A0A077ZB22_TRITR Loading...

Pre-mRNA-processing factor 19

Ubiquitin-protein ligase which is mainly involved pre-mRNA splicing and DNA repair. Required for pre-mRNA splicing as component of the spliceosome.

AlphaFold DB , UniProt , Accession A0A077ZB22, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 487 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	87.4	Confident	88.3	Confident	72 Å²	72	73.7 Å²	73.7	36%	0.355	37%	0.372	S	S	.	.				0	131.2	0	-175.8	-178.4	-168.8	0	0	107.4	K6 C7 V8 I37 I39	M1-K6 HydrophobicContact CE-CB 4Å; M1-K6 WeakPolarHBondContact CE-O 3.47Å; M1-C7 WeakPolarHBondContact CA-O 3.5Å; M1-V8 HydrophobicContact CG-CG2 4.39Å; M1-I37 HydrophobicContact CB-CB 4.32Å; M1-I37 PolarHBondContact N-O 3.37Å; M1-I37 PolarHBondContact O-N 3.26Å; M1-I39 HydrophobicContact CB-CD1 3.86Å; M1-I39 HydrophobicContact CB-CG1 4.26Å; M1-I39 HydrophobicContact CG-CD1 4.44Å; M1-I39 HydrophobicContact SD-CD1 4.28Å
2	S	88.6	Confident	88.5	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	39%	0.392	C	S	.	.			trans	-79.9	129	174	-179	0	0	0	0	109.5	S4 S5 K6 C7 D24 L31	S2-S4 VanDerWaalsContact C-N 3.33Å; S2-S4 PolarHBondContact OG-OG 2.89Å; S2-S5 WeakPolarHBondContact CB-OG 3.3Å; S2-K6 WeakPolarHBondContact O-CA 3.24Å; S2-K6 PolarHBondContact O-N 3.19Å; S2-C7 PolarHBondContact N-O 3.21Å; S2-C7 VanDerWaalsContact N-O 3.08Å; S2-D24 WeakPolarHBondContact CB-OD2 3.46Å; S2-D24 PolarHBondContact OG-OD2 2.91Å; S2-L31 WeakPolarHBondContact OG-CD2 3.28Å
3	P	86.1	Confident	88.8	Confident	62 Å²	62	82.5 Å²	82.5	40%	0.403	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-29	178.8	27.3	-33	0	0	0	113	L31 Q35	P3-L31 HydrophobicContact CG-CD1 4.29Å; P3-Q35 WeakPolarHBondContact CD-O 3.5Å; P3-Q35 HydrophobicContact CG-CB 4.37Å; P3-Q35 WeakPolarHBondContact CG-O 3.43Å
4	S	85.1	Confident	89	Confident	38 Å²	38	77.3 Å²	77.3	27%	0.266	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-58.8	179.5	39.1	0	0	0	0	112	S2 D24 E29	S2-S4 VanDerWaalsContact C-N 3.33Å; S2-S4 PolarHBondContact OG-OG 2.89Å; S4-D24 PolarHBondContact OG-OD2 3.29Å; S4-E29 WeakPolarHBondContact CB-OE2 3.44Å
5	S	87.8	Confident	89.2	Confident	25 Å²	25	76.3 Å²	76.3	18%	0.175	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-13.7	-179.7	54.8	0	0	0	0	114.5	S2 C7 D24	S2-S5 WeakPolarHBondContact CB-OG 3.3Å; S5-C7 PolarHBondContact O-N 3.33Å; S5-C7 VanDerWaalsContact O-N 3.1Å; S5-C7 PolarHBondContact O-SG 2.86Å; S5-D24 WeakPolarHBondContact CB-OD2 3.4Å; S5-D24 PolarHBondContact N-OD2 2.82Å; S5-D24 VanDerWaalsContact N-OD2 3.15Å; S5-D24 PolarHBondContact OG-OD1 2.96Å; S5-D24 PolarHBondContact OG-OD2 3.38Å
6	K	89	Confident	89.4	Confident	159 Å²	159	79.4 Å²	79.4	69%	0.691	38%	0.382	S	S	*	.			trans	55.6	20.3	-171.1	-58.6	178.8	-178.1	174.8	0	113.6	M1 S2	M1-K6 HydrophobicContact CE-CB 4Å; M1-K6 WeakPolarHBondContact CE-O 3.47Å; S2-K6 WeakPolarHBondContact O-CA 3.24Å; S2-K6 PolarHBondContact O-N 3.19Å
7	C	90.1	Very high	89.6	Confident	45 Å²	45	78.5 Å²	78.5	30%	0.304	37%	0.374	S	S	.	.			trans	-92.4	149.7	177.3	-67.8	0	0	0	0	111.6	M1 S2 S5 F9 I26	M1-C7 WeakPolarHBondContact CA-O 3.5Å; S2-C7 PolarHBondContact N-O 3.21Å; S2-C7 VanDerWaalsContact N-O 3.08Å; S5-C7 PolarHBondContact O-N 3.33Å; S5-C7 VanDerWaalsContact O-N 3.1Å; S5-C7 PolarHBondContact O-SG 2.86Å; C7-F9 HydrophobicContact CB-CE1 4.38Å; C7-F9 HydrophobicContact CB-CE2 3.78Å; C7-F9 HydrophobicContact CB-CZ 3.67Å; C7-I26 HydrophobicContact CB-CD1 3.69Å; C7-I26 WeakPolarHBondContact SG-CD1 3.07Å
8	V	91.1	Very high	89.7	Confident	99 Å²	99	74.9 Å²	74.9	60%	0.6	36%	0.358	S	S	*	.			trans	-97.4	126.3	177.4	-177.6	0	0	0	0	108.6	M1 I39	M1-V8 HydrophobicContact CG-CG2 4.39Å; V8-I39 HydrophobicContact CB-CD1 4.46Å; V8-I39 HydrophobicContact CG1-CD1 4.01Å; V8-I39 HydrophobicContact CG2-CD1 3.61Å
9	F	89.8	Confident	89.8	Confident	61 Å²	61	75.6 Å²	75.6	27%	0.268	38%	0.377	S	S	.	.			trans	-121.6	154.5	179.9	-57.6	-78.9	0	0	0	110.3	C7 I14 P25 I26	C7-F9 HydrophobicContact CB-CE1 4.38Å; C7-F9 HydrophobicContact CB-CE2 3.78Å; C7-F9 HydrophobicContact CB-CZ 3.67Å; F9-I14 HydrophobicContact CB-CB 3.81Å; F9-I14 HydrophobicContact CB-CG1 4.34Å; F9-I14 HydrophobicContact CB-CG2 4.14Å; F9-I14 HydrophobicContact CD2-CD1 4.05Å; F9-I14 HydrophobicContact CD2-CG1 4.22Å; F9-I14 HydrophobicContact CE2-CD1 4.37Å; F9-I14 HydrophobicContact CG-CB 4.32Å; F9-I14 HydrophobicContact CG-CD1 4.24Å; F9-I14 HydrophobicContact CG-CG1 4.39Å; F9-P25 HydrophobicContact CE1-CG 3.77Å; F9-P25 HydrophobicContact CE2-CG 4.33Å; F9-P25 HydrophobicContact CZ-CG 3.66Å; F9-I26 HydrophobicContact CE1-CD1 3.96Å; F9-I26 HydrophobicContact CE1-CG1 4.38Å; F9-I26 HydrophobicContact CZ-CD1 3.6Å; F9-I26 HydrophobicContact CZ-CG1 4.01Å
10	E	88.3	Confident	90	Very high	99 Å²	99	78.4 Å²	78.4	46%	0.463	39%	0.389	S	S	.	.			trans	-69.1	132.8	166.4	-172.7	-92	178.3	0	0	109.2	R12 L13 I14	E10-R12 PolarHBondContact O-N 2.91Å; E10-R12 WeakPolarHBondContact OE1-CB 3.23Å; E10-R12 IonicContact OE1-NE 2.79Å; E10-R12 WeakPolarHBondContact OE2-CB 3.49Å; E10-R12 PolarHBondContact OE2-N 2.94Å; E10-R12 VanDerWaalsContact OE2-N 3.15Å; E10-L13 HydrophobicContact CB-CD1 4.36Å; E10-L13 PolarHBondContact O-N 2.9Å; E10-L13 WeakPolarHBondContact OE2-CB 3.32Å; E10-L13 VanDerWaalsContact OE2-CG 3.22Å; E10-L13 WeakPolarHBondContact OE2-CG 3.26Å; E10-L13 PolarHBondContact OE2-N 3.42Å; E10-I14 WeakPolarHBondContact O-CG2 3.5Å; E10-I14 PolarHBondContact O-N 3.23Å; E10-I14 VanDerWaalsContact O-N 3.13Å
11	R	88.7	Confident	89.9	Confident	151 Å²	151	80.6 Å²	80.6	57%	0.57	40%	0.396	S	S	*	.	H	α-helix	trans	-57.7	-44.8	-166.5	-178.4	173.3	177.2	164.4	-0.8	112.7	L13 I14 E15 E38	R11-L13 PolarHBondContact O-N 3.29Å; R11-I14 VanDerWaalsContact O-CG2 3.28Å; R11-I14 WeakPolarHBondContact O-CG2 3.36Å; R11-E15 HydrophobicContact CG-CG 4.4Å; R11-E15 VanDerWaalsContact CG-OE1 3.25Å; R11-E15 WeakPolarHBondContact CG-OE1 3.35Å; R11-E15 IonicContact CZ-OE1 3.64Å; R11-E15 IonicContact NE-OE1 2.81Å; R11-E15 PolarHBondContact NE-OE1 3.46Å; R11-E15 IonicContact NH2-OE1 3.54Å; R11-E15 WeakPolarHBondContact O-CB 3.47Å; R11-E15 VanDerWaalsContact O-CG 3.28Å; R11-E15 WeakPolarHBondContact O-CG 3.45Å; R11-E15 PolarHBondContact O-N 3.33Å; R11-E38 IonicContact NH1-OE1 2.95Å; R11-E38 PolarHBondContact NH1-OE1 3.33Å
12	R	90.2	Very high	90	Very high	163 Å²	163	78.8 Å²	78.8	62%	0.615	40%	0.396	S	S	*	.	H	α-helix	trans	-66.6	-39.6	-177.6	-175	-172	65.7	96.9	2.9	111.9	E10 K16	E10-R12 PolarHBondContact O-N 2.91Å; E10-R12 WeakPolarHBondContact OE1-CB 3.23Å; E10-R12 IonicContact OE1-NE 2.79Å; E10-R12 WeakPolarHBondContact OE2-CB 3.49Å; E10-R12 PolarHBondContact OE2-N 2.94Å; E10-R12 VanDerWaalsContact OE2-N 3.15Å; R12-K16 WeakPolarHBondContact O-CB 3.47Å; R12-K16 PolarHBondContact O-N 2.83Å; R12-K16 VanDerWaalsContact O-N 3.14Å
13	L	92.3	Very high	90.2	Very high	99 Å²	99	80.4 Å²	80.4	52%	0.518	41%	0.406	S	S	.	.	H	α-helix	trans	-68.6	-43.1	179.4	-71.3	176.6	0	0	0	111.9	E10 R11 Y17	E10-L13 HydrophobicContact CB-CD1 4.36Å; E10-L13 PolarHBondContact O-N 2.9Å; E10-L13 WeakPolarHBondContact OE2-CB 3.32Å; E10-L13 VanDerWaalsContact OE2-CG 3.22Å; E10-L13 WeakPolarHBondContact OE2-CG 3.26Å; E10-L13 PolarHBondContact OE2-N 3.42Å; R11-L13 PolarHBondContact O-N 3.29Å; L13-Y17 PolarHBondContact O-N 3.23Å
14	I	91.1	Very high	90.4	Very high	9 Å²	9	77.5 Å²	77.5	5%	0.046	39%	0.387	C	S	.	.	H	α-helix	trans	-71.3	-40.3	179.8	-170.7	61.9	0	0	0	112.2	F9 E10 R11 K16 Y17 I18 P25 L36	F9-I14 HydrophobicContact CB-CB 3.81Å; F9-I14 HydrophobicContact CB-CG1 4.34Å; F9-I14 HydrophobicContact CB-CG2 4.14Å; F9-I14 HydrophobicContact CD2-CD1 4.05Å; F9-I14 HydrophobicContact CD2-CG1 4.22Å; F9-I14 HydrophobicContact CE2-CD1 4.37Å; F9-I14 HydrophobicContact CG-CB 4.32Å; F9-I14 HydrophobicContact CG-CD1 4.24Å; F9-I14 HydrophobicContact CG-CG1 4.39Å; E10-I14 WeakPolarHBondContact O-CG2 3.5Å; E10-I14 PolarHBondContact O-N 3.23Å; E10-I14 VanDerWaalsContact O-N 3.13Å; R11-I14 VanDerWaalsContact O-CG2 3.28Å; R11-I14 WeakPolarHBondContact O-CG2 3.36Å; I14-K16 VanDerWaalsContact C-N 3.31Å; I14-K16 PolarHBondContact O-N 3.4Å; I14-Y17 PolarHBondContact O-N 3.47Å; I14-I18 HydrophobicContact CD1-CD1 4.34Å; I14-I18 HydrophobicContact CD1-CG1 4.38Å; I14-I18 HydrophobicContact CG1-CD1 3.91Å; I14-I18 HydrophobicContact CG1-CG1 4.4Å; I14-I18 WeakPolarHBondContact O-CG1 3.31Å; I14-I18 PolarHBondContact O-N 3.43Å; I14-P25 HydrophobicContact CD1-CG 3.83Å; I14-L36 HydrophobicContact CG1-CD1 4.34Å; I14-L36 HydrophobicContact CG1-CD2 4.1Å; I14-L36 HydrophobicContact CG2-CD1 3.95Å
15	E	92.3	Very high	90.6	Very high	63 Å²	63	78.1 Å²	78.1	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-42.2	174.8	-75	173.4	-179.3	0	0	111.1	R11 I18 A19 V33	R11-E15 HydrophobicContact CG-CG 4.4Å; R11-E15 VanDerWaalsContact CG-OE1 3.25Å; R11-E15 WeakPolarHBondContact CG-OE1 3.35Å; R11-E15 IonicContact CZ-OE1 3.64Å; R11-E15 IonicContact NE-OE1 2.81Å; R11-E15 PolarHBondContact NE-OE1 3.46Å; R11-E15 IonicContact NH2-OE1 3.54Å; R11-E15 WeakPolarHBondContact O-CB 3.47Å; R11-E15 VanDerWaalsContact O-CG 3.28Å; R11-E15 WeakPolarHBondContact O-CG 3.45Å; R11-E15 PolarHBondContact O-N 3.33Å; E15-I18 PolarHBondContact O-N 3.31Å; E15-A19 WeakPolarHBondContact O-CB 3.46Å; E15-A19 PolarHBondContact O-N 3.01Å; E15-V33 HydrophobicContact CG-CG1 4.27Å
16	K	93.4	Very high	90.7	Very high	126 Å²	126	82 Å²	82	55%	0.548	41%	0.408	S	S	.	.	H	α-helix	trans	-63.2	-42.8	175.3	-172.1	-179.7	176.9	-173.1	0	112.1	R12 I14 A19 E20	R12-K16 WeakPolarHBondContact O-CB 3.47Å; R12-K16 PolarHBondContact O-N 2.83Å; R12-K16 VanDerWaalsContact O-N 3.14Å; I14-K16 VanDerWaalsContact C-N 3.31Å; I14-K16 PolarHBondContact O-N 3.4Å; K16-A19 PolarHBondContact O-N 3.21Å; K16-E20 WeakPolarHBondContact CE-OE1 3.41Å; K16-E20 IonicContact NZ-OE1 2.93Å; K16-E20 PolarHBondContact O-N 2.65Å; K16-E20 VanDerWaalsContact O-N 3.17Å
17	Y	91.7	Very high	90.7	Very high	64 Å²	64	76.9 Å²	76.9	25%	0.251	39%	0.392	S	S	.	.	H	α-helix	trans	-64.6	-43.8	179	-171.8	-90.4	0	0	0	112.2	L13 I14 A19 E20 K21 T23 P25	L13-Y17 PolarHBondContact O-N 3.23Å; I14-Y17 PolarHBondContact O-N 3.47Å; Y17-A19 VanDerWaalsContact C-N 3.33Å; Y17-A19 PolarHBondContact O-N 2.68Å; Y17-E20 PolarHBondContact O-N 3.13Å; Y17-K21 HydrophobicContact CE1-CB 4.35Å; Y17-K21 HydrophobicContact CE1-CD 4.24Å; Y17-K21 HydrophobicContact CE2-CD 3.92Å; Y17-K21 PolarHBondContact O-N 2.89Å; Y17-K21 WeakPolarHBondContact OH-CD 3.47Å; Y17-K21 PolarHBondContact OH-NZ 3.18Å; Y17-T23 WeakPolarHBondContact CD1-O 3.43Å; Y17-T23 VanDerWaalsContact CE1-O 3.23Å; Y17-T23 WeakPolarHBondContact CE1-O 3.35Å; Y17-P25 HydrophobicContact CD1-CB 4.04Å; Y17-P25 HydrophobicContact CD1-CG 4.35Å; Y17-P25 HydrophobicContact CE1-CB 3.73Å; Y17-P25 HydrophobicContact CE1-CG 4.41Å; Y17-P25 HydrophobicContact CE2-CB 4.22Å; Y17-P25 HydrophobicContact CG-CB 4.41Å
18	I	91.6	Very high	90.5	Very high	14 Å²	14	77.1 Å²	77.1	7%	0.072	40%	0.402	C	S	.	.	H	α-helix	trans	-62.9	-41.1	176.7	-68.2	167.4	0	0	0	110.5	I14 E15 E20 K21 G22 L31 V33 L36	I14-I18 HydrophobicContact CD1-CD1 4.34Å; I14-I18 HydrophobicContact CD1-CG1 4.38Å; I14-I18 HydrophobicContact CG1-CD1 3.91Å; I14-I18 HydrophobicContact CG1-CG1 4.4Å; I14-I18 WeakPolarHBondContact O-CG1 3.31Å; I14-I18 PolarHBondContact O-N 3.43Å; E15-I18 PolarHBondContact O-N 3.31Å; I18-E20 VanDerWaalsContact C-N 3.26Å; I18-E20 PolarHBondContact O-N 3.03Å; I18-K21 PolarHBondContact O-N 3.42Å; I18-G22 VanDerWaalsContact O-CA 3.3Å; I18-G22 WeakPolarHBondContact O-CA 3.4Å; I18-G22 PolarHBondContact O-N 3.23Å; I18-L31 HydrophobicContact CD1-CD2 3.77Å; I18-L31 HydrophobicContact CD1-CG 4.01Å; I18-L31 HydrophobicContact CG1-CD2 4.21Å; I18-L31 HydrophobicContact CG1-CG 4.5Å; I18-L31 VanDerWaalsContact CG2-O 3.31Å; I18-L31 WeakPolarHBondContact CG2-O 3.46Å; I18-V33 HydrophobicContact CB-CG2 4.43Å; I18-V33 HydrophobicContact CG2-CG2 3.89Å; I18-L36 HydrophobicContact CD1-CD1 3.86Å; I18-L36 HydrophobicContact CD1-CD2 4.24Å; I18-L36 HydrophobicContact CD1-CG 4.21Å
19	A	92.4	Very high	90.5	Very high	88 Å²	88	77.8 Å²	77.8	73%	0.727	40%	0.399	S	S	*	.	H	α-helix	trans	-62.1	-32.7	176.6	0	0	0	0	0	113.1	E15 K16 Y17	E15-A19 WeakPolarHBondContact O-CB 3.46Å; E15-A19 PolarHBondContact O-N 3.01Å; K16-A19 PolarHBondContact O-N 3.21Å; Y17-A19 VanDerWaalsContact C-N 3.33Å; Y17-A19 PolarHBondContact O-N 2.68Å
20	E	92.4	Very high	90.4	Very high	130 Å²	130	83.3 Å²	83.3	61%	0.607	43%	0.425	S	S	*	.	H	α-helix	trans	-83.4	-35.9	179.4	-72.5	177.9	-172.8	0	0	113.6	K16 Y17 I18	K16-E20 WeakPolarHBondContact CE-OE1 3.41Å; K16-E20 IonicContact NZ-OE1 2.93Å; K16-E20 PolarHBondContact O-N 2.65Å; K16-E20 VanDerWaalsContact O-N 3.17Å; Y17-E20 PolarHBondContact O-N 3.13Å; I18-E20 VanDerWaalsContact C-N 3.26Å; I18-E20 PolarHBondContact O-N 3.03Å
21	K	88.3	Confident	90.4	Very high	125 Å²	125	79 Å²	79	54%	0.543	41%	0.405	S	S	.	.	H	α-helix	trans	-129.7	-10.1	-169.3	-65.4	-171.5	-173.3	178	0	116.6	Y17 I18 T23	Y17-K21 HydrophobicContact CE1-CB 4.35Å; Y17-K21 HydrophobicContact CE1-CD 4.24Å; Y17-K21 HydrophobicContact CE2-CD 3.92Å; Y17-K21 PolarHBondContact O-N 2.89Å; Y17-K21 WeakPolarHBondContact OH-CD 3.47Å; Y17-K21 PolarHBondContact OH-NZ 3.18Å; I18-K21 PolarHBondContact O-N 3.42Å; K21-T23 PolarHBondContact O-N 2.99Å; K21-T23 VanDerWaalsContact O-N 3.14Å; K21-T23 PolarHBondContact O-OG1 3.44Å
22	G	89.3	Confident	90.4	Very high	34 Å²	34	74.1 Å²	74.1	35%	0.351	39%	0.394	S	S	.	.	S	Bend	trans	62.7	16	178.5	0	0	0	0	0	116.2	I18 L31	I18-G22 VanDerWaalsContact O-CA 3.3Å; I18-G22 WeakPolarHBondContact O-CA 3.4Å; I18-G22 PolarHBondContact O-N 3.23Å; G22-L31 PolarHBondContact O-N 3.24Å; G22-L31 VanDerWaalsContact O-N 3.08Å
23	T	92.5	Very high	90.4	Very high	35 Å²	35	69.5 Å²	69.5	22%	0.215	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-134.8	159.8	-172.1	45.5	0	0	0	0	112	Y17 K21 E29	Y17-T23 WeakPolarHBondContact CD1-O 3.43Å; Y17-T23 VanDerWaalsContact CE1-O 3.23Å; Y17-T23 WeakPolarHBondContact CE1-O 3.35Å; K21-T23 PolarHBondContact O-N 2.99Å; K21-T23 VanDerWaalsContact O-N 3.14Å; K21-T23 PolarHBondContact O-OG1 3.44Å; T23-E29 CarbonylContact C-O 3.58Å; T23-E29 WeakPolarHBondContact CA-O 3.16Å; T23-E29 WeakPolarHBondContact CB-O 3.06Å
24	D	90.2	Very high	90.3	Very high	1 Å²	1	72.1 Å²	72.1	1%	0.005	40%	0.399	C	S	.	.			trans	-70.2	129.7	171.3	-173	-30.1	0	0	0	110.3	S2 S4 S5 I26 S27 G28 E29 L31	S2-D24 WeakPolarHBondContact CB-OD2 3.46Å; S2-D24 PolarHBondContact OG-OD2 2.91Å; S4-D24 PolarHBondContact OG-OD2 3.29Å; S5-D24 WeakPolarHBondContact CB-OD2 3.4Å; S5-D24 PolarHBondContact N-OD2 2.82Å; S5-D24 VanDerWaalsContact N-OD2 3.15Å; S5-D24 PolarHBondContact OG-OD1 2.96Å; S5-D24 PolarHBondContact OG-OD2 3.38Å; D24-I26 PolarHBondContact O-N 3.28Å; D24-I26 PolarHBondContact OD1-N 3.47Å; D24-S27 VanDerWaalsContact CB-OG 3.29Å; D24-S27 WeakPolarHBondContact CB-OG 3.5Å; D24-S27 PolarHBondContact OD2-OG 2.95Å; D24-G28 WeakPolarHBondContact O-CA 3.23Å; D24-G28 PolarHBondContact O-N 3Å; D24-E29 PolarHBondContact N-O 2.86Å; D24-L31 HydrophobicContact CB-CB 4.36Å; D24-L31 HydrophobicContact CB-CD2 4.06Å
25	P	89.6	Confident	90.1	Very high	50 Å²	50	76.4 Å²	76.4	33%	0.325	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.2	-179.7	25.5	-37	0	0	0	115.2	F9 I14 Y17	F9-P25 HydrophobicContact CE1-CG 3.77Å; F9-P25 HydrophobicContact CE2-CG 4.33Å; F9-P25 HydrophobicContact CZ-CG 3.66Å; I14-P25 HydrophobicContact CD1-CG 3.83Å; Y17-P25 HydrophobicContact CD1-CB 4.04Å; Y17-P25 HydrophobicContact CD1-CG 4.35Å; Y17-P25 HydrophobicContact CE1-CB 3.73Å; Y17-P25 HydrophobicContact CE1-CG 4.41Å; Y17-P25 HydrophobicContact CE2-CB 4.22Å; Y17-P25 HydrophobicContact CG-CB 4.41Å
26	I	91	Very high	89.9	Confident	107 Å²	107	75.1 Å²	75.1	55%	0.549	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-50.7	-177.6	-62.1	175.5	0	0	0	111.5	C7 F9 D24	C7-I26 HydrophobicContact CB-CD1 3.69Å; C7-I26 WeakPolarHBondContact SG-CD1 3.07Å; F9-I26 HydrophobicContact CE1-CD1 3.96Å; F9-I26 HydrophobicContact CE1-CG1 4.38Å; F9-I26 HydrophobicContact CZ-CD1 3.6Å; F9-I26 HydrophobicContact CZ-CG1 4.01Å; D24-I26 PolarHBondContact O-N 3.28Å; D24-I26 PolarHBondContact OD1-N 3.47Å
27	S	87.7	Confident	89.7	Confident	52 Å²	52	73.7 Å²	73.7	36%	0.364	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-22.5	-176.5	64.3	0	0	0	0	113.6	D24 E29	D24-S27 VanDerWaalsContact CB-OG 3.29Å; D24-S27 WeakPolarHBondContact CB-OG 3.5Å; D24-S27 PolarHBondContact OD2-OG 2.95Å; S27-E29 PolarHBondContact O-N 3.09Å
28	G	87.6	Confident	89.5	Confident	50 Å²	50	76.7 Å²	76.7	52%	0.515	43%	0.427	S	S	.	.			trans	73.5	4.9	-175.7	0	0	0	0	0	114.8	D24	D24-G28 WeakPolarHBondContact O-CA 3.23Å; D24-G28 PolarHBondContact O-N 3Å
29	E	89.6	Confident	89.2	Confident	113 Å²	113	79.9 Å²	79.9	53%	0.528	44%	0.443	S	S	.	.			trans	-76	153.8	177	-65.1	177.7	162.3	0	0	111.2	S4 T23 D24 S27 L31	S4-E29 WeakPolarHBondContact CB-OE2 3.44Å; T23-E29 CarbonylContact C-O 3.58Å; T23-E29 WeakPolarHBondContact CA-O 3.16Å; T23-E29 WeakPolarHBondContact CB-O 3.06Å; D24-E29 PolarHBondContact N-O 2.86Å; S27-E29 PolarHBondContact O-N 3.09Å; E29-L31 PolarHBondContact O-N 2.98Å
30	E	89	Confident	88.5	Confident	177 Å²	177	84.2 Å²	84.2	83%	0.827	45%	0.446	S	S	*	.	B	Isolated β-bridge	trans	-61.6	126.8	176	-68	-175.9	173.9	0	0	110.5
31	L	88.2	Confident	87.7	Confident	7 Å²	7	84.3 Å²	84.3	4%	0.037	45%	0.451	C	S	.	.			trans	-137.9	123.8	-175	-177.2	70.1	0	0	0	109.4	S2 P3 I18 G22 D24 E29 Q35 L36	S2-L31 WeakPolarHBondContact OG-CD2 3.28Å; P3-L31 HydrophobicContact CG-CD1 4.29Å; I18-L31 HydrophobicContact CD1-CD2 3.77Å; I18-L31 HydrophobicContact CD1-CG 4.01Å; I18-L31 HydrophobicContact CG1-CD2 4.21Å; I18-L31 HydrophobicContact CG1-CG 4.5Å; I18-L31 VanDerWaalsContact CG2-O 3.31Å; I18-L31 WeakPolarHBondContact CG2-O 3.46Å; G22-L31 PolarHBondContact O-N 3.24Å; G22-L31 VanDerWaalsContact O-N 3.08Å; D24-L31 HydrophobicContact CB-CB 4.36Å; D24-L31 HydrophobicContact CB-CD2 4.06Å; E29-L31 PolarHBondContact O-N 2.98Å; L31-Q35 HydrophobicContact CD1-CB 4.02Å; L31-L36 HydrophobicContact CD2-CD2 4.1Å
32	S	88.9	Confident	87.1	Confident	49 Å²	49	83.4 Å²	83.4	34%	0.343	46%	0.457	S	S	.	.			trans	-100.3	158	172.5	71.2	0	0	0	0	111.7	D34 Q35	S32-D34 PolarHBondContact O-N 2.81Å; S32-Q35 VanDerWaalsContact N-OE1 3.17Å; S32-Q35 WeakPolarHBondContact O-CB 3.26Å; S32-Q35 PolarHBondContact O-N 2.99Å; S32-Q35 VanDerWaalsContact O-N 3.12Å; S32-Q35 WeakPolarHBondContact OG-CG 3.19Å
33	V	89.3	Confident	86.2	Confident	67 Å²	67	87.3 Å²	87.3	41%	0.406	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-59.7	-34.1	-178.9	179.8	0	0	0	0	111.6	E15 I18 Q35 L36	E15-V33 HydrophobicContact CG-CG1 4.27Å; I18-V33 HydrophobicContact CB-CG2 4.43Å; I18-V33 HydrophobicContact CG2-CG2 3.89Å; V33-Q35 PolarHBondContact O-N 2.82Å; V33-L36 HydrophobicContact CG1-CD1 4.5Å; V33-L36 WeakPolarHBondContact O-CB 3.47Å; V33-L36 PolarHBondContact O-N 3.2Å
34	D	89.5	Confident	85.1	Confident	154 Å²	154	92 Å²	92	82%	0.824	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-68	-21.1	-179.3	-57.5	-32	0	0	0	113.4	S32 L36	S32-D34 PolarHBondContact O-N 2.81Å; D34-L36 VanDerWaalsContact C-N 3.29Å
35	Q	87.6	Confident	83.8	Confident	98 Å²	98	99.5 Å²	99.5	46%	0.458	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-82.6	-7.3	178.8	-67.2	170.4	-14	0	0	112.6	P3 L31 S32 V33	P3-Q35 WeakPolarHBondContact CD-O 3.5Å; P3-Q35 HydrophobicContact CG-CB 4.37Å; P3-Q35 WeakPolarHBondContact CG-O 3.43Å; L31-Q35 HydrophobicContact CD1-CB 4.02Å; S32-Q35 VanDerWaalsContact N-OE1 3.17Å; S32-Q35 WeakPolarHBondContact O-CB 3.26Å; S32-Q35 PolarHBondContact O-N 2.99Å; S32-Q35 VanDerWaalsContact O-N 3.12Å; S32-Q35 WeakPolarHBondContact OG-CG 3.19Å; V33-Q35 PolarHBondContact O-N 2.82Å
36	L	89	Confident	82.8	Confident	37 Å²	37	106 Å²	106	19%	0.194	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-74.7	127.6	179.9	-66.3	175.6	0	0	0	111.7	I14 I18 L31 V33 D34	I14-L36 HydrophobicContact CG1-CD1 4.34Å; I14-L36 HydrophobicContact CG1-CD2 4.1Å; I14-L36 HydrophobicContact CG2-CD1 3.95Å; I18-L36 HydrophobicContact CD1-CD1 3.86Å; I18-L36 HydrophobicContact CD1-CD2 4.24Å; I18-L36 HydrophobicContact CD1-CG 4.21Å; L31-L36 HydrophobicContact CD2-CD2 4.1Å; V33-L36 HydrophobicContact CG1-CD1 4.5Å; V33-L36 WeakPolarHBondContact O-CB 3.47Å; V33-L36 PolarHBondContact O-N 3.2Å; D34-L36 VanDerWaalsContact C-N 3.29Å
37	I	88.8	Confident	81.7	Confident	96 Å²	96	106.7 Å²	106.7	49%	0.492	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-87.4	119.1	175.4	-59.7	165.2	0	0	0	109.3	M1	M1-I37 HydrophobicContact CB-CB 4.32Å; M1-I37 PolarHBondContact N-O 3.37Å; M1-I37 PolarHBondContact O-N 3.26Å
38	E	87.1	Confident	80.7	Confident	127 Å²	127	113.7 Å²	113.7	59%	0.593	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-74	124.6	177.1	-171.4	170.8	-140.4	0	0	111.2	R11	R11-E38 IonicContact NH1-OE1 2.95Å; R11-E38 PolarHBondContact NH1-OE1 3.33Å
39	I	84.2	Confident	80	Confident	80 Å²	80	114.7 Å²	114.7	41%	0.41	59%	0.592	S	S	.	*			trans	-98.8	111.6	172.9	-62.4	175.3	0	0	0	107.6	M1 V8 N41	M1-I39 HydrophobicContact CB-CD1 3.86Å; M1-I39 HydrophobicContact CB-CG1 4.26Å; M1-I39 HydrophobicContact CG-CD1 4.44Å; M1-I39 HydrophobicContact SD-CD1 4.28Å; V8-I39 HydrophobicContact CB-CD1 4.46Å; V8-I39 HydrophobicContact CG1-CD1 4.01Å; V8-I39 HydrophobicContact CG2-CD1 3.61Å; I39-N41 PolarHBondContact O-N 2.8Å
40	K	78.9	Confident	79.1	Confident	180 Å²	180	114.7 Å²	114.7	78%	0.783	60%	0.602	S	S	*	*			trans	-79.5	101.1	176.4	-69.6	-176.4	179.4	178.9	0	110.1
41	N	74.7	Confident	78.3	Confident	132 Å²	132	109.9 Å²	109.9	71%	0.706	59%	0.588	S	S	*	*			trans	-105.8	133.3	163.6	-80	-10.4	0	0	0	109.3	I39	I39-N41 PolarHBondContact O-N 2.8Å
42	P	77.3	Confident	77.7	Confident	105 Å²	105	110.3 Å²	110.3	68%	0.682	59%	0.592	S	S	*	*			trans	-61.1	135.4	172.7	26	-32.3	0	0	0	109	V44	P42-V44 PolarHBondContact O-N 2.9Å
43	P	69.2	Low	77.2	Confident	117 Å²	117	113.7 Å²	113.7	76%	0.76	61%	0.611	S	S	*	*			trans	-66.4	102.5	-179.5	26.7	-32.9	0	0	0	109.1	M45	P43-M45 PolarHBondContact O-N 3.4Å
44	V	70.2	Confident	77.1	Confident	132 Å²	132	113.1 Å²	113.1	80%	0.8	61%	0.61	S	S	*	*			trans	-74.3	84.8	166.5	-176.2	0	0	0	0	106.8	P42 K46	P42-V44 PolarHBondContact O-N 2.9Å; V44-K46 PolarHBondContact O-N 3.21Å; V44-K46 VanDerWaalsContact O-N 3.09Å
45	M	62.8	Low	76.9	Confident	159 Å²	159	112.1 Å²	112.1	78%	0.783	60%	0.604	S	S	*	*			trans	-67.5	106.6	169.4	-71.6	-175.8	65.6	0	0	107.7	P43	P43-M45 PolarHBondContact O-N 3.4Å
46	K	67.9	Low	76.9	Confident	188 Å²	188	112 Å²	112	82%	0.817	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-58.1	126.4	165.7	-70.5	-176.9	179.4	179.3	0	107.4	V44 R48	V44-K46 PolarHBondContact O-N 3.21Å; V44-K46 VanDerWaalsContact O-N 3.09Å; K46-R48 PolarHBondContact O-N 2.85Å
47	P	68.6	Low	76.8	Confident	120 Å²	120	111.4 Å²	111.4	78%	0.779	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58	137.9	179.5	22.8	-31.8	0	0	0	109.3
48	R	66.8	Low	76.8	Confident	199 Å²	199	109.9 Å²	109.9	75%	0.751	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-59.1	131.8	175.8	-68.6	-175.2	-166.4	-135.3	1.4	108	K46	K46-R48 PolarHBondContact O-N 2.85Å
49	P	72	Confident	76.9	Confident	72 Å²	72	108.6 Å²	108.6	47%	0.468	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-59.5	142.5	175.9	25.3	-32.3	0	0	0	108.7	S51 A52	P49-S51 PolarHBondContact O-N 3.27Å; P49-A52 HydrophobicContact CG-CB 4.24Å; P49-A52 WeakPolarHBondContact O-CB 3.15Å; P49-A52 PolarHBondContact O-N 3.06Å
50	P	70.4	Confident	77.2	Confident	113 Å²	113	111 Å²	111	73%	0.734	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-58.9	-18.5	-176.2	20.8	-31.6	0	0	0	113.4	A52 T53	P50-A52 VanDerWaalsContact C-N 3.27Å; P50-A52 PolarHBondContact O-N 2.98Å; P50-T53 VanDerWaalsContact O-CG2 3.32Å; P50-T53 WeakPolarHBondContact O-CG2 3.48Å; P50-T53 PolarHBondContact O-OG1 3.06Å
51	S	72.1	Confident	77.7	Confident	76 Å²	76	105.2 Å²	105.2	53%	0.531	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-67.1	-19.6	171.8	53.1	0	0	0	0	114.3	P49 T53 A57	P49-S51 PolarHBondContact O-N 3.27Å; S51-T53 VanDerWaalsContact C-N 3.33Å; S51-T53 PolarHBondContact O-N 2.54Å; S51-A57 WeakPolarHBondContact O-CB 3.41Å
52	A	75.9	Confident	78.5	Confident	15 Å²	15	103.1 Å²	103.1	12%	0.124	57%	0.573	C	S	.	*	G	3₁₀ helix	trans	-93.7	32.7	-176.3	0	0	0	0	0	113.7	P49 P50 I61	P49-A52 HydrophobicContact CG-CB 4.24Å; P49-A52 WeakPolarHBondContact O-CB 3.15Å; P49-A52 PolarHBondContact O-N 3.06Å; P50-A52 VanDerWaalsContact C-N 3.27Å; P50-A52 PolarHBondContact O-N 2.98Å; A52-I61 HydrophobicContact CB-CD1 3.69Å
53	T	78.2	Confident	79.3	Confident	121 Å²	121	104.1 Å²	104.1	74%	0.742	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-100	-16.5	-173.2	48.4	0	0	0	0	114.4	P50 S51	P50-T53 VanDerWaalsContact O-CG2 3.32Å; P50-T53 WeakPolarHBondContact O-CG2 3.48Å; P50-T53 PolarHBondContact O-OG1 3.06Å; S51-T53 VanDerWaalsContact C-N 3.33Å; S51-T53 PolarHBondContact O-N 2.54Å
54	S	87.6	Confident	80.4	Confident	55 Å²	55	102.7 Å²	102.7	39%	0.385	56%	0.555	S	S	.	*	S	Bend	trans	-109.8	149.3	177	71.9	0	0	0	0	111.9	A57 I58	S54-A57 PolarHBondContact O-N 3.32Å; S54-A57 VanDerWaalsContact O-N 3.12Å; S54-A57 VanDerWaalsContact OG-CB 3.25Å; S54-A57 WeakPolarHBondContact OG-CB 3.47Å; S54-A57 PolarHBondContact OG-N 3Å; S54-I58 WeakPolarHBondContact O-CG1 3.34Å; S54-I58 PolarHBondContact O-N 3.34Å
55	I	85.2	Confident	81.6	Confident	133 Å²	133	102.7 Å²	102.7	68%	0.682	55%	0.546	S	S	*	.	H	α-helix	trans	-55.6	-45.8	177.7	-62.7	171.1	0	0	0	111.7	A57 I58 L59	I55-A57 VanDerWaalsContact C-N 3.31Å; I55-A57 PolarHBondContact O-N 2.59Å; I55-I58 PolarHBondContact O-N 3.1Å; I55-L59 HydrophobicContact CG2-CD1 4.28Å; I55-L59 WeakPolarHBondContact O-CG 3.4Å; I55-L59 PolarHBondContact O-N 3.35Å
56	P	88.6	Confident	83.2	Confident	96 Å²	96	102.6 Å²	102.6	62%	0.623	54%	0.537	S	S	*	.	H	α-helix	trans	-61.1	-37.7	176.5	-24.4	35.8	0	0	0	113.2	L59 K60	P56-L59 PolarHBondContact O-N 2.8Å; P56-K60 PolarHBondContact O-N 3.27Å
57	A	87.4	Confident	84.5	Confident	24 Å²	24	98.5 Å²	98.5	20%	0.198	52%	0.524	C	S	.	.	H	α-helix	trans	-70.5	-36.6	178.5	0	0	0	0	0	112.5	S51 S54 I55 K60 I61	S51-A57 WeakPolarHBondContact O-CB 3.41Å; S54-A57 PolarHBondContact O-N 3.32Å; S54-A57 VanDerWaalsContact O-N 3.12Å; S54-A57 VanDerWaalsContact OG-CB 3.25Å; S54-A57 WeakPolarHBondContact OG-CB 3.47Å; S54-A57 PolarHBondContact OG-N 3Å; I55-A57 VanDerWaalsContact C-N 3.31Å; I55-A57 PolarHBondContact O-N 2.59Å; A57-K60 PolarHBondContact O-N 3.37Å; A57-I61 VanDerWaalsContact O-CG1 3.29Å; A57-I61 WeakPolarHBondContact O-CG1 3.5Å; A57-I61 PolarHBondContact O-N 2.98Å
58	I	87.9	Confident	85.9	Confident	64 Å²	64	95.5 Å²	95.5	33%	0.328	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-43.5	173.9	-67	166.3	0	0	0	110.7	S54 I55 K60 I61 L62	S54-I58 WeakPolarHBondContact O-CG1 3.34Å; S54-I58 PolarHBondContact O-N 3.34Å; I55-I58 PolarHBondContact O-N 3.1Å; I58-K60 VanDerWaalsContact C-N 3.32Å; I58-K60 PolarHBondContact O-N 3.1Å; I58-I61 PolarHBondContact O-N 3.3Å; I58-L62 HydrophobicContact CG2-CD1 4.16Å; I58-L62 WeakPolarHBondContact O-CG 3.41Å; I58-L62 PolarHBondContact O-N 2.66Å
59	L	90	Very high	87.3	Confident	99 Å²	99	89.1 Å²	89.1	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-41	177	-71.6	175.2	0	0	0	111.8	I55 P56 L62 Q63	I55-L59 HydrophobicContact CG2-CD1 4.28Å; I55-L59 WeakPolarHBondContact O-CG 3.4Å; I55-L59 PolarHBondContact O-N 3.35Å; P56-L59 PolarHBondContact O-N 2.8Å; L59-L62 PolarHBondContact O-N 3.45Å; L59-Q63 WeakPolarHBondContact O-CG 3.38Å; L59-Q63 PolarHBondContact O-N 3.37Å
60	K	90	Very high	88.4	Confident	130 Å²	130	91 Å²	91	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-47.3	175.5	-173.6	176.1	179	-179.9	0	112	P56 A57 I58 L62 Q63 D64	P56-K60 PolarHBondContact O-N 3.27Å; A57-K60 PolarHBondContact O-N 3.37Å; I58-K60 VanDerWaalsContact C-N 3.32Å; I58-K60 PolarHBondContact O-N 3.1Å; K60-L62 VanDerWaalsContact C-N 3.29Å; K60-L62 PolarHBondContact O-N 3.16Å; K60-Q63 WeakPolarHBondContact O-CB 3.48Å; K60-Q63 PolarHBondContact O-N 3.02Å; K60-Q63 VanDerWaalsContact O-N 3.13Å; K60-D64 VanDerWaalsContact O-CG 3.25Å; K60-D64 PolarHBondContact O-N 2.98Å
61	I	89.9	Confident	89.6	Confident	59 Å²	59	91.7 Å²	91.7	30%	0.303	49%	0.494	S	S	.	.	H	α-helix	trans	-60.1	-41.4	177.1	-68.3	164.3	0	0	0	111	A52 A57 I58 Q63 D64 E65	A52-I61 HydrophobicContact CB-CD1 3.69Å; A57-I61 VanDerWaalsContact O-CG1 3.29Å; A57-I61 WeakPolarHBondContact O-CG1 3.5Å; A57-I61 PolarHBondContact O-N 2.98Å; I58-I61 PolarHBondContact O-N 3.3Å; I61-Q63 VanDerWaalsContact C-N 3.34Å; I61-Q63 PolarHBondContact O-N 3.03Å; I61-D64 PolarHBondContact O-N 3.35Å; I61-E65 HydrophobicContact CG2-CG 4.48Å; I61-E65 WeakPolarHBondContact O-CG 3.19Å; I61-E65 PolarHBondContact O-N 3.33Å
62	L	90.3	Very high	90.8	Very high	89 Å²	89	93.2 Å²	93.2	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-61.9	-42.6	175.8	-73.8	170.8	0	0	0	111.7	I58 L59 K60 E65 W66	I58-L62 HydrophobicContact CG2-CD1 4.16Å; I58-L62 WeakPolarHBondContact O-CG 3.41Å; I58-L62 PolarHBondContact O-N 2.66Å; L59-L62 PolarHBondContact O-N 3.45Å; K60-L62 VanDerWaalsContact C-N 3.29Å; K60-L62 PolarHBondContact O-N 3.16Å; L62-E65 PolarHBondContact O-N 3.34Å; L62-W66 WeakPolarHBondContact O-CB 3.38Å; L62-W66 PolarHBondContact O-N 3.12Å
63	Q	93.5	Very high	91.8	Very high	126 Å²	126	94.8 Å²	94.8	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-60.9	-47.3	174.8	-74.2	177.1	-20.8	0	0	111.4	L59 K60 I61 E65 W66 D67	L59-Q63 WeakPolarHBondContact O-CG 3.38Å; L59-Q63 PolarHBondContact O-N 3.37Å; K60-Q63 WeakPolarHBondContact O-CB 3.48Å; K60-Q63 PolarHBondContact O-N 3.02Å; K60-Q63 VanDerWaalsContact O-N 3.13Å; I61-Q63 VanDerWaalsContact C-N 3.34Å; I61-Q63 PolarHBondContact O-N 3.03Å; Q63-E65 VanDerWaalsContact C-N 3.33Å; Q63-E65 PolarHBondContact O-N 3.45Å; Q63-W66 PolarHBondContact O-N 3.24Å; Q63-W66 VanDerWaalsContact O-N 3.12Å; Q63-D67 WeakPolarHBondContact O-CB 3.33Å; Q63-D67 PolarHBondContact O-N 2.74Å
64	D	93.5	Very high	92.7	Very high	87 Å²	87	95.1 Å²	95.1	47%	0.465	50%	0.497	S	S	.	.	H	α-helix	trans	-59.5	-41.7	180	-64.1	-25.9	0	0	0	111.8	K60 I61 A68	K60-D64 VanDerWaalsContact O-CG 3.25Å; K60-D64 PolarHBondContact O-N 2.98Å; I61-D64 PolarHBondContact O-N 3.35Å; D64-A68 WeakPolarHBondContact O-CB 3.39Å; D64-A68 PolarHBondContact O-N 2.93Å
65	E	94.3	Very high	93.1	Very high	131 Å²	131	94.4 Å²	94.4	61%	0.612	49%	0.494	S	S	*	.	H	α-helix	trans	-67.7	-39.1	175.6	-69	-68.9	155	0	0	112.4	I61 L62 Q63 C69	I61-E65 HydrophobicContact CG2-CG 4.48Å; I61-E65 WeakPolarHBondContact O-CG 3.19Å; I61-E65 PolarHBondContact O-N 3.33Å; L62-E65 PolarHBondContact O-N 3.34Å; Q63-E65 VanDerWaalsContact C-N 3.33Å; Q63-E65 PolarHBondContact O-N 3.45Å; E65-C69 WeakPolarHBondContact O-CB 3.32Å; E65-C69 PolarHBondContact O-N 2.77Å
66	W	96.5	Very high	93.6	Very high	158 Å²	158	91.7 Å²	91.7	60%	0.598	48%	0.484	S	S	*	.	H	α-helix	trans	-66.6	-42.7	176.2	-88.6	109.6	0	0	0	111.9	L62 Q63 C69 M70	L62-W66 WeakPolarHBondContact O-CB 3.38Å; L62-W66 PolarHBondContact O-N 3.12Å; Q63-W66 PolarHBondContact O-N 3.24Å; Q63-W66 VanDerWaalsContact O-N 3.12Å; W66-C69 PolarHBondContact O-N 2.94Å; W66-M70 HydrophobicContact CE3-CE 4.01Å; W66-M70 HydrophobicContact CZ3-CE 3.98Å; W66-M70 WeakPolarHBondContact O-CB 3.48Å; W66-M70 VanDerWaalsContact O-CG 3.32Å; W66-M70 WeakPolarHBondContact O-CG 3.45Å; W66-M70 PolarHBondContact O-N 3.18Å
67	D	96.6	Very high	94	Very high	101 Å²	101	95.6 Å²	95.6	54%	0.54	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-44.3	177	-72.9	-13.8	0	0	0	110.5	Q63 C69 M70 M71	Q63-D67 WeakPolarHBondContact O-CB 3.33Å; Q63-D67 PolarHBondContact O-N 2.74Å; D67-C69 PolarHBondContact O-N 2.77Å; D67-M70 PolarHBondContact O-N 3.27Å; D67-M71 WeakPolarHBondContact O-CB 3.5Å; D67-M71 VanDerWaalsContact O-CG 3.3Å; D67-M71 WeakPolarHBondContact O-CG 3.23Å; D67-M71 PolarHBondContact O-N 3.02Å
68	A	96.3	Very high	94.4	Very high	57 Å²	57	99.7 Å²	99.7	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-44.1	174.5	0	0	0	0	0	112.2	D64 M71 N72	D64-A68 WeakPolarHBondContact O-CB 3.39Å; D64-A68 PolarHBondContact O-N 2.93Å; A68-M71 PolarHBondContact O-N 2.85Å; A68-N72 WeakPolarHBondContact O-CB 3.38Å; A68-N72 PolarHBondContact O-N 3.44Å
69	C	96.5	Very high	94.8	Very high	65 Å²	65	102.9 Å²	102.9	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-41.4	178	-173.9	0	0	0	0	112.3	E65 W66 D67 S73	E65-C69 WeakPolarHBondContact O-CB 3.32Å; E65-C69 PolarHBondContact O-N 2.77Å; W66-C69 PolarHBondContact O-N 2.94Å; D67-C69 PolarHBondContact O-N 2.77Å; C69-S73 VanDerWaalsContact O-CB 3.29Å; C69-S73 WeakPolarHBondContact O-CB 3.37Å; C69-S73 PolarHBondContact O-N 3.26Å; C69-S73 PolarHBondContact O-OG 2.94Å
70	M	95.2	Very high	95.1	Very high	111 Å²	111	102.7 Å²	102.7	55%	0.547	51%	0.514	S	S	.	.	H	α-helix	trans	-67.2	-44.1	177.8	-74.1	-63.5	175.7	0	0	111.7	W66 D67 S73 F74	W66-M70 HydrophobicContact CE3-CE 4.01Å; W66-M70 HydrophobicContact CZ3-CE 3.98Å; W66-M70 WeakPolarHBondContact O-CB 3.48Å; W66-M70 VanDerWaalsContact O-CG 3.32Å; W66-M70 WeakPolarHBondContact O-CG 3.45Å; W66-M70 PolarHBondContact O-N 3.18Å; D67-M70 PolarHBondContact O-N 3.27Å; M70-S73 PolarHBondContact O-N 3.33Å; M70-F74 WeakPolarHBondContact O-CB 3.48Å; M70-F74 PolarHBondContact O-N 3.31Å
71	M	96.3	Very high	95.4	Very high	129 Å²	129	101.7 Å²	101.7	64%	0.635	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-43.2	176.7	-72.8	-58	-63.4	0	0	111.9	D67 A68 F74 A75	D67-M71 WeakPolarHBondContact O-CB 3.5Å; D67-M71 VanDerWaalsContact O-CG 3.3Å; D67-M71 WeakPolarHBondContact O-CG 3.23Å; D67-M71 PolarHBondContact O-N 3.02Å; A68-M71 PolarHBondContact O-N 2.85Å; M71-F74 PolarHBondContact O-N 2.86Å; M71-A75 PolarHBondContact O-N 2.88Å
72	N	97.3	Very high	95.7	Very high	107 Å²	107	102.1 Å²	102.1	57%	0.572	52%	0.52	S	S	*	.	H	α-helix	trans	-64.3	-43.9	175.5	-171	31	0	0	0	111.5	A68 F74 A75 V76	A68-N72 WeakPolarHBondContact O-CB 3.38Å; A68-N72 PolarHBondContact O-N 3.44Å; N72-F74 VanDerWaalsContact C-N 3.28Å; N72-F74 PolarHBondContact O-N 2.96Å; N72-A75 PolarHBondContact O-N 2.75Å; N72-V76 WeakPolarHBondContact O-CG2 3.42Å; N72-V76 PolarHBondContact O-N 3.07Å
73	S	96.9	Very high	95.9	Very high	48 Å²	48	101.6 Å²	101.6	34%	0.336	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-37.3	177.1	-64.4	0	0	0	0	112.4	C69 M70 R77	C69-S73 VanDerWaalsContact O-CB 3.29Å; C69-S73 WeakPolarHBondContact O-CB 3.37Å; C69-S73 PolarHBondContact O-N 3.26Å; C69-S73 PolarHBondContact O-OG 2.94Å; M70-S73 PolarHBondContact O-N 3.33Å; S73-R77 WeakPolarHBondContact O-CB 3.47Å; S73-R77 VanDerWaalsContact O-CG 3.24Å; S73-R77 WeakPolarHBondContact O-CG 3.49Å; S73-R77 PolarHBondContact O-N 2.86Å; S73-R77 VanDerWaalsContact O-N 3.12Å
