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Pleckstrin homology domain-containing family M member 2

Plays a role in lysosomes movement and localization at the cell periphery acting as an effector of ARL8B. Required for ARL8B to exert its effects on lysosome location, recruits kinesin-1 to lysosomes and hence direct their movement toward microtubule plus ends. Binding to ARL8B provides a link from lysosomal membranes to plus-end-directed motility. Critical factor involved in NK cell-mediated cytotoxicity. Drives the polarization of cytolytic granules and microtubule-organizing centers (MTOCs) toward the immune synapse between effector NK lymphocytes and target cells. Required for maintenance of the Golgi apparatus organization. May play a role in membrane tubulation.

AlphaFold DB , UniProt , Accession Z4YJW6, Species MOUSE (Mus musculus, Mouse), Gene Plekhm2, Length 1,033 aa.

						>Z4YJW6_MOUSE|Z4YJW6|Plekhm2
MEPREVKDRILENISLSVKKLQSYFAACEDETPAIRNHDKVLQRLCEHLDHALLYGLQDLSSGYWVLVVHFTRREAIRQIEVLQHVATNLGRSRAWLYLALNENSLESYLRLFQENLGLLQKYYVRNALVCSHDHLTLFLTLVSGLEFIRFDLDLDAPYLDLAPYMPDYYKPQYLLDFEDRLPSSVHGSDSLSLNSFNSVTSTNLEWDDSAIAPSSEDYDFGDVFPAVPSVPSTDWEDGDLTDTISGPRSTASDLTSSKTSTKSPTQRHNPFNEEQAETASSDTTPVHTTSQEKEEAQAPDQPDACTELEVIRVTKKKKIGKKKKTKLDEDASPLHPTSSQQKCGQQGEGDGLVGTPGLARDPSDTVLASPQEQGEGLSSTAGSSELSELSQMGLLIPEMKDTSMECLGQPLSKVIDKLHGQLDPSTWCSHADPPEQSFRAGSPGEAPEKPPFCDFSEGLPAPMDFYRFTVESPSTVAPGGGHHDPPGPSQPLHVPGSPAAALQEEEEGGGRGEGQTSQPLEDRQGEEIQEPEPQEPDSQLPLVSQEPVPEPVSQPEPGTHEALCKLKRDQPSPCLSSAEDSGVEEGQGSPSEMTHPSEFRVDNNHLLLLMIHVFRENEEQLFKMIRMSTGHMEGNLQLLYVLLTDCYVYLLRKGATEKPYLVEEAVSYNELDYVSVGLDQQTVKLVCTNRRKQFLLDTADVALAELFLASLKSAMIKGCREPPYPSILTDATMEKLALAKFVAQESKCEASAVTVHFYGLVHWEDPMEEALGPVPCQCSPAEGTITKEGMLHYKASTSYLGKEHWKACFVVLSNGILYQYPDRTDVIPLLSVNMGGEQCGGCRRSNTTDRPHAFQVILADRPCLELSADSEAEMADWMQHLCQAVSKGVIPQGIAPSPCIPCCLVITEDRLFTCHEDCQTSFFRSLGTARLADITAISTELGKEYCVLEFSQDSPQLLQPWVIYLSCTSELDRFLTALSSGWKAIYQVDLPHKAIHEASIKQKFEDALSLIHSAWQRSDSLCRGRASRDPWC
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.3	Very low	76.7	Confident	87 Å²	87	72 Å²	72	43%	0.429	33%	0.334	S	S	.	.				0	121.1	0	-166.9	164.4	-85.8	0	0	108.5	E5 V6 A211	M1-E5 VanDerWaalsContact C-OE2 3.25Å; M1-E5 WeakPolarHBondContact CA-OE2 3.43Å; M1-E5 HydrophobicContact CG-CB 3.68Å; M1-E5 VanDerWaalsContact CG-OE2 3.24Å; M1-E5 WeakPolarHBondContact CG-OE2 3.18Å; M1-V6 HydrophobicContact CB-CG2 4.47Å; M1-V6 HydrophobicContact CG-CG2 3.7Å; M1-V6 HydrophobicContact SD-CG2 3.82Å; M1-A211 PolarHBondContact N-O 3.22Å
2	E	59.5	Low	78	Confident	120 Å²	120	75.6 Å²	75.6	56%	0.561	35%	0.351	S	S	*	.			trans	-70.5	155.7	176.4	-78	-140.1	136.8	0	0	112.2	R4 E5 V6	E2-R4 PolarHBondContact O-N 3.03Å; E2-E5 HydrophobicContact CB-CG 4.19Å; E2-E5 PolarHBondContact N-OE2 3.28Å; E2-E5 PolarHBondContact O-N 3.34Å; E2-V6 PolarHBondContact O-N 3.3Å
3	P	62.9	Low	79	Confident	69 Å²	69	74.2 Å²	74.2	45%	0.448	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-6	173.5	-22.4	34.1	0	0	0	115.5	K7	P3-K7 VanDerWaalsContact O-CE 3.3Å; P3-K7 WeakPolarHBondContact O-CE 3.48Å; P3-K7 WeakPolarHBondContact O-CG 3.35Å
4	R	66.9	Low	80	Confident	166 Å²	166	68.9 Å²	68.9	63%	0.626	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-58.6	173.3	-171.6	177.4	-172.9	171.8	3.1	110.7	E2 V6 K7 D8	E2-R4 PolarHBondContact O-N 3.03Å; R4-V6 PolarHBondContact O-N 3.21Å; R4-V6 VanDerWaalsContact O-N 3.09Å; R4-K7 WeakPolarHBondContact O-CA 3.48Å; R4-K7 WeakPolarHBondContact O-CB 3.45Å; R4-K7 PolarHBondContact O-N 3.07Å; R4-D8 WeakPolarHBondContact CG-OD2 3.47Å; R4-D8 PolarHBondContact O-N 3.41Å; R4-D8 VanDerWaalsContact O-N 3.1Å
5	E	76.6	Confident	80.8	Confident	97 Å²	97	65.9 Å²	65.9	45%	0.453	31%	0.313	S	S	.	.	H	α-helix	trans	-48.1	-39.7	175.7	-62.2	168.2	172.5	0	0	113	M1 E2 K7 D8 R9	M1-E5 VanDerWaalsContact C-OE2 3.25Å; M1-E5 WeakPolarHBondContact CA-OE2 3.43Å; M1-E5 HydrophobicContact CG-CB 3.68Å; M1-E5 VanDerWaalsContact CG-OE2 3.24Å; M1-E5 WeakPolarHBondContact CG-OE2 3.18Å; E2-E5 HydrophobicContact CB-CG 4.19Å; E2-E5 PolarHBondContact N-OE2 3.28Å; E2-E5 PolarHBondContact O-N 3.34Å; E5-K7 VanDerWaalsContact C-N 3.34Å; E5-K7 PolarHBondContact O-N 2.87Å; E5-D8 PolarHBondContact O-N 3.37Å; E5-R9 WeakPolarHBondContact O-CB 3.34Å; E5-R9 PolarHBondContact O-N 3.1Å
6	V	82.8	Confident	81.3	Confident	29 Å²	29	67.9 Å²	67.9	18%	0.176	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-39.5	176.1	-177	0	0	0	0	112.2	M1 E2 R4 I10 Y55	M1-V6 HydrophobicContact CB-CG2 4.47Å; M1-V6 HydrophobicContact CG-CG2 3.7Å; M1-V6 HydrophobicContact SD-CG2 3.82Å; E2-V6 PolarHBondContact O-N 3.3Å; R4-V6 PolarHBondContact O-N 3.21Å; R4-V6 VanDerWaalsContact O-N 3.09Å; V6-I10 HydrophobicContact CG1-CD1 4.08Å; V6-I10 WeakPolarHBondContact O-CD1 3.12Å; V6-I10 WeakPolarHBondContact O-CG1 3.46Å; V6-I10 PolarHBondContact O-N 2.85Å; V6-I10 VanDerWaalsContact O-N 3.16Å; V6-Y55 HydrophobicContact CB-CE2 4.32Å; V6-Y55 HydrophobicContact CG1-CD2 4.26Å; V6-Y55 HydrophobicContact CG1-CE2 3.49Å; V6-Y55 VanDerWaalsContact CG1-CE2 3.49Å
7	K	86.7	Confident	81.8	Confident	14 Å²	14	64.7 Å²	64.7	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-71.6	-44.3	178.7	-60.8	175.6	-170.2	-165.2	0	111.2	P3 R4 E5 R9 I10 L11 Y55 N127 A128 L129 H135	P3-K7 VanDerWaalsContact O-CE 3.3Å; P3-K7 WeakPolarHBondContact O-CE 3.48Å; P3-K7 WeakPolarHBondContact O-CG 3.35Å; R4-K7 WeakPolarHBondContact O-CA 3.48Å; R4-K7 WeakPolarHBondContact O-CB 3.45Å; R4-K7 PolarHBondContact O-N 3.07Å; E5-K7 VanDerWaalsContact C-N 3.34Å; E5-K7 PolarHBondContact O-N 2.87Å; K7-R9 VanDerWaalsContact C-N 3.3Å; K7-R9 PolarHBondContact O-N 2.97Å; K7-I10 WeakPolarHBondContact O-CB 3.43Å; K7-I10 PolarHBondContact O-N 3.46Å; K7-L11 WeakPolarHBondContact O-CG 3.41Å; K7-L11 PolarHBondContact O-N 3.23Å; K7-Y55 HydrophobicContact CD-CE1 4.5Å; K7-Y55 HydrophobicContact CG-CD1 4.37Å; K7-Y55 HydrophobicContact CG-CE1 3.69Å; K7-N127 WeakPolarHBondContact CE-O 3.24Å; K7-N127 PolarHBondContact NZ-O 3.16Å; K7-A128 WeakPolarHBondContact CE-O 3.3Å; K7-A128 PolarHBondContact NZ-O 2.82Å; K7-L129 HydrophobicContact CG-CB 4.41Å; K7-H135 VanDerWaalsContact CB-CD2 3.44Å; K7-H135 WeakPolarHBondContact CB-CD2 3.15Å
8	D	88.4	Confident	82.3	Confident	66 Å²	66	61.3 Å²	61.3	35%	0.353	30%	0.295	S	S	.	.	H	α-helix	trans	-60.3	-43.8	-179.2	-63.2	-41.6	0	0	0	109.9	R4 E5 I10 L11 E12 H135	R4-D8 WeakPolarHBondContact CG-OD2 3.47Å; R4-D8 PolarHBondContact O-N 3.41Å; R4-D8 VanDerWaalsContact O-N 3.1Å; E5-D8 PolarHBondContact O-N 3.37Å; D8-I10 PolarHBondContact O-N 2.87Å; D8-L11 PolarHBondContact O-N 3.13Å; D8-E12 WeakPolarHBondContact O-CB 3.45Å; D8-E12 PolarHBondContact O-N 3.34Å; D8-H135 IonicContact OD1-CD2 3.31Å; D8-H135 IonicContact OD1-NE2 3.88Å
9	R	88.8	Confident	82.7	Confident	128 Å²	128	64.5 Å²	64.5	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-63.4	-34.2	172.5	-169.9	173.4	65.3	174	-0.1	114	E5 K7 N13	E5-R9 WeakPolarHBondContact O-CB 3.34Å; E5-R9 PolarHBondContact O-N 3.1Å; K7-R9 VanDerWaalsContact C-N 3.3Å; K7-R9 PolarHBondContact O-N 2.97Å; R9-N13 PolarHBondContact O-N 3.14Å; R9-N13 PolarHBondContact O-OD1 3.13Å
10	I	89.8	Confident	82.7	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-66.8	-44	173.6	-70.9	164.7	0	0	0	110.5	V6 K7 D8 N13 I14 A52 Y55 L129	V6-I10 HydrophobicContact CG1-CD1 4.08Å; V6-I10 WeakPolarHBondContact O-CD1 3.12Å; V6-I10 WeakPolarHBondContact O-CG1 3.46Å; V6-I10 PolarHBondContact O-N 2.85Å; V6-I10 VanDerWaalsContact O-N 3.16Å; K7-I10 WeakPolarHBondContact O-CB 3.43Å; K7-I10 PolarHBondContact O-N 3.46Å; D8-I10 PolarHBondContact O-N 2.87Å; I10-N13 PolarHBondContact O-N 3.01Å; I10-I14 HydrophobicContact CG2-CD1 4.13Å; I10-I14 WeakPolarHBondContact O-CG1 3.37Å; I10-I14 PolarHBondContact O-N 3.5Å; I10-A52 HydrophobicContact CG2-CB 3.65Å; I10-Y55 HydrophobicContact CD1-CD1 4.4Å; I10-Y55 HydrophobicContact CD1-CD2 3.94Å; I10-Y55 HydrophobicContact CD1-CE2 4.48Å; I10-Y55 HydrophobicContact CD1-CG 3.89Å; I10-L129 HydrophobicContact CB-CD1 4.08Å; I10-L129 HydrophobicContact CG2-CD1 3.62Å
11	L	92.1	Very high	82.9	Confident	11 Å²	11	61.8 Å²	61.8	6%	0.058	29%	0.293	C	S	.	.	H	α-helix	trans	-66	-38.5	177	-66	173.9	0	0	0	111.9	K7 D8 I14 S15 L129 H135 L138 F139 L142	K7-L11 WeakPolarHBondContact O-CG 3.41Å; K7-L11 PolarHBondContact O-N 3.23Å; D8-L11 PolarHBondContact O-N 3.13Å; L11-I14 PolarHBondContact O-N 2.86Å; L11-S15 WeakPolarHBondContact O-CB 3.47Å; L11-S15 PolarHBondContact O-N 3.37Å; L11-L129 HydrophobicContact CD2-CD1 4.13Å; L11-L129 HydrophobicContact CD2-CD2 4.4Å; L11-L129 HydrophobicContact CG-CD1 4.27Å; L11-H135 HydrophobicContact CD1-CB 4.03Å; L11-L138 HydrophobicContact CD1-CB 3.98Å; L11-L138 HydrophobicContact CD1-CD1 4.04Å; L11-F139 HydrophobicContact CD2-CB 3.68Å; L11-F139 HydrophobicContact CD2-CG 4.34Å; L11-L142 HydrophobicContact CB-CD1 4.4Å; L11-L142 HydrophobicContact CD2-CD1 4.45Å; L11-L142 VanDerWaalsContact O-CD1 3.25Å; L11-L142 WeakPolarHBondContact O-CD1 2.85Å
12	E	92.1	Very high	84.6	Confident	115 Å²	115	61.3 Å²	61.3	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-49.3	174.2	-178.6	172.6	-143.9	0	0	111.6	D8 I14 S15 L16	D8-E12 WeakPolarHBondContact O-CB 3.45Å; D8-E12 PolarHBondContact O-N 3.34Å; E12-I14 VanDerWaalsContact C-N 3.3Å; E12-I14 PolarHBondContact O-N 3.31Å; E12-S15 CarbonylContact O-C 3.51Å; E12-S15 WeakPolarHBondContact O-CA 3.2Å; E12-S15 VanDerWaalsContact O-CB 3.31Å; E12-S15 WeakPolarHBondContact O-CB 3.21Å; E12-S15 PolarHBondContact O-N 3.25Å; E12-L16 HydrophobicContact CG-CD1 4.26Å; E12-L16 WeakPolarHBondContact O-CG 3.24Å; E12-L16 PolarHBondContact O-N 3.08Å
13	N	90.6	Very high	85.6	Confident	57 Å²	57	58.8 Å²	58.8	31%	0.305	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-35.8	176.8	-75.2	10.3	0	0	0	112.9	R9 I10 S17 H48	R9-N13 PolarHBondContact O-N 3.14Å; R9-N13 PolarHBondContact O-OD1 3.13Å; I10-N13 PolarHBondContact O-N 3.01Å; N13-S17 WeakPolarHBondContact O-CB 3.35Å; N13-S17 PolarHBondContact O-N 3.12Å; N13-S17 PolarHBondContact O-OG 2.95Å; N13-H48 VanDerWaalsContact CB-CD2 3.41Å; N13-H48 WeakPolarHBondContact CB-CD2 3.22Å; N13-H48 WeakPolarHBondContact CB-NE2 3.12Å; N13-H48 PolarHBondContact ND2-NE2 2.99Å; N13-H48 VanDerWaalsContact ND2-NE2 3.11Å
14	I	93.4	Very high	86	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-45.5	170.6	-67.6	168.9	0	0	0	109.8	I10 L11 E12 L16 S17 V18 H48 L49 A52 F139 L142	I10-I14 HydrophobicContact CG2-CD1 4.13Å; I10-I14 WeakPolarHBondContact O-CG1 3.37Å; I10-I14 PolarHBondContact O-N 3.5Å; L11-I14 PolarHBondContact O-N 2.86Å; E12-I14 VanDerWaalsContact C-N 3.3Å; E12-I14 PolarHBondContact O-N 3.31Å; I14-L16 PolarHBondContact O-N 2.98Å; I14-S17 PolarHBondContact O-N 3.27Å; I14-S17 VanDerWaalsContact O-N 3.13Å; I14-V18 HydrophobicContact CG2-CG2 4.02Å; I14-V18 WeakPolarHBondContact O-CB 3.16Å; I14-V18 VanDerWaalsContact O-CG2 3.28Å; I14-V18 WeakPolarHBondContact O-CG2 3.13Å; I14-V18 PolarHBondContact O-N 3.43Å; I14-H48 HydrophobicContact CG1-CB 3.76Å; I14-L49 HydrophobicContact CD1-CD2 4.3Å; I14-L49 HydrophobicContact CG2-CD2 4.42Å; I14-A52 HydrophobicContact CD1-CB 3.73Å; I14-F139 HydrophobicContact CD1-CD2 4.01Å; I14-F139 HydrophobicContact CD1-CE2 3.78Å; I14-F139 HydrophobicContact CD1-CZ 4.49Å; I14-L142 HydrophobicContact CB-CD1 4.19Å; I14-L142 HydrophobicContact CG2-CB 4.03Å; I14-L142 HydrophobicContact CG2-CD1 3.95Å
15	S	92.4	Very high	86.2	Confident	25 Å²	25	52 Å²	52	18%	0.175	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-45.3	178.5	-168.1	0	0	0	0	111.9	L11 E12 V18 K19	L11-S15 WeakPolarHBondContact O-CB 3.47Å; L11-S15 PolarHBondContact O-N 3.37Å; E12-S15 CarbonylContact O-C 3.51Å; E12-S15 WeakPolarHBondContact O-CA 3.2Å; E12-S15 VanDerWaalsContact O-CB 3.31Å; E12-S15 WeakPolarHBondContact O-CB 3.21Å; E12-S15 PolarHBondContact O-N 3.25Å; S15-V18 PolarHBondContact O-N 3.42Å; S15-K19 VanDerWaalsContact O-CB 3.26Å; S15-K19 WeakPolarHBondContact O-CB 3.24Å; S15-K19 WeakPolarHBondContact O-CG 3.33Å; S15-K19 PolarHBondContact O-N 2.61Å; S15-K19 WeakPolarHBondContact OG-CE 3.26Å
16	L	88.1	Confident	86.1	Confident	98 Å²	98	51.6 Å²	51.6	51%	0.513	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-42.4	174.2	-68.1	171.1	0	0	0	111.7	E12 I14 K20	E12-L16 HydrophobicContact CG-CD1 4.26Å; E12-L16 WeakPolarHBondContact O-CG 3.24Å; E12-L16 PolarHBondContact O-N 3.08Å; I14-L16 PolarHBondContact O-N 2.98Å; L16-K20 WeakPolarHBondContact O-CB 3.42Å; L16-K20 PolarHBondContact O-N 3.31Å
17	S	90.4	Very high	85.3	Confident	13 Å²	13	52.9 Å²	52.9	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-43	177.9	-59	0	0	0	0	112.5	N13 I14 L21 H48	N13-S17 WeakPolarHBondContact O-CB 3.35Å; N13-S17 PolarHBondContact O-N 3.12Å; N13-S17 PolarHBondContact O-OG 2.95Å; I14-S17 PolarHBondContact O-N 3.27Å; I14-S17 VanDerWaalsContact O-N 3.13Å; S17-L21 WeakPolarHBondContact O-CB 3.38Å; S17-L21 PolarHBondContact O-N 3.05Å; S17-L21 VanDerWaalsContact O-N 3.07Å; S17-H48 PolarHBondContact OG-ND1 3.25Å
18	V	90.7	Very high	84.2	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-51.8	176.4	171.7	0	0	0	0	110.6	I14 S15 K20 L21 Q22 L45 L146	I14-V18 HydrophobicContact CG2-CG2 4.02Å; I14-V18 WeakPolarHBondContact O-CB 3.16Å; I14-V18 VanDerWaalsContact O-CG2 3.28Å; I14-V18 WeakPolarHBondContact O-CG2 3.13Å; I14-V18 PolarHBondContact O-N 3.43Å; S15-V18 PolarHBondContact O-N 3.42Å; V18-K20 VanDerWaalsContact C-N 3.31Å; V18-K20 PolarHBondContact O-N 2.67Å; V18-L21 PolarHBondContact O-N 3.08Å; V18-L21 VanDerWaalsContact O-N 3.13Å; V18-Q22 HydrophobicContact CG1-CG 4.24Å; V18-Q22 WeakPolarHBondContact O-CB 3.19Å; V18-Q22 WeakPolarHBondContact O-CG 3.05Å; V18-Q22 PolarHBondContact O-N 3.32Å; V18-L45 HydrophobicContact CG2-CD1 4.03Å; V18-L146 HydrophobicContact CG1-CD2 4.18Å; V18-L146 HydrophobicContact CG2-CD1 4.48Å; V18-L146 HydrophobicContact CG2-CD2 4.05Å; V18-L146 HydrophobicContact CG2-CG 4.28Å
19	K	89.1	Confident	82.7	Confident	121 Å²	121	59.2 Å²	59.2	53%	0.526	31%	0.309	S	S	.	.	H	α-helix	trans	-56.2	-44.6	176.9	-74.7	169.5	-179.4	175.1	0	111.6	S15 L21 Q22 S23	S15-K19 VanDerWaalsContact O-CB 3.26Å; S15-K19 WeakPolarHBondContact O-CB 3.24Å; S15-K19 WeakPolarHBondContact O-CG 3.33Å; S15-K19 PolarHBondContact O-N 2.61Å; S15-K19 WeakPolarHBondContact OG-CE 3.26Å; K19-L21 PolarHBondContact O-N 2.86Å; K19-Q22 PolarHBondContact O-N 3.25Å; K19-S23 WeakPolarHBondContact O-CB 3.28Å; K19-S23 PolarHBondContact O-N 2.94Å; K19-S23 PolarHBondContact O-OG 3.27Å
20	K	84.3	Confident	81	Confident	68 Å²	68	61 Å²	61	30%	0.296	33%	0.328	S	S	.	.	H	α-helix	trans	-59.3	-47.8	176.5	178.7	165.5	169.7	160.4	0	110.7	L16 V18 S23 Y24 V41 E179	L16-K20 WeakPolarHBondContact O-CB 3.42Å; L16-K20 PolarHBondContact O-N 3.31Å; V18-K20 VanDerWaalsContact C-N 3.31Å; V18-K20 PolarHBondContact O-N 2.67Å; K20-S23 PolarHBondContact O-N 3.02Å; K20-S23 PolarHBondContact O-OG 2.88Å; K20-Y24 HydrophobicContact CD-CE2 4.19Å; K20-Y24 WeakPolarHBondContact CE-OH 3.25Å; K20-Y24 HydrophobicContact CG-CD2 4.27Å; K20-Y24 HydrophobicContact CG-CE2 3.71Å; K20-Y24 PolarHBondContact NZ-OH 3.04Å; K20-Y24 WeakPolarHBondContact O-CD2 3.02Å; K20-Y24 PolarHBondContact O-N 3.32Å; K20-V41 HydrophobicContact CD-CG1 4.41Å; K20-V41 HydrophobicContact CG-CG1 4.07Å; K20-E179 WeakPolarHBondContact CE-OE1 3.4Å; K20-E179 IonicContact NZ-OE1 3.26Å; K20-E179 PolarHBondContact NZ-OE1 3.16Å
21	L	85.6	Confident	79.5	Confident	4 Å²	4	69 Å²	69	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-65.4	-42.7	179.2	-163.2	67.9	0	0	0	112.7	S17 V18 K19 S23 Y24 F25 I35 V41 L45 L146 I149 F151	S17-L21 WeakPolarHBondContact O-CB 3.38Å; S17-L21 PolarHBondContact O-N 3.05Å; S17-L21 VanDerWaalsContact O-N 3.07Å; V18-L21 PolarHBondContact O-N 3.08Å; V18-L21 VanDerWaalsContact O-N 3.13Å; K19-L21 PolarHBondContact O-N 2.86Å; L21-S23 PolarHBondContact O-N 2.98Å; L21-Y24 PolarHBondContact O-N 3.42Å; L21-F25 WeakPolarHBondContact O-CD2 3.29Å; L21-F25 PolarHBondContact O-N 2.99Å; L21-F25 VanDerWaalsContact O-N 3.15Å; L21-I35 HydrophobicContact CD1-CD1 3.76Å; L21-I35 HydrophobicContact CD1-CG1 4.49Å; L21-I35 HydrophobicContact CD2-CD1 3.83Å; L21-I35 HydrophobicContact CG-CD1 4.1Å; L21-V41 HydrophobicContact CB-CG1 4.19Å; L21-V41 HydrophobicContact CD1-CB 3.93Å; L21-V41 HydrophobicContact CD1-CG1 3.58Å; L21-V41 HydrophobicContact CG-CG1 4.5Å; L21-L45 HydrophobicContact CD2-CD2 3.83Å; L21-L146 HydrophobicContact CD2-CD2 4.09Å; L21-I149 HydrophobicContact CB-CD1 4.4Å; L21-I149 HydrophobicContact CD2-CD1 3.89Å; L21-I149 HydrophobicContact CD2-CG2 4.04Å; L21-I149 HydrophobicContact CG-CD1 3.97Å; L21-I149 HydrophobicContact CG-CG2 4.46Å; L21-F151 HydrophobicContact CD2-CE1 4.13Å; L21-F151 HydrophobicContact CD2-CZ 3.95Å
22	Q	85.2	Confident	78.1	Confident	78 Å²	78	71.4 Å²	71.4	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-58.9	-43.8	173.5	-72.6	174	-28.2	0	0	112.1	V18 K19 Y24 F25 A26 G145 I149	V18-Q22 HydrophobicContact CG1-CG 4.24Å; V18-Q22 WeakPolarHBondContact O-CB 3.19Å; V18-Q22 WeakPolarHBondContact O-CG 3.05Å; V18-Q22 PolarHBondContact O-N 3.32Å; K19-Q22 PolarHBondContact O-N 3.25Å; Q22-Y24 VanDerWaalsContact C-N 3.3Å; Q22-Y24 PolarHBondContact O-N 3.11Å; Q22-F25 PolarHBondContact O-N 3.36Å; Q22-F25 VanDerWaalsContact O-N 3.16Å; Q22-A26 PolarHBondContact O-N 3.32Å; Q22-G145 VanDerWaalsContact NE2-CA 3.26Å; Q22-G145 PolarHBondContact NE2-O 3.11Å; Q22-I149 HydrophobicContact CG-CD1 4.25Å
23	S	79.8	Confident	77	Confident	67 Å²	67	68 Å²	68	47%	0.469	37%	0.369	S	S	.	.	H	α-helix	trans	-63.3	-33.6	-179.1	72.4	0	0	0	0	113.2	K19 K20 L21	K19-S23 WeakPolarHBondContact O-CB 3.28Å; K19-S23 PolarHBondContact O-N 2.94Å; K19-S23 PolarHBondContact O-OG 3.27Å; K20-S23 PolarHBondContact O-N 3.02Å; K20-S23 PolarHBondContact O-OG 2.88Å; L21-S23 PolarHBondContact O-N 2.98Å
24	Y	71.6	Confident	76.6	Confident	65 Å²	65	66.8 Å²	66.8	26%	0.255	37%	0.367	S	S	.	.	H	α-helix	trans	-75.5	-34.5	173.3	-65.8	-45.7	0	0	0	113.1	K20 L21 Q22 A26 A27 C28 V41 E179 L182	K20-Y24 HydrophobicContact CD-CE2 4.19Å; K20-Y24 WeakPolarHBondContact CE-OH 3.25Å; K20-Y24 HydrophobicContact CG-CD2 4.27Å; K20-Y24 HydrophobicContact CG-CE2 3.71Å; K20-Y24 PolarHBondContact NZ-OH 3.04Å; K20-Y24 WeakPolarHBondContact O-CD2 3.02Å; K20-Y24 PolarHBondContact O-N 3.32Å; L21-Y24 PolarHBondContact O-N 3.42Å; Q22-Y24 VanDerWaalsContact C-N 3.3Å; Q22-Y24 PolarHBondContact O-N 3.11Å; Y24-A26 VanDerWaalsContact C-N 3.28Å; Y24-A26 PolarHBondContact O-N 3.43Å; Y24-A27 PolarHBondContact O-N 2.96Å; Y24-A27 VanDerWaalsContact O-N 3.12Å; Y24-C28 PolarHBondContact O-SG 2.86Å; Y24-V41 HydrophobicContact CD2-CG1 4.38Å; Y24-V41 HydrophobicContact CD2-CG2 4.03Å; Y24-V41 HydrophobicContact CE2-CG1 4.37Å; Y24-V41 HydrophobicContact CE2-CG2 3.74Å; Y24-E179 HydrophobicContact CE2-CG 4.11Å; Y24-E179 PolarHBondContact OH-OE1 2.99Å; Y24-L182 HydrophobicContact CD1-CD1 4.43Å
25	F	72.6	Confident	76.3	Confident	27 Å²	27	66.9 Å²	66.9	12%	0.118	37%	0.367	C	S	.	.	H	α-helix	trans	-67.2	-31.2	174.4	-92.8	-107.4	0	0	0	112.2	L21 Q22 A27 C28 T32 P33 I35 I149 F178	L21-F25 WeakPolarHBondContact O-CD2 3.29Å; L21-F25 PolarHBondContact O-N 2.99Å; L21-F25 VanDerWaalsContact O-N 3.15Å; Q22-F25 PolarHBondContact O-N 3.36Å; Q22-F25 VanDerWaalsContact O-N 3.16Å; F25-A27 PolarHBondContact O-N 3.1Å; F25-C28 PolarHBondContact O-N 3.38Å; F25-T32 HydrophobicContact CD1-CG2 4.12Å; F25-T32 HydrophobicContact CE1-CG2 4.33Å; F25-P33 WeakPolarHBondContact CZ-O 3.46Å; F25-I35 HydrophobicContact CE2-CD1 3.63Å; F25-I35 HydrophobicContact CE2-CG1 3.72Å; F25-I35 HydrophobicContact CZ-CD1 3.86Å; F25-I35 HydrophobicContact CZ-CG1 3.82Å; F25-I149 HydrophobicContact CD1-CG1 4.48Å; F25-I149 HydrophobicContact CD1-CG2 4.47Å; F25-I149 HydrophobicContact CD2-CG2 4.32Å; F25-I149 HydrophobicContact CE1-CG2 4.09Å; F25-I149 HydrophobicContact CE2-CG2 3.94Å; F25-I149 HydrophobicContact CG-CG1 4.43Å; F25-I149 HydrophobicContact CZ-CG2 3.82Å; F25-F178 HydrophobicContact CD2-CZ 4.4Å; F25-F178 HydrophobicContact CE2-CE1 4.03Å; F25-F178 HydrophobicContact CE2-CE2 4.15Å; F25-F178 AromaticContact CE2-CZ 3.5Å; F25-F178 HydrophobicContact CE2-CZ 3.5Å; F25-F178 HydrophobicContact CZ-CE2 4.15Å; F25-F178 AromaticContact CZ-CZ 3.68Å; F25-F178 HydrophobicContact CZ-CZ 3.68Å
26	A	73.6	Confident	76.1	Confident	88 Å²	88	70.4 Å²	70.4	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-17.3	171.5	0	0	0	0	0	114.1	Q22 Y24	Q22-A26 PolarHBondContact O-N 3.32Å; Y24-A26 VanDerWaalsContact C-N 3.28Å; Y24-A26 PolarHBondContact O-N 3.43Å
27	A	66.1	Low	76.1	Confident	56 Å²	56	66.4 Å²	66.4	46%	0.463	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	8.9	179.4	0	0	0	0	0	114	Y24 F25	Y24-A27 PolarHBondContact O-N 2.96Å; Y24-A27 VanDerWaalsContact O-N 3.12Å; F25-A27 PolarHBondContact O-N 3.1Å
28	C	63.9	Low	75.8	Confident	22 Å²	22	66.3 Å²	66.3	15%	0.149	35%	0.354	C	S	.	.			trans	-109.1	92.9	-178.3	-63.5	0	0	0	0	110.9	Y24 F25 T32 L182	Y24-C28 PolarHBondContact O-SG 2.86Å; F25-C28 PolarHBondContact O-N 3.38Å; C28-T32 HydrophobicContact CB-CG2 4.06Å; C28-L182 VanDerWaalsContact SG-CD2 3.54Å
29	E	56.3	Low	75.7	Confident	192 Å²	192	66.1 Å²	66.1	90%	0.897	35%	0.353	S	S	*	.	S	Bend	trans	-74.6	-44.5	-170.1	-62.8	-166.9	124.7	0	0	115.5
30	D	53.7	Low	75.4	Confident	165 Å²	165	63.5 Å²	63.5	88%	0.882	34%	0.341	S	S	*	.	S	Bend	trans	-106.9	-37.3	-168.4	-89.1	-45.5	0	0	0	115.9
31	E	57.5	Low	75.3	Confident	173 Å²	173	60.5 Å²	60.5	81%	0.808	33%	0.329	S	S	*	.			trans	-137.1	127.3	170.7	-72.5	-164.9	164.3	0	0	109.9	P33	E31-P33 VanDerWaalsContact O-CD 3.3Å; E31-P33 WeakPolarHBondContact O-CD 3.41Å
32	T	64	Low	75.4	Confident	62 Å²	62	60.4 Å²	60.4	38%	0.38	33%	0.328	S	S	.	.			trans	-86.2	110.2	172.5	36.2	0	0	0	0	110	F25 C28	F25-T32 HydrophobicContact CD1-CG2 4.12Å; F25-T32 HydrophobicContact CE1-CG2 4.33Å; C28-T32 HydrophobicContact CB-CG2 4.06Å
33	P	69.3	Low	75.6	Confident	44 Å²	44	57.5 Å²	57.5	29%	0.286	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.2	155.5	176.4	-8.4	23.8	0	0	0	110.2	F25 E31 F178	F25-P33 WeakPolarHBondContact CZ-O 3.46Å; E31-P33 VanDerWaalsContact O-CD 3.3Å; E31-P33 WeakPolarHBondContact O-CD 3.41Å; P33-F178 HydrophobicContact CB-CD2 4.44Å; P33-F178 HydrophobicContact CB-CE2 3.69Å; P33-F178 HydrophobicContact CB-CZ 3.94Å; P33-F178 HydrophobicContact CG-CE1 4.45Å; P33-F178 HydrophobicContact CG-CE2 4.13Å; P33-F178 HydrophobicContact CG-CZ 3.88Å; P33-F178 WeakPolarHBondContact O-CE2 3.4Å
34	A	81.3	Confident	75.9	Confident	31 Å²	31	59 Å²	59	26%	0.256	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-84.9	143.2	169.6	0	0	0	0	0	111.2	R150 D152	A34-R150 WeakPolarHBondContact CA-O 3.41Å; A34-R150 HydrophobicContact CB-CB 4.31Å; A34-D152 HydrophobicContact CB-CB 3.46Å; A34-D152 VanDerWaalsContact CB-CB 3.46Å
35	I	86.4	Confident	76.9	Confident	1 Å²	1	56 Å²	56	1%	0.005	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-84.2	137.3	-179.1	-50.9	153	0	0	0	110	L21 F25 D39 L42 I149 R150 F151 D152 L153 F178	L21-I35 HydrophobicContact CD1-CD1 3.76Å; L21-I35 HydrophobicContact CD1-CG1 4.49Å; L21-I35 HydrophobicContact CD2-CD1 3.83Å; L21-I35 HydrophobicContact CG-CD1 4.1Å; F25-I35 HydrophobicContact CE2-CD1 3.63Å; F25-I35 HydrophobicContact CE2-CG1 3.72Å; F25-I35 HydrophobicContact CZ-CD1 3.86Å; F25-I35 HydrophobicContact CZ-CG1 3.82Å; I35-D39 HydrophobicContact CG2-CB 3.92Å; I35-L42 HydrophobicContact CG2-CB 3.73Å; I35-L42 HydrophobicContact CG2-CD1 4.21Å; I35-L42 HydrophobicContact CG2-CD2 4.5Å; I35-L42 HydrophobicContact CG2-CG 4.37Å; I35-I149 HydrophobicContact CD1-CG2 3.3Å; I35-R150 PolarHBondContact N-O 3.48Å; I35-F151 HydrophobicContact CB-CD1 4.15Å; I35-F151 HydrophobicContact CD1-CD1 3.84Å; I35-F151 HydrophobicContact CD1-CE1 3.54Å; I35-F151 HydrophobicContact CD1-CZ 4.11Å; I35-D152 CarbonylContact O-C 3.54Å; I35-D152 PolarHBondContact O-N 2.56Å; I35-L153 WeakPolarHBondContact O-CD2 3.2Å; I35-F178 HydrophobicContact CB-CD2 4.36Å; I35-F178 HydrophobicContact CB-CE2 4.41Å; I35-F178 HydrophobicContact CG1-CD2 3.96Å; I35-F178 HydrophobicContact CG1-CE2 3.68Å; I35-F178 HydrophobicContact CG1-CZ 4.34Å
36	R	89.1	Confident	77.9	Confident	99 Å²	99	54.7 Å²	54.7	37%	0.374	29%	0.292	S	S	.	.			trans	-120.2	162	-174.8	-66.4	-179.9	170.8	148.9	5.9	112.5	H38 D39 L42 D152	R36-H38 PolarHBondContact O-N 2.83Å; R36-D39 PolarHBondContact N-OD2 3.49Å; R36-D39 WeakPolarHBondContact O-CB 3.19Å; R36-D39 PolarHBondContact O-N 3.46Å; R36-L42 VanDerWaalsContact O-CD2 3.29Å; R36-L42 WeakPolarHBondContact O-CD2 3.35Å; R36-D152 HydrophobicContact CG-CB 4.21Å; R36-D152 IonicContact CZ-OD2 4Å; R36-D152 VanDerWaalsContact CZ-OD2 3.31Å; R36-D152 IonicContact NE-OD2 3.03Å; R36-D152 PolarHBondContact NE-OD2 3.32Å; R36-D152 IonicContact NH2-OD2 3.22Å; R36-D152 PolarHBondContact NH2-OD2 2.79Å
37	N	88.7	Confident	78.7	Confident	14 Å²	14	54.5 Å²	54.5	8%	0.075	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-34.8	-179	-61.1	42.5	0	0	0	114.6	Q43 L153 D154 Y159 M166	N37-Q43 PolarHBondContact O-NE2 3.26Å; N37-L153 VanDerWaalsContact OD1-CA 3.24Å; N37-L153 WeakPolarHBondContact OD1-CA 3.27Å; N37-D154 PolarHBondContact ND2-O 2.65Å; N37-D154 PolarHBondContact OD1-N 3.11Å; N37-Y159 WeakPolarHBondContact CB-OH 3.3Å; N37-Y159 PolarHBondContact ND2-OH 3.32Å; N37-M166 HydrophobicContact CB-SD 4.25Å
38	H	84	Confident	80	Confident	11 Å²	11	53.4 Å²	53.4	5%	0.051	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.8	-175	72.3	-81.4	0	0	0	114.5	R36 K40 Q43 M166 L176 D177 R181	R36-H38 PolarHBondContact O-N 2.83Å; H38-K40 PolarHBondContact O-N 3.22Å; H38-Q43 VanDerWaalsContact CA-NE2 3.31Å; H38-Q43 PolarHBondContact O-NE2 3.21Å; H38-M166 HydrophobicContact CB-CE 3.37Å; H38-L176 PolarHBondContact NE2-O 2.68Å; H38-D177 IonicContact CD2-OD1 2.61Å; H38-D177 PolarHBondContact CD2-OD1 2.72Å; H38-R181 PolarHBondContact CE1-NH2 3.11Å; H38-R181 PolarHBondContact NE2-NH2 3.29Å
39	D	86.8	Confident	81.5	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.255	C	S	.	.			trans	-72.8	123.9	-174.7	-63.8	-35.9	0	0	0	112.6	I35 R36 V41 L42 Q43 D177 F178 R181	I35-D39 HydrophobicContact CG2-CB 3.92Å; R36-D39 PolarHBondContact N-OD2 3.49Å; R36-D39 WeakPolarHBondContact O-CB 3.19Å; R36-D39 PolarHBondContact O-N 3.46Å; D39-V41 PolarHBondContact O-N 3.35Å; D39-V41 VanDerWaalsContact O-N 3.08Å; D39-L42 HydrophobicContact CB-CB 4.49Å; D39-L42 WeakPolarHBondContact O-CB 3.28Å; D39-L42 PolarHBondContact O-N 3.33Å; D39-L42 VanDerWaalsContact O-N 3.09Å; D39-Q43 PolarHBondContact O-N 2.85Å; D39-Q43 VanDerWaalsContact O-N 3.17Å; D39-D177 WeakPolarHBondContact OD1-CA 3.31Å; D39-F178 HydrophobicContact CB-CB 4Å; D39-F178 PolarHBondContact OD1-N 3.4Å; D39-R181 IonicContact OD1-CZ 2.96Å; D39-R181 IonicContact OD1-NH1 3.06Å; D39-R181 IonicContact OD1-NH2 3.12Å; D39-R181 PolarHBondContact OD1-NH2 2.7Å; D39-R181 IonicContact OD2-CZ 3.42Å; D39-R181 IonicContact OD2-NH1 3.62Å; D39-R181 PolarHBondContact OD2-NH1 2.94Å; D39-R181 IonicContact OD2-NH2 2.62Å
40	K	83.4	Confident	83.2	Confident	65 Å²	65	43.4 Å²	43.4	28%	0.283	21%	0.213	S	C	.	.	H	α-helix	trans	-57.5	-27.2	-173.4	-52.2	-174.5	-171.9	78.5	0	115.1	H38 R44 D177	H38-K40 PolarHBondContact O-N 3.22Å; K40-R44 PolarHBondContact O-NH1 3.32Å; K40-D177 WeakPolarHBondContact CE-OD2 3.17Å; K40-D177 VanDerWaalsContact CG-OD2 3.26Å; K40-D177 WeakPolarHBondContact CG-OD2 3.49Å; K40-D177 IonicContact NZ-OD2 2.94Å; K40-D177 PolarHBondContact NZ-OD2 2.62Å
41	V	82.3	Confident	85	Confident	6 Å²	6	40 Å²	40	4%	0.036	19%	0.192	C	C	.	.	H	α-helix	trans	-76.8	-39.1	-179.9	-161.4	0	0	0	0	110.8	K20 L21 Y24 D39 L45 E179	K20-V41 HydrophobicContact CD-CG1 4.41Å; K20-V41 HydrophobicContact CG-CG1 4.07Å; L21-V41 HydrophobicContact CB-CG1 4.19Å; L21-V41 HydrophobicContact CD1-CB 3.93Å; L21-V41 HydrophobicContact CD1-CG1 3.58Å; L21-V41 HydrophobicContact CG-CG1 4.5Å; Y24-V41 HydrophobicContact CD2-CG1 4.38Å; Y24-V41 HydrophobicContact CD2-CG2 4.03Å; Y24-V41 HydrophobicContact CE2-CG1 4.37Å; Y24-V41 HydrophobicContact CE2-CG2 3.74Å; D39-V41 PolarHBondContact O-N 3.35Å; D39-V41 VanDerWaalsContact O-N 3.08Å; V41-L45 PolarHBondContact O-N 3.01Å; V41-E179 HydrophobicContact CG2-CG 3.67Å; V41-E179 WeakPolarHBondContact CG2-OE1 3.46Å
42	L	88.3	Confident	86.7	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-46.1	173	-179.6	79.9	0	0	0	111.2	I35 R36 D39 R44 L45 C46 F151 L153	I35-L42 HydrophobicContact CG2-CB 3.73Å; I35-L42 HydrophobicContact CG2-CD1 4.21Å; I35-L42 HydrophobicContact CG2-CD2 4.5Å; I35-L42 HydrophobicContact CG2-CG 4.37Å; R36-L42 VanDerWaalsContact O-CD2 3.29Å; R36-L42 WeakPolarHBondContact O-CD2 3.35Å; D39-L42 HydrophobicContact CB-CB 4.49Å; D39-L42 WeakPolarHBondContact O-CB 3.28Å; D39-L42 PolarHBondContact O-N 3.33Å; D39-L42 VanDerWaalsContact O-N 3.09Å; L42-R44 VanDerWaalsContact C-N 3.28Å; L42-R44 PolarHBondContact O-N 2.99Å; L42-L45 CarbonylContact O-C 3.52Å; L42-L45 WeakPolarHBondContact O-CA 3.42Å; L42-L45 WeakPolarHBondContact O-CB 3.44Å; L42-L45 PolarHBondContact O-N 2.96Å; L42-C46 PolarHBondContact O-N 3.41Å; L42-F151 HydrophobicContact CD1-CD1 3.78Å; L42-F151 HydrophobicContact CD1-CE1 3.67Å; L42-L153 HydrophobicContact CD1-CD1 4.12Å; L42-L153 HydrophobicContact CD1-CD2 4.07Å; L42-L153 HydrophobicContact CD2-CD1 4.32Å; L42-L153 HydrophobicContact CD2-CD2 3.31Å; L42-L153 HydrophobicContact CD2-CG 4.44Å; L42-L153 HydrophobicContact CG-CD2 4.32Å
43	Q	88.6	Confident	88.1	Confident	18 Å²	18	28.9 Å²	28.9	8%	0.084	14%	0.135	C	C	.	.	H	α-helix	trans	-54.8	-45	-175.3	-76.4	163.4	12.2	0	0	111.7	N37 H38 D39 E47	N37-Q43 PolarHBondContact O-NE2 3.26Å; H38-Q43 VanDerWaalsContact CA-NE2 3.31Å; H38-Q43 PolarHBondContact O-NE2 3.21Å; D39-Q43 PolarHBondContact O-N 2.85Å; D39-Q43 VanDerWaalsContact O-N 3.17Å; Q43-E47 WeakPolarHBondContact O-CB 3.43Å; Q43-E47 PolarHBondContact O-N 3.46Å
44	R	87.3	Confident	89.1	Confident	99 Å²	99	28.1 Å²	28.1	37%	0.374	13%	0.129	S	C	.	.	H	α-helix	trans	-65.8	-39.4	173.8	-65.9	-176.1	-179	99.2	-9.4	113.1	K40 L42 H48	K40-R44 PolarHBondContact O-NH1 3.32Å; L42-R44 VanDerWaalsContact C-N 3.28Å; L42-R44 PolarHBondContact O-N 2.99Å; R44-H48 PolarHBondContact O-N 2.95Å; R44-H48 PolarHBondContact O-ND1 2.79Å
45	L	92.1	Very high	89.6	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.7	-50.6	177.3	179.2	62.1	0	0	0	110.9	V18 L21 V41 L42 E47 H48 L49 L146 F151	V18-L45 HydrophobicContact CG2-CD1 4.03Å; L21-L45 HydrophobicContact CD2-CD2 3.83Å; V41-L45 PolarHBondContact O-N 3.01Å; L42-L45 CarbonylContact O-C 3.52Å; L42-L45 WeakPolarHBondContact O-CA 3.42Å; L42-L45 WeakPolarHBondContact O-CB 3.44Å; L42-L45 PolarHBondContact O-N 2.96Å; L45-E47 VanDerWaalsContact C-N 3.32Å; L45-E47 PolarHBondContact O-N 2.88Å; L45-H48 PolarHBondContact O-N 3.11Å; L45-L49 HydrophobicContact CD1-CD1 4.02Å; L45-L49 HydrophobicContact CD1-CG 4.11Å; L45-L49 HydrophobicContact CG-CD1 3.85Å; L45-L49 HydrophobicContact CG-CG 4.33Å; L45-L49 WeakPolarHBondContact O-CB 3.39Å; L45-L49 VanDerWaalsContact O-CG 3.25Å; L45-L49 WeakPolarHBondContact O-CG 3.41Å; L45-L49 PolarHBondContact O-N 2.71Å; L45-L146 HydrophobicContact CD2-CD1 3.98Å; L45-L146 HydrophobicContact CD2-CD2 3.97Å; L45-F151 HydrophobicContact CD2-CZ 4.48Å
46	C	92.3	Very high	89.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.1	-36.1	179.1	-70.7	0	0	0	0	112.8	L42 D50 Y98	L42-C46 PolarHBondContact O-N 3.41Å; C46-D50 VanDerWaalsContact O-CB 3.29Å; C46-D50 WeakPolarHBondContact O-CB 3.45Å; C46-D50 PolarHBondContact O-N 2.9Å; C46-Y98 HydrophobicContact CB-CE1 4.15Å
47	E	91.9	Very high	89.6	Confident	84 Å²	84	25.8 Å²	25.8	39%	0.393	12%	0.121	S	C	.	.	H	α-helix	trans	-61.4	-49.1	173.7	-179.5	174.9	-155.5	0	0	112.2	Q43 L45 D50 H51 P164	Q43-E47 WeakPolarHBondContact O-CB 3.43Å; Q43-E47 PolarHBondContact O-N 3.46Å; L45-E47 VanDerWaalsContact C-N 3.32Å; L45-E47 PolarHBondContact O-N 2.88Å; E47-D50 PolarHBondContact O-N 2.74Å; E47-H51 WeakPolarHBondContact O-CB 3.5Å; E47-H51 PolarHBondContact O-N 3.38Å; E47-P164 HydrophobicContact CB-CG 4.42Å
48	H	92.9	Very high	89.6	Confident	34 Å²	34	30.8 Å²	30.8	16%	0.157	14%	0.144	C	C	.	.	H	α-helix	trans	-68.9	-34	178.4	-67.3	110.7	0	0	0	113.1	N13 I14 S17 R44 L45 A52	N13-H48 VanDerWaalsContact CB-CD2 3.41Å; N13-H48 WeakPolarHBondContact CB-CD2 3.22Å; N13-H48 WeakPolarHBondContact CB-NE2 3.12Å; N13-H48 PolarHBondContact ND2-NE2 2.99Å; N13-H48 VanDerWaalsContact ND2-NE2 3.11Å; I14-H48 HydrophobicContact CG1-CB 3.76Å; S17-H48 PolarHBondContact OG-ND1 3.25Å; R44-H48 PolarHBondContact O-N 2.95Å; R44-H48 PolarHBondContact O-ND1 2.79Å; L45-H48 PolarHBondContact O-N 3.11Å; H48-A52 WeakPolarHBondContact O-CB 3.39Å; H48-A52 PolarHBondContact O-N 3.4Å
49	L	94.3	Very high	89.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-44.8	173.6	-68.4	177	0	0	0	112	I14 L45 H51 A52 L53 L97 L101 L106 F139 V143	I14-L49 HydrophobicContact CD1-CD2 4.3Å; I14-L49 HydrophobicContact CG2-CD2 4.42Å; L45-L49 HydrophobicContact CD1-CD1 4.02Å; L45-L49 HydrophobicContact CD1-CG 4.11Å; L45-L49 HydrophobicContact CG-CD1 3.85Å; L45-L49 HydrophobicContact CG-CG 4.33Å; L45-L49 WeakPolarHBondContact O-CB 3.39Å; L45-L49 VanDerWaalsContact O-CG 3.25Å; L45-L49 WeakPolarHBondContact O-CG 3.41Å; L45-L49 PolarHBondContact O-N 2.71Å; L49-H51 VanDerWaalsContact C-N 3.33Å; L49-H51 PolarHBondContact O-N 2.82Å; L49-A52 PolarHBondContact O-N 3.32Å; L49-L53 WeakPolarHBondContact O-CB 3.38Å; L49-L53 WeakPolarHBondContact O-CG 3.42Å; L49-L53 PolarHBondContact O-N 2.95Å; L49-L97 HydrophobicContact CB-CD1 4.23Å; L49-L97 HydrophobicContact CB-CD2 3.88Å; L49-L97 HydrophobicContact CD1-CD1 4.27Å; L49-L101 HydrophobicContact CD1-CD1 4.31Å; L49-L101 HydrophobicContact CD1-CD2 4.28Å; L49-L106 HydrophobicContact CD1-CD2 4.12Å; L49-L106 HydrophobicContact CD2-CD2 4.46Å; L49-F139 HydrophobicContact CD2-CE2 3.53Å; L49-F139 HydrophobicContact CD2-CZ 3.94Å; L49-V143 HydrophobicContact CD2-CG2 4.31Å
