A0A087XAU3_POEFO Loading...

Proteasome subunit beta

Component of the proteasome, a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity. The proteasome is a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity. This subunit is involved in antigen processing to generate class I binding peptides.

AlphaFold DB , UniProt , Accession A0A087XAU3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 216 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	48.4	Very low	247 Å²	247	138.2 Å²	138.2	100%	1.217	75%	0.748	S	S	*	*				0	102.5	0	-69.3	-171.8	-145.6	0	0	106.7	G3	M1-G3 PolarHBondContact O-N 2.92Å
2	L	41.5	Very low	48.3	Very low	177 Å²	177	136.6 Å²	136.6	93%	0.927	73%	0.732	S	S	*	*			trans	-79.1	110.2	172	-70.1	161.7	0	0	0	105.4	E4	L2-E4 PolarHBondContact O-N 2.89Å
3	G	44.9	Very low	48.7	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.9	119.2	168.9	0	0	0	0	0	107.4	M1 A5	M1-G3 PolarHBondContact O-N 2.92Å; G3-A5 PolarHBondContact O-N 3.43Å; G3-A5 VanDerWaalsContact O-N 3.1Å
4	E	49.5	Very low	49.1	Very low	191 Å²	191	128.8 Å²	128.8	89%	0.893	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-57.2	116.1	167.8	-70.9	-179.9	161.8	0	0	106.9	L2 E6	L2-E4 PolarHBondContact O-N 2.89Å; E4-E6 PolarHBondContact O-N 3.33Å
5	A	58.3	Low	49.6	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-59.9	121.6	171.9	0	0	0	0	0	106.9	G3	G3-A5 PolarHBondContact O-N 3.43Å; G3-A5 VanDerWaalsContact O-N 3.1Å
6	E	56.2	Low	50.4	Low	154 Å²	154	124.5 Å²	124.5	72%	0.72	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-51.2	135.6	174.7	-75.9	-170.1	163.6	0	0	108.9	E4 Q8	E4-E6 PolarHBondContact O-N 3.33Å; E6-Q8 PolarHBondContact O-N 2.83Å; E6-Q8 VanDerWaalsContact O-N 3.17Å
7	P	55	Low	51.6	Low	59 Å²	59	117.4 Å²	117.4	38%	0.383	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-53.7	127.6	179.9	-20.9	26.9	0	0	0	110.1	W9 L10	P7-W9 VanDerWaalsContact CB-CD1 3.45Å; P7-W9 HydrophobicContact CB-CD2 4.26Å; P7-W9 HydrophobicContact CB-CG 4.18Å; P7-W9 HydrophobicContact CB-CZ2 4.13Å; P7-W9 HydrophobicContact CG-CZ2 4.26Å; P7-W9 PolarHBondContact O-N 3.11Å; P7-L10 HydrophobicContact CB-CD1 4.12Å; P7-L10 HydrophobicContact CG-CD1 3.8Å; P7-L10 WeakPolarHBondContact O-CB 3.5Å; P7-L10 PolarHBondContact O-N 3.05Å
8	Q	46.1	Very low	53.8	Low	140 Å²	140	111 Å²	111	65%	0.654	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-56.4	-24.2	-172.8	-155.8	168.5	-2.1	0	0	113.3	E6 L10 S11 E12	E6-Q8 PolarHBondContact O-N 2.83Å; E6-Q8 VanDerWaalsContact O-N 3.17Å; Q8-L10 VanDerWaalsContact C-N 3.31Å; Q8-L10 PolarHBondContact O-N 2.96Å; Q8-S11 PolarHBondContact O-N 3.2Å; Q8-S11 PolarHBondContact O-OG 2.87Å; Q8-E12 HydrophobicContact CG-CG 4.4Å; Q8-E12 WeakPolarHBondContact O-CB 3.47Å; Q8-E12 WeakPolarHBondContact O-CG 3.43Å; Q8-E12 PolarHBondContact O-N 3.16Å
9	W	51.1	Low	56	Low	187 Å²	187	105.2 Å²	105.2	71%	0.708	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-72.7	-14.5	175	62.5	-97.7	0	0	0	115	P7	P7-W9 VanDerWaalsContact CB-CD1 3.45Å; P7-W9 HydrophobicContact CB-CD2 4.26Å; P7-W9 HydrophobicContact CB-CG 4.18Å; P7-W9 HydrophobicContact CB-CZ2 4.13Å; P7-W9 HydrophobicContact CG-CZ2 4.26Å; P7-W9 PolarHBondContact O-N 3.11Å
10	L	43.2	Very low	58	Low	108 Å²	108	99.9 Å²	99.9	57%	0.565	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-79.1	-22.5	170.8	-87.4	144.5	0	0	0	112.2	P7 Q8	P7-L10 HydrophobicContact CB-CD1 4.12Å; P7-L10 HydrophobicContact CG-CD1 3.8Å; P7-L10 WeakPolarHBondContact O-CB 3.5Å; P7-L10 PolarHBondContact O-N 3.05Å; Q8-L10 VanDerWaalsContact C-N 3.31Å; Q8-L10 PolarHBondContact O-N 2.96Å
11	S	47.8	Very low	59.9	Low	90 Å²	90	95.1 Å²	95.1	63%	0.629	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-11.4	-178.2	57.1	0	0	0	0	114.1	Q8	Q8-S11 PolarHBondContact O-N 3.2Å; Q8-S11 PolarHBondContact O-OG 2.87Å
12	E	47.8	Very low	62.8	Low	119 Å²	119	83.4 Å²	83.4	56%	0.556	45%	0.445	S	S	*	.	S	Bend	trans	-77.6	129.2	173.8	-83.6	-177.7	173.3	0	0	111.7	Q8 V14	Q8-E12 HydrophobicContact CG-CG 4.4Å; Q8-E12 WeakPolarHBondContact O-CB 3.47Å; Q8-E12 WeakPolarHBondContact O-CG 3.43Å; Q8-E12 PolarHBondContact O-N 3.16Å; E12-V14 PolarHBondContact O-N 2.86Å
13	E	53.3	Low	65.5	Low	89 Å²	89	75 Å²	75	42%	0.416	40%	0.401	S	S	.	.			trans	-55.4	123.4	172.1	-169	-179.7	-149.3	0	0	109.7	K15 S112	E13-K15 PolarHBondContact O-N 3.24Å; E13-S112 VanDerWaalsContact CD-CB 3.41Å; E13-S112 WeakPolarHBondContact OE1-CB 3.28Å; E13-S112 VanDerWaalsContact OE2-CB 3.24Å; E13-S112 WeakPolarHBondContact OE2-CB 3.42Å
14	V	54.2	Low	68	Low	75 Å²	75	73.4 Å²	73.4	46%	0.455	37%	0.374	S	S	.	.			trans	-65.1	98.1	178.3	176.7	0	0	0	0	108.7	E12 T16 S38 A39	E12-V14 PolarHBondContact O-N 2.86Å; V14-T16 HydrophobicContact CG1-CG2 3.99Å; V14-T16 PolarHBondContact O-N 2.69Å; V14-S38 WeakPolarHBondContact CG1-O 3.41Å; V14-A39 HydrophobicContact CG1-CB 3.69Å
15	K	56.4	Low	70.3	Confident	172 Å²	172	65.4 Å²	65.4	75%	0.748	34%	0.336	S	S	*	.			trans	-70.4	96.1	172.1	-70.3	-177.1	-178.3	173.8	0	108.9	E13 G17	E13-K15 PolarHBondContact O-N 3.24Å; K15-G17 PolarHBondContact O-N 3.43Å
16	T	62.7	Low	71.9	Confident	17 Å²	17	68.2 Å²	68.2	10%	0.104	34%	0.338	C	S	.	.			trans	-79.4	113.2	169.4	80.7	0	0	0	0	107	V14 V37 S38 G64	V14-T16 HydrophobicContact CG1-CG2 3.99Å; V14-T16 PolarHBondContact O-N 2.69Å; T16-V37 HydrophobicContact CG2-CG1 3.54Å; T16-S38 WeakPolarHBondContact CA-O 3.3Å; T16-S38 WeakPolarHBondContact CG2-O 3.39Å; T16-G64 PolarHBondContact OG1-O 3.48Å
17	G	71.6	Confident	73.6	Confident	4 Å²	4	62.6 Å²	62.6	4%	0.041	32%	0.322	C	S	.	.			trans	-71.7	149.5	171.5	0	0	0	0	0	110.2	K15 S38 K50 S146	K15-G17 PolarHBondContact O-N 3.43Å; G17-S38 PolarHBondContact N-OG 3.44Å; G17-K50 PolarHBondContact O-NZ 3.08Å; G17-S146 WeakPolarHBondContact CA-OG 3.1Å
18	T	89.8	Confident	75.6	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.012	30%	0.304	C	S	.	.			trans	-157.5	144.3	-165.1	-70.7	0	0	0	0	108.8	I20 D34 K50 G145 S146 G147 S186	T18-I20 HydrophobicContact CG2-CG2 3.77Å; T18-D34 WeakPolarHBondContact CA-OD1 3.29Å; T18-K50 HydrophobicContact CG2-CD 3.65Å; T18-K50 PolarHBondContact OG1-NZ 3.46Å; T18-G145 CarbonylContact O-C 3.19Å; T18-G145 WeakPolarHBondContact O-CA 3.4Å; T18-S146 PolarHBondContact N-OG 3.03Å; T18-S146 PolarHBondContact O-N 3.05Å; T18-S146 PolarHBondContact O-OG 2.92Å; T18-G147 PolarHBondContact O-N 2.88Å; T18-G147 VanDerWaalsContact O-N 3.08Å; T18-S186 VanDerWaalsContact C-OG 3.27Å
19	T	95.5	Very high	78.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.272	C	S	.	.			trans	-121.3	119	162.9	-50.3	0	0	0	0	108.5	S33 D34 G147 L176 A179 S186	T19-S33 VanDerWaalsContact O-CA 3.3Å; T19-S33 WeakPolarHBondContact O-CA 3.34Å; T19-D34 PolarHBondContact N-OD1 2.87Å; T19-D34 PolarHBondContact O-N 3.14Å; T19-G147 WeakPolarHBondContact OG1-CA 3.35Å; T19-L176 HydrophobicContact CG2-CD2 3.78Å; T19-A179 HydrophobicContact CG2-CB 3.55Å; T19-A179 WeakPolarHBondContact OG1-CB 3.42Å; T19-S186 PolarHBondContact N-OG 2.99Å; T19-S186 WeakPolarHBondContact OG1-CB 3.44Å; T19-S186 PolarHBondContact OG1-OG 3.26Å
20	I	96.9	Very high	80.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.4	170.6	52.8	170.6	0	0	0	109.7	T18 G32 A61 I116 V143 G144	T18-I20 HydrophobicContact CG2-CG2 3.77Å; I20-G32 WeakPolarHBondContact CA-O 3.49Å; I20-A61 HydrophobicContact CB-CB 3.84Å; I20-A61 HydrophobicContact CD1-CB 4.04Å; I20-A61 HydrophobicContact CG2-CB 3.86Å; I20-I116 HydrophobicContact CB-CD1 4.47Å; I20-I116 HydrophobicContact CD1-CD1 3.83Å; I20-I116 HydrophobicContact CD1-CG1 3.96Å; I20-I116 HydrophobicContact CG1-CD1 3.92Å; I20-V143 CarbonylContact O-C 3.51Å; I20-V143 WeakPolarHBondContact O-CA 3.44Å; I20-V143 WeakPolarHBondContact O-CG1 3.48Å; I20-G144 PolarHBondContact N-O 2.93Å; I20-G144 VanDerWaalsContact N-O 3.08Å; I20-G144 PolarHBondContact O-N 2.89Å
21	I	98.1	Very high	83	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	146.9	177.7	177.1	164.3	0	0	0	110.1	L31 G32 A142 V143 V155 F171 V172 T175 L176	I21-L31 CarbonylContact O-C 3.57Å; I21-L31 WeakPolarHBondContact O-CA 3.4Å; I21-G32 PolarHBondContact N-O 3.16Å; I21-G32 PolarHBondContact O-N 2.75Å; I21-A142 CarbonylContact C-O 3.58Å; I21-A142 VanDerWaalsContact CA-O 3.24Å; I21-A142 WeakPolarHBondContact CA-O 3.49Å; I21-V143 HydrophobicContact CB-CG2 4.38Å; I21-V143 HydrophobicContact CD1-CG2 3.91Å; I21-V143 HydrophobicContact CG1-CG2 4.02Å; I21-V155 HydrophobicContact CD1-CG1 4.4Å; I21-F171 HydrophobicContact CD1-CD1 4.2Å; I21-F171 HydrophobicContact CD1-CE1 3.8Å; I21-V172 HydrophobicContact CD1-CG2 4.41Å; I21-V172 HydrophobicContact CG1-CG2 4.35Å; I21-V172 HydrophobicContact CG2-CB 4.34Å; I21-V172 HydrophobicContact CG2-CG1 3.76Å; I21-V172 HydrophobicContact CG2-CG2 4.16Å; I21-T175 HydrophobicContact CD1-CG2 3.74Å; I21-L176 HydrophobicContact CG2-CD2 4.09Å; I21-L176 HydrophobicContact CG2-CG 4.13Å
22	A	98.4	Very high	85.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	150.3	163	0	0	0	0	0	111	V30 L31 I116 A118 V128 F141 A142	A22-V30 CarbonylContact C-O 3.58Å; A22-V30 VanDerWaalsContact CA-O 3.22Å; A22-V30 WeakPolarHBondContact CA-O 3.21Å; A22-L31 HydrophobicContact CB-CG 4.11Å; A22-I116 HydrophobicContact CB-CG2 3.7Å; A22-A118 HydrophobicContact CB-CB 4Å; A22-V128 HydrophobicContact CB-CG1 3.82Å; A22-V128 HydrophobicContact CB-CG2 3.85Å; A22-F141 CarbonylContact O-C 3.52Å; A22-F141 WeakPolarHBondContact O-CA 3.42Å; A22-F141 WeakPolarHBondContact O-CB 3.21Å; A22-A142 PolarHBondContact N-O 2.95Å; A22-A142 PolarHBondContact O-N 3.23Å
23	I	98.5	Very high	87.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	137.1	178.9	-178.4	166.1	0	0	0	111	V29 V30 F141 Y159 M163 C168 F171 V172	I23-V29 CarbonylContact O-C 3.59Å; I23-V29 VanDerWaalsContact O-CA 3.3Å; I23-V29 WeakPolarHBondContact O-CA 3.38Å; I23-V30 HydrophobicContact CG2-CB 4.04Å; I23-V30 PolarHBondContact N-O 3.15Å; I23-V30 PolarHBondContact O-N 2.97Å; I23-F141 HydrophobicContact CB-CB 4.08Å; I23-F141 HydrophobicContact CG1-CB 4.12Å; I23-Y159 HydrophobicContact CD1-CD2 3.79Å; I23-Y159 HydrophobicContact CD1-CE2 4.01Å; I23-Y159 HydrophobicContact CG1-CE2 4.41Å; I23-M163 HydrophobicContact CD1-SD 4.32Å; I23-C168 HydrophobicContact CG2-CB 3.86Å; I23-F171 HydrophobicContact CD1-CD1 3.59Å; I23-F171 HydrophobicContact CD1-CE1 3.74Å; I23-F171 HydrophobicContact CD1-CG 4.3Å; I23-F171 HydrophobicContact CG2-CD1 4.45Å; I23-V172 HydrophobicContact CG2-CG2 3.73Å
24	E	97.9	Very high	89.9	Confident	41 Å²	41	24.9 Å²	24.9	19%	0.192	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	139.5	171.4	-61.9	-174.7	-171	0	0	110.6	V29 Q127 V128 R138 P140	E24-V29 HydrophobicContact CG-CG1 4.19Å; E24-Q127 WeakPolarHBondContact OE1-CA 3.46Å; E24-V128 HydrophobicContact CG-CB 4.03Å; E24-V128 HydrophobicContact CG-CG2 3.65Å; E24-V128 PolarHBondContact OE1-N 3.48Å; E24-R138 IonicContact OE1-CZ 3.98Å; E24-R138 IonicContact OE1-NE 3.93Å; E24-R138 PolarHBondContact OE1-NE 3.15Å; E24-R138 VanDerWaalsContact OE1-NE 3.14Å; E24-R138 IonicContact OE1-NH2 3.89Å; E24-R138 IonicContact OE2-CZ 2.75Å; E24-R138 IonicContact OE2-NE 2.79Å; E24-R138 IonicContact OE2-NH2 3.14Å; E24-R138 PolarHBondContact OE2-NH2 3.25Å; E24-R138 VanDerWaalsContact OE2-NH2 3.15Å; E24-P140 PolarHBondContact N-O 3.12Å
25	F	96.9	Very high	91.9	Very high	24 Å²	24	21.3 Å²	21.3	11%	0.105	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	169.1	169.6	72.2	-93.1	0	0	0	110.7	G27 G28 V29 V30 M163 K165 C168 T194 D196	F25-G27 PolarHBondContact O-N 3.26Å; F25-G28 VanDerWaalsContact CD1-C 3.41Å; F25-G28 WeakPolarHBondContact CD1-O 3.39Å; F25-G28 PolarHBondContact N-O 2.98Å; F25-G28 PolarHBondContact O-N 2.94Å; F25-G28 VanDerWaalsContact O-N 3.16Å; F25-G28 VanDerWaalsContact O-O 3.06Å; F25-V29 VanDerWaalsContact CE1-N 3.27Å; F25-V30 HydrophobicContact CD1-CG2 3.98Å; F25-V30 HydrophobicContact CE1-CG2 3.94Å; F25-M163 WeakPolarHBondContact CB-O 2.97Å; F25-K165 HydrophobicContact CD2-CB 4.13Å; F25-K165 HydrophobicContact CE2-CB 3.77Å; F25-K165 HydrophobicContact CE2-CG 4.39Å; F25-K165 HydrophobicContact CZ-CB 3.98Å; F25-K165 HydrophobicContact CZ-CD 4.25Å; F25-K165 HydrophobicContact CZ-CG 4.1Å; F25-C168 HydrophobicContact CB-CB 4.32Å; F25-C168 VanDerWaalsContact CB-SG 3.55Å; F25-C168 HydrophobicContact CD1-CB 4.49Å; F25-T194 HydrophobicContact CE1-CG2 4.02Å; F25-T194 HydrophobicContact CZ-CG2 4.23Å; F25-D196 HydrophobicContact CZ-CB 4.43Å
26	N	92.2	Very high	93.7	Very high	151 Å²	151	16.5 Å²	16.5	81%	0.807	9%	0.091	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	100.6	177.1	-171.8	20	0	0	0	110.8
27	G	92.3	Very high	95	Very high	37 Å²	37	16.2 Å²	16.2	38%	0.381	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	115.4	-7.3	-179.6	0	0	0	0	0	115	F25 D196	F25-G27 PolarHBondContact O-N 3.26Å; G27-D196 WeakPolarHBondContact O-CB 3.2Å
28	G	97.7	Very high	95.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.7	-161.4	-174.3	0	0	0	0	0	115.9	F25 I195	F25-G28 VanDerWaalsContact CD1-C 3.41Å; F25-G28 WeakPolarHBondContact CD1-O 3.39Å; F25-G28 PolarHBondContact N-O 2.98Å; F25-G28 PolarHBondContact O-N 2.94Å; F25-G28 VanDerWaalsContact O-N 3.16Å; F25-G28 VanDerWaalsContact O-O 3.06Å; G28-I195 CarbonylContact C-O 3.51Å; G28-I195 WeakPolarHBondContact CA-O 3.46Å
29	V	98.6	Very high	95.2	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	154.6	177.2	-62.2	0	0	0	0	111.6	I23 E24 F25 L31 A118 V128 T194 I195	I23-V29 CarbonylContact O-C 3.59Å; I23-V29 VanDerWaalsContact O-CA 3.3Å; I23-V29 WeakPolarHBondContact O-CA 3.38Å; E24-V29 HydrophobicContact CG-CG1 4.19Å; F25-V29 VanDerWaalsContact CE1-N 3.27Å; V29-L31 HydrophobicContact CG2-CD1 4.06Å; V29-A118 HydrophobicContact CB-CB 4.36Å; V29-A118 HydrophobicContact CG2-CB 4.1Å; V29-V128 HydrophobicContact CB-CG2 4.44Å; V29-V128 HydrophobicContact CG1-CG2 3.96Å; V29-T194 WeakPolarHBondContact O-CA 3.37Å; V29-I195 HydrophobicContact CG2-CB 3.87Å; V29-I195 HydrophobicContact CG2-CD1 4.08Å; V29-I195 HydrophobicContact CG2-CG1 4.22Å; V29-I195 PolarHBondContact N-O 3.06Å; V29-I195 PolarHBondContact O-N 2.93Å
30	V	98.8	Very high	94.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.5	167.6	-174.4	0	0	0	0	108.3	A22 I23 F25 C168 Q169 V172 L192 V193 T194	A22-V30 CarbonylContact C-O 3.58Å; A22-V30 VanDerWaalsContact CA-O 3.22Å; A22-V30 WeakPolarHBondContact CA-O 3.21Å; I23-V30 HydrophobicContact CG2-CB 4.04Å; I23-V30 PolarHBondContact N-O 3.15Å; I23-V30 PolarHBondContact O-N 2.97Å; F25-V30 HydrophobicContact CD1-CG2 3.98Å; F25-V30 HydrophobicContact CE1-CG2 3.94Å; V30-C168 HydrophobicContact CG2-CB 3.87Å; V30-Q169 HydrophobicContact CG1-CG 4.21Å; V30-Q169 HydrophobicContact CG2-CG 4.06Å; V30-V172 HydrophobicContact CB-CG2 4.27Å; V30-V172 HydrophobicContact CG1-CB 4.29Å; V30-V172 HydrophobicContact CG1-CG2 3.91Å; V30-L192 HydrophobicContact CG1-CD2 4.35Å; V30-V193 CarbonylContact C-O 3.5Å; V30-V193 WeakPolarHBondContact CA-O 3.1Å; V30-T194 HydrophobicContact CG2-CG2 3.93Å
31	L	98.6	Very high	93.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	151.5	168.8	-57.6	90.3	0	0	0	109.8	I21 A22 V29 L51 A61 A118 L192 V193 I195	I21-L31 CarbonylContact O-C 3.57Å; I21-L31 WeakPolarHBondContact O-CA 3.4Å; A22-L31 HydrophobicContact CB-CG 4.11Å; V29-L31 HydrophobicContact CG2-CD1 4.06Å; L31-L51 HydrophobicContact CB-CD1 4.19Å; L31-L51 HydrophobicContact CB-CD2 4.01Å; L31-L51 HydrophobicContact CD2-CD2 4.47Å; L31-A61 HydrophobicContact CD2-CB 4.37Å; L31-A118 HydrophobicContact CD1-CB 3.94Å; L31-A118 HydrophobicContact CD2-CB 3.86Å; L31-A118 HydrophobicContact CG-CB 3.84Å; L31-L192 WeakPolarHBondContact O-CA 3.29Å; L31-V193 HydrophobicContact CB-CB 4.45Å; L31-V193 HydrophobicContact CD1-CB 4.41Å; L31-V193 HydrophobicContact CD1-CG1 4.45Å; L31-V193 PolarHBondContact N-O 2.99Å; L31-V193 PolarHBondContact O-N 3.4Å; L31-I195 HydrophobicContact CD1-CD1 3.74Å; L31-I195 HydrophobicContact CD1-CG1 4.32Å
