A0A5K4F1B5_SCHMA Loading...

UBX domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1B5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 634 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	38.5	Very low	71.5	Confident	249 Å²	249	98.9 Å²	98.9	100%	1.227	54%	0.54	S	S	*	.				0	100.9	0	-70.2	-158.8	173.3	0	0	108.8
2	L	45.5	Very low	73.2	Confident	159 Å²	159	105 Å²	105	83%	0.832	55%	0.549	S	S	*	.			trans	-89.5	118	168.8	-78.6	151.8	0	0	0	106.1	H4	L2-H4 PolarHBondContact O-N 3.18Å; L2-H4 VanDerWaalsContact O-N 3.12Å
3	S	47.5	Very low	74.5	Confident	103 Å²	103	102.3 Å²	102.3	72%	0.72	53%	0.532	S	S	*	.			trans	-61.1	114	172	53.6	0	0	0	0	108.4	T5	S3-T5 VanDerWaalsContact C-N 3.33Å; S3-T5 PolarHBondContact O-N 3.2Å
4	H	59.8	Low	75.9	Confident	134 Å²	134	95 Å²	95	62%	0.62	49%	0.494	S	S	*	.			trans	-66	93.2	176.2	-68.4	-79.1	0	0	0	109.2	L2 V6	L2-H4 PolarHBondContact O-N 3.18Å; L2-H4 VanDerWaalsContact O-N 3.12Å; H4-V6 PolarHBondContact O-N 3.32Å
5	T	74.9	Confident	77	Confident	113 Å²	113	90.9 Å²	90.9	69%	0.693	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-72.1	116.3	171.3	51.2	0	0	0	0	108.2	S3	S3-T5 VanDerWaalsContact C-N 3.33Å; S3-T5 PolarHBondContact O-N 3.2Å
6	V	78.4	Confident	77.9	Confident	31 Å²	31	95.6 Å²	95.6	19%	0.188	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-67.6	134.2	174.7	179.5	0	0	0	0	109.5	H4 T8 I11 L29 N34	H4-V6 PolarHBondContact O-N 3.32Å; V6-T8 PolarHBondContact O-N 3.05Å; V6-I11 HydrophobicContact CB-CD1 4.38Å; V6-I11 HydrophobicContact CG1-CD1 3.85Å; V6-I11 HydrophobicContact CG1-CG1 3.75Å; V6-L29 HydrophobicContact CG1-CB 3.7Å; V6-L29 HydrophobicContact CG1-CD1 3.99Å; V6-N34 VanDerWaalsContact CA-OD1 3.23Å; V6-N34 WeakPolarHBondContact CA-OD1 3.33Å; V6-N34 WeakPolarHBondContact CG1-OD1 3.46Å
7	S	85.3	Confident	78.7	Confident	49 Å²	49	95.1 Å²	95.1	34%	0.343	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-68.8	123.3	-177.9	176.6	0	0	0	0	111.7	K9 C10 I11 N34	S7-K9 PolarHBondContact O-N 3.29Å; S7-K9 VanDerWaalsContact O-N 3.15Å; S7-C10 PolarHBondContact O-N 3.16Å; S7-I11 PolarHBondContact O-N 3.35Å; S7-I11 VanDerWaalsContact O-N 3.12Å; S7-N34 PolarHBondContact N-OD1 3.24Å
8	T	85.9	Confident	79.2	Confident	98 Å²	98	90.9 Å²	90.9	60%	0.601	48%	0.476	S	S	*	.	H	α-helix	trans	-63.7	-18.3	178.2	58.4	0	0	0	0	113.7	V6 R12	V6-T8 PolarHBondContact O-N 3.05Å; T8-R12 PolarHBondContact O-NE 3.33Å
9	K	89.1	Confident	79.8	Confident	123 Å²	123	89.8 Å²	89.8	54%	0.535	49%	0.489	S	S	.	.	H	α-helix	trans	-73.6	-47.3	171	-174.5	-175.3	169.9	-168	0	110.8	S7 I11 R12 E13	S7-K9 PolarHBondContact O-N 3.29Å; S7-K9 VanDerWaalsContact O-N 3.15Å; K9-I11 VanDerWaalsContact C-N 3.31Å; K9-I11 PolarHBondContact O-N 3.4Å; K9-R12 PolarHBondContact O-N 3.13Å; K9-E13 WeakPolarHBondContact CE-OE1 3.35Å; K9-E13 IonicContact NZ-OE1 3.79Å; K9-E13 PolarHBondContact O-N 2.93Å; K9-E13 VanDerWaalsContact O-N 3.09Å
10	C	89.8	Confident	80.2	Confident	21 Å²	21	86 Å²	86	14%	0.142	47%	0.469	C	S	.	.	H	α-helix	trans	-64.1	-36.4	179.9	-61.8	0	0	0	0	111.8	S7 E13 F14 L29	S7-C10 PolarHBondContact O-N 3.16Å; C10-E13 PolarHBondContact O-N 3.11Å; C10-F14 VanDerWaalsContact O-CB 3.29Å; C10-F14 WeakPolarHBondContact O-CB 3.36Å; C10-F14 PolarHBondContact O-N 3.3Å; C10-L29 HydrophobicContact CB-CD1 3.88Å; C10-L29 HydrophobicContact CB-CD2 4.06Å
11	I	92.3	Very high	80.7	Confident	8 Å²	8	85.8 Å²	85.8	4%	0.041	47%	0.468	C	S	.	.	H	α-helix	trans	-59.6	-47.2	174.7	-67.4	171.1	0	0	0	111	V6 S7 K9 F14 C15 E22 A25 R26 L29	V6-I11 HydrophobicContact CB-CD1 4.38Å; V6-I11 HydrophobicContact CG1-CD1 3.85Å; V6-I11 HydrophobicContact CG1-CG1 3.75Å; S7-I11 PolarHBondContact O-N 3.35Å; S7-I11 VanDerWaalsContact O-N 3.12Å; K9-I11 VanDerWaalsContact C-N 3.31Å; K9-I11 PolarHBondContact O-N 3.4Å; I11-F14 PolarHBondContact O-N 3.39Å; I11-C15 WeakPolarHBondContact O-CB 3.38Å; I11-C15 PolarHBondContact O-N 3.29Å; I11-C15 PolarHBondContact O-SG 2.93Å; I11-C15 VanDerWaalsContact O-SG 3.33Å; I11-E22 HydrophobicContact CG2-CG 3.69Å; I11-A25 HydrophobicContact CG2-CB 4.24Å; I11-R26 HydrophobicContact CD1-CG 3.61Å; I11-R26 HydrophobicContact CG1-CG 4.2Å; I11-L29 HydrophobicContact CB-CD1 4.42Å; I11-L29 HydrophobicContact CG1-CD1 3.83Å
12	R	91.2	Very high	83.2	Confident	172 Å²	172	78.5 Å²	78.5	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-64.6	-43	179.4	-80.8	-175.2	-78.1	163.6	-7.5	112.4	T8 K9 Q16	T8-R12 PolarHBondContact O-NE 3.33Å; K9-R12 PolarHBondContact O-N 3.13Å; R12-Q16 VanDerWaalsContact O-CB 3.28Å; R12-Q16 WeakPolarHBondContact O-CB 3.46Å; R12-Q16 PolarHBondContact O-N 3.27Å
13	E	90.7	Very high	85.2	Confident	70 Å²	70	78 Å²	78	33%	0.327	42%	0.424	S	S	.	.	H	α-helix	trans	-66	-41.3	177.2	-73.6	174.6	-179	0	0	111.4	K9 C10 Q16 V17 L36	K9-E13 WeakPolarHBondContact CE-OE1 3.35Å; K9-E13 IonicContact NZ-OE1 3.79Å; K9-E13 PolarHBondContact O-N 2.93Å; K9-E13 VanDerWaalsContact O-N 3.09Å; C10-E13 PolarHBondContact O-N 3.11Å; E13-Q16 PolarHBondContact O-N 3.35Å; E13-V17 VanDerWaalsContact O-CG2 3.31Å; E13-V17 WeakPolarHBondContact O-CG2 3.31Å; E13-V17 PolarHBondContact O-N 2.97Å; E13-L36 HydrophobicContact CB-CD1 4.29Å; E13-L36 HydrophobicContact CB-CD2 3.77Å; E13-L36 WeakPolarHBondContact OE2-CD2 3.28Å
14	F	93.5	Very high	87.2	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-59.5	-53.9	174.9	-173.6	-85.4	0	0	0	111.1	C10 I11 Q16 V17 T18 S20 A25 F28 L29 L36 A39 V40 Y43	C10-F14 VanDerWaalsContact O-CB 3.29Å; C10-F14 WeakPolarHBondContact O-CB 3.36Å; C10-F14 PolarHBondContact O-N 3.3Å; I11-F14 PolarHBondContact O-N 3.39Å; F14-Q16 PolarHBondContact O-N 3.02Å; F14-V17 PolarHBondContact O-N 3.49Å; F14-T18 HydrophobicContact CD1-CG2 4.07Å; F14-T18 WeakPolarHBondContact CD1-OG1 3.44Å; F14-T18 HydrophobicContact CD2-CG2 4.25Å; F14-T18 HydrophobicContact CE1-CG2 3.85Å; F14-T18 WeakPolarHBondContact CE1-OG1 3.48Å; F14-T18 HydrophobicContact CE2-CG2 4.01Å; F14-T18 HydrophobicContact CG-CG2 4.29Å; F14-T18 HydrophobicContact CZ-CG2 3.82Å; F14-T18 PolarHBondContact O-N 3.42Å; F14-T18 PolarHBondContact O-OG1 3.4Å; F14-S20 WeakPolarHBondContact CD1-OG 3.39Å; F14-S20 WeakPolarHBondContact CE1-OG 3.34Å; F14-A25 HydrophobicContact CB-CB 4.24Å; F14-A25 HydrophobicContact CD1-CB 3.35Å; F14-A25 HydrophobicContact CE1-CB 3.93Å; F14-A25 HydrophobicContact CG-CB 4.03Å; F14-F28 HydrophobicContact CE2-CB 4.1Å; F14-F28 HydrophobicContact CZ-CB 3.93Å; F14-F28 HydrophobicContact CZ-CD2 4.47Å; F14-F28 HydrophobicContact CZ-CG 4.19Å; F14-L29 HydrophobicContact CB-CD1 4.23Å; F14-L36 HydrophobicContact CB-CD1 3.7Å; F14-L36 HydrophobicContact CD2-CD1 4.16Å; F14-L36 HydrophobicContact CG-CD1 4.45Å; F14-A39 HydrophobicContact CD2-CB 4Å; F14-A39 HydrophobicContact CE2-CB 3.73Å; F14-V40 HydrophobicContact CD2-CG2 3.64Å; F14-V40 HydrophobicContact CE2-CG2 3.98Å; F14-Y43 HydrophobicContact CZ-CD2 4.17Å; F14-Y43 AromaticContact CZ-CG 3.95Å; F14-Y43 HydrophobicContact CZ-CG 3.95Å
15	C	92.8	Very high	88.6	Confident	33 Å²	33	68.6 Å²	68.6	22%	0.223	37%	0.371	C	S	.	.	H	α-helix	trans	-59	-34.7	177.8	-69.7	0	0	0	0	112.6	I11 G19 S20	I11-C15 WeakPolarHBondContact O-CB 3.38Å; I11-C15 PolarHBondContact O-N 3.29Å; I11-C15 PolarHBondContact O-SG 2.93Å; I11-C15 VanDerWaalsContact O-SG 3.33Å; C15-G19 WeakPolarHBondContact O-CA 3.31Å; C15-G19 PolarHBondContact O-N 3.43Å; C15-S20 PolarHBondContact SG-O 3Å
16	Q	91.5	Very high	89.4	Confident	166 Å²	166	68.4 Å²	68.4	78%	0.776	36%	0.358	S	S	*	.	H	α-helix	trans	-68.7	-33.3	177.1	-173	173.1	19.2	0	0	112.6	R12 E13 F14	R12-Q16 VanDerWaalsContact O-CB 3.28Å; R12-Q16 WeakPolarHBondContact O-CB 3.46Å; R12-Q16 PolarHBondContact O-N 3.27Å; E13-Q16 PolarHBondContact O-N 3.35Å; F14-Q16 PolarHBondContact O-N 3.02Å
17	V	90.8	Very high	89.8	Confident	88 Å²	88	68.7 Å²	68.7	53%	0.533	36%	0.362	S	S	.	.	H	α-helix	trans	-86.9	-40.9	-178.3	174.6	0	0	0	0	112.2	E13 F14 V40	E13-V17 VanDerWaalsContact O-CG2 3.31Å; E13-V17 WeakPolarHBondContact O-CG2 3.31Å; E13-V17 PolarHBondContact O-N 2.97Å; F14-V17 PolarHBondContact O-N 3.49Å; V17-V40 HydrophobicContact CG1-CG1 3.85Å; V17-V40 HydrophobicContact CG1-CG2 4.33Å
18	T	89	Confident	90	Very high	19 Å²	19	66.6 Å²	66.6	12%	0.117	35%	0.346	C	S	.	.	H	α-helix	trans	-94.8	-19	-173.2	63.9	0	0	0	0	113.9	F14 S20 V40 Y43 M44	F14-T18 HydrophobicContact CD1-CG2 4.07Å; F14-T18 WeakPolarHBondContact CD1-OG1 3.44Å; F14-T18 HydrophobicContact CD2-CG2 4.25Å; F14-T18 HydrophobicContact CE1-CG2 3.85Å; F14-T18 WeakPolarHBondContact CE1-OG1 3.48Å; F14-T18 HydrophobicContact CE2-CG2 4.01Å; F14-T18 HydrophobicContact CG-CG2 4.29Å; F14-T18 HydrophobicContact CZ-CG2 3.82Å; F14-T18 PolarHBondContact O-N 3.42Å; F14-T18 PolarHBondContact O-OG1 3.4Å; T18-S20 PolarHBondContact O-N 3.03Å; T18-S20 WeakPolarHBondContact OG1-CB 3.44Å; T18-S20 PolarHBondContact OG1-N 2.95Å; T18-S20 PolarHBondContact OG1-OG 3.46Å; T18-V40 HydrophobicContact CG2-CG1 4.3Å; T18-V40 HydrophobicContact CG2-CG2 4.1Å; T18-Y43 HydrophobicContact CG2-CD1 3.58Å; T18-Y43 HydrophobicContact CG2-CE1 4.03Å; T18-Y43 HydrophobicContact CG2-CG 4.2Å; T18-M44 HydrophobicContact CG2-CE 4.21Å
19	G	89.4	Confident	90.2	Very high	70 Å²	70	61.9 Å²	61.9	72%	0.722	32%	0.318	S	S	*	.			trans	69	12.7	-171.4	0	0	0	0	0	114.1	C15	C15-G19 WeakPolarHBondContact O-CA 3.31Å; C15-G19 PolarHBondContact O-N 3.43Å
20	S	88.5	Confident	90.1	Very high	13 Å²	13	58.4 Å²	58.4	9%	0.091	31%	0.309	C	S	.	.			trans	-81	163.6	-179.7	74.7	0	0	0	0	112.6	F14 C15 T18	F14-S20 WeakPolarHBondContact CD1-OG 3.39Å; F14-S20 WeakPolarHBondContact CE1-OG 3.34Å; C15-S20 PolarHBondContact SG-O 3Å; T18-S20 PolarHBondContact O-N 3.03Å; T18-S20 WeakPolarHBondContact OG1-CB 3.44Å; T18-S20 PolarHBondContact OG1-N 2.95Å; T18-S20 PolarHBondContact OG1-OG 3.46Å
21	D	90.8	Very high	89.9	Confident	82 Å²	82	59.2 Å²	59.2	44%	0.439	32%	0.317	S	S	.	.			trans	-69.3	163.5	170	64.9	-63.7	0	0	0	112.5	E23 T24 A25	D21-E23 VanDerWaalsContact C-N 3.28Å; D21-E23 PolarHBondContact O-N 2.92Å; D21-E23 WeakPolarHBondContact OD2-CB 3.12Å; D21-E23 PolarHBondContact OD2-N 3.43Å; D21-T24 VanDerWaalsContact CG-OG1 3.29Å; D21-T24 WeakPolarHBondContact OD1-CB 3.43Å; D21-T24 PolarHBondContact OD1-OG1 3.45Å; D21-T24 PolarHBondContact OD2-N 3.17Å; D21-T24 PolarHBondContact OD2-OG1 3.1Å; D21-A25 PolarHBondContact O-N 3.11Å; D21-A25 VanDerWaalsContact O-N 3.13Å
22	E	90.3	Very high	89.6	Confident	97 Å²	97	59.4 Å²	59.4	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-66.8	-27.3	-177	-179.7	167.9	-161.2	0	0	112.9	I11 R26	I11-E22 HydrophobicContact CG2-CG 3.69Å; E22-R26 VanDerWaalsContact O-CG 3.31Å; E22-R26 WeakPolarHBondContact O-CG 3.29Å; E22-R26 PolarHBondContact O-N 3.44Å; E22-R26 VanDerWaalsContact O-N 3.1Å; E22-R26 IonicContact OE1-CZ 3.18Å; E22-R26 IonicContact OE1-NE 3.49Å; E22-R26 IonicContact OE1-NH2 2.9Å; E22-R26 PolarHBondContact OE1-NH2 3.05Å; E22-R26 IonicContact OE2-NH2 2.77Å
23	E	87.6	Confident	89.4	Confident	149 Å²	149	57.1 Å²	57.1	70%	0.696	32%	0.319	S	S	*	.	H	α-helix	trans	-75	-44.6	-179.6	-57.8	179.8	168.3	0	0	110.8	D21 A25 R26 S27	D21-E23 VanDerWaalsContact C-N 3.28Å; D21-E23 PolarHBondContact O-N 2.92Å; D21-E23 WeakPolarHBondContact OD2-CB 3.12Å; D21-E23 PolarHBondContact OD2-N 3.43Å; E23-A25 VanDerWaalsContact C-N 3.34Å; E23-A25 PolarHBondContact O-N 2.84Å; E23-R26 PolarHBondContact O-N 3.13Å; E23-S27 PolarHBondContact O-N 3.19Å; E23-S27 VanDerWaalsContact O-N 3.09Å
24	T	89	Confident	89.1	Confident	38 Å²	38	56.2 Å²	56.2	23%	0.233	32%	0.317	C	S	.	.	H	α-helix	trans	-58.6	-46	171.5	-58.2	0	0	0	0	111.2	D21 R26 S27 F28 Y43	D21-T24 VanDerWaalsContact CG-OG1 3.29Å; D21-T24 WeakPolarHBondContact OD1-CB 3.43Å; D21-T24 PolarHBondContact OD1-OG1 3.45Å; D21-T24 PolarHBondContact OD2-N 3.17Å; D21-T24 PolarHBondContact OD2-OG1 3.1Å; T24-R26 VanDerWaalsContact C-N 3.32Å; T24-R26 PolarHBondContact O-N 2.9Å; T24-S27 WeakPolarHBondContact O-CB 3.36Å; T24-S27 PolarHBondContact O-N 2.94Å; T24-S27 VanDerWaalsContact O-N 3.11Å; T24-F28 HydrophobicContact CG2-CD2 3.82Å; T24-F28 HydrophobicContact CG2-CE2 3.77Å; T24-F28 WeakPolarHBondContact O-CD2 3.45Å; T24-F28 PolarHBondContact O-N 2.88Å; T24-F28 VanDerWaalsContact O-N 3.15Å; T24-Y43 HydrophobicContact CG2-CD2 4.08Å; T24-Y43 HydrophobicContact CG2-CE2 3.84Å
25	A	91	Very high	88.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57.2	-42.9	177.1	0	0	0	0	0	112.8	I11 F14 D21 E23 S27 L29	I11-A25 HydrophobicContact CG2-CB 4.24Å; F14-A25 HydrophobicContact CB-CB 4.24Å; F14-A25 HydrophobicContact CD1-CB 3.35Å; F14-A25 HydrophobicContact CE1-CB 3.93Å; F14-A25 HydrophobicContact CG-CB 4.03Å; D21-A25 PolarHBondContact O-N 3.11Å; D21-A25 VanDerWaalsContact O-N 3.13Å; E23-A25 VanDerWaalsContact C-N 3.34Å; E23-A25 PolarHBondContact O-N 2.84Å; A25-S27 VanDerWaalsContact C-N 3.35Å; A25-S27 PolarHBondContact O-N 3.45Å; A25-L29 VanDerWaalsContact O-CB 3.26Å; A25-L29 WeakPolarHBondContact O-CB 3.47Å; A25-L29 WeakPolarHBondContact O-CD1 3.4Å; A25-L29 VanDerWaalsContact O-CG 3.25Å; A25-L29 WeakPolarHBondContact O-CG 3.49Å; A25-L29 PolarHBondContact O-N 3.15Å
26	R	90.2	Very high	88.8	Confident	110 Å²	110	60.5 Å²	60.5	42%	0.415	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-38.6	176.9	-76.2	174.3	-173.7	146.1	0.1	112.4	I11 E22 E23 T24 S30	I11-R26 HydrophobicContact CD1-CG 3.61Å; I11-R26 HydrophobicContact CG1-CG 4.2Å; E22-R26 VanDerWaalsContact O-CG 3.31Å; E22-R26 WeakPolarHBondContact O-CG 3.29Å; E22-R26 PolarHBondContact O-N 3.44Å; E22-R26 VanDerWaalsContact O-N 3.1Å; E22-R26 IonicContact OE1-CZ 3.18Å; E22-R26 IonicContact OE1-NE 3.49Å; E22-R26 IonicContact OE1-NH2 2.9Å; E22-R26 PolarHBondContact OE1-NH2 3.05Å; E22-R26 IonicContact OE2-NH2 2.77Å; E23-R26 PolarHBondContact O-N 3.13Å; T24-R26 VanDerWaalsContact C-N 3.32Å; T24-R26 PolarHBondContact O-N 2.9Å; R26-S30 WeakPolarHBondContact O-CB 3.45Å; R26-S30 PolarHBondContact O-N 2.89Å
27	S	88	Confident	88.8	Confident	37 Å²	37	60.1 Å²	60.1	26%	0.259	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-52	179.8	-170.7	0	0	0	0	111.8	E23 T24 A25 S30 A31 V50	E23-S27 PolarHBondContact O-N 3.19Å; E23-S27 VanDerWaalsContact O-N 3.09Å; T24-S27 WeakPolarHBondContact O-CB 3.36Å; T24-S27 PolarHBondContact O-N 2.94Å; T24-S27 VanDerWaalsContact O-N 3.11Å; A25-S27 VanDerWaalsContact C-N 3.35Å; A25-S27 PolarHBondContact O-N 3.45Å; S27-S30 PolarHBondContact O-N 3.21Å; S27-A31 PolarHBondContact O-N 3.29Å; S27-A31 VanDerWaalsContact O-N 3.13Å; S27-V50 VanDerWaalsContact OG-CG1 3.3Å; S27-V50 WeakPolarHBondContact OG-CG1 3.29Å
28	F	88.4	Confident	88.7	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-66.6	-42.8	179.8	-79.8	-96.8	0	0	0	112.3	F14 T24 S30 A31 C32 A39 L42 Y43 R49	F14-F28 HydrophobicContact CE2-CB 4.1Å; F14-F28 HydrophobicContact CZ-CB 3.93Å; F14-F28 HydrophobicContact CZ-CD2 4.47Å; F14-F28 HydrophobicContact CZ-CG 4.19Å; T24-F28 HydrophobicContact CG2-CD2 3.82Å; T24-F28 HydrophobicContact CG2-CE2 3.77Å; T24-F28 WeakPolarHBondContact O-CD2 3.45Å; T24-F28 PolarHBondContact O-N 2.88Å; T24-F28 VanDerWaalsContact O-N 3.15Å; F28-S30 VanDerWaalsContact C-N 3.33Å; F28-S30 PolarHBondContact O-N 3.11Å; F28-A31 PolarHBondContact O-N 2.92Å; F28-C32 WeakPolarHBondContact O-CB 3.28Å; F28-C32 PolarHBondContact O-N 3.06Å; F28-C32 PolarHBondContact O-SG 2.87Å; F28-C32 VanDerWaalsContact O-SG 3.4Å; F28-A39 HydrophobicContact CB-CB 4.08Å; F28-L42 HydrophobicContact CD1-CB 4.11Å; F28-L42 HydrophobicContact CD1-CD2 3.96Å; F28-L42 HydrophobicContact CD1-CG 4.13Å; F28-L42 HydrophobicContact CE1-CB 4.18Å; F28-L42 HydrophobicContact CE1-CD2 4.07Å; F28-L42 HydrophobicContact CE1-CG 3.91Å; F28-Y43 HydrophobicContact CD2-CD2 4.33Å; F28-Y43 HydrophobicContact CE1-CD2 4.5Å; F28-Y43 AromaticContact CE2-CD2 3.88Å; F28-Y43 HydrophobicContact CE2-CD2 3.88Å; F28-Y43 AromaticContact CZ-CD2 3.97Å; F28-Y43 HydrophobicContact CZ-CD2 3.97Å; F28-R49 WeakPolarHBondContact CZ-O 3.26Å
29	L	91	Very high	88.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-33.5	177.2	-72.4	168.1	0	0	0	112.7	V6 C10 I11 F14 A25 N33 N34 L36 A39	V6-L29 HydrophobicContact CG1-CB 3.7Å; V6-L29 HydrophobicContact CG1-CD1 3.99Å; C10-L29 HydrophobicContact CB-CD1 3.88Å; C10-L29 HydrophobicContact CB-CD2 4.06Å; I11-L29 HydrophobicContact CB-CD1 4.42Å; I11-L29 HydrophobicContact CG1-CD1 3.83Å; F14-L29 HydrophobicContact CB-CD1 4.23Å; A25-L29 VanDerWaalsContact O-CB 3.26Å; A25-L29 WeakPolarHBondContact O-CB 3.47Å; A25-L29 WeakPolarHBondContact O-CD1 3.4Å; A25-L29 VanDerWaalsContact O-CG 3.25Å; A25-L29 WeakPolarHBondContact O-CG 3.49Å; A25-L29 PolarHBondContact O-N 3.15Å; L29-N33 PolarHBondContact O-N 3.27Å; L29-N34 PolarHBondContact O-N 2.98Å; L29-L36 HydrophobicContact CD2-CD1 4.39Å; L29-A39 HydrophobicContact CD2-CB 3.9Å; L29-A39 HydrophobicContact CG-CB 4.33Å
30	S	86.7	Confident	88.8	Confident	50 Å²	50	57.2 Å²	57.2	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-65.1	-44.7	175.8	-176.7	0	0	0	0	111.2	R26 S27 F28 C32 N33	R26-S30 WeakPolarHBondContact O-CB 3.45Å; R26-S30 PolarHBondContact O-N 2.89Å; S27-S30 PolarHBondContact O-N 3.21Å; F28-S30 VanDerWaalsContact C-N 3.33Å; F28-S30 PolarHBondContact O-N 3.11Å; S30-C32 VanDerWaalsContact C-N 3.35Å; S30-C32 PolarHBondContact O-N 3.31Å; S30-N33 PolarHBondContact O-N 2.76Å
31	A	84.8	Confident	88.8	Confident	38 Å²	38	59.5 Å²	59.5	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-71.1	-28.2	178.2	0	0	0	0	0	114.1	S27 F28 N33 P51	S27-A31 PolarHBondContact O-N 3.29Å; S27-A31 VanDerWaalsContact O-N 3.13Å; F28-A31 PolarHBondContact O-N 2.92Å; A31-N33 VanDerWaalsContact C-N 3.34Å; A31-P51 HydrophobicContact CB-CB 3.33Å; A31-P51 HydrophobicContact CB-CG 3.17Å
32	C	86.5	Confident	88.8	Confident	11 Å²	11	57.3 Å²	57.3	7%	0.074	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	19	177.7	-62.9	0	0	0	0	113.1	F28 S30 N34 N35 L38 A39	F28-C32 WeakPolarHBondContact O-CB 3.28Å; F28-C32 PolarHBondContact O-N 3.06Å; F28-C32 PolarHBondContact O-SG 2.87Å; F28-C32 VanDerWaalsContact O-SG 3.4Å; S30-C32 VanDerWaalsContact C-N 3.35Å; S30-C32 PolarHBondContact O-N 3.31Å; C32-N34 VanDerWaalsContact C-N 3.3Å; C32-N34 PolarHBondContact O-N 3.41Å; C32-N35 HydrophobicContact CB-CB 4.38Å; C32-N35 WeakPolarHBondContact O-CB 3.37Å; C32-N35 PolarHBondContact O-N 3.06Å; C32-L38 HydrophobicContact CB-CB 4.23Å; C32-L38 HydrophobicContact CB-CD2 3.98Å; C32-L38 HydrophobicContact CB-CG 4.28Å; C32-A39 HydrophobicContact CB-CB 4.14Å
33	N	86.8	Confident	88.8	Confident	124 Å²	124	54.9 Å²	54.9	66%	0.663	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	42	179.2	-74	70.8	0	0	0	114.1	L29 S30 A31 N35	L29-N33 PolarHBondContact O-N 3.27Å; S30-N33 PolarHBondContact O-N 2.76Å; A31-N33 VanDerWaalsContact C-N 3.34Å; N33-N35 VanDerWaalsContact C-N 3.27Å; N33-N35 PolarHBondContact O-N 2.83Å
34	N	85.4	Confident	88.9	Confident	52 Å²	52	53.1 Å²	53.1	28%	0.278	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	16.4	-174.2	-63.2	-55.7	0	0	0	115.7	V6 S7 L29 C32 L36	V6-N34 VanDerWaalsContact CA-OD1 3.23Å; V6-N34 WeakPolarHBondContact CA-OD1 3.33Å; V6-N34 WeakPolarHBondContact CG1-OD1 3.46Å; S7-N34 PolarHBondContact N-OD1 3.24Å; L29-N34 PolarHBondContact O-N 2.98Å; C32-N34 VanDerWaalsContact C-N 3.3Å; C32-N34 PolarHBondContact O-N 3.41Å; N34-L36 PolarHBondContact O-N 2.89Å
35	N	89.5	Confident	88.8	Confident	81 Å²	81	57.4 Å²	57.4	43%	0.433	31%	0.305	S	S	.	.			trans	-80.5	106.7	172.2	-171	-22.8	0	0	0	110.5	C32 N33 E37 L38 A39	C32-N35 HydrophobicContact CB-CB 4.38Å; C32-N35 WeakPolarHBondContact O-CB 3.37Å; C32-N35 PolarHBondContact O-N 3.06Å; N33-N35 VanDerWaalsContact C-N 3.27Å; N33-N35 PolarHBondContact O-N 2.83Å; N35-E37 PolarHBondContact OD1-N 2.94Å; N35-L38 HydrophobicContact CB-CB 4.15Å; N35-L38 PolarHBondContact OD1-N 3.27Å; N35-A39 VanDerWaalsContact O-CB 3.32Å; N35-A39 WeakPolarHBondContact O-CB 3.41Å; N35-A39 PolarHBondContact O-N 2.93Å; N35-A39 VanDerWaalsContact O-N 3.11Å
36	L	90	Very high	88.5	Confident	41 Å²	41	60.4 Å²	60.4	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-45.5	-178.2	179.5	67.8	0	0	0	112.4	E13 F14 L29 N34 L38 A39 V40	E13-L36 HydrophobicContact CB-CD1 4.29Å; E13-L36 HydrophobicContact CB-CD2 3.77Å; E13-L36 WeakPolarHBondContact OE2-CD2 3.28Å; F14-L36 HydrophobicContact CB-CD1 3.7Å; F14-L36 HydrophobicContact CD2-CD1 4.16Å; F14-L36 HydrophobicContact CG-CD1 4.45Å; L29-L36 HydrophobicContact CD2-CD1 4.39Å; N34-L36 PolarHBondContact O-N 2.89Å; L36-L38 PolarHBondContact O-N 2.87Å; L36-A39 PolarHBondContact O-N 2.97Å; L36-V40 HydrophobicContact CD1-CG2 4.03Å; L36-V40 HydrophobicContact CG-CG2 4.33Å; L36-V40 WeakPolarHBondContact O-CB 3.34Å; L36-V40 VanDerWaalsContact O-CG2 3.28Å; L36-V40 WeakPolarHBondContact O-CG2 3.46Å; L36-V40 PolarHBondContact O-N 3.15Å
37	E	90.4	Very high	87.9	Confident	158 Å²	158	59.1 Å²	59.1	74%	0.738	33%	0.327	S	S	*	.	H	α-helix	trans	-62	-47.2	-175.8	-160.6	86.6	-162	0	0	110.9	N35 V40 S41	N35-E37 PolarHBondContact OD1-N 2.94Å; E37-V40 PolarHBondContact O-N 3.48Å; E37-S41 WeakPolarHBondContact O-CB 3.18Å; E37-S41 PolarHBondContact O-N 3.25Å
38	L	89.5	Confident	87.3	Confident	94 Å²	94	61.7 Å²	61.7	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-41	179.9	-172	69.3	0	0	0	111.3	C32 N35 L36 S41 L42	C32-L38 HydrophobicContact CB-CB 4.23Å; C32-L38 HydrophobicContact CB-CD2 3.98Å; C32-L38 HydrophobicContact CB-CG 4.28Å; N35-L38 HydrophobicContact CB-CB 4.15Å; N35-L38 PolarHBondContact OD1-N 3.27Å; L36-L38 PolarHBondContact O-N 2.87Å; L38-S41 PolarHBondContact O-N 3.46Å; L38-L42 VanDerWaalsContact O-CB 3.31Å; L38-L42 WeakPolarHBondContact O-CB 3.39Å; L38-L42 PolarHBondContact O-N 3.38Å
39	A	89.8	Confident	86.3	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-45.8	176.7	0	0	0	0	0	111.3	F14 F28 L29 C32 N35 L36 L42 Y43	F14-A39 HydrophobicContact CD2-CB 4Å; F14-A39 HydrophobicContact CE2-CB 3.73Å; F28-A39 HydrophobicContact CB-CB 4.08Å; L29-A39 HydrophobicContact CD2-CB 3.9Å; L29-A39 HydrophobicContact CG-CB 4.33Å; C32-A39 HydrophobicContact CB-CB 4.14Å; N35-A39 VanDerWaalsContact O-CB 3.32Å; N35-A39 WeakPolarHBondContact O-CB 3.41Å; N35-A39 PolarHBondContact O-N 2.93Å; N35-A39 VanDerWaalsContact O-N 3.11Å; L36-A39 PolarHBondContact O-N 2.97Å; A39-L42 PolarHBondContact O-N 3.01Å; A39-Y43 WeakPolarHBondContact O-CB 3.18Å; A39-Y43 PolarHBondContact O-N 2.99Å
40	V	90.9	Very high	85	Confident	23 Å²	23	73.8 Å²	73.8	14%	0.139	40%	0.403	C	S	.	.	H	α-helix	trans	-64.7	-44.5	178.7	171.3	0	0	0	0	110.3	F14 V17 T18 L36 E37 L42 Y43 M44	F14-V40 HydrophobicContact CD2-CG2 3.64Å; F14-V40 HydrophobicContact CE2-CG2 3.98Å; V17-V40 HydrophobicContact CG1-CG1 3.85Å; V17-V40 HydrophobicContact CG1-CG2 4.33Å; T18-V40 HydrophobicContact CG2-CG1 4.3Å; T18-V40 HydrophobicContact CG2-CG2 4.1Å; L36-V40 HydrophobicContact CD1-CG2 4.03Å; L36-V40 HydrophobicContact CG-CG2 4.33Å; L36-V40 WeakPolarHBondContact O-CB 3.34Å; L36-V40 VanDerWaalsContact O-CG2 3.28Å; L36-V40 WeakPolarHBondContact O-CG2 3.46Å; L36-V40 PolarHBondContact O-N 3.15Å; E37-V40 PolarHBondContact O-N 3.48Å; V40-L42 PolarHBondContact O-N 3.48Å; V40-Y43 PolarHBondContact O-N 3.49Å; V40-M44 HydrophobicContact CG1-CE 4.4Å; V40-M44 HydrophobicContact CG1-CG 4.27Å; V40-M44 WeakPolarHBondContact O-CB 3.29Å; V40-M44 WeakPolarHBondContact O-CG 3.49Å; V40-M44 PolarHBondContact O-N 3.26Å
41	S	89.2	Confident	83.5	Confident	60 Å²	60	72.7 Å²	72.7	42%	0.42	40%	0.395	S	S	.	.	H	α-helix	trans	-57.9	-48.2	175.5	-170.8	0	0	0	0	111.5	E37 L38 Y43 M44 D45	E37-S41 WeakPolarHBondContact O-CB 3.18Å; E37-S41 PolarHBondContact O-N 3.25Å; L38-S41 PolarHBondContact O-N 3.46Å; S41-Y43 VanDerWaalsContact C-N 3.31Å; S41-Y43 PolarHBondContact O-N 3.42Å; S41-M44 PolarHBondContact O-N 2.84Å; S41-D45 PolarHBondContact O-N 3.46Å
42	L	89.2	Confident	81.9	Confident	37 Å²	37	76 Å²	76	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-63.9	-37.1	-178.8	-169.4	68.2	0	0	0	112.2	F28 L38 A39 V40 D46 P51	F28-L42 HydrophobicContact CD1-CB 4.11Å; F28-L42 HydrophobicContact CD1-CD2 3.96Å; F28-L42 HydrophobicContact CD1-CG 4.13Å; F28-L42 HydrophobicContact CE1-CB 4.18Å; F28-L42 HydrophobicContact CE1-CD2 4.07Å; F28-L42 HydrophobicContact CE1-CG 3.91Å; L38-L42 VanDerWaalsContact O-CB 3.31Å; L38-L42 WeakPolarHBondContact O-CB 3.39Å; L38-L42 PolarHBondContact O-N 3.38Å; A39-L42 PolarHBondContact O-N 3.01Å; V40-L42 PolarHBondContact O-N 3.48Å; L42-D46 PolarHBondContact O-N 2.99Å; L42-D46 VanDerWaalsContact O-N 3.12Å; L42-P51 HydrophobicContact CD2-CB 4.47Å
43	Y	90.5	Very high	79.9	Confident	46 Å²	46	83.5 Å²	83.5	18%	0.18	45%	0.45	C	S	.	.	H	α-helix	trans	-69.3	-37.1	175.4	177.4	-92.3	0	0	0	112.6	F14 T18 T24 F28 A39 V40 S41 D46 P47	F14-Y43 HydrophobicContact CZ-CD2 4.17Å; F14-Y43 AromaticContact CZ-CG 3.95Å; F14-Y43 HydrophobicContact CZ-CG 3.95Å; T18-Y43 HydrophobicContact CG2-CD1 3.58Å; T18-Y43 HydrophobicContact CG2-CE1 4.03Å; T18-Y43 HydrophobicContact CG2-CG 4.2Å; T24-Y43 HydrophobicContact CG2-CD2 4.08Å; T24-Y43 HydrophobicContact CG2-CE2 3.84Å; F28-Y43 HydrophobicContact CD2-CD2 4.33Å; F28-Y43 HydrophobicContact CE1-CD2 4.5Å; F28-Y43 AromaticContact CE2-CD2 3.88Å; F28-Y43 HydrophobicContact CE2-CD2 3.88Å; F28-Y43 AromaticContact CZ-CD2 3.97Å; F28-Y43 HydrophobicContact CZ-CD2 3.97Å; A39-Y43 WeakPolarHBondContact O-CB 3.18Å; A39-Y43 PolarHBondContact O-N 2.99Å; V40-Y43 PolarHBondContact O-N 3.49Å; S41-Y43 VanDerWaalsContact C-N 3.31Å; S41-Y43 PolarHBondContact O-N 3.42Å; Y43-D46 CarbonylContact O-C 3.46Å; Y43-P47 HydrophobicContact CD2-CB 4.33Å; Y43-P47 HydrophobicContact CE2-CB 3.94Å; Y43-P47 WeakPolarHBondContact O-CA 3.47Å
44	M	89.3	Confident	77.5	Confident	111 Å²	111	82.2 Å²	82.2	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-71.9	-31.6	177.1	-68.3	-64.9	177.3	0	0	112.3	T18 V40 S41	T18-M44 HydrophobicContact CG2-CE 4.21Å; V40-M44 HydrophobicContact CG1-CE 4.4Å; V40-M44 HydrophobicContact CG1-CG 4.27Å; V40-M44 WeakPolarHBondContact O-CB 3.29Å; V40-M44 WeakPolarHBondContact O-CG 3.49Å; V40-M44 PolarHBondContact O-N 3.26Å; S41-M44 PolarHBondContact O-N 2.84Å
45	D	87.5	Confident	75.5	Confident	128 Å²	128	85.5 Å²	85.5	68%	0.684	47%	0.474	S	S	*	.	H	α-helix	trans	-71.7	-44.7	175.1	-71.6	-26.5	0	0	0	111.9	S41	S41-D45 PolarHBondContact O-N 3.46Å
46	D	83.9	Confident	73.1	Confident	63 Å²	63	87.1 Å²	87.1	34%	0.337	49%	0.487	S	S	.	.			trans	-151.1	101.7	176	-170.2	-11.8	0	0	0	112.2	L42 Y43 S48 R49	L42-D46 PolarHBondContact O-N 2.99Å; L42-D46 VanDerWaalsContact O-N 3.12Å; Y43-D46 CarbonylContact O-C 3.46Å; D46-S48 PolarHBondContact O-N 2.89Å; D46-S48 WeakPolarHBondContact OD1-CB 3.36Å; D46-S48 PolarHBondContact OD1-N 2.96Å; D46-S48 PolarHBondContact OD1-OG 3.37Å; D46-R49 HydrophobicContact CB-CB 3.98Å; D46-R49 PolarHBondContact O-N 3.36Å
47	P	79.4	Confident	71	Confident	83 Å²	83	93.8 Å²	93.8	54%	0.539	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-12.1	-178.6	27.7	-33.9	0	0	0	113.3	Y43	Y43-P47 HydrophobicContact CD2-CB 4.33Å; Y43-P47 HydrophobicContact CE2-CB 3.94Å; Y43-P47 WeakPolarHBondContact O-CA 3.47Å
48	S	74.5	Confident	68.9	Low	92 Å²	92	94.9 Å²	94.9	64%	0.643	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-11.6	179.8	74.3	0	0	0	0	113.5	D46 V50	D46-S48 PolarHBondContact O-N 2.89Å; D46-S48 WeakPolarHBondContact OD1-CB 3.36Å; D46-S48 PolarHBondContact OD1-N 2.96Å; D46-S48 PolarHBondContact OD1-OG 3.37Å; S48-V50 PolarHBondContact O-N 3.27Å; S48-V50 VanDerWaalsContact O-N 3.15Å
49	R	68	Low	66.9	Low	148 Å²	148	100.6 Å²	100.6	56%	0.558	54%	0.539	S	S	*	.			trans	-82.7	95.7	-173.8	-167.1	173.8	-172.6	-141.9	-0.5	110.7	F28 D46 P51	F28-R49 WeakPolarHBondContact CZ-O 3.26Å; D46-R49 HydrophobicContact CB-CB 3.98Å; D46-R49 PolarHBondContact O-N 3.36Å; R49-P51 WeakPolarHBondContact O-CD 3.25Å
50	V	62.5	Low	65.2	Low	109 Å²	109	110 Å²	110	66%	0.661	58%	0.575	S	S	*	*			trans	-71.3	111.2	166.3	-146.6	0	0	0	0	107.4	S27 S48 S52	S27-V50 VanDerWaalsContact OG-CG1 3.3Å; S27-V50 WeakPolarHBondContact OG-CG1 3.29Å; S48-V50 PolarHBondContact O-N 3.27Å; S48-V50 VanDerWaalsContact O-N 3.15Å; V50-S52 PolarHBondContact O-N 2.85Å
51	P	56.1	Low	63.9	Low	28 Å²	28	114.2 Å²	114.2	18%	0.182	60%	0.601	C	S	.	*			trans	-66.8	106.5	178.9	24.9	-30.7	0	0	0	108.9	A31 L42 R49 Q53	A31-P51 HydrophobicContact CB-CB 3.33Å; A31-P51 HydrophobicContact CB-CG 3.17Å; L42-P51 HydrophobicContact CD2-CB 4.47Å; R49-P51 WeakPolarHBondContact O-CD 3.25Å; P51-Q53 PolarHBondContact O-N 3.22Å
52	S	51.4	Low	62.4	Low	108 Å²	108	117.1 Å²	117.1	76%	0.755	62%	0.618	S	S	*	*			trans	-58.6	132.1	165.9	50.9	0	0	0	0	107.3	V50 S54	V50-S52 PolarHBondContact O-N 2.85Å; S52-S54 PolarHBondContact O-N 3.08Å
53	Q	44.7	Very low	61.2	Low	168 Å²	168	120.1 Å²	120.1	79%	0.785	63%	0.633	S	S	*	*			trans	-50.5	104.3	173.3	-67.3	178	-0.5	0	0	107.8	P51	P51-Q53 PolarHBondContact O-N 3.22Å
54	S	36.9	Very low	59.6	Low	96 Å²	96	122.5 Å²	122.5	67%	0.671	65%	0.654	S	S	*	*			trans	-57.9	132.4	158.6	44.2	0	0	0	0	105.1	S52 T56	S52-S54 PolarHBondContact O-N 3.08Å; S54-T56 PolarHBondContact O-N 3.38Å
55	P	43.3	Very low	58	Low	121 Å²	121	126.3 Å²	126.3	79%	0.786	67%	0.671	S	S	*	*			trans	-55.9	120.1	171.5	3.9	2	0	0	0	105.9	E57	P55-E57 PolarHBondContact O-N 3.39Å
56	T	39.1	Very low	56.6	Low	115 Å²	115	127.7 Å²	127.7	71%	0.706	67%	0.666	S	S	*	*			trans	-29.5	127.4	169.1	40.6	0	0	0	0	110.2	S54 E58	S54-T56 PolarHBondContact O-N 3.38Å; T56-E58 VanDerWaalsContact C-N 3.26Å; T56-E58 PolarHBondContact O-N 3.05Å
57	E	44.9	Very low	55.2	Low	182 Å²	182	132 Å²	132	85%	0.85	69%	0.689	S	S	*	*			trans	-45.9	95.3	166.3	-76.8	-174.8	149.7	0	0	108.8	P55 Y59	P55-E57 PolarHBondContact O-N 3.39Å; E57-Y59 VanDerWaalsContact C-N 3.35Å; E57-Y59 PolarHBondContact O-N 3.32Å
58	E	45.3	Very low	54.3	Low	181 Å²	181	131.5 Å²	131.5	85%	0.846	68%	0.68	S	S	*	*			trans	-75.1	100.3	170.7	-166.1	166.8	-154.9	0	0	104.5	T56 R60	T56-E58 VanDerWaalsContact C-N 3.26Å; T56-E58 PolarHBondContact O-N 3.05Å; E58-R60 VanDerWaalsContact C-N 3.33Å; E58-R60 PolarHBondContact O-N 2.76Å
59	Y	48.7	Very low	53.2	Low	213 Å²	213	134.2 Å²	134.2	84%	0.835	68%	0.682	S	S	*	*			trans	-47.3	102.5	169.2	-111.3	-97.7	0	0	0	107.6	E57 T61	E57-Y59 VanDerWaalsContact C-N 3.35Å; E57-Y59 PolarHBondContact O-N 3.32Å; Y59-T61 PolarHBondContact O-N 3.48Å
60	R	53.3	Low	52.6	Low	198 Å²	198	132.6 Å²	132.6	75%	0.747	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-60.8	123.5	173.9	-168.2	174.8	-175.8	165.8	0.7	106.1	E58	E58-R60 VanDerWaalsContact C-N 3.33Å; E58-R60 PolarHBondContact O-N 2.76Å
61	T	64	Low	52.2	Low	112 Å²	112	132.1 Å²	132.1	69%	0.687	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-49.7	144.1	168.9	48.8	0	0	0	0	109.1	Y59 I63	Y59-T61 PolarHBondContact O-N 3.48Å; T61-I63 PolarHBondContact O-N 2.82Å