74	F	96.4	Very high	96	Very high	129 Å²	129	103.8 Å²	103.8	57%	0.566	52%	0.523	S	S	*	.	H	α-helix	trans	-66.8	-48.3	175.2	178.3	-96.5	0	0	0	111.6	M70 M71 N72 V76 R77 Q78	M70-F74 WeakPolarHBondContact O-CB 3.48Å; M70-F74 PolarHBondContact O-N 3.31Å; M71-F74 PolarHBondContact O-N 2.86Å; N72-F74 VanDerWaalsContact C-N 3.28Å; N72-F74 PolarHBondContact O-N 2.96Å; F74-V76 PolarHBondContact O-N 3.46Å; F74-R77 PolarHBondContact O-N 2.96Å; F74-Q78 PolarHBondContact O-N 3.43Å
75	A	96.8	Very high	96.1	Very high	39 Å²	39	105.1 Å²	105.1	32%	0.322	53%	0.529	S	S	.	.	H	α-helix	trans	-58.8	-47.8	178.6	0	0	0	0	0	111.8	M71 N72 R77 Q78 E79	M71-A75 PolarHBondContact O-N 2.88Å; N72-A75 PolarHBondContact O-N 2.75Å; A75-R77 VanDerWaalsContact C-N 3.32Å; A75-R77 PolarHBondContact O-N 2.92Å; A75-Q78 WeakPolarHBondContact O-CB 3.4Å; A75-Q78 PolarHBondContact O-N 2.9Å; A75-Q78 VanDerWaalsContact O-N 3.12Å; A75-E79 PolarHBondContact O-N 2.89Å
76	V	96.4	Very high	96.1	Very high	77 Å²	77	104.3 Å²	104.3	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-39.8	177.4	172.6	0	0	0	0	111.7	N72 F74 L80	N72-V76 WeakPolarHBondContact O-CG2 3.42Å; N72-V76 PolarHBondContact O-N 3.07Å; F74-V76 PolarHBondContact O-N 3.46Å; V76-L80 WeakPolarHBondContact O-CB 3.39Å; V76-L80 PolarHBondContact O-N 2.8Å
77	R	96.3	Very high	96.1	Very high	178 Å²	178	101.6 Å²	101.6	67%	0.672	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-39.5	175.5	-77.3	175.5	-177.4	173.9	3.2	111.9	S73 F74 A75 L80 L81	S73-R77 WeakPolarHBondContact O-CB 3.47Å; S73-R77 VanDerWaalsContact O-CG 3.24Å; S73-R77 WeakPolarHBondContact O-CG 3.49Å; S73-R77 PolarHBondContact O-N 2.86Å; S73-R77 VanDerWaalsContact O-N 3.12Å; F74-R77 PolarHBondContact O-N 2.96Å; A75-R77 VanDerWaalsContact C-N 3.32Å; A75-R77 PolarHBondContact O-N 2.92Å; R77-L80 PolarHBondContact O-N 3.46Å; R77-L81 WeakPolarHBondContact O-CG 3.48Å; R77-L81 PolarHBondContact O-N 3.14Å
78	Q	95.8	Very high	95.8	Very high	109 Å²	109	99.2 Å²	99.2	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-65	-46.4	177.5	-173.8	172.8	9.4	0	0	111.1	F74 A75 L80 L81 T82	F74-Q78 PolarHBondContact O-N 3.43Å; A75-Q78 WeakPolarHBondContact O-CB 3.4Å; A75-Q78 PolarHBondContact O-N 2.9Å; A75-Q78 VanDerWaalsContact O-N 3.12Å; Q78-L80 VanDerWaalsContact C-N 3.33Å; Q78-L80 PolarHBondContact O-N 3.36Å; Q78-L81 PolarHBondContact O-N 2.82Å; Q78-T82 PolarHBondContact O-N 2.87Å; Q78-T82 PolarHBondContact O-OG1 3.17Å
79	E	96.8	Very high	95.7	Very high	131 Å²	131	104.2 Å²	104.2	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-59.9	-42.1	174.6	-72.5	-178.9	176	0	0	112.1	A75 L81 T82 T83	A75-E79 PolarHBondContact O-N 2.89Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 2.95Å; E79-T82 PolarHBondContact O-N 2.67Å; E79-T83 WeakPolarHBondContact O-CB 3.4Å; E79-T83 VanDerWaalsContact O-CG2 3.31Å; E79-T83 WeakPolarHBondContact O-CG2 3.35Å; E79-T83 PolarHBondContact O-N 2.92Å; E79-T83 PolarHBondContact O-OG1 2.81Å
80	L	96.5	Very high	95.5	Very high	95 Å²	95	103.8 Å²	103.8	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-41.1	175.3	-176.9	153.8	0	0	0	112	V76 R77 Q78 T83 R84	V76-L80 WeakPolarHBondContact O-CB 3.39Å; V76-L80 PolarHBondContact O-N 2.8Å; R77-L80 PolarHBondContact O-N 3.46Å; Q78-L80 VanDerWaalsContact C-N 3.33Å; Q78-L80 PolarHBondContact O-N 3.36Å; L80-T83 WeakPolarHBondContact CA-OG1 3.45Å; L80-T83 PolarHBondContact O-OG1 3.29Å; L80-R84 VanDerWaalsContact O-CB 3.28Å; L80-R84 WeakPolarHBondContact O-CB 3.45Å; L80-R84 PolarHBondContact O-N 3.11Å
81	L	95.1	Very high	95.5	Very high	109 Å²	109	103.7 Å²	103.7	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-69.3	-43.2	177.9	-70.7	174.8	0	0	0	112	R77 Q78 E79 R84 L85	R77-L81 WeakPolarHBondContact O-CG 3.48Å; R77-L81 PolarHBondContact O-N 3.14Å; Q78-L81 PolarHBondContact O-N 2.82Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 2.95Å; L81-R84 PolarHBondContact O-N 2.96Å; L81-L85 PolarHBondContact O-N 3.18Å
82	T	96.5	Very high	95.3	Very high	69 Å²	69	106.3 Å²	106.3	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-48.9	177.3	-60.6	0	0	0	0	110.9	Q78 E79 R84 L85 E86	Q78-T82 PolarHBondContact O-N 2.87Å; Q78-T82 PolarHBondContact O-OG1 3.17Å; E79-T82 PolarHBondContact O-N 2.67Å; T82-R84 VanDerWaalsContact C-N 3.32Å; T82-R84 PolarHBondContact O-N 3.08Å; T82-L85 WeakPolarHBondContact O-CB 3.33Å; T82-L85 PolarHBondContact O-N 3.16Å; T82-L85 VanDerWaalsContact O-N 3.08Å; T82-E86 WeakPolarHBondContact O-CG 3.18Å; T82-E86 PolarHBondContact O-N 3.18Å
83	T	94.8	Very high	95.1	Very high	78 Å²	78	106.4 Å²	106.4	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-37.2	177.7	51.4	0	0	0	0	112.5	E79 L80 L85 E86 L87	E79-T83 WeakPolarHBondContact O-CB 3.4Å; E79-T83 VanDerWaalsContact O-CG2 3.31Å; E79-T83 WeakPolarHBondContact O-CG2 3.35Å; E79-T83 PolarHBondContact O-N 2.92Å; E79-T83 PolarHBondContact O-OG1 2.81Å; L80-T83 WeakPolarHBondContact CA-OG1 3.45Å; L80-T83 PolarHBondContact O-OG1 3.29Å; T83-L85 VanDerWaalsContact C-N 3.34Å; T83-E86 PolarHBondContact O-N 3.5Å; T83-L87 WeakPolarHBondContact O-CB 3.21Å; T83-L87 PolarHBondContact O-N 3.28Å
84	R	96	Very high	95.1	Very high	172 Å²	172	110 Å²	110	65%	0.649	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-39.7	172.8	177.7	178.9	-96	-177.3	-6	111.9	L80 L81 T82 L87 S88	L80-R84 VanDerWaalsContact O-CB 3.28Å; L80-R84 WeakPolarHBondContact O-CB 3.45Å; L80-R84 PolarHBondContact O-N 3.11Å; L81-R84 PolarHBondContact O-N 2.96Å; T82-R84 VanDerWaalsContact C-N 3.32Å; T82-R84 PolarHBondContact O-N 3.08Å; R84-L87 PolarHBondContact O-N 3.04Å; R84-S88 PolarHBondContact O-N 3.35Å
85	L	94	Very high	95	Very high	114 Å²	114	107.4 Å²	107.4	60%	0.597	52%	0.523	S	S	*	.	H	α-helix	trans	-67.1	-43.8	177.2	-171	146.8	0	0	0	110.8	L81 T82 T83 L87 S88 R89	L81-L85 PolarHBondContact O-N 3.18Å; T82-L85 WeakPolarHBondContact O-CB 3.33Å; T82-L85 PolarHBondContact O-N 3.16Å; T82-L85 VanDerWaalsContact O-N 3.08Å; T83-L85 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 2.5Å; L85-S88 PolarHBondContact O-N 3.19Å; L85-S88 PolarHBondContact O-OG 3.04Å; L85-R89 PolarHBondContact O-N 3.32Å
86	E	95.7	Very high	94.8	Very high	115 Å²	115	108 Å²	108	54%	0.537	53%	0.529	S	S	.	.	H	α-helix	trans	-60.2	-44.1	174	-71.3	174.5	179.2	0	0	112.2	T82 T83 S88 R89 S90	T82-E86 WeakPolarHBondContact O-CG 3.18Å; T82-E86 PolarHBondContact O-N 3.18Å; T83-E86 PolarHBondContact O-N 3.5Å; E86-S88 VanDerWaalsContact C-N 3.34Å; E86-S88 PolarHBondContact O-N 3.43Å; E86-R89 PolarHBondContact O-N 3.37Å; E86-S90 PolarHBondContact O-N 3Å; E86-S90 PolarHBondContact O-OG 3.35Å
87	L	95	Very high	94.6	Very high	100 Å²	100	106.8 Å²	106.8	52%	0.524	53%	0.526	S	S	.	.	H	α-helix	trans	-60.3	-42.7	173.9	179.9	64.9	0	0	0	111.7	T83 R84 L85 R89 S90 L91	T83-L87 WeakPolarHBondContact O-CB 3.21Å; T83-L87 PolarHBondContact O-N 3.28Å; R84-L87 PolarHBondContact O-N 3.04Å; L85-L87 PolarHBondContact O-N 2.5Å; L87-R89 VanDerWaalsContact C-N 3.33Å; L87-R89 PolarHBondContact O-N 3.13Å; L87-S90 WeakPolarHBondContact CA-OG 3.24Å; L87-S90 PolarHBondContact O-N 3.47Å; L87-S90 PolarHBondContact O-OG 2.83Å; L87-L91 HydrophobicContact CD1-CD1 4.34Å; L87-L91 HydrophobicContact CD1-CG 4.31Å; L87-L91 HydrophobicContact CG-CD1 4.14Å; L87-L91 WeakPolarHBondContact O-CB 3.38Å; L87-L91 VanDerWaalsContact O-CG 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.44Å; L87-L91 PolarHBondContact O-N 3.12Å
88	S	90.8	Very high	94.4	Very high	51 Å²	51	101 Å²	101	36%	0.357	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-43.4	177.1	74.1	0	0	0	0	111.2	R84 L85 E86 S90 L91 Y92	R84-S88 PolarHBondContact O-N 3.35Å; L85-S88 PolarHBondContact O-N 3.19Å; L85-S88 PolarHBondContact O-OG 3.04Å; E86-S88 VanDerWaalsContact C-N 3.34Å; E86-S88 PolarHBondContact O-N 3.43Å; S88-S90 PolarHBondContact O-N 2.99Å; S88-L91 PolarHBondContact O-N 2.9Å; S88-Y92 WeakPolarHBondContact O-CD2 3.34Å; S88-Y92 PolarHBondContact O-N 3.33Å
89	R	94.8	Very high	94.2	Very high	162 Å²	162	103.1 Å²	103.1	61%	0.611	52%	0.516	S	S	*	.	H	α-helix	trans	-62.4	-43.4	176.9	-178.3	-179.1	175.5	175.9	1.9	111.6	L85 E86 L87 Y92 Q93	L85-R89 PolarHBondContact O-N 3.32Å; E86-R89 PolarHBondContact O-N 3.37Å; L87-R89 VanDerWaalsContact C-N 3.33Å; L87-R89 PolarHBondContact O-N 3.13Å; R89-Y92 PolarHBondContact O-N 3.49Å; R89-Q93 WeakPolarHBondContact O-CG 3.39Å; R89-Q93 PolarHBondContact O-N 2.98Å
90	S	93.1	Very high	94.1	Very high	57 Å²	57	100.6 Å²	100.6	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-67.7	-37.6	179.9	68.8	0	0	0	0	112.1	E86 L87 S88 Q93 H94	E86-S90 PolarHBondContact O-N 3Å; E86-S90 PolarHBondContact O-OG 3.35Å; L87-S90 WeakPolarHBondContact CA-OG 3.24Å; L87-S90 PolarHBondContact O-N 3.47Å; L87-S90 PolarHBondContact O-OG 2.83Å; S88-S90 PolarHBondContact O-N 2.99Å; S90-Q93 PolarHBondContact O-N 3.39Å; S90-H94 VanDerWaalsContact O-CB 3.32Å; S90-H94 WeakPolarHBondContact O-CB 3.41Å; S90-H94 PolarHBondContact O-N 3.36Å
91	L	93.4	Very high	94	Very high	108 Å²	108	100.4 Å²	100.4	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-64	-41.8	174.1	-71.7	172.8	0	0	0	112.2	L87 S88 H94 D95	L87-L91 HydrophobicContact CD1-CD1 4.34Å; L87-L91 HydrophobicContact CD1-CG 4.31Å; L87-L91 HydrophobicContact CG-CD1 4.14Å; L87-L91 WeakPolarHBondContact O-CB 3.38Å; L87-L91 VanDerWaalsContact O-CG 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.44Å; L87-L91 PolarHBondContact O-N 3.12Å; S88-L91 PolarHBondContact O-N 2.9Å; L91-H94 PolarHBondContact O-N 2.96Å; L91-D95 PolarHBondContact O-N 3.35Å
92	Y	92.5	Very high	93.8	Very high	184 Å²	184	98 Å²	98	72%	0.722	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-42.1	174.3	-77.7	-62	0	0	0	112.4	S88 R89 H94 D95 A96	S88-Y92 WeakPolarHBondContact O-CD2 3.34Å; S88-Y92 PolarHBondContact O-N 3.33Å; R89-Y92 PolarHBondContact O-N 3.49Å; Y92-H94 VanDerWaalsContact C-N 3.33Å; Y92-D95 PolarHBondContact O-N 3.47Å; Y92-A96 PolarHBondContact O-N 3.03Å
93	Q	93.6	Very high	93.7	Very high	110 Å²	110	102.3 Å²	102.3	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-65	-37.3	175.4	-73.7	179.8	-17	0	0	112.2	R89 S90 A96 A97	R89-Q93 WeakPolarHBondContact O-CG 3.39Å; R89-Q93 PolarHBondContact O-N 2.98Å; S90-Q93 PolarHBondContact O-N 3.39Å; Q93-A96 PolarHBondContact O-N 3.28Å; Q93-A97 WeakPolarHBondContact O-CB 3.47Å; Q93-A97 PolarHBondContact O-N 3.42Å
94	H	96.2	Very high	93.7	Very high	123 Å²	123	102.8 Å²	102.8	57%	0.569	51%	0.511	S	S	*	.	H	α-helix	trans	-63.6	-46.4	175.5	-178.8	-80.2	0	0	0	111.5	S90 L91 Y92 A96 A97 C98	S90-H94 VanDerWaalsContact O-CB 3.32Å; S90-H94 WeakPolarHBondContact O-CB 3.41Å; S90-H94 PolarHBondContact O-N 3.36Å; L91-H94 PolarHBondContact O-N 2.96Å; Y92-H94 VanDerWaalsContact C-N 3.33Å; H94-A96 VanDerWaalsContact C-N 3.34Å; H94-A96 PolarHBondContact O-N 2.96Å; H94-A97 PolarHBondContact O-N 3.35Å; H94-C98 PolarHBondContact CE1-SG 3.46Å; H94-C98 PolarHBondContact O-N 3.46Å; H94-C98 PolarHBondContact O-SG 2.98Å; H94-C98 VanDerWaalsContact O-SG 3.36Å
95	D	95.2	Very high	93.7	Very high	74 Å²	74	100.5 Å²	100.5	40%	0.396	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-43.4	175.6	-171.6	59.4	0	0	0	111.7	L91 Y92 A97 C98 R99	L91-D95 PolarHBondContact O-N 3.35Å; Y92-D95 PolarHBondContact O-N 3.47Å; D95-A97 VanDerWaalsContact C-N 3.35Å; D95-A97 PolarHBondContact O-N 2.87Å; D95-C98 WeakPolarHBondContact O-CB 3.37Å; D95-C98 PolarHBondContact O-N 3.33Å; D95-R99 WeakPolarHBondContact O-CG 3.42Å; D95-R99 PolarHBondContact O-N 2.92Å; D95-R99 VanDerWaalsContact O-N 3.08Å; D95-R99 IonicContact OD2-CZ 3.13Å; D95-R99 IonicContact OD2-NE 3.72Å; D95-R99 PolarHBondContact OD2-NE 2.85Å; D95-R99 VanDerWaalsContact OD2-NE 3.08Å; D95-R99 IonicContact OD2-NH2 2.73Å; D95-R99 PolarHBondContact OD2-NH2 2.77Å
96	A	91.5	Very high	93.7	Very high	52 Å²	52	102.7 Å²	102.7	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-59.9	-43.6	175.3	0	0	0	0	0	112.1	Y92 Q93 H94 R99 V100	Y92-A96 PolarHBondContact O-N 3.03Å; Q93-A96 PolarHBondContact O-N 3.28Å; H94-A96 VanDerWaalsContact C-N 3.34Å; H94-A96 PolarHBondContact O-N 2.96Å; A96-R99 PolarHBondContact O-N 2.97Å; A96-V100 WeakPolarHBondContact O-CG2 3.08Å; A96-V100 PolarHBondContact O-N 2.97Å; A96-V100 VanDerWaalsContact O-N 3.15Å
97	A	92.9	Very high	93.6	Very high	51 Å²	51	102.1 Å²	102.1	42%	0.421	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-40.5	176.2	0	0	0	0	0	112.2	Q93 H94 D95 R99 V100 I101	Q93-A97 WeakPolarHBondContact O-CB 3.47Å; Q93-A97 PolarHBondContact O-N 3.42Å; H94-A97 PolarHBondContact O-N 3.35Å; D95-A97 VanDerWaalsContact C-N 3.35Å; D95-A97 PolarHBondContact O-N 2.87Å; A97-R99 VanDerWaalsContact C-N 3.31Å; A97-R99 PolarHBondContact O-N 2.96Å; A97-V100 PolarHBondContact O-N 2.96Å; A97-I101 WeakPolarHBondContact O-CG1 3.45Å; A97-I101 PolarHBondContact O-N 2.97Å
98	C	92.7	Very high	93.6	Very high	56 Å²	56	100.7 Å²	100.7	38%	0.378	51%	0.505	S	S	.	.	H	α-helix	trans	-59.1	-40.5	174.5	-72.8	0	0	0	0	112.2	H94 D95 I101 A102	H94-C98 PolarHBondContact CE1-SG 3.46Å; H94-C98 PolarHBondContact O-N 3.46Å; H94-C98 PolarHBondContact O-SG 2.98Å; H94-C98 VanDerWaalsContact O-SG 3.36Å; D95-C98 WeakPolarHBondContact O-CB 3.37Å; D95-C98 PolarHBondContact O-N 3.33Å; C98-I101 PolarHBondContact O-N 3.36Å; C98-A102 PolarHBondContact O-N 3.43Å
99	R	92.3	Very high	93.8	Very high	155 Å²	155	101.7 Å²	101.7	59%	0.585	51%	0.509	S	S	*	.	H	α-helix	trans	-65.1	-38.9	175.7	-65.3	178.3	-164.6	-155.3	3.6	112.5	D95 A96 A97 A102 R103	D95-R99 WeakPolarHBondContact O-CG 3.42Å; D95-R99 PolarHBondContact O-N 2.92Å; D95-R99 VanDerWaalsContact O-N 3.08Å; D95-R99 IonicContact OD2-CZ 3.13Å; D95-R99 IonicContact OD2-NE 3.72Å; D95-R99 PolarHBondContact OD2-NE 2.85Å; D95-R99 VanDerWaalsContact OD2-NE 3.08Å; D95-R99 IonicContact OD2-NH2 2.73Å; D95-R99 PolarHBondContact OD2-NH2 2.77Å; A96-R99 PolarHBondContact O-N 2.97Å; A97-R99 VanDerWaalsContact C-N 3.31Å; A97-R99 PolarHBondContact O-N 2.96Å; R99-A102 PolarHBondContact O-N 3.2Å; R99-R103 PolarHBondContact O-N 2.84Å
100	V	94.2	Very high	93.7	Very high	77 Å²	77	96.5 Å²	96.5	47%	0.467	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-44.1	174.9	174.2	0	0	0	0	110.8	A96 A97 A102 R103 L104	A96-V100 WeakPolarHBondContact O-CG2 3.08Å; A96-V100 PolarHBondContact O-N 2.97Å; A96-V100 VanDerWaalsContact O-N 3.15Å; A97-V100 PolarHBondContact O-N 2.96Å; V100-A102 VanDerWaalsContact C-N 3.34Å; V100-A102 PolarHBondContact O-N 2.82Å; V100-R103 PolarHBondContact O-N 2.75Å; V100-L104 HydrophobicContact CG1-CD1 3.85Å; V100-L104 HydrophobicContact CG1-CG 4.29Å; V100-L104 WeakPolarHBondContact O-CB 3.46Å; V100-L104 WeakPolarHBondContact O-CG 3.29Å; V100-L104 PolarHBondContact O-N 3.06Å
101	I	93.3	Very high	93.6	Very high	92 Å²	92	97.1 Å²	97.1	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-44.4	176.6	-66.5	166.9	0	0	0	110.7	A97 C98 R103 L104 Q105	A97-I101 WeakPolarHBondContact O-CG1 3.45Å; A97-I101 PolarHBondContact O-N 2.97Å; C98-I101 PolarHBondContact O-N 3.36Å; I101-R103 VanDerWaalsContact C-N 3.34Å; I101-R103 PolarHBondContact O-N 3.1Å; I101-L104 PolarHBondContact O-N 3.12Å; I101-Q105 HydrophobicContact CG2-CG 4.3Å; I101-Q105 WeakPolarHBondContact O-CB 3.25Å; I101-Q105 VanDerWaalsContact O-CG 3.31Å; I101-Q105 WeakPolarHBondContact O-CG 3.38Å; I101-Q105 PolarHBondContact O-N 2.84Å
102	A	91.7	Very high	93.5	Very high	57 Å²	57	100.5 Å²	100.5	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-40.7	177.8	0	0	0	0	0	112.4	C98 R99 V100 K106	C98-A102 PolarHBondContact O-N 3.43Å; R99-A102 PolarHBondContact O-N 3.2Å; V100-A102 VanDerWaalsContact C-N 3.34Å; V100-A102 PolarHBondContact O-N 2.82Å; A102-K106 PolarHBondContact O-N 2.98Å
103	R	94.8	Very high	93.5	Very high	161 Å²	161	98.1 Å²	98.1	61%	0.608	51%	0.506	S	S	*	.	H	α-helix	trans	-63.1	-50	174.8	-173.9	-176.6	-62.9	167.9	-1.2	111.5	R99 V100 I101 Q105 K106 E107	R99-R103 PolarHBondContact O-N 2.84Å; V100-R103 PolarHBondContact O-N 2.75Å; I101-R103 VanDerWaalsContact C-N 3.34Å; I101-R103 PolarHBondContact O-N 3.1Å; R103-Q105 VanDerWaalsContact C-N 3.32Å; R103-Q105 PolarHBondContact O-N 2.85Å; R103-K106 WeakPolarHBondContact O-CB 3.33Å; R103-K106 PolarHBondContact O-N 3.35Å; R103-K106 VanDerWaalsContact O-N 3.13Å; R103-E107 PolarHBondContact O-N 3.24Å
104	L	94.7	Very high	93.3	Very high	88 Å²	88	95.4 Å²	95.4	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-61.7	-39	178.9	-71.7	173.1	0	0	0	112	V100 I101 K106 E107 V108	V100-L104 HydrophobicContact CG1-CD1 3.85Å; V100-L104 HydrophobicContact CG1-CG 4.29Å; V100-L104 WeakPolarHBondContact O-CB 3.46Å; V100-L104 WeakPolarHBondContact O-CG 3.29Å; V100-L104 PolarHBondContact O-N 3.06Å; I101-L104 PolarHBondContact O-N 3.12Å; L104-K106 VanDerWaalsContact C-N 3.32Å; L104-K106 PolarHBondContact O-N 2.88Å; L104-E107 PolarHBondContact O-N 2.85Å; L104-V108 WeakPolarHBondContact O-CB 3.32Å; L104-V108 WeakPolarHBondContact O-CG2 3.25Å; L104-V108 PolarHBondContact O-N 3.33Å
105	Q	95.1	Very high	92.8	Very high	124 Å²	124	95.3 Å²	95.3	58%	0.579	51%	0.505	S	S	*	.	H	α-helix	trans	-60.1	-43	175	-79.1	177.9	-23.9	0	0	111.5	I101 R103 V108 T109	I101-Q105 HydrophobicContact CG2-CG 4.3Å; I101-Q105 WeakPolarHBondContact O-CB 3.25Å; I101-Q105 VanDerWaalsContact O-CG 3.31Å; I101-Q105 WeakPolarHBondContact O-CG 3.38Å; I101-Q105 PolarHBondContact O-N 2.84Å; R103-Q105 VanDerWaalsContact C-N 3.32Å; R103-Q105 PolarHBondContact O-N 2.85Å; Q105-V108 PolarHBondContact O-N 3.37Å; Q105-T109 WeakPolarHBondContact O-CG2 3.48Å; Q105-T109 PolarHBondContact O-N 2.92Å; Q105-T109 PolarHBondContact O-OG1 2.85Å; Q105-T109 VanDerWaalsContact O-OG1 3.12Å
106	K	93.9	Very high	92.2	Very high	160 Å²	160	95.6 Å²	95.6	70%	0.696	52%	0.518	S	S	*	.	H	α-helix	trans	-65.7	-41.6	177.8	-169.6	178.4	178.6	-177.3	0	112.4	A102 R103 L104 T109 A110	A102-K106 PolarHBondContact O-N 2.98Å; R103-K106 WeakPolarHBondContact O-CB 3.33Å; R103-K106 PolarHBondContact O-N 3.35Å; R103-K106 VanDerWaalsContact O-N 3.13Å; L104-K106 VanDerWaalsContact C-N 3.32Å; L104-K106 PolarHBondContact O-N 2.88Å; K106-T109 WeakPolarHBondContact CA-OG1 3.07Å; K106-T109 PolarHBondContact O-N 2.86Å; K106-T109 PolarHBondContact O-OG1 3.44Å; K106-A110 WeakPolarHBondContact O-CB 3.31Å; K106-A110 PolarHBondContact O-N 2.91Å
107	E	95.1	Very high	91.6	Very high	102 Å²	102	98.6 Å²	98.6	48%	0.477	53%	0.531	S	S	.	.	H	α-helix	trans	-64.8	-42	175.7	-72.6	173	-169.5	0	0	111.8	R103 L104 A110 S111	R103-E107 PolarHBondContact O-N 3.24Å; L104-E107 PolarHBondContact O-N 2.85Å; E107-A110 PolarHBondContact O-N 3.1Å; E107-S111 WeakPolarHBondContact O-CB 3.43Å; E107-S111 PolarHBondContact O-N 2.88Å; E107-S111 PolarHBondContact O-OG 2.85Å
108	V	94.7	Very high	90.4	Very high	71 Å²	71	102.2 Å²	102.2	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-64.5	-41.9	176.4	169.6	0	0	0	0	111.3	L104 Q105 S111 R112	L104-V108 WeakPolarHBondContact O-CB 3.32Å; L104-V108 WeakPolarHBondContact O-CG2 3.25Å; L104-V108 PolarHBondContact O-N 3.33Å; Q105-V108 PolarHBondContact O-N 3.37Å; V108-S111 PolarHBondContact O-N 2.89Å; V108-R112 WeakPolarHBondContact O-CG 3.49Å; V108-R112 PolarHBondContact O-N 2.89Å
109	T	93.7	Very high	88.5	Confident	71 Å²	71	107.9 Å²	107.9	44%	0.436	56%	0.561	S	S	.	*	H	α-helix	trans	-64.7	-45.2	176.3	48.7	0	0	0	0	111.7	Q105 K106 S111 R112 E113	Q105-T109 WeakPolarHBondContact O-CG2 3.48Å; Q105-T109 PolarHBondContact O-N 2.92Å; Q105-T109 PolarHBondContact O-OG1 2.85Å; Q105-T109 VanDerWaalsContact O-OG1 3.12Å; K106-T109 WeakPolarHBondContact CA-OG1 3.07Å; K106-T109 PolarHBondContact O-N 2.86Å; K106-T109 PolarHBondContact O-OG1 3.44Å; T109-S111 VanDerWaalsContact C-N 3.32Å; T109-S111 PolarHBondContact O-N 3.09Å; T109-R112 PolarHBondContact O-N 2.99Å; T109-E113 WeakPolarHBondContact O-CG 3.36Å; T109-E113 PolarHBondContact O-N 2.87Å
110	A	93.1	Very high	86.4	Confident	54 Å²	54	106 Å²	106	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-61.7	-41.1	177.5	0	0	0	0	0	111.9	K106 E107 R112 E113 A114	K106-A110 WeakPolarHBondContact O-CB 3.31Å; K106-A110 PolarHBondContact O-N 2.91Å; E107-A110 PolarHBondContact O-N 3.1Å; A110-R112 PolarHBondContact O-N 3.48Å; A110-E113 PolarHBondContact O-N 3.07Å; A110-A114 WeakPolarHBondContact O-CB 3.49Å; A110-A114 PolarHBondContact O-N 2.95Å
111	S	91.2	Very high	84.1	Confident	69 Å²	69	111.3 Å²	111.3	48%	0.483	59%	0.588	S	S	.	*	H	α-helix	trans	-64.4	-39.7	176.8	-56.6	0	0	0	0	112.2	E107 V108 T109 A114 L115	E107-S111 WeakPolarHBondContact O-CB 3.43Å; E107-S111 PolarHBondContact O-N 2.88Å; E107-S111 PolarHBondContact O-OG 2.85Å; V108-S111 PolarHBondContact O-N 2.89Å; T109-S111 VanDerWaalsContact C-N 3.32Å; T109-S111 PolarHBondContact O-N 3.09Å; S111-A114 PolarHBondContact O-N 3.02Å; S111-L115 WeakPolarHBondContact O-CG 3.31Å; S111-L115 PolarHBondContact O-N 2.98Å
112	R	91.8	Very high	81.3	Confident	179 Å²	179	111.5 Å²	111.5	68%	0.675	60%	0.603	S	S	*	*	H	α-helix	trans	-66.1	-40.5	176.3	-76.5	177.5	178.4	-176.5	0.7	112.1	V108 T109 A110 L115 A116	V108-R112 WeakPolarHBondContact O-CG 3.49Å; V108-R112 PolarHBondContact O-N 2.89Å; T109-R112 PolarHBondContact O-N 2.99Å; A110-R112 PolarHBondContact O-N 3.48Å; R112-L115 PolarHBondContact O-N 2.77Å; R112-A116 WeakPolarHBondContact O-CB 3.23Å; R112-A116 PolarHBondContact O-N 2.66Å
113	E	91.3	Very high	78.5	Confident	135 Å²	135	112.7 Å²	112.7	63%	0.631	61%	0.613	S	S	*	*	H	α-helix	trans	-67.1	-41	176.3	-71.7	175.2	-179.8	0	0	112.1	T109 A110 L115 A116 T117	T109-E113 WeakPolarHBondContact O-CG 3.36Å; T109-E113 PolarHBondContact O-N 2.87Å; A110-E113 PolarHBondContact O-N 3.07Å; E113-L115 VanDerWaalsContact C-N 3.35Å; E113-L115 PolarHBondContact O-N 2.9Å; E113-A116 PolarHBondContact O-N 3.27Å; E113-T117 PolarHBondContact O-N 3.39Å; E113-T117 PolarHBondContact O-OG1 2.92Å
114	A	89.8	Confident	75.6	Confident	52 Å²	52	111.1 Å²	111.1	43%	0.43	62%	0.621	S	S	.	*	H	α-helix	trans	-61.4	-41	173.5	0	0	0	0	0	112.1	A110 S111 T117 L118	A110-A114 WeakPolarHBondContact O-CB 3.49Å; A110-A114 PolarHBondContact O-N 2.95Å; S111-A114 PolarHBondContact O-N 3.02Å; A114-T117 WeakPolarHBondContact CA-OG1 3.33Å; A114-T117 PolarHBondContact O-OG1 3.42Å; A114-L118 WeakPolarHBondContact O-CG 3.34Å; A114-L118 PolarHBondContact O-N 3.09Å
115	L	85.3	Confident	72.6	Confident	122 Å²	122	112.5 Å²	112.5	64%	0.639	64%	0.638	S	S	*	*	H	α-helix	trans	-69.5	-35.9	174.8	-73.6	172.6	0	0	0	112.8	S111 R112 E113 T117 L118	S111-L115 WeakPolarHBondContact O-CG 3.31Å; S111-L115 PolarHBondContact O-N 2.98Å; R112-L115 PolarHBondContact O-N 2.77Å; E113-L115 VanDerWaalsContact C-N 3.35Å; E113-L115 PolarHBondContact O-N 2.9Å; L115-T117 VanDerWaalsContact C-N 3.31Å; L115-T117 PolarHBondContact O-N 3.45Å; L115-L118 HydrophobicContact CD2-CD1 4.44Å; L115-L118 PolarHBondContact O-N 2.76Å
116	A	83.1	Confident	69.5	Low	80 Å²	80	114.8 Å²	114.8	66%	0.661	65%	0.649	S	S	*	*	H	α-helix	trans	-68.9	-30.4	178.3	0	0	0	0	0	112.8	R112 E113	R112-A116 WeakPolarHBondContact O-CB 3.23Å; R112-A116 PolarHBondContact O-N 2.66Å; E113-A116 PolarHBondContact O-N 3.27Å
117	T	78.1	Confident	66.5	Low	115 Å²	115	113.5 Å²	113.5	71%	0.706	66%	0.657	S	S	*	*	H	α-helix	trans	-76.5	-23.9	175.5	42.8	0	0	0	0	112.7	E113 A114 L115 K119	E113-T117 PolarHBondContact O-N 3.39Å; E113-T117 PolarHBondContact O-OG1 2.92Å; A114-T117 WeakPolarHBondContact CA-OG1 3.33Å; A114-T117 PolarHBondContact O-OG1 3.42Å; L115-T117 VanDerWaalsContact C-N 3.31Å; L115-T117 PolarHBondContact O-N 3.45Å; T117-K119 VanDerWaalsContact C-N 3.32Å; T117-K119 PolarHBondContact O-N 2.96Å
118	L	69.2	Low	63.4	Low	126 Å²	126	120.2 Å²	120.2	66%	0.66	68%	0.678	S	S	*	*			trans	-75	81.1	167.9	-68.4	167.8	0	0	0	110.5	A114 L115	A114-L118 WeakPolarHBondContact O-CG 3.34Å; A114-L118 PolarHBondContact O-N 3.09Å; L115-L118 HydrophobicContact CD2-CD1 4.44Å; L115-L118 PolarHBondContact O-N 2.76Å
119	K	53.1	Low	60.3	Low	175 Å²	175	126.1 Å²	126.1	76%	0.761	70%	0.701	S	S	*	*			trans	-57.9	144.9	162.2	-80.7	-175	178.5	177.8	0	109.6	T117 H121	T117-K119 VanDerWaalsContact C-N 3.32Å; T117-K119 PolarHBondContact O-N 2.96Å; K119-H121 PolarHBondContact O-N 2.74Å
120	P	46.9	Very low	57.4	Low	116 Å²	116	127.3 Å²	127.3	75%	0.753	72%	0.717	S	S	*	*			trans	-72.2	97.4	-176.5	30.7	-32.5	0	0	0	109.3	A122	P120-A122 PolarHBondContact O-N 3.47Å; P120-A122 VanDerWaalsContact O-N 3.11Å
121	H	45.2	Very low	54.5	Low	188 Å²	188	130.3 Å²	130.3	87%	0.87	73%	0.733	S	S	*	*			trans	-79.3	66.4	151.1	-87.1	19.9	0	0	0	108.5	K119 A123	K119-H121 PolarHBondContact O-N 2.74Å; H121-A123 PolarHBondContact O-N 3.31Å
122	A	34.9	Very low	51.6	Low	97 Å²	97	137.7 Å²	137.7	80%	0.802	75%	0.752	S	S	*	*			trans	-89.7	69.7	158.3	0	0	0	0	0	107.6	P120	P120-A122 PolarHBondContact O-N 3.47Å; P120-A122 VanDerWaalsContact O-N 3.11Å
123	A	32.9	Very low	48.8	Very low	81 Å²	81	132.9 Å²	132.9	67%	0.669	76%	0.757	S	S	*	*	S	Bend	trans	-147.7	102	165.7	0	0	0	0	0	109.1	H121	H121-A123 PolarHBondContact O-N 3.31Å
124	V	34.8	Very low	45.9	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	76%	0.764	S	S	*	*			trans	67.1	97.5	157	-167.6	0	0	0	0	116.2	Q126	V124-Q126 PolarHBondContact O-N 3.09Å
125	S	30.5	Very low	42.9	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	79%	0.787	S	S	*	*			trans	-55.8	117.2	153.3	51.4	0	0	0	0	110.9
126	Q	31.3	Very low	40.1	Very low	172 Å²	172	138.8 Å²	138.8	80%	0.804	79%	0.792	S	S	*	*			trans	-116.8	131.1	145.5	-79.6	-172.1	-8.3	0	0	107.6	V124 R128	V124-Q126 PolarHBondContact O-N 3.09Å; Q126-R128 PolarHBondContact O-N 3.17Å
127	P	30.7	Very low	37.5	Very low	134 Å²	134	142.1 Å²	142.1	87%	0.87	80%	0.799	S	S	*	*			trans	-76.2	119.9	176	31.1	-28.3	0	0	0	107.7
128	R	30.5	Very low	35.1	Very low	243 Å²	243	145.9 Å²	145.9	92%	0.917	81%	0.808	S	S	*	*			trans	-122.9	118.9	166.5	-137.9	175	-176.9	164	-0	108.6	Q126	Q126-R128 PolarHBondContact O-N 3.17Å
129	E	28.4	Very low	33.2	Very low	195 Å²	195	144.2 Å²	144.2	91%	0.911	81%	0.807	S	S	*	*			trans	-53.1	142.6	176.2	-62.8	168.9	149.8	0	0	111.3
130	A	32.7	Very low	32.2	Very low	95 Å²	95	139.8 Å²	139.8	79%	0.785	80%	0.804	S	S	*	*			trans	-132	126.6	160.8	0	0	0	0	0	108.6
131	P	32.2	Very low	31.7	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	81%	0.808	S	S	*	*			trans	-90.3	142.1	170.7	34.5	-28.6	0	0	0	111.2
132	Y	31.7	Very low	31.3	Very low	224 Å²	224	136.7 Å²	136.7	88%	0.878	79%	0.789	S	S	*	*			trans	41.3	122.6	149.6	-95.3	-94.6	0	0	0	121.1
133	G	32.2	Very low	32	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	78%	0.776	S	S	*	*			trans	-171	100.7	157.8	0	0	0	0	0	111
134	L	31	Very low	32.7	Very low	149 Å²	149	138.5 Å²	138.5	78%	0.78	78%	0.777	S	S	*	*			trans	-64.5	127.8	174.3	-75.7	126.9	0	0	0	111.1
135	E	26.3	Very low	33.6	Very low	195 Å²	195	137.7 Å²	137.7	91%	0.911	77%	0.765	S	S	*	*			trans	-137	105.9	140.4	-73.8	-166.4	159.6	0	0	107.3	D137	E135-D137 PolarHBondContact O-N 3.47Å
136	A	26.9	Very low	35	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	74%	0.741	S	S	*	*			trans	-76.2	107	166.7	0	0	0	0	0	106.6	E138	A136-E138 PolarHBondContact O-N 3.18Å
137	D	28.3	Very low	36.1	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	73%	0.726	S	S	*	*			trans	-79.2	98.6	172.9	-143	-0.3	0	0	0	107.6	E135 S139	E135-D137 PolarHBondContact O-N 3.47Å; D137-S139 VanDerWaalsContact C-N 3.3Å; D137-S139 PolarHBondContact O-N 3.31Å
138	E	26.7	Very low	37.6	Very low	194 Å²	194	126.9 Å²	126.9	91%	0.907	70%	0.702	S	S	*	*			trans	-66	87	169.8	-75.6	-177.7	161.5	0	0	109.1	A136	A136-E138 PolarHBondContact O-N 3.18Å
139	S	29.7	Very low	39.5	Very low	91 Å²	91	116.6 Å²	116.6	64%	0.636	66%	0.664	S	S	*	*			trans	-137.8	32.6	174.5	56.5	0	0	0	0	113.5	D137	D137-S139 VanDerWaalsContact C-N 3.3Å; D137-S139 PolarHBondContact O-N 3.31Å
140	A	33.1	Very low	41.7	Very low	83 Å²	83	108.9 Å²	108.9	69%	0.686	63%	0.632	S	S	*	*	S	Bend	trans	-106.2	-12	-178.7	0	0	0	0	0	115.7
141	E	35.8	Very low	43.8	Very low	181 Å²	181	110.6 Å²	110.6	85%	0.846	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-9.6	-177	-72.4	-173.5	162.9	0	0	114.9	T143	E141-T143 VanDerWaalsContact C-N 3.28Å; E141-T143 PolarHBondContact O-N 3.36Å
142	A	37.5	Very low	46.1	Very low	58 Å²	58	107.4 Å²	107.4	48%	0.479	61%	0.607	S	S	.	*	H	α-helix	trans	-78.3	-3.9	-174.1	0	0	0	0	0	114.9	E146	A142-E146 WeakPolarHBondContact O-CB 3.45Å; A142-E146 VanDerWaalsContact O-CG 3.23Å; A142-E146 WeakPolarHBondContact O-CG 3.43Å
143	T	48.8	Very low	48.5	Very low	84 Å²	84	97.6 Å²	97.6	52%	0.515	57%	0.57	S	S	.	*	H	α-helix	trans	-91.3	-44	-170.1	53.6	0	0	0	0	113.5	E141 I147	E141-T143 VanDerWaalsContact C-N 3.28Å; E141-T143 PolarHBondContact O-N 3.36Å; T143-I147 VanDerWaalsContact O-CD1 3.32Å; T143-I147 WeakPolarHBondContact O-CD1 3.45Å; T143-I147 WeakPolarHBondContact O-CG1 3.45Å; T143-I147 PolarHBondContact O-N 3.14Å; T143-I147 VanDerWaalsContact O-N 3.13Å
144	D	46.8	Very low	50.9	Low	131 Å²	131	98.1 Å²	98.1	70%	0.701	55%	0.552	S	S	*	*	H	α-helix	trans	-72.2	-39.7	-176.4	-82.9	-15.8	0	0	0	113.1	I147 G148	D144-I147 PolarHBondContact O-N 3.24Å; D144-G148 PolarHBondContact O-N 3.48Å; D144-G148 VanDerWaalsContact O-N 3.08Å
145	E	55.4	Low	53.4	Low	111 Å²	111	97.9 Å²	97.9	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-42.2	175.8	-71.4	-169.6	152.9	0	0	111.1	G148 M149 R317	E145-G148 PolarHBondContact O-N 3.41Å; E145-M149 WeakPolarHBondContact O-CB 3.4Å; E145-M149 WeakPolarHBondContact O-CG 3.45Å; E145-M149 PolarHBondContact O-N 3.14Å; E145-R317 IonicContact OE2-NH1 3.8Å; E145-R317 PolarHBondContact OE2-NH1 2.79Å
146	E	58.3	Low	56	Low	68 Å²	68	92.8 Å²	92.8	32%	0.318	52%	0.522	S	S	.	.	H	α-helix	trans	-65.9	-39.5	179.7	-75.2	-167.6	160.9	0	0	112.9	A142 M149 S150 R361	A142-E146 WeakPolarHBondContact O-CB 3.45Å; A142-E146 VanDerWaalsContact O-CG 3.23Å; A142-E146 WeakPolarHBondContact O-CG 3.43Å; E146-M149 HydrophobicContact CB-CE 4.39Å; E146-M149 HydrophobicContact CG-CE 4Å; E146-S150 PolarHBondContact O-N 3.2Å; E146-S150 VanDerWaalsContact O-N 3.11Å; E146-R361 IonicContact OE1-CZ 3.8Å; E146-R361 IonicContact OE1-NH1 2.88Å; E146-R361 IonicContact OE1-NH2 3.53Å; E146-R361 PolarHBondContact OE1-NH2 3.17Å; E146-R361 IonicContact OE2-NH2 3.88Å; E146-R361 PolarHBondContact OE2-NH2 3.24Å; E146-R361 VanDerWaalsContact OE2-NH2 3.1Å
147	I	55.8	Low	58.5	Low	93 Å²	93	88.6 Å²	88.6	48%	0.477	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-49.5	177.4	-66.5	163.4	0	0	0	110.1	T143 D144 M149 S150 E151	T143-I147 VanDerWaalsContact O-CD1 3.32Å; T143-I147 WeakPolarHBondContact O-CD1 3.45Å; T143-I147 WeakPolarHBondContact O-CG1 3.45Å; T143-I147 PolarHBondContact O-N 3.14Å; T143-I147 VanDerWaalsContact O-N 3.13Å; D144-I147 PolarHBondContact O-N 3.24Å; I147-M149 PolarHBondContact O-N 2.75Å; I147-S150 WeakPolarHBondContact O-CB 3.48Å; I147-S150 PolarHBondContact O-N 2.98Å; I147-S150 PolarHBondContact O-OG 2.95Å; I147-E151 PolarHBondContact O-N 3.49Å
148	G	62.3	Low	61	Low	36 Å²	36	84.9 Å²	84.9	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-63.2	-38.2	-179.8	0	0	0	0	0	113.2	D144 E145 S150 E151 A152	D144-G148 PolarHBondContact O-N 3.48Å; D144-G148 VanDerWaalsContact O-N 3.08Å; E145-G148 PolarHBondContact O-N 3.41Å; G148-S150 VanDerWaalsContact C-N 3.33Å; G148-S150 PolarHBondContact O-N 2.79Å; G148-E151 PolarHBondContact O-N 2.97Å; G148-A152 PolarHBondContact O-N 2.85Å
149	M	70.5	Confident	63.8	Low	27 Å²	27	78.1 Å²	78.1	13%	0.133	45%	0.45	C	S	.	.	H	α-helix	trans	-59.9	-44.1	171.3	-74.1	-171.5	-64.8	0	0	111.2	E145 E146 I147 E151 A152 L153 Y298 L319	E145-M149 WeakPolarHBondContact O-CB 3.4Å; E145-M149 WeakPolarHBondContact O-CG 3.45Å; E145-M149 PolarHBondContact O-N 3.14Å; E146-M149 HydrophobicContact CB-CE 4.39Å; E146-M149 HydrophobicContact CG-CE 4Å; I147-M149 PolarHBondContact O-N 2.75Å; M149-E151 VanDerWaalsContact C-N 3.3Å; M149-E151 PolarHBondContact O-N 2.79Å; M149-A152 PolarHBondContact O-N 3.42Å; M149-L153 WeakPolarHBondContact O-CB 3.39Å; M149-L153 WeakPolarHBondContact O-CD1 3.31Å; M149-L153 WeakPolarHBondContact O-CG 3.4Å; M149-L153 PolarHBondContact O-N 2.89Å; M149-Y298 WeakPolarHBondContact CG-OH 3.35Å; M149-Y298 HydrophobicContact SD-CE1 3.78Å; M149-L319 HydrophobicContact CE-CD1 4.04Å; M149-L319 HydrophobicContact CE-CD2 4.03Å; M149-L319 HydrophobicContact SD-CD1 3.58Å; M149-L319 VanDerWaalsContact SD-CD1 3.58Å; M149-L319 HydrophobicContact SD-CD2 4.03Å; M149-L319 HydrophobicContact SD-CG 4.43Å
150	S	73.6	Confident	66.2	Low	32 Å²	32	76 Å²	76	22%	0.224	43%	0.431	C	S	.	.	H	α-helix	trans	-61.6	-37.6	-177.9	89.6	0	0	0	0	112.8	E146 I147 G148 Q154	E146-S150 PolarHBondContact O-N 3.2Å; E146-S150 VanDerWaalsContact O-N 3.11Å; I147-S150 WeakPolarHBondContact O-CB 3.48Å; I147-S150 PolarHBondContact O-N 2.98Å; I147-S150 PolarHBondContact O-OG 2.95Å; G148-S150 VanDerWaalsContact C-N 3.33Å; G148-S150 PolarHBondContact O-N 2.79Å; S150-Q154 WeakPolarHBondContact O-CB 3.46Å; S150-Q154 PolarHBondContact O-N 2.81Å; S150-Q154 VanDerWaalsContact O-N 3.1Å
151	E	78.1	Confident	68.4	Low	131 Å²	131	74.2 Å²	74.2	61%	0.612	41%	0.412	S	S	*	.	H	α-helix	trans	-69	-47.6	179	-67.5	-173.9	165.3	0	0	111.4	I147 G148 M149 L153 Q154 E155	I147-E151 PolarHBondContact O-N 3.49Å; G148-E151 PolarHBondContact O-N 2.97Å; M149-E151 VanDerWaalsContact C-N 3.3Å; M149-E151 PolarHBondContact O-N 2.79Å; E151-L153 VanDerWaalsContact C-N 3.33Å; E151-L153 PolarHBondContact O-N 3.05Å; E151-Q154 PolarHBondContact O-N 3.31Å; E151-Q154 VanDerWaalsContact O-N 3.1Å; E151-E155 PolarHBondContact O-N 2.74Å
152	A	79.2	Confident	70.5	Confident	52 Å²	52	68.3 Å²	68.3	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-39.6	178.2	0	0	0	0	0	112.4	G148 M149 Q154 K156	G148-A152 PolarHBondContact O-N 2.85Å; M149-A152 PolarHBondContact O-N 3.42Å; A152-Q154 VanDerWaalsContact C-N 3.31Å; A152-Q154 PolarHBondContact O-N 2.97Å; A152-K156 WeakPolarHBondContact O-CB 3.28Å; A152-K156 PolarHBondContact O-N 3Å; A152-K156 VanDerWaalsContact O-N 3.1Å
153	L	83	Confident	72.5	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.089	39%	0.391	C	S	.	.	H	α-helix	trans	-60.6	-42.8	173.9	-68.7	169.2	0	0	0	110.7	M149 E151 A157 H293 T295 Y298 L358	M149-L153 WeakPolarHBondContact O-CB 3.39Å; M149-L153 WeakPolarHBondContact O-CD1 3.31Å; M149-L153 WeakPolarHBondContact O-CG 3.4Å; M149-L153 PolarHBondContact O-N 2.89Å; E151-L153 VanDerWaalsContact C-N 3.33Å; E151-L153 PolarHBondContact O-N 3.05Å; L153-A157 VanDerWaalsContact O-CB 3.24Å; L153-A157 WeakPolarHBondContact O-CB 3.5Å; L153-A157 PolarHBondContact O-N 2.94Å; L153-H293 WeakPolarHBondContact CD2-CE1 3.32Å; L153-T295 HydrophobicContact CD2-CG2 4.1Å; L153-Y298 HydrophobicContact CD2-CD2 3.86Å; L153-Y298 HydrophobicContact CD2-CE2 3.86Å; L153-L358 HydrophobicContact CD1-CD2 4.01Å
154	Q	82.2	Confident	73.7	Confident	88 Å²	88	66.3 Å²	66.3	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-73.7	-37.9	-176.4	-166.1	148.2	3.2	0	0	113.1	S150 E151 A152 A157 S158	S150-Q154 WeakPolarHBondContact O-CB 3.46Å; S150-Q154 PolarHBondContact O-N 2.81Å; S150-Q154 VanDerWaalsContact O-N 3.1Å; E151-Q154 PolarHBondContact O-N 3.31Å; E151-Q154 VanDerWaalsContact O-N 3.1Å; A152-Q154 VanDerWaalsContact C-N 3.31Å; A152-Q154 PolarHBondContact O-N 2.97Å; Q154-A157 PolarHBondContact O-N 2.84Å; Q154-S158 PolarHBondContact O-N 2.95Å