32	G	98.4	Very high	93.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	147.7	172.5	0	0	0	0	0	112.9	I20 I21 Y191	I20-G32 WeakPolarHBondContact CA-O 3.49Å; I21-G32 PolarHBondContact N-O 3.16Å; I21-G32 PolarHBondContact O-N 2.75Å; G32-Y191 CarbonylContact C-O 3.57Å; G32-Y191 WeakPolarHBondContact CA-O 3.47Å
33	S	98	Very high	92.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	153.5	170.4	79.8	0	0	0	0	112	T19 A190 Y191	T19-S33 VanDerWaalsContact O-CA 3.3Å; T19-S33 WeakPolarHBondContact O-CA 3.34Å; S33-A190 WeakPolarHBondContact O-CA 3.48Å; S33-Y191 PolarHBondContact N-O 3.23Å; S33-Y191 PolarHBondContact O-N 2.74Å
34	D	97.2	Very high	92.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.247	C	C	.	.			trans	-72.4	178	158.6	86.6	-62.5	0	0	0	110.3	T18 T19 R36 K50 M180 S186 G187	T18-D34 WeakPolarHBondContact CA-OD1 3.29Å; T19-D34 PolarHBondContact N-OD1 2.87Å; T19-D34 PolarHBondContact O-N 3.14Å; D34-R36 PolarHBondContact OD2-N 2.94Å; D34-K50 VanDerWaalsContact CG-NZ 3.34Å; D34-K50 WeakPolarHBondContact O-CD 3.23Å; D34-K50 IonicContact OD1-NZ 2.74Å; D34-K50 PolarHBondContact OD1-NZ 2.78Å; D34-K50 IonicContact OD2-NZ 3.31Å; D34-K50 PolarHBondContact OD2-NZ 2.79Å; D34-M180 HydrophobicContact CB-CG 3.89Å; D34-M180 HydrophobicContact CB-SD 4.07Å; D34-S186 VanDerWaalsContact OD2-CA 3.29Å; D34-S186 WeakPolarHBondContact OD2-CA 3.47Å; D34-G187 PolarHBondContact OD2-N 2.76Å
35	S	95.6	Very high	91.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.254	C	S	.	.			trans	-124	-2.8	-173.6	71.1	0	0	0	0	115.6	R46 V47 M48 G187 G188 V189	S35-R46 CarbonylContact O-C 3.27Å; S35-R46 VanDerWaalsContact O-C 3.27Å; S35-R46 PolarHBondContact OG-O 2.97Å; S35-V47 PolarHBondContact O-N 2.91Å; S35-M48 VanDerWaalsContact CA-O 3.23Å; S35-M48 WeakPolarHBondContact CA-O 3.31Å; S35-M48 WeakPolarHBondContact CB-O 3.49Å; S35-M48 PolarHBondContact O-N 3.21Å; S35-G187 PolarHBondContact N-O 2.95Å; S35-G187 VanDerWaalsContact N-O 3.14Å; S35-G187 PolarHBondContact OG-O 3.34Å; S35-G188 WeakPolarHBondContact OG-CA 3.37Å; S35-V189 PolarHBondContact N-O 3.43Å; S35-V189 WeakPolarHBondContact OG-CG2 3.43Å; S35-V189 PolarHBondContact OG-N 2.92Å; S35-V189 PolarHBondContact OG-O 3.43Å
36	R	93.4	Very high	91.6	Very high	71 Å²	71	50.1 Å²	50.1	27%	0.268	28%	0.282	S	S	.	.			trans	-78.9	138.5	-177.8	-178.9	177.3	-69.4	176.7	4.6	110.4	D34 V43 N45 K50 G184 S185 S186 G187	D34-R36 PolarHBondContact OD2-N 2.94Å; R36-V43 HydrophobicContact CG-CG1 3.9Å; R36-V43 HydrophobicContact CG-CG2 4.23Å; R36-N45 CarbonylContact C-O 3.59Å; R36-N45 WeakPolarHBondContact CA-O 3.42Å; R36-K50 WeakPolarHBondContact O-CE 3.5Å; R36-K50 PolarHBondContact O-NZ 2.95Å; R36-G184 PolarHBondContact NH1-O 3.47Å; R36-S185 WeakPolarHBondContact CD-O 3.34Å; R36-S186 PolarHBondContact NH1-O 3.05Å; R36-G187 WeakPolarHBondContact CB-O 3.4Å; R36-G187 PolarHBondContact N-O 2.66Å
37	V	90.1	Very high	91.7	Very high	10 Å²	10	47 Å²	47	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.9	167.1	-172.7	0	0	0	0	107.1	T16 V44 N45 M48	T16-V37 HydrophobicContact CG2-CG1 3.54Å; V37-V44 HydrophobicContact CB-CG2 3.95Å; V37-V44 HydrophobicContact CG1-CG2 3.67Å; V37-V44 VanDerWaalsContact O-CG2 3.27Å; V37-V44 WeakPolarHBondContact O-CG2 3.29Å; V37-V44 PolarHBondContact O-N 2.84Å; V37-N45 HydrophobicContact CB-CB 3.99Å; V37-N45 HydrophobicContact CG2-CB 4.07Å; V37-N45 PolarHBondContact N-O 3.35Å; V37-N45 PolarHBondContact O-N 3.4Å; V37-M48 HydrophobicContact CG2-CB 3.62Å; V37-M48 HydrophobicContact CG2-CG 4.09Å; V37-M48 HydrophobicContact CG2-SD 3.59Å; V37-M48 VanDerWaalsContact CG2-SD 3.59Å
38	S	84.4	Confident	91.7	Very high	4 Å²	4	46.5 Å²	46.5	3%	0.028	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	143.1	179.8	58.5	0	0	0	0	111.5	V14 T16 G17 S42	V14-S38 WeakPolarHBondContact CG1-O 3.41Å; T16-S38 WeakPolarHBondContact CA-O 3.3Å; T16-S38 WeakPolarHBondContact CG2-O 3.39Å; G17-S38 PolarHBondContact N-OG 3.44Å; S38-S42 CarbonylContact C-O 3.5Å; S38-S42 VanDerWaalsContact CA-O 3.29Å; S38-S42 WeakPolarHBondContact CA-O 3.4Å
39	A	82.8	Confident	91.6	Very high	34 Å²	34	49.2 Å²	49.2	28%	0.281	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	100	163.6	0	0	0	0	0	109.1	V14 E41 S42 V44	V14-A39 HydrophobicContact CG1-CB 3.69Å; A39-E41 PolarHBondContact O-N 3Å; A39-S42 PolarHBondContact N-O 2.81Å; A39-S42 PolarHBondContact O-N 2.9Å; A39-S42 VanDerWaalsContact O-N 3.08Å; A39-V44 HydrophobicContact CB-CG1 3.59Å
40	G	79.1	Confident	91.4	Very high	60 Å²	60	49.5 Å²	49.5	62%	0.619	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	-126.9	-165.8	0	0	0	0	0	110.7	S42	G40-S42 VanDerWaalsContact C-N 3.31Å
41	E	81.9	Confident	91.4	Very high	203 Å²	203	49.7 Å²	49.7	95%	0.949	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.1	178.3	-59.9	-175.7	162.6	0	0	113.5	A39	A39-E41 PolarHBondContact O-N 3Å
42	S	84.5	Confident	91.3	Very high	79 Å²	79	51.1 Å²	51.1	55%	0.552	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.4	-177.3	-67.2	0	0	0	0	111.7	S38 A39 G40	S38-S42 CarbonylContact C-O 3.5Å; S38-S42 VanDerWaalsContact CA-O 3.29Å; S38-S42 WeakPolarHBondContact CA-O 3.4Å; A39-S42 PolarHBondContact N-O 2.81Å; A39-S42 PolarHBondContact O-N 2.9Å; A39-S42 VanDerWaalsContact O-N 3.08Å; G40-S42 VanDerWaalsContact C-N 3.31Å
43	V	89.3	Confident	91.2	Very high	59 Å²	59	54.1 Å²	54.1	36%	0.358	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	111.3	172.4	179.3	0	0	0	0	109.3	R36 N45 R46	R36-V43 HydrophobicContact CG-CG1 3.9Å; R36-V43 HydrophobicContact CG-CG2 4.23Å; V43-N45 WeakPolarHBondContact CG1-O 3.07Å; V43-R46 HydrophobicContact CG1-CG 3.65Å
44	V	89.1	Confident	91.2	Very high	97 Å²	97	54.1 Å²	54.1	59%	0.588	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	-29.4	-177.7	-62.8	0	0	0	0	112.7	V37 A39	V37-V44 HydrophobicContact CB-CG2 3.95Å; V37-V44 HydrophobicContact CG1-CG2 3.67Å; V37-V44 VanDerWaalsContact O-CG2 3.27Å; V37-V44 WeakPolarHBondContact O-CG2 3.29Å; V37-V44 PolarHBondContact O-N 2.84Å; A39-V44 HydrophobicContact CB-CG1 3.59Å
45	N	90.1	Very high	91.2	Very high	63 Å²	63	55 Å²	55	34%	0.337	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	139.6	171.6	-168.6	-15.2	0	0	0	109.7	R36 V37 V43 V47	R36-N45 CarbonylContact C-O 3.59Å; R36-N45 WeakPolarHBondContact CA-O 3.42Å; V37-N45 HydrophobicContact CB-CB 3.99Å; V37-N45 HydrophobicContact CG2-CB 4.07Å; V37-N45 PolarHBondContact N-O 3.35Å; V37-N45 PolarHBondContact O-N 3.4Å; V43-N45 WeakPolarHBondContact CG1-O 3.07Å; N45-V47 PolarHBondContact OD1-N 2.9Å
46	R	91.4	Very high	91.1	Very high	184 Å²	184	61 Å²	61	69%	0.694	34%	0.339	S	S	*	.	S	Bend	trans	-103.4	-16.4	-178.7	-68.1	-178.4	177.7	-166.9	-0.1	113.7	S35 V43	S35-R46 CarbonylContact O-C 3.27Å; S35-R46 VanDerWaalsContact O-C 3.27Å; S35-R46 PolarHBondContact OG-O 2.97Å; V43-R46 HydrophobicContact CG1-CG 3.65Å
47	V	93.9	Very high	91.3	Very high	86 Å²	86	59.6 Å²	59.6	52%	0.521	34%	0.335	S	S	.	.	S	Bend	trans	-137	32.5	-166.7	-65	0	0	0	0	112.3	S35 N45 N49 Y191	S35-V47 PolarHBondContact O-N 2.91Å; N45-V47 PolarHBondContact OD1-N 2.9Å; V47-N49 PolarHBondContact O-N 2.95Å; V47-Y191 PolarHBondContact O-OH 3Å; V47-Y191 VanDerWaalsContact O-OH 3.05Å
48	M	93.3	Very high	91.7	Very high	27 Å²	27	59.3 Å²	59.3	13%	0.133	33%	0.333	C	S	.	.			trans	-72.9	124.9	175.6	-178.1	153	169.5	0	0	110.2	S35 V37 K50 A66 Q70 Y191	S35-M48 VanDerWaalsContact CA-O 3.23Å; S35-M48 WeakPolarHBondContact CA-O 3.31Å; S35-M48 WeakPolarHBondContact CB-O 3.49Å; S35-M48 PolarHBondContact O-N 3.21Å; V37-M48 HydrophobicContact CG2-CB 3.62Å; V37-M48 HydrophobicContact CG2-CG 4.09Å; V37-M48 HydrophobicContact CG2-SD 3.59Å; V37-M48 VanDerWaalsContact CG2-SD 3.59Å; M48-K50 HydrophobicContact CG-CG 4.49Å; M48-K50 PolarHBondContact O-N 3.42Å; M48-A66 HydrophobicContact CE-CB 4.15Å; M48-Q70 VanDerWaalsContact CE-CD 3.47Å; M48-Q70 HydrophobicContact CE-CG 4Å; M48-Y191 WeakPolarHBondContact O-CE2 3.23Å
49	N	94.4	Very high	92.4	Very high	57 Å²	57	59.9 Å²	59.9	31%	0.305	33%	0.334	S	S	.	.			trans	-76.6	119.1	168.2	-172.5	-1.3	0	0	0	109	V47 L51 Y191	V47-N49 PolarHBondContact O-N 2.95Å; N49-L51 WeakPolarHBondContact OD1-CB 3.48Å; N49-L51 PolarHBondContact OD1-N 2.8Å; N49-Y191 HydrophobicContact CB-CD1 4.16Å; N49-Y191 HydrophobicContact CB-CD2 4.13Å; N49-Y191 HydrophobicContact CB-CE1 4.06Å; N49-Y191 HydrophobicContact CB-CE2 4Å; N49-Y191 HydrophobicContact CB-CG 4.22Å
50	K	95.6	Very high	93.1	Very high	6 Å²	6	58.3 Å²	58.3	3%	0.026	32%	0.321	C	S	.	.			trans	-98.6	9.4	-179.9	-49.9	177	-173.1	177.5	0	112	G17 T18 D34 R36 M48 A61 L62	G17-K50 PolarHBondContact O-NZ 3.08Å; T18-K50 HydrophobicContact CG2-CD 3.65Å; T18-K50 PolarHBondContact OG1-NZ 3.46Å; D34-K50 VanDerWaalsContact CG-NZ 3.34Å; D34-K50 WeakPolarHBondContact O-CD 3.23Å; D34-K50 IonicContact OD1-NZ 2.74Å; D34-K50 PolarHBondContact OD1-NZ 2.78Å; D34-K50 IonicContact OD2-NZ 3.31Å; D34-K50 PolarHBondContact OD2-NZ 2.79Å; R36-K50 WeakPolarHBondContact O-CE 3.5Å; R36-K50 PolarHBondContact O-NZ 2.95Å; M48-K50 HydrophobicContact CG-CG 4.49Å; M48-K50 PolarHBondContact O-N 3.42Å; K50-A61 CarbonylContact O-C 3.58Å; K50-A61 WeakPolarHBondContact O-CA 3.22Å; K50-L62 HydrophobicContact CB-CB 4.38Å; K50-L62 WeakPolarHBondContact O-CB 3.4Å; K50-L62 WeakPolarHBondContact O-CG 3.25Å; K50-L62 PolarHBondContact O-N 3.21Å
51	L	97.6	Very high	93.9	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	100	174.6	-54.1	-179.4	0	0	0	108	L31 N49 Y59 A61 V193	L31-L51 HydrophobicContact CB-CD1 4.19Å; L31-L51 HydrophobicContact CB-CD2 4.01Å; L31-L51 HydrophobicContact CD2-CD2 4.47Å; N49-L51 WeakPolarHBondContact OD1-CB 3.48Å; N49-L51 PolarHBondContact OD1-N 2.8Å; L51-Y59 HydrophobicContact CB-CD1 4.34Å; L51-A61 HydrophobicContact CD2-CB 3.57Å; L51-V193 HydrophobicContact CB-CG2 4.03Å; L51-V193 HydrophobicContact CD1-CB 4.12Å; L51-V193 HydrophobicContact CD1-CG2 3.59Å; L51-V193 HydrophobicContact CG-CG2 4.46Å
52	S	96.9	Very high	94.5	Very high	29 Å²	29	46.2 Å²	46.2	20%	0.203	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.3	-177.3	-167.2	0	0	0	0	111	L54 Y59 C60	S52-L54 PolarHBondContact O-N 2.83Å; S52-Y59 CarbonylContact O-C 3.53Å; S52-Y59 WeakPolarHBondContact O-CA 3.41Å; S52-C60 PolarHBondContact N-O 3.49Å; S52-C60 PolarHBondContact O-N 2.99Å
53	P	97.3	Very high	94.7	Very high	64 Å²	64	42.9 Å²	42.9	42%	0.416	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133	173.3	28.8	-33.4	0	0	0	110.3	Y59	P53-Y59 HydrophobicContact CB-CD1 4.43Å; P53-Y59 HydrophobicContact CB-CE1 4.03Å; P53-Y59 HydrophobicContact CB-CE2 4.15Å
54	L	97.1	Very high	94.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-28.8	168.1	-60.6	-173.3	0	0	0	111.6	S52 I58 C60 A73 V76 N77 L80 A96 V100 V117	S52-L54 PolarHBondContact O-N 2.83Å; L54-I58 WeakPolarHBondContact CA-O 3.37Å; L54-I58 HydrophobicContact CB-CB 4.36Å; L54-I58 HydrophobicContact CB-CG2 4.09Å; L54-I58 HydrophobicContact CD1-CG2 4.2Å; L54-I58 PolarHBondContact N-O 3.03Å; L54-C60 HydrophobicContact CD1-CB 3.86Å; L54-C60 HydrophobicContact CD2-CB 3.86Å; L54-C60 HydrophobicContact CG-CB 3.78Å; L54-A73 HydrophobicContact CD2-CB 3.9Å; L54-A73 WeakPolarHBondContact CD2-O 3.46Å; L54-V76 HydrophobicContact CD1-CG1 3.99Å; L54-V76 HydrophobicContact CD2-CB 4.16Å; L54-V76 HydrophobicContact CD2-CG1 4.14Å; L54-V76 HydrophobicContact CG-CG1 4.48Å; L54-N77 VanDerWaalsContact O-CA 3.31Å; L54-N77 WeakPolarHBondContact O-CA 3.35Å; L54-N77 PolarHBondContact O-ND2 2.81Å; L54-L80 HydrophobicContact CB-CD1 3.94Å; L54-A96 HydrophobicContact CD1-CB 4.25Å; L54-V100 HydrophobicContact CD1-CG2 3.95Å; L54-V117 HydrophobicContact CD1-CG1 4.08Å; L54-V117 HydrophobicContact CD1-CG2 4.33Å
55	H	96.8	Very high	94.3	Very high	19 Å²	19	37.3 Å²	37.3	9%	0.088	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	173.4	171.8	-164.5	-85.3	0	0	0	107.3	K57 I58 D81 S84 D90 P91	H55-K57 PolarHBondContact O-N 3.12Å; H55-I58 HydrophobicContact CB-CB 4.33Å; H55-I58 HydrophobicContact CB-CD1 4.4Å; H55-I58 HydrophobicContact CB-CG1 4.48Å; H55-I58 PolarHBondContact N-O 3.27Å; H55-I58 VanDerWaalsContact N-O 3.12Å; H55-I58 PolarHBondContact O-N 3.19Å; H55-D81 IonicContact CD2-OD1 3.35Å; H55-D81 PolarHBondContact CD2-OD1 3.35Å; H55-S84 PolarHBondContact NE2-OG 2.86Å; H55-D90 IonicContact CE1-OD1 3.92Å; H55-P91 HydrophobicContact CB-CG 3.97Å; H55-P91 VanDerWaalsContact CD2-CG 3.48Å; H55-P91 WeakPolarHBondContact CD2-CG 3.3Å; H55-P91 VanDerWaalsContact CE1-CD 3.46Å; H55-P91 WeakPolarHBondContact CE1-CD 3.43Å; H55-P91 VanDerWaalsContact NE2-CD 3.35Å; H55-P91 WeakPolarHBondContact NE2-CD 3.27Å
56	D	95.1	Very high	93.8	Very high	125 Å²	125	35.6 Å²	35.6	67%	0.668	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45	-37	-176.9	-68.9	-4.3	0	0	0	116	T200	D56-T200 PolarHBondContact O-OG1 2.83Å
57	K	97.4	Very high	93.3	Very high	42 Å²	42	29.6 Å²	29.6	18%	0.183	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	20.7	-178.5	-63	-175.2	-178.2	178.3	0	113.5	H55 G119 W120 I195 E197	H55-K57 PolarHBondContact O-N 3.12Å; K57-G119 CarbonylContact O-C 3.59Å; K57-G119 WeakPolarHBondContact O-CA 3.49Å; K57-W120 HydrophobicContact CD-CE3 3.71Å; K57-W120 HydrophobicContact CD-CZ3 4.2Å; K57-W120 PolarHBondContact O-N 3.13Å; K57-I195 HydrophobicContact CB-CG2 3.86Å; K57-I195 HydrophobicContact CG-CG2 4.32Å; K57-E197 PolarHBondContact NZ-O 3.24Å
58	I	98.4	Very high	92.9	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.5	-179.6	-53.3	174.6	0	0	0	108.9	L54 H55 P91 V93 A96 V117	L54-I58 WeakPolarHBondContact CA-O 3.37Å; L54-I58 HydrophobicContact CB-CB 4.36Å; L54-I58 HydrophobicContact CB-CG2 4.09Å; L54-I58 HydrophobicContact CD1-CG2 4.2Å; L54-I58 PolarHBondContact N-O 3.03Å; H55-I58 HydrophobicContact CB-CB 4.33Å; H55-I58 HydrophobicContact CB-CD1 4.4Å; H55-I58 HydrophobicContact CB-CG1 4.48Å; H55-I58 PolarHBondContact N-O 3.27Å; H55-I58 VanDerWaalsContact N-O 3.12Å; H55-I58 PolarHBondContact O-N 3.19Å; I58-P91 HydrophobicContact CD1-CB 4.36Å; I58-P91 HydrophobicContact CD1-CG 4Å; I58-V93 HydrophobicContact CG1-CG2 4.37Å; I58-V93 HydrophobicContact CG2-CG1 4.49Å; I58-A96 HydrophobicContact CD1-CB 4.02Å; I58-A96 HydrophobicContact CG2-CB 3.77Å; I58-V117 HydrophobicContact CG2-CG1 3.92Å
59	Y	98.4	Very high	92.5	Very high	16 Å²	16	26.2 Å²	26.2	6%	0.063	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	155.4	179.7	-81.3	-116.8	0	0	0	111	L51 S52 P53 V117 A118 V193 I195 T200 E202	L51-Y59 HydrophobicContact CB-CD1 4.34Å; S52-Y59 CarbonylContact O-C 3.53Å; S52-Y59 WeakPolarHBondContact O-CA 3.41Å; P53-Y59 HydrophobicContact CB-CD1 4.43Å; P53-Y59 HydrophobicContact CB-CE1 4.03Å; P53-Y59 HydrophobicContact CB-CE2 4.15Å; Y59-V117 WeakPolarHBondContact O-CA 3.33Å; Y59-A118 PolarHBondContact N-O 3.05Å; Y59-A118 PolarHBondContact O-N 3.31Å; Y59-A118 VanDerWaalsContact O-O 3.07Å; Y59-V193 HydrophobicContact CD1-CB 4.37Å; Y59-V193 HydrophobicContact CD1-CG1 3.94Å; Y59-V193 HydrophobicContact CD1-CG2 3.96Å; Y59-V193 HydrophobicContact CD2-CG1 4.06Å; Y59-V193 HydrophobicContact CE1-CB 4.49Å; Y59-V193 HydrophobicContact CE1-CG1 3.92Å; Y59-V193 HydrophobicContact CE1-CG2 3.86Å; Y59-V193 HydrophobicContact CE2-CG1 4.09Å; Y59-V193 HydrophobicContact CG-CG1 4Å; Y59-I195 HydrophobicContact CD2-CD1 3.63Å; Y59-I195 HydrophobicContact CE2-CD1 4.41Å; Y59-I195 HydrophobicContact CG-CD1 4.22Å; Y59-T200 HydrophobicContact CE2-CG2 3.71Å; Y59-E202 PolarHBondContact OH-OE1 2.91Å