62	P	57.8	Low	52	Low	120 Å²	120	136.1 Å²	136.1	78%	0.779	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-48	130.6	178.2	-22.1	29.2	0	0	0	110	P64	P62-P64 WeakPolarHBondContact O-CD 3.34Å
63	I	64.2	Low	52	Low	100 Å²	100	135.3 Å²	135.3	51%	0.513	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-59.2	123.6	177.1	-62	167.5	0	0	0	106.8	T61 Q65	T61-I63 PolarHBondContact O-N 2.82Å; I63-Q65 PolarHBondContact O-N 3.24Å
64	P	56.7	Low	52.3	Low	96 Å²	96	133.3 Å²	133.3	62%	0.623	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-56	128.1	173.1	-21.7	31.9	0	0	0	109.1	P62 R66	P62-P64 WeakPolarHBondContact O-CD 3.34Å; P64-R66 PolarHBondContact O-N 3.38Å
65	Q	55.8	Low	52.8	Low	192 Å²	192	134 Å²	134	90%	0.897	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55.3	116.2	172.1	-78.7	-179.3	-43.8	0	0	108.5	I63	I63-Q65 PolarHBondContact O-N 3.24Å
66	R	57.3	Low	53.1	Low	156 Å²	156	133.5 Å²	133.5	59%	0.589	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-94.1	130.4	168.9	-68.1	-171.7	173.4	102.8	-4.4	108.1	P64 E68	P64-R66 PolarHBondContact O-N 3.38Å; R66-E68 PolarHBondContact O-N 3.38Å; R66-E68 VanDerWaalsContact O-N 3.12Å
67	N	54.6	Low	53.3	Low	154 Å²	154	136.6 Å²	136.6	82%	0.824	70%	0.7	S	S	*	*			trans	-81.2	81.6	174.7	-71.7	-17.1	0	0	0	109.1
68	E	60.4	Low	52.9	Low	72 Å²	72	135.4 Å²	135.4	34%	0.336	70%	0.699	S	S	.	*			trans	-90.6	114.4	168.8	-69.8	-179.5	-145.7	0	0	108.8	R66 L70 Q279	R66-E68 PolarHBondContact O-N 3.38Å; R66-E68 VanDerWaalsContact O-N 3.12Å; E68-L70 PolarHBondContact O-N 3.2Å; E68-Q279 PolarHBondContact OE2-NE2 3.18Å
69	Q	51.8	Low	52.5	Low	150 Å²	150	132.6 Å²	132.6	70%	0.701	70%	0.697	S	S	*	*			trans	-83.1	107.1	175.4	-74.2	-176.2	-10.3	0	0	109.6	L71 M281	Q69-L71 PolarHBondContact O-N 3.36Å; Q69-M281 VanDerWaalsContact O-CE 3.23Å; Q69-M281 WeakPolarHBondContact O-CE 3.25Å
70	L	56.4	Low	51.9	Low	114 Å²	114	128.9 Å²	128.9	60%	0.597	70%	0.696	S	S	*	*			trans	-72.1	106.8	164	-70.3	170.9	0	0	0	108.3	E68 P72 N606	E68-L70 PolarHBondContact O-N 3.2Å; L70-P72 WeakPolarHBondContact O-CD 3.49Å; L70-N606 WeakPolarHBondContact CD1-ND2 3.25Å
71	L	52.5	Low	51.1	Low	99 Å²	99	127.8 Å²	127.8	52%	0.518	70%	0.699	S	S	.	*			trans	-68.3	124.1	172.8	-67.8	176.3	0	0	0	109.3	Q69 V73	Q69-L71 PolarHBondContact O-N 3.36Å; L71-V73 PolarHBondContact O-N 3.23Å
72	P	52	Low	49.9	Very low	112 Å²	112	131.1 Å²	131.1	73%	0.727	71%	0.712	S	S	*	*			trans	-67.4	121.7	174.5	-13.2	26.6	0	0	0	110	L70 V74	L70-P72 WeakPolarHBondContact O-CD 3.49Å; P72-V74 PolarHBondContact O-N 2.9Å; P72-V74 VanDerWaalsContact O-N 3.11Å
73	V	52.7	Low	48.8	Very low	91 Å²	91	133.4 Å²	133.4	55%	0.552	71%	0.712	S	S	*	*			trans	-72.7	101.9	166	177.2	0	0	0	0	107.7	L71 V75	L71-V73 PolarHBondContact O-N 3.23Å; V73-V75 HydrophobicContact CG1-CG2 4.11Å; V73-V75 PolarHBondContact O-N 2.82Å
74	V	50.8	Low	47.4	Very low	126 Å²	126	136.5 Å²	136.5	76%	0.764	73%	0.73	S	S	*	*			trans	-82.9	103.9	168.9	-178.8	0	0	0	0	107.8	P72 P76	P72-V74 PolarHBondContact O-N 2.9Å; P72-V74 VanDerWaalsContact O-N 3.11Å; V74-P76 WeakPolarHBondContact O-CD 3.43Å
75	V	47	Very low	46.6	Very low	110 Å²	110	136.7 Å²	136.7	67%	0.667	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-74.9	122.7	173.5	-176.1	0	0	0	0	109.1	V73 L77	V73-V75 HydrophobicContact CG1-CG2 4.11Å; V73-V75 PolarHBondContact O-N 2.82Å; V75-L77 PolarHBondContact O-N 2.81Å
76	P	50.2	Low	45.7	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-68.4	119	175	-17.1	30.8	0	0	0	111.3	V74 L78	V74-P76 WeakPolarHBondContact O-CD 3.43Å; P76-L78 PolarHBondContact O-N 3.11Å
77	L	42.9	Very low	44.6	Very low	179 Å²	179	133.8 Å²	133.8	94%	0.937	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-72.1	117.5	169.2	-75	156.5	0	0	0	109.6	V75	V75-L77 PolarHBondContact O-N 2.81Å
78	L	37.4	Very low	43.7	Very low	158 Å²	158	134.7 Å²	134.7	83%	0.827	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-86.4	149.3	171.7	-74.2	168.8	0	0	0	111.6	P76	P76-L78 PolarHBondContact O-N 3.11Å
79	P	36.8	Very low	42.6	Very low	121 Å²	121	139.8 Å²	139.8	79%	0.786	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-76.3	153.5	-169.1	-13.1	29.9	0	0	0	115.4	H81	P79-H81 PolarHBondContact O-N 2.82Å
80	V	35.1	Very low	42	Very low	136 Å²	136	139 Å²	139	82%	0.824	78%	0.778	S	S	*	*			trans	-76.7	97.1	-177.6	-175.9	0	0	0	0	111.7
81	H	36.6	Very low	41.4	Very low	174 Å²	174	145.2 Å²	145.2	81%	0.806	79%	0.794	S	S	*	*			trans	-159.2	86.4	157.2	-155.9	65.4	0	0	0	111.2	P79	P79-H81 PolarHBondContact O-N 2.82Å
82	L	40.2	Very low	40.8	Very low	183 Å²	183	151.8 Å²	151.8	96%	0.958	81%	0.812	S	S	*	*			trans	-162.7	68.6	157.5	-124.9	89.8	0	0	0	108.3
83	Q	34.4	Very low	40.5	Very low	167 Å²	167	158.1 Å²	158.1	78%	0.78	82%	0.821	S	S	*	*			trans	-98.9	125.8	165	-112.8	150.4	-14.7	0	0	106.7
84	N	34.3	Very low	40	Very low	166 Å²	166	158 Å²	158	89%	0.888	83%	0.829	S	S	*	*			trans	115.2	84.7	171.8	-57	-16.3	0	0	0	115.2
85	A	39.8	Very low	39.4	Very low	99 Å²	99	162.3 Å²	162.3	82%	0.818	84%	0.838	S	S	*	*			trans	-155.5	139.8	146.5	0	0	0	0	0	110.8
86	P	36.6	Very low	39.5	Very low	126 Å²	126	163.2 Å²	163.2	82%	0.818	84%	0.844	S	S	*	*			trans	-92.7	140.1	-164.4	35.4	-33.3	0	0	0	115.2
87	L	34.8	Very low	39.3	Very low	162 Å²	162	162 Å²	162	85%	0.848	84%	0.843	S	S	*	*			trans	20.9	107.6	142.6	-133	134	0	0	0	119.4
88	M	35.4	Very low	39.3	Very low	172 Å²	172	162.7 Å²	162.7	85%	0.847	84%	0.842	S	S	*	*			trans	-137	139	156.1	-90.9	-72.1	154.3	0	0	111
89	Q	38	Very low	39.9	Very low	180 Å²	180	161.9 Å²	161.9	84%	0.841	84%	0.838	S	S	*	*			trans	-58.1	129.9	-163.2	-74.2	151.6	-27	0	0	115.5	R91	Q89-R91 PolarHBondContact O-N 2.9Å
90	T	37.9	Very low	40.1	Very low	133 Å²	133	161.5 Å²	161.5	82%	0.816	84%	0.838	S	S	*	*			trans	-83.4	110	170.4	-48.1	0	0	0	0	110.7	R92	T90-R92 PolarHBondContact O-N 3.18Å
91	R	43.8	Very low	40.8	Very low	245 Å²	245	161.4 Å²	161.4	93%	0.925	83%	0.833	S	S	*	*			trans	-70.4	111.8	162.2	-106.8	-177.3	167.3	-159.7	-2.7	109.1	Q89	Q89-R91 PolarHBondContact O-N 2.9Å
92	R	41.1	Very low	41.4	Very low	237 Å²	237	161 Å²	161	89%	0.894	84%	0.837	S	S	*	*			trans	-64	127.3	166.4	-74.5	179	165.5	173.5	-4.7	109.4	T90	T90-R92 PolarHBondContact O-N 3.18Å
93	R	45.6	Very low	41.9	Very low	245 Å²	245	158.7 Å²	158.7	93%	0.925	83%	0.825	S	S	*	*			trans	-104.3	120	160.9	-99.9	-176.7	164.1	173.6	-3.6	108.5
94	A	41.9	Very low	42.5	Very low	88 Å²	88	156.1 Å²	156.1	73%	0.727	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-67	140.3	179	0	0	0	0	0	111.5
95	F	38.4	Very low	43.1	Very low	217 Å²	217	155.9 Å²	155.9	95%	0.952	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-63.3	125.7	160.6	-91.7	-102.4	0	0	0	108.4
96	V	49.1	Very low	43.7	Very low	128 Å²	128	157.8 Å²	157.8	78%	0.776	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-103.9	126.2	171.3	-162.6	0	0	0	0	106.6
97	A	44.7	Very low	44	Very low	86 Å²	86	159.4 Å²	159.4	71%	0.711	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-65.2	161.5	-179.2	0	0	0	0	0	112.2	D99	A97-D99 PolarHBondContact O-N 2.95Å
98	E	42.5	Very low	44.4	Very low	194 Å²	194	157 Å²	157	91%	0.907	82%	0.815	S	S	*	*			trans	-61.1	109.6	177.2	-61.3	169.1	166.2	0	0	110.8
99	D	50.1	Low	44.6	Very low	141 Å²	141	155.1 Å²	155.1	75%	0.754	81%	0.813	S	S	*	*			trans	-92.3	107.2	163	-75.5	-26.4	0	0	0	108.3	A97 D101	A97-D99 PolarHBondContact O-N 2.95Å; D99-D101 PolarHBondContact O-N 3.35Å
100	S	41.3	Very low	44.6	Very low	112 Å²	112	152.9 Å²	152.9	78%	0.783	81%	0.812	S	S	*	*			trans	-76.5	101.8	167.9	54.7	0	0	0	0	109.6
101	D	51.2	Low	44.8	Very low	134 Å²	134	152.3 Å²	152.3	72%	0.717	81%	0.813	S	S	*	*			trans	-113.2	95.1	170.6	-73.3	-30.5	0	0	0	110.2	D99 N103	D99-D101 PolarHBondContact O-N 3.35Å; D101-N103 PolarHBondContact O-N 3.22Å
102	D	47.5	Very low	44.5	Very low	165 Å²	165	144.2 Å²	144.2	88%	0.882	81%	0.806	S	S	*	*			trans	-63.6	114.7	158.6	-124.9	-14.3	0	0	0	107.7
103	N	50.4	Low	44.6	Very low	135 Å²	135	137.7 Å²	137.7	72%	0.722	80%	0.803	S	S	*	*			trans	-132	97.1	167.1	-85.6	-52.2	0	0	0	108.6	D101	D101-N103 PolarHBondContact O-N 3.22Å
104	S	49	Very low	44.2	Very low	114 Å²	114	135.2 Å²	135.2	80%	0.797	80%	0.799	S	S	*	*			trans	-76.7	109.4	161.2	55	0	0	0	0	108.7	D106	S104-D106 PolarHBondContact O-N 3.47Å
105	D	45.2	Very low	43.9	Very low	161 Å²	161	135.9 Å²	135.9	86%	0.861	80%	0.797	S	S	*	*			trans	-71.4	108.5	163.3	-67.7	-40.3	0	0	0	108.3
106	D	52.6	Low	44.2	Very low	138 Å²	138	134.2 Å²	134.2	74%	0.738	79%	0.792	S	S	*	*			trans	-129	102.9	162.9	-171.3	23.6	0	0	0	109.4	S104 T108	S104-D106 PolarHBondContact O-N 3.47Å; D106-T108 PolarHBondContact O-N 3.3Å
107	D	43.2	Very low	43.5	Very low	160 Å²	160	133.3 Å²	133.3	86%	0.856	79%	0.789	S	S	*	*			trans	-75.6	99	172.3	-78.7	-48.9	0	0	0	109.3
108	T	43.2	Very low	43.2	Very low	111 Å²	111	138.4 Å²	138.4	68%	0.681	80%	0.796	S	S	*	*			trans	-139.7	110.8	157.3	-37.3	0	0	0	0	112.8	D106 T110	D106-T108 PolarHBondContact O-N 3.3Å; T108-T110 PolarHBondContact O-N 3.46Å
109	V	39	Very low	43	Very low	133 Å²	133	135 Å²	135	81%	0.806	78%	0.779	S	S	*	*			trans	-54.6	124.4	165	-179.3	0	0	0	0	109.3
110	T	39.2	Very low	42.5	Very low	133 Å²	133	136 Å²	136	82%	0.816	78%	0.777	S	S	*	*			trans	179.4	133.1	133.7	28.9	0	0	0	0	112.4	T108	T108-T110 PolarHBondContact O-N 3.46Å
111	S	42	Very low	42.3	Very low	122 Å²	122	134.9 Å²	134.9	85%	0.853	77%	0.769	S	S	*	*			trans	-68.6	135.3	177.6	43.5	0	0	0	0	114
112	G	38.2	Very low	41.7	Very low	75 Å²	75	136.7 Å²	136.7	77%	0.773	77%	0.773	S	S	*	*			trans	106.6	109.8	133.6	0	0	0	0	0	118.8
113	A	41.3	Very low	41	Very low	100 Å²	100	133.8 Å²	133.8	83%	0.826	77%	0.766	S	S	*	*			trans	81.2	100.9	140.7	0	0	0	0	0	121.2
114	K	38.6	Very low	40.4	Very low	192 Å²	192	131.3 Å²	131.3	84%	0.835	76%	0.764	S	S	*	*				78.2	105.4	115	-149.9	168.3	-173.5	176.4	0	120.2
115	C	36.2	Very low	39.9	Very low	102 Å²	102	130.3 Å²	130.3	69%	0.689	76%	0.757	S	S	*	*			trans	79.9	114.7	132	-74.1	0	0	0	0	122.8
116	Q	43.3	Very low	39.7	Very low	183 Å²	183	131.9 Å²	131.9	86%	0.855	76%	0.756	S	S	*	*				109.9	137	128.4	-63.4	-115.1	-12.9	0	0	118.5
117	P	34.9	Very low	39.2	Very low	109 Å²	109	129.6 Å²	129.6	71%	0.708	75%	0.751	S	S	*	*			trans	-110.8	151.2	-162	37.9	-23.8	0	0	0	113.5
118	F	37.7	Very low	39.1	Very low	193 Å²	193	127.9 Å²	127.9	85%	0.846	74%	0.742	S	S	*	*			trans	-156.7	153.6	150.3	-141.7	-101.1	0	0	0	113.9
119	E	38.4	Very low	39.2	Very low	121 Å²	121	130.6 Å²	130.6	57%	0.565	75%	0.747	S	S	*	*			trans	-54.4	158.5	-163.6	-61.9	-172.2	147.7	0	0	121.4
120	K	39.6	Very low	39.2	Very low	163 Å²	163	129.2 Å²	129.2	71%	0.709	74%	0.743	S	S	*	*			trans	89.3	113.4	132.4	-92.5	176.4	-173	128.1	0	121.1
121	S	36.8	Very low	39.2	Very low	88 Å²	88	128.4 Å²	128.4	62%	0.615	74%	0.738	S	S	*	*				90	136.9	118.9	-56.8	0	0	0	0	121.1
122	Q	38.5	Very low	39.2	Very low	173 Å²	173	131.8 Å²	131.8	81%	0.808	74%	0.737	S	S	*	*			trans	78.7	104.1	149.2	-74.7	170.9	52.5	0	0	116
123	S	34.7	Very low	39.4	Very low	103 Å²	103	137.3 Å²	137.3	72%	0.72	74%	0.743	S	S	*	*				94	134.6	71.5	69.2	0	0	0	0	112.9
124	A	37.3	Very low	39.1	Very low	84 Å²	84	143.5 Å²	143.5	69%	0.694	75%	0.745	S	S	*	*			trans	95.3	105.5	147.9	0	0	0	0	0	119.1
125	S	37.1	Very low	39	Very low	93 Å²	93	139 Å²	139	65%	0.65	74%	0.737	S	S	*	*				91.1	137.1	109.7	66.8	0	0	0	0	121.3
126	K	41.8	Very low	39.1	Very low	193 Å²	193	138.7 Å²	138.7	84%	0.839	74%	0.736	S	S	*	*			trans	76.2	142.9	149.9	-71.1	162.4	-176.5	-180	0	115.2
127	S	41.9	Very low	38.8	Very low	90 Å²	90	137.2 Å²	137.2	63%	0.629	73%	0.734	S	S	*	*			cis	179.9	133.5	15.9	38.5	0	0	0	0	105.1
128	D	41.1	Very low	39.1	Very low	125 Å²	125	138.3 Å²	138.3	67%	0.668	74%	0.738	S	S	*	*				93.8	136.8	104.3	-84.7	-41.1	0	0	0	117.8
129	H	45.9	Very low	39.2	Very low	168 Å²	168	134.7 Å²	134.7	78%	0.778	74%	0.737	S	S	*	*			trans	72.4	146.8	151.3	-51.3	-29.2	0	0	0	118.4
130	S	39.3	Very low	39.2	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	75%	0.746	S	S	*	*			cis	-179	162.8	-12.6	174.9	0	0	0	0	106.6
131	T	39.6	Very low	39.5	Very low	117 Å²	117	130.6 Å²	130.6	72%	0.718	75%	0.751	S	S	*	*			trans	103.1	93.7	145.5	-44.7	0	0	0	0	119.7
132	K	41.5	Very low	39.7	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.835	76%	0.763	S	S	*	*				28.9	128.6	122.3	-61.5	-179.6	177.9	177.1	0	120.8
133	Q	41.5	Very low	40	Very low	192 Å²	192	131.8 Å²	131.8	90%	0.897	76%	0.763	S	S	*	*				166.3	107.8	122.3	-94.4	176.8	-15	0	0	108
134	R	34.8	Very low	40.2	Very low	229 Å²	229	132.7 Å²	132.7	86%	0.864	76%	0.764	S	S	*	*				70.3	125.7	75.3	-178.9	165.8	174.2	-176	-2.3	115.5
135	C	37.2	Very low	40	Very low	99 Å²	99	135.8 Å²	135.8	67%	0.669	77%	0.768	S	S	*	*			trans	81.6	143	163.9	-68.2	0	0	0	0	116.4
136	S	39.3	Very low	40.2	Very low	95 Å²	95	139.5 Å²	139.5	66%	0.664	78%	0.78	S	S	*	*			cis	179.3	139.4	-16.4	44.7	0	0	0	0	105.7
137	N	35.4	Very low	39.8	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	78%	0.777	S	S	*	*			trans	36.7	129.1	150.2	-52.2	-8.2	0	0	0	119.6
138	V	41.6	Very low	39.8	Very low	133 Å²	133	139.5 Å²	139.5	81%	0.806	79%	0.787	S	S	*	*				174.3	133.4	100.8	159.9	0	0	0	0	109.9
139	S	40.9	Very low	39.6	Very low	117 Å²	117	141.6 Å²	141.6	82%	0.818	80%	0.798	S	S	*	*			trans	-14.8	139.4	164.4	-47.3	0	0	0	0	119.7
140	G	37.6	Very low	39.3	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	79%	0.794	S	S	*	*			trans	-127	146	155.3	0	0	0	0	0	110.8
141	P	46.3	Very low	39.3	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	80%	0.8	S	S	*	*			trans	-112	143.9	155.4	32.3	-19.7	0	0	0	111.2
142	N	40.9	Very low	39.4	Very low	162 Å²	162	137.7 Å²	137.7	87%	0.866	80%	0.8	S	S	*	*			trans	-57.4	161.2	171.6	-79.1	-26.4	0	0	0	112.3
143	P	45.7	Very low	39.4	Very low	124 Å²	124	134.3 Å²	134.3	81%	0.805	80%	0.8	S	S	*	*				-143.8	164.6	113.4	32.4	-14.2	0	0	0	116.4
144	T	37.6	Very low	39.3	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	79%	0.79	S	S	*	*			trans	-56.9	152.9	-178.8	14	0	0	0	0	119
145	L	34.1	Very low	39.6	Very low	150 Å²	150	122.5 Å²	122.5	79%	0.785	79%	0.785	S	S	*	*			trans	62.9	128.3	140.4	-63.5	171.2	0	0	0	120.5
146	L	40.3	Very low	39.5	Very low	171 Å²	171	123 Å²	123	90%	0.895	79%	0.789	S	S	*	*			trans	-160.5	120	142.8	-99.5	152.4	0	0	0	110.2
147	N	32.9	Very low	39.6	Very low	144 Å²	144	123.9 Å²	123.9	77%	0.77	80%	0.795	S	S	*	*			trans	-74.6	149.1	165	-77.2	-9.5	0	0	0	110.3
148	T	42.9	Very low	39.5	Very low	138 Å²	138	126.5 Å²	126.5	85%	0.847	80%	0.8	S	S	*	*			trans	-150.3	128.7	150.4	51.4	0	0	0	0	111.5
149	D	36.4	Very low	39.5	Very low	169 Å²	169	125.3 Å²	125.3	90%	0.904	80%	0.797	S	S	*	*			trans	-66.6	165.3	179	-61.6	-60.1	0	0	0	115.2
150	G	40.3	Very low	39.3	Very low	67 Å²	67	125.5 Å²	125.5	69%	0.691	80%	0.799	S	S	*	*			trans	167.8	70.3	162.3	0	0	0	0	0	119.2
151	T	39.1	Very low	39.5	Very low	137 Å²	137	133.2 Å²	133.2	84%	0.84	81%	0.805	S	S	*	*			trans	58.2	128.6	135.2	-14.1	0	0	0	0	123.6
152	S	41.3	Very low	39.4	Very low	103 Å²	103	134.9 Å²	134.9	72%	0.72	80%	0.801	S	S	*	*			trans	108.6	107.6	134.1	69.8	0	0	0	0	121.1
153	S	41.4	Very low	40.1	Very low	120 Å²	120	133.3 Å²	133.3	84%	0.839	80%	0.798	S	S	*	*			trans	64.9	123.3	133.9	62.8	0	0	0	0	121.3
154	G	39.8	Very low	40.4	Very low	67 Å²	67	132 Å²	132	69%	0.691	78%	0.784	S	S	*	*			trans	137.4	103.4	136.6	0	0	0	0	0	116.5
155	S	41.2	Very low	41.1	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	78%	0.775	S	S	*	*			trans	65.9	96	141.2	38.7	0	0	0	0	119.9
156	S	34.4	Very low	42.1	Very low	108 Å²	108	127 Å²	127	76%	0.755	77%	0.77	S	S	*	*				29.6	106.2	124.3	60.8	0	0	0	0	118.5
157	S	40.8	Very low	42.9	Very low	114 Å²	114	125.9 Å²	125.9	80%	0.797	76%	0.758	S	S	*	*			trans	-158.8	122.8	137.6	-7.8	0	0	0	0	110.2	S159	S157-S159 PolarHBondContact O-N 2.82Å
158	F	34.3	Very low	44.3	Very low	207 Å²	207	124.3 Å²	124.3	91%	0.908	75%	0.75	S	S	*	*			trans	-53.3	129.5	175.1	-61.9	-94.4	0	0	0	111.2
159	S	40.6	Very low	45.4	Very low	108 Å²	108	121 Å²	121	76%	0.755	73%	0.732	S	S	*	*			trans	-148.3	105.4	163	-80.3	0	0	0	0	109.3	S157 R161	S157-S159 PolarHBondContact O-N 2.82Å; S159-R161 PolarHBondContact O-N 2.88Å; S159-R161 VanDerWaalsContact O-N 3.1Å
160	S	38.4	Very low	47.1	Very low	121 Å²	121	115.9 Å²	115.9	85%	0.846	71%	0.707	S	S	*	*			trans	-55.7	105.9	170.8	56.4	0	0	0	0	110
161	R	40.8	Very low	48.4	Very low	236 Å²	236	116.6 Å²	116.6	89%	0.891	70%	0.695	S	S	*	*			trans	-95.6	100.5	171.5	-92.8	-178.8	172	179.2	-2.1	110.6	S159	S159-R161 PolarHBondContact O-N 2.88Å; S159-R161 VanDerWaalsContact O-N 3.1Å
162	H	44.1	Very low	50	Low	158 Å²	158	116.8 Å²	116.8	73%	0.731	68%	0.684	S	S	*	*			trans	13.5	102.6	148.8	-75.4	-79.7	0	0	0	118.6	N164	H162-N164 PolarHBondContact O-N 2.97Å
163	T	54.8	Low	51.5	Low	129 Å²	129	121.1 Å²	121.1	79%	0.791	69%	0.685	S	S	*	*			trans	-85.1	48	162.2	51	0	0	0	0	111.6
164	N	53.1	Low	52.9	Low	97 Å²	97	121.4 Å²	121.4	52%	0.519	67%	0.671	S	S	.	*			trans	-102.2	-16.4	-178.6	-77.4	-9.8	0	0	0	114.8	H162 V166	H162-N164 PolarHBondContact O-N 2.97Å; N164-V166 PolarHBondContact O-N 3.05Å
165	G	51.2	Low	54.5	Low	54 Å²	54	127.7 Å²	127.7	56%	0.557	67%	0.674	S	S	*	*	H	α-helix	trans	-77	-17	-174	0	0	0	0	0	117.1
166	V	55.8	Low	56.1	Low	112 Å²	112	128.5 Å²	128.5	68%	0.679	66%	0.664	S	S	*	*	H	α-helix	trans	-81.3	-32.6	-177.1	-178.5	0	0	0	0	111.8	N164 V170	N164-V166 PolarHBondContact O-N 3.05Å; V166-V170 WeakPolarHBondContact O-CG2 3.47Å; V166-V170 PolarHBondContact O-N 3.13Å
167	K	57	Low	58.3	Low	148 Å²	148	128.5 Å²	128.5	64%	0.643	65%	0.651	S	S	*	*	H	α-helix	trans	-68.4	-38.1	-178.4	-73.3	-179.6	177.5	174.7	0	112.1	S169 V170 N171	K167-S169 PolarHBondContact O-N 3.27Å; K167-V170 PolarHBondContact O-N 2.98Å; K167-N171 WeakPolarHBondContact O-CB 3.32Å; K167-N171 VanDerWaalsContact O-CG 3.28Å; K167-N171 PolarHBondContact O-N 3.16Å; K167-N171 PolarHBondContact O-ND2 3.14Å
168	D	61.8	Low	60.2	Low	110 Å²	110	127.7 Å²	127.7	59%	0.588	64%	0.638	S	S	*	*	H	α-helix	trans	-67.4	-38.2	-179.6	-62.4	-28.3	0	0	0	112.3	N171 K172	D168-N171 PolarHBondContact O-N 2.77Å; D168-K172 VanDerWaalsContact O-CB 3.29Å; D168-K172 WeakPolarHBondContact O-CB 3.42Å; D168-K172 PolarHBondContact O-N 3.3Å
169	S	67.8	Low	62.4	Low	68 Å²	68	124.1 Å²	124.1	48%	0.476	62%	0.624	S	S	.	*	H	α-helix	trans	-64.7	-41.5	176.7	-67.7	0	0	0	0	112.3	K167 K172 R173	K167-S169 PolarHBondContact O-N 3.27Å; S169-K172 PolarHBondContact O-N 3.45Å; S169-R173 WeakPolarHBondContact O-CG 3.5Å; S169-R173 PolarHBondContact O-N 2.9Å
170	V	70.4	Confident	64.4	Low	62 Å²	62	124 Å²	124	38%	0.376	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-43.3	176.9	174.9	0	0	0	0	110.8	V166 K167 R173 K174	V166-V170 WeakPolarHBondContact O-CG2 3.47Å; V166-V170 PolarHBondContact O-N 3.13Å; K167-V170 PolarHBondContact O-N 2.98Å; V170-R173 PolarHBondContact O-N 3.28Å; V170-K174 HydrophobicContact CG1-CD 4.19Å; V170-K174 WeakPolarHBondContact O-CG 3.4Å; V170-K174 PolarHBondContact O-N 2.88Å
171	N	68.7	Low	66.5	Low	83 Å²	83	121.2 Å²	121.2	44%	0.444	59%	0.587	S	S	.	*	H	α-helix	trans	-64.9	-40.5	177.4	-70.6	-22.3	0	0	0	111.8	K167 D168 R173 K174 R175	K167-N171 WeakPolarHBondContact O-CB 3.32Å; K167-N171 VanDerWaalsContact O-CG 3.28Å; K167-N171 PolarHBondContact O-N 3.16Å; K167-N171 PolarHBondContact O-ND2 3.14Å; D168-N171 PolarHBondContact O-N 2.77Å; N171-R173 PolarHBondContact O-N 3.49Å; N171-K174 PolarHBondContact O-N 3.13Å; N171-R175 VanDerWaalsContact O-CG 3.31Å; N171-R175 WeakPolarHBondContact O-CG 3.38Å; N171-R175 PolarHBondContact O-N 3.46Å
172	K	71.4	Confident	68.6	Low	141 Å²	141	113.1 Å²	113.1	61%	0.613	56%	0.557	S	S	*	*	H	α-helix	trans	-63.1	-40.5	175.4	-166.2	170	-173.3	169.9	0	112	D168 S169 K176	D168-K172 VanDerWaalsContact O-CB 3.29Å; D168-K172 WeakPolarHBondContact O-CB 3.42Å; D168-K172 PolarHBondContact O-N 3.3Å; S169-K172 PolarHBondContact O-N 3.45Å; K172-K176 WeakPolarHBondContact O-CG 3.29Å; K172-K176 PolarHBondContact O-N 2.93Å
173	R	73.8	Confident	70.6	Confident	193 Å²	193	109.9 Å²	109.9	73%	0.728	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-44.3	174	-73.4	178.5	-177.1	-176.5	1.5	112.1	S169 V170 N171 K176 H177	S169-R173 WeakPolarHBondContact O-CG 3.5Å; S169-R173 PolarHBondContact O-N 2.9Å; V170-R173 PolarHBondContact O-N 3.28Å; N171-R173 PolarHBondContact O-N 3.49Å; R173-K176 PolarHBondContact O-N 2.99Å; R173-H177 WeakPolarHBondContact O-CB 3.27Å; R173-H177 PolarHBondContact O-N 2.84Å
174	K	71.6	Confident	72.1	Confident	127 Å²	127	105.8 Å²	105.8	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-61.8	-42.6	176.2	-72.9	176.1	179.9	177.1	0	112.2	V170 N171 H177 L178	V170-K174 HydrophobicContact CG1-CD 4.19Å; V170-K174 WeakPolarHBondContact O-CG 3.4Å; V170-K174 PolarHBondContact O-N 2.88Å; N171-K174 PolarHBondContact O-N 3.13Å; K174-H177 PolarHBondContact O-N 3.11Å; K174-L178 WeakPolarHBondContact O-CG 3.22Å; K174-L178 PolarHBondContact O-N 3.48Å
175	R	71.9	Confident	73.8	Confident	198 Å²	198	101.6 Å²	101.6	75%	0.747	50%	0.496	S	S	*	.	H	α-helix	trans	-62.5	-45.8	176.5	-71.9	176.3	85.2	142.5	3.6	111.9	N171 H177 L178 Q179	N171-R175 VanDerWaalsContact O-CG 3.31Å; N171-R175 WeakPolarHBondContact O-CG 3.38Å; N171-R175 PolarHBondContact O-N 3.46Å; R175-H177 PolarHBondContact O-N 2.9Å; R175-L178 PolarHBondContact O-N 3.43Å; R175-Q179 PolarHBondContact O-N 3.12Å
176	K	76.1	Confident	75.7	Confident	125 Å²	125	104 Å²	104	54%	0.543	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-43.6	175	-74.2	-173.8	175.8	-165.6	0	112.1	K172 R173 Q179 Q180	K172-K176 WeakPolarHBondContact O-CG 3.29Å; K172-K176 PolarHBondContact O-N 2.93Å; R173-K176 PolarHBondContact O-N 2.99Å; K176-Q179 PolarHBondContact O-N 2.96Å; K176-Q180 VanDerWaalsContact O-CG 3.29Å; K176-Q180 WeakPolarHBondContact O-CG 3.33Å; K176-Q180 PolarHBondContact O-N 3.4Å; K176-Q180 VanDerWaalsContact O-N 3.09Å
177	H	80.5	Confident	77.4	Confident	107 Å²	107	106 Å²	106	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-43	178.3	-177.8	64.4	0	0	0	112.4	R173 K174 R175 Q179 Q180 L181	R173-H177 WeakPolarHBondContact O-CB 3.27Å; R173-H177 PolarHBondContact O-N 2.84Å; K174-H177 PolarHBondContact O-N 3.11Å; R175-H177 PolarHBondContact O-N 2.9Å; H177-Q179 VanDerWaalsContact C-N 3.34Å; H177-Q179 PolarHBondContact O-N 3.04Å; H177-Q180 WeakPolarHBondContact O-CB 3.23Å; H177-Q180 PolarHBondContact O-N 3.31Å; H177-L181 PolarHBondContact O-N 2.9Å
178	L	79.5	Confident	79.2	Confident	98 Å²	98	99.8 Å²	99.8	51%	0.513	48%	0.475	S	S	.	.	H	α-helix	trans	-61.9	-42.2	176.2	-74.3	172.7	0	0	0	111.9	K174 R175 Q180 L181 Y182	K174-L178 WeakPolarHBondContact O-CG 3.22Å; K174-L178 PolarHBondContact O-N 3.48Å; R175-L178 PolarHBondContact O-N 3.43Å; L178-Q180 VanDerWaalsContact C-N 3.29Å; L178-Q180 PolarHBondContact O-N 2.8Å; L178-L181 HydrophobicContact CD2-CD1 4.3Å; L178-L181 PolarHBondContact O-N 2.84Å; L178-Y182 WeakPolarHBondContact O-CD2 3.31Å
179	Q	80.8	Confident	80.8	Confident	132 Å²	132	96.1 Å²	96.1	62%	0.617	46%	0.455	S	S	*	.	H	α-helix	trans	-61.2	-39.8	176.7	-166.7	174.5	25.4	0	0	111.5	R175 K176 H177 L181 Y182 Q183	R175-Q179 PolarHBondContact O-N 3.12Å; K176-Q179 PolarHBondContact O-N 2.96Å; H177-Q179 VanDerWaalsContact C-N 3.34Å; H177-Q179 PolarHBondContact O-N 3.04Å; Q179-L181 VanDerWaalsContact C-N 3.29Å; Q179-L181 PolarHBondContact O-N 2.85Å; Q179-Y182 PolarHBondContact O-N 2.87Å; Q179-Q183 WeakPolarHBondContact O-CG 3.41Å; Q179-Q183 PolarHBondContact O-N 3.44Å
180	Q	83.1	Confident	82.2	Confident	105 Å²	105	95.3 Å²	95.3	49%	0.491	44%	0.443	S	S	.	.	H	α-helix	trans	-62.6	-31.2	177.1	-71.9	168.5	-17.9	0	0	113.7	K176 H177 L178 Y182 K229	K176-Q180 VanDerWaalsContact O-CG 3.29Å; K176-Q180 WeakPolarHBondContact O-CG 3.33Å; K176-Q180 PolarHBondContact O-N 3.4Å; K176-Q180 VanDerWaalsContact O-N 3.09Å; H177-Q180 WeakPolarHBondContact O-CB 3.23Å; H177-Q180 PolarHBondContact O-N 3.31Å; L178-Q180 VanDerWaalsContact C-N 3.29Å; L178-Q180 PolarHBondContact O-N 2.8Å; Q180-Y182 PolarHBondContact O-N 3.23Å; Q180-K229 PolarHBondContact O-NZ 3.21Å; Q180-K229 VanDerWaalsContact O-NZ 3.11Å
181	L	82.9	Confident	83.2	Confident	62 Å²	62	99.2 Å²	99.2	33%	0.325	46%	0.462	S	S	.	.	H	α-helix	trans	-66.2	-38.7	-179.7	-68.6	174.3	0	0	0	112.3	H177 L178 Q179 R225 K229	H177-L181 PolarHBondContact O-N 2.9Å; L178-L181 HydrophobicContact CD2-CD1 4.3Å; L178-L181 PolarHBondContact O-N 2.84Å; Q179-L181 VanDerWaalsContact C-N 3.29Å; Q179-L181 PolarHBondContact O-N 2.85Å; L181-R225 HydrophobicContact CB-CG 4.4Å; L181-K229 PolarHBondContact O-NZ 3.1Å
182	Y	85.1	Confident	84.3	Confident	66 Å²	66	97.7 Å²	97.7	26%	0.259	47%	0.465	S	S	.	.	H	α-helix	trans	-93.6	-6.5	-176.9	-59	-71.2	0	0	0	113.8	L178 Q179 Q180 H221 N224 R225	L178-Y182 WeakPolarHBondContact O-CD2 3.31Å; Q179-Y182 PolarHBondContact O-N 2.87Å; Q180-Y182 PolarHBondContact O-N 3.23Å; Y182-H221 HydrophobicContact CD1-CB 3.68Å; Y182-H221 HydrophobicContact CE1-CB 4.37Å; Y182-H221 HydrophobicContact CG-CB 4.25Å; Y182-N224 WeakPolarHBondContact O-CB 3.39Å; Y182-N224 PolarHBondContact O-ND2 3.23Å; Y182-R225 HydrophobicContact CD1-CB 4.03Å; Y182-R225 HydrophobicContact CE1-CB 4.29Å; Y182-R225 HydrophobicContact CE1-CG 4.47Å; Y182-R225 PolarHBondContact OH-NH1 3.45Å
183	Q	84.8	Confident	85.3	Confident	90 Å²	90	94.4 Å²	94.4	42%	0.421	46%	0.458	S	S	.	.	S	Bend	trans	-57.7	141.4	174.8	-86.9	171	-0.2	0	0	111.5	Q179 K229	Q179-Q183 WeakPolarHBondContact O-CG 3.41Å; Q179-Q183 PolarHBondContact O-N 3.44Å; Q183-K229 WeakPolarHBondContact O-CE 3.34Å; Q183-K229 PolarHBondContact O-NZ 3.49Å
184	P	87.3	Confident	86.1	Confident	44 Å²	44	86.1 Å²	86.1	29%	0.286	43%	0.428	S	S	.	.			trans	-48	148.2	170.5	-30.8	37	0	0	0	113.4	V186 L189 Q245	P184-V186 PolarHBondContact O-N 2.83Å; P184-L189 HydrophobicContact CB-CD1 3.82Å; P184-Q245 VanDerWaalsContact CB-OE1 3.29Å
185	P	89.3	Confident	87.1	Confident	9 Å²	9	85.5 Å²	85.5	6%	0.058	43%	0.427	C	S	.	.			trans	-79.5	69.7	-178.2	38.2	-41.7	0	0	0	110.9	E187 I188 L189 W228 F243	P185-E187 PolarHBondContact O-N 3.2Å; P185-I188 HydrophobicContact CB-CD1 3.99Å; P185-I188 HydrophobicContact CB-CG1 3.79Å; P185-I188 HydrophobicContact CG-CD1 3.95Å; P185-I188 HydrophobicContact CG-CG1 3.9Å; P185-I188 VanDerWaalsContact O-CG1 3.27Å; P185-I188 WeakPolarHBondContact O-CG1 3.39Å; P185-I188 PolarHBondContact O-N 3.45Å; P185-L189 HydrophobicContact CG-CG 4.33Å; P185-L189 PolarHBondContact O-N 3.41Å; P185-W228 HydrophobicContact CB-CB 4.06Å; P185-W228 HydrophobicContact CG-CB 3.6Å; P185-W228 HydrophobicContact CG-CG 4.16Å; P185-F243 HydrophobicContact CG-CE1 4.01Å
186	V	90.2	Very high	88.3	Confident	104 Å²	104	77.7 Å²	77.7	63%	0.63	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-27.5	-173	-64.6	0	0	0	0	114.6	P184 I188	P184-V186 PolarHBondContact O-N 2.83Å; V186-I188 VanDerWaalsContact C-N 3.33Å; V186-I188 PolarHBondContact O-N 3.1Å
187	E	91.7	Very high	89.2	Confident	153 Å²	153	71.8 Å²	71.8	72%	0.715	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.7	-179.4	-61.3	174.6	-171.1	0	0	115	P185 Y234	P185-E187 PolarHBondContact O-N 3.2Å; E187-Y234 HydrophobicContact CB-CE2 4.32Å; E187-Y234 PolarHBondContact OE2-OH 2.86Å
188	I	94.5	Very high	90	Very high	18 Å²	18	68.8 Å²	68.8	9%	0.092	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-10.4	178.9	53.2	166	0	0	0	112.8	P185 V186 W228 Y234 I237 F243	P185-I188 HydrophobicContact CB-CD1 3.99Å; P185-I188 HydrophobicContact CB-CG1 3.79Å; P185-I188 HydrophobicContact CG-CD1 3.95Å; P185-I188 HydrophobicContact CG-CG1 3.9Å; P185-I188 VanDerWaalsContact O-CG1 3.27Å; P185-I188 WeakPolarHBondContact O-CG1 3.39Å; P185-I188 PolarHBondContact O-N 3.45Å; V186-I188 VanDerWaalsContact C-N 3.33Å; V186-I188 PolarHBondContact O-N 3.1Å; I188-W228 HydrophobicContact CD1-CB 4.32Å; I188-Y234 HydrophobicContact CB-CE2 4.45Å; I188-Y234 HydrophobicContact CD1-CD2 4.37Å; I188-Y234 HydrophobicContact CG2-CD1 4.3Å; I188-Y234 HydrophobicContact CG2-CD2 3.48Å; I188-Y234 VanDerWaalsContact CG2-CD2 3.48Å; I188-Y234 HydrophobicContact CG2-CE1 4.03Å; I188-Y234 HydrophobicContact CG2-CE2 3.21Å; I188-Y234 HydrophobicContact CG2-CG 4.03Å; I188-Y234 VanDerWaalsContact CG2-CZ 3.49Å; I188-I237 HydrophobicContact CD1-CD1 4.25Å; I188-I237 HydrophobicContact CD1-CG2 4.5Å; I188-F243 HydrophobicContact CD1-CD1 3.8Å; I188-F243 HydrophobicContact CD1-CE1 4.03Å; I188-F243 HydrophobicContact CG1-CD1 3.99Å; I188-F243 HydrophobicContact CG1-CE1 4.44Å
189	L	95.9	Very high	90.8	Very high	33 Å²	33	68.3 Å²	68.3	17%	0.173	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-71.4	141.5	176	-69.8	174.1	0	0	0	110	P184 P185 D191 F243 Q245	P184-L189 HydrophobicContact CB-CD1 3.82Å; P185-L189 HydrophobicContact CG-CG 4.33Å; P185-L189 PolarHBondContact O-N 3.41Å; L189-D191 PolarHBondContact O-N 2.9Å; L189-F243 HydrophobicContact CD2-CD1 3.53Å; L189-F243 HydrophobicContact CD2-CE1 3.48Å; L189-F243 VanDerWaalsContact CD2-CE1 3.48Å; L189-F243 HydrophobicContact CD2-CG 4.21Å; L189-F243 HydrophobicContact CD2-CZ 4.14Å; L189-F243 HydrophobicContact CG-CD1 4.35Å; L189-F243 HydrophobicContact CG-CE1 4.4Å; L189-Q245 HydrophobicContact CD1-CB 4.38Å; L189-Q245 HydrophobicContact CD2-CB 3.51Å
190	F	96.2	Very high	91.6	Very high	51 Å²	51	62.6 Å²	62.6	22%	0.224	34%	0.338	C	S	.	.			trans	-75.6	122.6	172	-179.9	-92.6	0	0	0	109.9	G192 A196 A197 A200 T242 F243 V244	F190-G192 PolarHBondContact O-N 3.45Å; F190-G192 VanDerWaalsContact O-N 3.14Å; F190-A196 HydrophobicContact CE1-CB 3.81Å; F190-A196 HydrophobicContact CZ-CB 4.09Å; F190-A196 WeakPolarHBondContact CZ-O 3.24Å; F190-A197 HydrophobicContact CB-CB 4.36Å; F190-A197 HydrophobicContact CD1-CB 3.47Å; F190-A197 VanDerWaalsContact CD1-CB 3.47Å; F190-A197 HydrophobicContact CE1-CB 3.82Å; F190-A197 VanDerWaalsContact CE1-N 3.29Å; F190-A197 HydrophobicContact CG-CB 3.88Å; F190-A200 HydrophobicContact CD2-CB 4.18Å; F190-A200 HydrophobicContact CE2-CB 3.38Å; F190-A200 HydrophobicContact CZ-CB 3.87Å; F190-T242 HydrophobicContact CB-CG2 3.87Å; F190-T242 HydrophobicContact CD2-CG2 3.76Å; F190-T242 HydrophobicContact CG-CG2 3.94Å; F190-F243 WeakPolarHBondContact CB-O 3.39Å; F190-F243 PolarHBondContact N-O 2.86Å; F190-V244 HydrophobicContact CB-CG2 4.19Å
191	D	92.4	Very high	92.2	Very high	145 Å²	145	57.6 Å²	57.6	78%	0.775	32%	0.315	S	S	*	.	S	Bend	trans	-78.9	94.1	175.7	-66.2	-32.9	0	0	0	110.5	L189	L189-D191 PolarHBondContact O-N 2.9Å
192	G	90.6	Very high	92.9	Very high	50 Å²	50	57.7 Å²	57.7	52%	0.515	31%	0.314	S	S	.	.	S	Bend	trans	162.9	-168.8	174.7	0	0	0	0	0	114	F190	F190-G192 PolarHBondContact O-N 3.45Å; F190-G192 VanDerWaalsContact O-N 3.14Å
193	T	92.2	Very high	93.4	Very high	73 Å²	73	62.6 Å²	62.6	45%	0.448	34%	0.339	S	S	.	.			trans	-76.6	160.7	174.6	61	0	0	0	0	111.1	H195 A196 A197	T193-H195 PolarHBondContact O-N 3.28Å; T193-A196 PolarHBondContact O-N 3.29Å; T193-A196 PolarHBondContact OG1-N 3.01Å; T193-A197 PolarHBondContact O-N 3.05Å