155	E	83.4	Confident	75	Confident	144 Å²	144	66.3 Å²	66.3	67%	0.673	37%	0.366	S	S	*	.	H	α-helix	trans	-61.6	-50.2	172.4	-172.3	-179	179.7	0	0	110.7	E151 A157 S158 A159	E151-E155 PolarHBondContact O-N 2.74Å; E155-A157 VanDerWaalsContact C-N 3.31Å; E155-A157 PolarHBondContact O-N 2.79Å; E155-S158 WeakPolarHBondContact O-CB 3.39Å; E155-S158 PolarHBondContact O-N 2.89Å; E155-S158 VanDerWaalsContact O-N 3.09Å; E155-S158 PolarHBondContact O-OG 2.79Å; E155-A159 PolarHBondContact O-N 2.83Å
156	K	81.4	Confident	75.8	Confident	89 Å²	89	68 Å²	68	39%	0.387	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-37.8	178.9	-164.5	137	175.2	-169.3	0	111.6	A152 S158 A159 L160 T295	A152-K156 WeakPolarHBondContact O-CB 3.28Å; A152-K156 PolarHBondContact O-N 3Å; A152-K156 VanDerWaalsContact O-N 3.1Å; K156-S158 VanDerWaalsContact C-N 3.31Å; K156-S158 PolarHBondContact O-N 2.74Å; K156-A159 PolarHBondContact O-N 3.05Å; K156-L160 HydrophobicContact CG-CD1 4.1Å; K156-L160 HydrophobicContact CG-CG 4.43Å; K156-L160 WeakPolarHBondContact O-CB 3.2Å; K156-L160 WeakPolarHBondContact O-CG 3.22Å; K156-L160 PolarHBondContact O-N 3.46Å; K156-T295 HydrophobicContact CB-CG2 4.12Å; K156-T295 HydrophobicContact CD-CG2 3.66Å; K156-T295 HydrophobicContact CG-CG2 4.04Å; K156-T295 PolarHBondContact NZ-O 3.33Å
157	A	78.8	Confident	76.2	Confident	1 Å²	1	72 Å²	72	1%	0.008	39%	0.386	C	S	.	.	H	α-helix	trans	-59.3	-41.6	172.7	0	0	0	0	0	112.5	L153 Q154 E155 T161 D340 L342	L153-A157 VanDerWaalsContact O-CB 3.24Å; L153-A157 WeakPolarHBondContact O-CB 3.5Å; L153-A157 PolarHBondContact O-N 2.94Å; Q154-A157 PolarHBondContact O-N 2.84Å; E155-A157 VanDerWaalsContact C-N 3.31Å; E155-A157 PolarHBondContact O-N 2.79Å; A157-T161 VanDerWaalsContact O-CB 3.28Å; A157-T161 WeakPolarHBondContact O-CB 3.34Å; A157-T161 PolarHBondContact O-N 2.93Å; A157-T161 PolarHBondContact O-OG1 3.49Å; A157-D340 WeakPolarHBondContact CA-O 3.4Å; A157-D340 WeakPolarHBondContact CB-O 3.46Å; A157-L342 HydrophobicContact CB-CD1 3.75Å; A157-L342 HydrophobicContact CB-CD2 4.02Å; A157-L342 HydrophobicContact CB-CG 3.59Å
158	S	81.3	Confident	76.4	Confident	72 Å²	72	70.8 Å²	70.8	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-41.7	177.2	81.1	0	0	0	0	111.9	Q154 E155 K156 T161 A162	Q154-S158 PolarHBondContact O-N 2.95Å; E155-S158 WeakPolarHBondContact O-CB 3.39Å; E155-S158 PolarHBondContact O-N 2.89Å; E155-S158 VanDerWaalsContact O-N 3.09Å; E155-S158 PolarHBondContact O-OG 2.79Å; K156-S158 VanDerWaalsContact C-N 3.31Å; K156-S158 PolarHBondContact O-N 2.74Å; S158-T161 PolarHBondContact O-N 2.92Å; S158-A162 WeakPolarHBondContact O-CB 3.43Å; S158-A162 PolarHBondContact O-N 3.35Å
159	A	85.6	Confident	76.3	Confident	52 Å²	52	77.7 Å²	77.7	43%	0.43	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-46.9	176.7	0	0	0	0	0	111.7	E155 K156 T161 A162 V163	E155-A159 PolarHBondContact O-N 2.83Å; K156-A159 PolarHBondContact O-N 3.05Å; A159-T161 VanDerWaalsContact C-N 3.32Å; A159-T161 PolarHBondContact O-N 2.95Å; A159-A162 WeakPolarHBondContact O-CB 3.37Å; A159-A162 PolarHBondContact O-N 2.99Å; A159-A162 VanDerWaalsContact O-N 3.14Å; A159-V163 WeakPolarHBondContact O-CG2 3.22Å; A159-V163 PolarHBondContact O-N 3.31Å
160	L	79.8	Confident	76	Confident	45 Å²	45	79.7 Å²	79.7	24%	0.236	44%	0.437	C	S	.	.	H	α-helix	trans	-62	-40.6	176.9	-70.5	167.5	0	0	0	111.6	K156 A162 V163 R164 A294	K156-L160 HydrophobicContact CG-CD1 4.1Å; K156-L160 HydrophobicContact CG-CG 4.43Å; K156-L160 WeakPolarHBondContact O-CB 3.2Å; K156-L160 WeakPolarHBondContact O-CG 3.22Å; K156-L160 PolarHBondContact O-N 3.46Å; L160-A162 VanDerWaalsContact C-N 3.33Å; L160-A162 PolarHBondContact O-N 3.47Å; L160-V163 PolarHBondContact O-N 3.03Å; L160-R164 WeakPolarHBondContact O-CB 3.29Å; L160-R164 WeakPolarHBondContact O-CG 3.04Å; L160-R164 PolarHBondContact O-N 2.87Å; L160-A294 HydrophobicContact CD1-CB 3.36Å
161	T	78.8	Confident	76	Confident	46 Å²	46	83.5 Å²	83.5	28%	0.282	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-39.4	174.8	-60.9	0	0	0	0	111.6	A157 S158 A159 K165	A157-T161 VanDerWaalsContact O-CB 3.28Å; A157-T161 WeakPolarHBondContact O-CB 3.34Å; A157-T161 PolarHBondContact O-N 2.93Å; A157-T161 PolarHBondContact O-OG1 3.49Å; S158-T161 PolarHBondContact O-N 2.92Å; A159-T161 VanDerWaalsContact C-N 3.32Å; A159-T161 PolarHBondContact O-N 2.95Å; T161-K165 HydrophobicContact CG2-CD 4.41Å; T161-K165 WeakPolarHBondContact O-CG 3.37Å; T161-K165 PolarHBondContact O-N 3.48Å
162	A	79.8	Confident	76	Confident	58 Å²	58	79.9 Å²	79.9	48%	0.479	44%	0.442	S	S	.	.	H	α-helix	trans	-66.2	-48.7	176.9	0	0	0	0	0	111.7	S158 A159 L160 R164 K165 Q166	S158-A162 WeakPolarHBondContact O-CB 3.43Å; S158-A162 PolarHBondContact O-N 3.35Å; A159-A162 WeakPolarHBondContact O-CB 3.37Å; A159-A162 PolarHBondContact O-N 2.99Å; A159-A162 VanDerWaalsContact O-N 3.14Å; L160-A162 VanDerWaalsContact C-N 3.33Å; L160-A162 PolarHBondContact O-N 3.47Å; A162-R164 VanDerWaalsContact C-N 3.28Å; A162-R164 PolarHBondContact O-N 3.27Å; A162-K165 PolarHBondContact O-N 2.88Å; A162-Q166 PolarHBondContact O-N 3Å; A162-Q166 VanDerWaalsContact O-N 3.08Å
163	V	80.4	Confident	76	Confident	67 Å²	67	86.6 Å²	86.6	41%	0.406	46%	0.464	S	S	.	.	H	α-helix	trans	-58.8	-41.3	176.3	173.3	0	0	0	0	110.8	A159 L160 Q166 R167	A159-V163 WeakPolarHBondContact O-CG2 3.22Å; A159-V163 PolarHBondContact O-N 3.31Å; L160-V163 PolarHBondContact O-N 3.03Å; V163-Q166 WeakPolarHBondContact O-CB 3.48Å; V163-Q166 PolarHBondContact O-N 3.48Å; V163-R167 PolarHBondContact O-N 3.2Å
164	R	73.9	Confident	76.2	Confident	32 Å²	32	91.7 Å²	91.7	12%	0.121	49%	0.492	C	S	.	.	H	α-helix	trans	-61.8	-47.5	173.9	-88.3	-165.2	-179.1	95.1	46.7	113.7	L160 A162 Q166 R167 G168 P339 E381	L160-R164 WeakPolarHBondContact O-CB 3.29Å; L160-R164 WeakPolarHBondContact O-CG 3.04Å; L160-R164 PolarHBondContact O-N 2.87Å; A162-R164 VanDerWaalsContact C-N 3.28Å; A162-R164 PolarHBondContact O-N 3.27Å; R164-Q166 PolarHBondContact O-N 2.9Å; R164-Q166 VanDerWaalsContact O-N 3.16Å; R164-R167 PolarHBondContact O-N 2.58Å; R164-R167 VanDerWaalsContact O-N 3.11Å; R164-G168 PolarHBondContact O-N 2.96Å; R164-P339 VanDerWaalsContact CZ-CB 3.41Å; R164-P339 VanDerWaalsContact CZ-O 3.22Å; R164-P339 PolarHBondContact NH1-O 3.33Å; R164-P339 PolarHBondContact NH2-O 3Å; R164-E381 WeakPolarHBondContact CD-O 3.45Å; R164-E381 IonicContact CZ-OE2 3.09Å; R164-E381 VanDerWaalsContact CZ-OE2 3.24Å; R164-E381 PolarHBondContact NE-O 3.01Å; R164-E381 VanDerWaalsContact NE-O 3.14Å; R164-E381 IonicContact NE-OE2 3.6Å; R164-E381 PolarHBondContact NE-OE2 3.22Å; R164-E381 IonicContact NH2-OE1 2.98Å; R164-E381 IonicContact NH2-OE2 3.9Å; R164-E381 PolarHBondContact NH2-OE2 2.95Å
165	K	73.1	Confident	76.5	Confident	131 Å²	131	88.3 Å²	88.3	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-59.8	-26	177.3	-76.9	176.9	-178.4	176.3	0	111.5	T161 A162 K169	T161-K165 HydrophobicContact CG2-CD 4.41Å; T161-K165 WeakPolarHBondContact O-CG 3.37Å; T161-K165 PolarHBondContact O-N 3.48Å; A162-K165 PolarHBondContact O-N 2.88Å; K165-K169 WeakPolarHBondContact O-CG 3.37Å
166	Q	72.1	Confident	76.8	Confident	147 Å²	147	82.6 Å²	82.6	69%	0.687	45%	0.45	S	S	*	.	H	α-helix	trans	-76.4	-48.3	172.5	-163.3	172.7	7.4	0	0	111.9	A162 V163 R164 G168 K169	A162-Q166 PolarHBondContact O-N 3Å; A162-Q166 VanDerWaalsContact O-N 3.08Å; V163-Q166 WeakPolarHBondContact O-CB 3.48Å; V163-Q166 PolarHBondContact O-N 3.48Å; R164-Q166 PolarHBondContact O-N 2.9Å; R164-Q166 VanDerWaalsContact O-N 3.16Å; Q166-G168 PolarHBondContact O-N 2.82Å; Q166-K169 PolarHBondContact O-N 3.37Å
167	R	66.9	Low	77.3	Confident	151 Å²	151	85.3 Å²	85.3	57%	0.57	46%	0.462	S	S	*	.	H	α-helix	trans	-62.2	-41.7	176.9	-72.6	-178.7	179.1	179.2	-1.3	112.9	V163 R164 K169 A170	V163-R167 PolarHBondContact O-N 3.2Å; R164-R167 PolarHBondContact O-N 2.58Å; R164-R167 VanDerWaalsContact O-N 3.11Å; R167-K169 PolarHBondContact O-N 3.47Å; R167-A170 PolarHBondContact O-N 2.85Å
168	G	59.5	Low	77.9	Confident	69 Å²	69	87 Å²	87	71%	0.711	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-11.2	-179.5	0	0	0	0	0	114.9	R164 Q166	R164-G168 PolarHBondContact O-N 2.96Å; Q166-G168 PolarHBondContact O-N 2.82Å
169	K	60.2	Low	78.3	Confident	181 Å²	181	91.2 Å²	91.2	79%	0.787	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-25.5	176.5	-73.8	176.5	-178.2	-177.1	0	113.3	K165 Q166 R167	K165-K169 WeakPolarHBondContact O-CG 3.37Å; Q166-K169 PolarHBondContact O-N 3.37Å; R167-K169 PolarHBondContact O-N 3.47Å
170	A	65.7	Low	78.6	Confident	69 Å²	69	91.1 Å²	91.1	57%	0.57	48%	0.478	S	S	*	.	S	Bend	trans	-141.5	126.3	-176.2	0	0	0	0	0	110.6	R167	R167-A170 PolarHBondContact O-N 2.85Å
171	I	73	Confident	79.1	Confident	111 Å²	111	89 Å²	89	57%	0.569	47%	0.467	S	S	*	.			trans	-62.6	131.6	171.1	-59.5	172.1	0	0	0	107.1	E173 L175	I171-E173 PolarHBondContact O-N 2.97Å; I171-L175 HydrophobicContact CG2-CB 4.16Å; I171-L175 HydrophobicContact CG2-CD2 3.51Å; I171-L175 HydrophobicContact CG2-CG 4.48Å
172	P	78.1	Confident	79.6	Confident	55 Å²	55	89.8 Å²	89.8	36%	0.357	48%	0.475	S	S	.	.			trans	-54.2	131.3	176.9	-24.1	32.9	0	0	0	110.7	N174 L175	P172-N174 PolarHBondContact O-N 3.08Å; P172-L175 HydrophobicContact CB-CB 4.35Å; P172-L175 WeakPolarHBondContact O-CB 3.36Å; P172-L175 PolarHBondContact O-N 3.49Å
173	E	79.6	Confident	80.2	Confident	194 Å²	194	89.2 Å²	89.2	91%	0.907	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-32.1	-176.3	-65.7	-174.8	167.2	0	0	112.4	I171 L175	I171-E173 PolarHBondContact O-N 2.97Å; E173-L175 VanDerWaalsContact C-N 3.27Å; E173-L175 PolarHBondContact O-N 2.96Å
174	N	86.2	Confident	80.8	Confident	123 Å²	123	86.6 Å²	86.6	66%	0.658	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	0.2	179.2	-61.8	-15.5	0	0	0	113.3	P172 I176	P172-N174 PolarHBondContact O-N 3.08Å; N174-I176 PolarHBondContact O-N 3.49Å
175	L	89.4	Confident	81.7	Confident	17 Å²	17	88.1 Å²	88.1	9%	0.089	47%	0.47	C	S	.	.	S	Bend	trans	-64.8	127.4	177.5	-174.7	72.3	0	0	0	109.7	I171 P172 E173 K177 S425 N427 Y428 A466	I171-L175 HydrophobicContact CG2-CB 4.16Å; I171-L175 HydrophobicContact CG2-CD2 3.51Å; I171-L175 HydrophobicContact CG2-CG 4.48Å; P172-L175 HydrophobicContact CB-CB 4.35Å; P172-L175 WeakPolarHBondContact O-CB 3.36Å; P172-L175 PolarHBondContact O-N 3.49Å; E173-L175 VanDerWaalsContact C-N 3.27Å; E173-L175 PolarHBondContact O-N 2.96Å; L175-K177 PolarHBondContact O-N 2.96Å; L175-S425 WeakPolarHBondContact CD2-OG 3.07Å; L175-N427 HydrophobicContact CD2-CB 4.05Å; L175-N427 WeakPolarHBondContact CD2-ND2 3.46Å; L175-Y428 HydrophobicContact CD1-CD2 4.42Å; L175-Y428 HydrophobicContact CD1-CE2 4.04Å; L175-Y428 HydrophobicContact CD2-CE2 4.08Å; L175-Y428 HydrophobicContact CG-CE2 4.04Å; L175-A466 HydrophobicContact CD1-CB 4.38Å
176	I	90.4	Very high	82.7	Confident	24 Å²	24	85.2 Å²	85.2	12%	0.123	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-59.8	134.8	177	-70.8	-168.8	0	0	0	110.5	N174 V180 L181 Y184 Y428 N465 C467	N174-I176 PolarHBondContact O-N 3.49Å; I176-V180 HydrophobicContact CG2-CB 3.78Å; I176-V180 HydrophobicContact CG2-CG1 3.88Å; I176-L181 HydrophobicContact CG2-CB 4.29Å; I176-Y184 HydrophobicContact CD1-CE1 4.47Å; I176-Y184 WeakPolarHBondContact CD1-OH 3.38Å; I176-Y184 HydrophobicContact CG2-CE1 4.35Å; I176-Y184 WeakPolarHBondContact CG2-OH 3.31Å; I176-Y428 WeakPolarHBondContact O-CE2 3.45Å; I176-Y428 PolarHBondContact O-OH 3.44Å; I176-N465 PolarHBondContact N-O 3.4Å; I176-C467 VanDerWaalsContact CD1-CA 3.48Å; I176-C467 HydrophobicContact CD1-CB 4.41Å
177	K	91.6	Very high	83.7	Confident	147 Å²	147	82.4 Å²	82.4	64%	0.639	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-72.1	150	178	-67.9	-179.8	-176.7	175	0	110.8	L175 E179 V180 L181	L175-K177 PolarHBondContact O-N 2.96Å; K177-E179 PolarHBondContact O-N 2.86Å; K177-E179 VanDerWaalsContact O-N 3.16Å; K177-V180 PolarHBondContact O-N 3.42Å; K177-V180 VanDerWaalsContact O-N 3.1Å; K177-L181 PolarHBondContact O-N 3.25Å; K177-L181 VanDerWaalsContact O-N 3.1Å
178	P	90.7	Very high	85	Confident	37 Å²	37	76 Å²	76	24%	0.24	43%	0.428	C	S	.	.	H	α-helix	trans	-60	-31.2	-176.9	23.7	-34.6	0	0	0	113.2	L181 S182 Y428 L447	P178-L181 PolarHBondContact O-N 3.42Å; P178-S182 PolarHBondContact O-N 2.87Å; P178-Y428 HydrophobicContact CB-CE1 4.37Å; P178-Y428 WeakPolarHBondContact CD-OH 3.28Å; P178-L447 HydrophobicContact CB-CD1 4.03Å; P178-L447 HydrophobicContact CB-CD2 3.87Å
179	E	89.7	Confident	86.6	Confident	160 Å²	160	74.8 Å²	74.8	75%	0.748	41%	0.408	S	S	*	.	H	α-helix	trans	-62.1	-44.6	177	-65.1	171.5	-170.6	0	0	112	K177 S182	K177-E179 PolarHBondContact O-N 2.86Å; K177-E179 VanDerWaalsContact O-N 3.16Å; E179-S182 PolarHBondContact O-N 3.14Å; E179-S182 PolarHBondContact O-OG 3.47Å
180	V	91	Very high	88.3	Confident	49 Å²	49	67.7 Å²	67.7	30%	0.297	38%	0.377	S	S	.	.	H	α-helix	trans	-69.9	-39.4	177.3	178.5	0	0	0	0	110.5	I176 K177 S182 G183 Y184 Q483	I176-V180 HydrophobicContact CG2-CB 3.78Å; I176-V180 HydrophobicContact CG2-CG1 3.88Å; K177-V180 PolarHBondContact O-N 3.42Å; K177-V180 VanDerWaalsContact O-N 3.1Å; V180-S182 PolarHBondContact O-N 3.13Å; V180-G183 PolarHBondContact O-N 3.28Å; V180-Y184 HydrophobicContact CG1-CE1 4.43Å; V180-Y184 WeakPolarHBondContact O-CD1 3.39Å; V180-Q483 HydrophobicContact CG1-CB 4.12Å; V180-Q483 VanDerWaalsContact CG1-CD 3.44Å; V180-Q483 HydrophobicContact CG1-CG 3.86Å
181	L	91.1	Very high	89.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-61.4	-33.3	178.4	-161.7	146.6	0	0	0	112.5	I176 K177 P178 G183 Y184 Y428 V438 L447 V448 A466	I176-L181 HydrophobicContact CG2-CB 4.29Å; K177-L181 PolarHBondContact O-N 3.25Å; K177-L181 VanDerWaalsContact O-N 3.1Å; P178-L181 PolarHBondContact O-N 3.42Å; L181-G183 PolarHBondContact O-N 3.22Å; L181-Y184 VanDerWaalsContact CA-CE1 3.5Å; L181-Y184 HydrophobicContact CB-CE1 4.3Å; L181-Y184 HydrophobicContact CG-CE1 4.34Å; L181-Y184 HydrophobicContact CG-CE2 4.18Å; L181-Y184 PolarHBondContact O-N 3.34Å; L181-Y428 HydrophobicContact CD1-CD1 4.19Å; L181-Y428 HydrophobicContact CD1-CD2 4.03Å; L181-Y428 HydrophobicContact CD1-CE1 4.2Å; L181-Y428 HydrophobicContact CD1-CE2 4Å; L181-Y428 HydrophobicContact CD1-CG 4.12Å; L181-V438 HydrophobicContact CD2-CB 3.91Å; L181-V438 HydrophobicContact CD2-CG1 3.74Å; L181-V438 HydrophobicContact CD2-CG2 4.28Å; L181-L447 HydrophobicContact CD2-CB 4.1Å; L181-L447 HydrophobicContact CD2-CD1 4.03Å; L181-V448 HydrophobicContact CD2-CG1 3.94Å; L181-A466 HydrophobicContact CD1-CB 4.31Å
182	S	89.6	Confident	90.2	Very high	64 Å²	64	67.1 Å²	67.1	45%	0.448	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.5	175.8	76.7	0	0	0	0	113.8	P178 E179 V180 L447	P178-S182 PolarHBondContact O-N 2.87Å; E179-S182 PolarHBondContact O-N 3.14Å; E179-S182 PolarHBondContact O-OG 3.47Å; V180-S182 PolarHBondContact O-N 3.13Å; S182-L447 WeakPolarHBondContact CB-O 3.37Å
183	G	91.2	Very high	90.8	Very high	46 Å²	46	65.1 Å²	65.1	47%	0.474	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	17.5	179.5	0	0	0	0	0	114.6	V180 L181	V180-G183 PolarHBondContact O-N 3.28Å; L181-G183 PolarHBondContact O-N 3.22Å
184	Y	94	Very high	91.5	Very high	12 Å²	12	56.3 Å²	56.3	5%	0.047	32%	0.323	C	S	.	.			trans	-64.2	136.9	-179.7	-84	19.9	0	0	0	112	I176 V180 L181 A466 I469 F481 G482	I176-Y184 HydrophobicContact CD1-CE1 4.47Å; I176-Y184 WeakPolarHBondContact CD1-OH 3.38Å; I176-Y184 HydrophobicContact CG2-CE1 4.35Å; I176-Y184 WeakPolarHBondContact CG2-OH 3.31Å; V180-Y184 HydrophobicContact CG1-CE1 4.43Å; V180-Y184 WeakPolarHBondContact O-CD1 3.39Å; L181-Y184 VanDerWaalsContact CA-CE1 3.5Å; L181-Y184 HydrophobicContact CB-CE1 4.3Å; L181-Y184 HydrophobicContact CG-CE1 4.34Å; L181-Y184 HydrophobicContact CG-CE2 4.18Å; L181-Y184 PolarHBondContact O-N 3.34Å; Y184-A466 PolarHBondContact OH-O 3.44Å; Y184-I469 HydrophobicContact CD2-CD1 4.02Å; Y184-I469 HydrophobicContact CD2-CG1 4.3Å; Y184-I469 HydrophobicContact CE2-CD1 4.03Å; Y184-I469 HydrophobicContact CE2-CG1 4.05Å; Y184-F481 HydrophobicContact CD2-CB 4.37Å; Y184-G482 WeakPolarHBondContact CA-O 3.46Å
185	V	93.4	Very high	91.7	Very high	63 Å²	63	52.5 Å²	52.5	38%	0.382	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	159.8	177	-64.4	0	0	0	0	109.9	L187 F481 G482	V185-L187 HydrophobicContact CG2-CD2 4.37Å; V185-L187 PolarHBondContact O-N 3.47Å; V185-F481 VanDerWaalsContact O-CA 3.26Å; V185-F481 WeakPolarHBondContact O-CA 3.43Å; V185-G482 PolarHBondContact N-O 2.98Å; V185-G482 PolarHBondContact O-N 2.89Å
186	E	93.9	Very high	91.7	Very high	71 Å²	71	54.9 Å²	54.9	33%	0.332	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	118.3	171.8	-174.7	172.9	135.5	0	0	109.7	S189 D452 R479 F481	E186-S189 WeakPolarHBondContact OE1-CB 3.34Å; E186-D452 WeakPolarHBondContact OE2-CB 3.43Å; E186-R479 IonicContact OE1-NH1 3.68Å; E186-R479 PolarHBondContact OE1-NH1 3.23Å; E186-R479 IonicContact OE2-CZ 2.77Å; E186-R479 IonicContact OE2-NH1 3.56Å; E186-R479 PolarHBondContact OE2-NH1 3.5Å; E186-F481 HydrophobicContact CB-CD1 4.11Å; E186-F481 HydrophobicContact CB-CE1 3.79Å; E186-F481 HydrophobicContact CG-CE1 4.37Å
187	L	92.8	Very high	91.7	Very high	88 Å²	88	58.6 Å²	58.6	46%	0.461	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-42.1	176	-62.5	177.5	0	0	0	111	V185 I480	V185-L187 HydrophobicContact CG2-CD2 4.37Å; V185-L187 PolarHBondContact O-N 3.47Å; L187-I480 PolarHBondContact N-O 3.21Å
188	A	93.3	Very high	91.6	Very high	17 Å²	17	55.1 Å²	55.1	14%	0.14	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151	-178	0	0	0	0	0	111.5	R479 I480	A188-R479 WeakPolarHBondContact O-CA 3.36Å; A188-I480 HydrophobicContact CB-CB 4.41Å; A188-I480 PolarHBondContact N-O 3.01Å; A188-I480 PolarHBondContact O-N 2.94Å
189	S	94.5	Very high	91.5	Very high	43 Å²	43	56.4 Å²	56.4	30%	0.301	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	118.3	176.9	177.2	0	0	0	0	111.2	E186 L478	E186-S189 WeakPolarHBondContact OE1-CB 3.34Å; S189-L478 WeakPolarHBondContact CA-O 3.41Å
190	H	94.9	Very high	91.6	Very high	31 Å²	31	48.8 Å²	48.8	14%	0.144	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	103.8	-176.3	-54.1	-76	0	0	0	109.7	L193 F226 L478	H190-L193 HydrophobicContact CB-CD1 4.4Å; H190-L193 HydrophobicContact CB-CG 4.28Å; H190-F226 AromaticContact CD2-CE1 3.81Å; H190-F226 AromaticContact CD2-CZ 3.62Å; H190-F226 AromaticContact CE1-CZ 3.59Å; H190-F226 AromaticContact CG-CZ 3.88Å; H190-F226 AromaticContact ND1-CZ 3.85Å; H190-F226 AromaticContact NE2-CE1 3.79Å; H190-F226 AromaticContact NE2-CZ 3.43Å; H190-F226 WeakPolarHBondContact NE2-CZ 3.18Å; H190-L478 PolarHBondContact N-O 2.83Å; H190-L478 PolarHBondContact O-N 3.42Å
191	M	89.7	Confident	91.9	Very high	107 Å²	107	46.4 Å²	46.4	53%	0.527	30%	0.302	S	S	.	.			trans	-94.3	3.5	179.2	-54.5	-166.1	-54.3	0	0	113.6	R476 A477	M191-R476 PolarHBondContact O-NE 3.37Å; M191-R476 PolarHBondContact O-NH2 3.06Å; M191-R476 VanDerWaalsContact O-NH2 3.07Å; M191-A477 HydrophobicContact CG-CB 4.26Å
192	G	88.3	Confident	92.1	Very high	62 Å²	62	47.7 Å²	47.7	64%	0.639	31%	0.31	S	S	*	.			trans	-106.8	3	-169.8	0	0	0	0	0	115.7
193	L	91.8	Very high	92.4	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.063	29%	0.29	C	S	.	.	S	Bend	trans	-70.7	-37.4	-172.3	-62.9	177.2	0	0	0	113	H190 T216 V224 F226 I233 L478	H190-L193 HydrophobicContact CB-CD1 4.4Å; H190-L193 HydrophobicContact CB-CG 4.28Å; L193-T216 HydrophobicContact CD1-CG2 4.43Å; L193-V224 HydrophobicContact CB-CG1 4.46Å; L193-V224 HydrophobicContact CD2-CG1 4.34Å; L193-F226 HydrophobicContact CD2-CB 4.25Å; L193-F226 HydrophobicContact CD2-CD2 3.62Å; L193-F226 HydrophobicContact CD2-CE2 4.23Å; L193-F226 HydrophobicContact CD2-CG 4.08Å; L193-I233 HydrophobicContact CD2-CD1 4.09Å; L193-I233 HydrophobicContact CD2-CG1 3.81Å; L193-L478 HydrophobicContact CD1-CB 3.59Å; L193-L478 HydrophobicContact CD1-CD1 3.89Å; L193-L478 HydrophobicContact CD1-CG 4.23Å
194	H	93.5	Very high	92.7	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.042	27%	0.269	C	S	.	.	S	Bend	trans	-118.8	163.9	-178.5	-72.5	-85.5	0	0	0	111.8	A196 T216 G218 D220 N222 R476	H194-A196 PolarHBondContact O-N 3.37Å; H194-T216 WeakPolarHBondContact NE2-CB 3.42Å; H194-T216 PolarHBondContact NE2-OG1 3.11Å; H194-G218 VanDerWaalsContact CE1-CA 3.43Å; H194-G218 WeakPolarHBondContact CE1-CA 3.46Å; H194-G218 PolarHBondContact CE1-N 2.93Å; H194-G218 WeakPolarHBondContact ND1-CA 3.35Å; H194-D220 IonicContact CE1-OD1 3.67Å; H194-D220 IonicContact CG-OD1 2.8Å; H194-D220 IonicContact CG-OD2 3.15Å; H194-D220 IonicContact ND1-OD1 3.62Å; H194-D220 PolarHBondContact ND1-OD1 3.48Å; H194-D220 IonicContact ND1-OD2 3.41Å; H194-D220 PolarHBondContact ND1-OD2 2.89Å; H194-N222 PolarHBondContact CE1-O 2.88Å; H194-R476 HydrophobicContact CB-CG 4.36Å; H194-R476 WeakPolarHBondContact O-CD 3.43Å
195	S	91.7	Very high	92.8	Very high	43 Å²	43	43.6 Å²	43.6	30%	0.301	27%	0.273	S	S	.	.			trans	-55.3	135.8	-177.5	-177.8	0	0	0	0	113.1	S197 M198 D220 R476	S195-S197 VanDerWaalsContact C-N 3.27Å; S195-S197 PolarHBondContact O-N 2.96Å; S195-S197 PolarHBondContact OG-N 2.83Å; S195-S197 VanDerWaalsContact OG-N 3.12Å; S195-S197 PolarHBondContact OG-OG 2.83Å; S195-M198 CarbonylContact O-C 3.56Å; S195-D220 PolarHBondContact N-OD2 2.73Å; S195-R476 WeakPolarHBondContact O-CD 3.46Å
196	A	88.9	Confident	92.9	Very high	68 Å²	68	41.4 Å²	41.4	56%	0.562	26%	0.26	S	S	*	.	S	Bend	trans	-69.6	-23.4	171.6	0	0	0	0	0	113.6	H194 R476	H194-A196 PolarHBondContact O-N 3.37Å; A196-R476 VanDerWaalsContact CA-NH1 3.28Å; A196-R476 VanDerWaalsContact CB-NH1 3.26Å
197	S	91.2	Very high	92.9	Very high	101 Å²	101	38 Å²	38	71%	0.706	24%	0.244	S	C	*	.	S	Bend	trans	-76.7	-29.2	-178	71.5	0	0	0	0	113.1	S195	S195-S197 VanDerWaalsContact C-N 3.27Å; S195-S197 PolarHBondContact O-N 2.96Å; S195-S197 PolarHBondContact OG-N 2.83Å; S195-S197 VanDerWaalsContact OG-N 3.12Å; S195-S197 PolarHBondContact OG-OG 2.83Å
198	M	89.4	Confident	92.7	Very high	75 Å²	75	38.9 Å²	38.9	37%	0.369	25%	0.249	S	C	.	.	S	Bend	trans	-127	75.3	174.3	-69.5	-158.1	-68.4	0	0	108.2	S195 D220	S195-M198 CarbonylContact O-C 3.56Å; M198-D220 HydrophobicContact CB-CB 4.33Å; M198-D220 HydrophobicContact CE-CB 4.43Å
199	P	87.6	Confident	92.4	Very high	63 Å²	63	42.4 Å²	42.4	41%	0.409	27%	0.269	S	S	.	.			trans	-64.8	152.1	-174.5	27.9	-34.5	0	0	0	111.5	R476	P199-R476 HydrophobicContact CB-CB 4.46Å
200	G	91.9	Very high	92.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.265	C	S	.	.			trans	121.5	123.8	169	0	0	0	0	0	113.6	N219 M474	G200-N219 PolarHBondContact O-N 2.62Å; G200-M474 WeakPolarHBondContact CA-O 3.31Å
201	I	96.5	Very high	92.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.1	166.3	-56.4	176.8	0	0	0	106.1	C203 T216 G217 T458 C472 G473 L478	I201-C203 WeakPolarHBondContact CG2-O 3.13Å; I201-T216 HydrophobicContact CD1-CG2 4.44Å; I201-T216 HydrophobicContact CG2-CG2 4.12Å; I201-G217 CarbonylContact C-O 3.56Å; I201-G217 WeakPolarHBondContact CG2-O 3.33Å; I201-T458 WeakPolarHBondContact O-CB 3.44Å; I201-T458 WeakPolarHBondContact O-CG2 3.47Å; I201-T458 PolarHBondContact O-OG1 3.27Å; I201-C472 HydrophobicContact CB-CB 3.98Å; I201-C472 HydrophobicContact CD1-CB 4.17Å; I201-C472 HydrophobicContact CG2-CB 3.62Å; I201-G473 PolarHBondContact N-O 3.42Å; I201-L478 HydrophobicContact CD1-CB 4.19Å
202	T	95.9	Very high	92.2	Very high	27 Å²	27	38.2 Å²	38.2	17%	0.166	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-26.3	-174.5	55	0	0	0	0	112.6	G217 N219 V244	T202-G217 PolarHBondContact N-O 2.98Å; T202-G217 PolarHBondContact OG1-O 3.34Å; T202-G217 VanDerWaalsContact OG1-O 3.09Å; T202-N219 HydrophobicContact CG2-CB 4.23Å; T202-V244 WeakPolarHBondContact CB-O 3.42Å; T202-V244 PolarHBondContact OG1-O 2.85Å
203	C	96.2	Very high	92.6	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.034	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	159.5	-177	53.9	0	0	0	0	110.6	I201 G217 K246 V247	I201-C203 WeakPolarHBondContact CG2-O 3.13Å; C203-G217 PolarHBondContact O-N 2.89Å; C203-K246 VanDerWaalsContact SG-CA 3.55Å; C203-V247 HydrophobicContact CB-CG2 4.27Å
204	M	96.5	Very high	92.8	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153.1	179.1	178	-177.9	65.3	0	0	110.2	I214 V215 T216 V470 C472 L478	M204-I214 HydrophobicContact CG-CG2 3.67Å; M204-I214 HydrophobicContact SD-CG2 3.76Å; M204-V215 CarbonylContact C-O 3.46Å; M204-V215 VanDerWaalsContact CA-O 3.23Å; M204-V215 WeakPolarHBondContact CA-O 3.45Å; M204-V215 WeakPolarHBondContact CG-O 3.41Å; M204-T216 HydrophobicContact CB-CG2 4.33Å; M204-T216 HydrophobicContact CG-CG2 4.03Å; M204-T216 HydrophobicContact SD-CG2 4.41Å; M204-V470 HydrophobicContact CE-CB 3.92Å; M204-V470 HydrophobicContact CE-CG1 3.73Å; M204-V470 WeakPolarHBondContact CE-O 3.22Å; M204-V470 HydrophobicContact SD-CB 4.16Å; M204-V470 HydrophobicContact SD-CG1 3.37Å; M204-V470 WeakPolarHBondContact SD-CG1 3.37Å; M204-C472 HydrophobicContact CB-CB 4.19Å; M204-C472 WeakPolarHBondContact CB-SG 3.1Å; M204-C472 HydrophobicContact CE-CB 4.32Å; M204-C472 HydrophobicContact SD-CB 3.98Å; M204-L478 HydrophobicContact SD-CD1 3.7Å; M204-L478 HydrophobicContact SD-CG 4.35Å
205	D	96.5	Very high	93	Very high	28 Å²	28	36.7 Å²	36.7	15%	0.15	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	158.6	167.4	-155.7	30.7	0	0	0	111	V215 V247 A248 Y249 R461	D205-V215 HydrophobicContact CB-CG1 3.77Å; D205-V215 PolarHBondContact N-O 3.1Å; D205-V215 WeakPolarHBondContact O-CG1 3.32Å; D205-V215 PolarHBondContact O-N 3.41Å; D205-V247 HydrophobicContact CB-CG2 4.3Å; D205-A248 WeakPolarHBondContact OD2-CA 3.4Å; D205-Y249 PolarHBondContact OD2-N 2.92Å; D205-R461 IonicContact OD1-CZ 3.92Å; D205-R461 IonicContact OD1-NE 3.86Å; D205-R461 PolarHBondContact OD1-NE 2.89Å; D205-R461 IonicContact OD1-NH2 3.98Å
206	V	95.2	Very high	93.3	Very high	16 Å²	16	34.7 Å²	34.7	10%	0.097	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139	-178.8	178.9	0	0	0	0	108.4	L208 P211 I214 R461 V470	V206-L208 PolarHBondContact O-N 2.62Å; V206-P211 HydrophobicContact CG1-CB 3.82Å; V206-P211 WeakPolarHBondContact CG1-O 3.3Å; V206-I214 HydrophobicContact CG2-CG1 4.23Å; V206-I214 HydrophobicContact CG2-CG2 4.23Å; V206-R461 HydrophobicContact CB-CB 4.25Å; V206-R461 HydrophobicContact CG2-CB 3.59Å; V206-R461 HydrophobicContact CG2-CG 4.08Å; V206-V470 HydrophobicContact CG2-CB 4.43Å; V206-V470 HydrophobicContact CG2-CG2 4.23Å
207	H	94.1	Very high	93.7	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.18	C	C	.	.			trans	-66.9	132	179.2	-177.9	-105.7	0	0	0	111.2	T209 N210 P211 Y213 Y249 H250 E254	H207-T209 PolarHBondContact CE1-OG1 3.18Å; H207-N210 WeakPolarHBondContact CB-O 3.37Å; H207-N210 WeakPolarHBondContact ND1-CB 3.41Å; H207-N210 PolarHBondContact ND1-N 3.44Å; H207-N210 PolarHBondContact ND1-O 2.79Å; H207-N210 CarbonylContact O-C 3.54Å; H207-P211 WeakPolarHBondContact O-CA 3.42Å; H207-Y213 PolarHBondContact N-O 3.1Å; H207-Y249 HydrophobicContact CB-CD1 4.02Å; H207-Y249 HydrophobicContact CB-CD2 4.02Å; H207-Y249 HydrophobicContact CB-CE1 4.25Å; H207-Y249 HydrophobicContact CB-CE2 4.26Å; H207-Y249 HydrophobicContact CB-CG 3.9Å; H207-Y249 AromaticContact CD2-CD1 3.41Å; H207-Y249 VanDerWaalsContact CD2-CD1 3.41Å; H207-Y249 WeakPolarHBondContact CD2-CD1 3.37Å; H207-Y249 AromaticContact CD2-CE1 3.67Å; H207-H250 PolarHBondContact CD2-O 3.27Å; H207-H250 PolarHBondContact NE2-O 2.84Å; H207-E254 VanDerWaalsContact CE1-CG 3.47Å; H207-E254 WeakPolarHBondContact CE1-CG 3.24Å
208	L	88.4	Confident	93.9	Very high	106 Å²	106	26.6 Å²	26.6	56%	0.555	15%	0.146	S	C	*	.	S	Bend	trans	-69.7	-43.2	-166.2	-174.7	68	0	0	0	113.4	V206 P251 L424	V206-L208 PolarHBondContact O-N 2.62Å; L208-P251 HydrophobicContact CB-CB 4.41Å; L208-P251 HydrophobicContact CD2-CB 4.07Å; L208-L424 HydrophobicContact CD1-CD1 4.05Å
209	T	87.7	Confident	94.1	Very high	91 Å²	91	25.2 Å²	25.2	56%	0.558	14%	0.14	S	C	*	.	S	Bend	trans	-90.4	-20.1	-177.5	57.8	0	0	0	0	113.5	H207 P251	H207-T209 PolarHBondContact CE1-OG1 3.18Å; T209-P251 WeakPolarHBondContact CG2-O 3.33Å
210	N	91.9	Very high	94.5	Very high	41 Å²	41	22.8 Å²	22.8	22%	0.219	12%	0.124	C	C	.	.			trans	-136.6	84.5	178.9	-172.7	-7.7	0	0	0	109	H207 N212 Y213 E254	H207-N210 WeakPolarHBondContact CB-O 3.37Å; H207-N210 WeakPolarHBondContact ND1-CB 3.41Å; H207-N210 PolarHBondContact ND1-N 3.44Å; H207-N210 PolarHBondContact ND1-O 2.79Å; H207-N210 CarbonylContact O-C 3.54Å; N210-N212 PolarHBondContact O-N 3.34Å; N210-N212 WeakPolarHBondContact OD1-CB 3.43Å; N210-Y213 HydrophobicContact CB-CD2 4.34Å; N210-Y213 WeakPolarHBondContact ND2-CE2 3.42Å; N210-Y213 PolarHBondContact O-N 2.94Å; N210-E254 VanDerWaalsContact CB-OE1 3.28Å; N210-E254 WeakPolarHBondContact CB-OE1 3.08Å; N210-E254 PolarHBondContact ND2-OE1 3.04Å
211	P	90.8	Very high	94.7	Very high	15 Å²	15	26.6 Å²	26.6	10%	0.097	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	4.4	-169.7	34.9	-40.9	0	0	0	113.6	V206 H207 Y213 E464 F468	V206-P211 HydrophobicContact CG1-CB 3.82Å; V206-P211 WeakPolarHBondContact CG1-O 3.3Å; H207-P211 WeakPolarHBondContact O-CA 3.42Å; P211-Y213 VanDerWaalsContact C-N 3.3Å; P211-E464 HydrophobicContact CG-CB 3.99Å; P211-F468 HydrophobicContact CB-CZ 3.87Å; P211-F468 HydrophobicContact CG-CE1 4.42Å; P211-F468 HydrophobicContact CG-CZ 4.21Å
212	N	93.1	Very high	94.7	Very high	36 Å²	36	28.2 Å²	28.2	19%	0.193	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-27.1	171.3	-65.6	-15.7	0	0	0	111.5	N210 N227 K228 E229	N210-N212 PolarHBondContact O-N 3.34Å; N210-N212 WeakPolarHBondContact OD1-CB 3.43Å; N212-N227 WeakPolarHBondContact O-CA 3.42Å; N212-K228 WeakPolarHBondContact O-CB 3.5Å; N212-K228 PolarHBondContact O-N 2.94Å; N212-E229 HydrophobicContact CB-CB 4.33Å; N212-E229 PolarHBondContact ND2-OE2 3.43Å
213	Y	95.6	Very high	94.7	Very high	52 Å²	52	27 Å²	27	20%	0.204	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.9	175.6	-66.6	-72.3	0	0	0	111.6	H207 N210 P211 N227 V234	H207-Y213 PolarHBondContact N-O 3.1Å; N210-Y213 HydrophobicContact CB-CD2 4.34Å; N210-Y213 WeakPolarHBondContact ND2-CE2 3.42Å; N210-Y213 PolarHBondContact O-N 2.94Å; P211-Y213 VanDerWaalsContact C-N 3.3Å; Y213-N227 HydrophobicContact CD1-CB 4.2Å; Y213-N227 HydrophobicContact CE1-CB 4.09Å; Y213-V234 HydrophobicContact CD1-CG2 4.25Å; Y213-V234 HydrophobicContact CE1-CG2 3.98Å
214	I	96.7	Very high	94.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	135.1	-179	-51.9	165.8	0	0	0	107.9	M204 V206 V225 F226 K228 V470 L478 I480	M204-I214 HydrophobicContact CG-CG2 3.67Å; M204-I214 HydrophobicContact SD-CG2 3.76Å; V206-I214 HydrophobicContact CG2-CG1 4.23Å; V206-I214 HydrophobicContact CG2-CG2 4.23Å; I214-V225 WeakPolarHBondContact O-CA 3.39Å; I214-F226 HydrophobicContact CD1-CD1 4.27Å; I214-F226 PolarHBondContact N-O 2.92Å; I214-F226 PolarHBondContact O-N 3.04Å; I214-K228 HydrophobicContact CD1-CB 4.2Å; I214-V470 HydrophobicContact CD1-CG1 3.95Å; I214-V470 HydrophobicContact CD1-CG2 3.91Å; I214-V470 HydrophobicContact CG2-CG1 4.42Å; I214-L478 HydrophobicContact CD1-CD2 4.36Å; I214-L478 HydrophobicContact CG2-CD1 3.79Å; I214-I480 HydrophobicContact CD1-CD1 4.38Å
215	V	97.3	Very high	94.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.8	172.9	62.8	0	0	0	0	110.1	M204 D205 V223 V224 V225 V247 Y249 V257	M204-V215 CarbonylContact C-O 3.46Å; M204-V215 VanDerWaalsContact CA-O 3.23Å; M204-V215 WeakPolarHBondContact CA-O 3.45Å; M204-V215 WeakPolarHBondContact CG-O 3.41Å; D205-V215 HydrophobicContact CB-CG1 3.77Å; D205-V215 PolarHBondContact N-O 3.1Å; D205-V215 WeakPolarHBondContact O-CG1 3.32Å; D205-V215 PolarHBondContact O-N 3.41Å; V215-V223 HydrophobicContact CG2-CG1 3.36Å; V215-V224 CarbonylContact C-O 3.55Å; V215-V224 WeakPolarHBondContact CA-O 3.32Å; V215-V225 HydrophobicContact CG2-CG2 4.36Å; V215-V247 HydrophobicContact CG1-CB 4.11Å; V215-V247 HydrophobicContact CG1-CG2 3.97Å; V215-V247 HydrophobicContact CG2-CB 4.25Å; V215-V247 HydrophobicContact CG2-CG1 4.34Å; V215-V247 HydrophobicContact CG2-CG2 4.49Å; V215-Y249 HydrophobicContact CB-CD2 3.85Å; V215-Y249 HydrophobicContact CB-CE2 4.22Å; V215-Y249 HydrophobicContact CG1-CD2 3.72Å; V215-Y249 HydrophobicContact CG1-CG 4.34Å; V215-V257 HydrophobicContact CB-CG1 4.35Å; V215-V257 HydrophobicContact CG2-CG1 3.6Å
216	T	97.5	Very high	94.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138.7	175.3	58	0	0	0	0	111.4	L193 H194 I201 M204 V223 V224 L478	L193-T216 HydrophobicContact CD1-CG2 4.43Å; H194-T216 WeakPolarHBondContact NE2-CB 3.42Å; H194-T216 PolarHBondContact NE2-OG1 3.11Å; I201-T216 HydrophobicContact CD1-CG2 4.44Å; I201-T216 HydrophobicContact CG2-CG2 4.12Å; M204-T216 HydrophobicContact CB-CG2 4.33Å; M204-T216 HydrophobicContact CG-CG2 4.03Å; M204-T216 HydrophobicContact SD-CG2 4.41Å; T216-V223 CarbonylContact O-C 3.48Å; T216-V223 WeakPolarHBondContact O-CA 3.33Å; T216-V224 PolarHBondContact N-O 2.81Å; T216-V224 PolarHBondContact O-N 3.11Å; T216-L478 HydrophobicContact CG2-CD1 3.43Å; T216-L478 VanDerWaalsContact CG2-CD1 3.43Å
217	G	97	Very high	94.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.5	171.2	0	0	0	0	0	110.6	I201 T202 C203	I201-G217 CarbonylContact C-O 3.56Å; I201-G217 WeakPolarHBondContact CG2-O 3.33Å; T202-G217 PolarHBondContact N-O 2.98Å; T202-G217 PolarHBondContact OG1-O 3.34Å; T202-G217 VanDerWaalsContact OG1-O 3.09Å; C203-G217 PolarHBondContact O-N 2.89Å
218	G	95.6	Very high	94.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	156.9	-174.9	0	0	0	0	0	114.8	H194 D220 K221 N222 V244	H194-G218 VanDerWaalsContact CE1-CA 3.43Å; H194-G218 WeakPolarHBondContact CE1-CA 3.46Å; H194-G218 PolarHBondContact CE1-N 2.93Å; H194-G218 WeakPolarHBondContact ND1-CA 3.35Å; G218-D220 WeakPolarHBondContact CA-OD1 3.4Å; G218-D220 PolarHBondContact O-N 2.98Å; G218-K221 PolarHBondContact O-N 3.3Å; G218-N222 PolarHBondContact N-O 3.41Å; G218-V244 PolarHBondContact O-N 2.88Å
219	N	94.9	Very high	94.9	Very high	45 Å²	45	29.7 Å²	29.7	24%	0.241	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20.7	164.1	-157.4	30.5	0	0	0	111.8	G200 T202 K221 R243	G200-N219 PolarHBondContact O-N 2.62Å; T202-N219 HydrophobicContact CG2-CB 4.23Å; N219-K221 PolarHBondContact O-N 2.97Å; N219-R243 WeakPolarHBondContact OD1-CB 3.4Å; N219-R243 WeakPolarHBondContact OD1-CD 3.46Å
220	D	94.8	Very high	95.2	Very high	12 Å²	12	28.9 Å²	28.9	6%	0.064	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	5.1	174.4	74.2	-13.9	0	0	0	114.9	H194 S195 M198 G218 N222	H194-D220 IonicContact CE1-OD1 3.67Å; H194-D220 IonicContact CG-OD1 2.8Å; H194-D220 IonicContact CG-OD2 3.15Å; H194-D220 IonicContact ND1-OD1 3.62Å; H194-D220 PolarHBondContact ND1-OD1 3.48Å; H194-D220 IonicContact ND1-OD2 3.41Å; H194-D220 PolarHBondContact ND1-OD2 2.89Å; S195-D220 PolarHBondContact N-OD2 2.73Å; M198-D220 HydrophobicContact CB-CB 4.33Å; M198-D220 HydrophobicContact CE-CB 4.43Å; G218-D220 WeakPolarHBondContact CA-OD1 3.4Å; G218-D220 PolarHBondContact O-N 2.98Å; D220-N222 VanDerWaalsContact CG-ND2 3.34Å; D220-N222 PolarHBondContact O-N 3.47Å; D220-N222 PolarHBondContact OD1-N 3.46Å; D220-N222 VanDerWaalsContact OD1-N 3.1Å; D220-N222 PolarHBondContact OD2-ND2 3.15Å