60	C	97.3	Very high	92.2	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.9	173.8	-167.6	0	0	0	0	109.4	S52 L54 L62 I116	S52-C60 PolarHBondContact N-O 3.49Å; S52-C60 PolarHBondContact O-N 2.99Å; L54-C60 HydrophobicContact CD1-CB 3.86Å; L54-C60 HydrophobicContact CD2-CB 3.86Å; L54-C60 HydrophobicContact CG-CB 3.78Å; C60-L62 HydrophobicContact CB-CD2 4.13Å; C60-I116 CarbonylContact C-O 3.46Å; C60-I116 WeakPolarHBondContact CA-O 3.31Å
61	A	96.7	Very high	91.9	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	127.4	169.2	0	0	0	0	0	109.7	I20 L31 K50 L51 L115 I116	I20-A61 HydrophobicContact CB-CB 3.84Å; I20-A61 HydrophobicContact CD1-CB 4.04Å; I20-A61 HydrophobicContact CG2-CB 3.86Å; L31-A61 HydrophobicContact CD2-CB 4.37Å; K50-A61 CarbonylContact O-C 3.58Å; K50-A61 WeakPolarHBondContact O-CA 3.22Å; L51-A61 HydrophobicContact CD2-CB 3.57Å; A61-L115 WeakPolarHBondContact O-CA 3.33Å; A61-I116 HydrophobicContact CB-CB 4.22Å; A61-I116 PolarHBondContact N-O 3.15Å; A61-I116 PolarHBondContact O-N 2.9Å; A61-I116 VanDerWaalsContact O-N 3.12Å
62	L	93.1	Very high	91.6	Very high	9 Å²	9	30 Å²	30	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128	-168.4	-53.5	-174	0	0	0	110.9	K50 C60 A69 Q70 A73 L115	K50-L62 HydrophobicContact CB-CB 4.38Å; K50-L62 WeakPolarHBondContact O-CB 3.4Å; K50-L62 WeakPolarHBondContact O-CG 3.25Å; K50-L62 PolarHBondContact O-N 3.21Å; C60-L62 HydrophobicContact CB-CD2 4.13Å; L62-A69 HydrophobicContact CB-CB 3.81Å; L62-A69 HydrophobicContact CD1-CB 4.25Å; L62-A69 HydrophobicContact CD2-CB 4.11Å; L62-A69 HydrophobicContact CG-CB 4.26Å; L62-Q70 HydrophobicContact CD1-CG 3.97Å; L62-A73 HydrophobicContact CD2-CB 4.19Å; L62-L115 HydrophobicContact CD2-CD2 3.72Å
63	S	89.6	Confident	91.4	Very high	10 Å²	10	28.6 Å²	28.6	7%	0.07	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	147.5	170.6	174.4	0	0	0	0	110.7	A113 H114 G145	S63-A113 WeakPolarHBondContact O-CA 3.49Å; S63-H114 VanDerWaalsContact CB-O 3.32Å; S63-H114 WeakPolarHBondContact CB-O 3.23Å; S63-H114 PolarHBondContact N-O 3.5Å; S63-H114 VanDerWaalsContact N-O 3.15Å; S63-H114 PolarHBondContact O-N 3.35Å; S63-G145 WeakPolarHBondContact OG-CA 3.45Å
64	G	85.6	Confident	91.2	Very high	17 Å²	17	31.7 Å²	31.7	18%	0.175	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	111.4	-140.7	-179.2	0	0	0	0	0	111.7	T16 A66 S112	T16-G64 PolarHBondContact OG1-O 3.48Å; G64-A66 PolarHBondContact O-N 3.42Å; G64-S112 CarbonylContact C-O 3.6Å; G64-S112 VanDerWaalsContact CA-O 3.26Å; G64-S112 WeakPolarHBondContact CA-O 3.29Å
65	S	83.9	Confident	91.1	Very high	21 Å²	21	35.8 Å²	35.8	15%	0.147	20%	0.2	C	C	.	.	S	Bend	trans	-62.7	118.7	171	168	0	0	0	0	109.7	A67 D68 A69 S112	S65-A67 VanDerWaalsContact C-N 3.35Å; S65-A67 PolarHBondContact O-N 3.32Å; S65-D68 WeakPolarHBondContact CB-OD2 3.06Å; S65-D68 PolarHBondContact O-N 3.33Å; S65-D68 PolarHBondContact OG-OD2 3.03Å; S65-A69 WeakPolarHBondContact O-CB 3.34Å; S65-A69 PolarHBondContact O-N 2.77Å; S65-S112 PolarHBondContact N-O 3.01Å
66	A	79.3	Confident	91	Very high	27 Å²	27	34.9 Å²	34.9	22%	0.223	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-42.4	-174.4	0	0	0	0	0	111.8	M48 G64 Q70	M48-A66 HydrophobicContact CE-CB 4.15Å; G64-A66 PolarHBondContact O-N 3.42Å; A66-Q70 WeakPolarHBondContact O-CB 3.16Å; A66-Q70 VanDerWaalsContact O-CG 3.27Å; A66-Q70 WeakPolarHBondContact O-CG 3.45Å; A66-Q70 PolarHBondContact O-N 2.91Å
67	A	81.9	Confident	91.1	Very high	59 Å²	59	31.4 Å²	31.4	49%	0.488	18%	0.177	S	C	.	.	H	α-helix	trans	-64.4	-44	179.7	0	0	0	0	0	111.7	S65 T71	S65-A67 VanDerWaalsContact C-N 3.35Å; S65-A67 PolarHBondContact O-N 3.32Å; A67-T71 WeakPolarHBondContact O-CB 3.41Å; A67-T71 PolarHBondContact O-N 2.82Å; A67-T71 PolarHBondContact O-OG1 3.38Å
68	D	84.6	Confident	91.1	Very high	40 Å²	40	37.1 Å²	37.1	21%	0.214	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-48.4	179.7	-67.5	-27.5	0	0	0	111.4	S65 Q70 T71 I72 L111	S65-D68 WeakPolarHBondContact CB-OD2 3.06Å; S65-D68 PolarHBondContact O-N 3.33Å; S65-D68 PolarHBondContact OG-OD2 3.03Å; D68-Q70 VanDerWaalsContact C-N 3.33Å; D68-Q70 PolarHBondContact O-N 2.95Å; D68-T71 PolarHBondContact O-N 2.83Å; D68-I72 WeakPolarHBondContact O-CD1 3.31Å; D68-I72 WeakPolarHBondContact O-CG1 3.43Å; D68-I72 PolarHBondContact O-N 2.97Å; D68-L111 HydrophobicContact CB-CD2 3.64Å; D68-L111 VanDerWaalsContact CG-CD2 3.43Å
69	A	85.7	Confident	91	Very high	1 Å²	1	41 Å²	41	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-39.7	-178.9	0	0	0	0	0	112.1	L62 S65 A73 L115	L62-A69 HydrophobicContact CB-CB 3.81Å; L62-A69 HydrophobicContact CD1-CB 4.25Å; L62-A69 HydrophobicContact CD2-CB 4.11Å; L62-A69 HydrophobicContact CG-CB 4.26Å; S65-A69 WeakPolarHBondContact O-CB 3.34Å; S65-A69 PolarHBondContact O-N 2.77Å; A69-A73 PolarHBondContact O-N 2.81Å; A69-A73 VanDerWaalsContact O-N 3.17Å; A69-L115 HydrophobicContact CB-CD2 3.96Å
70	Q	88.1	Confident	90.8	Very high	79 Å²	79	40.3 Å²	40.3	37%	0.369	21%	0.214	S	C	.	.	H	α-helix	trans	-64.2	-47.5	174.3	-75.5	179.1	-47.7	0	0	111.7	M48 L62 A66 D68 I72 A73 E74	M48-Q70 VanDerWaalsContact CE-CD 3.47Å; M48-Q70 HydrophobicContact CE-CG 4Å; L62-Q70 HydrophobicContact CD1-CG 3.97Å; A66-Q70 WeakPolarHBondContact O-CB 3.16Å; A66-Q70 VanDerWaalsContact O-CG 3.27Å; A66-Q70 WeakPolarHBondContact O-CG 3.45Å; A66-Q70 PolarHBondContact O-N 2.91Å; D68-Q70 VanDerWaalsContact C-N 3.33Å; D68-Q70 PolarHBondContact O-N 2.95Å; Q70-I72 VanDerWaalsContact C-N 3.31Å; Q70-I72 PolarHBondContact O-N 2.72Å; Q70-A73 PolarHBondContact O-N 3.45Å; Q70-A73 VanDerWaalsContact O-N 3.08Å; Q70-E74 WeakPolarHBondContact O-CG 3.47Å; Q70-E74 PolarHBondContact O-N 3.14Å
71	T	89.9	Confident	90.7	Very high	63 Å²	63	43 Å²	43	39%	0.387	23%	0.229	S	C	.	.	H	α-helix	trans	-58.7	-43.4	-180	-59.4	0	0	0	0	111.4	A67 D68 A73 E74 M75	A67-T71 WeakPolarHBondContact O-CB 3.41Å; A67-T71 PolarHBondContact O-N 2.82Å; A67-T71 PolarHBondContact O-OG1 3.38Å; D68-T71 PolarHBondContact O-N 2.83Å; T71-A73 PolarHBondContact O-N 3.28Å; T71-E74 PolarHBondContact O-N 2.95Å; T71-M75 HydrophobicContact CG2-CE 3.6Å; T71-M75 HydrophobicContact CG2-SD 4.28Å; T71-M75 WeakPolarHBondContact O-CB 3.41Å; T71-M75 VanDerWaalsContact O-CG 3.29Å; T71-M75 WeakPolarHBondContact O-CG 3.34Å; T71-M75 PolarHBondContact O-N 3.49Å
72	I	90.6	Very high	90.6	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-45.6	176.2	-63.3	159.5	0	0	0	110.6	D68 Q70 M75 V76 V100 I103 L111 A113 L115	D68-I72 WeakPolarHBondContact O-CD1 3.31Å; D68-I72 WeakPolarHBondContact O-CG1 3.43Å; D68-I72 PolarHBondContact O-N 2.97Å; Q70-I72 VanDerWaalsContact C-N 3.31Å; Q70-I72 PolarHBondContact O-N 2.72Å; I72-M75 PolarHBondContact O-N 3.44Å; I72-V76 HydrophobicContact CG2-CG2 4.45Å; I72-V76 VanDerWaalsContact O-CG2 3.32Å; I72-V76 WeakPolarHBondContact O-CG2 3.37Å; I72-V76 PolarHBondContact O-N 3.47Å; I72-V100 HydrophobicContact CG2-CG1 4.31Å; I72-I103 HydrophobicContact CG1-CG2 4.07Å; I72-I103 HydrophobicContact CG2-CB 4.47Å; I72-I103 HydrophobicContact CG2-CG2 4.21Å; I72-L111 HydrophobicContact CD1-CD1 3.69Å; I72-L111 HydrophobicContact CG1-CD1 4.06Å; I72-A113 HydrophobicContact CD1-CB 4.14Å; I72-L115 HydrophobicContact CB-CD1 4.42Å; I72-L115 HydrophobicContact CD1-CD1 4.01Å; I72-L115 HydrophobicContact CG2-CD1 3.89Å
73	A	93.1	Very high	90.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-44	-179.2	0	0	0	0	0	111.9	L54 L62 A69 Q70 T71 V76 N77	L54-A73 HydrophobicContact CD2-CB 3.9Å; L54-A73 WeakPolarHBondContact CD2-O 3.46Å; L62-A73 HydrophobicContact CD2-CB 4.19Å; A69-A73 PolarHBondContact O-N 2.81Å; A69-A73 VanDerWaalsContact O-N 3.17Å; Q70-A73 PolarHBondContact O-N 3.45Å; Q70-A73 VanDerWaalsContact O-N 3.08Å; T71-A73 PolarHBondContact O-N 3.28Å; A73-V76 PolarHBondContact O-N 2.86Å; A73-N77 WeakPolarHBondContact O-CB 3.4Å; A73-N77 PolarHBondContact O-N 3Å
74	E	93.8	Very high	90.8	Very high	129 Å²	129	49.4 Å²	49.4	60%	0.603	26%	0.262	S	S	*	.	H	α-helix	trans	-63.5	-43.9	177.3	-70.6	174.5	-175.1	0	0	112.2	Q70 T71 V76 N77 Y78	Q70-E74 WeakPolarHBondContact O-CG 3.47Å; Q70-E74 PolarHBondContact O-N 3.14Å; T71-E74 PolarHBondContact O-N 2.95Å; E74-V76 VanDerWaalsContact C-N 3.33Å; E74-V76 PolarHBondContact O-N 3.34Å; E74-N77 PolarHBondContact O-N 2.95Å; E74-Y78 PolarHBondContact O-N 2.9Å
75	M	93.9	Very high	91.2	Very high	87 Å²	87	56.3 Å²	56.3	43%	0.429	29%	0.292	S	S	.	.	H	α-helix	trans	-61.2	-42	175.9	-74.1	-177.9	-179	0	0	112.1	T71 I72 Q79 I103	T71-M75 HydrophobicContact CG2-CE 3.6Å; T71-M75 HydrophobicContact CG2-SD 4.28Å; T71-M75 WeakPolarHBondContact O-CB 3.41Å; T71-M75 VanDerWaalsContact O-CG 3.29Å; T71-M75 WeakPolarHBondContact O-CG 3.34Å; T71-M75 PolarHBondContact O-N 3.49Å; I72-M75 PolarHBondContact O-N 3.44Å; M75-Q79 WeakPolarHBondContact O-CG 3.34Å; M75-Q79 PolarHBondContact O-N 2.77Å; M75-Q79 VanDerWaalsContact O-N 3.15Å; M75-I103 HydrophobicContact CB-CD1 4.17Å
76	V	95.6	Very high	91.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-70.3	-41.9	179	172.7	0	0	0	0	111	L54 I72 A73 E74 Y78 Q79 L80 L99 V100 I103	L54-V76 HydrophobicContact CD1-CG1 3.99Å; L54-V76 HydrophobicContact CD2-CB 4.16Å; L54-V76 HydrophobicContact CD2-CG1 4.14Å; L54-V76 HydrophobicContact CG-CG1 4.48Å; I72-V76 HydrophobicContact CG2-CG2 4.45Å; I72-V76 VanDerWaalsContact O-CG2 3.32Å; I72-V76 WeakPolarHBondContact O-CG2 3.37Å; I72-V76 PolarHBondContact O-N 3.47Å; A73-V76 PolarHBondContact O-N 2.86Å; E74-V76 VanDerWaalsContact C-N 3.33Å; E74-V76 PolarHBondContact O-N 3.34Å; V76-Y78 PolarHBondContact O-N 2.84Å; V76-Q79 PolarHBondContact O-N 3.12Å; V76-L80 HydrophobicContact CG1-CD1 3.67Å; V76-L80 HydrophobicContact CG1-CG 4.06Å; V76-L80 WeakPolarHBondContact O-CB 3.39Å; V76-L80 VanDerWaalsContact O-CG 3.3Å; V76-L80 WeakPolarHBondContact O-CG 3.49Å; V76-L80 PolarHBondContact O-N 2.94Å; V76-L99 HydrophobicContact CG1-CB 4.03Å; V76-L99 HydrophobicContact CG1-CD1 4.29Å; V76-L99 HydrophobicContact CG2-CB 4.01Å; V76-V100 HydrophobicContact CB-CG2 4.35Å; V76-V100 HydrophobicContact CG1-CG2 4.1Å; V76-V100 HydrophobicContact CG2-CG2 3.85Å; V76-I103 HydrophobicContact CG2-CD1 3.58Å
77	N	96.9	Very high	92.4	Very high	51 Å²	51	65.7 Å²	65.7	27%	0.273	33%	0.331	S	S	.	.	H	α-helix	trans	-56.4	-51.6	175.9	169.1	-113.2	0	0	0	111	L54 A73 E74 Q79 L80 D81	L54-N77 VanDerWaalsContact O-CA 3.31Å; L54-N77 WeakPolarHBondContact O-CA 3.35Å; L54-N77 PolarHBondContact O-ND2 2.81Å; A73-N77 WeakPolarHBondContact O-CB 3.4Å; A73-N77 PolarHBondContact O-N 3Å; E74-N77 PolarHBondContact O-N 2.95Å; N77-Q79 VanDerWaalsContact C-N 3.33Å; N77-Q79 PolarHBondContact O-N 3.27Å; N77-L80 PolarHBondContact O-N 2.75Å; N77-L80 VanDerWaalsContact O-N 3.15Å; N77-D81 PolarHBondContact ND2-OD2 2.79Å; N77-D81 PolarHBondContact O-N 3.45Å
78	Y	96.3	Very high	92.9	Very high	163 Å²	163	66 Å²	66	64%	0.639	34%	0.34	S	S	*	.	H	α-helix	trans	-56.2	-45.3	177	174.8	-99.3	0	0	0	112.9	E74 V76 D81 V82	E74-Y78 PolarHBondContact O-N 2.9Å; V76-Y78 PolarHBondContact O-N 2.84Å; Y78-D81 PolarHBondContact O-N 3.03Å; Y78-V82 HydrophobicContact CD2-CG2 4.49Å; Y78-V82 HydrophobicContact CE1-CG2 4.2Å; Y78-V82 HydrophobicContact CE2-CG2 4.04Å; Y78-V82 WeakPolarHBondContact O-CG2 3.38Å; Y78-V82 PolarHBondContact O-N 3.35Å; Y78-V82 VanDerWaalsContact O-N 3.13Å
79	Q	95.8	Very high	93.3	Very high	85 Å²	85	70 Å²	70	40%	0.397	36%	0.357	S	S	.	.	H	α-helix	trans	-66.1	-38	179.3	-73.7	177.7	14.3	0	0	112.7	M75 V76 N77 H83 L99	M75-Q79 WeakPolarHBondContact O-CG 3.34Å; M75-Q79 PolarHBondContact O-N 2.77Å; M75-Q79 VanDerWaalsContact O-N 3.15Å; V76-Q79 PolarHBondContact O-N 3.12Å; N77-Q79 VanDerWaalsContact C-N 3.33Å; N77-Q79 PolarHBondContact O-N 3.27Å; Q79-H83 VanDerWaalsContact O-CB 3.27Å; Q79-H83 WeakPolarHBondContact O-CB 3.22Å; Q79-H83 PolarHBondContact O-N 3.01Å; Q79-H83 VanDerWaalsContact O-N 3.08Å; Q79-L99 HydrophobicContact CB-CD1 4.17Å
80	L	95.9	Very high	93.6	Very high	1 Å²	1	73.9 Å²	73.9	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-68.1	-41.5	177.2	-73.8	173.3	0	0	0	111.7	L54 V76 N77 H83 S84 P91 A96 L99	L54-L80 HydrophobicContact CB-CD1 3.94Å; V76-L80 HydrophobicContact CG1-CD1 3.67Å; V76-L80 HydrophobicContact CG1-CG 4.06Å; V76-L80 WeakPolarHBondContact O-CB 3.39Å; V76-L80 VanDerWaalsContact O-CG 3.3Å; V76-L80 WeakPolarHBondContact O-CG 3.49Å; V76-L80 PolarHBondContact O-N 2.94Å; N77-L80 PolarHBondContact O-N 2.75Å; N77-L80 VanDerWaalsContact O-N 3.15Å; L80-H83 PolarHBondContact O-N 3.35Å; L80-S84 WeakPolarHBondContact O-CB 3.24Å; L80-S84 PolarHBondContact O-N 2.91Å; L80-P91 HydrophobicContact CD2-CB 3.87Å; L80-P91 HydrophobicContact CD2-CG 4.45Å; L80-A96 HydrophobicContact CD1-CB 3.52Å; L80-A96 HydrophobicContact CD2-CB 4.2Å; L80-A96 HydrophobicContact CG-CB 4.47Å; L80-L99 HydrophobicContact CD2-CD1 3.71Å; L80-L99 HydrophobicContact CG-CD1 3.93Å
81	D	94.7	Very high	94	Very high	57 Å²	57	70.7 Å²	70.7	31%	0.305	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-47.2	179.7	-70.9	-10.1	0	0	0	110.9	H55 N77 Y78 H83 S84 M85	H55-D81 IonicContact CD2-OD1 3.35Å; H55-D81 PolarHBondContact CD2-OD1 3.35Å; N77-D81 PolarHBondContact ND2-OD2 2.79Å; N77-D81 PolarHBondContact O-N 3.45Å; Y78-D81 PolarHBondContact O-N 3.03Å; D81-H83 VanDerWaalsContact C-N 3.33Å; D81-H83 PolarHBondContact O-N 3.34Å; D81-S84 PolarHBondContact O-N 2.97Å; D81-M85 WeakPolarHBondContact O-CB 3.49Å; D81-M85 VanDerWaalsContact O-CG 3.24Å; D81-M85 WeakPolarHBondContact O-CG 3.44Å; D81-M85 PolarHBondContact O-N 2.87Å
82	V	95.3	Very high	94.3	Very high	52 Å²	52	70.5 Å²	70.5	32%	0.315	36%	0.359	S	S	.	.	H	α-helix	trans	-58.6	-46.3	175	173.1	0	0	0	0	110.9	Y78 M85 E86	Y78-V82 HydrophobicContact CD2-CG2 4.49Å; Y78-V82 HydrophobicContact CE1-CG2 4.2Å; Y78-V82 HydrophobicContact CE2-CG2 4.04Å; Y78-V82 WeakPolarHBondContact O-CG2 3.38Å; Y78-V82 PolarHBondContact O-N 3.35Å; Y78-V82 VanDerWaalsContact O-N 3.13Å; V82-M85 PolarHBondContact O-N 2.94Å; V82-E86 WeakPolarHBondContact O-CG 3.2Å; V82-E86 PolarHBondContact O-N 2.8Å
83	H	92.9	Very high	94.6	Very high	84 Å²	84	70.3 Å²	70.3	39%	0.389	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-41.4	-179.5	-173.9	62.6	0	0	0	113	Q79 L80 D81 M85 E86 I87	Q79-H83 VanDerWaalsContact O-CB 3.27Å; Q79-H83 WeakPolarHBondContact O-CB 3.22Å; Q79-H83 PolarHBondContact O-N 3.01Å; Q79-H83 VanDerWaalsContact O-N 3.08Å; L80-H83 PolarHBondContact O-N 3.35Å; D81-H83 VanDerWaalsContact C-N 3.33Å; D81-H83 PolarHBondContact O-N 3.34Å; H83-M85 VanDerWaalsContact C-N 3.35Å; H83-E86 PolarHBondContact O-N 3.3Å; H83-I87 WeakPolarHBondContact CE1-CD1 3.36Å; H83-I87 VanDerWaalsContact NE2-CD1 3.25Å; H83-I87 WeakPolarHBondContact NE2-CD1 3.13Å; H83-I87 WeakPolarHBondContact O-CG1 3.24Å; H83-I87 PolarHBondContact O-N 3.08Å
84	S	93.9	Very high	94.8	Very high	17 Å²	17	77.1 Å²	77.1	12%	0.119	38%	0.383	C	S	.	.	H	α-helix	trans	-61.1	-43.7	176.2	179.9	0	0	0	0	110.9	H55 L80 D81 I87 G88 E89	H55-S84 PolarHBondContact NE2-OG 2.86Å; L80-S84 WeakPolarHBondContact O-CB 3.24Å; L80-S84 PolarHBondContact O-N 2.91Å; D81-S84 PolarHBondContact O-N 2.97Å; S84-I87 PolarHBondContact O-N 3.41Å; S84-G88 WeakPolarHBondContact O-CA 3.47Å; S84-G88 PolarHBondContact O-N 3.35Å; S84-E89 PolarHBondContact O-N 2.94Å; S84-E89 PolarHBondContact OG-O 3.4Å
85	M	94.1	Very high	94.9	Very high	162 Å²	162	73 Å²	73	80%	0.798	37%	0.369	S	S	*	.	H	α-helix	trans	-65.2	-39	176.3	-70.3	176.5	69.7	0	0	113.1	D81 V82 H83	D81-M85 WeakPolarHBondContact O-CB 3.49Å; D81-M85 VanDerWaalsContact O-CG 3.24Å; D81-M85 WeakPolarHBondContact O-CG 3.44Å; D81-M85 PolarHBondContact O-N 2.87Å; V82-M85 PolarHBondContact O-N 2.94Å; H83-M85 VanDerWaalsContact C-N 3.35Å
86	E	93.9	Very high	95	Very high	149 Å²	149	68.8 Å²	68.8	70%	0.696	35%	0.348	S	S	*	.	H	α-helix	trans	-68.2	-40.8	178.3	-75.3	179.5	165.6	0	0	112.6	V82 H83	V82-E86 WeakPolarHBondContact O-CG 3.2Å; V82-E86 PolarHBondContact O-N 2.8Å; H83-E86 PolarHBondContact O-N 3.3Å