194	V	91.3	Very high	93.9	Very high	19 Å²	19	64.2 Å²	64.2	12%	0.115	35%	0.345	C	S	.	.	H	α-helix	trans	-55.5	-39.8	176.3	175.6	0	0	0	0	111.4	A197 E198 V244 I246 E252	V194-A197 WeakPolarHBondContact O-CB 3.45Å; V194-A197 PolarHBondContact O-N 2.95Å; V194-E198 WeakPolarHBondContact O-CG 3.38Å; V194-E198 PolarHBondContact O-N 3.2Å; V194-V244 HydrophobicContact CG2-CG1 4.23Å; V194-I246 HydrophobicContact CG2-CD1 3.44Å; V194-I246 VanDerWaalsContact CG2-CD1 3.44Å; V194-I246 HydrophobicContact CG2-CG1 3.75Å; V194-E252 HydrophobicContact CG2-CB 4.29Å; V194-E252 WeakPolarHBondContact CG2-OE2 3.45Å; V194-E252 PolarHBondContact N-OE1 2.81Å
195	H	92.6	Very high	94.2	Very high	113 Å²	113	66 Å²	66	52%	0.523	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-38.7	177.7	-174.4	55.1	0	0	0	113	T193 A197 E198 L199	T193-H195 PolarHBondContact O-N 3.28Å; H195-A197 VanDerWaalsContact C-N 3.28Å; H195-A197 PolarHBondContact O-N 3.24Å; H195-E198 IonicContact ND1-OE2 2.69Å; H195-E198 PolarHBondContact ND1-OE2 3.38Å; H195-E198 WeakPolarHBondContact O-CB 3.47Å; H195-E198 PolarHBondContact O-N 2.99Å; H195-L199 WeakPolarHBondContact O-CG 3.49Å; H195-L199 PolarHBondContact O-N 3.34Å; H195-L199 VanDerWaalsContact O-N 3.15Å
196	A	96.5	Very high	94.6	Very high	35 Å²	35	67 Å²	67	29%	0.289	36%	0.356	S	S	.	.	H	α-helix	trans	-65.6	-35.1	174	0	0	0	0	0	111.4	F190 T193 L199 A200	F190-A196 HydrophobicContact CE1-CB 3.81Å; F190-A196 HydrophobicContact CZ-CB 4.09Å; F190-A196 WeakPolarHBondContact CZ-O 3.24Å; T193-A196 PolarHBondContact O-N 3.29Å; T193-A196 PolarHBondContact OG1-N 3.01Å; A196-L199 PolarHBondContact O-N 3.21Å; A196-A200 WeakPolarHBondContact O-CB 3.41Å; A196-A200 PolarHBondContact O-N 3.26Å
197	A	96.8	Very high	94.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.1	-39.2	174.9	0	0	0	0	0	112.6	F190 T193 V194 H195 A200 A201 L208 T242 V244	F190-A197 HydrophobicContact CB-CB 4.36Å; F190-A197 HydrophobicContact CD1-CB 3.47Å; F190-A197 VanDerWaalsContact CD1-CB 3.47Å; F190-A197 HydrophobicContact CE1-CB 3.82Å; F190-A197 VanDerWaalsContact CE1-N 3.29Å; F190-A197 HydrophobicContact CG-CB 3.88Å; T193-A197 PolarHBondContact O-N 3.05Å; V194-A197 WeakPolarHBondContact O-CB 3.45Å; V194-A197 PolarHBondContact O-N 2.95Å; H195-A197 VanDerWaalsContact C-N 3.28Å; H195-A197 PolarHBondContact O-N 3.24Å; A197-A200 PolarHBondContact O-N 3.41Å; A197-A201 VanDerWaalsContact O-CB 3.29Å; A197-A201 WeakPolarHBondContact O-CB 3.41Å; A197-A201 PolarHBondContact O-N 3.09Å; A197-L208 HydrophobicContact CB-CD1 4Å; A197-T242 HydrophobicContact CB-CG2 4.1Å; A197-V244 HydrophobicContact CB-CG2 3.22Å
198	E	95.9	Very high	95.2	Very high	45 Å²	45	55.4 Å²	55.4	21%	0.21	29%	0.294	C	S	.	.	H	α-helix	trans	-56.9	-50.6	172.2	-72.4	168.7	171.9	0	0	110.7	V194 H195 A200 A201 Q202 L208	V194-E198 WeakPolarHBondContact O-CG 3.38Å; V194-E198 PolarHBondContact O-N 3.2Å; H195-E198 IonicContact ND1-OE2 2.69Å; H195-E198 PolarHBondContact ND1-OE2 3.38Å; H195-E198 WeakPolarHBondContact O-CB 3.47Å; H195-E198 PolarHBondContact O-N 2.99Å; E198-A200 PolarHBondContact O-N 3.23Å; E198-A201 WeakPolarHBondContact O-CB 3.36Å; E198-A201 PolarHBondContact O-N 3.46Å; E198-Q202 WeakPolarHBondContact O-CG 3.46Å; E198-Q202 PolarHBondContact O-N 3.06Å; E198-L208 HydrophobicContact CG-CD2 3.65Å
199	L	96.6	Very high	95.3	Very high	87 Å²	87	54.6 Å²	54.6	46%	0.455	29%	0.29	S	S	.	.	H	α-helix	trans	-62.4	-42.1	178.7	-66.1	175.5	0	0	0	112.2	H195 A196 A201 Q202 E203	H195-L199 WeakPolarHBondContact O-CG 3.49Å; H195-L199 PolarHBondContact O-N 3.34Å; H195-L199 VanDerWaalsContact O-N 3.15Å; A196-L199 PolarHBondContact O-N 3.21Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.37Å; L199-Q202 WeakPolarHBondContact O-CB 3.37Å; L199-Q202 PolarHBondContact O-N 3.38Å; L199-E203 PolarHBondContact O-N 3.35Å
200	A	97	Very high	95.3	Very high	12 Å²	12	53 Å²	53	10%	0.099	28%	0.282	C	S	.	.	H	α-helix	trans	-65.5	-36.7	177	0	0	0	0	0	112.4	F190 A196 A197 E198 E203 K204	F190-A200 HydrophobicContact CD2-CB 4.18Å; F190-A200 HydrophobicContact CE2-CB 3.38Å; F190-A200 HydrophobicContact CZ-CB 3.87Å; A196-A200 WeakPolarHBondContact O-CB 3.41Å; A196-A200 PolarHBondContact O-N 3.26Å; A197-A200 PolarHBondContact O-N 3.41Å; E198-A200 PolarHBondContact O-N 3.23Å; A200-E203 PolarHBondContact O-N 2.94Å; A200-K204 WeakPolarHBondContact O-CB 3.5Å; A200-K204 VanDerWaalsContact O-CG 3.31Å; A200-K204 WeakPolarHBondContact O-CG 3.42Å; A200-K204 PolarHBondContact O-N 3.39Å
201	A	97.2	Very high	95.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-40.3	173.7	0	0	0	0	0	111.8	A197 E198 L199 N205 Q206 L208 T242 P274	A197-A201 VanDerWaalsContact O-CB 3.29Å; A197-A201 WeakPolarHBondContact O-CB 3.41Å; A197-A201 PolarHBondContact O-N 3.09Å; E198-A201 WeakPolarHBondContact O-CB 3.36Å; E198-A201 PolarHBondContact O-N 3.46Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.37Å; A201-N205 WeakPolarHBondContact O-CA 3.32Å; A201-N205 PolarHBondContact O-N 3.07Å; A201-Q206 PolarHBondContact O-N 2.97Å; A201-L208 HydrophobicContact CB-CB 4.35Å; A201-T242 WeakPolarHBondContact CA-OG1 3.41Å; A201-P274 HydrophobicContact CB-CB 3.6Å; A201-P274 HydrophobicContact CB-CG 4.11Å
202	Q	96.2	Very high	95.2	Very high	65 Å²	65	43.8 Å²	43.8	30%	0.304	24%	0.235	S	C	.	.	H	α-helix	trans	-61.2	-47.1	172.5	-67.6	174.3	10.9	0	0	111.5	E198 L199 N205 P274 F275	E198-Q202 WeakPolarHBondContact O-CG 3.46Å; E198-Q202 PolarHBondContact O-N 3.06Å; L199-Q202 WeakPolarHBondContact O-CB 3.37Å; L199-Q202 PolarHBondContact O-N 3.38Å; Q202-N205 PolarHBondContact O-N 2.94Å; Q202-P274 HydrophobicContact CG-CB 3.88Å; Q202-P274 HydrophobicContact CG-CG 4.47Å; Q202-P274 WeakPolarHBondContact CG-O 3.44Å; Q202-P274 PolarHBondContact NE2-O 3.48Å; Q202-F275 HydrophobicContact CB-CD1 4.27Å; Q202-F275 HydrophobicContact CB-CE1 3.79Å; Q202-F275 HydrophobicContact CB-CZ 4.26Å; Q202-F275 HydrophobicContact CG-CD1 3.85Å; Q202-F275 HydrophobicContact CG-CE1 3.9Å; Q202-F275 HydrophobicContact CG-CG 4.45Å
203	E	95.6	Very high	95.2	Very high	169 Å²	169	42.2 Å²	42.2	79%	0.79	21%	0.214	S	C	*	.	H	α-helix	trans	-63	-44.2	-179	-175.5	-178	-175.6	0	0	112.1	L199 A200 N205	L199-E203 PolarHBondContact O-N 3.35Å; A200-E203 PolarHBondContact O-N 2.94Å; E203-N205 VanDerWaalsContact C-N 3.26Å; E203-N205 PolarHBondContact O-N 3.31Å
204	K	95.1	Very high	95.2	Very high	124 Å²	124	41.1 Å²	41.1	54%	0.539	21%	0.205	S	C	.	.	H	α-helix	trans	-80.6	-5.9	179.8	-64.9	174.9	-174.4	174.4	0	113.5	A200 Q206	A200-K204 WeakPolarHBondContact O-CB 3.5Å; A200-K204 VanDerWaalsContact O-CG 3.31Å; A200-K204 WeakPolarHBondContact O-CG 3.42Å; A200-K204 PolarHBondContact O-N 3.39Å; K204-Q206 VanDerWaalsContact C-N 3.26Å; K204-Q206 HydrophobicContact CB-CB 4.27Å; K204-Q206 HydrophobicContact CB-CG 3.88Å; K204-Q206 VanDerWaalsContact CD-OE1 3.31Å; K204-Q206 PolarHBondContact O-N 3.34Å
205	N	95.1	Very high	94.9	Very high	80 Å²	80	47.9 Å²	47.9	43%	0.428	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	48	-170.6	-162.5	54.1	0	0	0	111.9	A201 Q202 E203	A201-N205 WeakPolarHBondContact O-CA 3.32Å; A201-N205 PolarHBondContact O-N 3.07Å; Q202-N205 PolarHBondContact O-N 2.94Å; E203-N205 VanDerWaalsContact C-N 3.26Å; E203-N205 PolarHBondContact O-N 3.31Å
206	Q	96.4	Very high	94.7	Very high	30 Å²	30	45.8 Å²	45.8	14%	0.14	25%	0.245	C	C	.	.			trans	-114.6	154.1	-179.7	-75.9	-177.9	-34.9	0	0	110.4	A201 K204 R239 H240 P274 L305	A201-Q206 PolarHBondContact O-N 2.97Å; K204-Q206 VanDerWaalsContact C-N 3.26Å; K204-Q206 HydrophobicContact CB-CB 4.27Å; K204-Q206 HydrophobicContact CB-CG 3.88Å; K204-Q206 VanDerWaalsContact CD-OE1 3.31Å; K204-Q206 PolarHBondContact O-N 3.34Å; Q206-R239 PolarHBondContact NE2-O 3.35Å; Q206-H240 WeakPolarHBondContact CA-O 3.37Å; Q206-H240 WeakPolarHBondContact CB-O 3.49Å; Q206-P274 WeakPolarHBondContact O-CG 3.45Å; Q206-L305 WeakPolarHBondContact O-CD2 3.27Å
207	W	97.5	Very high	94.3	Very high	14 Å²	14	45.3 Å²	45.3	5%	0.053	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	153.3	172.1	-67.9	106.8	0	0	0	111.1	H240 C241 T242 I271 D273 K280 F299 T303 L305	W207-H240 PolarHBondContact N-O 3.05Å; W207-C241 CarbonylContact O-C 3.48Å; W207-C241 WeakPolarHBondContact O-CA 3.29Å; W207-T242 PolarHBondContact O-N 3.36Å; W207-I271 HydrophobicContact CB-CG2 3.91Å; W207-I271 HydrophobicContact CD2-CG2 4.2Å; W207-I271 HydrophobicContact CE3-CG2 4.02Å; W207-I271 HydrophobicContact CG-CG2 4.18Å; W207-D273 HydrophobicContact CZ3-CB 3.93Å; W207-K280 HydrophobicContact CH2-CG 4.26Å; W207-K280 HydrophobicContact CZ3-CG 3.77Å; W207-F299 AromaticContact CD1-CE1 3.96Å; W207-F299 AromaticContact CD2-CE1 3.65Å; W207-F299 HydrophobicContact CD2-CE1 3.65Å; W207-F299 AromaticContact CD2-CZ 3.98Å; W207-F299 HydrophobicContact CD2-CZ 3.98Å; W207-F299 AromaticContact CE2-CE1 3.57Å; W207-F299 AromaticContact CE2-CZ 3.85Å; W207-F299 HydrophobicContact CE3-CE1 4.16Å; W207-F299 HydrophobicContact CE3-CZ 4.06Å; W207-F299 AromaticContact CG-CE1 3.92Å; W207-F299 HydrophobicContact CG-CE1 3.92Å; W207-F299 AromaticContact CH2-CZ 3.98Å; W207-F299 HydrophobicContact CH2-CZ 3.98Å; W207-F299 HydrophobicContact CZ2-CE1 4.04Å; W207-F299 AromaticContact CZ2-CZ 3.86Å; W207-F299 HydrophobicContact CZ2-CZ 3.86Å; W207-F299 HydrophobicContact CZ3-CZ 4.07Å; W207-F299 AromaticContact NE1-CE1 3.73Å; W207-T303 HydrophobicContact CH2-CG2 3.73Å; W207-T303 HydrophobicContact CZ2-CG2 3.59Å; W207-L305 HydrophobicContact CD2-CD1 4.33Å; W207-L305 HydrophobicContact CE3-CD1 3.91Å; W207-L305 HydrophobicContact CH2-CB 4.29Å; W207-L305 HydrophobicContact CH2-CD1 3.8Å; W207-L305 HydrophobicContact CZ2-CB 3.91Å; W207-L305 HydrophobicContact CZ2-CD1 4.23Å; W207-L305 HydrophobicContact CZ3-CD1 3.63Å
208	L	97.4	Very high	94	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	108.3	171.6	-179.9	65.3	0	0	0	109.1	A197 E198 A201 V210 T242 V244 I271 L272	A197-L208 HydrophobicContact CB-CD1 4Å; E198-L208 HydrophobicContact CG-CD2 3.65Å; A201-L208 HydrophobicContact CB-CB 4.35Å; L208-V210 HydrophobicContact CD2-CG2 4.26Å; L208-V210 HydrophobicContact CG-CG2 3.94Å; L208-T242 HydrophobicContact CD1-CG2 4.31Å; L208-V244 HydrophobicContact CD1-CG2 3.9Å; L208-I271 WeakPolarHBondContact O-CA 3.28Å; L208-L272 HydrophobicContact CB-CB 4.21Å; L208-L272 HydrophobicContact CD2-CB 4.36Å; L208-L272 HydrophobicContact CD2-CD1 4.2Å; L208-L272 PolarHBondContact N-O 3.34Å; L208-L272 PolarHBondContact O-N 2.96Å
209	L	97.5	Very high	93.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.5	174.4	-178.7	68.2	0	0	0	108.7	W228 I237 C241 T242 F243 V244 I269 I271 L296	L209-W228 HydrophobicContact CD2-CZ3 4.36Å; L209-I237 HydrophobicContact CD2-CD1 3.62Å; L209-I237 HydrophobicContact CD2-CG1 3.76Å; L209-I237 HydrophobicContact CD2-CG2 4.45Å; L209-C241 HydrophobicContact CB-CB 3.97Å; L209-T242 PolarHBondContact N-O 2.94Å; L209-F243 HydrophobicContact CB-CD2 3.96Å; L209-F243 HydrophobicContact CD2-CD2 3.6Å; L209-F243 HydrophobicContact CD2-CE2 3.97Å; L209-F243 HydrophobicContact CD2-CG 4.23Å; L209-F243 HydrophobicContact CG-CD2 3.64Å; L209-F243 HydrophobicContact CG-CE2 4.03Å; L209-F243 WeakPolarHBondContact O-CA 3.25Å; L209-F243 WeakPolarHBondContact O-CD2 3.3Å; L209-V244 PolarHBondContact O-N 3.5Å; L209-I269 HydrophobicContact CD1-CG2 3.88Å; L209-I271 HydrophobicContact CD1-CG1 3.8Å; L209-L296 HydrophobicContact CD1-CD2 4.2Å
210	V	95.5	Very high	93.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.1	-179	-175.5	0	0	0	0	109.8	L208 V244 I246 F256 I269 A270 L272	L208-V210 HydrophobicContact CD2-CG2 4.26Å; L208-V210 HydrophobicContact CG-CG2 3.94Å; V210-V244 CarbonylContact C-O 3.46Å; V210-V244 WeakPolarHBondContact CA-O 3.39Å; V210-I246 HydrophobicContact CG1-CD1 3.49Å; V210-I246 VanDerWaalsContact CG1-CD1 3.49Å; V210-I246 HydrophobicContact CG1-CG1 4.08Å; V210-F256 HydrophobicContact CB-CE2 4.01Å; V210-F256 HydrophobicContact CB-CZ 3.94Å; V210-F256 HydrophobicContact CG1-CD2 4.18Å; V210-F256 HydrophobicContact CG1-CE1 4.24Å; V210-F256 HydrophobicContact CG1-CE2 3.63Å; V210-F256 HydrophobicContact CG1-CZ 3.67Å; V210-F256 HydrophobicContact CG2-CE2 3.95Å; V210-F256 HydrophobicContact CG2-CZ 4.32Å; V210-I269 CarbonylContact O-C 3.54Å; V210-I269 WeakPolarHBondContact O-CA 3.31Å; V210-A270 PolarHBondContact N-O 2.92Å; V210-A270 PolarHBondContact O-N 3.18Å; V210-L272 HydrophobicContact CG2-CD1 4.24Å; V210-L272 HydrophobicContact CG2-CG 4.37Å
211	S	94.8	Very high	93.2	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.007	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.1	167.5	-179.4	0	0	0	0	109	V244 Q245 I246 H268	S211-V244 PolarHBondContact N-O 3.4Å; S211-Q245 CarbonylContact O-C 3.53Å; S211-Q245 VanDerWaalsContact O-CA 3.22Å; S211-Q245 WeakPolarHBondContact O-CA 3.44Å; S211-I246 PolarHBondContact O-N 3.05Å; S211-H268 CarbonylContact C-O 3.57Å; S211-H268 WeakPolarHBondContact CA-O 3.48Å
212	I	92.3	Very high	93	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	145.2	161.5	-55.9	-67.4	0	0	0	107.7	I246 V248 F256 R257 A266 H268	I212-I246 CarbonylContact C-O 3.52Å; I212-I246 WeakPolarHBondContact CA-O 3.24Å; I212-I246 HydrophobicContact CD1-CB 4.11Å; I212-I246 HydrophobicContact CD1-CD1 4.5Å; I212-V248 HydrophobicContact CG2-CB 3.85Å; I212-V248 HydrophobicContact CG2-CG2 4.05Å; I212-F256 HydrophobicContact CD1-CB 4.4Å; I212-F256 HydrophobicContact CD1-CD1 3.62Å; I212-F256 HydrophobicContact CD1-CE1 4.2Å; I212-F256 HydrophobicContact CD1-CG 4.15Å; I212-F256 HydrophobicContact CG1-CD1 4.2Å; I212-F256 HydrophobicContact CG1-CE1 4.38Å; I212-R257 HydrophobicContact CD1-CG 4.5Å; I212-A266 CarbonylContact C-O 3.55Å; I212-A266 VanDerWaalsContact C-O 3.23Å; I212-H268 HydrophobicContact CB-CB 4Å; I212-H268 HydrophobicContact CG1-CB 3.91Å; I212-H268 PolarHBondContact N-O 3.43Å
213	H	90.7	Very high	92.9	Very high	17 Å²	17	48 Å²	48	8%	0.079	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.3	-178.1	-180	80.3	0	0	0	111.3	N224 Q245 I246 P247 V248	H213-N224 PolarHBondContact CE1-ND2 3.11Å; H213-N224 VanDerWaalsContact CE1-ND2 3.28Å; H213-Q245 HydrophobicContact CB-CG 3.39Å; H213-I246 PolarHBondContact N-O 3.24Å; H213-P247 CarbonylContact O-C 3.59Å; H213-P247 VanDerWaalsContact O-CA 3.32Å; H213-P247 WeakPolarHBondContact O-CA 3.4Å; H213-V248 PolarHBondContact O-N 3.24Å
214	D	90.7	Very high	92.8	Very high	50 Å²	50	40 Å²	40	27%	0.267	21%	0.209	S	C	.	.			trans	-135	128.3	173.1	178.7	4.8	0	0	0	108.1	G216 C217 V248 A266	D214-G216 PolarHBondContact O-N 3.32Å; D214-G216 PolarHBondContact OD1-N 3.32Å; D214-C217 HydrophobicContact CB-CB 3.77Å; D214-C217 PolarHBondContact O-N 2.83Å; D214-C217 VanDerWaalsContact O-N 3.1Å; D214-V248 HydrophobicContact CB-CB 4.33Å; D214-V248 HydrophobicContact CB-CG1 3.59Å; D214-A266 HydrophobicContact CB-CB 3.42Å; D214-A266 VanDerWaalsContact CB-CB 3.42Å
215	E	86.6	Confident	92.7	Very high	161 Å²	161	38 Å²	38	75%	0.752	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.4	177.6	-63.2	-172.3	169.7	0	0	111.8	C217 H221	E215-C217 VanDerWaalsContact C-N 3.34Å; E215-H221 PolarHBondContact O-NE2 3.27Å
216	G	87.7	Confident	92.7	Very high	69 Å²	69	36.9 Å²	36.9	71%	0.711	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-12.2	174.5	0	0	0	0	0	114.1	D214	D214-G216 PolarHBondContact O-N 3.32Å; D214-G216 PolarHBondContact OD1-N 3.32Å
217	C	88.1	Confident	92.6	Very high	26 Å²	26	35.5 Å²	35.5	18%	0.176	19%	0.185	C	C	.	.			trans	-94	113.8	-175.1	-174	0	0	0	0	112	D214 E215 E219 C220 H221 A266	D214-C217 HydrophobicContact CB-CB 3.77Å; D214-C217 PolarHBondContact O-N 2.83Å; D214-C217 VanDerWaalsContact O-N 3.1Å; E215-C217 VanDerWaalsContact C-N 3.34Å; C217-E219 VanDerWaalsContact C-N 3.27Å; C217-E219 PolarHBondContact O-N 3.02Å; C217-C220 HydrophobicContact CB-CB 4.03Å; C217-C220 WeakPolarHBondContact O-CB 3.24Å; C217-C220 PolarHBondContact O-N 3.42Å; C217-C220 VanDerWaalsContact O-N 3.1Å; C217-H221 PolarHBondContact O-CD2 2.8Å; C217-H221 PolarHBondContact O-N 3.08Å; C217-A266 HydrophobicContact CB-CB 3.82Å
218	F	89.5	Confident	92.5	Very high	134 Å²	134	34.8 Å²	34.8	59%	0.588	18%	0.183	S	C	*	.	H	α-helix	trans	-60.2	-33.5	178.8	-174.7	-109.9	0	0	0	113.5	C220 H221 L222	F218-C220 VanDerWaalsContact C-N 3.33Å; F218-C220 PolarHBondContact O-N 3.04Å; F218-H221 WeakPolarHBondContact O-CB 3.28Å; F218-H221 PolarHBondContact O-N 3.02Å; F218-L222 HydrophobicContact CD1-CD1 4.09Å; F218-L222 HydrophobicContact CD1-CG 4.26Å; F218-L222 HydrophobicContact CE1-CD1 3.77Å; F218-L222 HydrophobicContact CE1-CD2 4.05Å; F218-L222 HydrophobicContact CE1-CG 3.92Å; F218-L222 HydrophobicContact CZ-CD2 3.99Å; F218-L222 HydrophobicContact CZ-CG 4.26Å; F218-L222 PolarHBondContact O-N 3.22Å
219	E	89.8	Confident	92.3	Very high	53 Å²	53	38.6 Å²	38.6	25%	0.248	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-35.3	176.4	-67.2	-178.8	179.2	0	0	112.4	C217 H221 L222 L223 S267 H285	C217-E219 VanDerWaalsContact C-N 3.27Å; C217-E219 PolarHBondContact O-N 3.02Å; E219-H221 VanDerWaalsContact C-N 3.26Å; E219-H221 PolarHBondContact O-N 2.95Å; E219-L222 PolarHBondContact O-N 3.35Å; E219-L223 WeakPolarHBondContact O-CG 3.34Å; E219-L223 PolarHBondContact O-N 2.58Å; E219-S267 VanDerWaalsContact OE2-CB 3.23Å; E219-S267 WeakPolarHBondContact OE2-CB 3.3Å; E219-S267 PolarHBondContact OE2-OG 3.42Å; E219-H285 IonicContact OE1-CE1 3.87Å; E219-H285 IonicContact OE1-CG 3.52Å; E219-H285 IonicContact OE1-ND1 3.58Å; E219-H285 PolarHBondContact OE1-ND1 3.45Å; E219-H285 IonicContact OE2-CE1 3.79Å; E219-H285 IonicContact OE2-CG 3.18Å; E219-H285 IonicContact OE2-ND1 3.4Å; E219-H285 PolarHBondContact OE2-ND1 2.78Å
220	C	91.9	Very high	92.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.007	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-35.7	173.4	-66.2	0	0	0	0	111.5	C217 F218 L223 N224 A266	C217-C220 HydrophobicContact CB-CB 4.03Å; C217-C220 WeakPolarHBondContact O-CB 3.24Å; C217-C220 PolarHBondContact O-N 3.42Å; C217-C220 VanDerWaalsContact O-N 3.1Å; F218-C220 VanDerWaalsContact C-N 3.33Å; F218-C220 PolarHBondContact O-N 3.04Å; C220-L223 PolarHBondContact O-N 2.96Å; C220-N224 PolarHBondContact O-N 3.16Å; C220-N224 VanDerWaalsContact O-N 3.1Å; C220-A266 PolarHBondContact SG-O 2.74Å; C220-A266 VanDerWaalsContact SG-O 3.4Å
221	H	91.7	Very high	92.3	Very high	48 Å²	48	44.9 Å²	44.9	22%	0.222	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-39.9	172.2	-72.2	-54.4	0	0	0	112.6	Y182 E215 C217 F218 E219 N224 R225	Y182-H221 HydrophobicContact CD1-CB 3.68Å; Y182-H221 HydrophobicContact CE1-CB 4.37Å; Y182-H221 HydrophobicContact CG-CB 4.25Å; E215-H221 PolarHBondContact O-NE2 3.27Å; C217-H221 PolarHBondContact O-CD2 2.8Å; C217-H221 PolarHBondContact O-N 3.08Å; F218-H221 WeakPolarHBondContact O-CB 3.28Å; F218-H221 PolarHBondContact O-N 3.02Å; E219-H221 VanDerWaalsContact C-N 3.26Å; E219-H221 PolarHBondContact O-N 2.95Å; H221-N224 PolarHBondContact O-N 3.4Å; H221-R225 WeakPolarHBondContact O-CB 3.39Å; H221-R225 PolarHBondContact O-N 2.67Å
222	L	92.4	Very high	92.3	Very high	29 Å²	29	51 Å²	51	15%	0.152	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-41.7	173.9	-66.7	178.9	0	0	0	111.8	F218 E219 N224 R225 D226 N287	F218-L222 HydrophobicContact CD1-CD1 4.09Å; F218-L222 HydrophobicContact CD1-CG 4.26Å; F218-L222 HydrophobicContact CE1-CD1 3.77Å; F218-L222 HydrophobicContact CE1-CD2 4.05Å; F218-L222 HydrophobicContact CE1-CG 3.92Å; F218-L222 HydrophobicContact CZ-CD2 3.99Å; F218-L222 HydrophobicContact CZ-CG 4.26Å; F218-L222 PolarHBondContact O-N 3.22Å; E219-L222 PolarHBondContact O-N 3.35Å; L222-N224 PolarHBondContact O-N 2.91Å; L222-R225 PolarHBondContact O-N 3.23Å; L222-D226 WeakPolarHBondContact O-CB 3.36Å; L222-D226 PolarHBondContact O-N 2.69Å; L222-N287 HydrophobicContact CB-CB 4.45Å
223	L	94.6	Very high	92.6	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.264	C	S	.	.	I	π-helix	trans	-56.9	-48.4	174.2	-74.1	173.9	0	0	0	111.5	E219 C220 R225 V227 W228 I269 L286	E219-L223 WeakPolarHBondContact O-CG 3.34Å; E219-L223 PolarHBondContact O-N 2.58Å; C220-L223 PolarHBondContact O-N 2.96Å; L223-R225 PolarHBondContact O-N 3.41Å; L223-V227 HydrophobicContact CD2-CB 4.13Å; L223-V227 HydrophobicContact CD2-CG1 4.32Å; L223-V227 HydrophobicContact CD2-CG2 3.92Å; L223-V227 WeakPolarHBondContact O-CA 3.43Å; L223-V227 WeakPolarHBondContact O-CB 3.42Å; L223-V227 PolarHBondContact O-N 2.76Å; L223-V227 VanDerWaalsContact O-N 3.13Å; L223-W228 HydrophobicContact CD2-CZ2 4.15Å; L223-W228 VanDerWaalsContact O-CD1 3.3Å; L223-W228 PolarHBondContact O-N 3.42Å; L223-I269 HydrophobicContact CD1-CD1 4.3Å; L223-I269 HydrophobicContact CD2-CD1 3.86Å; L223-L286 WeakPolarHBondContact CD2-O 3.31Å
224	N	94.1	Very high	92.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-65.1	-36.1	178.9	-71.5	-13.4	0	0	0	113.5	Y182 H213 C220 H221 L222 K229 Q245	Y182-N224 WeakPolarHBondContact O-CB 3.39Å; Y182-N224 PolarHBondContact O-ND2 3.23Å; H213-N224 PolarHBondContact CE1-ND2 3.11Å; H213-N224 VanDerWaalsContact CE1-ND2 3.28Å; C220-N224 PolarHBondContact O-N 3.16Å; C220-N224 VanDerWaalsContact O-N 3.1Å; H221-N224 PolarHBondContact O-N 3.4Å; L222-N224 PolarHBondContact O-N 2.91Å; N224-K229 VanDerWaalsContact O-CD 3.25Å; N224-K229 WeakPolarHBondContact O-CD 3.18Å; N224-K229 VanDerWaalsContact O-CE 3.29Å; N224-K229 WeakPolarHBondContact O-CE 3.22Å; N224-K229 VanDerWaalsContact O-CG 3.3Å; N224-K229 WeakPolarHBondContact O-CG 3.38Å; N224-Q245 PolarHBondContact OD1-NE2 3.48Å
225	R	92.3	Very high	93.1	Very high	82 Å²	82	56.6 Å²	56.6	31%	0.309	29%	0.287	S	S	.	.	I	π-helix	trans	-83.4	-49	-176.9	-170.6	-170.6	72.2	-164	-1.6	113.1	L181 Y182 H221 L222 L223	L181-R225 HydrophobicContact CB-CG 4.4Å; Y182-R225 HydrophobicContact CD1-CB 4.03Å; Y182-R225 HydrophobicContact CE1-CB 4.29Å; Y182-R225 HydrophobicContact CE1-CG 4.47Å; Y182-R225 PolarHBondContact OH-NH1 3.45Å; H221-R225 WeakPolarHBondContact O-CB 3.39Å; H221-R225 PolarHBondContact O-N 2.67Å; L222-R225 PolarHBondContact O-N 3.23Å; L223-R225 PolarHBondContact O-N 3.41Å
226	D	94.1	Very high	93.6	Very high	57 Å²	57	49.4 Å²	49.4	31%	0.305	25%	0.254	S	S	.	.	I	π-helix	trans	-102.4	-29.3	-166.2	-62.3	-20.1	0	0	0	112.8	L222 P289	L222-D226 WeakPolarHBondContact O-CB 3.36Å; L222-D226 PolarHBondContact O-N 2.69Å; D226-P289 WeakPolarHBondContact O-CB 3.39Å
227	V	96	Very high	94	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.221	C	C	.	.	I	π-helix	trans	-99.5	-61.9	-172.8	-179.6	0	0	0	0	111.6	L223 K229 D230 I233 N287 P289 V292	L223-V227 HydrophobicContact CD2-CB 4.13Å; L223-V227 HydrophobicContact CD2-CG1 4.32Å; L223-V227 HydrophobicContact CD2-CG2 3.92Å; L223-V227 WeakPolarHBondContact O-CA 3.43Å; L223-V227 WeakPolarHBondContact O-CB 3.42Å; L223-V227 PolarHBondContact O-N 2.76Å; L223-V227 VanDerWaalsContact O-N 3.13Å; V227-K229 VanDerWaalsContact C-N 3.25Å; V227-K229 PolarHBondContact O-N 3.31Å; V227-D230 WeakPolarHBondContact O-CB 3.21Å; V227-D230 PolarHBondContact O-N 3.18Å; V227-D230 VanDerWaalsContact O-N 3.08Å; V227-I233 HydrophobicContact CG1-CD1 3.63Å; V227-I233 WeakPolarHBondContact O-CD1 3.37Å; V227-N287 WeakPolarHBondContact CG2-O 3.36Å; V227-P289 HydrophobicContact CG2-CB 4.42Å; V227-V292 HydrophobicContact CG1-CB 3.82Å; V227-V292 HydrophobicContact CG1-CG1 3.6Å; V227-V292 HydrophobicContact CG1-CG2 3.71Å; V227-V292 HydrophobicContact CG2-CG2 4.33Å
228	W	95.5	Very high	94.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-21.2	-172.8	-50.5	138.1	0	0	0	114	P185 I188 L209 L223 I233 I237 F243 I269 V292	P185-W228 HydrophobicContact CB-CB 4.06Å; P185-W228 HydrophobicContact CG-CB 3.6Å; P185-W228 HydrophobicContact CG-CG 4.16Å; I188-W228 HydrophobicContact CD1-CB 4.32Å; L209-W228 HydrophobicContact CD2-CZ3 4.36Å; L223-W228 HydrophobicContact CD2-CZ2 4.15Å; L223-W228 VanDerWaalsContact O-CD1 3.3Å; L223-W228 PolarHBondContact O-N 3.42Å; W228-I233 HydrophobicContact CE3-CG2 4.12Å; W228-I233 HydrophobicContact CZ3-CG2 4.41Å; W228-I237 HydrophobicContact CE3-CD1 3.8Å; W228-I237 HydrophobicContact CZ3-CD1 4.04Å; W228-F243 HydrophobicContact CD2-CE1 4.3Å; W228-F243 AromaticContact CD2-CZ 3.92Å; W228-F243 HydrophobicContact CD2-CZ 3.92Å; W228-F243 AromaticContact CE2-CZ 3.82Å; W228-F243 HydrophobicContact CE3-CZ 4.34Å; W228-F243 HydrophobicContact CG-CE1 4.27Å; W228-F243 HydrophobicContact CG-CZ 4.23Å; W228-F243 HydrophobicContact CZ2-CZ 4.19Å; W228-F243 AromaticContact NE1-CZ 3.99Å; W228-I269 HydrophobicContact CH2-CD1 3.63Å; W228-I269 HydrophobicContact CH2-CG1 3.94Å; W228-I269 HydrophobicContact CH2-CG2 4.01Å; W228-I269 HydrophobicContact CZ2-CD1 3.77Å; W228-I269 HydrophobicContact CZ2-CG1 3.9Å; W228-V292 HydrophobicContact CZ3-CG1 4.28Å
229	K	92.8	Very high	94.7	Very high	80 Å²	80	52.8 Å²	52.8	35%	0.348	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.2	173.7	-68.4	176.2	-172	172.3	0	113	Q180 L181 Q183 N224 V227	Q180-K229 PolarHBondContact O-NZ 3.21Å; Q180-K229 VanDerWaalsContact O-NZ 3.11Å; L181-K229 PolarHBondContact O-NZ 3.1Å; Q183-K229 WeakPolarHBondContact O-CE 3.34Å; Q183-K229 PolarHBondContact O-NZ 3.49Å; N224-K229 VanDerWaalsContact O-CD 3.25Å; N224-K229 WeakPolarHBondContact O-CD 3.18Å; N224-K229 VanDerWaalsContact O-CE 3.29Å; N224-K229 WeakPolarHBondContact O-CE 3.22Å; N224-K229 VanDerWaalsContact O-CG 3.3Å; N224-K229 WeakPolarHBondContact O-CG 3.38Å; V227-K229 VanDerWaalsContact C-N 3.25Å; V227-K229 PolarHBondContact O-N 3.31Å
230	D	95.7	Very high	95	Very high	44 Å²	44	52.2 Å²	52.2	24%	0.235	24%	0.238	C	C	.	.	S	Bend	trans	-63.7	127.5	172.8	179	-87.8	0	0	0	109.5	V227 K232 I233 Y234 P289	V227-D230 WeakPolarHBondContact O-CB 3.21Å; V227-D230 PolarHBondContact O-N 3.18Å; V227-D230 VanDerWaalsContact O-N 3.08Å; D230-K232 PolarHBondContact O-N 3.41Å; D230-K232 VanDerWaalsContact O-N 3.15Å; D230-K232 WeakPolarHBondContact OD1-CA 3.37Å; D230-K232 VanDerWaalsContact OD1-CB 3.29Å; D230-K232 WeakPolarHBondContact OD1-CB 3.43Å; D230-K232 PolarHBondContact OD1-N 2.8Å; D230-I233 HydrophobicContact CB-CB 4.28Å; D230-I233 HydrophobicContact CB-CD1 4.12Å; D230-I233 HydrophobicContact CB-CG1 4.24Å; D230-I233 PolarHBondContact O-N 3.48Å; D230-I233 PolarHBondContact OD1-N 3.27Å; D230-Y234 VanDerWaalsContact O-CB 3.29Å; D230-Y234 WeakPolarHBondContact O-CB 3.29Å; D230-Y234 PolarHBondContact O-N 3.49Å; D230-P289 HydrophobicContact CB-CB 4.32Å
231	P	95.9	Very high	95.3	Very high	89 Å²	89	52.5 Å²	52.5	58%	0.578	24%	0.241	S	C	*	.	H	α-helix	trans	-57.7	-33	-174.5	-28	35.1	0	0	0	114.4	Q235	P231-Q235 WeakPolarHBondContact O-CB 3.46Å; P231-Q235 VanDerWaalsContact O-CG 3.26Å; P231-Q235 WeakPolarHBondContact O-CG 3.43Å; P231-Q235 PolarHBondContact O-N 3.31Å; P231-Q235 VanDerWaalsContact O-N 3.11Å
232	K	96.3	Very high	95.5	Very high	128 Å²	128	50.5 Å²	50.5	56%	0.557	23%	0.232	S	C	*	.	H	α-helix	trans	-74.9	-43	-178.3	-58.9	-179	177.4	-179.8	0	111	D230 L236 Y293	D230-K232 PolarHBondContact O-N 3.41Å; D230-K232 VanDerWaalsContact O-N 3.15Å; D230-K232 WeakPolarHBondContact OD1-CA 3.37Å; D230-K232 VanDerWaalsContact OD1-CB 3.29Å; D230-K232 WeakPolarHBondContact OD1-CB 3.43Å; D230-K232 PolarHBondContact OD1-N 2.8Å; K232-L236 WeakPolarHBondContact O-CB 3.46Å; K232-L236 PolarHBondContact O-N 3Å; K232-L236 VanDerWaalsContact O-N 3.1Å; K232-Y293 HydrophobicContact CB-CD2 3.63Å; K232-Y293 HydrophobicContact CB-CE2 3.59Å; K232-Y293 HydrophobicContact CB-CG 4.48Å; K232-Y293 HydrophobicContact CD-CE2 4.43Å
233	I	97.1	Very high	95.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-45.5	175.7	-63.1	176.9	0	0	0	109.8	V227 W228 D230 Q235 L236 I237 P289 V292 Y293 L296	V227-I233 HydrophobicContact CG1-CD1 3.63Å; V227-I233 WeakPolarHBondContact O-CD1 3.37Å; W228-I233 HydrophobicContact CE3-CG2 4.12Å; W228-I233 HydrophobicContact CZ3-CG2 4.41Å; D230-I233 HydrophobicContact CB-CB 4.28Å; D230-I233 HydrophobicContact CB-CD1 4.12Å; D230-I233 HydrophobicContact CB-CG1 4.24Å; D230-I233 PolarHBondContact O-N 3.48Å; D230-I233 PolarHBondContact OD1-N 3.27Å; I233-Q235 VanDerWaalsContact C-N 3.35Å; I233-Q235 PolarHBondContact O-N 2.9Å; I233-L236 WeakPolarHBondContact O-CB 3.26Å; I233-L236 PolarHBondContact O-N 3.39Å; I233-L236 VanDerWaalsContact O-N 3.11Å; I233-I237 HydrophobicContact CG2-CD1 3.63Å; I233-I237 HydrophobicContact CG2-CG1 4.15Å; I233-I237 WeakPolarHBondContact O-CG1 3.41Å; I233-I237 PolarHBondContact O-N 3.26Å; I233-P289 HydrophobicContact CD1-CB 4.13Å; I233-P289 WeakPolarHBondContact CD1-O 3.37Å; I233-V292 HydrophobicContact CD1-CB 3.9Å; I233-V292 HydrophobicContact CD1-CG1 3.82Å; I233-Y293 HydrophobicContact CG1-CD2 4.28Å; I233-L296 HydrophobicContact CG2-CD1 4.19Å
234	Y	96.5	Very high	95.9	Very high	51 Å²	51	49.6 Å²	49.6	20%	0.2	23%	0.227	C	C	.	.	H	α-helix	trans	-53.1	-51	177.3	-178.8	-77.1	0	0	0	111.5	E187 I188 D230 L236 I237 K238	E187-Y234 HydrophobicContact CB-CE2 4.32Å; E187-Y234 PolarHBondContact OE2-OH 2.86Å; I188-Y234 HydrophobicContact CB-CE2 4.45Å; I188-Y234 HydrophobicContact CD1-CD2 4.37Å; I188-Y234 HydrophobicContact CG2-CD1 4.3Å; I188-Y234 HydrophobicContact CG2-CD2 3.48Å; I188-Y234 VanDerWaalsContact CG2-CD2 3.48Å; I188-Y234 HydrophobicContact CG2-CE1 4.03Å; I188-Y234 HydrophobicContact CG2-CE2 3.21Å; I188-Y234 HydrophobicContact CG2-CG 4.03Å; I188-Y234 VanDerWaalsContact CG2-CZ 3.49Å; D230-Y234 VanDerWaalsContact O-CB 3.29Å; D230-Y234 WeakPolarHBondContact O-CB 3.29Å; D230-Y234 PolarHBondContact O-N 3.49Å; Y234-L236 VanDerWaalsContact C-N 3.33Å; Y234-L236 PolarHBondContact O-N 3.48Å; Y234-I237 PolarHBondContact O-N 2.78Å; Y234-K238 HydrophobicContact CE1-CD 3.8Å; Y234-K238 VanDerWaalsContact O-CB 3.29Å; Y234-K238 WeakPolarHBondContact O-CB 3.36Å; Y234-K238 PolarHBondContact O-N 3.41Å
235	Q	96.5	Very high	95.9	Very high	136 Å²	136	51 Å²	51	64%	0.636	23%	0.234	S	C	*	.	H	α-helix	trans	-64.9	-36.7	179	-73.7	176.5	3.5	0	0	112.5	P231 I233 R239	P231-Q235 WeakPolarHBondContact O-CB 3.46Å; P231-Q235 VanDerWaalsContact O-CG 3.26Å; P231-Q235 WeakPolarHBondContact O-CG 3.43Å; P231-Q235 PolarHBondContact O-N 3.31Å; P231-Q235 VanDerWaalsContact O-N 3.11Å; I233-Q235 VanDerWaalsContact C-N 3.35Å; I233-Q235 PolarHBondContact O-N 2.9Å; Q235-R239 WeakPolarHBondContact O-CB 3.48Å; Q235-R239 PolarHBondContact O-N 3.44Å