221	K	96	Very high	95.3	Very high	80 Å²	80	32.8 Å²	32.8	35%	0.348	16%	0.16	S	C	.	.	S	Bend	trans	75.3	-0.1	178	-39.8	165.4	-178	-167.2	0	114.5	G218 N219 H240 Q241 K242	G218-K221 PolarHBondContact O-N 3.3Å; N219-K221 PolarHBondContact O-N 2.97Å; K221-H240 HydrophobicContact CB-CB 4.4Å; K221-H240 WeakPolarHBondContact CB-O 3.31Å; K221-Q241 WeakPolarHBondContact CD-O 3.43Å; K221-Q241 WeakPolarHBondContact CE-O 3.47Å; K221-Q241 PolarHBondContact NZ-O 2.87Å; K221-K242 WeakPolarHBondContact CB-O 3.44Å
222	N	96.1	Very high	95.4	Very high	35 Å²	35	38.1 Å²	38.1	19%	0.187	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	151.8	179.6	-58.1	-43.5	0	0	0	110.1	H194 G218 D220 V224 I236	H194-N222 PolarHBondContact CE1-O 2.88Å; G218-N222 PolarHBondContact N-O 3.41Å; D220-N222 VanDerWaalsContact CG-ND2 3.34Å; D220-N222 PolarHBondContact O-N 3.47Å; D220-N222 PolarHBondContact OD1-N 3.46Å; D220-N222 VanDerWaalsContact OD1-N 3.1Å; D220-N222 PolarHBondContact OD2-ND2 3.15Å; N222-V224 HydrophobicContact CB-CG2 4.49Å; N222-I236 HydrophobicContact CB-CG2 4.26Å
223	V	97.3	Very high	95.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.7	163.7	179.8	0	0	0	0	106.8	V215 T216 L237 V244 V247 V257	V215-V223 HydrophobicContact CG2-CG1 3.36Å; T216-V223 CarbonylContact O-C 3.48Å; T216-V223 WeakPolarHBondContact O-CA 3.33Å; V223-L237 HydrophobicContact CB-CB 4.09Å; V223-L237 HydrophobicContact CB-CD1 4.32Å; V223-L237 HydrophobicContact CG1-CD1 4.1Å; V223-L237 PolarHBondContact N-O 3.03Å; V223-L237 WeakPolarHBondContact O-CB 3.46Å; V223-L237 PolarHBondContact O-N 2.95Å; V223-V244 HydrophobicContact CG2-CG1 4.13Å; V223-V244 HydrophobicContact CG2-CG2 3.82Å; V223-V247 HydrophobicContact CG1-CG1 4.09Å; V223-V247 HydrophobicContact CG2-CG1 4.28Å; V223-V257 HydrophobicContact CG1-CG1 4.13Å
224	V	97	Very high	95.5	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.1	-174.5	178	0	0	0	0	108.2	L193 V215 T216 N222 I233 A235 I236	L193-V224 HydrophobicContact CB-CG1 4.46Å; L193-V224 HydrophobicContact CD2-CG1 4.34Å; V215-V224 CarbonylContact C-O 3.55Å; V215-V224 WeakPolarHBondContact CA-O 3.32Å; T216-V224 PolarHBondContact N-O 2.81Å; T216-V224 PolarHBondContact O-N 3.11Å; N222-V224 HydrophobicContact CB-CG2 4.49Å; V224-I233 HydrophobicContact CG1-CG1 4.37Å; V224-I233 HydrophobicContact CG1-CG2 3.81Å; V224-A235 WeakPolarHBondContact CA-O 3.37Å; V224-I236 HydrophobicContact CG2-CG1 4.49Å; V224-I236 HydrophobicContact CG2-CG2 4.42Å
225	V	97.1	Very high	95.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.7	172.2	-175.6	0	0	0	0	107.5	I214 V215 V234 A235 L237 Y249 V257 V271	I214-V225 WeakPolarHBondContact O-CA 3.39Å; V215-V225 HydrophobicContact CG2-CG2 4.36Å; V225-V234 HydrophobicContact CB-CB 4.34Å; V225-V234 HydrophobicContact CG1-CB 4.15Å; V225-V234 PolarHBondContact O-N 2.78Å; V225-A235 HydrophobicContact CB-CB 4.32Å; V225-A235 PolarHBondContact N-O 2.84Å; V225-A235 PolarHBondContact O-N 3.45Å; V225-L237 HydrophobicContact CG2-CD1 4.11Å; V225-Y249 HydrophobicContact CG1-CE2 4.11Å; V225-V257 HydrophobicContact CG2-CG2 4.09Å; V225-V271 HydrophobicContact CB-CG1 4.19Å; V225-V271 HydrophobicContact CG1-CG1 4.13Å; V225-V271 HydrophobicContact CG2-CG1 4.12Å; V225-V271 HydrophobicContact CG2-CG2 4.08Å
226	F	96.5	Very high	95.4	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.013	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138	-175.3	176.8	-105.5	0	0	0	109.4	H190 L193 I214 K228 E231 E232 I233 L478	H190-F226 AromaticContact CD2-CE1 3.81Å; H190-F226 AromaticContact CD2-CZ 3.62Å; H190-F226 AromaticContact CE1-CZ 3.59Å; H190-F226 AromaticContact CG-CZ 3.88Å; H190-F226 AromaticContact ND1-CZ 3.85Å; H190-F226 AromaticContact NE2-CE1 3.79Å; H190-F226 AromaticContact NE2-CZ 3.43Å; H190-F226 WeakPolarHBondContact NE2-CZ 3.18Å; L193-F226 HydrophobicContact CD2-CB 4.25Å; L193-F226 HydrophobicContact CD2-CD2 3.62Å; L193-F226 HydrophobicContact CD2-CE2 4.23Å; L193-F226 HydrophobicContact CD2-CG 4.08Å; I214-F226 HydrophobicContact CD1-CD1 4.27Å; I214-F226 PolarHBondContact N-O 2.92Å; I214-F226 PolarHBondContact O-N 3.04Å; F226-K228 HydrophobicContact CE1-CB 4.42Å; F226-E231 VanDerWaalsContact CE2-C 3.42Å; F226-E231 WeakPolarHBondContact CE2-O 3.38Å; F226-E231 HydrophobicContact CZ-CB 4.33Å; F226-E232 VanDerWaalsContact CD2-O 3.3Å; F226-E232 WeakPolarHBondContact CD2-O 3.41Å; F226-I233 HydrophobicContact CD2-CG1 4.45Å; F226-L478 HydrophobicContact CD1-CD2 4.38Å; F226-L478 HydrophobicContact CE1-CD2 4.35Å
227	N	95.2	Very high	95.3	Very high	14 Å²	14	43.5 Å²	43.5	8%	0.075	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.4	171.4	-176.2	-11.5	0	0	0	108.7	N212 Y213 E229 T230 E231 E232 V234	N212-N227 WeakPolarHBondContact O-CA 3.42Å; Y213-N227 HydrophobicContact CD1-CB 4.2Å; Y213-N227 HydrophobicContact CE1-CB 4.09Å; N227-E229 VanDerWaalsContact C-N 3.35Å; N227-E229 WeakPolarHBondContact OD1-CB 3.44Å; N227-E229 PolarHBondContact OD1-N 2.91Å; N227-T230 WeakPolarHBondContact CB-OG1 3.39Å; N227-E231 VanDerWaalsContact O-CA 3.24Å; N227-E231 WeakPolarHBondContact O-CA 3.27Å; N227-E231 PolarHBondContact O-N 2.96Å; N227-E232 PolarHBondContact N-O 2.78Å; N227-E232 PolarHBondContact O-N 3.44Å; N227-V234 HydrophobicContact CB-CG2 3.7Å
228	K	93.4	Very high	95.2	Very high	53 Å²	53	50.5 Å²	50.5	23%	0.23	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-39.3	177.2	169.9	-170.1	170.2	-149.9	0	112.6	N212 I214 F226 E231 F468 I480	N212-K228 WeakPolarHBondContact O-CB 3.5Å; N212-K228 PolarHBondContact O-N 2.94Å; I214-K228 HydrophobicContact CD1-CB 4.2Å; F226-K228 HydrophobicContact CE1-CB 4.42Å; K228-E231 WeakPolarHBondContact O-CG 3.2Å; K228-E231 PolarHBondContact O-N 3.24Å; K228-F468 HydrophobicContact CD-CD2 4.42Å; K228-F468 HydrophobicContact CD-CE1 4.5Å; K228-F468 HydrophobicContact CD-CE2 3.99Å; K228-F468 HydrophobicContact CD-CZ 4.02Å; K228-F468 VanDerWaalsContact NZ-CE1 3.26Å; K228-I480 HydrophobicContact CB-CD1 4.19Å; K228-I480 HydrophobicContact CD-CD1 3.91Å; K228-I480 HydrophobicContact CD-CG2 4.48Å; K228-I480 HydrophobicContact CG-CD1 3.62Å
229	E	91.9	Very high	95	Very high	146 Å²	146	52.7 Å²	52.7	68%	0.682	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-39.4	-172.2	-174.2	175.5	-170.1	0	0	111.8	N212 N227	N212-E229 HydrophobicContact CB-CB 4.33Å; N212-E229 PolarHBondContact ND2-OE2 3.43Å; N227-E229 VanDerWaalsContact C-N 3.35Å; N227-E229 WeakPolarHBondContact OD1-CB 3.44Å; N227-E229 PolarHBondContact OD1-N 2.91Å
230	T	93.5	Very high	95	Very high	73 Å²	73	51 Å²	51	45%	0.448	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.4	175.6	61.8	0	0	0	0	113	N227 E232	N227-T230 WeakPolarHBondContact CB-OG1 3.39Å; T230-E232 PolarHBondContact O-N 3.06Å
231	E	92.9	Very high	95	Very high	123 Å²	123	57.1 Å²	57.1	58%	0.575	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	31.6	-171	-59.3	-169.3	166.3	0	0	114.2	F226 N227 K228	F226-E231 VanDerWaalsContact CE2-C 3.42Å; F226-E231 WeakPolarHBondContact CE2-O 3.38Å; F226-E231 HydrophobicContact CZ-CB 4.33Å; N227-E231 VanDerWaalsContact O-CA 3.24Å; N227-E231 WeakPolarHBondContact O-CA 3.27Å; N227-E231 PolarHBondContact O-N 2.96Å; K228-E231 WeakPolarHBondContact O-CG 3.2Å; K228-E231 PolarHBondContact O-N 3.24Å
232	E	94.1	Very high	95	Very high	127 Å²	127	59 Å²	59	59%	0.593	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	150.9	-175.3	-74.4	178.6	172.2	0	0	113.2	F226 N227 T230 V234	F226-E232 VanDerWaalsContact CD2-O 3.3Å; F226-E232 WeakPolarHBondContact CD2-O 3.41Å; N227-E232 PolarHBondContact N-O 2.78Å; N227-E232 PolarHBondContact O-N 3.44Å; T230-E232 PolarHBondContact O-N 3.06Å; E232-V234 PolarHBondContact O-N 3.29Å
233	I	95	Very high	95	Very high	74 Å²	74	63.5 Å²	63.5	38%	0.379	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113	169.5	-61.1	173	0	0	0	108.5	L193 V224 F226 I236	L193-I233 HydrophobicContact CD2-CD1 4.09Å; L193-I233 HydrophobicContact CD2-CG1 3.81Å; V224-I233 HydrophobicContact CG1-CG1 4.37Å; V224-I233 HydrophobicContact CG1-CG2 3.81Å; F226-I233 HydrophobicContact CD2-CG1 4.45Å; I233-I236 HydrophobicContact CG2-CD1 4.31Å; I233-I236 HydrophobicContact CG2-CG1 3.7Å
234	V	95.4	Very high	95	Very high	58 Å²	58	63.5 Å²	63.5	35%	0.352	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-44.1	178.4	-178	0	0	0	0	110.7	Y213 V225 N227 E232 V271 Q274	Y213-V234 HydrophobicContact CD1-CG2 4.25Å; Y213-V234 HydrophobicContact CE1-CG2 3.98Å; V225-V234 HydrophobicContact CB-CB 4.34Å; V225-V234 HydrophobicContact CG1-CB 4.15Å; V225-V234 PolarHBondContact O-N 2.78Å; N227-V234 HydrophobicContact CB-CG2 3.7Å; E232-V234 PolarHBondContact O-N 3.29Å; V234-V271 HydrophobicContact CG1-CG1 3.94Å; V234-Q274 PolarHBondContact O-NE2 2.99Å
235	A	95.9	Very high	95	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	146.5	-177.7	0	0	0	0	0	112.6	V224 V225 L237 V271 Q274	V224-A235 WeakPolarHBondContact CA-O 3.37Å; V225-A235 HydrophobicContact CB-CB 4.32Å; V225-A235 PolarHBondContact N-O 2.84Å; V225-A235 PolarHBondContact O-N 3.45Å; A235-L237 HydrophobicContact CB-CD2 4.29Å; A235-L237 HydrophobicContact CB-CG 4.45Å; A235-V271 HydrophobicContact CB-CG1 3.85Å; A235-Q274 HydrophobicContact CB-CG 3.95Å
236	I	95.9	Very high	95	Very high	68 Å²	68	67.4 Å²	67.4	35%	0.349	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	103.6	168.2	-55.7	177.1	0	0	0	107.8	N222 V224 I233 K238	N222-I236 HydrophobicContact CB-CG2 4.26Å; V224-I236 HydrophobicContact CG2-CG1 4.49Å; V224-I236 HydrophobicContact CG2-CG2 4.42Å; I233-I236 HydrophobicContact CG2-CD1 4.31Å; I233-I236 HydrophobicContact CG2-CG1 3.7Å; I236-K238 HydrophobicContact CG2-CG 4.17Å
237	L	96.2	Very high	95	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	110.7	-175.4	-55.9	169	0	0	0	109.2	V223 V225 A235 V257 W269 Q274	V223-L237 HydrophobicContact CB-CB 4.09Å; V223-L237 HydrophobicContact CB-CD1 4.32Å; V223-L237 HydrophobicContact CG1-CD1 4.1Å; V223-L237 PolarHBondContact N-O 3.03Å; V223-L237 WeakPolarHBondContact O-CB 3.46Å; V223-L237 PolarHBondContact O-N 2.95Å; V225-L237 HydrophobicContact CG2-CD1 4.11Å; A235-L237 HydrophobicContact CB-CD2 4.29Å; A235-L237 HydrophobicContact CB-CG 4.45Å; L237-V257 HydrophobicContact CD1-CB 4.49Å; L237-V257 HydrophobicContact CD1-CG1 4.35Å; L237-W269 HydrophobicContact CB-CD2 3.83Å; L237-W269 HydrophobicContact CB-CE3 3.75Å; L237-W269 HydrophobicContact CB-CG 4.39Å; L237-W269 HydrophobicContact CB-CH2 4.31Å; L237-W269 HydrophobicContact CB-CZ2 4.36Å; L237-W269 HydrophobicContact CB-CZ3 4Å; L237-W269 HydrophobicContact CD1-CB 3.69Å; L237-W269 HydrophobicContact CD1-CD2 4.01Å; L237-W269 HydrophobicContact CD1-CE3 4.47Å; L237-W269 HydrophobicContact CD1-CG 3.66Å; L237-W269 HydrophobicContact CD2-CB 4.24Å; L237-W269 HydrophobicContact CD2-CD2 4.29Å; L237-W269 HydrophobicContact CD2-CE3 3.92Å; L237-W269 HydrophobicContact CD2-CG 4.46Å; L237-W269 HydrophobicContact CG-CD2 4.26Å; L237-W269 HydrophobicContact CG-CE3 4.25Å; L237-W269 HydrophobicContact CG-CG 4.39Å; L237-Q274 HydrophobicContact CD2-CB 4.45Å
238	K	94.7	Very high	95.1	Very high	147 Å²	147	67 Å²	67	64%	0.639	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.2	-176.9	-58.9	-175.6	179.8	173.5	0	110.1	I236 W269	I236-K238 HydrophobicContact CG2-CG 4.17Å; K238-W269 WeakPolarHBondContact O-CH2 3.28Å
239	G	91.5	Very high	95.2	Very high	46 Å²	46	65 Å²	65	47%	0.474	32%	0.32	S	S	.	.			trans	173	-19.6	173.3	0	0	0	0	0	115.7
240	H	95.1	Very high	95.4	Very high	11 Å²	11	58.2 Å²	58.2	5%	0.051	29%	0.288	C	S	.	.			trans	-67.7	143	170.5	-77.1	-72.4	0	0	0	111.5	K221 S259 G261 D263 I265 N267	K221-H240 HydrophobicContact CB-CB 4.4Å; K221-H240 WeakPolarHBondContact CB-O 3.31Å; H240-S259 PolarHBondContact NE2-OG 3.12Å; H240-G261 PolarHBondContact CE1-N 2.9Å; H240-D263 VanDerWaalsContact CA-OD2 3.27Å; H240-D263 WeakPolarHBondContact CA-OD2 3.36Å; H240-D263 WeakPolarHBondContact CB-OD2 3.5Å; H240-D263 IonicContact CE1-OD1 3.74Å; H240-D263 IonicContact CG-OD2 3.99Å; H240-D263 IonicContact ND1-OD1 2.96Å; H240-D263 PolarHBondContact ND1-OD1 3.3Å; H240-D263 VanDerWaalsContact ND1-OD1 3.13Å; H240-D263 IonicContact ND1-OD2 3.77Å; H240-D263 PolarHBondContact ND1-OD2 3.41Å; H240-I265 PolarHBondContact CE1-O 3.13Å; H240-N267 PolarHBondContact CE1-ND2 3.33Å; H240-N267 PolarHBondContact NE2-ND2 3.18Å
241	Q	94.9	Very high	95.2	Very high	140 Å²	140	56.1 Å²	56.1	65%	0.654	28%	0.276	S	S	*	.	S	Bend	trans	-91.8	-20.3	179.8	-62.5	-174.3	2.5	0	0	112.5	K221 D263	K221-Q241 WeakPolarHBondContact CD-O 3.43Å; K221-Q241 WeakPolarHBondContact CE-O 3.47Å; K221-Q241 PolarHBondContact NZ-O 2.87Å; Q241-D263 HydrophobicContact CB-CB 4.25Å; Q241-D263 PolarHBondContact N-OD2 3.28Å
242	K	96.1	Very high	95	Very high	119 Å²	119	54.9 Å²	54.9	52%	0.517	28%	0.277	S	S	.	.	S	Bend	trans	-130.1	175.7	178	-64.3	179.9	-177.1	173.8	0	109.6	K221 A262 D263	K221-K242 WeakPolarHBondContact CB-O 3.44Å; K242-A262 HydrophobicContact CB-CB 3.98Å; K242-A262 HydrophobicContact CD-CB 4.28Å; K242-A262 WeakPolarHBondContact CD-O 3.1Å; K242-D263 HydrophobicContact CB-CB 4.17Å; K242-D263 HydrophobicContact CD-CB 4.36Å; K242-D263 HydrophobicContact CG-CB 4.24Å
243	R	96	Very high	94.9	Very high	129 Å²	129	51.5 Å²	51.5	49%	0.487	26%	0.261	S	S	.	.			trans	-54.4	145.2	179.3	68.6	179.8	-171.1	-171.3	1.7	112	N219 L245 G261 A262	N219-R243 WeakPolarHBondContact OD1-CB 3.4Å; N219-R243 WeakPolarHBondContact OD1-CD 3.46Å; R243-L245 HydrophobicContact CG-CD2 4.28Å; R243-G261 WeakPolarHBondContact O-CA 3.49Å; R243-A262 HydrophobicContact CG-CB 4.08Å; R243-A262 PolarHBondContact O-N 3.35Å
244	V	97.3	Very high	94.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	139.2	172.6	-173	0	0	0	0	108.4	T202 G218 V223 V247 S260	T202-V244 WeakPolarHBondContact CB-O 3.42Å; T202-V244 PolarHBondContact OG1-O 2.85Å; G218-V244 PolarHBondContact O-N 2.88Å; V223-V244 HydrophobicContact CG2-CG1 4.13Å; V223-V244 HydrophobicContact CG2-CG2 3.82Å; V244-V247 HydrophobicContact CG1-CG1 3.8Å; V244-S260 CarbonylContact C-O 3.46Å; V244-S260 WeakPolarHBondContact CG1-O 3.33Å
245	L	96.3	Very high	94.6	Very high	38 Å²	38	52.6 Å²	52.6	20%	0.199	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-39.9	-178.4	-68.6	178.9	0	0	0	112.4	R243 S260 A262 P286 V287	R243-L245 HydrophobicContact CG-CD2 4.28Å; L245-S260 PolarHBondContact N-O 3.36Å; L245-A262 HydrophobicContact CD1-CB 3.99Å; L245-A262 HydrophobicContact CG-CB 4.2Å; L245-P286 HydrophobicContact CD1-CB 4.18Å; L245-V287 WeakPolarHBondContact CD1-O 3.48Å
246	K	96.9	Very high	94.5	Very high	45 Å²	45	52.8 Å²	52.8	20%	0.196	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	147.5	175.3	-154.3	70.7	173.7	-179.3	0	109.9	C203 S259 S260 D419	C203-K246 VanDerWaalsContact SG-CA 3.55Å; K246-S259 CarbonylContact O-C 3.59Å; K246-S259 WeakPolarHBondContact O-CA 3.04Å; K246-S260 WeakPolarHBondContact CB-OG 3.24Å; K246-S260 PolarHBondContact N-O 3.2Å; K246-S260 PolarHBondContact N-OG 3.12Å; K246-S260 PolarHBondContact O-N 2.9Å; K246-S260 PolarHBondContact O-OG 3.46Å; K246-D419 IonicContact NZ-OD1 3.67Å
247	V	97.3	Very high	94.6	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.1	170.2	-68.7	0	0	0	0	108.4	C203 D205 V215 V223 V244 I258	C203-V247 HydrophobicContact CB-CG2 4.27Å; D205-V247 HydrophobicContact CB-CG2 4.3Å; V215-V247 HydrophobicContact CG1-CB 4.11Å; V215-V247 HydrophobicContact CG1-CG2 3.97Å; V215-V247 HydrophobicContact CG2-CB 4.25Å; V215-V247 HydrophobicContact CG2-CG1 4.34Å; V215-V247 HydrophobicContact CG2-CG2 4.49Å; V223-V247 HydrophobicContact CG1-CG1 4.09Å; V223-V247 HydrophobicContact CG2-CG1 4.28Å; V244-V247 HydrophobicContact CG1-CG1 3.8Å; V247-I258 CarbonylContact C-O 3.55Å; V247-I258 VanDerWaalsContact CA-O 3.31Å; V247-I258 WeakPolarHBondContact CA-O 3.33Å
248	A	96.6	Very high	94.7	Very high	8 Å²	8	49.5 Å²	49.5	7%	0.066	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	129.9	172.7	0	0	0	0	0	108.8	D205 I258 I290 I292	D205-A248 WeakPolarHBondContact OD2-CA 3.4Å; A248-I258 PolarHBondContact N-O 2.98Å; A248-I258 PolarHBondContact O-N 3.28Å; A248-I290 HydrophobicContact CB-CG2 4.12Å; A248-I292 HydrophobicContact CB-CD1 3.78Å; A248-I292 HydrophobicContact CB-CG1 3.93Å
249	Y	95.7	Very high	94.8	Very high	10 Å²	10	42.5 Å²	42.5	4%	0.039	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	135.5	172.3	-139.2	-55.4	0	0	0	108.7	D205 H207 V215 V225 E254 M256 V257 I292	D205-Y249 PolarHBondContact OD2-N 2.92Å; H207-Y249 HydrophobicContact CB-CD1 4.02Å; H207-Y249 HydrophobicContact CB-CD2 4.02Å; H207-Y249 HydrophobicContact CB-CE1 4.25Å; H207-Y249 HydrophobicContact CB-CE2 4.26Å; H207-Y249 HydrophobicContact CB-CG 3.9Å; H207-Y249 AromaticContact CD2-CD1 3.41Å; H207-Y249 VanDerWaalsContact CD2-CD1 3.41Å; H207-Y249 WeakPolarHBondContact CD2-CD1 3.37Å; H207-Y249 AromaticContact CD2-CE1 3.67Å; V215-Y249 HydrophobicContact CB-CD2 3.85Å; V215-Y249 HydrophobicContact CB-CE2 4.22Å; V215-Y249 HydrophobicContact CG1-CD2 3.72Å; V215-Y249 HydrophobicContact CG1-CG 4.34Å; V225-Y249 HydrophobicContact CG1-CE2 4.11Å; Y249-E254 WeakPolarHBondContact CE1-O 3.34Å; Y249-E254 PolarHBondContact OH-O 2.76Å; Y249-M256 WeakPolarHBondContact CD1-O 3.37Å; Y249-V257 HydrophobicContact CD1-CG2 3.94Å; Y249-V257 HydrophobicContact CD2-CG2 4.06Å; Y249-V257 HydrophobicContact CE1-CG2 3.75Å; Y249-V257 HydrophobicContact CE2-CG2 3.87Å; Y249-V257 HydrophobicContact CG-CG2 4.1Å; Y249-I292 WeakPolarHBondContact O-CD1 3.24Å
250	H	95.9	Very high	95	Very high	3 Å²	3	40.3 Å²	40.3	1%	0.014	19%	0.194	C	C	.	.			trans	-60.1	136.5	174.5	-172.9	-89.9	0	0	0	110.4	H207 T252 E253 M256 G296	H207-H250 PolarHBondContact CD2-O 3.27Å; H207-H250 PolarHBondContact NE2-O 2.84Å; H250-T252 VanDerWaalsContact C-N 3.3Å; H250-T252 PolarHBondContact CE1-OG1 3.09Å; H250-T252 PolarHBondContact ND1-N 3.4Å; H250-T252 PolarHBondContact O-N 3.44Å; H250-E253 HydrophobicContact CB-CB 4.44Å; H250-E253 VanDerWaalsContact ND1-CB 3.31Å; H250-E253 WeakPolarHBondContact ND1-CB 3.37Å; H250-E253 PolarHBondContact ND1-N 3.17Å; H250-M256 HydrophobicContact CB-CB 3.74Å; H250-M256 HydrophobicContact CB-CG 4.09Å; H250-M256 WeakPolarHBondContact CB-O 3.46Å; H250-M256 HydrophobicContact CB-SD 4.4Å; H250-M256 PolarHBondContact N-O 2.8Å; H250-G296 PolarHBondContact CD2-O 3.21Å; H250-G296 VanDerWaalsContact CD2-O 3.31Å; H250-G296 VanDerWaalsContact NE2-CA 3.32Å; H250-G296 WeakPolarHBondContact NE2-CA 3.35Å; H250-G296 PolarHBondContact NE2-O 2.95Å
251	P	89.8	Confident	95	Very high	30 Å²	30	39.8 Å²	39.8	20%	0.195	19%	0.192	C	C	.	.	S	Bend	trans	-69.2	-22.2	-169	24.3	-35.2	0	0	0	115.1	L208 T209	L208-P251 HydrophobicContact CB-CB 4.41Å; L208-P251 HydrophobicContact CD2-CB 4.07Å; T209-P251 WeakPolarHBondContact CG2-O 3.33Å
252	T	88.5	Confident	95	Very high	96 Å²	96	33.9 Å²	33.9	59%	0.589	17%	0.167	S	C	*	.	S	Bend	trans	-130	-13.6	-175.1	62.6	0	0	0	0	114.7	H250	H250-T252 VanDerWaalsContact C-N 3.3Å; H250-T252 PolarHBondContact CE1-OG1 3.09Å; H250-T252 PolarHBondContact ND1-N 3.4Å; H250-T252 PolarHBondContact O-N 3.44Å
253	E	91.6	Very high	94.9	Very high	56 Å²	56	29.2 Å²	29.2	26%	0.262	15%	0.147	S	C	.	.			trans	-113.3	106.5	-174.2	-66.7	-176	-168.1	0	0	107	H250 D255 M256 R314	H250-E253 HydrophobicContact CB-CB 4.44Å; H250-E253 VanDerWaalsContact ND1-CB 3.31Å; H250-E253 WeakPolarHBondContact ND1-CB 3.37Å; H250-E253 PolarHBondContact ND1-N 3.17Å; E253-D255 PolarHBondContact O-N 3.43Å; E253-M256 HydrophobicContact CB-CB 4.15Å; E253-M256 PolarHBondContact O-N 3.04Å; E253-M256 VanDerWaalsContact OE2-CE 3.32Å; E253-M256 WeakPolarHBondContact OE2-CE 3.35Å; E253-R314 IonicContact OE1-CZ 3.4Å; E253-R314 IonicContact OE1-NH2 3.45Å; E253-R314 PolarHBondContact OE1-NH2 2.86Å
254	E	90.6	Very high	94.8	Very high	82 Å²	82	23.9 Å²	23.9	38%	0.383	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.4	-178.2	-65.5	-176.4	168.3	0	0	112.6	H207 N210 Y249 M256	H207-E254 VanDerWaalsContact CE1-CG 3.47Å; H207-E254 WeakPolarHBondContact CE1-CG 3.24Å; N210-E254 VanDerWaalsContact CB-OE1 3.28Å; N210-E254 WeakPolarHBondContact CB-OE1 3.08Å; N210-E254 PolarHBondContact ND2-OE1 3.04Å; Y249-E254 WeakPolarHBondContact CE1-O 3.34Å; Y249-E254 PolarHBondContact OH-O 2.76Å; E254-M256 VanDerWaalsContact C-N 3.29Å; E254-M256 PolarHBondContact O-N 3.32Å
255	D	93.8	Very high	94.8	Very high	73 Å²	73	25 Å²	25	39%	0.39	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-2.4	179.5	-167.5	46.2	0	0	0	113.6	E253 S270 V271 G272	E253-D255 PolarHBondContact O-N 3.43Å; D255-S270 CarbonylContact O-C 3.58Å; D255-S270 VanDerWaalsContact O-CA 3.26Å; D255-S270 WeakPolarHBondContact O-CA 3.12Å; D255-S270 PolarHBondContact OD1-OG 3.32Å; D255-S270 PolarHBondContact OD2-OG 2.9Å; D255-V271 PolarHBondContact O-N 2.85Å; D255-V271 PolarHBondContact OD1-N 2.91Å; D255-G272 PolarHBondContact OD1-N 2.95Å
256	M	95.2	Very high	94.8	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.025	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.6	-170.2	-169.4	178.6	-70.4	0	0	112.9	Y249 H250 E253 E254 V268 I313	Y249-M256 WeakPolarHBondContact CD1-O 3.37Å; H250-M256 HydrophobicContact CB-CB 3.74Å; H250-M256 HydrophobicContact CB-CG 4.09Å; H250-M256 WeakPolarHBondContact CB-O 3.46Å; H250-M256 HydrophobicContact CB-SD 4.4Å; H250-M256 PolarHBondContact N-O 2.8Å; E253-M256 HydrophobicContact CB-CB 4.15Å; E253-M256 PolarHBondContact O-N 3.04Å; E253-M256 VanDerWaalsContact OE2-CE 3.32Å; E253-M256 WeakPolarHBondContact OE2-CE 3.35Å; E254-M256 VanDerWaalsContact C-N 3.29Å; E254-M256 PolarHBondContact O-N 3.32Å; M256-V268 HydrophobicContact CG-CG1 4.03Å; M256-V268 HydrophobicContact SD-CG1 4.17Å; M256-I313 HydrophobicContact CE-CG2 4.34Å; M256-I313 HydrophobicContact SD-CG2 3.38Å; M256-I313 WeakPolarHBondContact SD-CG2 3.41Å
257	V	96.9	Very high	94.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	143.1	179.1	167.5	0	0	0	0	109.4	V215 V223 V225 L237 Y249 W269 V271	V215-V257 HydrophobicContact CB-CG1 4.35Å; V215-V257 HydrophobicContact CG2-CG1 3.6Å; V223-V257 HydrophobicContact CG1-CG1 4.13Å; V225-V257 HydrophobicContact CG2-CG2 4.09Å; L237-V257 HydrophobicContact CD1-CB 4.49Å; L237-V257 HydrophobicContact CD1-CG1 4.35Å; Y249-V257 HydrophobicContact CD1-CG2 3.94Å; Y249-V257 HydrophobicContact CD2-CG2 4.06Å; Y249-V257 HydrophobicContact CE1-CG2 3.75Å; Y249-V257 HydrophobicContact CE2-CG2 3.87Å; Y249-V257 HydrophobicContact CG-CG2 4.1Å; V257-W269 HydrophobicContact CB-CB 4.4Å; V257-W269 PolarHBondContact N-O 3.15Å; V257-W269 WeakPolarHBondContact O-CB 3.48Å; V257-W269 PolarHBondContact O-N 3.45Å; V257-V271 HydrophobicContact CB-CG2 4.23Å; V257-V271 HydrophobicContact CG2-CG2 3.61Å
258	I	97.3	Very high	94.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.1	179.6	-49.9	172.6	0	0	0	110.3	V247 A248 I266 N267 V268 I290 I292 I299 I313	V247-I258 CarbonylContact C-O 3.55Å; V247-I258 VanDerWaalsContact CA-O 3.31Å; V247-I258 WeakPolarHBondContact CA-O 3.33Å; A248-I258 PolarHBondContact N-O 2.98Å; A248-I258 PolarHBondContact O-N 3.28Å; I258-I266 HydrophobicContact CG2-CG2 3.71Å; I258-N267 VanDerWaalsContact CA-O 3.31Å; I258-N267 WeakPolarHBondContact CA-O 3.48Å; I258-N267 WeakPolarHBondContact CG2-O 3.49Å; I258-V268 HydrophobicContact CG1-CG1 4.38Å; I258-V268 HydrophobicContact CG1-CG2 4.3Å; I258-V268 HydrophobicContact CG2-CG2 4.42Å; I258-I290 HydrophobicContact CG2-CD1 4.23Å; I258-I292 HydrophobicContact CD1-CD1 3.68Å; I258-I292 HydrophobicContact CD1-CG1 3.88Å; I258-I292 HydrophobicContact CG1-CD1 4.42Å; I258-I299 HydrophobicContact CB-CD1 4.26Å; I258-I299 HydrophobicContact CD1-CD1 3.89Å; I258-I299 HydrophobicContact CG2-CD1 3.36Å; I258-I313 HydrophobicContact CD1-CD1 3.64Å; I258-I313 HydrophobicContact CD1-CG1 3.93Å; I258-I313 HydrophobicContact CD1-CG2 4.01Å
259	S	97.6	Very high	94.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	142.8	178.8	64.3	0	0	0	0	112.8	H240 K246 I266 N267 W269	H240-S259 PolarHBondContact NE2-OG 3.12Å; K246-S259 CarbonylContact O-C 3.59Å; K246-S259 WeakPolarHBondContact O-CA 3.04Å; S259-I266 CarbonylContact O-C 3.6Å; S259-I266 VanDerWaalsContact O-CA 3.31Å; S259-I266 WeakPolarHBondContact O-CA 3.46Å; S259-N267 PolarHBondContact N-O 2.97Å; S259-N267 PolarHBondContact O-N 2.98Å; S259-W269 PolarHBondContact OG-NE1 2.95Å
260	S	96.3	Very high	94.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.3	166.7	46.9	0	0	0	0	111	V244 L245 K246 I265 V287 I290	V244-S260 CarbonylContact C-O 3.46Å; V244-S260 WeakPolarHBondContact CG1-O 3.33Å; L245-S260 PolarHBondContact N-O 3.36Å; K246-S260 WeakPolarHBondContact CB-OG 3.24Å; K246-S260 PolarHBondContact N-O 3.2Å; K246-S260 PolarHBondContact N-OG 3.12Å; K246-S260 PolarHBondContact O-N 2.9Å; K246-S260 PolarHBondContact O-OG 3.46Å; S260-I265 WeakPolarHBondContact CA-O 3.33Å; S260-V287 VanDerWaalsContact CB-CG1 3.5Å; S260-V287 WeakPolarHBondContact CB-O 3.34Å; S260-V287 PolarHBondContact OG-O 2.95Å; S260-I290 VanDerWaalsContact N-CD1 3.3Å; S260-I290 WeakPolarHBondContact OG-CD1 3.43Å
261	G	94.1	Very high	94.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	167	172.4	0	0	0	0	0	113.9	H240 R243 D263 S264 I265 V287	H240-G261 PolarHBondContact CE1-N 2.9Å; R243-G261 WeakPolarHBondContact O-CA 3.49Å; G261-D263 VanDerWaalsContact C-OD1 3.31Å; G261-D263 WeakPolarHBondContact CA-OD1 3.37Å; G261-D263 PolarHBondContact O-N 3.36Å; G261-D263 VanDerWaalsContact O-N 3.15Å; G261-S264 PolarHBondContact O-N 3.09Å; G261-I265 PolarHBondContact N-O 3.35Å; G261-I265 VanDerWaalsContact N-O 3.14Å; G261-V287 PolarHBondContact O-N 2.98Å
262	A	95.2	Very high	94.9	Very high	16 Å²	16	23.3 Å²	23.3	13%	0.132	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-2.8	167.7	0	0	0	0	0	113.1	K242 R243 L245 S264	K242-A262 HydrophobicContact CB-CB 3.98Å; K242-A262 HydrophobicContact CD-CB 4.28Å; K242-A262 WeakPolarHBondContact CD-O 3.1Å; R243-A262 HydrophobicContact CG-CB 4.08Å; R243-A262 PolarHBondContact O-N 3.35Å; L245-A262 HydrophobicContact CD1-CB 3.99Å; L245-A262 HydrophobicContact CG-CB 4.2Å; A262-S264 VanDerWaalsContact C-N 3.26Å
263	D	94.6	Very high	95.1	Very high	20 Å²	20	21.4 Å²	21.4	11%	0.107	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	2.6	171.5	55.7	2.7	0	0	0	113.3	H240 Q241 K242 G261 I265	H240-D263 VanDerWaalsContact CA-OD2 3.27Å; H240-D263 WeakPolarHBondContact CA-OD2 3.36Å; H240-D263 WeakPolarHBondContact CB-OD2 3.5Å; H240-D263 IonicContact CE1-OD1 3.74Å; H240-D263 IonicContact CG-OD2 3.99Å; H240-D263 IonicContact ND1-OD1 2.96Å; H240-D263 PolarHBondContact ND1-OD1 3.3Å; H240-D263 VanDerWaalsContact ND1-OD1 3.13Å; H240-D263 IonicContact ND1-OD2 3.77Å; H240-D263 PolarHBondContact ND1-OD2 3.41Å; Q241-D263 HydrophobicContact CB-CB 4.25Å; Q241-D263 PolarHBondContact N-OD2 3.28Å; K242-D263 HydrophobicContact CB-CB 4.17Å; K242-D263 HydrophobicContact CD-CB 4.36Å; K242-D263 HydrophobicContact CG-CB 4.24Å; G261-D263 VanDerWaalsContact C-OD1 3.31Å; G261-D263 WeakPolarHBondContact CA-OD1 3.37Å; G261-D263 PolarHBondContact O-N 3.36Å; G261-D263 VanDerWaalsContact O-N 3.15Å; D263-I265 PolarHBondContact O-N 2.82Å; D263-I265 PolarHBondContact OD1-N 3.41Å
264	S	94.4	Very high	95.1	Very high	18 Å²	18	23.7 Å²	23.7	13%	0.126	15%	0.149	C	C	.	.	S	Bend	trans	71.5	13.6	179.1	-33.8	0	0	0	0	114.1	G261 A262 H283 T284 T285	G261-S264 PolarHBondContact O-N 3.09Å; A262-S264 VanDerWaalsContact C-N 3.26Å; S264-H283 WeakPolarHBondContact CB-O 3.39Å; S264-T284 PolarHBondContact OG-O 2.86Å; S264-T285 WeakPolarHBondContact CB-O 3.34Å; S264-T285 PolarHBondContact OG-O 3.42Å
265	I	95.6	Very high	95.3	Very high	23 Å²	23	26.8 Å²	26.8	12%	0.118	16%	0.161	C	C	.	.			trans	-102.9	142.5	-178.2	-63.9	172.6	0	0	0	109.4	H240 S260 G261 D263 I279	H240-I265 PolarHBondContact CE1-O 3.13Å; S260-I265 WeakPolarHBondContact CA-O 3.33Å; G261-I265 PolarHBondContact N-O 3.35Å; G261-I265 VanDerWaalsContact N-O 3.14Å; D263-I265 PolarHBondContact O-N 2.82Å; D263-I265 PolarHBondContact OD1-N 3.41Å; I265-I279 HydrophobicContact CG2-CG2 3.51Å
266	I	96.9	Very high	95.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.2	165.5	-56.4	160.4	0	0	0	107.2	I258 S259 I280 V287 I290 I299 S301	I258-I266 HydrophobicContact CG2-CG2 3.71Å; S259-I266 CarbonylContact O-C 3.6Å; S259-I266 VanDerWaalsContact O-CA 3.31Å; S259-I266 WeakPolarHBondContact O-CA 3.46Å; I266-I280 HydrophobicContact CB-CB 4.15Å; I266-I280 PolarHBondContact N-O 2.67Å; I266-I280 VanDerWaalsContact N-O 3.09Å; I266-I280 PolarHBondContact O-N 3.49Å; I266-V287 HydrophobicContact CD1-CG1 4.29Å; I266-V287 HydrophobicContact CG1-CB 4.5Å; I266-V287 HydrophobicContact CG1-CG1 4.06Å; I266-V287 HydrophobicContact CG1-CG2 4.2Å; I266-I290 HydrophobicContact CG1-CD1 4.18Å; I266-I290 HydrophobicContact CG2-CD1 3.83Å; I266-I299 HydrophobicContact CG2-CD1 3.99Å; I266-S301 WeakPolarHBondContact CD1-OG 3.3Å
267	N	96.8	Very high	95.2	Very high	3 Å²	3	31 Å²	31	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.7	177.7	-80.8	-37.1	0	0	0	109.9	H240 I258 S259 W269 I279	H240-N267 PolarHBondContact CE1-ND2 3.33Å; H240-N267 PolarHBondContact NE2-ND2 3.18Å; I258-N267 VanDerWaalsContact CA-O 3.31Å; I258-N267 WeakPolarHBondContact CA-O 3.48Å; I258-N267 WeakPolarHBondContact CG2-O 3.49Å; S259-N267 PolarHBondContact N-O 2.97Å; S259-N267 PolarHBondContact O-N 2.98Å; N267-W269 HydrophobicContact CB-CD2 4.26Å; N267-W269 VanDerWaalsContact CB-CE2 3.44Å; N267-W269 HydrophobicContact CB-CZ2 3.62Å; N267-W269 VanDerWaalsContact CB-NE1 3.3Å; N267-W269 WeakPolarHBondContact ND2-CZ2 3.45Å; N267-I279 WeakPolarHBondContact OD1-CG1 3.43Å
268	V	97.1	Very high	95.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.1	166	-176.6	0	0	0	0	106.8	M256 I258 S276 R277 H278 I280 I313	M256-V268 HydrophobicContact CG-CG1 4.03Å; M256-V268 HydrophobicContact SD-CG1 4.17Å; I258-V268 HydrophobicContact CG1-CG1 4.38Å; I258-V268 HydrophobicContact CG1-CG2 4.3Å; I258-V268 HydrophobicContact CG2-CG2 4.42Å; V268-S276 CarbonylContact O-C 3.59Å; V268-R277 WeakPolarHBondContact O-CB 3.24Å; V268-R277 PolarHBondContact O-N 3.16Å; V268-H278 HydrophobicContact CB-CB 4.2Å; V268-H278 HydrophobicContact CG2-CB 4.4Å; V268-H278 PolarHBondContact N-O 2.95Å; V268-H278 PolarHBondContact O-N 3.02Å; V268-I280 HydrophobicContact CG2-CD1 4.05Å; V268-I313 HydrophobicContact CG1-CG2 3.82Å; V268-I313 HydrophobicContact CG2-CG2 4.19Å
269	W	96.9	Very high	95	Very high	2 Å²	2	37 Å²	37	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	145.5	-175.1	-57.1	94.8	0	0	0	111	L237 K238 V257 S259 N267 S276	L237-W269 HydrophobicContact CB-CD2 3.83Å; L237-W269 HydrophobicContact CB-CE3 3.75Å; L237-W269 HydrophobicContact CB-CG 4.39Å; L237-W269 HydrophobicContact CB-CH2 4.31Å; L237-W269 HydrophobicContact CB-CZ2 4.36Å; L237-W269 HydrophobicContact CB-CZ3 4Å; L237-W269 HydrophobicContact CD1-CB 3.69Å; L237-W269 HydrophobicContact CD1-CD2 4.01Å; L237-W269 HydrophobicContact CD1-CE3 4.47Å; L237-W269 HydrophobicContact CD1-CG 3.66Å; L237-W269 HydrophobicContact CD2-CB 4.24Å; L237-W269 HydrophobicContact CD2-CD2 4.29Å; L237-W269 HydrophobicContact CD2-CE3 3.92Å; L237-W269 HydrophobicContact CD2-CG 4.46Å; L237-W269 HydrophobicContact CG-CD2 4.26Å; L237-W269 HydrophobicContact CG-CE3 4.25Å; L237-W269 HydrophobicContact CG-CG 4.39Å; K238-W269 WeakPolarHBondContact O-CH2 3.28Å; V257-W269 HydrophobicContact CB-CB 4.4Å; V257-W269 PolarHBondContact N-O 3.15Å; V257-W269 WeakPolarHBondContact O-CB 3.48Å; V257-W269 PolarHBondContact O-N 3.45Å; S259-W269 PolarHBondContact OG-NE1 2.95Å; N267-W269 HydrophobicContact CB-CD2 4.26Å; N267-W269 VanDerWaalsContact CB-CE2 3.44Å; N267-W269 HydrophobicContact CB-CZ2 3.62Å; N267-W269 VanDerWaalsContact CB-NE1 3.3Å; N267-W269 WeakPolarHBondContact ND2-CZ2 3.45Å; W269-S276 WeakPolarHBondContact CH2-OG 2.94Å; W269-S276 WeakPolarHBondContact CZ3-OG 3.26Å
270	S	95.9	Very high	94.8	Very high	20 Å²	20	37.1 Å²	37.1	14%	0.14	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.5	157	165.1	0	0	0	0	108	D255 A273 Q274 K275	D255-S270 CarbonylContact O-C 3.58Å; D255-S270 VanDerWaalsContact O-CA 3.26Å; D255-S270 WeakPolarHBondContact O-CA 3.12Å; D255-S270 PolarHBondContact OD1-OG 3.32Å; D255-S270 PolarHBondContact OD2-OG 2.9Å; S270-A273 WeakPolarHBondContact OG-CB 3.18Å; S270-A273 PolarHBondContact OG-N 3.38Å; S270-Q274 WeakPolarHBondContact O-CA 3.36Å; S270-Q274 PolarHBondContact O-N 2.87Å; S270-K275 PolarHBondContact N-O 2.87Å; S270-K275 PolarHBondContact O-N 2.9Å
271	V	94.6	Very high	94.7	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.048	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-49	-173.1	178.1	0	0	0	0	110.6	V225 V234 A235 D255 V257 Q274	V225-V271 HydrophobicContact CB-CG1 4.19Å; V225-V271 HydrophobicContact CG1-CG1 4.13Å; V225-V271 HydrophobicContact CG2-CG1 4.12Å; V225-V271 HydrophobicContact CG2-CG2 4.08Å; V234-V271 HydrophobicContact CG1-CG1 3.94Å; A235-V271 HydrophobicContact CB-CG1 3.85Å; D255-V271 PolarHBondContact O-N 2.85Å; D255-V271 PolarHBondContact OD1-N 2.91Å; V257-V271 HydrophobicContact CB-CG2 4.23Å; V257-V271 HydrophobicContact CG2-CG2 3.61Å; V271-Q274 VanDerWaalsContact O-CG 3.23Å; V271-Q274 WeakPolarHBondContact O-CG 3.5Å; V271-Q274 PolarHBondContact O-N 3.01Å; V271-Q274 VanDerWaalsContact O-N 3.13Å
272	G	92.4	Very high	94.6	Very high	68 Å²	68	45.9 Å²	45.9	70%	0.701	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-35.3	178.8	0	0	0	0	0	112.9	D255 Q274	D255-G272 PolarHBondContact OD1-N 2.95Å; G272-Q274 VanDerWaalsContact C-N 3.31Å
273	A	92.9	Very high	94.4	Very high	55 Å²	55	45.7 Å²	45.7	46%	0.455	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.6	173.8	0	0	0	0	0	113.5	S270 K275	S270-A273 WeakPolarHBondContact OG-CB 3.18Å; S270-A273 PolarHBondContact OG-N 3.38Å; A273-K275 HydrophobicContact CB-CB 4.49Å; A273-K275 WeakPolarHBondContact O-CG 3.36Å; A273-K275 PolarHBondContact O-N 2.93Å
274	Q	92.6	Very high	94.2	Very high	104 Å²	104	50.6 Å²	50.6	49%	0.486	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	39.3	-172.4	-59.9	-170.5	-2.2	0	0	113.7	V234 A235 L237 S270 V271 G272	V234-Q274 PolarHBondContact O-NE2 2.99Å; A235-Q274 HydrophobicContact CB-CG 3.95Å; L237-Q274 HydrophobicContact CD2-CB 4.45Å; S270-Q274 WeakPolarHBondContact O-CA 3.36Å; S270-Q274 PolarHBondContact O-N 2.87Å; V271-Q274 VanDerWaalsContact O-CG 3.23Å; V271-Q274 WeakPolarHBondContact O-CG 3.5Å; V271-Q274 PolarHBondContact O-N 3.01Å; V271-Q274 VanDerWaalsContact O-N 3.13Å; G272-Q274 VanDerWaalsContact C-N 3.31Å