87	I	93.2	Very high	95	Very high	96 Å²	96	68.8 Å²	68.8	49%	0.492	35%	0.348	S	S	.	.	H	α-helix	trans	-81	-30.6	-179.9	-66.4	-174.2	0	0	0	111.6	H83 S84 E89	H83-I87 WeakPolarHBondContact CE1-CD1 3.36Å; H83-I87 VanDerWaalsContact NE2-CD1 3.25Å; H83-I87 WeakPolarHBondContact NE2-CD1 3.13Å; H83-I87 WeakPolarHBondContact O-CG1 3.24Å; H83-I87 PolarHBondContact O-N 3.08Å; S84-I87 PolarHBondContact O-N 3.41Å; I87-E89 VanDerWaalsContact C-N 3.34Å; I87-E89 HydrophobicContact CG2-CB 3.88Å; I87-E89 HydrophobicContact CG2-CG 4.06Å
88	G	93.1	Very high	94.9	Very high	66 Å²	66	68.6 Å²	68.6	68%	0.68	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	23.5	-171.3	0	0	0	0	0	113.4	S84	S84-G88 WeakPolarHBondContact O-CA 3.47Å; S84-G88 PolarHBondContact O-N 3.35Å
89	E	92	Very high	94.9	Very high	124 Å²	124	63 Å²	63	58%	0.579	33%	0.33	S	S	*	.	S	Bend	trans	-136.8	147.2	177.9	-65.2	-170.2	164.4	0	0	111.4	S84 I87	S84-E89 PolarHBondContact O-N 2.94Å; S84-E89 PolarHBondContact OG-O 3.4Å; I87-E89 VanDerWaalsContact C-N 3.34Å; I87-E89 HydrophobicContact CG2-CB 3.88Å; I87-E89 HydrophobicContact CG2-CG 4.06Å
90	D	93.3	Very high	94.8	Very high	83 Å²	83	59 Å²	59	44%	0.444	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-57.2	138.3	173.9	-63.8	-35.9	0	0	0	111.1	H55 R122	H55-D90 IonicContact CE1-OD1 3.92Å; D90-R122 IonicContact OD2-NH2 3.88Å
91	P	95.4	Very high	94.6	Very high	12 Å²	12	61.5 Å²	61.5	8%	0.078	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-68.5	152	-179.4	27.8	-33.6	0	0	0	112.2	H55 I58 L80	H55-P91 HydrophobicContact CB-CG 3.97Å; H55-P91 VanDerWaalsContact CD2-CG 3.48Å; H55-P91 WeakPolarHBondContact CD2-CG 3.3Å; H55-P91 VanDerWaalsContact CE1-CD 3.46Å; H55-P91 WeakPolarHBondContact CE1-CD 3.43Å; H55-P91 VanDerWaalsContact NE2-CD 3.35Å; H55-P91 WeakPolarHBondContact NE2-CD 3.27Å; I58-P91 HydrophobicContact CD1-CB 4.36Å; I58-P91 HydrophobicContact CD1-CG 4Å; L80-P91 HydrophobicContact CD2-CB 3.87Å; L80-P91 HydrophobicContact CD2-CG 4.45Å
92	Q	96.5	Very high	94.4	Very high	58 Å²	58	62.4 Å²	62.4	27%	0.271	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-78.5	146.2	172.2	-67.4	168.4	17.5	0	0	111.1	R94 S95 A96 D121 R123	Q92-R94 PolarHBondContact O-N 2.92Å; Q92-S95 WeakPolarHBondContact O-CB 3.4Å; Q92-S95 PolarHBondContact O-N 3.27Å; Q92-A96 PolarHBondContact O-N 3.22Å; Q92-D121 WeakPolarHBondContact CA-OD2 3.18Å; Q92-D121 WeakPolarHBondContact CB-OD2 3.3Å; Q92-R123 VanDerWaalsContact NE2-CD 3.34Å; Q92-R123 VanDerWaalsContact NE2-NE 3.19Å
93	V	97.5	Very high	94.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.4	-38.8	177.3	-170.2	0	0	0	0	110.2	I58 S95 A96 A97 V117 G119 D121 Q127 F129	I58-V93 HydrophobicContact CG1-CG2 4.37Å; I58-V93 HydrophobicContact CG2-CG1 4.49Å; V93-S95 VanDerWaalsContact C-N 3.3Å; V93-S95 PolarHBondContact O-N 2.96Å; V93-A96 PolarHBondContact O-N 2.86Å; V93-A97 WeakPolarHBondContact O-CB 3.45Å; V93-A97 PolarHBondContact O-N 3.42Å; V93-V117 HydrophobicContact CG1-CG1 4.36Å; V93-G119 VanDerWaalsContact CG2-C 3.49Å; V93-D121 HydrophobicContact CG2-CB 4.11Å; V93-D121 PolarHBondContact N-OD2 2.86Å; V93-Q127 HydrophobicContact CB-CB 4.19Å; V93-Q127 VanDerWaalsContact CB-OE1 3.25Å; V93-Q127 HydrophobicContact CG1-CB 4.09Å; V93-Q127 HydrophobicContact CG2-CB 4.43Å; V93-Q127 VanDerWaalsContact CG2-OE1 3.3Å; V93-F129 HydrophobicContact CB-CE2 4.41Å; V93-F129 HydrophobicContact CG1-CD2 4.07Å; V93-F129 HydrophobicContact CG1-CE2 4.11Å
94	R	96.4	Very high	93.8	Very high	143 Å²	143	57.7 Å²	57.7	54%	0.54	30%	0.304	S	S	.	.	H	α-helix	trans	-62.5	-35.6	177.1	-173.1	175.2	-178.6	169.9	0	112.8	Q92 T98 F129	Q92-R94 PolarHBondContact O-N 2.92Å; R94-T98 WeakPolarHBondContact O-CB 3.49Å; R94-T98 PolarHBondContact O-N 3.14Å; R94-T98 PolarHBondContact O-OG1 3.02Å; R94-F129 HydrophobicContact CB-CE2 4.33Å; R94-F129 HydrophobicContact CB-CZ 4.02Å; R94-F129 HydrophobicContact CG-CZ 4.16Å
95	S	95.8	Very high	93.5	Very high	42 Å²	42	62.8 Å²	62.8	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-66.2	-48.6	176.7	-64	0	0	0	0	110.4	Q92 V93 A97 T98 L99	Q92-S95 WeakPolarHBondContact O-CB 3.4Å; Q92-S95 PolarHBondContact O-N 3.27Å; V93-S95 VanDerWaalsContact C-N 3.3Å; V93-S95 PolarHBondContact O-N 2.96Å; S95-A97 PolarHBondContact O-N 3.16Å; S95-T98 WeakPolarHBondContact O-CB 3.26Å; S95-T98 PolarHBondContact O-N 3Å; S95-T98 VanDerWaalsContact O-N 3.16Å; S95-L99 PolarHBondContact O-N 2.87Å
96	A	96.8	Very high	93.2	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-56.2	-48.8	174.6	0	0	0	0	0	111.9	L54 I58 L80 Q92 V93 T98 L99 V100 V117	L54-A96 HydrophobicContact CD1-CB 4.25Å; I58-A96 HydrophobicContact CD1-CB 4.02Å; I58-A96 HydrophobicContact CG2-CB 3.77Å; L80-A96 HydrophobicContact CD1-CB 3.52Å; L80-A96 HydrophobicContact CD2-CB 4.2Å; L80-A96 HydrophobicContact CG-CB 4.47Å; Q92-A96 PolarHBondContact O-N 3.22Å; V93-A96 PolarHBondContact O-N 2.86Å; A96-T98 VanDerWaalsContact C-N 3.26Å; A96-T98 PolarHBondContact O-N 2.91Å; A96-L99 PolarHBondContact O-N 2.83Å; A96-L99 VanDerWaalsContact O-N 3.14Å; A96-V100 WeakPolarHBondContact O-CG2 3.46Å; A96-V100 PolarHBondContact O-N 3.3Å; A96-V117 HydrophobicContact CB-CG1 4.35Å
97	A	95.9	Very high	92.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-31	-179.8	0	0	0	0	0	112.7	V93 S95 K101 V117 F129 L136	V93-A97 WeakPolarHBondContact O-CB 3.45Å; V93-A97 PolarHBondContact O-N 3.42Å; S95-A97 PolarHBondContact O-N 3.16Å; A97-K101 WeakPolarHBondContact O-CB 3.46Å; A97-K101 PolarHBondContact O-N 3.02Å; A97-V117 HydrophobicContact CB-CB 3.87Å; A97-V117 HydrophobicContact CB-CG1 3.93Å; A97-V117 HydrophobicContact CB-CG2 4.24Å; A97-F129 HydrophobicContact CB-CB 3.76Å; A97-F129 HydrophobicContact CB-CD1 4.41Å; A97-F129 HydrophobicContact CB-CD2 3.79Å; A97-F129 HydrophobicContact CB-CE2 4.49Å; A97-F129 HydrophobicContact CB-CG 3.74Å; A97-L136 HydrophobicContact CB-CD1 3.76Å; A97-L136 HydrophobicContact CB-CD2 4.16Å
98	T	95	Very high	92.2	Very high	47 Å²	47	59 Å²	59	29%	0.288	29%	0.293	S	S	.	.	H	α-helix	trans	-69.3	-40.1	173.8	-59.9	0	0	0	0	112	R94 S95 A96 K101 N102	R94-T98 WeakPolarHBondContact O-CB 3.49Å; R94-T98 PolarHBondContact O-N 3.14Å; R94-T98 PolarHBondContact O-OG1 3.02Å; S95-T98 WeakPolarHBondContact O-CB 3.26Å; S95-T98 PolarHBondContact O-N 3Å; S95-T98 VanDerWaalsContact O-N 3.16Å; A96-T98 VanDerWaalsContact C-N 3.26Å; A96-T98 PolarHBondContact O-N 2.91Å; T98-K101 PolarHBondContact O-N 3.43Å; T98-N102 WeakPolarHBondContact O-CB 3.39Å; T98-N102 PolarHBondContact O-N 3.36Å; T98-N102 PolarHBondContact O-ND2 2.9Å
99	L	94.6	Very high	91.6	Very high	45 Å²	45	63.6 Å²	63.6	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-63.5	-48.1	175.2	-68.3	177.4	0	0	0	111.3	V76 Q79 L80 S95 A96 K101 N102 I103	V76-L99 HydrophobicContact CG1-CB 4.03Å; V76-L99 HydrophobicContact CG1-CD1 4.29Å; V76-L99 HydrophobicContact CG2-CB 4.01Å; Q79-L99 HydrophobicContact CB-CD1 4.17Å; L80-L99 HydrophobicContact CD2-CD1 3.71Å; L80-L99 HydrophobicContact CG-CD1 3.93Å; S95-L99 PolarHBondContact O-N 2.87Å; A96-L99 PolarHBondContact O-N 2.83Å; A96-L99 VanDerWaalsContact O-N 3.14Å; L99-K101 VanDerWaalsContact C-N 3.34Å; L99-K101 PolarHBondContact O-N 2.82Å; L99-N102 PolarHBondContact O-N 3.29Å; L99-N102 VanDerWaalsContact O-N 3.15Å; L99-I103 WeakPolarHBondContact O-CG1 3.42Å; L99-I103 PolarHBondContact O-N 3.34Å
100	V	93.6	Very high	90.9	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-54.4	-52.1	174.5	176.1	0	0	0	0	110.2	L54 I72 V76 A96 N102 I103 S104 L115 V117 T131	L54-V100 HydrophobicContact CD1-CG2 3.95Å; I72-V100 HydrophobicContact CG2-CG1 4.31Å; V76-V100 HydrophobicContact CB-CG2 4.35Å; V76-V100 HydrophobicContact CG1-CG2 4.1Å; V76-V100 HydrophobicContact CG2-CG2 3.85Å; A96-V100 WeakPolarHBondContact O-CG2 3.46Å; A96-V100 PolarHBondContact O-N 3.3Å; V100-N102 VanDerWaalsContact C-N 3.32Å; V100-N102 PolarHBondContact O-N 3.06Å; V100-I103 PolarHBondContact O-N 3.42Å; V100-S104 WeakPolarHBondContact O-CB 3.48Å; V100-S104 PolarHBondContact O-N 3.49Å; V100-S104 PolarHBondContact O-OG 2.9Å; V100-L115 HydrophobicContact CG1-CB 4.08Å; V100-L115 HydrophobicContact CG1-CD1 3.4Å; V100-L115 VanDerWaalsContact CG1-CD1 3.4Å; V100-L115 HydrophobicContact CG1-CG 4.37Å; V100-V117 HydrophobicContact CB-CG2 4.01Å; V100-V117 HydrophobicContact CG1-CG2 4.17Å; V100-V117 HydrophobicContact CG2-CG2 3.7Å; V100-T131 HydrophobicContact CG1-CG2 4.02Å
101	K	92.3	Very high	89.9	Confident	55 Å²	55	62.1 Å²	62.1	24%	0.239	29%	0.288	C	S	.	.	H	α-helix	trans	-56.8	-43.2	178.1	-173.1	-135.3	77.8	-170.8	0	112.5	A97 T98 L99 Y105 G134 L136	A97-K101 WeakPolarHBondContact O-CB 3.46Å; A97-K101 PolarHBondContact O-N 3.02Å; T98-K101 PolarHBondContact O-N 3.43Å; L99-K101 VanDerWaalsContact C-N 3.34Å; L99-K101 PolarHBondContact O-N 2.82Å; K101-Y105 WeakPolarHBondContact O-CB 3.25Å; K101-Y105 PolarHBondContact O-N 2.59Å; K101-G134 VanDerWaalsContact CD-O 3.31Å; K101-G134 WeakPolarHBondContact CD-O 3.39Å; K101-G134 VanDerWaalsContact CG-O 3.25Å; K101-G134 WeakPolarHBondContact CG-O 3.34Å; K101-L136 HydrophobicContact CB-CB 4.27Å; K101-L136 HydrophobicContact CB-CD1 4.44Å; K101-L136 HydrophobicContact CD-CB 3.82Å; K101-L136 HydrophobicContact CG-CB 3.94Å
102	N	91.6	Very high	88.8	Confident	76 Å²	76	64.4 Å²	64.4	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-66.4	-43	-178.2	-73.5	-16.3	0	0	0	111.7	T98 L99 V100 K106	T98-N102 WeakPolarHBondContact O-CB 3.39Å; T98-N102 PolarHBondContact O-N 3.36Å; T98-N102 PolarHBondContact O-ND2 2.9Å; L99-N102 PolarHBondContact O-N 3.29Å; L99-N102 VanDerWaalsContact O-N 3.15Å; V100-N102 VanDerWaalsContact C-N 3.32Å; V100-N102 PolarHBondContact O-N 3.06Å; N102-K106 VanDerWaalsContact O-CB 3.31Å; N102-K106 WeakPolarHBondContact O-CB 3.39Å; N102-K106 PolarHBondContact O-N 2.96Å
103	I	89.7	Confident	87.8	Confident	20 Å²	20	62.9 Å²	62.9	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-67	-50.1	177.2	-64.1	172.7	0	0	0	109.9	I72 M75 V76 L99 V100 Y105 K106 Y107	I72-I103 HydrophobicContact CG1-CG2 4.07Å; I72-I103 HydrophobicContact CG2-CB 4.47Å; I72-I103 HydrophobicContact CG2-CG2 4.21Å; M75-I103 HydrophobicContact CB-CD1 4.17Å; V76-I103 HydrophobicContact CG2-CD1 3.58Å; L99-I103 WeakPolarHBondContact O-CG1 3.42Å; L99-I103 PolarHBondContact O-N 3.34Å; V100-I103 PolarHBondContact O-N 3.42Å; I103-Y105 VanDerWaalsContact C-N 3.27Å; I103-Y105 PolarHBondContact O-N 2.68Å; I103-K106 WeakPolarHBondContact O-CB 3.32Å; I103-K106 PolarHBondContact O-N 2.92Å; I103-K106 VanDerWaalsContact O-N 3.13Å; I103-Y107 HydrophobicContact CG2-CD2 4.06Å; I103-Y107 HydrophobicContact CG2-CE2 4.24Å; I103-Y107 WeakPolarHBondContact O-CD2 3.49Å; I103-Y107 PolarHBondContact O-N 3.43Å
104	S	86.4	Confident	87.2	Confident	17 Å²	17	64.9 Å²	64.9	12%	0.119	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-38.2	178.1	-59	0	0	0	0	112.5	V100 K108	V100-S104 WeakPolarHBondContact O-CB 3.48Å; V100-S104 PolarHBondContact O-N 3.49Å; V100-S104 PolarHBondContact O-OG 2.9Å; S104-K108 WeakPolarHBondContact O-CA 3.47Å; S104-K108 PolarHBondContact O-N 3.25Å
105	Y	87	Confident	87	Confident	124 Å²	124	58 Å²	58	49%	0.486	29%	0.285	S	S	.	.	H	α-helix	trans	-72.4	-37.2	177.2	-174.5	-107	0	0	0	112.8	K101 I103 Y107 K108	K101-Y105 WeakPolarHBondContact O-CB 3.25Å; K101-Y105 PolarHBondContact O-N 2.59Å; I103-Y105 VanDerWaalsContact C-N 3.27Å; I103-Y105 PolarHBondContact O-N 2.68Å; Y105-Y107 VanDerWaalsContact C-N 3.27Å; Y105-Y107 PolarHBondContact O-N 2.82Å; Y105-K108 HydrophobicContact CD2-CD 4.03Å; Y105-K108 HydrophobicContact CE2-CD 3.86Å; Y105-K108 WeakPolarHBondContact O-CB 3.43Å; Y105-K108 WeakPolarHBondContact O-CG 3.31Å; Y105-K108 PolarHBondContact O-N 3.44Å
106	K	87.6	Confident	87	Confident	148 Å²	148	56 Å²	56	64%	0.643	27%	0.271	S	S	*	.	H	α-helix	trans	-59.9	-39.5	178.8	-178.4	-178.2	175.4	-161.6	0	111.6	N102 I103	N102-K106 VanDerWaalsContact O-CB 3.31Å; N102-K106 WeakPolarHBondContact O-CB 3.39Å; N102-K106 PolarHBondContact O-N 2.96Å; I103-K106 WeakPolarHBondContact O-CB 3.32Å; I103-K106 PolarHBondContact O-N 2.92Å; I103-K106 VanDerWaalsContact O-N 3.13Å
107	Y	84.3	Confident	87.1	Confident	77 Å²	77	56 Å²	56	30%	0.302	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	28.9	-177.6	-57.5	-80.1	0	0	0	112.3	I103 Y105 E109 E110 L111	I103-Y107 HydrophobicContact CG2-CD2 4.06Å; I103-Y107 HydrophobicContact CG2-CE2 4.24Å; I103-Y107 WeakPolarHBondContact O-CD2 3.49Å; I103-Y107 PolarHBondContact O-N 3.43Å; Y105-Y107 VanDerWaalsContact C-N 3.27Å; Y105-Y107 PolarHBondContact O-N 2.82Å; Y107-E109 PolarHBondContact O-N 3.43Å; Y107-E110 PolarHBondContact O-N 2.98Å; Y107-L111 HydrophobicContact CD2-CD1 4.24Å; Y107-L111 HydrophobicContact CG-CD1 4.18Å; Y107-L111 WeakPolarHBondContact O-CG 3.48Å; Y107-L111 PolarHBondContact O-N 2.85Å
108	K	80.9	Confident	87.2	Confident	102 Å²	102	56 Å²	56	44%	0.443	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.1	-174.1	66.7	-179.3	-178.8	172.2	0	115.7	S104 Y105	S104-K108 WeakPolarHBondContact O-CA 3.47Å; S104-K108 PolarHBondContact O-N 3.25Å; Y105-K108 HydrophobicContact CD2-CD 4.03Å; Y105-K108 HydrophobicContact CE2-CD 3.86Å; Y105-K108 WeakPolarHBondContact O-CB 3.43Å; Y105-K108 WeakPolarHBondContact O-CG 3.31Å; Y105-K108 PolarHBondContact O-N 3.44Å
109	E	80.4	Confident	87.3	Confident	163 Å²	163	53.8 Å²	53.8	76%	0.762	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-15.8	177.8	-54.1	-58.8	148.1	0	0	111.9	Y107	Y107-E109 PolarHBondContact O-N 3.43Å
110	E	78	Confident	87.5	Confident	141 Å²	141	53.2 Å²	53.2	66%	0.659	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-26	-175.1	-66.3	166.6	-150.9	0	0	112	Y107	Y107-E110 PolarHBondContact O-N 2.98Å
111	L	73.1	Confident	87.7	Confident	34 Å²	34	53.7 Å²	53.7	18%	0.178	26%	0.255	C	S	.	.			trans	-109.2	122.5	-176.7	-52.8	176.1	0	0	0	111.3	D68 I72 Y107	D68-L111 HydrophobicContact CB-CD2 3.64Å; D68-L111 VanDerWaalsContact CG-CD2 3.43Å; I72-L111 HydrophobicContact CD1-CD1 3.69Å; I72-L111 HydrophobicContact CG1-CD1 4.06Å; Y107-L111 HydrophobicContact CD2-CD1 4.24Å; Y107-L111 HydrophobicContact CG-CD1 4.18Å; Y107-L111 WeakPolarHBondContact O-CG 3.48Å; Y107-L111 PolarHBondContact O-N 2.85Å
112	S	71.9	Confident	87.8	Confident	60 Å²	60	60.6 Å²	60.6	42%	0.42	28%	0.279	S	S	.	.			trans	-100.1	83.8	164.2	-164.6	0	0	0	0	109.3	E13 G64 S65	E13-S112 VanDerWaalsContact CD-CB 3.41Å; E13-S112 WeakPolarHBondContact OE1-CB 3.28Å; E13-S112 VanDerWaalsContact OE2-CB 3.24Å; E13-S112 WeakPolarHBondContact OE2-CB 3.42Å; G64-S112 CarbonylContact C-O 3.6Å; G64-S112 VanDerWaalsContact CA-O 3.26Å; G64-S112 WeakPolarHBondContact CA-O 3.29Å; S65-S112 PolarHBondContact N-O 3.01Å
113	A	75.6	Confident	87.9	Confident	27 Å²	27	65.6 Å²	65.6	22%	0.223	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.6	178.7	0	0	0	0	0	111.5	S63 I72 L115	S63-A113 WeakPolarHBondContact O-CA 3.49Å; I72-A113 HydrophobicContact CD1-CB 4.14Å; A113-L115 HydrophobicContact CB-CD1 4.43Å; A113-L115 HydrophobicContact CB-CD2 4.19Å; A113-L115 HydrophobicContact CB-CG 4.11Å
114	H	83.6	Confident	88.2	Confident	41 Å²	41	69.1 Å²	69.1	19%	0.19	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	111.5	165	-173.3	112.6	0	0	0	107.4	S63 L132	S63-H114 VanDerWaalsContact CB-O 3.32Å; S63-H114 WeakPolarHBondContact CB-O 3.23Å; S63-H114 PolarHBondContact N-O 3.5Å; S63-H114 VanDerWaalsContact N-O 3.15Å; S63-H114 PolarHBondContact O-N 3.35Å; H114-L132 VanDerWaalsContact CE1-CD2 3.45Å; H114-L132 WeakPolarHBondContact CE1-CD2 3.46Å
