y211-Y233 HydrophobicContact CE2-CG 4.08Å; Y211-Y233 AromaticContact CG-CD1 3.86Å; Y211-Y233 HydrophobicContact CG-CD1 3.86Å; Y211-Y233 AromaticContact CG-CD2 3.5Å; Y211-Y233 HydrophobicContact CG-CD2 3.5Å; Y211-Y233 HydrophobicContact CG-CE1 4.17Å; Y211-Y233 AromaticContact CG-CE2 3.84Å; Y211-Y233 HydrophobicContact CG-CE2 3.84Å; Y211-Y233 AromaticContact CG-CG 3.54Å; Y211-Y233 HydrophobicContact CG-CG 3.54Å; Y211-Y233 AromaticContact CZ-CD1 3.84Å; Y211-Y233 AromaticContact CZ-CE1 3.95Å
212	L	87.2	Confident	83.1	Confident	70 Å²	70	69 Å²	69	37%	0.366	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	109.5	178.6	-56.5	179.7	0	0	0	108.2	L22 Y69 F210	L22-L212 HydrophobicContact CD1-CD2 4.09Å; Y69-L212 HydrophobicContact CD2-CD2 3.74Å; Y69-L212 HydrophobicContact CE2-CB 4.27Å; Y69-L212 HydrophobicContact CE2-CD1 4.15Å; Y69-L212 HydrophobicContact CE2-CD2 3.76Å; Y69-L212 HydrophobicContact CE2-CG 4.28Å; Y69-L212 HydrophobicContact CG-CD2 4.15Å; F210-L212 HydrophobicContact CB-CD2 4.45Å; F210-L212 HydrophobicContact CB-CG 4.48Å
213	N	79.7	Confident	83.3	Confident	33 Å²	33	68.7 Å²	68.7	18%	0.176	38%	0.38	C	S	.	.			trans	-70.7	127.8	174.9	-170	-2	0	0	0	109.4	Y69 Y211 E215 A218 G221	Y69-N213 PolarHBondContact OH-O 2.75Å; Y211-N213 HydrophobicContact CE1-CB 3.93Å; N213-E215 WeakPolarHBondContact OD1-CB 3.23Å; N213-E215 PolarHBondContact OD1-N 2.98Å; N213-A218 WeakPolarHBondContact ND2-CB 3.29Å; N213-G221 WeakPolarHBondContact CA-O 3.3Å; N213-G221 VanDerWaalsContact CB-O 3.32Å; N213-G221 WeakPolarHBondContact CB-O 3.21Å; N213-G221 PolarHBondContact N-O 3.25Å
214	Q	72.3	Confident	83.6	Confident	146 Å²	146	64.3 Å²	64.3	68%	0.682	36%	0.357	S	S	*	.			trans	-92.8	-2.7	179.6	-54	-172	-2.3	0	0	112.6	N216	Q214-N216 PolarHBondContact O-N 3.4Å
215	E	71.2	Confident	83.7	Confident	139 Å²	139	63.7 Å²	63.7	65%	0.65	35%	0.354	S	S	*	.			trans	-72	115.5	177.9	-171.3	-179.7	-178.2	0	0	111.2	N213 G217 A218	N213-E215 WeakPolarHBondContact OD1-CB 3.23Å; N213-E215 PolarHBondContact OD1-N 2.98Å; E215-G217 PolarHBondContact O-N 2.92Å; E215-A218 HydrophobicContact CB-CB 4.36Å; E215-A218 PolarHBondContact O-N 2.67Å
216	N	66.2	Low	83.8	Confident	145 Å²	145	59.2 Å²	59.2	78%	0.775	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	122.2	176.7	-78.1	-32.9	0	0	0	111.1	Q214	Q214-N216 PolarHBondContact O-N 3.4Å
217	G	64.9	Low	84	Confident	80 Å²	80	54.9 Å²	54.9	83%	0.825	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	4.2	176.3	0	0	0	0	0	115.2	E215	E215-G217 PolarHBondContact O-N 2.92Å
218	A	68.3	Low	84	Confident	14 Å²	14	51.6 Å²	51.6	12%	0.116	29%	0.286	C	S	.	.			trans	-59.6	133	172.2	0	0	0	0	0	110.9	N213 E215 I220	N213-A218 WeakPolarHBondContact ND2-CB 3.29Å; E215-A218 HydrophobicContact CB-CB 4.36Å; E215-A218 PolarHBondContact O-N 2.67Å; A218-I220 PolarHBondContact O-N 3.22Å