50	D	93.6	Very high	89.6	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-43.3	174.9	-161.6	53.4	0	0	0	110.2	C46 E47 L53 L54 Y64 R94 L97 P164	C46-D50 VanDerWaalsContact O-CB 3.29Å; C46-D50 WeakPolarHBondContact O-CB 3.45Å; C46-D50 PolarHBondContact O-N 2.9Å; E47-D50 PolarHBondContact O-N 2.74Å; D50-L53 PolarHBondContact O-N 3.23Å; D50-L54 WeakPolarHBondContact O-CB 3.43Å; D50-L54 WeakPolarHBondContact O-CG 3.41Å; D50-L54 PolarHBondContact O-N 3.14Å; D50-Y64 VanDerWaalsContact OD1-CE1 3.24Å; D50-Y64 WeakPolarHBondContact OD1-CE1 3.36Å; D50-Y64 PolarHBondContact OD1-OH 3.04Å; D50-R94 WeakPolarHBondContact OD1-CG 3.21Å; D50-R94 IonicContact OD1-NE 3.61Å; D50-R94 IonicContact OD2-CZ 2.75Å; D50-R94 VanDerWaalsContact OD2-CZ 3.28Å; D50-R94 IonicContact OD2-NE 3.81Å; D50-R94 PolarHBondContact OD2-NE 2.88Å; D50-R94 IonicContact OD2-NH2 2.86Å; D50-R94 PolarHBondContact OD2-NH2 2.58Å; D50-L97 HydrophobicContact CB-CD2 4.48Å; D50-P164 HydrophobicContact CB-CB 3.73Å; D50-P164 HydrophobicContact CB-CG 4.24Å
51	H	91.4	Very high	89.3	Confident	94 Å²	94	39.7 Å²	39.7	44%	0.435	20%	0.202	S	C	.	.	H	α-helix	trans	-63.4	-43.5	176.4	-175.4	-129.7	0	0	0	112.9	E47 L49 L53 L54 Y55	E47-H51 WeakPolarHBondContact O-CB 3.5Å; E47-H51 PolarHBondContact O-N 3.38Å; L49-H51 VanDerWaalsContact C-N 3.33Å; L49-H51 PolarHBondContact O-N 2.82Å; H51-L53 VanDerWaalsContact C-N 3.32Å; H51-L53 PolarHBondContact O-N 3.4Å; H51-L54 PolarHBondContact O-N 3.01Å; H51-Y55 WeakPolarHBondContact O-CB 3.4Å; H51-Y55 PolarHBondContact O-N 3.08Å
52	A	92.8	Very high	89.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-35	176.3	0	0	0	0	0	113.2	I10 I14 H48 L49 L129 F139	I10-A52 HydrophobicContact CG2-CB 3.65Å; I14-A52 HydrophobicContact CD1-CB 3.73Å; H48-A52 WeakPolarHBondContact O-CB 3.39Å; H48-A52 PolarHBondContact O-N 3.4Å; L49-A52 PolarHBondContact O-N 3.32Å; A52-L129 HydrophobicContact CB-CD1 4.17Å; A52-F139 HydrophobicContact CB-CE1 4.26Å; A52-F139 HydrophobicContact CB-CZ 4.1Å
53	L	92.6	Very high	89.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-77.6	-26	175.3	-68.6	173	0	0	0	112.8	L49 D50 H51 Y64 W96 L97 L110 F113 Y124 V130 F139	L49-L53 WeakPolarHBondContact O-CB 3.38Å; L49-L53 WeakPolarHBondContact O-CG 3.42Å; L49-L53 PolarHBondContact O-N 2.95Å; D50-L53 PolarHBondContact O-N 3.23Å; H51-L53 VanDerWaalsContact C-N 3.32Å; H51-L53 PolarHBondContact O-N 3.4Å; L53-Y64 HydrophobicContact CB-CD1 3.67Å; L53-Y64 HydrophobicContact CB-CD2 4.46Å; L53-Y64 HydrophobicContact CB-CE1 3.65Å; L53-Y64 HydrophobicContact CB-CE2 4.42Å; L53-Y64 HydrophobicContact CB-CG 4.12Å; L53-Y64 HydrophobicContact CD1-CD2 4.22Å; L53-Y64 HydrophobicContact CD1-CE1 4.28Å; L53-Y64 HydrophobicContact CD1-CE2 3.73Å; L53-W96 HydrophobicContact CD1-CZ3 4.28Å; L53-L97 HydrophobicContact CD1-CD1 4.1Å; L53-L110 HydrophobicContact CD2-CD2 4.4Å; L53-F113 HydrophobicContact CD2-CE2 4.02Å; L53-Y124 WeakPolarHBondContact O-CE1 3.43Å; L53-Y124 VanDerWaalsContact O-CZ 3.3Å; L53-Y124 PolarHBondContact O-OH 3.4Å; L53-V130 HydrophobicContact CD2-CG1 4.48Å; L53-F139 HydrophobicContact CD2-CE1 4.26Å
54	L	91.1	Very high	89.7	Confident	28 Å²	28	39.6 Å²	39.6	15%	0.147	20%	0.204	C	C	.	.	H	α-helix	trans	-85.9	-22.1	173.9	-67.8	169.2	0	0	0	113	D50 H51 G56 L57 L60 Y64 L90	D50-L54 WeakPolarHBondContact O-CB 3.43Å; D50-L54 WeakPolarHBondContact O-CG 3.41Å; D50-L54 PolarHBondContact O-N 3.14Å; H51-L54 PolarHBondContact O-N 3.01Å; L54-G56 PolarHBondContact O-N 2.95Å; L54-L57 HydrophobicContact CD2-CD2 3.77Å; L54-L57 WeakPolarHBondContact O-CB 3.46Å; L54-L57 PolarHBondContact O-N 2.84Å; L54-L60 HydrophobicContact CD2-CG 4.46Å; L54-Y64 HydrophobicContact CD2-CD1 3.92Å; L54-Y64 HydrophobicContact CD2-CE1 4.17Å; L54-Y64 HydrophobicContact CG-CD1 4.23Å; L54-Y64 HydrophobicContact CG-CE1 4.14Å; L54-L90 HydrophobicContact CD1-CD1 4.35Å; L54-L90 HydrophobicContact CD2-CD1 4.06Å
55	Y	90.8	Very high	90	Very high	48 Å²	48	35.6 Å²	35.6	19%	0.188	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	103.5	-174.8	-177	-100	0	0	0	112.9	V6 K7 I10 H51 A128 L129	V6-Y55 HydrophobicContact CB-CE2 4.32Å; V6-Y55 HydrophobicContact CG1-CD2 4.26Å; V6-Y55 HydrophobicContact CG1-CE2 3.49Å; V6-Y55 VanDerWaalsContact CG1-CE2 3.49Å; K7-Y55 HydrophobicContact CD-CE1 4.5Å; K7-Y55 HydrophobicContact CG-CD1 4.37Å; K7-Y55 HydrophobicContact CG-CE1 3.69Å; I10-Y55 HydrophobicContact CD1-CD1 4.4Å; I10-Y55 HydrophobicContact CD1-CD2 3.94Å; I10-Y55 HydrophobicContact CD1-CE2 4.48Å; I10-Y55 HydrophobicContact CD1-CG 3.89Å; H51-Y55 WeakPolarHBondContact O-CB 3.4Å; H51-Y55 PolarHBondContact O-N 3.08Å; Y55-A128 WeakPolarHBondContact O-CB 3.26Å; Y55-L129 HydrophobicContact CD1-CB 3.92Å
56	G	86.1	Confident	89.9	Confident	21 Å²	21	37.7 Å²	37.7	22%	0.216	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	11.9	-178.3	0	0	0	0	0	114.9	L54 Y124 V125	L54-G56 PolarHBondContact O-N 2.95Å; G56-Y124 CarbonylContact O-C 3.56Å; G56-Y124 VanDerWaalsContact O-CA 3.29Å; G56-Y124 WeakPolarHBondContact O-CA 3.4Å; G56-V125 PolarHBondContact O-N 3.48Å
57	L	90.8	Very high	89.8	Confident	14 Å²	14	37.7 Å²	37.7	7%	0.073	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-66	136.2	168.3	179.7	70.4	0	0	0	110	L54 D59 L60 G63 Y124	L54-L57 HydrophobicContact CD2-CD2 3.77Å; L54-L57 WeakPolarHBondContact O-CB 3.46Å; L54-L57 PolarHBondContact O-N 2.84Å; L57-D59 WeakPolarHBondContact CD2-O 3.15Å; L57-L60 HydrophobicContact CB-CD1 4.13Å; L57-L60 HydrophobicContact CD2-CD1 4.42Å; L57-G63 VanDerWaalsContact CD2-C 3.42Å; L57-Y124 HydrophobicContact CB-CD1 4.21Å; L57-Y124 HydrophobicContact CB-CE1 3.84Å; L57-Y124 HydrophobicContact CD1-CD2 4.24Å; L57-Y124 HydrophobicContact CD1-CE1 4.22Å; L57-Y124 HydrophobicContact CD1-CE2 3.74Å
58	Q	87.3	Confident	89.8	Confident	118 Å²	118	33.7 Å²	33.7	55%	0.551	18%	0.182	S	C	*	.	S	Bend	trans	-78.1	-26.7	-175.1	-65.8	-179.8	42.7	0	0	113.8	Y123 Y124 V125	Q58-Y123 VanDerWaalsContact CB-O 3.31Å; Q58-Y123 WeakPolarHBondContact CB-O 3.28Å; Q58-Y123 WeakPolarHBondContact CG-O 3.47Å; Q58-Y123 PolarHBondContact N-O 3.07Å; Q58-Y124 PolarHBondContact NE2-O 3.03Å; Q58-V125 HydrophobicContact CG-CG1 3.97Å
59	D	86.1	Confident	89.7	Confident	66 Å²	66	34.2 Å²	34.2	35%	0.353	19%	0.188	S	C	.	.			trans	-130.3	96.3	174.6	175.8	12.8	0	0	0	110.5	L57 S61 S62 G63	L57-D59 WeakPolarHBondContact CD2-O 3.15Å; D59-S61 PolarHBondContact O-N 3.22Å; D59-S61 WeakPolarHBondContact OD1-CA 3.42Å; D59-S61 WeakPolarHBondContact OD1-CB 3.23Å; D59-S61 PolarHBondContact OD1-N 3.21Å; D59-S61 PolarHBondContact OD1-OG 3.2Å; D59-S62 PolarHBondContact OD1-N 3.15Å; D59-S62 WeakPolarHBondContact OD2-CB 3.38Å; D59-S62 PolarHBondContact OD2-OG 3.08Å; D59-G63 PolarHBondContact O-N 2.91Å
60	L	84.8	Confident	89.5	Confident	104 Å²	104	40.3 Å²	40.3	55%	0.545	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-25.4	175.5	-106.8	66	0	0	0	113.4	L54 L57 G63	L54-L60 HydrophobicContact CD2-CG 4.46Å; L57-L60 HydrophobicContact CB-CD1 4.13Å; L57-L60 HydrophobicContact CD2-CD1 4.42Å; L60-G63 PolarHBondContact O-N 3.12Å
61	S	79	Confident	89.3	Confident	94 Å²	94	41.5 Å²	41.5	66%	0.657	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-30.2	-176.7	75.1	0	0	0	0	112.7	D59	D59-S61 PolarHBondContact O-N 3.22Å; D59-S61 WeakPolarHBondContact OD1-CA 3.42Å; D59-S61 WeakPolarHBondContact OD1-CB 3.23Å; D59-S61 PolarHBondContact OD1-N 3.21Å; D59-S61 PolarHBondContact OD1-OG 3.2Å
62	S	84.1	Confident	89.2	Confident	24 Å²	24	37.6 Å²	37.6	17%	0.168	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.6	169.6	-69.7	0	0	0	0	113.7	D59 N89	D59-S62 PolarHBondContact OD1-N 3.15Å; D59-S62 WeakPolarHBondContact OD2-CB 3.38Å; D59-S62 PolarHBondContact OD2-OG 3.08Å; S62-N89 WeakPolarHBondContact O-CB 3.2Å
63	G	88.9	Confident	89.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	-171.2	-170.7	0	0	0	0	0	113	L57 D59 L60 W65	L57-G63 VanDerWaalsContact CD2-C 3.42Å; D59-G63 PolarHBondContact O-N 2.91Å; L60-G63 PolarHBondContact O-N 3.12Å; G63-W65 PolarHBondContact O-N 2.99Å
64	Y	93.1	Very high	88.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-5	175.8	44.7	-88.1	0	0	0	113.5	D50 L53 L54 V66 L67 V68 S93 W96 Y124	D50-Y64 VanDerWaalsContact OD1-CE1 3.24Å; D50-Y64 WeakPolarHBondContact OD1-CE1 3.36Å; D50-Y64 PolarHBondContact OD1-OH 3.04Å; L53-Y64 HydrophobicContact CB-CD1 3.67Å; L53-Y64 HydrophobicContact CB-CD2 4.46Å; L53-Y64 HydrophobicContact CB-CE1 3.65Å; L53-Y64 HydrophobicContact CB-CE2 4.42Å; L53-Y64 HydrophobicContact CB-CG 4.12Å; L53-Y64 HydrophobicContact CD1-CD2 4.22Å; L53-Y64 HydrophobicContact CD1-CE1 4.28Å; L53-Y64 HydrophobicContact CD1-CE2 3.73Å; L54-Y64 HydrophobicContact CD2-CD1 3.92Å; L54-Y64 HydrophobicContact CD2-CE1 4.17Å; L54-Y64 HydrophobicContact CG-CD1 4.23Å; L54-Y64 HydrophobicContact CG-CE1 4.14Å; Y64-V66 VanDerWaalsContact C-N 3.28Å; Y64-V66 PolarHBondContact O-N 3.1Å; Y64-L67 WeakPolarHBondContact O-CA 3.3Å; Y64-L67 WeakPolarHBondContact O-CB 3.38Å; Y64-L67 PolarHBondContact O-N 3.07Å; Y64-V68 HydrophobicContact CD2-CG1 4.2Å; Y64-V68 PolarHBondContact O-N 2.96Å; Y64-S93 WeakPolarHBondContact CE2-O 3.43Å; Y64-S93 PolarHBondContact N-OG 2.98Å; Y64-S93 VanDerWaalsContact N-OG 3.14Å; Y64-S93 PolarHBondContact OH-O 2.95Å; Y64-W96 HydrophobicContact CD2-CE3 4.26Å; Y64-W96 HydrophobicContact CD2-CZ3 4.45Å; Y64-W96 AromaticContact CE2-CE3 3.9Å; Y64-W96 HydrophobicContact CE2-CE3 3.9Å; Y64-W96 HydrophobicContact CE2-CZ3 4.24Å; Y64-Y124 WeakPolarHBondContact CB-OH 3.41Å
65	W	93.4	Very high	88.8	Confident	15 Å²	15	57 Å²	57	6%	0.057	28%	0.28	C	S	.	.	H	α-helix	trans	-48.8	-45.3	175.6	-174.3	-121.3	0	0	0	113	G63 L67 V68 V69 I77 I80 E81 N89 R92 S93 W96	G63-W65 PolarHBondContact O-N 2.99Å; W65-L67 PolarHBondContact O-N 2.88Å; W65-L67 VanDerWaalsContact O-N 3.12Å; W65-V68 HydrophobicContact CE3-CG2 3.75Å; W65-V68 HydrophobicContact CZ3-CG2 4.27Å; W65-V68 PolarHBondContact O-N 3.35Å; W65-V69 HydrophobicContact CD2-CG2 3.61Å; W65-V69 HydrophobicContact CE3-CG2 3.94Å; W65-V69 HydrophobicContact CG-CG2 4.21Å; W65-V69 HydrophobicContact CH2-CG2 3.77Å; W65-V69 HydrophobicContact CZ2-CG2 3.45Å; W65-V69 VanDerWaalsContact CZ2-CG2 3.45Å; W65-V69 HydrophobicContact CZ3-CG2 4Å; W65-V69 WeakPolarHBondContact O-CB 3.3Å; W65-V69 VanDerWaalsContact O-CG2 3.25Å; W65-V69 WeakPolarHBondContact O-CG2 3.45Å; W65-V69 PolarHBondContact O-N 2.93Å; W65-V69 VanDerWaalsContact O-N 3.1Å; W65-I77 HydrophobicContact CH2-CG1 4.48Å; W65-I77 HydrophobicContact CH2-CG2 4.46Å; W65-I77 HydrophobicContact CZ2-CG2 4.34Å; W65-I80 HydrophobicContact CE3-CG2 4.4Å; W65-I80 HydrophobicContact CH2-CB 3.68Å; W65-I80 HydrophobicContact CH2-CD1 3.92Å; W65-I80 HydrophobicContact CH2-CG1 4.42Å; W65-I80 HydrophobicContact CH2-CG2 3.48Å; W65-I80 VanDerWaalsContact CH2-CG2 3.48Å; W65-I80 HydrophobicContact CZ2-CB 4.3Å; W65-I80 HydrophobicContact CZ2-CG2 3.86Å; W65-I80 HydrophobicContact CZ3-CB 4.24Å; W65-I80 HydrophobicContact CZ3-CD1 3.76Å; W65-I80 HydrophobicContact CZ3-CG2 3.79Å; W65-E81 HydrophobicContact CZ2-CG 4.39Å; W65-N89 HydrophobicContact CB-CB 4.36Å; W65-N89 WeakPolarHBondContact CB-O 3.48Å; W65-R92 HydrophobicContact CB-CB 4.4Å; W65-R92 HydrophobicContact CD2-CB 3.68Å; W65-R92 HydrophobicContact CE3-CB 4.1Å; W65-R92 HydrophobicContact CG-CB 3.8Å; W65-S93 WeakPolarHBondContact CB-OG 3.44Å; W65-S93 PolarHBondContact N-OG 3.18Å; W65-W96 HydrophobicContact CE3-CB 4.16Å; W65-W96 HydrophobicContact CZ3-CB 3.98Å; W65-W96 HydrophobicContact CZ3-CG 4.31Å
66	V	89.6	Confident	88.7	Confident	43 Å²	43	55 Å²	55	26%	0.261	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-15.7	179.4	-65.4	0	0	0	0	114.5	Y64 H70 Y123	Y64-V66 VanDerWaalsContact C-N 3.28Å; Y64-V66 PolarHBondContact O-N 3.1Å; V66-H70 PolarHBondContact O-CD2 2.95Å; V66-H70 PolarHBondContact O-NE2 3.47Å; V66-Y123 HydrophobicContact CB-CD1 4.48Å; V66-Y123 HydrophobicContact CB-CE1 4.01Å; V66-Y123 HydrophobicContact CG2-CD1 3.76Å; V66-Y123 HydrophobicContact CG2-CE1 3.78Å; V66-Y123 PolarHBondContact O-OH 3.31Å
67	L	91	Very high	89	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-93.8	-53.6	168.2	178.2	70.3	0	0	0	111.4	Y64 W65 V69 H70 F71 F113 L119 L120 Y123 Y124	Y64-L67 WeakPolarHBondContact O-CA 3.3Å; Y64-L67 WeakPolarHBondContact O-CB 3.38Å; Y64-L67 PolarHBondContact O-N 3.07Å; W65-L67 PolarHBondContact O-N 2.88Å; W65-L67 VanDerWaalsContact O-N 3.12Å; L67-V69 PolarHBondContact O-N 2.74Å; L67-H70 WeakPolarHBondContact O-CB 3.43Å; L67-H70 PolarHBondContact O-CD2 2.76Å; L67-H70 PolarHBondContact O-N 2.83Å; L67-F71 HydrophobicContact CD1-CE2 3.74Å; L67-F71 HydrophobicContact CD2-CE2 4.4Å; L67-F71 HydrophobicContact CG-CD2 4.37Å; L67-F71 HydrophobicContact CG-CE2 3.88Å; L67-F113 HydrophobicContact CD2-CD1 4.47Å; L67-F113 HydrophobicContact CD2-CE1 4.05Å; L67-F113 HydrophobicContact CD2-CE2 4.32Å; L67-F113 HydrophobicContact CD2-CZ 3.97Å; L67-L119 HydrophobicContact CD1-CD2 4.29Å; L67-L119 HydrophobicContact CD1-CG 4.04Å; L67-L120 HydrophobicContact CD2-CD1 3.42Å; L67-L120 VanDerWaalsContact CD2-CD1 3.42Å; L67-Y123 HydrophobicContact CB-CD2 4.4Å; L67-Y123 HydrophobicContact CB-CG 4.4Å; L67-Y123 HydrophobicContact CD1-CD2 3.7Å; L67-Y123 HydrophobicContact CD1-CE2 4.1Å; L67-Y123 HydrophobicContact CD1-CG 4.41Å; L67-Y124 HydrophobicContact CD2-CD2 4.26Å; L67-Y124 HydrophobicContact CD2-CE2 3.64Å
68	V	91.8	Very high	89	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-25.7	-169.6	-65.2	0	0	0	0	113	Y64 W65 H70 F71 T72 W96 F113	Y64-V68 HydrophobicContact CD2-CG1 4.2Å; Y64-V68 PolarHBondContact O-N 2.96Å; W65-V68 HydrophobicContact CE3-CG2 3.75Å; W65-V68 HydrophobicContact CZ3-CG2 4.27Å; W65-V68 PolarHBondContact O-N 3.35Å; V68-H70 PolarHBondContact O-N 3.02Å; V68-H70 VanDerWaalsContact O-N 3.15Å; V68-F71 PolarHBondContact O-N 2.85Å; V68-T72 WeakPolarHBondContact O-CB 3.05Å; V68-T72 PolarHBondContact O-N 2.88Å; V68-T72 PolarHBondContact O-OG1 2.79Å; V68-W96 HydrophobicContact CB-CD2 3.99Å; V68-W96 HydrophobicContact CB-CE3 4.5Å; V68-W96 HydrophobicContact CB-CG 4.39Å; V68-W96 HydrophobicContact CB-CH2 4.36Å; V68-W96 HydrophobicContact CB-CZ2 3.81Å; V68-W96 HydrophobicContact CG1-CD2 4.05Å; V68-W96 HydrophobicContact CG1-CE3 4.07Å; V68-W96 HydrophobicContact CG1-CH2 3.63Å; V68-W96 HydrophobicContact CG1-CZ2 3.58Å; V68-W96 HydrophobicContact CG1-CZ3 3.89Å; V68-W96 HydrophobicContact CG2-CB 4.44Å; V68-W96 HydrophobicContact CG2-CD2 3.82Å; V68-W96 HydrophobicContact CG2-CE3 4.38Å; V68-W96 HydrophobicContact CG2-CG 3.83Å; V68-F113 HydrophobicContact CG1-CE1 4.19Å; V68-F113 HydrophobicContact CG1-CZ 3.82Å
69	V	91.8	Very high	89.2	Confident	46 Å²	46	58.3 Å²	58.3	28%	0.279	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.7	171.3	166.3	0	0	0	0	113.2	W65 L67 F71 I77	W65-V69 HydrophobicContact CD2-CG2 3.61Å; W65-V69 HydrophobicContact CE3-CG2 3.94Å; W65-V69 HydrophobicContact CG-CG2 4.21Å; W65-V69 HydrophobicContact CH2-CG2 3.77Å; W65-V69 HydrophobicContact CZ2-CG2 3.45Å; W65-V69 VanDerWaalsContact CZ2-CG2 3.45Å; W65-V69 HydrophobicContact CZ3-CG2 4Å; W65-V69 WeakPolarHBondContact O-CB 3.3Å; W65-V69 VanDerWaalsContact O-CG2 3.25Å; W65-V69 WeakPolarHBondContact O-CG2 3.45Å; W65-V69 PolarHBondContact O-N 2.93Å; W65-V69 VanDerWaalsContact O-N 3.1Å; L67-V69 PolarHBondContact O-N 2.74Å; V69-F71 VanDerWaalsContact C-N 3.34Å; V69-I77 HydrophobicContact CG1-CD1 4.14Å; V69-I77 WeakPolarHBondContact O-CD1 3.28Å
70	H	88.9	Confident	89.5	Confident	128 Å²	128	55.1 Å²	55.1	59%	0.593	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-21.7	174.9	-62.4	-75.3	0	0	0	113.9	V66 L67 V68 L119 Y123	V66-H70 PolarHBondContact O-CD2 2.95Å; V66-H70 PolarHBondContact O-NE2 3.47Å; L67-H70 WeakPolarHBondContact O-CB 3.43Å; L67-H70 PolarHBondContact O-CD2 2.76Å; L67-H70 PolarHBondContact O-N 2.83Å; V68-H70 PolarHBondContact O-N 3.02Å; V68-H70 VanDerWaalsContact O-N 3.15Å; H70-L119 HydrophobicContact CB-CD2 3.86Å; H70-Y123 AromaticContact NE2-CE2 3.68Å; H70-Y123 AromaticContact NE2-CZ 3.13Å; H70-Y123 PolarHBondContact NE2-OH 3.38Å
71	F	89.1	Confident	89.7	Confident	29 Å²	29	55.6 Å²	55.6	13%	0.127	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-19.8	-177.3	-58.1	-65.1	0	0	0	113.3	L67 V68 V69 Y109 L112 F113 N116 L119	L67-F71 HydrophobicContact CD1-CE2 3.74Å; L67-F71 HydrophobicContact CD2-CE2 4.4Å; L67-F71 HydrophobicContact CG-CD2 4.37Å; L67-F71 HydrophobicContact CG-CE2 3.88Å; V68-F71 PolarHBondContact O-N 2.85Å; V69-F71 VanDerWaalsContact C-N 3.34Å; F71-Y109 HydrophobicContact CB-CD1 4.28Å; F71-Y109 WeakPolarHBondContact O-CE1 3.31Å; F71-L112 HydrophobicContact CB-CD1 4.1Å; F71-L112 HydrophobicContact CD1-CB 3.74Å; F71-L112 HydrophobicContact CD1-CD1 4.28Å; F71-L112 HydrophobicContact CE1-CB 4.11Å; F71-L112 HydrophobicContact CG-CB 4.23Å; F71-F113 AromaticContact CD2-CD1 3.83Å; F71-F113 HydrophobicContact CD2-CD1 3.83Å; F71-F113 AromaticContact CD2-CE1 3.63Å; F71-F113 HydrophobicContact CD2-CE1 3.63Å; F71-F113 AromaticContact CE2-CD1 3.63Å; F71-F113 HydrophobicContact CE2-CD1 3.63Å; F71-F113 AromaticContact CE2-CE1 3.79Å; F71-F113 HydrophobicContact CE2-CE1 3.79Å; F71-F113 HydrophobicContact CZ-CD1 4.31Å; F71-N116 HydrophobicContact CE1-CB 3.75Å; F71-N116 HydrophobicContact CZ-CB 3.75Å; F71-L119 HydrophobicContact CE1-CD2 4.39Å; F71-L119 HydrophobicContact CE2-CD2 4.3Å; F71-L119 HydrophobicContact CZ-CD2 3.84Å
72	T	90.3	Very high	90.3	Very high	12 Å²	12	56.6 Å²	56.6	7%	0.074	26%	0.263	C	S	.	.	S	Bend	trans	-79.4	145.9	-173.1	-56.6	0	0	0	0	111.8	V68 A76 I77 W96	V68-T72 WeakPolarHBondContact O-CB 3.05Å; V68-T72 PolarHBondContact O-N 2.88Å; V68-T72 PolarHBondContact O-OG1 2.79Å; T72-A76 HydrophobicContact CG2-CB 3.63Å; T72-I77 HydrophobicContact CG2-CG1 3.8Å; T72-I77 WeakPolarHBondContact O-CD1 3.43Å; T72-W96 PolarHBondContact OG1-NE1 3.43Å
73	R	90	Very high	90.7	Very high	147 Å²	147	56.8 Å²	56.8	56%	0.555	26%	0.262	S	S	*	.			trans	-60.6	137.6	175.3	-60.3	171.9	-178.4	152.5	-1.4	110.2	E75 A76 I77 E103	R73-E75 PolarHBondContact O-N 2.9Å; R73-A76 HydrophobicContact CB-CB 4.29Å; R73-A76 WeakPolarHBondContact O-CB 3.37Å; R73-A76 PolarHBondContact O-N 3.26Å; R73-I77 PolarHBondContact O-N 3.36Å; R73-E103 IonicContact CZ-OE1 3.63Å; R73-E103 IonicContact CZ-OE2 2.71Å; R73-E103 VanDerWaalsContact NH1-CD 3.28Å; R73-E103 IonicContact NH1-OE1 3.83Å; R73-E103 PolarHBondContact NH1-OE1 2.97Å; R73-E103 IonicContact NH1-OE2 3.21Å; R73-E103 PolarHBondContact NH1-OE2 2.94Å
74	R	89.1	Confident	90.6	Very high	174 Å²	174	65 Å²	65	66%	0.657	30%	0.301	S	S	*	.	H	α-helix	trans	-53.2	-32.1	-179	-166	-173.5	69.5	177.4	-3.3	114	R78	R74-R78 WeakPolarHBondContact O-CD 3.01Å; R74-R78 VanDerWaalsContact O-CG 3.29Å; R74-R78 WeakPolarHBondContact O-CG 3.32Å; R74-R78 PolarHBondContact O-N 3Å; R74-R78 VanDerWaalsContact O-N 3.16Å
75	E	88.2	Confident	90.2	Very high	115 Å²	115	69.9 Å²	69.9	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-76.6	-38.8	178.9	-142.8	61	-158.3	0	0	112.9	R73 I77 R78 Q79	R73-E75 PolarHBondContact O-N 2.9Å; E75-I77 VanDerWaalsContact C-N 3.31Å; E75-I77 PolarHBondContact O-N 2.94Å; E75-R78 WeakPolarHBondContact O-CB 3.43Å; E75-R78 PolarHBondContact O-N 2.71Å; E75-R78 IonicContact OE1-NH1 3.69Å; E75-R78 PolarHBondContact OE1-NH1 3.33Å; E75-R78 WeakPolarHBondContact OE2-CD 3.31Å; E75-R78 IonicContact OE2-CZ 3.17Å; E75-R78 IonicContact OE2-NE 3.04Å; E75-R78 IonicContact OE2-NH1 2.7Å; E75-R78 PolarHBondContact OE2-NH1 2.84Å; E75-Q79 WeakPolarHBondContact O-CB 3.35Å; E75-Q79 PolarHBondContact O-N 2.98Å
76	A	89.8	Confident	90.1	Very high	5 Å²	5	69.3 Å²	69.3	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-37.4	170.9	0	0	0	0	0	111.8	T72 R73 Q79 I80 L99	T72-A76 HydrophobicContact CG2-CB 3.63Å; R73-A76 HydrophobicContact CB-CB 4.29Å; R73-A76 WeakPolarHBondContact O-CB 3.37Å; R73-A76 PolarHBondContact O-N 3.26Å; A76-Q79 PolarHBondContact O-N 3.47Å; A76-I80 WeakPolarHBondContact O-CG1 3.4Å; A76-I80 PolarHBondContact O-N 2.84Å; A76-I80 VanDerWaalsContact O-N 3.1Å; A76-L99 HydrophobicContact CB-CD2 3.51Å
77	I	92.2	Very high	89.9	Confident	21 Å²	21	70.7 Å²	70.7	11%	0.108	34%	0.337	C	S	.	.	H	α-helix	trans	-59.9	-50.7	172.6	-65.6	164.5	0	0	0	110.4	W65 V69 T72 R73 E75 Q79 I80 E81	W65-I77 HydrophobicContact CH2-CG1 4.48Å; W65-I77 HydrophobicContact CH2-CG2 4.46Å; W65-I77 HydrophobicContact CZ2-CG2 4.34Å; V69-I77 HydrophobicContact CG1-CD1 4.14Å; V69-I77 WeakPolarHBondContact O-CD1 3.28Å; T72-I77 HydrophobicContact CG2-CG1 3.8Å; T72-I77 WeakPolarHBondContact O-CD1 3.43Å; R73-I77 PolarHBondContact O-N 3.36Å; E75-I77 VanDerWaalsContact C-N 3.31Å; E75-I77 PolarHBondContact O-N 2.94Å; I77-Q79 VanDerWaalsContact C-N 3.32Å; I77-Q79 PolarHBondContact O-N 3.4Å; I77-I80 PolarHBondContact O-N 3.37Å; I77-I80 VanDerWaalsContact O-N 3.14Å; I77-E81 HydrophobicContact CG2-CG 4.17Å; I77-E81 WeakPolarHBondContact O-CB 3.02Å; I77-E81 WeakPolarHBondContact O-CG 3.42Å; I77-E81 PolarHBondContact O-N 3.36Å
78	R	90.6	Very high	89.9	Confident	105 Å²	105	73.4 Å²	73.4	40%	0.396	35%	0.354	S	S	.	.	H	α-helix	trans	-58.8	-40.4	177	-71.1	158.6	162.9	-161.9	-17.1	112.9	R74 E75 I80 E81 V82	R74-R78 WeakPolarHBondContact O-CD 3.01Å; R74-R78 VanDerWaalsContact O-CG 3.29Å; R74-R78 WeakPolarHBondContact O-CG 3.32Å; R74-R78 PolarHBondContact O-N 3Å; R74-R78 VanDerWaalsContact O-N 3.16Å; E75-R78 WeakPolarHBondContact O-CB 3.43Å; E75-R78 PolarHBondContact O-N 2.71Å; E75-R78 IonicContact OE1-NH1 3.69Å; E75-R78 PolarHBondContact OE1-NH1 3.33Å; E75-R78 WeakPolarHBondContact OE2-CD 3.31Å; E75-R78 IonicContact OE2-CZ 3.17Å; E75-R78 IonicContact OE2-NE 3.04Å; E75-R78 IonicContact OE2-NH1 2.7Å; E75-R78 PolarHBondContact OE2-NH1 2.84Å; R78-I80 VanDerWaalsContact C-N 3.3Å; R78-I80 PolarHBondContact O-N 2.94Å; R78-E81 PolarHBondContact O-N 3.13Å; R78-V82 WeakPolarHBondContact O-CB 3.15Å; R78-V82 VanDerWaalsContact O-CG2 3.25Å; R78-V82 WeakPolarHBondContact O-CG2 3.36Å; R78-V82 PolarHBondContact O-N 2.83Å; R78-V82 VanDerWaalsContact O-N 3.13Å
79	Q	91.3	Very high	89.8	Confident	96 Å²	96	76.2 Å²	76.2	45%	0.449	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-42.4	176.9	-177.2	178.7	-7	0	0	111.2	E75 A76 I77 L83	E75-Q79 WeakPolarHBondContact O-CB 3.35Å; E75-Q79 PolarHBondContact O-N 2.98Å; A76-Q79 PolarHBondContact O-N 3.47Å; I77-Q79 VanDerWaalsContact C-N 3.32Å; I77-Q79 PolarHBondContact O-N 3.4Å; Q79-L83 WeakPolarHBondContact O-CG 3.45Å
80	I	92	Very high	89.7	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-78	-28.8	179.7	-64.5	164.4	0	0	0	112.3	W65 A76 I77 R78 V82 L83 R92 A95 W96 L99	W65-I80 HydrophobicContact CE3-CG2 4.4Å; W65-I80 HydrophobicContact CH2-CB 3.68Å; W65-I80 HydrophobicContact CH2-CD1 3.92Å; W65-I80 HydrophobicContact CH2-CG1 4.42Å; W65-I80 HydrophobicContact CH2-CG2 3.48Å; W65-I80 VanDerWaalsContact CH2-CG2 3.48Å; W65-I80 HydrophobicContact CZ2-CB 4.3Å; W65-I80 HydrophobicContact CZ2-CG2 3.86Å; W65-I80 HydrophobicContact CZ3-CB 4.24Å; W65-I80 HydrophobicContact CZ3-CD1 3.76Å; W65-I80 HydrophobicContact CZ3-CG2 3.79Å; A76-I80 WeakPolarHBondContact O-CG1 3.4Å; A76-I80 PolarHBondContact O-N 2.84Å; A76-I80 VanDerWaalsContact O-N 3.1Å; I77-I80 PolarHBondContact O-N 3.37Å; I77-I80 VanDerWaalsContact O-N 3.14Å; R78-I80 VanDerWaalsContact C-N 3.3Å; R78-I80 PolarHBondContact O-N 2.94Å; I80-V82 VanDerWaalsContact C-N 3.33Å; I80-L83 HydrophobicContact CB-CD1 4.36Å; I80-L83 HydrophobicContact CG2-CD1 4.12Å; I80-L83 WeakPolarHBondContact O-CD1 3.36Å; I80-L83 WeakPolarHBondContact O-CG 3.37Å; I80-R92 HydrophobicContact CG2-CB 3.73Å; I80-R92 HydrophobicContact CG2-CG 3.74Å; I80-A95 HydrophobicContact CG2-CB 4.47Å; I80-W96 HydrophobicContact CD1-CB 3.84Å; I80-W96 HydrophobicContact CD1-CG 4.42Å; I80-L99 HydrophobicContact CD1-CD2 3.9Å; I80-L99 HydrophobicContact CG1-CD2 4.44Å
81	E	90	Very high	89.9	Confident	113 Å²	113	69.7 Å²	69.7	53%	0.528	34%	0.337	S	S	.	.	H	α-helix	trans	-74.1	-19.8	174.5	-74.1	177.3	157	0	0	113.8	W65 I77 R78	W65-E81 HydrophobicContact CZ2-CG 4.39Å; I77-E81 HydrophobicContact CG2-CG 4.17Å; I77-E81 WeakPolarHBondContact O-CB 3.02Å; I77-E81 WeakPolarHBondContact O-CG 3.42Å; I77-E81 PolarHBondContact O-N 3.36Å; R78-E81 PolarHBondContact O-N 3.13Å
82	V	91.8	Very high	90.1	Very high	115 Å²	115	70.4 Å²	70.4	70%	0.697	34%	0.339	S	S	*	.	S	Bend	trans	-105.3	3.7	-175.7	176.8	0	0	0	0	112.9	R78 I80	R78-V82 WeakPolarHBondContact O-CB 3.15Å; R78-V82 VanDerWaalsContact O-CG2 3.25Å; R78-V82 WeakPolarHBondContact O-CG2 3.36Å; R78-V82 PolarHBondContact O-N 2.83Å; R78-V82 VanDerWaalsContact O-N 3.13Å; I80-V82 VanDerWaalsContact C-N 3.33Å
83	L	90.9	Very high	90.3	Very high	29 Å²	29	69.9 Å²	69.9	15%	0.152	34%	0.335	C	S	.	.			trans	-55.4	136.7	170.7	-63.1	176.8	0	0	0	111.1	Q79 I80 V86 A95 L155 D156	Q79-L83 WeakPolarHBondContact O-CG 3.45Å; I80-L83 HydrophobicContact CB-CD1 4.36Å; I80-L83 HydrophobicContact CG2-CD1 4.12Å; I80-L83 WeakPolarHBondContact O-CD1 3.36Å; I80-L83 WeakPolarHBondContact O-CG 3.37Å; L83-V86 HydrophobicContact CB-CB 4.03Å; L83-V86 HydrophobicContact CB-CG2 4.41Å; L83-V86 HydrophobicContact CD1-CB 3.92Å; L83-V86 HydrophobicContact CD1-CG1 4.35Å; L83-V86 HydrophobicContact CD1-CG2 4.02Å; L83-A95 HydrophobicContact CD1-CB 3.71Å; L83-L155 HydrophobicContact CD2-CB 4.32Å; L83-D156 WeakPolarHBondContact CB-OD1 3.46Å; L83-D156 HydrophobicContact CD2-CB 3.81Å
84	Q	86.8	Confident	90.5	Very high	172 Å²	172	63.7 Å²	63.7	80%	0.804	31%	0.312	S	S	*	.	S	Bend	trans	-88.6	-26.3	-172.9	-55.6	-176.5	20.4	0	0	112.7	D156	Q84-D156 WeakPolarHBondContact CB-OD2 3.28Å; Q84-D156 VanDerWaalsContact N-CG 3.33Å; Q84-D156 PolarHBondContact N-OD1 3Å; Q84-D156 PolarHBondContact N-OD2 3.28Å
85	H	86.4	Confident	90.8	Very high	102 Å²	102	55.4 Å²	55.4	47%	0.472	28%	0.281	S	S	.	.	S	Bend	trans	-110.9	-11.8	-171.8	-56.2	90.5	0	0	0	113.2	D156 P158	H85-D156 VanDerWaalsContact CB-O 3.31Å; H85-D156 WeakPolarHBondContact CB-O 3.41Å; H85-D156 WeakPolarHBondContact CB-OD1 3.3Å; H85-D156 IonicContact CE1-OD2 2.75Å; H85-D156 IonicContact CG-OD1 2.8Å; H85-D156 IonicContact CG-OD2 3.78Å; H85-D156 PolarHBondContact N-OD1 2.84Å; H85-D156 VanDerWaalsContact ND1-CG 3.27Å; H85-D156 PolarHBondContact ND1-O 3.22Å; H85-D156 IonicContact ND1-OD1 3.98Å; H85-D156 IonicContact ND1-OD2 2.65Å; H85-D156 PolarHBondContact ND1-OD2 3.34Å; H85-P158 HydrophobicContact CB-CB 4.07Å
86	V	90.1	Very high	91.1	Very high	3 Å²	3	50 Å²	50	2%	0.018	26%	0.255	C	S	.	.			trans	-104.2	99.1	-178.5	-176.6	0	0	0	0	110.6	L83 R92 L160	L83-V86 HydrophobicContact CB-CB 4.03Å; L83-V86 HydrophobicContact CB-CG2 4.41Å; L83-V86 HydrophobicContact CD1-CB 3.92Å; L83-V86 HydrophobicContact CD1-CG1 4.35Å; L83-V86 HydrophobicContact CD1-CG2 4.02Å; V86-R92 HydrophobicContact CG1-CG 4.21Å; V86-R92 PolarHBondContact O-NH2 2.95Å; V86-L160 HydrophobicContact CG2-CB 4.46Å; V86-L160 HydrophobicContact CG2-CD1 4.22Å
87	A	86.3	Confident	91.3	Very high	72 Å²	72	49.8 Å²	49.8	60%	0.595	25%	0.254	S	S	*	.			trans	-96.5	-31.8	-171.7	0	0	0	0	0	114	R92 D161	A87-R92 VanDerWaalsContact C-NH2 3.34Å; A87-R92 VanDerWaalsContact O-CZ 3.29Å; A87-R92 PolarHBondContact O-NH1 2.94Å; A87-R92 PolarHBondContact O-NH2 2.92Å; A87-D161 WeakPolarHBondContact CA-OD2 3.4Å; A87-D161 WeakPolarHBondContact CB-OD2 3.34Å; A87-D161 PolarHBondContact N-OD2 3.36Å
88	T	91.1	Very high	91.5	Very high	58 Å²	58	48.9 Å²	48.9	36%	0.356	25%	0.249	S	C	.	.	S	Bend	trans	-91.3	160.5	-174.8	77.4	0	0	0	0	113	L90 G91 R92 D161	T88-L90 VanDerWaalsContact C-N 3.32Å; T88-L90 PolarHBondContact OG1-N 2.78Å; T88-G91 PolarHBondContact O-N 3.4Å; T88-G91 PolarHBondContact OG1-N 2.94Å; T88-R92 WeakPolarHBondContact O-CG 3.46Å; T88-R92 PolarHBondContact O-N 2.93Å; T88-D161 WeakPolarHBondContact CA-OD1 3.44Å; T88-D161 VanDerWaalsContact CB-OD1 3.24Å; T88-D161 WeakPolarHBondContact CB-OD1 3.44Å; T88-D161 HydrophobicContact CG2-CB 4.17Å; T88-D161 WeakPolarHBondContact CG2-OD1 3.44Å; T88-D161 PolarHBondContact N-OD1 3.49Å; T88-D161 PolarHBondContact N-OD2 3.02Å; T88-D161 PolarHBondContact OG1-OD1 2.83Å
89	N	90.1	Very high	91.6	Very high	58 Å²	58	44.5 Å²	44.5	31%	0.31	23%	0.233	S	C	.	.	H	α-helix	trans	-73.1	-25.5	174.7	-65.2	-18.5	0	0	0	112.4	S62 W65 R92 S93	S62-N89 WeakPolarHBondContact O-CB 3.2Å; W65-N89 HydrophobicContact CB-CB 4.36Å; W65-N89 WeakPolarHBondContact CB-O 3.48Å; N89-R92 PolarHBondContact O-N 3Å; N89-R92 PolarHBondContact OD1-NH1 2.98Å; N89-S93 PolarHBondContact O-N 2.8Å; N89-S93 PolarHBondContact O-OG 2.79Å
90	L	89.2	Confident	91.7	Very high	38 Å²	38	40 Å²	40	20%	0.199	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-43.5	170.4	-175.6	63	0	0	0	111.2	L54 T88 S93 R94	L54-L90 HydrophobicContact CD1-CD1 4.35Å; L54-L90 HydrophobicContact CD2-CD1 4.06Å; T88-L90 VanDerWaalsContact C-N 3.32Å; T88-L90 PolarHBondContact OG1-N 2.78Å; L90-S93 WeakPolarHBondContact O-CA 3.18Å; L90-S93 WeakPolarHBondContact O-CB 3.25Å; L90-S93 PolarHBondContact O-N 3.08Å; L90-S93 VanDerWaalsContact O-N 3.13Å; L90-R94 PolarHBondContact O-N 3.23Å; L90-R94 VanDerWaalsContact O-N 3.09Å
91	G	91.8	Very high	91.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-43	171.6	0	0	0	0	0	112.5	T88 S93 R94 A95 D161	T88-G91 PolarHBondContact O-N 3.4Å; T88-G91 PolarHBondContact OG1-N 2.94Å; G91-S93 VanDerWaalsContact C-N 3.27Å; G91-S93 PolarHBondContact O-N 3.12Å; G91-R94 PolarHBondContact O-N 2.71Å; G91-R94 VanDerWaalsContact O-N 3.13Å; G91-A95 WeakPolarHBondContact O-CB 3.49Å; G91-A95 PolarHBondContact O-N 2.9Å; G91-D161 WeakPolarHBondContact CA-OD1 3.39Å
92	R	93.6	Very high	91.9	Very high	44 Å²	44	36.9 Å²	36.9	17%	0.166	20%	0.199	C	C	.	.	H	α-helix	trans	-61.7	-33.2	172.3	-69.4	180	-171.2	88.3	25.9	113.1	W65 I80 V86 A87 T88 N89 W96	W65-R92 HydrophobicContact CB-CB 4.4Å; W65-R92 HydrophobicContact CD2-CB 3.68Å; W65-R92 HydrophobicContact CE3-CB 4.1Å; W65-R92 HydrophobicContact CG-CB 3.8Å; I80-R92 HydrophobicContact CG2-CB 3.73Å; I80-R92 HydrophobicContact CG2-CG 3.74Å; V86-R92 HydrophobicContact CG1-CG 4.21Å; V86-R92 PolarHBondContact O-NH2 2.95Å; A87-R92 VanDerWaalsContact C-NH2 3.34Å; A87-R92 VanDerWaalsContact O-CZ 3.29Å; A87-R92 PolarHBondContact O-NH1 2.94Å; A87-R92 PolarHBondContact O-NH2 2.92Å; T88-R92 WeakPolarHBondContact O-CG 3.46Å; T88-R92 PolarHBondContact O-N 2.93Å; N89-R92 PolarHBondContact O-N 3Å; N89-R92 PolarHBondContact OD1-NH1 2.98Å; R92-W96 VanDerWaalsContact O-CB 3.3Å; R92-W96 WeakPolarHBondContact O-CB 3.48Å; R92-W96 PolarHBondContact O-N 3.25Å
93	S	94.9	Very high	91.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-44.9	173.1	-53	0	0	0	0	110.8	Y64 W65 N89 L90 G91 W96 L97	Y64-S93 WeakPolarHBondContact CE2-O 3.43Å; Y64-S93 PolarHBondContact N-OG 2.98Å; Y64-S93 VanDerWaalsContact N-OG 3.14Å; Y64-S93 PolarHBondContact OH-O 2.95Å; W65-S93 WeakPolarHBondContact CB-OG 3.44Å; W65-S93 PolarHBondContact N-OG 3.18Å; N89-S93 PolarHBondContact O-N 2.8Å; N89-S93 PolarHBondContact O-OG 2.79Å; L90-S93 WeakPolarHBondContact O-CA 3.18Å; L90-S93 WeakPolarHBondContact O-CB 3.25Å; L90-S93 PolarHBondContact O-N 3.08Å; L90-S93 VanDerWaalsContact O-N 3.13Å; G91-S93 VanDerWaalsContact C-N 3.27Å; G91-S93 PolarHBondContact O-N 3.12Å; S93-W96 WeakPolarHBondContact O-CB 3.43Å; S93-W96 PolarHBondContact O-N 3.31Å; S93-L97 PolarHBondContact O-N 2.89Å
94	R	94.6	Very high	91.9	Very high	17 Å²	17	36.5 Å²	36.5	6%	0.064	19%	0.191	C	C	.	.	H	α-helix	trans	-73.4	-39	179	-69.2	159.3	175.3	172.3	-1.9	113.2	D50 L90 G91 W96 L97 Y98 L160 L162 P164	D50-R94 WeakPolarHBondContact OD1-CG 3.21Å; D50-R94 IonicContact OD1-NE 3.61Å; D50-R94 IonicContact OD2-CZ 2.75Å; D50-R94 VanDerWaalsContact OD2-CZ 3.28Å; D50-R94 IonicContact OD2-NE 3.81Å; D50-R94 PolarHBondContact OD2-NE 2.88Å; D50-R94 IonicContact OD2-NH2 2.86Å; D50-R94 PolarHBondContact OD2-NH2 2.58Å; L90-R94 PolarHBondContact O-N 3.23Å; L90-R94 VanDerWaalsContact O-N 3.09Å; G91-R94 PolarHBondContact O-N 2.71Å; G91-R94 VanDerWaalsContact O-N 3.13Å; R94-W96 VanDerWaalsContact C-N 3.28Å; R94-W96 PolarHBondContact O-N 2.81Å; R94-L97 WeakPolarHBondContact O-CB 3.23Å; R94-L97 PolarHBondContact O-N 2.86Å; R94-L97 VanDerWaalsContact O-N 3.13Å; R94-Y98 VanDerWaalsContact O-CD1 3.3Å; R94-Y98 WeakPolarHBondContact O-CD1 3.16Å; R94-Y98 PolarHBondContact O-N 2.89Å; R94-L160 HydrophobicContact CB-CB 4.39Å; R94-L160 HydrophobicContact CB-CD2 4.07Å; R94-L160 WeakPolarHBondContact CD-O 3.29Å; R94-L160 PolarHBondContact NH1-O 3.48Å; R94-L162 VanDerWaalsContact NH1-C 3.28Å; R94-L162 PolarHBondContact NH1-O 3.48Å; R94-L162 VanDerWaalsContact NH1-O 3.07Å; R94-P164 HydrophobicContact CG-CB 4.44Å
95	A	94.4	Very high	92.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-36.8	171.6	0	0	0	0	0	111.6	I80 L83 G91 Y98 L99 L160	I80-A95 HydrophobicContact CG2-CB 4.47Å; L83-A95 HydrophobicContact CD1-CB 3.71Å; G91-A95 WeakPolarHBondContact O-CB 3.49Å; G91-A95 PolarHBondContact O-N 2.9Å; A95-Y98 PolarHBondContact O-N 3.03Å; A95-L99 PolarHBondContact O-N 2.85Å; A95-L160 HydrophobicContact CB-CD1 4.27Å