275	K	93.5	Very high	94.2	Very high	147 Å²	147	51.8 Å²	51.8	64%	0.639	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	152	-175.4	-76	175.7	-175.6	178.5	0	111.3	S270 A273 R277	S270-K275 PolarHBondContact N-O 2.87Å; S270-K275 PolarHBondContact O-N 2.9Å; A273-K275 HydrophobicContact CB-CB 4.49Å; A273-K275 WeakPolarHBondContact O-CG 3.36Å; A273-K275 PolarHBondContact O-N 2.93Å; K275-R277 PolarHBondContact O-N 3.42Å
276	S	93.6	Very high	94.1	Very high	41 Å²	41	52.8 Å²	52.8	29%	0.287	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	115.9	166.7	-53.9	0	0	0	0	108.9	V268 W269	V268-S276 CarbonylContact O-C 3.59Å; W269-S276 WeakPolarHBondContact CH2-OG 2.94Å; W269-S276 WeakPolarHBondContact CZ3-OG 3.26Å
277	R	93.8	Very high	94.1	Very high	126 Å²	126	52.8 Å²	52.8	48%	0.475	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-46.9	171.6	-169.1	-174.7	176.9	160.8	0.8	110.1	V268 K275	V268-R277 WeakPolarHBondContact O-CB 3.24Å; V268-R277 PolarHBondContact O-N 3.16Å; K275-R277 PolarHBondContact O-N 3.42Å
278	H	94.6	Very high	93.9	Very high	48 Å²	48	54.2 Å²	54.2	22%	0.222	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.7	175.4	-61.2	-72.3	0	0	0	111.1	V268 I313 R314 S315	V268-H278 HydrophobicContact CB-CB 4.2Å; V268-H278 HydrophobicContact CG2-CB 4.4Å; V268-H278 PolarHBondContact N-O 2.95Å; V268-H278 PolarHBondContact O-N 3.02Å; H278-I313 PolarHBondContact CD2-O 3.2Å; H278-R314 PolarHBondContact NE2-O 2.92Å; H278-S315 PolarHBondContact ND1-O 2.88Å
279	I	95.2	Very high	93.8	Very high	78 Å²	78	54.3 Å²	54.3	40%	0.4	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	105.8	174.5	-53.6	-171.2	0	0	0	107.4	I265 N267	I265-I279 HydrophobicContact CG2-CG2 3.51Å; N267-I279 WeakPolarHBondContact OD1-CG1 3.43Å
280	I	95	Very high	93.8	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.6	-176.9	-52.6	173.5	0	0	0	108.7	I266 V268 A282 I299	I266-I280 HydrophobicContact CB-CB 4.15Å; I266-I280 PolarHBondContact N-O 2.67Å; I266-I280 VanDerWaalsContact N-O 3.09Å; I266-I280 PolarHBondContact O-N 3.49Å; V268-I280 HydrophobicContact CG2-CD1 4.05Å; I280-A282 HydrophobicContact CG2-CB 4.22Å; I280-I299 HydrophobicContact CD1-CG2 4.21Å
281	R	93.6	Very high	93.8	Very high	178 Å²	178	54.4 Å²	54.4	67%	0.672	29%	0.294	S	S	*	.			trans	-108.2	65.1	178.3	-66.6	-173.4	177.6	84.2	-0.4	111
282	A	90.7	Very high	93.8	Very high	5 Å²	5	55.1 Å²	55.1	4%	0.041	30%	0.297	C	S	.	.			trans	-78	-24.9	-178.6	0	0	0	0	0	113.7	I280 A309 L318	I280-A282 HydrophobicContact CG2-CB 4.22Å; A282-A309 HydrophobicContact CB-CB 3.7Å; A282-L318 HydrophobicContact CB-CD1 3.94Å
283	H	91.8	Very high	93.9	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.056	26%	0.264	C	S	.	.			trans	-128	149	-171.3	-60.3	-76	0	0	0	111.8	S264 V287 S301 S303 K307	S264-H283 WeakPolarHBondContact CB-O 3.39Å; H283-V287 HydrophobicContact CB-CG2 3.92Å; H283-S301 PolarHBondContact NE2-O 3.04Å; H283-S301 PolarHBondContact NE2-OG 2.8Å; H283-S303 WeakPolarHBondContact ND1-CB 3.05Å; H283-K307 PolarHBondContact CE1-O 2.84Å; H283-K307 VanDerWaalsContact CE1-O 3.25Å
284	T	91.3	Very high	93.6	Very high	123 Å²	123	51 Å²	51	76%	0.755	26%	0.256	S	S	*	.	S	Bend	trans	-95	-9.7	172.9	51.9	0	0	0	0	112.7	S264	S264-T284 PolarHBondContact OG-O 2.86Å
285	T	93.1	Very high	93.4	Very high	43 Å²	43	46.8 Å²	46.8	26%	0.264	24%	0.238	S	C	.	.	S	Bend	trans	-118.6	161.3	-179.5	44.6	0	0	0	0	110.5	S264 V287 S303 G305	S264-T285 WeakPolarHBondContact CB-O 3.34Å; S264-T285 PolarHBondContact OG-O 3.42Å; T285-V287 PolarHBondContact O-N 2.89Å; T285-S303 VanDerWaalsContact C-OG 3.26Å; T285-S303 WeakPolarHBondContact CB-OG 3.28Å; T285-S303 PolarHBondContact O-OG 2.9Å; T285-S303 PolarHBondContact OG1-OG 3.08Å; T285-G305 WeakPolarHBondContact OG1-CA 3.06Å; T285-G305 PolarHBondContact OG1-N 3.38Å; T285-G305 VanDerWaalsContact OG1-N 3.15Å
286	P	94.2	Very high	93.2	Very high	44 Å²	44	39.9 Å²	39.9	29%	0.286	21%	0.208	S	C	.	.			trans	-46.6	132.4	-179.9	-32.4	37.2	0	0	0	113.3	L245 T288 S303 S304	L245-P286 HydrophobicContact CD1-CB 4.18Å; P286-T288 PolarHBondContact O-N 3.43Å; P286-S303 WeakPolarHBondContact O-CA 3.19Å; P286-S303 PolarHBondContact O-OG 2.95Å; P286-S304 PolarHBondContact O-N 3.39Å
287	V	95.5	Very high	93	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	103.1	178.5	179.1	0	0	0	0	108.3	L245 S260 G261 I266 H283 T285 I290 V302	L245-V287 WeakPolarHBondContact CD1-O 3.48Å; S260-V287 VanDerWaalsContact CB-CG1 3.5Å; S260-V287 WeakPolarHBondContact CB-O 3.34Å; S260-V287 PolarHBondContact OG-O 2.95Å; G261-V287 PolarHBondContact O-N 2.98Å; I266-V287 HydrophobicContact CD1-CG1 4.29Å; I266-V287 HydrophobicContact CG1-CB 4.5Å; I266-V287 HydrophobicContact CG1-CG1 4.06Å; I266-V287 HydrophobicContact CG1-CG2 4.2Å; H283-V287 HydrophobicContact CB-CG2 3.92Å; T285-V287 PolarHBondContact O-N 2.89Å; V287-I290 HydrophobicContact CG1-CG1 4.13Å; V287-V302 CarbonylContact C-O 3.57Å; V287-V302 WeakPolarHBondContact CA-O 3.46Å; V287-V302 WeakPolarHBondContact CG1-O 3.1Å
288	T	94.3	Very high	93	Very high	34 Å²	34	35.5 Å²	35.5	21%	0.209	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-24.8	-170	50.2	0	0	0	0	112.8	P286 V302 M332 T333	P286-T288 PolarHBondContact O-N 3.43Å; T288-V302 PolarHBondContact N-O 2.98Å; T288-V302 PolarHBondContact OG1-O 3.1Å; T288-M332 WeakPolarHBondContact CB-O 3.43Å; T288-M332 PolarHBondContact OG1-O 2.98Å; T288-T333 WeakPolarHBondContact CB-O 3.38Å
289	G	94.2	Very high	93.1	Very high	2 Å²	2	33.2 Å²	33.2	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	148.2	179.6	0	0	0	0	0	112.8	S301 V302	G289-S301 WeakPolarHBondContact O-CA 3.46Å; G289-V302 PolarHBondContact N-O 2.76Å; G289-V302 PolarHBondContact O-N 3.48Å
290	I	95.9	Very high	93.1	Very high	8 Å²	8	29.5 Å²	29.5	4%	0.041	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143	174.2	-74.9	177.7	0	0	0	108	A248 I258 S260 I266 V287 I299 L300	A248-I290 HydrophobicContact CB-CG2 4.12Å; I258-I290 HydrophobicContact CG2-CD1 4.23Å; S260-I290 VanDerWaalsContact N-CD1 3.3Å; S260-I290 WeakPolarHBondContact OG-CD1 3.43Å; I266-I290 HydrophobicContact CG1-CD1 4.18Å; I266-I290 HydrophobicContact CG2-CD1 3.83Å; V287-I290 HydrophobicContact CG1-CG1 4.13Å; I290-I299 HydrophobicContact CB-CD1 4.4Å; I290-I299 HydrophobicContact CD1-CD1 4.23Å; I290-I299 HydrophobicContact CG1-CD1 4.33Å; I290-I299 HydrophobicContact CG2-CD1 3.3Å; I290-I299 HydrophobicContact CG2-CG1 3.74Å; I290-L300 CarbonylContact C-O 3.56Å; I290-L300 WeakPolarHBondContact CA-O 3.47Å
291	S	96.1	Very high	93.2	Very high	15 Å²	15	29.3 Å²	29.3	11%	0.105	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	133.4	167	-172.9	0	0	0	0	110.6	L300 F337	S291-L300 PolarHBondContact N-O 3.09Å; S291-L300 PolarHBondContact O-N 2.99Å; S291-F337 PolarHBondContact OG-N 3.37Å
292	I	95.2	Very high	93.2	Very high	23 Å²	23	20.9 Å²	20.9	12%	0.118	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	135.5	175.4	-58.5	176.4	0	0	0	108.3	A248 Y249 I258 I313	A248-I292 HydrophobicContact CB-CD1 3.78Å; A248-I292 HydrophobicContact CB-CG1 3.93Å; Y249-I292 WeakPolarHBondContact O-CD1 3.24Å; I258-I292 HydrophobicContact CD1-CD1 3.68Å; I258-I292 HydrophobicContact CD1-CG1 3.88Å; I258-I292 HydrophobicContact CG1-CD1 4.42Å; I292-I313 HydrophobicContact CG2-CD1 3.95Å
293	H	93.9	Very high	93.3	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	12%	0.124	C	C	.	.			trans	-67.6	149.9	174.9	-177.3	-97.8	0	0	0	110.4	L153 T295 G296 Y298 F337 G341	L153-H293 WeakPolarHBondContact CD2-CE1 3.32Å; H293-T295 WeakPolarHBondContact CE1-CG2 3.46Å; H293-T295 WeakPolarHBondContact ND1-CB 3.29Å; H293-T295 VanDerWaalsContact ND1-CG2 3.31Å; H293-T295 WeakPolarHBondContact ND1-CG2 3.23Å; H293-T295 PolarHBondContact ND1-N 2.98Å; H293-T295 PolarHBondContact ND1-OG1 2.96Å; H293-T295 PolarHBondContact O-N 3.02Å; H293-G296 PolarHBondContact O-N 3.4Å; H293-Y298 WeakPolarHBondContact CB-O 3.32Å; H293-Y298 PolarHBondContact N-O 2.9Å; H293-F337 HydrophobicContact CB-CD2 4.25Å; H293-F337 HydrophobicContact CB-CE2 3.93Å; H293-F337 HydrophobicContact CB-CZ 4.33Å; H293-F337 AromaticContact CD2-CE1 3.88Å; H293-G341 PolarHBondContact CD2-O 2.93Å; H293-G341 WeakPolarHBondContact NE2-CA 3.39Å; H293-G341 PolarHBondContact NE2-O 3.14Å
294	A	87.6	Confident	93.2	Very high	35 Å²	35	22.4 Å²	22.4	29%	0.289	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.1	-176.9	0	0	0	0	0	114.4	L160 G296	L160-A294 HydrophobicContact CD1-CB 3.36Å; A294-G296 VanDerWaalsContact C-N 3.33Å
295	T	87.5	Confident	92.7	Very high	17 Å²	17	17.6 Å²	17.6	10%	0.104	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-28.9	170	56.2	0	0	0	0	113.3	L153 K156 H293 D297 Y298	L153-T295 HydrophobicContact CD2-CG2 4.1Å; K156-T295 HydrophobicContact CB-CG2 4.12Å; K156-T295 HydrophobicContact CD-CG2 3.66Å; K156-T295 HydrophobicContact CG-CG2 4.04Å; K156-T295 PolarHBondContact NZ-O 3.33Å; H293-T295 WeakPolarHBondContact CE1-CG2 3.46Å; H293-T295 WeakPolarHBondContact ND1-CB 3.29Å; H293-T295 VanDerWaalsContact ND1-CG2 3.31Å; H293-T295 WeakPolarHBondContact ND1-CG2 3.23Å; H293-T295 PolarHBondContact ND1-N 2.98Å; H293-T295 PolarHBondContact ND1-OG1 2.96Å; H293-T295 PolarHBondContact O-N 3.02Å; T295-D297 VanDerWaalsContact C-N 3.3Å; T295-D297 PolarHBondContact OG1-N 2.81Å; T295-Y298 WeakPolarHBondContact OG1-CD2 3.19Å
296	G	89.5	Confident	92	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.01	12%	0.118	C	C	.	.	S	Bend	trans	91.1	-21.2	-168.1	0	0	0	0	0	113.6	H250 H293 A294 I313	H250-G296 PolarHBondContact CD2-O 3.21Å; H250-G296 VanDerWaalsContact CD2-O 3.31Å; H250-G296 VanDerWaalsContact NE2-CA 3.32Å; H250-G296 WeakPolarHBondContact NE2-CA 3.35Å; H250-G296 PolarHBondContact NE2-O 2.95Å; H293-G296 PolarHBondContact O-N 3.4Å; A294-G296 VanDerWaalsContact C-N 3.33Å; G296-I313 VanDerWaalsContact O-CD1 3.23Å; G296-I313 WeakPolarHBondContact O-CD1 3.35Å
297	D	90.4	Very high	91.7	Very high	41 Å²	41	19.6 Å²	19.6	22%	0.219	12%	0.115	C	C	.	.	S	Bend	trans	-89.9	-17.7	-169	-53.8	-57.4	0	0	0	114.3	T295 I313 R314	T295-D297 VanDerWaalsContact C-N 3.3Å; T295-D297 PolarHBondContact OG1-N 2.81Å; D297-I313 WeakPolarHBondContact O-CB 3.36Å; D297-I313 PolarHBondContact O-N 3.18Å; D297-R314 IonicContact OD1-CZ 3.76Å; D297-R314 IonicContact OD1-NE 3.33Å; D297-R314 PolarHBondContact OD1-NE 3.47Å; D297-R314 IonicContact OD1-NH2 2.93Å; D297-R314 PolarHBondContact OD1-NH2 2.65Å
298	Y	94.3	Very high	91.5	Very high	34 Å²	34	19.6 Å²	19.6	13%	0.133	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	153.5	-175.2	-51.6	-75.2	0	0	0	113.1	M149 L153 H293 T295 F310 S311 D312 I313 L319	M149-Y298 WeakPolarHBondContact CG-OH 3.35Å; M149-Y298 HydrophobicContact SD-CE1 3.78Å; L153-Y298 HydrophobicContact CD2-CD2 3.86Å; L153-Y298 HydrophobicContact CD2-CE2 3.86Å; H293-Y298 WeakPolarHBondContact CB-O 3.32Å; H293-Y298 PolarHBondContact N-O 2.9Å; T295-Y298 WeakPolarHBondContact OG1-CD2 3.19Å; Y298-F310 AromaticContact CD1-CE1 3.79Å; Y298-F310 HydrophobicContact CD1-CE1 3.79Å; Y298-F310 AromaticContact CD1-CZ 3.99Å; Y298-F310 HydrophobicContact CD1-CZ 3.99Å; Y298-F310 HydrophobicContact CD2-CE1 4.33Å; Y298-F310 AromaticContact CD2-CZ 3.9Å; Y298-F310 HydrophobicContact CD2-CZ 3.9Å; Y298-F310 HydrophobicContact CE1-CE1 4.47Å; Y298-F310 AromaticContact CG-CE1 3.72Å; Y298-F310 HydrophobicContact CG-CE1 3.72Å; Y298-F310 HydrophobicContact CG-CE2 4.27Å; Y298-F310 AromaticContact CG-CZ 3.41Å; Y298-F310 HydrophobicContact CG-CZ 3.41Å; Y298-F310 VanDerWaalsContact CG-CZ 3.41Å; Y298-S311 WeakPolarHBondContact CA-O 3.4Å; Y298-D312 HydrophobicContact CD1-CB 4.23Å; Y298-D312 HydrophobicContact CE1-CB 4.31Å; Y298-I313 VanDerWaalsContact C-CD1 3.42Å; Y298-I313 WeakPolarHBondContact O-CD1 3.4Å; Y298-L319 HydrophobicContact CD1-CD1 3.74Å; Y298-L319 HydrophobicContact CE1-CD1 3.79Å
299	I	95.4	Very high	91.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.2	177.5	-172.3	161.2	0	0	0	111.1	I258 I266 I280 I290 F310 S311 I313	I258-I299 HydrophobicContact CB-CD1 4.26Å; I258-I299 HydrophobicContact CD1-CD1 3.89Å; I258-I299 HydrophobicContact CG2-CD1 3.36Å; I266-I299 HydrophobicContact CG2-CD1 3.99Å; I280-I299 HydrophobicContact CD1-CG2 4.21Å; I290-I299 HydrophobicContact CB-CD1 4.4Å; I290-I299 HydrophobicContact CD1-CD1 4.23Å; I290-I299 HydrophobicContact CG1-CD1 4.33Å; I290-I299 HydrophobicContact CG2-CD1 3.3Å; I290-I299 HydrophobicContact CG2-CG1 3.74Å; I299-F310 WeakPolarHBondContact O-CA 3.18Å; I299-S311 WeakPolarHBondContact CG2-O 3.42Å; I299-S311 PolarHBondContact N-O 3.35Å; I299-S311 PolarHBondContact O-N 3.4Å; I299-I313 HydrophobicContact CB-CD1 4.05Å; I299-I313 HydrophobicContact CB-CG1 3.84Å; I299-I313 HydrophobicContact CG2-CG1 4.04Å
300	L	96	Very high	91.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	134.3	163.4	174.2	71.7	0	0	0	108.8	I290 S291 W308 A309 A335 F337 F344	I290-L300 CarbonylContact C-O 3.56Å; I290-L300 WeakPolarHBondContact CA-O 3.47Å; S291-L300 PolarHBondContact N-O 3.09Å; S291-L300 PolarHBondContact O-N 2.99Å; L300-W308 HydrophobicContact CD1-CB 4.26Å; L300-W308 HydrophobicContact CD1-CD2 4.31Å; L300-W308 HydrophobicContact CD1-CE3 3.63Å; L300-W308 HydrophobicContact CD1-CZ3 4.34Å; L300-A309 WeakPolarHBondContact CA-O 3.35Å; L300-A335 HydrophobicContact CD2-CB 3.91Å; L300-A335 HydrophobicContact CG-CB 4.49Å; L300-F337 HydrophobicContact CB-CD2 3.98Å; L300-F337 HydrophobicContact CB-CE2 3.19Å; L300-F337 HydrophobicContact CB-CZ 3.6Å; L300-F337 HydrophobicContact CD2-CD2 4.43Å; L300-F337 HydrophobicContact CD2-CE2 4.16Å; L300-F337 HydrophobicContact CD2-CZ 4.23Å; L300-F337 HydrophobicContact CG-CE2 4.28Å; L300-F337 HydrophobicContact CG-CZ 4.41Å; L300-F344 HydrophobicContact CD1-CD2 4.17Å; L300-F344 HydrophobicContact CD1-CE2 3.84Å; L300-F344 HydrophobicContact CD1-CZ 4.14Å; L300-F344 HydrophobicContact CD2-CB 3.83Å; L300-F344 HydrophobicContact CD2-CD1 4.43Å; L300-F344 HydrophobicContact CD2-CD2 3.36Å; L300-F344 HydrophobicContact CD2-CE2 3.92Å; L300-F344 HydrophobicContact CD2-CG 3.64Å; L300-F344 HydrophobicContact CG-CD2 4.41Å
301	S	95.7	Very high	91.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	141.1	174.2	59.3	0	0	0	0	110.7	I266 H283 G289 W308 A309	I266-S301 WeakPolarHBondContact CD1-OG 3.3Å; H283-S301 PolarHBondContact NE2-O 3.04Å; H283-S301 PolarHBondContact NE2-OG 2.8Å; G289-S301 WeakPolarHBondContact O-CA 3.46Å; S301-W308 CarbonylContact O-C 3.58Å; S301-W308 VanDerWaalsContact O-CA 3.27Å; S301-W308 WeakPolarHBondContact O-CA 3.44Å; S301-A309 PolarHBondContact N-O 3.15Å; S301-A309 PolarHBondContact O-N 2.92Å; S301-A309 PolarHBondContact OG-O 2.76Å
302	V	94.4	Very high	91.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	148	176.2	-67.6	0	0	0	0	110.7	V287 T288 G289 W308 M332 A335 I346	V287-V302 CarbonylContact C-O 3.57Å; V287-V302 WeakPolarHBondContact CA-O 3.46Å; V287-V302 WeakPolarHBondContact CG1-O 3.1Å; T288-V302 PolarHBondContact N-O 2.98Å; T288-V302 PolarHBondContact OG1-O 3.1Å; G289-V302 PolarHBondContact N-O 2.76Å; G289-V302 PolarHBondContact O-N 3.48Å; V302-W308 HydrophobicContact CG1-CB 3.73Å; V302-M332 HydrophobicContact CB-CB 3.94Å; V302-M332 HydrophobicContact CB-SD 4.08Å; V302-M332 HydrophobicContact CG1-SD 3.92Å; V302-M332 HydrophobicContact CG2-CB 4.4Å; V302-A335 HydrophobicContact CB-CB 4.16Å; V302-A335 HydrophobicContact CG1-CB 3.45Å; V302-A335 VanDerWaalsContact CG1-CB 3.45Å; V302-A335 HydrophobicContact CG2-CB 3.59Å; V302-I346 HydrophobicContact CG1-CD1 4.1Å; V302-I346 HydrophobicContact CG1-CG1 4.27Å; V302-I346 HydrophobicContact CG1-CG2 4.4Å
303	S	93.4	Very high	91.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.3	-177	-172.6	0	0	0	0	112	H283 T285 P286 G305 E306 K307 M332	H283-S303 WeakPolarHBondContact ND1-CB 3.05Å; T285-S303 VanDerWaalsContact C-OG 3.26Å; T285-S303 WeakPolarHBondContact CB-OG 3.28Å; T285-S303 PolarHBondContact O-OG 2.9Å; T285-S303 PolarHBondContact OG1-OG 3.08Å; P286-S303 WeakPolarHBondContact O-CA 3.19Å; P286-S303 PolarHBondContact O-OG 2.95Å; S303-G305 PolarHBondContact O-N 3.25Å; S303-G305 VanDerWaalsContact O-N 3.11Å; S303-E306 PolarHBondContact O-N 3.21Å; S303-K307 PolarHBondContact N-O 3.45Å; S303-K307 VanDerWaalsContact N-O 3.15Å; S303-M332 WeakPolarHBondContact O-CB 3.43Å; S303-M332 PolarHBondContact O-N 2.94Å
304	S	88.9	Confident	91.1	Very high	50 Å²	50	23.2 Å²	23.2	35%	0.35	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.4	172	62.3	0	0	0	0	113.3	P286 E306 G331	P286-S304 PolarHBondContact O-N 3.39Å; S304-E306 VanDerWaalsContact C-N 3.27Å; S304-E306 PolarHBondContact O-N 3.34Å; S304-G331 WeakPolarHBondContact O-CA 3.33Å
305	G	80.7	Confident	91.3	Very high	21 Å²	21	24.3 Å²	24.3	22%	0.216	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	28.4	178.1	0	0	0	0	0	115	T285 S303 K307	T285-G305 WeakPolarHBondContact OG1-CA 3.06Å; T285-G305 PolarHBondContact OG1-N 3.38Å; T285-G305 VanDerWaalsContact OG1-N 3.15Å; S303-G305 PolarHBondContact O-N 3.25Å; S303-G305 VanDerWaalsContact O-N 3.11Å; G305-K307 VanDerWaalsContact C-N 3.29Å; G305-K307 VanDerWaalsContact O-CG 3.31Å; G305-K307 WeakPolarHBondContact O-CG 3.45Å; G305-K307 PolarHBondContact O-N 2.93Å
306	E	78.7	Confident	91.4	Very high	80 Å²	80	24.3 Å²	24.3	37%	0.374	13%	0.131	S	C	.	.	S	Bend	trans	65.6	23	172.1	-60	157.9	-148.4	0	0	115.6	S303 S304 D324 S329 M332	S303-E306 PolarHBondContact O-N 3.21Å; S304-E306 VanDerWaalsContact C-N 3.27Å; S304-E306 PolarHBondContact O-N 3.34Å; E306-D324 PolarHBondContact O-N 3.39Å; E306-S329 WeakPolarHBondContact CG-O 3.27Å; E306-M332 VanDerWaalsContact C-CE 3.47Å; E306-M332 WeakPolarHBondContact O-CE 3.5Å
307	K	87.3	Confident	91.5	Very high	50 Å²	50	31 Å²	31	22%	0.217	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.5	-173.6	-61.6	173.1	-169.7	-120.9	0	110.3	H283 S303 G305 R321 D323	H283-K307 PolarHBondContact CE1-O 2.84Å; H283-K307 VanDerWaalsContact CE1-O 3.25Å; S303-K307 PolarHBondContact N-O 3.45Å; S303-K307 VanDerWaalsContact N-O 3.15Å; G305-K307 VanDerWaalsContact C-N 3.29Å; G305-K307 VanDerWaalsContact O-CG 3.31Å; G305-K307 WeakPolarHBondContact O-CG 3.45Å; G305-K307 PolarHBondContact O-N 2.93Å; K307-R321 HydrophobicContact CB-CG 4.21Å; K307-D323 WeakPolarHBondContact CD-OD1 3.29Å; K307-D323 VanDerWaalsContact CE-OD1 3.27Å; K307-D323 WeakPolarHBondContact CE-OD1 3.38Å; K307-D323 HydrophobicContact CG-CB 4.43Å; K307-D323 WeakPolarHBondContact CG-OD1 3.24Å; K307-D323 IonicContact NZ-OD1 3.52Å; K307-D323 PolarHBondContact NZ-OD1 2.99Å; K307-D323 IonicContact NZ-OD2 3.83Å; K307-D323 PolarHBondContact NZ-OD2 2.9Å
308	W	93.1	Very high	91.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	145.6	168	67.1	-96.2	0	0	0	109.3	L300 S301 V302 F310 F320 R321 V322 M332 F344 I346 W356 L358 R361	L300-W308 HydrophobicContact CD1-CB 4.26Å; L300-W308 HydrophobicContact CD1-CD2 4.31Å; L300-W308 HydrophobicContact CD1-CE3 3.63Å; L300-W308 HydrophobicContact CD1-CZ3 4.34Å; S301-W308 CarbonylContact O-C 3.58Å; S301-W308 VanDerWaalsContact O-CA 3.27Å; S301-W308 WeakPolarHBondContact O-CA 3.44Å; V302-W308 HydrophobicContact CG1-CB 3.73Å; W308-F310 HydrophobicContact CZ3-CB 4.36Å; W308-F320 HydrophobicContact CH2-CD2 4.37Å; W308-F320 AromaticContact CH2-CE2 3.75Å; W308-F320 HydrophobicContact CH2-CE2 3.75Å; W308-F320 HydrophobicContact CZ3-CD2 4.21Å; W308-F320 AromaticContact CZ3-CE2 3.62Å; W308-F320 HydrophobicContact CZ3-CE2 3.62Å; W308-R321 WeakPolarHBondContact O-CG 3.32Å; W308-V322 HydrophobicContact CD2-CB 4.01Å; W308-V322 HydrophobicContact CD2-CG2 4.49Å; W308-V322 VanDerWaalsContact CE2-CB 3.42Å; W308-V322 HydrophobicContact CH2-CB 4.13Å; W308-V322 HydrophobicContact CH2-CG2 3.63Å; W308-V322 HydrophobicContact CZ2-CB 3.49Å; W308-V322 VanDerWaalsContact CZ2-CB 3.49Å; W308-V322 HydrophobicContact CZ2-CG1 3.82Å; W308-V322 HydrophobicContact CZ2-CG2 3.43Å; W308-V322 VanDerWaalsContact CZ2-CG2 3.43Å; W308-V322 HydrophobicContact CZ3-CG2 4.24Å; W308-V322 PolarHBondContact N-O 3.13Å; W308-V322 VanDerWaalsContact N-O 3.13Å; W308-V322 PolarHBondContact O-N 3.11Å; W308-M332 HydrophobicContact CB-SD 4.16Å; W308-F344 HydrophobicContact CD2-CE2 4.02Å; W308-F344 AromaticContact CD2-CZ 3.78Å; W308-F344 HydrophobicContact CD2-CZ 3.78Å; W308-F344 AromaticContact CE2-CZ 3.73Å; W308-F344 HydrophobicContact CE3-CE2 4.23Å; W308-F344 AromaticContact CE3-CZ 3.76Å; W308-F344 HydrophobicContact CE3-CZ 3.76Å; W308-F344 HydrophobicContact CG-CE2 4.34Å; W308-F344 HydrophobicContact CH2-CE1 4.25Å; W308-F344 AromaticContact CH2-CZ 3.7Å; W308-F344 HydrophobicContact CH2-CZ 3.7Å; W308-F344 AromaticContact CZ2-CZ 3.72Å; W308-F344 HydrophobicContact CZ2-CZ 3.72Å; W308-F344 HydrophobicContact CZ3-CE1 4.31Å; W308-F344 AromaticContact CZ3-CZ 3.71Å; W308-F344 HydrophobicContact CZ3-CZ 3.71Å; W308-I346 HydrophobicContact CB-CD1 4.02Å; W308-I346 HydrophobicContact CG-CD1 3.98Å; W308-W356 HydrophobicContact CZ2-CD2 4.45Å; W308-W356 AromaticContact CZ2-CE3 3.91Å; W308-W356 HydrophobicContact CZ2-CE3 3.91Å; W308-W356 HydrophobicContact CZ2-CZ3 4.32Å; W308-W356 AromaticContact NE1-CD2 3.65Å; W308-W356 AromaticContact NE1-CE2 3.75Å; W308-W356 AromaticContact NE1-CE3 3.64Å; W308-W356 AromaticContact NE1-CH2 3.89Å; W308-W356 AromaticContact NE1-CZ2 3.89Å; W308-W356 AromaticContact NE1-CZ3 3.76Å; W308-L358 HydrophobicContact CZ3-CD1 4.34Å; W308-R361 HydrophobicContact CH2-CB 4.47Å; W308-R361 HydrophobicContact CH2-CG 4.38Å; W308-R361 HydrophobicContact CZ2-CB 4.43Å
309	A	94.1	Very high	91.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.6	-176.8	0	0	0	0	0	110.4	A282 L300 S301 L318 R321	A282-A309 HydrophobicContact CB-CB 3.7Å; L300-A309 WeakPolarHBondContact CA-O 3.35Å; S301-A309 PolarHBondContact N-O 3.15Å; S301-A309 PolarHBondContact O-N 2.92Å; S301-A309 PolarHBondContact OG-O 2.76Å; A309-L318 HydrophobicContact CB-CD1 3.83Å; A309-R321 HydrophobicContact CB-CB 4.36Å; A309-R321 HydrophobicContact CB-CG 4.16Å
310	F	94.6	Very high	91.1	Very high	3 Å²	3	33.5 Å²	33.5	1%	0.013	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.5	177.5	-165.7	-113.8	0	0	0	108.9	Y298 I299 W308 L319 F320 F337 L358	Y298-F310 AromaticContact CD1-CE1 3.79Å; Y298-F310 HydrophobicContact CD1-CE1 3.79Å; Y298-F310 AromaticContact CD1-CZ 3.99Å; Y298-F310 HydrophobicContact CD1-CZ 3.99Å; Y298-F310 HydrophobicContact CD2-CE1 4.33Å; Y298-F310 AromaticContact CD2-CZ 3.9Å; Y298-F310 HydrophobicContact CD2-CZ 3.9Å; Y298-F310 HydrophobicContact CE1-CE1 4.47Å; Y298-F310 AromaticContact CG-CE1 3.72Å; Y298-F310 HydrophobicContact CG-CE1 3.72Å; Y298-F310 HydrophobicContact CG-CE2 4.27Å; Y298-F310 AromaticContact CG-CZ 3.41Å; Y298-F310 HydrophobicContact CG-CZ 3.41Å; Y298-F310 VanDerWaalsContact CG-CZ 3.41Å; I299-F310 WeakPolarHBondContact O-CA 3.18Å; W308-F310 HydrophobicContact CZ3-CB 4.36Å; F310-L319 HydrophobicContact CD1-CB 4.43Å; F310-L319 HydrophobicContact CD1-CD1 3.58Å; F310-L319 HydrophobicContact CE1-CD1 3.77Å; F310-L319 WeakPolarHBondContact O-CB 3.27Å; F310-L319 PolarHBondContact O-N 2.9Å; F310-F320 HydrophobicContact CB-CD2 4.08Å; F310-F320 HydrophobicContact CB-CE1 4.2Å; F310-F320 HydrophobicContact CB-CE2 3.65Å; F310-F320 HydrophobicContact CB-CZ 3.71Å; F310-F320 AromaticContact CD1-CE1 3.7Å; F310-F320 HydrophobicContact CD1-CE1 3.7Å; F310-F320 HydrophobicContact CD1-CE2 4.43Å; F310-F320 AromaticContact CD1-CZ 3.62Å; F310-F320 HydrophobicContact CD1-CZ 3.62Å; F310-F320 HydrophobicContact CE1-CZ 4.49Å; F310-F320 HydrophobicContact CG-CE1 4.35Å; F310-F320 HydrophobicContact CG-CE2 4.3Å; F310-F320 AromaticContact CG-CZ 3.9Å; F310-F320 HydrophobicContact CG-CZ 3.9Å; F310-F320 PolarHBondContact N-O 2.76Å; F310-F320 PolarHBondContact O-N 2.56Å; F310-F337 HydrophobicContact CD2-CZ 4.12Å; F310-F337 HydrophobicContact CE2-CE2 4.26Å; F310-F337 AromaticContact CE2-CZ 3.68Å; F310-F337 HydrophobicContact CE2-CZ 3.68Å; F310-L358 HydrophobicContact CD1-CD1 4.43Å; F310-L358 HydrophobicContact CD2-CD1 3.85Å; F310-L358 HydrophobicContact CE1-CD2 4.47Å; F310-L358 HydrophobicContact CE2-CD1 3.97Å; F310-L358 HydrophobicContact CE2-CD2 3.96Å; F310-L358 HydrophobicContact CG-CD1 4.08Å; F310-L358 HydrophobicContact CZ-CD1 4.29Å; F310-L358 HydrophobicContact CZ-CD2 3.82Å
311	S	95.2	Very high	90.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.1	-174	-52.8	0	0	0	0	110.7	Y298 I299 R317 L318	Y298-S311 WeakPolarHBondContact CA-O 3.4Å; I299-S311 WeakPolarHBondContact CG2-O 3.42Å; I299-S311 PolarHBondContact N-O 3.35Å; I299-S311 PolarHBondContact O-N 3.4Å; S311-R317 CarbonylContact C-O 3.53Å; S311-R317 WeakPolarHBondContact CA-O 3.22Å; S311-R317 WeakPolarHBondContact CB-O 3.41Å; S311-L318 WeakPolarHBondContact OG-CD1 3.2Å
312	D	93.6	Very high	90.6	Very high	33 Å²	33	39.3 Å²	39.3	18%	0.176	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.7	172.8	172.2	10.3	0	0	0	109.6	Y298 R314 S315 G316 R317	Y298-D312 HydrophobicContact CD1-CB 4.23Å; Y298-D312 HydrophobicContact CE1-CB 4.31Å; D312-R314 PolarHBondContact OD1-N 2.95Å; D312-S315 WeakPolarHBondContact CB-OG 3.38Å; D312-S315 VanDerWaalsContact OD2-CB 3.25Å; D312-S315 WeakPolarHBondContact OD2-CB 3.35Å; D312-S315 PolarHBondContact OD2-N 2.91Å; D312-S315 PolarHBondContact OD2-OG 3.42Å; D312-G316 CarbonylContact O-C 3.59Å; D312-G316 WeakPolarHBondContact O-CA 3.45Å; D312-G316 PolarHBondContact O-N 2.79Å; D312-R317 PolarHBondContact N-O 2.87Å
313	I	93.2	Very high	90.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-36.3	-178.1	-64.1	167.4	0	0	0	110.8	M256 I258 V268 H278 I292 G296 D297 Y298 I299	M256-I313 HydrophobicContact CE-CG2 4.34Å; M256-I313 HydrophobicContact SD-CG2 3.38Å; M256-I313 WeakPolarHBondContact SD-CG2 3.41Å; I258-I313 HydrophobicContact CD1-CD1 3.64Å; I258-I313 HydrophobicContact CD1-CG1 3.93Å; I258-I313 HydrophobicContact CD1-CG2 4.01Å; V268-I313 HydrophobicContact CG1-CG2 3.82Å; V268-I313 HydrophobicContact CG2-CG2 4.19Å; H278-I313 PolarHBondContact CD2-O 3.2Å; I292-I313 HydrophobicContact CG2-CD1 3.95Å; G296-I313 VanDerWaalsContact O-CD1 3.23Å; G296-I313 WeakPolarHBondContact O-CD1 3.35Å; D297-I313 WeakPolarHBondContact O-CB 3.36Å; D297-I313 PolarHBondContact O-N 3.18Å; Y298-I313 VanDerWaalsContact C-CD1 3.42Å; Y298-I313 WeakPolarHBondContact O-CD1 3.4Å; I299-I313 HydrophobicContact CB-CD1 4.05Å; I299-I313 HydrophobicContact CB-CG1 3.84Å; I299-I313 HydrophobicContact CG2-CG1 4.04Å
314	R	90.3	Very high	89	Confident	123 Å²	123	43.7 Å²	43.7	46%	0.464	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-36.1	-173.6	-66.3	-172.9	-178.7	-106	-18.5	112.8	E253 H278 D297 D312	E253-R314 IonicContact OE1-CZ 3.4Å; E253-R314 IonicContact OE1-NH2 3.45Å; E253-R314 PolarHBondContact OE1-NH2 2.86Å; H278-R314 PolarHBondContact NE2-O 2.92Å; D297-R314 IonicContact OD1-CZ 3.76Å; D297-R314 IonicContact OD1-NE 3.33Å; D297-R314 PolarHBondContact OD1-NE 3.47Å; D297-R314 IonicContact OD1-NH2 2.93Å; D297-R314 PolarHBondContact OD1-NH2 2.65Å; D312-R314 PolarHBondContact OD1-N 2.95Å
315	S	90.4	Very high	87.7	Confident	57 Å²	57	47 Å²	47	40%	0.399	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-22.9	175.4	65	0	0	0	0	112.9	H278 D312 R317	H278-S315 PolarHBondContact ND1-O 2.88Å; D312-S315 WeakPolarHBondContact CB-OG 3.38Å; D312-S315 VanDerWaalsContact OD2-CB 3.25Å; D312-S315 WeakPolarHBondContact OD2-CB 3.35Å; D312-S315 PolarHBondContact OD2-N 2.91Å; D312-S315 PolarHBondContact OD2-OG 3.42Å; S315-R317 PolarHBondContact O-N 2.85Å; S315-R317 WeakPolarHBondContact OG-CB 3.32Å; S315-R317 PolarHBondContact OG-N 2.8Å
316	G	90.3	Very high	86.8	Confident	17 Å²	17	47.5 Å²	47.5	18%	0.175	24%	0.243	C	C	.	.			trans	72	13.1	-169.7	0	0	0	0	0	113.5	D312	D312-G316 CarbonylContact O-C 3.59Å; D312-G316 WeakPolarHBondContact O-CA 3.45Å; D312-G316 PolarHBondContact O-N 2.79Å
317	R	91.1	Very high	85.5	Confident	141 Å²	141	50.8 Å²	50.8	53%	0.532	27%	0.271	S	S	.	.			trans	-82.4	135.8	-178.5	-168.1	179.8	178.4	-164.4	0.8	110.7	E145 S311 D312 S315 L319	E145-R317 IonicContact OE2-NH1 3.8Å; E145-R317 PolarHBondContact OE2-NH1 2.79Å; S311-R317 CarbonylContact C-O 3.53Å; S311-R317 WeakPolarHBondContact CA-O 3.22Å; S311-R317 WeakPolarHBondContact CB-O 3.41Å; D312-R317 PolarHBondContact N-O 2.87Å; S315-R317 PolarHBondContact O-N 2.85Å; S315-R317 WeakPolarHBondContact OG-CB 3.32Å; S315-R317 PolarHBondContact OG-N 2.8Å; R317-L319 PolarHBondContact O-N 3.01Å
318	L	92.6	Very high	83.9	Confident	69 Å²	69	52.5 Å²	52.5	36%	0.361	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.3	165.7	174.5	66.4	0	0	0	108.5	A282 A309 S311	A282-L318 HydrophobicContact CB-CD1 3.94Å; A309-L318 HydrophobicContact CB-CD1 3.83Å; S311-L318 WeakPolarHBondContact OG-CD1 3.2Å
319	L	90.1	Very high	82.2	Confident	37 Å²	37	52.9 Å²	52.9	19%	0.194	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-58.2	177.6	-61.8	172.6	0	0	0	109.6	M149 Y298 F310 R317	M149-L319 HydrophobicContact CE-CD1 4.04Å; M149-L319 HydrophobicContact CE-CD2 4.03Å; M149-L319 HydrophobicContact SD-CD1 3.58Å; M149-L319 VanDerWaalsContact SD-CD1 3.58Å; M149-L319 HydrophobicContact SD-CD2 4.03Å; M149-L319 HydrophobicContact SD-CG 4.43Å; Y298-L319 HydrophobicContact CD1-CD1 3.74Å; Y298-L319 HydrophobicContact CE1-CD1 3.79Å; F310-L319 HydrophobicContact CD1-CB 4.43Å; F310-L319 HydrophobicContact CD1-CD1 3.58Å; F310-L319 HydrophobicContact CE1-CD1 3.77Å; F310-L319 WeakPolarHBondContact O-CB 3.27Å; F310-L319 PolarHBondContact O-N 2.9Å; R317-L319 PolarHBondContact O-N 3.01Å
320	F	90.4	Very high	81	Confident	23 Å²	23	58 Å²	58	10%	0.101	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	157.9	176.5	51.1	-93.3	0	0	0	111.7	W308 F310 V322 L358 R361	W308-F320 HydrophobicContact CH2-CD2 4.37Å; W308-F320 AromaticContact CH2-CE2 3.75Å; W308-F320 HydrophobicContact CH2-CE2 3.75Å; W308-F320 HydrophobicContact CZ3-CD2 4.21Å; W308-F320 AromaticContact CZ3-CE2 3.62Å; W308-F320 HydrophobicContact CZ3-CE2 3.62Å; F310-F320 HydrophobicContact CB-CD2 4.08Å; F310-F320 HydrophobicContact CB-CE1 4.2Å; F310-F320 HydrophobicContact CB-CE2 3.65Å; F310-F320 HydrophobicContact CB-CZ 3.71Å; F310-F320 AromaticContact CD1-CE1 3.7Å; F310-F320 HydrophobicContact CD1-CE1 3.7Å; F310-F320 HydrophobicContact CD1-CE2 4.43Å; F310-F320 AromaticContact CD1-CZ 3.62Å; F310-F320 HydrophobicContact CD1-CZ 3.62Å; F310-F320 HydrophobicContact CE1-CZ 4.49Å; F310-F320 HydrophobicContact CG-CE1 4.35Å; F310-F320 HydrophobicContact CG-CE2 4.3Å; F310-F320 AromaticContact CG-CZ 3.9Å; F310-F320 HydrophobicContact CG-CZ 3.9Å; F310-F320 PolarHBondContact N-O 2.76Å; F310-F320 PolarHBondContact O-N 2.56Å; F320-V322 HydrophobicContact CD2-CG2 4.11Å; F320-L358 HydrophobicContact CE2-CD1 4.45Å; F320-L358 HydrophobicContact CZ-CD1 4.12Å; F320-R361 HydrophobicContact CE2-CG 4.24Å
321	R	90.9	Very high	80.4	Confident	98 Å²	98	58.5 Å²	58.5	37%	0.37	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.1	172	-171.4	179.4	84.7	-179.6	2.6	108.7	K307 W308 A309 D323	K307-R321 HydrophobicContact CB-CG 4.21Å; W308-R321 WeakPolarHBondContact O-CG 3.32Å; A309-R321 HydrophobicContact CB-CB 4.36Å; A309-R321 HydrophobicContact CB-CG 4.16Å; R321-D323 IonicContact NE-OD1 2.83Å; R321-D323 IonicContact NH2-OD1 3.08Å
322	V	88.9	Confident	80.2	Confident	23 Å²	23	58.6 Å²	58.6	14%	0.139	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.2	178.6	180	0	0	0	0	108.7	W308 F320 W356 R361	W308-V322 HydrophobicContact CD2-CB 4.01Å; W308-V322 HydrophobicContact CD2-CG2 4.49Å; W308-V322 VanDerWaalsContact CE2-CB 3.42Å; W308-V322 HydrophobicContact CH2-CB 4.13Å; W308-V322 HydrophobicContact CH2-CG2 3.63Å; W308-V322 HydrophobicContact CZ2-CB 3.49Å; W308-V322 VanDerWaalsContact CZ2-CB 3.49Å; W308-V322 HydrophobicContact CZ2-CG1 3.82Å; W308-V322 HydrophobicContact CZ2-CG2 3.43Å; W308-V322 VanDerWaalsContact CZ2-CG2 3.43Å; W308-V322 HydrophobicContact CZ3-CG2 4.24Å; W308-V322 PolarHBondContact N-O 3.13Å; W308-V322 VanDerWaalsContact N-O 3.13Å; W308-V322 PolarHBondContact O-N 3.11Å; F320-V322 HydrophobicContact CD2-CG2 4.11Å; V322-W356 HydrophobicContact CG1-CH2 4.35Å; V322-W356 HydrophobicContact CG1-CZ3 4.09Å; V322-R361 HydrophobicContact CG2-CB 4.27Å
323	D	84.1	Confident	80.2	Confident	78 Å²	78	58.1 Å²	58.1	42%	0.417	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	134.8	173.6	-63.8	-5.5	0	0	0	108	K307 R321 S325	K307-D323 WeakPolarHBondContact CD-OD1 3.29Å; K307-D323 VanDerWaalsContact CE-OD1 3.27Å; K307-D323 WeakPolarHBondContact CE-OD1 3.38Å; K307-D323 HydrophobicContact CG-CB 4.43Å; K307-D323 WeakPolarHBondContact CG-OD1 3.24Å; K307-D323 IonicContact NZ-OD1 3.52Å; K307-D323 PolarHBondContact NZ-OD1 2.99Å; K307-D323 IonicContact NZ-OD2 3.83Å; K307-D323 PolarHBondContact NZ-OD2 2.9Å; R321-D323 IonicContact NE-OD1 2.83Å; R321-D323 IonicContact NH2-OD1 3.08Å; D323-S325 PolarHBondContact O-N 2.73Å
324	D	71.3	Confident	80.2	Confident	14 Å²	14	58.6 Å²	58.6	8%	0.075	33%	0.325	C	S	.	.			trans	-72.7	97	172	-175.1	14.2	0	0	0	108.3	E306 A326 S329 M332 K354 W356	E306-D324 PolarHBondContact O-N 3.39Å; D324-A326 PolarHBondContact O-N 2.78Å; D324-S329 VanDerWaalsContact OD2-CB 3.3Å; D324-S329 WeakPolarHBondContact OD2-CB 3.48Å; D324-S329 PolarHBondContact OD2-OG 2.88Å; D324-M332 HydrophobicContact CB-CE 3.87Å; D324-K354 IonicContact OD1-NZ 2.88Å; D324-K354 PolarHBondContact OD1-NZ 3Å; D324-K354 IonicContact OD2-NZ 2.59Å; D324-K354 PolarHBondContact OD2-NZ 3.16Å; D324-W356 HydrophobicContact CB-CZ2 4.45Å
325	S	61.9	Low	80.4	Confident	121 Å²	121	53.3 Å²	53.3	85%	0.846	31%	0.307	S	S	*	.			trans	-67.5	12.6	-174.3	69.9	0	0	0	0	114.5	D323	D323-S325 PolarHBondContact O-N 2.73Å
326	A	61.8	Low	80.7	Confident	31 Å²	31	53 Å²	53	26%	0.256	30%	0.299	S	S	.	.			trans	-79.2	131.1	179.4	0	0	0	0	0	110.1	D324 S328 S329	D324-A326 PolarHBondContact O-N 2.78Å; A326-S328 PolarHBondContact O-N 3.45Å; A326-S329 PolarHBondContact O-N 3.37Å
327	P	50.9	Low	80.9	Confident	148 Å²	148	52.7 Å²	52.7	96%	0.961	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-1.1	-176.8	26.3	-34.3	0	0	0	114.6
328	S	52.8	Low	81	Confident	87 Å²	87	46.4 Å²	46.4	61%	0.608	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.5	21.6	-178.9	74.5	0	0	0	0	112.8	A326 Q330	A326-S328 PolarHBondContact O-N 3.45Å; S328-Q330 PolarHBondContact O-N 3.49Å
329	S	58.8	Low	80.9	Confident	7 Å²	7	44 Å²	44	5%	0.049	26%	0.258	C	S	.	.			trans	-67.2	120.2	175.1	-165.1	0	0	0	0	108.4	E306 D324 A326	E306-S329 WeakPolarHBondContact CG-O 3.27Å; D324-S329 VanDerWaalsContact OD2-CB 3.3Å; D324-S329 WeakPolarHBondContact OD2-CB 3.48Å; D324-S329 PolarHBondContact OD2-OG 2.88Å; A326-S329 PolarHBondContact O-N 3.37Å
330	Q	67.8	Low	80.7	Confident	107 Å²	107	43.4 Å²	43.4	50%	0.5	26%	0.255	S	S	.	.			trans	-108.9	142.4	165.1	-59.6	-177.2	7.7	0	0	108	S328 V349 D350	S328-Q330 PolarHBondContact O-N 3.49Å; Q330-V349 HydrophobicContact CB-CB 4.19Å; Q330-V349 HydrophobicContact CB-CG1 4.46Å; Q330-D350 VanDerWaalsContact CB-OD1 3.22Å; Q330-D350 WeakPolarHBondContact CB-OD1 3.04Å; Q330-D350 WeakPolarHBondContact CB-OD2 3.49Å; Q330-D350 WeakPolarHBondContact CG-OD1 3.34Å; Q330-D350 PolarHBondContact N-OD2 3.47Å; Q330-D350 PolarHBondContact OE1-OD1 3.24Å