219	P	69	Low	84	Confident	117 Å²	117	52.1 Å²	52.1	76%	0.76	29%	0.292	S	S	*	.	S	Bend	trans	-59.8	-34.5	-179.8	-24	32.2	0	0	0	113.5	H23	H23-P219 PolarHBondContact ND1-O 3.07Å; H23-P219 VanDerWaalsContact ND1-O 3.13Å
220	I	75.6	Confident	83.9	Confident	88 Å²	88	51 Å²	51	45%	0.451	28%	0.284	S	S	.	.	S	Bend	trans	-112.8	113.4	172.2	-62.8	174.9	0	0	0	106.2	P21 A218 G222	P21-I220 HydrophobicContact CB-CG2 4.38Å; A218-I220 PolarHBondContact O-N 3.22Å; I220-G222 VanDerWaalsContact C-N 3.33Å; I220-G222 WeakPolarHBondContact CG2-O 3.27Å
221	G	83.6	Confident	84	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.021	30%	0.298	C	S	.	.			trans	-85.8	-5.9	-178.8	0	0	0	0	0	113.2	L22 Y69 N213	L22-G221 PolarHBondContact O-N 3.04Å; Y69-G221 VanDerWaalsContact CE1-C 3.48Å; Y69-G221 WeakPolarHBondContact CE1-O 3.41Å; N213-G221 WeakPolarHBondContact CA-O 3.3Å; N213-G221 VanDerWaalsContact CB-O 3.32Å; N213-G221 WeakPolarHBondContact CB-O 3.21Å; N213-G221 PolarHBondContact N-O 3.25Å
222	G	89.5	Confident	84.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-172.8	176.8	0	0	0	0	0	113.3	L22 Y211 I220	L22-G222 PolarHBondContact N-O 2.97Å; L22-G222 PolarHBondContact O-N 3.33Å; L22-G222 VanDerWaalsContact O-N 3.09Å; Y211-G222 CarbonylContact O-C 3.41Å; Y211-G222 WeakPolarHBondContact O-CA 3.44Å; I220-G222 VanDerWaalsContact C-N 3.33Å; I220-G222 WeakPolarHBondContact CG2-O 3.27Å
223	E	92	Very high	84.2	Confident	22 Å²	22	56.4 Å²	56.4	10%	0.103	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.4	174.8	-176.3	172.2	86.7	0	0	109.5	K19 I20 F210 Y211 V225 N230 Y233	K19-E223 HydrophobicContact CB-CG 4.24Å; K19-E223 WeakPolarHBondContact CB-OE2 3.44Å; K19-E223 WeakPolarHBondContact CD-OE2 3.41Å; I20-E223 WeakPolarHBondContact O-CA 3.39Å; F210-E223 WeakPolarHBondContact CA-O 3.32Å; Y211-E223 PolarHBondContact N-O 3.26Å; Y211-E223 PolarHBondContact O-N 3.26Å; E223-V225 HydrophobicContact CG-CG2 3.99Å; E223-V225 WeakPolarHBondContact OE1-CG2 3.33Å; E223-N230 VanDerWaalsContact OE1-CB 3.29Å; E223-N230 WeakPolarHBondContact OE1-CB 3.2Å; E223-N230 PolarHBondContact OE1-ND2 3.46Å; E223-Y233 HydrophobicContact CB-CE2 3.92Å; E223-Y233 HydrophobicContact CG-CE2 4.49Å; E223-Y233 WeakPolarHBondContact OE1-CE2 3.49Å
224	M	94	Very high	84.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133	163.4	-178.8	-167.6	-176.8	0	0	108.2	K19 I20 L22 F86 M180 F208 S209 F210 L226	K19-M224 CarbonylContact C-O 3.5Å; I20-M224 HydrophobicContact CB-CB 4.31Å; I20-M224 HydrophobicContact CD1-CG 4.48Å; I20-M224 HydrophobicContact CD1-SD 3.91Å; I20-M224 PolarHBondContact N-O 3.24Å; I20-M224 PolarHBondContact O-N 2.82Å; L22-M224 HydrophobicContact CD1-CB 4.06Å; L22-M224 HydrophobicContact CD2-CB 4.13Å; L22-M224 HydrophobicContact CG-CB 4.19Å; F86-M224 