96	W	95.5	Very high	92.4	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.008	14%	0.135	C	C	.	.	H	α-helix	trans	-63.8	-43.2	170	177.1	89.5	0	0	0	112.7	L53 Y64 W65 V68 T72 I80 R92 S93 R94 Y98 L99 A100 L106 Y109	L53-W96 HydrophobicContact CD1-CZ3 4.28Å; Y64-W96 HydrophobicContact CD2-CE3 4.26Å; Y64-W96 HydrophobicContact CD2-CZ3 4.45Å; Y64-W96 AromaticContact CE2-CE3 3.9Å; Y64-W96 HydrophobicContact CE2-CE3 3.9Å; Y64-W96 HydrophobicContact CE2-CZ3 4.24Å; W65-W96 HydrophobicContact CE3-CB 4.16Å; W65-W96 HydrophobicContact CZ3-CB 3.98Å; W65-W96 HydrophobicContact CZ3-CG 4.31Å; V68-W96 HydrophobicContact CB-CD2 3.99Å; V68-W96 HydrophobicContact CB-CE3 4.5Å; V68-W96 HydrophobicContact CB-CG 4.39Å; V68-W96 HydrophobicContact CB-CH2 4.36Å; V68-W96 HydrophobicContact CB-CZ2 3.81Å; V68-W96 HydrophobicContact CG1-CD2 4.05Å; V68-W96 HydrophobicContact CG1-CE3 4.07Å; V68-W96 HydrophobicContact CG1-CH2 3.63Å; V68-W96 HydrophobicContact CG1-CZ2 3.58Å; V68-W96 HydrophobicContact CG1-CZ3 3.89Å; V68-W96 HydrophobicContact CG2-CB 4.44Å; V68-W96 HydrophobicContact CG2-CD2 3.82Å; V68-W96 HydrophobicContact CG2-CE3 4.38Å; V68-W96 HydrophobicContact CG2-CG 3.83Å; T72-W96 PolarHBondContact OG1-NE1 3.43Å; I80-W96 HydrophobicContact CD1-CB 3.84Å; I80-W96 HydrophobicContact CD1-CG 4.42Å; R92-W96 VanDerWaalsContact O-CB 3.3Å; R92-W96 WeakPolarHBondContact O-CB 3.48Å; R92-W96 PolarHBondContact O-N 3.25Å; S93-W96 WeakPolarHBondContact O-CB 3.43Å; S93-W96 PolarHBondContact O-N 3.31Å; R94-W96 VanDerWaalsContact C-N 3.28Å; R94-W96 PolarHBondContact O-N 2.81Å; W96-Y98 VanDerWaalsContact C-N 3.31Å; W96-Y98 PolarHBondContact O-N 3.2Å; W96-L99 WeakPolarHBondContact O-CB 3.18Å; W96-L99 PolarHBondContact O-N 3.31Å; W96-A100 WeakPolarHBondContact O-CB 3.42Å; W96-A100 PolarHBondContact O-N 2.72Å; W96-L106 HydrophobicContact CH2-CD1 3.89Å; W96-L106 HydrophobicContact CZ3-CD1 3.87Å; W96-Y109 HydrophobicContact CH2-CD2 4.08Å; W96-Y109 HydrophobicContact CH2-CG 4.15Å; W96-Y109 HydrophobicContact CZ2-CD1 4.13Å; W96-Y109 AromaticContact CZ2-CD2 3.45Å; W96-Y109 HydrophobicContact CZ2-CD2 3.45Å; W96-Y109 VanDerWaalsContact CZ2-CD2 3.45Å; W96-Y109 HydrophobicContact CZ2-CE2 4.03Å; W96-Y109 AromaticContact CZ2-CG 3.52Å; W96-Y109 HydrophobicContact CZ2-CG 3.52Å
97	L	94.7	Very high	92.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-61.1	-42	176.7	177.7	61	0	0	0	111.1	L49 D50 L53 S93 R94 A100 L101 L106	L49-L97 HydrophobicContact CB-CD1 4.23Å; L49-L97 HydrophobicContact CB-CD2 3.88Å; L49-L97 HydrophobicContact CD1-CD1 4.27Å; D50-L97 HydrophobicContact CB-CD2 4.48Å; L53-L97 HydrophobicContact CD1-CD1 4.1Å; S93-L97 PolarHBondContact O-N 2.89Å; R94-L97 WeakPolarHBondContact O-CB 3.23Å; R94-L97 PolarHBondContact O-N 2.86Å; R94-L97 VanDerWaalsContact O-N 3.13Å; L97-A100 PolarHBondContact O-N 3.09Å; L97-L101 WeakPolarHBondContact O-CG 3.18Å; L97-L101 PolarHBondContact O-N 3.2Å; L97-L106 HydrophobicContact CD1-CD1 3.95Å; L97-L106 HydrophobicContact CD1-CD2 3.79Å
98	Y	94.6	Very high	92.9	Very high	2 Å²	2	25 Å²	25	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-64.9	-40.2	175.3	-77.7	31.7	0	0	0	111.5	C46 R94 A95 W96 L101 N102 L153 D154 Y159 L160 P164	C46-Y98 HydrophobicContact CB-CE1 4.15Å; R94-Y98 VanDerWaalsContact O-CD1 3.3Å; R94-Y98 WeakPolarHBondContact O-CD1 3.16Å; R94-Y98 PolarHBondContact O-N 2.89Å; A95-Y98 PolarHBondContact O-N 3.03Å; W96-Y98 VanDerWaalsContact C-N 3.31Å; W96-Y98 PolarHBondContact O-N 3.2Å; Y98-L101 PolarHBondContact O-N 3.29Å; Y98-N102 WeakPolarHBondContact O-CB 3.47Å; Y98-N102 PolarHBondContact O-N 2.61Å; Y98-L153 HydrophobicContact CD1-CD1 4.31Å; Y98-L153 HydrophobicContact CD2-CB 3.8Å; Y98-L153 HydrophobicContact CD2-CD1 4.02Å; Y98-L153 HydrophobicContact CD2-CG 4.46Å; Y98-L153 HydrophobicContact CG-CB 4.25Å; Y98-L153 HydrophobicContact CG-CD1 3.83Å; Y98-D154 WeakPolarHBondContact CD2-O 3.35Å; Y98-Y159 WeakPolarHBondContact CE2-OH 3.34Å; Y98-Y159 PolarHBondContact OH-OH 3.25Å; Y98-L160 HydrophobicContact CD2-CD2 4.41Å; Y98-L160 HydrophobicContact CE1-CD2 4.11Å; Y98-L160 HydrophobicContact CE2-CD2 3.82Å; Y98-P164 PolarHBondContact OH-O 3.39Å
99	L	94	Very high	92.9	Very high	12 Å²	12	22.8 Å²	22.8	6%	0.063	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-43.7	172.9	-173.2	58.6	0	0	0	112.1	A76 I80 A95 W96 L101 N102 E103 L155	A76-L99 HydrophobicContact CB-CD2 3.51Å; I80-L99 HydrophobicContact CD1-CD2 3.9Å; I80-L99 HydrophobicContact CG1-CD2 4.44Å; A95-L99 PolarHBondContact O-N 2.85Å; W96-L99 WeakPolarHBondContact O-CB 3.18Å; W96-L99 PolarHBondContact O-N 3.31Å; L99-L101 VanDerWaalsContact C-N 3.26Å; L99-L101 PolarHBondContact O-N 2.84Å; L99-N102 PolarHBondContact O-N 3.11Å; L99-E103 HydrophobicContact CD1-CG 4.26Å; L99-E103 HydrophobicContact CG-CG 4.49Å; L99-E103 WeakPolarHBondContact O-CB 3.41Å; L99-E103 PolarHBondContact O-N 2.81Å; L99-L155 HydrophobicContact CB-CD2 3.58Å; L99-L155 HydrophobicContact CD1-CD2 3.84Å; L99-L155 HydrophobicContact CG-CD2 4.18Å
100	A	93.8	Very high	93	Very high	1 Å²	1	20 Å²	20	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-69	-23	-179.5	0	0	0	0	0	113	W96 L97 N104 S105 L106 Y109	W96-A100 WeakPolarHBondContact O-CB 3.42Å; W96-A100 PolarHBondContact O-N 2.72Å; L97-A100 PolarHBondContact O-N 3.09Å; A100-N104 CarbonylContact O-C 3.46Å; A100-S105 PolarHBondContact O-N 2.86Å; A100-L106 HydrophobicContact CB-CB 3.93Å; A100-L106 HydrophobicContact CB-CD1 4.05Å; A100-L106 PolarHBondContact O-N 2.85Å; A100-Y109 HydrophobicContact CB-CD2 4.05Å; A100-Y109 HydrophobicContact CB-CE2 4.11Å
101	L	93.2	Very high	93.1	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-79.5	-46	168.3	-68.8	170.5	0	0	0	111.5	L49 L97 Y98 L99 E103 N104 L106 L146 F151 L153	L49-L101 HydrophobicContact CD1-CD1 4.31Å; L49-L101 HydrophobicContact CD1-CD2 4.28Å; L97-L101 WeakPolarHBondContact O-CG 3.18Å; L97-L101 PolarHBondContact O-N 3.2Å; Y98-L101 PolarHBondContact O-N 3.29Å; L99-L101 VanDerWaalsContact C-N 3.26Å; L99-L101 PolarHBondContact O-N 2.84Å; L101-E103 VanDerWaalsContact C-N 3.31Å; L101-E103 PolarHBondContact O-N 2.89Å; L101-N104 PolarHBondContact O-N 3.24Å; L101-L106 HydrophobicContact CD2-CD2 4.1Å; L101-L146 HydrophobicContact CD2-CD1 4.05Å; L101-F151 HydrophobicContact CB-CD1 4.48Å; L101-F151 HydrophobicContact CB-CD2 4.14Å; L101-F151 HydrophobicContact CB-CE2 4.48Å; L101-F151 HydrophobicContact CB-CG 4.14Å; L101-F151 HydrophobicContact CD2-CE2 4.3Å; L101-F151 HydrophobicContact CD2-CZ 4.31Å; L101-F151 WeakPolarHBondContact O-CD2 3.49Å; L101-L153 HydrophobicContact CB-CD1 4.22Å; L101-L153 HydrophobicContact CD1-CD1 4.25Å
102	N	92.7	Very high	93.1	Very high	44 Å²	44	25.4 Å²	25.4	24%	0.235	13%	0.125	C	C	.	.	H	α-helix	trans	-60.6	-34.4	175.9	-76.7	-9.5	0	0	0	113.7	Y98 L99 N104 F151 L153	Y98-N102 WeakPolarHBondContact O-CB 3.47Å; Y98-N102 PolarHBondContact O-N 2.61Å; L99-N102 PolarHBondContact O-N 3.11Å; N102-N104 VanDerWaalsContact C-N 3.34Å; N102-F151 WeakPolarHBondContact OD1-CB 3.41Å; N102-F151 PolarHBondContact OD1-O 3.45Å; N102-L153 PolarHBondContact ND2-O 2.62Å; N102-L153 WeakPolarHBondContact OD1-CB 3.46Å; N102-L153 VanDerWaalsContact OD1-CG 3.32Å; N102-L153 WeakPolarHBondContact OD1-CG 3.26Å; N102-L153 PolarHBondContact OD1-N 2.68Å
103	E	91.3	Very high	93	Very high	71 Å²	71	23.3 Å²	23.3	33%	0.332	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-3	174.1	-75.9	-164	147.7	0	0	113.4	R73 L99 L101 S105	R73-E103 IonicContact CZ-OE1 3.63Å; R73-E103 IonicContact CZ-OE2 2.71Å; R73-E103 VanDerWaalsContact NH1-CD 3.28Å; R73-E103 IonicContact NH1-OE1 3.83Å; R73-E103 PolarHBondContact NH1-OE1 2.97Å; R73-E103 IonicContact NH1-OE2 3.21Å; R73-E103 PolarHBondContact NH1-OE2 2.94Å; L99-E103 HydrophobicContact CD1-CG 4.26Å; L99-E103 HydrophobicContact CG-CG 4.49Å; L99-E103 WeakPolarHBondContact O-CB 3.41Å; L99-E103 PolarHBondContact O-N 2.81Å; L101-E103 VanDerWaalsContact C-N 3.31Å; L101-E103 PolarHBondContact O-N 2.89Å; E103-S105 VanDerWaalsContact CB-OG 3.24Å; E103-S105 WeakPolarHBondContact CB-OG 3.45Å; E103-S105 PolarHBondContact O-N 3.1Å; E103-S105 VanDerWaalsContact O-N 3.08Å; E103-S105 PolarHBondContact OE2-OG 2.89Å
104	N	90.3	Very high	92.7	Very high	65 Å²	65	25.8 Å²	25.8	35%	0.348	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	27	-165.8	-59.3	93.7	0	0	0	113.3	A100 L101 N102 L146 E147 I149	A100-N104 CarbonylContact O-C 3.46Å; L101-N104 PolarHBondContact O-N 3.24Å; N102-N104 VanDerWaalsContact C-N 3.34Å; N104-L146 PolarHBondContact ND2-O 3.33Å; N104-E147 PolarHBondContact ND2-O 3.32Å; N104-I149 PolarHBondContact ND2-O 2.85Å
105	S	92.1	Very high	92.4	Very high	11 Å²	11	31.7 Å²	31.7	8%	0.077	16%	0.157	C	C	.	.			trans	-100.4	-5.5	-168.7	64.5	0	0	0	0	115	A100 E103 E107 S108 Y109	A100-S105 PolarHBondContact O-N 2.86Å; E103-S105 VanDerWaalsContact CB-OG 3.24Å; E103-S105 WeakPolarHBondContact CB-OG 3.45Å; E103-S105 PolarHBondContact O-N 3.1Å; E103-S105 VanDerWaalsContact O-N 3.08Å; E103-S105 PolarHBondContact OE2-OG 2.89Å; S105-E107 VanDerWaalsContact C-N 3.3Å; S105-E107 PolarHBondContact O-N 3.33Å; S105-S108 WeakPolarHBondContact O-CB 3.28Å; S105-S108 PolarHBondContact O-N 2.75Å; S105-Y109 WeakPolarHBondContact O-CD2 3.4Å; S105-Y109 PolarHBondContact O-N 2.94Å; S105-Y109 VanDerWaalsContact OG-CE2 3.26Å; S105-Y109 WeakPolarHBondContact OG-CE2 3.4Å
106	L	92.9	Very high	92.1	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-52.4	-42.8	-179.6	-175.3	61.3	0	0	0	113.5	L49 W96 L97 A100 L101 S108 Y109 L110 V143	L49-L106 HydrophobicContact CD1-CD2 4.12Å; L49-L106 HydrophobicContact CD2-CD2 4.46Å; W96-L106 HydrophobicContact CH2-CD1 3.89Å; W96-L106 HydrophobicContact CZ3-CD1 3.87Å; L97-L106 HydrophobicContact CD1-CD1 3.95Å; L97-L106 HydrophobicContact CD1-CD2 3.79Å; A100-L106 HydrophobicContact CB-CB 3.93Å; A100-L106 HydrophobicContact CB-CD1 4.05Å; A100-L106 PolarHBondContact O-N 2.85Å; L101-L106 HydrophobicContact CD2-CD2 4.1Å; L106-S108 VanDerWaalsContact C-N 3.3Å; L106-S108 PolarHBondContact O-N 3Å; L106-Y109 PolarHBondContact O-N 2.84Å; L106-Y109 VanDerWaalsContact O-N 3.16Å; L106-L110 PolarHBondContact O-N 3.37Å; L106-V143 HydrophobicContact CB-CG1 3.9Å; L106-V143 HydrophobicContact CD2-CG1 3.89Å; L106-V143 HydrophobicContact CD2-CG2 4.25Å; L106-V143 HydrophobicContact CG-CG1 3.86Å
107	E	92.8	Very high	91.7	Very high	32 Å²	32	37.3 Å²	37.3	15%	0.15	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-40.6	177.1	-168.2	-144.8	-154.6	0	0	112.1	S105 L110 R111 L140 V143 S144	S105-E107 VanDerWaalsContact C-N 3.3Å; S105-E107 PolarHBondContact O-N 3.33Å; E107-L110 PolarHBondContact O-N 2.9Å; E107-R111 VanDerWaalsContact CD-NH1 3.29Å; E107-R111 PolarHBondContact O-N 2.88Å; E107-R111 IonicContact OE1-CZ 3Å; E107-R111 IonicContact OE1-NH1 3.33Å; E107-R111 IonicContact OE1-NH2 2.79Å; E107-R111 PolarHBondContact OE1-NH2 3.08Å; E107-R111 IonicContact OE2-CZ 2.73Å; E107-R111 VanDerWaalsContact OE2-CZ 3.26Å; E107-R111 IonicContact OE2-NH1 2.83Å; E107-R111 PolarHBondContact OE2-NH1 3.28Å; E107-R111 IonicContact OE2-NH2 3.24Å; E107-R111 PolarHBondContact OE2-NH2 2.89Å; E107-L140 HydrophobicContact CG-CD2 3.7Å; E107-L140 HydrophobicContact CG-CG 3.92Å; E107-V143 HydrophobicContact CB-CG1 3.97Å; E107-S144 WeakPolarHBondContact OE1-CB 3.31Å; E107-S144 PolarHBondContact OE1-OG 3.28Å
108	S	92.3	Very high	91.2	Very high	62 Å²	62	40.1 Å²	40.1	43%	0.434	22%	0.216	S	C	.	.	H	α-helix	trans	-69.3	-34.7	177.6	-69.1	0	0	0	0	112.3	S105 L106 R111 L112	S105-S108 WeakPolarHBondContact O-CB 3.28Å; S105-S108 PolarHBondContact O-N 2.75Å; L106-S108 VanDerWaalsContact C-N 3.3Å; L106-S108 PolarHBondContact O-N 3Å; S108-R111 PolarHBondContact O-N 2.94Å; S108-L112 WeakPolarHBondContact O-CG 3.29Å; S108-L112 PolarHBondContact O-N 2.96Å
109	Y	92.4	Very high	90.9	Very high	12 Å²	12	41.8 Å²	41.8	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-68.2	-34.1	172.2	-65	-59.2	0	0	0	112.2	F71 W96 A100 S105 L106 L112 F113	F71-Y109 HydrophobicContact CB-CD1 4.28Å; F71-Y109 WeakPolarHBondContact O-CE1 3.31Å; W96-Y109 HydrophobicContact CH2-CD2 4.08Å; W96-Y109 HydrophobicContact CH2-CG 4.15Å; W96-Y109 HydrophobicContact CZ2-CD1 4.13Å; W96-Y109 AromaticContact CZ2-CD2 3.45Å; W96-Y109 HydrophobicContact CZ2-CD2 3.45Å; W96-Y109 VanDerWaalsContact CZ2-CD2 3.45Å; W96-Y109 HydrophobicContact CZ2-CE2 4.03Å; W96-Y109 AromaticContact CZ2-CG 3.52Å; W96-Y109 HydrophobicContact CZ2-CG 3.52Å; A100-Y109 HydrophobicContact CB-CD2 4.05Å; A100-Y109 HydrophobicContact CB-CE2 4.11Å; S105-Y109 WeakPolarHBondContact O-CD2 3.4Å; S105-Y109 PolarHBondContact O-N 2.94Å; S105-Y109 VanDerWaalsContact OG-CE2 3.26Å; S105-Y109 WeakPolarHBondContact OG-CE2 3.4Å; L106-Y109 PolarHBondContact O-N 2.84Å; L106-Y109 VanDerWaalsContact O-N 3.16Å; Y109-L112 HydrophobicContact CD1-CD1 4.25Å; Y109-L112 PolarHBondContact O-N 3.2Å; Y109-F113 VanDerWaalsContact O-CD1 3.23Å; Y109-F113 WeakPolarHBondContact O-CD1 3.24Å; Y109-F113 PolarHBondContact O-N 2.85Å; Y109-F113 VanDerWaalsContact O-N 3.12Å
110	L	92.6	Very high	90.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-34.6	173.1	-66.3	177.4	0	0	0	112.8	L53 L106 E107 L112 F113 Q114 L136 F139 L140 V143	L53-L110 HydrophobicContact CD2-CD2 4.4Å; L106-L110 PolarHBondContact O-N 3.37Å; E107-L110 PolarHBondContact O-N 2.9Å; L110-L112 VanDerWaalsContact C-N 3.33Å; L110-L112 PolarHBondContact O-N 3.4Å; L110-F113 HydrophobicContact CD2-CD2 3.96Å; L110-F113 HydrophobicContact CD2-CE2 4.11Å; L110-F113 WeakPolarHBondContact O-CB 3.44Å; L110-F113 PolarHBondContact O-N 2.85Å; L110-Q114 PolarHBondContact O-N 3.22Å; L110-Q114 VanDerWaalsContact O-N 3.13Å; L110-L136 HydrophobicContact CB-CD1 4.32Å; L110-L136 HydrophobicContact CD2-CD1 4.09Å; L110-F139 HydrophobicContact CD1-CD1 3.9Å; L110-F139 HydrophobicContact CD1-CD2 4.28Å; L110-F139 HydrophobicContact CD1-CE1 3.86Å; L110-F139 HydrophobicContact CD1-CE2 4.21Å; L110-F139 HydrophobicContact CD1-CG 4.12Å; L110-F139 HydrophobicContact CD1-CZ 4.02Å; L110-F139 HydrophobicContact CD2-CD1 4.06Å; L110-F139 HydrophobicContact CD2-CE1 3.74Å; L110-F139 HydrophobicContact CD2-CZ 4.44Å; L110-F139 HydrophobicContact CG-CE1 4.49Å; L110-L140 HydrophobicContact CB-CD1 3.97Å; L110-L140 HydrophobicContact CB-CG 4.34Å; L110-V143 HydrophobicContact CD1-CB 4.24Å; L110-V143 HydrophobicContact CD1-CG2 3.9Å
111	R	91.6	Very high	90.2	Very high	97 Å²	97	45.2 Å²	45.2	37%	0.366	24%	0.24	S	C	.	.	H	α-helix	trans	-58.2	-46	168.5	-68.5	-166	-177.9	85.5	8.9	111.3	E107 S108 F113 Q114 E115 L140	E107-R111 VanDerWaalsContact CD-NH1 3.29Å; E107-R111 PolarHBondContact O-N 2.88Å; E107-R111 IonicContact OE1-CZ 3Å; E107-R111 IonicContact OE1-NH1 3.33Å; E107-R111 IonicContact OE1-NH2 2.79Å; E107-R111 PolarHBondContact OE1-NH2 3.08Å; E107-R111 IonicContact OE2-CZ 2.73Å; E107-R111 VanDerWaalsContact OE2-CZ 3.26Å; E107-R111 IonicContact OE2-NH1 2.83Å; E107-R111 PolarHBondContact OE2-NH1 3.28Å; E107-R111 IonicContact OE2-NH2 3.24Å; E107-R111 PolarHBondContact OE2-NH2 2.89Å; S108-R111 PolarHBondContact O-N 2.94Å; R111-F113 VanDerWaalsContact C-N 3.25Å; R111-F113 PolarHBondContact O-N 2.88Å; R111-Q114 WeakPolarHBondContact O-CA 3.23Å; R111-Q114 WeakPolarHBondContact O-CB 3.4Å; R111-Q114 PolarHBondContact O-N 2.91Å; R111-E115 WeakPolarHBondContact O-CG 3.44Å; R111-E115 PolarHBondContact O-N 3.06Å; R111-L140 HydrophobicContact CB-CD1 4.37Å; R111-L140 HydrophobicContact CG-CD1 3.57Å
112	L	91.1	Very high	90	Very high	54 Å²	54	51.9 Å²	51.9	28%	0.283	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-31.8	178.6	-67.2	171.8	0	0	0	112.5	F71 S108 Y109 L110 N116	F71-L112 HydrophobicContact CB-CD1 4.1Å; F71-L112 HydrophobicContact CD1-CB 3.74Å; F71-L112 HydrophobicContact CD1-CD1 4.28Å; F71-L112 HydrophobicContact CE1-CB 4.11Å; F71-L112 HydrophobicContact CG-CB 4.23Å; S108-L112 WeakPolarHBondContact O-CG 3.29Å; S108-L112 PolarHBondContact O-N 2.96Å; Y109-L112 HydrophobicContact CD1-CD1 4.25Å; Y109-L112 PolarHBondContact O-N 3.2Å; L110-L112 VanDerWaalsContact C-N 3.33Å; L110-L112 PolarHBondContact O-N 3.4Å; L112-N116 VanDerWaalsContact O-CB 3.27Å; L112-N116 WeakPolarHBondContact O-CB 3.36Å; L112-N116 PolarHBondContact O-N 2.97Å; L112-N116 PolarHBondContact O-ND2 2.58Å
113	F	90.9	Very high	89.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.3	-42.2	171.4	-68.5	9.2	0	0	0	111.8	L53 L67 V68 F71 Y109 L110 R111 N116 L117 L120 V130 L136	L53-F113 HydrophobicContact CD2-CE2 4.02Å; L67-F113 HydrophobicContact CD2-CD1 4.47Å; L67-F113 HydrophobicContact CD2-CE1 4.05Å; L67-F113 HydrophobicContact CD2-CE2 4.32Å; L67-F113 HydrophobicContact CD2-CZ 3.97Å; V68-F113 HydrophobicContact CG1-CE1 4.19Å; V68-F113 HydrophobicContact CG1-CZ 3.82Å; F71-F113 AromaticContact CD2-CD1 3.83Å; F71-F113 HydrophobicContact CD2-CD1 3.83Å; F71-F113 AromaticContact CD2-CE1 3.63Å; F71-F113 HydrophobicContact CD2-CE1 3.63Å; F71-F113 AromaticContact CE2-CD1 3.63Å; F71-F113 HydrophobicContact CE2-CD1 3.63Å; F71-F113 AromaticContact CE2-CE1 3.79Å; F71-F113 HydrophobicContact CE2-CE1 3.79Å; F71-F113 HydrophobicContact CZ-CD1 4.31Å; Y109-F113 VanDerWaalsContact O-CD1 3.23Å; Y109-F113 WeakPolarHBondContact O-CD1 3.24Å; Y109-F113 PolarHBondContact O-N 2.85Å; Y109-F113 VanDerWaalsContact O-N 3.12Å; L110-F113 HydrophobicContact CD2-CD2 3.96Å; L110-F113 HydrophobicContact CD2-CE2 4.11Å; L110-F113 WeakPolarHBondContact O-CB 3.44Å; L110-F113 PolarHBondContact O-N 2.85Å; R111-F113 VanDerWaalsContact C-N 3.25Å; R111-F113 PolarHBondContact O-N 2.88Å; F113-N116 CarbonylContact O-C 3.54Å; F113-N116 PolarHBondContact O-N 2.99Å; F113-L117 PolarHBondContact O-N 3.25Å; F113-L120 HydrophobicContact CB-CD2 4.47Å; F113-L120 HydrophobicContact CD2-CD1 4.31Å; F113-L120 HydrophobicContact CG-CD1 4.42Å; F113-V130 HydrophobicContact CD2-CB 4.36Å; F113-V130 HydrophobicContact CD2-CG1 4.18Å; F113-V130 HydrophobicContact CE2-CG1 4.46Å; F113-L136 HydrophobicContact CB-CD2 4.33Å
114	Q	88.3	Confident	89.8	Confident	52 Å²	52	49.2 Å²	49.2	24%	0.243	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-39.3	178.5	-163.1	175.1	23.4	0	0	111.9	L110 R111 H133 L136 T137	L110-Q114 PolarHBondContact O-N 3.22Å; L110-Q114 VanDerWaalsContact O-N 3.13Å; R111-Q114 WeakPolarHBondContact O-CA 3.23Å; R111-Q114 WeakPolarHBondContact O-CB 3.4Å; R111-Q114 PolarHBondContact O-N 2.91Å; Q114-H133 PolarHBondContact NE2-CE1 3.24Å; Q114-H133 VanDerWaalsContact NE2-CE1 3.27Å; Q114-H133 PolarHBondContact NE2-ND1 3.11Å; Q114-L136 HydrophobicContact CB-CD2 3.64Å; Q114-L136 HydrophobicContact CG-CD2 4.06Å; Q114-T137 PolarHBondContact NE2-OG1 2.94Å
115	E	89	Confident	89.7	Confident	140 Å²	140	49.3 Å²	49.3	65%	0.654	26%	0.256	S	S	*	.	H	α-helix	trans	-70.1	-33.5	175	-69.7	173.4	-171	0	0	112.7	R111	R111-E115 WeakPolarHBondContact O-CG 3.44Å; R111-E115 PolarHBondContact O-N 3.06Å
116	N	89	Confident	89.2	Confident	65 Å²	65	58 Å²	58	35%	0.348	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	39.3	-169.2	-65.1	-89.9	0	0	0	113.7	F71 L112 F113 G118 L119 L120	F71-N116 HydrophobicContact CE1-CB 3.75Å; F71-N116 HydrophobicContact CZ-CB 3.75Å; L112-N116 VanDerWaalsContact O-CB 3.27Å; L112-N116 WeakPolarHBondContact O-CB 3.36Å; L112-N116 PolarHBondContact O-N 2.97Å; L112-N116 PolarHBondContact O-ND2 2.58Å; F113-N116 CarbonylContact O-C 3.54Å; F113-N116 PolarHBondContact O-N 2.99Å; N116-G118 PolarHBondContact O-N 3Å; N116-L119 HydrophobicContact CB-CB 4.46Å; N116-L119 WeakPolarHBondContact O-CB 3.26Å; N116-L119 PolarHBondContact O-N 3.29Å; N116-L120 PolarHBondContact O-N 3.47Å; N116-L120 VanDerWaalsContact O-N 3.11Å
117	L	86.2	Confident	88.6	Confident	56 Å²	56	62.8 Å²	62.8	29%	0.293	31%	0.312	S	S	.	.	H	α-helix	trans	-48.4	-34.3	177	-71.2	168.6	0	0	0	114	F113 L119 L120 Q121	F113-L117 PolarHBondContact O-N 3.25Å; L117-L119 VanDerWaalsContact C-N 3.29Å; L117-L119 PolarHBondContact O-N 2.91Å; L117-L120 HydrophobicContact CD2-CD2 4.02Å; L117-L120 PolarHBondContact O-N 3.48Å; L117-Q121 WeakPolarHBondContact O-CG 3.33Å; L117-Q121 PolarHBondContact O-N 3.38Å
118	G	84.6	Confident	88.4	Confident	59 Å²	59	61.2 Å²	61.2	61%	0.608	31%	0.305	S	S	*	.	H	α-helix	trans	-70.9	-16.6	177.4	0	0	0	0	0	115.3	N116 K122	N116-G118 PolarHBondContact O-N 3Å; G118-K122 VanDerWaalsContact O-CE 3.3Å; G118-K122 WeakPolarHBondContact O-CE 3.35Å
119	L	87.8	Confident	88.1	Confident	37 Å²	37	58.3 Å²	58.3	19%	0.194	29%	0.285	C	S	.	.	H	α-helix	trans	-88.9	-43.4	166	-175.8	60.5	0	0	0	110.2	L67 H70 F71 N116 L117 Q121 K122 Y123	L67-L119 HydrophobicContact CD1-CD2 4.29Å; L67-L119 HydrophobicContact CD1-CG 4.04Å; H70-L119 HydrophobicContact CB-CD2 3.86Å; F71-L119 HydrophobicContact CE1-CD2 4.39Å; F71-L119 HydrophobicContact CE2-CD2 4.3Å; F71-L119 HydrophobicContact CZ-CD2 3.84Å; N116-L119 HydrophobicContact CB-CB 4.46Å; N116-L119 WeakPolarHBondContact O-CB 3.26Å; N116-L119 PolarHBondContact O-N 3.29Å; L117-L119 VanDerWaalsContact C-N 3.29Å; L117-L119 PolarHBondContact O-N 2.91Å; L119-Q121 PolarHBondContact O-N 3.07Å; L119-K122 HydrophobicContact CD1-CD 4.22Å; L119-K122 WeakPolarHBondContact O-CB 3.28Å; L119-K122 PolarHBondContact O-N 3.37Å; L119-Y123 HydrophobicContact CD1-CE2 3.96Å; L119-Y123 HydrophobicContact CG-CE2 4.4Å
120	L	87.3	Confident	87.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-55.6	-46	-179.4	-168.4	66.2	0	0	0	112.7	L67 F113 N116 L117 K122 Y123 Y124 V130	L67-L120 HydrophobicContact CD2-CD1 3.42Å; L67-L120 VanDerWaalsContact CD2-CD1 3.42Å; F113-L120 HydrophobicContact CB-CD2 4.47Å; F113-L120 HydrophobicContact CD2-CD1 4.31Å; F113-L120 HydrophobicContact CG-CD1 4.42Å; N116-L120 PolarHBondContact O-N 3.47Å; N116-L120 VanDerWaalsContact O-N 3.11Å; L117-L120 HydrophobicContact CD2-CD2 4.02Å; L117-L120 PolarHBondContact O-N 3.48Å; L120-K122 PolarHBondContact O-N 2.81Å; L120-Y123 PolarHBondContact O-N 3.14Å; L120-Y124 HydrophobicContact CD1-CD2 3.57Å; L120-Y124 HydrophobicContact CD1-CE2 3.86Å; L120-Y124 HydrophobicContact CD1-CG 4.28Å; L120-Y124 HydrophobicContact CG-CD2 4.2Å; L120-Y124 PolarHBondContact O-N 3.34Å; L120-V130 HydrophobicContact CD1-CB 4.49Å; L120-V130 HydrophobicContact CD1-CG2 3.94Å; L120-V130 HydrophobicContact CD2-CB 4.11Å; L120-V130 HydrophobicContact CD2-CG2 4.05Å; L120-V130 WeakPolarHBondContact CD2-O 3.26Å; L120-V130 HydrophobicContact CG-CG2 4.3Å
121	Q	86.9	Confident	87.7	Confident	86 Å²	86	58.5 Å²	58.5	40%	0.402	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.7	178.1	-71	-176.6	29.3	0	0	114.9	L117 L119	L117-Q121 WeakPolarHBondContact O-CG 3.33Å; L117-Q121 PolarHBondContact O-N 3.38Å; L119-Q121 PolarHBondContact O-N 3.07Å
122	K	88.1	Confident	87.6	Confident	143 Å²	143	55 Å²	55	62%	0.622	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-23.9	171.1	-55.7	-178.7	-169	167	0	112.8	G118 L119 L120	G118-K122 VanDerWaalsContact O-CE 3.3Å; G118-K122 WeakPolarHBondContact O-CE 3.35Å; L119-K122 HydrophobicContact CD1-CD 4.22Å; L119-K122 WeakPolarHBondContact O-CB 3.28Å; L119-K122 PolarHBondContact O-N 3.37Å; L120-K122 PolarHBondContact O-N 2.81Å
123	Y	87.9	Confident	87.4	Confident	59 Å²	59	57.8 Å²	57.8	23%	0.231	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-23.6	-176.3	-64.4	-84.4	0	0	0	112.4	Q58 V66 L67 H70 L119 L120	Q58-Y123 VanDerWaalsContact CB-O 3.31Å; Q58-Y123 WeakPolarHBondContact CB-O 3.28Å; Q58-Y123 WeakPolarHBondContact CG-O 3.47Å; Q58-Y123 PolarHBondContact N-O 3.07Å; V66-Y123 HydrophobicContact CB-CD1 4.48Å; V66-Y123 HydrophobicContact CB-CE1 4.01Å; V66-Y123 HydrophobicContact CG2-CD1 3.76Å; V66-Y123 HydrophobicContact CG2-CE1 3.78Å; V66-Y123 PolarHBondContact O-OH 3.31Å; L67-Y123 HydrophobicContact CB-CD2 4.4Å; L67-Y123 HydrophobicContact CB-CG 4.4Å; L67-Y123 HydrophobicContact CD1-CD2 3.7Å; L67-Y123 HydrophobicContact CD1-CE2 4.1Å; L67-Y123 HydrophobicContact CD1-CG 4.41Å; H70-Y123 AromaticContact NE2-CE2 3.68Å; H70-Y123 AromaticContact NE2-CZ 3.13Å; H70-Y123 PolarHBondContact NE2-OH 3.38Å; L119-Y123 HydrophobicContact CD1-CE2 3.96Å; L119-Y123 HydrophobicContact CG-CE2 4.4Å; L120-Y123 PolarHBondContact O-N 3.14Å
124	Y	90.8	Very high	87.3	Confident	1 Å²	1	62.8 Å²	62.8	0%	0.004	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-115.9	152.3	179.4	-73.5	-99.8	0	0	0	111.7	L53 G56 L57 Q58 Y64 L67 L120 A128 V130 C131	L53-Y124 WeakPolarHBondContact O-CE1 3.43Å; L53-Y124 VanDerWaalsContact O-CZ 3.3Å; L53-Y124 PolarHBondContact O-OH 3.4Å; G56-Y124 CarbonylContact O-C 3.56Å; G56-Y124 VanDerWaalsContact O-CA 3.29Å; G56-Y124 WeakPolarHBondContact O-CA 3.4Å; L57-Y124 HydrophobicContact CB-CD1 4.21Å; L57-Y124 HydrophobicContact CB-CE1 3.84Å; L57-Y124 HydrophobicContact CD1-CD2 4.24Å; L57-Y124 HydrophobicContact CD1-CE1 4.22Å; L57-Y124 HydrophobicContact CD1-CE2 3.74Å; Q58-Y124 PolarHBondContact NE2-O 3.03Å; Y64-Y124 WeakPolarHBondContact CB-OH 3.41Å; L67-Y124 HydrophobicContact CD2-CD2 4.26Å; L67-Y124 HydrophobicContact CD2-CE2 3.64Å; L120-Y124 HydrophobicContact CD1-CD2 3.57Å; L120-Y124 HydrophobicContact CD1-CE2 3.86Å; L120-Y124 HydrophobicContact CD1-CG 4.28Å; L120-Y124 HydrophobicContact CG-CD2 4.2Å; L120-Y124 PolarHBondContact O-N 3.34Å; Y124-A128 HydrophobicContact CD1-CB 3.73Å; Y124-A128 HydrophobicContact CG-CB 4.28Å; Y124-V130 HydrophobicContact CD1-CG2 3.53Å; Y124-V130 HydrophobicContact CD2-CG2 4.27Å; Y124-V130 HydrophobicContact CE1-CG2 3.6Å; Y124-V130 HydrophobicContact CE2-CG2 4.35Å; Y124-V130 HydrophobicContact CG-CG2 3.88Å; Y124-C131 VanDerWaalsContact CB-SG 3.59Å
125	V	88.6	Confident	87.5	Confident	66 Å²	66	61.1 Å²	61.1	40%	0.4	31%	0.308	S	S	.	.			trans	-72.8	151.6	168.5	-54.3	0	0	0	0	109.9	G56 Q58 N127 A128 C131	G56-V125 PolarHBondContact O-N 3.48Å; Q58-V125 HydrophobicContact CG-CG1 3.97Å; V125-N127 PolarHBondContact O-N 2.95Å; V125-A128 HydrophobicContact CG2-CB 4.46Å; V125-A128 VanDerWaalsContact O-CB 3.24Å; V125-A128 WeakPolarHBondContact O-CB 3.37Å; V125-A128 PolarHBondContact O-N 3.4Å; V125-C131 PolarHBondContact O-SG 2.97Å
126	R	81.3	Confident	87.6	Confident	194 Å²	194	54.5 Å²	54.5	73%	0.732	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-28	-180	-74.1	-179	171.5	163.7	-2.4	114	A128 C131	R126-A128 VanDerWaalsContact C-N 3.35Å; R126-C131 WeakPolarHBondContact O-CB 3.37Å
127	N	81.8	Confident	87.7	Confident	103 Å²	103	54 Å²	54	55%	0.551	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	7.3	179	-68.3	8.7	0	0	0	114	K7 V125	K7-N127 WeakPolarHBondContact CE-O 3.24Å; K7-N127 PolarHBondContact NZ-O 3.16Å; V125-N127 PolarHBondContact O-N 2.95Å
128	A	87.1	Confident	88	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-59.2	163.6	173	0	0	0	0	0	112.6	K7 Y55 Y124 V125 R126 V130 C131	K7-A128 WeakPolarHBondContact CE-O 3.3Å; K7-A128 PolarHBondContact NZ-O 2.82Å; Y55-A128 WeakPolarHBondContact O-CB 3.26Å; Y124-A128 HydrophobicContact CD1-CB 3.73Å; Y124-A128 HydrophobicContact CG-CB 4.28Å; V125-A128 HydrophobicContact CG2-CB 4.46Å; V125-A128 VanDerWaalsContact O-CB 3.24Å; V125-A128 WeakPolarHBondContact O-CB 3.37Å; V125-A128 PolarHBondContact O-N 3.4Å; R126-A128 VanDerWaalsContact C-N 3.35Å; A128-V130 HydrophobicContact CB-CG2 4.24Å; A128-C131 HydrophobicContact CB-CB 4.08Å
129	L	87.4	Confident	88.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	-65.9	-54.9	175.2	-176.1	156.4	0	0	0	109.4	K7 I10 L11 A52 Y55 C131 S132 H135 F139	K7-L129 HydrophobicContact CG-CB 4.41Å; I10-L129 HydrophobicContact CB-CD1 4.08Å; I10-L129 HydrophobicContact CG2-CD1 3.62Å; L11-L129 HydrophobicContact CD2-CD1 4.13Å; L11-L129 HydrophobicContact CD2-CD2 4.4Å; L11-L129 HydrophobicContact CG-CD1 4.27Å; A52-L129 HydrophobicContact CB-CD1 4.17Å; Y55-L129 HydrophobicContact CD1-CB 3.92Å; L129-C131 PolarHBondContact O-N 2.66Å; L129-C131 VanDerWaalsContact O-N 3.15Å; L129-S132 PolarHBondContact O-N 3.43Å; L129-S132 VanDerWaalsContact O-N 3.1Å; L129-H135 HydrophobicContact CG-CB 4.41Å; L129-F139 HydrophobicContact CD2-CB 4.14Å; L129-F139 HydrophobicContact CD2-CD1 3.65Å; L129-F139 HydrophobicContact CD2-CE1 4.38Å; L129-F139 HydrophobicContact CD2-CG 4.14Å
130	V	88	Confident	88.8	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.4	178.7	-64.4	0	0	0	0	114.5	L53 F113 L120 Y124 A128 L136	L53-V130 HydrophobicContact CD2-CG1 4.48Å; F113-V130 HydrophobicContact CD2-CB 4.36Å; F113-V130 HydrophobicContact CD2-CG1 4.18Å; F113-V130 HydrophobicContact CE2-CG1 4.46Å; L120-V130 HydrophobicContact CD1-CB 4.49Å; L120-V130 HydrophobicContact CD1-CG2 3.94Å; L120-V130 HydrophobicContact CD2-CB 4.11Å; L120-V130 HydrophobicContact CD2-CG2 4.05Å; L120-V130 WeakPolarHBondContact CD2-O 3.26Å; L120-V130 HydrophobicContact CG-CG2 4.3Å; Y124-V130 HydrophobicContact CD1-CG2 3.53Å; Y124-V130 HydrophobicContact CD2-CG2 4.27Å; Y124-V130 HydrophobicContact CE1-CG2 3.6Å; Y124-V130 HydrophobicContact CE2-CG2 4.35Å; Y124-V130 HydrophobicContact CG-CG2 3.88Å; A128-V130 HydrophobicContact CB-CG2 4.24Å; V130-L136 HydrophobicContact CG1-CD1 4.45Å
131	C	88.1	Confident	89	Confident	16 Å²	16	56.2 Å²	56.2	11%	0.108	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-9.4	177	-72.7	0	0	0	0	114.5	Y124 V125 R126 A128 L129	Y124-C131 VanDerWaalsContact CB-SG 3.59Å; V125-C131 PolarHBondContact O-SG 2.97Å; R126-C131 WeakPolarHBondContact O-CB 3.37Å; A128-C131 HydrophobicContact CB-CB 4.08Å; L129-C131 PolarHBondContact O-N 2.66Å; L129-C131 VanDerWaalsContact O-N 3.15Å
132	S	88.3	Confident	89.3	Confident	24 Å²	24	53.8 Å²	53.8	17%	0.168	27%	0.267	C	S	.	.	S	Bend	trans	-101.5	125.7	179.8	179.7	0	0	0	0	110.5	L129 D134 H135 L136	L129-S132 PolarHBondContact O-N 3.43Å; L129-S132 VanDerWaalsContact O-N 3.1Å; S132-D134 PolarHBondContact O-N 3.33Å; S132-H135 WeakPolarHBondContact CB-ND1 2.9Å; S132-H135 PolarHBondContact OG-ND1 3.25Å; S132-L136 WeakPolarHBondContact O-CB 3.41Å; S132-L136 PolarHBondContact O-N 3.28Å
133	H	88.1	Confident	89.6	Confident	113 Å²	113	47.2 Å²	47.2	52%	0.523	24%	0.239	S	C	.	.	H	α-helix	trans	-57.4	-46.2	-175.2	-173.2	83.8	0	0	0	112.5	Q114 T137	Q114-H133 PolarHBondContact NE2-CE1 3.24Å; Q114-H133 VanDerWaalsContact NE2-CE1 3.27Å; Q114-H133 PolarHBondContact NE2-ND1 3.11Å; H133-T137 WeakPolarHBondContact O-CB 3.29Å; H133-T137 PolarHBondContact O-N 2.86Å; H133-T137 PolarHBondContact O-OG1 3.09Å
134	D	89.3	Confident	89.7	Confident	105 Å²	105	46 Å²	46	56%	0.561	24%	0.239	S	C	*	.	H	α-helix	trans	-68.9	-51.1	-175.3	-35.8	-41.5	0	0	0	110.8	S132 L136 T137 L138	S132-D134 PolarHBondContact O-N 3.33Å; D134-L136 VanDerWaalsContact C-N 3.34Å; D134-L136 PolarHBondContact O-N 2.83Å; D134-T137 PolarHBondContact O-N 3.3Å; D134-T137 VanDerWaalsContact O-N 3.13Å; D134-L138 WeakPolarHBondContact O-CG 3.32Å; D134-L138 PolarHBondContact O-N 2.79Å
135	H	91	Very high	89.5	Confident	17 Å²	17	46.8 Å²	46.8	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-64.3	-36.2	179	-56.9	83.2	0	0	0	112.1	K7 D8 L11 L129 S132 F139	K7-H135 VanDerWaalsContact CB-CD2 3.44Å; K7-H135 WeakPolarHBondContact CB-CD2 3.15Å; D8-H135 IonicContact OD1-CD2 3.31Å; D8-H135 IonicContact OD1-NE2 3.88Å; L11-H135 HydrophobicContact CD1-CB 4.03Å; L129-H135 HydrophobicContact CG-CB 4.41Å; S132-H135 WeakPolarHBondContact CB-ND1 2.9Å; S132-H135 PolarHBondContact OG-ND1 3.25Å; H135-F139 VanDerWaalsContact O-CB 3.31Å; H135-F139 WeakPolarHBondContact O-CB 3.46Å; H135-F139 PolarHBondContact O-N 3.26Å
136	L	91.6	Very high	89.6	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-69.4	-36.6	173.5	-179.6	61.1	0	0	0	111.7	L110 F113 Q114 V130 S132 D134 F139 L140	L110-L136 HydrophobicContact CB-CD1 4.32Å; L110-L136 HydrophobicContact CD2-CD1 4.09Å; F113-L136 HydrophobicContact CB-CD2 4.33Å; Q114-L136 HydrophobicContact CB-CD2 3.64Å; Q114-L136 HydrophobicContact CG-CD2 4.06Å; V130-L136 HydrophobicContact CG1-CD1 4.45Å; S132-L136 WeakPolarHBondContact O-CB 3.41Å; S132-L136 PolarHBondContact O-N 3.28Å; D134-L136 VanDerWaalsContact C-N 3.34Å; D134-L136 PolarHBondContact O-N 2.83Å; L136-F139 HydrophobicContact CD1-CD1 4.26Å; L136-F139 PolarHBondContact O-N 3.25Å; L136-L140 VanDerWaalsContact O-CB 3.24Å; L136-L140 WeakPolarHBondContact O-CB 3.28Å; L136-L140 PolarHBondContact O-N 3.27Å
137	T	92	Very high	89.8	Confident	54 Å²	54	40.3 Å²	40.3	33%	0.331	22%	0.222	S	C	.	.	H	α-helix	trans	-67.7	-40.4	176.7	-57.4	0	0	0	0	111.4	Q114 H133 D134 L140 T141	Q114-T137 PolarHBondContact NE2-OG1 2.94Å; H133-T137 WeakPolarHBondContact O-CB 3.29Å; H133-T137 PolarHBondContact O-N 2.86Å; H133-T137 PolarHBondContact O-OG1 3.09Å; D134-T137 PolarHBondContact O-N 3.3Å; D134-T137 VanDerWaalsContact O-N 3.13Å; T137-L140 PolarHBondContact O-N 3.16Å; T137-T141 PolarHBondContact O-N 3.3Å; T137-T141 PolarHBondContact O-OG1 3.31Å
138	L	92.6	Very high	89.8	Confident	96 Å²	96	43.8 Å²	43.8	50%	0.503	23%	0.232	S	C	.	.	H	α-helix	trans	-62	-49.6	170.3	-70.1	172.4	0	0	0	111.2	L11 D134 L140 T141 L142	L11-L138 HydrophobicContact CD1-CB 3.98Å; L11-L138 HydrophobicContact CD1-CD1 4.04Å; D134-L138 WeakPolarHBondContact O-CG 3.32Å; D134-L138 PolarHBondContact O-N 2.79Å; L138-L140 VanDerWaalsContact C-N 3.28Å; L138-L140 PolarHBondContact O-N 3.08Å; L138-T141 PolarHBondContact O-N 2.9Å; L138-T141 VanDerWaalsContact O-N 3.17Å; L138-L142 WeakPolarHBondContact O-CG 3.39Å; L138-L142 PolarHBondContact O-N 3.45Å
139	F	94.5	Very high	89.8	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.5	-44.8	176.8	-175.1	-161.9	0	0	0	111.6	L11 I14 L49 A52 L53 L110 L129 H135 L136 T141 L142 V143	L11-F139 HydrophobicContact CD2-CB 3.68Å; L11-F139 HydrophobicContact CD2-CG 4.34Å; I14-F139 HydrophobicContact CD1-CD2 4.01Å; I14-F139 HydrophobicContact CD1-CE2 3.78Å; I14-F139 HydrophobicContact CD1-CZ 4.49Å; L49-F139 HydrophobicContact CD2-CE2 3.53Å; L49-F139 HydrophobicContact CD2-CZ 3.94Å; A52-F139 HydrophobicContact CB-CE1 4.26Å; A52-F139 HydrophobicContact CB-CZ 4.1Å; L53-F139 HydrophobicContact CD2-CE1 4.26Å; L110-F139 HydrophobicContact CD1-CD1 3.9Å; L110-F139 HydrophobicContact CD1-CD2 4.28Å; L110-F139 HydrophobicContact CD1-CE1 3.86Å; L110-F139 HydrophobicContact CD1-CE2 4.21Å; L110-F139 HydrophobicContact CD1-CG 4.12Å; L110-F139 HydrophobicContact CD1-CZ 4.02Å; L110-F139 HydrophobicContact CD2-CD1 4.06Å; L110-F139 HydrophobicContact CD2-CE1 3.74Å; L110-F139 HydrophobicContact CD2-CZ 4.44Å; L110-F139 HydrophobicContact CG-CE1 4.49Å; L129-F139 HydrophobicContact CD2-CB 4.14Å; L129-F139 HydrophobicContact CD2-CD1 3.65Å; L129-F139 HydrophobicContact CD2-CE1 4.38Å; L129-F139 HydrophobicContact CD2-CG 4.14Å; H135-F139 VanDerWaalsContact O-CB 3.31Å; H135-F139 WeakPolarHBondContact O-CB 3.46Å; H135-F139 PolarHBondContact O-N 3.26Å; L136-F139 HydrophobicContact CD1-CD1 4.26Å; L136-F139 PolarHBondContact O-N 3.25Å; F139-T141 PolarHBondContact O-N 3.48Å; F139-L142 PolarHBondContact O-N 2.96Å; F139-V143 HydrophobicContact CD2-CG2 3.88Å; F139-V143 HydrophobicContact CE2-CG2 3.62Å; F139-V143 HydrophobicContact CZ-CG2 4.47Å; F139-V143 WeakPolarHBondContact O-CG2 3.16Å; F139-V143 PolarHBondContact O-N 3.47Å