115	L	92.3	Very high	88.7	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.2	-174.9	-53	176.4	0	0	0	110.5	A61 L62 A69 I72 V100 A113 T131	A61-L115 WeakPolarHBondContact O-CA 3.33Å; L62-L115 HydrophobicContact CD2-CD2 3.72Å; A69-L115 HydrophobicContact CB-CD2 3.96Å; I72-L115 HydrophobicContact CB-CD1 4.42Å; I72-L115 HydrophobicContact CD1-CD1 4.01Å; I72-L115 HydrophobicContact CG2-CD1 3.89Å; V100-L115 HydrophobicContact CG1-CB 4.08Å; V100-L115 HydrophobicContact CG1-CD1 3.4Å; V100-L115 VanDerWaalsContact CG1-CD1 3.4Å; V100-L115 HydrophobicContact CG1-CG 4.37Å; A113-L115 HydrophobicContact CB-CD1 4.43Å; A113-L115 HydrophobicContact CB-CD2 4.19Å; A113-L115 HydrophobicContact CB-CG 4.11Å; L115-T131 WeakPolarHBondContact CB-OG1 3.33Å; L115-T131 PolarHBondContact N-OG1 2.79Å; L115-T131 PolarHBondContact O-N 2.88Å; L115-T131 PolarHBondContact O-OG1 3.28Å
116	I	96.6	Very high	89.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.6	171.1	-58.8	170.2	0	0	0	107.1	I20 A22 C60 A61 V128 F129 A142	I20-I116 HydrophobicContact CB-CD1 4.47Å; I20-I116 HydrophobicContact CD1-CD1 3.83Å; I20-I116 HydrophobicContact CD1-CG1 3.96Å; I20-I116 HydrophobicContact CG1-CD1 3.92Å; A22-I116 HydrophobicContact CB-CG2 3.7Å; C60-I116 CarbonylContact C-O 3.46Å; C60-I116 WeakPolarHBondContact CA-O 3.31Å; A61-I116 HydrophobicContact CB-CB 4.22Å; A61-I116 PolarHBondContact N-O 3.15Å; A61-I116 PolarHBondContact O-N 2.9Å; A61-I116 VanDerWaalsContact O-N 3.12Å; I116-V128 HydrophobicContact CG2-CG1 3.89Å; I116-F129 CarbonylContact C-O 3.58Å; I116-F129 WeakPolarHBondContact CA-O 3.37Å; I116-A142 HydrophobicContact CD1-CB 3.88Å; I116-A142 HydrophobicContact CG1-CB 4.18Å; I116-A142 HydrophobicContact CG2-CB 4.11Å
117	V	97.9	Very high	89.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124	174	-177.8	0	0	0	0	107.9	L54 I58 Y59 V93 A96 A97 V100 F129	L54-V117 HydrophobicContact CD1-CG1 4.08Å; L54-V117 HydrophobicContact CD1-CG2 4.33Å; I58-V117 HydrophobicContact CG2-CG1 3.92Å; Y59-V117 WeakPolarHBondContact O-CA 3.33Å; V93-V117 HydrophobicContact CG1-CG1 4.36Å; A96-V117 HydrophobicContact CB-CG1 4.35Å; A97-V117 HydrophobicContact CB-CB 3.87Å; A97-V117 HydrophobicContact CB-CG1 3.93Å; A97-V117 HydrophobicContact CB-CG2 4.24Å; V100-V117 HydrophobicContact CB-CG2 4.01Å; V100-V117 HydrophobicContact CG1-CG2 4.17Å; V100-V117 HydrophobicContact CG2-CG2 3.7Å; V117-F129 HydrophobicContact CB-CB 4.47Å; V117-F129 PolarHBondContact N-O 3.26Å; V117-F129 PolarHBondContact O-N 2.89Å
118	A	98.4	Very high	90.4	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.1	173.8	0	0	0	0	0	110.7	A22 V29 L31 Y59 Q127 V128	A22-A118 HydrophobicContact CB-CB 4Å; V29-A118 HydrophobicContact CB-CB 4.36Å; V29-A118 HydrophobicContact CG2-CB 4.1Å; L31-A118 HydrophobicContact CD1-CB 3.94Å; L31-A118 HydrophobicContact CD2-CB 3.86Å; L31-A118 HydrophobicContact CG-CB 3.84Å; Y59-A118 PolarHBondContact N-O 3.05Å; Y59-A118 PolarHBondContact O-N 3.31Å; Y59-A118 VanDerWaalsContact O-O 3.07Å; A118-Q127 WeakPolarHBondContact CA-O 3.41Å; A118-V128 HydrophobicContact CB-CB 4.41Å; A118-V128 HydrophobicContact CB-CG2 3.8Å
119	G	98.3	Very high	91.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	-172.9	-177.8	0	0	0	0	0	111.9	K57 V93 G126 Q127	K57-G119 CarbonylContact O-C 3.59Å; K57-G119 WeakPolarHBondContact O-CA 3.49Å; V93-G119 VanDerWaalsContact CG2-C 3.49Å; G119-G126 WeakPolarHBondContact O-CA 3.31Å; G119-Q127 PolarHBondContact N-O 2.86Å; G119-Q127 VanDerWaalsContact N-O 3.12Å; G119-Q127 PolarHBondContact O-N 3.38Å
120	W	98.4	Very high	91.8	Very high	33 Å²	33	41.3 Å²	41.3	13%	0.125	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.8	172.9	-178.2	98.6	0	0	0	109.7	K57 R122 G125 I195 E197	K57-W120 HydrophobicContact CD-CE3 3.71Å; K57-W120 HydrophobicContact CD-CZ3 4.2Å; K57-W120 PolarHBondContact O-N 3.13Å; W120-R122 HydrophobicContact CH2-CB 4.41Å; W120-R122 HydrophobicContact CH2-CG 3.72Å; W120-R122 HydrophobicContact CZ3-CG 3.81Å; W120-G125 WeakPolarHBondContact CA-O 3.1Å; W120-I195 HydrophobicContact CB-CG2 3.84Å; W120-E197 HydrophobicContact CD2-CB 4.39Å; W120-E197 HydrophobicContact CH2-CB 3.72Å; W120-E197 HydrophobicContact CZ2-CB 3.23Å; W120-E197 HydrophobicContact CZ3-CB 4.47Å
121	D	96.9	Very high	92.2	Very high	9 Å²	9	34.9 Å²	34.9	5%	0.048	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	163.7	167	73	45.6	0	0	0	112.4	Q92 V93 R123 E124 G125 Q127	Q92-D121 WeakPolarHBondContact CA-OD2 3.18Å; Q92-D121 WeakPolarHBondContact CB-OD2 3.3Å; V93-D121 HydrophobicContact CG2-CB 4.11Å; V93-D121 PolarHBondContact N-OD2 2.86Å; D121-R123 PolarHBondContact O-N 3.01Å; D121-R123 WeakPolarHBondContact OD1-CA 3.42Å; D121-R123 WeakPolarHBondContact OD1-CB 3.4Å; D121-R123 PolarHBondContact OD1-N 3.08Å; D121-E124 PolarHBondContact OD1-N 2.8Å; D121-G125 PolarHBondContact N-O 3.38Å; D121-G125 VanDerWaalsContact N-O 3.12Å; D121-G125 WeakPolarHBondContact O-CA 3.29Å; D121-G125 PolarHBondContact O-N 2.89Å; D121-Q127 PolarHBondContact OD2-OE1 3.34Å
122	R	94.9	Very high	92.1	Very high	201 Å²	201	37.5 Å²	37.5	76%	0.758	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-15.9	-177.1	-66.5	-178.8	-176.7	171.6	6.6	113.8	D90 W120	D90-R122 IonicContact OD2-NH2 3.88Å; W120-R122 HydrophobicContact CH2-CB 4.41Å; W120-R122 HydrophobicContact CH2-CG 3.72Å; W120-R122 HydrophobicContact CZ3-CG 3.81Å
123	R	94.3	Very high	91.9	Very high	181 Å²	181	44.4 Å²	44.4	68%	0.683	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-48.1	-173	-67.9	-168.2	178.2	-166.7	0.9	112	Q92 D121	Q92-R123 VanDerWaalsContact NE2-CD 3.34Å; Q92-R123 VanDerWaalsContact NE2-NE 3.19Å; D121-R123 PolarHBondContact O-N 3.01Å; D121-R123 WeakPolarHBondContact OD1-CA 3.42Å; D121-R123 WeakPolarHBondContact OD1-CB 3.4Å; D121-R123 PolarHBondContact OD1-N 3.08Å
124	E	95.7	Very high	91.5	Very high	93 Å²	93	43.9 Å²	43.9	44%	0.435	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117	-2.9	-175	-70.4	-168	-153.6	0	0	113.5	D121 Q127 R138	D121-E124 PolarHBondContact OD1-N 2.8Å; E124-Q127 HydrophobicContact CB-CG 4.05Å; E124-Q127 VanDerWaalsContact CD-NE2 3.33Å; E124-Q127 PolarHBondContact OE2-NE2 3.44Å; E124-R138 IonicContact OE2-CZ 3.15Å; E124-R138 IonicContact OE2-NH1 3.78Å; E124-R138 PolarHBondContact OE2-NH1 3Å
125	G	97.1	Very high	91.4	Very high	19 Å²	19	47.7 Å²	47.7	20%	0.196	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	73.1	-142.4	-178.9	0	0	0	0	0	111.9	W120 D121	W120-G125 WeakPolarHBondContact CA-O 3.1Å; D121-G125 PolarHBondContact N-O 3.38Å; D121-G125 VanDerWaalsContact N-O 3.12Å; D121-G125 WeakPolarHBondContact O-CA 3.29Å; D121-G125 PolarHBondContact O-N 2.89Å
126	G	97.5	Very high	91.3	Very high	9 Å²	9	50 Å²	50	9%	0.093	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	130.2	176.5	0	0	0	0	0	112	G119 R138	G119-G126 WeakPolarHBondContact O-CA 3.31Å; G126-R138 PolarHBondContact O-NH2 3.12Å
127	Q	98.3	Very high	91.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139	-178.9	-61.7	167.3	-78.1	0	0	111.2	E24 V93 A118 G119 D121 E124 F129	E24-Q127 WeakPolarHBondContact OE1-CA 3.46Å; V93-Q127 HydrophobicContact CB-CB 4.19Å; V93-Q127 VanDerWaalsContact CB-OE1 3.25Å; V93-Q127 HydrophobicContact CG1-CB 4.09Å; V93-Q127 HydrophobicContact CG2-CB 4.43Å; V93-Q127 VanDerWaalsContact CG2-OE1 3.3Å; A118-Q127 WeakPolarHBondContact CA-O 3.41Å; G119-Q127 PolarHBondContact N-O 2.86Å; G119-Q127 VanDerWaalsContact N-O 3.12Å; G119-Q127 PolarHBondContact O-N 3.38Å; D121-Q127 PolarHBondContact OD2-OE1 3.34Å; E124-Q127 HydrophobicContact CB-CG 4.05Å; E124-Q127 VanDerWaalsContact CD-NE2 3.33Å; E124-Q127 PolarHBondContact OE2-NE2 3.44Å; Q127-F129 HydrophobicContact CB-CD2 4.32Å; Q127-F129 HydrophobicContact CB-CE2 3.76Å; Q127-F129 HydrophobicContact CG-CE2 4.47Å
128	V	98.2	Very high	91	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.7	172.3	174.4	0	0	0	0	110.1	A22 E24 V29 I116 A118 R138 Q139 A142	A22-V128 HydrophobicContact CB-CG1 3.82Å; A22-V128 HydrophobicContact CB-CG2 3.85Å; E24-V128 HydrophobicContact CG-CB 4.03Å; E24-V128 HydrophobicContact CG-CG2 3.65Å; E24-V128 PolarHBondContact OE1-N 3.48Å; V29-V128 HydrophobicContact CB-CG2 4.44Å; V29-V128 HydrophobicContact CG1-CG2 3.96Å; I116-V128 HydrophobicContact CG2-CG1 3.89Å; A118-V128 HydrophobicContact CB-CB 4.41Å; A118-V128 HydrophobicContact CB-CG2 3.8Å; V128-R138 WeakPolarHBondContact O-CA 3.36Å; V128-Q139 WeakPolarHBondContact CB-O 3.36Å; V128-Q139 PolarHBondContact O-N 3Å; V128-A142 HydrophobicContact CG1-CB 3.87Å
129	F	97.5	Very high	90.9	Very high	12 Å²	12	61.5 Å²	61.5	5%	0.053	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.9	177.2	-68.6	-85.4	0	0	0	111	V93 R94 A97 I116 V117 Q127 L136 T137 R138	V93-F129 HydrophobicContact CB-CE2 4.41Å; V93-F129 HydrophobicContact CG1-CD2 4.07Å; V93-F129 HydrophobicContact CG1-CE2 4.11Å; R94-F129 HydrophobicContact CB-CE2 4.33Å; R94-F129 HydrophobicContact CB-CZ 4.02Å; R94-F129 HydrophobicContact CG-CZ 4.16Å; A97-F129 HydrophobicContact CB-CB 3.76Å; A97-F129 HydrophobicContact CB-CD1 4.41Å; A97-F129 HydrophobicContact CB-CD2 3.79Å; A97-F129 HydrophobicContact CB-CE2 4.49Å; A97-F129 HydrophobicContact CB-CG 3.74Å; I116-F129 CarbonylContact C-O 3.58Å; I116-F129 WeakPolarHBondContact CA-O 3.37Å; V117-F129 HydrophobicContact CB-CB 4.47Å; V117-F129 PolarHBondContact N-O 3.26Å; V117-F129 PolarHBondContact O-N 2.89Å; Q127-F129 HydrophobicContact CB-CD2 4.32Å; Q127-F129 HydrophobicContact CB-CE2 3.76Å; Q127-F129 HydrophobicContact CG-CE2 4.47Å; F129-L136 HydrophobicContact CB-CD1 3.78Å; F129-L136 HydrophobicContact CD1-CD1 4.04Å; F129-L136 HydrophobicContact CD1-CD2 4.31Å; F129-L136 HydrophobicContact CD1-CG 3.95Å; F129-L136 HydrophobicContact CG-CD1 4.21Å; F129-T137 WeakPolarHBondContact CA-O 3.4Å; F129-R138 HydrophobicContact CD1-CB 3.98Å; F129-R138 HydrophobicContact CE1-CB 3.73Å; F129-R138 HydrophobicContact CE1-CG 4.27Å; F129-R138 HydrophobicContact CZ-CB 4.38Å; F129-R138 HydrophobicContact CZ-CG 4.47Å
130	A	93.2	Very high	90.7	Very high	8 Å²	8	63.8 Å²	63.8	7%	0.066	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.5	170.3	0	0	0	0	0	110.2	T137 A142	A130-T137 PolarHBondContact N-O 3.15Å; A130-T137 PolarHBondContact O-N 3.16Å; A130-T137 VanDerWaalsContact O-N 3.14Å; A130-A142 HydrophobicContact CB-CB 4.04Å
131	T	85.4	Confident	90.7	Very high	5 Å²	5	63.8 Å²	63.8	3%	0.031	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.3	172.1	70.6	0	0	0	0	109.6	V100 L115 L135 L136	V100-T131 HydrophobicContact CG1-CG2 4.02Å; L115-T131 WeakPolarHBondContact CB-OG1 3.33Å; L115-T131 PolarHBondContact N-OG1 2.79Å; L115-T131 PolarHBondContact O-N 2.88Å; L115-T131 PolarHBondContact O-OG1 3.28Å; T131-L135 WeakPolarHBondContact CA-O 3.44Å; T131-L136 HydrophobicContact CG2-CD1 4Å
132	L	72.1	Confident	90.6	Very high	90 Å²	90	63.8 Å²	63.8	47%	0.471	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	107	-178.9	-85.4	162.9	0	0	0	109.1	H114 G134 L135	H114-L132 VanDerWaalsContact CE1-CD2 3.45Å; H114-L132 WeakPolarHBondContact CE1-CD2 3.46Å; L132-G134 PolarHBondContact O-N 3.03Å; L132-G134 VanDerWaalsContact O-N 3.14Å; L132-L135 PolarHBondContact N-O 3.48Å; L132-L135 VanDerWaalsContact O-CB 3.32Å; L132-L135 WeakPolarHBondContact O-CB 3.41Å; L132-L135 PolarHBondContact O-N 3.09Å
133	K	67.1	Low	90.7	Very high	205 Å²	205	54.7 Å²	54.7	89%	0.891	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	39.6	176.1	-60.6	-175.2	174.2	-175.2	0	113.8	L135	K133-L135 VanDerWaalsContact C-N 3.33Å
134	G	66.9	Low	90.6	Very high	16 Å²	16	46.1 Å²	46.1	17%	0.165	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	2.5	-179	0	0	0	0	0	115.7	K101 L132	K101-G134 VanDerWaalsContact CD-O 3.31Å; K101-G134 WeakPolarHBondContact CD-O 3.39Å; K101-G134 VanDerWaalsContact CG-O 3.25Å; K101-G134 WeakPolarHBondContact CG-O 3.34Å; L132-G134 PolarHBondContact O-N 3.03Å; L132-G134 VanDerWaalsContact O-N 3.14Å
135	L	81.7	Confident	90.4	Very high	121 Å²	121	42.5 Å²	42.5	63%	0.634	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	146.6	163.8	-60.2	175.3	0	0	0	109.8	T131 L132 K133	T131-L135 WeakPolarHBondContact CA-O 3.44Å; L132-L135 PolarHBondContact N-O 3.48Å; L132-L135 VanDerWaalsContact O-CB 3.32Å; L132-L135 WeakPolarHBondContact O-CB 3.41Å; L132-L135 PolarHBondContact O-N 3.09Å; K133-L135 VanDerWaalsContact C-N 3.33Å
136	L	90.6	Very high	90.1	Very high	48 Å²	48	43.9 Å²	43.9	25%	0.251	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.6	174.5	-176.4	68.3	0	0	0	108.6	A97 K101 F129 T131	A97-L136 HydrophobicContact CB-CD1 3.76Å; A97-L136 HydrophobicContact CB-CD2 4.16Å; K101-L136 HydrophobicContact CB-CB 4.27Å; K101-L136 HydrophobicContact CB-CD1 4.44Å; K101-L136 HydrophobicContact CD-CB 3.82Å; K101-L136 HydrophobicContact CG-CB 3.94Å; F129-L136 HydrophobicContact CB-CD1 3.78Å; F129-L136 HydrophobicContact CD1-CD1 4.04Å; F129-L136 HydrophobicContact CD1-CD2 4.31Å; F129-L136 HydrophobicContact CD1-CG 3.95Å; F129-L136 HydrophobicContact CG-CD1 4.21Å; T131-L136 HydrophobicContact CG2-CD1 4Å
137	T	93.2	Very high	89.8	Confident	57 Å²	57	43.4 Å²	43.4	35%	0.35	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.1	-176.6	-52.4	0	0	0	0	110.3	F129 A130 Q139	F129-T137 WeakPolarHBondContact CA-O 3.4Å; A130-T137 PolarHBondContact N-O 3.15Å; A130-T137 PolarHBondContact O-N 3.16Å; A130-T137 VanDerWaalsContact O-N 3.14Å; T137-Q139 HydrophobicContact CG2-CG 4.22Å
138	R	95.7	Very high	89.6	Confident	100 Å²	100	44.1 Å²	44.1	38%	0.377	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.4	169.7	-172.3	175.1	176.6	174.6	-2.2	109.6	E24 E124 G126 V128 F129	E24-R138 IonicContact OE1-CZ 3.98Å; E24-R138 IonicContact OE1-NE 3.93Å; E24-R138 PolarHBondContact OE1-NE 3.15Å; E24-R138 VanDerWaalsContact OE1-NE 3.14Å; E24-R138 IonicContact OE1-NH2 3.89Å; E24-R138 IonicContact OE2-CZ 2.75Å; E24-R138 IonicContact OE2-NE 2.79Å; E24-R138 IonicContact OE2-NH2 3.14Å; E24-R138 PolarHBondContact OE2-NH2 3.25Å; E24-R138 VanDerWaalsContact OE2-NH2 3.15Å; E124-R138 IonicContact OE2-CZ 3.15Å; E124-R138 IonicContact OE2-NH1 3.78Å; E124-R138 PolarHBondContact OE2-NH1 3Å; G126-R138 PolarHBondContact O-NH2 3.12Å; V128-R138 WeakPolarHBondContact O-CA 3.36Å; F129-R138 HydrophobicContact CD1-CB 3.98Å; F129-R138 HydrophobicContact CE1-CB 3.73Å; F129-R138 HydrophobicContact CE1-CG 4.27Å; F129-R138 HydrophobicContact CZ-CB 4.38Å; F129-R138 HydrophobicContact CZ-CG 4.47Å
139	Q	95.3	Very high	89.4	Confident	85 Å²	85	47.8 Å²	47.8	40%	0.397	26%	0.258	S	S	.	.			trans	-138.9	149.7	179.8	-67.5	-68.7	-32.6	0	0	109.8	V128 T137 F141	V128-Q139 WeakPolarHBondContact CB-O 3.36Å; V128-Q139 PolarHBondContact O-N 3Å; T137-Q139 HydrophobicContact CG2-CG 4.22Å; Q139-F141 WeakPolarHBondContact CB-O 3.33Å; Q139-F141 PolarHBondContact O-N 2.97Å
140	P	95.6	Very high	89.2	Confident	47 Å²	47	53.3 Å²	53.3	31%	0.305	28%	0.28	S	S	.	.	S	Bend	trans	-64.5	-27.7	173.9	26.3	-33.4	0	0	0	112.5	E24 Y159	E24-P140 PolarHBondContact N-O 3.12Å; P140-Y159 HydrophobicContact CB-CE1 4.49Å; P140-Y159 HydrophobicContact CB-CE2 4.27Å; P140-Y159 VanDerWaalsContact CB-OH 3.23Å; P140-Y159 WeakPolarHBondContact CB-OH 3.45Å; P140-Y159 HydrophobicContact CG-CE1 4.48Å
141	F	96.7	Very high	89.4	Confident	34 Å²	34	52.9 Å²	52.9	15%	0.149	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	156.4	169.4	66.8	-89.6	0	0	0	109.3	A22 I23 Q139 V143 V155 Y159	A22-F141 CarbonylContact O-C 3.52Å; A22-F141 WeakPolarHBondContact O-CA 3.42Å; A22-F141 WeakPolarHBondContact O-CB 3.21Å; I23-F141 HydrophobicContact CB-CB 4.08Å; I23-F141 HydrophobicContact CG1-CB 4.12Å; Q139-F141 WeakPolarHBondContact CB-O 3.33Å; Q139-F141 PolarHBondContact O-N 2.97Å; F141-V143 HydrophobicContact CD2-CG2 4.4Å; F141-V155 HydrophobicContact CE2-CB 4.12Å; F141-V155 HydrophobicContact CE2-CG2 3.87Å; F141-Y159 HydrophobicContact CD1-CD1 4.03Å; F141-Y159 AromaticContact CD1-CD2 3.57Å; F141-Y159 HydrophobicContact CD1-CD2 3.57Å; F141-Y159 HydrophobicContact CD1-CE1 4.3Å; F141-Y159 AromaticContact CD1-CE2 3.88Å; F141-Y159 HydrophobicContact CD1-CE2 3.88Å; F141-Y159 AromaticContact CD1-CG 3.66Å; F141-Y159 HydrophobicContact CD1-CG 3.66Å; F141-Y159 AromaticContact CE1-CD1 3.73Å; F141-Y159 HydrophobicContact CE1-CD1 3.73Å; F141-Y159 HydrophobicContact CE1-CD2 4.04Å; F141-Y159 HydrophobicContact CE1-CE1 4.26Å; F141-Y159 AromaticContact CE1-CG 3.61Å; F141-Y159 HydrophobicContact CE1-CG 3.61Å; F141-Y159 HydrophobicContact CG-CD2 4.42Å