236	L	96.5	Very high	96	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-65.9	-47.4	178.5	-169.7	70.9	0	0	0	111.3	K232 I233 Y234 R239 H240 Y293 L296 Y297 I300	K232-L236 WeakPolarHBondContact O-CB 3.46Å; K232-L236 PolarHBondContact O-N 3Å; K232-L236 VanDerWaalsContact O-N 3.1Å; I233-L236 WeakPolarHBondContact O-CB 3.26Å; I233-L236 PolarHBondContact O-N 3.39Å; I233-L236 VanDerWaalsContact O-N 3.11Å; Y234-L236 VanDerWaalsContact C-N 3.33Å; Y234-L236 PolarHBondContact O-N 3.48Å; L236-R239 PolarHBondContact O-N 3.43Å; L236-H240 PolarHBondContact O-CD2 3.45Å; L236-H240 PolarHBondContact O-N 3.4Å; L236-H240 VanDerWaalsContact O-N 3.13Å; L236-Y293 HydrophobicContact CD2-CD2 4.43Å; L236-Y293 HydrophobicContact CD2-CE2 4.47Å; L236-L296 HydrophobicContact CD2-CB 3.56Å; L236-Y297 HydrophobicContact CD1-CD2 4.1Å; L236-I300 HydrophobicContact CD1-CD1 3.75Å; L236-I300 HydrophobicContact CD2-CD1 3.91Å; L236-I300 HydrophobicContact CG-CD1 3.57Å
237	I	97.3	Very high	95.9	Very high	3 Å²	3	48 Å²	48	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-54.8	176.6	-67.5	174.7	0	0	0	109.7	I188 L209 W228 I233 Y234 R239 H240 C241 F243	I188-I237 HydrophobicContact CD1-CD1 4.25Å; I188-I237 HydrophobicContact CD1-CG2 4.5Å; L209-I237 HydrophobicContact CD2-CD1 3.62Å; L209-I237 HydrophobicContact CD2-CG1 3.76Å; L209-I237 HydrophobicContact CD2-CG2 4.45Å; W228-I237 HydrophobicContact CE3-CD1 3.8Å; W228-I237 HydrophobicContact CZ3-CD1 4.04Å; I233-I237 HydrophobicContact CG2-CD1 3.63Å; I233-I237 HydrophobicContact CG2-CG1 4.15Å; I233-I237 WeakPolarHBondContact O-CG1 3.41Å; I233-I237 PolarHBondContact O-N 3.26Å; Y234-I237 PolarHBondContact O-N 2.78Å; I237-R239 PolarHBondContact O-N 3.21Å; I237-H240 PolarHBondContact O-N 3.22Å; I237-C241 HydrophobicContact CG2-CB 4.25Å; I237-C241 WeakPolarHBondContact O-CA 3.23Å; I237-C241 PolarHBondContact O-N 3.01Å; I237-F243 HydrophobicContact CG2-CB 3.62Å; I237-F243 HydrophobicContact CG2-CD1 4.46Å; I237-F243 HydrophobicContact CG2-CG 4.18Å
238	K	95.7	Very high	95.6	Very high	138 Å²	138	48.5 Å²	48.5	60%	0.6	23%	0.231	S	C	*	.	H	α-helix	trans	-54.8	-32.2	-177.5	-173.4	171.3	-176.8	171.8	0	113.1	Y234	Y234-K238 HydrophobicContact CE1-CD 3.8Å; Y234-K238 VanDerWaalsContact O-CB 3.29Å; Y234-K238 WeakPolarHBondContact O-CB 3.36Å; Y234-K238 PolarHBondContact O-N 3.41Å
239	R	95.8	Very high	95.3	Very high	159 Å²	159	54.7 Å²	54.7	60%	0.6	26%	0.264	S	S	*	.	H	α-helix	trans	-84.3	-37	-178.8	-170.6	160.2	71.6	104.7	-5.8	113.9	Q206 Q235 L236 I237	Q206-R239 PolarHBondContact NE2-O 3.35Å; Q235-R239 WeakPolarHBondContact O-CB 3.48Å; Q235-R239 PolarHBondContact O-N 3.44Å; L236-R239 PolarHBondContact O-N 3.43Å; I237-R239 PolarHBondContact O-N 3.21Å
240	H	96.4	Very high	95.2	Very high	40 Å²	40	52.4 Å²	52.4	19%	0.185	26%	0.258	C	S	.	.	H	α-helix	trans	-120.5	-13.9	-166	-63	-69.1	0	0	0	115.2	Q206 W207 L236 I237 I300	Q206-H240 WeakPolarHBondContact CA-O 3.37Å; Q206-H240 WeakPolarHBondContact CB-O 3.49Å; W207-H240 PolarHBondContact N-O 3.05Å; L236-H240 PolarHBondContact O-CD2 3.45Å; L236-H240 PolarHBondContact O-N 3.4Å; L236-H240 VanDerWaalsContact O-N 3.13Å; I237-H240 PolarHBondContact O-N 3.22Å; H240-I300 HydrophobicContact CB-CD1 3.81Å; H240-I300 HydrophobicContact CB-CG1 4.27Å; H240-I300 HydrophobicContact CB-CG2 4.25Å
241	C	97.3	Very high	95	Very high	8 Å²	8	55 Å²	55	5%	0.054	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.3	-172.4	-57.3	0	0	0	0	111.8	W207 L209 I237	W207-C241 CarbonylContact O-C 3.48Å; W207-C241 WeakPolarHBondContact O-CA 3.29Å; L209-C241 HydrophobicContact CB-CB 3.97Å; I237-C241 HydrophobicContact CG2-CB 4.25Å; I237-C241 WeakPolarHBondContact O-CA 3.23Å; I237-C241 PolarHBondContact O-N 3.01Å
242	T	97.6	Very high	94.7	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	121.5	154.9	-61.2	0	0	0	0	107.1	F190 A197 A201 W207 L208 L209	F190-T242 HydrophobicContact CB-CG2 3.87Å; F190-T242 HydrophobicContact CD2-CG2 3.76Å; F190-T242 HydrophobicContact CG-CG2 3.94Å; A197-T242 HydrophobicContact CB-CG2 4.1Å; A201-T242 WeakPolarHBondContact CA-OG1 3.41Å; W207-T242 PolarHBondContact O-N 3.36Å; L208-T242 HydrophobicContact CD1-CG2 4.31Å; L209-T242 PolarHBondContact N-O 2.94Å
243	F	97.8	Very high	94.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.4	-174.5	179.9	-138.8	0	0	0	111.9	P185 I188 L189 F190 L209 W228 I237	P185-F243 HydrophobicContact CG-CE1 4.01Å; I188-F243 HydrophobicContact CD1-CD1 3.8Å; I188-F243 HydrophobicContact CD1-CE1 4.03Å; I188-F243 HydrophobicContact CG1-CD1 3.99Å; I188-F243 HydrophobicContact CG1-CE1 4.44Å; L189-F243 HydrophobicContact CD2-CD1 3.53Å; L189-F243 HydrophobicContact CD2-CE1 3.48Å; L189-F243 VanDerWaalsContact CD2-CE1 3.48Å; L189-F243 HydrophobicContact CD2-CG 4.21Å; L189-F243 HydrophobicContact CD2-CZ 4.14Å; L189-F243 HydrophobicContact CG-CD1 4.35Å; L189-F243 HydrophobicContact CG-CE1 4.4Å; F190-F243 WeakPolarHBondContact CB-O 3.39Å; F190-F243 PolarHBondContact N-O 2.86Å; L209-F243 HydrophobicContact CB-CD2 3.96Å; L209-F243 HydrophobicContact CD2-CD2 3.6Å; L209-F243 HydrophobicContact CD2-CE2 3.97Å; L209-F243 HydrophobicContact CD2-CG 4.23Å; L209-F243 HydrophobicContact CG-CD2 3.64Å; L209-F243 HydrophobicContact CG-CE2 4.03Å; L209-F243 WeakPolarHBondContact O-CA 3.25Å; L209-F243 WeakPolarHBondContact O-CD2 3.3Å; W228-F243 HydrophobicContact CD2-CE1 4.3Å; W228-F243 AromaticContact CD2-CZ 3.92Å; W228-F243 HydrophobicContact CD2-CZ 3.92Å; W228-F243 AromaticContact CE2-CZ 3.82Å; W228-F243 HydrophobicContact CE3-CZ 4.34Å; W228-F243 HydrophobicContact CG-CE1 4.27Å; W228-F243 HydrophobicContact CG-CZ 4.23Å; W228-F243 HydrophobicContact CZ2-CZ 4.19Å; W228-F243 AromaticContact NE1-CZ 3.99Å; I237-F243 HydrophobicContact CG2-CB 3.62Å; I237-F243 HydrophobicContact CG2-CD1 4.46Å; I237-F243 HydrophobicContact CG2-CG 4.18Å
244	V	96.4	Very high	93.9	Very high	9 Å²	9	52.6 Å²	52.6	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.2	176.8	-174.2	0	0	0	0	109.3	F190 V194 A197 L208 L209 V210 S211 I246	F190-V244 HydrophobicContact CB-CG2 4.19Å; V194-V244 HydrophobicContact CG2-CG1 4.23Å; A197-V244 HydrophobicContact CB-CG2 3.22Å; L208-V244 HydrophobicContact CD1-CG2 3.9Å; L209-V244 PolarHBondContact O-N 3.5Å; V210-V244 CarbonylContact C-O 3.46Å; V210-V244 WeakPolarHBondContact CA-O 3.39Å; S211-V244 PolarHBondContact N-O 3.4Å; V244-I246 HydrophobicContact CG1-CG1 3.78Å
245	Q	95	Very high	93.5	Very high	30 Å²	30	59.3 Å²	59.3	14%	0.14	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.9	169.8	-174	171.7	69.5	0	0	109.3	P184 L189 S211 H213 N224	P184-Q245 VanDerWaalsContact CB-OE1 3.29Å; L189-Q245 HydrophobicContact CD1-CB 4.38Å; L189-Q245 HydrophobicContact CD2-CB 3.51Å; S211-Q245 CarbonylContact O-C 3.53Å; S211-Q245 VanDerWaalsContact O-CA 3.22Å; S211-Q245 WeakPolarHBondContact O-CA 3.44Å; H213-Q245 HydrophobicContact CB-CG 3.39Å; N224-Q245 PolarHBondContact OD1-NE2 3.48Å
246	I	93.3	Very high	93.2	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.4	-173.6	-50.9	170.5	0	0	0	108.9	V194 V210 S211 I212 H213 V244 V248 E252 F256	V194-I246 HydrophobicContact CG2-CD1 3.44Å; V194-I246 VanDerWaalsContact CG2-CD1 3.44Å; V194-I246 HydrophobicContact CG2-CG1 3.75Å; V210-I246 HydrophobicContact CG1-CD1 3.49Å; V210-I246 VanDerWaalsContact CG1-CD1 3.49Å; V210-I246 HydrophobicContact CG1-CG1 4.08Å; S211-I246 PolarHBondContact O-N 3.05Å; I212-I246 CarbonylContact C-O 3.52Å; I212-I246 WeakPolarHBondContact CA-O 3.24Å; I212-I246 HydrophobicContact CD1-CB 4.11Å; I212-I246 HydrophobicContact CD1-CD1 4.5Å; H213-I246 PolarHBondContact N-O 3.24Å; V244-I246 HydrophobicContact CG1-CG1 3.78Å; I246-V248 PolarHBondContact O-N 3.33Å; I246-E252 HydrophobicContact CG2-CB 3.99Å; I246-F256 HydrophobicContact CD1-CB 4.31Å; I246-F256 HydrophobicContact CD1-CD2 3.92Å; I246-F256 HydrophobicContact CD1-CG 4.15Å
247	P	92.5	Very high	92.7	Very high	73 Å²	73	55.3 Å²	55.3	47%	0.474	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	134.5	174	-22.2	32.9	0	0	0	111.5	H213 D249 S250	H213-P247 CarbonylContact O-C 3.59Å; H213-P247 VanDerWaalsContact O-CA 3.32Å; H213-P247 WeakPolarHBondContact O-CA 3.4Å; P247-D249 PolarHBondContact O-N 3.42Å; P247-S250 WeakPolarHBondContact O-CB 3.32Å; P247-S250 PolarHBondContact O-N 3Å; P247-S250 VanDerWaalsContact O-N 3.11Å; P247-S250 PolarHBondContact O-OG 3.42Å
248	V	90	Very high	92	Very high	10 Å²	10	60 Å²	60	6%	0.061	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-35.1	-174.3	67.4	0	0	0	0	112.9	I212 H213 D214 I246	I212-V248 HydrophobicContact CG2-CB 3.85Å; I212-V248 HydrophobicContact CG2-CG2 4.05Å; H213-V248 PolarHBondContact O-N 3.24Å; D214-V248 HydrophobicContact CB-CB 4.33Å; D214-V248 HydrophobicContact CB-CG1 3.59Å; I246-V248 PolarHBondContact O-N 3.33Å
249	D	88.8	Confident	91.4	Very high	131 Å²	131	56.6 Å²	56.6	70%	0.701	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-3.8	-177	-62.5	-31.8	0	0	0	113.5	P247	P247-D249 PolarHBondContact O-N 3.42Å
250	S	91.8	Very high	90.6	Very high	31 Å²	31	51.4 Å²	51.4	22%	0.217	28%	0.276	C	S	.	.	S	Bend	trans	-70.1	154.3	174.1	70.7	0	0	0	0	110.9	P247 E252 G253 L254	P247-S250 WeakPolarHBondContact O-CB 3.32Å; P247-S250 PolarHBondContact O-N 3Å; P247-S250 VanDerWaalsContact O-N 3.11Å; P247-S250 PolarHBondContact O-OG 3.42Å; S250-E252 PolarHBondContact O-N 2.82Å; S250-G253 WeakPolarHBondContact O-CA 3.36Å; S250-G253 PolarHBondContact O-N 3.49Å; S250-G253 PolarHBondContact OG-N 3.41Å; S250-L254 PolarHBondContact O-N 3.06Å
251	S	90.6	Very high	89.3	Confident	99 Å²	99	50.2 Å²	50.2	69%	0.692	27%	0.272	S	S	*	.	H	α-helix	trans	-58.4	-34.8	174.3	55.1	0	0	0	0	112.2	R255	S251-R255 WeakPolarHBondContact O-CB 3.38Å; S251-R255 PolarHBondContact O-N 3.26Å
252	E	90.1	Very high	87.7	Confident	72 Å²	72	58.2 Å²	58.2	34%	0.336	30%	0.303	S	S	.	.	H	α-helix	trans	-66.2	-42.3	172.5	-66.3	-170.7	150	0	0	111.6	V194 I246 S250 R255 F256	V194-E252 HydrophobicContact CG2-CB 4.29Å; V194-E252 WeakPolarHBondContact CG2-OE2 3.45Å; V194-E252 PolarHBondContact N-OE1 2.81Å; I246-E252 HydrophobicContact CG2-CB 3.99Å; S250-E252 PolarHBondContact O-N 2.82Å; E252-R255 PolarHBondContact O-N 2.8Å; E252-F256 VanDerWaalsContact O-CB 3.26Å; E252-F256 WeakPolarHBondContact O-CB 3.38Å; E252-F256 PolarHBondContact O-N 2.9Å
253	G	89.3	Confident	85.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-44.7	176.5	0	0	0	0	0	112.8	S250 F256 R257	S250-G253 WeakPolarHBondContact O-CA 3.36Å; S250-G253 PolarHBondContact O-N 3.49Å; S250-G253 PolarHBondContact OG-N 3.41Å; G253-F256 PolarHBondContact O-N 2.8Å; G253-R257 WeakPolarHBondContact O-CB 3.31Å; G253-R257 VanDerWaalsContact O-CG 3.27Å; G253-R257 WeakPolarHBondContact O-CG 3.48Å; G253-R257 PolarHBondContact O-N 3.13Å
254	L	87.7	Confident	84.3	Confident	95 Å²	95	69 Å²	69	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-62.2	-43.1	174.5	-67.7	174	0	0	0	111.9	S250 S258	S250-L254 PolarHBondContact O-N 3.06Å; L254-S258 WeakPolarHBondContact O-CB 3.29Å; L254-S258 PolarHBondContact O-N 3.23Å; L254-S258 PolarHBondContact O-OG 3.08Å
255	R	88.3	Confident	83.1	Confident	191 Å²	191	69.3 Å²	69.3	72%	0.721	36%	0.359	S	S	*	.	H	α-helix	trans	-66.4	-43.6	177.4	-175.6	177.1	178.9	-120.2	-1.7	111.8	S251 E252 S258 S259	S251-R255 WeakPolarHBondContact O-CB 3.38Å; S251-R255 PolarHBondContact O-N 3.26Å; E252-R255 PolarHBondContact O-N 2.8Å; R255-S258 PolarHBondContact O-N 2.98Å; R255-S259 WeakPolarHBondContact O-CB 3.39Å; R255-S259 PolarHBondContact O-N 3.1Å; R255-S259 VanDerWaalsContact O-N 3.13Å; R255-S259 PolarHBondContact O-OG 2.8Å
256	F	88.2	Confident	82.2	Confident	11 Å²	11	68.3 Å²	68.3	5%	0.048	36%	0.356	C	S	.	.	H	α-helix	trans	-62.1	-50.2	177.5	-174.8	-82.3	0	0	0	110.5	V210 I212 I246 E252 G253 S258 S259 Y260 H268 A270 L272	V210-F256 HydrophobicContact CB-CE2 4.01Å; V210-F256 HydrophobicContact CB-CZ 3.94Å; V210-F256 HydrophobicContact CG1-CD2 4.18Å; V210-F256 HydrophobicContact CG1-CE1 4.24Å; V210-F256 HydrophobicContact CG1-CE2 3.63Å; V210-F256 HydrophobicContact CG1-CZ 3.67Å; V210-F256 HydrophobicContact CG2-CE2 3.95Å; V210-F256 HydrophobicContact CG2-CZ 4.32Å; I212-F256 HydrophobicContact CD1-CB 4.4Å; I212-F256 HydrophobicContact CD1-CD1 3.62Å; I212-F256 HydrophobicContact CD1-CE1 4.2Å; I212-F256 HydrophobicContact CD1-CG 4.15Å; I212-F256 HydrophobicContact CG1-CD1 4.2Å; I212-F256 HydrophobicContact CG1-CE1 4.38Å; I246-F256 HydrophobicContact CD1-CB 4.31Å; I246-F256 HydrophobicContact CD1-CD2 3.92Å; I246-F256 HydrophobicContact CD1-CG 4.15Å; E252-F256 VanDerWaalsContact O-CB 3.26Å; E252-F256 WeakPolarHBondContact O-CB 3.38Å; E252-F256 PolarHBondContact O-N 2.9Å; G253-F256 PolarHBondContact O-N 2.8Å; F256-S258 VanDerWaalsContact C-N 3.3Å; F256-S258 PolarHBondContact O-N 2.97Å; F256-S259 PolarHBondContact O-N 3.08Å; F256-Y260 HydrophobicContact CD1-CD2 4.27Å; F256-Y260 AromaticContact CD2-CD2 3.57Å; F256-Y260 HydrophobicContact CD2-CD2 3.57Å; F256-Y260 HydrophobicContact CD2-CE2 4.04Å; F256-Y260 HydrophobicContact CE1-CD2 4.22Å; F256-Y260 HydrophobicContact CE1-CG 4.38Å; F256-Y260 AromaticContact CE2-CD2 3.51Å; F256-Y260 HydrophobicContact CE2-CD2 3.51Å; F256-Y260 HydrophobicContact CE2-CE2 4.01Å; F256-Y260 HydrophobicContact CE2-CG 4.18Å; F256-Y260 AromaticContact CG-CD2 3.96Å; F256-Y260 HydrophobicContact CG-CD2 3.96Å; F256-Y260 AromaticContact CZ-CD2 3.85Å; F256-Y260 HydrophobicContact CZ-CD2 3.85Å; F256-Y260 HydrophobicContact CZ-CG 4.08Å; F256-Y260 PolarHBondContact O-N 2.74Å; F256-H268 AromaticContact CE1-CD2 3.89Å; F256-H268 AromaticContact CE1-NE2 3.56Å; F256-A270 HydrophobicContact CZ-CB 4.3Å; F256-L272 HydrophobicContact CE2-CD1 3.81Å; F256-L272 HydrophobicContact CZ-CD1 4.43Å
257	R	86.6	Confident	81.8	Confident	51 Å²	51	68.2 Å²	68.2	19%	0.192	36%	0.356	C	S	.	.	H	α-helix	trans	-59	-42.4	177.9	-73.5	174.3	63	-163.2	1.1	111.8	I212 G253 S259 S261	I212-R257 HydrophobicContact CD1-CG 4.5Å; G253-R257 WeakPolarHBondContact O-CB 3.31Å; G253-R257 VanDerWaalsContact O-CG 3.27Å; G253-R257 WeakPolarHBondContact O-CG 3.48Å; G253-R257 PolarHBondContact O-N 3.13Å; R257-S259 PolarHBondContact O-N 2.93Å; R257-S261 CarbonylContact O-C 3.58Å; R257-S261 PolarHBondContact O-N 3.03Å
258	S	83.3	Confident	81.6	Confident	101 Å²	101	64.8 Å²	64.8	71%	0.706	33%	0.333	S	S	*	.	H	α-helix	trans	-63.6	-23.7	176	-57.2	0	0	0	0	113.8	L254 R255 F256	L254-S258 WeakPolarHBondContact O-CB 3.29Å; L254-S258 PolarHBondContact O-N 3.23Å; L254-S258 PolarHBondContact O-OG 3.08Å; R255-S258 PolarHBondContact O-N 2.98Å; F256-S258 VanDerWaalsContact C-N 3.3Å; F256-S258 PolarHBondContact O-N 2.97Å
259	S	83.2	Confident	81.8	Confident	67 Å²	67	64.4 Å²	64.4	47%	0.469	33%	0.331	S	S	.	.	H	α-helix	trans	-98.3	-36.4	-175.8	-54.4	0	0	0	0	113.4	R255 F256 R257	R255-S259 WeakPolarHBondContact O-CB 3.39Å; R255-S259 PolarHBondContact O-N 3.1Å; R255-S259 VanDerWaalsContact O-N 3.13Å; R255-S259 PolarHBondContact O-OG 2.8Å; F256-S259 PolarHBondContact O-N 3.08Å; R257-S259 PolarHBondContact O-N 2.93Å
260	Y	79.4	Confident	82.1	Confident	51 Å²	51	58.1 Å²	58.1	20%	0.2	30%	0.297	C	S	.	.	H	α-helix	trans	-126	-25.8	-167.5	-61.8	-69.9	0	0	0	114.2	F256 L272 G277 Q279	F256-Y260 HydrophobicContact CD1-CD2 4.27Å; F256-Y260 AromaticContact CD2-CD2 3.57Å; F256-Y260 HydrophobicContact CD2-CD2 3.57Å; F256-Y260 HydrophobicContact CD2-CE2 4.04Å; F256-Y260 HydrophobicContact CE1-CD2 4.22Å; F256-Y260 HydrophobicContact CE1-CG 4.38Å; F256-Y260 AromaticContact CE2-CD2 3.51Å; F256-Y260 HydrophobicContact CE2-CD2 3.51Å; F256-Y260 HydrophobicContact CE2-CE2 4.01Å; F256-Y260 HydrophobicContact CE2-CG 4.18Å; F256-Y260 AromaticContact CG-CD2 3.96Å; F256-Y260 HydrophobicContact CG-CD2 3.96Å; F256-Y260 AromaticContact CZ-CD2 3.85Å; F256-Y260 HydrophobicContact CZ-CD2 3.85Å; F256-Y260 HydrophobicContact CZ-CG 4.08Å; F256-Y260 PolarHBondContact O-N 2.74Å; Y260-L272 HydrophobicContact CD1-CD2 4.09Å; Y260-L272 HydrophobicContact CE1-CD1 4.36Å; Y260-L272 HydrophobicContact CE1-CD2 4.09Å; Y260-L272 HydrophobicContact CE2-CD1 4.08Å; Y260-G277 VanDerWaalsContact CE1-O 3.24Å; Y260-G277 WeakPolarHBondContact CE1-O 3.11Å; Y260-G277 PolarHBondContact OH-O 3.1Å; Y260-Q279 HydrophobicContact CD1-CB 4.08Å; Y260-Q279 PolarHBondContact O-OE1 3.29Å
261	S	68.8	Low	82.3	Confident	14 Å²	14	56.7 Å²	56.7	10%	0.098	29%	0.287	C	S	.	.			trans	-109.4	110.1	-173.9	-166	0	0	0	0	112.8	R257 V263 H268	R257-S261 CarbonylContact O-C 3.58Å; R257-S261 PolarHBondContact O-N 3.03Å; S261-V263 PolarHBondContact O-N 3.44Å; S261-V263 PolarHBondContact OG-N 2.78Å; S261-V263 PolarHBondContact OG-O 3.31Å; S261-H268 PolarHBondContact OG-ND1 3.42Å; S261-H268 VanDerWaalsContact OG-ND1 3.15Å
262	Y	63.5	Low	82.5	Confident	177 Å²	177	52.1 Å²	52.1	69%	0.694	26%	0.255	S	S	*	.	S	Bend	trans	-75.8	-12.6	169.5	-52.4	-80	0	0	0	112.8
263	V	58.8	Low	82.7	Confident	59 Å²	59	49.1 Å²	49.1	36%	0.358	24%	0.241	S	C	.	.	S	Bend	trans	-109	136	-174.4	-170.9	0	0	0	0	109.4	S261 S265 T284	S261-V263 PolarHBondContact O-N 3.44Å; S261-V263 PolarHBondContact OG-N 2.78Å; S261-V263 PolarHBondContact OG-O 3.31Å; V263-S265 PolarHBondContact O-N 3.15Å; V263-T284 HydrophobicContact CB-CG2 4.35Å; V263-T284 HydrophobicContact CG1-CG2 4.42Å
264	Q	65.7	Low	83	Confident	174 Å²	174	49.4 Å²	49.4	81%	0.813	24%	0.243	S	C	*	.			trans	-79.6	16.1	177.4	-62.5	-172.7	-22.3	0	0	113.6
265	S	70.6	Confident	83.2	Confident	15 Å²	15	46.7 Å²	46.7	11%	0.105	23%	0.227	C	C	.	.			trans	-73.1	136	178.9	-175.2	0	0	0	0	110.4	V263 S267 H285	V263-S265 PolarHBondContact O-N 3.15Å; S265-S267 VanDerWaalsContact C-N 3.32Å; S265-S267 PolarHBondContact OG-N 3Å; S265-S267 VanDerWaalsContact OG-N 3.16Å; S265-S267 PolarHBondContact OG-OG 2.88Å; S265-H285 PolarHBondContact OG-CE1 3.09Å; S265-H285 VanDerWaalsContact OG-CE1 3.32Å; S265-H285 PolarHBondContact OG-NE2 2.84Å
266	A	76.2	Confident	83.4	Confident	10 Å²	10	41.9 Å²	41.9	8%	0.083	22%	0.219	C	C	.	.	S	Bend	trans	-74	-24	170.3	0	0	0	0	0	112.3	I212 D214 C217 C220 H268	I212-A266 CarbonylContact C-O 3.55Å; I212-A266 VanDerWaalsContact C-O 3.23Å; D214-A266 HydrophobicContact CB-CB 3.42Å; D214-A266 VanDerWaalsContact CB-CB 3.42Å; C217-A266 HydrophobicContact CB-CB 3.82Å; C220-A266 PolarHBondContact SG-O 2.74Å; C220-A266 VanDerWaalsContact SG-O 3.4Å; A266-H268 PolarHBondContact O-N 3.32Å; A266-H268 VanDerWaalsContact O-N 3.08Å
267	S	83.5	Confident	83.5	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.007	23%	0.229	C	C	.	.			trans	-86.9	51	178.8	61.7	0	0	0	0	112.2	E219 S265 T284 H285	E219-S267 VanDerWaalsContact OE2-CB 3.23Å; E219-S267 WeakPolarHBondContact OE2-CB 3.3Å; E219-S267 PolarHBondContact OE2-OG 3.42Å; S265-S267 VanDerWaalsContact C-N 3.32Å; S265-S267 PolarHBondContact OG-N 3Å; S265-S267 VanDerWaalsContact OG-N 3.16Å; S265-S267 PolarHBondContact OG-OG 2.88Å; S267-T284 WeakPolarHBondContact O-CA 3.42Å; S267-H285 PolarHBondContact O-N 3.5Å; S267-H285 PolarHBondContact OG-N 3.29Å; S267-H285 PolarHBondContact OG-ND1 3.05Å
268	H	89.7	Confident	83.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.5	-179.9	178	106.9	0	0	0	110.8	S211 I212 F256 S261 A266 M282	S211-H268 CarbonylContact C-O 3.57Å; S211-H268 WeakPolarHBondContact CA-O 3.48Å; I212-H268 HydrophobicContact CB-CB 4Å; I212-H268 HydrophobicContact CG1-CB 3.91Å; I212-H268 PolarHBondContact N-O 3.43Å; F256-H268 AromaticContact CE1-CD2 3.89Å; F256-H268 AromaticContact CE1-NE2 3.56Å; S261-H268 PolarHBondContact OG-ND1 3.42Å; S261-H268 VanDerWaalsContact OG-ND1 3.15Å; A266-H268 PolarHBondContact O-N 3.32Å; A266-H268 VanDerWaalsContact O-N 3.08Å; H268-M282 WeakPolarHBondContact CE1-CG 3.38Å
269	I	94	Very high	84.1	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.1	175.5	-57.5	164.5	0	0	0	107.8	L209 V210 L223 W228 M282 W283 L286	L209-I269 HydrophobicContact CD1-CG2 3.88Å; V210-I269 CarbonylContact O-C 3.54Å; V210-I269 WeakPolarHBondContact O-CA 3.31Å; L223-I269 HydrophobicContact CD1-CD1 4.3Å; L223-I269 HydrophobicContact CD2-CD1 3.86Å; W228-I269 HydrophobicContact CH2-CD1 3.63Å; W228-I269 HydrophobicContact CH2-CG1 3.94Å; W228-I269 HydrophobicContact CH2-CG2 4.01Å; W228-I269 HydrophobicContact CZ2-CD1 3.77Å; W228-I269 HydrophobicContact CZ2-CG1 3.9Å; I269-M282 CarbonylContact O-C 3.46Å; I269-M282 VanDerWaalsContact O-CA 3.3Å; I269-M282 WeakPolarHBondContact O-CA 3.48Å; I269-W283 HydrophobicContact CB-CE3 4.39Å; I269-W283 HydrophobicContact CG2-CE3 4.05Å; I269-W283 HydrophobicContact CG2-CZ3 4.47Å; I269-W283 PolarHBondContact N-O 2.92Å; I269-W283 PolarHBondContact O-N 2.8Å; I269-L286 HydrophobicContact CD1-CB 4.47Å
270	A	94	Very high	84.6	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.3	177.8	0	0	0	0	0	112.1	V210 F256 Q279 M281 M282	V210-A270 PolarHBondContact N-O 2.92Å; V210-A270 PolarHBondContact O-N 3.18Å; F256-A270 HydrophobicContact CZ-CB 4.3Å; A270-Q279 HydrophobicContact CB-CG 4.44Å; A270-M281 CarbonylContact C-O 3.47Å; A270-M281 VanDerWaalsContact CA-O 3.28Å; A270-M281 WeakPolarHBondContact CA-O 3.05Å; A270-M282 HydrophobicContact CB-CB 4.41Å; A270-M282 HydrophobicContact CB-CG 4.45Å
271	I	96.1	Very high	85.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.9	169	-58.9	174.3	0	0	0	108.4	W207 L208 L209 K280 M281 W283 L296 F299	W207-I271 HydrophobicContact CB-CG2 3.91Å; W207-I271 HydrophobicContact CD2-CG2 4.2Å; W207-I271 HydrophobicContact CE3-CG2 4.02Å; W207-I271 HydrophobicContact CG-CG2 4.18Å; L208-I271 WeakPolarHBondContact O-CA 3.28Å; L209-I271 HydrophobicContact CD1-CG1 3.8Å; I271-K280 PolarHBondContact O-N 3.02Å; I271-M281 HydrophobicContact CB-CB 4.33Å; I271-M281 HydrophobicContact CD1-CB 4.41Å; I271-M281 PolarHBondContact N-O 3.32Å; I271-M281 PolarHBondContact O-N 3.26Å; I271-W283 HydrophobicContact CD1-CH2 3.8Å; I271-W283 HydrophobicContact CD1-CZ3 3.91Å; I271-W283 HydrophobicContact CG1-CH2 4.37Å; I271-W283 HydrophobicContact CG1-CZ3 4.02Å; I271-L296 HydrophobicContact CD1-CD2 3.8Å; I271-L296 HydrophobicContact CG1-CD2 4.48Å; I271-F299 HydrophobicContact CB-CE1 4.34Å; I271-F299 HydrophobicContact CB-CZ 4.49Å; I271-F299 HydrophobicContact CD1-CB 4.39Å; I271-F299 HydrophobicContact CD1-CD1 3.43Å; I271-F299 VanDerWaalsContact CD1-CD1 3.43Å; I271-F299 HydrophobicContact CD1-CE1 3.8Å; I271-F299 HydrophobicContact CD1-CG 3.86Å; I271-F299 HydrophobicContact CD1-CZ 4.49Å; I271-F299 HydrophobicContact CG2-CD1 4.31Å; I271-F299 HydrophobicContact CG2-CE1 3.55Å; I271-F299 HydrophobicContact CG2-CZ 3.83Å
272	L	94.9	Very high	86.3	Confident	4 Å²	4	38 Å²	38	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	143.9	176.7	-52.5	-172.3	0	0	0	110.9	L208 V210 F256 Y260 P274 E278 Q279	L208-L272 HydrophobicContact CB-CB 4.21Å; L208-L272 HydrophobicContact CD2-CB 4.36Å; L208-L272 HydrophobicContact CD2-CD1 4.2Å; L208-L272 PolarHBondContact N-O 3.34Å; L208-L272 PolarHBondContact O-N 2.96Å; V210-L272 HydrophobicContact CG2-CD1 4.24Å; V210-L272 HydrophobicContact CG2-CG 4.37Å; F256-L272 HydrophobicContact CE2-CD1 3.81Å; F256-L272 HydrophobicContact CZ-CD1 4.43Å; Y260-L272 HydrophobicContact CD1-CD2 4.09Å; Y260-L272 HydrophobicContact CE1-CD1 4.36Å; Y260-L272 HydrophobicContact CE1-CD2 4.09Å; Y260-L272 HydrophobicContact CE2-CD1 4.08Å; L272-P274 WeakPolarHBondContact O-CD 3.24Å; L272-E278 WeakPolarHBondContact CA-O 3.32Å; L272-Q279 VanDerWaalsContact CD2-CA 3.5Å; L272-Q279 HydrophobicContact CD2-CB 3.67Å; L272-Q279 HydrophobicContact CD2-CG 4.01Å
273	D	94.6	Very high	87.6	Confident	8 Å²	8	31.6 Å²	31.6	4%	0.043	17%	0.166	C	C	.	.			trans	-74.2	116.4	163.5	179	-20.4	0	0	0	109	W207 F275 T276 G277 E278 K280	W207-D273 HydrophobicContact CZ3-CB 3.93Å; D273-F275 PolarHBondContact O-N 3.1Å; D273-F275 PolarHBondContact OD1-N 2.89Å; D273-T276 WeakPolarHBondContact CB-OG1 3.2Å; D273-T276 PolarHBondContact OD1-N 3.34Å; D273-T276 PolarHBondContact OD2-OG1 3.44Å; D273-G277 VanDerWaalsContact O-CA 3.24Å; D273-G277 WeakPolarHBondContact O-CA 3.46Å; D273-G277 PolarHBondContact O-N 3.25Å; D273-E278 PolarHBondContact N-O 3.49Å; D273-K280 HydrophobicContact CB-CG 4.34Å
274	P	95.2	Very high	89	Confident	6 Å²	6	30 Å²	30	4%	0.039	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.6	-176.3	33.2	-43	0	0	0	113.8	A201 Q202 Q206 L272 L305	A201-P274 HydrophobicContact CB-CB 3.6Å; A201-P274 HydrophobicContact CB-CG 4.11Å; Q202-P274 HydrophobicContact CG-CB 3.88Å; Q202-P274 HydrophobicContact CG-CG 4.47Å; Q202-P274 WeakPolarHBondContact CG-O 3.44Å; Q202-P274 PolarHBondContact NE2-O 3.48Å; Q206-P274 WeakPolarHBondContact O-CG 3.45Å; L272-P274 WeakPolarHBondContact O-CD 3.24Å; P274-L305 HydrophobicContact CG-CD1 4.23Å; P274-L305 HydrophobicContact CG-CD2 3.95Å
275	F	92.9	Very high	90	Very high	39 Å²	39	26 Å²	26	17%	0.171	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-38.4	-179.8	-62	-75.5	0	0	0	112.4	Q202 D273 L305 N307 P308	Q202-F275 HydrophobicContact CB-CD1 4.27Å; Q202-F275 HydrophobicContact CB-CE1 3.79Å; Q202-F275 HydrophobicContact CB-CZ 4.26Å; Q202-F275 HydrophobicContact CG-CD1 3.85Å; Q202-F275 HydrophobicContact CG-CE1 3.9Å; Q202-F275 HydrophobicContact CG-CG 4.45Å; D273-F275 PolarHBondContact O-N 3.1Å; D273-F275 PolarHBondContact OD1-N 2.89Å; F275-L305 HydrophobicContact CD2-CD1 4Å; F275-L305 HydrophobicContact CD2-CD2 4.45Å; F275-L305 HydrophobicContact CD2-CG 4.17Å; F275-L305 HydrophobicContact CE2-CD1 4.2Å; F275-L305 HydrophobicContact CE2-CD2 3.87Å; F275-L305 HydrophobicContact CE2-CG 3.86Å; F275-N307 HydrophobicContact CE1-CB 4.22Å; F275-N307 HydrophobicContact CE2-CB 4.02Å; F275-N307 HydrophobicContact CZ-CB 3.74Å; F275-P308 HydrophobicContact CB-CG 4.2Å; F275-P308 HydrophobicContact CD1-CG 4.32Å; F275-P308 HydrophobicContact CG-CG 4.38Å
276	T	91.7	Very high	90.9	Very high	89 Å²	89	26.6 Å²	26.6	55%	0.546	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-19.3	-176	62.2	0	0	0	0	113.1	D273 E278	D273-T276 WeakPolarHBondContact CB-OG1 3.2Å; D273-T276 PolarHBondContact OD1-N 3.34Å; D273-T276 PolarHBondContact OD2-OG1 3.44Å; T276-E278 PolarHBondContact O-N 3.32Å; T276-E278 VanDerWaalsContact OG1-CB 3.31Å; T276-E278 WeakPolarHBondContact OG1-CB 3.37Å; T276-E278 PolarHBondContact OG1-N 3.25Å
277	G	91	Very high	91.5	Very high	24 Å²	24	28.8 Å²	28.8	25%	0.247	15%	0.15	C	C	.	.			trans	69.1	10.9	-168.8	0	0	0	0	0	113.1	Y260 D273	Y260-G277 VanDerWaalsContact CE1-O 3.24Å; Y260-G277 WeakPolarHBondContact CE1-O 3.11Å; Y260-G277 PolarHBondContact OH-O 3.1Å; D273-G277 VanDerWaalsContact O-CA 3.24Å; D273-G277 WeakPolarHBondContact O-CA 3.46Å; D273-G277 PolarHBondContact O-N 3.25Å
278	E	90.1	Very high	91.9	Very high	66 Å²	66	31.8 Å²	31.8	31%	0.308	17%	0.166	S	C	.	.			trans	-75.3	132.9	-178.2	-167.4	-169.6	140.4	0	0	111.1	L272 D273 T276 K280	L272-E278 WeakPolarHBondContact CA-O 3.32Å; D273-E278 PolarHBondContact N-O 3.49Å; T276-E278 PolarHBondContact O-N 3.32Å; T276-E278 VanDerWaalsContact OG1-CB 3.31Å; T276-E278 WeakPolarHBondContact OG1-CB 3.37Å; T276-E278 PolarHBondContact OG1-N 3.25Å; E278-K280 PolarHBondContact O-N 2.85Å; E278-K280 IonicContact OE1-NZ 2.82Å; E278-K280 PolarHBondContact OE1-NZ 3.43Å; E278-K280 IonicContact OE2-NZ 2.76Å; E278-K280 PolarHBondContact OE2-NZ 3.13Å
279	Q	92.4	Very high	92.1	Very high	5 Å²	5	33.5 Å²	33.5	2%	0.023	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	110	170.4	-178.1	178.7	-87.1	0	0	109.6	E68 Y260 A270 L272 M282	E68-Q279 PolarHBondContact OE2-NE2 3.18Å; Y260-Q279 HydrophobicContact CD1-CB 4.08Å; Y260-Q279 PolarHBondContact O-OE1 3.29Å; A270-Q279 HydrophobicContact CB-CG 4.44Å; L272-Q279 VanDerWaalsContact CD2-CA 3.5Å; L272-Q279 HydrophobicContact CD2-CB 3.67Å; L272-Q279 HydrophobicContact CD2-CG 4.01Å; Q279-M282 HydrophobicContact CG-CB 4.28Å
280	K	93.1	Very high	92.2	Very high	54 Å²	54	40.8 Å²	40.8	24%	0.235	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-41.3	178.9	-65.2	-61.1	177.2	-172.2	0	111.7	W207 I271 D273 E278 F299	W207-K280 HydrophobicContact CH2-CG 4.26Å; W207-K280 HydrophobicContact CZ3-CG 3.77Å; I271-K280 PolarHBondContact O-N 3.02Å; D273-K280 HydrophobicContact CB-CG 4.34Å; E278-K280 PolarHBondContact O-N 2.85Å; E278-K280 IonicContact OE1-NZ 2.82Å; E278-K280 PolarHBondContact OE1-NZ 3.43Å; E278-K280 IonicContact OE2-NZ 2.76Å; E278-K280 PolarHBondContact OE2-NZ 3.13Å; K280-F299 HydrophobicContact CB-CE2 3.71Å; K280-F299 HydrophobicContact CB-CZ 3.75Å; K280-F299 HydrophobicContact CG-CZ 4.29Å
281	M	92.3	Very high	92.2	Very high	29 Å²	29	43.5 Å²	43.5	14%	0.143	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.5	179.8	-69.6	-77.6	95	0	0	110.6	Q69 A270 I271 W283 F299	Q69-M281 VanDerWaalsContact O-CE 3.23Å; Q69-M281 WeakPolarHBondContact O-CE 3.25Å; A270-M281 CarbonylContact C-O 3.47Å; A270-M281 VanDerWaalsContact CA-O 3.28Å; A270-M281 WeakPolarHBondContact CA-O 3.05Å; I271-M281 HydrophobicContact CB-CB 4.33Å; I271-M281 HydrophobicContact CD1-CB 4.41Å; I271-M281 PolarHBondContact N-O 3.32Å; I271-M281 PolarHBondContact O-N 3.26Å; M281-W283 HydrophobicContact CB-CH2 3.41Å; M281-W283 VanDerWaalsContact CB-CH2 3.41Å; M281-W283 HydrophobicContact CB-CZ2 3.78Å; M281-W283 HydrophobicContact CB-CZ3 3.84Å; M281-W283 HydrophobicContact CG-CH2 3.92Å; M281-W283 HydrophobicContact CG-CZ2 4.07Å; M281-W283 HydrophobicContact SD-CZ2 4.12Å; M281-F299 HydrophobicContact CG-CD2 3.4Å; M281-F299 HydrophobicContact CG-CE2 3.74Å; M281-F299 HydrophobicContact CG-CG 4.14Å; M281-F299 HydrophobicContact SD-CD2 4.38Å
282	M	91.5	Very high	92.2	Very high	36 Å²	36	43.6 Å²	43.6	18%	0.177	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	139.8	176.1	-179.4	-96.8	-70.6	0	0	111.5	H268 I269 A270 Q279 T284	H268-M282 WeakPolarHBondContact CE1-CG 3.38Å; I269-M282 CarbonylContact O-C 3.46Å; I269-M282 VanDerWaalsContact O-CA 3.3Å; I269-M282 WeakPolarHBondContact O-CA 3.48Å; A270-M282 HydrophobicContact CB-CB 4.41Å; A270-M282 HydrophobicContact CB-CG 4.45Å; Q279-M282 HydrophobicContact CG-CB 4.28Å; M282-T284 HydrophobicContact SD-CG2 4.17Å
283	W	91	Very high	92.3	Very high	43 Å²	43	46.5 Å²	46.5	16%	0.163	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.8	177.3	-55	-84.3	0	0	0	110.3	I269 I271 M281 L286 V295 L296	I269-W283 HydrophobicContact CB-CE3 4.39Å; I269-W283 HydrophobicContact CG2-CE3 4.05Å; I269-W283 HydrophobicContact CG2-CZ3 4.47Å; I269-W283 PolarHBondContact N-O 2.92Å; I269-W283 PolarHBondContact O-N 2.8Å; I271-W283 HydrophobicContact CD1-CH2 3.8Å; I271-W283 HydrophobicContact CD1-CZ3 3.91Å; I271-W283 HydrophobicContact CG1-CH2 4.37Å; I271-W283 HydrophobicContact CG1-CZ3 4.02Å; M281-W283 HydrophobicContact CB-CH2 3.41Å; M281-W283 VanDerWaalsContact CB-CH2 3.41Å; M281-W283 HydrophobicContact CB-CZ2 3.78Å; M281-W283 HydrophobicContact CB-CZ3 3.84Å; M281-W283 HydrophobicContact CG-CH2 3.92Å; M281-W283 HydrophobicContact CG-CZ2 4.07Å; M281-W283 HydrophobicContact SD-CZ2 4.12Å; W283-L286 HydrophobicContact CB-CB 4.02Å; W283-L286 HydrophobicContact CB-CD2 3.95Å; W283-L286 HydrophobicContact CD2-CD2 4.25Å; W283-L286 HydrophobicContact CG-CD2 3.81Å; W283-V295 HydrophobicContact CD2-CG2 4.42Å; W283-V295 HydrophobicContact CH2-CG2 4.23Å; W283-V295 HydrophobicContact CZ2-CB 3.81Å; W283-V295 HydrophobicContact CZ2-CG2 3.77Å; W283-L296 HydrophobicContact CH2-CD2 4.36Å; W283-L296 HydrophobicContact CZ3-CD2 4.23Å