140	L	93.3	Very high	89.8	Confident	15 Å²	15	51.6 Å²	51.6	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-46.5	178.5	-164.2	147.4	0	0	0	111.2	E107 L110 R111 L136 T137 L138 L142 V143 S144	E107-L140 HydrophobicContact CG-CD2 3.7Å; E107-L140 HydrophobicContact CG-CG 3.92Å; L110-L140 HydrophobicContact CB-CD1 3.97Å; L110-L140 HydrophobicContact CB-CG 4.34Å; R111-L140 HydrophobicContact CB-CD1 4.37Å; R111-L140 HydrophobicContact CG-CD1 3.57Å; L136-L140 VanDerWaalsContact O-CB 3.24Å; L136-L140 WeakPolarHBondContact O-CB 3.28Å; L136-L140 PolarHBondContact O-N 3.27Å; T137-L140 PolarHBondContact O-N 3.16Å; L138-L140 VanDerWaalsContact C-N 3.28Å; L138-L140 PolarHBondContact O-N 3.08Å; L140-L142 VanDerWaalsContact C-N 3.3Å; L140-L142 PolarHBondContact O-N 2.86Å; L140-V143 CarbonylContact O-C 3.58Å; L140-V143 PolarHBondContact O-N 2.99Å; L140-S144 PolarHBondContact O-N 3.15Å; L140-S144 PolarHBondContact O-OG 3.24Å
141	T	92.8	Very high	89.9	Confident	88 Å²	88	52.5 Å²	52.5	54%	0.54	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-36.2	177.6	-57	0	0	0	0	112.3	T137 L138 F139 S144 G145	T137-T141 PolarHBondContact O-N 3.3Å; T137-T141 PolarHBondContact O-OG1 3.31Å; L138-T141 PolarHBondContact O-N 2.9Å; L138-T141 VanDerWaalsContact O-N 3.17Å; F139-T141 PolarHBondContact O-N 3.48Å; T141-S144 WeakPolarHBondContact O-CB 3.42Å; T141-G145 PolarHBondContact O-N 3.2Å
142	L	93.2	Very high	90	Very high	34 Å²	34	55.2 Å²	55.2	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-67.7	-38.2	173.6	-64.1	176	0	0	0	111.9	L11 I14 L138 F139 L140 G145	L11-L142 HydrophobicContact CB-CD1 4.4Å; L11-L142 HydrophobicContact CD2-CD1 4.45Å; L11-L142 VanDerWaalsContact O-CD1 3.25Å; L11-L142 WeakPolarHBondContact O-CD1 2.85Å; I14-L142 HydrophobicContact CB-CD1 4.19Å; I14-L142 HydrophobicContact CG2-CB 4.03Å; I14-L142 HydrophobicContact CG2-CD1 3.95Å; L138-L142 WeakPolarHBondContact O-CG 3.39Å; L138-L142 PolarHBondContact O-N 3.45Å; F139-L142 PolarHBondContact O-N 2.96Å; L140-L142 VanDerWaalsContact C-N 3.3Å; L140-L142 PolarHBondContact O-N 2.86Å; L142-G145 PolarHBondContact O-N 3.45Å
143	V	93	Very high	90.2	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.036	27%	0.273	C	S	.	.	H	α-helix	trans	-73.5	-31.9	176.7	176.3	0	0	0	0	112.1	L49 L106 E107 L110 F139 L140 G145 L146	L49-V143 HydrophobicContact CD2-CG2 4.31Å; L106-V143 HydrophobicContact CB-CG1 3.9Å; L106-V143 HydrophobicContact CD2-CG1 3.89Å; L106-V143 HydrophobicContact CD2-CG2 4.25Å; L106-V143 HydrophobicContact CG-CG1 3.86Å; E107-V143 HydrophobicContact CB-CG1 3.97Å; L110-V143 HydrophobicContact CD1-CB 4.24Å; L110-V143 HydrophobicContact CD1-CG2 3.9Å; F139-V143 HydrophobicContact CD2-CG2 3.88Å; F139-V143 HydrophobicContact CE2-CG2 3.62Å; F139-V143 HydrophobicContact CZ-CG2 4.47Å; F139-V143 WeakPolarHBondContact O-CG2 3.16Å; F139-V143 PolarHBondContact O-N 3.47Å; L140-V143 CarbonylContact O-C 3.58Å; L140-V143 PolarHBondContact O-N 2.99Å; V143-G145 PolarHBondContact O-N 3.19Å; V143-L146 WeakPolarHBondContact O-CB 3.48Å; V143-L146 PolarHBondContact O-N 2.86Å
144	S	90.3	Very high	90.4	Very high	33 Å²	33	53.3 Å²	53.3	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-54	-34	168.7	-47.5	0	0	0	0	111.5	E107 L140 T141 L146 E147	E107-S144 WeakPolarHBondContact OE1-CB 3.31Å; E107-S144 PolarHBondContact OE1-OG 3.28Å; L140-S144 PolarHBondContact O-N 3.15Å; L140-S144 PolarHBondContact O-OG 3.24Å; T141-S144 WeakPolarHBondContact O-CB 3.42Å; S144-L146 PolarHBondContact O-N 2.85Å; S144-E147 WeakPolarHBondContact O-CB 3.29Å; S144-E147 PolarHBondContact O-N 2.83Å; S144-E147 VanDerWaalsContact O-N 3.12Å
145	G	88.3	Confident	90.5	Very high	18 Å²	18	49.4 Å²	49.4	19%	0.186	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-10.3	175.3	0	0	0	0	0	115.5	Q22 T141 L142 V143	Q22-G145 VanDerWaalsContact NE2-CA 3.26Å; Q22-G145 PolarHBondContact NE2-O 3.11Å; T141-G145 PolarHBondContact O-N 3.2Å; L142-G145 PolarHBondContact O-N 3.45Å; V143-G145 PolarHBondContact O-N 3.19Å
146	L	89.6	Confident	90.5	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.031	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-1.8	178.3	-56.5	175	0	0	0	113.6	V18 L21 L45 L101 N104 V143 S144 F148 I149	V18-L146 HydrophobicContact CG1-CD2 4.18Å; V18-L146 HydrophobicContact CG2-CD1 4.48Å; V18-L146 HydrophobicContact CG2-CD2 4.05Å; V18-L146 HydrophobicContact CG2-CG 4.28Å; L21-L146 HydrophobicContact CD2-CD2 4.09Å; L45-L146 HydrophobicContact CD2-CD1 3.98Å; L45-L146 HydrophobicContact CD2-CD2 3.97Å; L101-L146 HydrophobicContact CD2-CD1 4.05Å; N104-L146 PolarHBondContact ND2-O 3.33Å; V143-L146 WeakPolarHBondContact O-CB 3.48Å; V143-L146 PolarHBondContact O-N 2.86Å; S144-L146 PolarHBondContact O-N 2.85Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 2.83Å; L146-I149 HydrophobicContact CD2-CD1 3.88Å; L146-I149 PolarHBondContact O-N 2.8Å; L146-I149 VanDerWaalsContact O-N 3.13Å
147	E	84.8	Confident	90.3	Very high	117 Å²	117	50.3 Å²	50.3	55%	0.547	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-38.9	-174.7	-173.8	179.9	-174.6	0	0	113.2	N104 S144 I149	N104-E147 PolarHBondContact ND2-O 3.32Å; S144-E147 WeakPolarHBondContact O-CB 3.29Å; S144-E147 PolarHBondContact O-N 2.83Å; S144-E147 VanDerWaalsContact O-N 3.12Å; E147-I149 VanDerWaalsContact C-N 3.3Å; E147-I149 PolarHBondContact O-N 2.82Å
148	F	82.6	Confident	90.1	Very high	176 Å²	176	50.2 Å²	50.2	77%	0.772	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	1.2	-177.8	-58.5	-75.2	0	0	0	114.3	L146	L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 2.83Å
149	I	87.3	Confident	89.9	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.026	23%	0.233	C	C	.	.			trans	-99	131.4	-171.6	-59	-173	0	0	0	110	L21 Q22 F25 I35 N104 L146 E147 F151	L21-I149 HydrophobicContact CB-CD1 4.4Å; L21-I149 HydrophobicContact CD2-CD1 3.89Å; L21-I149 HydrophobicContact CD2-CG2 4.04Å; L21-I149 HydrophobicContact CG-CD1 3.97Å; L21-I149 HydrophobicContact CG-CG2 4.46Å; Q22-I149 HydrophobicContact CG-CD1 4.25Å; F25-I149 HydrophobicContact CD1-CG1 4.48Å; F25-I149 HydrophobicContact CD1-CG2 4.47Å; F25-I149 HydrophobicContact CD2-CG2 4.32Å; F25-I149 HydrophobicContact CE1-CG2 4.09Å; F25-I149 HydrophobicContact CE2-CG2 3.94Å; F25-I149 HydrophobicContact CG-CG1 4.43Å; F25-I149 HydrophobicContact CZ-CG2 3.82Å; I35-I149 HydrophobicContact CD1-CG2 3.3Å; N104-I149 PolarHBondContact ND2-O 2.85Å; L146-I149 HydrophobicContact CD2-CD1 3.88Å; L146-I149 PolarHBondContact O-N 2.8Å; L146-I149 VanDerWaalsContact O-N 3.13Å; E147-I149 VanDerWaalsContact C-N 3.3Å; E147-I149 PolarHBondContact O-N 2.82Å; I149-F151 HydrophobicContact CB-CE2 3.91Å; I149-F151 HydrophobicContact CB-CZ 4.22Å; I149-F151 HydrophobicContact CG2-CD2 4.33Å; I149-F151 HydrophobicContact CG2-CE1 4.24Å; I149-F151 HydrophobicContact CG2-CE2 3.69Å; I149-F151 HydrophobicContact CG2-CZ 3.63Å; I149-F151 WeakPolarHBondContact O-CD2 3.42Å
150	R	86.5	Confident	89.7	Confident	159 Å²	159	45.7 Å²	45.7	60%	0.6	23%	0.233	S	C	*	.			trans	-93.2	121.2	-178.5	-71.6	-177	174.6	173.6	0	111.8	A34 I35	A34-R150 WeakPolarHBondContact CA-O 3.41Å; A34-R150 HydrophobicContact CB-CB 4.31Å; I35-R150 PolarHBondContact N-O 3.48Å
151	F	90.6	Very high	89.4	Confident	20 Å²	20	46.6 Å²	46.6	9%	0.088	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-108.8	139.6	176.7	-63.1	-82.5	0	0	0	110.4	L21 I35 L42 L45 L101 N102 I149 L153	L21-F151 HydrophobicContact CD2-CE1 4.13Å; L21-F151 HydrophobicContact CD2-CZ 3.95Å; I35-F151 HydrophobicContact CB-CD1 4.15Å; I35-F151 HydrophobicContact CD1-CD1 3.84Å; I35-F151 HydrophobicContact CD1-CE1 3.54Å; I35-F151 HydrophobicContact CD1-CZ 4.11Å; L42-F151 HydrophobicContact CD1-CD1 3.78Å; L42-F151 HydrophobicContact CD1-CE1 3.67Å; L45-F151 HydrophobicContact CD2-CZ 4.48Å; L101-F151 HydrophobicContact CB-CD1 4.48Å; L101-F151 HydrophobicContact CB-CD2 4.14Å; L101-F151 HydrophobicContact CB-CE2 4.48Å; L101-F151 HydrophobicContact CB-CG 4.14Å; L101-F151 HydrophobicContact CD2-CE2 4.3Å; L101-F151 HydrophobicContact CD2-CZ 4.31Å; L101-F151 WeakPolarHBondContact O-CD2 3.49Å; N102-F151 WeakPolarHBondContact OD1-CB 3.41Å; N102-F151 PolarHBondContact OD1-O 3.45Å; I149-F151 HydrophobicContact CB-CE2 3.91Å; I149-F151 HydrophobicContact CB-CZ 4.22Å; I149-F151 HydrophobicContact CG2-CD2 4.33Å; I149-F151 HydrophobicContact CG2-CE1 4.24Å; I149-F151 HydrophobicContact CG2-CE2 3.69Å; I149-F151 HydrophobicContact CG2-CZ 3.63Å; I149-F151 WeakPolarHBondContact O-CD2 3.42Å; F151-L153 HydrophobicContact CB-CD1 4.45Å; F151-L153 HydrophobicContact CB-CG 4.13Å; F151-L153 HydrophobicContact CD1-CD1 4.44Å
152	D	91.2	Very high	89	Confident	73 Å²	73	48.6 Å²	48.6	39%	0.39	24%	0.244	S	C	.	.			trans	-131.7	61.2	-179.6	177	36.2	0	0	0	107.3	A34 I35 R36	A34-D152 HydrophobicContact CB-CB 3.46Å; A34-D152 VanDerWaalsContact CB-CB 3.46Å; I35-D152 CarbonylContact O-C 3.54Å; I35-D152 PolarHBondContact O-N 2.56Å; R36-D152 HydrophobicContact CG-CB 4.21Å; R36-D152 IonicContact CZ-OD2 4Å; R36-D152 VanDerWaalsContact CZ-OD2 3.31Å; R36-D152 IonicContact NE-OD2 3.03Å; R36-D152 PolarHBondContact NE-OD2 3.32Å; R36-D152 IonicContact NH2-OD2 3.22Å; R36-D152 PolarHBondContact NH2-OD2 2.79Å
153	L	92.1	Very high	88.6	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	24%	0.241	C	C	.	.			trans	-94.6	130.1	-172.1	-50.4	-176.9	0	0	0	112.3	I35 N37 L42 Y98 L101 N102 F151 L155	I35-L153 WeakPolarHBondContact O-CD2 3.2Å; N37-L153 VanDerWaalsContact OD1-CA 3.24Å; N37-L153 WeakPolarHBondContact OD1-CA 3.27Å; L42-L153 HydrophobicContact CD1-CD1 4.12Å; L42-L153 HydrophobicContact CD1-CD2 4.07Å; L42-L153 HydrophobicContact CD2-CD1 4.32Å; L42-L153 HydrophobicContact CD2-CD2 3.31Å; L42-L153 HydrophobicContact CD2-CG 4.44Å; L42-L153 HydrophobicContact CG-CD2 4.32Å; Y98-L153 HydrophobicContact CD1-CD1 4.31Å; Y98-L153 HydrophobicContact CD2-CB 3.8Å; Y98-L153 HydrophobicContact CD2-CD1 4.02Å; Y98-L153 HydrophobicContact CD2-CG 4.46Å; Y98-L153 HydrophobicContact CG-CB 4.25Å; Y98-L153 HydrophobicContact CG-CD1 3.83Å; L101-L153 HydrophobicContact CB-CD1 4.22Å; L101-L153 HydrophobicContact CD1-CD1 4.25Å; N102-L153 PolarHBondContact ND2-O 2.62Å; N102-L153 WeakPolarHBondContact OD1-CB 3.46Å; N102-L153 VanDerWaalsContact OD1-CG 3.32Å; N102-L153 WeakPolarHBondContact OD1-CG 3.26Å; N102-L153 PolarHBondContact OD1-N 2.68Å; F151-L153 HydrophobicContact CB-CD1 4.45Å; F151-L153 HydrophobicContact CB-CG 4.13Å; F151-L153 HydrophobicContact CD1-CD1 4.44Å; L153-L155 WeakPolarHBondContact O-CD1 3.34Å
154	D	91.2	Very high	88	Confident	91 Å²	91	47.9 Å²	47.9	49%	0.487	24%	0.243	S	C	.	.			trans	-75.7	129.2	167.7	-177.5	11.7	0	0	0	110.4	N37 Y98 D156	N37-D154 PolarHBondContact ND2-O 2.65Å; N37-D154 PolarHBondContact OD1-N 3.11Å; Y98-D154 WeakPolarHBondContact CD2-O 3.35Å; D154-D156 PolarHBondContact OD1-N 3Å
155	L	91.8	Very high	87.6	Confident	22 Å²	22	51 Å²	51	12%	0.115	25%	0.25	C	S	.	.	S	Bend	trans	-96.8	-19.3	-175.1	-55.2	92.6	0	0	0	112.8	L83 L99 L153 A157 L160	L83-L155 HydrophobicContact CD2-CB 4.32Å; L99-L155 HydrophobicContact CB-CD2 3.58Å; L99-L155 HydrophobicContact CD1-CD2 3.84Å; L99-L155 HydrophobicContact CG-CD2 4.18Å; L153-L155 WeakPolarHBondContact O-CD1 3.34Å; L155-A157 VanDerWaalsContact C-N 3.34Å; L155-L160 WeakPolarHBondContact O-CD1 3.39Å
156	D	90.8	Very high	87.3	Confident	32 Å²	32	50.9 Å²	50.9	17%	0.171	25%	0.245	C	C	.	.			trans	-101	36	-176.7	-160.3	22.5	0	0	0	112	L83 Q84 H85 D154	L83-D156 WeakPolarHBondContact CB-OD1 3.46Å; L83-D156 HydrophobicContact CD2-CB 3.81Å; Q84-D156 WeakPolarHBondContact CB-OD2 3.28Å; Q84-D156 VanDerWaalsContact N-CG 3.33Å; Q84-D156 PolarHBondContact N-OD1 3Å; Q84-D156 PolarHBondContact N-OD2 3.28Å; H85-D156 VanDerWaalsContact CB-O 3.31Å; H85-D156 WeakPolarHBondContact CB-O 3.41Å; H85-D156 WeakPolarHBondContact CB-OD1 3.3Å; H85-D156 IonicContact CE1-OD2 2.75Å; H85-D156 IonicContact CG-OD1 2.8Å; H85-D156 IonicContact CG-OD2 3.78Å; H85-D156 PolarHBondContact N-OD1 2.84Å; H85-D156 VanDerWaalsContact ND1-CG 3.27Å; H85-D156 PolarHBondContact ND1-O 3.22Å; H85-D156 IonicContact ND1-OD1 3.98Å; H85-D156 IonicContact ND1-OD2 2.65Å; H85-D156 PolarHBondContact ND1-OD2 3.34Å; D154-D156 PolarHBondContact OD1-N 3Å
157	A	89.3	Confident	86.9	Confident	5 Å²	5	52.4 Å²	52.4	4%	0.041	26%	0.255	C	S	.	.			trans	-87	124.1	-176.9	0	0	0	0	0	111.2	L155 Y159 L160	L155-A157 VanDerWaalsContact C-N 3.34Å; A157-Y159 HydrophobicContact CB-CD1 3.69Å; A157-Y159 HydrophobicContact CB-CE1 3.36Å; A157-Y159 PolarHBondContact O-N 2.59Å; A157-L160 HydrophobicContact CB-CD1 4.15Å; A157-L160 HydrophobicContact CB-CG 4.23Å; A157-L160 WeakPolarHBondContact O-CB 3.19Å; A157-L160 WeakPolarHBondContact O-CG 3.29Å; A157-L160 PolarHBondContact O-N 2.91Å; A157-L160 VanDerWaalsContact O-N 3.1Å
158	P	85.9	Confident	86.5	Confident	52 Å²	52	51.6 Å²	51.6	34%	0.338	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.8	-173.2	23.8	-34.8	0	0	0	114.5	H85 L160 Y170	H85-P158 HydrophobicContact CB-CB 4.07Å; P158-L160 VanDerWaalsContact C-N 3.3Å; P158-Y170 HydrophobicContact CG-CE1 3.77Å
159	Y	88.8	Confident	86.2	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-16.4	177.5	72.5	-99.1	0	0	0	113.2	N37 Y98 A157 D161 L162 A163 Y165 M166	N37-Y159 WeakPolarHBondContact CB-OH 3.3Å; N37-Y159 PolarHBondContact ND2-OH 3.32Å; Y98-Y159 WeakPolarHBondContact CE2-OH 3.34Å; Y98-Y159 PolarHBondContact OH-OH 3.25Å; A157-Y159 HydrophobicContact CB-CD1 3.69Å; A157-Y159 HydrophobicContact CB-CE1 3.36Å; A157-Y159 PolarHBondContact O-N 2.59Å; Y159-D161 VanDerWaalsContact C-N 3.29Å; Y159-D161 PolarHBondContact O-N 3.35Å; Y159-L162 CarbonylContact O-C 3.57Å; Y159-L162 WeakPolarHBondContact O-CA 3.49Å; Y159-L162 WeakPolarHBondContact O-CB 3.22Å; Y159-L162 PolarHBondContact O-N 2.82Å; Y159-A163 PolarHBondContact O-N 3.22Å; Y159-Y165 VanDerWaalsContact CD2-O 3.28Å; Y159-Y165 WeakPolarHBondContact CD2-O 3.47Å; Y159-Y165 WeakPolarHBondContact CE2-O 3.39Å; Y159-M166 HydrophobicContact CD1-CB 4.23Å; Y159-M166 HydrophobicContact CD1-CG 3.6Å; Y159-M166 HydrophobicContact CD1-SD 4.21Å; Y159-M166 HydrophobicContact CD2-CB 4.44Å; Y159-M166 HydrophobicContact CE1-CB 3.72Å; Y159-M166 HydrophobicContact CE1-CG 3.37Å; Y159-M166 HydrophobicContact CE1-SD 3.66Å; Y159-M166 HydrophobicContact CE2-CB 4Å; Y159-M166 HydrophobicContact CE2-CG 4.42Å; Y159-M166 HydrophobicContact CG-CG 4.22Å
160	L	90	Very high	85.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-32.4	-174.7	-65.1	170.5	0	0	0	112.7	V86 R94 A95 Y98 L155 A157 P158 L162	V86-L160 HydrophobicContact CG2-CB 4.46Å; V86-L160 HydrophobicContact CG2-CD1 4.22Å; R94-L160 HydrophobicContact CB-CB 4.39Å; R94-L160 HydrophobicContact CB-CD2 4.07Å; R94-L160 WeakPolarHBondContact CD-O 3.29Å; R94-L160 PolarHBondContact NH1-O 3.48Å; A95-L160 HydrophobicContact CB-CD1 4.27Å; Y98-L160 HydrophobicContact CD2-CD2 4.41Å; Y98-L160 HydrophobicContact CE1-CD2 4.11Å; Y98-L160 HydrophobicContact CE2-CD2 3.82Å; L155-L160 WeakPolarHBondContact O-CD1 3.39Å; A157-L160 HydrophobicContact CB-CD1 4.15Å; A157-L160 HydrophobicContact CB-CG 4.23Å; A157-L160 WeakPolarHBondContact O-CB 3.19Å; A157-L160 WeakPolarHBondContact O-CG 3.29Å; A157-L160 PolarHBondContact O-N 2.91Å; A157-L160 VanDerWaalsContact O-N 3.1Å; P158-L160 VanDerWaalsContact C-N 3.3Å; L160-L162 PolarHBondContact O-N 3.24Å
161	D	87.9	Confident	85.3	Confident	34 Å²	34	52.2 Å²	52.2	18%	0.182	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.1	170.3	-85.1	-16.4	0	0	0	113.3	A87 T88 G91 Y159	A87-D161 WeakPolarHBondContact CA-OD2 3.4Å; A87-D161 WeakPolarHBondContact CB-OD2 3.34Å; A87-D161 PolarHBondContact N-OD2 3.36Å; T88-D161 WeakPolarHBondContact CA-OD1 3.44Å; T88-D161 VanDerWaalsContact CB-OD1 3.24Å; T88-D161 WeakPolarHBondContact CB-OD1 3.44Å; T88-D161 HydrophobicContact CG2-CB 4.17Å; T88-D161 WeakPolarHBondContact CG2-OD1 3.44Å; T88-D161 PolarHBondContact N-OD1 3.49Å; T88-D161 PolarHBondContact N-OD2 3.02Å; T88-D161 PolarHBondContact OG1-OD1 2.83Å; G91-D161 WeakPolarHBondContact CA-OD1 3.39Å; Y159-D161 VanDerWaalsContact C-N 3.29Å; Y159-D161 PolarHBondContact O-N 3.35Å
162	L	85.3	Confident	84.7	Confident	129 Å²	129	54.3 Å²	54.3	68%	0.675	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-59.4	-178.9	-53.8	174.8	0	0	0	111.1	R94 Y159 L160	R94-L162 VanDerWaalsContact NH1-C 3.28Å; R94-L162 PolarHBondContact NH1-O 3.48Å; R94-L162 VanDerWaalsContact NH1-O 3.07Å; Y159-L162 CarbonylContact O-C 3.57Å; Y159-L162 WeakPolarHBondContact O-CA 3.49Å; Y159-L162 WeakPolarHBondContact O-CB 3.22Å; Y159-L162 PolarHBondContact O-N 2.82Å; L160-L162 PolarHBondContact O-N 3.24Å
163	A	83.9	Confident	83.7	Confident	12 Å²	12	58.9 Å²	58.9	10%	0.099	29%	0.29	C	S	.	.			trans	-133.8	153.8	-171.7	0	0	0	0	0	112.6	Y159 Y165	Y159-A163 PolarHBondContact O-N 3.22Å; A163-Y165 HydrophobicContact CB-CD1 4.49Å; A163-Y165 HydrophobicContact CB-CE1 4.33Å; A163-Y165 HydrophobicContact CB-CE2 4.38Å; A163-Y165 WeakPolarHBondContact CB-O 3.38Å
164	P	80.6	Confident	82.6	Confident	13 Å²	13	69.2 Å²	69.2	8%	0.084	33%	0.33	C	S	.	.	S	Bend	trans	-79.4	-21.8	175.5	32	-32.1	0	0	0	112.8	E47 D50 R94 Y98	E47-P164 HydrophobicContact CB-CG 4.42Å; D50-P164 HydrophobicContact CB-CB 3.73Å; D50-P164 HydrophobicContact CB-CG 4.24Å; R94-P164 HydrophobicContact CG-CB 4.44Å; Y98-P164 PolarHBondContact OH-O 3.39Å
165	Y	81.8	Confident	81.5	Confident	99 Å²	99	68.1 Å²	68.1	39%	0.388	32%	0.324	S	S	.	.	S	Bend	trans	-101.9	157.5	172.5	61.2	-97.2	0	0	0	110.6	Y159 A163 P167	Y159-Y165 VanDerWaalsContact CD2-O 3.28Å; Y159-Y165 WeakPolarHBondContact CD2-O 3.47Å; Y159-Y165 WeakPolarHBondContact CE2-O 3.39Å; A163-Y165 HydrophobicContact CB-CD1 4.49Å; A163-Y165 HydrophobicContact CB-CE1 4.33Å; A163-Y165 HydrophobicContact CB-CE2 4.38Å; A163-Y165 WeakPolarHBondContact CB-O 3.38Å; Y165-P167 WeakPolarHBondContact O-CD 3.38Å
166	M	81.9	Confident	80.5	Confident	15 Å²	15	72.1 Å²	72.1	7%	0.074	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-82.6	121.2	179.6	-167	170.4	83.8	0	0	112.1	N37 H38 Y159 Y170 K171	N37-M166 HydrophobicContact CB-SD 4.25Å; H38-M166 HydrophobicContact CB-CE 3.37Å; Y159-M166 HydrophobicContact CD1-CB 4.23Å; Y159-M166 HydrophobicContact CD1-CG 3.6Å; Y159-M166 HydrophobicContact CD1-SD 4.21Å; Y159-M166 HydrophobicContact CD2-CB 4.44Å; Y159-M166 HydrophobicContact CE1-CB 3.72Å; Y159-M166 HydrophobicContact CE1-CG 3.37Å; Y159-M166 HydrophobicContact CE1-SD 3.66Å; Y159-M166 HydrophobicContact CE2-CB 4Å; Y159-M166 HydrophobicContact CE2-CG 4.42Å; Y159-M166 HydrophobicContact CG-CG 4.22Å; M166-Y170 VanDerWaalsContact CE-O 3.25Å; M166-Y170 WeakPolarHBondContact CE-O 3.25Å; M166-K171 HydrophobicContact CE-CB 4.15Å; M166-K171 HydrophobicContact CE-CG 3.52Å
167	P	81.3	Confident	79.6	Confident	38 Å²	38	71.4 Å²	71.4	25%	0.247	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-66.5	151.9	177.1	-18.9	31.8	0	0	0	112.6	Y165 Y169 Y170	Y165-P167 WeakPolarHBondContact O-CD 3.38Å; P167-Y169 PolarHBondContact O-N 3.11Å; P167-Y169 VanDerWaalsContact O-N 3.1Å; P167-Y170 HydrophobicContact CB-CD2 4.26Å; P167-Y170 HydrophobicContact CG-CD2 4.22Å; P167-Y170 PolarHBondContact O-N 3.12Å
168	D	75.6	Confident	78.5	Confident	100 Å²	100	71.5 Å²	71.5	54%	0.535	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-60.5	-27.7	-172.9	-55.9	-58.7	0	0	0	114.6	Y170 K171	D168-Y170 PolarHBondContact O-N 3.38Å; D168-K171 HydrophobicContact CB-CD 4.44Å; D168-K171 WeakPolarHBondContact O-CB 3.43Å; D168-K171 PolarHBondContact O-N 2.82Å; D168-K171 WeakPolarHBondContact OD1-CD 3.19Å; D168-K171 VanDerWaalsContact OD1-CE 3.31Å; D168-K171 WeakPolarHBondContact OD1-CE 3.29Å; D168-K171 IonicContact OD1-NZ 3.51Å; D168-K171 PolarHBondContact OD1-NZ 2.89Å
169	Y	76.6	Confident	77.6	Confident	208 Å²	208	71 Å²	71	82%	0.816	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-60.2	-27.2	173.6	179.1	-99.5	0	0	0	113.4	P167	P167-Y169 PolarHBondContact O-N 3.11Å; P167-Y169 VanDerWaalsContact O-N 3.1Å
170	Y	75.5	Confident	76.6	Confident	96 Å²	96	73.8 Å²	73.8	38%	0.376	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-91.3	-2.8	177.3	-67.7	-85	0	0	0	113.1	P158 M166 P167 D168 P172	P158-Y170 HydrophobicContact CG-CE1 3.77Å; M166-Y170 VanDerWaalsContact CE-O 3.25Å; M166-Y170 WeakPolarHBondContact CE-O 3.25Å; P167-Y170 HydrophobicContact CB-CD2 4.26Å; P167-Y170 HydrophobicContact CG-CD2 4.22Å; P167-Y170 PolarHBondContact O-N 3.12Å; D168-Y170 PolarHBondContact O-N 3.38Å; Y170-P172 WeakPolarHBondContact O-CD 2.78Å
171	K	79.6	Confident	75.5	Confident	50 Å²	50	77 Å²	77	22%	0.217	36%	0.361	C	S	.	.	S	Bend	trans	-73.8	125.8	-178.1	-72.4	-179.5	-178.1	167.3	0	111.5	M166 D168 Q173	M166-K171 HydrophobicContact CE-CB 4.15Å; M166-K171 HydrophobicContact CE-CG 3.52Å; D168-K171 HydrophobicContact CB-CD 4.44Å; D168-K171 WeakPolarHBondContact O-CB 3.43Å; D168-K171 PolarHBondContact O-N 2.82Å; D168-K171 WeakPolarHBondContact OD1-CD 3.19Å; D168-K171 VanDerWaalsContact OD1-CE 3.31Å; D168-K171 WeakPolarHBondContact OD1-CE 3.29Å; D168-K171 IonicContact OD1-NZ 3.51Å; D168-K171 PolarHBondContact OD1-NZ 2.89Å; K171-Q173 PolarHBondContact O-N 3.39Å; K171-Q173 VanDerWaalsContact O-N 3.1Å
172	P	77.9	Confident	74.2	Confident	63 Å²	63	76 Å²	76	41%	0.409	36%	0.355	S	S	.	.			trans	-64.2	111.9	177.6	-22.2	33.6	0	0	0	111.6	Y170 Y174 L175	Y170-P172 WeakPolarHBondContact O-CD 2.78Å; P172-Y174 PolarHBondContact O-N 3.28Å; P172-L175 HydrophobicContact CB-CB 3.83Å; P172-L175 HydrophobicContact CG-CB 4.5Å; P172-L175 PolarHBondContact O-N 3.1Å; P172-L175 VanDerWaalsContact O-N 3.1Å
173	Q	70.8	Confident	72.5	Confident	169 Å²	169	75.4 Å²	75.4	79%	0.79	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-4.4	-173.6	-62.4	178.2	-1.5	0	0	115.9	K171	K171-Q173 PolarHBondContact O-N 3.39Å; K171-Q173 VanDerWaalsContact O-N 3.1Å
174	Y	69.1	Low	70.6	Confident	223 Å²	223	78.6 Å²	78.6	88%	0.875	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	8.2	-176.4	-55.4	-69.3	0	0	0	113.4	P172	P172-Y174 PolarHBondContact O-N 3.28Å
175	L	68.3	Low	68.9	Low	69 Å²	69	79.4 Å²	79.4	36%	0.361	39%	0.387	S	S	.	.	S	Bend	trans	-117	111.4	-178.4	-145.2	-178.9	0	0	0	109.3	P172	P172-L175 HydrophobicContact CB-CB 3.83Å; P172-L175 HydrophobicContact CG-CB 4.5Å; P172-L175 PolarHBondContact O-N 3.1Å; P172-L175 VanDerWaalsContact O-N 3.1Å
176	L	69.6	Low	66.9	Low	106 Å²	106	80.4 Å²	80.4	56%	0.555	40%	0.403	S	S	*	.			trans	-53.1	140.8	176.5	-65.9	-178.1	0	0	0	111.9	H38 D180 R181	H38-L176 PolarHBondContact NE2-O 2.68Å; L176-D180 HydrophobicContact CB-CB 3.95Å; L176-D180 HydrophobicContact CD2-CB 4.12Å; L176-D180 HydrophobicContact CG-CB 4.44Å; L176-R181 HydrophobicContact CB-CG 3.96Å; L176-R181 VanDerWaalsContact O-CZ 3.3Å; L176-R181 PolarHBondContact O-NE 3.49Å; L176-R181 PolarHBondContact O-NH2 2.85Å
177	D	72	Confident	64.9	Low	17 Å²	17	87.2 Å²	87.2	9%	0.091	43%	0.434	C	S	.	.			trans	-69.5	162.7	169.9	-66.9	-24.6	0	0	0	109.7	H38 D39 K40 E179 D180 R181	H38-D177 IonicContact CD2-OD1 2.61Å; H38-D177 PolarHBondContact CD2-OD1 2.72Å; D39-D177 WeakPolarHBondContact OD1-CA 3.31Å; K40-D177 WeakPolarHBondContact CE-OD2 3.17Å; K40-D177 VanDerWaalsContact CG-OD2 3.26Å; K40-D177 WeakPolarHBondContact CG-OD2 3.49Å; K40-D177 IonicContact NZ-OD2 2.94Å; K40-D177 PolarHBondContact NZ-OD2 2.62Å; D177-E179 VanDerWaalsContact C-N 3.29Å; D177-E179 PolarHBondContact O-N 3.24Å; D177-D180 WeakPolarHBondContact CB-OD2 3.42Å; D177-D180 PolarHBondContact N-OD2 2.85Å; D177-D180 VanDerWaalsContact N-OD2 3.13Å; D177-D180 CarbonylContact O-C 3.59Å; D177-D180 WeakPolarHBondContact O-CA 3.41Å; D177-D180 WeakPolarHBondContact O-CB 3.12Å; D177-D180 PolarHBondContact O-N 3.34Å; D177-R181 WeakPolarHBondContact O-CG 3.45Å; D177-R181 PolarHBondContact O-N 2.84Å; D177-R181 VanDerWaalsContact O-N 3.09Å
178	F	65.7	Low	62.7	Low	7 Å²	7	88.9 Å²	88.9	3%	0.031	46%	0.458	C	S	.	.	H	α-helix	trans	-55.9	-42.3	179.8	-156.2	-76.4	0	0	0	112.8	F25 P33 I35 D39 D180 R181 L182	F25-F178 HydrophobicContact CD2-CZ 4.4Å; F25-F178 HydrophobicContact CE2-CE1 4.03Å; F25-F178 HydrophobicContact CE2-CE2 4.15Å; F25-F178 AromaticContact CE2-CZ 3.5Å; F25-F178 HydrophobicContact CE2-CZ 3.5Å; F25-F178 HydrophobicContact CZ-CE2 4.15Å; F25-F178 AromaticContact CZ-CZ 3.68Å; F25-F178 HydrophobicContact CZ-CZ 3.68Å; P33-F178 HydrophobicContact CB-CD2 4.44Å; P33-F178 HydrophobicContact CB-CE2 3.69Å; P33-F178 HydrophobicContact CB-CZ 3.94Å; P33-F178 HydrophobicContact CG-CE1 4.45Å; P33-F178 HydrophobicContact CG-CE2 4.13Å; P33-F178 HydrophobicContact CG-CZ 3.88Å; P33-F178 WeakPolarHBondContact O-CE2 3.4Å; I35-F178 HydrophobicContact CB-CD2 4.36Å; I35-F178 HydrophobicContact CB-CE2 4.41Å; I35-F178 HydrophobicContact CG1-CD2 3.96Å; I35-F178 HydrophobicContact CG1-CE2 3.68Å; I35-F178 HydrophobicContact CG1-CZ 4.34Å; D39-F178 HydrophobicContact CB-CB 4Å; D39-F178 PolarHBondContact OD1-N 3.4Å; F178-D180 PolarHBondContact O-N 3.32Å; F178-R181 PolarHBondContact O-N 3.18Å; F178-R181 VanDerWaalsContact O-N 3.13Å; F178-L182 HydrophobicContact CD1-CD2 4.45Å; F178-L182 HydrophobicContact CE1-CD2 4.22Å
179	E	66.7	Low	60.5	Low	40 Å²	40	88.6 Å²	88.6	19%	0.187	46%	0.464	C	S	.	.	H	α-helix	trans	-57.1	-35.3	174.7	-70.4	173.3	144	0	0	110.8	K20 Y24 V41 D177 S185	K20-E179 WeakPolarHBondContact CE-OE1 3.4Å; K20-E179 IonicContact NZ-OE1 3.26Å; K20-E179 PolarHBondContact NZ-OE1 3.16Å; Y24-E179 HydrophobicContact CE2-CG 4.11Å; Y24-E179 PolarHBondContact OH-OE1 2.99Å; V41-E179 HydrophobicContact CG2-CG 3.67Å; V41-E179 WeakPolarHBondContact CG2-OE1 3.46Å; D177-E179 VanDerWaalsContact C-N 3.29Å; D177-E179 PolarHBondContact O-N 3.24Å; E179-S185 WeakPolarHBondContact O-CB 3.5Å
180	D	68.3	Low	58.4	Low	62 Å²	62	86.7 Å²	86.7	33%	0.332	47%	0.468	S	S	.	.	H	α-helix	trans	-83.1	-15.3	-179.5	-48.9	-36.4	0	0	0	113.4	L176 D177 F178 S185	L176-D180 HydrophobicContact CB-CB 3.95Å; L176-D180 HydrophobicContact CD2-CB 4.12Å; L176-D180 HydrophobicContact CG-CB 4.44Å; D177-D180 WeakPolarHBondContact CB-OD2 3.42Å; D177-D180 PolarHBondContact N-OD2 2.85Å; D177-D180 VanDerWaalsContact N-OD2 3.13Å; D177-D180 CarbonylContact O-C 3.59Å; D177-D180 WeakPolarHBondContact O-CA 3.41Å; D177-D180 WeakPolarHBondContact O-CB 3.12Å; D177-D180 PolarHBondContact O-N 3.34Å; F178-D180 PolarHBondContact O-N 3.32Å; D180-S185 PolarHBondContact O-OG 3.15Å
181	R	67.6	Low	56.3	Low	67 Å²	67	86.2 Å²	86.2	25%	0.253	48%	0.479	S	S	.	.	H	α-helix	trans	-84.3	-14	-178.7	-70.2	176.9	-144.1	135.1	19.1	114.5	H38 D39 L176 D177 F178	H38-R181 PolarHBondContact CE1-NH2 3.11Å; H38-R181 PolarHBondContact NE2-NH2 3.29Å; D39-R181 IonicContact OD1-CZ 2.96Å; D39-R181 IonicContact OD1-NH1 3.06Å; D39-R181 IonicContact OD1-NH2 3.12Å; D39-R181 PolarHBondContact OD1-NH2 2.7Å; D39-R181 IonicContact OD2-CZ 3.42Å; D39-R181 IonicContact OD2-NH1 3.62Å; D39-R181 PolarHBondContact OD2-NH1 2.94Å; D39-R181 IonicContact OD2-NH2 2.62Å; L176-R181 HydrophobicContact CB-CG 3.96Å; L176-R181 VanDerWaalsContact O-CZ 3.3Å; L176-R181 PolarHBondContact O-NE 3.49Å; L176-R181 PolarHBondContact O-NH2 2.85Å; D177-R181 WeakPolarHBondContact O-CG 3.45Å; D177-R181 PolarHBondContact O-N 2.84Å; D177-R181 VanDerWaalsContact O-N 3.09Å; F178-R181 PolarHBondContact O-N 3.18Å; F178-R181 VanDerWaalsContact O-N 3.13Å
182	L	59.6	Low	54	Low	13 Å²	13	91.5 Å²	91.5	7%	0.068	51%	0.509	C	S	.	.	S	Bend	trans	-73.4	146.1	-174.5	-60	179.5	0	0	0	111.6	Y24 C28 F178 S184 S185	Y24-L182 HydrophobicContact CD1-CD1 4.43Å; C28-L182 VanDerWaalsContact SG-CD2 3.54Å; F178-L182 HydrophobicContact CD1-CD2 4.45Å; F178-L182 HydrophobicContact CE1-CD2 4.22Å; L182-S184 PolarHBondContact O-N 3.43Å; L182-S185 WeakPolarHBondContact O-CB 3.21Å; L182-S185 PolarHBondContact O-N 2.29Å; L182-S185 PolarHBondContact O-OG 2.61Å
183	P	50.1	Low	51.6	Low	117 Å²	117	93.5 Å²	93.5	76%	0.76	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.3	176.7	-26.4	35.5	0	0	0	114.2
184	S	44.9	Very low	49.8	Very low	79 Å²	79	92.5 Å²	92.5	55%	0.552	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-17.4	176	47.2	0	0	0	0	114.6	L182 V186 H187	L182-S184 PolarHBondContact O-N 3.43Å; S184-V186 PolarHBondContact O-N 2.75Å; S184-H187 PolarHBondContact O-N 2.86Å
185	S	44.7	Very low	47.9	Very low	29 Å²	29	88.9 Å²	88.9	20%	0.203	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.9	-179.6	78.6	0	0	0	0	113.5	E179 D180 L182 H187	E179-S185 WeakPolarHBondContact O-CB 3.5Å; D180-S185 PolarHBondContact O-OG 3.15Å; L182-S185 WeakPolarHBondContact O-CB 3.21Å; L182-S185 PolarHBondContact O-N 2.29Å; L182-S185 PolarHBondContact O-OG 2.61Å; S185-H187 CarbonylContact O-C 3.56Å; S185-H187 PolarHBondContact O-N 3.3Å
186	V	40.3	Very low	46.1	Very low	120 Å²	120	90.3 Å²	90.3	73%	0.727	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.8	-176.7	-172.4	0	0	0	0	111.6	S184	S184-V186 PolarHBondContact O-N 2.75Å
187	H	38.4	Very low	44.2	Very low	158 Å²	158	94.8 Å²	94.8	73%	0.731	55%	0.55	S	S	*	.	S	Bend	trans	-88.6	106.1	160.5	-65.9	74.9	0	0	0	107.1	S184 S185 S189	S184-H187 PolarHBondContact O-N 2.86Å; S185-H187 CarbonylContact O-C 3.56Å; S185-H187 PolarHBondContact O-N 3.3Å; H187-S189 PolarHBondContact O-N 3.42Å
188	G	35.5	Very low	42.1	Very low	73 Å²	73	100.7 Å²	100.7	75%	0.753	58%	0.582	S	S	*	*			trans	-52.5	119.4	-164.6	0	0	0	0	0	113.1	D190	G188-D190 PolarHBondContact O-N 2.96Å
189	S	30.6	Very low	40.3	Very low	94 Å²	94	106 Å²	106	66%	0.657	62%	0.62	S	S	*	*			trans	-70.4	122	165.4	-68.5	0	0	0	0	109.2	H187 S191	H187-S189 PolarHBondContact O-N 3.42Å; S189-S191 PolarHBondContact O-N 3.4Å; S189-S191 PolarHBondContact O-OG 2.91Å
190	D	31.5	Very low	38.6	Very low	169 Å²	169	110.3 Å²	110.3	90%	0.904	65%	0.648	S	S	*	*			trans	-66.9	68.2	162.3	-93	-37.7	0	0	0	110.3	G188 L192	G188-D190 PolarHBondContact O-N 2.96Å; D190-L192 PolarHBondContact O-N 3.47Å
191	S	31.2	Very low	36.6	Very low	86 Å²	86	113.4 Å²	113.4	60%	0.601	67%	0.67	S	S	*	*			trans	-72	94.8	166.9	52.2	0	0	0	0	107.7	S189 S193	S189-S191 PolarHBondContact O-N 3.4Å; S189-S191 PolarHBondContact O-OG 2.91Å; S191-S193 PolarHBondContact O-N 3.4Å
192	L	31	Very low	34.6	Very low	161 Å²	161	116 Å²	116	84%	0.843	70%	0.698	S	S	*	*			trans	-39.5	116.2	173.1	-70.1	172.5	0	0	0	109.8	D190 L194	D190-L192 PolarHBondContact O-N 3.47Å; L192-L194 PolarHBondContact O-N 3.36Å
193	S	27.2	Very low	33.3	Very low	104 Å²	104	121.8 Å²	121.8	73%	0.727	73%	0.734	S	S	*	*			trans	-63.9	103.9	-167.6	-79.7	0	0	0	0	111.6	S191 N195	S191-S193 PolarHBondContact O-N 3.4Å; S193-N195 PolarHBondContact O-N 2.94Å
194	L	33.3	Very low	32.2	Very low	148 Å²	148	122.9 Å²	122.9	78%	0.775	73%	0.734	S	S	*	*			trans	-68.2	19.5	173.3	-78.3	166.6	0	0	0	113.9	L192 S196	L192-L194 PolarHBondContact O-N 3.36Å; L194-S196 PolarHBondContact O-N 2.76Å
195	N	30.7	Very low	31.8	Very low	148 Å²	148	126.3 Å²	126.3	79%	0.791	75%	0.745	S	S	*	*			trans	-97.4	57.6	-177.8	-73	-16.7	0	0	0	111.8	S193	S193-N195 PolarHBondContact O-N 2.94Å
196	S	28.8	Very low	31	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	77%	0.773	S	S	*	*			trans	-131.4	16.7	175.9	-166.3	0	0	0	0	115.2	L194	L194-S196 PolarHBondContact O-N 2.76Å
197	F	30.3	Very low	30.8	Very low	200 Å²	200	138.1 Å²	138.1	88%	0.877	78%	0.78	S	S	*	*			trans	-132.5	81	171.1	-79.2	-71.6	0	0	0	112.8
198	N	28.1	Very low	30.2	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	79%	0.785	S	S	*	*			trans	-151.8	58.6	161.2	-109.5	-45.5	0	0	0	111.6
199	S	27	Very low	29.8	Very low	120 Å²	120	141.2 Å²	141.2	84%	0.839	78%	0.784	S	S	*	*			trans	-107.6	92.3	167	-74.4	0	0	0	0	109.4	T201	S199-T201 PolarHBondContact O-N 3.27Å; S199-T201 VanDerWaalsContact O-N 3.09Å
200	V	31.6	Very low	29.8	Very low	129 Å²	129	141.2 Å²	141.2	78%	0.782	78%	0.784	S	S	*	*			trans	-80.3	91.5	-173.5	-176.6	0	0	0	0	111.1
201	T	26.4	Very low	29.6	Very low	127 Å²	127	136.3 Å²	136.3	78%	0.779	77%	0.767	S	S	*	*			trans	-161.8	154.9	152.3	20.6	0	0	0	0	110.1	S199	S199-T201 PolarHBondContact O-N 3.27Å; S199-T201 VanDerWaalsContact O-N 3.09Å
202	S	24.6	Very low	29.5	Very low	121 Å²	121	139.5 Å²	139.5	85%	0.846	78%	0.776	S	S	*	*			trans	70.5	97	177.8	-55.4	0	0	0	0	116	N204	S202-N204 PolarHBondContact O-N 3.4Å
203	T	33	Very low	29.3	Very low	136 Å²	136	136.3 Å²	136.3	83%	0.834	77%	0.772	S	S	*	*			trans	-58.7	126.7	156.6	47.4	0	0	0	0	111
204	N	27.2	Very low	29.5	Very low	139 Å²	139	137 Å²	137	74%	0.743	78%	0.775	S	S	*	*			trans	-153.8	138	143.5	-104	-4.1	0	0	0	109.1	S202	S202-N204 PolarHBondContact O-N 3.4Å
205	L	35.9	Very low	29.2	Very low	151 Å²	151	136.1 Å²	136.1	79%	0.791	78%	0.78	S	S	*	*			trans	-117.7	85.6	177.6	-177.7	81.2	0	0	0	106.9
206	E	28	Very low	29.2	Very low	168 Å²	168	134.4 Å²	134.4	79%	0.785	78%	0.78	S	S	*	*			trans	-123.5	136.1	177	-67.1	-175.1	134	0	0	108.9
207	W	36.6	Very low	29.5	Very low	230 Å²	230	138.7 Å²	138.7	87%	0.871	79%	0.789	S	S	*	*			trans	-101.5	123.9	-176.4	-66.2	-60	0	0	0	110.6
208	D	26.4	Very low	29.6	Very low	158 Å²	158	136.3 Å²	136.3	85%	0.845	79%	0.786	S	S	*	*			trans	-155.1	151.5	148.7	-95.6	-33.9	0	0	0	105.4
209	D	27.2	Very low	29.8	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	79%	0.794	S	S	*	*			cis	-138.8	148.5	9.3	-150.7	-36.3	0	0	0	104.2
210	S	29	Very low	30.1	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	79%	0.787	S	S	*	*			cis	-162.6	-179.4	36.2	-57.3	0	0	0	0	114.7
211	A	29	Very low	29.8	Very low	65 Å²	65	144.4 Å²	144.4	54%	0.537	79%	0.791	S	S	.	*			trans	85.6	79.5	150.7	0	0	0	0	0	119.5	M1	M1-A211 PolarHBondContact N-O 3.22Å
212	I	28	Very low	29.9	Very low	154 Å²	154	140.9 Å²	140.9	79%	0.79	78%	0.78	S	S	*	*			trans	-133.6	103.4	135.8	-55.5	-179	0	0	0	110.9
213	A	27.3	Very low	30.2	Very low	93 Å²	93	142.9 Å²	142.9	77%	0.769	78%	0.781	S	S	*	*			trans	-163.7	124.5	136	0	0	0	0	0	108.5
214	P	30.6	Very low	30	Very low	120 Å²	120	142.4 Å²	142.4	78%	0.779	78%	0.778	S	S	*	*			trans	-86.1	148.9	175.9	34.2	-33.4	0	0	0	111.7
215	S	27.2	Very low	29.8	Very low	128 Å²	128	145.1 Å²	145.1	90%	0.895	78%	0.783	S	S	*	*			trans	-90.2	124.2	163.9	52.3	0	0	0	0	110.3
216	S	31.6	Very low	30.6	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	78%	0.781	S	S	*	*			trans	-130	137	169.7	59.4	0	0	0	0	109.5