HydrophobicContact CB-CE 4.39Å; F86-M224 HydrophobicContact CB-SD 3.93Å; F86-M224 HydrophobicContact CD1-CE 3.81Å; F86-M224 HydrophobicContact CD1-SD 3.33Å; F86-M224 WeakPolarHBondContact CD1-SD 3.3Å; F86-M224 HydrophobicContact CD2-SD 3.52Å; F86-M224 VanDerWaalsContact CD2-SD 3.52Å; F86-M224 HydrophobicContact CE1-CE 4.27Å; F86-M224 HydrophobicContact CE1-SD 3.56Å; F86-M224 VanDerWaalsContact CE1-SD 3.56Å; F86-M224 HydrophobicContact CE2-SD 3.74Å; F86-M224 HydrophobicContact CG-CE 4.13Å; F86-M224 HydrophobicContact CG-SD 3.3Å; F86-M224 WeakPolarHBondContact CG-SD 3.33Å; F86-M224 HydrophobicContact CZ-SD 3.76Å; M180-M224 HydrophobicContact CE-CE 3.36Å; M180-M224 HydrophobicContact CG-CE 4.35Å; M180-M224 HydrophobicContact SD-CE 3.97Å; F208-M224 HydrophobicContact CB-CE 4.24Å; F208-M224 HydrophobicContact CD2-CE 4.45Å; F208-M224 HydrophobicContact CG-CE 4.4Å; S209-M224 CarbonylContact O-C 3.58Å; S209-M224 WeakPolarHBondContact O-CA 3.45Å; F210-M224 HydrophobicContact CD1-CB 3.99Å; F210-M224 HydrophobicContact CD1-CG 4.08Å; F210-M224 HydrophobicContact CE1-CB 3.82Å; F210-M224 HydrophobicContact CE1-CG 3.62Å; F210-M224 HydrophobicContact CE1-SD 3.99Å; F210-M224 HydrophobicContact CZ-CE 4.05Å; F210-M224 HydrophobicContact CZ-CG 3.98Å; F210-M224 HydrophobicContact CZ-SD 4.08Å; M224-L226 HydrophobicContact CE-CD2 3.52Å; M224-L226 HydrophobicContact CE-CG 4.28Å
225	V	95.1	Very high	85.8	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.8	175.6	-171.6	0	0	0	0	108.7	I17 V18 K19 F208 S209 E223 N230	I17-V225 HydrophobicContact CG2-CG1 3.44Å; I17-V225 VanDerWaalsContact CG2-CG1 3.44Å; V18-V225 WeakPolarHBondContact O-CA 3.27Å; K19-V225 HydrophobicContact CG-CG2 4.35Å; F208-V225 CarbonylContact C-O 3.48Å; F208-V225 WeakPolarHBondContact CA-O 3.04Å; F208-V225 VanDerWaalsContact CB-O 3.31Å; F208-V225 WeakPolarHBondContact CB-O 3.01Å; S209-V225 PolarHBondContact N-O 3.31Å; S209-V225 PolarHBondContact O-N 3.15Å; S209-V225 WeakPolarHBondContact OG-CB 3.43Å; E223-V225 HydrophobicContact CG-CG2 3.99Å; E223-V225 WeakPolarHBondContact OE1-CG2 3.33Å; V225-N230 HydrophobicContact CG2-CB 4.21Å
226	L	94.7	Very high	86.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.1	166.5	-63.3	172.6	0	0	0	108.2	I17 V18 I20 I148 L151 M180 F194 L197 M204 F208 M224	I17-L226 WeakPolarHBondContact CA-O 3.21Å; V18-L226 HydrophobicContact CB-CB 4.43Å; V18-L226 PolarHBondContact N-O 3.09Å; V18-L226 PolarHBondContact O-N 2.92Å; I20-L226 HydrophobicContact CD1-CD1 4.09Å; I20-L226 HydrophobicContact CD1-CG 4.34Å; I148-L226 HydrophobicContact CD1-CD1 4.36Å; L151-L226 HydrophobicContact CD1-CD1 3.57Å; M180-L226 HydrophobicContact CE-CD2 4.25Å; F194-L226 HydrophobicContact CD2-CD2 3.79Å; F194-L226 HydrophobicContact CE2-CD2 3.79Å; L197-L226 HydrophobicContact CD2-CD1 4.31Å; M204-L226 HydrophobicContact CE-CB 3.82Å; M204-L226 WeakPolarHBondContact CE-O 3.45Å; M204-L226 VanDerWaalsContact SD-C 3.59Å; M204-L226 HydrophobicContact SD-CB 3.69Å; F208-L226 HydrophobicContact CB-CD2 3.99Å; M224-L226 HydrophobicContact CE-CD2 3.52Å; M224-L226 HydrophobicContact CE-CG 4.28Å