284	T	88.9	Confident	92.3	Very high	24 Å²	24	50.7 Å²	50.7	15%	0.147	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	149.9	170	54.6	0	0	0	0	109.6	V263 S267 M282 L286	V263-T284 HydrophobicContact CB-CG2 4.35Å; V263-T284 HydrophobicContact CG1-CG2 4.42Å; S267-T284 WeakPolarHBondContact O-CA 3.42Å; M282-T284 HydrophobicContact SD-CG2 4.17Å; T284-L286 PolarHBondContact O-N 2.89Å
285	H	86.6	Confident	92.3	Very high	92 Å²	92	51.3 Å²	51.3	43%	0.426	26%	0.26	S	S	.	.	S	Bend	trans	58.5	18.7	177.6	-52	-78.2	0	0	0	115	E219 S265 S267 N287	E219-H285 IonicContact OE1-CE1 3.87Å; E219-H285 IonicContact OE1-CG 3.52Å; E219-H285 IonicContact OE1-ND1 3.58Å; E219-H285 PolarHBondContact OE1-ND1 3.45Å; E219-H285 IonicContact OE2-CE1 3.79Å; E219-H285 IonicContact OE2-CG 3.18Å; E219-H285 IonicContact OE2-ND1 3.4Å; E219-H285 PolarHBondContact OE2-ND1 2.78Å; S265-H285 PolarHBondContact OG-CE1 3.09Å; S265-H285 VanDerWaalsContact OG-CE1 3.32Å; S265-H285 PolarHBondContact OG-NE2 2.84Å; S267-H285 PolarHBondContact O-N 3.5Å; S267-H285 PolarHBondContact OG-N 3.29Å; S267-H285 PolarHBondContact OG-ND1 3.05Å; H285-N287 PolarHBondContact O-N 3.49Å
286	L	89	Confident	92.4	Very high	26 Å²	26	49.6 Å²	49.6	14%	0.136	25%	0.253	C	S	.	.			trans	-87.2	89.3	-176.6	-173	69.4	0	0	0	110.8	L223 I269 W283 T284 I291 V292 V295	L223-L286 WeakPolarHBondContact CD2-O 3.31Å; I269-L286 HydrophobicContact CD1-CB 4.47Å; W283-L286 HydrophobicContact CB-CB 4.02Å; W283-L286 HydrophobicContact CB-CD2 3.95Å; W283-L286 HydrophobicContact CD2-CD2 4.25Å; W283-L286 HydrophobicContact CG-CD2 3.81Å; T284-L286 PolarHBondContact O-N 2.89Å; L286-I291 HydrophobicContact CD1-CB 4.06Å; L286-I291 HydrophobicContact CD1-CG2 3.63Å; L286-V292 HydrophobicContact CD2-CB 4.45Å; L286-V292 HydrophobicContact CD2-CG2 3.72Å; L286-V292 HydrophobicContact CG-CG2 3.6Å; L286-V295 HydrophobicContact CD2-CG2 3.85Å
287	N	88.1	Confident	92.6	Very high	56 Å²	56	50.1 Å²	50.1	30%	0.299	25%	0.246	S	C	.	.			trans	-115.6	1	-172	60.5	7.5	0	0	0	115.2	L222 V227 H285 P289	L222-N287 HydrophobicContact CB-CB 4.45Å; V227-N287 WeakPolarHBondContact CG2-O 3.36Å; H285-N287 PolarHBondContact O-N 3.49Å; N287-P289 WeakPolarHBondContact O-CD 3.35Å
288	D	92.7	Very high	92.7	Very high	65 Å²	65	53.5 Å²	53.5	35%	0.348	26%	0.255	S	S	.	.			trans	-84.1	115.8	172	-174.3	-24.1	0	0	0	109.9	K290 I291 V292	D288-K290 PolarHBondContact O-N 2.75Å; D288-K290 VanDerWaalsContact O-N 3.16Å; D288-K290 WeakPolarHBondContact OD1-CB 3.33Å; D288-K290 PolarHBondContact OD1-N 2.9Å; D288-I291 HydrophobicContact CB-CB 4.27Å; D288-I291 HydrophobicContact CB-CD1 3.87Å; D288-I291 HydrophobicContact CB-CG1 3.89Å; D288-I291 PolarHBondContact O-N 3.4Å; D288-I291 VanDerWaalsContact O-N 3.13Å; D288-V292 WeakPolarHBondContact O-CG2 3.3Å; D288-V292 PolarHBondContact O-N 2.88Å
289	P	95	Very high	92.9	Very high	35 Å²	35	51.1 Å²	51.1	23%	0.227	24%	0.244	C	C	.	.	H	α-helix	trans	-58.2	-30.3	-178.6	22.2	-32.8	0	0	0	113.4	D226 V227 D230 I233 N287 Y293	D226-P289 WeakPolarHBondContact O-CB 3.39Å; V227-P289 HydrophobicContact CG2-CB 4.42Å; D230-P289 HydrophobicContact CB-CB 4.32Å; I233-P289 HydrophobicContact CD1-CB 4.13Å; I233-P289 WeakPolarHBondContact CD1-O 3.37Å; N287-P289 WeakPolarHBondContact O-CD 3.35Å; P289-Y293 WeakPolarHBondContact O-CB 3.27Å; P289-Y293 PolarHBondContact O-N 3.32Å
290	K	95	Very high	92.9	Very high	155 Å²	155	51.9 Å²	51.9	67%	0.674	25%	0.248	S	C	*	.	H	α-helix	trans	-67.6	-46.4	177.8	-65.5	179.2	-177.3	176.7	0	111.1	D288 Y293 D294	D288-K290 PolarHBondContact O-N 2.75Å; D288-K290 VanDerWaalsContact O-N 3.16Å; D288-K290 WeakPolarHBondContact OD1-CB 3.33Å; D288-K290 PolarHBondContact OD1-N 2.9Å; K290-Y293 PolarHBondContact O-N 2.94Å; K290-D294 VanDerWaalsContact O-CG 3.28Å; K290-D294 PolarHBondContact O-N 2.74Å
291	I	94.6	Very high	92.8	Very high	58 Å²	58	54 Å²	54	30%	0.297	26%	0.258	S	S	.	.	H	α-helix	trans	-67.2	-42.4	-179.5	-52.1	178.5	0	0	0	109.9	L286 D288 Y293 D294 V295	L286-I291 HydrophobicContact CD1-CB 4.06Å; L286-I291 HydrophobicContact CD1-CG2 3.63Å; D288-I291 HydrophobicContact CB-CB 4.27Å; D288-I291 HydrophobicContact CB-CD1 3.87Å; D288-I291 HydrophobicContact CB-CG1 3.89Å; D288-I291 PolarHBondContact O-N 3.4Å; D288-I291 VanDerWaalsContact O-N 3.13Å; I291-Y293 VanDerWaalsContact C-N 3.34Å; I291-Y293 PolarHBondContact O-N 2.76Å; I291-D294 PolarHBondContact O-N 3.34Å; I291-V295 HydrophobicContact CG2-CG1 4.38Å; I291-V295 WeakPolarHBondContact O-CG1 3.39Å; I291-V295 WeakPolarHBondContact O-CG2 3.27Å; I291-V295 PolarHBondContact O-N 2.81Å
292	V	95.4	Very high	92.6	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-58.9	-46.4	175.8	177.5	0	0	0	0	111	V227 W228 I233 L286 D288 D294 V295 L296	V227-V292 HydrophobicContact CG1-CB 3.82Å; V227-V292 HydrophobicContact CG1-CG1 3.6Å; V227-V292 HydrophobicContact CG1-CG2 3.71Å; V227-V292 HydrophobicContact CG2-CG2 4.33Å; W228-V292 HydrophobicContact CZ3-CG1 4.28Å; I233-V292 HydrophobicContact CD1-CB 3.9Å; I233-V292 HydrophobicContact CD1-CG1 3.82Å; L286-V292 HydrophobicContact CD2-CB 4.45Å; L286-V292 HydrophobicContact CD2-CG2 3.72Å; L286-V292 HydrophobicContact CG-CG2 3.6Å; D288-V292 WeakPolarHBondContact O-CG2 3.3Å; D288-V292 PolarHBondContact O-N 2.88Å; V292-D294 PolarHBondContact O-N 3.03Å; V292-V295 WeakPolarHBondContact O-CG2 3.31Å; V292-L296 HydrophobicContact CG1-CD1 3.71Å; V292-L296 HydrophobicContact CG1-CG 4.13Å; V292-L296 WeakPolarHBondContact O-CB 3.4Å; V292-L296 VanDerWaalsContact O-CG 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.43Å; V292-L296 PolarHBondContact O-N 2.85Å
293	Y	96.8	Very high	92.6	Very high	64 Å²	64	60.2 Å²	60.2	25%	0.251	29%	0.289	S	S	.	.	H	α-helix	trans	-58.8	-48.3	176.4	177.8	-97.5	0	0	0	111.7	K232 I233 L236 P289 K290 I291 V295 L296 Y297	K232-Y293 HydrophobicContact CB-CD2 3.63Å; K232-Y293 HydrophobicContact CB-CE2 3.59Å; K232-Y293 HydrophobicContact CB-CG 4.48Å; K232-Y293 HydrophobicContact CD-CE2 4.43Å; I233-Y293 HydrophobicContact CG1-CD2 4.28Å; L236-Y293 HydrophobicContact CD2-CD2 4.43Å; L236-Y293 HydrophobicContact CD2-CE2 4.47Å; P289-Y293 WeakPolarHBondContact O-CB 3.27Å; P289-Y293 PolarHBondContact O-N 3.32Å; K290-Y293 PolarHBondContact O-N 2.94Å; I291-Y293 VanDerWaalsContact C-N 3.34Å; I291-Y293 PolarHBondContact O-N 2.76Å; Y293-V295 PolarHBondContact O-N 3Å; Y293-L296 PolarHBondContact O-N 3.38Å; Y293-Y297 WeakPolarHBondContact O-CB 3.49Å; Y293-Y297 PolarHBondContact O-N 2.74Å
294	D	95.6	Very high	92.4	Very high	97 Å²	97	63.7 Å²	63.7	52%	0.519	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-46.6	-177.8	-70.6	-17.9	0	0	0	111.6	K290 I291 V292 Q298	K290-D294 VanDerWaalsContact O-CG 3.28Å; K290-D294 PolarHBondContact O-N 2.74Å; I291-D294 PolarHBondContact O-N 3.34Å; V292-D294 PolarHBondContact O-N 3.03Å; D294-Q298 WeakPolarHBondContact O-CB 3.35Å; D294-Q298 PolarHBondContact O-N 3.22Å
295	V	94.1	Very high	92.4	Very high	18 Å²	18	63.6 Å²	63.6	11%	0.109	31%	0.314	C	S	.	.	H	α-helix	trans	-69.7	-40.7	-179.5	-59.2	0	0	0	0	112.6	W283 L286 I291 V292 Y293 F299	W283-V295 HydrophobicContact CD2-CG2 4.42Å; W283-V295 HydrophobicContact CH2-CG2 4.23Å; W283-V295 HydrophobicContact CZ2-CB 3.81Å; W283-V295 HydrophobicContact CZ2-CG2 3.77Å; L286-V295 HydrophobicContact CD2-CG2 3.85Å; I291-V295 HydrophobicContact CG2-CG1 4.38Å; I291-V295 WeakPolarHBondContact O-CG1 3.39Å; I291-V295 WeakPolarHBondContact O-CG2 3.27Å; I291-V295 PolarHBondContact O-N 2.81Å; V292-V295 WeakPolarHBondContact O-CG2 3.31Å; Y293-V295 PolarHBondContact O-N 3Å; V295-F299 WeakPolarHBondContact O-CB 3.48Å; V295-F299 PolarHBondContact O-N 3.44Å
296	L	95.2	Very high	92.3	Very high	4 Å²	4	64 Å²	64	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-65.7	-44.8	176.7	-71.6	-179.2	0	0	0	110.8	L209 I233 L236 I271 W283 V292 Y293 F299 I300	L209-L296 HydrophobicContact CD1-CD2 4.2Å; I233-L296 HydrophobicContact CG2-CD1 4.19Å; L236-L296 HydrophobicContact CD2-CB 3.56Å; I271-L296 HydrophobicContact CD1-CD2 3.8Å; I271-L296 HydrophobicContact CG1-CD2 4.48Å; W283-L296 HydrophobicContact CH2-CD2 4.36Å; W283-L296 HydrophobicContact CZ3-CD2 4.23Å; V292-L296 HydrophobicContact CG1-CD1 3.71Å; V292-L296 HydrophobicContact CG1-CG 4.13Å; V292-L296 WeakPolarHBondContact O-CB 3.4Å; V292-L296 VanDerWaalsContact O-CG 3.25Å; V292-L296 WeakPolarHBondContact O-CG 3.43Å; V292-L296 PolarHBondContact O-N 2.85Å; Y293-L296 PolarHBondContact O-N 3.38Å; L296-F299 PolarHBondContact O-N 3.44Å; L296-I300 WeakPolarHBondContact O-CB 3.46Å; L296-I300 WeakPolarHBondContact O-CD1 3.4Å; L296-I300 VanDerWaalsContact O-CG1 3.28Å; L296-I300 WeakPolarHBondContact O-CG1 3.44Å; L296-I300 PolarHBondContact O-N 3.33Å
297	Y	95.5	Very high	92.1	Very high	100 Å²	100	64.5 Å²	64.5	39%	0.392	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-47.6	179.2	-176.7	-96.5	0	0	0	110.6	L236 Y293 F299 I300 Q301	L236-Y297 HydrophobicContact CD1-CD2 4.1Å; Y293-Y297 WeakPolarHBondContact O-CB 3.49Å; Y293-Y297 PolarHBondContact O-N 2.74Å; Y297-F299 VanDerWaalsContact C-N 3.34Å; Y297-F299 PolarHBondContact O-N 3.07Å; Y297-I300 PolarHBondContact O-N 2.97Å; Y297-Q301 HydrophobicContact CD1-CG 3.99Å; Y297-Q301 HydrophobicContact CE1-CG 3.61Å; Y297-Q301 HydrophobicContact CE2-CG 4.21Å; Y297-Q301 HydrophobicContact CG-CG 4.44Å; Y297-Q301 VanDerWaalsContact O-CG 3.31Å; Y297-Q301 WeakPolarHBondContact O-CG 3.45Å; Y297-Q301 PolarHBondContact O-N 3.3Å
298	Q	93.6	Very high	91.7	Very high	95 Å²	95	65.7 Å²	65.7	44%	0.444	34%	0.336	S	S	.	.	H	α-helix	trans	-57.6	-46.4	177	-173.5	177.4	11.2	0	0	111.5	D294 I300 Q301 H302	D294-Q298 WeakPolarHBondContact O-CB 3.35Å; D294-Q298 PolarHBondContact O-N 3.22Å; Q298-I300 PolarHBondContact O-N 3.26Å; Q298-Q301 PolarHBondContact O-N 3.3Å; Q298-H302 PolarHBondContact O-CD2 2.81Å; Q298-H302 PolarHBondContact O-N 2.99Å; Q298-H302 VanDerWaalsContact O-N 3.11Å
299	F	94.3	Very high	90.7	Very high	16 Å²	16	68.2 Å²	68.2	7%	0.07	35%	0.35	C	S	.	.	H	α-helix	trans	-59.1	-49	177.7	175.3	-97.1	0	0	0	112.1	W207 I271 K280 M281 V295 L296 Y297 Q301 H302 T303	W207-F299 AromaticContact CD1-CE1 3.96Å; W207-F299 AromaticContact CD2-CE1 3.65Å; W207-F299 HydrophobicContact CD2-CE1 3.65Å; W207-F299 AromaticContact CD2-CZ 3.98Å; W207-F299 HydrophobicContact CD2-CZ 3.98Å; W207-F299 AromaticContact CE2-CE1 3.57Å; W207-F299 AromaticContact CE2-CZ 3.85Å; W207-F299 HydrophobicContact CE3-CE1 4.16Å; W207-F299 HydrophobicContact CE3-CZ 4.06Å; W207-F299 AromaticContact CG-CE1 3.92Å; W207-F299 HydrophobicContact CG-CE1 3.92Å; W207-F299 AromaticContact CH2-CZ 3.98Å; W207-F299 HydrophobicContact CH2-CZ 3.98Å; W207-F299 HydrophobicContact CZ2-CE1 4.04Å; W207-F299 AromaticContact CZ2-CZ 3.86Å; W207-F299 HydrophobicContact CZ2-CZ 3.86Å; W207-F299 HydrophobicContact CZ3-CZ 4.07Å; W207-F299 AromaticContact NE1-CE1 3.73Å; I271-F299 HydrophobicContact CB-CE1 4.34Å; I271-F299 HydrophobicContact CB-CZ 4.49Å; I271-F299 HydrophobicContact CD1-CB 4.39Å; I271-F299 HydrophobicContact CD1-CD1 3.43Å; I271-F299 VanDerWaalsContact CD1-CD1 3.43Å; I271-F299 HydrophobicContact CD1-CE1 3.8Å; I271-F299 HydrophobicContact CD1-CG 3.86Å; I271-F299 HydrophobicContact CD1-CZ 4.49Å; I271-F299 HydrophobicContact CG2-CD1 4.31Å; I271-F299 HydrophobicContact CG2-CE1 3.55Å; I271-F299 HydrophobicContact CG2-CZ 3.83Å; K280-F299 HydrophobicContact CB-CE2 3.71Å; K280-F299 HydrophobicContact CB-CZ 3.75Å; K280-F299 HydrophobicContact CG-CZ 4.29Å; M281-F299 HydrophobicContact CG-CD2 3.4Å; M281-F299 HydrophobicContact CG-CE2 3.74Å; M281-F299 HydrophobicContact CG-CG 4.14Å; M281-F299 HydrophobicContact SD-CD2 4.38Å; V295-F299 WeakPolarHBondContact O-CB 3.48Å; V295-F299 PolarHBondContact O-N 3.44Å; L296-F299 PolarHBondContact O-N 3.44Å; Y297-F299 VanDerWaalsContact C-N 3.34Å; Y297-F299 PolarHBondContact O-N 3.07Å; F299-Q301 VanDerWaalsContact C-N 3.31Å; F299-Q301 PolarHBondContact O-N 3.49Å; F299-H302 PolarHBondContact O-N 3.06Å; F299-T303 WeakPolarHBondContact CD2-OG1 3.43Å; F299-T303 HydrophobicContact CE2-CG2 3.87Å; F299-T303 WeakPolarHBondContact CE2-OG1 3.33Å; F299-T303 HydrophobicContact CZ-CG2 3.93Å; F299-T303 VanDerWaalsContact O-CB 3.28Å; F299-T303 WeakPolarHBondContact O-CB 3.44Å; F299-T303 PolarHBondContact O-N 2.93Å; F299-T303 PolarHBondContact O-OG1 2.9Å; F299-T303 VanDerWaalsContact O-OG1 3.06Å
300	I	93.7	Very high	89.3	Confident	21 Å²	21	72.6 Å²	72.6	11%	0.108	37%	0.372	C	S	.	.	H	α-helix	trans	-64.1	-34.9	-178.6	-70.1	164.3	0	0	0	111.7	L236 H240 L296 Y297 Q298	L236-I300 HydrophobicContact CD1-CD1 3.75Å; L236-I300 HydrophobicContact CD2-CD1 3.91Å; L236-I300 HydrophobicContact CG-CD1 3.57Å; H240-I300 HydrophobicContact CB-CD1 3.81Å; H240-I300 HydrophobicContact CB-CG1 4.27Å; H240-I300 HydrophobicContact CB-CG2 4.25Å; L296-I300 WeakPolarHBondContact O-CB 3.46Å; L296-I300 WeakPolarHBondContact O-CD1 3.4Å; L296-I300 VanDerWaalsContact O-CG1 3.28Å; L296-I300 WeakPolarHBondContact O-CG1 3.44Å; L296-I300 PolarHBondContact O-N 3.33Å; Y297-I300 PolarHBondContact O-N 2.97Å; Q298-I300 PolarHBondContact O-N 3.26Å
301	Q	91	Very high	87.3	Confident	99 Å²	99	72.5 Å²	72.5	46%	0.463	38%	0.378	S	S	.	.	H	α-helix	trans	-73.6	-33.9	178.2	-68.6	-54.4	-47.1	0	0	113.2	Y297 Q298 F299	Y297-Q301 HydrophobicContact CD1-CG 3.99Å; Y297-Q301 HydrophobicContact CE1-CG 3.61Å; Y297-Q301 HydrophobicContact CE2-CG 4.21Å; Y297-Q301 HydrophobicContact CG-CG 4.44Å; Y297-Q301 VanDerWaalsContact O-CG 3.31Å; Y297-Q301 WeakPolarHBondContact O-CG 3.45Å; Y297-Q301 PolarHBondContact O-N 3.3Å; Q298-Q301 PolarHBondContact O-N 3.3Å; F299-Q301 VanDerWaalsContact C-N 3.31Å; F299-Q301 PolarHBondContact O-N 3.49Å
302	H	88.2	Confident	85.1	Confident	150 Å²	150	75 Å²	75	69%	0.694	40%	0.397	S	S	*	.	H	α-helix	trans	-101.1	-11.4	-172.4	-68.1	-63	0	0	0	114.5	Q298 F299	Q298-H302 PolarHBondContact O-CD2 2.81Å; Q298-H302 PolarHBondContact O-N 2.99Å; Q298-H302 VanDerWaalsContact O-N 3.11Å; F299-H302 PolarHBondContact O-N 3.06Å
303	T	89.9	Confident	82.1	Confident	44 Å²	44	82.3 Å²	82.3	27%	0.27	44%	0.435	S	S	.	.			trans	-121.3	117.9	-176.4	-41.6	0	0	0	0	110.6	W207 F299	W207-T303 HydrophobicContact CH2-CG2 3.73Å; W207-T303 HydrophobicContact CZ2-CG2 3.59Å; F299-T303 WeakPolarHBondContact CD2-OG1 3.43Å; F299-T303 HydrophobicContact CE2-CG2 3.87Å; F299-T303 WeakPolarHBondContact CE2-OG1 3.33Å; F299-T303 HydrophobicContact CZ-CG2 3.93Å; F299-T303 VanDerWaalsContact O-CB 3.28Å; F299-T303 WeakPolarHBondContact O-CB 3.44Å; F299-T303 PolarHBondContact O-N 2.93Å; F299-T303 PolarHBondContact O-OG1 2.9Å; F299-T303 VanDerWaalsContact O-OG1 3.06Å
304	T	87.9	Confident	79.5	Confident	116 Å²	116	86 Å²	86	71%	0.712	46%	0.458	S	S	*	.			trans	-94.3	133.4	175.7	55.4	0	0	0	0	110.9	T306	T304-T306 PolarHBondContact O-N 3.05Å
305	L	88.7	Confident	76.7	Confident	23 Å²	23	88.8 Å²	88.8	12%	0.12	47%	0.473	C	S	.	.			trans	-77.9	115.3	173.2	-173.2	63.1	0	0	0	110.1	Q206 W207 P274 F275	Q206-L305 WeakPolarHBondContact O-CD2 3.27Å; W207-L305 HydrophobicContact CD2-CD1 4.33Å; W207-L305 HydrophobicContact CE3-CD1 3.91Å; W207-L305 HydrophobicContact CH2-CB 4.29Å; W207-L305 HydrophobicContact CH2-CD1 3.8Å; W207-L305 HydrophobicContact CZ2-CB 3.91Å; W207-L305 HydrophobicContact CZ2-CD1 4.23Å; W207-L305 HydrophobicContact CZ3-CD1 3.63Å; P274-L305 HydrophobicContact CG-CD1 4.23Å; P274-L305 HydrophobicContact CG-CD2 3.95Å; F275-L305 HydrophobicContact CD2-CD1 4Å; F275-L305 HydrophobicContact CD2-CD2 4.45Å; F275-L305 HydrophobicContact CD2-CG 4.17Å; F275-L305 HydrophobicContact CE2-CD1 4.2Å; F275-L305 HydrophobicContact CE2-CD2 3.87Å; F275-L305 HydrophobicContact CE2-CG 3.86Å
306	T	84.9	Confident	73.9	Confident	99 Å²	99	94.6 Å²	94.6	61%	0.607	50%	0.503	S	S	*	.			trans	-98.6	109.8	-179.1	53.5	0	0	0	0	110.9	T304 P308	T304-T306 PolarHBondContact O-N 3.05Å; T306-P308 WeakPolarHBondContact O-CD 3.12Å
307	N	83.9	Confident	71.2	Confident	38 Å²	38	100 Å²	100	20%	0.203	54%	0.537	C	S	.	.			trans	-74.9	117.4	174.7	-175.8	-16.2	0	0	0	110.2	F275 N309 N310	F275-N307 HydrophobicContact CE1-CB 4.22Å; F275-N307 HydrophobicContact CE2-CB 4.02Å; F275-N307 HydrophobicContact CZ-CB 3.74Å; N307-N309 PolarHBondContact O-N 2.72Å; N307-N309 VanDerWaalsContact O-N 3.13Å; N307-N309 WeakPolarHBondContact OD1-CB 3.48Å; N307-N309 PolarHBondContact OD1-N 3.32Å; N307-N310 PolarHBondContact O-N 2.96Å
308	P	79.2	Confident	68.4	Low	80 Å²	80	101.9 Å²	101.9	52%	0.519	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-62.1	-20.5	-179.3	25.1	-33.9	0	0	0	113.7	F275 T306	F275-P308 HydrophobicContact CB-CG 4.2Å; F275-P308 HydrophobicContact CD1-CG 4.32Å; F275-P308 HydrophobicContact CG-CG 4.38Å; T306-P308 WeakPolarHBondContact O-CD 3.12Å
309	N	73	Confident	65.9	Low	119 Å²	119	100.9 Å²	100.9	64%	0.636	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-81.8	-12.4	-176	-63.5	-26.3	0	0	0	114.2	N307 N311	N307-N309 PolarHBondContact O-N 2.72Å; N307-N309 VanDerWaalsContact O-N 3.13Å; N307-N309 WeakPolarHBondContact OD1-CB 3.48Å; N307-N309 PolarHBondContact OD1-N 3.32Å; N309-N311 VanDerWaalsContact C-N 3.29Å; N309-N311 PolarHBondContact O-N 3.07Å
310	N	64.8	Low	63.5	Low	127 Å²	127	107.4 Å²	107.4	68%	0.679	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-79.9	-2.6	-176.9	-81.3	-5.7	0	0	0	114.7	N307 T312	N307-N310 PolarHBondContact O-N 2.96Å; N310-T312 VanDerWaalsContact C-N 3.28Å; N310-T312 PolarHBondContact O-N 2.92Å
311	N	53.9	Low	61	Low	153 Å²	153	113 Å²	113	82%	0.818	63%	0.631	S	S	*	*			trans	-90	35.5	179.9	-72.8	-12.1	0	0	0	114.1	N309	N309-N311 VanDerWaalsContact C-N 3.29Å; N309-N311 PolarHBondContact O-N 3.07Å
312	T	46.6	Very low	58.6	Low	111 Å²	111	116.1 Å²	116.1	68%	0.681	65%	0.651	S	S	*	*	S	Bend	trans	-115.2	107.3	169.3	51.4	0	0	0	0	110.7	N310	N310-T312 VanDerWaalsContact C-N 3.28Å; N310-T312 PolarHBondContact O-N 2.92Å
313	N	34.4	Very low	56.2	Low	154 Å²	154	112 Å²	112	82%	0.824	65%	0.649	S	S	*	*			trans	71	79.4	162.5	-60.3	-24.5	0	0	0	119.6
314	I	40.6	Very low	54	Low	143 Å²	143	118.4 Å²	118.4	73%	0.733	68%	0.676	S	S	*	*			trans	-139.8	68	142.5	-43.6	174.7	0	0	0	109.8	N316	I314-N316 VanDerWaalsContact C-N 3.31Å; I314-N316 HydrophobicContact CG2-CB 4.37Å; I314-N316 PolarHBondContact O-N 3.47Å
315	N	37.7	Very low	51.7	Low	155 Å²	155	119.7 Å²	119.7	83%	0.829	68%	0.678	S	S	*	*			trans	-85.5	81.5	156.3	-76.9	-12.2	0	0	0	107.6	T317	N315-T317 PolarHBondContact O-N 3.23Å
316	N	35.9	Very low	49.5	Very low	139 Å²	139	123.5 Å²	123.5	74%	0.743	71%	0.707	S	S	*	*			trans	-77.4	79.2	164.3	-79	-12.6	0	0	0	108.4	I314 T318	I314-N316 VanDerWaalsContact C-N 3.31Å; I314-N316 HydrophobicContact CG2-CB 4.37Å; I314-N316 PolarHBondContact O-N 3.47Å; N316-T318 PolarHBondContact O-N 3.46Å
317	T	36.9	Very low	47.5	Very low	119 Å²	119	123.9 Å²	123.9	73%	0.73	71%	0.714	S	S	*	*			trans	-76.9	97.6	164.6	-55.4	0	0	0	0	108	N315 A319	N315-T317 PolarHBondContact O-N 3.23Å; T317-A319 HydrophobicContact CG2-CB 4.38Å; T317-A319 PolarHBondContact O-N 3.36Å
318	T	37.9	Very low	45.6	Very low	139 Å²	139	126.9 Å²	126.9	85%	0.853	74%	0.738	S	S	*	*			trans	-70.4	101.4	166.4	-41.7	0	0	0	0	108.7	N316	N316-T318 PolarHBondContact O-N 3.46Å
319	A	40.1	Very low	43.8	Very low	74 Å²	74	131.5 Å²	131.5	61%	0.612	76%	0.756	S	S	*	*			trans	-145.8	92.3	168.5	0	0	0	0	0	111.1	T317	T317-A319 HydrophobicContact CG2-CB 4.38Å; T317-A319 PolarHBondContact O-N 3.36Å
320	I	43.9	Very low	42.1	Very low	153 Å²	153	129 Å²	129	79%	0.785	76%	0.759	S	S	*	*				46.9	104.6	129.8	-52.6	172.3	0	0	0	117.8
321	N	42.3	Very low	40.6	Very low	137 Å²	137	129 Å²	129	73%	0.733	77%	0.769	S	S	*	*			trans	32.1	116.2	132.6	-61.6	-19.4	0	0	0	120.5
322	N	40	Very low	40	Very low	165 Å²	165	129.3 Å²	129.3	88%	0.882	77%	0.769	S	S	*	*				144.1	135.7	115.3	-81.8	-22	0	0	0	114.2
323	G	37.2	Very low	39.3	Very low	64 Å²	64	131.7 Å²	131.7	66%	0.66	78%	0.777	S	S	*	*			trans	88.7	98.7	156.4	0	0	0	0	0	115.4
324	Q	44.6	Very low	39.6	Very low	179 Å²	179	132 Å²	132	84%	0.836	78%	0.778	S	S	*	*				61.5	98.1	96.2	-74.5	-171.9	-73.9	0	0	114.1
325	D	39.6	Very low	39.4	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	78%	0.782	S	S	*	*				162.2	121	107.7	-81.9	-20.2	0	0	0	113.2
326	S	42.9	Very low	39.4	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	78%	0.777	S	S	*	*			trans	25.7	119.4	146.2	56.5	0	0	0	0	121.5
327	S	42.2	Very low	39.6	Very low	107 Å²	107	129 Å²	129	75%	0.748	79%	0.785	S	S	*	*				141.8	122.6	102.5	63	0	0	0	0	115.3
328	S	43.5	Very low	39.6	Very low	101 Å²	101	126.7 Å²	126.7	71%	0.706	79%	0.785	S	S	*	*			trans	86.3	119.9	130.5	-66.4	0	0	0	0	122.5
329	I	41.7	Very low	39.7	Very low	176 Å²	176	131.2 Å²	131.2	90%	0.903	79%	0.787	S	S	*	*			trans	87.2	124.5	147.8	-52.3	148.8	0	0	0	115.5
330	G	36.6	Very low	39.8	Very low	68 Å²	68	133.2 Å²	133.2	70%	0.701	79%	0.791	S	S	*	*			cis	176.8	129.3	1.3	0	0	0	0	0	108.7
331	S	35.1	Very low	39.6	Very low	127 Å²	127	132.5 Å²	132.5	89%	0.888	79%	0.789	S	S	*	*			trans	-98.1	137.4	178.6	-31.3	0	0	0	0	109.8
332	I	41.1	Very low	39.4	Very low	158 Å²	158	130.5 Å²	130.5	81%	0.81	79%	0.786	S	S	*	*			trans	-135.4	103.5	160.6	19.2	171.1	0	0	0	108.7
333	N	31.8	Very low	39.4	Very low	161 Å²	161	129.3 Å²	129.3	86%	0.861	79%	0.785	S	S	*	*			trans	-106.1	130	152.9	-84.7	-27.8	0	0	0	106.2
334	L	40.1	Very low	39.3	Very low	161 Å²	161	130.9 Å²	130.9	84%	0.843	79%	0.786	S	S	*	*			trans	-140	108.2	159	-92.8	133.2	0	0	0	109.2
335	T	35.4	Very low	39.2	Very low	134 Å²	134	130.1 Å²	130.1	82%	0.822	79%	0.786	S	S	*	*			trans	-50.8	153.3	157.5	48.2	0	0	0	0	113.2
336	G	38.8	Very low	39	Very low	70 Å²	70	130 Å²	130	72%	0.722	79%	0.785	S	S	*	*			trans	159	86.2	153.7	0	0	0	0	0	117.1
337	N	39.5	Very low	38.8	Very low	169 Å²	169	132 Å²	132	90%	0.904	79%	0.787	S	S	*	*			trans	48.5	121.6	136	-63.9	-3.2	0	0	0	121.3
338	G	37.5	Very low	38.3	Very low	71 Å²	71	137 Å²	137	73%	0.732	79%	0.79	S	S	*	*				115	103.7	104.8	0	0	0	0	0	118.8
339	R	39.6	Very low	38	Very low	235 Å²	235	140.9 Å²	140.9	89%	0.887	80%	0.795	S	S	*	*				86.5	127.1	127.8	-79.6	-177.5	161.3	159.1	-3.1	121.6
340	T	43.5	Very low	37.9	Very low	115 Å²	115	138.4 Å²	138.4	71%	0.706	79%	0.788	S	S	*	*			trans	70.2	143.4	145.5	61.8	0	0	0	0	117.3
341	D	38.6	Very low	37.7	Very low	138 Å²	138	143 Å²	143	74%	0.738	80%	0.796	S	S	*	*			cis	-172.6	149.8	-11.2	-105.4	-22.6	0	0	0	105.4
342	S	38.6	Very low	37.8	Very low	96 Å²	96	142.2 Å²	142.2	67%	0.671	79%	0.791	S	S	*	*			trans	59.7	113.4	148.2	-48.6	0	0	0	0	120.2
343	T	40.2	Very low	37.5	Very low	140 Å²	140	140.5 Å²	140.5	86%	0.859	79%	0.788	S	S	*	*				162.7	138.1	97.8	40.7	0	0	0	0	112.7
344	S	35.4	Very low	37.6	Very low	97 Å²	97	141.2 Å²	141.2	68%	0.678	79%	0.79	S	S	*	*			trans	-26.4	139.4	164.7	178.3	0	0	0	0	116.8
345	I	41.4	Very low	37.4	Very low	163 Å²	163	142.2 Å²	142.2	84%	0.836	79%	0.791	S	S	*	*			trans	-160.6	124.8	132	-89.6	141.5	0	0	0	108.6
346	D	35.1	Very low	37.5	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	79%	0.792	S	S	*	*			trans	-56.1	139.6	166.2	-65.3	-60.5	0	0	0	112
347	N	38.9	Very low	37.2	Very low	145 Å²	145	143.2 Å²	143.2	78%	0.775	79%	0.792	S	S	*	*				-168.1	133.9	129.9	-102.6	-34.1	0	0	0	113.2
348	R	32.8	Very low	37.3	Very low	212 Å²	212	142.6 Å²	142.6	80%	0.8	79%	0.787	S	S	*	*			trans	-25.2	143.7	158	-59.1	166.5	-170.3	173	2.6	113.3
349	F	36.8	Very low	37.2	Very low	184 Å²	184	149.2 Å²	149.2	81%	0.807	79%	0.79	S	S	*	*				178.6	111.9	123.6	-93.8	-69.6	0	0	0	110.8
350	T	39	Very low	36.9	Very low	124 Å²	124	149.5 Å²	149.5	76%	0.761	79%	0.791	S	S	*	*			trans	49.1	124.4	134.9	57.8	0	0	0	0	121.7
351	N	32	Very low	36.6	Very low	163 Å²	163	154.6 Å²	154.6	87%	0.872	80%	0.797	S	S	*	*			trans	-41.8	137.2	158.3	-77.1	-42.5	0	0	0	114.5
352	S	36.8	Very low	36.5	Very low	112 Å²	112	153.8 Å²	153.8	78%	0.783	80%	0.8	S	S	*	*			trans	-147.3	114.7	143.7	71.7	0	0	0	0	110.3
353	V	35.6	Very low	36.3	Very low	122 Å²	122	153.7 Å²	153.7	74%	0.739	81%	0.805	S	S	*	*			trans	-78.7	134.5	169.1	168.2	0	0	0	0	108.5	Q355	V353-Q355 HydrophobicContact CG1-CG 4.3Å
354	L	34.8	Very low	36.2	Very low	175 Å²	175	156.6 Å²	156.6	92%	0.916	81%	0.809	S	S	*	*			trans	-108.3	106.8	160.2	-83.2	166.2	0	0	0	108.4
355	Q	34.2	Very low	36.3	Very low	183 Å²	183	158 Å²	158	86%	0.855	81%	0.813	S	S	*	*			trans	-92.5	124.7	158	-88.7	-177.1	-22.2	0	0	108.2	V353	V353-Q355 HydrophobicContact CG1-CG 4.3Å
356	S	38.3	Very low	36.2	Very low	122 Å²	122	156.9 Å²	156.9	85%	0.853	81%	0.814	S	S	*	*			trans	-105.6	142.9	156.5	56	0	0	0	0	109.3
357	S	32.2	Very low	36	Very low	103 Å²	103	158 Å²	158	72%	0.72	82%	0.82	S	S	*	*			trans	-104.1	-174.6	-158.8	33.2	0	0	0	0	112
358	I	41.1	Very low	35.9	Very low	155 Å²	155	155.4 Å²	155.4	80%	0.795	82%	0.819	S	S	*	*			trans	99.2	121.7	164.3	-51.1	152.5	0	0	0	111.8
359	R	35.8	Very low	36	Very low	210 Å²	210	154.1 Å²	154.1	79%	0.792	82%	0.822	S	S	*	*			cis	-166.2	145.9	26.6	-155	170.4	174.4	-167.3	-0	110.2
360	R	34.5	Very low	36	Very low	241 Å²	241	154.2 Å²	154.2	91%	0.909	83%	0.827	S	S	*	*			trans	-87.4	153.4	167.7	-67.2	-176.9	177.5	-168.1	-1.3	112.2
361	R	37.2	Very low	35.6	Very low	222 Å²	222	157.7 Å²	157.7	84%	0.838	83%	0.834	S	S	*	*			trans	-154.5	152.7	141.4	-106.2	-173.2	-172.3	157.6	0.2	111.7
362	P	36.3	Very low	35.9	Very low	121 Å²	121	158.1 Å²	158.1	79%	0.786	83%	0.831	S	S	*	*			trans	-112.2	175.3	-159.7	39.8	-27	0	0	0	115.8
363	A	34	Very low	35.6	Very low	95 Å²	95	160.7 Å²	160.7	79%	0.785	83%	0.831	S	S	*	*			trans	-19.5	142.5	173.4	0	0	0	0	0	121.2
364	E	37	Very low	35.4	Very low	200 Å²	200	165.2 Å²	165.2	94%	0.935	84%	0.841	S	S	*	*			trans	-154.9	148.5	142.4	-113.1	172.2	-158.5	0	0	111.7
365	V	38.7	Very low	35.4	Very low	126 Å²	126	163.8 Å²	163.8	76%	0.764	83%	0.834	S	S	*	*			trans	-82.7	144.4	-170.5	172.1	0	0	0	0	110.7
366	T	39.5	Very low	35.4	Very low	141 Å²	141	162.9 Å²	162.9	87%	0.865	83%	0.83	S	S	*	*			trans	-178.7	131.4	137.7	24.8	0	0	0	0	111.5
367	N	30.4	Very low	35.2	Very low	161 Å²	161	166.6 Å²	166.6	86%	0.861	83%	0.831	S	S	*	*			trans	-67.6	138.5	167.5	-59.7	-51.8	0	0	0	110.3
368	A	36.9	Very low	35.1	Very low	92 Å²	92	169.5 Å²	169.5	76%	0.76	84%	0.838	S	S	*	*			trans	-168.6	124.3	146.7	0	0	0	0	0	110.6
369	E	34.3	Very low	34.9	Very low	184 Å²	184	169 Å²	169	86%	0.86	84%	0.837	S	S	*	*			trans	-4.3	126.4	153.5	-69	153.7	121.1	0	0	118.3
370	M	36.7	Very low	35	Very low	187 Å²	187	168.2 Å²	168.2	92%	0.921	84%	0.839	S	S	*	*			trans	-136.4	100.7	134.4	-78.5	-156.2	-66.1	0	0	109.4
371	H	32	Very low	34.7	Very low	197 Å²	197	168.4 Å²	168.4	91%	0.912	84%	0.84	S	S	*	*			trans	-77.2	119.2	156.8	-116.4	43.7	0	0	0	107.4
372	E	36.8	Very low	35	Very low	171 Å²	171	163.9 Å²	163.9	80%	0.799	84%	0.839	S	S	*	*			trans	-157	97.8	157.2	-105.5	178.4	-172	0	0	106.2
373	Q	31	Very low	34.7	Very low	167 Å²	167	168.4 Å²	168.4	78%	0.78	84%	0.84	S	S	*	*				80.2	83.1	89.8	-166.3	159.4	1.3	0	0	112.7
374	F	32.3	Very low	34.9	Very low	216 Å²	216	172.3 Å²	172.3	95%	0.947	85%	0.847	S	S	*	*			trans	-137.3	76.4	150.5	-87	-78.3	0	0	0	108.8
375	D	33.3	Very low	34.7	Very low	145 Å²	145	170.2 Å²	170.2	78%	0.775	84%	0.837	S	S	*	*			trans	-85.7	154.9	156.6	-98.1	-44	0	0	0	109.3
376	H	34.5	Very low	34.6	Very low	165 Å²	165	171 Å²	171	76%	0.764	84%	0.842	S	S	*	*			trans	87.2	89.5	171.7	-68.1	19.6	0	0	0	117.2
377	F	34.5	Very low	34.2	Very low	199 Å²	199	168.9 Å²	168.9	87%	0.873	83%	0.833	S	S	*	*				-146.3	82.7	123.9	-99.8	-75.6	0	0	0	110	L379	F377-L379 HydrophobicContact CD1-CD1 3.91Å; F377-L379 HydrophobicContact CE1-CD1 4.09Å
378	N	30.5	Very low	34.6	Very low	164 Å²	164	167.6 Å²	167.6	88%	0.877	83%	0.827	S	S	*	*			trans	-94.4	100.8	162.7	-120.8	-43.4	0	0	0	107
379	L	37.4	Very low	34.5	Very low	146 Å²	146	170.4 Å²	170.4	76%	0.764	83%	0.829	S	S	*	*			trans	-109	94.3	173.2	-121.1	77.1	0	0	0	110.9	F377	F377-L379 HydrophobicContact CD1-CD1 3.91Å; F377-L379 HydrophobicContact CE1-CD1 4.09Å
380	K	36.2	Very low	34.7	Very low	193 Å²	193	168.4 Å²	168.4	84%	0.839	83%	0.829	S	S	*	*			trans	22.6	114.1	142.4	-69.4	175.5	175.3	176.6	0	118.4
381	R	28.6	Very low	34.8	Very low	245 Å²	245	169.9 Å²	169.9	93%	0.925	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-61.6	149	150.2	-71.9	-176.7	-173.2	-153.6	0.8	111.3
382	P	43.9	Very low	34.9	Very low	127 Å²	127	166.2 Å²	166.2	83%	0.825	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-93.7	132.7	146.7	21.5	-5.6	0	0	0	110.6
383	R	30.4	Very low	35	Very low	215 Å²	215	163.1 Å²	163.1	81%	0.811	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-92.7	121.3	177	-174.5	-179.7	-174.3	151.3	-0.6	107.5
384	L	38.3	Very low	35.2	Very low	178 Å²	178	163.6 Å²	163.6	93%	0.932	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-101.7	120.1	161.2	-79.3	170.6	0	0	0	108.3
385	Q	32.8	Very low	35.2	Very low	155 Å²	155	159.3 Å²	159.3	72%	0.724	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-90.1	128.1	167.4	-70.2	173.6	-4.6	0	0	107.7
386	T	36.2	Very low	35.2	Very low	142 Å²	142	160.8 Å²	160.8	87%	0.871	81%	0.812	S	S	*	*			trans	-143	127.3	142.7	48.7	0	0	0	0	107.5
387	S	32.5	Very low	35	Very low	97 Å²	97	164 Å²	164	68%	0.678	82%	0.819	S	S	*	*			trans	-70.6	150	175.1	53.2	0	0	0	0	111
388	D	37.3	Very low	35	Very low	135 Å²	135	160.7 Å²	160.7	72%	0.722	81%	0.81	S	S	*	*				167.5	119.9	115.3	-78.2	-15.7	0	0	0	110.6
389	N	36.1	Very low	35.1	Very low	150 Å²	150	159 Å²	159	80%	0.802	80%	0.801	S	S	*	*			trans	26.2	125.6	141.2	-57.7	-31.5	0	0	0	119.5
390	V	37.6	Very low	35	Very low	143 Å²	143	159.9 Å²	159.9	87%	0.867	81%	0.805	S	S	*	*				173	143	100.1	163.2	0	0	0	0	109.4
391	Y	38	Very low	34.8	Very low	218 Å²	218	154.1 Å²	154.1	86%	0.855	79%	0.789	S	S	*	*			trans	-55.2	159.8	-177.2	-108.8	-110.5	0	0	0	116.5
392	P	34	Very low	35.1	Very low	119 Å²	119	149.9 Å²	149.9	77%	0.773	79%	0.785	S	S	*	*			trans	-90.8	137.9	177.5	35.2	-29.9	0	0	0	113.2
393	S	39.2	Very low	34.7	Very low	106 Å²	106	148.5 Å²	148.5	74%	0.741	78%	0.778	S	S	*	*			trans	-132	113.5	164.7	57.7	0	0	0	0	107.4
394	E	36.7	Very low	35.1	Very low	178 Å²	178	144.5 Å²	144.5	83%	0.832	78%	0.777	S	S	*	*				91.4	102.1	91.7	-155.7	169.1	-151.8	0	0	111.7
395	V	32.1	Very low	34.8	Very low	126 Å²	126	143.7 Å²	143.7	76%	0.764	77%	0.768	S	S	*	*			trans	40	119.5	139.3	-166.1	0	0	0	0	119.1
396	E	32.1	Very low	34.8	Very low	176 Å²	176	141.7 Å²	141.7	82%	0.822	77%	0.771	S	S	*	*				-160.5	117.8	123.8	-117.2	175.1	-178.9	0	0	112.3
397	Y	30.4	Very low	34.8	Very low	231 Å²	231	140.2 Å²	140.2	91%	0.906	77%	0.767	S	S	*	*			trans	-74.5	122.5	164.8	-111.7	-102.7	0	0	0	107.6
398	I	35.6	Very low	34.7	Very low	131 Å²	131	144.6 Å²	144.6	67%	0.672	78%	0.777	S	S	*	*			trans	-102.4	101.3	171.2	-53.2	179.8	0	0	0	108.3	L400	I398-L400 HydrophobicContact CG2-CD2 4.07Å; I398-L400 HydrophobicContact CG2-CG 3.91Å