217	E	34.5	Very low	30.5	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	78%	0.783	S	S	*	*			trans	-78.6	158.4	-174.8	-63.1	173.3	125.1	0	0	113.2
218	D	33.3	Very low	30.1	Very low	150 Å²	150	136 Å²	136	80%	0.802	78%	0.783	S	S	*	*			trans	52.2	119	164.8	-65.4	-11.9	0	0	0	121.1
219	Y	30.4	Very low	31.2	Very low	234 Å²	234	133.9 Å²	133.9	92%	0.918	78%	0.777	S	S	*	*				-162.1	145.7	103.4	-118	-83.3	0	0	0	112.8
220	D	33.8	Very low	31.1	Very low	131 Å²	131	133 Å²	133	70%	0.701	78%	0.782	S	S	*	*			trans	-87.2	132.7	178.4	164.2	46.8	0	0	0	112.9
221	F	26.3	Very low	31.1	Very low	196 Å²	196	135.1 Å²	135.1	86%	0.86	79%	0.79	S	S	*	*			trans	-168.6	129.7	130.8	-141	-107	0	0	0	114.7
222	G	29	Very low	32.4	Very low	53 Å²	53	137.4 Å²	137.4	55%	0.546	80%	0.8	S	S	.	*				80.6	92.4	129.6	0	0	0	0	0	122.4
223	D	30.4	Very low	32.3	Very low	163 Å²	163	136.1 Å²	136.1	87%	0.872	80%	0.804	S	S	*	*				82.3	144.5	118.5	-118.5	-20.4	0	0	0	124.3
224	V	28.2	Very low	32.7	Very low	126 Å²	126	137.4 Å²	137.4	76%	0.764	80%	0.803	S	S	*	*			trans	77.4	99.6	157.5	-176.1	0	0	0	0	121.8
225	F	24	Very low	32.7	Very low	196 Å²	196	137.3 Å²	137.3	86%	0.86	80%	0.796	S	S	*	*			trans	-67.7	-179.3	152.4	-80.1	-80.2	0	0	0	113.7
226	P	52.3	Low	32.8	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	79%	0.792	S	S	*	*			cis	-135.1	176.1	-31.3	35.4	-19	0	0	0	113.6
227	A	25.9	Very low	32.8	Very low	100 Å²	100	143.2 Å²	143.2	83%	0.826	79%	0.788	S	S	*	*			trans	-169.6	144.5	136.3	0	0	0	0	0	114.2
228	V	26.9	Very low	32.7	Very low	142 Å²	142	142 Å²	142	86%	0.861	79%	0.787	S	S	*	*			trans	-141.2	173.3	166.4	-110.9	0	0	0	0	106.9
229	P	49.5	Very low	32.5	Very low	113 Å²	113	138.3 Å²	138.3	73%	0.734	79%	0.785	S	S	*	*			cis	-131	178.4	-26.6	38.7	-24.3	0	0	0	112.1
230	S	26.1	Very low	32.4	Very low	118 Å²	118	134.2 Å²	134.2	83%	0.825	78%	0.779	S	S	*	*			trans	-170.1	156.3	148.4	42.7	0	0	0	0	113.3
231	V	29.3	Very low	32.3	Very low	139 Å²	139	134.4 Å²	134.4	84%	0.842	78%	0.779	S	S	*	*			trans	-129.4	-171.7	177.1	-145.6	0	0	0	0	109.4
232	P	55.4	Low	32.6	Very low	113 Å²	113	130.8 Å²	130.8	73%	0.734	77%	0.773	S	S	*	*				-96.7	176.9	-122.3	42.5	-29.8	0	0	0	115.5
233	S	26.5	Very low	32.6	Very low	127 Å²	127	135 Å²	135	89%	0.888	78%	0.783	S	S	*	*			trans	-163.4	172	154.3	-84.3	0	0	0	0	113.6
234	T	35.3	Very low	32.5	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	77%	0.774	S	S	*	*			trans	-111.5	-162.5	-148.4	-30.8	0	0	0	0	114
235	D	30.9	Very low	32.4	Very low	118 Å²	118	133.5 Å²	133.5	63%	0.631	77%	0.773	S	S	*	*			trans	84.4	147.7	161.7	-44.2	-35	0	0	0	115.7
236	W	29.3	Very low	32.6	Very low	213 Å²	213	129.3 Å²	129.3	81%	0.807	77%	0.768	S	S	*	*			cis	-151.5	170.8	23.4	-62	76.2	0	0	0	109.2
237	E	31.7	Very low	31.3	Very low	152 Å²	152	127 Å²	127	71%	0.71	77%	0.766	S	S	*	*			cis	-174	155	-22.8	176.3	168.8	-118.4	0	0	108.1
238	D	31.3	Very low	32.2	Very low	161 Å²	161	127.5 Å²	127.5	86%	0.861	76%	0.76	S	S	*	*			trans	60.4	157.1	176.3	-88.3	-17.5	0	0	0	119.4
239	G	29.8	Very low	32.2	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	76%	0.76	S	S	*	*			cis	161.8	166.7	0.4	0	0	0	0	0	109.1
240	D	29	Very low	31.3	Very low	149 Å²	149	130.4 Å²	130.4	80%	0.797	76%	0.755	S	S	*	*			cis	-166.6	-177.3	-8.9	-178.9	29.5	0	0	0	108.7
241	L	31.8	Very low	31.2	Very low	135 Å²	135	131.5 Å²	131.5	71%	0.707	76%	0.757	S	S	*	*			trans	91.3	115.1	158.3	-68.4	166	0	0	0	122.5
242	T	32.9	Very low	31	Very low	119 Å²	119	128.7 Å²	128.7	73%	0.73	75%	0.749	S	S	*	*			trans	71.5	120.8	152.5	58.3	0	0	0	0	118.8
243	D	28.4	Very low	29.7	Very low	142 Å²	142	128.4 Å²	128.4	76%	0.759	75%	0.749	S	S	*	*				72.5	133.7	58.7	-74.8	-23.6	0	0	0	113.5
244	T	28.1	Very low	29.7	Very low	110 Å²	110	129.2 Å²	129.2	68%	0.675	74%	0.744	S	S	*	*			cis	-162.2	167.1	10.7	8.2	0	0	0	0	114.2
245	I	26.5	Very low	29.4	Very low	147 Å²	147	130.3 Å²	130.3	75%	0.754	74%	0.744	S	S	*	*			trans	48.5	137	163	-0.4	84.7	0	0	0	123.5
246	S	27	Very low	29.2	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	75%	0.748	S	S	*	*			trans	101.6	107.3	140.6	-53.3	0	0	0	0	120.3
247	G	24.9	Very low	29	Very low	68 Å²	68	125 Å²	125	70%	0.701	74%	0.744	S	S	*	*				-89.9	-154.9	129.3	0	0	0	0	0	110
248	P	46.2	Very low	28.7	Very low	110 Å²	110	122.6 Å²	122.6	71%	0.714	74%	0.744	S	S	*	*			cis	-137.3	-162.3	0.1	32.4	-8.4	0	0	0	113.1
249	R	26.4	Very low	28.6	Very low	227 Å²	227	124.2 Å²	124.2	86%	0.857	74%	0.743	S	S	*	*			trans	77.1	159.7	161.5	-60	173.8	-173.8	-173.5	2	117.3
250	S	30.3	Very low	28.4	Very low	90 Å²	90	127.3 Å²	127.3	63%	0.629	75%	0.748	S	S	*	*			cis	-179.7	161.3	-29.7	-86.8	0	0	0	0	107.8
251	T	24.6	Very low	28.2	Very low	141 Å²	141	125 Å²	125	87%	0.865	74%	0.743	S	S	*	*			trans	63.8	151	153.7	49.6	0	0	0	0	118.4
252	A	25.3	Very low	27.8	Very low	80 Å²	80	125.2 Å²	125.2	66%	0.661	75%	0.751	S	S	*	*			cis	-169.7	-174.8	-17.3	0	0	0	0	0	108.7
253	S	28.5	Very low	27.5	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	76%	0.758	S	S	*	*			trans	65.2	135.8	163.8	60.4	0	0	0	0	118.5
254	D	26.6	Very low	27.7	Very low	145 Å²	145	127.7 Å²	127.7	78%	0.775	76%	0.758	S	S	*	*			cis	135.4	145.5	-6.4	-97.3	-47.7	0	0	0	110.1
255	L	28.3	Very low	28.1	Very low	143 Å²	143	127.6 Å²	127.6	75%	0.749	76%	0.759	S	S	*	*			trans	70.7	112.4	151.5	-67.1	163.5	0	0	0	121.3
256	T	25.8	Very low	28.1	Very low	116 Å²	116	126 Å²	126	71%	0.712	76%	0.757	S	S	*	*				89.5	120.7	124.4	55.3	0	0	0	0	123.5
257	S	25.3	Very low	28.2	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	76%	0.76	S	S	*	*				99.6	141.8	118.6	77.6	0	0	0	0	123
258	S	26.8	Very low	28.2	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	77%	0.767	S	S	*	*			trans	61.3	98	153.6	24.8	0	0	0	0	120.9
259	K	27.3	Very low	27.2	Very low	196 Å²	196	138.9 Å²	138.9	85%	0.852	77%	0.767	S	S	*	*				24.8	118	121.8	-56.2	176.7	179.4	178.7	0	117.4
260	T	25.6	Very low	27.4	Very low	137 Å²	137	135 Å²	135	84%	0.84	76%	0.763	S	S	*	*				175.9	139.2	98	31.9	0	0	0	0	114.7
261	S	24.9	Very low	28.2	Very low	100 Å²	100	135 Å²	135	70%	0.699	76%	0.762	S	S	*	*			trans	21.7	118.3	141.8	-171.7	0	0	0	0	120.7
262	T	24.9	Very low	28.2	Very low	140 Å²	140	136.6 Å²	136.6	86%	0.859	76%	0.757	S	S	*	*				-171.8	172.4	105.1	21.6	0	0	0	0	114.3
263	K	26.4	Very low	28.4	Very low	203 Å²	203	138.2 Å²	138.2	88%	0.883	76%	0.755	S	S	*	*			trans	-64.6	159.9	-167.5	-62.3	166.8	176.1	175.9	0	116.8
264	S	31.3	Very low	28.6	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	76%	0.755	S	S	*	*			trans	-41.1	166.5	161.3	-15.4	0	0	0	0	115.5
265	P	38.3	Very low	28.7	Very low	107 Å²	107	141 Å²	141	70%	0.695	75%	0.751	S	S	*	*				-160.9	168.7	69.9	43.8	-22.2	0	0	0	121.3
266	T	26.1	Very low	28.6	Very low	115 Å²	115	142 Å²	142	71%	0.706	75%	0.752	S	S	*	*			trans	58.9	117	143	48.9	0	0	0	0	125.1
267	Q	28.1	Very low	28.8	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	75%	0.754	S	S	*	*				50	131.8	118.9	-64.9	-177.4	-16.6	0	0	123.4
268	R	25.8	Very low	28.9	Very low	220 Å²	220	143.9 Å²	143.9	83%	0.83	76%	0.757	S	S	*	*				-176.5	160.7	121.4	-95.2	168	-167.9	-144.6	3	107.7
269	H	24.3	Very low	28.9	Very low	158 Å²	158	145.4 Å²	145.4	73%	0.731	76%	0.762	S	S	*	*			cis	-154.4	169	9.1	-138.1	10.1	0	0	0	110.9
270	N	32	Very low	28.8	Very low	145 Å²	145	140.6 Å²	140.6	78%	0.775	76%	0.758	S	S	*	*			trans	-157.2	137.3	167	-175	11.4	0	0	0	108.1
271	P	46.1	Very low	28.7	Very low	91 Å²	91	139 Å²	139	59%	0.591	75%	0.753	S	S	*	*				-155.7	172.3	127.3	36.6	-17.4	0	0	0	118.6
272	F	23.9	Very low	28.8	Very low	174 Å²	174	139.3 Å²	139.3	76%	0.763	76%	0.755	S	S	*	*			trans	114.5	98	163.9	-79.5	-88.4	0	0	0	113.7
273	N	31.1	Very low	28.8	Very low	115 Å²	115	139.7 Å²	139.7	62%	0.615	75%	0.752	S	S	*	*				88.3	148.7	80.9	-84.5	26.2	0	0	0	112
274	E	30.8	Very low	28.8	Very low	160 Å²	160	136.8 Å²	136.8	75%	0.748	75%	0.752	S	S	*	*			cis	-163.1	157.2	2.2	-109.9	158.1	125.6	0	0	106.4
275	E	30.1	Very low	28.5	Very low	148 Å²	148	137.8 Å²	137.8	69%	0.692	75%	0.753	S	S	*	*			cis	-163.4	-175.7	-12.3	-148.5	-158.2	-168.1	0	0	109.3
276	Q	26.8	Very low	28.7	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	76%	0.755	S	S	*	*			trans	69.2	127.4	163	-67.6	155.7	41.1	0	0	118.6
277	A	28.8	Very low	28.7	Very low	90 Å²	90	138 Å²	138	74%	0.744	75%	0.754	S	S	*	*			cis	115.4	155.4	21.3	0	0	0	0	0	110.9
278	E	27.3	Very low	28.6	Very low	170 Å²	170	138.3 Å²	138.3	79%	0.794	76%	0.755	S	S	*	*			cis	-146.2	156.8	23.8	-67.8	-176.8	120.4	0	0	114.6
279	T	26.2	Very low	28.6	Very low	133 Å²	133	132.9 Å²	132.9	82%	0.816	75%	0.746	S	S	*	*			trans	61.5	151.3	149.3	52.4	0	0	0	0	120.9
280	A	25.6	Very low	28.5	Very low	94 Å²	94	131.8 Å²	131.8	78%	0.777	75%	0.751	S	S	*	*			cis	-174	167.9	-10.2	0	0	0	0	0	106.4
281	S	23.7	Very low	28.1	Very low	104 Å²	104	130 Å²	130	73%	0.727	75%	0.75	S	S	*	*			cis	170.4	121.4	-9.1	167.3	0	0	0	0	107.4
282	S	28	Very low	27.1	Very low	107 Å²	107	133 Å²	133	75%	0.748	76%	0.756	S	S	*	*			trans	62.2	137.6	147.5	-55.4	0	0	0	0	124.6
283	D	24.6	Very low	27.1	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	75%	0.753	S	S	*	*			trans	19	125.3	145.8	-58.2	-31.5	0	0	0	121.8
284	T	26	Very low	26.9	Very low	143 Å²	143	132.9 Å²	132.9	88%	0.877	75%	0.752	S	S	*	*				175.9	154	104.5	29.1	0	0	0	0	113.7
285	T	25.9	Very low	26.7	Very low	131 Å²	131	132.2 Å²	132.2	80%	0.804	75%	0.749	S	S	*	*			trans	-111.9	167.7	153.1	56.4	0	0	0	0	107.9
286	P	41.6	Very low	26.7	Very low	113 Å²	113	132.1 Å²	132.1	73%	0.734	75%	0.749	S	S	*	*			cis	-135.7	-179.8	10.8	43.3	-25.8	0	0	0	116.3
287	V	26.3	Very low	26.7	Very low	113 Å²	113	128 Å²	128	69%	0.685	74%	0.743	S	S	*	*			trans	25.9	122.7	145.8	178	0	0	0	0	119.5
288	H	26.7	Very low	26.6	Very low	184 Å²	184	130.9 Å²	130.9	85%	0.852	74%	0.741	S	S	*	*				-161	173.7	124.1	-104.8	-61.6	0	0	0	112.7
289	T	24.3	Very low	26.6	Very low	105 Å²	105	126.8 Å²	126.8	64%	0.644	74%	0.736	S	S	*	*			trans	-116.6	161.5	-158.6	47.3	0	0	0	0	114.5
290	T	22.5	Very low	27.5	Very low	135 Å²	135	126.2 Å²	126.2	83%	0.828	73%	0.734	S	S	*	*			trans	66.8	151.4	159.5	45.7	0	0	0	0	117
291	S	23.8	Very low	27.3	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	74%	0.739	S	S	*	*			cis	-156	-169.2	15	42.7	0	0	0	0	112.7
292	Q	24.5	Very low	27.4	Very low	156 Å²	156	132.9 Å²	132.9	73%	0.729	74%	0.743	S	S	*	*			trans	89.3	120.9	172.6	-52.2	-149.9	-84.7	0	0	115.5
293	E	24.7	Very low	28.2	Very low	150 Å²	150	132.4 Å²	132.4	70%	0.701	74%	0.738	S	S	*	*			cis	86.2	145.1	48.8	-70.2	-178.7	138.3	0	0	112.6
294	K	27.3	Very low	28.2	Very low	136 Å²	136	133 Å²	133	59%	0.591	74%	0.741	S	S	*	*			cis	-162.4	159.9	25	-146.3	158.1	161.5	-96.6	0	114.5
295	E	27.1	Very low	28.2	Very low	145 Å²	145	131.4 Å²	131.4	68%	0.678	74%	0.742	S	S	*	*			trans	61.5	143	153.6	-86.2	149.8	172.7	0	0	120.6
296	E	28.2	Very low	28.1	Very low	147 Å²	147	130.9 Å²	130.9	69%	0.687	74%	0.742	S	S	*	*			cis	-156	-168.6	-13.5	-142.6	-156.2	139.6	0	0	106.9	Q298	E296-Q298 WeakPolarHBondContact OE1-CG 3.33Å; E296-Q298 PolarHBondContact OE1-NE2 3.45Å
297	A	28.7	Very low	27.4	Very low	78 Å²	78	131.2 Å²	131.2	65%	0.645	74%	0.742	S	S	*	*			cis	-165	169	4.5	0	0	0	0	0	106.1
298	Q	25.1	Very low	27.4	Very low	150 Å²	150	133.6 Å²	133.6	70%	0.701	75%	0.746	S	S	*	*			cis	-159.4	141.6	-19.2	-101.1	171.7	35.9	0	0	104.3	E296	E296-Q298 WeakPolarHBondContact OE1-CG 3.33Å; E296-Q298 PolarHBondContact OE1-NE2 3.45Å
299	A	27.2	Very low	27.4	Very low	85 Å²	85	131 Å²	131	70%	0.702	74%	0.738	S	S	*	*				71.4	148.7	66.7	0	0	0	0	0	115.2
300	P	45.5	Very low	27.6	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	74%	0.743	S	S	*	*			cis	-141.5	173.4	-46.9	40.6	-26.4	0	0	0	113.7
301	D	22.6	Very low	27.9	Very low	164 Å²	164	133 Å²	133	88%	0.877	74%	0.738	S	S	*	*			trans	-165.4	179.9	143.4	-127.4	-31.3	0	0	0	115.2
302	Q	24.4	Very low	28.3	Very low	174 Å²	174	133.4 Å²	133.4	81%	0.813	73%	0.731	S	S	*	*			trans	-102.5	-142.4	-168.3	-61.9	-173.5	-0.2	0	0	116.3
303	P	44.9	Very low	28.5	Very low	97 Å²	97	135.7 Å²	135.7	63%	0.63	73%	0.733	S	S	*	*				-127.5	-165.4	-101.8	41.9	-24.1	0	0	0	116.1
304	D	24.4	Very low	28.8	Very low	161 Å²	161	134.1 Å²	134.1	86%	0.861	73%	0.734	S	S	*	*			trans	69	130.6	157.9	-68.5	-29.4	0	0	0	121.7
305	A	25.9	Very low	28.7	Very low	108 Å²	108	132.6 Å²	132.6	89%	0.893	74%	0.736	S	S	*	*			trans	-159.4	143.6	142.9	0	0	0	0	0	111
306	C	24	Very low	28.8	Very low	120 Å²	120	134.6 Å²	134.6	81%	0.811	74%	0.742	S	S	*	*			trans	-147.4	140.5	179.4	178.8	0	0	0	0	110.5
307	T	27.1	Very low	28.9	Very low	120 Å²	120	136.6 Å²	136.6	74%	0.736	75%	0.749	S	S	*	*			trans	-169.5	128.9	159.5	21.8	0	0	0	0	107.4
308	E	25.9	Very low	29	Very low	163 Å²	163	141.2 Å²	141.2	76%	0.762	75%	0.754	S	S	*	*				75.5	150.3	72.1	-73	-160	132.3	0	0	115.6
309	L	27.9	Very low	29.4	Very low	130 Å²	130	142.7 Å²	142.7	68%	0.681	76%	0.758	S	S	*	*			cis	-174.4	158.8	-40	-114.3	-172.6	0	0	0	108.1
310	E	27.4	Very low	29.5	Very low	159 Å²	159	145.1 Å²	145.1	74%	0.743	76%	0.758	S	S	*	*			trans	61.2	160	152.5	-69.3	-159.7	-177.4	0	0	122.2
311	V	29	Very low	28.8	Very low	122 Å²	122	142.5 Å²	142.5	74%	0.739	75%	0.753	S	S	*	*			cis	-175.5	-158.9	-44.4	135.1	0	0	0	0	106.8
312	I	31.8	Very low	29.2	Very low	116 Å²	116	143.1 Å²	143.1	60%	0.595	75%	0.748	S	S	*	*			trans	83.2	124.5	165.3	-59.5	-171.7	0	0	0	115.5
313	R	29.8	Very low	29.4	Very low	204 Å²	204	144.1 Å²	144.1	77%	0.77	75%	0.75	S	S	*	*			cis	-168.1	163.3	0.3	-116.7	-179.7	-151.8	136	3.9	113.6
314	V	30.1	Very low	28.7	Very low	118 Å²	118	147.8 Å²	147.8	72%	0.715	76%	0.756	S	S	*	*			trans	73.4	136	142.3	164.6	0	0	0	0	119.5
315	T	25.5	Very low	28.8	Very low	103 Å²	103	148.5 Å²	148.5	63%	0.632	75%	0.751	S	S	*	*			cis	-163.5	155.2	-14.7	31	0	0	0	0	114.4
316	K	28.5	Very low	28.8	Very low	188 Å²	188	147.8 Å²	147.8	82%	0.817	74%	0.736	S	S	*	*			trans	54.2	131.7	144	-67.8	169.8	177.3	169.2	0	118.8
317	K	30.4	Very low	28.9	Very low	188 Å²	188	150.4 Å²	150.4	82%	0.817	73%	0.733	S	S	*	*				170.9	132.2	50.7	-142.6	-171.3	179.6	176.9	0	112.4
318	K	31.8	Very low	28.9	Very low	176 Å²	176	151.1 Å²	151.1	77%	0.765	73%	0.732	S	S	*	*			trans	63.7	117.2	139.1	-154.7	-166.1	-175.1	-166.2	0	123.5
319	K	33.6	Very low	28.9	Very low	181 Å²	181	149.8 Å²	149.8	79%	0.787	73%	0.73	S	S	*	*			trans	36.8	146.6	138.2	-58.6	-178.3	167.1	-173.9	0	120.6
320	I	28.8	Very low	29	Very low	135 Å²	135	151.9 Å²	151.9	69%	0.692	74%	0.736	S	S	*	*			cis	-147.1	153.1	10.8	-149.2	60.2	0	0	0	105.7
321	G	30.8	Very low	28.9	Very low	66 Å²	66	151.4 Å²	151.4	68%	0.68	74%	0.739	S	S	*	*			cis	110.7	146.5	30.9	0	0	0	0	0	108.7
322	K	31.5	Very low	28.7	Very low	176 Å²	176	149.6 Å²	149.6	77%	0.765	74%	0.737	S	S	*	*			cis	-147	134.2	17.8	-70.7	172.4	178.7	168.5	0	109.9
323	K	29.2	Very low	28.4	Very low	196 Å²	196	149.6 Å²	149.6	85%	0.852	75%	0.747	S	S	*	*				72.4	151.8	109	-68.2	-172.4	169.5	-168.1	0	116.9
324	K	29	Very low	29.1	Very low	173 Å²	173	145.2 Å²	145.2	75%	0.752	75%	0.745	S	S	*	*			cis	178.8	117.5	-19.5	-177.1	-153.8	173.8	-159.2	0	104.3
325	K	26.8	Very low	28.7	Very low	177 Å²	177	146 Å²	146	77%	0.77	75%	0.745	S	S	*	*				74.4	127.5	62.8	-148.1	-162.6	178.3	175.7	0	116.6
326	T	25.9	Very low	28.5	Very low	92 Å²	92	149.1 Å²	149.1	56%	0.564	75%	0.752	S	S	*	*			trans	79.9	113.1	148.5	26.8	0	0	0	0	122.8
327	K	26.5	Very low	28.7	Very low	175 Å²	175	145.1 Å²	145.1	76%	0.761	75%	0.745	S	S	*	*				75.9	139.4	110.8	-97.8	-167.1	165.2	-160.7	0	123.9
328	L	26.1	Very low	28.2	Very low	136 Å²	136	141.9 Å²	141.9	71%	0.712	74%	0.741	S	S	*	*			trans	66.9	165.6	147.2	-64.1	165	0	0	0	118.9
329	D	25.4	Very low	27.7	Very low	134 Å²	134	138.1 Å²	138.1	72%	0.717	74%	0.737	S	S	*	*				-173	166	-54.8	-132.8	-42.8	0	0	0	109.2
330	E	30.5	Very low	27.5	Very low	174 Å²	174	134.5 Å²	134.5	81%	0.813	73%	0.734	S	S	*	*			trans	60.6	152.3	173.9	-62.4	-177.5	117.8	0	0	115.8
331	D	26.4	Very low	27.4	Very low	149 Å²	149	135 Å²	135	80%	0.797	73%	0.734	S	S	*	*			cis	-147.5	172.1	4.6	-163.1	7.5	0	0	0	111.8
332	A	24.5	Very low	27.1	Very low	85 Å²	85	140.8 Å²	140.8	70%	0.702	74%	0.743	S	S	*	*			trans	79.8	130.5	159.7	0	0	0	0	0	120.1
333	S	25.9	Very low	26.7	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	74%	0.739	S	S	*	*			trans	-117.6	-171.9	174.5	-66.7	0	0	0	0	108.8
334	P	43.8	Very low	26.4	Very low	111 Å²	111	136.5 Å²	136.5	72%	0.721	74%	0.739	S	S	*	*			cis	-145.6	-173.4	8	44	-23.4	0	0	0	117.9
335	L	22.3	Very low	26	Very low	135 Å²	135	131.3 Å²	131.3	71%	0.707	74%	0.735	S	S	*	*			trans	76.4	108.5	158	-61.2	-178.9	0	0	0	121.5
336	H	21.5	Very low	25.9	Very low	169 Å²	169	132 Å²	132	78%	0.782	74%	0.741	S	S	*	*			trans	68	160.9	145.5	-59.8	-49.7	0	0	0	119.6
337	P	31.3	Very low	25.9	Very low	103 Å²	103	137.5 Å²	137.5	67%	0.669	76%	0.76	S	S	*	*			cis	-131.3	-178.9	-20.8	30.8	-9.4	0	0	0	114.4
338	T	20.3	Very low	25.8	Very low	120 Å²	120	132.3 Å²	132.3	74%	0.736	76%	0.756	S	S	*	*			trans	49.7	126.6	145.5	50.5	0	0	0	0	123.4
339	S	22.1	Very low	25.8	Very low	98 Å²	98	135.4 Å²	135.4	69%	0.685	77%	0.767	S	S	*	*				67.4	121.1	128.9	74.8	0	0	0	0	122.3
340	S	29.6	Very low	26	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	77%	0.769	S	S	*	*			trans	15.5	114.6	134	61.3	0	0	0	0	120.4
341	Q	25.8	Very low	25.9	Very low	144 Å²	144	131.9 Å²	131.9	67%	0.673	77%	0.771	S	S	*	*			trans	-170.1	123.7	130.1	-119.4	177.5	83.1	0	0	114.3
342	Q	24.7	Very low	25.8	Very low	188 Å²	188	127.4 Å²	127.4	88%	0.879	76%	0.76	S	S	*	*				-167.5	105.3	126.7	-104.3	171.1	-52.6	0	0	106.6
343	K	23.4	Very low	26.1	Very low	155 Å²	155	131.2 Å²	131.2	67%	0.674	77%	0.768	S	S	*	*				59.2	111.7	81	-75.1	176.9	166.8	155.4	0	111.7
344	C	21.5	Very low	26.1	Very low	127 Å²	127	132.2 Å²	132.2	86%	0.858	77%	0.769	S	S	*	*				69.8	128.2	68.1	-176.3	0	0	0	0	111.7
345	G	21.9	Very low	25.2	Very low	65 Å²	65	129.5 Å²	129.5	67%	0.67	76%	0.76	S	S	*	*			cis	162.4	178.2	-1.7	0	0	0	0	0	111.8
346	Q	24.2	Very low	25.3	Very low	192 Å²	192	130 Å²	130	90%	0.897	77%	0.769	S	S	*	*			trans	58.4	107.9	171.3	-66.4	-176	-31.1	0	0	119.3
347	Q	25.1	Very low	26.1	Very low	207 Å²	207	127.8 Å²	127.8	97%	0.967	77%	0.77	S	S	*	*			trans	163.4	146.7	141.2	-94.6	174.2	-19.3	0	0	108.3
348	G	26.4	Very low	25.8	Very low	66 Å²	66	126.1 Å²	126.1	68%	0.68	77%	0.772	S	S	*	*			cis	-168.9	-175.3	-2.6	0	0	0	0	0	110.7
349	E	25.5	Very low	26.2	Very low	200 Å²	200	129.1 Å²	129.1	94%	0.935	78%	0.782	S	S	*	*			trans	-56.7	145.8	176.9	-60	120	122.1	0	0	112.3
350	G	29	Very low	26.3	Very low	73 Å²	73	128.9 Å²	128.9	75%	0.753	79%	0.786	S	S	*	*				114.1	165.4	71.7	0	0	0	0	0	108.3
351	D	28.8	Very low	26	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	80%	0.795	S	S	*	*			cis	-159.6	156.3	-6.4	-163.9	39.7	0	0	0	106
352	G	24.6	Very low	26.2	Very low	54 Å²	54	135.5 Å²	135.5	56%	0.557	80%	0.799	S	S	*	*			cis	172.9	-153.3	5.4	0	0	0	0	0	111.3
353	L	30.8	Very low	27	Very low	165 Å²	165	131.8 Å²	131.8	86%	0.864	79%	0.792	S	S	*	*			trans	65	128.3	163.5	-61.4	165.3	0	0	0	116.2
354	V	26.2	Very low	26.9	Very low	138 Å²	138	128.8 Å²	128.8	84%	0.836	79%	0.791	S	S	*	*			cis	-147.5	150.1	-1.5	-176.1	0	0	0	0	105.6
355	G	23.3	Very low	26.9	Very low	53 Å²	53	129.8 Å²	129.8	55%	0.546	79%	0.787	S	S	.	*			cis	158.4	124.7	-3.5	0	0	0	0	0	109.8
356	T	25.4	Very low	27	Very low	145 Å²	145	132.8 Å²	132.8	89%	0.89	79%	0.793	S	S	*	*			trans	21.7	156.2	144.7	31.9	0	0	0	0	122.7
357	P	37.3	Very low	26.9	Very low	124 Å²	124	129.4 Å²	129.4	81%	0.805	79%	0.785	S	S	*	*			cis	-129.3	178	5.4	40.7	-25.1	0	0	0	114.7
358	G	25.3	Very low	26.9	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	78%	0.781	S	S	*	*			trans	-140.5	168.9	157.2	0	0	0	0	0	110.2
359	L	28.2	Very low	26.8	Very low	183 Å²	183	128.3 Å²	128.3	96%	0.958	78%	0.781	S	S	*	*			trans	-156.9	169.8	157.8	-137.2	75	0	0	0	109.9
360	A	25.1	Very low	26.8	Very low	92 Å²	92	123.1 Å²	123.1	76%	0.76	77%	0.766	S	S	*	*			trans	-102.9	-174.9	-170.8	0	0	0	0	0	113.4
361	R	23.2	Very low	26.8	Very low	243 Å²	243	126 Å²	126	92%	0.917	77%	0.772	S	S	*	*			trans	97.8	133.3	159.1	-148	-173.7	-147.8	160.3	3.8	116.2
362	D	30	Very low	26.6	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	77%	0.766	S	S	*	*			trans	-58.6	165.9	161.1	-50.7	-77.3	0	0	0	111.4
363	P	41.1	Very low	26.6	Very low	111 Å²	111	131.1 Å²	131.1	72%	0.721	78%	0.776	S	S	*	*			cis	-144.4	-164.7	18.5	41.4	-19.7	0	0	0	116.5
364	S	21.4	Very low	26.4	Very low	92 Å²	92	131 Å²	131	64%	0.643	77%	0.771	S	S	*	*			trans	71.5	126.5	148.1	56.8	0	0	0	0	122.1
365	D	22	Very low	26.3	Very low	148 Å²	148	127.6 Å²	127.6	79%	0.791	76%	0.764	S	S	*	*			trans	51.1	126.7	140.8	-52.6	-30.1	0	0	0	122.4
366	T	23	Very low	26.5	Very low	127 Å²	127	135.1 Å²	135.1	78%	0.779	79%	0.785	S	S	*	*				-178.8	112.6	100.9	-70	0	0	0	0	113.2
367	V	22.7	Very low	26.5	Very low	122 Å²	122	132 Å²	132	74%	0.739	78%	0.782	S	S	*	*			trans	25.9	124.8	140.5	-168.2	0	0	0	0	120.9
368	L	25.8	Very low	25.9	Very low	167 Å²	167	134.2 Å²	134.2	87%	0.874	79%	0.786	S	S	*	*				167	137.5	127.4	-88.6	168	0	0	0	108.8
369	A	23.8	Very low	25.9	Very low	83 Å²	83	136.9 Å²	136.9	69%	0.686	79%	0.794	S	S	*	*			cis	-153.1	147.9	-9.1	0	0	0	0	0	110.2
370	S	24.9	Very low	25.8	Very low	90 Å²	90	133 Å²	133	63%	0.629	78%	0.782	S	S	*	*			trans	-88.7	165.3	162.5	55.2	0	0	0	0	110.8
371	P	29.3	Very low	25.8	Very low	134 Å²	134	135.2 Å²	135.2	87%	0.87	79%	0.786	S	S	*	*				-109.8	123.4	127.1	-14.1	31.2	0	0	0	111.5
372	Q	25	Very low	25.8	Very low	158 Å²	158	128.7 Å²	128.7	74%	0.738	79%	0.785	S	S	*	*			trans	-82.2	156.1	154.7	-62.9	163.8	-99.8	0	0	108.5
373	E	25.6	Very low	25.5	Very low	166 Å²	166	125.6 Å²	125.6	78%	0.776	79%	0.787	S	S	*	*				-130.8	113.6	121.8	-68.9	-151.8	115.6	0	0	107.8
374	Q	25.3	Very low	24.8	Very low	161 Å²	161	125.9 Å²	125.9	75%	0.752	79%	0.792	S	S	*	*				81.3	120.6	103.1	-66.1	-169	55.5	0	0	113.3
375	G	25.6	Very low	24.9	Very low	67 Å²	67	126.7 Å²	126.7	69%	0.691	80%	0.798	S	S	*	*			cis	179.4	156.8	-5.8	0	0	0	0	0	114.8
376	E	26.5	Very low	25.1	Very low	211 Å²	211	128 Å²	128	99%	0.986	80%	0.799	S	S	*	*			trans	47.8	130.3	150.4	-52.3	-168.6	139.3	0	0	122.5
377	G	25.4	Very low	25.2	Very low	81 Å²	81	129.4 Å²	129.4	84%	0.835	80%	0.801	S	S	*	*			trans	170.2	111.7	165.5	0	0	0	0	0	112.7
378	L	24.8	Very low	25.4	Very low	169 Å²	169	129 Å²	129	89%	0.885	80%	0.803	S	S	*	*			trans	-113.1	158	-170.3	-89.3	166.3	0	0	0	114.6
379	S	26.1	Very low	25.3	Very low	124 Å²	124	129.7 Å²	129.7	87%	0.867	80%	0.802	S	S	*	*			trans	81.8	157.5	154	78.7	0	0	0	0	119.5
380	S	25.8	Very low	25.3	Very low	102 Å²	102	133.6 Å²	133.6	71%	0.713	81%	0.81	S	S	*	*			trans	-118.3	135.2	-167.6	49.7	0	0	0	0	112.4
381	T	24.3	Very low	25.2	Very low	138 Å²	138	134.2 Å²	134.2	85%	0.847	82%	0.815	S	S	*	*				173.8	127.9	118.1	29.6	0	0	0	0	113
382	A	24	Very low	25.1	Very low	106 Å²	106	135.8 Å²	135.8	88%	0.876	81%	0.81	S	S	*	*			trans	47.6	112.2	152.7	0	0	0	0	0	121.5
383	G	23.9	Very low	25.2	Very low	80 Å²	80	136.1 Å²	136.1	83%	0.825	81%	0.814	S	S	*	*			trans	101.6	140.6	162.4	0	0	0	0	0	114.7
384	S	24.7	Very low	25.2	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	81%	0.81	S	S	*	*			cis	-162.2	137.5	-0.2	57.5	0	0	0	0	114.2
385	S	24.1	Very low	25.3	Very low	110 Å²	110	132.2 Å²	132.2	77%	0.769	82%	0.819	S	S	*	*			trans	71.2	154	146.5	-150.9	0	0	0	0	121.3
386	E	26.3	Very low	25.4	Very low	175 Å²	175	137.1 Å²	137.1	82%	0.818	83%	0.828	S	S	*	*			trans	68.1	125.8	175.4	-55.7	-175.4	-168.8	0	0	115.2
387	L	24.8	Very low	25.7	Very low	156 Å²	156	134.6 Å²	134.6	82%	0.817	82%	0.82	S	S	*	*	S	Bend	cis	-125	141.1	15.6	-82	161.7	0	0	0	114.4
388	S	26.6	Very low	25.9	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	81%	0.813	S	S	*	*			trans	62.9	81.3	148.9	-55.3	0	0	0	0	120.5
389	E	23.5	Very low	26.1	Very low	183 Å²	183	135.1 Å²	135.1	86%	0.855	81%	0.805	S	S	*	*			trans	-113	147.6	149.4	-78.4	-164.9	135.6	0	0	111.7
390	L	25.3	Very low	26.2	Very low	164 Å²	164	138.1 Å²	138.1	86%	0.859	81%	0.808	S	S	*	*			trans	51.8	101.9	156.2	-71	166	0	0	0	120.5
391	S	22.2	Very low	26.6	Very low	103 Å²	103	140.4 Å²	140.4	72%	0.72	81%	0.805	S	S	*	*				-169.2	121.9	127.7	51	0	0	0	0	114.3
392	Q	27	Very low	27.1	Very low	167 Å²	167	139.9 Å²	139.9	78%	0.78	80%	0.797	S	S	*	*			trans	59.6	143.7	131	-66.7	173.3	-5.3	0	0	119.9
393	M	27.1	Very low	27.9	Very low	165 Å²	165	140.7 Å²	140.7	81%	0.813	79%	0.791	S	S	*	*			cis	-152	167.4	0.5	-94.8	142.1	177.3	0	0	106.7
394	G	25.6	Very low	29	Very low	68 Å²	68	141.7 Å²	141.7	70%	0.701	79%	0.786	S	S	*	*			cis	148.9	124.1	-1.5	0	0	0	0	0	111.2
395	L	27.6	Very low	29.7	Very low	178 Å²	178	142.4 Å²	142.4	93%	0.932	78%	0.778	S	S	*	*			trans	-134.6	145.4	165.7	-79.4	177.7	0	0	0	109
396	L	28.4	Very low	30.7	Very low	169 Å²	169	146.1 Å²	146.1	89%	0.885	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-88.6	133.5	-169.8	-63.1	118.7	0	0	0	112
397	I	33.3	Very low	31.8	Very low	159 Å²	159	142.9 Å²	142.9	82%	0.815	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-82.3	123.4	154.8	-60.1	175.1	0	0	0	106.6
398	P	28.3	Very low	32.4	Very low	105 Å²	105	143 Å²	143	68%	0.682	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.9	137.4	175.4	-23.5	35	0	0	0	112	M400	P398-M400 PolarHBondContact O-N 3.22Å
399	E	30.2	Very low	33.4	Very low	155 Å²	155	141.3 Å²	141.3	72%	0.724	78%	0.779	S	S	*	*			trans	-63.7	99.1	170.1	-178.2	-178	-114.1	0	0	109.3	K401	E399-K401 VanDerWaalsContact C-N 3.28Å; E399-K401 HydrophobicContact CG-CG 4.37Å; E399-K401 PolarHBondContact O-N 2.9Å; E399-K401 WeakPolarHBondContact OE2-CE 3.44Å; E399-K401 IonicContact OE2-NZ 3.28Å; E399-K401 PolarHBondContact OE2-NZ 2.85Å
400	M	28	Very low	34.7	Very low	187 Å²	187	138 Å²	138	92%	0.921	76%	0.764	S	S	*	*			trans	-68.4	88.2	172	-81.6	-169.4	68.7	0	0	109.8	P398 D402	P398-M400 PolarHBondContact O-N 3.22Å; M400-D402 PolarHBondContact O-N 2.76Å
401	K	32.9	Very low	36.4	Very low	150 Å²	150	133.8 Å²	133.8	65%	0.652	75%	0.746	S	S	*	*			trans	-63.8	121.6	163.5	-69.4	-177.5	-177.2	174.7	0	108.4	E399 T403	E399-K401 VanDerWaalsContact C-N 3.28Å; E399-K401 HydrophobicContact CG-CG 4.37Å; E399-K401 PolarHBondContact O-N 2.9Å; E399-K401 WeakPolarHBondContact OE2-CE 3.44Å; E399-K401 IonicContact OE2-NZ 3.28Å; E399-K401 PolarHBondContact OE2-NZ 2.85Å; K401-T403 PolarHBondContact O-N 3.27Å; K401-T403 VanDerWaalsContact O-N 3.08Å
402	D	36.3	Very low	37.5	Very low	127 Å²	127	135 Å²	135	68%	0.679	74%	0.743	S	S	*	*			trans	-61.9	111.2	170.3	-175.9	5.2	0	0	0	109.4	M400 S404	M400-D402 PolarHBondContact O-N 2.76Å; D402-S404 WeakPolarHBondContact OD1-CA 3.42Å; D402-S404 VanDerWaalsContact OD1-CB 3.28Å; D402-S404 WeakPolarHBondContact OD1-CB 3.45Å; D402-S404 PolarHBondContact OD1-N 2.89Å
403	T	39.2	Very low	38.9	Very low	123 Å²	123	130.3 Å²	130.3	76%	0.755	73%	0.729	S	S	*	*			trans	-114.3	11.8	170.6	53	0	0	0	0	111.1	K401 M405	K401-T403 PolarHBondContact O-N 3.27Å; K401-T403 VanDerWaalsContact O-N 3.08Å; T403-M405 VanDerWaalsContact C-N 3.35Å; T403-M405 PolarHBondContact O-N 3Å
404	S	47.4	Very low	40.3	Very low	102 Å²	102	128.3 Å²	128.3	71%	0.713	72%	0.716	S	S	*	*	S	Bend	trans	-88.6	9.4	-167.5	-165.2	0	0	0	0	114.5	D402	D402-S404 WeakPolarHBondContact OD1-CA 3.42Å; D402-S404 VanDerWaalsContact OD1-CB 3.28Å; D402-S404 WeakPolarHBondContact OD1-CB 3.45Å; D402-S404 PolarHBondContact OD1-N 2.89Å
405	M	39.3	Very low	42	Very low	132 Å²	132	128.3 Å²	128.3	65%	0.65	70%	0.702	S	S	*	*	S	Bend	trans	-130.1	-7.6	-175.8	-74.5	-59	-58	0	0	116.7	T403	T403-M405 VanDerWaalsContact C-N 3.35Å; T403-M405 PolarHBondContact O-N 3Å
406	E	45.7	Very low	43.6	Very low	188 Å²	188	123.5 Å²	123.5	88%	0.879	68%	0.677	S	S	*	*	S	Bend	trans	-90.2	-1.1	-173	-70.4	-159.6	140.4	0	0	116.2
407	C	48.7	Very low	44.9	Very low	106 Å²	106	120.8 Å²	120.8	72%	0.716	66%	0.663	S	S	*	*			trans	-114.1	2.7	-172	-76.4	0	0	0	0	116.6	G409	C407-G409 PolarHBondContact O-N 3.02Å
408	L	37	Very low	45.8	Very low	159 Å²	159	121.3 Å²	121.3	83%	0.832	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	93.6	173.3	-67.9	176.5	0	0	0	110.6
409	G	49	Very low	46.9	Very low	77 Å²	77	122 Å²	122	79%	0.794	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.2	-5.1	174.9	0	0	0	0	0	116.7	C407	C407-G409 PolarHBondContact O-N 3.02Å
410	Q	49.5	Very low	47.7	Very low	115 Å²	115	121.6 Å²	121.6	54%	0.537	66%	0.655	S	S	.	*			trans	-82.2	135.1	174	-66.7	-75.5	-22.8	0	0	110.9
411	P	61.8	Low	48.7	Very low	74 Å²	74	115.8 Å²	115.8	48%	0.481	64%	0.643	S	S	.	*			trans	-68.1	139.5	173	28.5	-34.1	0	0	0	111.1	S413 K414	P411-S413 PolarHBondContact O-N 2.87Å; P411-K414 HydrophobicContact CG-CD 4.44Å; P411-K414 PolarHBondContact O-N 3.09Å
412	L	44.5	Very low	49.3	Very low	128 Å²	128	117 Å²	117	67%	0.67	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-33.1	-167.6	-174	62.9	0	0	0	114.8	K414 V415 I416	L412-K414 VanDerWaalsContact C-N 3.31Å; L412-K414 PolarHBondContact O-N 3.14Å; L412-V415 WeakPolarHBondContact O-CB 3.45Å; L412-V415 PolarHBondContact O-N 2.88Å; L412-I416 HydrophobicContact CD2-CD1 4.44Å; L412-I416 HydrophobicContact CG-CD1 4Å; L412-I416 HydrophobicContact CG-CG1 4.49Å; L412-I416 PolarHBondContact O-N 2.81Å; L412-I416 VanDerWaalsContact O-N 3.14Å
413	S	57.6	Low	49.5	Very low	69 Å²	69	118.1 Å²	118.1	48%	0.483	66%	0.656	S	S	.	*	H	α-helix	trans	-54.8	-42.8	176.2	48.2	0	0	0	0	113	P411 V415 I416 D417	P411-S413 PolarHBondContact O-N 2.87Å; S413-V415 PolarHBondContact O-N 3.36Å; S413-I416 PolarHBondContact O-N 3.25Å; S413-I416 VanDerWaalsContact O-N 3.13Å; S413-D417 VanDerWaalsContact O-CG 3.27Å; S413-D417 PolarHBondContact O-N 3.35Å
414	K	56.2	Low	49.3	Very low	124 Å²	124	118 Å²	118	54%	0.539	65%	0.651	S	S	.	*	H	α-helix	trans	-67.6	-19.7	178.7	-76.9	-175.4	173.1	-179.5	0	114.1	P411 L412 K418	P411-K414 HydrophobicContact CG-CD 4.44Å; P411-K414 PolarHBondContact O-N 3.09Å; L412-K414 VanDerWaalsContact C-N 3.31Å; L412-K414 PolarHBondContact O-N 3.14Å; K414-K418 WeakPolarHBondContact O-CB 3.48Å
415	V	60.6	Low	49	Very low	68 Å²	68	119 Å²	119	41%	0.412	65%	0.654	S	S	.	*	H	α-helix	trans	-80.6	-42.6	172.8	-175	0	0	0	0	109.6	L412 S413 K418 L419	L412-V415 WeakPolarHBondContact O-CB 3.45Å; L412-V415 PolarHBondContact O-N 2.88Å; S413-V415 PolarHBondContact O-N 3.36Å; V415-K418 PolarHBondContact O-N 2.83Å; V415-L419 HydrophobicContact CG1-CD1 4.35Å; V415-L419 PolarHBondContact O-N 3Å; V415-L419 VanDerWaalsContact O-N 3.08Å
416	I	62.7	Low	48.8	Very low	77 Å²	77	117.4 Å²	117.4	40%	0.395	66%	0.656	S	S	.	*	H	α-helix	trans	-64.3	-45.6	177.8	-65.6	171.8	0	0	0	111.4	L412 S413 K418 L419 H420	L412-I416 HydrophobicContact CD2-CD1 4.44Å; L412-I416 HydrophobicContact CG-CD1 4Å; L412-I416 HydrophobicContact CG-CG1 4.49Å; L412-I416 PolarHBondContact O-N 2.81Å; L412-I416 VanDerWaalsContact O-N 3.14Å; S413-I416 PolarHBondContact O-N 3.25Å; S413-I416 VanDerWaalsContact O-N 3.13Å; I416-K418 VanDerWaalsContact C-N 3.25Å; I416-K418 PolarHBondContact O-N 2.99Å; I416-L419 PolarHBondContact O-N 3.02Å; I416-H420 PolarHBondContact O-N 3.22Å; I416-H420 PolarHBondContact O-ND1 2.91Å
417	D	55.7	Low	48.2	Very low	112 Å²	112	114.1 Å²	114.1	60%	0.599	65%	0.649	S	S	*	*	H	α-helix	trans	-60.7	-36.1	176.6	-66.1	-28.2	0	0	0	111.8	S413 G421	S413-D417 VanDerWaalsContact O-CG 3.27Å; S413-D417 PolarHBondContact O-N 3.35Å; D417-G421 PolarHBondContact O-N 3.32Å
418	K	52.3	Low	47.5	Very low	170 Å²	170	120.6 Å²	120.6	74%	0.739	66%	0.659	S	S	*	*	H	α-helix	trans	-75.2	-28.1	-179.4	-163.3	177.6	-177	-172.6	0	112.8	K414 V415 I416	K414-K418 WeakPolarHBondContact O-CB 3.48Å; V415-K418 PolarHBondContact O-N 2.83Å; I416-K418 VanDerWaalsContact C-N 3.25Å; I416-K418 PolarHBondContact O-N 2.99Å
419	L	49.7	Very low	47	Very low	120 Å²	120	119 Å²	119	63%	0.628	66%	0.66	S	S	*	*	H	α-helix	trans	-75.6	-41	172.4	-84.4	160.9	0	0	0	112.4	V415 I416 G421 Q422	V415-L419 HydrophobicContact CG1-CD1 4.35Å; V415-L419 PolarHBondContact O-N 3Å; V415-L419 VanDerWaalsContact O-N 3.08Å; I416-L419 PolarHBondContact O-N 3.02Å; L419-G421 PolarHBondContact O-N 3.03Å; L419-Q422 PolarHBondContact O-N 3.4Å
420	H	48.5	Very low	46	Very low	146 Å²	146	119.6 Å²	119.6	68%	0.676	65%	0.652	S	S	*	*	H	α-helix	trans	-64.8	-20.4	176.3	-74.8	88.1	0	0	0	113.3	I416 Q422	I416-H420 PolarHBondContact O-N 3.22Å; I416-H420 PolarHBondContact O-ND1 2.91Å; H420-Q422 VanDerWaalsContact C-N 3.32Å; H420-Q422 PolarHBondContact O-N 2.88Å
421	G	48.9	Very low	45	Very low	65 Å²	65	121.8 Å²	121.8	67%	0.67	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	1.9	176.5	0	0	0	0	0	116.6	D417 L419	D417-G421 PolarHBondContact O-N 3.32Å; L419-G421 PolarHBondContact O-N 3.03Å
422	Q	45.5	Very low	43.3	Very low	174 Å²	174	122.3 Å²	122.3	81%	0.813	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	20.6	-177.8	-69	-153.2	-66.3	0	0	115.5	L419 H420	L419-Q422 PolarHBondContact O-N 3.4Å; H420-Q422 VanDerWaalsContact C-N 3.32Å; H420-Q422 PolarHBondContact O-N 2.88Å
423	L	39.3	Very low	42.4	Very low	151 Å²	151	122.1 Å²	122.1	79%	0.791	67%	0.672	S	S	*	*			trans	-114	80.9	170.8	-68.5	174.6	0	0	0	110.7	P425	L423-P425 WeakPolarHBondContact O-CD 3.4Å
424	D	35.9	Very low	42.3	Very low	122 Å²	122	124.3 Å²	124.3	65%	0.652	69%	0.685	S	S	*	*			trans	-78.4	117	173.3	-162.6	-19.9	0	0	0	109.9	S426	D424-S426 PolarHBondContact O-N 2.96Å
425	P	39.9	Very low	42	Very low	121 Å²	121	123.8 Å²	123.8	79%	0.786	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-71.8	0.9	-167.8	-20.7	34.2	0	0	0	116.3	L423 T427	L423-P425 WeakPolarHBondContact O-CD 3.4Å; P425-T427 PolarHBondContact O-N 3.47Å
426	S	35.1	Very low	40.6	Very low	99 Å²	99	127.8 Å²	127.8	69%	0.692	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-80.4	-4.4	-161.6	62.3	0	0	0	0	117.2	D424	D424-S426 PolarHBondContact O-N 2.96Å
427	T	34.2	Very low	39	Very low	119 Å²	119	131.3 Å²	131.3	73%	0.73	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-90.5	-16.7	-165.5	-25.2	0	0	0	0	115.5	P425	P425-T427 PolarHBondContact O-N 3.47Å
428	W	34.4	Very low	38.1	Very low	243 Å²	243	130.2 Å²	130.2	92%	0.92	72%	0.724	S	S	*	*			trans	-124	104.9	-173.8	-79.5	-9.3	0	0	0	114
429	C	25.8	Very low	37	Very low	126 Å²	126	131.6 Å²	131.6	85%	0.851	73%	0.73	S	S	*	*			trans	-156	148.9	164.4	-84.1	0	0	0	0	107.5