142	A	96.6	Very high	89.9	Confident	8 Å²	8	58 Å²	58	7%	0.066	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	141.2	174.2	0	0	0	0	0	109.5	I21 A22 I116 V128 A130	I21-A142 CarbonylContact C-O 3.58Å; I21-A142 VanDerWaalsContact CA-O 3.24Å; I21-A142 WeakPolarHBondContact CA-O 3.49Å; A22-A142 PolarHBondContact N-O 2.95Å; A22-A142 PolarHBondContact O-N 3.23Å; I116-A142 HydrophobicContact CD1-CB 3.88Å; I116-A142 HydrophobicContact CG1-CB 4.18Å; I116-A142 HydrophobicContact CG2-CB 4.11Å; V128-A142 HydrophobicContact CG1-CB 3.87Å; A130-A142 HydrophobicContact CB-CB 4.04Å
143	V	95.5	Very high	91.1	Very high	11 Å²	11	56.5 Å²	56.5	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.3	174.1	-167.8	0	0	0	0	108.1	I20 I21 F141 V151 V155	I20-V143 CarbonylContact O-C 3.51Å; I20-V143 WeakPolarHBondContact O-CA 3.44Å; I20-V143 WeakPolarHBondContact O-CG1 3.48Å; I21-V143 HydrophobicContact CB-CG2 4.38Å; I21-V143 HydrophobicContact CD1-CG2 3.91Å; I21-V143 HydrophobicContact CG1-CG2 4.02Å; F141-V143 HydrophobicContact CD2-CG2 4.4Å; V143-V151 HydrophobicContact CG1-CG2 3.99Å; V143-V155 HydrophobicContact CG2-CG1 4.11Å; V143-V155 HydrophobicContact CG2-CG2 4.3Å
144	G	92.9	Very high	92.5	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	170	-175.5	0	0	0	0	0	113.1	I20	I20-G144 PolarHBondContact N-O 2.93Å; I20-G144 VanDerWaalsContact N-O 3.08Å; I20-G144 PolarHBondContact O-N 2.89Å
145	G	90.8	Very high	93.9	Very high	17 Å²	17	48.1 Å²	48.1	18%	0.175	26%	0.262	C	S	.	.	S	Bend	trans	82.6	179.8	-177.1	0	0	0	0	0	114.2	T18 S63 G147 S148	T18-G145 CarbonylContact O-C 3.19Å; T18-G145 WeakPolarHBondContact O-CA 3.4Å; S63-G145 WeakPolarHBondContact OG-CA 3.45Å; G145-G147 VanDerWaalsContact C-N 3.28Å; G145-G147 PolarHBondContact O-N 3.28Å; G145-S148 WeakPolarHBondContact O-CB 3.42Å; G145-S148 PolarHBondContact O-N 2.98Å; G145-S148 PolarHBondContact O-OG 3.36Å
146	S	91	Very high	94.6	Very high	47 Å²	47	47.6 Å²	47.6	33%	0.329	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-38.7	-177.8	51.3	0	0	0	0	112.8	G17 T18 S148 S149 D183	G17-S146 WeakPolarHBondContact CA-OG 3.1Å; T18-S146 PolarHBondContact N-OG 3.03Å; T18-S146 PolarHBondContact O-N 3.05Å; T18-S146 PolarHBondContact O-OG 2.92Å; S146-S148 PolarHBondContact O-N 3.15Å; S146-S149 PolarHBondContact O-N 2.9Å; S146-S149 PolarHBondContact O-OG 3.41Å; S146-D183 PolarHBondContact OG-OD2 3.12Å
147	G	92.8	Very high	94.9	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-18.3	-176.3	0	0	0	0	0	114	T18 T19 G145 S149 Y150 D183	T18-G147 PolarHBondContact O-N 2.88Å; T18-G147 VanDerWaalsContact O-N 3.08Å; T19-G147 WeakPolarHBondContact OG1-CA 3.35Å; G145-G147 VanDerWaalsContact C-N 3.28Å; G145-G147 PolarHBondContact O-N 3.28Å; G147-S149 PolarHBondContact O-N 2.98Å; G147-Y150 PolarHBondContact O-N 3.14Å; G147-Y150 VanDerWaalsContact O-N 3.15Å; G147-D183 WeakPolarHBondContact CA-OD2 3.34Å; G147-D183 PolarHBondContact N-OD2 3.31Å; G147-D183 VanDerWaalsContact N-OD2 3.14Å
148	S	93.1	Very high	95	Very high	14 Å²	14	50.3 Å²	50.3	10%	0.098	28%	0.28	C	S	.	.	H	α-helix	trans	-55.1	-36.6	177.2	66.9	0	0	0	0	112.8	G145 S146 Y150 V151 Y152	G145-S148 WeakPolarHBondContact O-CB 3.42Å; G145-S148 PolarHBondContact O-N 2.98Å; G145-S148 PolarHBondContact O-OG 3.36Å; S146-S148 PolarHBondContact O-N 3.15Å; S148-Y150 PolarHBondContact O-N 3.49Å; S148-Y150 VanDerWaalsContact O-N 3.16Å; S148-V151 WeakPolarHBondContact O-CG2 3.36Å; S148-V151 PolarHBondContact O-N 2.87Å; S148-V151 VanDerWaalsContact O-N 3.09Å; S148-Y152 WeakPolarHBondContact O-CD2 3.32Å; S148-Y152 WeakPolarHBondContact O-CE2 3.45Å; S148-Y152 PolarHBondContact O-N 3.34Å
149	S	93.1	Very high	95.1	Very high	77 Å²	77	48.4 Å²	48.4	54%	0.538	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-28.6	-178.9	62.3	0	0	0	0	113.9	S146 G147	S146-S149 PolarHBondContact O-N 2.9Å; S146-S149 PolarHBondContact O-OG 3.41Å; G147-S149 PolarHBondContact O-N 2.98Å
150	Y	95.3	Very high	95.1	Very high	128 Å²	128	50.4 Å²	50.4	50%	0.502	28%	0.277	S	S	.	.	H	α-helix	trans	-86	-15.4	-179.1	-60.7	-77.2	0	0	0	113.8	G147 S148 R182 D183	G147-Y150 PolarHBondContact O-N 3.14Å; G147-Y150 VanDerWaalsContact O-N 3.15Å; S148-Y150 PolarHBondContact O-N 3.49Å; S148-Y150 VanDerWaalsContact O-N 3.16Å; Y150-R182 HydrophobicContact CD1-CB 3.67Å; Y150-R182 HydrophobicContact CD2-CB 4.33Å; Y150-R182 HydrophobicContact CE1-CB 4.15Å; Y150-R182 HydrophobicContact CG-CB 3.77Å; Y150-D183 HydrophobicContact CD2-CB 3.77Å; Y150-D183 HydrophobicContact CE2-CB 3.58Å
151	V	96.6	Very high	95.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-118.2	-6.2	-169.1	-64.4	0	0	0	0	114.5	V143 S148 G153 F154 V155 T175 L178 A179	V143-V151 HydrophobicContact CG1-CG2 3.99Å; S148-V151 WeakPolarHBondContact O-CG2 3.36Å; S148-V151 PolarHBondContact O-N 2.87Å; S148-V151 VanDerWaalsContact O-N 3.09Å; V151-G153 VanDerWaalsContact C-N 3.28Å; V151-G153 PolarHBondContact O-N 3.11Å; V151-F154 WeakPolarHBondContact O-CA 3.41Å; V151-F154 WeakPolarHBondContact O-CB 3.31Å; V151-F154 PolarHBondContact O-N 2.97Å; V151-V155 WeakPolarHBondContact O-CG2 3.45Å; V151-V155 PolarHBondContact O-N 2.69Å; V151-T175 HydrophobicContact CB-CG2 3.93Å; V151-T175 HydrophobicContact CG1-CG2 4.25Å; V151-T175 HydrophobicContact CG2-CG2 3.72Å; V151-L178 HydrophobicContact CG1-CB 3.9Å; V151-A179 HydrophobicContact CG1-CB 3.72Å
152	Y	95.5	Very high	94.9	Very high	111 Å²	111	58.9 Å²	58.9	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-48.8	-47.6	176.8	-81.9	-64.6	0	0	0	113.1	S148 F154 V155 D156	S148-Y152 WeakPolarHBondContact O-CD2 3.32Å; S148-Y152 WeakPolarHBondContact O-CE2 3.45Å; S148-Y152 PolarHBondContact O-N 3.34Å; Y152-F154 VanDerWaalsContact C-N 3.31Å; Y152-F154 PolarHBondContact O-N 2.85Å; Y152-V155 VanDerWaalsContact O-CG2 3.26Å; Y152-V155 WeakPolarHBondContact O-CG2 3.35Å; Y152-V155 PolarHBondContact O-N 2.59Å; Y152-D156 WeakPolarHBondContact O-CB 3.21Å; Y152-D156 PolarHBondContact O-N 3.35Å
153	G	97	Very high	94.8	Very high	60 Å²	60	59 Å²	59	62%	0.619	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-31.9	178.4	0	0	0	0	0	114.2	V151 A157	V151-G153 VanDerWaalsContact C-N 3.28Å; V151-G153 PolarHBondContact O-N 3.11Å; G153-A157 VanDerWaalsContact O-CB 3.29Å; G153-A157 WeakPolarHBondContact O-CB 3.46Å; G153-A157 PolarHBondContact O-N 3.3Å
154	F	96.7	Very high	94.9	Very high	45 Å²	45	62.4 Å²	62.4	20%	0.197	34%	0.344	C	S	.	.	H	α-helix	trans	-73.3	-48.8	175.8	170.1	-95.1	0	0	0	111.2	V151 Y152 D156 A157 E158 F171 N174 T175 L178	V151-F154 WeakPolarHBondContact O-CA 3.41Å; V151-F154 WeakPolarHBondContact O-CB 3.31Å; V151-F154 PolarHBondContact O-N 2.97Å; Y152-F154 VanDerWaalsContact C-N 3.31Å; Y152-F154 PolarHBondContact O-N 2.85Å; F154-D156 VanDerWaalsContact C-N 3.32Å; F154-D156 PolarHBondContact O-N 3.05Å; F154-A157 PolarHBondContact O-N 3.14Å; F154-E158 HydrophobicContact CD2-CG 3.83Å; F154-E158 HydrophobicContact CE1-CB 4.47Å; F154-E158 HydrophobicContact CE1-CG 4.5Å; F154-E158 HydrophobicContact CE2-CB 4.28Å; F154-E158 HydrophobicContact CE2-CG 3.48Å; F154-E158 VanDerWaalsContact CE2-CG 3.48Å; F154-E158 HydrophobicContact CZ-CB 4.17Å; F154-E158 HydrophobicContact CZ-CG 3.84Å; F154-E158 WeakPolarHBondContact O-CB 3.45Å; F154-E158 PolarHBondContact O-N 3.43Å; F154-F171 HydrophobicContact CE1-CD2 4.38Å; F154-F171 HydrophobicContact CE1-CE2 4.32Å; F154-N174 HydrophobicContact CE1-CB 4.09Å; F154-N174 HydrophobicContact CZ-CB 3.66Å; F154-T175 WeakPolarHBondContact CE1-OG1 3.44Å; F154-L178 HydrophobicContact CB-CD1 4.04Å; F154-L178 HydrophobicContact CD1-CD1 3.81Å; F154-L178 HydrophobicContact CD2-CD1 3.36Å; F154-L178 HydrophobicContact CE1-CD1 4.1Å; F154-L178 HydrophobicContact CE2-CD1 3.66Å; F154-L178 HydrophobicContact CG-CD1 3.44Å; F154-L178 VanDerWaalsContact CG-CD1 3.44Å; F154-L178 HydrophobicContact CZ-CD1 4.03Å
155	V	96.6	Very high	95.1	Very high	0 Å²	0	65 Å²	65	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-38.2	-177.5	-63.5	0	0	0	0	111.7	I21 F141 V143 V151 Y152 A157 Y159 F171 T175	I21-V155 HydrophobicContact CD1-CG1 4.4Å; F141-V155 HydrophobicContact CE2-CB 4.12Å; F141-V155 HydrophobicContact CE2-CG2 3.87Å; V143-V155 HydrophobicContact CG2-CG1 4.11Å; V143-V155 HydrophobicContact CG2-CG2 4.3Å; V151-V155 WeakPolarHBondContact O-CG2 3.45Å; V151-V155 PolarHBondContact O-N 2.69Å; Y152-V155 VanDerWaalsContact O-CG2 3.26Å; Y152-V155 WeakPolarHBondContact O-CG2 3.35Å; Y152-V155 PolarHBondContact O-N 2.59Å; V155-A157 VanDerWaalsContact C-N 3.33Å; V155-A157 PolarHBondContact O-N 3.04Å; V155-Y159 WeakPolarHBondContact O-CB 3.42Å; V155-Y159 PolarHBondContact O-N 2.94Å; V155-F171 HydrophobicContact CB-CE2 4.44Å; V155-F171 HydrophobicContact CB-CZ 3.76Å; V155-F171 HydrophobicContact CG1-CE1 4.35Å; V155-F171 HydrophobicContact CG1-CE2 4.45Å; V155-F171 HydrophobicContact CG1-CZ 3.78Å; V155-T175 HydrophobicContact CG1-CG2 3.66Å
156	D	95.8	Very high	95.4	Very high	110 Å²	110	72 Å²	72	59%	0.588	38%	0.381	S	S	*	.	H	α-helix	trans	-67.3	-33.9	176.6	-74.4	-14.3	0	0	0	112.5	Y152 F154	Y152-D156 WeakPolarHBondContact O-CB 3.21Å; Y152-D156 PolarHBondContact O-N 3.35Å; F154-D156 VanDerWaalsContact C-N 3.32Å; F154-D156 PolarHBondContact O-N 3.05Å
157	A	97	Very high	95.8	Very high	76 Å²	76	72.9 Å²	72.9	63%	0.628	38%	0.38	S	S	*	.	H	α-helix	trans	-79.8	-39.4	-179.7	0	0	0	0	0	113.1	G153 F154 V155	G153-A157 VanDerWaalsContact O-CB 3.29Å; G153-A157 WeakPolarHBondContact O-CB 3.46Å; G153-A157 PolarHBondContact O-N 3.3Å; F154-A157 PolarHBondContact O-N 3.14Å; V155-A157 VanDerWaalsContact C-N 3.33Å; V155-A157 PolarHBondContact O-N 3.04Å
158	E	96.7	Very high	96	Very high	85 Å²	85	72.9 Å²	72.9	40%	0.397	38%	0.38	S	S	.	.	H	α-helix	trans	-93.8	-19.2	-172.9	-71.6	-59.8	135.2	0	0	113.9	F154 R160 F171	F154-E158 HydrophobicContact CD2-CG 3.83Å; F154-E158 HydrophobicContact CE1-CB 4.47Å; F154-E158 HydrophobicContact CE1-CG 4.5Å; F154-E158 HydrophobicContact CE2-CB 4.28Å; F154-E158 HydrophobicContact CE2-CG 3.48Å; F154-E158 VanDerWaalsContact CE2-CG 3.48Å; F154-E158 HydrophobicContact CZ-CB 4.17Å; F154-E158 HydrophobicContact CZ-CG 3.84Å; F154-E158 WeakPolarHBondContact O-CB 3.45Å; F154-E158 PolarHBondContact O-N 3.43Å; E158-R160 PolarHBondContact O-N 2.8Å; E158-F171 HydrophobicContact CB-CD2 4.18Å; E158-F171 HydrophobicContact CB-CE2 3.92Å
159	Y	96.9	Very high	96.3	Very high	60 Å²	60	74 Å²	74	24%	0.235	38%	0.383	C	S	.	.			trans	-62	125.9	176.8	171.5	-102.1	0	0	0	110.7	I23 P140 F141 V155	I23-Y159 HydrophobicContact CD1-CD2 3.79Å; I23-Y159 HydrophobicContact CD1-CE2 4.01Å; I23-Y159 HydrophobicContact CG1-CE2 4.41Å; P140-Y159 HydrophobicContact CB-CE1 4.49Å; P140-Y159 HydrophobicContact CB-CE2 4.27Å; P140-Y159 VanDerWaalsContact CB-OH 3.23Å; P140-Y159 WeakPolarHBondContact CB-OH 3.45Å; P140-Y159 HydrophobicContact CG-CE1 4.48Å; F141-Y159 HydrophobicContact CD1-CD1 4.03Å; F141-Y159 AromaticContact CD1-CD2 3.57Å; F141-Y159 HydrophobicContact CD1-CD2 3.57Å; F141-Y159 HydrophobicContact CD1-CE1 4.3Å; F141-Y159 AromaticContact CD1-CE2 3.88Å; F141-Y159 HydrophobicContact CD1-CE2 3.88Å; F141-Y159 AromaticContact CD1-CG 3.66Å; F141-Y159 HydrophobicContact CD1-CG 3.66Å; F141-Y159 AromaticContact CE1-CD1 3.73Å; F141-Y159 HydrophobicContact CE1-CD1 3.73Å; F141-Y159 HydrophobicContact CE1-CD2 4.04Å; F141-Y159 HydrophobicContact CE1-CE1 4.26Å; F141-Y159 AromaticContact CE1-CG 3.61Å; F141-Y159 HydrophobicContact CE1-CG 3.61Å; F141-Y159 HydrophobicContact CG-CD2 4.42Å; V155-Y159 WeakPolarHBondContact O-CB 3.42Å; V155-Y159 PolarHBondContact O-N 2.94Å
160	R	95.7	Very high	96.5	Very high	128 Å²	128	75.1 Å²	75.1	48%	0.483	38%	0.38	S	S	.	.			trans	-122.6	132.3	173.3	-62.5	-172.5	-63.4	-98.7	3.7	109.7	E158 G162 M163 E167	E158-R160 PolarHBondContact O-N 2.8Å; R160-G162 PolarHBondContact O-N 3.04Å; R160-M163 HydrophobicContact CB-CG 3.96Å; R160-M163 HydrophobicContact CB-SD 4.17Å; R160-M163 PolarHBondContact N-SD 3.31Å; R160-M163 WeakPolarHBondContact O-CG 3.36Å; R160-M163 PolarHBondContact O-N 2.84Å; R160-E167 IonicContact NH2-OE1 3.08Å; R160-E167 PolarHBondContact NH2-OE1 2.99Å; R160-E167 VanDerWaalsContact NH2-OE1 3.08Å
161	K	94.1	Very high	96.6	Very high	196 Å²	196	69.3 Å²	69.3	85%	0.852	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	130.1	173.1	-172	176.9	-178.1	178.7	0	109.6
162	G	92.9	Very high	96.7	Very high	63 Å²	63	69.3 Å²	69.3	65%	0.649	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	21.5	177	0	0	0	0	0	114.9	R160	R160-G162 PolarHBondContact O-N 3.04Å
163	M	96.1	Very high	96.9	Very high	11 Å²	11	64.5 Å²	64.5	5%	0.054	34%	0.339	C	S	.	.			trans	-54.5	144	167.3	-75.1	167.2	90.8	0	0	111	I23 F25 R160 E167 C168 F171	I23-M163 HydrophobicContact CD1-SD 4.32Å; F25-M163 WeakPolarHBondContact CB-O 2.97Å; R160-M163 HydrophobicContact CB-CG 3.96Å; R160-M163 HydrophobicContact CB-SD 4.17Å; R160-M163 PolarHBondContact N-SD 3.31Å; R160-M163 WeakPolarHBondContact O-CG 3.36Å; R160-M163 PolarHBondContact O-N 2.84Å; M163-E167 WeakPolarHBondContact CA-OE2 3.41Å; M163-E167 HydrophobicContact CB-CB 3.98Å; M163-E167 HydrophobicContact CE-CB 3.84Å; M163-E167 HydrophobicContact CG-CB 4.19Å; M163-C168 WeakPolarHBondContact CB-SG 3.38Å; M163-F171 HydrophobicContact CE-CB 3.78Å; M163-F171 HydrophobicContact CE-CD2 4.21Å; M163-F171 HydrophobicContact CE-CG 4.18Å
164	N	97.1	Very high	96.9	Very high	81 Å²	81	63.2 Å²	63.2	43%	0.433	32%	0.318	S	S	.	.			trans	-84.4	170.2	174.3	70.5	60.4	0	0	0	111.9	K166 E167 C168	N164-K166 VanDerWaalsContact C-N 3.31Å; N164-K166 PolarHBondContact O-N 3.08Å; N164-K166 WeakPolarHBondContact OD1-CB 3.46Å; N164-K166 PolarHBondContact OD1-N 3.17Å; N164-E167 PolarHBondContact N-OE2 2.99Å; N164-E167 WeakPolarHBondContact ND2-CG 3.49Å; N164-E167 PolarHBondContact ND2-OE2 2.85Å; N164-E167 PolarHBondContact O-N 3.34Å; N164-E167 VanDerWaalsContact O-N 3.11Å; N164-E167 PolarHBondContact OD1-N 2.95Å; N164-C168 PolarHBondContact O-N 2.62Å
165	K	97.3	Very high	97	Very high	57 Å²	57	61 Å²	61	25%	0.248	31%	0.309	C	S	.	.	H	α-helix	trans	-46.9	-48.1	179.6	177.3	169.2	169.2	166.7	0	113.4	F25 C168 Q169 T194 D196 E201	F25-K165 HydrophobicContact CD2-CB 4.13Å; F25-K165 HydrophobicContact CE2-CB 3.77Å; F25-K165 HydrophobicContact CE2-CG 4.39Å; F25-K165 HydrophobicContact CZ-CB 3.98Å; F25-K165 HydrophobicContact CZ-CD 4.25Å; F25-K165 HydrophobicContact CZ-CG 4.1Å; K165-C168 PolarHBondContact O-N 2.74Å; K165-Q169 VanDerWaalsContact O-CG 3.31Å; K165-Q169 WeakPolarHBondContact O-CG 3.41Å; K165-Q169 PolarHBondContact O-N 2.81Å; K165-T194 HydrophobicContact CD-CG2 3.88Å; K165-T194 VanDerWaalsContact CE-CG2 3.45Å; K165-T194 HydrophobicContact CG-CG2 3.98Å; K165-D196 IonicContact NZ-OD2 3.51Å; K165-E201 VanDerWaalsContact CE-OE2 3.29Å; K165-E201 WeakPolarHBondContact CE-OE2 3Å; K165-E201 IonicContact NZ-OE2 3.52Å; K165-E201 PolarHBondContact NZ-OE2 3.22Å