331	G	82.5	Confident	80.6	Confident	14 Å²	14	42.3 Å²	42.3	14%	0.144	25%	0.25	C	S	.	.			trans	-30	142.1	-166.4	0	0	0	0	0	118.1	S304 V349	S304-G331 WeakPolarHBondContact O-CA 3.33Å; G331-V349 VanDerWaalsContact O-CG2 3.23Å; G331-V349 WeakPolarHBondContact O-CG2 3.49Å; G331-V349 PolarHBondContact O-N 2.95Å; G331-V349 VanDerWaalsContact O-N 3.16Å
332	M	90.8	Very high	80.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	138.4	179.3	-56.8	171.5	-179.7	0	0	110	T288 V302 S303 E306 W308 D324 I346	T288-M332 WeakPolarHBondContact CB-O 3.43Å; T288-M332 PolarHBondContact OG1-O 2.98Å; V302-M332 HydrophobicContact CB-CB 3.94Å; V302-M332 HydrophobicContact CB-SD 4.08Å; V302-M332 HydrophobicContact CG1-SD 3.92Å; V302-M332 HydrophobicContact CG2-CB 4.4Å; S303-M332 WeakPolarHBondContact O-CB 3.43Å; S303-M332 PolarHBondContact O-N 2.94Å; E306-M332 VanDerWaalsContact C-CE 3.47Å; E306-M332 WeakPolarHBondContact O-CE 3.5Å; W308-M332 HydrophobicContact CB-SD 4.16Å; D324-M332 HydrophobicContact CB-CE 3.87Å; M332-I346 HydrophobicContact CB-CG2 3.8Å; M332-I346 HydrophobicContact CE-CD1 4.1Å; M332-I346 HydrophobicContact CG-CG2 3.64Å; M332-I346 HydrophobicContact SD-CD1 3.86Å; M332-I346 HydrophobicContact SD-CG2 3.86Å
333	T	92.7	Very high	80.8	Confident	24 Å²	24	40.7 Å²	40.7	15%	0.147	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-34.3	-175.5	57.1	0	0	0	0	113.2	T288 G347 V349 I374	T288-T333 WeakPolarHBondContact CB-O 3.38Å; T333-G347 PolarHBondContact N-O 3.45Å; T333-G347 PolarHBondContact OG1-O 3.32Å; T333-V349 HydrophobicContact CG2-CG2 3.57Å; T333-I374 WeakPolarHBondContact CB-O 3.36Å; T333-I374 WeakPolarHBondContact CG2-O 3.38Å; T333-I374 PolarHBondContact OG1-O 3.48Å
334	C	93.7	Very high	81.4	Confident	10 Å²	10	37 Å²	37	7%	0.068	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	156.6	-177.9	57.9	0	0	0	0	110.2	I346 G347	C334-I346 WeakPolarHBondContact O-CA 3.15Å; C334-G347 PolarHBondContact O-N 2.87Å
335	A	94.8	Very high	82.4	Confident	11 Å²	11	36.3 Å²	36.3	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.7	173.1	0	0	0	0	0	110.6	L300 V302 G345 I346	L300-A335 HydrophobicContact CD2-CB 3.91Å; L300-A335 HydrophobicContact CG-CB 4.49Å; V302-A335 HydrophobicContact CB-CB 4.16Å; V302-A335 HydrophobicContact CG1-CB 3.45Å; V302-A335 VanDerWaalsContact CG1-CB 3.45Å; V302-A335 HydrophobicContact CG2-CB 3.59Å; A335-G345 CarbonylContact C-O 3.59Å; A335-G345 VanDerWaalsContact CA-O 3.22Å; A335-G345 WeakPolarHBondContact CA-O 3.4Å; A335-I346 HydrophobicContact CB-CG1 4.39Å
336	Q	95.6	Very high	84	Confident	52 Å²	52	30.5 Å²	30.5	24%	0.243	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	137.2	175.5	-159.5	-172.7	25.9	0	0	110.1	F344 G345 L377 S378 F379	Q336-F344 CarbonylContact O-C 3.54Å; Q336-F344 VanDerWaalsContact O-CA 3.32Å; Q336-F344 WeakPolarHBondContact O-CA 3.28Å; Q336-F344 VanDerWaalsContact O-CB 3.27Å; Q336-F344 WeakPolarHBondContact O-CB 3.33Å; Q336-G345 PolarHBondContact N-O 2.94Å; Q336-G345 PolarHBondContact O-N 2.77Å; Q336-L377 HydrophobicContact CB-CB 4.45Å; Q336-L377 PolarHBondContact OE1-O 3.46Å; Q336-S378 VanDerWaalsContact OE1-C 3.27Å; Q336-F379 HydrophobicContact CB-CD2 4.15Å; Q336-F379 HydrophobicContact CB-CE2 4.23Å; Q336-F379 HydrophobicContact CG-CD2 4.25Å; Q336-F379 VanDerWaalsContact O-CE2 3.29Å; Q336-F379 WeakPolarHBondContact O-CE2 3.46Å
337	F	95	Very high	85.5	Confident	10 Å²	10	29 Å²	29	4%	0.044	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.8	166.5	-87.1	-69.1	0	0	0	110.7	S291 H293 L300 F310 F344 L358 F379	S291-F337 PolarHBondContact OG-N 3.37Å; H293-F337 HydrophobicContact CB-CD2 4.25Å; H293-F337 HydrophobicContact CB-CE2 3.93Å; H293-F337 HydrophobicContact CB-CZ 4.33Å; H293-F337 AromaticContact CD2-CE1 3.88Å; L300-F337 HydrophobicContact CB-CD2 3.98Å; L300-F337 HydrophobicContact CB-CE2 3.19Å; L300-F337 HydrophobicContact CB-CZ 3.6Å; L300-F337 HydrophobicContact CD2-CD2 4.43Å; L300-F337 HydrophobicContact CD2-CE2 4.16Å; L300-F337 HydrophobicContact CD2-CZ 4.23Å; L300-F337 HydrophobicContact CG-CE2 4.28Å; L300-F337 HydrophobicContact CG-CZ 4.41Å; F310-F337 HydrophobicContact CD2-CZ 4.12Å; F310-F337 HydrophobicContact CE2-CE2 4.26Å; F310-F337 AromaticContact CE2-CZ 3.68Å; F310-F337 HydrophobicContact CE2-CZ 3.68Å; F337-F344 HydrophobicContact CD1-CB 3.76Å; F337-F344 HydrophobicContact CD1-CD1 4.32Å; F337-F344 HydrophobicContact CD1-CG 4.43Å; F337-F344 HydrophobicContact CE1-CB 4.03Å; F337-F344 AromaticContact CE1-CD1 3.79Å; F337-F344 HydrophobicContact CE1-CD1 3.79Å; F337-F344 HydrophobicContact CE1-CG 4.21Å; F337-F344 HydrophobicContact CG-CB 4.32Å; F337-L358 HydrophobicContact CE1-CD2 4.13Å; F337-L358 HydrophobicContact CZ-CD2 4.4Å; F337-F379 WeakPolarHBondContact O-CD2 3.46Å
338	H	94.1	Very high	87.4	Confident	9 Å²	9	22 Å²	22	4%	0.042	13%	0.126	C	C	.	.			trans	-66.5	143.7	158.5	178.3	-93.8	0	0	0	107.3	D340 G341 I343 F379 G383	H338-D340 VanDerWaalsContact CE1-CG 3.48Å; H338-D340 IonicContact CE1-OD1 3.1Å; H338-D340 IonicContact CE1-OD2 3.59Å; H338-D340 PolarHBondContact CE1-OD2 2.93Å; H338-D340 IonicContact CG-OD1 2.76Å; H338-D340 PolarHBondContact ND1-N 2.87Å; H338-D340 IonicContact ND1-OD1 3.68Å; H338-D340 PolarHBondContact ND1-OD1 2.74Å; H338-D340 IonicContact ND1-OD2 3.34Å; H338-D340 PolarHBondContact ND1-OD2 3.48Å; H338-D340 VanDerWaalsContact ND1-OD2 3.15Å; H338-D340 PolarHBondContact O-N 2.86Å; H338-G341 PolarHBondContact O-N 3.42Å; H338-I343 HydrophobicContact CB-CD1 4.04Å; H338-I343 HydrophobicContact CB-CG1 3.32Å; H338-I343 VanDerWaalsContact CB-O 3.24Å; H338-I343 WeakPolarHBondContact CB-O 3.43Å; H338-I343 PolarHBondContact N-O 3.06Å; H338-F379 HydrophobicContact CB-CD1 4.09Å; H338-F379 HydrophobicContact CB-CD2 4.27Å; H338-F379 HydrophobicContact CB-CE1 4.03Å; H338-F379 HydrophobicContact CB-CE2 4.26Å; H338-F379 HydrophobicContact CB-CG 4.19Å; H338-F379 HydrophobicContact CB-CZ 4.12Å; H338-F379 AromaticContact CD2-CD1 3.49Å; H338-F379 VanDerWaalsContact CD2-CD1 3.49Å; H338-F379 WeakPolarHBondContact CD2-CD1 3.45Å; H338-F379 AromaticContact CD2-CE1 3.89Å; H338-G383 WeakPolarHBondContact NE2-CA 3.32Å; H338-G383 PolarHBondContact NE2-O 3.39Å; H338-G383 VanDerWaalsContact NE2-O 3.11Å
339	P	89.8	Confident	89.1	Confident	18 Å²	18	20.7 Å²	20.7	12%	0.117	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	4.1	-162.7	34.6	-39.1	0	0	0	111.7	R164 G341 F379 E381	R164-P339 VanDerWaalsContact CZ-CB 3.41Å; R164-P339 VanDerWaalsContact CZ-O 3.22Å; R164-P339 PolarHBondContact NH1-O 3.33Å; R164-P339 PolarHBondContact NH2-O 3Å; P339-G341 VanDerWaalsContact C-N 3.34Å; P339-F379 HydrophobicContact CG-CB 4.4Å; P339-E381 WeakPolarHBondContact CB-OE1 3.22Å
340	D	87.2	Confident	90.3	Very high	24 Å²	24	22.2 Å²	22.2	13%	0.128	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-18	164.8	69.1	-4.1	0	0	0	112.5	A157 H338 L342	A157-D340 WeakPolarHBondContact CA-O 3.4Å; A157-D340 WeakPolarHBondContact CB-O 3.46Å; H338-D340 VanDerWaalsContact CE1-CG 3.48Å; H338-D340 IonicContact CE1-OD1 3.1Å; H338-D340 IonicContact CE1-OD2 3.59Å; H338-D340 PolarHBondContact CE1-OD2 2.93Å; H338-D340 IonicContact CG-OD1 2.76Å; H338-D340 PolarHBondContact ND1-N 2.87Å; H338-D340 IonicContact ND1-OD1 3.68Å; H338-D340 PolarHBondContact ND1-OD1 2.74Å; H338-D340 IonicContact ND1-OD2 3.34Å; H338-D340 PolarHBondContact ND1-OD2 3.48Å; H338-D340 VanDerWaalsContact ND1-OD2 3.15Å; H338-D340 PolarHBondContact O-N 2.86Å; D340-L342 VanDerWaalsContact C-N 3.31Å; D340-L342 PolarHBondContact O-N 3.07Å; D340-L342 PolarHBondContact OD1-N 3.22Å
341	G	88.2	Confident	91.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	84.6	-10.8	-179.5	0	0	0	0	0	115.8	H293 H338 P339	H293-G341 PolarHBondContact CD2-O 2.93Å; H293-G341 WeakPolarHBondContact NE2-CA 3.39Å; H293-G341 PolarHBondContact NE2-O 3.14Å; H338-G341 PolarHBondContact O-N 3.42Å; P339-G341 VanDerWaalsContact C-N 3.34Å
342	L	89.6	Confident	91.7	Very high	47 Å²	47	20.2 Å²	20.2	25%	0.246	11%	0.114	C	C	.	.	S	Bend	trans	-85.6	-35.4	-175.8	-67.7	173.1	0	0	0	112.4	A157 D340 L358	A157-L342 HydrophobicContact CB-CD1 3.75Å; A157-L342 HydrophobicContact CB-CD2 4.02Å; A157-L342 HydrophobicContact CB-CG 3.59Å; D340-L342 VanDerWaalsContact C-N 3.31Å; D340-L342 PolarHBondContact O-N 3.07Å; D340-L342 PolarHBondContact OD1-N 3.22Å; L342-L358 WeakPolarHBondContact O-CB 3.36Å; L342-L358 PolarHBondContact O-N 3.49Å
343	I	93.7	Very high	91.9	Very high	40 Å²	40	20.1 Å²	20.1	21%	0.205	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	158.7	-179.4	69	-180	0	0	0	111.1	H338 I355 W356	H338-I343 HydrophobicContact CB-CD1 4.04Å; H338-I343 HydrophobicContact CB-CG1 3.32Å; H338-I343 VanDerWaalsContact CB-O 3.24Å; H338-I343 WeakPolarHBondContact CB-O 3.43Å; H338-I343 PolarHBondContact N-O 3.06Å; I343-I355 HydrophobicContact CB-CG2 4.17Å; I343-I355 HydrophobicContact CD1-CG2 4.25Å; I343-W356 CarbonylContact C-O 3.6Å; I343-W356 WeakPolarHBondContact CA-O 3.39Å; I343-W356 WeakPolarHBondContact CB-O 3.31Å
344	F	95.4	Very high	91.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	151.6	173.5	56.8	-85.4	0	0	0	111	L300 W308 Q336 F337 I346 I355 W356 L358	L300-F344 HydrophobicContact CD1-CD2 4.17Å; L300-F344 HydrophobicContact CD1-CE2 3.84Å; L300-F344 HydrophobicContact CD1-CZ 4.14Å; L300-F344 HydrophobicContact CD2-CB 3.83Å; L300-F344 HydrophobicContact CD2-CD1 4.43Å; L300-F344 HydrophobicContact CD2-CD2 3.36Å; L300-F344 HydrophobicContact CD2-CE2 3.92Å; L300-F344 HydrophobicContact CD2-CG 3.64Å; L300-F344 HydrophobicContact CG-CD2 4.41Å; W308-F344 HydrophobicContact CD2-CE2 4.02Å; W308-F344 AromaticContact CD2-CZ 3.78Å; W308-F344 HydrophobicContact CD2-CZ 3.78Å; W308-F344 AromaticContact CE2-CZ 3.73Å; W308-F344 HydrophobicContact CE3-CE2 4.23Å; W308-F344 AromaticContact CE3-CZ 3.76Å; W308-F344 HydrophobicContact CE3-CZ 3.76Å; W308-F344 HydrophobicContact CG-CE2 4.34Å; W308-F344 HydrophobicContact CH2-CE1 4.25Å; W308-F344 AromaticContact CH2-CZ 3.7Å; W308-F344 HydrophobicContact CH2-CZ 3.7Å; W308-F344 AromaticContact CZ2-CZ 3.72Å; W308-F344 HydrophobicContact CZ2-CZ 3.72Å; W308-F344 HydrophobicContact CZ3-CE1 4.31Å; W308-F344 AromaticContact CZ3-CZ 3.71Å; W308-F344 HydrophobicContact CZ3-CZ 3.71Å; Q336-F344 CarbonylContact O-C 3.54Å; Q336-F344 VanDerWaalsContact O-CA 3.32Å; Q336-F344 WeakPolarHBondContact O-CA 3.28Å; Q336-F344 VanDerWaalsContact O-CB 3.27Å; Q336-F344 WeakPolarHBondContact O-CB 3.33Å; F337-F344 HydrophobicContact CD1-CB 3.76Å; F337-F344 HydrophobicContact CD1-CD1 4.32Å; F337-F344 HydrophobicContact CD1-CG 4.43Å; F337-F344 HydrophobicContact CE1-CB 4.03Å; F337-F344 AromaticContact CE1-CD1 3.79Å; F337-F344 HydrophobicContact CE1-CD1 3.79Å; F337-F344 HydrophobicContact CE1-CG 4.21Å; F337-F344 HydrophobicContact CG-CB 4.32Å; F344-I346 HydrophobicContact CD2-CD1 4.4Å; F344-I346 HydrophobicContact CD2-CG1 3.98Å; F344-I346 HydrophobicContact CE2-CD1 3.93Å; F344-I346 HydrophobicContact CE2-CG1 4.02Å; F344-I355 WeakPolarHBondContact O-CA 3.48Å; F344-W356 HydrophobicContact CD1-CB 4.18Å; F344-W356 HydrophobicContact CD2-CB 3.99Å; F344-W356 HydrophobicContact CE1-CB 3.68Å; F344-W356 HydrophobicContact CE2-CB 3.51Å; F344-W356 AromaticContact CE2-CG 3.89Å; F344-W356 HydrophobicContact CE2-CG 3.89Å; F344-W356 HydrophobicContact CG-CB 4.32Å; F344-W356 HydrophobicContact CZ-CB 3.32Å; F344-W356 AromaticContact CZ-CG 3.98Å; F344-W356 HydrophobicContact CZ-CG 3.98Å; F344-W356 PolarHBondContact N-O 3.2Å; F344-W356 PolarHBondContact O-N 2.83Å; F344-L358 HydrophobicContact CD1-CB 4.36Å; F344-L358 HydrophobicContact CE1-CB 4.09Å; F344-L358 HydrophobicContact CE1-CD1 4.02Å
345	G	94.2	Very high	91.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	137.7	176	0	0	0	0	0	110.7	A335 Q336 K354	A335-G345 CarbonylContact C-O 3.59Å; A335-G345 VanDerWaalsContact CA-O 3.22Å; A335-G345 WeakPolarHBondContact CA-O 3.4Å; Q336-G345 PolarHBondContact N-O 2.94Å; Q336-G345 PolarHBondContact O-N 2.77Å; G345-K354 CarbonylContact C-O 3.58Å; G345-K354 WeakPolarHBondContact CA-O 3.46Å
346	I	94.1	Very high	91.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129	169.8	-56	-176.9	0	0	0	108.4	V302 W308 M332 C334 A335 F344 I353 K354 W356	V302-I346 HydrophobicContact CG1-CD1 4.1Å; V302-I346 HydrophobicContact CG1-CG1 4.27Å; V302-I346 HydrophobicContact CG1-CG2 4.4Å; W308-I346 HydrophobicContact CB-CD1 4.02Å; W308-I346 HydrophobicContact CG-CD1 3.98Å; M332-I346 HydrophobicContact CB-CG2 3.8Å; M332-I346 HydrophobicContact CE-CD1 4.1Å; M332-I346 HydrophobicContact CG-CG2 3.64Å; M332-I346 HydrophobicContact SD-CD1 3.86Å; M332-I346 HydrophobicContact SD-CG2 3.86Å; C334-I346 WeakPolarHBondContact O-CA 3.15Å; A335-I346 HydrophobicContact CB-CG1 4.39Å; F344-I346 HydrophobicContact CD2-CD1 4.4Å; F344-I346 HydrophobicContact CD2-CG1 3.98Å; F344-I346 HydrophobicContact CE2-CD1 3.93Å; F344-I346 HydrophobicContact CE2-CG1 4.02Å; I346-I353 CarbonylContact O-C 3.59Å; I346-I353 WeakPolarHBondContact O-CA 3.48Å; I346-I353 WeakPolarHBondContact O-CG2 3.43Å; I346-K354 PolarHBondContact N-O 3.3Å; I346-K354 PolarHBondContact O-N 3.49Å; I346-W356 HydrophobicContact CD1-CG 4.49Å
347	G	92.9	Very high	91.6	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	132.9	168.6	0	0	0	0	0	110.4	T333 C334	T333-G347 PolarHBondContact N-O 3.45Å; T333-G347 PolarHBondContact OG1-O 3.32Å; C334-G347 PolarHBondContact O-N 2.87Å
348	N	91.1	Very high	91.4	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	163.7	178.8	-63.2	-28.4	0	0	0	112.2	D350 T352 K354 I374	N348-D350 VanDerWaalsContact C-N 3.25Å; N348-T352 WeakPolarHBondContact CB-O 3.33Å; N348-T352 PolarHBondContact N-O 2.78Å; N348-T352 VanDerWaalsContact N-O 3.16Å; N348-K354 WeakPolarHBondContact ND2-CD 3.35Å; N348-K354 WeakPolarHBondContact ND2-CG 3.37Å; N348-I374 PolarHBondContact O-N 2.95Å
349	V	90	Very high	91	Very high	60 Å²	60	23.5 Å²	23.5	36%	0.364	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-31.2	167.2	172.6	0	0	0	0	111.2	Q330 G331 T333 T351 A373	Q330-V349 HydrophobicContact CB-CB 4.19Å; Q330-V349 HydrophobicContact CB-CG1 4.46Å; G331-V349 VanDerWaalsContact O-CG2 3.23Å; G331-V349 WeakPolarHBondContact O-CG2 3.49Å; G331-V349 PolarHBondContact O-N 2.95Å; G331-V349 VanDerWaalsContact O-N 3.16Å; T333-V349 HydrophobicContact CG2-CG2 3.57Å; V349-T351 PolarHBondContact O-N 3.29Å; V349-A373 HydrophobicContact CB-CB 4.49Å; V349-A373 HydrophobicContact CG1-CB 4.42Å; V349-A373 HydrophobicContact CG2-CB 4.4Å
350	D	83.7	Confident	90.8	Very high	39 Å²	39	27.5 Å²	27.5	21%	0.209	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	21.5	177.9	-56.7	-50.1	0	0	0	114.8	Q330 N348 T352	Q330-D350 VanDerWaalsContact CB-OD1 3.22Å; Q330-D350 WeakPolarHBondContact CB-OD1 3.04Å; Q330-D350 WeakPolarHBondContact CB-OD2 3.49Å; Q330-D350 WeakPolarHBondContact CG-OD1 3.34Å; Q330-D350 PolarHBondContact N-OD2 3.47Å; Q330-D350 PolarHBondContact OE1-OD1 3.24Å; N348-D350 VanDerWaalsContact C-N 3.25Å; D350-T352 PolarHBondContact O-N 3.38Å
351	T	89.2	Confident	90.9	Very high	43 Å²	43	30.3 Å²	30.3	26%	0.264	15%	0.15	S	C	.	.	S	Bend	trans	61.5	7	176.4	91.9	0	0	0	0	115.6	V349 H370 G372	V349-T351 PolarHBondContact O-N 3.29Å; T351-H370 WeakPolarHBondContact CB-O 3.2Å; T351-H370 PolarHBondContact OG1-O 2.86Å; T351-G372 WeakPolarHBondContact CA-O 3.36Å; T351-G372 WeakPolarHBondContact CB-O 3.48Å; T351-G372 VanDerWaalsContact CG2-N 3.29Å; T351-G372 WeakPolarHBondContact CG2-O 3.44Å
352	T	90.9	Very high	90.9	Very high	35 Å²	35	33.6 Å²	33.6	22%	0.215	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-102.3	138.3	178.9	53.8	0	0	0	0	110.9	N348 D350 I374	N348-T352 WeakPolarHBondContact CB-O 3.33Å; N348-T352 PolarHBondContact N-O 2.78Å; N348-T352 VanDerWaalsContact N-O 3.16Å; D350-T352 PolarHBondContact O-N 3.38Å; T352-I374 WeakPolarHBondContact O-CD1 3.49Å
353	I	93.4	Very high	91	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	124	169	-50.4	160.8	0	0	0	107.3	I346 I355 N366 F367 I374 L377 L386 S388 W398	I346-I353 CarbonylContact O-C 3.59Å; I346-I353 WeakPolarHBondContact O-CA 3.48Å; I346-I353 WeakPolarHBondContact O-CG2 3.43Å; I353-I355 HydrophobicContact CG2-CD1 4.35Å; I353-N366 CarbonylContact O-C 3.46Å; I353-N366 WeakPolarHBondContact O-CA 3.47Å; I353-F367 HydrophobicContact CB-CB 4.15Å; I353-F367 HydrophobicContact CB-CD2 4.45Å; I353-F367 HydrophobicContact CD1-CB 4.48Å; I353-F367 PolarHBondContact N-O 3.05Å; I353-F367 VanDerWaalsContact N-O 3.16Å; I353-F367 PolarHBondContact O-N 3.25Å; I353-I374 HydrophobicContact CB-CD1 4.36Å; I353-I374 HydrophobicContact CG1-CD1 3.4Å; I353-I374 VanDerWaalsContact CG1-CD1 3.4Å; I353-I374 HydrophobicContact CG1-CG1 4.15Å; I353-L377 HydrophobicContact CD1-CD2 3.93Å; I353-L377 HydrophobicContact CG1-CD2 4.11Å; I353-L377 HydrophobicContact CG2-CD1 4.05Å; I353-L377 HydrophobicContact CG2-CD2 3.95Å; I353-L386 HydrophobicContact CG2-CD2 4.15Å; I353-S388 VanDerWaalsContact CD1-CB 3.4Å; I353-S388 WeakPolarHBondContact CD1-OG 3.2Å; I353-W398 HydrophobicContact CD1-CZ2 4.35Å
354	K	92.1	Very high	90.8	Very high	20 Å²	20	36.1 Å²	36.1	9%	0.087	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.4	177.5	-64.5	-169.9	166.3	178.6	0	109.4	D324 G345 I346 N348 N363 N366	D324-K354 IonicContact OD1-NZ 2.88Å; D324-K354 PolarHBondContact OD1-NZ 3Å; D324-K354 IonicContact OD2-NZ 2.59Å; D324-K354 PolarHBondContact OD2-NZ 3.16Å; G345-K354 CarbonylContact C-O 3.58Å; G345-K354 WeakPolarHBondContact CA-O 3.46Å; I346-K354 PolarHBondContact N-O 3.3Å; I346-K354 PolarHBondContact O-N 3.49Å; N348-K354 WeakPolarHBondContact ND2-CD 3.35Å; N348-K354 WeakPolarHBondContact ND2-CG 3.37Å; K354-N363 WeakPolarHBondContact CB-ND2 3.34Å; K354-N363 WeakPolarHBondContact CD-ND2 3.28Å; K354-N363 WeakPolarHBondContact CG-ND2 3.12Å; K354-N366 WeakPolarHBondContact CG-OD1 3.28Å
355	I	94.3	Very high	90.6	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.036	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.5	170.6	-53.1	-55.5	0	0	0	108.6	I343 F344 I353 N363 V364 A365 F367 F379 L386	I343-I355 HydrophobicContact CB-CG2 4.17Å; I343-I355 HydrophobicContact CD1-CG2 4.25Å; F344-I355 WeakPolarHBondContact O-CA 3.48Å; I353-I355 HydrophobicContact CG2-CD1 4.35Å; I355-N363 WeakPolarHBondContact O-CA 3.37Å; I355-V364 PolarHBondContact O-N 3.39Å; I355-A365 HydrophobicContact CB-CB 4.15Å; I355-A365 HydrophobicContact CG1-CB 4.27Å; I355-A365 PolarHBondContact N-O 3.12Å; I355-A365 PolarHBondContact O-N 3.22Å; I355-F367 HydrophobicContact CD1-CD2 4.27Å; I355-F367 HydrophobicContact CD1-CE2 3.95Å; I355-F367 HydrophobicContact CG1-CD2 3.98Å; I355-F367 HydrophobicContact CG1-CE2 3.51Å; I355-F379 HydrophobicContact CD1-CZ 4.25Å; I355-L386 HydrophobicContact CD1-CD2 3.96Å
356	W	93.1	Very high	90.5	Very high	12 Å²	12	40.8 Å²	40.8	5%	0.045	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.4	-179.5	-71.7	82.5	0	0	0	110.7	W308 V322 D324 I343 F344 I346 R361 T362 N363	W308-W356 HydrophobicContact CZ2-CD2 4.45Å; W308-W356 AromaticContact CZ2-CE3 3.91Å; W308-W356 HydrophobicContact CZ2-CE3 3.91Å; W308-W356 HydrophobicContact CZ2-CZ3 4.32Å; W308-W356 AromaticContact NE1-CD2 3.65Å; W308-W356 AromaticContact NE1-CE2 3.75Å; W308-W356 AromaticContact NE1-CE3 3.64Å; W308-W356 AromaticContact NE1-CH2 3.89Å; W308-W356 AromaticContact NE1-CZ2 3.89Å; W308-W356 AromaticContact NE1-CZ3 3.76Å; V322-W356 HydrophobicContact CG1-CH2 4.35Å; V322-W356 HydrophobicContact CG1-CZ3 4.09Å; D324-W356 HydrophobicContact CB-CZ2 4.45Å; I343-W356 CarbonylContact C-O 3.6Å; I343-W356 WeakPolarHBondContact CA-O 3.39Å; I343-W356 WeakPolarHBondContact CB-O 3.31Å; F344-W356 HydrophobicContact CD1-CB 4.18Å; F344-W356 HydrophobicContact CD2-CB 3.99Å; F344-W356 HydrophobicContact CE1-CB 3.68Å; F344-W356 HydrophobicContact CE2-CB 3.51Å; F344-W356 AromaticContact CE2-CG 3.89Å; F344-W356 HydrophobicContact CE2-CG 3.89Å; F344-W356 HydrophobicContact CG-CB 4.32Å; F344-W356 HydrophobicContact CZ-CB 3.32Å; F344-W356 AromaticContact CZ-CG 3.98Å; F344-W356 HydrophobicContact CZ-CG 3.98Å; F344-W356 PolarHBondContact N-O 3.2Å; F344-W356 PolarHBondContact O-N 2.83Å; I346-W356 HydrophobicContact CD1-CG 4.49Å; W356-R361 WeakPolarHBondContact CZ3-O 3.38Å; W356-T362 WeakPolarHBondContact CA-O 3.44Å; W356-N363 HydrophobicContact CD2-CB 4.3Å; W356-N363 HydrophobicContact CE3-CB 4.45Å; W356-N363 HydrophobicContact CH2-CB 4.38Å; W356-N363 HydrophobicContact CZ2-CB 4.22Å; W356-N363 HydrophobicContact CZ3-CB 4.49Å
357	D	92	Very high	90.3	Very high	38 Å²	38	41 Å²	41	20%	0.203	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.5	164.5	-173.2	-22.3	0	0	0	108.6	K359 E360 R361 T362 V364	D357-K359 VanDerWaalsContact C-N 3.32Å; D357-K359 WeakPolarHBondContact OD1-CB 3.49Å; D357-K359 PolarHBondContact OD1-N 2.82Å; D357-E360 HydrophobicContact CB-CB 4.44Å; D357-R361 WeakPolarHBondContact O-CA 3.12Å; D357-R361 PolarHBondContact O-N 3.39Å; D357-T362 PolarHBondContact N-O 3.37Å; D357-T362 PolarHBondContact O-N 2.87Å; D357-V364 HydrophobicContact CB-CG2 3.56Å
358	L	89.9	Confident	90.2	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.042	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-35.6	179.9	-176.6	65.1	0	0	0	112.1	L153 W308 F310 F320 F337 L342 F344	L153-L358 HydrophobicContact CD1-CD2 4.01Å; W308-L358 HydrophobicContact CZ3-CD1 4.34Å; F310-L358 HydrophobicContact CD1-CD1 4.43Å; F310-L358 HydrophobicContact CD2-CD1 3.85Å; F310-L358 HydrophobicContact CE1-CD2 4.47Å; F310-L358 HydrophobicContact CE2-CD1 3.97Å; F310-L358 HydrophobicContact CE2-CD2 3.96Å; F310-L358 HydrophobicContact CG-CD1 4.08Å; F310-L358 HydrophobicContact CZ-CD1 4.29Å; F310-L358 HydrophobicContact CZ-CD2 3.82Å; F320-L358 HydrophobicContact CE2-CD1 4.45Å; F320-L358 HydrophobicContact CZ-CD1 4.12Å; F337-L358 HydrophobicContact CE1-CD2 4.13Å; F337-L358 HydrophobicContact CZ-CD2 4.4Å; L342-L358 WeakPolarHBondContact O-CB 3.36Å; L342-L358 PolarHBondContact O-N 3.49Å; F344-L358 HydrophobicContact CD1-CB 4.36Å; F344-L358 HydrophobicContact CE1-CB 4.09Å; F344-L358 HydrophobicContact CE1-CD1 4.02Å
359	K	86.2	Confident	89.8	Confident	102 Å²	102	47.3 Å²	47.3	44%	0.443	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-54.4	-174.9	-175.9	177.2	-172.7	169.2	0	111.2	D357 R361	D357-K359 VanDerWaalsContact C-N 3.32Å; D357-K359 WeakPolarHBondContact OD1-CB 3.49Å; D357-K359 PolarHBondContact OD1-N 2.82Å; K359-R361 PolarHBondContact O-N 2.94Å
360	E	86	Confident	89.8	Confident	102 Å²	102	44.9 Å²	44.9	48%	0.477	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-12.9	-179	-62.4	-63.8	148.3	0	0	111.9	D357 T362	D357-E360 HydrophobicContact CB-CB 4.44Å; E360-T362 HydrophobicContact CB-CG2 4.22Å; E360-T362 WeakPolarHBondContact CB-OG1 3.45Å; E360-T362 WeakPolarHBondContact O-CG2 3.49Å; E360-T362 PolarHBondContact O-N 3.45Å
361	R	88.8	Confident	90	Very high	83 Å²	83	47 Å²	47	31%	0.313	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	37.1	-174.8	-53.2	177.3	-172	173.5	3.6	111.4	E146 W308 F320 V322 W356 D357 K359	E146-R361 IonicContact OE1-CZ 3.8Å; E146-R361 IonicContact OE1-NH1 2.88Å; E146-R361 IonicContact OE1-NH2 3.53Å; E146-R361 PolarHBondContact OE1-NH2 3.17Å; E146-R361 IonicContact OE2-NH2 3.88Å; E146-R361 PolarHBondContact OE2-NH2 3.24Å; E146-R361 VanDerWaalsContact OE2-NH2 3.1Å; W308-R361 HydrophobicContact CH2-CB 4.47Å; W308-R361 HydrophobicContact CH2-CG 4.38Å; W308-R361 HydrophobicContact CZ2-CB 4.43Å; F320-R361 HydrophobicContact CE2-CG 4.24Å; V322-R361 HydrophobicContact CG2-CB 4.27Å; W356-R361 WeakPolarHBondContact CZ3-O 3.38Å; D357-R361 WeakPolarHBondContact O-CA 3.12Å; D357-R361 PolarHBondContact O-N 3.39Å; K359-R361 PolarHBondContact O-N 2.94Å
362	T	89.1	Confident	90	Very high	69 Å²	69	45.7 Å²	45.7	42%	0.423	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	149.7	-178.2	55.9	0	0	0	0	111.3	W356 D357 E360 V364	W356-T362 WeakPolarHBondContact CA-O 3.44Å; D357-T362 PolarHBondContact N-O 3.37Å; D357-T362 PolarHBondContact O-N 2.87Å; E360-T362 HydrophobicContact CB-CG2 4.22Å; E360-T362 WeakPolarHBondContact CB-OG1 3.45Å; E360-T362 WeakPolarHBondContact O-CG2 3.49Å; E360-T362 PolarHBondContact O-N 3.45Å; T362-V364 PolarHBondContact O-N 2.78Å
363	N	89.9	Confident	90	Very high	49 Å²	49	44.6 Å²	44.6	26%	0.262	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	119.1	167.4	-178.7	-50.4	0	0	0	108.9	K354 I355 W356 A365 N366	K354-N363 WeakPolarHBondContact CB-ND2 3.34Å; K354-N363 WeakPolarHBondContact CD-ND2 3.28Å; K354-N363 WeakPolarHBondContact CG-ND2 3.12Å; I355-N363 WeakPolarHBondContact O-CA 3.37Å; W356-N363 HydrophobicContact CD2-CB 4.3Å; W356-N363 HydrophobicContact CE3-CB 4.45Å; W356-N363 HydrophobicContact CH2-CB 4.38Å; W356-N363 HydrophobicContact CZ2-CB 4.22Å; W356-N363 HydrophobicContact CZ3-CB 4.49Å; N363-A365 PolarHBondContact OD1-N 3.48Å; N363-A365 PolarHBondContact OD1-O 2.96Å; N363-N366 PolarHBondContact ND2-OD1 3.33Å; N363-N366 PolarHBondContact OD1-ND2 3.15Å; N363-N366 PolarHBondContact OD1-OD1 3.13Å
364	V	90.9	Very high	90	Very high	91 Å²	91	44.6 Å²	44.6	55%	0.552	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	-31	-177	-168.8	0	0	0	0	111.7	I355 D357 T362	I355-V364 PolarHBondContact O-N 3.39Å; D357-V364 HydrophobicContact CB-CG2 3.56Å; T362-V364 PolarHBondContact O-N 2.78Å
365	A	91.1	Very high	90.2	Very high	12 Å²	12	48 Å²	48	10%	0.099	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	149.2	-179.1	0	0	0	0	0	112.3	I355 N363 L403	I355-A365 HydrophobicContact CB-CB 4.15Å; I355-A365 HydrophobicContact CG1-CB 4.27Å; I355-A365 PolarHBondContact N-O 3.12Å; I355-A365 PolarHBondContact O-N 3.22Å; N363-A365 PolarHBondContact OD1-N 3.48Å; N363-A365 PolarHBondContact OD1-O 2.96Å; A365-L403 HydrophobicContact CB-CD1 4.37Å; A365-L403 HydrophobicContact CB-CD2 3.64Å
366	N	91.2	Very high	90.2	Very high	87 Å²	87	47.7 Å²	47.7	47%	0.465	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131	174	-63.4	-52.7	0	0	0	109.3	I353 K354 N363 P368	I353-N366 CarbonylContact O-C 3.46Å; I353-N366 WeakPolarHBondContact O-CA 3.47Å; K354-N366 WeakPolarHBondContact CG-OD1 3.28Å; N363-N366 PolarHBondContact ND2-OD1 3.33Å; N363-N366 PolarHBondContact OD1-ND2 3.15Å; N363-N366 PolarHBondContact OD1-OD1 3.13Å; N366-P368 WeakPolarHBondContact O-CD 3.04Å
367	F	91.4	Very high	90.3	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	95.7	174.1	-63.9	-72.9	0	0	0	109.9	I353 I355 W398 L400 L403	I353-F367 HydrophobicContact CB-CB 4.15Å; I353-F367 HydrophobicContact CB-CD2 4.45Å; I353-F367 HydrophobicContact CD1-CB 4.48Å; I353-F367 PolarHBondContact N-O 3.05Å; I353-F367 VanDerWaalsContact N-O 3.16Å; I353-F367 PolarHBondContact O-N 3.25Å; I355-F367 HydrophobicContact CD1-CD2 4.27Å; I355-F367 HydrophobicContact CD1-CE2 3.95Å; I355-F367 HydrophobicContact CG1-CD2 3.98Å; I355-F367 HydrophobicContact CG1-CE2 3.51Å; F367-W398 HydrophobicContact CB-CD2 4.01Å; F367-W398 HydrophobicContact CB-CE3 3.83Å; F367-W398 HydrophobicContact CB-CH2 4.05Å; F367-W398 HydrophobicContact CB-CZ2 4.22Å; F367-W398 HydrophobicContact CB-CZ3 3.84Å; F367-W398 HydrophobicContact CD1-CB 4.4Å; F367-W398 AromaticContact CD1-CD2 3.9Å; F367-W398 HydrophobicContact CD1-CD2 3.9Å; F367-W398 AromaticContact CD1-CE3 3.32Å; F367-W398 HydrophobicContact CD1-CE3 3.32Å; F367-W398 HydrophobicContact CD1-CG 4.36Å; F367-W398 AromaticContact CD1-CZ3 3.87Å; F367-W398 HydrophobicContact CD1-CZ3 3.87Å; F367-W398 HydrophobicContact CE1-CB 4.21Å; F367-W398 HydrophobicContact CE1-CE3 4.05Å; F367-W398 HydrophobicContact CG-CD2 4.02Å; F367-W398 AromaticContact CG-CE3 3.82Å; F367-W398 HydrophobicContact CG-CE3 3.82Å; F367-W398 HydrophobicContact CG-CG 4.41Å; F367-W398 HydrophobicContact CG-CZ3 4.27Å; F367-W398 HydrophobicContact CZ-CB 4.41Å; F367-L400 HydrophobicContact CE2-CD2 3.83Å; F367-L400 HydrophobicContact CZ-CD2 3.84Å; F367-L403 HydrophobicContact CE1-CB 4.26Å; F367-L403 HydrophobicContact CE1-CD2 4.18Å; F367-L403 HydrophobicContact CZ-CD2 3.73Å
368	P	89.7	Confident	90.5	Very high	91 Å²	91	46 Å²	46	59%	0.591	26%	0.264	S	S	*	.			trans	-79.2	146.5	169.6	32.8	-33.8	0	0	0	110.3	N366 W398	N366-P368 WeakPolarHBondContact O-CD 3.04Å; P368-W398 VanDerWaalsContact O-CH2 3.3Å; P368-W398 WeakPolarHBondContact O-CH2 3.07Å
369	G	82.8	Confident	90.8	Very high	42 Å²	42	46.1 Å²	46.1	43%	0.433	26%	0.264	S	S	.	.			trans	146.7	-6.8	165.6	0	0	0	0	0	116.6	K396	G369-K396 WeakPolarHBondContact O-CE 3.32Å; G369-K396 PolarHBondContact O-NZ 3.03Å; G369-K396 VanDerWaalsContact O-NZ 3.17Å
370	H	89.4	Confident	91.1	Very high	9 Å²	9	41.2 Å²	41.2	4%	0.042	24%	0.243	C	C	.	.			trans	-73.9	152.7	165.8	-86.2	-73.4	0	0	0	110.6	T351 S388 D392 A394	T351-H370 WeakPolarHBondContact CB-O 3.2Å; T351-H370 PolarHBondContact OG1-O 2.86Å; H370-S388 PolarHBondContact NE2-OG 3.32Å; H370-D392 VanDerWaalsContact CA-OD2 3.3Å; H370-D392 WeakPolarHBondContact CA-OD2 3.15Å; H370-D392 IonicContact CE1-OD1 2.71Å; H370-D392 IonicContact CE1-OD2 2.97Å; H370-D392 IonicContact CG-OD2 3.6Å; H370-D392 IonicContact ND1-OD1 3.37Å; H370-D392 PolarHBondContact ND1-OD1 3.43Å; H370-D392 IonicContact ND1-OD2 2.79Å; H370-D392 PolarHBondContact ND1-OD2 3.15Å; H370-A394 PolarHBondContact CE1-O 2.8Å
371	A	88.6	Confident	91.3	Very high	84 Å²	84	38.9 Å²	38.9	69%	0.694	23%	0.232	S	C	*	.	S	Bend	trans	-112.3	47.4	175	0	0	0	0	0	111.1	D392	A371-D392 HydrophobicContact CB-CB 3.91Å; A371-D392 PolarHBondContact N-OD2 3.27Å
372	G	88.9	Confident	91.1	Very high	15 Å²	15	37.5 Å²	37.5	16%	0.155	23%	0.23	C	C	.	.	S	Bend	trans	169.5	172	-179.9	0	0	0	0	0	111.8	T351 I374	T351-G372 WeakPolarHBondContact CA-O 3.36Å; T351-G372 WeakPolarHBondContact CB-O 3.48Å; T351-G372 VanDerWaalsContact CG2-N 3.29Å; T351-G372 WeakPolarHBondContact CG2-O 3.44Å; G372-I374 PolarHBondContact O-N 3.14Å
373	A	91.5	Very high	91	Very high	11 Å²	11	34.9 Å²	34.9	9%	0.091	22%	0.218	C	C	.	.			trans	-61.7	133.8	178.5	0	0	0	0	0	109.9	V349 G390 D391	V349-A373 HydrophobicContact CB-CB 4.49Å; V349-A373 HydrophobicContact CG1-CB 4.42Å; V349-A373 HydrophobicContact CG2-CB 4.4Å; A373-G390 CarbonylContact O-C 3.6Å; A373-G390 WeakPolarHBondContact O-CA 3.07Å; A373-D391 PolarHBondContact O-N 3.5Å
374	I	94.1	Very high	91	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	138.8	176.1	-64	143	0	0	0	107.7	T333 N348 T352 I353 G372 L377	T333-I374 WeakPolarHBondContact CB-O 3.36Å; T333-I374 WeakPolarHBondContact CG2-O 3.38Å; T333-I374 PolarHBondContact OG1-O 3.48Å; N348-I374 PolarHBondContact O-N 2.95Å; T352-I374 WeakPolarHBondContact O-CD1 3.49Å; I353-I374 HydrophobicContact CB-CD1 4.36Å; I353-I374 HydrophobicContact CG1-CD1 3.4Å; I353-I374 VanDerWaalsContact CG1-CD1 3.4Å; I353-I374 HydrophobicContact CG1-CG1 4.15Å; G372-I374 PolarHBondContact O-N 3.14Å; I374-L377 HydrophobicContact CG2-CD2 4.04Å; I374-L377 HydrophobicContact CG2-CG 4.34Å
375	R	94.4	Very high	91.1	Very high	91 Å²	91	34.4 Å²	34.4	34%	0.343	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-39.7	-177.2	-66	-63.7	177.1	-173.9	-10	112.5	V389 D391	R375-V389 PolarHBondContact N-O 3.22Å; R375-D391 IonicContact CZ-OD1 3.88Å; R375-D391 IonicContact CZ-OD2 2.85Å; R375-D391 IonicContact NE-OD1 3.58Å; R375-D391 PolarHBondContact NE-OD1 3.38Å; R375-D391 IonicContact NE-OD2 3Å; R375-D391 VanDerWaalsContact NH2-CG 3.35Å; R375-D391 IonicContact NH2-OD1 3.59Å; R375-D391 PolarHBondContact NH2-OD1 2.99Å; R375-D391 VanDerWaalsContact NH2-OD1 3.11Å; R375-D391 IonicContact NH2-OD2 2.89Å; R375-D391 PolarHBondContact NH2-OD2 3.21Å
376	A	95.4	Very high	91.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.9	179.4	0	0	0	0	0	111.9	S388 V389 V420	A376-S388 WeakPolarHBondContact O-CA 3.33Å; A376-V389 HydrophobicContact CB-CG2 4.01Å; A376-V389 PolarHBondContact N-O 3.22Å; A376-V389 PolarHBondContact O-N 3.17Å; A376-V389 VanDerWaalsContact O-N 3.16Å; A376-V420 HydrophobicContact CB-CG1 3.96Å
377	L	96.1	Very high	91.6	Very high	11 Å²	11	29.7 Å²	29.7	6%	0.058	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	141	177.7	-65.2	174.3	0	0	0	108.2	Q336 I353 I374 L386 A387	Q336-L377 HydrophobicContact CB-CB 4.45Å; Q336-L377 PolarHBondContact OE1-O 3.46Å; I353-L377 HydrophobicContact CD1-CD2 3.93Å; I353-L377 HydrophobicContact CG1-CD2 4.11Å; I353-L377 HydrophobicContact CG2-CD1 4.05Å; I353-L377 HydrophobicContact CG2-CD2 3.95Å; I374-L377 HydrophobicContact CG2-CD2 4.04Å; I374-L377 HydrophobicContact CG2-CG 4.34Å; L377-L386 HydrophobicContact CB-CD1 4.19Å; L377-L386 HydrophobicContact CD2-CD1 4.28Å; L377-A387 CarbonylContact C-O 3.6Å; L377-A387 WeakPolarHBondContact CA-O 3.27Å
378	S	96.2	Very high	91.8	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.028	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	117.4	168.9	-166.1	0	0	0	0	110.7	Q336 A387 V420 F422	Q336-S378 VanDerWaalsContact OE1-C 3.27Å; S378-A387 PolarHBondContact N-O 3.11Å; S378-A387 PolarHBondContact O-N 3.43Å; S378-V420 WeakPolarHBondContact CB-O 3.37Å; S378-F422 WeakPolarHBondContact O-CD2 3.47Å; S378-F422 WeakPolarHBondContact O-CE2 3.44Å; S378-F422 PolarHBondContact OG-N 3.49Å
379	F	95.2	Very high	92.1	Very high	10 Å²	10	25.2 Å²	25.2	4%	0.044	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	142.7	164.7	-71.3	-79.1	0	0	0	110.5	Q336 F337 H338 P339 I355 L386 L400	Q336-F379 HydrophobicContact CB-CD2 4.15Å; Q336-F379 HydrophobicContact CB-CE2 4.23Å; Q336-F379 HydrophobicContact CG-CD2 4.25Å; Q336-F379 VanDerWaalsContact O-CE2 3.29Å; Q336-F379 WeakPolarHBondContact O-CE2 3.46Å; F337-F379 WeakPolarHBondContact O-CD2 3.46Å; H338-F379 HydrophobicContact CB-CD1 4.09Å; H338-F379 HydrophobicContact CB-CD2 4.27Å; H338-F379 HydrophobicContact CB-CE1 4.03Å; H338-F379 HydrophobicContact CB-CE2 4.26Å; H338-F379 HydrophobicContact CB-CG 4.19Å; H338-F379 HydrophobicContact CB-CZ 4.12Å; H338-F379 AromaticContact CD2-CD1 3.49Å; H338-F379 VanDerWaalsContact CD2-CD1 3.49Å; H338-F379 WeakPolarHBondContact CD2-CD1 3.45Å; H338-F379 AromaticContact CD2-CE1 3.89Å; P339-F379 HydrophobicContact CG-CB 4.4Å; I355-F379 HydrophobicContact CD1-CZ 4.25Å; F379-L386 HydrophobicContact CD1-CB 4.08Å; F379-L386 HydrophobicContact CD1-CD1 3.83Å; F379-L386 HydrophobicContact CD1-CG 4.45Å; F379-L386 HydrophobicContact CD2-CD1 4.1Å; F379-L386 HydrophobicContact CE1-CB 4.05Å; F379-L386 HydrophobicContact CE1-CD1 3.78Å; F379-L386 HydrophobicContact CE1-CD2 4.11Å; F379-L386 HydrophobicContact CE1-CG 4.2Å; F379-L386 HydrophobicContact CE2-CD1 3.99Å; F379-L386 HydrophobicContact CG-CD1 4.03Å; F379-L386 HydrophobicContact CZ-CD1 3.86Å; F379-L386 HydrophobicContact CZ-CD2 4.22Å; F379-L400 HydrophobicContact CD1-CD1 3.95Å; F379-L400 HydrophobicContact CE1-CD1 3.76Å; F379-L400 HydrophobicContact CE1-CD2 4.3Å