430	S	28.6	Very low	36.1	Very low	89 Å²	89	137.1 Å²	137.1	62%	0.622	74%	0.743	S	S	*	*			cis	177.9	164.7	-12.9	47.2	0	0	0	0	109.1
431	H	27.8	Very low	35.3	Very low	160 Å²	160	135.1 Å²	135.1	74%	0.741	75%	0.751	S	S	*	*			trans	72.7	150.8	168.2	-66.7	-70.5	0	0	0	117.6	D433	H431-D433 IonicContact ND1-OD1 3.22Å; H431-D433 PolarHBondContact ND1-OD1 3.39Å; H431-D433 IonicContact ND1-OD2 2.65Å; H431-D433 PolarHBondContact ND1-OD2 3.34Å
432	A	25.9	Very low	34	Very low	86 Å²	86	135.8 Å²	135.8	71%	0.711	76%	0.759	S	S	*	*			cis	-153.8	169.1	6.6	0	0	0	0	0	111
433	D	27	Very low	33.2	Very low	123 Å²	123	133.1 Å²	133.1	66%	0.658	76%	0.759	S	S	*	*			cis	-169.9	164.2	-27.7	-88.2	-24.5	0	0	0	107.6	H431	H431-D433 IonicContact ND1-OD1 3.22Å; H431-D433 PolarHBondContact ND1-OD1 3.39Å; H431-D433 IonicContact ND1-OD2 2.65Å; H431-D433 PolarHBondContact ND1-OD2 3.34Å
434	P	54.1	Low	33.7	Very low	116 Å²	116	132.1 Å²	132.1	75%	0.753	76%	0.762	S	S	*	*			trans	-97.8	-173.5	-168.8	42.5	-39.2	0	0	0	113.9
435	P	50.1	Low	33.2	Very low	113 Å²	113	129.8 Å²	129.8	73%	0.734	77%	0.767	S	S	*	*				-157.5	-172	85.1	42.4	-21.3	0	0	0	117.5
436	E	31.1	Very low	32.6	Very low	152 Å²	152	133.9 Å²	133.9	71%	0.71	78%	0.776	S	S	*	*			trans	76	144.1	164.7	-62.4	-77.7	43.5	0	0	117.7
437	Q	29.9	Very low	32.4	Very low	150 Å²	150	133.4 Å²	133.4	70%	0.701	78%	0.778	S	S	*	*			cis	-151.9	-162.9	-13.7	-157.3	169.2	90.8	0	0	109.5
438	S	37.1	Very low	32.7	Very low	89 Å²	89	133.5 Å²	133.5	62%	0.622	78%	0.78	S	S	*	*			trans	-155.2	167.2	177.4	70.8	0	0	0	0	111.7
439	F	27.5	Very low	32.3	Very low	199 Å²	199	130.6 Å²	130.6	87%	0.873	78%	0.777	S	S	*	*			trans	179.3	-172.6	140.2	-93.9	-55.4	0	0	0	113
440	R	31.7	Very low	32.4	Very low	236 Å²	236	134.4 Å²	134.4	89%	0.891	78%	0.779	S	S	*	*			trans	-145.2	142.1	-147.6	-164.5	-167.1	-165.6	-172	6	115.4
441	A	31	Very low	33.3	Very low	104 Å²	104	134.8 Å²	134.8	86%	0.86	78%	0.779	S	S	*	*			trans	68.1	142.4	158.2	0	0	0	0	0	121.2
442	G	23.1	Very low	34.2	Very low	80 Å²	80	132.2 Å²	132.2	83%	0.825	78%	0.777	S	S	*	*			trans	159.4	142.7	166.7	0	0	0	0	0	115.5
443	S	28.8	Very low	34.4	Very low	117 Å²	117	136.5 Å²	136.5	82%	0.818	78%	0.78	S	S	*	*			trans	-161.4	175.2	170.6	67.9	0	0	0	0	108.9
444	P	48.8	Very low	34.4	Very low	130 Å²	130	135.5 Å²	135.5	84%	0.844	78%	0.781	S	S	*	*			cis	-125	-171.7	-20.1	41.5	-27.1	0	0	0	112.5
445	G	26.2	Very low	33	Very low	74 Å²	74	136 Å²	136	76%	0.763	78%	0.777	S	S	*	*			trans	136.5	140	144.8	0	0	0	0	0	120.8
446	E	26.6	Very low	32	Very low	207 Å²	207	141.1 Å²	141.1	97%	0.967	79%	0.788	S	S	*	*			trans	65.1	147.5	158.1	-87.2	177.5	162.3	0	0	123.4
447	A	31.8	Very low	31.9	Very low	89 Å²	89	139.5 Å²	139.5	74%	0.736	79%	0.794	S	S	*	*			trans	-147.3	168.2	179	0	0	0	0	0	108.9
448	P	38.9	Very low	32	Very low	121 Å²	121	142 Å²	142	79%	0.786	81%	0.805	S	S	*	*				-159	-176	108.6	37.4	-15.3	0	0	0	118.1
449	E	26.8	Very low	31.6	Very low	182 Å²	182	141.3 Å²	141.3	85%	0.85	81%	0.813	S	S	*	*			trans	81.3	67.8	155.7	-49.1	-149.9	150.2	0	0	123.1
450	K	28.9	Very low	32	Very low	206 Å²	206	140 Å²	140	90%	0.896	81%	0.814	S	S	*	*				38.2	163.7	110.5	-91.9	-156.4	165.1	179.7	0	124.1
451	P	47	Very low	31.9	Very low	96 Å²	96	134.8 Å²	134.8	62%	0.623	81%	0.811	S	S	*	*			trans	-128.5	-152.6	-136.7	37.5	-13.6	0	0	0	114.4
452	P	45.5	Very low	31.7	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	81%	0.807	S	S	*	*				-144.3	145.2	95	35.4	-18.9	0	0	0	117.2
453	F	30.9	Very low	32.5	Very low	176 Å²	176	136.1 Å²	136.1	77%	0.772	80%	0.804	S	S	*	*			trans	36.3	137.1	133.9	-63.1	-61.4	0	0	0	120.8
454	C	26.1	Very low	32.4	Very low	101 Å²	101	138.6 Å²	138.6	68%	0.682	81%	0.805	S	S	*	*			cis	-157.3	172	14	-88.9	0	0	0	0	108.2
455	D	26.2	Very low	31.4	Very low	126 Å²	126	139.7 Å²	139.7	67%	0.674	80%	0.804	S	S	*	*			cis	-168.4	-165.2	-21.5	-91.8	-6.7	0	0	0	107.6
456	F	29.3	Very low	31.4	Very low	221 Å²	221	145.3 Å²	145.3	97%	0.969	81%	0.807	S	S	*	*			trans	74.2	132.2	-172.6	-71.9	-81.8	0	0	0	116.5
457	S	28.9	Very low	31.7	Very low	118 Å²	118	145.2 Å²	145.2	83%	0.825	80%	0.8	S	S	*	*			trans	-156.9	131.8	-177.5	57.3	0	0	0	0	112.4
458	E	31.4	Very low	31.3	Very low	202 Å²	202	151.6 Å²	151.6	94%	0.944	81%	0.805	S	S	*	*			trans	-86.9	161.3	163	-60.5	172.7	113.7	0	0	110.5
459	G	27.9	Very low	30.8	Very low	76 Å²	76	154.1 Å²	154.1	78%	0.784	80%	0.804	S	S	*	*			trans	164.8	95.9	171.6	0	0	0	0	0	117.3
460	L	35.5	Very low	30.9	Very low	172 Å²	172	151.4 Å²	151.4	90%	0.901	80%	0.8	S	S	*	*			trans	-25.2	144.8	164.1	-60.6	162	0	0	0	118.5
461	P	29.5	Very low	31.2	Very low	126 Å²	126	148.4 Å²	148.4	82%	0.818	80%	0.798	S	S	*	*			trans	-104.7	168.7	147.1	37.3	-30	0	0	0	112.8
462	A	27.3	Very low	30.1	Very low	95 Å²	95	153 Å²	153	79%	0.785	81%	0.811	S	S	*	*			trans	-118.7	-170.7	176.2	0	0	0	0	0	110
463	P	39.5	Very low	29.2	Very low	117 Å²	117	152.8 Å²	152.8	76%	0.76	81%	0.813	S	S	*	*				-115.3	168.4	-122.8	40.5	-28.6	0	0	0	116.6
464	M	27.6	Very low	29.3	Very low	168 Å²	168	150.8 Å²	150.8	83%	0.828	82%	0.817	S	S	*	*			trans	63.4	107.4	164.4	-79.4	-80.5	-171.7	0	0	117.3
465	D	27.1	Very low	29.4	Very low	153 Å²	153	151.7 Å²	151.7	82%	0.818	83%	0.825	S	S	*	*			trans	-131.4	137.8	160.4	-104.8	-46	0	0	0	110.8
466	F	26.9	Very low	29.5	Very low	192 Å²	192	152.1 Å²	152.1	84%	0.842	83%	0.832	S	S	*	*			trans	-89.3	116.5	179.2	-88.2	-112.4	0	0	0	110.6	R468	F466-R468 PolarHBondContact O-N 2.72Å
467	Y	31.9	Very low	29.6	Very low	205 Å²	205	148.1 Å²	148.1	80%	0.804	83%	0.826	S	S	*	*			trans	-74.7	89.5	176.8	-80.1	-79.5	0	0	0	113
468	R	24.8	Very low	29.7	Very low	224 Å²	224	147 Å²	147	85%	0.845	82%	0.824	S	S	*	*			trans	-90	112.2	163.1	-178.6	179.8	-178.1	172.2	1.8	109.3	F466	F466-R468 PolarHBondContact O-N 2.72Å
469	F	28.9	Very low	30.2	Very low	173 Å²	173	143.7 Å²	143.7	76%	0.759	82%	0.82	S	S	*	*			trans	-72.6	129.8	177.5	-69.9	-87.1	0	0	0	111.7
470	T	27.6	Very low	30.2	Very low	126 Å²	126	143.9 Å²	143.9	77%	0.773	82%	0.821	S	S	*	*			trans	-115.1	140.6	163.9	46.6	0	0	0	0	109.2
471	V	34.7	Very low	29.8	Very low	143 Å²	143	139.9 Å²	139.9	87%	0.867	82%	0.822	S	S	*	*			trans	-78.6	124.7	179.8	178.6	0	0	0	0	109.9
472	E	24.2	Very low	29.7	Very low	191 Å²	191	137.2 Å²	137.2	89%	0.893	82%	0.817	S	S	*	*			trans	-151.5	131	162.9	-127	168.8	-142.1	0	0	110.9
473	S	27.7	Very low	29.9	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	82%	0.816	S	S	*	*			trans	-95.1	143	-173.3	-58	0	0	0	0	111.8
474	P	33	Very low	29.4	Very low	134 Å²	134	142.8 Å²	142.8	87%	0.87	82%	0.816	S	S	*	*			trans	-77.6	134.4	-174.2	31	-35.1	0	0	0	112.8
475	S	26.8	Very low	29.4	Very low	120 Å²	120	141.2 Å²	141.2	84%	0.839	81%	0.811	S	S	*	*			trans	-148.5	139.5	158.2	55.6	0	0	0	0	110.6
476	T	28.8	Very low	30.7	Very low	134 Å²	134	139.6 Å²	139.6	82%	0.822	81%	0.809	S	S	*	*			trans	-116.1	126.7	-169.8	35.1	0	0	0	0	112.7
477	V	30.9	Very low	31.2	Very low	138 Å²	138	136.1 Å²	136.1	84%	0.836	81%	0.805	S	S	*	*			trans	33.5	113.5	142.7	-167.9	0	0	0	0	116.5
478	A	30.9	Very low	31	Very low	95 Å²	95	129.9 Å²	129.9	79%	0.785	80%	0.804	S	S	*	*				-166	168.7	89.1	0	0	0	0	0	113
479	P	43.7	Very low	32.1	Very low	132 Å²	132	125.6 Å²	125.6	86%	0.857	81%	0.805	S	S	*	*			trans	-107.4	165.5	-154.2	40.6	-36.4	0	0	0	116.3
480	G	26.4	Very low	31.8	Very low	79 Å²	79	123 Å²	123	81%	0.814	81%	0.808	S	S	*	*			trans	168.1	112.4	162.1	0	0	0	0	0	114.5
481	G	27.6	Very low	31.8	Very low	89 Å²	89	125.8 Å²	125.8	92%	0.918	81%	0.813	S	S	*	*			trans	-79.3	178.7	-171.5	0	0	0	0	0	117.9
482	G	27.9	Very low	32.5	Very low	69 Å²	69	124 Å²	124	71%	0.711	80%	0.804	S	S	*	*			trans	122.2	91.8	148.7	0	0	0	0	0	118.4
483	H	31.1	Very low	32.6	Very low	167 Å²	167	121.4 Å²	121.4	77%	0.773	80%	0.795	S	S	*	*			trans	46.6	120.7	138.4	-78	-71.7	0	0	0	123
484	H	28.8	Very low	32.5	Very low	162 Å²	162	124 Å²	124	75%	0.75	80%	0.796	S	S	*	*			trans	83	150	137.8	-67.4	-50.8	0	0	0	122.3
485	D	28.1	Very low	32.4	Very low	136 Å²	136	123.6 Å²	123.6	73%	0.727	79%	0.79	S	S	*	*			trans	-104.3	-169.9	-163.5	-30.8	-108.2	0	0	0	112.7
486	P	55.1	Low	32.9	Very low	119 Å²	119	124 Å²	124	77%	0.773	79%	0.79	S	S	*	*			cis	-122.5	-36.5	-45.3	15.1	1.1	0	0	0	121
487	P	36.3	Very low	32.6	Very low	118 Å²	118	120.8 Å²	120.8	77%	0.766	78%	0.784	S	S	*	*				-124.6	141.5	-110.1	38.2	-24.7	0	0	0	118.8
488	G	27	Very low	32.4	Very low	75 Å²	75	120.3 Å²	120.3	77%	0.773	79%	0.786	S	S	*	*			trans	123.7	161.6	137.6	0	0	0	0	0	118.1
489	P	47.8	Very low	32.9	Very low	133 Å²	133	121.5 Å²	121.5	86%	0.864	79%	0.786	S	S	*	*			trans	-125	162.3	-164.8	41.5	-27.8	0	0	0	116.6
490	S	24.4	Very low	32.1	Very low	120 Å²	120	119.7 Å²	119.7	84%	0.839	78%	0.782	S	S	*	*			trans	-162.9	135.3	155.4	54.6	0	0	0	0	114.4
491	Q	27.1	Very low	32.2	Very low	184 Å²	184	120.2 Å²	120.2	86%	0.86	78%	0.779	S	S	*	*			trans	-89.4	-170.9	164.3	-64.5	-179.3	-23.7	0	0	110
492	P	48.1	Very low	32.1	Very low	104 Å²	104	120.3 Å²	120.3	68%	0.675	77%	0.771	S	S	*	*			cis	-128.5	-173	-3.3	28.6	-2.8	0	0	0	113.8
493	L	26.4	Very low	31.9	Very low	138 Å²	138	124.5 Å²	124.5	72%	0.723	78%	0.776	S	S	*	*				-179.9	148.1	80.7	-83	170	0	0	0	114.1
494	H	27.1	Very low	31.7	Very low	159 Å²	159	123.3 Å²	123.3	74%	0.736	77%	0.771	S	S	*	*			trans	50.7	127.9	158.7	-65.1	-65.8	0	0	0	121.5
495	V	29.5	Very low	31.5	Very low	125 Å²	125	122.8 Å²	122.8	76%	0.758	77%	0.769	S	S	*	*			cis	74.6	135.6	39.6	179.4	0	0	0	0	112.6
496	P	37.9	Very low	31.4	Very low	128 Å²	128	124.2 Å²	124.2	83%	0.831	77%	0.771	S	S	*	*			cis	-127	-179.3	16.4	30.1	-7.9	0	0	0	116.2
497	G	23.5	Very low	30	Very low	67 Å²	67	126.6 Å²	126.6	69%	0.691	77%	0.772	S	S	*	*			cis	155.4	137.1	-13.5	0	0	0	0	0	116.7
498	S	26	Very low	29.4	Very low	127 Å²	127	129.8 Å²	129.8	89%	0.888	78%	0.777	S	S	*	*			trans	60	159.9	158.8	-55.2	0	0	0	0	121.2
499	P	41.3	Very low	29.2	Very low	120 Å²	120	129.7 Å²	129.7	78%	0.779	78%	0.776	S	S	*	*			cis	-114.2	-172.9	-15.5	43.9	-30.3	0	0	0	111.2
500	A	26.6	Very low	28	Very low	94 Å²	94	127.6 Å²	127.6	78%	0.777	78%	0.778	S	S	*	*			cis	84.1	140.3	11.8	0	0	0	0	0	118.2
501	A	28.2	Very low	28	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	77%	0.772	S	S	*	*			cis	-171.5	159.8	-18.4	0	0	0	0	0	112.7
502	A	25.9	Very low	27.9	Very low	91 Å²	91	128.5 Å²	128.5	75%	0.752	78%	0.777	S	S	*	*			trans	65.5	166.9	146.4	0	0	0	0	0	123.5
503	L	24.6	Very low	27	Very low	156 Å²	156	126.8 Å²	126.8	82%	0.817	78%	0.778	S	S	*	*			trans	74.6	164	169	-51.1	177.7	0	0	0	117.5
504	Q	25.3	Very low	27	Very low	142 Å²	142	129.6 Å²	129.6	66%	0.664	79%	0.788	S	S	*	*			cis	-176.5	164.8	-40.7	-170.2	168.6	-45.7	0	0	106.7
505	E	25.5	Very low	26.9	Very low	152 Å²	152	125.7 Å²	125.7	71%	0.71	79%	0.79	S	S	*	*			trans	63.7	169.1	168.6	-79.1	141.2	-131.8	0	0	115.3
506	E	26.2	Very low	26.8	Very low	165 Å²	165	129 Å²	129	77%	0.771	80%	0.797	S	S	*	*			cis	-174.5	153.1	-46	-117	-177.9	179.1	0	0	105.6
507	E	24.6	Very low	26.1	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.794	80%	0.797	S	S	*	*			trans	59.3	155.8	154.7	-66.3	-147.9	128.4	0	0	125.4
508	E	23.7	Very low	26	Very low	184 Å²	184	130.8 Å²	130.8	86%	0.86	80%	0.796	S	S	*	*			trans	42.4	124.2	155.7	-67.4	-155.5	134.8	0	0	123.6
509	G	23.2	Very low	26	Very low	74 Å²	74	132.5 Å²	132.5	76%	0.763	79%	0.79	S	S	*	*				131.2	82.8	88.3	0	0	0	0	0	119.9
510	G	23.7	Very low	25.5	Very low	88 Å²	88	133 Å²	133	91%	0.907	79%	0.794	S	S	*	*			trans	72	167.2	155.8	0	0	0	0	0	117.4
511	G	24.3	Very low	25.4	Very low	68 Å²	68	135 Å²	135	70%	0.701	79%	0.791	S	S	*	*			cis	157.8	158.4	-3.3	0	0	0	0	0	112
512	R	25.4	Very low	25.3	Very low	256 Å²	256	138.8 Å²	138.8	97%	0.966	79%	0.793	S	S	*	*			trans	75.5	145.4	-171.5	-57.2	170	162.2	-100.5	-5.7	114.5
513	G	27.4	Very low	25.2	Very low	68 Å²	68	141.5 Å²	141.5	70%	0.701	79%	0.794	S	S	*	*			cis	-161.9	176.1	4.1	0	0	0	0	0	114.7
514	E	26.2	Very low	25.2	Very low	197 Å²	197	143 Å²	143	92%	0.921	79%	0.789	S	S	*	*			trans	-68.7	156.9	-172.4	-54.1	127.2	112.3	0	0	113.7
515	G	26.7	Very low	25.1	Very low	76 Å²	76	144 Å²	144	78%	0.784	79%	0.794	S	S	*	*			trans	170.6	79.9	171	0	0	0	0	0	115.2
516	Q	26.1	Very low	24.9	Very low	196 Å²	196	140 Å²	140	92%	0.916	79%	0.793	S	S	*	*			trans	-78.2	131.3	166.2	-69.1	177.7	-26.4	0	0	110.9
517	T	22.9	Very low	24.8	Very low	134 Å²	134	140.8 Å²	140.8	82%	0.822	80%	0.797	S	S	*	*			trans	-154.4	107.5	153.3	11.3	0	0	0	0	112.8
518	S	23	Very low	24.7	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	80%	0.797	S	S	*	*			trans	15.3	127.6	138.1	58.6	0	0	0	0	120.9
519	Q	24.9	Very low	24.7	Very low	163 Å²	163	137.4 Å²	137.4	76%	0.762	78%	0.784	S	S	*	*				53.2	144.1	127.4	-100.5	177.2	-8.8	0	0	120.8
520	P	31.3	Very low	24.6	Very low	131 Å²	131	142 Å²	142	85%	0.851	79%	0.786	S	S	*	*				-136.5	174.2	89.6	38.7	-27	0	0	0	115.3
521	L	23.8	Very low	24.6	Very low	137 Å²	137	146.4 Å²	146.4	72%	0.717	78%	0.783	S	S	*	*			trans	-135.6	179	178.3	-130.6	177.4	0	0	0	108
522	E	26.3	Very low	25	Very low	170 Å²	170	149 Å²	149	79%	0.794	79%	0.787	S	S	*	*			trans	67.3	112.4	162.9	-64.3	-176.8	132.6	0	0	120.7
523	D	23.6	Very low	24.8	Very low	147 Å²	147	145.1 Å²	145.1	79%	0.786	78%	0.78	S	S	*	*				-172.3	145.4	113.6	-113.3	-2.8	0	0	0	109.1
524	R	24.7	Very low	25.1	Very low	188 Å²	188	146.3 Å²	146.3	71%	0.709	78%	0.775	S	S	*	*			cis	-161.8	145.6	-28.9	-130.7	179.4	90.2	-174.4	5.4	111.3
525	Q	22.7	Very low	24.9	Very low	162 Å²	162	145 Å²	145	76%	0.757	77%	0.769	S	S	*	*			trans	23.9	135.2	150.4	-67.4	170.8	-23	0	0	122.7
526	G	22.3	Very low	24.6	Very low	68 Å²	68	150 Å²	150	70%	0.701	77%	0.772	S	S	*	*			trans	155.4	111.4	139.3	0	0	0	0	0	118.6
527	E	23.8	Very low	25.1	Very low	183 Å²	183	145.6 Å²	145.6	86%	0.855	76%	0.76	S	S	*	*			trans	58.8	131.9	146.7	-65	166.3	152.8	0	0	118.8
528	E	23.1	Very low	25.2	Very low	167 Å²	167	146.1 Å²	146.1	78%	0.78	76%	0.758	S	S	*	*				62.3	135.4	68.1	-67.1	-165	178.2	0	0	113.3
529	I	22.8	Very low	25.2	Very low	116 Å²	116	145.8 Å²	145.8	60%	0.595	76%	0.756	S	S	*	*			cis	-165.3	151.8	9.6	-124.6	170.2	0	0	0	112.3
530	Q	22.2	Very low	25.2	Very low	171 Å²	171	147.1 Å²	147.1	80%	0.799	76%	0.762	S	S	*	*			trans	53.6	158.8	150.8	-63	163.8	19.2	0	0	125.9
531	E	22.2	Very low	24.9	Very low	180 Å²	180	148.6 Å²	148.6	84%	0.841	76%	0.762	S	S	*	*			trans	-46	169.1	157.6	-78.1	-178.1	133.5	0	0	115.7
532	P	33.8	Very low	25.6	Very low	121 Å²	121	147.5 Å²	147.5	79%	0.786	76%	0.763	S	S	*	*			cis	-156.8	-171	44.4	45.1	-21.7	0	0	0	121.1
533	E	21.4	Very low	25.6	Very low	176 Å²	176	147 Å²	147	82%	0.822	77%	0.765	S	S	*	*			trans	-32.9	173.5	158	-76.9	-158.1	119.9	0	0	119
534	P	34.4	Very low	25.6	Very low	92 Å²	92	146.1 Å²	146.1	60%	0.597	76%	0.764	S	S	*	*			cis	-149.9	177.8	26	45.1	-24.6	0	0	0	121.5
535	Q	20.6	Very low	25.6	Very low	170 Å²	170	141 Å²	141	79%	0.794	76%	0.757	S	S	*	*			trans	72.5	113.6	144.1	-77.9	152.6	30.1	0	0	123.8
536	E	21.2	Very low	25.7	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	76%	0.757	S	S	*	*				34.1	161.4	113.8	-91.3	-172.9	-163.8	0	0	123.6
537	P	36.6	Very low	25.6	Very low	103 Å²	103	145.5 Å²	145.5	67%	0.669	76%	0.76	S	S	*	*			cis	-144.2	-179.1	-14.1	40.8	-20.8	0	0	0	117.6
538	D	24.6	Very low	26.4	Very low	145 Å²	145	141.8 Å²	141.8	78%	0.775	75%	0.752	S	S	*	*			trans	77.5	137.8	137.7	-118.7	-31	0	0	0	128.1
539	S	23.7	Very low	26.5	Very low	91 Å²	91	140 Å²	140	64%	0.636	75%	0.752	S	S	*	*			trans	50.6	130.5	140.4	-79.1	0	0	0	0	126.2
540	Q	23.6	Very low	27.5	Very low	190 Å²	190	140.4 Å²	140.4	89%	0.888	76%	0.762	S	S	*	*				-177.5	154.5	110	-98.3	166.8	51.3	0	0	117
541	L	24.5	Very low	27.6	Very low	163 Å²	163	140.8 Å²	140.8	85%	0.853	76%	0.764	S	S	*	*			trans	-118.7	-161.4	168.1	-72.4	169.3	0	0	0	108.1
542	P	39.5	Very low	28.4	Very low	113 Å²	113	137 Å²	137	73%	0.734	76%	0.755	S	S	*	*			cis	-125.6	174.2	-6.7	13.3	16.4	0	0	0	115
543	L	26.1	Very low	28	Very low	160 Å²	160	137.2 Å²	137.2	84%	0.838	75%	0.754	S	S	*	*				54.7	136.5	81.9	-102.4	154.6	0	0	0	114.6
544	V	24.7	Very low	28.1	Very low	128 Å²	128	134.2 Å²	134.2	78%	0.776	75%	0.752	S	S	*	*			cis	-147.2	-156.6	33.3	-139.9	0	0	0	0	111.7
545	S	23.8	Very low	27.5	Very low	80 Å²	80	138.4 Å²	138.4	56%	0.559	76%	0.764	S	S	*	*			cis	-165.7	151.4	8.3	-137	0	0	0	0	116.7
546	Q	24.3	Very low	28.1	Very low	159 Å²	159	135.4 Å²	135.4	74%	0.743	76%	0.759	S	S	*	*			trans	59.4	118.5	134.3	-75.2	166.4	-36.5	0	0	128.6
547	E	20.1	Very low	28.2	Very low	167 Å²	167	135 Å²	135	78%	0.78	76%	0.757	S	S	*	*				61.2	165.3	124.5	-79.3	-173	131	0	0	124.9
548	P	42.2	Very low	27.9	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	76%	0.761	S	S	*	*			cis	-140.3	164.9	-20.5	35.3	-14.6	0	0	0	118.8
549	V	24.8	Very low	27.9	Very low	131 Å²	131	132.1 Å²	132.1	79%	0.794	76%	0.76	S	S	*	*			trans	32.2	144.2	133.5	178.3	0	0	0	0	121.6
550	P	44.3	Very low	27.9	Very low	123 Å²	123	134 Å²	134	80%	0.799	77%	0.767	S	S	*	*			cis	-139.5	-177	24.5	24.1	4	0	0	0	120.5
551	E	23.5	Very low	27.9	Very low	179 Å²	179	132.7 Å²	132.7	84%	0.836	76%	0.761	S	S	*	*			trans	-71.8	-170.9	172.8	-112.9	178.1	-141.5	0	0	116.9
552	P	39.5	Very low	27.8	Very low	102 Å²	102	132.7 Å²	132.7	66%	0.662	76%	0.756	S	S	*	*			cis	-141.5	-168.5	-6.4	25.4	2	0	0	0	117.6
553	V	24	Very low	27	Very low	125 Å²	125	130.8 Å²	130.8	76%	0.758	75%	0.75	S	S	*	*			trans	105.6	97.8	148.3	-169.2	0	0	0	0	121.8
554	S	24.1	Very low	26.8	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	75%	0.748	S	S	*	*			trans	50.4	148.4	141.6	72.8	0	0	0	0	126.6
555	Q	21.1	Very low	26.8	Very low	181 Å²	181	130.3 Å²	130.3	85%	0.846	75%	0.752	S	S	*	*			trans	-75.6	-171.8	176	-52.3	175.2	-37.1	0	0	113.7
556	P	33.4	Very low	26.8	Very low	106 Å²	106	134.9 Å²	134.9	69%	0.688	76%	0.762	S	S	*	*			cis	-140.5	176.6	2.8	44.4	-26.4	0	0	0	118.5
557	E	24.3	Very low	26.8	Very low	174 Å²	174	133.4 Å²	133.4	81%	0.813	76%	0.758	S	S	*	*			trans	62.7	167	168.9	-64.1	-66.8	127	0	0	116.2
558	P	30.9	Very low	27	Very low	114 Å²	114	133 Å²	133	74%	0.74	75%	0.754	S	S	*	*			cis	-132.3	-164.9	-2.9	44.1	-27.9	0	0	0	114
559	G	23.5	Very low	26.4	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	77%	0.767	S	S	*	*				99.2	143.3	126.6	0	0	0	0	0	120.2
560	T	23.7	Very low	26.2	Very low	129 Å²	129	138.3 Å²	138.3	79%	0.791	75%	0.753	S	S	*	*			trans	-109.1	166.9	179.2	35.9	0	0	0	0	113.6
561	H	22.8	Very low	25.3	Very low	163 Å²	163	140.6 Å²	140.6	76%	0.755	75%	0.753	S	S	*	*			trans	72.7	140.6	-176.8	-64	-107.2	0	0	0	114.6
562	E	23.6	Very low	25.2	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.762	75%	0.754	S	S	*	*			cis	-154.3	152.9	2.8	-138.7	160.8	-132.7	0	0	115.4
563	A	22.1	Very low	24.3	Very low	73 Å²	73	137.8 Å²	137.8	60%	0.603	75%	0.753	S	S	*	*			trans	33.4	122	148.6	0	0	0	0	0	124.1
564	L	22.7	Very low	24.9	Very low	152 Å²	152	137.2 Å²	137.2	80%	0.796	75%	0.752	S	S	*	*			trans	66.6	144.4	150.7	-82.1	77.1	0	0	0	117.6
565	C	24.1	Very low	24.7	Very low	126 Å²	126	137.3 Å²	137.3	85%	0.851	75%	0.751	S	S	*	*			cis	-102	130.9	19.9	-68	0	0	0	0	115.7
566	K	23.7	Very low	24.9	Very low	177 Å²	177	136 Å²	136	77%	0.77	75%	0.749	S	S	*	*			trans	-69.4	154	147	-58.1	176.4	178.8	179.3	0	107.6
567	L	24.6	Very low	24.5	Very low	128 Å²	128	136.4 Å²	136.4	67%	0.67	75%	0.754	S	S	*	*				176.4	163.7	82	-139.7	62.9	0	0	0	104.6
568	K	24.2	Very low	24.7	Very low	157 Å²	157	133.2 Å²	133.2	68%	0.683	75%	0.751	S	S	*	*			cis	-159.8	120.3	23.2	-164.7	164.1	-156.2	178.4	0	109.2	D570	K568-D570 VanDerWaalsContact CE-CG 3.43Å; K568-D570 WeakPolarHBondContact CE-OD2 3.45Å; K568-D570 HydrophobicContact CG-CB 3.9Å; K568-D570 VanDerWaalsContact CG-OD1 3.31Å; K568-D570 WeakPolarHBondContact CG-OD1 3.39Å; K568-D570 IonicContact NZ-OD2 3.55Å
569	R	28.9	Very low	24.4	Very low	254 Å²	254	131.3 Å²	131.3	96%	0.958	75%	0.745	S	S	*	*			trans	-126.5	56.8	161.6	-163.1	-179.7	-162.7	165.7	6.5	107.8
570	D	22.4	Very low	24.6	Very low	93 Å²	93	136.8 Å²	136.8	50%	0.497	75%	0.751	S	S	.	*			trans	-77.4	158.6	-174.8	-68.5	17.7	0	0	0	110.5	K568	K568-D570 VanDerWaalsContact CE-CG 3.43Å; K568-D570 WeakPolarHBondContact CE-OD2 3.45Å; K568-D570 HydrophobicContact CG-CB 3.9Å; K568-D570 VanDerWaalsContact CG-OD1 3.31Å; K568-D570 WeakPolarHBondContact CG-OD1 3.39Å; K568-D570 IonicContact NZ-OD2 3.55Å
571	Q	23.8	Very low	24.7	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	75%	0.752	S	S	*	*			trans	-61.3	152.5	175.4	-58.4	169.6	-13.1	0	0	111.9
572	P	22.1	Very low	25.2	Very low	131 Å²	131	135.5 Å²	135.5	85%	0.851	75%	0.754	S	S	*	*			trans	-76.8	113.9	137.2	31.9	-25.3	0	0	0	109.3
573	S	20.4	Very low	25.3	Very low	91 Å²	91	131.2 Å²	131.2	64%	0.636	75%	0.754	S	S	*	*			trans	-67.8	165	160.5	49	0	0	0	0	111
574	P	36.8	Very low	25.7	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	77%	0.766	S	S	*	*			trans	-72	-171.8	-175.9	30.8	-38.6	0	0	0	114.7
575	C	20.6	Very low	26.1	Very low	113 Å²	113	136.5 Å²	136.5	76%	0.764	77%	0.771	S	S	*	*			trans	91.9	149.1	174.2	-57.4	0	0	0	0	116
576	L	24.1	Very low	26.4	Very low	154 Å²	154	139.8 Å²	139.8	81%	0.806	77%	0.774	S	S	*	*			cis	-168	159.1	-9.2	-116.1	172.1	0	0	0	111.8
577	S	25.5	Very low	26.6	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	77%	0.771	S	S	*	*			trans	66.3	156.5	156.6	-132.2	0	0	0	0	118.7
578	S	28.7	Very low	26.8	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	78%	0.784	S	S	*	*			cis	-137.6	165.2	4.6	61.5	0	0	0	0	111
579	A	23.8	Very low	27.1	Very low	75 Å²	75	134.6 Å²	134.6	62%	0.62	79%	0.792	S	S	*	*			cis	-147.2	153.5	20.8	0	0	0	0	0	114.8
580	E	29.1	Very low	27.1	Very low	188 Å²	188	127.6 Å²	127.6	88%	0.879	78%	0.782	S	S	*	*				34.3	136.5	127.5	-63.3	172.8	164.6	0	0	119.5
581	D	24.7	Very low	27.8	Very low	152 Å²	152	128.6 Å²	128.6	81%	0.813	79%	0.794	S	S	*	*			cis	-159.3	172.1	6.3	177.6	40.5	0	0	0	111.4
582	S	32.6	Very low	28.5	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	80%	0.796	S	S	*	*			trans	109.6	111	167.5	71.3	0	0	0	0	114.7
583	G	27.3	Very low	30.2	Very low	73 Å²	73	127 Å²	127	75%	0.753	79%	0.789	S	S	*	*			trans	-137.2	154.7	-179	0	0	0	0	0	112.6
584	V	28.9	Very low	32.2	Very low	144 Å²	144	128.6 Å²	128.6	87%	0.873	79%	0.787	S	S	*	*			trans	-137.7	130.7	167.1	-170.5	0	0	0	0	106.5
585	E	31.2	Very low	34	Very low	191 Å²	191	128.2 Å²	128.2	89%	0.893	78%	0.783	S	S	*	*			trans	-82.9	128.9	165.7	-79.6	-166.4	148.6	0	0	109.5
586	E	31.6	Very low	37.1	Very low	196 Å²	196	124.4 Å²	124.4	92%	0.916	75%	0.754	S	S	*	*			trans	-131.5	141.4	140.1	-73.4	-159	139.3	0	0	108.4
587	G	26.5	Very low	39.9	Very low	69 Å²	69	122.8 Å²	122.8	71%	0.711	75%	0.753	S	S	*	*			trans	-148.3	123.5	-177.1	0	0	0	0	0	112.3
588	Q	29.7	Very low	42.8	Very low	201 Å²	201	118.1 Å²	118.1	94%	0.939	72%	0.72	S	S	*	*			trans	-158	148.6	155.3	-108.4	156.6	56.7	0	0	108.8
589	G	30.1	Very low	45.6	Very low	82 Å²	82	115.4 Å²	115.4	85%	0.845	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-87	131.5	-166.1	0	0	0	0	0	114.2
590	S	29.2	Very low	48.5	Very low	108 Å²	108	114.2 Å²	114.2	76%	0.755	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-75.5	152.7	165.4	-62	0	0	0	0	111.6
591	P	37.6	Very low	51.1	Low	114 Å²	114	116.1 Å²	116.1	74%	0.74	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-64.2	158.8	170.7	29.6	-35.7	0	0	0	111.3	E593	P591-E593 PolarHBondContact O-N 3.01Å; P591-E593 VanDerWaalsContact O-N 3.09Å
592	S	38.8	Very low	54	Low	122 Å²	122	110.4 Å²	110.4	85%	0.853	65%	0.646	S	S	*	*			trans	-61.1	110.9	-179.9	52.8	0	0	0	0	111.7	M594	S592-M594 PolarHBondContact O-N 3.21Å
593	E	57.3	Low	56.5	Low	147 Å²	147	108.3 Å²	108.3	69%	0.687	63%	0.626	S	S	*	*			trans	-69.1	116.5	176.2	-65.9	-169.7	131.8	0	0	110.6	P591 T595	P591-E593 PolarHBondContact O-N 3.01Å; P591-E593 VanDerWaalsContact O-N 3.09Å; E593-T595 PolarHBondContact O-N 2.84Å
594	M	62.7	Low	59.4	Low	123 Å²	123	111.3 Å²	111.3	61%	0.606	63%	0.625	S	S	*	*			trans	-61.5	121.5	169.8	-155.6	83.6	153.9	0	0	108	S592 L707	S592-M594 PolarHBondContact O-N 3.21Å; M594-L707 HydrophobicContact CB-CD1 4.26Å; M594-L707 VanDerWaalsContact O-CD1 3.29Å; M594-L707 WeakPolarHBondContact O-CD1 3.36Å
595	T	73.4	Confident	62.1	Low	107 Å²	107	110.1 Å²	110.1	66%	0.656	61%	0.614	S	S	*	*			trans	-122.4	135.7	-177.7	40.5	0	0	0	0	109.7	E593	E593-T595 PolarHBondContact O-N 2.84Å
596	H	86.7	Confident	64.6	Low	32 Å²	32	103 Å²	103	15%	0.148	58%	0.581	C	S	.	*			trans	-123.8	147.8	-175.6	-160.3	-102.5	0	0	0	111	S598 E599 D701 L707	H596-S598 PolarHBondContact ND1-N 2.88Å; H596-S598 PolarHBondContact ND1-OG 2.9Å; H596-S598 PolarHBondContact O-N 2.86Å; H596-E599 VanDerWaalsContact O-CB 3.28Å; H596-E599 WeakPolarHBondContact O-CB 3.42Å; H596-E599 PolarHBondContact O-N 3.44Å; H596-D701 IonicContact CE1-OD2 3.89Å; H596-D701 PolarHBondContact CE1-OD2 3.45Å; H596-D701 IonicContact NE2-OD1 2.71Å; H596-D701 IonicContact NE2-OD2 3.61Å; H596-D701 PolarHBondContact NE2-OD2 2.9Å; H596-L707 HydrophobicContact CB-CD2 3.36Å
597	P	83.1	Confident	67.3	Low	121 Å²	121	96.2 Å²	96.2	79%	0.786	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.9	175.4	-27.2	36.4	0	0	0	115.1
598	S	84.9	Confident	70.2	Confident	16 Å²	16	97.7 Å²	97.7	11%	0.112	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.9	175.6	-46.7	0	0	0	0	114.3	H596 F600 R627	H596-S598 PolarHBondContact ND1-N 2.88Å; H596-S598 PolarHBondContact ND1-OG 2.9Å; H596-S598 PolarHBondContact O-N 2.86Å; S598-F600 PolarHBondContact O-N 3.25Å; S598-R627 WeakPolarHBondContact CB-O 3.38Å; S598-R627 WeakPolarHBondContact O-CB 3.43Å; S598-R627 PolarHBondContact O-N 3.39Å
599	E	87.7	Confident	72.9	Confident	50 Å²	50	90.4 Å²	90.4	23%	0.234	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	114.4	174.8	-176.1	169.2	165.5	0	0	110.4	H596 R601 K624	H596-E599 VanDerWaalsContact O-CB 3.28Å; H596-E599 WeakPolarHBondContact O-CB 3.42Å; H596-E599 PolarHBondContact O-N 3.44Å; E599-R601 PolarHBondContact O-N 2.79Å; E599-K624 VanDerWaalsContact CD-CD 3.49Å; E599-K624 VanDerWaalsContact CD-CE 3.45Å; E599-K624 HydrophobicContact CG-CD 3.95Å; E599-K624 HydrophobicContact CG-CG 4.06Å; E599-K624 WeakPolarHBondContact OE1-CD 3.39Å; E599-K624 WeakPolarHBondContact OE1-CE 3.29Å; E599-K624 IonicContact OE1-NZ 3.24Å; E599-K624 PolarHBondContact OE1-NZ 2.85Å; E599-K624 IonicContact OE2-NZ 3.56Å; E599-K624 PolarHBondContact OE2-NZ 3.44Å
600	F	84.4	Confident	75.7	Confident	50 Å²	50	86.5 Å²	86.5	22%	0.219	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.7	-179.7	-173.3	-87.7	0	0	0	109.9	S598 V602 M625 Y641	S598-F600 PolarHBondContact O-N 3.25Å; F600-V602 HydrophobicContact CD1-CG2 3.87Å; F600-V602 HydrophobicContact CE1-CG2 4.28Å; F600-V602 PolarHBondContact O-N 2.83Å; F600-M625 HydrophobicContact CB-CB 4.19Å; F600-M625 HydrophobicContact CB-CG 4.1Å; F600-M625 HydrophobicContact CB-SD 4.42Å; F600-M625 HydrophobicContact CD1-CE 4.45Å; F600-M625 HydrophobicContact CD1-CG 4.33Å; F600-M625 HydrophobicContact CD1-SD 3.59Å; F600-M625 VanDerWaalsContact CD1-SD 3.59Å; F600-M625 HydrophobicContact CE1-SD 4.19Å; F600-M625 HydrophobicContact CG-SD 4.22Å; F600-M625 PolarHBondContact N-O 2.95Å; F600-Y641 HydrophobicContact CD2-CE1 4.3Å
601	R	84.2	Confident	78.6	Confident	227 Å²	227	85.8 Å²	85.8	86%	0.857	45%	0.454	S	S	*	.			trans	-76.1	90.1	177.5	-63.8	-169.2	69.6	-150.6	-1.8	110.5	E599 D603	E599-R601 PolarHBondContact O-N 2.79Å; R601-D603 PolarHBondContact O-N 2.72Å
602	V	85.3	Confident	80.9	Confident	32 Å²	32	85.6 Å²	85.6	19%	0.194	45%	0.445	C	S	.	.			trans	-58.4	120.1	171.9	-176	0	0	0	0	109.6	F600 H606 L607 L610 L622 M625	F600-V602 HydrophobicContact CD1-CG2 3.87Å; F600-V602 HydrophobicContact CE1-CG2 4.28Å; F600-V602 PolarHBondContact O-N 2.83Å; V602-H606 HydrophobicContact CG1-CB 3.72Å; V602-L607 HydrophobicContact CG1-CB 3.87Å; V602-L607 VanDerWaalsContact CG1-N 3.32Å; V602-L610 HydrophobicContact CG1-CD1 4.06Å; V602-L610 HydrophobicContact CG2-CD1 4.25Å; V602-L622 HydrophobicContact CB-CD2 3.69Å; V602-L622 HydrophobicContact CG1-CD2 3.78Å; V602-L622 HydrophobicContact CG2-CD2 3.8Å; V602-M625 HydrophobicContact CG2-CB 3.73Å; V602-M625 HydrophobicContact CG2-CG 4.38Å; V602-M625 HydrophobicContact CG2-SD 3.69Å
603	D	86.8	Confident	83	Confident	69 Å²	69	83.1 Å²	83.1	37%	0.369	42%	0.42	S	S	.	.			trans	-87.7	172.7	169	75.4	27.6	0	0	0	111.6	R601 N605 H606 L607	R601-D603 PolarHBondContact O-N 2.72Å; D603-N605 PolarHBondContact O-N 2.8Å; D603-N605 VanDerWaalsContact O-N 3.12Å; D603-N605 WeakPolarHBondContact OD1-CA 3.46Å; D603-N605 VanDerWaalsContact OD1-CB 3.3Å; D603-N605 WeakPolarHBondContact OD1-CB 3.28Å; D603-N605 PolarHBondContact OD1-N 3.04Å; D603-N605 PolarHBondContact OD1-ND2 2.95Å; D603-H606 PolarHBondContact O-N 3.32Å; D603-H606 VanDerWaalsContact O-N 3.11Å; D603-H606 IonicContact OD1-CE1 2.29Å; D603-H606 IonicContact OD1-CG 2.66Å; D603-H606 PolarHBondContact OD1-N 3.03Å; D603-H606 IonicContact OD1-ND1 2.68Å; D603-H606 PolarHBondContact OD1-ND1 3.04Å; D603-H606 IonicContact OD2-CE1 3.81Å; D603-H606 IonicContact OD2-ND1 2.62Å; D603-H606 PolarHBondContact OD2-ND1 3.13Å; D603-L607 WeakPolarHBondContact O-CB 3.22Å; D603-L607 PolarHBondContact O-N 2.87Å
604	N	87.9	Confident	84.6	Confident	137 Å²	137	76.4 Å²	76.4	73%	0.733	39%	0.389	S	S	*	.	H	α-helix	trans	-59	-27.2	-177.2	-64.1	1.1	0	0	0	114	L608	N604-L608 WeakPolarHBondContact O-CB 3.35Å; N604-L608 PolarHBondContact O-N 3.39Å; N604-L608 VanDerWaalsContact O-N 3.12Å
605	N	84.8	Confident	86.1	Confident	119 Å²	119	71.9 Å²	71.9	64%	0.636	37%	0.366	S	S	*	.	H	α-helix	trans	-76.9	-43.6	177.4	-47.6	-70.4	0	0	0	110.3	D603 L607 L608 L609	D603-N605 PolarHBondContact O-N 2.8Å; D603-N605 VanDerWaalsContact O-N 3.12Å; D603-N605 WeakPolarHBondContact OD1-CA 3.46Å; D603-N605 VanDerWaalsContact OD1-CB 3.3Å; D603-N605 WeakPolarHBondContact OD1-CB 3.28Å; D603-N605 PolarHBondContact OD1-N 3.04Å; D603-N605 PolarHBondContact OD1-ND2 2.95Å; N605-L607 VanDerWaalsContact C-N 3.33Å; N605-L608 PolarHBondContact O-N 3.38Å; N605-L609 VanDerWaalsContact O-CB 3.24Å; N605-L609 WeakPolarHBondContact O-CB 3.34Å; N605-L609 PolarHBondContact O-N 2.94Å
606	H	84.4	Confident	86.9	Confident	42 Å²	42	72.9 Å²	72.9	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-66.1	-35.6	174.8	-65.5	81.5	0	0	0	111.3	V602 D603 L609 L610	V602-H606 HydrophobicContact CG1-CB 3.72Å; D603-H606 PolarHBondContact O-N 3.32Å; D603-H606 VanDerWaalsContact O-N 3.11Å; D603-H606 IonicContact OD1-CE1 2.29Å; D603-H606 IonicContact OD1-CG 2.66Å; D603-H606 PolarHBondContact OD1-N 3.03Å; D603-H606 IonicContact OD1-ND1 2.68Å; D603-H606 PolarHBondContact OD1-ND1 3.04Å; D603-H606 IonicContact OD2-CE1 3.81Å; D603-H606 IonicContact OD2-ND1 2.62Å; D603-H606 PolarHBondContact OD2-ND1 3.13Å; H606-L609 WeakPolarHBondContact O-CB 3.44Å; H606-L609 PolarHBondContact O-N 3.04Å; H606-L610 VanDerWaalsContact O-CG 3.25Å; H606-L610 WeakPolarHBondContact O-CG 3.29Å; H606-L610 PolarHBondContact O-N 2.92Å
607	L	88.7	Confident	86.9	Confident	52 Å²	52	76 Å²	76	27%	0.272	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-50.6	173.9	177.6	58.7	0	0	0	111	V602 D603 N605 L609 L610 M611 F615 L622	V602-L607 HydrophobicContact CG1-CB 3.87Å; V602-L607 VanDerWaalsContact CG1-N 3.32Å; D603-L607 WeakPolarHBondContact O-CB 3.22Å; D603-L607 PolarHBondContact O-N 2.87Å; N605-L607 VanDerWaalsContact C-N 3.33Å; L607-L609 PolarHBondContact O-N 3.43Å; L607-L610 PolarHBondContact O-N 3.06Å; L607-L610 VanDerWaalsContact O-N 3.13Å; L607-M611 HydrophobicContact CD1-CG 4.3Å; L607-M611 HydrophobicContact CD1-SD 4.34Å; L607-M611 HydrophobicContact CG-SD 4.1Å; L607-M611 VanDerWaalsContact O-CG 3.32Å; L607-M611 WeakPolarHBondContact O-CG 3.43Å; L607-M611 PolarHBondContact O-N 3.48Å; L607-F615 HydrophobicContact CD1-CE2 4.45Å; L607-F615 HydrophobicContact CD1-CZ 4.03Å; L607-L622 HydrophobicContact CD1-CB 3.85Å; L607-L622 HydrophobicContact CD1-CD2 3.98Å
608	L	86.4	Confident	86.7	Confident	100 Å²	100	78.3 Å²	78.3	52%	0.524	38%	0.378	S	S	.	.	H	α-helix	trans	-57.1	-40	175.7	-179.9	63	0	0	0	111.9	N604 N605 M611 I612	N604-L608 WeakPolarHBondContact O-CB 3.35Å; N604-L608 PolarHBondContact O-N 3.39Å; N604-L608 VanDerWaalsContact O-N 3.12Å; N605-L608 PolarHBondContact O-N 3.38Å; L608-M611 PolarHBondContact O-N 3.25Å; L608-I612 HydrophobicContact CD1-CD1 3.86Å; L608-I612 HydrophobicContact CD1-CG1 4.36Å; L608-I612 HydrophobicContact CG-CD1 3.83Å; L608-I612 WeakPolarHBondContact O-CD1 3.37Å; L608-I612 VanDerWaalsContact O-CG1 3.22Å; L608-I612 WeakPolarHBondContact O-CG1 3.47Å; L608-I612 PolarHBondContact O-N 3.48Å
609	L	86	Confident	86.7	Confident	48 Å²	48	85.5 Å²	85.5	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-65.6	-37.8	177.7	-170.3	69.3	0	0	0	112.6	N605 H606 L607 H613 P660 Y661	N605-L609 VanDerWaalsContact O-CB 3.24Å; N605-L609 WeakPolarHBondContact O-CB 3.34Å; N605-L609 PolarHBondContact O-N 2.94Å; H606-L609 WeakPolarHBondContact O-CB 3.44Å; H606-L609 PolarHBondContact O-N 3.04Å; L607-L609 PolarHBondContact O-N 3.43Å; L609-H613 WeakPolarHBondContact O-CB 3.47Å; L609-H613 PolarHBondContact O-CD2 3.23Å; L609-H613 VanDerWaalsContact O-CD2 3.32Å; L609-H613 PolarHBondContact O-N 2.94Å; L609-H613 VanDerWaalsContact O-N 3.15Å; L609-P660 HydrophobicContact CD1-CG 3.78Å; L609-P660 HydrophobicContact CD2-CB 4.47Å; L609-P660 HydrophobicContact CD2-CG 3.58Å; L609-P660 HydrophobicContact CG-CG 3.82Å; L609-Y661 HydrophobicContact CD2-CE2 4.1Å
610	L	90.3	Very high	86.9	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-69.8	-41.7	172.5	-69.3	169.8	0	0	0	111.6	V602 H606 L607 I612 H613 V614 F615 M625 L643 L652 Y661	V602-L610 HydrophobicContact CG1-CD1 4.06Å; V602-L610 HydrophobicContact CG2-CD1 4.25Å; H606-L610 VanDerWaalsContact O-CG 3.25Å; H606-L610 WeakPolarHBondContact O-CG 3.29Å; H606-L610 PolarHBondContact O-N 2.92Å; L607-L610 PolarHBondContact O-N 3.06Å; L607-L610 VanDerWaalsContact O-N 3.13Å; L610-I612 VanDerWaalsContact C-N 3.26Å; L610-I612 PolarHBondContact O-N 3.41Å; L610-H613 PolarHBondContact O-N 2.78Å; L610-V614 HydrophobicContact CD2-CB 4.03Å; L610-V614 HydrophobicContact CD2-CG1 4.39Å; L610-V614 HydrophobicContact CD2-CG2 3.69Å; L610-V614 WeakPolarHBondContact O-CA 3.5Å; L610-V614 WeakPolarHBondContact O-CB 3.21Å; L610-V614 PolarHBondContact O-N 3.49Å; L610-F615 HydrophobicContact CB-CD1 4.2Å; L610-F615 HydrophobicContact CB-CE1 3.77Å; L610-F615 HydrophobicContact CB-CZ 4.43Å; L610-F615 PolarHBondContact O-N 3.32Å; L610-M625 HydrophobicContact CD1-SD 4.28Å; L610-L643 HydrophobicContact CD1-CD1 3.98Å; L610-L643 HydrophobicContact CD1-CD2 4.4Å; L610-L643 HydrophobicContact CD2-CD2 4.17Å; L610-L652 HydrophobicContact CD2-CD1 4.02Å; L610-Y661 HydrophobicContact CD2-CD2 3.53Å; L610-Y661 HydrophobicContact CD2-CE2 3.61Å; L610-Y661 HydrophobicContact CD2-CG 4.2Å; L610-Y661 HydrophobicContact CG-CD2 4.39Å; L610-Y661 HydrophobicContact CG-CE2 4.1Å