227	G	94.2	Very high	88.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.01	34%	0.337	C	S	.	.	S	Bend	trans	88.9	3.1	174.7	0	0	0	0	0	116.5	M204 I207	M204-G227 VanDerWaalsContact SD-CA 3.6Å; M204-G227 PolarHBondContact SD-N 2.95Å; M204-G227 VanDerWaalsContact SD-N 3.45Å; I207-G227 PolarHBondContact O-N 3.42Å
228	G	94.3	Very high	89.4	Confident	6 Å²	6	58.7 Å²	58.7	6%	0.062	32%	0.319	C	S	.	.	S	Bend	trans	174.9	-160.5	-172.5	0	0	0	0	0	113.1	S209	S209-G228 PolarHBondContact OG-O 3.08Å
229	V	94.7	Very high	90.5	Very high	49 Å²	49	66.5 Å²	66.5	30%	0.297	35%	0.353	S	S	.	.			trans	-129.6	154.3	174.7	-67	0	0	0	0	108.2	P231 F234 F238	V229-P231 WeakPolarHBondContact O-CD 3.11Å; V229-F234 HydrophobicContact CB-CE1 3.9Å; V229-F234 HydrophobicContact CG2-CE1 3.54Å; V229-F234 HydrophobicContact CG2-CZ 3.83Å; V229-F238 HydrophobicContact CB-CE2 4.34Å; V229-F238 HydrophobicContact CB-CZ 4.33Å; V229-F238 HydrophobicContact CG1-CE2 4.01Å; V229-F238 HydrophobicContact CG1-CZ 3.94Å; V229-F238 HydrophobicContact CG2-CE2 3.99Å; V229-F238 HydrophobicContact CG2-CZ 4.44Å
230	N	93.2	Very high	91.6	Very high	6 Å²	6	70.1 Å²	70.1	3%	0.032	35%	0.353	C	S	.	.			trans	-93	113.8	170.4	-174.4	-3.3	0	0	0	109.4	K19 E223 V225 E232 Y233 F234	K19-N230 PolarHBondContact NZ-ND2 2.94Å; K19-N230 PolarHBondContact NZ-OD1 2.88Å; E223-N230 VanDerWaalsContact OE1-CB 3.29Å; E223-N230 WeakPolarHBondContact OE1-CB 3.2Å; E223-N230 PolarHBondContact OE1-ND2 3.46Å; V225-N230 HydrophobicContact CG2-CB 4.21Å; N230-E232 PolarHBondContact ND2-OE2 3.19Å; N230-E232 PolarHBondContact O-N 2.73Å; N230-E232 VanDerWaalsContact O-N 3.12Å; N230-E232 PolarHBondContact OD1-N 2.88Å; N230-Y233 HydrophobicContact CB-CD2 3.69Å; N230-Y233 HydrophobicContact CB-CE2 3.98Å; N230-Y233 VanDerWaalsContact ND2-CE2 3.34Å; N230-Y233 WeakPolarHBondContact ND2-CE2 3.35Å; N230-Y233 PolarHBondContact O-N 3.34Å; N230-Y233 VanDerWaalsContact O-N 3.14Å; N230-F234 WeakPolarHBondContact O-CD1 2.97Å
231	P	93.1	Very high	92.2	Very high	94 Å²	94	70.9 Å²	70.9	61%	0.61	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-65	-12	-177.8	28.1	-36	0	0	0	114.2	V229 Y233 F234	V229-P231 WeakPolarHBondContact O-CD 3.11Å; P231-Y233 PolarHBondContact O-N 2.7Å; P231-F234 VanDerWaalsContact CA-CE1 3.43Å; P231-F234 HydrophobicContact CB-CE1 4.24Å; P231-F234 HydrophobicContact CB-CZ 4.35Å