380	S	93.1	Very high	92.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.127	C	C	.	.			trans	-84.5	143.2	170	177.6	0	0	0	0	110	N382 G383 Y385	S380-N382 WeakPolarHBondContact CB-OD1 3.36Å; S380-N382 PolarHBondContact O-N 2.88Å; S380-N382 PolarHBondContact OG-N 2.71Å; S380-N382 PolarHBondContact OG-OD1 2.6Å; S380-G383 PolarHBondContact O-N 3.24Å; S380-Y385 PolarHBondContact N-O 3.33Å
381	E	89.1	Confident	92.6	Very high	53 Å²	53	26.2 Å²	26.2	25%	0.248	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-6.7	172.5	-73.8	-60.1	147.4	0	0	114	R164 P339 G383 L424	R164-E381 WeakPolarHBondContact CD-O 3.45Å; R164-E381 IonicContact CZ-OE2 3.09Å; R164-E381 VanDerWaalsContact CZ-OE2 3.24Å; R164-E381 PolarHBondContact NE-O 3.01Å; R164-E381 VanDerWaalsContact NE-O 3.14Å; R164-E381 IonicContact NE-OE2 3.6Å; R164-E381 PolarHBondContact NE-OE2 3.22Å; R164-E381 IonicContact NH2-OE1 2.98Å; R164-E381 IonicContact NH2-OE2 3.9Å; R164-E381 PolarHBondContact NH2-OE2 2.95Å; P339-E381 WeakPolarHBondContact CB-OE1 3.22Å; E381-G383 PolarHBondContact O-N 2.9Å; E381-L424 WeakPolarHBondContact CB-O 3.39Å; E381-L424 HydrophobicContact CG-CD1 3.95Å; E381-L424 WeakPolarHBondContact CG-O 3.45Å
382	N	85.9	Confident	92.6	Very high	53 Å²	53	24 Å²	24	28%	0.283	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-15.1	168.1	73.1	11.6	0	0	0	113.2	S380 Y384 Y385	S380-N382 WeakPolarHBondContact CB-OD1 3.36Å; S380-N382 PolarHBondContact O-N 2.88Å; S380-N382 PolarHBondContact OG-N 2.71Å; S380-N382 PolarHBondContact OG-OD1 2.6Å; N382-Y384 VanDerWaalsContact C-N 3.3Å; N382-Y384 WeakPolarHBondContact O-CD2 3.44Å; N382-Y384 VanDerWaalsContact O-CE2 3.28Å; N382-Y384 WeakPolarHBondContact O-CE2 3.37Å; N382-Y384 PolarHBondContact O-N 3.15Å; N382-Y384 PolarHBondContact OD1-N 3.3Å; N382-Y385 WeakPolarHBondContact ND2-CD2 3.49Å; N382-Y385 WeakPolarHBondContact ND2-CE2 3.4Å; N382-Y385 PolarHBondContact OD1-N 3.01Å
383	G	87.1	Confident	92.7	Very high	15 Å²	15	24.3 Å²	24.3	16%	0.155	12%	0.119	C	C	.	.	S	Bend	trans	76.2	7.8	178.9	0	0	0	0	0	115.7	H338 S380 E381	H338-G383 WeakPolarHBondContact NE2-CA 3.32Å; H338-G383 PolarHBondContact NE2-O 3.39Å; H338-G383 VanDerWaalsContact NE2-O 3.11Å; S380-G383 PolarHBondContact O-N 3.24Å; E381-G383 PolarHBondContact O-N 2.9Å
384	Y	89.7	Confident	92.8	Very high	90 Å²	90	23.9 Å²	23.9	35%	0.353	12%	0.116	S	C	.	.	S	Bend	trans	-123	-23.6	-177	-53.4	-58.3	0	0	0	113.3	N382 D399 L400 R401	N382-Y384 VanDerWaalsContact C-N 3.3Å; N382-Y384 WeakPolarHBondContact O-CD2 3.44Å; N382-Y384 VanDerWaalsContact O-CE2 3.28Å; N382-Y384 WeakPolarHBondContact O-CE2 3.37Å; N382-Y384 PolarHBondContact O-N 3.15Å; N382-Y384 PolarHBondContact OD1-N 3.3Å; Y384-D399 WeakPolarHBondContact O-CA 3.41Å; Y384-L400 WeakPolarHBondContact O-CG 3.42Å; Y384-L400 PolarHBondContact O-N 3.43Å; Y384-R401 HydrophobicContact CD1-CG 3.54Å; Y384-R401 HydrophobicContact CE1-CG 4.05Å; Y384-R401 HydrophobicContact CG-CG 4.37Å
385	Y	93.3	Very high	92.8	Very high	40 Å²	40	23.9 Å²	23.9	16%	0.157	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139	-178.8	-60.2	-24.4	0	0	0	112.2	S380 N382 I397 W398 L406	S380-Y385 PolarHBondContact N-O 3.33Å; N382-Y385 WeakPolarHBondContact ND2-CD2 3.49Å; N382-Y385 WeakPolarHBondContact ND2-CE2 3.4Å; N382-Y385 PolarHBondContact OD1-N 3.01Å; Y385-I397 HydrophobicContact CG-CG2 4.45Å; Y385-W398 WeakPolarHBondContact CA-O 3.34Å; Y385-L406 HydrophobicContact CE1-CD1 3.8Å
386	L	95.6	Very high	92.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.9	169.2	171.1	63.5	0	0	0	107.9	I353 I355 L377 F379 I397 W398 L400	I353-L386 HydrophobicContact CG2-CD2 4.15Å; I355-L386 HydrophobicContact CD1-CD2 3.96Å; L377-L386 HydrophobicContact CB-CD1 4.19Å; L377-L386 HydrophobicContact CD2-CD1 4.28Å; F379-L386 HydrophobicContact CD1-CB 4.08Å; F379-L386 HydrophobicContact CD1-CD1 3.83Å; F379-L386 HydrophobicContact CD1-CG 4.45Å; F379-L386 HydrophobicContact CD2-CD1 4.1Å; F379-L386 HydrophobicContact CE1-CB 4.05Å; F379-L386 HydrophobicContact CE1-CD1 3.78Å; F379-L386 HydrophobicContact CE1-CD2 4.11Å; F379-L386 HydrophobicContact CE1-CG 4.2Å; F379-L386 HydrophobicContact CE2-CD1 3.99Å; F379-L386 HydrophobicContact CG-CD1 4.03Å; F379-L386 HydrophobicContact CZ-CD1 3.86Å; F379-L386 HydrophobicContact CZ-CD2 4.22Å; L386-I397 CarbonylContact O-C 3.56Å; L386-I397 WeakPolarHBondContact O-CA 3.28Å; L386-W398 HydrophobicContact CB-CB 4.31Å; L386-W398 PolarHBondContact N-O 3.23Å; L386-W398 PolarHBondContact O-N 3.35Å; L386-L400 HydrophobicContact CB-CD2 4.22Å; L386-L400 HydrophobicContact CD2-CD2 4.44Å
387	A	96.3	Very high	92.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	141.2	169.3	0	0	0	0	0	109.5	L377 S378 K396 I397 V420 F422 L429	L377-A387 CarbonylContact C-O 3.6Å; L377-A387 WeakPolarHBondContact CA-O 3.27Å; S378-A387 PolarHBondContact N-O 3.11Å; S378-A387 PolarHBondContact O-N 3.43Å; A387-K396 CarbonylContact C-O 3.59Å; A387-K396 WeakPolarHBondContact CA-O 3.4Å; A387-I397 HydrophobicContact CB-CD1 3.66Å; A387-V420 HydrophobicContact CB-CG2 3.91Å; A387-F422 HydrophobicContact CB-CD2 4.16Å; A387-F422 HydrophobicContact CB-CE2 3.35Å; A387-F422 HydrophobicContact CB-CZ 3.82Å; A387-L429 HydrophobicContact CB-CD1 3.78Å; A387-L429 HydrophobicContact CB-CD2 4.09Å
388	S	96	Very high	92.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148.4	175.9	63.2	0	0	0	0	110.9	I353 H370 A376 V395 K396 W398	I353-S388 VanDerWaalsContact CD1-CB 3.4Å; I353-S388 WeakPolarHBondContact CD1-OG 3.2Å; H370-S388 PolarHBondContact NE2-OG 3.32Å; A376-S388 WeakPolarHBondContact O-CA 3.33Å; S388-V395 WeakPolarHBondContact O-CA 3.31Å; S388-K396 PolarHBondContact N-O 3.27Å; S388-K396 PolarHBondContact O-N 3.47Å; S388-K396 PolarHBondContact OG-O 3.27Å; S388-W398 PolarHBondContact OG-NE1 3.41Å
389	V	94.8	Very high	92.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	144.9	174.3	-95.9	0	0	0	0	109.2	R375 A376 V395 A417 V420 V431	R375-V389 PolarHBondContact N-O 3.22Å; A376-V389 HydrophobicContact CB-CG2 4.01Å; A376-V389 PolarHBondContact N-O 3.22Å; A376-V389 PolarHBondContact O-N 3.17Å; A376-V389 VanDerWaalsContact O-N 3.16Å; V389-V395 HydrophobicContact CG1-CB 4.08Å; V389-V395 HydrophobicContact CG1-CG1 4.29Å; V389-V395 HydrophobicContact CG1-CG2 3.52Å; V389-A417 HydrophobicContact CB-CB 3.7Å; V389-A417 HydrophobicContact CG1-CB 3.61Å; V389-A417 HydrophobicContact CG2-CB 4.42Å; V389-V420 HydrophobicContact CG2-CB 3.58Å; V389-V420 HydrophobicContact CG2-CG1 3.53Å; V389-V431 HydrophobicContact CG1-CG1 4.07Å
390	G	92.4	Very high	92.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	-171.3	177.4	0	0	0	0	0	112.6	A373 D392 S393	A373-G390 CarbonylContact O-C 3.6Å; A373-G390 WeakPolarHBondContact O-CA 3.07Å; G390-D392 PolarHBondContact O-N 3.16Å; G390-D392 VanDerWaalsContact O-N 3.16Å; G390-S393 PolarHBondContact O-N 3.23Å
391	D	91	Very high	92.3	Very high	73 Å²	73	28.7 Å²	28.7	39%	0.39	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.4	179.8	-67.4	-22.7	0	0	0	113.6	A373 R375 S393	A373-D391 PolarHBondContact O-N 3.5Å; R375-D391 IonicContact CZ-OD1 3.88Å; R375-D391 IonicContact CZ-OD2 2.85Å; R375-D391 IonicContact NE-OD1 3.58Å; R375-D391 PolarHBondContact NE-OD1 3.38Å; R375-D391 IonicContact NE-OD2 3Å; R375-D391 VanDerWaalsContact NH2-CG 3.35Å; R375-D391 IonicContact NH2-OD1 3.59Å; R375-D391 PolarHBondContact NH2-OD1 2.99Å; R375-D391 VanDerWaalsContact NH2-OD1 3.11Å; R375-D391 IonicContact NH2-OD2 2.89Å; R375-D391 PolarHBondContact NH2-OD2 3.21Å; D391-S393 PolarHBondContact O-N 3.08Å
392	D	89.7	Confident	92.3	Very high	38 Å²	38	33.2 Å²	33.2	20%	0.203	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	7.7	178	63	-8.2	0	0	0	114.3	H370 A371 G390 A394	H370-D392 VanDerWaalsContact CA-OD2 3.3Å; H370-D392 WeakPolarHBondContact CA-OD2 3.15Å; H370-D392 IonicContact CE1-OD1 2.71Å; H370-D392 IonicContact CE1-OD2 2.97Å; H370-D392 IonicContact CG-OD2 3.6Å; H370-D392 IonicContact ND1-OD1 3.37Å; H370-D392 PolarHBondContact ND1-OD1 3.43Å; H370-D392 IonicContact ND1-OD2 2.79Å; H370-D392 PolarHBondContact ND1-OD2 3.15Å; A371-D392 HydrophobicContact CB-CB 3.91Å; A371-D392 PolarHBondContact N-OD2 3.27Å; G390-D392 PolarHBondContact O-N 3.16Å; G390-D392 VanDerWaalsContact O-N 3.16Å; D392-A394 PolarHBondContact O-N 3.2Å; D392-A394 VanDerWaalsContact O-N 3.14Å; D392-A394 PolarHBondContact OD1-N 2.9Å
393	S	90.1	Very high	92.5	Very high	20 Å²	20	35.3 Å²	35.3	14%	0.14	17%	0.165	C	C	.	.	S	Bend	trans	58.1	25.7	179.5	-51.3	0	0	0	0	112.7	G390 D391 L411 F415	G390-S393 PolarHBondContact O-N 3.23Å; D391-S393 PolarHBondContact O-N 3.08Å; S393-L411 VanDerWaalsContact O-CB 3.32Å; S393-L411 WeakPolarHBondContact O-CB 3.45Å; S393-L411 PolarHBondContact O-N 3.14Å; S393-F415 WeakPolarHBondContact CA-O 3.45Å; S393-F415 WeakPolarHBondContact CB-O 3.08Å; S393-F415 PolarHBondContact OG-N 3.45Å; S393-F415 VanDerWaalsContact OG-N 3.07Å; S393-F415 PolarHBondContact OG-O 2.81Å
394	A	92.6	Very high	92.7	Very high	3 Å²	3	41.6 Å²	41.6	3%	0.025	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140	-179	0	0	0	0	0	111.3	H370 D392 T408 I409	H370-A394 PolarHBondContact CE1-O 2.8Å; D392-A394 PolarHBondContact O-N 3.2Å; D392-A394 VanDerWaalsContact O-N 3.14Å; D392-A394 PolarHBondContact OD1-N 2.9Å; A394-T408 HydrophobicContact CB-CG2 4.05Å; A394-I409 WeakPolarHBondContact CA-O 3.45Å
395	V	94.9	Very high	92.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119.9	167.6	-173.9	0	0	0	0	107	S388 V389 I397 T408 I409 L411 L429 V431	S388-V395 WeakPolarHBondContact O-CA 3.31Å; V389-V395 HydrophobicContact CG1-CB 4.08Å; V389-V395 HydrophobicContact CG1-CG1 4.29Å; V389-V395 HydrophobicContact CG1-CG2 3.52Å; V395-I397 HydrophobicContact CG1-CD1 4.1Å; V395-T408 WeakPolarHBondContact O-CA 3.48Å; V395-I409 HydrophobicContact CB-CB 4.21Å; V395-I409 PolarHBondContact N-O 3.3Å; V395-I409 PolarHBondContact O-N 2.79Å; V395-L411 HydrophobicContact CG2-CD1 3.66Å; V395-L411 HydrophobicContact CG2-CD2 4.37Å; V395-L411 HydrophobicContact CG2-CG 4.06Å; V395-L429 HydrophobicContact CG1-CD2 3.95Å; V395-V431 HydrophobicContact CG1-CG2 4.35Å; V395-V431 HydrophobicContact CG2-CG1 4.19Å; V395-V431 HydrophobicContact CG2-CG2 3.7Å
396	K	95.2	Very high	92.8	Very high	27 Å²	27	41.9 Å²	41.9	12%	0.117	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.8	177.3	-72	-178.3	-172.2	-83.9	0	109.6	G369 A387 S388 W398 N405 T408	G369-K396 WeakPolarHBondContact O-CE 3.32Å; G369-K396 PolarHBondContact O-NZ 3.03Å; G369-K396 VanDerWaalsContact O-NZ 3.17Å; A387-K396 CarbonylContact C-O 3.59Å; A387-K396 WeakPolarHBondContact CA-O 3.4Å; S388-K396 PolarHBondContact N-O 3.27Å; S388-K396 PolarHBondContact O-N 3.47Å; S388-K396 PolarHBondContact OG-O 3.27Å; K396-W398 HydrophobicContact CB-CZ2 3.89Å; K396-W398 HydrophobicContact CD-CH2 4.24Å; K396-W398 HydrophobicContact CD-CZ2 3.61Å; K396-W398 HydrophobicContact CG-CZ2 4.35Å; K396-N405 WeakPolarHBondContact CB-ND2 3.38Å; K396-T408 HydrophobicContact CG-CG2 4.09Å; K396-T408 PolarHBondContact NZ-OG1 3.17Å
397	I	95.5	Very high	92.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.5	174.2	-47.1	-60.1	0	0	0	108.1	Y385 L386 A387 V395 L406 K407 F422 L429 W444	Y385-I397 HydrophobicContact CG-CG2 4.45Å; L386-I397 CarbonylContact O-C 3.56Å; L386-I397 WeakPolarHBondContact O-CA 3.28Å; A387-I397 HydrophobicContact CB-CD1 3.66Å; V395-I397 HydrophobicContact CG1-CD1 4.1Å; I397-L406 PolarHBondContact O-N 2.83Å; I397-K407 HydrophobicContact CB-CB 4.36Å; I397-K407 HydrophobicContact CG1-CB 4.41Å; I397-K407 PolarHBondContact N-O 2.88Å; I397-K407 PolarHBondContact O-N 3.16Å; I397-F422 HydrophobicContact CD1-CZ 4.37Å; I397-L429 HydrophobicContact CD1-CD2 3.58Å; I397-W444 HydrophobicContact CB-CH2 4.33Å; I397-W444 HydrophobicContact CB-CZ2 4.19Å; I397-W444 HydrophobicContact CD1-CE3 4.41Å; I397-W444 HydrophobicContact CD1-CH2 3.74Å; I397-W444 HydrophobicContact CD1-CZ2 4.4Å; I397-W444 HydrophobicContact CD1-CZ3 3.75Å; I397-W444 HydrophobicContact CG1-CD2 4.36Å; I397-W444 HydrophobicContact CG1-CE3 4.22Å; I397-W444 HydrophobicContact CG1-CH2 3.67Å; I397-W444 HydrophobicContact CG1-CZ2 3.82Å; I397-W444 HydrophobicContact CG1-CZ3 3.89Å; I397-W444 HydrophobicContact CG2-CH2 3.82Å; I397-W444 HydrophobicContact CG2-CZ2 3.69Å
398	W	94.9	Very high	92.6	Very high	9 Å²	9	48.8 Å²	48.8	3%	0.034	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.9	-177.5	-52.2	91.1	0	0	0	109.9	I353 F367 P368 Y385 L386 S388 K396 K404 N405	I353-W398 HydrophobicContact CD1-CZ2 4.35Å; F367-W398 HydrophobicContact CB-CD2 4.01Å; F367-W398 HydrophobicContact CB-CE3 3.83Å; F367-W398 HydrophobicContact CB-CH2 4.05Å; F367-W398 HydrophobicContact CB-CZ2 4.22Å; F367-W398 HydrophobicContact CB-CZ3 3.84Å; F367-W398 HydrophobicContact CD1-CB 4.4Å; F367-W398 AromaticContact CD1-CD2 3.9Å; F367-W398 HydrophobicContact CD1-CD2 3.9Å; F367-W398 AromaticContact CD1-CE3 3.32Å; F367-W398 HydrophobicContact CD1-CE3 3.32Å; F367-W398 HydrophobicContact CD1-CG 4.36Å; F367-W398 AromaticContact CD1-CZ3 3.87Å; F367-W398 HydrophobicContact CD1-CZ3 3.87Å; F367-W398 HydrophobicContact CE1-CB 4.21Å; F367-W398 HydrophobicContact CE1-CE3 4.05Å; F367-W398 HydrophobicContact CG-CD2 4.02Å; F367-W398 AromaticContact CG-CE3 3.82Å; F367-W398 HydrophobicContact CG-CE3 3.82Å; F367-W398 HydrophobicContact CG-CG 4.41Å; F367-W398 HydrophobicContact CG-CZ3 4.27Å; F367-W398 HydrophobicContact CZ-CB 4.41Å; P368-W398 VanDerWaalsContact O-CH2 3.3Å; P368-W398 WeakPolarHBondContact O-CH2 3.07Å; Y385-W398 WeakPolarHBondContact CA-O 3.34Å; L386-W398 HydrophobicContact CB-CB 4.31Å; L386-W398 PolarHBondContact N-O 3.23Å; L386-W398 PolarHBondContact O-N 3.35Å; S388-W398 PolarHBondContact OG-NE1 3.41Å; K396-W398 HydrophobicContact CB-CZ2 3.89Å; K396-W398 HydrophobicContact CD-CH2 4.24Å; K396-W398 HydrophobicContact CD-CZ2 3.61Å; K396-W398 HydrophobicContact CG-CZ2 4.35Å; W398-K404 WeakPolarHBondContact CA-O 3.47Å; W398-N405 VanDerWaalsContact CE3-CA 3.5Å; W398-N405 HydrophobicContact CE3-CB 3.78Å; W398-N405 HydrophobicContact CH2-CB 4.08Å; W398-N405 HydrophobicContact CZ3-CB 3.54Å
399	D	93	Very high	92.4	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.9	168.8	-174.5	-16.4	0	0	0	108.7	Y384 R401 K402 L403 K404 L406	Y384-D399 WeakPolarHBondContact O-CA 3.41Å; D399-R401 PolarHBondContact O-N 3.45Å; D399-R401 WeakPolarHBondContact OD1-CB 3.35Å; D399-R401 PolarHBondContact OD1-N 3.43Å; D399-R401 IonicContact OD1-NE 3.67Å; D399-R401 IonicContact OD2-NH2 2.74Å; D399-K402 HydrophobicContact CB-CB 4.34Å; D399-K402 PolarHBondContact O-N 3Å; D399-L403 WeakPolarHBondContact O-CA 3.37Å; D399-L403 PolarHBondContact O-N 2.83Å; D399-K404 PolarHBondContact N-O 3.35Å; D399-K404 PolarHBondContact O-N 3.05Å; D399-L406 HydrophobicContact CB-CB 4.46Å; D399-L406 HydrophobicContact CB-CD1 3.99Å
400	L	91.3	Very high	92.3	Very high	26 Å²	26	56 Å²	56	14%	0.136	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.5	-177.8	-63.5	173.1	0	0	0	112.5	F367 F379 Y384 L386 L403	F367-L400 HydrophobicContact CE2-CD2 3.83Å; F367-L400 HydrophobicContact CZ-CD2 3.84Å; F379-L400 HydrophobicContact CD1-CD1 3.95Å; F379-L400 HydrophobicContact CE1-CD1 3.76Å; F379-L400 HydrophobicContact CE1-CD2 4.3Å; Y384-L400 WeakPolarHBondContact O-CG 3.42Å; Y384-L400 PolarHBondContact O-N 3.43Å; L386-L400 HydrophobicContact CB-CD2 4.22Å; L386-L400 HydrophobicContact CD2-CD2 4.44Å; L400-L403 VanDerWaalsContact O-CD2 3.28Å; L400-L403 WeakPolarHBondContact O-CD2 3.42Å
401	R	89.5	Confident	92	Very high	151 Å²	151	56.3 Å²	56.3	57%	0.57	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-36.3	178.5	-63.4	177.8	-67.1	-176	1.9	112.2	Y384 D399	Y384-R401 HydrophobicContact CD1-CG 3.54Å; Y384-R401 HydrophobicContact CE1-CG 4.05Å; Y384-R401 HydrophobicContact CG-CG 4.37Å; D399-R401 PolarHBondContact O-N 3.45Å; D399-R401 WeakPolarHBondContact OD1-CB 3.35Å; D399-R401 PolarHBondContact OD1-N 3.43Å; D399-R401 IonicContact OD1-NE 3.67Å; D399-R401 IonicContact OD2-NH2 2.74Å
402	K	89.5	Confident	91.4	Very high	148 Å²	148	57.1 Å²	57.1	64%	0.643	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-9.8	-179.1	-64.3	-177	-177.7	177.7	0	112.5	D399 K404	D399-K402 HydrophobicContact CB-CB 4.34Å; D399-K402 PolarHBondContact O-N 3Å; K402-K404 HydrophobicContact CB-CB 4.45Å; K402-K404 WeakPolarHBondContact O-CG 3.23Å; K402-K404 PolarHBondContact O-N 3.34Å
403	L	90.1	Very high	90.4	Very high	98 Å²	98	58.3 Å²	58.3	51%	0.513	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	43.5	-174.2	-61.4	175.4	0	0	0	112.2	A365 F367 D399 L400	A365-L403 HydrophobicContact CB-CD1 4.37Å; A365-L403 HydrophobicContact CB-CD2 3.64Å; F367-L403 HydrophobicContact CE1-CB 4.26Å; F367-L403 HydrophobicContact CE1-CD2 4.18Å; F367-L403 HydrophobicContact CZ-CD2 3.73Å; D399-L403 WeakPolarHBondContact O-CA 3.37Å; D399-L403 PolarHBondContact O-N 2.83Å; L400-L403 VanDerWaalsContact O-CD2 3.28Å; L400-L403 WeakPolarHBondContact O-CD2 3.42Å
404	K	91.4	Very high	89.7	Confident	147 Å²	147	67 Å²	67	64%	0.639	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	153.1	-175.1	-77	178.2	-176.9	-174.1	0	112.4	W398 D399 K402 L406	W398-K404 WeakPolarHBondContact CA-O 3.47Å; D399-K404 PolarHBondContact N-O 3.35Å; D399-K404 PolarHBondContact O-N 3.05Å; K402-K404 HydrophobicContact CB-CB 4.45Å; K402-K404 WeakPolarHBondContact O-CG 3.23Å; K402-K404 PolarHBondContact O-N 3.34Å; K404-L406 PolarHBondContact O-N 2.83Å
405	N	92.4	Very high	89.3	Confident	57 Å²	57	67.2 Å²	67.2	31%	0.305	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	118.6	167.2	-167	-79.5	0	0	0	108.6	K396 W398 K407 T408	K396-N405 WeakPolarHBondContact CB-ND2 3.38Å; W398-N405 VanDerWaalsContact CE3-CA 3.5Å; W398-N405 HydrophobicContact CE3-CB 3.78Å; W398-N405 HydrophobicContact CH2-CB 4.08Å; W398-N405 HydrophobicContact CZ3-CB 3.54Å; N405-K407 PolarHBondContact OD1-N 3.16Å; N405-K407 PolarHBondContact OD1-O 3.4Å; N405-T408 PolarHBondContact OD1-OG1 2.94Å; N405-T408 VanDerWaalsContact OD1-OG1 3.12Å
406	L	92.2	Very high	89.1	Confident	78 Å²	78	71.6 Å²	71.6	41%	0.408	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-41.7	179.3	-171.6	148.8	0	0	0	110.8	Y385 I397 D399 K404	Y385-L406 HydrophobicContact CE1-CD1 3.8Å; I397-L406 PolarHBondContact O-N 2.83Å; D399-L406 HydrophobicContact CB-CB 4.46Å; D399-L406 HydrophobicContact CB-CD1 3.99Å; K404-L406 PolarHBondContact O-N 2.83Å
407	K	93.3	Very high	89	Confident	100 Å²	100	70.4 Å²	70.4	44%	0.435	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	141.7	179.5	-170.6	70	174.8	-174	0	110.1	I397 N405 I409 W444	I397-K407 HydrophobicContact CB-CB 4.36Å; I397-K407 HydrophobicContact CG1-CB 4.41Å; I397-K407 PolarHBondContact N-O 2.88Å; I397-K407 PolarHBondContact O-N 3.16Å; N405-K407 PolarHBondContact OD1-N 3.16Å; N405-K407 PolarHBondContact OD1-O 3.4Å; K407-I409 HydrophobicContact CG-CG1 4.23Å; K407-W444 HydrophobicContact CG-CG 4.11Å
408	T	94	Very high	89	Confident	45 Å²	45	74.3 Å²	74.3	28%	0.276	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.5	164.3	-60.7	0	0	0	0	108	A394 V395 K396 N405 N410	A394-T408 HydrophobicContact CB-CG2 4.05Å; V395-T408 WeakPolarHBondContact O-CA 3.48Å; K396-T408 HydrophobicContact CG-CG2 4.09Å; K396-T408 PolarHBondContact NZ-OG1 3.17Å; N405-T408 PolarHBondContact OD1-OG1 2.94Å; N405-T408 VanDerWaalsContact OD1-OG1 3.12Å; T408-N410 WeakPolarHBondContact CG2-OD1 3.39Å
409	I	93.5	Very high	89	Confident	21 Å²	21	74 Å²	74	11%	0.108	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	111.9	173.5	-53	170	0	0	0	106	A394 V395 K407 L411 F439 W444	A394-I409 WeakPolarHBondContact CA-O 3.45Å; V395-I409 HydrophobicContact CB-CB 4.21Å; V395-I409 PolarHBondContact N-O 3.3Å; V395-I409 PolarHBondContact O-N 2.79Å; K407-I409 HydrophobicContact CG-CG1 4.23Å; I409-L411 HydrophobicContact CG2-CD2 4.38Å; I409-L411 PolarHBondContact O-N 3.27Å; I409-F439 HydrophobicContact CD1-CD1 4.29Å; I409-F439 HydrophobicContact CD1-CG 4.35Å; I409-F439 HydrophobicContact CG2-CE1 3.98Å; I409-F439 HydrophobicContact CG2-CZ 4.18Å; I409-W444 HydrophobicContact CD1-CB 3.97Å; I409-W444 HydrophobicContact CD1-CD2 4.28Å; I409-W444 HydrophobicContact CD1-CE3 3.93Å; I409-W444 HydrophobicContact CD1-CG 4.33Å; I409-W444 HydrophobicContact CG1-CB 4.41Å
410	N	91.7	Very high	89.1	Confident	130 Å²	130	74 Å²	74	70%	0.695	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.4	177	-66	-27.6	0	0	0	108.4	T408 S412	T408-N410 WeakPolarHBondContact CG2-OD1 3.39Å; N410-S412 PolarHBondContact O-N 2.94Å
411	L	86.3	Confident	89.4	Confident	7 Å²	7	73.4 Å²	73.4	4%	0.037	37%	0.367	C	S	.	.			trans	-80.1	118.5	173.3	-56.8	173.6	0	0	0	106.5	S393 V395 I409 F415 V431 F439	S393-L411 VanDerWaalsContact O-CB 3.32Å; S393-L411 WeakPolarHBondContact O-CB 3.45Å; S393-L411 PolarHBondContact O-N 3.14Å; V395-L411 HydrophobicContact CG2-CD1 3.66Å; V395-L411 HydrophobicContact CG2-CD2 4.37Å; V395-L411 HydrophobicContact CG2-CG 4.06Å; I409-L411 HydrophobicContact CG2-CD2 4.38Å; I409-L411 PolarHBondContact O-N 3.27Å; L411-F415 HydrophobicContact CB-CB 3.72Å; L411-F415 HydrophobicContact CB-CD1 3.89Å; L411-F415 HydrophobicContact CB-CD2 4.45Å; L411-F415 HydrophobicContact CB-CG 3.73Å; L411-F415 HydrophobicContact CD1-CD1 3.31Å; L411-F415 HydrophobicContact CD1-CE1 3.54Å; L411-F415 HydrophobicContact CD1-CG 4.04Å; L411-F415 HydrophobicContact CD1-CZ 4.44Å; L411-F415 HydrophobicContact CG-CD1 4.22Å; L411-V431 HydrophobicContact CD1-CG1 4.02Å; L411-F439 HydrophobicContact CD2-CE2 4.22Å; L411-F439 HydrophobicContact CD2-CZ 3.69Å
412	S	79.3	Confident	89.7	Confident	90 Å²	90	66.9 Å²	66.9	63%	0.629	34%	0.343	S	S	*	.	S	Bend	trans	-62.1	143.9	-172.7	51.2	0	0	0	0	112.1	N410	N410-S412 PolarHBondContact O-N 2.94Å
413	G	68.1	Low	89.8	Confident	64 Å²	64	60.1 Å²	60.1	66%	0.66	31%	0.314	S	S	*	.	S	Bend	trans	77.2	-178.3	-177.1	0	0	0	0	0	113	F415	G413-F415 PolarHBondContact O-N 2.8Å
414	K	75.8	Confident	89.7	Confident	203 Å²	203	59.5 Å²	59.5	88%	0.883	31%	0.311	S	S	*	.	S	Bend	trans	-73.1	60.8	175.9	-66.7	-178.8	178.6	179.5	0	110.4	Q416	K414-Q416 PolarHBondContact O-N 3.23Å
415	F	84.4	Confident	89.6	Confident	7 Å²	7	54.1 Å²	54.1	3%	0.031	29%	0.291	C	S	.	.			trans	-71.2	108.4	-175.7	-166.8	-90.1	0	0	0	110.7	S393 L411 G413 A417 V431 A434 D435	S393-F415 WeakPolarHBondContact CA-O 3.45Å; S393-F415 WeakPolarHBondContact CB-O 3.08Å; S393-F415 PolarHBondContact OG-N 3.45Å; S393-F415 VanDerWaalsContact OG-N 3.07Å; S393-F415 PolarHBondContact OG-O 2.81Å; L411-F415 HydrophobicContact CB-CB 3.72Å; L411-F415 HydrophobicContact CB-CD1 3.89Å; L411-F415 HydrophobicContact CB-CD2 4.45Å; L411-F415 HydrophobicContact CB-CG 3.73Å; L411-F415 HydrophobicContact CD1-CD1 3.31Å; L411-F415 HydrophobicContact CD1-CE1 3.54Å; L411-F415 HydrophobicContact CD1-CG 4.04Å; L411-F415 HydrophobicContact CD1-CZ 4.44Å; L411-F415 HydrophobicContact CG-CD1 4.22Å; G413-F415 PolarHBondContact O-N 2.8Å; F415-A417 HydrophobicContact CD1-CB 4.11Å; F415-A417 HydrophobicContact CE1-CB 4.18Å; F415-A417 PolarHBondContact O-N 2.95Å; F415-V431 HydrophobicContact CE1-CG1 4.38Å; F415-A434 HydrophobicContact CD2-CB 4Å; F415-A434 HydrophobicContact CE2-CB 3.76Å; F415-D435 WeakPolarHBondContact CE2-OD1 3.46Å; F415-D435 WeakPolarHBondContact CZ-O 3.25Å; F415-D435 VanDerWaalsContact CZ-OD1 3.26Å; F415-D435 WeakPolarHBondContact CZ-OD1 3.48Å
416	Q	90.2	Very high	89.4	Confident	92 Å²	92	51.6 Å²	51.6	43%	0.43	28%	0.279	S	S	.	.			trans	-82.7	82.9	179.5	-63	-173.9	26.3	0	0	110.7	K414 G433 L456	K414-Q416 PolarHBondContact O-N 3.23Å; Q416-G433 WeakPolarHBondContact O-CA 3.3Å; Q416-L456 HydrophobicContact CB-CD2 3.84Å
417	A	92.7	Very high	89.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	27%	0.267	C	S	.	.			trans	-64.9	133.7	174.4	0	0	0	0	0	111	V389 F415 V431 S432	V389-A417 HydrophobicContact CB-CB 3.7Å; V389-A417 HydrophobicContact CG1-CB 3.61Å; V389-A417 HydrophobicContact CG2-CB 4.42Å; F415-A417 HydrophobicContact CD1-CB 4.11Å; F415-A417 HydrophobicContact CE1-CB 4.18Å; F415-A417 PolarHBondContact O-N 2.95Å; A417-V431 HydrophobicContact CB-CG1 4.23Å; A417-S432 CarbonylContact C-O 3.6Å; A417-S432 WeakPolarHBondContact CA-O 3.31Å
418	R	94.7	Very high	89.4	Confident	82 Å²	82	44.9 Å²	44.9	31%	0.309	25%	0.248	S	C	.	.			trans	-118.5	-40	-176	-65.3	-62.9	174.3	164.3	-6.1	113	S432 A457	R418-S432 PolarHBondContact N-O 2.92Å; R418-A457 WeakPolarHBondContact CB-O 3.29Å
419	D	95.7	Very high	89.5	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	157.3	179	-154.4	23.6	0	0	0	111.1	K246 V431 S432 V460 R461	K246-D419 IonicContact NZ-OD1 3.67Å; D419-V431 WeakPolarHBondContact O-CA 3.2Å; D419-S432 VanDerWaalsContact CB-OG 3.3Å; D419-S432 WeakPolarHBondContact CB-OG 3.47Å; D419-S432 PolarHBondContact N-O 3.24Å; D419-S432 PolarHBondContact N-OG 3.4Å; D419-S432 PolarHBondContact O-N 3.36Å; D419-V460 PolarHBondContact OD2-N 2.83Å; D419-R461 IonicContact OD2-CZ 3.76Å; D419-R461 IonicContact OD2-NH1 2.86Å; D419-R461 PolarHBondContact OD2-NH1 3.44Å; D419-R461 IonicContact OD2-NH2 3.37Å
420	V	96.3	Very high	89.7	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	140.4	174.1	63	0	0	0	0	108.7	A376 S378 A387 V389 L429 A430 V431	A376-V420 HydrophobicContact CB-CG1 3.96Å; S378-V420 WeakPolarHBondContact CB-O 3.37Å; A387-V420 HydrophobicContact CB-CG2 3.91Å; V389-V420 HydrophobicContact CG2-CB 3.58Å; V389-V420 HydrophobicContact CG2-CG1 3.53Å; V420-L429 HydrophobicContact CG2-CD1 3.37Å; V420-L429 HydrophobicContact CG2-CD2 4.41Å; V420-L429 HydrophobicContact CG2-CG 4.04Å; V420-A430 CarbonylContact C-O 3.56Å; V420-A430 WeakPolarHBondContact CA-O 3.44Å; V420-A430 WeakPolarHBondContact CG2-O 3.33Å; V420-V431 HydrophobicContact CG2-CG2 4.05Å
421	C	96.1	Very high	89.9	Confident	15 Å²	15	35.5 Å²	35.5	10%	0.101	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	126.1	-178.5	-176.8	0	0	0	0	109.8	A430 V460 F462	C421-A430 PolarHBondContact N-O 2.91Å; C421-A430 PolarHBondContact O-N 3.26Å; C421-V460 HydrophobicContact CB-CG1 4.37Å; C421-V460 WeakPolarHBondContact CB-O 3.33Å; C421-F462 WeakPolarHBondContact O-CE2 3.38Å
422	F	95.4	Very high	90.3	Very high	14 Å²	14	35.2 Å²	35.2	6%	0.061	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	145.7	161.7	-80.9	-74	0	0	0	109.7	S378 A387 I397 Y428 L429 W444	S378-F422 WeakPolarHBondContact O-CD2 3.47Å; S378-F422 WeakPolarHBondContact O-CE2 3.44Å; S378-F422 PolarHBondContact OG-N 3.49Å; A387-F422 HydrophobicContact CB-CD2 4.16Å; A387-F422 HydrophobicContact CB-CE2 3.35Å; A387-F422 HydrophobicContact CB-CZ 3.82Å; I397-F422 HydrophobicContact CD1-CZ 4.37Å; F422-Y428 WeakPolarHBondContact CA-O 3.23Å; F422-Y428 WeakPolarHBondContact CD1-O 3.32Å; F422-L429 HydrophobicContact CD1-CB 4.1Å; F422-L429 HydrophobicContact CD1-CD1 3.79Å; F422-L429 HydrophobicContact CD2-CD1 3.9Å; F422-L429 HydrophobicContact CE1-CB 3.95Å; F422-L429 HydrophobicContact CE1-CD1 3.77Å; F422-L429 HydrophobicContact CE1-CD2 4.42Å; F422-L429 HydrophobicContact CE1-CG 4.28Å; F422-L429 HydrophobicContact CE2-CD1 3.91Å; F422-L429 HydrophobicContact CG-CD1 3.84Å; F422-L429 HydrophobicContact CZ-CD1 3.84Å; F422-L429 HydrophobicContact CZ-CD2 4.36Å; F422-W444 HydrophobicContact CE1-CH2 4.04Å; F422-W444 HydrophobicContact CE1-CZ3 4.29Å; F422-W444 HydrophobicContact CZ-CH2 4.09Å
423	D	93.5	Very high	91	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.027	17%	0.165	C	C	.	.			trans	-70.3	162.9	166.3	84.6	-59.8	0	0	0	111.1	S425 G426 N427 Y428 F462	D423-S425 PolarHBondContact O-N 2.64Å; D423-S425 WeakPolarHBondContact OD2-CA 3.3Å; D423-S425 WeakPolarHBondContact OD2-CB 3.5Å; D423-S425 PolarHBondContact OD2-N 2.59Å; D423-S425 PolarHBondContact OD2-OG 3.37Å; D423-G426 PolarHBondContact O-N 3.28Å; D423-G426 WeakPolarHBondContact OD1-CA 3.4Å; D423-G426 PolarHBondContact OD1-N 2.74Å; D423-N427 PolarHBondContact OD1-N 3.45Å; D423-Y428 PolarHBondContact N-O 3.19Å; D423-Y428 PolarHBondContact OD1-N 3.02Å; D423-F462 HydrophobicContact CB-CB 4.23Å; D423-F462 HydrophobicContact CB-CD1 4.23Å; D423-F462 HydrophobicContact CB-CD2 3.69Å; D423-F462 HydrophobicContact CB-CE2 4.03Å; D423-F462 HydrophobicContact CB-CG 3.79Å; D423-F462 HydrophobicContact CB-CZ 4.43Å
424	L	88	Confident	92.2	Very high	85 Å²	85	30.6 Å²	30.6	45%	0.445	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.7	-178.2	-164.4	71.5	0	0	0	113.1	L208 E381	L208-L424 HydrophobicContact CD1-CD1 4.05Å; E381-L424 WeakPolarHBondContact CB-O 3.39Å; E381-L424 HydrophobicContact CG-CD1 3.95Å; E381-L424 WeakPolarHBondContact CG-O 3.45Å
425	S	87.6	Confident	93	Very high	34 Å²	34	21.8 Å²	21.8	24%	0.238	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-17.5	174.7	82.6	0	0	0	0	113.1	L175 D423 N427	L175-S425 WeakPolarHBondContact CD2-OG 3.07Å; D423-S425 PolarHBondContact O-N 2.64Å; D423-S425 WeakPolarHBondContact OD2-CA 3.3Å; D423-S425 WeakPolarHBondContact OD2-CB 3.5Å; D423-S425 PolarHBondContact OD2-N 2.59Å; D423-S425 PolarHBondContact OD2-OG 3.37Å; S425-N427 VanDerWaalsContact C-N 3.27Å; S425-N427 PolarHBondContact O-N 3.26Å; S425-N427 WeakPolarHBondContact OG-CB 3.3Å; S425-N427 PolarHBondContact OG-N 2.88Å; S425-N427 PolarHBondContact OG-ND2 3.34Å
426	G	88.6	Confident	93.5	Very high	4 Å²	4	21.5 Å²	21.5	4%	0.041	12%	0.117	C	C	.	.	S	Bend	trans	73.8	12.7	-174.9	0	0	0	0	0	114.5	D423 S441	D423-G426 PolarHBondContact O-N 3.28Å; D423-G426 WeakPolarHBondContact OD1-CA 3.4Å; D423-G426 PolarHBondContact OD1-N 2.74Å; G426-S441 WeakPolarHBondContact O-CB 3.47Å; G426-S441 PolarHBondContact O-OG 3.17Å
427	N	90.8	Very high	93.8	Very high	31 Å²	31	18.3 Å²	18.3	17%	0.166	10%	0.101	C	C	.	.	S	Bend	trans	-91.4	-17	178.6	-76	-32.5	0	0	0	113.9	L175 D423 S425 S441	L175-N427 HydrophobicContact CD2-CB 4.05Å; L175-N427 WeakPolarHBondContact CD2-ND2 3.46Å; D423-N427 PolarHBondContact OD1-N 3.45Å; S425-N427 VanDerWaalsContact C-N 3.27Å; S425-N427 PolarHBondContact O-N 3.26Å; S425-N427 WeakPolarHBondContact OG-CB 3.3Å; S425-N427 PolarHBondContact OG-N 2.88Å; S425-N427 PolarHBondContact OG-ND2 3.34Å; N427-S441 VanDerWaalsContact C-CB 3.47Å; N427-S441 WeakPolarHBondContact O-CB 3.32Å; N427-S441 PolarHBondContact O-N 2.97Å
428	Y	95	Very high	93.9	Very high	6 Å²	6	18.3 Å²	18.3	2%	0.024	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.9	-179.5	-57.2	-60.2	0	0	0	110.9	L175 I176 P178 L181 F422 D423 F439 Q440 L447 A466	L175-Y428 HydrophobicContact CD1-CD2 4.42Å; L175-Y428 HydrophobicContact CD1-CE2 4.04Å; L175-Y428 HydrophobicContact CD2-CE2 4.08Å; L175-Y428 HydrophobicContact CG-CE2 4.04Å; I176-Y428 WeakPolarHBondContact O-CE2 3.45Å; I176-Y428 PolarHBondContact O-OH 3.44Å; P178-Y428 HydrophobicContact CB-CE1 4.37Å; P178-Y428 WeakPolarHBondContact CD-OH 3.28Å; L181-Y428 HydrophobicContact CD1-CD1 4.19Å; L181-Y428 HydrophobicContact CD1-CD2 4.03Å; L181-Y428 HydrophobicContact CD1-CE1 4.2Å; L181-Y428 HydrophobicContact CD1-CE2 4Å; L181-Y428 HydrophobicContact CD1-CG 4.12Å; F422-Y428 WeakPolarHBondContact CA-O 3.23Å; F422-Y428 WeakPolarHBondContact CD1-O 3.32Å; D423-Y428 PolarHBondContact N-O 3.19Å; D423-Y428 PolarHBondContact OD1-N 3.02Å; Y428-F439 WeakPolarHBondContact CA-O 3.41Å; Y428-Q440 HydrophobicContact CE1-CG 4.41Å; Y428-L447 HydrophobicContact CD1-CD1 3.72Å; Y428-L447 HydrophobicContact CE1-CD1 3.59Å; Y428-A466 HydrophobicContact CD2-CB 4.03Å; Y428-A466 HydrophobicContact CE2-CB 4.29Å
429	L	96.6	Very high	94	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117.4	176.1	179.9	67.5	0	0	0	108.3	A387 V395 I397 V420 F422 V438 F439 W444	A387-L429 HydrophobicContact CB-CD1 3.78Å; A387-L429 HydrophobicContact CB-CD2 4.09Å; V395-L429 HydrophobicContact CG1-CD2 3.95Å; I397-L429 HydrophobicContact CD1-CD2 3.58Å; V420-L429 HydrophobicContact CG2-CD1 3.37Å; V420-L429 HydrophobicContact CG2-CD2 4.41Å; V420-L429 HydrophobicContact CG2-CG 4.04Å; F422-L429 HydrophobicContact CD1-CB 4.1Å; F422-L429 HydrophobicContact CD1-CD1 3.79Å; F422-L429 HydrophobicContact CD2-CD1 3.9Å; F422-L429 HydrophobicContact CE1-CB 3.95Å; F422-L429 HydrophobicContact CE1-CD1 3.77Å; F422-L429 HydrophobicContact CE1-CD2 4.42Å; F422-L429 HydrophobicContact CE1-CG 4.28Å; F422-L429 HydrophobicContact CE2-CD1 3.91Å; F422-L429 HydrophobicContact CG-CD1 3.84Å; F422-L429 HydrophobicContact CZ-CD1 3.84Å; F422-L429 HydrophobicContact CZ-CD2 4.36Å; L429-V438 CarbonylContact O-C 3.59Å; L429-V438 WeakPolarHBondContact O-CA 3.45Å; L429-F439 HydrophobicContact CB-CB 4.47Å; L429-F439 PolarHBondContact N-O 3.1Å; L429-F439 PolarHBondContact O-N 3.47Å; L429-W444 HydrophobicContact CB-CZ3 4.26Å; L429-W444 HydrophobicContact CD2-CE3 4.44Å; L429-W444 HydrophobicContact CD2-CZ3 3.77Å
430	A	96.7	Very high	93.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.6	172.2	0	0	0	0	0	110.8	V420 C421 R437 V438 V460 F462	V420-A430 CarbonylContact C-O 3.56Å; V420-A430 WeakPolarHBondContact CA-O 3.44Å; V420-A430 WeakPolarHBondContact CG2-O 3.33Å; C421-A430 PolarHBondContact N-O 2.91Å; C421-A430 PolarHBondContact O-N 3.26Å; A430-R437 CarbonylContact C-O 3.46Å; A430-R437 VanDerWaalsContact CA-O 3.31Å; A430-R437 WeakPolarHBondContact CA-O 3.32Å; A430-V438 HydrophobicContact CB-CG2 4.3Å; A430-V460 HydrophobicContact CB-CB 4.39Å; A430-V460 HydrophobicContact CB-CG1 3.87Å; A430-V460 HydrophobicContact CB-CG2 3.57Å; A430-F462 HydrophobicContact CB-CD2 4.49Å; A430-F462 HydrophobicContact CB-CE2 3.5Å; A430-F462 HydrophobicContact CB-CZ 3.51Å
431	V	96.5	Very high	93.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.6	175.8	-178.5	0	0	0	0	108.1	V389 V395 L411 F415 A417 D419 V420 V436 R437 F439	V389-V431 HydrophobicContact CG1-CG1 4.07Å; V395-V431 HydrophobicContact CG1-CG2 4.35Å; V395-V431 HydrophobicContact CG2-CG1 4.19Å; V395-V431 HydrophobicContact CG2-CG2 3.7Å; L411-V431 HydrophobicContact CD1-CG1 4.02Å; F415-V431 HydrophobicContact CE1-CG1 4.38Å; A417-V431 HydrophobicContact CB-CG1 4.23Å; D419-V431 WeakPolarHBondContact O-CA 3.2Å; V420-V431 HydrophobicContact CG2-CG2 4.05Å; V431-V436 WeakPolarHBondContact O-CA 3.48Å; V431-R437 PolarHBondContact N-O 2.82Å; V431-R437 PolarHBondContact O-N 3.43Å; V431-F439 HydrophobicContact CG2-CD2 4.37Å; V431-F439 HydrophobicContact CG2-CE2 4.15Å
432	S	95.2	Very high	93.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	143.6	174.4	80.4	0	0	0	0	110.9	A417 R418 D419 A457	A417-S432 CarbonylContact C-O 3.6Å; A417-S432 WeakPolarHBondContact CA-O 3.31Å; R418-S432 PolarHBondContact N-O 2.92Å; D419-S432 VanDerWaalsContact CB-OG 3.3Å; D419-S432 WeakPolarHBondContact CB-OG 3.47Å; D419-S432 PolarHBondContact N-O 3.24Å; D419-S432 PolarHBondContact N-OG 3.4Å; D419-S432 PolarHBondContact O-N 3.36Å; S432-A457 WeakPolarHBondContact CB-O 3.43Å; S432-A457 PolarHBondContact OG-O 3.19Å; S432-A457 VanDerWaalsContact OG-O 3.06Å
433	G	93.9	Very high	92.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	-173.8	-118.5	176.4	0	0	0	0	0	111.6	Q416 D435 L456 A457	Q416-G433 WeakPolarHBondContact O-CA 3.3Å; G433-D435 VanDerWaalsContact C-N 3.31Å; G433-D435 PolarHBondContact N-O 3.08Å; G433-L456 CarbonylContact O-C 3.57Å; G433-L456 WeakPolarHBondContact O-CA 3.45Å; G433-A457 PolarHBondContact N-O 3.28Å; G433-A457 PolarHBondContact O-N 2.7Å