611	M	89.1	Confident	87.2	Confident	94 Å²	94	86.5 Å²	86.5	46%	0.463	42%	0.415	S	S	.	.	H	α-helix	trans	-61.6	-31.7	175.3	-68.1	173.8	79	0	0	112.9	L607 L608 F615	L607-M611 HydrophobicContact CD1-CG 4.3Å; L607-M611 HydrophobicContact CD1-SD 4.34Å; L607-M611 HydrophobicContact CG-SD 4.1Å; L607-M611 VanDerWaalsContact O-CG 3.32Å; L607-M611 WeakPolarHBondContact O-CG 3.43Å; L607-M611 PolarHBondContact O-N 3.48Å; L608-M611 PolarHBondContact O-N 3.25Å; M611-F615 HydrophobicContact CB-CD2 4.26Å; M611-F615 HydrophobicContact CG-CD2 3.67Å; M611-F615 HydrophobicContact CG-CE2 3.52Å; M611-F615 HydrophobicContact CG-CG 4.45Å; M611-F615 HydrophobicContact CG-CZ 4.19Å
612	I	85.1	Confident	87.6	Confident	109 Å²	109	78 Å²	78	56%	0.559	39%	0.387	S	S	*	.	H	α-helix	trans	-85.9	-29.2	-179.5	-66	166.4	0	0	0	112.8	L608 L610	L608-I612 HydrophobicContact CD1-CD1 3.86Å; L608-I612 HydrophobicContact CD1-CG1 4.36Å; L608-I612 HydrophobicContact CG-CD1 3.83Å; L608-I612 WeakPolarHBondContact O-CD1 3.37Å; L608-I612 VanDerWaalsContact O-CG1 3.22Å; L608-I612 WeakPolarHBondContact O-CG1 3.47Å; L608-I612 PolarHBondContact O-N 3.48Å; L610-I612 VanDerWaalsContact C-N 3.26Å; L610-I612 PolarHBondContact O-N 3.41Å
613	H	84.7	Confident	87.9	Confident	71 Å²	71	78.8 Å²	78.8	33%	0.329	39%	0.388	S	S	.	.	H	α-helix	trans	-122.9	-14.1	-169	-60.3	-52.7	0	0	0	116.4	L609 L610	L609-H613 WeakPolarHBondContact O-CB 3.47Å; L609-H613 PolarHBondContact O-CD2 3.23Å; L609-H613 VanDerWaalsContact O-CD2 3.32Å; L609-H613 PolarHBondContact O-N 2.94Å; L609-H613 VanDerWaalsContact O-N 3.15Å; L610-H613 PolarHBondContact O-N 2.78Å
614	V	90.3	Very high	88.3	Confident	5 Å²	5	76.6 Å²	76.6	3%	0.03	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-48.3	-172.4	173.7	0	0	0	0	112.4	L610 L643 Y650 L652 Y661 V663	L610-V614 HydrophobicContact CD2-CB 4.03Å; L610-V614 HydrophobicContact CD2-CG1 4.39Å; L610-V614 HydrophobicContact CD2-CG2 3.69Å; L610-V614 WeakPolarHBondContact O-CA 3.5Å; L610-V614 WeakPolarHBondContact O-CB 3.21Å; L610-V614 PolarHBondContact O-N 3.49Å; V614-L643 HydrophobicContact CG1-CD2 3.76Å; V614-Y650 HydrophobicContact CG1-CD1 3.63Å; V614-Y650 HydrophobicContact CG1-CD2 4.26Å; V614-Y650 HydrophobicContact CG1-CE1 4.01Å; V614-Y650 HydrophobicContact CG1-CG 3.81Å; V614-Y650 WeakPolarHBondContact O-CE1 3.34Å; V614-L652 HydrophobicContact CG1-CD1 4.19Å; V614-L652 HydrophobicContact CG1-CD2 3.76Å; V614-L652 HydrophobicContact CG2-CD1 4.35Å; V614-L652 HydrophobicContact CG2-CD2 4.12Å; V614-Y661 HydrophobicContact CG2-CD2 4.38Å; V614-Y661 HydrophobicContact CG2-CG 4.43Å; V614-V663 HydrophobicContact CB-CG2 4.23Å; V614-V663 HydrophobicContact CG1-CG2 4.04Å; V614-V663 HydrophobicContact CG2-CG2 3.97Å
615	F	93.5	Very high	88.6	Confident	28 Å²	28	70.1 Å²	70.1	12%	0.123	34%	0.34	C	S	.	.			trans	-61.2	148.9	-177.3	-70.7	16.8	0	0	0	110.9	L607 L610 M611 E620 L622 L643 T645	L607-F615 HydrophobicContact CD1-CE2 4.45Å; L607-F615 HydrophobicContact CD1-CZ 4.03Å; L610-F615 HydrophobicContact CB-CD1 4.2Å; L610-F615 HydrophobicContact CB-CE1 3.77Å; L610-F615 HydrophobicContact CB-CZ 4.43Å; L610-F615 PolarHBondContact O-N 3.32Å; M611-F615 HydrophobicContact CB-CD2 4.26Å; M611-F615 HydrophobicContact CG-CD2 3.67Å; M611-F615 HydrophobicContact CG-CE2 3.52Å; M611-F615 HydrophobicContact CG-CG 4.45Å; M611-F615 HydrophobicContact CG-CZ 4.19Å; F615-E620 WeakPolarHBondContact CA-OE2 3.42Å; F615-E620 HydrophobicContact CB-CB 4.42Å; F615-E620 WeakPolarHBondContact CB-OE2 3.45Å; F615-E620 HydrophobicContact CD2-CB 3.8Å; F615-E620 HydrophobicContact CD2-CG 4Å; F615-E620 WeakPolarHBondContact CD2-O 3.27Å; F615-E620 HydrophobicContact CE2-CB 4.41Å; F615-E620 HydrophobicContact CE2-CG 4.41Å; F615-E620 WeakPolarHBondContact CE2-O 3.34Å; F615-E620 HydrophobicContact CG-CB 4.3Å; F615-E620 HydrophobicContact CG-CG 4.21Å; F615-L622 HydrophobicContact CZ-CB 4.21Å; F615-L643 HydrophobicContact CE1-CD2 4.09Å; F615-T645 HydrophobicContact CD1-CG2 4.39Å; F615-T645 HydrophobicContact CE1-CG2 4.01Å; F615-T645 HydrophobicContact CZ-CG2 4.27Å
616	R	90.9	Very high	89	Confident	129 Å²	129	64.4 Å²	64.4	49%	0.487	31%	0.31	S	S	.	.			trans	-107.4	-33.6	-178	-72.5	-178.9	173	-176.4	2.6	112.7	E620 Y648 Y650	R616-E620 PolarHBondContact N-OE2 2.95Å; R616-Y648 HydrophobicContact CB-CE2 4.36Å; R616-Y650 HydrophobicContact CG-CE1 4.16Å; R616-Y650 PolarHBondContact N-OH 2.86Å
617	E	87.6	Confident	89.3	Confident	98 Å²	98	65.1 Å²	65.1	46%	0.458	31%	0.311	S	S	.	.	S	Bend	trans	-104.5	143.2	-179.7	-48.6	-56.4	151	0	0	111.4	E619 E620 Y648	E617-E619 PolarHBondContact O-N 3.4Å; E617-E619 VanDerWaalsContact O-N 3.16Å; E617-E620 HydrophobicContact CB-CB 4.17Å; E617-E620 PolarHBondContact N-OE2 2.92Å; E617-E620 VanDerWaalsContact O-CB 3.31Å; E617-E620 WeakPolarHBondContact O-CB 3.49Å; E617-E620 PolarHBondContact O-N 2.98Å; E617-Y648 HydrophobicContact CG-CE2 4.21Å
618	N	78	Confident	89.4	Confident	168 Å²	168	63 Å²	63	90%	0.898	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.3	-173.7	-66.2	-69.4	0	0	0	114.6
619	E	85.4	Confident	89.5	Confident	167 Å²	167	58.9 Å²	58.9	78%	0.78	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	7.8	-179.2	-59.5	-170.2	161	0	0	112.7	E617 Q621	E617-E619 PolarHBondContact O-N 3.4Å; E617-E619 VanDerWaalsContact O-N 3.16Å; E619-Q621 PolarHBondContact O-NE2 3.37Å
620	E	90.9	Very high	89.7	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.019	27%	0.273	C	S	.	.			trans	-58.6	132.1	-177	-174.4	165.7	-165.2	0	0	112.8	F615 R616 E617 T645 Y648 Y650	F615-E620 WeakPolarHBondContact CA-OE2 3.42Å; F615-E620 HydrophobicContact CB-CB 4.42Å; F615-E620 WeakPolarHBondContact CB-OE2 3.45Å; F615-E620 HydrophobicContact CD2-CB 3.8Å; F615-E620 HydrophobicContact CD2-CG 4Å; F615-E620 WeakPolarHBondContact CD2-O 3.27Å; F615-E620 HydrophobicContact CE2-CB 4.41Å; F615-E620 HydrophobicContact CE2-CG 4.41Å; F615-E620 WeakPolarHBondContact CE2-O 3.34Å; F615-E620 HydrophobicContact CG-CB 4.3Å; F615-E620 HydrophobicContact CG-CG 4.21Å; R616-E620 PolarHBondContact N-OE2 2.95Å; E617-E620 HydrophobicContact CB-CB 4.17Å; E617-E620 PolarHBondContact N-OE2 2.92Å; E617-E620 VanDerWaalsContact O-CB 3.31Å; E617-E620 WeakPolarHBondContact O-CB 3.49Å; E617-E620 PolarHBondContact O-N 2.98Å; E620-T645 HydrophobicContact CG-CG2 3.83Å; E620-T645 WeakPolarHBondContact OE1-CB 3.37Å; E620-T645 WeakPolarHBondContact OE1-CG2 3.41Å; E620-T645 PolarHBondContact OE1-OG1 2.83Å; E620-Y648 WeakPolarHBondContact OE1-CD2 3.45Å; E620-Y650 WeakPolarHBondContact OE1-CE2 3.5Å; E620-Y650 PolarHBondContact OE1-OH 2.84Å; E620-Y650 PolarHBondContact OE2-OH 2.88Å
621	Q	90.4	Very high	89.4	Confident	117 Å²	117	58.4 Å²	58.4	55%	0.547	28%	0.282	S	S	.	.			trans	-107.6	133.4	-175.9	-60.3	-56.3	-56.9	0	0	112.5	E619 F623 T645 D646	E619-Q621 PolarHBondContact O-NE2 3.37Å; Q621-F623 PolarHBondContact O-N 2.62Å; Q621-T645 CarbonylContact O-C 3.45Å; Q621-T645 WeakPolarHBondContact O-CA 3.32Å; Q621-T645 VanDerWaalsContact O-CB 3.22Å; Q621-T645 WeakPolarHBondContact O-CB 3.5Å; Q621-D646 HydrophobicContact CB-CB 4.47Å; Q621-D646 WeakPolarHBondContact CB-OD2 3.47Å; Q621-D646 WeakPolarHBondContact CG-OD2 3.4Å; Q621-D646 VanDerWaalsContact N-CG 3.29Å; Q621-D646 PolarHBondContact N-OD1 3.28Å; Q621-D646 PolarHBondContact N-OD2 2.9Å; Q621-D646 VanDerWaalsContact N-OD2 3.16Å; Q621-D646 PolarHBondContact O-N 2.75Å
622	L	93.2	Very high	89.3	Confident	50 Å²	50	54 Å²	54	26%	0.262	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	124.8	171.7	178.2	60.2	0	0	0	111.1	V602 L607 F615 L643	V602-L622 HydrophobicContact CB-CD2 3.69Å; V602-L622 HydrophobicContact CG1-CD2 3.78Å; V602-L622 HydrophobicContact CG2-CD2 3.8Å; L607-L622 HydrophobicContact CD1-CB 3.85Å; L607-L622 HydrophobicContact CD1-CD2 3.98Å; F615-L622 HydrophobicContact CZ-CB 4.21Å; L622-L643 HydrophobicContact CD1-CD1 3.45Å; L622-L643 VanDerWaalsContact CD1-CD1 3.45Å; L622-L643 HydrophobicContact CD1-CG 4.32Å
623	F	92.6	Very high	89.3	Confident	47 Å²	47	49.3 Å²	49.3	21%	0.206	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-59.1	167.1	-177.6	-85.9	0	0	0	112	Q621 L644 S711 S714 A715 K718	Q621-F623 PolarHBondContact O-N 2.62Å; F623-L644 WeakPolarHBondContact CA-O 3.28Å; F623-L644 HydrophobicContact CB-CB 4.24Å; F623-L644 WeakPolarHBondContact CB-O 3.01Å; F623-L644 HydrophobicContact CD1-CB 4.27Å; F623-L644 HydrophobicContact CD1-CD1 4.39Å; F623-L644 PolarHBondContact N-O 2.79Å; F623-S711 WeakPolarHBondContact CE1-O 3.47Å; F623-S714 WeakPolarHBondContact CE2-OG 3.35Å; F623-S714 VanDerWaalsContact CZ-CB 3.46Å; F623-S714 WeakPolarHBondContact CZ-OG 3.45Å; F623-A715 HydrophobicContact CB-CB 3.88Å; F623-A715 HydrophobicContact CD1-CB 3.82Å; F623-A715 HydrophobicContact CD2-CB 3.87Å; F623-A715 HydrophobicContact CE1-CB 4.42Å; F623-A715 HydrophobicContact CE2-CB 4.42Å; F623-A715 HydrophobicContact CG-CB 3.55Å; F623-K718 HydrophobicContact CD2-CD 3.95Å; F623-K718 HydrophobicContact CE2-CD 3.8Å
624	K	93.9	Very high	89.2	Confident	23 Å²	23	50 Å²	50	10%	0.1	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	151.5	-178.7	-168	166.7	-71.8	-149	0	111.6	E599 I626 L644	E599-K624 VanDerWaalsContact CD-CD 3.49Å; E599-K624 VanDerWaalsContact CD-CE 3.45Å; E599-K624 HydrophobicContact CG-CD 3.95Å; E599-K624 HydrophobicContact CG-CG 4.06Å; E599-K624 WeakPolarHBondContact OE1-CD 3.39Å; E599-K624 WeakPolarHBondContact OE1-CE 3.29Å; E599-K624 IonicContact OE1-NZ 3.24Å; E599-K624 PolarHBondContact OE1-NZ 2.85Å; E599-K624 IonicContact OE2-NZ 3.56Å; E599-K624 PolarHBondContact OE2-NZ 3.44Å; K624-I626 HydrophobicContact CD-CD1 4.09Å; K624-I626 HydrophobicContact CD-CG1 4.07Å; K624-I626 HydrophobicContact CG-CD1 4.33Å; K624-I626 HydrophobicContact CG-CG1 3.91Å; K624-L644 PolarHBondContact N-O 2.91Å; K624-L644 VanDerWaalsContact N-O 3.13Å; K624-L644 PolarHBondContact O-N 3Å
625	M	93.6	Very high	88.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.6	171.8	-168.7	173	179.2	0	0	109.3	F600 V602 L610 Y641 L643 L652 Y661	F600-M625 HydrophobicContact CB-CB 4.19Å; F600-M625 HydrophobicContact CB-CG 4.1Å; F600-M625 HydrophobicContact CB-SD 4.42Å; F600-M625 HydrophobicContact CD1-CE 4.45Å; F600-M625 HydrophobicContact CD1-CG 4.33Å; F600-M625 HydrophobicContact CD1-SD 3.59Å; F600-M625 VanDerWaalsContact CD1-SD 3.59Å; F600-M625 HydrophobicContact CE1-SD 4.19Å; F600-M625 HydrophobicContact CG-SD 4.22Å; F600-M625 PolarHBondContact N-O 2.95Å; V602-M625 HydrophobicContact CG2-CB 3.73Å; V602-M625 HydrophobicContact CG2-CG 4.38Å; V602-M625 HydrophobicContact CG2-SD 3.69Å; L610-M625 HydrophobicContact CD1-SD 4.28Å; M625-Y641 HydrophobicContact CE-CD1 3.73Å; M625-Y641 HydrophobicContact CE-CD2 4.45Å; M625-Y641 HydrophobicContact CE-CG 3.67Å; M625-L643 HydrophobicContact CB-CD1 3.75Å; M625-L643 HydrophobicContact CG-CD1 3.82Å; M625-L643 HydrophobicContact SD-CD1 4.12Å; M625-L652 HydrophobicContact CE-CD1 4.35Å; M625-Y661 HydrophobicContact CE-CD1 4.47Å; M625-Y661 HydrophobicContact CE-CE1 3.74Å
626	I	93.9	Very high	87.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.3	-172.4	-56.8	177.9	0	0	0	109	K624 M628 Y641 V642 L644 L704 F708	K624-I626 HydrophobicContact CD-CD1 4.09Å; K624-I626 HydrophobicContact CD-CG1 4.07Å; K624-I626 HydrophobicContact CG-CD1 4.33Å; K624-I626 HydrophobicContact CG-CG1 3.91Å; I626-M628 HydrophobicContact CG2-CG 3.97Å; I626-M628 HydrophobicContact CG2-SD 4.37Å; I626-Y641 CarbonylContact O-C 3.59Å; I626-Y641 WeakPolarHBondContact O-CA 3.43Å; I626-V642 PolarHBondContact N-O 2.73Å; I626-V642 PolarHBondContact O-N 3.23Å; I626-L644 HydrophobicContact CD1-CD1 4.45Å; I626-L704 HydrophobicContact CG2-CD1 3.62Å; I626-F708 HydrophobicContact CD1-CD2 4.19Å
627	R	90.2	Very high	87.3	Confident	57 Å²	57	50.1 Å²	50.1	22%	0.215	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	126.2	176.4	-171.5	-173	68.5	179.2	-1	110.2	S598 L639 Y641	S598-R627 WeakPolarHBondContact CB-O 3.38Å; S598-R627 WeakPolarHBondContact O-CB 3.43Å; S598-R627 PolarHBondContact O-N 3.39Å; R627-L639 HydrophobicContact CG-CD1 3.82Å; R627-L639 HydrophobicContact CG-CD2 4.33Å; R627-L639 HydrophobicContact CG-CG 4.3Å; R627-Y641 HydrophobicContact CB-CD1 4.12Å; R627-Y641 HydrophobicContact CB-CE1 4.16Å; R627-Y641 HydrophobicContact CG-CD1 4.24Å; R627-Y641 HydrophobicContact CG-CE1 3.96Å
628	M	91.5	Very high	87	Confident	7 Å²	7	49.1 Å²	49.1	3%	0.034	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	-169.3	-177.6	-56.9	-171.7	69.2	0	0	109.7	I626 L640 V642 L697 T699 F708	I626-M628 HydrophobicContact CG2-CG 3.97Å; I626-M628 HydrophobicContact CG2-SD 4.37Å; M628-L640 CarbonylContact C-O 3.58Å; M628-L640 PolarHBondContact N-O 3.49Å; M628-L640 PolarHBondContact O-N 3.41Å; M628-V642 HydrophobicContact CB-CG2 4.34Å; M628-V642 HydrophobicContact CG-CG2 4.16Å; M628-V642 HydrophobicContact SD-CB 4.18Å; M628-V642 HydrophobicContact SD-CG2 3.63Å; M628-L697 HydrophobicContact CE-CB 3.78Å; M628-L697 HydrophobicContact CE-CD1 4.5Å; M628-L697 HydrophobicContact SD-CB 4.44Å; M628-L697 HydrophobicContact SD-CD1 4.38Å; M628-T699 HydrophobicContact CE-CG2 3.42Å; M628-T699 VanDerWaalsContact CE-CG2 3.42Å; M628-F708 HydrophobicContact SD-CD2 4.15Å; M628-F708 HydrophobicContact SD-CG 4.35Å
629	S	89.5	Confident	87.3	Confident	14 Å²	14	42.5 Å²	42.5	10%	0.098	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	171	177.3	39.2	0	0	0	0	113.1	Q638 D698	S629-Q638 CarbonylContact C-O 3.58Å; S629-Q638 WeakPolarHBondContact CA-O 3.41Å; S629-Q638 WeakPolarHBondContact CB-O 3.34Å; S629-D698 PolarHBondContact N-O 2.74Å; S629-D698 PolarHBondContact O-N 2.86Å; S629-D698 PolarHBondContact OG-O 3.3Å
630	T	90	Very high	87.5	Confident	20 Å²	20	34.6 Å²	34.6	12%	0.123	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.1	173.2	59	0	0	0	0	110	Q638 L640 R653 D698	T630-Q638 PolarHBondContact N-O 3.35Å; T630-Q638 PolarHBondContact O-N 2.94Å; T630-L640 HydrophobicContact CG2-CB 4.35Å; T630-L640 HydrophobicContact CG2-CD2 3.89Å; T630-R653 PolarHBondContact OG1-NH1 3.3Å; T630-R653 PolarHBondContact OG1-NH2 3.12Å; T630-D698 WeakPolarHBondContact CA-OD2 3.44Å
631	G	83.3	Confident	87.5	Confident	18 Å²	18	34.8 Å²	34.8	19%	0.186	18%	0.18	C	C	.	.			trans	85	11.8	174.9	0	0	0	0	0	115.2	M633 E634 G635 N636 D698	G631-M633 VanDerWaalsContact C-N 3.33Å; G631-M633 PolarHBondContact O-N 3.06Å; G631-E634 PolarHBondContact O-N 3.05Å; G631-G635 PolarHBondContact O-N 2.94Å; G631-N636 CarbonylContact C-O 3.36Å; G631-N636 WeakPolarHBondContact CA-O 3.45Å; G631-N636 CarbonylContact O-C 3.6Å; G631-N636 VanDerWaalsContact O-C 3.32Å; G631-N636 PolarHBondContact O-N 2.84Å; G631-D698 PolarHBondContact N-OD2 2.89Å
632	H	87.9	Confident	87.7	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.009	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-46.2	176.1	-161.2	137.2	0	0	0	110.9	E634 G635 L637 D698 L761 V762 H763	H632-E634 PolarHBondContact O-N 2.96Å; H632-G635 PolarHBondContact O-N 3.49Å; H632-L637 HydrophobicContact CB-CD1 3.59Å; H632-D698 HydrophobicContact CB-CB 4.03Å; H632-D698 WeakPolarHBondContact CB-OD2 2.94Å; H632-D698 PolarHBondContact N-OD2 2.8Å; H632-L761 HydrophobicContact CB-CD1 4.22Å; H632-V762 PolarHBondContact NE2-N 3.33Å; H632-V762 PolarHBondContact NE2-O 2.94Å; H632-H763 AromaticContact CE1-CE1 3.66Å
633	M	84.9	Confident	87.8	Confident	10 Å²	10	26.8 Å²	26.8	5%	0.049	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.7	179.3	-67.9	173.2	57.2	0	0	113.7	G631 T683 L696 L761 H916 E917	G631-M633 VanDerWaalsContact C-N 3.33Å; G631-M633 PolarHBondContact O-N 3.06Å; M633-T683 HydrophobicContact SD-CG2 3.67Å; M633-L696 HydrophobicContact SD-CD2 4.46Å; M633-L761 HydrophobicContact CG-CD2 3.51Å; M633-H916 CarbonylContact O-C 3.39Å; M633-H916 WeakPolarHBondContact O-CA 3.25Å; M633-H916 WeakPolarHBondContact O-CB 3.46Å; M633-H916 PolarHBondContact O-CD2 3.03Å; M633-E917 HydrophobicContact CE-CB 3.82Å; M633-E917 HydrophobicContact CE-CG 4.14Å; M633-E917 WeakPolarHBondContact CE-OE2 3.31Å; M633-E917 PolarHBondContact O-N 2.92Å
634	E	81.5	Confident	88	Confident	85 Å²	85	24.6 Å²	24.6	40%	0.397	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.7	-176.9	-69	174	-170.5	0	0	112.9	G631 H632 N636 E917 C919	G631-E634 PolarHBondContact O-N 3.05Å; H632-E634 PolarHBondContact O-N 2.96Å; E634-N636 VanDerWaalsContact C-N 3.31Å; E634-E917 VanDerWaalsContact CG-O 3.23Å; E634-E917 WeakPolarHBondContact CG-O 3.49Å; E634-C919 PolarHBondContact OE1-SG 3.32Å
635	G	77.2	Confident	88.1	Confident	28 Å²	28	23.5 Å²	23.5	29%	0.289	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	82	4.1	-175.1	0	0	0	0	0	115	G631 H632 P902 H916	G631-G635 PolarHBondContact O-N 2.94Å; H632-G635 PolarHBondContact O-N 3.49Å; G635-P902 WeakPolarHBondContact CA-O 3.24Å; G635-H916 VanDerWaalsContact CA-NE2 3.29Å; G635-H916 WeakPolarHBondContact CA-NE2 3.24Å; G635-H916 PolarHBondContact N-NE2 3.4Å
636	N	75.9	Confident	88	Confident	92 Å²	92	25.1 Å²	25.1	49%	0.492	14%	0.136	S	C	.	.			trans	-115.4	64.8	-176.4	-175.8	17	0	0	0	110.1	G631 E634 Q638	G631-N636 CarbonylContact C-O 3.36Å; G631-N636 WeakPolarHBondContact CA-O 3.45Å; G631-N636 CarbonylContact O-C 3.6Å; G631-N636 VanDerWaalsContact O-C 3.32Å; G631-N636 PolarHBondContact O-N 2.84Å; E634-N636 VanDerWaalsContact C-N 3.31Å; N636-Q638 PolarHBondContact ND2-NE2 3.26Å; N636-Q638 PolarHBondContact O-N 3.02Å
637	L	81.4	Confident	87.9	Confident	45 Å²	45	27.5 Å²	27.5	24%	0.236	15%	0.152	C	C	.	.			trans	-67.8	116	-174.7	-173.7	73.1	0	0	0	111.9	H632 H763 P902 W1016	H632-L637 HydrophobicContact CB-CD1 3.59Å; L637-H763 WeakPolarHBondContact CD2-NE2 3.35Å; L637-P902 HydrophobicContact CB-CB 4.17Å; L637-P902 HydrophobicContact CB-CG 3.91Å; L637-W1016 VanDerWaalsContact CD2-NE1 3.34Å
638	Q	82.2	Confident	88.1	Confident	77 Å²	77	26.4 Å²	26.4	36%	0.36	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.7	175.9	-59.9	178.2	7.5	0	0	110.5	S629 T630 N636	S629-Q638 CarbonylContact C-O 3.58Å; S629-Q638 WeakPolarHBondContact CA-O 3.41Å; S629-Q638 WeakPolarHBondContact CB-O 3.34Å; T630-Q638 PolarHBondContact N-O 3.35Å; T630-Q638 PolarHBondContact O-N 2.94Å; N636-Q638 PolarHBondContact ND2-NE2 3.26Å; N636-Q638 PolarHBondContact O-N 3.02Å
639	L	83.9	Confident	88.3	Confident	29 Å²	29	26.1 Å²	26.1	15%	0.152	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	144.3	175.4	-162.2	79.2	0	0	0	111.1	R627 Y641 R653 W1016 S1019	R627-L639 HydrophobicContact CG-CD1 3.82Å; R627-L639 HydrophobicContact CG-CD2 4.33Å; R627-L639 HydrophobicContact CG-CG 4.3Å; L639-Y641 HydrophobicContact CD2-CE2 3.6Å; L639-Y641 VanDerWaalsContact CD2-OH 3.3Å; L639-Y641 WeakPolarHBondContact CD2-OH 3.2Å; L639-Y641 HydrophobicContact CG-CE2 4.47Å; L639-R653 PolarHBondContact O-NH1 3.23Å; L639-R653 VanDerWaalsContact O-NH1 3.08Å; L639-W1016 HydrophobicContact CD1-CB 4.3Å; L639-W1016 WeakPolarHBondContact CD2-O 3.43Å; L639-S1019 WeakPolarHBondContact CB-OG 3.36Å; L639-S1019 WeakPolarHBondContact CD2-OG 3.36Å
640	L	88.9	Confident	88.6	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.3	171.6	-167.4	72.4	0	0	0	110.3	M628 T630 V642 L651 L652 R653 E664 L697	M628-L640 CarbonylContact C-O 3.58Å; M628-L640 PolarHBondContact N-O 3.49Å; M628-L640 PolarHBondContact O-N 3.41Å; T630-L640 HydrophobicContact CG2-CB 4.35Å; T630-L640 HydrophobicContact CG2-CD2 3.89Å; L640-V642 HydrophobicContact CD2-CG2 3.97Å; L640-V642 HydrophobicContact CG-CG2 4.45Å; L640-L651 HydrophobicContact CD1-CB 4.14Å; L640-L651 HydrophobicContact CD2-CB 4.22Å; L640-L651 HydrophobicContact CD2-CD2 4.17Å; L640-L652 WeakPolarHBondContact CD1-O 3.43Å; L640-R653 HydrophobicContact CD1-CG 3.76Å; L640-E664 VanDerWaalsContact CD1-OE2 3.26Å; L640-E664 WeakPolarHBondContact CD1-OE2 3.32Å; L640-L697 HydrophobicContact CD2-CD2 3.58Å
641	Y	91.4	Very high	88.9	Confident	8 Å²	8	24.7 Å²	24.7	3%	0.031	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.9	162.9	-56.4	-97.6	0	0	0	108.3	F600 M625 I626 R627 L639 L652 D1020	F600-Y641 HydrophobicContact CD2-CE1 4.3Å; M625-Y641 HydrophobicContact CE-CD1 3.73Å; M625-Y641 HydrophobicContact CE-CD2 4.45Å; M625-Y641 HydrophobicContact CE-CG 3.67Å; I626-Y641 CarbonylContact O-C 3.59Å; I626-Y641 WeakPolarHBondContact O-CA 3.43Å; R627-Y641 HydrophobicContact CB-CD1 4.12Å; R627-Y641 HydrophobicContact CB-CE1 4.16Å; R627-Y641 HydrophobicContact CG-CD1 4.24Å; R627-Y641 HydrophobicContact CG-CE1 3.96Å; L639-Y641 HydrophobicContact CD2-CE2 3.6Å; L639-Y641 VanDerWaalsContact CD2-OH 3.3Å; L639-Y641 WeakPolarHBondContact CD2-OH 3.2Å; L639-Y641 HydrophobicContact CG-CE2 4.47Å; Y641-L652 PolarHBondContact N-O 3.43Å; Y641-L652 WeakPolarHBondContact O-CB 3.3Å; Y641-L652 PolarHBondContact O-N 3.31Å; Y641-D1020 WeakPolarHBondContact OH-CB 3.18Å; Y641-D1020 PolarHBondContact OH-OD1 2.83Å; Y641-D1020 PolarHBondContact OH-OD2 2.93Å
642	V	95.6	Very high	89.3	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	114.1	173	-173	0	0	0	0	107.6	I626 M628 L640 V649 Y650 L651 L697 F708	I626-V642 PolarHBondContact N-O 2.73Å; I626-V642 PolarHBondContact O-N 3.23Å; M628-V642 HydrophobicContact CB-CG2 4.34Å; M628-V642 HydrophobicContact CG-CG2 4.16Å; M628-V642 HydrophobicContact SD-CB 4.18Å; M628-V642 HydrophobicContact SD-CG2 3.63Å; L640-V642 HydrophobicContact CD2-CG2 3.97Å; L640-V642 HydrophobicContact CG-CG2 4.45Å; V642-V649 HydrophobicContact CG1-CG1 3.6Å; V642-Y650 WeakPolarHBondContact CA-O 3.45Å; V642-L651 HydrophobicContact CG1-CD2 4.17Å; V642-L651 HydrophobicContact CG2-CD2 4.13Å; V642-L697 HydrophobicContact CG2-CD1 4.18Å; V642-L697 HydrophobicContact CG2-CD2 4.08Å; V642-F708 HydrophobicContact CB-CE2 4.42Å; V642-F708 HydrophobicContact CG1-CD2 4.44Å; V642-F708 HydrophobicContact CG1-CE2 3.63Å; V642-F708 HydrophobicContact CG1-CZ 4.33Å
643	L	95.3	Very high	89.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.9	-178.7	-177.2	77.4	0	0	0	108.8	L610 V614 F615 L622 M625 V649 Y650 L652	L610-L643 HydrophobicContact CD1-CD1 3.98Å; L610-L643 HydrophobicContact CD1-CD2 4.4Å; L610-L643 HydrophobicContact CD2-CD2 4.17Å; V614-L643 HydrophobicContact CG1-CD2 3.76Å; F615-L643 HydrophobicContact CE1-CD2 4.09Å; L622-L643 HydrophobicContact CD1-CD1 3.45Å; L622-L643 VanDerWaalsContact CD1-CD1 3.45Å; L622-L643 HydrophobicContact CD1-CG 4.32Å; M625-L643 HydrophobicContact CB-CD1 3.75Å; M625-L643 HydrophobicContact CG-CD1 3.82Å; M625-L643 HydrophobicContact SD-CD1 4.12Å; L643-V649 WeakPolarHBondContact O-CA 3.45Å; L643-Y650 HydrophobicContact CB-CD2 4.48Å; L643-Y650 HydrophobicContact CD2-CD2 3.89Å; L643-Y650 HydrophobicContact CD2-CG 4.34Å; L643-Y650 HydrophobicContact CG-CD2 4.42Å; L643-Y650 PolarHBondContact N-O 2.87Å; L643-Y650 PolarHBondContact O-N 2.94Å; L643-L652 HydrophobicContact CB-CD1 3.9Å; L643-L652 HydrophobicContact CB-CG 4.39Å; L643-L652 HydrophobicContact CD2-CD1 3.98Å; L643-L652 HydrophobicContact CG-CD1 4.47Å
644	L	96.1	Very high	88.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124	175.9	-59.8	174.9	0	0	0	108.8	F623 K624 I626 V649 F708 L712 A715	F623-L644 WeakPolarHBondContact CA-O 3.28Å; F623-L644 HydrophobicContact CB-CB 4.24Å; F623-L644 WeakPolarHBondContact CB-O 3.01Å; F623-L644 HydrophobicContact CD1-CB 4.27Å; F623-L644 HydrophobicContact CD1-CD1 4.39Å; F623-L644 PolarHBondContact N-O 2.79Å; K624-L644 PolarHBondContact N-O 2.91Å; K624-L644 VanDerWaalsContact N-O 3.13Å; K624-L644 PolarHBondContact O-N 3Å; I626-L644 HydrophobicContact CD1-CD1 4.45Å; L644-V649 HydrophobicContact CD2-CB 4.37Å; L644-V649 HydrophobicContact CD2-CG1 4.08Å; L644-V649 HydrophobicContact CD2-CG2 3.82Å; L644-F708 HydrophobicContact CD2-CE2 4.25Å; L644-L712 HydrophobicContact CD1-CB 4.48Å; L644-L712 HydrophobicContact CD2-CD1 3.96Å; L644-A715 HydrophobicContact CB-CB 4.28Å
645	T	95.1	Very high	87.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-173.5	167.1	61.4	0	0	0	0	110	F615 E620 Q621 C647 Y648 Y650 Y669	F615-T645 HydrophobicContact CD1-CG2 4.39Å; F615-T645 HydrophobicContact CE1-CG2 4.01Å; F615-T645 HydrophobicContact CZ-CG2 4.27Å; E620-T645 HydrophobicContact CG-CG2 3.83Å; E620-T645 WeakPolarHBondContact OE1-CB 3.37Å; E620-T645 WeakPolarHBondContact OE1-CG2 3.41Å; E620-T645 PolarHBondContact OE1-OG1 2.83Å; Q621-T645 CarbonylContact O-C 3.45Å; Q621-T645 WeakPolarHBondContact O-CA 3.32Å; Q621-T645 VanDerWaalsContact O-CB 3.22Å; Q621-T645 WeakPolarHBondContact O-CB 3.5Å; T645-C647 VanDerWaalsContact C-N 3.32Å; T645-C647 PolarHBondContact OG1-N 2.9Å; T645-Y648 PolarHBondContact N-O 3.04Å; T645-Y648 PolarHBondContact OG1-N 3.17Å; T645-Y648 PolarHBondContact OG1-O 3.08Å; T645-Y650 HydrophobicContact CG2-CD2 4.34Å; T645-Y650 HydrophobicContact CG2-CE2 3.85Å; T645-Y669 WeakPolarHBondContact O-CE2 3.32Å; T645-Y669 PolarHBondContact O-OH 3.37Å
646	D	92.3	Very high	87.1	Confident	36 Å²	36	28.7 Å²	28.7	19%	0.193	16%	0.159	C	C	.	.	S	Bend	trans	-68.5	-26.6	166.9	50.5	-1	0	0	0	113.4	Q621 Y669 G719	Q621-D646 HydrophobicContact CB-CB 4.47Å; Q621-D646 WeakPolarHBondContact CB-OD2 3.47Å; Q621-D646 WeakPolarHBondContact CG-OD2 3.4Å; Q621-D646 VanDerWaalsContact N-CG 3.29Å; Q621-D646 PolarHBondContact N-OD1 3.28Å; Q621-D646 PolarHBondContact N-OD2 2.9Å; Q621-D646 VanDerWaalsContact N-OD2 3.16Å; Q621-D646 PolarHBondContact O-N 2.75Å; D646-Y669 WeakPolarHBondContact O-CD2 3.12Å; D646-Y669 WeakPolarHBondContact O-CE2 3.42Å; D646-G719 WeakPolarHBondContact O-CA 3.26Å
647	C	91.4	Very high	86	Confident	49 Å²	49	31.2 Å²	31.2	33%	0.331	18%	0.178	S	C	.	.	S	Bend	trans	-109.3	-28.8	-175.7	-70.9	0	0	0	0	115.5	T645 Y669	T645-C647 VanDerWaalsContact C-N 3.32Å; T645-C647 PolarHBondContact OG1-N 2.9Å; C647-Y669 WeakPolarHBondContact O-CD2 3.18Å; C647-Y669 PolarHBondContact O-N 2.88Å; C647-Y669 VanDerWaalsContact O-N 3.14Å
648	Y	94.9	Very high	84.7	Confident	34 Å²	34	37.1 Å²	37.1	13%	0.133	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	156.3	-165.3	-72.8	-89.1	0	0	0	114.1	R616 E617 E620 T645 Y650 A666 V667 S668 Y669	R616-Y648 HydrophobicContact CB-CE2 4.36Å; E617-Y648 HydrophobicContact CG-CE2 4.21Å; E620-Y648 WeakPolarHBondContact OE1-CD2 3.45Å; T645-Y648 PolarHBondContact N-O 3.04Å; T645-Y648 PolarHBondContact OG1-N 3.17Å; T645-Y648 PolarHBondContact OG1-O 3.08Å; Y648-Y650 VanDerWaalsContact CB-CE2 3.44Å; Y648-Y650 HydrophobicContact CG-CE2 4.25Å; Y648-A666 HydrophobicContact CD1-CB 4.32Å; Y648-V667 WeakPolarHBondContact CA-O 3.22Å; Y648-S668 VanDerWaalsContact CD1-CA 3.42Å; Y648-S668 VanDerWaalsContact CD1-N 3.34Å; Y648-Y669 PolarHBondContact O-OH 3Å
649	V	96.1	Very high	83.9	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.3	156.7	-173.2	0	0	0	0	108.2	V642 L643 L644 L651 A666 V667 Y669 L686 L712	V642-V649 HydrophobicContact CG1-CG1 3.6Å; L643-V649 WeakPolarHBondContact O-CA 3.45Å; L644-V649 HydrophobicContact CD2-CB 4.37Å; L644-V649 HydrophobicContact CD2-CG1 4.08Å; L644-V649 HydrophobicContact CD2-CG2 3.82Å; V649-L651 HydrophobicContact CG1-CD2 4.17Å; V649-A666 CarbonylContact O-C 3.56Å; V649-A666 WeakPolarHBondContact O-CA 3.32Å; V649-V667 PolarHBondContact N-O 2.93Å; V649-V667 PolarHBondContact O-N 3.16Å; V649-Y669 HydrophobicContact CG2-CD1 4.07Å; V649-Y669 HydrophobicContact CG2-CE1 3.46Å; V649-Y669 VanDerWaalsContact CG2-CE1 3.46Å; V649-L686 HydrophobicContact CG1-CD1 4.05Å; V649-L712 HydrophobicContact CG2-CD1 3.84Å
650	Y	95.7	Very high	83.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	138.9	169.8	-53.7	-103.6	0	0	0	110.7	V614 R616 E620 V642 L643 T645 Y648 V663 A666	V614-Y650 HydrophobicContact CG1-CD1 3.63Å; V614-Y650 HydrophobicContact CG1-CD2 4.26Å; V614-Y650 HydrophobicContact CG1-CE1 4.01Å; V614-Y650 HydrophobicContact CG1-CG 3.81Å; V614-Y650 WeakPolarHBondContact O-CE1 3.34Å; R616-Y650 HydrophobicContact CG-CE1 4.16Å; R616-Y650 PolarHBondContact N-OH 2.86Å; E620-Y650 WeakPolarHBondContact OE1-CE2 3.5Å; E620-Y650 PolarHBondContact OE1-OH 2.84Å; E620-Y650 PolarHBondContact OE2-OH 2.88Å; V642-Y650 WeakPolarHBondContact CA-O 3.45Å; L643-Y650 HydrophobicContact CB-CD2 4.48Å; L643-Y650 HydrophobicContact CD2-CD2 3.89Å; L643-Y650 HydrophobicContact CD2-CG 4.34Å; L643-Y650 HydrophobicContact CG-CD2 4.42Å; L643-Y650 PolarHBondContact N-O 2.87Å; L643-Y650 PolarHBondContact O-N 2.94Å; T645-Y650 HydrophobicContact CG2-CD2 4.34Å; T645-Y650 HydrophobicContact CG2-CE2 3.85Å; Y648-Y650 VanDerWaalsContact CB-CE2 3.44Å; Y648-Y650 HydrophobicContact CG-CE2 4.25Å; Y650-V663 HydrophobicContact CD1-CG1 4.01Å; Y650-A666 HydrophobicContact CD1-CB 3.28Å; Y650-A666 HydrophobicContact CE1-CB 3.47Å; Y650-A666 VanDerWaalsContact CE1-CB 3.47Å; Y650-A666 HydrophobicContact CG-CB 4.01Å
651	L	95.3	Very high	82.7	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	111.5	169.8	-52.1	-172.9	0	0	0	106.7	L640 V642 V649 E664 E665 F695 L697	L640-L651 HydrophobicContact CD1-CB 4.14Å; L640-L651 HydrophobicContact CD2-CB 4.22Å; L640-L651 HydrophobicContact CD2-CD2 4.17Å; V642-L651 HydrophobicContact CG1-CD2 4.17Å; V642-L651 HydrophobicContact CG2-CD2 4.13Å; V649-L651 HydrophobicContact CG1-CD2 4.17Å; L651-E664 HydrophobicContact CB-CB 4.47Å; L651-E664 WeakPolarHBondContact O-CB 3.48Å; L651-E664 PolarHBondContact O-N 3.07Å; L651-E665 HydrophobicContact CB-CB 4.49Å; L651-E665 HydrophobicContact CD1-CB 4.29Å; L651-E665 HydrophobicContact CG-CB 4.46Å; L651-E665 PolarHBondContact N-O 2.81Å; L651-F695 HydrophobicContact CD1-CB 3.74Å; L651-F695 HydrophobicContact CD1-CD1 3.9Å; L651-F695 HydrophobicContact CD1-CD2 4.31Å; L651-F695 HydrophobicContact CD1-CG 3.7Å; L651-L697 HydrophobicContact CD2-CD2 4.08Å
652	L	91.8	Very high	82.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.7	-171.2	-53.9	-178.5	0	0	0	111.7	L610 V614 M625 L640 Y641 L643 Y661 L662 V663	L610-L652 HydrophobicContact CD2-CD1 4.02Å; V614-L652 HydrophobicContact CG1-CD1 4.19Å; V614-L652 HydrophobicContact CG1-CD2 3.76Å; V614-L652 HydrophobicContact CG2-CD1 4.35Å; V614-L652 HydrophobicContact CG2-CD2 4.12Å; M625-L652 HydrophobicContact CE-CD1 4.35Å; L640-L652 WeakPolarHBondContact CD1-O 3.43Å; Y641-L652 PolarHBondContact N-O 3.43Å; Y641-L652 WeakPolarHBondContact O-CB 3.3Å; Y641-L652 PolarHBondContact O-N 3.31Å; L643-L652 HydrophobicContact CB-CD1 3.9Å; L643-L652 HydrophobicContact CB-CG 4.39Å; L643-L652 HydrophobicContact CD2-CD1 3.98Å; L643-L652 HydrophobicContact CG-CD1 4.47Å; L652-Y661 HydrophobicContact CD1-CD1 4.46Å; L652-Y661 HydrophobicContact CD1-CG 4.48Å; L652-L662 WeakPolarHBondContact CA-O 3.48Å; L652-V663 HydrophobicContact CD2-CB 4.2Å; L652-V663 HydrophobicContact CD2-CG1 4.34Å; L652-V663 HydrophobicContact CD2-CG2 3.76Å
653	R	86.9	Confident	82.1	Confident	39 Å²	39	47 Å²	47	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	169.1	167.6	-60.7	-166.7	-170.1	-84.7	5.3	110.3	T630 L639 L640 G655 L662 E664	T630-R653 PolarHBondContact OG1-NH1 3.3Å; T630-R653 PolarHBondContact OG1-NH2 3.12Å; L639-R653 PolarHBondContact O-NH1 3.23Å; L639-R653 VanDerWaalsContact O-NH1 3.08Å; L640-R653 HydrophobicContact CD1-CG 3.76Å; R653-G655 PolarHBondContact O-N 3.23Å; R653-L662 PolarHBondContact N-O 2.63Å; R653-L662 PolarHBondContact O-N 2.82Å; R653-E664 IonicContact CZ-OE1 2.83Å; R653-E664 VanDerWaalsContact CZ-OE1 3.24Å; R653-E664 IonicContact CZ-OE2 3.57Å; R653-E664 IonicContact NE-OE1 3.94Å; R653-E664 PolarHBondContact NE-OE1 2.76Å; R653-E664 IonicContact NE-OE2 2.67Å; R653-E664 PolarHBondContact NE-OE2 2.78Å; R653-E664 IonicContact NH2-OE1 3.6Å; R653-E664 PolarHBondContact NH2-OE1 3.05Å; R653-E664 IonicContact NH2-OE2 3.51Å; R653-E664 PolarHBondContact NH2-OE2 2.62Å; R653-E664 VanDerWaalsContact NH2-OE2 3.17Å
654	K	72	Confident	81.8	Confident	93 Å²	93	51.1 Å²	51.1	40%	0.404	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.7	172.9	-165.9	-159.3	-141.5	166.8	0	109.4	R1018 S1019 S1021	K654-R1018 PolarHBondContact NZ-O 2.8Å; K654-S1019 WeakPolarHBondContact CB-O 3.2Å; K654-S1019 WeakPolarHBondContact CD-O 3.39Å; K654-S1019 WeakPolarHBondContact CE-O 3.29Å; K654-S1019 VanDerWaalsContact CG-O 3.26Å; K654-S1019 WeakPolarHBondContact CG-O 3.18Å; K654-S1019 PolarHBondContact NZ-O 3.22Å; K654-S1021 PolarHBondContact NZ-OG 2.71Å
655	G	65	Low	81.6	Confident	24 Å²	24	53.5 Å²	53.5	25%	0.247	29%	0.286	C	S	.	.			trans	-95.4	-168.4	173.5	0	0	0	0	0	113.3	R653 K659 P660	R653-G655 PolarHBondContact O-N 3.23Å; G655-K659 CarbonylContact C-O 3.32Å; G655-K659 VanDerWaalsContact C-O 3.23Å; G655-K659 WeakPolarHBondContact CA-O 3.25Å; G655-P660 PolarHBondContact N-O 2.93Å
656	A	62.9	Low	81.5	Confident	71 Å²	71	53.5 Å²	53.5	59%	0.587	29%	0.286	S	S	*	.			trans	-75.1	173.6	179	0	0	0	0	0	112.4	E658 K659	A656-E658 PolarHBondContact O-N 2.84Å; A656-K659 PolarHBondContact N-O 2.84Å; A656-K659 VanDerWaalsContact N-O 3.16Å; A656-K659 CarbonylContact O-C 3.39Å; A656-K659 PolarHBondContact O-N 3.39Å
657	T	52.2	Low	81.6	Confident	146 Å²	146	51.8 Å²	51.8	90%	0.896	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.8	-178.2	41.4	0	0	0	0	115.1
658	E	53.2	Low	81.6	Confident	168 Å²	168	50.3 Å²	50.3	79%	0.785	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-18.1	178.4	-64.9	171.4	-165	0	0	113.8	A656	A656-E658 PolarHBondContact O-N 2.84Å