166	K	97.3	Very high	97	Very high	164 Å²	164	61 Å²	61	71%	0.713	31%	0.309	S	S	*	.	H	α-helix	trans	-70	-40.2	-177.7	-68.4	-175	177.9	-179	0	112.2	N164 C168 Q169 Q170	N164-K166 VanDerWaalsContact C-N 3.31Å; N164-K166 PolarHBondContact O-N 3.08Å; N164-K166 WeakPolarHBondContact OD1-CB 3.46Å; N164-K166 PolarHBondContact OD1-N 3.17Å; K166-C168 VanDerWaalsContact C-N 3.34Å; K166-Q169 PolarHBondContact O-N 3.49Å; K166-Q170 PolarHBondContact O-N 3.29Å
167	E	97.8	Very high	97.1	Very high	64 Å²	64	56.2 Å²	56.2	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-43.1	175.1	-71.2	178.4	117.4	0	0	111.1	R160 M163 N164 Q170 F171	R160-E167 IonicContact NH2-OE1 3.08Å; R160-E167 PolarHBondContact NH2-OE1 2.99Å; R160-E167 VanDerWaalsContact NH2-OE1 3.08Å; M163-E167 WeakPolarHBondContact CA-OE2 3.41Å; M163-E167 HydrophobicContact CB-CB 3.98Å; M163-E167 HydrophobicContact CE-CB 3.84Å; M163-E167 HydrophobicContact CG-CB 4.19Å; N164-E167 PolarHBondContact N-OE2 2.99Å; N164-E167 WeakPolarHBondContact ND2-CG 3.49Å; N164-E167 PolarHBondContact ND2-OE2 2.85Å; N164-E167 PolarHBondContact O-N 3.34Å; N164-E167 VanDerWaalsContact O-N 3.11Å; N164-E167 PolarHBondContact OD1-N 2.95Å; E167-Q170 PolarHBondContact O-N 3.27Å; E167-F171 VanDerWaalsContact O-CB 3.29Å; E167-F171 WeakPolarHBondContact O-CB 3.49Å; E167-F171 PolarHBondContact O-N 2.87Å
168	C	98.3	Very high	97	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-41.1	176.6	-73.6	0	0	0	0	112.7	I23 F25 V30 M163 N164 K165 K166 F171 V172	I23-C168 HydrophobicContact CG2-CB 3.86Å; F25-C168 HydrophobicContact CB-CB 4.32Å; F25-C168 VanDerWaalsContact CB-SG 3.55Å; F25-C168 HydrophobicContact CD1-CB 4.49Å; V30-C168 HydrophobicContact CG2-CB 3.87Å; M163-C168 WeakPolarHBondContact CB-SG 3.38Å; N164-C168 PolarHBondContact O-N 2.62Å; K165-C168 PolarHBondContact O-N 2.74Å; K166-C168 VanDerWaalsContact C-N 3.34Å; C168-F171 PolarHBondContact O-N 3.48Å; C168-V172 WeakPolarHBondContact O-CG2 3.48Å; C168-V172 PolarHBondContact O-N 3.42Å
169	Q	98.2	Very high	97	Very high	38 Å²	38	50.5 Å²	50.5	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-50.2	171.8	-74.7	175.4	-23.9	0	0	110.6	V30 K165 K166 F171 V172 V173 T194	V30-Q169 HydrophobicContact CG1-CG 4.21Å; V30-Q169 HydrophobicContact CG2-CG 4.06Å; K165-Q169 VanDerWaalsContact O-CG 3.31Å; K165-Q169 WeakPolarHBondContact O-CG 3.41Å; K165-Q169 PolarHBondContact O-N 2.81Å; K166-Q169 PolarHBondContact O-N 3.49Å; Q169-F171 VanDerWaalsContact C-N 3.33Å; Q169-F171 PolarHBondContact O-N 3.36Å; Q169-V172 PolarHBondContact O-N 3.14Å; Q169-V173 VanDerWaalsContact O-CG2 3.31Å; Q169-V173 WeakPolarHBondContact O-CG2 3.49Å; Q169-V173 PolarHBondContact O-N 2.63Å; Q169-T194 PolarHBondContact NE2-OG1 3.45Å
170	Q	97.9	Very high	96.9	Very high	101 Å²	101	48.9 Å²	48.9	47%	0.472	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-39	178.8	-169.4	62.9	52.1	0	0	112.6	K166 E167 V173 N174	K166-Q170 PolarHBondContact O-N 3.29Å; E167-Q170 PolarHBondContact O-N 3.27Å; Q170-V173 PolarHBondContact O-N 3.4Å; Q170-N174 PolarHBondContact NE2-OD1 3.2Å; Q170-N174 WeakPolarHBondContact O-CB 3.48Å; Q170-N174 PolarHBondContact O-N 2.87Å; Q170-N174 PolarHBondContact O-OD1 3.18Å
171	F	98.2	Very high	96.8	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-59.7	-45.3	175.8	177.5	-99.6	0	0	0	111.9	I21 I23 F154 V155 E158 M163 E167 C168 Q169 N174 T175	I21-F171 HydrophobicContact CD1-CD1 4.2Å; I21-F171 HydrophobicContact CD1-CE1 3.8Å; I23-F171 HydrophobicContact CD1-CD1 3.59Å; I23-F171 HydrophobicContact CD1-CE1 3.74Å; I23-F171 HydrophobicContact CD1-CG 4.3Å; I23-F171 HydrophobicContact CG2-CD1 4.45Å; F154-F171 HydrophobicContact CE1-CD2 4.38Å; F154-F171 HydrophobicContact CE1-CE2 4.32Å; V155-F171 HydrophobicContact CB-CE2 4.44Å; V155-F171 HydrophobicContact CB-CZ 3.76Å; V155-F171 HydrophobicContact CG1-CE1 4.35Å; V155-F171 HydrophobicContact CG1-CE2 4.45Å; V155-F171 HydrophobicContact CG1-CZ 3.78Å; E158-F171 HydrophobicContact CB-CD2 4.18Å; E158-F171 HydrophobicContact CB-CE2 3.92Å; M163-F171 HydrophobicContact CE-CB 3.78Å; M163-F171 HydrophobicContact CE-CD2 4.21Å; M163-F171 HydrophobicContact CE-CG 4.18Å; E167-F171 VanDerWaalsContact O-CB 3.29Å; E167-F171 WeakPolarHBondContact O-CB 3.49Å; E167-F171 PolarHBondContact O-N 2.87Å; C168-F171 PolarHBondContact O-N 3.48Å; Q169-F171 VanDerWaalsContact C-N 3.33Å; Q169-F171 PolarHBondContact O-N 3.36Å; F171-N174 PolarHBondContact O-N 2.97Å; F171-T175 WeakPolarHBondContact O-CB 3.39Å; F171-T175 PolarHBondContact O-N 3.39Å; F171-T175 PolarHBondContact O-OG1 3.08Å
172	V	98.4	Very high	96.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-48.5	175.1	165.2	0	0	0	0	111	I21 I23 V30 C168 Q169 N174 T175 L176 L192	I21-V172 HydrophobicContact CD1-CG2 4.41Å; I21-V172 HydrophobicContact CG1-CG2 4.35Å; I21-V172 HydrophobicContact CG2-CB 4.34Å; I21-V172 HydrophobicContact CG2-CG1 3.76Å; I21-V172 HydrophobicContact CG2-CG2 4.16Å; I23-V172 HydrophobicContact CG2-CG2 3.73Å; V30-V172 HydrophobicContact CB-CG2 4.27Å; V30-V172 HydrophobicContact CG1-CB 4.29Å; V30-V172 HydrophobicContact CG1-CG2 3.91Å; C168-V172 WeakPolarHBondContact O-CG2 3.48Å; C168-V172 PolarHBondContact O-N 3.42Å; Q169-V172 PolarHBondContact O-N 3.14Å; V172-N174 PolarHBondContact O-N 3.2Å; V172-T175 PolarHBondContact O-N 3.39Å; V172-L176 HydrophobicContact CG1-CD1 3.99Å; V172-L176 HydrophobicContact CG1-CG 4.49Å; V172-L176 WeakPolarHBondContact O-CG 3.45Å; V172-L176 PolarHBondContact O-N 2.94Å; V172-L192 HydrophobicContact CB-CD2 4.36Å; V172-L192 HydrophobicContact CG1-CD2 3.92Å; V172-L192 HydrophobicContact CG1-CG 4.04Å
173	V	98.3	Very high	96.7	Very high	9 Å²	9	41.9 Å²	41.9	6%	0.055	19%	0.192	C	C	.	.	H	α-helix	trans	-59.7	-46	178.5	177.4	0	0	0	0	111.6	Q169 Q170 T175 L176 S177 L192 I205 L210 P211	Q169-V173 VanDerWaalsContact O-CG2 3.31Å; Q169-V173 WeakPolarHBondContact O-CG2 3.49Å; Q169-V173 PolarHBondContact O-N 2.63Å; Q170-V173 PolarHBondContact O-N 3.4Å; V173-T175 VanDerWaalsContact C-N 3.35Å; V173-T175 PolarHBondContact O-N 2.61Å; V173-L176 PolarHBondContact O-N 3.15Å; V173-S177 VanDerWaalsContact O-CB 3.31Å; V173-S177 WeakPolarHBondContact O-CB 3.36Å; V173-S177 PolarHBondContact O-N 2.98Å; V173-S177 PolarHBondContact O-OG 3.05Å; V173-L192 HydrophobicContact CG2-CD1 4.01Å; V173-L192 HydrophobicContact CG2-CD2 3.7Å; V173-L192 HydrophobicContact CG2-CG 4.5Å; V173-I205 HydrophobicContact CB-CD1 4.28Å; V173-I205 HydrophobicContact CG1-CD1 3.94Å; V173-I205 HydrophobicContact CG2-CD1 3.25Å; V173-L210 HydrophobicContact CG1-CD2 4.12Å; V173-P211 HydrophobicContact CG1-CG 3.95Å
174	N	97.7	Very high	96.4	Very high	33 Å²	33	44.3 Å²	44.3	18%	0.176	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-43.7	179.2	-73.2	-5.3	0	0	0	111.2	F154 Q170 F171 V172 S177 L178 F213	F154-N174 HydrophobicContact CE1-CB 4.09Å; F154-N174 HydrophobicContact CZ-CB 3.66Å; Q170-N174 PolarHBondContact NE2-OD1 3.2Å; Q170-N174 WeakPolarHBondContact O-CB 3.48Å; Q170-N174 PolarHBondContact O-N 2.87Å; Q170-N174 PolarHBondContact O-OD1 3.18Å; F171-N174 PolarHBondContact O-N 2.97Å; V172-N174 PolarHBondContact O-N 3.2Å; N174-S177 PolarHBondContact O-N 3.13Å; N174-L178 WeakPolarHBondContact O-CB 3.29Å; N174-L178 WeakPolarHBondContact O-CG 3.39Å; N174-L178 PolarHBondContact O-N 3.27Å; N174-F213 HydrophobicContact CB-CZ 3.87Å
175	T	98	Very high	96	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-50	178	-56.6	0	0	0	0	111.2	I21 V151 F154 V155 F171 V172 V173 S177 L178 A179	I21-T175 HydrophobicContact CD1-CG2 3.74Å; V151-T175 HydrophobicContact CB-CG2 3.93Å; V151-T175 HydrophobicContact CG1-CG2 4.25Å; V151-T175 HydrophobicContact CG2-CG2 3.72Å; F154-T175 WeakPolarHBondContact CE1-OG1 3.44Å; V155-T175 HydrophobicContact CG1-CG2 3.66Å; F171-T175 WeakPolarHBondContact O-CB 3.39Å; F171-T175 PolarHBondContact O-N 3.39Å; F171-T175 PolarHBondContact O-OG1 3.08Å; V172-T175 PolarHBondContact O-N 3.39Å; V173-T175 VanDerWaalsContact C-N 3.35Å; V173-T175 PolarHBondContact O-N 2.61Å; T175-S177 VanDerWaalsContact C-N 3.32Å; T175-S177 PolarHBondContact O-N 3.33Å; T175-L178 PolarHBondContact O-N 3.19Å; T175-A179 WeakPolarHBondContact O-CB 3.21Å; T175-A179 PolarHBondContact O-N 2.9Å
176	L	97.8	Very high	95.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-43.9	178.2	-69.5	174.6	0	0	0	111.2	T19 I21 V172 V173 L178 A179 M180 A190	T19-L176 HydrophobicContact CG2-CD2 3.78Å; I21-L176 HydrophobicContact CG2-CD2 4.09Å; I21-L176 HydrophobicContact CG2-CG 4.13Å; V172-L176 HydrophobicContact CG1-CD1 3.99Å; V172-L176 HydrophobicContact CG1-CG 4.49Å; V172-L176 WeakPolarHBondContact O-CG 3.45Å; V172-L176 PolarHBondContact O-N 2.94Å; V173-L176 PolarHBondContact O-N 3.15Å; L176-L178 PolarHBondContact O-N 3.35Å; L176-A179 PolarHBondContact O-N 3.38Å; L176-M180 HydrophobicContact CB-SD 4.18Å; L176-M180 VanDerWaalsContact O-CB 3.29Å; L176-M180 WeakPolarHBondContact O-CB 3.15Å; L176-M180 WeakPolarHBondContact O-CG 3.32Å; L176-M180 PolarHBondContact O-N 3.44Å; L176-A190 HydrophobicContact CD1-CB 3.81Å
177	S	96.9	Very high	95.6	Very high	8 Å²	8	31.8 Å²	31.8	6%	0.056	17%	0.167	C	C	.	.	H	α-helix	trans	-63.5	-41.4	-179.2	-56.5	0	0	0	0	112.4	V173 N174 T175 K181 L210 P211	V173-S177 VanDerWaalsContact O-CB 3.31Å; V173-S177 WeakPolarHBondContact O-CB 3.36Å; V173-S177 PolarHBondContact O-N 2.98Å; V173-S177 PolarHBondContact O-OG 3.05Å; N174-S177 PolarHBondContact O-N 3.13Å; T175-S177 VanDerWaalsContact C-N 3.32Å; T175-S177 PolarHBondContact O-N 3.33Å; S177-K181 WeakPolarHBondContact O-CB 3.36Å; S177-K181 PolarHBondContact O-N 2.95Å; S177-L210 WeakPolarHBondContact OG-CD2 3.47Å; S177-P211 VanDerWaalsContact OG-CD 3.28Å; S177-P211 WeakPolarHBondContact OG-CD 3.47Å; S177-P211 WeakPolarHBondContact OG-CG 3.48Å
178	L	96.6	Very high	95.4	Very high	42 Å²	42	30.2 Å²	30.2	22%	0.22	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-43.3	175.1	-72.7	169.8	0	0	0	111.7	V151 F154 N174 T175 L176 F213	V151-L178 HydrophobicContact CG1-CB 3.9Å; F154-L178 HydrophobicContact CB-CD1 4.04Å; F154-L178 HydrophobicContact CD1-CD1 3.81Å; F154-L178 HydrophobicContact CD2-CD1 3.36Å; F154-L178 HydrophobicContact CE1-CD1 4.1Å; F154-L178 HydrophobicContact CE2-CD1 3.66Å; F154-L178 HydrophobicContact CG-CD1 3.44Å; F154-L178 VanDerWaalsContact CG-CD1 3.44Å; F154-L178 HydrophobicContact CZ-CD1 4.03Å; N174-L178 WeakPolarHBondContact O-CB 3.29Å; N174-L178 WeakPolarHBondContact O-CG 3.39Å; N174-L178 PolarHBondContact O-N 3.27Å; T175-L178 PolarHBondContact O-N 3.19Å; L176-L178 PolarHBondContact O-N 3.35Å; L178-F213 HydrophobicContact CD1-CE1 4.34Å; L178-F213 HydrophobicContact CD1-CZ 4.16Å; L178-F213 HydrophobicContact CD2-CB 4.37Å; L178-F213 HydrophobicContact CD2-CD1 4.07Å; L178-F213 HydrophobicContact CD2-CD2 3.54Å; L178-F213 HydrophobicContact CD2-CE1 4.22Å; L178-F213 HydrophobicContact CD2-CE2 3.72Å; L178-F213 HydrophobicContact CD2-CG 3.73Å; L178-F213 HydrophobicContact CD2-CZ 4.06Å; L178-F213 HydrophobicContact CG-CD2 4.05Å; L178-F213 HydrophobicContact CG-CE1 4.27Å; L178-F213 HydrophobicContact CG-CE2 3.66Å; L178-F213 HydrophobicContact CG-CZ 3.79Å
179	A	96.1	Very high	95.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-51.3	178.7	0	0	0	0	0	111.9	T19 V151 T175 L176 K181 R182 D183	T19-A179 HydrophobicContact CG2-CB 3.55Å; T19-A179 WeakPolarHBondContact OG1-CB 3.42Å; V151-A179 HydrophobicContact CG1-CB 3.72Å; T175-A179 WeakPolarHBondContact O-CB 3.21Å; T175-A179 PolarHBondContact O-N 2.9Å; L176-A179 PolarHBondContact O-N 3.38Å; A179-K181 PolarHBondContact O-N 3.4Å; A179-R182 PolarHBondContact O-N 3.1Å; A179-D183 WeakPolarHBondContact O-CB 3.21Å; A179-D183 PolarHBondContact O-N 3.47Å
180	M	94.9	Very high	95.4	Very high	26 Å²	26	29.2 Å²	29.2	13%	0.128	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-22.9	-178.7	-70.3	163.7	73.2	0	0	113.3	D34 L176 G187 G188 L210	D34-M180 HydrophobicContact CB-CG 3.89Å; D34-M180 HydrophobicContact CB-SD 4.07Å; L176-M180 HydrophobicContact CB-SD 4.18Å; L176-M180 VanDerWaalsContact O-CB 3.29Å; L176-M180 WeakPolarHBondContact O-CB 3.15Å; L176-M180 WeakPolarHBondContact O-CG 3.32Å; L176-M180 PolarHBondContact O-N 3.44Å; M180-G187 VanDerWaalsContact CE-C 3.42Å; M180-G188 WeakPolarHBondContact CE-O 3.47Å; M180-L210 HydrophobicContact CE-CD1 3.5Å; M180-L210 HydrophobicContact SD-CD1 3.9Å
181	K	93.4	Very high	95.4	Very high	77 Å²	77	26.2 Å²	26.2	34%	0.335	15%	0.148	S	C	.	.	H	α-helix	trans	-87.2	-18.4	179.6	-171.1	162.5	164.4	-159.2	0	114	S177 A179 D215	S177-K181 WeakPolarHBondContact O-CB 3.36Å; S177-K181 PolarHBondContact O-N 2.95Å; A179-K181 PolarHBondContact O-N 3.4Å; K181-D215 WeakPolarHBondContact CE-OD2 3.37Å; K181-D215 IonicContact NZ-OD1 2.59Å; K181-D215 PolarHBondContact NZ-OD1 3.1Å; K181-D215 IonicContact NZ-OD2 2.69Å; K181-D215 PolarHBondContact NZ-OD2 3.3Å
182	R	92.5	Very high	95.4	Very high	150 Å²	150	26.2 Å²	26.2	57%	0.566	15%	0.148	S	C	*	.	H	α-helix	trans	-111.6	-35.4	-178.9	-64.2	-61.2	-171.6	172.6	-0.3	112.6	Y150 A179	Y150-R182 HydrophobicContact CD1-CB 3.67Å; Y150-R182 HydrophobicContact CD2-CB 4.33Å; Y150-R182 HydrophobicContact CE1-CB 4.15Å; Y150-R182 HydrophobicContact CG-CB 3.77Å; A179-R182 PolarHBondContact O-N 3.1Å
183	D	92.8	Very high	95.4	Very high	13 Å²	13	26.2 Å²	26.2	7%	0.07	15%	0.149	C	C	.	.			trans	-84.7	110.2	177.4	-175.7	23.3	0	0	0	110.9	S146 G147 Y150 A179 S185 S186	S146-D183 PolarHBondContact OG-OD2 3.12Å; G147-D183 WeakPolarHBondContact CA-OD2 3.34Å; G147-D183 PolarHBondContact N-OD2 3.31Å; G147-D183 VanDerWaalsContact N-OD2 3.14Å; Y150-D183 HydrophobicContact CD2-CB 3.77Å; Y150-D183 HydrophobicContact CE2-CB 3.58Å; A179-D183 WeakPolarHBondContact O-CB 3.21Å; A179-D183 PolarHBondContact O-N 3.47Å; D183-S185 PolarHBondContact O-N 2.73Å; D183-S185 VanDerWaalsContact O-N 3.12Å; D183-S185 PolarHBondContact OD1-N 3.31Å; D183-S186 PolarHBondContact O-N 3.47Å; D183-S186 VanDerWaalsContact O-N 3.1Å; D183-S186 WeakPolarHBondContact OD2-CB 3.4Å; D183-S186 PolarHBondContact OD2-N 2.92Å; D183-S186 PolarHBondContact OD2-OG 3.41Å
184	G	88.4	Confident	95.4	Very high	61 Å²	61	26 Å²	26	63%	0.629	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.5	-178.2	0	0	0	0	0	114	R36	R36-G184 PolarHBondContact NH1-O 3.47Å
185	S	88.4	Confident	95.5	Very high	37 Å²	37	24.4 Å²	24.4	26%	0.259	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-11.1	-179.2	-60.3	0	0	0	0	113.5	R36 D183	R36-S185 WeakPolarHBondContact CD-O 3.34Å; D183-S185 PolarHBondContact O-N 2.73Å; D183-S185 VanDerWaalsContact O-N 3.12Å; D183-S185 PolarHBondContact OD1-N 3.31Å
186	S	92.8	Very high	95.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.145	C	C	.	.			trans	-97.4	150	171.8	-64.1	0	0	0	0	111	T18 T19 D34 R36 D183	T18-S186 VanDerWaalsContact C-OG 3.27Å; T19-S186 PolarHBondContact N-OG 2.99Å; T19-S186 WeakPolarHBondContact OG1-CB 3.44Å; T19-S186 PolarHBondContact OG1-OG 3.26Å; D34-S186 VanDerWaalsContact OD2-CA 3.29Å; D34-S186 WeakPolarHBondContact OD2-CA 3.47Å; R36-S186 PolarHBondContact NH1-O 3.05Å; D183-S186 PolarHBondContact O-N 3.47Å; D183-S186 VanDerWaalsContact O-N 3.1Å; D183-S186 WeakPolarHBondContact OD2-CB 3.4Å; D183-S186 PolarHBondContact OD2-N 2.92Å; D183-S186 PolarHBondContact OD2-OG 3.41Å
187	G	93.6	Very high	95.4	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.031	17%	0.17	C	C	.	.			trans	160.2	-166.3	175.9	0	0	0	0	0	114.7	D34 S35 R36 M180	D34-G187 PolarHBondContact OD2-N 2.76Å; S35-G187 PolarHBondContact N-O 2.95Å; S35-G187 VanDerWaalsContact N-O 3.14Å; S35-G187 PolarHBondContact OG-O 3.34Å; R36-G187 WeakPolarHBondContact CB-O 3.4Å; R36-G187 PolarHBondContact N-O 2.66Å; M180-G187 VanDerWaalsContact CE-C 3.42Å
188	G	94.9	Very high	95.3	Very high	30 Å²	30	38 Å²	38	31%	0.309	20%	0.202	S	C	.	.	S	Bend	trans	88.5	-123.3	-177.6	0	0	0	0	0	112.1	S35 M180 G207	S35-G188 WeakPolarHBondContact OG-CA 3.37Å; M180-G188 WeakPolarHBondContact CE-O 3.47Å; G188-G207 WeakPolarHBondContact O-CA 3.29Å