399	D	31.7	Very low	34.6	Very low	129 Å²	129	145.2 Å²	145.2	69%	0.69	78%	0.779	S	S	*	*			trans	-71.6	118.6	161	179.2	3.2	0	0	0	108.4	S401	D399-S401 PolarHBondContact OD1-N 3.08Å; D399-S401 PolarHBondContact OD1-OG 3.2Å
400	L	36.2	Very low	34.3	Very low	163 Å²	163	146.3 Å²	146.3	85%	0.853	78%	0.784	S	S	*	*			trans	-111.7	69.5	173.3	-72.4	170.1	0	0	0	109.1	I398	I398-L400 HydrophobicContact CG2-CD2 4.07Å; I398-L400 HydrophobicContact CG2-CG 3.91Å
401	S	31.5	Very low	34.1	Very low	72 Å²	72	144.5 Å²	144.5	50%	0.503	78%	0.777	S	S	.	*			trans	-108.6	122.9	161	57	0	0	0	0	110.8	D399	D399-S401 PolarHBondContact OD1-N 3.08Å; D399-S401 PolarHBondContact OD1-OG 3.2Å
402	N	34.6	Very low	34.3	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	77%	0.773	S	S	*	*			trans	103.8	133	156.7	-58.6	-36.4	0	0	0	121.3
403	S	35.3	Very low	34.5	Very low	98 Å²	98	141.5 Å²	141.5	69%	0.685	78%	0.78	S	S	*	*			trans	85.2	120.7	160.3	-142.4	0	0	0	0	114.5
404	V	38.1	Very low	35.1	Very low	130 Å²	130	140.6 Å²	140.6	79%	0.788	77%	0.77	S	S	*	*				-151.2	124.8	59	177.3	0	0	0	0	113.1
405	H	33.6	Very low	36.1	Very low	162 Å²	162	136.9 Å²	136.9	75%	0.75	76%	0.756	S	S	*	*			trans	17.2	114.6	143.1	-66.8	71.2	0	0	0	120.7
406	S	32.3	Very low	37.7	Very low	112 Å²	112	135 Å²	135	78%	0.783	75%	0.745	S	S	*	*				177.9	134.1	113.6	-83.6	0	0	0	0	113.2
407	S	36	Very low	39.1	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	74%	0.741	S	S	*	*			trans	79	87.6	152.1	-46.6	0	0	0	0	119.6
408	Q	29.8	Very low	41.3	Very low	188 Å²	188	128.1 Å²	128.1	88%	0.879	73%	0.729	S	S	*	*			trans	39.7	102.7	134.3	-62.7	177.6	4.4	0	0	118.2
409	I	35.7	Very low	43.4	Very low	149 Å²	149	123.4 Å²	123.4	76%	0.764	71%	0.705	S	S	*	*				-165.6	116	129.6	-83.4	135.9	0	0	0	106.2	C411	I409-C411 PolarHBondContact O-N 2.95Å
410	N	29.4	Very low	46.1	Very low	172 Å²	172	121.2 Å²	121.2	92%	0.92	70%	0.697	S	S	*	*			trans	-69.2	107.2	170.4	-77.8	-14.2	0	0	0	109.1
411	C	34.3	Very low	48.1	Very low	105 Å²	105	121.8 Å²	121.8	71%	0.709	70%	0.695	S	S	*	*			trans	-129.4	112.2	156.9	-90.8	0	0	0	0	107.8	I409 T413	I409-C411 PolarHBondContact O-N 2.95Å; C411-T413 PolarHBondContact O-N 2.95Å; C411-T413 VanDerWaalsContact O-N 3.16Å
412	T	40.9	Very low	50.7	Low	127 Å²	127	125.9 Å²	125.9	78%	0.779	71%	0.706	S	S	*	*			trans	-53.9	113	168.1	42	0	0	0	0	109.3	T414	T412-T414 VanDerWaalsContact C-N 3.3Å; T412-T414 PolarHBondContact O-N 3.31Å
413	T	38.5	Very low	53.1	Low	148 Å²	148	122.7 Å²	122.7	91%	0.908	69%	0.687	S	S	*	*			trans	-73.1	83.9	171.7	43.3	0	0	0	0	109.1	C411	C411-T413 PolarHBondContact O-N 2.95Å; C411-T413 VanDerWaalsContact O-N 3.16Å
414	T	52.7	Low	55.4	Low	87 Å²	87	122.2 Å²	122.2	53%	0.534	67%	0.674	S	S	.	*			trans	-86.9	134.2	157.8	49.3	0	0	0	0	107.7	T412	T412-T414 VanDerWaalsContact C-N 3.3Å; T412-T414 PolarHBondContact O-N 3.31Å
415	N	58.4	Low	57.7	Low	100 Å²	100	121.1 Å²	121.1	54%	0.535	66%	0.663	S	S	.	*			trans	-60.8	127.7	177.8	-142.2	-13.7	0	0	0	107.2	L417 D418	N415-L417 PolarHBondContact O-N 2.95Å; N415-D418 PolarHBondContact O-N 2.8Å
416	P	65.3	Low	60.2	Low	85 Å²	85	119.3 Å²	119.3	55%	0.552	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-61	-13	-174.3	19	-30.2	0	0	0	113.9	Q424	P416-Q424 PolarHBondContact O-NE2 3.12Å
417	L	61.1	Low	62.6	Low	141 Å²	141	118.8 Å²	118.8	74%	0.738	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-79.2	-16	175.1	-62.6	173.5	0	0	0	114.1	N415	N415-L417 PolarHBondContact O-N 2.95Å
418	D	76.6	Confident	64.8	Low	122 Å²	122	116.1 Å²	116.1	65%	0.652	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-91.3	-3.3	179.6	-64	-32.3	0	0	0	112.7	N415	N415-D418 PolarHBondContact O-N 2.8Å
419	L	80.1	Confident	67.3	Low	32 Å²	32	110.9 Å²	110.9	17%	0.168	60%	0.604	C	S	.	*	S	Bend	trans	-86.9	143.4	179.7	-67.6	166.7	0	0	0	110.6	E423 Q424 L427	L419-E423 HydrophobicContact CB-CB 4.02Å; L419-E423 HydrophobicContact CD2-CB 4Å; L419-Q424 HydrophobicContact CB-CG 3.68Å; L419-Q424 HydrophobicContact CD1-CG 4.49Å; L419-Q424 PolarHBondContact O-NE2 2.89Å; L419-L427 HydrophobicContact CD1-CD1 3.83Å
420	T	87.2	Confident	69.6	Low	84 Å²	84	110.2 Å²	110.2	52%	0.515	60%	0.598	S	S	.	*			trans	-62.3	156.6	170.2	58.4	0	0	0	0	111.1	E422 E423 Q424	T420-E422 PolarHBondContact O-N 3.27Å; T420-E423 PolarHBondContact N-OE2 3.36Å; T420-E423 PolarHBondContact O-N 2.89Å; T420-E423 VanDerWaalsContact OG1-CG 3.29Å; T420-E423 WeakPolarHBondContact OG1-CG 3.28Å; T420-E423 PolarHBondContact OG1-N 2.76Å; T420-E423 PolarHBondContact OG1-OE2 3.44Å; T420-Q424 WeakPolarHBondContact O-CG 3.42Å; T420-Q424 PolarHBondContact O-N 3.43Å
421	E	78	Confident	72	Confident	174 Å²	174	104.9 Å²	104.9	81%	0.813	58%	0.578	S	S	*	*	H	α-helix	trans	-53.7	-38.7	178.6	-175	-176.9	173.9	0	0	112	Q424 L425	E421-Q424 PolarHBondContact O-N 3.48Å; E421-L425 WeakPolarHBondContact O-CB 3.32Å; E421-L425 PolarHBondContact O-N 2.87Å
422	E	86.2	Confident	74.3	Confident	158 Å²	158	103.8 Å²	103.8	74%	0.738	57%	0.572	S	S	*	*	H	α-helix	trans	-66.5	-41.1	177.3	-174	167.5	-173	0	0	112.2	T420 L425 Q426	T420-E422 PolarHBondContact O-N 3.27Å; E422-L425 PolarHBondContact O-N 2.86Å; E422-Q426 WeakPolarHBondContact O-CB 3.33Å; E422-Q426 PolarHBondContact O-N 2.83Å
423	E	86	Confident	76.4	Confident	91 Å²	91	104.9 Å²	104.9	43%	0.425	57%	0.565	S	S	.	*	H	α-helix	trans	-68.9	-39.1	175.6	-75.3	170.7	142.7	0	0	112.4	L419 T420 L425 Q426 L427	L419-E423 HydrophobicContact CB-CB 4.02Å; L419-E423 HydrophobicContact CD2-CB 4Å; T420-E423 PolarHBondContact N-OE2 3.36Å; T420-E423 PolarHBondContact O-N 2.89Å; T420-E423 VanDerWaalsContact OG1-CG 3.29Å; T420-E423 WeakPolarHBondContact OG1-CG 3.28Å; T420-E423 PolarHBondContact OG1-N 2.76Å; T420-E423 PolarHBondContact OG1-OE2 3.44Å; E423-L425 VanDerWaalsContact C-N 3.32Å; E423-L425 PolarHBondContact O-N 2.92Å; E423-Q426 PolarHBondContact O-N 2.9Å; E423-L427 WeakPolarHBondContact O-CB 3.43Å; E423-L427 PolarHBondContact O-N 3Å
424	Q	83.1	Confident	78.3	Confident	88 Å²	88	103.6 Å²	103.6	41%	0.411	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-42.1	174.3	-68	-178.4	32.5	0	0	111	P416 L419 T420 E421 L427 A428	P416-Q424 PolarHBondContact O-NE2 3.12Å; L419-Q424 HydrophobicContact CB-CG 3.68Å; L419-Q424 HydrophobicContact CD1-CG 4.49Å; L419-Q424 PolarHBondContact O-NE2 2.89Å; T420-Q424 WeakPolarHBondContact O-CG 3.42Å; T420-Q424 PolarHBondContact O-N 3.43Å; E421-Q424 PolarHBondContact O-N 3.48Å; Q424-L427 PolarHBondContact O-N 3.32Å; Q424-A428 WeakPolarHBondContact O-CB 3.5Å; Q424-A428 PolarHBondContact O-N 2.88Å
425	L	86.5	Confident	79.4	Confident	107 Å²	107	105.4 Å²	105.4	56%	0.56	55%	0.55	S	S	*	.	H	α-helix	trans	-63.9	-43.6	175.6	-175.1	65.8	0	0	0	111.5	E421 E422 E423 A428 I429	E421-L425 WeakPolarHBondContact O-CB 3.32Å; E421-L425 PolarHBondContact O-N 2.87Å; E422-L425 PolarHBondContact O-N 2.86Å; E423-L425 VanDerWaalsContact C-N 3.32Å; E423-L425 PolarHBondContact O-N 2.92Å; L425-A428 PolarHBondContact O-N 3.34Å; L425-I429 HydrophobicContact CD1-CD1 4.47Å; L425-I429 HydrophobicContact CG-CD1 4.07Å; L425-I429 VanDerWaalsContact O-CG1 3.28Å; L425-I429 WeakPolarHBondContact O-CG1 3.2Å; L425-I429 PolarHBondContact O-N 3.37Å
426	Q	86.3	Confident	80.1	Confident	123 Å²	123	103.1 Å²	103.1	58%	0.575	55%	0.545	S	S	*	.	H	α-helix	trans	-63	-43.8	177.7	-163.1	73.7	2.3	0	0	111.6	E422 E423 A428 I429 E430	E422-Q426 WeakPolarHBondContact O-CB 3.33Å; E422-Q426 PolarHBondContact O-N 2.83Å; E423-Q426 PolarHBondContact O-N 2.9Å; Q426-A428 PolarHBondContact O-N 3.43Å; Q426-I429 PolarHBondContact O-N 3.4Å; Q426-E430 WeakPolarHBondContact O-CB 3.08Å; Q426-E430 PolarHBondContact O-N 3.02Å
427	L	82.9	Confident	80.5	Confident	101 Å²	101	106.8 Å²	106.8	53%	0.529	55%	0.552	S	S	.	*	H	α-helix	trans	-63.2	-39.4	175	-108.2	113	0	0	0	112.2	L419 E423 Q424 E430 A431	L419-L427 HydrophobicContact CD1-CD1 3.83Å; E423-L427 WeakPolarHBondContact O-CB 3.43Å; E423-L427 PolarHBondContact O-N 3Å; Q424-L427 PolarHBondContact O-N 3.32Å; L427-E430 PolarHBondContact O-N 3.24Å; L427-A431 VanDerWaalsContact O-CB 3.29Å; L427-A431 WeakPolarHBondContact O-CB 3.43Å; L427-A431 PolarHBondContact O-N 3.19Å
428	A	81.2	Confident	80.5	Confident	57 Å²	57	107.6 Å²	107.6	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-42.9	176	0	0	0	0	0	111.8	Q424 L425 Q426 A431 S432	Q424-A428 WeakPolarHBondContact O-CB 3.5Å; Q424-A428 PolarHBondContact O-N 2.88Å; L425-A428 PolarHBondContact O-N 3.34Å; Q426-A428 PolarHBondContact O-N 3.43Å; A428-A431 PolarHBondContact O-N 3.06Å; A428-S432 VanDerWaalsContact O-CB 3.31Å; A428-S432 WeakPolarHBondContact O-CB 3.3Å; A428-S432 PolarHBondContact O-N 2.81Å
429	I	84.2	Confident	79.5	Confident	77 Å²	77	108.2 Å²	108.2	40%	0.395	54%	0.544	S	S	.	.	H	α-helix	trans	-64	-41.8	175.8	-67.7	165.7	0	0	0	110.7	L425 Q426 S432 K433	L425-I429 HydrophobicContact CD1-CD1 4.47Å; L425-I429 HydrophobicContact CG-CD1 4.07Å; L425-I429 VanDerWaalsContact O-CG1 3.28Å; L425-I429 WeakPolarHBondContact O-CG1 3.2Å; L425-I429 PolarHBondContact O-N 3.37Å; Q426-I429 PolarHBondContact O-N 3.4Å; I429-S432 PolarHBondContact O-N 3.38Å; I429-K433 PolarHBondContact O-N 2.95Å
430	E	82.5	Confident	78.3	Confident	136 Å²	136	113 Å²	113	64%	0.636	57%	0.569	S	S	*	*	H	α-helix	trans	-66.8	-43.6	178.7	-168.2	178.3	174.2	0	0	112	Q426 L427 S432 K433 K434	Q426-E430 WeakPolarHBondContact O-CB 3.08Å; Q426-E430 PolarHBondContact O-N 3.02Å; L427-E430 PolarHBondContact O-N 3.24Å; E430-S432 VanDerWaalsContact C-N 3.32Å; E430-S432 PolarHBondContact O-N 3.2Å; E430-K433 PolarHBondContact O-N 3.27Å; E430-K434 PolarHBondContact O-N 3.2Å
431	A	80.3	Confident	76.6	Confident	60 Å²	60	112.3 Å²	112.3	50%	0.496	57%	0.568	S	S	.	*	H	α-helix	trans	-59.3	-44	174.2	0	0	0	0	0	111.3	L427 A428 K434 E435	L427-A431 VanDerWaalsContact O-CB 3.29Å; L427-A431 WeakPolarHBondContact O-CB 3.43Å; L427-A431 PolarHBondContact O-N 3.19Å; A428-A431 PolarHBondContact O-N 3.06Å; A431-K434 PolarHBondContact O-N 2.8Å; A431-E435 PolarHBondContact O-N 2.93Å
432	S	82.3	Confident	75	Confident	82 Å²	82	109.7 Å²	109.7	57%	0.573	56%	0.559	S	S	*	*	H	α-helix	trans	-64.6	-41.1	177.8	-154.8	0	0	0	0	112.2	A428 I429 E430 K434 E435 A436	A428-S432 VanDerWaalsContact O-CB 3.31Å; A428-S432 WeakPolarHBondContact O-CB 3.3Å; A428-S432 PolarHBondContact O-N 2.81Å; I429-S432 PolarHBondContact O-N 3.38Å; E430-S432 VanDerWaalsContact C-N 3.32Å; E430-S432 PolarHBondContact O-N 3.2Å; S432-K434 PolarHBondContact O-N 2.96Å; S432-E435 PolarHBondContact O-N 3.07Å; S432-A436 PolarHBondContact O-N 2.99Å
433	K	84.4	Confident	73	Confident	149 Å²	149	108.8 Å²	108.8	65%	0.648	56%	0.559	S	S	*	*	H	α-helix	trans	-63.5	-36.9	173.4	-88.3	-178.2	177.6	173.2	0	113.1	I429 E430 K437	I429-K433 PolarHBondContact O-N 2.95Å; E430-K433 PolarHBondContact O-N 3.27Å; K433-K437 PolarHBondContact O-N 3.02Å; K433-K437 VanDerWaalsContact O-N 3.13Å
434	K	80.2	Confident	71	Confident	122 Å²	122	112 Å²	112	53%	0.53	57%	0.574	S	S	.	*	H	α-helix	trans	-70.4	-36.7	178.8	-168.7	174.8	-178.4	176.1	0	111.5	E430 A431 S432 R438	E430-K434 PolarHBondContact O-N 3.2Å; A431-K434 PolarHBondContact O-N 2.8Å; S432-K434 PolarHBondContact O-N 2.96Å; K434-R438 WeakPolarHBondContact O-CG 3.21Å; K434-R438 PolarHBondContact O-N 3.38Å; K434-R438 VanDerWaalsContact O-N 3.17Å
435	E	74.2	Confident	69.2	Low	124 Å²	124	114.8 Å²	114.8	58%	0.579	59%	0.592	S	S	*	*	H	α-helix	trans	-71.7	-40.1	175.8	-167.4	150.7	-176.6	0	0	112	A431 S432 K437 R438 Q439	A431-E435 PolarHBondContact O-N 2.93Å; S432-E435 PolarHBondContact O-N 3.07Å; E435-K437 VanDerWaalsContact C-N 3.33Å; E435-K437 PolarHBondContact O-N 3.14Å; E435-R438 PolarHBondContact O-N 3.25Å; E435-R438 VanDerWaalsContact O-N 3.17Å; E435-Q439 PolarHBondContact O-N 3.05Å
436	A	74	Confident	66.8	Low	52 Å²	52	118.4 Å²	118.4	43%	0.43	61%	0.606	S	S	.	*	H	α-helix	trans	-61.4	-37.2	173.3	0	0	0	0	0	113	S432 L440	S432-A436 PolarHBondContact O-N 2.99Å; A436-L440 WeakPolarHBondContact O-CG 3.27Å; A436-L440 PolarHBondContact O-N 2.9Å
437	K	72.6	Confident	64.6	Low	162 Å²	162	119.4 Å²	119.4	70%	0.704	61%	0.614	S	S	*	*	H	α-helix	trans	-68.9	-35.3	174	-86.4	-177.1	175.7	-179	0	113.2	K433 E435 L440 S441	K433-K437 PolarHBondContact O-N 3.02Å; K433-K437 VanDerWaalsContact O-N 3.13Å; E435-K437 VanDerWaalsContact C-N 3.33Å; E435-K437 PolarHBondContact O-N 3.14Å; K437-L440 PolarHBondContact O-N 3.17Å; K437-S441 PolarHBondContact O-N 3.17Å; K437-S441 PolarHBondContact O-OG 3.37Å
438	R	62.2	Low	62.5	Low	159 Å²	159	119.8 Å²	119.8	60%	0.6	62%	0.62	S	S	*	*	H	α-helix	trans	-70.4	-30.5	176.3	-77.5	-179.1	171.5	-168.1	-4.3	112.7	K434 E435 L440 S441 N442	K434-R438 WeakPolarHBondContact O-CG 3.21Å; K434-R438 PolarHBondContact O-N 3.38Å; K434-R438 VanDerWaalsContact O-N 3.17Å; E435-R438 PolarHBondContact O-N 3.25Å; E435-R438 VanDerWaalsContact O-N 3.17Å; R438-L440 VanDerWaalsContact C-N 3.3Å; R438-S441 PolarHBondContact O-OG 3.38Å; R438-N442 PolarHBondContact O-ND2 3.47Å; R438-N442 PolarHBondContact O-OD1 3.4Å
439	Q	54.7	Low	60.7	Low	134 Å²	134	124.4 Å²	124.4	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-75.5	-18.9	174.2	-67.1	-164	19.8	0	0	113.4	E435	E435-Q439 PolarHBondContact O-N 3.05Å
440	L	55.4	Low	58.9	Low	133 Å²	133	125.9 Å²	125.9	70%	0.696	65%	0.649	S	S	*	*	H	α-helix	trans	-90.3	-20	176.9	-72.2	165.2	0	0	0	113.6	A436 K437 R438	A436-L440 WeakPolarHBondContact O-CG 3.27Å; A436-L440 PolarHBondContact O-N 2.9Å; K437-L440 PolarHBondContact O-N 3.17Å; R438-L440 VanDerWaalsContact C-N 3.3Å
441	S	50.9	Low	57	Low	69 Å²	69	126.3 Å²	126.3	48%	0.483	66%	0.656	S	S	.	*	S	Bend	trans	-97.2	-4	-179.4	63.7	0	0	0	0	115	K437 R438	K437-S441 PolarHBondContact O-N 3.17Å; K437-S441 PolarHBondContact O-OG 3.37Å; R438-S441 PolarHBondContact O-OG 3.38Å
442	N	46.1	Very low	55.6	Low	119 Å²	119	130.2 Å²	130.2	64%	0.636	67%	0.668	S	S	*	*	S	Bend	trans	-101.1	17.2	-173.8	-72.1	6	0	0	0	113.7	R438	R438-N442 PolarHBondContact O-ND2 3.47Å; R438-N442 PolarHBondContact O-OD1 3.4Å
443	N	43.2	Very low	53.8	Low	139 Å²	139	133.2 Å²	133.2	74%	0.743	68%	0.678	S	S	*	*	S	Bend	trans	-105.1	19.2	-179.3	-70.2	-28.2	0	0	0	113.4
444	E	44.8	Very low	52.2	Low	158 Å²	158	133.6 Å²	133.6	74%	0.738	69%	0.687	S	S	*	*			trans	-125.1	2.9	-169.7	-51.5	-168.8	-155.8	0	0	115.1
445	D	43.9	Very low	50.7	Low	148 Å²	148	134.9 Å²	134.9	79%	0.791	70%	0.7	S	S	*	*			trans	-101	100	177	-68.5	-38.3	0	0	0	111.6	I447	D445-I447 PolarHBondContact O-N 3.28Å
446	E	36.6	Very low	49.8	Very low	182 Å²	182	136.7 Å²	136.7	85%	0.85	71%	0.713	S	S	*	*			trans	-44.2	106.6	164	-174.5	176.9	-179.2	0	0	112.2
447	I	40.4	Very low	48.8	Very low	144 Å²	144	140.9 Å²	140.9	74%	0.738	73%	0.729	S	S	*	*			trans	-110.9	101.4	169.5	-52.8	176	0	0	0	107.7	D445 L449	D445-I447 PolarHBondContact O-N 3.28Å; I447-L449 PolarHBondContact O-N 3.34Å
448	V	38.7	Very low	47.6	Very low	109 Å²	109	140 Å²	140	66%	0.661	73%	0.731	S	S	*	*			trans	-60.3	111.8	168.5	175.1	0	0	0	0	108.2	T450	V448-T450 HydrophobicContact CG1-CG2 4.4Å
449	L	43	Very low	47.1	Very low	154 Å²	154	140 Å²	140	81%	0.806	74%	0.744	S	S	*	*			trans	-88	110.5	165.6	-66.7	174.1	0	0	0	107	I447	I447-L449 PolarHBondContact O-N 3.34Å
450	T	46.6	Very low	46.7	Very low	108 Å²	108	141.4 Å²	141.4	66%	0.663	76%	0.755	S	S	*	*			trans	-74.3	122.1	165	44	0	0	0	0	108.2	V448 D452	V448-T450 HydrophobicContact CG1-CG2 4.4Å; T450-D452 PolarHBondContact O-N 3.31Å
451	D	41.8	Very low	46.5	Very low	146 Å²	146	142.1 Å²	142.1	78%	0.781	76%	0.755	S	S	*	*			trans	-69.4	113	167.2	-63	-47.3	0	0	0	107.9
452	D	51.3	Low	46.2	Very low	141 Å²	141	148 Å²	148	75%	0.754	78%	0.775	S	S	*	*			trans	-111.1	105.2	165.5	-75.7	-40.8	0	0	0	107.1	T450	T450-D452 PolarHBondContact O-N 3.31Å
453	D	44.4	Very low	46.4	Very low	146 Å²	146	151 Å²	151	78%	0.781	78%	0.779	S	S	*	*			trans	-71.9	125	168.2	-64.5	-55.8	0	0	0	109.1
454	D	52.1	Low	46.7	Very low	157 Å²	157	152.3 Å²	152.3	84%	0.84	78%	0.782	S	S	*	*			trans	-131.7	104.5	162.2	-82.2	-41	0	0	0	108.6
455	D	47.4	Very low	46.5	Very low	148 Å²	148	151.9 Å²	151.9	79%	0.791	79%	0.785	S	S	*	*			trans	-67.8	135.1	165	-70.3	-55.6	0	0	0	109.8
456	D	55	Low	46.3	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	79%	0.785	S	S	*	*			trans	-142.2	98.1	160.7	-91	-38.9	0	0	0	110
457	D	53.5	Low	46.4	Very low	140 Å²	140	146.6 Å²	146.6	75%	0.749	78%	0.781	S	S	*	*			trans	-7.3	132.9	158.2	-62.8	-42.6	0	0	0	121.8
458	D	47.7	Very low	46.6	Very low	143 Å²	143	149.7 Å²	149.7	77%	0.765	79%	0.789	S	S	*	*			trans	12.9	132.7	133.4	-62.7	-33.8	0	0	0	120.6
459	D	51.3	Low	46.6	Very low	160 Å²	160	155.6 Å²	155.6	86%	0.856	80%	0.799	S	S	*	*				-172.4	101.4	129.2	-95.9	-27.7	0	0	0	111.2
460	D	46.3	Very low	46.5	Very low	163 Å²	163	154.2 Å²	154.2	87%	0.872	80%	0.803	S	S	*	*			trans	-91.3	127.7	164.8	-72.7	-43.2	0	0	0	109.3
461	E	52.5	Low	46.2	Very low	149 Å²	149	156.2 Å²	156.2	70%	0.696	81%	0.809	S	S	*	*			trans	-131.8	104.1	168.5	-79.8	-72.9	-166.1	0	0	111.6	Y463	E461-Y463 WeakPolarHBondContact OE2-CE2 3.45Å
462	E	44	Very low	46.2	Very low	191 Å²	191	155.2 Å²	155.2	89%	0.893	81%	0.809	S	S	*	*			trans	-77.6	124.8	161.2	-80.2	-172	153.5	0	0	110
463	Y	49.4	Very low	45.6	Very low	184 Å²	184	151.6 Å²	151.6	72%	0.722	81%	0.805	S	S	*	*			trans	-125.3	112.6	162.4	-92	-97.9	0	0	0	112.8	E461	E461-Y463 WeakPolarHBondContact OE2-CE2 3.45Å
464	M	50.8	Low	45.4	Very low	165 Å²	165	153 Å²	153	81%	0.813	81%	0.81	S	S	*	*			trans	91	93.4	135.4	-58.5	-62	-121.4	0	0	121
465	N	38.9	Very low	44.8	Very low	150 Å²	150	151.9 Å²	151.9	80%	0.802	80%	0.804	S	S	*	*			trans	-38.5	141.3	146.1	-145.7	-9.3	0	0	0	115.2
466	G	40.8	Very low	44.6	Very low	77 Å²	77	151.9 Å²	151.9	79%	0.794	80%	0.8	S	S	*	*			trans	-159.2	58.7	179	0	0	0	0	0	113.6
467	N	38.3	Very low	43.9	Very low	141 Å²	141	151 Å²	151	75%	0.754	79%	0.791	S	S	*	*			trans	-56	131.3	169.2	-101.9	2.6	0	0	0	112.5
468	K	44.5	Very low	43.2	Very low	210 Å²	210	151.3 Å²	151.3	91%	0.913	79%	0.787	S	S	*	*			trans	-160.2	122.3	132.3	-116.3	170.1	-174.1	173.1	0	113.3
469	R	38.2	Very low	42.7	Very low	232 Å²	232	155.2 Å²	155.2	88%	0.875	79%	0.791	S	S	*	*			trans	-69.4	146.7	171.6	-58.3	171.1	170.9	-145.6	-3.6	110.8
470	S	41.9	Very low	42.1	Very low	126 Å²	126	153.8 Å²	153.8	88%	0.881	78%	0.784	S	S	*	*				-169.7	142.9	127.7	39.7	0	0	0	0	111.4
471	D	40	Very low	41.9	Very low	149 Å²	149	153.9 Å²	153.9	80%	0.797	78%	0.778	S	S	*	*			trans	-85.7	179.8	-163.7	-158.6	-6.8	0	0	0	113.2
472	T	42.1	Very low	41.4	Very low	126 Å²	126	154.5 Å²	154.5	77%	0.773	78%	0.779	S	S	*	*			trans	82	119.5	171.2	74	0	0	0	0	115.1
473	G	37.9	Very low	41.3	Very low	65 Å²	65	152.2 Å²	152.2	67%	0.67	77%	0.768	S	S	*	*			cis	93.9	102.1	27	0	0	0	0	0	109.4
474	I	41.3	Very low	40.8	Very low	174 Å²	174	149.4 Å²	149.4	89%	0.892	77%	0.766	S	S	*	*			trans	173.8	134.3	141.5	-85.2	151.3	0	0	0	110.7
475	D	39.9	Very low	40.4	Very low	134 Å²	134	151 Å²	151	72%	0.717	77%	0.768	S	S	*	*			trans	-55	170.7	174.3	-83.9	-47	0	0	0	117.4
476	Q	41.4	Very low	40.5	Very low	148 Å²	148	152 Å²	152	69%	0.692	77%	0.768	S	S	*	*			trans	117.2	107.3	134.3	-89.2	140.9	49	0	0	118.9
477	Q	40.4	Very low	40.4	Very low	145 Å²	145	157.6 Å²	157.6	68%	0.678	77%	0.774	S	S	*	*				79	115.7	120.6	-72.2	178.6	13.8	0	0	120.7
478	Q	40.3	Very low	40.2	Very low	145 Å²	145	159.3 Å²	159.3	68%	0.678	78%	0.782	S	S	*	*				54.7	121.7	125.1	-51.4	174.5	-0.6	0	0	118.8
479	R	36.9	Very low	39.7	Very low	225 Å²	225	155 Å²	155	85%	0.849	78%	0.778	S	S	*	*				173.4	151.5	94.7	-96.8	-179	-93.3	-164.9	-6.2	112.7
480	D	38.1	Very low	39.5	Very low	131 Å²	131	151.1 Å²	151.1	70%	0.701	77%	0.769	S	S	*	*			trans	-60.2	150.6	179.3	-49.5	-77.7	0	0	0	115
481	H	41.2	Very low	39.1	Very low	164 Å²	164	150.3 Å²	150.3	76%	0.759	76%	0.755	S	S	*	*				157.8	130.1	103.5	-96	-50.1	0	0	0	114.5
482	K	43	Very low	38.9	Very low	162 Å²	162	149.4 Å²	149.4	70%	0.704	76%	0.756	S	S	*	*			trans	76.4	119.2	131.7	-84.3	-173.9	168.8	-176	0	122.7
483	Q	41.2	Very low	38.7	Very low	143 Å²	143	151.6 Å²	151.6	67%	0.668	75%	0.751	S	S	*	*				119.2	112	114.2	-84.9	-178.4	-49.3	0	0	119
484	D	40.7	Very low	38.5	Very low	125 Å²	125	156.7 Å²	156.7	67%	0.668	76%	0.757	S	S	*	*				66.5	106.6	129.5	-47.4	-18.9	0	0	0	120
485	K	41.4	Very low	38.4	Very low	200 Å²	200	154.8 Å²	154.8	87%	0.87	75%	0.749	S	S	*	*				176.8	136.6	102.5	-98.3	173.8	177.2	177.1	0	114.6
486	E	41	Very low	38.5	Very low	169 Å²	169	155.3 Å²	155.3	79%	0.79	75%	0.752	S	S	*	*			trans	-39.6	136.2	169.9	-60.9	159.3	156.7	0	0	116.4
487	Q	38.1	Very low	38.3	Very low	196 Å²	196	156.1 Å²	156.1	92%	0.916	76%	0.76	S	S	*	*				-171.5	134.8	115.5	-99.4	168.5	81.3	0	0	111.9
488	L	34.2	Very low	38.1	Very low	177 Å²	177	154.7 Å²	154.7	93%	0.927	77%	0.766	S	S	*	*			trans	-70.5	125.7	-171.8	-89.2	70.7	0	0	0	113.8
489	S	34.8	Very low	38	Very low	120 Å²	120	155.6 Å²	155.6	84%	0.839	77%	0.773	S	S	*	*			trans	-164.2	103.4	141.4	63.2	0	0	0	0	109.5
490	H	34	Very low	37.9	Very low	149 Å²	149	150.1 Å²	150.1	69%	0.69	76%	0.764	S	S	*	*			trans	-142.6	141.6	174.8	-158.5	-105.4	0	0	0	103.6
491	N	33.9	Very low	37.8	Very low	109 Å²	109	148.5 Å²	148.5	58%	0.583	76%	0.759	S	S	*	*			cis	-148.5	129.7	36.4	-44.1	-7.7	0	0	0	108.8	Y493	N491-Y493 HydrophobicContact CB-CD2 3.82Å; N491-Y493 HydrophobicContact CB-CE2 4.06Å
492	T	34.9	Very low	37.6	Very low	131 Å²	131	147.5 Å²	147.5	80%	0.804	76%	0.76	S	S	*	*			trans	-102.8	116.3	150.2	-56	0	0	0	0	104.5
493	Y	38.2	Very low	37.5	Very low	172 Å²	172	148.9 Å²	148.9	68%	0.675	76%	0.762	S	S	*	*			trans	-99.8	109.4	172.7	-97.4	-87.1	0	0	0	107.6	N491	N491-Y493 HydrophobicContact CB-CD2 3.82Å; N491-Y493 HydrophobicContact CB-CE2 4.06Å
494	E	33.3	Very low	37.4	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	77%	0.765	S	S	*	*			trans	-83.9	130.9	153.9	-62	-177.1	159	0	0	106.2
495	D	40.6	Very low	37.1	Very low	133 Å²	133	151.7 Å²	151.7	71%	0.711	78%	0.777	S	S	*	*			trans	-166.9	99.5	158.5	-87.8	-32.9	0	0	0	108.8
496	D	41.1	Very low	37.1	Very low	146 Å²	146	151.5 Å²	151.5	78%	0.781	78%	0.776	S	S	*	*			trans	42.8	142.7	131.3	-61.9	-27.7	0	0	0	124
497	D	36.5	Very low	36.7	Very low	164 Å²	164	149.5 Å²	149.5	88%	0.877	78%	0.778	S	S	*	*			trans	77.4	82.3	164.7	-63.3	-20.9	0	0	0	119.4
498	C	36.9	Very low	36.4	Very low	116 Å²	116	145.8 Å²	145.8	78%	0.784	77%	0.774	S	S	*	*			trans	-137.6	128.5	145	65.2	0	0	0	0	112.4	V500	C498-V500 PolarHBondContact O-N 3.41Å
499	I	38.1	Very low	36.6	Very low	163 Å²	163	142.7 Å²	142.7	84%	0.836	77%	0.767	S	S	*	*			trans	-68.5	116.2	177.9	-67.5	169.7	0	0	0	108.8	V501	I499-V501 PolarHBondContact O-N 3.23Å
500	V	34.1	Very low	36.9	Very low	110 Å²	110	141.8 Å²	141.8	67%	0.667	76%	0.76	S	S	*	*			trans	-73.1	109.1	176.6	178.8	0	0	0	0	109.8	C498	C498-V500 PolarHBondContact O-N 3.41Å
501	V	37.3	Very low	36.8	Very low	97 Å²	97	139.8 Å²	139.8	59%	0.588	76%	0.763	S	S	*	*			trans	-89.5	100.5	164.1	-171.1	0	0	0	0	108.1	I499 Y503	I499-V501 PolarHBondContact O-N 3.23Å; V501-Y503 HydrophobicContact CB-CE2 4.2Å; V501-Y503 HydrophobicContact CG1-CD2 4.42Å; V501-Y503 HydrophobicContact CG1-CE2 3.87Å; V501-Y503 PolarHBondContact O-N 3.31Å
502	N	36.3	Very low	36.8	Very low	144 Å²	144	144 Å²	144	77%	0.77	78%	0.777	S	S	*	*			trans	-71.5	112.9	173.9	-91.1	-20.3	0	0	0	110.4
503	Y	40	Very low	36.9	Very low	191 Å²	191	144.7 Å²	144.7	75%	0.749	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-91.2	131.5	168	-69.3	-83.2	0	0	0	110.8	V501 K505	V501-Y503 HydrophobicContact CB-CE2 4.2Å; V501-Y503 HydrophobicContact CG1-CD2 4.42Å; V501-Y503 HydrophobicContact CG1-CE2 3.87Å; V501-Y503 PolarHBondContact O-N 3.31Å; Y503-K505 PolarHBondContact O-N 3.09Å
504	P	40.2	Very low	36.8	Very low	113 Å²	113	140.9 Å²	140.9	73%	0.734	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-68.5	131.9	173.4	26.6	-31.2	0	0	0	110.9	K506	P504-K506 PolarHBondContact O-N 3.44Å
505	K	35.3	Very low	36.9	Very low	214 Å²	214	138.7 Å²	138.7	93%	0.93	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-51.1	123	174.5	-73.4	174.3	177.3	173.5	0	110.8	Y503	Y503-K505 PolarHBondContact O-N 3.09Å
506	K	39.6	Very low	36.7	Very low	196 Å²	196	138.7 Å²	138.7	85%	0.852	79%	0.788	S	S	*	*			trans	-120.6	137.5	164	-89.8	-175.8	176.7	179.5	0	110.8	P504	P504-K506 PolarHBondContact O-N 3.44Å
507	P	34.6	Very low	36.5	Very low	127 Å²	127	138.4 Å²	138.4	83%	0.825	79%	0.791	S	S	*	*			trans	-81.1	156.3	-179.7	33.2	-32.6	0	0	0	112.5
508	S	31	Very low	36.4	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	78%	0.782	S	S	*	*			trans	-65.9	139.1	-175.2	51.3	0	0	0	0	116.1
509	S	39.1	Very low	36.2	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	79%	0.787	S	S	*	*			trans	-170.9	124.2	135.9	60.8	0	0	0	0	114.4
510	S	39.1	Very low	36.1	Very low	101 Å²	101	139 Å²	139	71%	0.706	79%	0.788	S	S	*	*			trans	60.5	106.3	136.6	70.6	0	0	0	0	122.7
511	S	31.7	Very low	36.2	Very low	107 Å²	107	140.1 Å²	140.1	75%	0.748	80%	0.796	S	S	*	*				42.3	108.8	120.7	67.6	0	0	0	0	119.6
512	F	35.5	Very low	35.8	Very low	198 Å²	198	140 Å²	140	87%	0.868	81%	0.805	S	S	*	*			trans	-138.1	109.1	148.6	-134.3	-93.6	0	0	0	108.6
513	V	36.9	Very low	35.8	Very low	145 Å²	145	145 Å²	145	88%	0.879	81%	0.813	S	S	*	*			trans	-86.4	112	167.1	-88	0	0	0	0	107.8
514	S	34.8	Very low	35.7	Very low	93 Å²	93	147.1 Å²	147.1	65%	0.65	82%	0.82	S	S	*	*			trans	-106.6	109	169.7	-91.3	0	0	0	0	109	T516	S514-T516 PolarHBondContact O-N 3.16Å
515	S	35.6	Very low	35.4	Very low	125 Å²	125	147.8 Å²	147.8	87%	0.874	82%	0.824	S	S	*	*			trans	-75.3	112.5	162.6	-62.1	0	0	0	0	109.1
516	T	36.7	Very low	35.5	Very low	134 Å²	134	145.8 Å²	145.8	82%	0.822	82%	0.823	S	S	*	*			trans	-89.2	118.2	169.4	17.9	0	0	0	0	110	S514	S514-T516 PolarHBondContact O-N 3.16Å
517	T	37.2	Very low	35.4	Very low	140 Å²	140	147.8 Å²	147.8	86%	0.859	83%	0.825	S	S	*	*			trans	-129.8	114.8	151.6	19.9	0	0	0	0	107.4
518	A	35.1	Very low	35.4	Very low	81 Å²	81	147.3 Å²	147.3	67%	0.669	82%	0.822	S	S	*	*			trans	-107.9	130.3	-179	0	0	0	0	0	110.1
519	F	30.9	Very low	35.9	Very low	203 Å²	203	148 Å²	148	89%	0.89	82%	0.823	S	S	*	*			trans	33.5	110.8	152.6	-52.2	-74.8	0	0	0	121
520	I	36.1	Very low	35.9	Very low	170 Å²	170	152 Å²	152	87%	0.872	83%	0.83	S	S	*	*			trans	-135.2	142.7	135.9	-60.6	-176.4	0	0	0	108.9
521	T	36.7	Very low	35.5	Very low	134 Å²	134	156.2 Å²	156.2	82%	0.822	84%	0.835	S	S	*	*			trans	-62.4	150.9	-165	35.7	0	0	0	0	117.8
522	A	28.7	Very low	35.7	Very low	94 Å²	94	159.7 Å²	159.7	78%	0.777	85%	0.845	S	S	*	*			trans	-42.4	136.8	174.8	0	0	0	0	0	117.6
523	R	37.4	Very low	35.5	Very low	250 Å²	250	156.2 Å²	156.2	94%	0.943	84%	0.835	S	S	*	*			trans	-154.3	110.8	134.2	-69.2	-159	174.1	168.7	-2.1	112.6
524	R	37.4	Very low	35.3	Very low	235 Å²	235	157.9 Å²	157.9	89%	0.887	83%	0.833	S	S	*	*			trans	32.1	123.6	148.1	-133.6	175	-163.2	169.6	3.9	120.9
525	P	33.6	Very low	35.3	Very low	128 Å²	128	158.6 Å²	158.6	83%	0.831	84%	0.838	S	S	*	*			trans	-80.4	136.6	170	-3.4	21.1	0	0	0	112.5
526	L	37.7	Very low	35.2	Very low	171 Å²	171	158.3 Å²	158.3	90%	0.895	83%	0.832	S	S	*	*			trans	-105.2	144.7	166.6	-74.6	168.7	0	0	0	110
527	R	36.7	Very low	35	Very low	239 Å²	239	156.2 Å²	156.2	90%	0.902	82%	0.822	S	S	*	*			trans	-44.2	152.4	-169.5	-82.9	174.3	179.8	155.4	-0.3	117.7
528	P	35.1	Very low	34.9	Very low	117 Å²	117	157.2 Å²	157.2	76%	0.76	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-80.3	144.8	164.4	33.5	-30	0	0	0	111.5
529	P	41	Very low	34.8	Very low	132 Å²	132	160.7 Å²	160.7	86%	0.857	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-84	152.3	170.9	33.5	-29.9	0	0	0	112
530	E	39.4	Very low	34.9	Very low	195 Å²	195	158.1 Å²	158.1	91%	0.911	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.1	156.4	-166.1	-64	172.6	141	0	0	115.3
531	K	30.6	Very low	34.9	Very low	190 Å²	190	158.4 Å²	158.4	83%	0.826	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-60.6	134.1	171.5	-66.1	175.3	175.8	-178.6	0	111.5
532	L	36.5	Very low	34.8	Very low	180 Å²	180	160.1 Å²	160.1	94%	0.942	82%	0.824	S	S	*	*			trans	-121.8	121.1	154.5	-84.6	169.5	0	0	0	109.2
533	N	31.5	Very low	35.8	Very low	125 Å²	125	158.3 Å²	158.3	67%	0.668	81%	0.806	S	S	*	*			trans	-90.1	157.4	-178.5	-60.1	-15.1	0	0	0	111.1
534	E	32.8	Very low	36.6	Very low	179 Å²	179	153.3 Å²	153.3	84%	0.836	80%	0.797	S	S	*	*			trans	68.1	114.5	150.1	-75.4	173.4	154.4	0	0	118.9
535	S	34.6	Very low	37.8	Very low	109 Å²	109	144.9 Å²	144.9	76%	0.762	77%	0.769	S	S	*	*				-179.5	150	91.1	45	0	0	0	0	112.8
536	T	33.3	Very low	39.7	Very low	119 Å²	119	141.2 Å²	141.2	73%	0.73	74%	0.743	S	S	*	*			trans	94.5	90.2	149.9	-33.8	0	0	0	0	117.9
537	S	32.4	Very low	41.6	Very low	90 Å²	90	136.8 Å²	136.8	63%	0.629	72%	0.722	S	S	*	*			trans	13	121.1	132.1	59.1	0	0	0	0	117.8
538	N	36	Very low	43.9	Very low	161 Å²	161	132.8 Å²	132.8	86%	0.861	71%	0.714	S	S	*	*				-159.7	130	118.8	-84.9	-35.8	0	0	0	109.1
539	N	32.3	Very low	46.4	Very low	153 Å²	153	127.8 Å²	127.8	82%	0.818	68%	0.681	S	S	*	*			trans	-62.9	129.1	175.2	-61.9	-54.7	0	0	0	109.1
540	D	33.1	Very low	48.6	Very low	150 Å²	150	124.7 Å²	124.7	80%	0.802	66%	0.661	S	S	*	*	S	Bend	trans	-176.5	115.2	137	-88.7	-29.8	0	0	0	108.6	K542	D540-K542 PolarHBondContact O-N 3.23Å
541	L	36.8	Very low	50.9	Low	175 Å²	175	120.3 Å²	120.3	92%	0.916	65%	0.648	S	S	*	*			trans	53.9	55.8	165.3	-62.2	161.2	0	0	0	116.2	S543	L541-S543 PolarHBondContact O-N 3.24Å
542	K	35	Very low	53.7	Low	170 Å²	170	111.9 Å²	111.9	74%	0.739	61%	0.612	S	S	*	*			trans	-81.7	104.9	169.7	-112.6	178.8	-178.1	-178	0	109.9	D540 D544 I545	D540-K542 PolarHBondContact O-N 3.23Å; K542-D544 PolarHBondContact O-N 3.5Å; K542-I545 HydrophobicContact CD-CD1 4.16Å; K542-I545 HydrophobicContact CG-CD1 4.23Å
543	S	48.4	Very low	56	Low	57 Å²	57	105.4 Å²	105.4	40%	0.399	59%	0.585	S	S	.	*			trans	-47.6	128.9	151	44.6	0	0	0	0	108.1	L541 I545	L541-S543 PolarHBondContact O-N 3.24Å; S543-I545 WeakPolarHBondContact O-CG1 3.46Å; S543-I545 PolarHBondContact O-N 3.37Å
544	D	53.8	Low	58.4	Low	144 Å²	144	105.6 Å²	105.6	77%	0.77	59%	0.593	S	S	*	*			trans	-49.2	102.5	179.8	-73.5	-43.7	0	0	0	110	K542 L546	K542-D544 PolarHBondContact O-N 3.5Å; D544-L546 PolarHBondContact O-N 3.13Å
545	I	63	Low	60.8	Low	59 Å²	59	101.3 Å²	101.3	30%	0.303	60%	0.597	S	S	.	*			trans	-73.8	101.2	-177.9	-60.5	-177.2	0	0	0	106.7	K542 S543 T547 Y590	K542-I545 HydrophobicContact CD-CD1 4.16Å; K542-I545 HydrophobicContact CG-CD1 4.23Å; S543-I545 WeakPolarHBondContact O-CG1 3.46Å; S543-I545 PolarHBondContact O-N 3.37Å; I545-T547 PolarHBondContact O-N 3.39Å; I545-Y590 HydrophobicContact CG2-CD2 3.86Å; I545-Y590 HydrophobicContact CG2-CG 4.11Å