232	E	92.6	Very high	92.5	Very high	150 Å²	150	76 Å²	76	70%	0.701	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-70.3	-15.5	174.1	-64	175.6	158.2	0	0	113.2	N230	N230-E232 PolarHBondContact ND2-OE2 3.19Å; N230-E232 PolarHBondContact O-N 2.73Å; N230-E232 VanDerWaalsContact O-N 3.12Å; N230-E232 PolarHBondContact OD1-N 2.88Å
233	Y	90.8	Very high	92.4	Very high	89 Å²	89	78.3 Å²	78.3	35%	0.349	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-109.3	6.3	-172.8	-60	-43.5	0	0	0	114.9	Y211 E223 N230 P231	Y211-Y233 VanDerWaalsContact CB-CD2 3.46Å; Y211-Y233 AromaticContact CD1-CD1 3.9Å; Y211-Y233 HydrophobicContact CD1-CD1 3.9Å; Y211-Y233 AromaticContact CD1-CD2 3.83Å; Y211-Y233 HydrophobicContact CD1-CD2 3.83Å; Y211-Y233 AromaticContact CD1-CE1 3.72Å; Y211-Y233 HydrophobicContact CD1-CE1 3.72Å; Y211-Y233 AromaticContact CD1-CE2 3.65Å; Y211-Y233 HydrophobicContact CD1-CE2 3.65Å; Y211-Y233 AromaticContact CD1-CG 3.97Å; Y211-Y233 HydrophobicContact CD1-CG 3.97Å; Y211-Y233 AromaticContact CD1-CZ 3.61Å; Y211-Y233 AromaticContact CD2-CD1 3.83Å; Y211-Y233 HydrophobicContact CD2-CD1 3.83Å; Y211-Y233 HydrophobicContact CD2-CD2 4.07Å; Y211-Y233 HydrophobicContact CD2-CE1 4.48Å; Y211-Y233 AromaticContact CD2-CG 3.61Å; Y211-Y233 HydrophobicContact CD2-CG 3.61Å; Y211-Y233 AromaticContact CE1-CD1 3.89Å; Y211-Y233 HydrophobicContact CE1-CD1 3.89Å; Y211-Y233 AromaticContact CE1-CE1 3.6Å; Y211-Y233 HydrophobicContact CE1-CE1 3.6Å; Y211-Y233 HydrophobicContact CE1-CE2 4.38Å; Y211-Y233 HydrophobicContact CE1-CG 4.41Å; Y211-Y233 AromaticContact CE1-CZ 3.88Å; Y211-Y233 AromaticContact CE2-CD1 3.81Å; Y211-Y233 HydrophobicContact CE2-CD1 3.81Å; Y211-Y233 HydrophobicContact CE2-CE1 4.38Å; Y211-Y233 HydrophobicContact CE2-CG 4.08Å; Y211-Y233 AromaticContact CG-CD1 3.86Å; Y211-Y233 HydrophobicContact CG-CD1 3.86Å; Y211-Y233 AromaticContact CG-CD2 3.5Å; Y211-Y233 HydrophobicContact CG-CD2 3.5Å; Y211-Y233 HydrophobicContact CG-CE1 4.17Å; Y211-Y233 AromaticContact CG-CE2 3.84Å; Y211-Y233 HydrophobicContact CG-CE2 3.84Å; Y211-Y233 AromaticContact CG-CG 3.54Å; Y211-Y233 HydrophobicContact CG-CG 3.54Å; Y211-Y233 AromaticContact CZ-CD1 3.84Å; Y211-Y233 AromaticContact CZ-CE1 3.95Å; E223-Y233 HydrophobicContact CB-CE2 3.92Å; E223-Y233 HydrophobicContact CG-CE2 4.49Å; E223-Y233 WeakPolarHBondContact OE1-CE2 3.49Å; N230-Y233 HydrophobicContact CB-CD2 3.69Å; N230-Y233 HydrophobicContact CB-CE2 3.98Å; N230-Y233 VanDerWaalsContact ND2-CE2 3.34Å; N230-Y233 WeakPolarHBondContact ND2-CE2 3.35Å; N230-Y233 PolarHBondContact O-N 3.34Å; N230-Y233 VanDerWaalsContact O-N 3.14Å; P231-Y233 PolarHBondContact O-N 2.7Å