189	V	97.1	Very high	95.3	Very high	17 Å²	17	37 Å²	37	10%	0.103	20%	0.202	C	C	.	.			trans	-107.2	161.2	178.2	-57.3	0	0	0	0	110.2	S35 Y191 V204 I205 L206	S35-V189 PolarHBondContact N-O 3.43Å; S35-V189 WeakPolarHBondContact OG-CG2 3.43Å; S35-V189 PolarHBondContact OG-N 2.92Å; S35-V189 PolarHBondContact OG-O 3.43Å; V189-Y191 HydrophobicContact CG2-CD2 4.15Å; V189-Y191 HydrophobicContact CG2-CE2 3.62Å; V189-V204 HydrophobicContact CB-CG1 3.94Å; V189-V204 HydrophobicContact CG1-CG1 4.5Å; V189-V204 HydrophobicContact CG2-CG1 3.77Å; V189-I205 WeakPolarHBondContact CA-O 3.46Å; V189-I205 WeakPolarHBondContact CB-O 3.41Å; V189-L206 HydrophobicContact CG1-CD2 4.19Å
190	A	98.1	Very high	95.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.6	170.2	0	0	0	0	0	109.8	S33 L176 L192 V204 I205 L210	S33-A190 WeakPolarHBondContact O-CA 3.48Å; L176-A190 HydrophobicContact CD1-CB 3.81Å; A190-L192 HydrophobicContact CB-CD1 4.06Å; A190-V204 WeakPolarHBondContact O-CA 2.89Å; A190-I205 HydrophobicContact CB-CB 4.34Å; A190-I205 PolarHBondContact N-O 2.95Å; A190-I205 PolarHBondContact O-N 3.34Å; A190-L210 HydrophobicContact CB-CD2 3.8Å
191	Y	98.4	Very high	95.5	Very high	38 Å²	38	42.2 Å²	42.2	15%	0.149	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	136.1	167.4	-70.8	-78.3	0	0	0	109	G32 S33 V47 M48 N49 V189 V204	G32-Y191 CarbonylContact C-O 3.57Å; G32-Y191 WeakPolarHBondContact CA-O 3.47Å; S33-Y191 PolarHBondContact N-O 3.23Å; S33-Y191 PolarHBondContact O-N 2.74Å; V47-Y191 PolarHBondContact O-OH 3Å; V47-Y191 VanDerWaalsContact O-OH 3.05Å; M48-Y191 WeakPolarHBondContact O-CE2 3.23Å; N49-Y191 HydrophobicContact CB-CD1 4.16Å; N49-Y191 HydrophobicContact CB-CD2 4.13Å; N49-Y191 HydrophobicContact CB-CE1 4.06Å; N49-Y191 HydrophobicContact CB-CE2 4Å; N49-Y191 HydrophobicContact CB-CG 4.22Å; V189-Y191 HydrophobicContact CG2-CD2 4.15Å; V189-Y191 HydrophobicContact CG2-CE2 3.62Å; Y191-V204 HydrophobicContact CD1-CG1 4.38Å; Y191-V204 HydrophobicContact CD1-CG2 3.64Å; Y191-V204 HydrophobicContact CE1-CB 4.42Å; Y191-V204 HydrophobicContact CE1-CG1 4.1Å; Y191-V204 HydrophobicContact CE1-CG2 3.47Å; Y191-V204 VanDerWaalsContact CE1-CG2 3.47Å
192	L	98.4	Very high	95.7	Very high	6 Å²	6	44 Å²	44	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.7	175	-77.3	89	0	0	0	109.5	V30 L31 V172 V173 A190 E202 K203 I205	V30-L192 HydrophobicContact CG1-CD2 4.35Å; L31-L192 WeakPolarHBondContact O-CA 3.29Å; V172-L192 HydrophobicContact CB-CD2 4.36Å; V172-L192 HydrophobicContact CG1-CD2 3.92Å; V172-L192 HydrophobicContact CG1-CG 4.04Å; V173-L192 HydrophobicContact CG2-CD1 4.01Å; V173-L192 HydrophobicContact CG2-CD2 3.7Å; V173-L192 HydrophobicContact CG2-CG 4.5Å; A190-L192 HydrophobicContact CB-CD1 4.06Å; L192-E202 CarbonylContact O-C 3.54Å; L192-E202 WeakPolarHBondContact O-CA 3.24Å; L192-K203 HydrophobicContact CB-CB 4.41Å; L192-K203 PolarHBondContact N-O 3.08Å; L192-K203 PolarHBondContact O-N 2.78Å; L192-I205 HydrophobicContact CD1-CD1 3.75Å; L192-I205 HydrophobicContact CD1-CG1 4.14Å
193	V	98.7	Very high	95.9	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	120.2	171.8	177.3	0	0	0	0	107.4	V30 L31 L51 Y59 I195 T200 E201 E202	V30-V193 CarbonylContact C-O 3.5Å; V30-V193 WeakPolarHBondContact CA-O 3.1Å; L31-V193 HydrophobicContact CB-CB 4.45Å; L31-V193 HydrophobicContact CD1-CB 4.41Å; L31-V193 HydrophobicContact CD1-CG1 4.45Å; L31-V193 PolarHBondContact N-O 2.99Å; L31-V193 PolarHBondContact O-N 3.4Å; L51-V193 HydrophobicContact CB-CG2 4.03Å; L51-V193 HydrophobicContact CD1-CB 4.12Å; L51-V193 HydrophobicContact CD1-CG2 3.59Å; L51-V193 HydrophobicContact CG-CG2 4.46Å; Y59-V193 HydrophobicContact CD1-CB 4.37Å; Y59-V193 HydrophobicContact CD1-CG1 3.94Å; Y59-V193 HydrophobicContact CD1-CG2 3.96Å; Y59-V193 HydrophobicContact CD2-CG1 4.06Å; Y59-V193 HydrophobicContact CE1-CB 4.49Å; Y59-V193 HydrophobicContact CE1-CG1 3.92Å; Y59-V193 HydrophobicContact CE1-CG2 3.86Å; Y59-V193 HydrophobicContact CE2-CG1 4.09Å; Y59-V193 HydrophobicContact CG-CG1 4Å; V193-I195 HydrophobicContact CG1-CD1 4.13Å; V193-I195 HydrophobicContact CG1-CG1 3.81Å; V193-T200 HydrophobicContact CG1-CG2 3.48Å; V193-T200 VanDerWaalsContact CG1-CG2 3.48Å; V193-E201 WeakPolarHBondContact CA-O 3.26Å; V193-E202 HydrophobicContact CG2-CG 4.16Å
194	T	98.7	Very high	96.2	Very high	3 Å²	3	45 Å²	45	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.1	174	-51.7	0	0	0	0	109.3	F25 V29 V30 K165 Q169 T200 E201	F25-T194 HydrophobicContact CE1-CG2 4.02Å; F25-T194 HydrophobicContact CZ-CG2 4.23Å; V29-T194 WeakPolarHBondContact O-CA 3.37Å; V30-T194 HydrophobicContact CG2-CG2 3.93Å; K165-T194 HydrophobicContact CD-CG2 3.88Å; K165-T194 VanDerWaalsContact CE-CG2 3.45Å; K165-T194 HydrophobicContact CG-CG2 3.98Å; Q169-T194 PolarHBondContact NE2-OG1 3.45Å; T194-T200 CarbonylContact O-C 3.57Å; T194-T200 WeakPolarHBondContact O-CA 3.05Å; T194-E201 PolarHBondContact N-O 2.7Å; T194-E201 PolarHBondContact O-N 2.84Å
195	I	98.6	Very high	96.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.9	-175.6	-48.4	173.4	0	0	0	108.4	G28 V29 L31 K57 Y59 W120 V193 G199 T200	G28-I195 CarbonylContact C-O 3.51Å; G28-I195 WeakPolarHBondContact CA-O 3.46Å; V29-I195 HydrophobicContact CG2-CB 3.87Å; V29-I195 HydrophobicContact CG2-CD1 4.08Å; V29-I195 HydrophobicContact CG2-CG1 4.22Å; V29-I195 PolarHBondContact N-O 3.06Å; V29-I195 PolarHBondContact O-N 2.93Å; L31-I195 HydrophobicContact CD1-CD1 3.74Å; L31-I195 HydrophobicContact CD1-CG1 4.32Å; K57-I195 HydrophobicContact CB-CG2 3.86Å; K57-I195 HydrophobicContact CG-CG2 4.32Å; Y59-I195 HydrophobicContact CD2-CD1 3.63Å; Y59-I195 HydrophobicContact CE2-CD1 4.41Å; Y59-I195 HydrophobicContact CG-CD1 4.22Å; W120-I195 HydrophobicContact CB-CG2 3.84Å; V193-I195 HydrophobicContact CG1-CD1 4.13Å; V193-I195 HydrophobicContact CG1-CG1 3.81Å; I195-G199 WeakPolarHBondContact CA-O 3.37Å; I195-T200 HydrophobicContact CG1-CG2 4.17Å
196	D	97.4	Very high	97	Very high	25 Å²	25	46 Å²	46	13%	0.134	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-171.3	175.3	60.7	39.8	0	0	0	111.6	F25 G27 K165 H198 G199	F25-D196 HydrophobicContact CZ-CB 4.43Å; G27-D196 WeakPolarHBondContact O-CB 3.2Å; K165-D196 IonicContact NZ-OD2 3.51Å; D196-H198 PolarHBondContact O-N 3.45Å; D196-H198 WeakPolarHBondContact OD1-CA 3.27Å; D196-H198 WeakPolarHBondContact OD1-CB 3.42Å; D196-H198 IonicContact OD1-CD2 3.88Å; D196-H198 IonicContact OD1-CG 3.91Å; D196-H198 PolarHBondContact OD1-N 3.23Å; D196-G199 PolarHBondContact N-O 2.96Å; D196-G199 PolarHBondContact O-N 2.79Å; D196-G199 PolarHBondContact OD1-N 2.9Å; D196-G199 VanDerWaalsContact OD1-N 3.16Å
197	E	96.6	Very high	97	Very high	112 Å²	112	47.7 Å²	47.7	52%	0.523	26%	0.257	S	S	.	.	S	Bend	trans	-61.8	-25.7	179.8	72.1	175.3	166.1	0	0	113.6	K57 W120	K57-E197 PolarHBondContact NZ-O 3.24Å; W120-E197 HydrophobicContact CD2-CB 4.39Å; W120-E197 HydrophobicContact CH2-CB 3.72Å; W120-E197 HydrophobicContact CZ2-CB 3.23Å; W120-E197 HydrophobicContact CZ3-CB 4.47Å
198	H	95.8	Very high	96.9	Very high	156 Å²	156	55.3 Å²	55.3	72%	0.722	30%	0.297	S	S	*	.	S	Bend	trans	-87.4	-30.8	-176.3	-55	-53.1	0	0	0	111.9	D196	D196-H198 PolarHBondContact O-N 3.45Å; D196-H198 WeakPolarHBondContact OD1-CA 3.27Å; D196-H198 WeakPolarHBondContact OD1-CB 3.42Å; D196-H198 IonicContact OD1-CD2 3.88Å; D196-H198 IonicContact OD1-CG 3.91Å; D196-H198 PolarHBondContact OD1-N 3.23Å
199	G	95	Very high	96.9	Very high	22 Å²	22	59.2 Å²	59.2	23%	0.227	31%	0.311	C	S	.	.			trans	160.6	-152.8	177.8	0	0	0	0	0	113.8	I195 D196	I195-G199 WeakPolarHBondContact CA-O 3.37Å; D196-G199 PolarHBondContact N-O 2.96Å; D196-G199 PolarHBondContact O-N 2.79Å; D196-G199 PolarHBondContact OD1-N 2.9Å; D196-G199 VanDerWaalsContact OD1-N 3.16Å
200	T	97.6	Very high	96.7	Very high	49 Å²	49	59.6 Å²	59.6	30%	0.301	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.3	-176.3	-59	0	0	0	0	110.2	D56 Y59 V193 T194 I195 E202	D56-T200 PolarHBondContact O-OG1 2.83Å; Y59-T200 HydrophobicContact CE2-CG2 3.71Å; V193-T200 HydrophobicContact CG1-CG2 3.48Å; V193-T200 VanDerWaalsContact CG1-CG2 3.48Å; T194-T200 CarbonylContact O-C 3.57Å; T194-T200 WeakPolarHBondContact O-CA 3.05Å; I195-T200 HydrophobicContact CG1-CG2 4.17Å; T200-E202 HydrophobicContact CG2-CG 4.38Å
201	E	97.9	Very high	96.5	Very high	87 Å²	87	61.7 Å²	61.7	41%	0.407	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	113.5	177.1	-179.2	-171.4	171.2	0	0	109.1	K165 V193 T194	K165-E201 VanDerWaalsContact CE-OE2 3.29Å; K165-E201 WeakPolarHBondContact CE-OE2 3Å; K165-E201 IonicContact NZ-OE2 3.52Å; K165-E201 PolarHBondContact NZ-OE2 3.22Å; V193-E201 WeakPolarHBondContact CA-O 3.26Å; T194-E201 PolarHBondContact N-O 2.7Å; T194-E201 PolarHBondContact O-N 2.84Å
202	E	97.9	Very high	96	Very high	113 Å²	113	63.3 Å²	63.3	53%	0.528	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.1	176	-53	-166.1	173.9	0	0	111.1	Y59 L192 V193 T200	Y59-E202 PolarHBondContact OH-OE1 2.91Å; L192-E202 CarbonylContact O-C 3.54Å; L192-E202 WeakPolarHBondContact O-CA 3.24Å; V193-E202 HydrophobicContact CG2-CG 4.16Å; T200-E202 HydrophobicContact CG2-CG 4.38Å
203	K	97.7	Very high	95.5	Very high	113 Å²	113	66.5 Å²	66.5	49%	0.491	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.6	179	-174.7	174.5	179.9	-179	0	110.8	L192	L192-K203 HydrophobicContact CB-CB 4.41Å; L192-K203 PolarHBondContact N-O 3.08Å; L192-K203 PolarHBondContact O-N 2.78Å
204	V	98.2	Very high	94.6	Very high	71 Å²	71	73 Å²	73	43%	0.43	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.7	170.4	-169.7	0	0	0	0	108.7	V189 A190 Y191	V189-V204 HydrophobicContact CB-CG1 3.94Å; V189-V204 HydrophobicContact CG1-CG1 4.5Å; V189-V204 HydrophobicContact CG2-CG1 3.77Å; A190-V204 WeakPolarHBondContact O-CA 2.89Å; Y191-V204 HydrophobicContact CD1-CG1 4.38Å; Y191-V204 HydrophobicContact CD1-CG2 3.64Å; Y191-V204 HydrophobicContact CE1-CB 4.42Å; Y191-V204 HydrophobicContact CE1-CG1 4.1Å; Y191-V204 HydrophobicContact CE1-CG2 3.47Å; Y191-V204 VanDerWaalsContact CE1-CG2 3.47Å
205	I	97.6	Very high	93.2	Very high	22 Å²	22	76.4 Å²	76.4	11%	0.113	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.5	172.1	-56.1	176.1	0	0	0	107.6	V173 V189 A190 L192 D209 L210	V173-I205 HydrophobicContact CB-CD1 4.28Å; V173-I205 HydrophobicContact CG1-CD1 3.94Å; V173-I205 HydrophobicContact CG2-CD1 3.25Å; V189-I205 WeakPolarHBondContact CA-O 3.46Å; V189-I205 WeakPolarHBondContact CB-O 3.41Å; A190-I205 HydrophobicContact CB-CB 4.34Å; A190-I205 PolarHBondContact N-O 2.95Å; A190-I205 PolarHBondContact O-N 3.34Å; L192-I205 HydrophobicContact CD1-CD1 3.75Å; L192-I205 HydrophobicContact CD1-CG1 4.14Å; I205-D209 HydrophobicContact CG2-CB 3.95Å; I205-L210 HydrophobicContact CB-CD2 4.23Å; I205-L210 HydrophobicContact CG2-CD2 3.76Å; I205-L210 HydrophobicContact CG2-CG 4.22Å
206	L	96.9	Very high	91.1	Very high	99 Å²	99	86.6 Å²	86.6	52%	0.518	45%	0.448	S	S	.	.			trans	-67.7	151.3	-179.1	-55.8	-179.4	0	0	0	110.1	V189 N208 D209 L210	V189-L206 HydrophobicContact CG1-CD2 4.19Å; L206-N208 PolarHBondContact O-N 3.42Å; L206-N208 VanDerWaalsContact O-N 3.11Å; L206-D209 WeakPolarHBondContact O-CA 3.27Å; L206-D209 PolarHBondContact O-N 2.96Å; L206-L210 PolarHBondContact O-N 2.86Å
207	G	91	Very high	90.8	Very high	35 Å²	35	89.7 Å²	89.7	36%	0.361	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-56.2	-32.3	-177.3	0	0	0	0	0	114.1	G188 D209 L210	G188-G207 WeakPolarHBondContact O-CA 3.29Å; G207-D209 VanDerWaalsContact C-N 3.3Å; G207-D209 PolarHBondContact O-N 3.26Å; G207-L210 PolarHBondContact O-N 3.18Å
208	N	92.3	Very high	90.5	Very high	163 Å²	163	88.5 Å²	88.5	87%	0.872	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-75.1	-18.5	177.5	-64.2	-12.1	0	0	0	113.5	L206	L206-N208 PolarHBondContact O-N 3.42Å; L206-N208 VanDerWaalsContact O-N 3.11Å
209	D	94.6	Very high	90.2	Very high	112 Å²	112	84.8 Å²	84.8	60%	0.599	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-97.6	-0.7	-179.9	-57.7	-37.7	0	0	0	111.7	I205 L206 G207	I205-D209 HydrophobicContact CG2-CB 3.95Å; L206-D209 WeakPolarHBondContact O-CA 3.27Å; L206-D209 PolarHBondContact O-N 2.96Å; G207-D209 VanDerWaalsContact C-N 3.3Å; G207-D209 PolarHBondContact O-N 3.26Å
210	L	94	Very high	89.9	Confident	25 Å²	25	88.5 Å²	88.5	13%	0.131	46%	0.459	C	S	.	.	S	Bend	trans	-72.8	141.1	176	-69.8	170.6	0	0	0	110.6	V173 S177 M180 A190 I205 L206 G207 T212	V173-L210 HydrophobicContact CG1-CD2 4.12Å; S177-L210 WeakPolarHBondContact OG-CD2 3.47Å; M180-L210 HydrophobicContact CE-CD1 3.5Å; M180-L210 HydrophobicContact SD-CD1 3.9Å; A190-L210 HydrophobicContact CB-CD2 3.8Å; I205-L210 HydrophobicContact CB-CD2 4.23Å; I205-L210 HydrophobicContact CG2-CD2 3.76Å; I205-L210 HydrophobicContact CG2-CG 4.22Å; L206-L210 PolarHBondContact O-N 2.86Å; G207-L210 PolarHBondContact O-N 3.18Å; L210-T212 PolarHBondContact O-N 3.17Å
211	P	93.4	Very high	89.4	Confident	43 Å²	43	90.9 Å²	90.9	28%	0.279	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-60.6	133.8	178.8	23.8	-34.2	0	0	0	112.1	V173 S177 F213	V173-P211 HydrophobicContact CG1-CG 3.95Å; S177-P211 VanDerWaalsContact OG-CD 3.28Å; S177-P211 WeakPolarHBondContact OG-CD 3.47Å; S177-P211 WeakPolarHBondContact OG-CG 3.48Å; P211-F213 HydrophobicContact CB-CE2 4.3Å; P211-F213 HydrophobicContact CB-CZ 4.47Å; P211-F213 HydrophobicContact CG-CE2 4.24Å; P211-F213 HydrophobicContact CG-CZ 4.38Å
212	T	88.9	Confident	88.8	Confident	72 Å²	72	91.2 Å²	91.2	44%	0.442	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-90.8	152.3	165.7	54	0	0	0	0	109.8	L210 D215 Q216	L210-T212 PolarHBondContact O-N 3.17Å; T212-D215 WeakPolarHBondContact CB-OD1 3.45Å; T212-Q216 WeakPolarHBondContact OG1-CG 3.4Å; T212-Q216 PolarHBondContact OG1-NE2 3.42Å
213	F	86.7	Confident	88.2	Confident	73 Å²	73	89.6 Å²	89.6	32%	0.32	47%	0.469	S	S	.	.			trans	-120.1	-84.7	-173	-69.3	-93.6	0	0	0	111.2	N174 L178 P211 D215	N174-F213 HydrophobicContact CB-CZ 3.87Å; L178-F213 HydrophobicContact CD1-CE1 4.34Å; L178-F213 HydrophobicContact CD1-CZ 4.16Å; L178-F213 HydrophobicContact CD2-CB 4.37Å; L178-F213 HydrophobicContact CD2-CD1 4.07Å; L178-F213 HydrophobicContact CD2-CD2 3.54Å; L178-F213 HydrophobicContact CD2-CE1 4.22Å; L178-F213 HydrophobicContact CD2-CE2 3.72Å; L178-F213 HydrophobicContact CD2-CG 3.73Å; L178-F213 HydrophobicContact CD2-CZ 4.06Å; L178-F213 HydrophobicContact CG-CD2 4.05Å; L178-F213 HydrophobicContact CG-CE1 4.27Å; L178-F213 HydrophobicContact CG-CE2 3.66Å; L178-F213 HydrophobicContact CG-CZ 3.79Å; P211-F213 HydrophobicContact CB-CE2 4.3Å; P211-F213 HydrophobicContact CB-CZ 4.47Å; P211-F213 HydrophobicContact CG-CE2 4.24Å; P211-F213 HydrophobicContact CG-CZ 4.38Å; F213-D215 PolarHBondContact N-OD1 3.19Å
214	F	81	Confident	87.4	Confident	138 Å²	138	87.8 Å²	87.8	61%	0.605	47%	0.467	S	S	*	.	S	Bend	trans	-92.1	-11.7	-176	76.4	-89.7	0	0	0	114.3
215	D	68.1	Low	86.5	Confident	75 Å²	75	89.3 Å²	89.3	40%	0.401	47%	0.47	S	S	.	.			trans	-102.1	28.5	-168.9	65.6	-41.7	0	0	0	113.3	K181 T212 F213	K181-D215 WeakPolarHBondContact CE-OD2 3.37Å; K181-D215 IonicContact NZ-OD1 2.59Å; K181-D215 PolarHBondContact NZ-OD1 3.1Å; K181-D215 IonicContact NZ-OD2 2.69Å; K181-D215 PolarHBondContact NZ-OD2 3.3Å; T212-D215 WeakPolarHBondContact CB-OD1 3.45Å; F213-D215 PolarHBondContact N-OD1 3.19Å
216	Q	54.3	Low	85.5	Confident	214 Å²	214	95.4 Å²	95.4	100%	1	50%	0.503	S	S	*	.			trans	-79.9	0	173.8	-70.8	-172.5	-4.6	0	0	111.7	T212	T212-Q216 WeakPolarHBondContact OG1-CG 3.4Å; T212-Q216 PolarHBondContact OG1-NE2 3.42Å

Retrieved 216 of 216 residues in 282.4 ms (Link to these results)

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