546	L	73.1	Confident	63.3	Low	51 Å²	51	101 Å²	101	27%	0.267	58%	0.583	S	S	.	*			trans	-68	111.9	176.5	-73.1	172.2	0	0	0	110.1	D544 E548 D583 Y587	D544-L546 PolarHBondContact O-N 3.13Å; L546-E548 VanDerWaalsContact C-N 3.35Å; L546-D583 HydrophobicContact CD1-CB 3.55Å; L546-Y587 WeakPolarHBondContact O-CA 3.05Å
547	T	78.6	Confident	65.9	Low	77 Å²	77	98 Å²	98	47%	0.472	57%	0.57	S	S	.	*	S	Bend	trans	-74	-29.4	176.5	52.5	0	0	0	0	112.6	I545 Y590	I545-T547 PolarHBondContact O-N 3.39Å; T547-Y590 HydrophobicContact CG2-CD1 4.33Å; T547-Y590 HydrophobicContact CG2-CD2 4.03Å; T547-Y590 HydrophobicContact CG2-CE1 3.98Å; T547-Y590 HydrophobicContact CG2-CE2 3.66Å; T547-Y590 HydrophobicContact CG2-CG 4.35Å
548	E	84.1	Confident	68.7	Low	156 Å²	156	95.9 Å²	95.9	73%	0.729	55%	0.554	S	S	*	*	S	Bend	trans	-137.7	146.9	178.8	-67.6	-173.2	175.4	0	0	109.6	L546	L546-E548 VanDerWaalsContact C-N 3.35Å
549	L	88.6	Confident	71.4	Confident	11 Å²	11	88.5 Å²	88.5	6%	0.058	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-81.2	136.9	175.9	-68.8	170.1	0	0	0	109.9	T551 F563 L575 L579 L584 Y587	L549-T551 PolarHBondContact O-N 2.85Å; L549-F563 HydrophobicContact CD1-CE2 3.74Å; L549-F563 HydrophobicContact CD1-CZ 4.23Å; L549-L575 HydrophobicContact CB-CD2 3.58Å; L549-L575 HydrophobicContact CD1-CD1 4.27Å; L549-L575 HydrophobicContact CD1-CD2 3.87Å; L549-L575 HydrophobicContact CG-CD2 4.25Å; L549-L579 HydrophobicContact CD2-CD2 4.2Å; L549-L584 HydrophobicContact CD1-CD2 3.85Å; L549-L584 HydrophobicContact CD2-CD2 3.96Å; L549-Y587 HydrophobicContact CD1-CD1 3.68Å; L549-Y587 HydrophobicContact CD1-CD2 4.36Å; L549-Y587 HydrophobicContact CD1-CE1 3.87Å; L549-Y587 HydrophobicContact CD1-CG 3.92Å; L549-Y587 HydrophobicContact CD2-CD1 4.33Å; L549-Y587 HydrophobicContact CD2-CD2 4.26Å; L549-Y587 HydrophobicContact CD2-CG 3.82Å; L549-Y587 HydrophobicContact CG-CD1 3.91Å; L549-Y587 HydrophobicContact CG-CD2 3.73Å; L549-Y587 HydrophobicContact CG-CE1 4.29Å; L549-Y587 HydrophobicContact CG-CE2 4.12Å; L549-Y587 HydrophobicContact CG-CG 3.59Å
550	P	87.4	Confident	74.3	Confident	67 Å²	67	85.1 Å²	85.1	44%	0.435	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-64	121.4	179.9	26.5	-34	0	0	0	110.4	L579	P550-L579 HydrophobicContact CG-CD1 3.51Å
551	T	87	Confident	77.2	Confident	104 Å²	104	78 Å²	78	64%	0.638	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-88.8	128.4	177.6	-55.2	0	0	0	0	109.3	L549	L549-T551 PolarHBondContact O-N 2.85Å
552	P	89.6	Confident	79.9	Confident	12 Å²	12	71.5 Å²	71.5	8%	0.078	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-61.3	145.3	179.4	-23.1	32.7	0	0	0	113	E556 V558 R574 H576	P552-E556 WeakPolarHBondContact CA-OE2 3.45Å; P552-E556 HydrophobicContact CB-CB 4.06Å; P552-V558 HydrophobicContact CB-CG2 3.9Å; P552-V558 HydrophobicContact CG-CG2 4.05Å; P552-R574 WeakPolarHBondContact CD-O 3.46Å; P552-H576 HydrophobicContact CG-CB 4.15Å
553	A	84.7	Confident	82.8	Confident	45 Å²	45	63.4 Å²	63.4	37%	0.372	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-69.8	156.9	173.6	0	0	0	0	0	111.5	G555 E556	A553-G555 PolarHBondContact O-N 2.77Å; A553-G555 VanDerWaalsContact O-N 3.14Å; A553-E556 HydrophobicContact CB-CG 4.15Å; A553-E556 PolarHBondContact N-OE2 3.19Å; A553-E556 WeakPolarHBondContact O-CB 3.4Å; A553-E556 PolarHBondContact O-N 2.9Å; A553-E556 VanDerWaalsContact O-N 3.07Å
554	P	81.4	Confident	84.9	Confident	128 Å²	128	64.1 Å²	64.1	83%	0.831	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	120.4	173.9	-22.6	33	0	0	0	111.2
555	G	82.9	Confident	86.8	Confident	89 Å²	89	57.8 Å²	57.8	92%	0.918	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-12	-178.5	0	0	0	0	0	115.3	A553	A553-G555 PolarHBondContact O-N 2.77Å; A553-G555 VanDerWaalsContact O-N 3.14Å
556	E	87.2	Confident	88.1	Confident	103 Å²	103	57.8 Å²	57.8	48%	0.481	35%	0.35	S	S	.	.	S	Bend	trans	-76.3	162.8	171.3	-67.5	-179.1	166.5	0	0	111.6	P552 A553	P552-E556 WeakPolarHBondContact CA-OE2 3.45Å; P552-E556 HydrophobicContact CB-CB 4.06Å; A553-E556 HydrophobicContact CB-CG 4.15Å; A553-E556 PolarHBondContact N-OE2 3.19Å; A553-E556 WeakPolarHBondContact O-CB 3.4Å; A553-E556 PolarHBondContact O-N 2.9Å; A553-E556 VanDerWaalsContact O-N 3.07Å
557	A	88.8	Confident	88.8	Confident	56 Å²	56	59.5 Å²	59.5	46%	0.463	36%	0.359	S	S	.	.			trans	-66.2	137.2	175.2	0	0	0	0	0	110	H576 P577	A557-H576 PolarHBondContact O-CD2 3.45Å; A557-H576 VanDerWaalsContact O-CD2 3.27Å; A557-P577 VanDerWaalsContact C-CD 3.5Å; A557-P577 HydrophobicContact CB-CG 3.78Å; A557-P577 WeakPolarHBondContact O-CD 3.4Å
558	V	91.9	Very high	89.1	Confident	46 Å²	46	58.6 Å²	58.6	28%	0.279	37%	0.366	S	S	.	.			trans	-129.1	133.3	-175.7	179	0	0	0	0	110.4	P552 R574	P552-V558 HydrophobicContact CB-CG2 3.9Å; P552-V558 HydrophobicContact CG-CG2 4.05Å; V558-R574 HydrophobicContact CG1-CB 4.02Å; V558-R574 HydrophobicContact CG1-CG 4.31Å
559	I	92.4	Very high	89.3	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.9	160.8	-168.3	173.7	0	0	0	108.6	L561 L575 P577 L618 L623	I559-L561 HydrophobicContact CD1-CD2 3.88Å; I559-L561 HydrophobicContact CD1-CG 4.38Å; I559-L561 HydrophobicContact CG1-CD2 3.89Å; I559-L561 HydrophobicContact CG1-CG 4.17Å; I559-L575 HydrophobicContact CG2-CB 4.01Å; I559-L575 WeakPolarHBondContact CG2-O 3.49Å; I559-L575 PolarHBondContact N-O 3.26Å; I559-L575 PolarHBondContact O-N 3.5Å; I559-P577 HydrophobicContact CB-CG 4.44Å; I559-L618 HydrophobicContact CG2-CD1 3.79Å; I559-L623 HydrophobicContact CD1-CB 3.84Å; I559-L623 VanDerWaalsContact CD1-O 3.25Å; I559-L623 WeakPolarHBondContact CD1-O 3.48Å
560	E	92.4	Very high	89.5	Confident	82 Å²	82	62.4 Å²	62.4	38%	0.383	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.7	177.5	-174.6	-176.5	-177.1	0	0	108.7	V572 H573 R574 T625 K626	E560-V572 HydrophobicContact CG-CG1 3.46Å; E560-V572 VanDerWaalsContact CG-CG1 3.46Å; E560-V572 VanDerWaalsContact OE1-CG1 3.3Å; E560-V572 WeakPolarHBondContact OE1-CG1 3.44Å; E560-H573 WeakPolarHBondContact CA-O 3.5Å; E560-R574 HydrophobicContact CG-CG 4.49Å; E560-T625 HydrophobicContact CB-CG2 3.97Å; E560-K626 WeakPolarHBondContact O-CA 3.31Å; E560-K626 PolarHBondContact O-N 3.04Å
561	L	93.8	Very high	89.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	139.9	-176.4	-63.2	-177.9	0	0	0	110.9	I559 F563 V572 H573 L575 L618 L623 C624 D627 L629	I559-L561 HydrophobicContact CD1-CD2 3.88Å; I559-L561 HydrophobicContact CD1-CG 4.38Å; I559-L561 HydrophobicContact CG1-CD2 3.89Å; I559-L561 HydrophobicContact CG1-CG 4.17Å; L561-F563 HydrophobicContact CB-CD1 4.34Å; L561-F563 HydrophobicContact CB-CE1 3.72Å; L561-F563 HydrophobicContact CB-CZ 4.36Å; L561-F563 HydrophobicContact CD1-CE1 4.15Å; L561-V572 WeakPolarHBondContact O-CA 3.43Å; L561-H573 PolarHBondContact N-O 2.94Å; L561-H573 PolarHBondContact O-N 2.69Å; L561-L575 HydrophobicContact CD1-CD1 4.17Å; L561-L618 HydrophobicContact CD1-CD1 4.1Å; L561-L623 HydrophobicContact CD1-CD1 3.97Å; L561-L623 HydrophobicContact CD2-CB 4.5Å; L561-C624 WeakPolarHBondContact CD2-O 2.78Å; L561-D627 HydrophobicContact CD2-CB 3.86Å; L561-L629 HydrophobicContact CD1-CD1 4.19Å
562	L	93.8	Very high	90	Very high	40 Å²	40	60.1 Å²	60.1	21%	0.209	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.6	172.4	179.1	70.7	0	0	0	109.6	R570 E571 V572 D627 T628 L629	L562-R570 HydrophobicContact CD1-CB 4.14Å; L562-E571 CarbonylContact C-O 3.47Å; L562-V572 HydrophobicContact CD1-CG2 3.51Å; L562-D627 PolarHBondContact N-O 3.33Å; L562-T628 HydrophobicContact CB-CG2 4.46Å; L562-T628 HydrophobicContact CD2-CG2 3.99Å; L562-T628 HydrophobicContact CG-CG2 4.29Å; L562-T628 CarbonylContact O-C 3.58Å; L562-T628 WeakPolarHBondContact O-CA 3.46Å; L562-L629 PolarHBondContact O-N 3.23Å
563	F	95.2	Very high	90.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.8	173.1	-57.6	-24.1	0	0	0	110.3	L549 L561 R570 E571 H573 L575 L584 F588 L629 I631	L549-F563 HydrophobicContact CD1-CE2 3.74Å; L549-F563 HydrophobicContact CD1-CZ 4.23Å; L561-F563 HydrophobicContact CB-CD1 4.34Å; L561-F563 HydrophobicContact CB-CE1 3.72Å; L561-F563 HydrophobicContact CB-CZ 4.36Å; L561-F563 HydrophobicContact CD1-CE1 4.15Å; F563-R570 CarbonylContact O-C 3.59Å; F563-R570 VanDerWaalsContact O-CA 3.29Å; F563-R570 WeakPolarHBondContact O-CA 3.34Å; F563-E571 PolarHBondContact N-O 2.79Å; F563-E571 PolarHBondContact O-N 3.16Å; F563-H573 HydrophobicContact CD2-CB 4.43Å; F563-H573 AromaticContact CD2-CD2 3.22Å; F563-H573 WeakPolarHBondContact CD2-CD2 3.3Å; F563-H573 AromaticContact CD2-CG 3.95Å; F563-H573 AromaticContact CD2-NE2 3.82Å; F563-H573 HydrophobicContact CE2-CB 3.85Å; F563-H573 AromaticContact CE2-CD2 3.4Å; F563-H573 VanDerWaalsContact CE2-CD2 3.4Å; F563-H573 WeakPolarHBondContact CE2-CD2 3.16Å; F563-H573 AromaticContact CE2-CG 3.62Å; F563-H573 HydrophobicContact CZ-CB 4.23Å; F563-L575 HydrophobicContact CZ-CD1 3.93Å; F563-L584 HydrophobicContact CE2-CD2 4.46Å; F563-L584 HydrophobicContact CZ-CD2 3.84Å; F563-F588 HydrophobicContact CB-CZ 4.34Å; F563-F588 HydrophobicContact CD1-CZ 4.19Å; F563-F588 HydrophobicContact CD2-CE1 4.03Å; F563-F588 AromaticContact CD2-CZ 3.55Å; F563-F588 HydrophobicContact CD2-CZ 3.55Å; F563-F588 HydrophobicContact CE1-CZ 4.38Å; F563-F588 AromaticContact CE2-CZ 3.77Å; F563-F588 HydrophobicContact CE2-CZ 3.77Å; F563-F588 HydrophobicContact CG-CE1 4.37Å; F563-F588 AromaticContact CG-CZ 3.77Å; F563-F588 HydrophobicContact CG-CZ 3.77Å; F563-F588 HydrophobicContact CZ-CZ 4.17Å; F563-L629 CarbonylContact C-O 3.59Å; F563-L629 WeakPolarHBondContact CA-O 3.42Å; F563-L629 HydrophobicContact CD1-CB 4Å; F563-L629 HydrophobicContact CD1-CD1 4.12Å; F563-L629 HydrophobicContact CD1-CG 4.27Å; F563-L629 HydrophobicContact CE1-CB 4.44Å; F563-L629 HydrophobicContact CE1-CD1 3.7Å; F563-L629 HydrophobicContact CE1-CG 4.26Å; F563-I631 HydrophobicContact CB-CD1 4.02Å
564	R	93.6	Very high	90.5	Very high	72 Å²	72	65.5 Å²	65.5	27%	0.272	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	110.2	169.9	-74.9	176.7	176.1	-112.4	7.3	108.5	R570 T628 L629 F630 I631	R564-R570 HydrophobicContact CG-CG 4.19Å; R564-R570 VanDerWaalsContact CZ-CZ 3.42Å; R564-R570 VanDerWaalsContact NH1-NH2 3.11Å; R564-R570 VanDerWaalsContact NH2-CZ 3.33Å; R564-T628 HydrophobicContact CG-CG2 3.95Å; R564-L629 PolarHBondContact N-O 2.87Å; R564-F630 HydrophobicContact CB-CD1 3.99Å; R564-F630 HydrophobicContact CB-CE1 4.37Å; R564-F630 HydrophobicContact CB-CG 4.39Å; R564-F630 VanDerWaalsContact CD-CZ 3.46Å; R564-F630 HydrophobicContact CG-CD1 4.47Å; R564-F630 HydrophobicContact CG-CE1 4.38Å; R564-I631 WeakPolarHBondContact O-CD1 3.37Å; R564-I631 PolarHBondContact O-N 3.05Å
565	L	93.6	Very high	91.2	Very high	10 Å²	10	59.4 Å²	59.4	5%	0.052	33%	0.332	C	S	.	.			trans	-86.2	154.2	-176.6	-62.7	176	0	0	0	110.8	D567 G568 N569 E571 F588 Y593 I631	L565-D567 WeakPolarHBondContact CB-OD1 3.38Å; L565-D567 PolarHBondContact O-N 2.91Å; L565-G568 PolarHBondContact O-N 2.94Å; L565-N569 HydrophobicContact CD1-CB 4.23Å; L565-N569 PolarHBondContact N-O 2.9Å; L565-E571 HydrophobicContact CD1-CG 4.23Å; L565-F588 HydrophobicContact CD2-CD1 4.19Å; L565-F588 HydrophobicContact CD2-CE1 3.81Å; L565-Y593 HydrophobicContact CB-CE2 4.41Å; L565-Y593 HydrophobicContact CD1-CE2 4.43Å; L565-Y593 HydrophobicContact CD2-CD2 4.17Å; L565-Y593 HydrophobicContact CD2-CE2 3.76Å; L565-Y593 HydrophobicContact CG-CE2 4.42Å; L565-I631 HydrophobicContact CD2-CD1 4.07Å; L565-I631 HydrophobicContact CD2-CG1 4.27Å
566	P	90.3	Very high	91.7	Very high	60 Å²	60	57.8 Å²	57.8	39%	0.39	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.7	176.9	-26.1	32.7	0	0	0	114.8	G568 Y593 Y598 I631	P566-G568 PolarHBondContact O-N 3.31Å; P566-Y593 HydrophobicContact CB-CD1 4.47Å; P566-Y593 HydrophobicContact CB-CE1 3.92Å; P566-Y593 VanDerWaalsContact CD-CE1 3.44Å; P566-Y593 HydrophobicContact CG-CD1 3.63Å; P566-Y593 HydrophobicContact CG-CE1 3.47Å; P566-Y593 VanDerWaalsContact CG-CE1 3.47Å; P566-Y593 HydrophobicContact CG-CG 4.49Å; P566-Y598 HydrophobicContact CB-CE1 4.02Å; P566-Y598 HydrophobicContact CG-CD1 3.71Å; P566-Y598 HydrophobicContact CG-CE1 3.51Å; P566-I631 VanDerWaalsContact CD-O 3.3Å; P566-I631 WeakPolarHBondContact CD-O 3.48Å; P566-I631 HydrophobicContact CG-CB 4.44Å; P566-I631 HydrophobicContact CG-CG2 3.97Å; P566-I631 VanDerWaalsContact CG-O 3.27Å; P566-I631 WeakPolarHBondContact CG-O 3.22Å
567	D	87.9	Confident	92	Very high	86 Å²	86	53.9 Å²	53.9	46%	0.46	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-0.9	175.4	64.4	0.7	0	0	0	113.4	L565 N569 Y593	L565-D567 WeakPolarHBondContact CB-OD1 3.38Å; L565-D567 PolarHBondContact O-N 2.91Å; D567-N569 VanDerWaalsContact C-N 3.29Å; D567-N569 VanDerWaalsContact CG-ND2 3.27Å; D567-N569 WeakPolarHBondContact OD1-CB 3.42Å; D567-N569 PolarHBondContact OD1-N 2.87Å; D567-N569 PolarHBondContact OD2-ND2 2.99Å; D567-Y593 PolarHBondContact OD2-OH 3.43Å
568	G	85.5	Confident	92.2	Very high	59 Å²	59	55.7 Å²	55.7	61%	0.608	29%	0.29	S	S	*	.	S	Bend	trans	86.5	-7	-177.6	0	0	0	0	0	114	L565 P566	L565-G568 PolarHBondContact O-N 2.94Å; P566-G568 PolarHBondContact O-N 3.31Å
569	N	88.1	Confident	92.3	Very high	92 Å²	92	54 Å²	54	49%	0.492	28%	0.279	S	S	.	.			trans	-70.4	150.1	178.2	-69.3	-37.2	0	0	0	111.3	L565 D567	L565-N569 HydrophobicContact CD1-CB 4.23Å; L565-N569 PolarHBondContact N-O 2.9Å; D567-N569 VanDerWaalsContact C-N 3.29Å; D567-N569 VanDerWaalsContact CG-ND2 3.27Å; D567-N569 WeakPolarHBondContact OD1-CB 3.42Å; D567-N569 PolarHBondContact OD1-N 2.87Å; D567-N569 PolarHBondContact OD2-ND2 2.99Å
570	R	91.2	Very high	92.4	Very high	155 Å²	155	58.5 Å²	58.5	59%	0.585	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.3	178.2	-53.9	-170.5	-172.1	169.4	4.9	109.2	L562 F563 R564	L562-R570 HydrophobicContact CD1-CB 4.14Å; F563-R570 CarbonylContact O-C 3.59Å; F563-R570 VanDerWaalsContact O-CA 3.29Å; F563-R570 WeakPolarHBondContact O-CA 3.34Å; R564-R570 HydrophobicContact CG-CG 4.19Å; R564-R570 VanDerWaalsContact CZ-CZ 3.42Å; R564-R570 VanDerWaalsContact NH1-NH2 3.11Å; R564-R570 VanDerWaalsContact NH2-CZ 3.33Å
571	E	91.8	Very high	92.5	Very high	40 Å²	40	54.6 Å²	54.6	19%	0.187	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.1	-177.9	-58.4	-172.9	171.8	0	0	110.2	L562 F563 L565 H573 R591	L562-E571 CarbonylContact C-O 3.47Å; F563-E571 PolarHBondContact N-O 2.79Å; F563-E571 PolarHBondContact O-N 3.16Å; L565-E571 HydrophobicContact CD1-CG 4.23Å; E571-H573 IonicContact OE2-CE1 2.8Å; E571-H573 IonicContact OE2-NE2 3.79Å; E571-H573 PolarHBondContact OE2-NE2 3.29Å; E571-R591 IonicContact OE1-CZ 3.91Å; E571-R591 IonicContact OE1-NH1 3.81Å; E571-R591 PolarHBondContact OE1-NH1 3.26Å; E571-R591 IonicContact OE1-NH2 3.4Å; E571-R591 PolarHBondContact OE1-NH2 3.47Å; E571-R591 IonicContact OE2-CZ 3.99Å; E571-R591 IonicContact OE2-NH1 2.96Å; E571-R591 IonicContact OE2-NH2 2.96Å; E571-R591 PolarHBondContact OE2-NH2 3.15Å
572	V	93.1	Very high	92.5	Very high	83 Å²	83	58.4 Å²	58.4	50%	0.503	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	175.7	180	0	0	0	0	108.7	E560 L561 L562	E560-V572 HydrophobicContact CG-CG1 3.46Å; E560-V572 VanDerWaalsContact CG-CG1 3.46Å; E560-V572 VanDerWaalsContact OE1-CG1 3.3Å; E560-V572 WeakPolarHBondContact OE1-CG1 3.44Å; L561-V572 WeakPolarHBondContact O-CA 3.43Å; L562-V572 HydrophobicContact CD1-CG2 3.51Å
573	H	92.9	Very high	92.5	Very high	36 Å²	36	58.5 Å²	58.5	17%	0.167	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.9	-178.1	-74.2	-94	0	0	0	110.7	E560 L561 F563 E571 L575 Y587	E560-H573 WeakPolarHBondContact CA-O 3.5Å; L561-H573 PolarHBondContact N-O 2.94Å; L561-H573 PolarHBondContact O-N 2.69Å; F563-H573 HydrophobicContact CD2-CB 4.43Å; F563-H573 AromaticContact CD2-CD2 3.22Å; F563-H573 WeakPolarHBondContact CD2-CD2 3.3Å; F563-H573 AromaticContact CD2-CG 3.95Å; F563-H573 AromaticContact CD2-NE2 3.82Å; F563-H573 HydrophobicContact CE2-CB 3.85Å; F563-H573 AromaticContact CE2-CD2 3.4Å; F563-H573 VanDerWaalsContact CE2-CD2 3.4Å; F563-H573 WeakPolarHBondContact CE2-CD2 3.16Å; F563-H573 AromaticContact CE2-CG 3.62Å; F563-H573 HydrophobicContact CZ-CB 4.23Å; E571-H573 IonicContact OE2-CE1 2.8Å; E571-H573 IonicContact OE2-NE2 3.79Å; E571-H573 PolarHBondContact OE2-NE2 3.29Å; H573-L575 HydrophobicContact CB-CD1 4.38Å; H573-L575 HydrophobicContact CB-CD2 4.18Å; H573-L575 HydrophobicContact CB-CG 4.14Å; H573-Y587 AromaticContact CE1-CZ 4Å; H573-Y587 PolarHBondContact CE1-OH 3.44Å; H573-Y587 VanDerWaalsContact CE1-OH 3.26Å
574	R	93.7	Very high	92.4	Very high	133 Å²	133	58.5 Å²	58.5	50%	0.502	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.7	172	-65.9	178.5	68.6	-160.8	0.3	108.2	P552 V558 E560	P552-R574 WeakPolarHBondContact CD-O 3.46Å; V558-R574 HydrophobicContact CG1-CB 4.02Å; V558-R574 HydrophobicContact CG1-CG 4.31Å; E560-R574 HydrophobicContact CG-CG 4.49Å
575	L	94.5	Very high	92.4	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	157.6	-172.3	-56.5	176.9	0	0	0	110.5	L549 I559 L561 F563 H573 L579 L584 L618	L549-L575 HydrophobicContact CB-CD2 3.58Å; L549-L575 HydrophobicContact CD1-CD1 4.27Å; L549-L575 HydrophobicContact CD1-CD2 3.87Å; L549-L575 HydrophobicContact CG-CD2 4.25Å; I559-L575 HydrophobicContact CG2-CB 4.01Å; I559-L575 WeakPolarHBondContact CG2-O 3.49Å; I559-L575 PolarHBondContact N-O 3.26Å; I559-L575 PolarHBondContact O-N 3.5Å; L561-L575 HydrophobicContact CD1-CD1 4.17Å; F563-L575 HydrophobicContact CZ-CD1 3.93Å; H573-L575 HydrophobicContact CB-CD1 4.38Å; H573-L575 HydrophobicContact CB-CD2 4.18Å; H573-L575 HydrophobicContact CB-CG 4.14Å; L575-L579 HydrophobicContact CB-CD2 4.22Å; L575-L579 HydrophobicContact CD1-CD2 4.05Å; L575-L579 HydrophobicContact CD2-CD2 4.05Å; L575-L579 HydrophobicContact CG-CD2 4.34Å; L575-L584 HydrophobicContact CD1-CD2 4Å; L575-L618 HydrophobicContact CB-CD1 3.93Å; L575-L618 HydrophobicContact CD1-CD1 3.88Å
576	H	94.2	Very high	92.4	Very high	54 Å²	54	55.6 Å²	55.6	25%	0.25	29%	0.289	C	S	.	.			trans	-77.5	135.4	172.5	-164.6	-94.9	0	0	0	109.1	P552 A557 T578 L579	P552-H576 HydrophobicContact CG-CB 4.15Å; A557-H576 PolarHBondContact O-CD2 3.45Å; A557-H576 VanDerWaalsContact O-CD2 3.27Å; H576-T578 PolarHBondContact CE1-OG1 3.41Å; H576-T578 VanDerWaalsContact CE1-OG1 3.32Å; H576-T578 PolarHBondContact ND1-N 3.21Å; H576-T578 PolarHBondContact ND1-OG1 3.48Å; H576-T578 PolarHBondContact O-N 2.88Å; H576-L579 WeakPolarHBondContact O-CB 3.22Å; H576-L579 PolarHBondContact O-N 2.92Å
577	P	92.9	Very high	92.6	Very high	22 Å²	22	53.1 Å²	53.1	14%	0.143	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.9	-177.6	-21.7	29.1	0	0	0	114.3	A557 I559 L618 T619	A557-P577 VanDerWaalsContact C-CD 3.5Å; A557-P577 HydrophobicContact CB-CG 3.78Å; A557-P577 WeakPolarHBondContact O-CD 3.4Å; I559-P577 HydrophobicContact CB-CG 4.44Å; P577-L618 PolarHBondContact O-N 2.59Å; P577-T619 WeakPolarHBondContact CB-OG1 3.18Å; P577-T619 PolarHBondContact O-N 3.29Å; P577-T619 VanDerWaalsContact O-N 3.1Å; P577-T619 PolarHBondContact O-OG1 3.18Å; P577-T619 VanDerWaalsContact O-OG1 3.08Å
578	T	93.5	Very high	92.9	Very high	93 Å²	93	49.2 Å²	49.2	57%	0.571	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-1.4	176.3	72.4	0	0	0	0	114.5	H576	H576-T578 PolarHBondContact CE1-OG1 3.41Å; H576-T578 VanDerWaalsContact CE1-OG1 3.32Å; H576-T578 PolarHBondContact ND1-N 3.21Å; H576-T578 PolarHBondContact ND1-OG1 3.48Å; H576-T578 PolarHBondContact O-N 2.88Å
579	L	94	Very high	93.2	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.063	24%	0.242	C	C	.	.			trans	-58.1	140.5	176.8	-171.3	71.4	0	0	0	110	L549 P550 L575 H576 D583 L584 S617 L618	L549-L579 HydrophobicContact CD2-CD2 4.2Å; P550-L579 HydrophobicContact CG-CD1 3.51Å; L575-L579 HydrophobicContact CB-CD2 4.22Å; L575-L579 HydrophobicContact CD1-CD2 4.05Å; L575-L579 HydrophobicContact CD2-CD2 4.05Å; L575-L579 HydrophobicContact CG-CD2 4.34Å; H576-L579 WeakPolarHBondContact O-CB 3.22Å; H576-L579 PolarHBondContact O-N 2.92Å; L579-D583 HydrophobicContact CD1-CB 3.8Å; L579-D583 WeakPolarHBondContact CD1-OD2 3.44Å; L579-D583 HydrophobicContact CG-CB 4.02Å; L579-L584 HydrophobicContact CD2-CD2 4.4Å; L579-S617 CarbonylContact O-C 3.48Å; L579-S617 WeakPolarHBondContact O-CA 3.36Å; L579-L618 HydrophobicContact CB-CD1 3.99Å; L579-L618 HydrophobicContact CB-CG 4.11Å; L579-L618 HydrophobicContact CD2-CD1 4.3Å; L579-L618 WeakPolarHBondContact O-CG 3.04Å; L579-L618 PolarHBondContact O-N 3.34Å
580	K	94.9	Very high	93.4	Very high	98 Å²	98	52.6 Å²	52.6	43%	0.426	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-88	153.7	-175.4	-65.8	177.1	178.6	173.1	0	111.3	Q582 D583 L584 I616	K580-Q582 HydrophobicContact CB-CB 4.43Å; K580-Q582 PolarHBondContact O-N 3.45Å; K580-D583 WeakPolarHBondContact CB-OD2 3.29Å; K580-D583 PolarHBondContact N-OD2 3Å; K580-D583 WeakPolarHBondContact O-CB 3.49Å; K580-D583 PolarHBondContact O-N 3.29Å; K580-D583 VanDerWaalsContact O-N 3.08Å; K580-L584 PolarHBondContact O-N 3.45Å; K580-I616 WeakPolarHBondContact CA-O 3.09Å
581	L	94.1	Very high	93.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-31.9	172.3	-67	-178.5	0	0	0	112.1	D583 L584 H585 L609 M612 Q614 I616 L618 A621	L581-D583 VanDerWaalsContact C-N 3.27Å; L581-D583 PolarHBondContact O-N 2.94Å; L581-L584 HydrophobicContact CD2-CD1 4.28Å; L581-L584 WeakPolarHBondContact O-CB 3.3Å; L581-L584 PolarHBondContact O-N 3.41Å; L581-H585 PolarHBondContact O-CD2 2.9Å; L581-H585 PolarHBondContact O-N 2.96Å; L581-L609 HydrophobicContact CD1-CB 4.49Å; L581-L609 HydrophobicContact CD2-CB 4.19Å; L581-L609 HydrophobicContact CD2-CD2 3.75Å; L581-L609 HydrophobicContact CD2-CG 4.32Å; L581-M612 HydrophobicContact CD1-CB 3.72Å; L581-M612 HydrophobicContact CD1-SD 4.37Å; L581-Q614 PolarHBondContact N-O 3.05Å; L581-I616 HydrophobicContact CD1-CB 4.25Å; L581-I616 HydrophobicContact CD1-CG2 4.49Å; L581-I616 PolarHBondContact N-O 3.39Å; L581-L618 HydrophobicContact CD2-CD2 4.06Å; L581-A621 HydrophobicContact CD1-CB 4.29Å; L581-A621 HydrophobicContact CD2-CB 4.35Å
582	Q	93.5	Very high	93.4	Very high	79 Å²	79	50.6 Å²	50.6	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-54	-43.9	172.4	-171.2	174.4	5.6	0	0	112.1	K580 L584 H585 S586 Q614	K580-Q582 HydrophobicContact CB-CB 4.43Å; K580-Q582 PolarHBondContact O-N 3.45Å; Q582-L584 VanDerWaalsContact C-N 3.34Å; Q582-L584 PolarHBondContact O-N 3.13Å; Q582-H585 PolarHBondContact O-N 2.97Å; Q582-S586 PolarHBondContact O-N 3.22Å; Q582-S586 PolarHBondContact O-OG 2.82Å; Q582-Q614 HydrophobicContact CB-CB 4.07Å; Q582-Q614 WeakPolarHBondContact CB-O 3.29Å; Q582-Q614 PolarHBondContact N-O 3.38Å
583	D	94	Very high	93.4	Very high	42 Å²	42	48.1 Å²	48.1	23%	0.225	23%	0.231	C	C	.	.	H	α-helix	trans	-66.2	-39.1	-178.3	-55.7	-42.6	0	0	0	111	L546 L579 K580 L581 Y587	L546-D583 HydrophobicContact CD1-CB 3.55Å; L579-D583 HydrophobicContact CD1-CB 3.8Å; L579-D583 WeakPolarHBondContact CD1-OD2 3.44Å; L579-D583 HydrophobicContact CG-CB 4.02Å; K580-D583 WeakPolarHBondContact CB-OD2 3.29Å; K580-D583 PolarHBondContact N-OD2 3Å; K580-D583 WeakPolarHBondContact O-CB 3.49Å; K580-D583 PolarHBondContact O-N 3.29Å; K580-D583 VanDerWaalsContact O-N 3.08Å; L581-D583 VanDerWaalsContact C-N 3.27Å; L581-D583 PolarHBondContact O-N 2.94Å; D583-Y587 WeakPolarHBondContact O-CB 3.22Å; D583-Y587 PolarHBondContact O-N 3.4Å
584	L	93.7	Very high	93.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-44	172.3	-72.4	-175.6	0	0	0	111.9	L549 F563 L575 L579 K580 L581 Q582 Y587 F588 I600 L618 L629	L549-L584 HydrophobicContact CD1-CD2 3.85Å; L549-L584 HydrophobicContact CD2-CD2 3.96Å; F563-L584 HydrophobicContact CE2-CD2 4.46Å; F563-L584 HydrophobicContact CZ-CD2 3.84Å; L575-L584 HydrophobicContact CD1-CD2 4Å; L579-L584 HydrophobicContact CD2-CD2 4.4Å; K580-L584 PolarHBondContact O-N 3.45Å; L581-L584 HydrophobicContact CD2-CD1 4.28Å; L581-L584 WeakPolarHBondContact O-CB 3.3Å; L581-L584 PolarHBondContact O-N 3.41Å; Q582-L584 VanDerWaalsContact C-N 3.34Å; Q582-L584 PolarHBondContact O-N 3.13Å; L584-Y587 PolarHBondContact O-N 3.27Å; L584-F588 HydrophobicContact CB-CD2 4.49Å; L584-F588 HydrophobicContact CB-CE2 4.38Å; L584-F588 HydrophobicContact CD2-CE2 4.49Å; L584-F588 WeakPolarHBondContact O-CD2 3.38Å; L584-F588 PolarHBondContact O-N 3.33Å; L584-I600 HydrophobicContact CB-CD1 4.39Å; L584-L618 HydrophobicContact CD1-CD2 3.46Å; L584-L618 VanDerWaalsContact CD1-CD2 3.46Å; L584-L618 HydrophobicContact CG-CD2 4.14Å; L584-L629 HydrophobicContact CD1-CD1 4.47Å
585	H	93.2	Very high	93.2	Very high	14 Å²	14	44.8 Å²	44.8	7%	0.065	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-44.8	178.1	-74.5	-54.1	0	0	0	112	L581 Q582 Y587 F588 E589 F595 S610	L581-H585 PolarHBondContact O-CD2 2.9Å; L581-H585 PolarHBondContact O-N 2.96Å; Q582-H585 PolarHBondContact O-N 2.97Å; H585-Y587 VanDerWaalsContact C-N 3.31Å; H585-Y587 PolarHBondContact O-N 3.38Å; H585-F588 PolarHBondContact O-N 3.41Å; H585-E589 VanDerWaalsContact O-CB 3.3Å; H585-E589 WeakPolarHBondContact O-CB 3.43Å; H585-E589 PolarHBondContact O-N 2.94Å; H585-F595 AromaticContact CE1-CD2 3.27Å; H585-F595 WeakPolarHBondContact CE1-CD2 3.41Å; H585-F595 AromaticContact CE1-CE2 3.43Å; H585-F595 VanDerWaalsContact CE1-CE2 3.43Å; H585-F595 WeakPolarHBondContact CE1-CE2 3.26Å; H585-F595 AromaticContact CG-CD2 3.92Å; H585-F595 AromaticContact ND1-CD2 3.3Å; H585-F595 VanDerWaalsContact ND1-CD2 3.3Å; H585-F595 WeakPolarHBondContact ND1-CD2 3.13Å; H585-F595 AromaticContact ND1-CE2 3.93Å; H585-F595 AromaticContact NE2-CD2 3.86Å; H585-F595 AromaticContact NE2-CE2 3.67Å; H585-S610 PolarHBondContact CE1-OG 3.35Å
586	S	93.3	Very high	93	Very high	8 Å²	8	50.7 Å²	50.7	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-37.3	176	-63.3	0	0	0	0	112.5	Q582 Y590	Q582-S586 PolarHBondContact O-N 3.22Å; Q582-S586 PolarHBondContact O-OG 2.82Å; S586-Y590 PolarHBondContact O-N 3.09Å; S586-Y590 VanDerWaalsContact O-N 3.09Å
587	Y	94.1	Very high	92.9	Very high	8 Å²	8	52.6 Å²	52.6	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-47	174.1	175.2	-104.9	0	0	0	113.2	L546 L549 H573 D583 L584 H585 E589 Y590 R591	L546-Y587 WeakPolarHBondContact O-CA 3.05Å; L549-Y587 HydrophobicContact CD1-CD1 3.68Å; L549-Y587 HydrophobicContact CD1-CD2 4.36Å; L549-Y587 HydrophobicContact CD1-CE1 3.87Å; L549-Y587 HydrophobicContact CD1-CG 3.92Å; L549-Y587 HydrophobicContact CD2-CD1 4.33Å; L549-Y587 HydrophobicContact CD2-CD2 4.26Å; L549-Y587 HydrophobicContact CD2-CG 3.82Å; L549-Y587 HydrophobicContact CG-CD1 3.91Å; L549-Y587 HydrophobicContact CG-CD2 3.73Å; L549-Y587 HydrophobicContact CG-CE1 4.29Å; L549-Y587 HydrophobicContact CG-CE2 4.12Å; L549-Y587 HydrophobicContact CG-CG 3.59Å; H573-Y587 AromaticContact CE1-CZ 4Å; H573-Y587 PolarHBondContact CE1-OH 3.44Å; H573-Y587 VanDerWaalsContact CE1-OH 3.26Å; D583-Y587 WeakPolarHBondContact O-CB 3.22Å; D583-Y587 PolarHBondContact O-N 3.4Å; L584-Y587 PolarHBondContact O-N 3.27Å; H585-Y587 VanDerWaalsContact C-N 3.31Å; H585-Y587 PolarHBondContact O-N 3.38Å; Y587-E589 VanDerWaalsContact C-N 3.34Å; Y587-Y590 WeakPolarHBondContact O-CB 3.46Å; Y587-Y590 PolarHBondContact O-N 3.49Å; Y587-R591 HydrophobicContact CE1-CG 4.16Å; Y587-R591 HydrophobicContact CE2-CG 4.42Å; Y587-R591 PolarHBondContact O-N 3.02Å; Y587-R591 PolarHBondContact OH-NE 3.11Å; Y587-R591 PolarHBondContact OH-NH2 2.93Å
588	F	94	Very high	93	Very high	3 Å²	3	53.1 Å²	53.1	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-70.4	-32	179	-72.3	-57.2	0	0	0	112.4	F563 L565 L584 H585 R591 G592 Y593 I600 I631	F563-F588 HydrophobicContact CB-CZ 4.34Å; F563-F588 HydrophobicContact CD1-CZ 4.19Å; F563-F588 HydrophobicContact CD2-CE1 4.03Å; F563-F588 AromaticContact CD2-CZ 3.55Å; F563-F588 HydrophobicContact CD2-CZ 3.55Å; F563-F588 HydrophobicContact CE1-CZ 4.38Å; F563-F588 AromaticContact CE2-CZ 3.77Å; F563-F588 HydrophobicContact CE2-CZ 3.77Å; F563-F588 HydrophobicContact CG-CE1 4.37Å; F563-F588 AromaticContact CG-CZ 3.77Å; F563-F588 HydrophobicContact CG-CZ 3.77Å; F563-F588 HydrophobicContact CZ-CZ 4.17Å; L565-F588 HydrophobicContact CD2-CD1 4.19Å; L565-F588 HydrophobicContact CD2-CE1 3.81Å; L584-F588 HydrophobicContact CB-CD2 4.49Å; L584-F588 HydrophobicContact CB-CE2 4.38Å; L584-F588 HydrophobicContact CD2-CE2 4.49Å; L584-F588 WeakPolarHBondContact O-CD2 3.38Å; L584-F588 PolarHBondContact O-N 3.33Å; H585-F588 PolarHBondContact O-N 3.41Å; F588-R591 CarbonylContact O-C 3.59Å; F588-R591 PolarHBondContact O-N 3.37Å; F588-G592 PolarHBondContact O-N 3.03Å; F588-Y593 CarbonylContact C-O 3.23Å; F588-Y593 HydrophobicContact CD1-CD2 4.42Å; F588-Y593 CarbonylContact O-C 3.6Å; F588-Y593 WeakPolarHBondContact O-CA 3.31Å; F588-Y593 WeakPolarHBondContact O-CB 3.48Å; F588-Y593 PolarHBondContact O-N 3.46Å; F588-I600 HydrophobicContact CD2-CD1 3.51Å; F588-I600 HydrophobicContact CD2-CG1 4.12Å; F588-I600 HydrophobicContact CE2-CD1 3.79Å; F588-I600 HydrophobicContact CE2-CG1 4.34Å; F588-I631 HydrophobicContact CD1-CD1 4.48Å; F588-I631 HydrophobicContact CD1-CG1 3.97Å; F588-I631 HydrophobicContact CD2-CG1 4.38Å; F588-I631 HydrophobicContact CE1-CD1 3.74Å; F588-I631 HydrophobicContact CE1-CG1 3.73Å; F588-I631 HydrophobicContact CE2-CD1 4.3Å; F588-I631 HydrophobicContact CE2-CG1 4.16Å; F588-I631 HydrophobicContact CG-CG1 4.3Å; F588-I631 HydrophobicContact CZ-CD1 3.63Å; F588-I631 HydrophobicContact CZ-CG1 3.83Å
589	E	93.2	Very high	93	Very high	89 Å²	89	50.7 Å²	50.7	42%	0.416	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-43.3	171.4	-174.1	168.8	-165.3	0	0	111.5	H585 Y587 R591 G592 P594	H585-E589 VanDerWaalsContact O-CB 3.3Å; H585-E589 WeakPolarHBondContact O-CB 3.43Å; H585-E589 PolarHBondContact O-N 2.94Å; Y587-E589 VanDerWaalsContact C-N 3.34Å; E589-R591 VanDerWaalsContact C-N 3.32Å; E589-R591 PolarHBondContact O-N 3Å; E589-G592 PolarHBondContact O-N 3.15Å; E589-G592 VanDerWaalsContact O-N 3.16Å; E589-P594 HydrophobicContact CG-CB 4.33Å
590	Y	92	Very high	93.1	Very high	134 Å²	134	50.4 Å²	50.4	53%	0.525	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-38.7	172.4	-179.5	-107.6	0	0	0	113	I545 T547 S586 Y587 G592	I545-Y590 HydrophobicContact CG2-CD2 3.86Å; I545-Y590 HydrophobicContact CG2-CG 4.11Å; T547-Y590 HydrophobicContact CG2-CD1 4.33Å; T547-Y590 HydrophobicContact CG2-CD2 4.03Å; T547-Y590 HydrophobicContact CG2-CE1 3.98Å; T547-Y590 HydrophobicContact CG2-CE2 3.66Å; T547-Y590 HydrophobicContact CG2-CG 4.35Å; S586-Y590 PolarHBondContact O-N 3.09Å; S586-Y590 VanDerWaalsContact O-N 3.09Å; Y587-Y590 WeakPolarHBondContact O-CB 3.46Å; Y587-Y590 PolarHBondContact O-N 3.49Å; Y590-G592 PolarHBondContact O-N 2.92Å