234	F	91.6	Very high	92.2	Very high	71 Å²	71	81 Å²	81	31%	0.311	42%	0.421	S	S	.	.			trans	-149.3	157.6	176	69.4	-87.1	0	0	0	112.2	V229 N230 P231 G236 F238	V229-F234 HydrophobicContact CB-CE1 3.9Å; V229-F234 HydrophobicContact CG2-CE1 3.54Å; V229-F234 HydrophobicContact CG2-CZ 3.83Å; N230-F234 WeakPolarHBondContact O-CD1 2.97Å; P231-F234 VanDerWaalsContact CA-CE1 3.43Å; P231-F234 HydrophobicContact CB-CE1 4.24Å; P231-F234 HydrophobicContact CB-CZ 4.35Å; F234-G236 WeakPolarHBondContact CD2-O 3.38Å; F234-G236 WeakPolarHBondContact CE2-O 3.29Å; F234-F238 HydrophobicContact CB-CZ 4.45Å; F234-F238 HydrophobicContact CD1-CE2 4.19Å; F234-F238 AromaticContact CD1-CZ 3.7Å; F234-F238 HydrophobicContact CD1-CZ 3.7Å; F234-F238 AromaticContact CD2-CE2 3.96Å; F234-F238 HydrophobicContact CD2-CE2 3.96Å; F234-F238 AromaticContact CD2-CZ 3.85Å; F234-F238 HydrophobicContact CD2-CZ 3.85Å; F234-F238 AromaticContact CE1-CE2 3.81Å; F234-F238 HydrophobicContact CE1-CE2 3.81Å; F234-F238 AromaticContact CE1-CZ 3.77Å; F234-F238 HydrophobicContact CE1-CZ 3.77Å; F234-F238 HydrophobicContact CE2-CD2 4.38Å; F234-F238 AromaticContact CE2-CE2 3.59Å; F234-F238 HydrophobicContact CE2-CE2 3.59Å; F234-F238 AromaticContact CE2-CZ 3.95Å; F234-F238 HydrophobicContact CE2-CZ 3.95Å; F234-F238 HydrophobicContact CG-CE1 4.48Å; F234-F238 HydrophobicContact CG-CE2 4.25Å; F234-F238 AromaticContact CG-CZ 3.74Å; F234-F238 HydrophobicContact CG-CZ 3.74Å; F234-F238 AromaticContact CZ-CE2 3.52Å; F234-F238 HydrophobicContact CZ-CE2 3.52Å; F234-F238 AromaticContact CZ-CZ 3.92Å; F234-F238 HydrophobicContact CZ-CZ 3.92Å
235	E	93.2	Very high	91.6	Very high	196 Å²	196	84.2 Å²	84.2	92%	0.916	44%	0.436	S	S	*	.			trans	-121.7	147.7	171	-65.1	-177	179.6	0	0	109.2
236	G	93.9	Very high	90.9	Very high	59 Å²	59	91.1 Å²	91.1	61%	0.608	47%	0.473	S	S	*	.	S	Bend	trans	76.7	-165.4	-178.6	0	0	0	0	0	114	F234	F234-G236 WeakPolarHBondContact CD2-O 3.38Å; F234-G236 WeakPolarHBondContact CE2-O 3.29Å
237	D	92.7	Very high	90.1	Very high	167 Å²	167	94 Å²	94	89%	0.893	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-100.1	153.9	-177.1	-64	-46.2	0	0	0	111.8
238	F	91.8	Very high	89.5	Confident	99 Å²	99	97.6 Å²	97.6	43%	0.434	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-79	136.3	174.9	-68.5	-75.4	0	0	0	112.3	V229 F234 Y240	V229-F238 HydrophobicContact CB-CE2 4.34Å; V229-F238 HydrophobicContact CB-CZ 4.33Å; V229-F238 HydrophobicContact CG1-CE2 4.01Å; V229-F238 HydrophobicContact CG1-CZ 3.94Å; V229-F238 HydrophobicContact CG2-CE2 3.99Å; V229-F238 HydrophobicContact CG2-CZ 4.44Å; F234-F238 HydrophobicContact CB-CZ 4.45Å; F234-F238 HydrophobicContact CD1-CE2 4.19Å; F234-F238 AromaticContact CD1-CZ 3.7Å; F234-F238 HydrophobicContact CD1-CZ 3.7Å; F234-F238 AromaticContact CD2-CE2 3.96Å; F234-F238 HydrophobicContact CD2-CE2 3.96Å; F234-F238 AromaticContact CD2-CZ 3.85Å; F234-F238 HydrophobicContact CD2-CZ 3.85Å; F234-F238 AromaticContact CE1-CE2 3.81Å; F234-F238 HydrophobicContact CE1-CE2 3.81Å; F234-F238 AromaticContact CE1-CZ 3.77Å; F234-F238 HydrophobicContact