434	A	92.7	Very high	92.7	Very high	57 Å²	57	27.1 Å²	27.1	47%	0.471	15%	0.147	S	C	.	.	S	Bend	trans	-69.7	-32.4	173.1	0	0	0	0	0	112.5	F415	F415-A434 HydrophobicContact CD2-CB 4Å; F415-A434 HydrophobicContact CE2-CB 3.76Å
435	D	93.2	Very high	92.9	Very high	18 Å²	18	27.7 Å²	27.7	10%	0.096	15%	0.15	C	C	.	.	S	Bend	trans	-131.9	175.8	166.4	55.6	29.8	0	0	0	107.9	F415 G433 R437 V449 L450 K451	F415-D435 WeakPolarHBondContact CE2-OD1 3.46Å; F415-D435 WeakPolarHBondContact CZ-O 3.25Å; F415-D435 VanDerWaalsContact CZ-OD1 3.26Å; F415-D435 WeakPolarHBondContact CZ-OD1 3.48Å; G433-D435 VanDerWaalsContact C-N 3.31Å; G433-D435 PolarHBondContact N-O 3.08Å; D435-R437 VanDerWaalsContact OD1-CG 3.24Å; D435-R437 WeakPolarHBondContact OD1-CG 3.35Å; D435-R437 IonicContact OD1-CZ 2.76Å; D435-R437 IonicContact OD1-NE 3.62Å; D435-R437 PolarHBondContact OD1-NE 3.01Å; D435-R437 IonicContact OD1-NH2 3.11Å; D435-R437 IonicContact OD2-CZ 2.73Å; D435-R437 IonicContact OD2-NE 3.66Å; D435-R437 PolarHBondContact OD2-NE 2.98Å; D435-R437 IonicContact OD2-NH2 3.57Å; D435-R437 PolarHBondContact OD2-NH2 2.87Å; D435-R437 VanDerWaalsContact OD2-NH2 3.09Å; D435-V449 HydrophobicContact CB-CG1 4.06Å; D435-V449 WeakPolarHBondContact OD2-CG1 3.34Å; D435-L450 WeakPolarHBondContact CB-O 3.39Å; D435-K451 HydrophobicContact CB-CG 4Å
436	V	95.1	Very high	93.2	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.1	172	179	0	0	0	0	108.5	V431 V449 L450 A457 V460 T471	V431-V436 WeakPolarHBondContact O-CA 3.48Å; V436-V449 CarbonylContact O-C 3.59Å; V436-V449 WeakPolarHBondContact O-CA 3.3Å; V436-L450 HydrophobicContact CB-CB 4.22Å; V436-L450 HydrophobicContact CB-CD1 4.45Å; V436-L450 HydrophobicContact CG1-CD1 4.34Å; V436-L450 PolarHBondContact N-O 3.35Å; V436-L450 PolarHBondContact O-N 3.36Å; V436-A457 HydrophobicContact CG2-CB 3.62Å; V436-V460 HydrophobicContact CG1-CB 4.46Å; V436-V460 HydrophobicContact CG1-CG2 3.95Å; V436-T471 HydrophobicContact CB-CG2 4.28Å; V436-T471 HydrophobicContact CG1-CG2 3.94Å; V436-T471 HydrophobicContact CG2-CG2 3.85Å
437	R	95.3	Very high	93.4	Very high	26 Å²	26	32.1 Å²	32.1	10%	0.098	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.8	-177.9	-53.2	-167.2	-174.3	-167.1	1.2	110.8	A430 V431 D435 F439 E446 V448 V449	A430-R437 CarbonylContact C-O 3.46Å; A430-R437 VanDerWaalsContact CA-O 3.31Å; A430-R437 WeakPolarHBondContact CA-O 3.32Å; V431-R437 PolarHBondContact N-O 2.82Å; V431-R437 PolarHBondContact O-N 3.43Å; D435-R437 VanDerWaalsContact OD1-CG 3.24Å; D435-R437 WeakPolarHBondContact OD1-CG 3.35Å; D435-R437 IonicContact OD1-CZ 2.76Å; D435-R437 IonicContact OD1-NE 3.62Å; D435-R437 PolarHBondContact OD1-NE 3.01Å; D435-R437 IonicContact OD1-NH2 3.11Å; D435-R437 IonicContact OD2-CZ 2.73Å; D435-R437 IonicContact OD2-NE 3.66Å; D435-R437 PolarHBondContact OD2-NE 2.98Å; D435-R437 IonicContact OD2-NH2 3.57Å; D435-R437 PolarHBondContact OD2-NH2 2.87Å; D435-R437 VanDerWaalsContact OD2-NH2 3.09Å; R437-F439 HydrophobicContact CB-CE2 3.71Å; R437-F439 HydrophobicContact CB-CZ 3.94Å; R437-E446 WeakPolarHBondContact CD-OE2 3.04Å; R437-E446 IonicContact CZ-OE2 3.24Å; R437-E446 IonicContact NE-OE2 3.85Å; R437-E446 IonicContact NH1-OE2 2.98Å; R437-E446 PolarHBondContact NH1-OE2 3.19Å; R437-V448 WeakPolarHBondContact CA-O 3.44Å; R437-V449 HydrophobicContact CG-CG1 4.26Å; R437-V449 HydrophobicContact CG-CG2 4.2Å
438	V	96.3	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.2	172.9	-170.8	0	0	0	0	109.7	L181 L429 A430 L447 V448 F462 I469	L181-V438 HydrophobicContact CD2-CB 3.91Å; L181-V438 HydrophobicContact CD2-CG1 3.74Å; L181-V438 HydrophobicContact CD2-CG2 4.28Å; L429-V438 CarbonylContact O-C 3.59Å; L429-V438 WeakPolarHBondContact O-CA 3.45Å; A430-V438 HydrophobicContact CB-CG2 4.3Å; V438-L447 PolarHBondContact O-N 2.98Å; V438-V448 HydrophobicContact CB-CG1 3.85Å; V438-V448 HydrophobicContact CG2-CG1 3.64Å; V438-V448 PolarHBondContact N-O 2.83Å; V438-F462 HydrophobicContact CG1-CE1 4.24Å; V438-F462 HydrophobicContact CG1-CZ 3.96Å; V438-I469 HydrophobicContact CG2-CD1 3.62Å
439	F	95.6	Very high	93.5	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.018	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	145.5	177.6	-59	-87.4	0	0	0	110.2	I409 L411 Y428 L429 V431 R437 N445 E446	I409-F439 HydrophobicContact CD1-CD1 4.29Å; I409-F439 HydrophobicContact CD1-CG 4.35Å; I409-F439 HydrophobicContact CG2-CE1 3.98Å; I409-F439 HydrophobicContact CG2-CZ 4.18Å; L411-F439 HydrophobicContact CD2-CE2 4.22Å; L411-F439 HydrophobicContact CD2-CZ 3.69Å; Y428-F439 WeakPolarHBondContact CA-O 3.41Å; L429-F439 HydrophobicContact CB-CB 4.47Å; L429-F439 PolarHBondContact N-O 3.1Å; L429-F439 PolarHBondContact O-N 3.47Å; V431-F439 HydrophobicContact CG2-CD2 4.37Å; V431-F439 HydrophobicContact CG2-CE2 4.15Å; R437-F439 HydrophobicContact CB-CE2 3.71Å; R437-F439 HydrophobicContact CB-CZ 3.94Å; F439-N445 VanDerWaalsContact CA-O 3.28Å; F439-N445 WeakPolarHBondContact CA-O 3.22Å; F439-E446 HydrophobicContact CD1-CB 4.07Å; F439-E446 HydrophobicContact CD1-CG 4.49Å; F439-E446 HydrophobicContact CE1-CB 3.79Å; F439-E446 HydrophobicContact CE1-CG 3.96Å; F439-E446 HydrophobicContact CZ-CG 4.41Å
440	Q	93.9	Very high	93.4	Very high	59 Å²	59	33.7 Å²	33.7	28%	0.276	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.1	168.8	-166.3	-180	28	0	0	110.4	Y428 S443 W444 N445 L447	Y428-Q440 HydrophobicContact CE1-CG 4.41Å; Q440-S443 WeakPolarHBondContact CB-OG 3.39Å; Q440-S443 PolarHBondContact OE1-OG 2.64Å; Q440-W444 WeakPolarHBondContact O-CA 3.08Å; Q440-W444 PolarHBondContact O-N 2.64Å; Q440-N445 PolarHBondContact N-O 2.68Å; Q440-L447 HydrophobicContact CB-CD1 3.93Å; Q440-L447 HydrophobicContact CB-CD2 4.27Å; Q440-L447 HydrophobicContact CB-CG 4.13Å
441	S	88.2	Confident	93.2	Very high	9 Å²	9	41 Å²	41	6%	0.063	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	151.1	175.1	-171.2	0	0	0	0	111.2	G426 N427 S443	G426-S441 WeakPolarHBondContact O-CB 3.47Å; G426-S441 PolarHBondContact O-OG 3.17Å; N427-S441 VanDerWaalsContact C-CB 3.47Å; N427-S441 WeakPolarHBondContact O-CB 3.32Å; N427-S441 PolarHBondContact O-N 2.97Å; S441-S443 PolarHBondContact O-N 3.15Å
442	K	87	Confident	93	Very high	162 Å²	162	44 Å²	44	70%	0.704	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	-52	-173.7	-51.7	174.2	-177.3	169.4	0	115	W444	K442-W444 VanDerWaalsContact O-CD1 3.31Å
443	S	90.6	Very high	92.9	Very high	51 Å²	51	45 Å²	45	36%	0.357	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-33.2	176.8	56.4	0	0	0	0	111.7	Q440 S441 N445	Q440-S443 WeakPolarHBondContact CB-OG 3.39Å; Q440-S443 PolarHBondContact OE1-OG 2.64Å; S441-S443 PolarHBondContact O-N 3.15Å; S443-N445 PolarHBondContact O-N 3.39Å
444	W	90.6	Very high	92.8	Very high	23 Å²	23	51 Å²	51	9%	0.087	27%	0.267	C	S	.	.			trans	58.4	27.5	-176	-52.4	107	0	0	0	113.5	I397 K407 I409 F422 L429 Q440 K442	I397-W444 HydrophobicContact CB-CH2 4.33Å; I397-W444 HydrophobicContact CB-CZ2 4.19Å; I397-W444 HydrophobicContact CD1-CE3 4.41Å; I397-W444 HydrophobicContact CD1-CH2 3.74Å; I397-W444 HydrophobicContact CD1-CZ2 4.4Å; I397-W444 HydrophobicContact CD1-CZ3 3.75Å; I397-W444 HydrophobicContact CG1-CD2 4.36Å; I397-W444 HydrophobicContact CG1-CE3 4.22Å; I397-W444 HydrophobicContact CG1-CH2 3.67Å; I397-W444 HydrophobicContact CG1-CZ2 3.82Å; I397-W444 HydrophobicContact CG1-CZ3 3.89Å; I397-W444 HydrophobicContact CG2-CH2 3.82Å; I397-W444 HydrophobicContact CG2-CZ2 3.69Å; K407-W444 HydrophobicContact CG-CG 4.11Å; I409-W444 HydrophobicContact CD1-CB 3.97Å; I409-W444 HydrophobicContact CD1-CD2 4.28Å; I409-W444 HydrophobicContact CD1-CE3 3.93Å; I409-W444 HydrophobicContact CD1-CG 4.33Å; I409-W444 HydrophobicContact CG1-CB 4.41Å; F422-W444 HydrophobicContact CE1-CH2 4.04Å; F422-W444 HydrophobicContact CE1-CZ3 4.29Å; F422-W444 HydrophobicContact CZ-CH2 4.09Å; L429-W444 HydrophobicContact CB-CZ3 4.26Å; L429-W444 HydrophobicContact CD2-CE3 4.44Å; L429-W444 HydrophobicContact CD2-CZ3 3.77Å; Q440-W444 WeakPolarHBondContact O-CA 3.08Å; Q440-W444 PolarHBondContact O-N 2.64Å; K442-W444 VanDerWaalsContact O-CD1 3.31Å
445	N	92.3	Very high	92.8	Very high	96 Å²	96	52.2 Å²	52.2	51%	0.513	27%	0.266	S	S	.	.			trans	-76.5	138.6	173.6	-65.8	-16.3	0	0	0	109.6	F439 Q440 S443 L447	F439-N445 VanDerWaalsContact CA-O 3.28Å; F439-N445 WeakPolarHBondContact CA-O 3.22Å; Q440-N445 PolarHBondContact N-O 2.68Å; S443-N445 PolarHBondContact O-N 3.39Å; N445-L447 PolarHBondContact O-N 3.26Å
446	E	93.6	Very high	92.8	Very high	98 Å²	98	53 Å²	53	46%	0.458	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	121.5	172	-166.4	176.2	94	0	0	108.6	R437 F439 V449	R437-E446 WeakPolarHBondContact CD-OE2 3.04Å; R437-E446 IonicContact CZ-OE2 3.24Å; R437-E446 IonicContact NE-OE2 3.85Å; R437-E446 IonicContact NH1-OE2 2.98Å; R437-E446 PolarHBondContact NH1-OE2 3.19Å; F439-E446 HydrophobicContact CD1-CB 4.07Å; F439-E446 HydrophobicContact CD1-CG 4.49Å; F439-E446 HydrophobicContact CE1-CB 3.79Å; F439-E446 HydrophobicContact CE1-CG 3.96Å; F439-E446 HydrophobicContact CZ-CG 4.41Å; E446-V449 VanDerWaalsContact CD-CG2 3.46Å; E446-V449 HydrophobicContact CG-CG2 3.94Å; E446-V449 WeakPolarHBondContact OE1-CG2 3.15Å
447	L	93.2	Very high	92.9	Very high	34 Å²	34	53 Å²	53	18%	0.178	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-45.9	-177.7	-66.9	178.4	0	0	0	112.1	P178 L181 S182 Y428 V438 Q440 N445	P178-L447 HydrophobicContact CB-CD1 4.03Å; P178-L447 HydrophobicContact CB-CD2 3.87Å; L181-L447 HydrophobicContact CD2-CB 4.1Å; L181-L447 HydrophobicContact CD2-CD1 4.03Å; S182-L447 WeakPolarHBondContact CB-O 3.37Å; Y428-L447 HydrophobicContact CD1-CD1 3.72Å; Y428-L447 HydrophobicContact CE1-CD1 3.59Å; V438-L447 PolarHBondContact O-N 2.98Å; Q440-L447 HydrophobicContact CB-CD1 3.93Å; Q440-L447 HydrophobicContact CB-CD2 4.27Å; Q440-L447 HydrophobicContact CB-CG 4.13Å; N445-L447 PolarHBondContact O-N 3.26Å
448	V	93.8	Very high	92.9	Very high	16 Å²	16	52.6 Å²	52.6	10%	0.097	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	147.2	-178.3	75.2	0	0	0	0	110.4	L181 R437 V438 L450	L181-V448 HydrophobicContact CD2-CG1 3.94Å; R437-V448 WeakPolarHBondContact CA-O 3.44Å; V438-V448 HydrophobicContact CB-CG1 3.85Å; V438-V448 HydrophobicContact CG2-CG1 3.64Å; V438-V448 PolarHBondContact N-O 2.83Å; V448-L450 HydrophobicContact CG1-CG 4.43Å; V448-L450 HydrophobicContact CG2-CD2 3.86Å; V448-L450 HydrophobicContact CG2-CG 4.42Å
449	V	94.2	Very high	92.8	Very high	43 Å²	43	52.7 Å²	52.7	26%	0.261	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	114.3	172.8	-176	0	0	0	0	108.3	D435 V436 R437 E446 K451	D435-V449 HydrophobicContact CB-CG1 4.06Å; D435-V449 WeakPolarHBondContact OD2-CG1 3.34Å; V436-V449 CarbonylContact O-C 3.59Å; V436-V449 WeakPolarHBondContact O-CA 3.3Å; R437-V449 HydrophobicContact CG-CG1 4.26Å; R437-V449 HydrophobicContact CG-CG2 4.2Å; E446-V449 VanDerWaalsContact CD-CG2 3.46Å; E446-V449 HydrophobicContact CG-CG2 3.94Å; E446-V449 WeakPolarHBondContact OE1-CG2 3.15Å; V449-K451 HydrophobicContact CG1-CD 4.38Å; V449-K451 HydrophobicContact CG1-CG 3.9Å
450	L	93.7	Very high	92.9	Very high	10 Å²	10	52.5 Å²	52.5	5%	0.052	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.7	-179.8	-51.7	169.5	0	0	0	108.2	D435 V436 V448 F481	D435-L450 WeakPolarHBondContact CB-O 3.39Å; V436-L450 HydrophobicContact CB-CB 4.22Å; V436-L450 HydrophobicContact CB-CD1 4.45Å; V436-L450 HydrophobicContact CG1-CD1 4.34Å; V436-L450 PolarHBondContact N-O 3.35Å; V436-L450 PolarHBondContact O-N 3.36Å; V448-L450 HydrophobicContact CG1-CG 4.43Å; V448-L450 HydrophobicContact CG2-CD2 3.86Å; V448-L450 HydrophobicContact CG2-CG 4.42Å; L450-F481 HydrophobicContact CB-CE1 4.23Å; L450-F481 HydrophobicContact CB-CZ 4.2Å; L450-F481 HydrophobicContact CD1-CB 4.18Å; L450-F481 HydrophobicContact CD1-CD1 3.95Å; L450-F481 HydrophobicContact CD1-CD2 3.74Å; L450-F481 HydrophobicContact CD1-CE1 4.26Å; L450-F481 HydrophobicContact CD1-CE2 4.05Å; L450-F481 HydrophobicContact CD1-CG 3.67Å; L450-F481 HydrophobicContact CD1-CZ 4.3Å; L450-F481 HydrophobicContact CD2-CD1 3.72Å; L450-F481 HydrophobicContact CD2-CE1 3.97Å; L450-F481 HydrophobicContact CD2-CG 4.26Å; L450-F481 HydrophobicContact CG-CD1 4.31Å; L450-F481 HydrophobicContact CG-CE1 4.38Å
451	K	92.9	Very high	93	Very high	153 Å²	153	51.4 Å²	51.4	67%	0.665	26%	0.264	S	S	*	.			trans	-116.2	19.1	-171.8	-62.3	-173.3	179.7	175.9	0	112.8	D435 V449	D435-K451 HydrophobicContact CB-CG 4Å; V449-K451 HydrophobicContact CG1-CD 4.38Å; V449-K451 HydrophobicContact CG1-CG 3.9Å
452	D	92	Very high	93.4	Very high	65 Å²	65	52.1 Å²	52.1	35%	0.348	27%	0.266	S	S	.	.			trans	-79.3	-24.3	-166.8	-50	-83.3	0	0	0	112.4	E186 T454 R479 F481	E186-D452 WeakPolarHBondContact OE2-CB 3.43Å; D452-T454 PolarHBondContact O-N 3.08Å; D452-R479 VanDerWaalsContact C-CZ 3.47Å; D452-R479 PolarHBondContact O-NH1 3.26Å; D452-R479 PolarHBondContact O-NH2 3.01Å; D452-F481 HydrophobicContact CB-CE1 4.32Å; D452-F481 HydrophobicContact CB-CZ 4.03Å; D452-F481 WeakPolarHBondContact OD2-CE1 3.38Å; D452-F481 WeakPolarHBondContact OD2-CZ 3.39Å
453	H	92.5	Very high	93.7	Very high	20 Å²	20	44.8 Å²	44.8	9%	0.093	24%	0.236	C	C	.	.			trans	-66.7	131.6	173.3	-77.1	-73.4	0	0	0	111.7	D455 T471 D475 A477	H453-D455 VanDerWaalsContact C-N 3.31Å; H453-D455 WeakPolarHBondContact CB-O 3.18Å; H453-T471 WeakPolarHBondContact NE2-CB 3.4Å; H453-T471 PolarHBondContact NE2-OG1 3.41Å; H453-D475 VanDerWaalsContact CA-OD2 3.31Å; H453-D475 WeakPolarHBondContact CA-OD2 3.42Å; H453-D475 IonicContact CE1-OD1 3.4Å; H453-D475 IonicContact CG-OD2 3.87Å; H453-D475 VanDerWaalsContact ND1-CG 3.28Å; H453-D475 IonicContact ND1-OD1 3.67Å; H453-D475 PolarHBondContact ND1-OD1 3.12Å; H453-D475 IonicContact ND1-OD2 3.83Å; H453-D475 PolarHBondContact ND1-OD2 3.08Å; H453-A477 PolarHBondContact CE1-O 2.93Å
454	T	91.9	Very high	93.6	Very high	125 Å²	125	48.1 Å²	48.1	77%	0.767	25%	0.246	S	C	*	.	S	Bend	trans	-83.6	-11.3	179.9	58	0	0	0	0	113.2	D452 D475	D452-T454 PolarHBondContact O-N 3.08Å; T454-D475 PolarHBondContact N-OD2 3.45Å; T454-D475 WeakPolarHBondContact OG1-CB 3.35Å
455	D	92.4	Very high	93.6	Very high	83 Å²	83	48.8 Å²	48.8	44%	0.444	25%	0.251	S	S	.	.	S	Bend	trans	-140	-179.7	176.5	-159.3	-10.4	0	0	0	108.8	H453 A457 M474 D475	H453-D455 VanDerWaalsContact C-N 3.31Å; H453-D455 WeakPolarHBondContact CB-O 3.18Å; D455-A457 PolarHBondContact O-N 3.01Å; D455-M474 HydrophobicContact CB-CB 4.12Å; D455-D475 HydrophobicContact CB-CB 4.04Å
456	L	94.2	Very high	93.5	Very high	35 Å²	35	44.2 Å²	44.2	18%	0.183	23%	0.227	C	C	.	.			trans	-54.3	126	-176.4	-73.3	163.1	0	0	0	112.9	Q416 G433 T458 G473 M474	Q416-L456 HydrophobicContact CB-CD2 3.84Å; G433-L456 CarbonylContact O-C 3.57Å; G433-L456 WeakPolarHBondContact O-CA 3.45Å; L456-T458 PolarHBondContact O-N 3.12Å; L456-G473 CarbonylContact O-C 3.58Å; L456-G473 VanDerWaalsContact O-CA 3.29Å; L456-G473 WeakPolarHBondContact O-CA 3.36Å; L456-M474 HydrophobicContact CB-CG 4.42Å; L456-M474 PolarHBondContact O-N 2.82Å
457	A	95.8	Very high	93.4	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	116.7	168.9	0	0	0	0	0	110	R418 S432 G433 V436 D455 C472	R418-A457 WeakPolarHBondContact CB-O 3.29Å; S432-A457 WeakPolarHBondContact CB-O 3.43Å; S432-A457 PolarHBondContact OG-O 3.19Å; S432-A457 VanDerWaalsContact OG-O 3.06Å; G433-A457 PolarHBondContact N-O 3.28Å; G433-A457 PolarHBondContact O-N 2.7Å; V436-A457 HydrophobicContact CG2-CB 3.62Å; D455-A457 PolarHBondContact O-N 3.01Å; A457-C472 CarbonylContact C-O 3.57Å; A457-C472 WeakPolarHBondContact CA-O 3.22Å
458	T	95.9	Very high	93.5	Very high	18 Å²	18	41.5 Å²	41.5	11%	0.11	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-18.5	-171.2	53.2	0	0	0	0	113.8	I201 L456 C472 M474	I201-T458 WeakPolarHBondContact O-CB 3.44Å; I201-T458 WeakPolarHBondContact O-CG2 3.47Å; I201-T458 PolarHBondContact O-OG1 3.27Å; L456-T458 PolarHBondContact O-N 3.12Å; T458-C472 PolarHBondContact N-O 2.91Å; T458-C472 PolarHBondContact OG1-O 2.94Å; T458-C472 PolarHBondContact OG1-SG 3.49Å; T458-M474 HydrophobicContact CG2-CG 3.66Å; T458-M474 HydrophobicContact CG2-SD 3.84Å
459	G	95.6	Very high	93.6	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	150.4	-179.5	0	0	0	0	0	112.6	T471 C472	G459-T471 WeakPolarHBondContact O-CA 3.31Å; G459-C472 PolarHBondContact N-O 3.36Å; G459-C472 PolarHBondContact N-SG 3.42Å; G459-C472 PolarHBondContact O-N 3.46Å; G459-C472 VanDerWaalsContact O-N 3.09Å
460	V	96.9	Very high	93.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	133.6	175.5	61.3	0	0	0	0	111	D419 C421 A430 V436 I469 V470 T471	D419-V460 PolarHBondContact OD2-N 2.83Å; C421-V460 HydrophobicContact CB-CG1 4.37Å; C421-V460 WeakPolarHBondContact CB-O 3.33Å; A430-V460 HydrophobicContact CB-CB 4.39Å; A430-V460 HydrophobicContact CB-CG1 3.87Å; A430-V460 HydrophobicContact CB-CG2 3.57Å; V436-V460 HydrophobicContact CG1-CB 4.46Å; V436-V460 HydrophobicContact CG1-CG2 3.95Å; V460-I469 HydrophobicContact CG2-CG2 3.62Å; V460-V470 WeakPolarHBondContact CA-O 3.38Å; V460-T471 HydrophobicContact CB-CG2 4.44Å; V460-T471 HydrophobicContact CG2-CG2 4.02Å
461	R	96.7	Very high	93.9	Very high	37 Å²	37	38.2 Å²	38.2	14%	0.14	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	144.9	176.2	-69.9	-66.9	179	-86.4	-3.4	110.6	D205 V206 D419 I469 V470	D205-R461 IonicContact OD1-CZ 3.92Å; D205-R461 IonicContact OD1-NE 3.86Å; D205-R461 PolarHBondContact OD1-NE 2.89Å; D205-R461 IonicContact OD1-NH2 3.98Å; V206-R461 HydrophobicContact CB-CB 4.25Å; V206-R461 HydrophobicContact CG2-CB 3.59Å; V206-R461 HydrophobicContact CG2-CG 4.08Å; D419-R461 IonicContact OD2-CZ 3.76Å; D419-R461 IonicContact OD2-NH1 2.86Å; D419-R461 PolarHBondContact OD2-NH1 3.44Å; D419-R461 IonicContact OD2-NH2 3.37Å; R461-I469 WeakPolarHBondContact O-CA 3.49Å; R461-V470 PolarHBondContact N-O 2.88Å; R461-V470 PolarHBondContact O-N 3.25Å
462	F	95.2	Very high	94	Very high	23 Å²	23	30.9 Å²	30.9	10%	0.101	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	141	171	-68.5	-84.5	0	0	0	110.2	C421 D423 A430 V438 A466 I469	C421-F462 WeakPolarHBondContact O-CE2 3.38Å; D423-F462 HydrophobicContact CB-CB 4.23Å; D423-F462 HydrophobicContact CB-CD1 4.23Å; D423-F462 HydrophobicContact CB-CD2 3.69Å; D423-F462 HydrophobicContact CB-CE2 4.03Å; D423-F462 HydrophobicContact CB-CG 3.79Å; D423-F462 HydrophobicContact CB-CZ 4.43Å; A430-F462 HydrophobicContact CB-CD2 4.49Å; A430-F462 HydrophobicContact CB-CE2 3.5Å; A430-F462 HydrophobicContact CB-CZ 3.51Å; V438-F462 HydrophobicContact CG1-CE1 4.24Å; V438-F462 HydrophobicContact CG1-CZ 3.96Å; F462-A466 HydrophobicContact CD1-CB 3.93Å; F462-A466 HydrophobicContact CE1-CB 4.44Å; F462-I469 HydrophobicContact CD1-CD1 4.15Å; F462-I469 HydrophobicContact CD1-CG1 3.7Å; F462-I469 HydrophobicContact CE1-CD1 3.7Å; F462-I469 HydrophobicContact CE1-CG1 3.81Å
463	G	92.8	Very high	94.2	Very high	8 Å²	8	27.8 Å²	27.8	8%	0.082	15%	0.151	C	C	.	.			trans	-73.4	-179.1	160.7	0	0	0	0	0	111.6	N465 A466 F468	G463-N465 PolarHBondContact O-N 3.02Å; G463-A466 PolarHBondContact O-N 2.85Å; G463-F468 PolarHBondContact N-O 3.36Å
464	E	89.7	Confident	94.3	Very high	122 Å²	122	29.5 Å²	29.5	57%	0.57	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-55.1	133.1	177.8	-175.7	178.5	-177.5	0	0	111.3	P211 A466 C467	P211-E464 HydrophobicContact CG-CB 3.99Å; E464-A466 PolarHBondContact O-N 3.35Å; E464-C467 VanDerWaalsContact O-CB 3.23Å; E464-C467 WeakPolarHBondContact O-CB 3.41Å; E464-C467 PolarHBondContact O-N 3.13Å; E464-C467 PolarHBondContact O-SG 2.9Å
465	N	89.6	Confident	94.3	Very high	36 Å²	36	24.7 Å²	24.7	19%	0.193	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	51	28	179.1	-61.4	-39.6	0	0	0	114.7	I176 G463 C467	I176-N465 PolarHBondContact N-O 3.4Å; G463-N465 PolarHBondContact O-N 3.02Å; N465-C467 PolarHBondContact O-N 3.19Å
466	A	91.4	Very high	94.4	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	58.3	18.8	-172.9	0	0	0	0	0	114.4	L175 L181 Y184 Y428 F462 G463 E464 F468	L175-A466 HydrophobicContact CD1-CB 4.38Å; L181-A466 HydrophobicContact CD1-CB 4.31Å; Y184-A466 PolarHBondContact OH-O 3.44Å; Y428-A466 HydrophobicContact CD2-CB 4.03Å; Y428-A466 HydrophobicContact CE2-CB 4.29Å; F462-A466 HydrophobicContact CD1-CB 3.93Å; F462-A466 HydrophobicContact CE1-CB 4.44Å; G463-A466 PolarHBondContact O-N 2.85Å; E464-A466 PolarHBondContact O-N 3.35Å; A466-F468 PolarHBondContact O-N 3.35Å
467	C	91.2	Very high	94.4	Very high	61 Å²	61	22 Å²	22	41%	0.412	11%	0.111	S	C	.	.	S	Bend	trans	-51	-33	179	-74.4	0	0	0	0	114.1	I176 E464 N465	I176-C467 VanDerWaalsContact CD1-CA 3.48Å; I176-C467 HydrophobicContact CD1-CB 4.41Å; E464-C467 VanDerWaalsContact O-CB 3.23Å; E464-C467 WeakPolarHBondContact O-CB 3.41Å; E464-C467 PolarHBondContact O-N 3.13Å; E464-C467 PolarHBondContact O-SG 2.9Å; N465-C467 PolarHBondContact O-N 3.19Å
468	F	94.4	Very high	94.4	Very high	13 Å²	13	22 Å²	22	6%	0.057	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	164.6	172.5	58.8	-85.5	0	0	0	109.7	P211 K228 G463 A466 V470 I480 F481	P211-F468 HydrophobicContact CB-CZ 3.87Å; P211-F468 HydrophobicContact CG-CE1 4.42Å; P211-F468 HydrophobicContact CG-CZ 4.21Å; K228-F468 HydrophobicContact CD-CD2 4.42Å; K228-F468 HydrophobicContact CD-CE1 4.5Å; K228-F468 HydrophobicContact CD-CE2 3.99Å; K228-F468 HydrophobicContact CD-CZ 4.02Å; K228-F468 VanDerWaalsContact NZ-CE1 3.26Å; G463-F468 PolarHBondContact N-O 3.36Å; A466-F468 PolarHBondContact O-N 3.35Å; F468-V470 HydrophobicContact CD2-CG2 3.7Å; F468-V470 HydrophobicContact CE2-CG2 3.61Å; F468-I480 HydrophobicContact CB-CG2 4.16Å; F468-I480 HydrophobicContact CD2-CG2 4.02Å; F468-I480 HydrophobicContact CG-CG2 4.38Å; F468-F481 CarbonylContact C-O 3.54Å; F468-F481 WeakPolarHBondContact CA-O 3.49Å; F468-F481 WeakPolarHBondContact CB-O 3.21Å
469	I	96.1	Very high	94.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131	173.3	-61.5	171.8	0	0	0	107.1	Y184 V438 V460 R461 F462 T471 I480 F481	Y184-I469 HydrophobicContact CD2-CD1 4.02Å; Y184-I469 HydrophobicContact CD2-CG1 4.3Å; Y184-I469 HydrophobicContact CE2-CD1 4.03Å; Y184-I469 HydrophobicContact CE2-CG1 4.05Å; V438-I469 HydrophobicContact CG2-CD1 3.62Å; V460-I469 HydrophobicContact CG2-CG2 3.62Å; R461-I469 WeakPolarHBondContact O-CA 3.49Å; F462-I469 HydrophobicContact CD1-CD1 4.15Å; F462-I469 HydrophobicContact CD1-CG1 3.7Å; F462-I469 HydrophobicContact CE1-CD1 3.7Å; F462-I469 HydrophobicContact CE1-CG1 3.81Å; I469-T471 HydrophobicContact CG2-CG2 4.02Å; I469-I480 WeakPolarHBondContact O-CA 3.42Å; I469-F481 HydrophobicContact CB-CB 4.46Å; I469-F481 PolarHBondContact N-O 3.32Å; I469-F481 PolarHBondContact O-N 2.99Å
470	V	96.7	Very high	94.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.9	172.2	-167.1	0	0	0	0	107.9	M204 V206 I214 V460 R461 F468 L478 R479 I480	M204-V470 HydrophobicContact CE-CB 3.92Å; M204-V470 HydrophobicContact CE-CG1 3.73Å; M204-V470 WeakPolarHBondContact CE-O 3.22Å; M204-V470 HydrophobicContact SD-CB 4.16Å; M204-V470 HydrophobicContact SD-CG1 3.37Å; M204-V470 WeakPolarHBondContact SD-CG1 3.37Å; V206-V470 HydrophobicContact CG2-CB 4.43Å; V206-V470 HydrophobicContact CG2-CG2 4.23Å; I214-V470 HydrophobicContact CD1-CG1 3.95Å; I214-V470 HydrophobicContact CD1-CG2 3.91Å; I214-V470 HydrophobicContact CG2-CG1 4.42Å; V460-V470 WeakPolarHBondContact CA-O 3.38Å; R461-V470 PolarHBondContact N-O 2.88Å; R461-V470 PolarHBondContact O-N 3.25Å; F468-V470 HydrophobicContact CD2-CG2 3.7Å; F468-V470 HydrophobicContact CE2-CG2 3.61Å; V470-L478 HydrophobicContact CG1-CD1 4.11Å; V470-L478 HydrophobicContact CG1-CD2 4.05Å; V470-L478 HydrophobicContact CG1-CG 3.93Å; V470-R479 WeakPolarHBondContact CA-O 3.43Å; V470-I480 HydrophobicContact CG1-CG1 4.38Å
471	T	97.4	Very high	94.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.3	174.2	66.7	0	0	0	0	110	V436 H453 G459 V460 I469 L478 R479 F481	V436-T471 HydrophobicContact CB-CG2 4.28Å; V436-T471 HydrophobicContact CG1-CG2 3.94Å; V436-T471 HydrophobicContact CG2-CG2 3.85Å; H453-T471 WeakPolarHBondContact NE2-CB 3.4Å; H453-T471 PolarHBondContact NE2-OG1 3.41Å; G459-T471 WeakPolarHBondContact O-CA 3.31Å; V460-T471 HydrophobicContact CB-CG2 4.44Å; V460-T471 HydrophobicContact CG2-CG2 4.02Å; I469-T471 HydrophobicContact CG2-CG2 4.02Å; T471-L478 CarbonylContact O-C 3.41Å; T471-L478 WeakPolarHBondContact O-CA 3.48Å; T471-R479 PolarHBondContact N-O 3.01Å; T471-R479 PolarHBondContact O-N 2.73Å; T471-F481 HydrophobicContact CG2-CD2 4.22Å; T471-F481 HydrophobicContact CG2-CE2 4.1Å; T471-F481 WeakPolarHBondContact OG1-CE2 3.21Å
472	C	96.5	Very high	94.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.5	173	67.9	0	0	0	0	110.5	I201 M204 A457 T458 G459 A477	I201-C472 HydrophobicContact CB-CB 3.98Å; I201-C472 HydrophobicContact CD1-CB 4.17Å; I201-C472 HydrophobicContact CG2-CB 3.62Å; M204-C472 HydrophobicContact CB-CB 4.19Å; M204-C472 WeakPolarHBondContact CB-SG 3.1Å; M204-C472 HydrophobicContact CE-CB 4.32Å; M204-C472 HydrophobicContact SD-CB 3.98Å; A457-C472 CarbonylContact C-O 3.57Å; A457-C472 WeakPolarHBondContact CA-O 3.22Å; T458-C472 PolarHBondContact N-O 2.91Å; T458-C472 PolarHBondContact OG1-O 2.94Å; T458-C472 PolarHBondContact OG1-SG 3.49Å; G459-C472 PolarHBondContact N-O 3.36Å; G459-C472 PolarHBondContact N-SG 3.42Å; G459-C472 PolarHBondContact O-N 3.46Å; G459-C472 VanDerWaalsContact O-N 3.09Å; C472-A477 WeakPolarHBondContact CA-O 3.34Å
473	G	95.4	Very high	94	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	169.7	-176.5	0	0	0	0	0	115.5	I201 L456 D475 R476 A477	I201-G473 PolarHBondContact N-O 3.42Å; L456-G473 CarbonylContact O-C 3.58Å; L456-G473 VanDerWaalsContact O-CA 3.29Å; L456-G473 WeakPolarHBondContact O-CA 3.36Å; G473-D475 WeakPolarHBondContact CA-OD1 3.45Å; G473-D475 PolarHBondContact O-N 3.43Å; G473-R476 PolarHBondContact O-N 3Å; G473-A477 PolarHBondContact N-O 3.48Å; G473-A477 VanDerWaalsContact N-O 3.17Å
474	M	94.9	Very high	93.4	Very high	56 Å²	56	27 Å²	27	28%	0.276	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.7	171	-69.8	-56.4	-60.9	0	0	112.5	G200 D455 L456 T458 R476	G200-M474 WeakPolarHBondContact CA-O 3.31Å; D455-M474 HydrophobicContact CB-CB 4.12Å; L456-M474 HydrophobicContact CB-CG 4.42Å; L456-M474 PolarHBondContact O-N 2.82Å; T458-M474 HydrophobicContact CG2-CG 3.66Å; T458-M474 HydrophobicContact CG2-SD 3.84Å; M474-R476 PolarHBondContact O-N 2.95Å; M474-R476 VanDerWaalsContact O-N 3.14Å
475	D	92.8	Very high	92.5	Very high	24 Å²	24	30.3 Å²	30.3	13%	0.128	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	3.8	170.9	66.6	-12.3	0	0	0	113.9	H453 T454 D455 G473 A477 R479	H453-D475 VanDerWaalsContact CA-OD2 3.31Å; H453-D475 WeakPolarHBondContact CA-OD2 3.42Å; H453-D475 IonicContact CE1-OD1 3.4Å; H453-D475 IonicContact CG-OD2 3.87Å; H453-D475 VanDerWaalsContact ND1-CG 3.28Å; H453-D475 IonicContact ND1-OD1 3.67Å; H453-D475 PolarHBondContact ND1-OD1 3.12Å; H453-D475 IonicContact ND1-OD2 3.83Å; H453-D475 PolarHBondContact ND1-OD2 3.08Å; T454-D475 PolarHBondContact N-OD2 3.45Å; T454-D475 WeakPolarHBondContact OG1-CB 3.35Å; D455-D475 HydrophobicContact CB-CB 4.04Å; G473-D475 WeakPolarHBondContact CA-OD1 3.45Å; G473-D475 PolarHBondContact O-N 3.43Å; D475-A477 PolarHBondContact O-N 3.31Å; D475-A477 PolarHBondContact OD1-N 2.89Å; D475-R479 IonicContact OD2-NE 2.67Å; D475-R479 IonicContact OD2-NH2 3.73Å
476	R	93.2	Very high	90.6	Very high	61 Å²	61	34.9 Å²	34.9	23%	0.23	18%	0.181	C	C	.	.	S	Bend	trans	70.9	3.2	-179.8	-155.2	178	74	-143.3	0.9	113.7	M191 H194 S195 A196 P199 G473 M474	M191-R476 PolarHBondContact O-NE 3.37Å; M191-R476 PolarHBondContact O-NH2 3.06Å; M191-R476 VanDerWaalsContact O-NH2 3.07Å; H194-R476 HydrophobicContact CB-CG 4.36Å; H194-R476 WeakPolarHBondContact O-CD 3.43Å; S195-R476 WeakPolarHBondContact O-CD 3.46Å; A196-R476 VanDerWaalsContact CA-NH1 3.28Å; A196-R476 VanDerWaalsContact CB-NH1 3.26Å; P199-R476 HydrophobicContact CB-CB 4.46Å; G473-R476 PolarHBondContact O-N 3Å; M474-R476 PolarHBondContact O-N 2.95Å; M474-R476 VanDerWaalsContact O-N 3.14Å
477	A	94.8	Very high	87.9	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	25%	0.247	C	C	.	.			trans	-87.5	134.3	179.8	0	0	0	0	0	110.6	M191 H453 C472 G473 D475 R479	M191-A477 HydrophobicContact CG-CB 4.26Å; H453-A477 PolarHBondContact CE1-O 2.93Å; C472-A477 WeakPolarHBondContact CA-O 3.34Å; G473-A477 PolarHBondContact N-O 3.48Å; G473-A477 VanDerWaalsContact N-O 3.17Å; D475-A477 PolarHBondContact O-N 3.31Å; D475-A477 PolarHBondContact OD1-N 2.89Å; A477-R479 HydrophobicContact CB-CG 4.09Å
478	L	96.4	Very high	87.7	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.6	154.6	178.8	142.2	0	0	0	107.3	S189 H190 L193 I201 M204 I214 T216 F226 V470 T471 I480	S189-L478 WeakPolarHBondContact CA-O 3.41Å; H190-L478 PolarHBondContact N-O 2.83Å; H190-L478 PolarHBondContact O-N 3.42Å; L193-L478 HydrophobicContact CD1-CB 3.59Å; L193-L478 HydrophobicContact CD1-CD1 3.89Å; L193-L478 HydrophobicContact CD1-CG 4.23Å; I201-L478 HydrophobicContact CD1-CB 4.19Å; M204-L478 HydrophobicContact SD-CD1 3.7Å; M204-L478 HydrophobicContact SD-CG 4.35Å; I214-L478 HydrophobicContact CD1-CD2 4.36Å; I214-L478 HydrophobicContact CG2-CD1 3.79Å; T216-L478 HydrophobicContact CG2-CD1 3.43Å; T216-L478 VanDerWaalsContact CG2-CD1 3.43Å; F226-L478 HydrophobicContact CD1-CD2 4.38Å; F226-L478 HydrophobicContact CE1-CD2 4.35Å; V470-L478 HydrophobicContact CG1-CD1 4.11Å; V470-L478 HydrophobicContact CG1-CD2 4.05Å; V470-L478 HydrophobicContact CG1-CG 3.93Å; T471-L478 CarbonylContact O-C 3.41Å; T471-L478 WeakPolarHBondContact O-CA 3.48Å; L478-I480 HydrophobicContact CD2-CD1 4.22Å; L478-I480 HydrophobicContact CD2-CG1 4.01Å
479	R	96.3	Very high	87.4	Confident	25 Å²	25	43.5 Å²	43.5	9%	0.094	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.3	-178	-61.2	-178.1	-172.2	-114.1	1.6	110.1	E186 A188 D452 V470 T471 D475 A477 F481	E186-R479 IonicContact OE1-NH1 3.68Å; E186-R479 PolarHBondContact OE1-NH1 3.23Å; E186-R479 IonicContact OE2-CZ 2.77Å; E186-R479 IonicContact OE2-NH1 3.56Å; E186-R479 PolarHBondContact OE2-NH1 3.5Å; A188-R479 WeakPolarHBondContact O-CA 3.36Å; D452-R479 VanDerWaalsContact C-CZ 3.47Å; D452-R479 PolarHBondContact O-NH1 3.26Å; D452-R479 PolarHBondContact O-NH2 3.01Å; V470-R479 WeakPolarHBondContact CA-O 3.43Å; T471-R479 PolarHBondContact N-O 3.01Å; T471-R479 PolarHBondContact O-N 2.73Å; D475-R479 IonicContact OD2-NE 2.67Å; D475-R479 IonicContact OD2-NH2 3.73Å; A477-R479 HydrophobicContact CB-CG 4.09Å; R479-F481 HydrophobicContact CB-CD2 4.37Å; R479-F481 HydrophobicContact CB-CE2 3.59Å; R479-F481 HydrophobicContact CB-CZ 4.01Å
480	I	96	Very high	86.9	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.1	178.9	-54.2	179.8	0	0	0	107.4	L187 A188 I214 K228 F468 I469 V470 L478	L187-I480 PolarHBondContact N-O 3.21Å; A188-I480 HydrophobicContact CB-CB 4.41Å; A188-I480 PolarHBondContact N-O 3.01Å; A188-I480 PolarHBondContact O-N 2.94Å; I214-I480 HydrophobicContact CD1-CD1 4.38Å; K228-I480 HydrophobicContact CB-CD1 4.19Å; K228-I480 HydrophobicContact CD-CD1 3.91Å; K228-I480 HydrophobicContact CD-CG2 4.48Å; K228-I480 HydrophobicContact CG-CD1 3.62Å; F468-I480 HydrophobicContact CB-CG2 4.16Å; F468-I480 HydrophobicContact CD2-CG2 4.02Å; F468-I480 HydrophobicContact CG-CG2 4.38Å; I469-I480 WeakPolarHBondContact O-CA 3.42Å; V470-I480 HydrophobicContact CG1-CG1 4.38Å; L478-I480 HydrophobicContact CD2-CD1 4.22Å; L478-I480 HydrophobicContact CD2-CG1 4.01Å
481	F	95.7	Very high	86.3	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.2	179.6	-62.6	-89.9	0	0	0	110.1	Y184 V185 E186 L450 D452 F468 I469 T471 R479	Y184-F481 HydrophobicContact CD2-CB 4.37Å; V185-F481 VanDerWaalsContact O-CA 3.26Å; V185-F481 WeakPolarHBondContact O-CA 3.43Å; E186-F481 HydrophobicContact CB-CD1 4.11Å; E186-F481 HydrophobicContact CB-CE1 3.79Å; E186-F481 HydrophobicContact CG-CE1 4.37Å; L450-F481 HydrophobicContact CB-CE1 4.23Å; L450-F481 HydrophobicContact CB-CZ 4.2Å; L450-F481 HydrophobicContact CD1-CB 4.18Å; L450-F481 HydrophobicContact CD1-CD1 3.95Å; L450-F481 HydrophobicContact CD1-CD2 3.74Å; L450-F481 HydrophobicContact CD1-CE1 4.26Å; L450-F481 HydrophobicContact CD1-CE2 4.05Å; L450-F481 HydrophobicContact CD1-CG 3.67Å; L450-F481 HydrophobicContact CD1-CZ 4.3Å; L450-F481 HydrophobicContact CD2-CD1 3.72Å; L450-F481 HydrophobicContact CD2-CE1 3.97Å; L450-F481 HydrophobicContact CD2-CG 4.26Å; L450-F481 HydrophobicContact CG-CD1 4.31Å; L450-F481 HydrophobicContact CG-CE1 4.38Å; D452-F481 HydrophobicContact CB-CE1 4.32Å; D452-F481 HydrophobicContact CB-CZ 4.03Å; D452-F481 WeakPolarHBondContact OD2-CE1 3.38Å; D452-F481 WeakPolarHBondContact OD2-CZ 3.39Å; F468-F481 CarbonylContact C-O 3.54Å; F468-F481 WeakPolarHBondContact CA-O 3.49Å; F468-F481 WeakPolarHBondContact CB-O 3.21Å; I469-F481 HydrophobicContact CB-CB 4.46Å; I469-F481 PolarHBondContact N-O 3.32Å; I469-F481 PolarHBondContact O-N 2.99Å; T471-F481 HydrophobicContact CG2-CD2 4.22Å; T471-F481 HydrophobicContact CG2-CE2 4.1Å; T471-F481 WeakPolarHBondContact OG1-CE2 3.21Å; R479-F481 HydrophobicContact CB-CD2 4.37Å; R479-F481 HydrophobicContact CB-CE2 3.59Å; R479-F481 HydrophobicContact CB-CZ 4.01Å
482	G	93.5	Very high	85.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	-170.3	175.2	0	0	0	0	0	111.4	Y184 V185 S484	Y184-G482 WeakPolarHBondContact CA-O 3.46Å; V185-G482 PolarHBondContact N-O 2.98Å; V185-G482 PolarHBondContact O-N 2.89Å; G482-S484 PolarHBondContact O-N 3.31Å
483	Q	90	Very high	84.9	Confident	111 Å²	111	55.1 Å²	55.1	52%	0.519	32%	0.315	S	S	.	.			trans	-67.5	130.5	174.2	-173.7	176.4	-1.7	0	0	109.7	V180 E485	V180-Q483 HydrophobicContact CG1-CB 4.12Å; V180-Q483 VanDerWaalsContact CG1-CD 3.44Å; V180-Q483 HydrophobicContact CG1-CG 3.86Å; Q483-E485 PolarHBondContact O-N 3.48Å
484	S	79.8	Confident	84.2	Confident	51 Å²	51	59 Å²	59	36%	0.357	34%	0.337	S	S	.	.			trans	-58.3	126.5	170.2	-176.9	0	0	0	0	109.5	G482 V486	G482-S484 PolarHBondContact O-N 3.31Å; S484-V486 PolarHBondContact O-N 3.39Å; S484-V486 PolarHBondContact OG-N 3.11Å
485	E	71.1	Confident	83.3	Confident	193 Å²	193	59.2 Å²	59.2	90%	0.902	34%	0.342	S	S	*	.	S	Bend	trans	-72	-1.7	173.7	-69.5	-168.6	160.5	0	0	112.9	Q483 A487	Q483-E485 PolarHBondContact O-N 3.48Å; E485-A487 PolarHBondContact O-N 3.03Å
486	V	50	Low	82.5	Confident	132 Å²	132	62.2 Å²	62.2	80%	0.8	36%	0.36	S	S	*	.			trans	-85.5	94.2	177	-169	0	0	0	0	109.7	S484	S484-V486 PolarHBondContact O-N 3.39Å; S484-V486 PolarHBondContact OG-N 3.11Å
487	A	33.9	Very low	81.6	Confident	168 Å²	168	62.3 Å²	62.3	100%	1.388	37%	0.372	S	S	*	.			trans	-108.3	0	160.3	0	0	0	0	0	110.2	E485	E485-A487 PolarHBondContact O-N 3.03Å

Retrieved 487 of 487 residues in 615.1 ms (Link to these results)

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