591	R	90.8	Very high	93.1	Very high	103 Å²	103	46.4 Å²	46.4	39%	0.389	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-4.7	177.1	-76.6	-80.4	-164.5	142.6	7.7	114.2	E571 Y587 F588 E589 Y593	E571-R591 IonicContact OE1-CZ 3.91Å; E571-R591 IonicContact OE1-NH1 3.81Å; E571-R591 PolarHBondContact OE1-NH1 3.26Å; E571-R591 IonicContact OE1-NH2 3.4Å; E571-R591 PolarHBondContact OE1-NH2 3.47Å; E571-R591 IonicContact OE2-CZ 3.99Å; E571-R591 IonicContact OE2-NH1 2.96Å; E571-R591 IonicContact OE2-NH2 2.96Å; E571-R591 PolarHBondContact OE2-NH2 3.15Å; Y587-R591 HydrophobicContact CE1-CG 4.16Å; Y587-R591 HydrophobicContact CE2-CG 4.42Å; Y587-R591 PolarHBondContact O-N 3.02Å; Y587-R591 PolarHBondContact OH-NE 3.11Å; Y587-R591 PolarHBondContact OH-NH2 2.93Å; F588-R591 CarbonylContact O-C 3.59Å; F588-R591 PolarHBondContact O-N 3.37Å; E589-R591 VanDerWaalsContact C-N 3.32Å; E589-R591 PolarHBondContact O-N 3Å; R591-Y593 HydrophobicContact CB-CD2 3.83Å; R591-Y593 HydrophobicContact CB-CE2 4.07Å
592	G	92.6	Very high	93	Very high	50 Å²	50	47.3 Å²	47.3	52%	0.515	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	12.3	-179.6	0	0	0	0	0	114.8	F588 E589 Y590 P594	F588-G592 PolarHBondContact O-N 3.03Å; E589-G592 PolarHBondContact O-N 3.15Å; E589-G592 VanDerWaalsContact O-N 3.16Å; Y590-G592 PolarHBondContact O-N 2.92Å; G592-P594 WeakPolarHBondContact O-CD 3.23Å
593	Y	93	Very high	92.6	Very high	30 Å²	30	47.6 Å²	47.6	12%	0.118	23%	0.233	C	C	.	.			trans	-113.7	71.9	178.1	-50.9	-64.8	0	0	0	110.3	L565 P566 D567 F588 R591 Y598 I631	L565-Y593 HydrophobicContact CB-CE2 4.41Å; L565-Y593 HydrophobicContact CD1-CE2 4.43Å; L565-Y593 HydrophobicContact CD2-CD2 4.17Å; L565-Y593 HydrophobicContact CD2-CE2 3.76Å; L565-Y593 HydrophobicContact CG-CE2 4.42Å; P566-Y593 HydrophobicContact CB-CD1 4.47Å; P566-Y593 HydrophobicContact CB-CE1 3.92Å; P566-Y593 VanDerWaalsContact CD-CE1 3.44Å; P566-Y593 HydrophobicContact CG-CD1 3.63Å; P566-Y593 HydrophobicContact CG-CE1 3.47Å; P566-Y593 VanDerWaalsContact CG-CE1 3.47Å; P566-Y593 HydrophobicContact CG-CG 4.49Å; D567-Y593 PolarHBondContact OD2-OH 3.43Å; F588-Y593 CarbonylContact C-O 3.23Å; F588-Y593 HydrophobicContact CD1-CD2 4.42Å; F588-Y593 CarbonylContact O-C 3.6Å; F588-Y593 WeakPolarHBondContact O-CA 3.31Å; F588-Y593 WeakPolarHBondContact O-CB 3.48Å; F588-Y593 PolarHBondContact O-N 3.46Å; R591-Y593 HydrophobicContact CB-CD2 3.83Å; R591-Y593 HydrophobicContact CB-CE2 4.07Å; Y593-Y598 VanDerWaalsContact CA-CD2 3.45Å; Y593-Y598 HydrophobicContact CD1-CD1 4.18Å; Y593-Y598 HydrophobicContact CD1-CD2 4.17Å; Y593-Y598 HydrophobicContact CD1-CE1 4.03Å; Y593-Y598 AromaticContact CD1-CE2 3.97Å; Y593-Y598 HydrophobicContact CD1-CE2 3.97Å; Y593-Y598 HydrophobicContact CD1-CG 4.28Å; Y593-Y598 AromaticContact CD1-CZ 3.92Å; Y593-I631 HydrophobicContact CD1-CG2 4.42Å; Y593-I631 HydrophobicContact CD2-CG2 4.48Å; Y593-I631 HydrophobicContact CG-CG2 4.02Å
594	P	92.7	Very high	91.6	Very high	37 Å²	37	52 Å²	52	24%	0.24	25%	0.252	C	S	.	.			trans	-66.9	144.3	-174.6	30.1	-37.6	0	0	0	111.4	E589 G592 N596 K597 Y598	E589-P594 HydrophobicContact CG-CB 4.33Å; G592-P594 WeakPolarHBondContact O-CD 3.23Å; P594-N596 VanDerWaalsContact CB-OD1 3.28Å; P594-N596 WeakPolarHBondContact CB-OD1 3.31Å; P594-N596 VanDerWaalsContact CG-OD1 3.32Å; P594-N596 WeakPolarHBondContact CG-OD1 3.41Å; P594-N596 PolarHBondContact O-N 3.2Å; P594-K597 HydrophobicContact CG-CB 4.15Å; P594-K597 PolarHBondContact O-N 2.96Å; P594-Y598 PolarHBondContact O-N 3.04Å
595	F	88.8	Confident	90.9	Very high	63 Å²	63	56 Å²	56	28%	0.276	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27	-176.6	176.1	-104	0	0	0	114.2	H585 K597 Y598 S610 R634	H585-F595 AromaticContact CE1-CD2 3.27Å; H585-F595 WeakPolarHBondContact CE1-CD2 3.41Å; H585-F595 AromaticContact CE1-CE2 3.43Å; H585-F595 VanDerWaalsContact CE1-CE2 3.43Å; H585-F595 WeakPolarHBondContact CE1-CE2 3.26Å; H585-F595 AromaticContact CG-CD2 3.92Å; H585-F595 AromaticContact ND1-CD2 3.3Å; H585-F595 VanDerWaalsContact ND1-CD2 3.3Å; H585-F595 WeakPolarHBondContact ND1-CD2 3.13Å; H585-F595 AromaticContact ND1-CE2 3.93Å; H585-F595 AromaticContact NE2-CD2 3.86Å; H585-F595 AromaticContact NE2-CE2 3.67Å; F595-K597 VanDerWaalsContact C-N 3.31Å; F595-K597 PolarHBondContact O-N 2.9Å; F595-Y598 CarbonylContact C-O 3.48Å; F595-Y598 VanDerWaalsContact O-O 3.05Å; F595-S610 WeakPolarHBondContact CE2-O 3.41Å; F595-S610 VanDerWaalsContact CZ-O 3.31Å; F595-S610 WeakPolarHBondContact CZ-O 3.28Å; F595-R634 VanDerWaalsContact CE2-NH2 3.26Å; F595-R634 PolarHBondContact O-NE 2.94Å; F595-R634 VanDerWaalsContact O-NE 3.13Å; F595-R634 PolarHBondContact O-NH2 3.05Å
596	N	90.8	Very high	90.3	Very high	125 Å²	125	60.8 Å²	60.8	67%	0.668	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-22.6	178.9	63.3	-7.7	0	0	0	113.7	P594	P594-N596 VanDerWaalsContact CB-OD1 3.28Å; P594-N596 WeakPolarHBondContact CB-OD1 3.31Å; P594-N596 VanDerWaalsContact CG-OD1 3.32Å; P594-N596 WeakPolarHBondContact CG-OD1 3.41Å; P594-N596 PolarHBondContact O-N 3.2Å
597	K	91.5	Very high	90.1	Very high	93 Å²	93	62 Å²	62	40%	0.404	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-33.9	-176	-174.4	177	178.6	-164.8	0	112.1	P594 F595 E633 R634	P594-K597 HydrophobicContact CG-CB 4.15Å; P594-K597 PolarHBondContact O-N 2.96Å; F595-K597 VanDerWaalsContact C-N 3.31Å; F595-K597 PolarHBondContact O-N 2.9Å; K597-E633 WeakPolarHBondContact CE-OE1 3.12Å; K597-E633 HydrophobicContact CG-CG 4.26Å; K597-E633 IonicContact NZ-OE1 2.69Å; K597-E633 PolarHBondContact NZ-OE1 3.32Å; K597-R634 PolarHBondContact O-N 3.35Å
598	Y	94.8	Very high	90	Very high	33 Å²	33	63.3 Å²	63.3	13%	0.129	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	148.6	-178.3	-64.1	-89.5	0	0	0	111	P566 Y593 P594 F595 I631 Q632 E633 R634	P566-Y598 HydrophobicContact CB-CE1 4.02Å; P566-Y598 HydrophobicContact CG-CD1 3.71Å; P566-Y598 HydrophobicContact CG-CE1 3.51Å; Y593-Y598 VanDerWaalsContact CA-CD2 3.45Å; Y593-Y598 HydrophobicContact CD1-CD1 4.18Å; Y593-Y598 HydrophobicContact CD1-CD2 4.17Å; Y593-Y598 HydrophobicContact CD1-CE1 4.03Å; Y593-Y598 AromaticContact CD1-CE2 3.97Å; Y593-Y598 HydrophobicContact CD1-CE2 3.97Å; Y593-Y598 HydrophobicContact CD1-CG 4.28Å; Y593-Y598 AromaticContact CD1-CZ 3.92Å; P594-Y598 PolarHBondContact O-N 3.04Å; F595-Y598 CarbonylContact C-O 3.48Å; F595-Y598 VanDerWaalsContact O-O 3.05Å; Y598-I631 HydrophobicContact CD1-CG2 4.29Å; Y598-I631 HydrophobicContact CG-CG2 4.43Å; Y598-Q632 CarbonylContact C-O 3.4Å; Y598-Q632 WeakPolarHBondContact CA-O 3.3Å; Y598-E633 HydrophobicContact CD1-CB 4.27Å; Y598-E633 HydrophobicContact CE1-CB 4.06Å; Y598-R634 PolarHBondContact O-NE 3.25Å
599	E	94.6	Very high	89.8	Confident	43 Å²	43	63.1 Å²	63.1	20%	0.201	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	151.3	167.3	58.5	168.7	-163.9	0	0	111.2	V601 C608 S610 I631 Q632 R634	E599-V601 HydrophobicContact CB-CG1 4.39Å; E599-V601 HydrophobicContact CG-CG1 3.87Å; E599-V601 WeakPolarHBondContact OE1-CG1 3.28Å; E599-C608 PolarHBondContact OE2-SG 2.94Å; E599-S610 WeakPolarHBondContact CA-OG 3.47Å; E599-I631 WeakPolarHBondContact O-CA 3.29Å; E599-Q632 HydrophobicContact CG-CG 3.76Å; E599-Q632 PolarHBondContact N-O 3.5Å; E599-Q632 PolarHBondContact O-N 2.93Å; E599-Q632 PolarHBondContact OE1-NE2 3.29Å; E599-R634 HydrophobicContact CB-CG 3.91Å; E599-R634 HydrophobicContact CG-CG 3.97Å
600	I	95.1	Very high	89.7	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.1	175.4	-49.6	170.8	0	0	0	106.8	L584 F588 L609 S610 L629 F630	L584-I600 HydrophobicContact CB-CD1 4.39Å; F588-I600 HydrophobicContact CD2-CD1 3.51Å; F588-I600 HydrophobicContact CD2-CG1 4.12Å; F588-I600 HydrophobicContact CE2-CD1 3.79Å; F588-I600 HydrophobicContact CE2-CG1 4.34Å; I600-L609 HydrophobicContact CB-CB 4.25Å; I600-L609 HydrophobicContact CG2-CB 4.34Å; I600-L609 HydrophobicContact CG2-CD1 4.33Å; I600-L609 HydrophobicContact CG2-CD2 4.02Å; I600-L609 HydrophobicContact CG2-CG 4.49Å; I600-L609 WeakPolarHBondContact O-CB 3.31Å; I600-L609 PolarHBondContact O-N 2.93Å; I600-S610 PolarHBondContact N-OG 2.9Å; I600-S610 PolarHBondContact O-N 3.48Å; I600-L629 HydrophobicContact CG2-CB 4.04Å; I600-L629 HydrophobicContact CG2-CD1 3.89Å; I600-L629 HydrophobicContact CG2-CG 4.46Å; I600-F630 WeakPolarHBondContact CA-O 3.38Å
601	V	94.4	Very high	89.5	Confident	15 Å²	15	57.6 Å²	57.6	9%	0.091	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.7	-176.8	-56.7	0	0	0	0	111.3	E599 L607 C608 L629 F630 Q632	E599-V601 HydrophobicContact CB-CG1 4.39Å; E599-V601 HydrophobicContact CG-CG1 3.87Å; E599-V601 WeakPolarHBondContact OE1-CG1 3.28Å; V601-L607 CarbonylContact C-O 3.55Å; V601-L607 WeakPolarHBondContact CA-O 3.29Å; V601-C608 HydrophobicContact CG1-CB 4.16Å; V601-L629 CarbonylContact O-C 3.59Å; V601-L629 WeakPolarHBondContact O-CA 3.43Å; V601-F630 HydrophobicContact CG2-CB 3.85Å; V601-F630 PolarHBondContact N-O 3.41Å; V601-F630 PolarHBondContact O-N 3.05Å; V601-Q632 HydrophobicContact CG2-CG 4.09Å
602	R	93.1	Very high	89.5	Confident	20 Å²	20	55 Å²	55	8%	0.075	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	128.8	164	-176.1	-171.5	65	-166.1	-7.8	107.7	H604 P605 N606 L607 L609 G622 D627 L629	R602-H604 WeakPolarHBondContact CD-O 3.32Å; R602-H604 PolarHBondContact NE-O 3.15Å; R602-P605 PolarHBondContact NE-O 3.12Å; R602-P605 VanDerWaalsContact NH2-CG 3.3Å; R602-P605 PolarHBondContact NH2-O 3.36Å; R602-N606 CarbonylContact O-C 3.58Å; R602-N606 WeakPolarHBondContact O-CA 3.43Å; R602-L607 HydrophobicContact CB-CB 4.28Å; R602-L607 PolarHBondContact N-O 3.43Å; R602-L607 PolarHBondContact O-N 3.11Å; R602-L609 HydrophobicContact CB-CD1 4.4Å; R602-G622 PolarHBondContact NH1-O 3.41Å; R602-D627 VanDerWaalsContact CD-OD2 3.31Å; R602-D627 WeakPolarHBondContact CD-OD2 3.49Å; R602-D627 IonicContact CZ-OD2 3.57Å; R602-D627 IonicContact NE-OD2 3.8Å; R602-D627 IonicContact NH1-OD2 2.66Å; R602-D627 PolarHBondContact NH1-OD2 2.99Å; R602-L629 HydrophobicContact CB-CD2 3.95Å
603	I	85.4	Confident	89.4	Confident	84 Å²	84	58.8 Å²	58.8	43%	0.431	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-30.3	-175.9	-61	178.2	0	0	0	112.2	N606 F630	I603-N606 PolarHBondContact O-N 3.25Å; I603-N606 PolarHBondContact O-OD1 3.4Å; I603-F630 HydrophobicContact CB-CE2 4.37Å; I603-F630 HydrophobicContact CD1-CD1 4.17Å; I603-F630 HydrophobicContact CD1-CD2 3.72Å; I603-F630 HydrophobicContact CD1-CE1 3.78Å; I603-F630 HydrophobicContact CD1-CE2 3.32Å; I603-F630 HydrophobicContact CD1-CG 4.14Å; I603-F630 HydrophobicContact CD1-CZ 3.36Å; I603-F630 HydrophobicContact CG1-CD2 3.71Å; I603-F630 HydrophobicContact CG1-CE2 3.62Å; I603-F630 HydrophobicContact CG1-CG 4.38Å; I603-F630 HydrophobicContact CG1-CZ 4.2Å
604	H	71.6	Confident	89.2	Confident	135 Å²	135	61.4 Å²	61.4	63%	0.625	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.8	122	-177.5	-141.4	69.6	0	0	0	113.5	R602	R602-H604 WeakPolarHBondContact CD-O 3.32Å; R602-H604 PolarHBondContact NE-O 3.15Å
605	P	79	Confident	89.2	Confident	83 Å²	83	62.6 Å²	62.6	54%	0.539	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	cis	-58.3	145.3	-21.2	14.3	-16.4	0	0	0	110.3	R602 L607	R602-P605 PolarHBondContact NE-O 3.12Å; R602-P605 VanDerWaalsContact NH2-CG 3.3Å; R602-P605 PolarHBondContact NH2-O 3.36Å; P605-L607 PolarHBondContact O-N 2.87Å
606	N	81.6	Confident	89.3	Confident	115 Å²	115	61.5 Å²	61.5	62%	0.615	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-50.7	110.1	178.8	-82.7	-35.4	0	0	0	109.7	L70 R602 I603	L70-N606 WeakPolarHBondContact CD1-ND2 3.25Å; R602-N606 CarbonylContact O-C 3.58Å; R602-N606 WeakPolarHBondContact O-CA 3.43Å; I603-N606 PolarHBondContact O-N 3.25Å; I603-N606 PolarHBondContact O-OD1 3.4Å
607	L	89.5	Confident	89.5	Confident	35 Å²	35	56.7 Å²	56.7	18%	0.183	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	112.7	-178.2	178.7	72.5	0	0	0	107.5	V601 R602 P605 L609 M612 A621 L623	V601-L607 CarbonylContact C-O 3.55Å; V601-L607 WeakPolarHBondContact CA-O 3.29Å; R602-L607 HydrophobicContact CB-CB 4.28Å; R602-L607 PolarHBondContact N-O 3.43Å; R602-L607 PolarHBondContact O-N 3.11Å; P605-L607 PolarHBondContact O-N 2.87Å; L607-L609 HydrophobicContact CD2-CD1 4.12Å; L607-L609 HydrophobicContact CD2-CG 4.38Å; L607-L609 HydrophobicContact CG-CD1 4.21Å; L607-L609 PolarHBondContact O-N 3.47Å; L607-M612 HydrophobicContact CD1-SD 3.82Å; L607-M612 HydrophobicContact CG-SD 4.39Å; L607-A621 WeakPolarHBondContact CD2-O 3.02Å; L607-L623 HydrophobicContact CD2-CD2 4.01Å
608	C	91.1	Very high	89.6	Confident	34 Å²	34	52.2 Å²	52.2	23%	0.23	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	105	168.7	180	0	0	0	0	107.9	E599 V601 S610 S611	E599-C608 PolarHBondContact OE2-SG 2.94Å; V601-C608 HydrophobicContact CG1-CB 4.16Å; C608-S610 PolarHBondContact O-N 2.66Å; C608-S611 PolarHBondContact O-N 3.39Å; C608-S611 PolarHBondContact O-OG 3.34Å
609	L	91.2	Very high	89.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-66.8	-26.5	178.2	-67.1	73.3	0	0	0	110.3	L581 I600 R602 L607 S611 M612 L623 L629	L581-L609 HydrophobicContact CD1-CB 4.49Å; L581-L609 HydrophobicContact CD2-CB 4.19Å; L581-L609 HydrophobicContact CD2-CD2 3.75Å; L581-L609 HydrophobicContact CD2-CG 4.32Å; I600-L609 HydrophobicContact CB-CB 4.25Å; I600-L609 HydrophobicContact CG2-CB 4.34Å; I600-L609 HydrophobicContact CG2-CD1 4.33Å; I600-L609 HydrophobicContact CG2-CD2 4.02Å; I600-L609 HydrophobicContact CG2-CG 4.49Å; I600-L609 WeakPolarHBondContact O-CB 3.31Å; I600-L609 PolarHBondContact O-N 2.93Å; R602-L609 HydrophobicContact CB-CD1 4.4Å; L607-L609 HydrophobicContact CD2-CD1 4.12Å; L607-L609 HydrophobicContact CD2-CG 4.38Å; L607-L609 HydrophobicContact CG-CD1 4.21Å; L607-L609 PolarHBondContact O-N 3.47Å; L609-S611 VanDerWaalsContact C-N 3.28Å; L609-S611 PolarHBondContact O-N 2.89Å; L609-M612 WeakPolarHBondContact O-CB 3.4Å; L609-M612 PolarHBondContact O-N 3.32Å; L609-L623 HydrophobicContact CD1-CD2 4.33Å; L609-L623 HydrophobicContact CD2-CD1 3.66Å; L609-L623 HydrophobicContact CD2-CD2 4.13Å; L609-L623 HydrophobicContact CD2-CG 4.32Å; L609-L623 HydrophobicContact CG-CD2 4.46Å; L609-L629 HydrophobicContact CD1-CD2 3.88Å; L609-L629 HydrophobicContact CD2-CD1 3.76Å; L609-L629 HydrophobicContact CD2-CD2 4.1Å
610	S	89.6	Confident	89.3	Confident	9 Å²	9	57.4 Å²	57.4	6%	0.063	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-72	-17.6	180	-61.1	0	0	0	0	114.6	H585 F595 E599 I600 C608	H585-S610 PolarHBondContact CE1-OG 3.35Å; F595-S610 WeakPolarHBondContact CE2-O 3.41Å; F595-S610 VanDerWaalsContact CZ-O 3.31Å; F595-S610 WeakPolarHBondContact CZ-O 3.28Å; E599-S610 WeakPolarHBondContact CA-OG 3.47Å; I600-S610 PolarHBondContact N-OG 2.9Å; I600-S610 PolarHBondContact O-N 3.48Å; C608-S610 PolarHBondContact O-N 2.66Å
611	S	88.8	Confident	89.1	Confident	97 Å²	97	57.5 Å²	57.5	68%	0.678	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-89.1	-9.6	172.8	68.1	0	0	0	0	113	C608 L609	C608-S611 PolarHBondContact O-N 3.39Å; C608-S611 PolarHBondContact O-OG 3.34Å; L609-S611 VanDerWaalsContact C-N 3.28Å; L609-S611 PolarHBondContact O-N 2.89Å
612	M	89.6	Confident	88.9	Confident	49 Å²	49	58.5 Å²	58.5	24%	0.241	34%	0.335	C	S	.	.	S	Bend	trans	-82.4	160.2	178.8	-57.5	-171.1	78.9	0	0	111.6	L581 L607 L609 Q614 I616 A621	L581-M612 HydrophobicContact CD1-CB 3.72Å; L581-M612 HydrophobicContact CD1-SD 4.37Å; L607-M612 HydrophobicContact CD1-SD 3.82Å; L607-M612 HydrophobicContact CG-SD 4.39Å; L609-M612 WeakPolarHBondContact O-CB 3.4Å; L609-M612 PolarHBondContact O-N 3.32Å; M612-Q614 PolarHBondContact O-N 3.13Å; M612-I616 HydrophobicContact CB-CD1 4.2Å; M612-I616 HydrophobicContact CE-CD1 4.05Å; M612-I616 HydrophobicContact CE-CG2 4.39Å; M612-A621 HydrophobicContact CE-CB 4.19Å; M612-A621 HydrophobicContact SD-CB 3.89Å
613	H	90.3	Very high	88.9	Confident	129 Å²	129	57.8 Å²	57.8	60%	0.597	33%	0.333	S	S	*	.			trans	-67.6	131.2	177.3	-169.2	-96.1	0	0	0	111	S615 I616	H613-S615 PolarHBondContact CE1-OG 3.42Å; H613-S615 VanDerWaalsContact CE1-OG 3.26Å; H613-S615 WeakPolarHBondContact ND1-CB 3.47Å; H613-S615 PolarHBondContact ND1-N 3.1Å; H613-S615 PolarHBondContact ND1-OG 3.47Å; H613-S615 PolarHBondContact O-N 3.23Å; H613-I616 HydrophobicContact CB-CD1 3.81Å; H613-I616 HydrophobicContact CB-CG1 4.1Å; H613-I616 VanDerWaalsContact O-CB 3.28Å; H613-I616 WeakPolarHBondContact O-CB 3.18Å; H613-I616 VanDerWaalsContact O-CG1 3.31Å; H613-I616 WeakPolarHBondContact O-CG1 3.46Å; H613-I616 PolarHBondContact O-N 3.2Å
614	Q	90.4	Very high	89	Confident	85 Å²	85	57.5 Å²	57.5	40%	0.397	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.4	-171.7	-61.5	177.9	19.6	0	0	113.9	L581 Q582 M612 I616	L581-Q614 PolarHBondContact N-O 3.05Å; Q582-Q614 HydrophobicContact CB-CB 4.07Å; Q582-Q614 WeakPolarHBondContact CB-O 3.29Å; Q582-Q614 PolarHBondContact N-O 3.38Å; M612-Q614 PolarHBondContact O-N 3.13Å; Q614-I616 VanDerWaalsContact C-N 3.29Å; Q614-I616 PolarHBondContact O-N 2.95Å
615	S	91.5	Very high	89.9	Confident	62 Å²	62	54.5 Å²	54.5	43%	0.434	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-6	178.3	78.3	0	0	0	0	114.8	H613	H613-S615 PolarHBondContact CE1-OG 3.42Å; H613-S615 VanDerWaalsContact CE1-OG 3.26Å; H613-S615 WeakPolarHBondContact ND1-CB 3.47Å; H613-S615 PolarHBondContact ND1-N 3.1Å; H613-S615 PolarHBondContact ND1-OG 3.47Å; H613-S615 PolarHBondContact O-N 3.23Å
616	I	92.5	Very high	90.4	Very high	40 Å²	40	58.6 Å²	58.6	21%	0.205	34%	0.338	C	S	.	.			trans	-71.7	139.3	-178.7	-68.3	172.3	0	0	0	109.2	K580 L581 M612 H613 Q614 V620 A621	K580-I616 WeakPolarHBondContact CA-O 3.09Å; L581-I616 HydrophobicContact CD1-CB 4.25Å; L581-I616 HydrophobicContact CD1-CG2 4.49Å; L581-I616 PolarHBondContact N-O 3.39Å; M612-I616 HydrophobicContact CB-CD1 4.2Å; M612-I616 HydrophobicContact CE-CD1 4.05Å; M612-I616 HydrophobicContact CE-CG2 4.39Å; H613-I616 HydrophobicContact CB-CD1 3.81Å; H613-I616 HydrophobicContact CB-CG1 4.1Å; H613-I616 VanDerWaalsContact O-CB 3.28Å; H613-I616 WeakPolarHBondContact O-CB 3.18Å; H613-I616 VanDerWaalsContact O-CG1 3.31Å; H613-I616 WeakPolarHBondContact O-CG1 3.46Å; H613-I616 PolarHBondContact O-N 3.2Å; Q614-I616 VanDerWaalsContact C-N 3.29Å; Q614-I616 PolarHBondContact O-N 2.95Å; I616-V620 HydrophobicContact CG2-CB 3.82Å; I616-V620 HydrophobicContact CG2-CG1 3.79Å; I616-A621 HydrophobicContact CG2-CB 3.97Å
617	S	94.6	Very high	90.9	Very high	24 Å²	24	54.5 Å²	54.5	17%	0.168	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-81.7	160.5	175.7	64.3	0	0	0	0	112.4	L579 T619 V620 A621	L579-S617 CarbonylContact O-C 3.48Å; L579-S617 WeakPolarHBondContact O-CA 3.36Å; S617-T619 VanDerWaalsContact C-N 3.29Å; S617-T619 PolarHBondContact O-N 3Å; S617-V620 PolarHBondContact O-N 3.12Å; S617-V620 VanDerWaalsContact OG-CG2 3.24Å; S617-V620 WeakPolarHBondContact OG-CG2 3.47Å; S617-V620 PolarHBondContact OG-N 3.32Å; S617-A621 WeakPolarHBondContact O-CB 3.43Å; S617-A621 PolarHBondContact O-N 2.63Å
618	L	93.4	Very high	91.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-43.3	178.7	-56.8	-175.2	0	0	0	112.7	I559 L561 L575 P577 L579 L581 L584 A621 G622 L623	I559-L618 HydrophobicContact CG2-CD1 3.79Å; L561-L618 HydrophobicContact CD1-CD1 4.1Å; L575-L618 HydrophobicContact CB-CD1 3.93Å; L575-L618 HydrophobicContact CD1-CD1 3.88Å; P577-L618 PolarHBondContact O-N 2.59Å; L579-L618 HydrophobicContact CB-CD1 3.99Å; L579-L618 HydrophobicContact CB-CG 4.11Å; L579-L618 HydrophobicContact CD2-CD1 4.3Å; L579-L618 WeakPolarHBondContact O-CG 3.04Å; L579-L618 PolarHBondContact O-N 3.34Å; L581-L618 HydrophobicContact CD2-CD2 4.06Å; L584-L618 HydrophobicContact CD1-CD2 3.46Å; L584-L618 VanDerWaalsContact CD1-CD2 3.46Å; L584-L618 HydrophobicContact CG-CD2 4.14Å; L618-A621 PolarHBondContact O-N 3.09Å; L618-G622 PolarHBondContact O-N 3.41Å; L618-L623 HydrophobicContact CB-CD1 4.13Å; L618-L623 HydrophobicContact CD2-CD1 3.84Å; L618-L623 HydrophobicContact CG-CD1 4.48Å; L618-L623 WeakPolarHBondContact O-CB 3.43Å; L618-L623 PolarHBondContact O-N 3.29Å; L618-L623 VanDerWaalsContact O-N 3.08Å
619	T	91.5	Very high	91.3	Very high	80 Å²	80	53 Å²	53	49%	0.491	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-42.3	176.2	-53.1	0	0	0	0	112.6	P577 S617 A621 G622	P577-T619 WeakPolarHBondContact CB-OG1 3.18Å; P577-T619 PolarHBondContact O-N 3.29Å; P577-T619 VanDerWaalsContact O-N 3.1Å; P577-T619 PolarHBondContact O-OG1 3.18Å; P577-T619 VanDerWaalsContact O-OG1 3.08Å; S617-T619 VanDerWaalsContact C-N 3.29Å; S617-T619 PolarHBondContact O-N 3Å; T619-A621 VanDerWaalsContact C-N 3.29Å; T619-A621 PolarHBondContact O-N 3.22Å; T619-G622 WeakPolarHBondContact O-CA 3.09Å; T619-G622 PolarHBondContact O-N 2.98Å
620	V	91.7	Very high	91.5	Very high	105 Å²	105	55.6 Å²	55.6	64%	0.636	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-27.7	-179.1	177.3	0	0	0	0	111	I616 S617 G622	I616-V620 HydrophobicContact CG2-CB 3.82Å; I616-V620 HydrophobicContact CG2-CG1 3.79Å; S617-V620 PolarHBondContact O-N 3.12Å; S617-V620 VanDerWaalsContact OG-CG2 3.24Å; S617-V620 WeakPolarHBondContact OG-CG2 3.47Å; S617-V620 PolarHBondContact OG-N 3.32Å; V620-G622 PolarHBondContact O-N 2.97Å
621	A	91.3	Very high	91.8	Very high	6 Å²	6	55.5 Å²	55.5	5%	0.05	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-12.2	168.8	0	0	0	0	0	112.7	L581 L607 M612 I616 S617 L618 T619 L623	L581-A621 HydrophobicContact CD1-CB 4.29Å; L581-A621 HydrophobicContact CD2-CB 4.35Å; L607-A621 WeakPolarHBondContact CD2-O 3.02Å; M612-A621 HydrophobicContact CE-CB 4.19Å; M612-A621 HydrophobicContact SD-CB 3.89Å; I616-A621 HydrophobicContact CG2-CB 3.97Å; S617-A621 WeakPolarHBondContact O-CB 3.43Å; S617-A621 PolarHBondContact O-N 2.63Å; L618-A621 PolarHBondContact O-N 3.09Å; T619-A621 VanDerWaalsContact C-N 3.29Å; T619-A621 PolarHBondContact O-N 3.22Å; A621-L623 HydrophobicContact CB-CG 4.37Å
622	G	90.6	Very high	91.9	Very high	36 Å²	36	54.8 Å²	54.8	37%	0.371	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	22.7	-179.6	0	0	0	0	0	113.5	R602 L618 T619 V620	R602-G622 PolarHBondContact NH1-O 3.41Å; L618-G622 PolarHBondContact O-N 3.41Å; T619-G622 WeakPolarHBondContact O-CA 3.09Å; T619-G622 PolarHBondContact O-N 2.98Å; V620-G622 PolarHBondContact O-N 2.97Å
623	L	91.8	Very high	92	Very high	6 Å²	6	58.1 Å²	58.1	3%	0.031	32%	0.318	C	S	.	.			trans	-81	139.6	173.3	-57.9	178.3	0	0	0	111.1	I559 L561 L607 L609 L618 A621 D627 L629	I559-L623 HydrophobicContact CD1-CB 3.84Å; I559-L623 VanDerWaalsContact CD1-O 3.25Å; I559-L623 WeakPolarHBondContact CD1-O 3.48Å; L561-L623 HydrophobicContact CD1-CD1 3.97Å; L561-L623 HydrophobicContact CD2-CB 4.5Å; L607-L623 HydrophobicContact CD2-CD2 4.01Å; L609-L623 HydrophobicContact CD1-CD2 4.33Å; L609-L623 HydrophobicContact CD2-CD1 3.66Å; L609-L623 HydrophobicContact CD2-CD2 4.13Å; L609-L623 HydrophobicContact CD2-CG 4.32Å; L609-L623 HydrophobicContact CG-CD2 4.46Å; L618-L623 HydrophobicContact CB-CD1 4.13Å; L618-L623 HydrophobicContact CD2-CD1 3.84Å; L618-L623 HydrophobicContact CG-CD1 4.48Å; L618-L623 WeakPolarHBondContact O-CB 3.43Å; L618-L623 PolarHBondContact O-N 3.29Å; L618-L623 VanDerWaalsContact O-N 3.08Å; A621-L623 HydrophobicContact CB-CG 4.37Å; L623-D627 WeakPolarHBondContact CA-OD2 3.44Å; L623-L629 HydrophobicContact CD1-CD1 4.29Å; L623-L629 HydrophobicContact CD2-CD2 3.78Å
624	C	88.3	Confident	91.8	Very high	78 Å²	78	60 Å²	60	53%	0.527	32%	0.32	S	S	.	.			trans	-119.5	160.6	177.2	-70.6	0	0	0	0	111.7	L561 K626 D627	L561-C624 WeakPolarHBondContact CD2-O 2.78Å; C624-K626 PolarHBondContact O-N 2.97Å; C624-D627 PolarHBondContact N-OD2 2.9Å; C624-D627 VanDerWaalsContact O-CB 3.27Å; C624-D627 WeakPolarHBondContact O-CB 3.28Å; C624-D627 PolarHBondContact O-N 3.28Å
625	T	90.9	Very high	91.8	Very high	72 Å²	72	58.7 Å²	58.7	44%	0.442	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	134	173.8	-63.8	0	0	0	0	109.9	E560 D627	E560-T625 HydrophobicContact CB-CG2 3.97Å; T625-D627 VanDerWaalsContact C-N 3.35Å
626	K	88.5	Confident	91.9	Very high	168 Å²	168	58.5 Å²	58.5	73%	0.73	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	7.8	-173.7	-52.3	174.5	-179.3	179.9	0	115.6	E560 C624	E560-K626 WeakPolarHBondContact O-CA 3.31Å; E560-K626 PolarHBondContact O-N 3.04Å; C624-K626 PolarHBondContact O-N 2.97Å
627	D	92.3	Very high	91.8	Very high	29 Å²	29	59.6 Å²	59.6	16%	0.155	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-62.3	141.3	169.8	-81.1	-0.4	0	0	0	110.9	L561 L562 R602 L623 C624 T625	L561-D627 HydrophobicContact CD2-CB 3.86Å; L562-D627 PolarHBondContact N-O 3.33Å; R602-D627 VanDerWaalsContact CD-OD2 3.31Å; R602-D627 WeakPolarHBondContact CD-OD2 3.49Å; R602-D627 IonicContact CZ-OD2 3.57Å; R602-D627 IonicContact NE-OD2 3.8Å; R602-D627 IonicContact NH1-OD2 2.66Å; R602-D627 PolarHBondContact NH1-OD2 2.99Å; L623-D627 WeakPolarHBondContact CA-OD2 3.44Å; C624-D627 PolarHBondContact N-OD2 2.9Å; C624-D627 VanDerWaalsContact O-CB 3.27Å; C624-D627 WeakPolarHBondContact O-CB 3.28Å; C624-D627 PolarHBondContact O-N 3.28Å; T625-D627 VanDerWaalsContact C-N 3.35Å
628	T	94	Very high	91.7	Very high	39 Å²	39	61.6 Å²	61.6	24%	0.239	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.5	174.6	-57.4	0	0	0	0	109.8	L562 R564 F630	L562-T628 HydrophobicContact CB-CG2 4.46Å; L562-T628 HydrophobicContact CD2-CG2 3.99Å; L562-T628 HydrophobicContact CG-CG2 4.29Å; L562-T628 CarbonylContact O-C 3.58Å; L562-T628 WeakPolarHBondContact O-CA 3.46Å; R564-T628 HydrophobicContact CG-CG2 3.95Å; T628-F630 HydrophobicContact CG2-CD2 4.1Å; T628-F630 HydrophobicContact CG2-CE2 3.52Å; T628-F630 HydrophobicContact CG2-CZ 3.87Å
629	L	95.1	Very high	91.6	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132	171.9	-53.8	-172.1	0	0	0	109.9	L561 L562 F563 R564 L584 I600 V601 R602 L609 L623	L561-L629 HydrophobicContact CD1-CD1 4.19Å; L562-L629 PolarHBondContact O-N 3.23Å; F563-L629 CarbonylContact C-O 3.59Å; F563-L629 WeakPolarHBondContact CA-O 3.42Å; F563-L629 HydrophobicContact CD1-CB 4Å; F563-L629 HydrophobicContact CD1-CD1 4.12Å; F563-L629 HydrophobicContact CD1-CG 4.27Å; F563-L629 HydrophobicContact CE1-CB 4.44Å; F563-L629 HydrophobicContact CE1-CD1 3.7Å; F563-L629 HydrophobicContact CE1-CG 4.26Å; R564-L629 PolarHBondContact N-O 2.87Å; L584-L629 HydrophobicContact CD1-CD1 4.47Å; I600-L629 HydrophobicContact CG2-CB 4.04Å; I600-L629 HydrophobicContact CG2-CD1 3.89Å; I600-L629 HydrophobicContact CG2-CG 4.46Å; V601-L629 CarbonylContact O-C 3.59Å; V601-L629 WeakPolarHBondContact O-CA 3.43Å; R602-L629 HydrophobicContact CB-CD2 3.95Å; L609-L629 HydrophobicContact CD1-CD2 3.88Å; L609-L629 HydrophobicContact CD2-CD1 3.76Å; L609-L629 HydrophobicContact CD2-CD2 4.1Å; L623-L629 HydrophobicContact CD1-CD1 4.29Å; L623-L629 HydrophobicContact CD2-CD2 3.78Å
630	F	95.3	Very high	91.6	Very high	53 Å²	53	64.5 Å²	64.5	23%	0.232	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.8	175.1	-64.3	-105.8	0	0	0	107.8	R564 I600 V601 I603 T628	R564-F630 HydrophobicContact CB-CD1 3.99Å; R564-F630 HydrophobicContact CB-CE1 4.37Å; R564-F630 HydrophobicContact CB-CG 4.39Å; R564-F630 VanDerWaalsContact CD-CZ 3.46Å; R564-F630 HydrophobicContact CG-CD1 4.47Å; R564-F630 HydrophobicContact CG-CE1 4.38Å; I600-F630 WeakPolarHBondContact CA-O 3.38Å; V601-F630 HydrophobicContact CG2-CB 3.85Å; V601-F630 PolarHBondContact N-O 3.41Å; V601-F630 PolarHBondContact O-N 3.05Å; I603-F630 HydrophobicContact CB-CE2 4.37Å; I603-F630 HydrophobicContact CD1-CD1 4.17Å; I603-F630 HydrophobicContact CD1-CD2 3.72Å; I603-F630 HydrophobicContact CD1-CE1 3.78Å; I603-F630 HydrophobicContact CD1-CE2 3.32Å; I603-F630 HydrophobicContact CD1-CG 4.14Å; I603-F630 HydrophobicContact CD1-CZ 3.36Å; I603-F630 HydrophobicContact CG1-CD2 3.71Å; I603-F630 HydrophobicContact CG1-CE2 3.62Å; I603-F630 HydrophobicContact CG1-CG 4.38Å; I603-F630 HydrophobicContact CG1-CZ 4.2Å; T628-F630 HydrophobicContact CG2-CD2 4.1Å; T628-F630 HydrophobicContact CG2-CE2 3.52Å; T628-F630 HydrophobicContact CG2-CZ 3.87Å
631	I	94.7	Very high	91.6	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.036	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112.3	169.8	-62.3	75.4	0	0	0	104.1	F563 R564 L565 P566 F588 Y593 Y598 E599	F563-I631 HydrophobicContact CB-CD1 4.02Å; R564-I631 WeakPolarHBondContact O-CD1 3.37Å; R564-I631 PolarHBondContact O-N 3.05Å; L565-I631 HydrophobicContact CD2-CD1 4.07Å; L565-I631 HydrophobicContact CD2-CG1 4.27Å; P566-I631 VanDerWaalsContact CD-O 3.3Å; P566-I631 WeakPolarHBondContact CD-O 3.48Å; P566-I631 HydrophobicContact CG-CB 4.44Å; P566-I631 HydrophobicContact CG-CG2 3.97Å; P566-I631 VanDerWaalsContact CG-O 3.27Å; P566-I631 WeakPolarHBondContact CG-O 3.22Å; F588-I631 HydrophobicContact CD1-CD1 4.48Å; F588-I631 HydrophobicContact CD1-CG1 3.97Å; F588-I631 HydrophobicContact CD2-CG1 4.38Å; F588-I631 HydrophobicContact CE1-CD1 3.74Å; F588-I631 HydrophobicContact CE1-CG1 3.73Å; F588-I631 HydrophobicContact CE2-CD1 4.3Å; F588-I631 HydrophobicContact CE2-CG1 4.16Å; F588-I631 HydrophobicContact CG-CG1 4.3Å; F588-I631 HydrophobicContact CZ-CD1 3.63Å; F588-I631 HydrophobicContact CZ-CG1 3.83Å; Y593-I631 HydrophobicContact CD1-CG2 4.42Å; Y593-I631 HydrophobicContact CD2-CG2 4.48Å; Y593-I631 HydrophobicContact CG-CG2 4.02Å; Y598-I631 HydrophobicContact CD1-CG2 4.29Å; Y598-I631 HydrophobicContact CG-CG2 4.43Å; E599-I631 WeakPolarHBondContact O-CA 3.29Å
632	Q	92.9	Very high	91.6	Very high	82 Å²	82	65.9 Å²	65.9	38%	0.383	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.5	-175.3	67.6	-178.5	21.5	0	0	110.6	Y598 E599 V601	Y598-Q632 CarbonylContact C-O 3.4Å; Y598-Q632 WeakPolarHBondContact CA-O 3.3Å; E599-Q632 HydrophobicContact CG-CG 3.76Å; E599-Q632 PolarHBondContact N-O 3.5Å; E599-Q632 PolarHBondContact O-N 2.93Å; E599-Q632 PolarHBondContact OE1-NE2 3.29Å; V601-Q632 HydrophobicContact CG2-CG 4.09Å
633	E	91.1	Very high	91.7	Very high	119 Å²	119	68.4 Å²	68.4	56%	0.556	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	139.5	173.9	-166.1	166.2	-166.6	0	0	109.3	K597 Y598	K597-E633 WeakPolarHBondContact CE-OE1 3.12Å; K597-E633 HydrophobicContact CG-CG 4.26Å; K597-E633 IonicContact NZ-OE1 2.69Å; K597-E633 PolarHBondContact NZ-OE1 3.32Å; Y598-E633 HydrophobicContact CD1-CB 4.27Å; Y598-E633 HydrophobicContact CE1-CB 4.06Å
634	R	85.2	Confident	91.6	Very high	168 Å²	168	74.1 Å²	74.1	63%	0.634	36%	0.358	S	S	*	.			trans	-69.5	0	-177.8	-74.1	-177.1	179.9	-158.6	-2.6	113.8	F595 K597 Y598 E599	F595-R634 VanDerWaalsContact CE2-NH2 3.26Å; F595-R634 PolarHBondContact O-NE 2.94Å; F595-R634 VanDerWaalsContact O-NE 3.13Å; F595-R634 PolarHBondContact O-NH2 3.05Å; K597-R634 PolarHBondContact O-N 3.35Å; Y598-R634 PolarHBondContact O-NE 3.25Å; E599-R634 HydrophobicContact CB-CG 3.91Å; E599-R634 HydrophobicContact CG-CG 3.97Å

Retrieved 634 of 634 residues in 256 ms (Link to these results)

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