CE1-CZ 3.77Å; F234-F238 HydrophobicContact CE2-CD2 4.38Å; F234-F238 AromaticContact CE2-CE2 3.59Å; F234-F238 HydrophobicContact CE2-CE2 3.59Å; F234-F238 AromaticContact CE2-CZ 3.95Å; F234-F238 HydrophobicContact CE2-CZ 3.95Å; F234-F238 HydrophobicContact CG-CE1 4.48Å; F234-F238 HydrophobicContact CG-CE2 4.25Å; F234-F238 AromaticContact CG-CZ 3.74Å; F234-F238 HydrophobicContact CG-CZ 3.74Å; F234-F238 AromaticContact CZ-CE2 3.52Å; F234-F238 HydrophobicContact CZ-CE2 3.52Å; F234-F238 AromaticContact CZ-CZ 3.92Å; F234-F238 HydrophobicContact CZ-CZ 3.92Å; F238-Y240 HydrophobicContact CB-CE2 3.91Å
239	E	91.8	Very high	89.1	Confident	178 Å²	178	103.6 Å²	103.6	83%	0.832	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-94.2	128.7	162.3	-171.9	177.6	174.1	0	0	110
240	Y	90.9	Very high	88.7	Confident	192 Å²	192	102.5 Å²	102.5	75%	0.753	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-100.8	124.7	-178	-67.2	-89.4	0	0	0	111.2	F238	F238-Y240 HydrophobicContact CB-CE2 3.91Å
241	I	89.7	Confident	88.3	Confident	105 Å²	105	105.8 Å²	105.8	54%	0.538	54%	0.544	S	S	.	.			trans	-105.9	128	176.9	-56.7	174.5	0	0	0	108.7	V251	I241-V251 HydrophobicContact CB-CG1 4.3Å; I241-V251 HydrophobicContact CG2-CB 4.03Å; I241-V251 HydrophobicContact CG2-CG1 3.95Å
242	P	89.4	Confident	87.8	Confident	109 Å²	109	104 Å²	104	71%	0.708	54%	0.543	S	S	*	.			trans	-65.3	140.6	178.2	27.3	-34	0	0	0	110.9
243	T	87.5	Confident	87.2	Confident	49 Å²	49	103.6 Å²	103.6	30%	0.301	54%	0.543	S	S	.	.	B	Isolated β-bridge	trans	-71.6	145.9	171.6	60.6	0	0	0	0	110.4	H245 W249 A250	T243-H245 WeakPolarHBondContact CB-O 3.3Å; T243-H245 PolarHBondContact O-N 3.49Å; T243-H245 PolarHBondContact OG1-O 3.42Å; T243-W249 HydrophobicContact CG2-CE3 3.89Å; T243-W249 HydrophobicContact CG2-CZ3 4.19Å; T243-A250 CarbonylContact C-O 3.49Å; T243-A250 WeakPolarHBondContact CA-O 3.48Å
244	V	86.7	Confident	86.5	Confident	79 Å²	79	105 Å²	105	48%	0.479	57%	0.565	S	S	.	*	S	Bend	trans	-70.2	-26	176.9	-174.9	0	0	0	0	111.1	A250	V244-A250 PolarHBondContact N-O 2.89Å
245	H	82.1	Confident	84.9	Confident	67 Å²	67	116.5 Å²	116.5	31%	0.31	61%	0.607	S	S	.	*			trans	-138.4	153.1	-179.3	-55.6	-64.3	0	0	0	111.6	T243 N247 I248	T243-H245 WeakPolarHBondContact CB-O 3.3Å; T243-H245 PolarHBondContact O-N 3.49Å; T243-H245 PolarHBondContact OG1-O 3.42Å; H245-N247 VanDerWaalsContact C-N 3.27Å; H245-N247 VanDerWaalsContact CB-OD1 3.3Å; H245-N247 WeakPolarHBondContact CB-OD1 3.27Å; H245-N247 PolarHBondContact O-N 3.12Å; H245-I248 HydrophobicContact CB-CG1 3.95Å
246	N	79.6	Confident	84.5	Confident	148 Å²	148	112.6 Å²	112.6	79%	0.791	59%	0.591	S	S	*	*	S	Bend	trans	-85.4	5.2	-179.7	-65.8	-9.5	0	0	0	113.6
247	N	78.9	Confident	84	Confident	59 Å²	59	115.4 Å²	115.4	32%	0.316	59%	0.59	S	S	.	*	S	Bend	trans	-131.6	-2.3	-169.5	68.7	-16.3	0	0	0	114.5	S182 R183 H245	S182-N247 VanDerWaalsContact OG-C 3.26Å; R183-N247 HydrophobicContact CB-CB 4.09Å; R183-N247 HydrophobicContact CG-CB 4.2Å; R183-N247 PolarHBondContact NH2-ND2 2.9Å; H245-N247 VanDerWaalsContact C-N 3.27Å; H245-N247 VanDerWaalsContact CB-OD1 3.3Å; H245-N247 WeakPolarHBondContact CB-OD1 3.27Å; H245-N247 PolarHBondContact O-N 3.12Å
248	I	81.2	Confident	83.5	Confident	77 Å²	77	112.5 Å²	112.5	40%	0.395	57%	0.573	S	S	.	*	S	Bend	trans	-144.5	154.3	173.2	58.6	172	0	0	0	109.3	S182 H245 A250	S182-I248 VanDerWaalsContact OG-C 3.32Å; S182-I248 WeakPolarHBondContact OG-CA 3.39Å; S182-I248 PolarHBondContact OG-N 2.91Å; S182-I248 PolarHBondContact OG-O 2.9Å; H245-I248 HydrophobicContact CB-CG1 3.95Å; I248-A250 HydrophobicContact CD1-CB 3.88Å; I248-A250 HydrophobicContact CG1-CB 4Å; I248-A250 PolarHBondContact O-N 3.12Å
249	W	86.8	Confident	83	Confident	132 Å²	132	113.3 Å²	113.3	50%	0.5	58%	0.582	S	S	.	*			trans	-81.4	92.8	169.4	-61	114.1	0	0	0	109.2	M180 F208 T243	M180-W249 PolarHBondContact O-NE1 2.83Å; F208-W249 AromaticContact CE1-CZ2 3.86Å; F208-W249 HydrophobicContact CE1-CZ2 3.86Å; F208-W249 AromaticContact CZ-CE2 3.89Å; F208-W249 AromaticContact CZ-CZ2 3.77Å; F208-W249 HydrophobicContact CZ-CZ2 3.77Å; F208-W249 AromaticContact CZ-NE1 3.7Å; T243-W249 HydrophobicContact CG2-CE3 3.89Å; T243-W249 HydrophobicContact CG2-CZ3 4.19Å
250	A	85.1	Confident	82.5	Confident	27 Å²	27	109.3 Å²	109.3	22%	0.223	57%	0.566	C	S	.	*			trans	-138.4	131.5	177.3	0	0	0	0	0	109.5	T243 V244 I248	T243-A250 CarbonylContact C-O 3.49Å; T243-A250 WeakPolarHBondContact CA-O 3.48Å; V244-A250 PolarHBondContact N-O 2.89Å; I248-A250 HydrophobicContact CD1-CB 3.88Å; I248-A250 HydrophobicContact CG1-CB 4Å; I248-A250 PolarHBondContact O-N 3.12Å
251	V	85.3	Confident	81.9	Confident	75 Å²	75	103.7 Å²	103.7	46%	0.455	55%	0.554	S	S	.	*	B	Isolated β-bridge	trans	-116.4	148.3	176.4	-65.3	0	0	0	0	109.8	I241	I241-V251 HydrophobicContact CB-CG1 4.3Å; I241-V251 HydrophobicContact CG2-CB 4.03Å; I241-V251 HydrophobicContact CG2-CG1 3.95Å
252	G	82.9	Confident	81.3	Confident	57 Å²	57	103.6 Å²	103.6	59%	0.588	56%	0.555	S	S	*	*			trans	-78.3	125.3	173	0	0	0	0	0	109.7
253	M	78.8	Confident	80.7	Confident	141 Å²	141	103.2 Å²	103.2	70%	0.695	54%	0.543	S	S	*	.			trans	-105.9	126.6	173.2	-62	-177.2	71.3	0	0	109	L61	L61-M253 HydrophobicContact CD1-SD 4.5Å
254	S	76	Confident	80.1	Confident	118 Å²	118	107.8 Å²	107.8	83%	0.825	56%	0.563	S	S	*	*			trans	-75	133.9	166.4	54.1	0	0	0	0	108.9
255	R	58.4	Low	79.6	Confident	313 Å²	313	110.4 Å²	110.4	100%	1.181	57%	0.571	S	S	*	*			trans	-74.8	0	171.5	-166.2	177.9	-174.9	179.2	3.4	111.2

Retrieved 255 of 255 residues in 131 ms (Link to these results)

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