659	K	65.6	Low	81.5	Confident	134 Å²	134	49 Å²	49	58%	0.583	26%	0.262	S	S	*	.			trans	-137.6	88.9	177.9	-75.6	-170.9	177.3	-174.6	0	108	G655 A656 Y661	G655-K659 CarbonylContact C-O 3.32Å; G655-K659 VanDerWaalsContact C-O 3.23Å; G655-K659 WeakPolarHBondContact CA-O 3.25Å; A656-K659 PolarHBondContact N-O 2.84Å; A656-K659 VanDerWaalsContact N-O 3.16Å; A656-K659 CarbonylContact O-C 3.39Å; A656-K659 PolarHBondContact O-N 3.39Å; K659-Y661 PolarHBondContact O-N 3.18Å; K659-Y661 VanDerWaalsContact O-N 3.15Å
660	P	67.6	Low	81.1	Confident	27 Å²	27	54.9 Å²	54.9	18%	0.175	29%	0.293	C	S	.	.	S	Bend	trans	-64.8	-23	-169.4	19.8	-28.8	0	0	0	113.7	L609 G655 L1022	L609-P660 HydrophobicContact CD1-CG 3.78Å; L609-P660 HydrophobicContact CD2-CB 4.47Å; L609-P660 HydrophobicContact CD2-CG 3.58Å; L609-P660 HydrophobicContact CG-CG 3.82Å; G655-P660 PolarHBondContact N-O 2.93Å; P660-L1022 HydrophobicContact CB-CD2 4.35Å
661	Y	80.3	Confident	80.9	Confident	19 Å²	19	58 Å²	58	8%	0.075	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.7	169.4	-57.5	-65.9	0	0	0	110.6	L609 L610 V614 M625 L652 K659	L609-Y661 HydrophobicContact CD2-CE2 4.1Å; L610-Y661 HydrophobicContact CD2-CD2 3.53Å; L610-Y661 HydrophobicContact CD2-CE2 3.61Å; L610-Y661 HydrophobicContact CD2-CG 4.2Å; L610-Y661 HydrophobicContact CG-CD2 4.39Å; L610-Y661 HydrophobicContact CG-CE2 4.1Å; V614-Y661 HydrophobicContact CG2-CD2 4.38Å; V614-Y661 HydrophobicContact CG2-CG 4.43Å; M625-Y661 HydrophobicContact CE-CD1 4.47Å; M625-Y661 HydrophobicContact CE-CE1 3.74Å; L652-Y661 HydrophobicContact CD1-CD1 4.46Å; L652-Y661 HydrophobicContact CD1-CG 4.48Å; K659-Y661 PolarHBondContact O-N 3.18Å; K659-Y661 VanDerWaalsContact O-N 3.15Å
662	L	83.9	Confident	80.8	Confident	97 Å²	97	58.1 Å²	58.1	51%	0.508	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	117.4	163.6	174.2	63.1	0	0	0	107.4	L652 R653 E664	L652-L662 WeakPolarHBondContact CA-O 3.48Å; R653-L662 PolarHBondContact N-O 2.63Å; R653-L662 PolarHBondContact O-N 2.82Å; L662-E664 PolarHBondContact O-N 3.19Å
663	V	90.4	Very high	80.9	Confident	44 Å²	44	60.7 Å²	60.7	27%	0.267	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	110.4	167.9	-174.2	0	0	0	0	107.5	V614 Y650 L652 E665 A666	V614-V663 HydrophobicContact CB-CG2 4.23Å; V614-V663 HydrophobicContact CG1-CG2 4.04Å; V614-V663 HydrophobicContact CG2-CG2 3.97Å; Y650-V663 HydrophobicContact CD1-CG1 4.01Å; L652-V663 HydrophobicContact CD2-CB 4.2Å; L652-V663 HydrophobicContact CD2-CG1 4.34Å; L652-V663 HydrophobicContact CD2-CG2 3.76Å; V663-E665 WeakPolarHBondContact CG1-O 3.4Å; V663-A666 HydrophobicContact CG1-CB 4.33Å
664	E	88.5	Confident	81.2	Confident	88 Å²	88	61.7 Å²	61.7	41%	0.411	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-51.7	174.1	178.3	174.6	-139.1	0	0	109.4	L640 L651 R653 L662	L640-E664 VanDerWaalsContact CD1-OE2 3.26Å; L640-E664 WeakPolarHBondContact CD1-OE2 3.32Å; L651-E664 HydrophobicContact CB-CB 4.47Å; L651-E664 WeakPolarHBondContact O-CB 3.48Å; L651-E664 PolarHBondContact O-N 3.07Å; R653-E664 IonicContact CZ-OE1 2.83Å; R653-E664 VanDerWaalsContact CZ-OE1 3.24Å; R653-E664 IonicContact CZ-OE2 3.57Å; R653-E664 IonicContact NE-OE1 3.94Å; R653-E664 PolarHBondContact NE-OE1 2.76Å; R653-E664 IonicContact NE-OE2 2.67Å; R653-E664 PolarHBondContact NE-OE2 2.78Å; R653-E664 IonicContact NH2-OE1 3.6Å; R653-E664 PolarHBondContact NH2-OE1 3.05Å; R653-E664 IonicContact NH2-OE2 3.51Å; R653-E664 PolarHBondContact NH2-OE2 2.62Å; R653-E664 VanDerWaalsContact NH2-OE2 3.17Å; L662-E664 PolarHBondContact O-N 3.19Å
665	E	92.1	Very high	82.4	Confident	50 Å²	50	57.4 Å²	57.4	23%	0.234	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	158.9	174.6	-92.3	-78.7	-166.9	0	0	110.3	L651 V663 K693 F695	L651-E665 HydrophobicContact CB-CB 4.49Å; L651-E665 HydrophobicContact CD1-CB 4.29Å; L651-E665 HydrophobicContact CG-CB 4.46Å; L651-E665 PolarHBondContact N-O 2.81Å; V663-E665 WeakPolarHBondContact CG1-O 3.4Å; E665-K693 VanDerWaalsContact CD-NZ 3.26Å; E665-K693 WeakPolarHBondContact OE1-CE 3.15Å; E665-K693 IonicContact OE1-NZ 3.97Å; E665-K693 PolarHBondContact OE1-NZ 2.91Å; E665-K693 IonicContact OE2-NZ 3.38Å; E665-K693 PolarHBondContact OE2-NZ 3.1Å; E665-F695 HydrophobicContact CB-CE1 4.24Å; E665-F695 HydrophobicContact CB-CZ 4.23Å; E665-F695 HydrophobicContact CG-CE1 3.67Å; E665-F695 HydrophobicContact CG-CZ 3.74Å
666	A	94.2	Very high	83.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	121.3	165.7	0	0	0	0	0	109.5	Y648 V649 Y650 V663	Y648-A666 HydrophobicContact CD1-CB 4.32Å; V649-A666 CarbonylContact O-C 3.56Å; V649-A666 WeakPolarHBondContact O-CA 3.32Å; Y650-A666 HydrophobicContact CD1-CB 3.28Å; Y650-A666 HydrophobicContact CE1-CB 3.47Å; Y650-A666 VanDerWaalsContact CE1-CB 3.47Å; Y650-A666 HydrophobicContact CG-CB 4.01Å; V663-A666 HydrophobicContact CG1-CB 4.33Å
667	V	93.9	Very high	85.4	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.7	-173.6	-177.1	0	0	0	0	107.6	Y648 V649 E671 L672 F695	Y648-V667 WeakPolarHBondContact CA-O 3.22Å; V649-V667 PolarHBondContact N-O 2.93Å; V649-V667 PolarHBondContact O-N 3.16Å; V667-E671 HydrophobicContact CG1-CB 4.09Å; V667-L672 HydrophobicContact CG1-CD1 4.24Å; V667-F695 HydrophobicContact CG2-CD2 3.89Å; V667-F695 HydrophobicContact CG2-CE2 3.47Å; V667-F695 VanDerWaalsContact CG2-CE2 3.47Å; V667-F695 HydrophobicContact CG2-CZ 4.36Å
668	S	91.8	Very high	87.3	Confident	18 Å²	18	47.2 Å²	47.2	13%	0.126	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	144.5	170.4	178.6	0	0	0	0	108.7	Y648 N670 E671	Y648-S668 VanDerWaalsContact CD1-CA 3.42Å; Y648-S668 VanDerWaalsContact CD1-N 3.34Å; S668-N670 PolarHBondContact O-N 3.3Å; S668-N670 VanDerWaalsContact O-N 3.09Å; S668-N670 PolarHBondContact OG-N 3Å; S668-E671 WeakPolarHBondContact O-CB 3.07Å; S668-E671 PolarHBondContact O-N 3.47Å
669	Y	91.3	Very high	89.2	Confident	7 Å²	7	39.5 Å²	39.5	3%	0.027	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-53.7	-34.4	172.7	-66.6	-47.2	0	0	0	111.8	T645 D646 C647 Y648 V649 E671 L672 L712 A715 M716 R721	T645-Y669 WeakPolarHBondContact O-CE2 3.32Å; T645-Y669 PolarHBondContact O-OH 3.37Å; D646-Y669 WeakPolarHBondContact O-CD2 3.12Å; D646-Y669 WeakPolarHBondContact O-CE2 3.42Å; C647-Y669 WeakPolarHBondContact O-CD2 3.18Å; C647-Y669 PolarHBondContact O-N 2.88Å; C647-Y669 VanDerWaalsContact O-N 3.14Å; Y648-Y669 PolarHBondContact O-OH 3Å; V649-Y669 HydrophobicContact CG2-CD1 4.07Å; V649-Y669 HydrophobicContact CG2-CE1 3.46Å; V649-Y669 VanDerWaalsContact CG2-CE1 3.46Å; Y669-E671 PolarHBondContact O-N 3.07Å; Y669-L672 WeakPolarHBondContact O-CB 3.43Å; Y669-L672 PolarHBondContact O-N 3.19Å; Y669-L672 VanDerWaalsContact O-N 3.11Å; Y669-L712 HydrophobicContact CD1-CD1 4.22Å; Y669-L712 HydrophobicContact CE1-CD1 3.53Å; Y669-A715 VanDerWaalsContact OH-CB 3.29Å; Y669-A715 WeakPolarHBondContact OH-CB 3.43Å; Y669-M716 HydrophobicContact CD1-CE 4.29Å; Y669-M716 HydrophobicContact CD1-CG 3.45Å; Y669-M716 VanDerWaalsContact CD1-CG 3.45Å; Y669-M716 HydrophobicContact CD1-SD 3.88Å; Y669-M716 HydrophobicContact CD2-CG 3.93Å; Y669-M716 HydrophobicContact CE1-CG 3.57Å; Y669-M716 HydrophobicContact CE1-SD 4.22Å; Y669-M716 HydrophobicContact CE2-CG 4.03Å; Y669-M716 HydrophobicContact CG-CE 4.4Å; Y669-M716 HydrophobicContact CG-CG 3.66Å; Y669-M716 HydrophobicContact CG-SD 4.43Å; Y669-R721 VanDerWaalsContact C-NH1 3.32Å; Y669-R721 PolarHBondContact O-NH1 2.72Å
670	N	88.9	Confident	90.5	Very high	123 Å²	123	36 Å²	36	66%	0.658	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-66.9	-18.2	177.8	-63.9	-29.9	0	0	0	114.2	S668	S668-N670 PolarHBondContact O-N 3.3Å; S668-N670 VanDerWaalsContact O-N 3.09Å; S668-N670 PolarHBondContact OG-N 3Å
671	E	91.5	Very high	91.8	Very high	65 Å²	65	37.2 Å²	37.2	30%	0.304	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-80.9	-16	172.9	-74.4	178.5	-116.6	0	0	113.2	V667 S668 Y669 C688 T689	V667-E671 HydrophobicContact CG1-CB 4.09Å; S668-E671 WeakPolarHBondContact O-CB 3.07Å; S668-E671 PolarHBondContact O-N 3.47Å; Y669-E671 PolarHBondContact O-N 3.07Å; E671-C688 CarbonylContact O-C 3.57Å; E671-C688 WeakPolarHBondContact O-CA 3.42Å; E671-C688 WeakPolarHBondContact O-CB 3.31Å; E671-T689 PolarHBondContact O-N 3.27Å; E671-T689 PolarHBondContact O-OG1 3.33Å
672	L	92.9	Very high	92.5	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121	-172.5	-152.7	74.9	0	0	0	112.4	V667 Y669 V675 L686 P726	V667-L672 HydrophobicContact CG1-CD1 4.24Å; Y669-L672 WeakPolarHBondContact O-CB 3.43Å; Y669-L672 PolarHBondContact O-N 3.19Å; Y669-L672 VanDerWaalsContact O-N 3.11Å; L672-V675 HydrophobicContact CD2-CG2 3.77Å; L672-L686 HydrophobicContact CD1-CB 4.01Å; L672-L686 HydrophobicContact CD1-CD2 4.37Å; L672-P726 HydrophobicContact CB-CG 3.98Å; L672-P726 HydrophobicContact CD2-CB 4.2Å; L672-P726 HydrophobicContact CD2-CG 3.99Å; L672-P726 HydrophobicContact CG-CB 4.44Å; L672-P726 HydrophobicContact CG-CG 4.24Å; L672-P726 WeakPolarHBondContact O-CG 3.35Å
673	D	93.1	Very high	93	Very high	54 Å²	54	31.9 Å²	31.9	29%	0.289	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-56	176.8	-171.6	18.2	0	0	0	109.6	V687 T689 R691	D673-V687 PolarHBondContact N-O 3.4Å; D673-T689 HydrophobicContact CB-CG2 4.13Å; D673-R691 IonicContact OD2-CZ 3.28Å; D673-R691 IonicContact OD2-NE 3.84Å; D673-R691 PolarHBondContact OD2-NE 3.19Å; D673-R691 IonicContact OD2-NH2 3.33Å; D673-R691 PolarHBondContact OD2-NH2 3.12Å
674	Y	94	Very high	93.4	Very high	60 Å²	60	29.8 Å²	29.8	24%	0.235	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	166.6	176.6	64.4	-86.9	0	0	0	111.9	V687 S727 L729	Y674-V687 HydrophobicContact CD1-CB 4.2Å; Y674-V687 HydrophobicContact CD1-CG1 4.26Å; Y674-V687 HydrophobicContact CD2-CB 4.29Å; Y674-V687 HydrophobicContact CD2-CG2 4.27Å; Y674-V687 HydrophobicContact CE1-CB 3.94Å; Y674-V687 HydrophobicContact CE1-CG1 3.65Å; Y674-V687 HydrophobicContact CE1-CG2 4.41Å; Y674-V687 HydrophobicContact CE2-CB 4.04Å; Y674-V687 HydrophobicContact CE2-CG1 4.47Å; Y674-V687 HydrophobicContact CE2-CG2 3.73Å; Y674-V687 HydrophobicContact CG-CB 4.36Å; Y674-V687 PolarHBondContact N-O 3.46Å; Y674-V687 PolarHBondContact O-N 3.22Å; Y674-S727 WeakPolarHBondContact CA-O 3.49Å; Y674-S727 WeakPolarHBondContact CB-O 3.41Å; Y674-S727 WeakPolarHBondContact CB-OG 3.5Å; Y674-L729 HydrophobicContact CD2-CD1 3.59Å; Y674-L729 HydrophobicContact CD2-CG 4.11Å; Y674-L729 HydrophobicContact CE2-CD1 3.75Å; Y674-L729 HydrophobicContact CG-CD1 4.33Å
675	V	96.1	Very high	93.7	Very high	3 Å²	3	28 Å²	28	2%	0.018	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	133.6	169.9	-177.6	0	0	0	0	108.3	L672 V684 L686 L709 L712 S727 I728 L729	L672-V675 HydrophobicContact CD2-CG2 3.77Å; V675-V684 HydrophobicContact CG1-CG1 3.43Å; V675-V684 VanDerWaalsContact CG1-CG1 3.43Å; V675-L686 HydrophobicContact CG1-CD2 4.3Å; V675-L686 HydrophobicContact CG2-CD2 3.95Å; V675-L709 HydrophobicContact CG1-CD2 3.84Å; V675-L712 HydrophobicContact CG2-CD2 4.02Å; V675-S727 PolarHBondContact N-O 2.7Å; V675-I728 HydrophobicContact CB-CG1 4.43Å; V675-I728 CarbonylContact O-C 3.49Å; V675-I728 WeakPolarHBondContact O-CA 3.43Å; V675-L729 PolarHBondContact O-N 2.71Å
676	S	95.1	Very high	93.8	Very high	21 Å²	21	25.6 Å²	25.6	15%	0.147	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.1	172.7	-162.9	0	0	0	0	109.3	K685	S676-K685 PolarHBondContact N-O 3.16Å; S676-K685 PolarHBondContact O-N 2.81Å
677	V	96.4	Very high	93.9	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.012	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.1	172.5	-175.1	0	0	0	0	107.4	Q681 L709 I728 L729 T730	V677-Q681 HydrophobicContact CG1-CB 4.05Å; V677-Q681 HydrophobicContact CG1-CG 3.95Å; V677-L709 HydrophobicContact CG2-CD1 3.62Å; V677-L709 HydrophobicContact CG2-CD2 4.22Å; V677-I728 HydrophobicContact CG2-CG2 3.82Å; V677-L729 PolarHBondContact N-O 2.78Å; V677-T730 HydrophobicContact CB-CG2 4.16Å; V677-T730 HydrophobicContact CG2-CG2 4.03Å
678	G	92.9	Very high	93.9	Very high	5 Å²	5	25.9 Å²	25.9	5%	0.052	13%	0.132	C	C	.	.			trans	-82.8	-171.4	-174.3	0	0	0	0	0	114.3	D680 Q681 T683 E735	G678-D680 PolarHBondContact O-N 3.12Å; G678-Q681 PolarHBondContact O-N 3.09Å; G678-T683 PolarHBondContact N-O 2.82Å; G678-E735 WeakPolarHBondContact CA-OE2 3.21Å
679	L	92.6	Very high	93.8	Very high	6 Å²	6	29.2 Å²	29.2	3%	0.031	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-45.4	130.7	174.3	-63.8	177.6	0	0	0	112.7	Q681 Q682 A732 E735 K736 L739 Y759	L679-Q681 PolarHBondContact O-N 2.87Å; L679-Q682 WeakPolarHBondContact O-CB 3.4Å; L679-Q682 WeakPolarHBondContact O-CG 3.03Å; L679-Q682 PolarHBondContact O-N 3.5Å; L679-A732 HydrophobicContact CD2-CB 4.34Å; L679-E735 HydrophobicContact CD1-CB 4.15Å; L679-E735 HydrophobicContact CD2-CB 4.09Å; L679-E735 HydrophobicContact CG-CB 3.82Å; L679-E735 PolarHBondContact N-OE2 2.89Å; L679-K736 HydrophobicContact CD2-CB 4.34Å; L679-K736 HydrophobicContact CD2-CD 4.35Å; L679-K736 HydrophobicContact CD2-CG 3.33Å; L679-L739 HydrophobicContact CD1-CB 4.35Å; L679-L739 HydrophobicContact CD1-CD2 3.7Å; L679-Y759 HydrophobicContact CB-CD1 3.34Å; L679-Y759 HydrophobicContact CB-CD2 4.28Å; L679-Y759 HydrophobicContact CB-CE1 3.71Å; L679-Y759 HydrophobicContact CB-CG 3.67Å; L679-Y759 HydrophobicContact CD1-CD1 4.19Å; L679-Y759 HydrophobicContact CD1-CD2 3.64Å; L679-Y759 HydrophobicContact CD1-CE1 4.21Å; L679-Y759 HydrophobicContact CD1-CE2 3.65Å; L679-Y759 HydrophobicContact CD1-CG 3.91Å; L679-Y759 HydrophobicContact CG-CD1 4.41Å; L679-Y759 HydrophobicContact CG-CG 4.43Å
680	D	93.4	Very high	93.8	Very high	59 Å²	59	33.1 Å²	33.1	32%	0.316	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	44.6	32.9	179.2	-71.8	13.3	0	0	0	115.2	G678 Q682 V702 Y759 R974	G678-D680 PolarHBondContact O-N 3.12Å; D680-Q682 HydrophobicContact CB-CG 4.09Å; D680-Q682 PolarHBondContact O-N 3.46Å; D680-Q682 VanDerWaalsContact O-N 3.12Å; D680-Q682 PolarHBondContact O-NE2 3.41Å; D680-V702 WeakPolarHBondContact O-CG2 3.41Å; D680-Y759 VanDerWaalsContact CB-O 3.26Å; D680-Y759 WeakPolarHBondContact CB-O 3.25Å; D680-Y759 PolarHBondContact OD2-N 3.11Å; D680-R974 IonicContact OD2-CZ 2.84Å; D680-R974 IonicContact OD2-NH1 3.54Å; D680-R974 PolarHBondContact OD2-NH1 3.27Å
681	Q	94.7	Very high	93.6	Very high	53 Å²	53	35.1 Å²	35.1	25%	0.248	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	53.6	25.1	-175.3	-49.9	-162.6	90.4	0	0	114.4	V677 G678 L679 T683 T699 V702 A705 E706	V677-Q681 HydrophobicContact CG1-CB 4.05Å; V677-Q681 HydrophobicContact CG1-CG 3.95Å; G678-Q681 PolarHBondContact O-N 3.09Å; L679-Q681 PolarHBondContact O-N 2.87Å; Q681-T683 VanDerWaalsContact C-N 3.34Å; Q681-T699 PolarHBondContact O-OG1 2.74Å; Q681-V702 HydrophobicContact CB-CG1 4.27Å; Q681-V702 HydrophobicContact CB-CG2 4.39Å; Q681-A705 HydrophobicContact CB-CB 4.05Å; Q681-A705 VanDerWaalsContact O-CB 3.24Å; Q681-A705 WeakPolarHBondContact O-CB 3.46Å; Q681-E706 PolarHBondContact NE2-OE1 2.99Å
682	Q	94.9	Very high	93.3	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	20%	0.198	C	C	.	.			trans	-79.4	-16.3	-177.8	-61.1	-65.1	-72.2	0	0	114	L679 D680 T699 A700 Y759 L761 E971 R974	L679-Q682 WeakPolarHBondContact O-CB 3.4Å; L679-Q682 WeakPolarHBondContact O-CG 3.03Å; L679-Q682 PolarHBondContact O-N 3.5Å; D680-Q682 HydrophobicContact CB-CG 4.09Å; D680-Q682 PolarHBondContact O-N 3.46Å; D680-Q682 VanDerWaalsContact O-N 3.12Å; D680-Q682 PolarHBondContact O-NE2 3.41Å; Q682-T699 WeakPolarHBondContact CA-OG1 3.21Å; Q682-T699 PolarHBondContact O-N 2.99Å; Q682-T699 PolarHBondContact O-OG1 2.85Å; Q682-A700 PolarHBondContact O-N 3.37Å; Q682-A700 VanDerWaalsContact O-N 3.08Å; Q682-Y759 HydrophobicContact CB-CD1 4.25Å; Q682-Y759 HydrophobicContact CB-CE1 4.09Å; Q682-Y759 HydrophobicContact CG-CD1 3.82Å; Q682-Y759 HydrophobicContact CG-CE1 4.13Å; Q682-L761 HydrophobicContact CB-CD1 4.1Å; Q682-L761 HydrophobicContact CB-CG 4Å; Q682-L761 WeakPolarHBondContact O-CD1 3.36Å; Q682-E971 PolarHBondContact NE2-OE2 3.36Å; Q682-R974 VanDerWaalsContact NE2-NH2 3.14Å
683	T	95.1	Very high	93.2	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.025	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	154.1	177.9	63.2	0	0	0	0	111.2	M633 G678 Q681 L696 L697 D698 L761	M633-T683 HydrophobicContact SD-CG2 3.67Å; G678-T683 PolarHBondContact N-O 2.82Å; Q681-T683 VanDerWaalsContact C-N 3.34Å; T683-L696 HydrophobicContact CG2-CD1 4.32Å; T683-L697 CarbonylContact C-O 3.58Å; T683-L697 VanDerWaalsContact CA-O 3.29Å; T683-L697 WeakPolarHBondContact CA-O 3.26Å; T683-D698 WeakPolarHBondContact CG2-OD1 3.25Å; T683-L761 HydrophobicContact CG2-CD1 4.01Å
684	V	96.8	Very high	93.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.9	172.3	-177.9	0	0	0	0	108.8	V675 L697 T699 A705 F708 L709	V675-V684 HydrophobicContact CG1-CG1 3.43Å; V675-V684 VanDerWaalsContact CG1-CG1 3.43Å; V684-L697 PolarHBondContact N-O 3.33Å; V684-L697 WeakPolarHBondContact O-CA 3.13Å; V684-L697 VanDerWaalsContact O-CB 3.26Å; V684-L697 WeakPolarHBondContact O-CB 3.38Å; V684-L697 PolarHBondContact O-N 3.21Å; V684-T699 HydrophobicContact CG2-CG2 4.02Å; V684-A705 HydrophobicContact CG2-CB 4.23Å; V684-F708 HydrophobicContact CB-CD1 4.31Å; V684-F708 HydrophobicContact CB-CE1 4.47Å; V684-F708 HydrophobicContact CG1-CD1 3.93Å; V684-F708 HydrophobicContact CG1-CE1 3.78Å; V684-F708 HydrophobicContact CG2-CD1 4.37Å; V684-L709 HydrophobicContact CG1-CD2 4.03Å
685	K	95.1	Very high	93.1	Very high	50 Å²	50	46.1 Å²	46.1	22%	0.217	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.6	-175.7	-172.7	171.7	179.6	174.2	0	110.8	S676 V687 F695 L696	S676-K685 PolarHBondContact N-O 3.16Å; S676-K685 PolarHBondContact O-N 2.81Å; K685-V687 HydrophobicContact CG-CG2 4.32Å; K685-F695 CarbonylContact C-O 3.57Å; K685-F695 VanDerWaalsContact CA-O 3.28Å; K685-F695 WeakPolarHBondContact CA-O 3.3Å; K685-L696 HydrophobicContact CB-CD1 4.1Å; K685-L696 HydrophobicContact CD-CD1 4.48Å; K685-L696 HydrophobicContact CG-CD1 4.48Å
686	L	95.9	Very high	93	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	125.1	174.7	-57.8	-179.7	0	0	0	109	V649 L672 V675 Q694 F695 L697 F708 L712	V649-L686 HydrophobicContact CG1-CD1 4.05Å; L672-L686 HydrophobicContact CD1-CB 4.01Å; L672-L686 HydrophobicContact CD1-CD2 4.37Å; V675-L686 HydrophobicContact CG1-CD2 4.3Å; V675-L686 HydrophobicContact CG2-CD2 3.95Å; L686-Q694 CarbonylContact O-C 3.52Å; L686-Q694 VanDerWaalsContact O-CA 3.31Å; L686-Q694 WeakPolarHBondContact O-CA 3.4Å; L686-F695 HydrophobicContact CB-CB 4.38Å; L686-F695 HydrophobicContact CB-CD2 4.47Å; L686-F695 PolarHBondContact N-O 3.27Å; L686-F695 PolarHBondContact O-N 3.48Å; L686-L697 HydrophobicContact CD1-CD1 4.07Å; L686-L697 HydrophobicContact CG-CD1 4.13Å; L686-F708 HydrophobicContact CD2-CE1 4.18Å; L686-F708 HydrophobicContact CD2-CZ 4.18Å; L686-L712 HydrophobicContact CD2-CD2 4.26Å
687	V	94.5	Very high	93	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.6	178.4	-175.8	0	0	0	0	110	D673 Y674 K685 R691	D673-V687 PolarHBondContact N-O 3.4Å; Y674-V687 HydrophobicContact CD1-CB 4.2Å; Y674-V687 HydrophobicContact CD1-CG1 4.26Å; Y674-V687 HydrophobicContact CD2-CB 4.29Å; Y674-V687 HydrophobicContact CD2-CG2 4.27Å; Y674-V687 HydrophobicContact CE1-CB 3.94Å; Y674-V687 HydrophobicContact CE1-CG1 3.65Å; Y674-V687 HydrophobicContact CE1-CG2 4.41Å; Y674-V687 HydrophobicContact CE2-CB 4.04Å; Y674-V687 HydrophobicContact CE2-CG1 4.47Å; Y674-V687 HydrophobicContact CE2-CG2 3.73Å; Y674-V687 HydrophobicContact CG-CB 4.36Å; Y674-V687 PolarHBondContact N-O 3.46Å; Y674-V687 PolarHBondContact O-N 3.22Å; K685-V687 HydrophobicContact CG-CG2 4.32Å; V687-R691 HydrophobicContact CG1-CG 4.46Å
688	C	94.1	Very high	92.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	159	179.2	-55.2	0	0	0	0	111.6	E671 N690 R691 K693	E671-C688 CarbonylContact O-C 3.57Å; E671-C688 WeakPolarHBondContact O-CA 3.42Å; E671-C688 WeakPolarHBondContact O-CB 3.31Å; C688-N690 CarbonylContact O-C 3.59Å; C688-N690 PolarHBondContact O-N 3.26Å; C688-R691 PolarHBondContact O-N 3.31Å; C688-K693 HydrophobicContact CB-CB 3.81Å; C688-K693 WeakPolarHBondContact CB-O 3.33Å; C688-K693 PolarHBondContact N-O 3.35Å; C688-K693 VanDerWaalsContact N-O 3.08Å
689	T	91	Very high	92.9	Very high	88 Å²	88	47.3 Å²	47.3	54%	0.54	22%	0.216	S	C	.	.	S	Bend	trans	-54.8	-40.5	174.7	52.6	0	0	0	0	111.5	E671 D673 R691	E671-T689 PolarHBondContact O-N 3.27Å; E671-T689 PolarHBondContact O-OG1 3.33Å; D673-T689 HydrophobicContact CB-CG2 4.13Å; T689-R691 PolarHBondContact O-N 2.84Å; T689-R691 VanDerWaalsContact O-N 3.11Å
690	N	90.1	Very high	92.9	Very high	89 Å²	89	47.2 Å²	47.2	48%	0.476	22%	0.216	S	C	.	.	S	Bend	trans	-73.9	91.7	156.8	178.5	5.6	0	0	0	109.6	C688 R692 K693	C688-N690 CarbonylContact O-C 3.59Å; C688-N690 PolarHBondContact O-N 3.26Å; N690-R692 PolarHBondContact O-N 3.11Å; N690-R692 WeakPolarHBondContact OD1-CB 3.38Å; N690-R692 PolarHBondContact OD1-N 3.04Å; N690-K693 PolarHBondContact O-N 3.03Å
691	R	84.8	Confident	92.9	Very high	164 Å²	164	44.8 Å²	44.8	62%	0.619	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-1.6	-177.1	-64.6	-177.2	175.1	-177.2	-3.4	116.2	D673 V687 C688 T689	D673-R691 IonicContact OD2-CZ 3.28Å; D673-R691 IonicContact OD2-NE 3.84Å; D673-R691 PolarHBondContact OD2-NE 3.19Å; D673-R691 IonicContact OD2-NH2 3.33Å; D673-R691 PolarHBondContact OD2-NH2 3.12Å; V687-R691 HydrophobicContact CG1-CG 4.46Å; C688-R691 PolarHBondContact O-N 3.31Å; T689-R691 PolarHBondContact O-N 2.84Å; T689-R691 VanDerWaalsContact O-N 3.11Å
692	R	85.4	Confident	92.9	Very high	229 Å²	229	43.7 Å²	43.7	86%	0.864	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-27.7	166.6	-61	-176.3	179.5	-176	0.8	112.2	N690	N690-R692 PolarHBondContact O-N 3.11Å; N690-R692 WeakPolarHBondContact OD1-CB 3.38Å; N690-R692 PolarHBondContact OD1-N 3.04Å
693	K	90.6	Very high	92.9	Very high	55 Å²	55	45.3 Å²	45.3	24%	0.239	21%	0.213	C	C	.	.			trans	-84.3	105.6	167.3	-79.4	-162	171.3	-158	0	109.1	E665 C688 N690 F695	E665-K693 VanDerWaalsContact CD-NZ 3.26Å; E665-K693 WeakPolarHBondContact OE1-CE 3.15Å; E665-K693 IonicContact OE1-NZ 3.97Å; E665-K693 PolarHBondContact OE1-NZ 2.91Å; E665-K693 IonicContact OE2-NZ 3.38Å; E665-K693 PolarHBondContact OE2-NZ 3.1Å; C688-K693 HydrophobicContact CB-CB 3.81Å; C688-K693 WeakPolarHBondContact CB-O 3.33Å; C688-K693 PolarHBondContact N-O 3.35Å; C688-K693 VanDerWaalsContact N-O 3.08Å; N690-K693 PolarHBondContact O-N 3.03Å; K693-F695 HydrophobicContact CB-CE2 4.02Å; K693-F695 HydrophobicContact CB-CZ 3.94Å; K693-F695 HydrophobicContact CD-CE2 4.39Å; K693-F695 HydrophobicContact CD-CZ 4.05Å; K693-F695 HydrophobicContact CG-CZ 4.04Å
694	Q	92	Very high	92.9	Very high	99 Å²	99	45.4 Å²	45.4	46%	0.463	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	133.6	173.8	51.2	171.8	-5.9	0	0	108.3	L686	L686-Q694 CarbonylContact O-C 3.52Å; L686-Q694 VanDerWaalsContact O-CA 3.31Å; L686-Q694 WeakPolarHBondContact O-CA 3.4Å
695	F	93.9	Very high	92.8	Very high	34 Å²	34	45.4 Å²	45.4	15%	0.149	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.7	-172.8	-51.5	-69.4	0	0	0	109.4	L651 E665 V667 K685 L686 K693	L651-F695 HydrophobicContact CD1-CB 3.74Å; L651-F695 HydrophobicContact CD1-CD1 3.9Å; L651-F695 HydrophobicContact CD1-CD2 4.31Å; L651-F695 HydrophobicContact CD1-CG 3.7Å; E665-F695 HydrophobicContact CB-CE1 4.24Å; E665-F695 HydrophobicContact CB-CZ 4.23Å; E665-F695 HydrophobicContact CG-CE1 3.67Å; E665-F695 HydrophobicContact CG-CZ 3.74Å; V667-F695 HydrophobicContact CG2-CD2 3.89Å; V667-F695 HydrophobicContact CG2-CE2 3.47Å; V667-F695 VanDerWaalsContact CG2-CE2 3.47Å; V667-F695 HydrophobicContact CG2-CZ 4.36Å; K685-F695 CarbonylContact C-O 3.57Å; K685-F695 VanDerWaalsContact CA-O 3.28Å; K685-F695 WeakPolarHBondContact CA-O 3.3Å; L686-F695 HydrophobicContact CB-CB 4.38Å; L686-F695 HydrophobicContact CB-CD2 4.47Å; L686-F695 PolarHBondContact N-O 3.27Å; L686-F695 PolarHBondContact O-N 3.48Å; K693-F695 HydrophobicContact CB-CE2 4.02Å; K693-F695 HydrophobicContact CB-CZ 3.94Å; K693-F695 HydrophobicContact CD-CE2 4.39Å; K693-F695 HydrophobicContact CD-CZ 4.05Å; K693-F695 HydrophobicContact CG-CZ 4.04Å
696	L	92.9	Very high	92.8	Very high	49 Å²	49	47.3 Å²	47.3	26%	0.257	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.7	176.6	-178.1	64.2	0	0	0	109.2	M633 T683 K685 C919	M633-L696 HydrophobicContact SD-CD2 4.46Å; T683-L696 HydrophobicContact CG2-CD1 4.32Å; K685-L696 HydrophobicContact CB-CD1 4.1Å; K685-L696 HydrophobicContact CD-CD1 4.48Å; K685-L696 HydrophobicContact CG-CD1 4.48Å; L696-C919 HydrophobicContact CD2-CB 4.01Å; L696-C919 VanDerWaalsContact CD2-SG 3.56Å
697	L	95.4	Very high	92.7	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.3	178.8	-48.3	171.7	0	0	0	107.9	M628 L640 V642 L651 T683 V684 L686 F708	M628-L697 HydrophobicContact CE-CB 3.78Å; M628-L697 HydrophobicContact CE-CD1 4.5Å; M628-L697 HydrophobicContact SD-CB 4.44Å; M628-L697 HydrophobicContact SD-CD1 4.38Å; L640-L697 HydrophobicContact CD2-CD2 3.58Å; V642-L697 HydrophobicContact CG2-CD1 4.18Å; V642-L697 HydrophobicContact CG2-CD2 4.08Å; L651-L697 HydrophobicContact CD2-CD2 4.08Å; T683-L697 CarbonylContact C-O 3.58Å; T683-L697 VanDerWaalsContact CA-O 3.29Å; T683-L697 WeakPolarHBondContact CA-O 3.26Å; V684-L697 PolarHBondContact N-O 3.33Å; V684-L697 WeakPolarHBondContact O-CA 3.13Å; V684-L697 VanDerWaalsContact O-CB 3.26Å; V684-L697 WeakPolarHBondContact O-CB 3.38Å; V684-L697 PolarHBondContact O-N 3.21Å; L686-L697 HydrophobicContact CD1-CD1 4.07Å; L686-L697 HydrophobicContact CG-CD1 4.13Å; L697-F708 HydrophobicContact CD1-CE1 4.18Å; L697-F708 HydrophobicContact CD1-CZ 4.01Å
698	D	94.4	Very high	92.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.4	174.6	-57.1	-42.8	0	0	0	108.6	S629 T630 G631 H632 T683 L761	S629-D698 PolarHBondContact N-O 2.74Å; S629-D698 PolarHBondContact O-N 2.86Å; S629-D698 PolarHBondContact OG-O 3.3Å; T630-D698 WeakPolarHBondContact CA-OD2 3.44Å; G631-D698 PolarHBondContact N-OD2 2.89Å; H632-D698 HydrophobicContact CB-CB 4.03Å; H632-D698 WeakPolarHBondContact CB-OD2 2.94Å; H632-D698 PolarHBondContact N-OD2 2.8Å; T683-D698 WeakPolarHBondContact CG2-OD1 3.25Å; D698-L761 HydrophobicContact CB-CD1 4.08Å
699	T	93.6	Very high	92.9	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.043	23%	0.227	C	C	.	.			trans	-89.7	-38.6	172.6	63.1	0	0	0	0	110.3	M628 Q681 Q682 V684 D701 A705	M628-T699 HydrophobicContact CE-CG2 3.42Å; M628-T699 VanDerWaalsContact CE-CG2 3.42Å; Q681-T699 PolarHBondContact O-OG1 2.74Å; Q682-T699 WeakPolarHBondContact CA-OG1 3.21Å; Q682-T699 PolarHBondContact O-N 2.99Å; Q682-T699 PolarHBondContact O-OG1 2.85Å; V684-T699 HydrophobicContact CG2-CG2 4.02Å; T699-D701 WeakPolarHBondContact CB-O 3.26Å; T699-D701 PolarHBondContact O-N 3.23Å; T699-D701 PolarHBondContact OG1-N 2.84Å; T699-D701 PolarHBondContact OG1-O 3.38Å; T699-A705 HydrophobicContact CG2-CB 3.75Å
700	A	92.9	Very high	93	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.033	22%	0.224	C	C	.	.			trans	52.3	12	-167.6	0	0	0	0	0	114.4	Q682 L761 S967	Q682-A700 PolarHBondContact O-N 3.37Å; Q682-A700 VanDerWaalsContact O-N 3.08Å; A700-L761 HydrophobicContact CB-CB 3.74Å; A700-L761 HydrophobicContact CB-CD1 4.23Å; A700-S967 VanDerWaalsContact O-CB 3.23Å; A700-S967 WeakPolarHBondContact O-CB 3.43Å; A700-S967 PolarHBondContact O-OG 2.89Å
701	D	93.2	Very high	93.2	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.043	20%	0.203	C	C	.	.	S	Bend	trans	-155.7	125.3	-171	-176.1	-30.8	0	0	0	108.8	H596 T699 A703 L704 A705 C968	H596-D701 IonicContact CE1-OD2 3.89Å; H596-D701 PolarHBondContact CE1-OD2 3.45Å; H596-D701 IonicContact NE2-OD1 2.71Å; H596-D701 IonicContact NE2-OD2 3.61Å; H596-D701 PolarHBondContact NE2-OD2 2.9Å; T699-D701 WeakPolarHBondContact CB-O 3.26Å; T699-D701 PolarHBondContact O-N 3.23Å; T699-D701 PolarHBondContact OG1-N 2.84Å; T699-D701 PolarHBondContact OG1-O 3.38Å; D701-A703 WeakPolarHBondContact OD1-CB 3.42Å; D701-A703 PolarHBondContact OD1-N 3.25Å; D701-L704 HydrophobicContact CB-CB 3.86Å; D701-L704 PolarHBondContact O-N 3.16Å; D701-L704 PolarHBondContact OD1-N 2.98Å; D701-A705 PolarHBondContact O-N 2.8Å; D701-A705 VanDerWaalsContact O-N 3.07Å; D701-C968 PolarHBondContact OD2-SG 3.29Å
702	V	94.4	Very high	93.7	Very high	30 Å²	30	35.1 Å²	35.1	18%	0.182	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-41.2	-179.4	178.9	0	0	0	0	111.7	D680 Q681 L704 A705 E706 E971	D680-V702 WeakPolarHBondContact O-CG2 3.41Å; Q681-V702 HydrophobicContact CB-CG1 4.27Å; Q681-V702 HydrophobicContact CB-CG2 4.39Å; V702-L704 VanDerWaalsContact C-N 3.32Å; V702-L704 PolarHBondContact O-N 3.24Å; V702-A705 WeakPolarHBondContact O-CB 3.41Å; V702-A705 PolarHBondContact O-N 3.12Å; V702-E706 WeakPolarHBondContact O-CG 3.26Å; V702-E706 PolarHBondContact O-N 2.82Å; V702-E971 WeakPolarHBondContact CG2-OE1 2.94Å
703	A	94.6	Very high	94	Very high	35 Å²	35	29.6 Å²	29.6	29%	0.289	16%	0.157	S	C	.	.	H	α-helix	trans	-70.4	-31.2	-179.4	0	0	0	0	0	111.7	D701 L707	D701-A703 WeakPolarHBondContact OD1-CB 3.42Å; D701-A703 PolarHBondContact OD1-N 3.25Å; A703-L707 WeakPolarHBondContact O-CB 3.41Å; A703-L707 PolarHBondContact O-N 2.84Å
704	L	94.6	Very high	94.1	Very high	6 Å²	6	29 Å²	29	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-69.5	-40	172.2	-175.2	53.6	0	0	0	112.1	I626 D701 V702 L707 F708	I626-L704 HydrophobicContact CG2-CD1 3.62Å; D701-L704 HydrophobicContact CB-CB 3.86Å; D701-L704 PolarHBondContact O-N 3.16Å; D701-L704 PolarHBondContact OD1-N 2.98Å; V702-L704 VanDerWaalsContact C-N 3.32Å; V702-L704 PolarHBondContact O-N 3.24Å; L704-L707 PolarHBondContact O-N 2.8Å; L704-F708 WeakPolarHBondContact O-CB 3.09Å; L704-F708 PolarHBondContact O-N 2.81Å
705	A	95.3	Very high	94.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-48.4	174.1	0	0	0	0	0	111.4	Q681 V684 T699 D701 V702 F708 L709	Q681-A705 HydrophobicContact CB-CB 4.05Å; Q681-A705 VanDerWaalsContact O-CB 3.24Å; Q681-A705 WeakPolarHBondContact O-CB 3.46Å; V684-A705 HydrophobicContact CG2-CB 4.23Å; T699-A705 HydrophobicContact CG2-CB 3.75Å; D701-A705 PolarHBondContact O-N 2.8Å; D701-A705 VanDerWaalsContact O-N 3.07Å; V702-A705 WeakPolarHBondContact O-CB 3.41Å; V702-A705 PolarHBondContact O-N 3.12Å; A705-F708 PolarHBondContact O-N 2.65Å; A705-L709 VanDerWaalsContact O-CG 3.28Å; A705-L709 WeakPolarHBondContact O-CG 3.02Å; A705-L709 PolarHBondContact O-N 3.13Å
706	E	94.8	Very high	93.9	Very high	90 Å²	90	23 Å²	23	42%	0.421	13%	0.133	S	C	.	.	H	α-helix	trans	-64.2	-41.4	178.3	-71.1	-179.4	-175.3	0	0	112.1	Q681 V702 A710	Q681-E706 PolarHBondContact NE2-OE1 2.99Å; V702-E706 WeakPolarHBondContact O-CG 3.26Å; V702-E706 PolarHBondContact O-N 2.82Å; E706-A710 VanDerWaalsContact O-CB 3.26Å; E706-A710 WeakPolarHBondContact O-CB 3.37Å; E706-A710 PolarHBondContact O-N 2.91Å
707	L	94.9	Very high	93.7	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-60.7	-45.2	172.4	177.8	62.2	0	0	0	111.7	M594 H596 A703 L704 A710 S711	M594-L707 HydrophobicContact CB-CD1 4.26Å; M594-L707 VanDerWaalsContact O-CD1 3.29Å; M594-L707 WeakPolarHBondContact O-CD1 3.36Å; H596-L707 HydrophobicContact CB-CD2 3.36Å; A703-L707 WeakPolarHBondContact O-CB 3.41Å; A703-L707 PolarHBondContact O-N 2.84Å; L704-L707 PolarHBondContact O-N 2.8Å; L707-A710 PolarHBondContact O-N 3.05Å; L707-S711 WeakPolarHBondContact O-CB 3.31Å; L707-S711 PolarHBondContact O-N 2.87Å; L707-S711 PolarHBondContact O-OG 3.4Å
708	F	96.1	Very high	93.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-49.2	-179.8	173.6	-105.2	0	0	0	111.1	I626 M628 V642 L644 V684 L686 L697 L704 A705 A710 S711 L712	I626-F708 HydrophobicContact CD1-CD2 4.19Å; M628-F708 HydrophobicContact SD-CD2 4.15Å; M628-F708 HydrophobicContact SD-CG 4.35Å; V642-F708 HydrophobicContact CB-CE2 4.42Å; V642-F708 HydrophobicContact CG1-CD2 4.44Å; V642-F708 HydrophobicContact CG1-CE2 3.63Å; V642-F708 HydrophobicContact CG1-CZ 4.33Å; L644-F708 HydrophobicContact CD2-CE2 4.25Å; V684-F708 HydrophobicContact CB-CD1 4.31Å; V684-F708 HydrophobicContact CB-CE1 4.47Å; V684-F708 HydrophobicContact CG1-CD1 3.93Å; V684-F708 HydrophobicContact CG1-CE1 3.78Å; V684-F708 HydrophobicContact CG2-CD1 4.37Å; L686-F708 HydrophobicContact CD2-CE1 4.18Å; L686-F708 HydrophobicContact CD2-CZ 4.18Å; L697-F708 HydrophobicContact CD1-CE1 4.18Å; L697-F708 HydrophobicContact CD1-CZ 4.01Å; L704-F708 WeakPolarHBondContact O-CB 3.09Å; L704-F708 PolarHBondContact O-N 2.81Å; A705-F708 PolarHBondContact O-N 2.65Å; F708-A710 PolarHBondContact O-N 3.29Å; F708-S711 PolarHBondContact O-N 3.31Å; F708-L712 HydrophobicContact CE1-CD2 4.05Å; F708-L712 HydrophobicContact CZ-CB 4.48Å; F708-L712 HydrophobicContact CZ-CD2 4.06Å; F708-L712 VanDerWaalsContact O-CB 3.29Å; F708-L712 WeakPolarHBondContact O-CB 3.25Å; F708-L712 PolarHBondContact O-N 2.89Å
709	L	95.1	Very high	92.7	Very high	17 Å²	17	32.3 Å²	32.3	9%	0.089	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-40.3	-179.7	-64.9	167.3	0	0	0	112.2	V675 V677 V684 A705 K713 I728	V675-L709 HydrophobicContact CG1-CD2 3.84Å; V677-L709 HydrophobicContact CG2-CD1 3.62Å; V677-L709 HydrophobicContact CG2-CD2 4.22Å; V684-L709 HydrophobicContact CG1-CD2 4.03Å; A705-L709 VanDerWaalsContact O-CG 3.28Å; A705-L709 WeakPolarHBondContact O-CG 3.02Å; A705-L709 PolarHBondContact O-N 3.13Å; L709-K713 WeakPolarHBondContact O-CB 3.02Å; L709-K713 PolarHBondContact O-N 2.81Å; L709-I728 HydrophobicContact CD2-CD1 4.35Å; L709-I728 HydrophobicContact CD2-CG2 4.2Å
710	A	94.1	Very high	91.5	Very high	58 Å²	58	37.5 Å²	37.5	48%	0.479	22%	0.217	S	C	.	.	H	α-helix	trans	-65.7	-40.3	174.4	0	0	0	0	0	112.2	E706 L707 F708 S714	E706-A710 VanDerWaalsContact O-CB 3.26Å; E706-A710 WeakPolarHBondContact O-CB 3.37Å; E706-A710 PolarHBondContact O-N 2.91Å; L707-A710 PolarHBondContact O-N 3.05Å; F708-A710 PolarHBondContact O-N 3.29Å; A710-S714 VanDerWaalsContact O-CB 3.3Å; A710-S714 WeakPolarHBondContact O-CB 3.36Å; A710-S714 PolarHBondContact O-N 2.9Å
711	S	94.7	Very high	90.8	Very high	5 Å²	5	39.5 Å²	39.5	4%	0.035	22%	0.223	C	C	.	.	H	α-helix	trans	-67.4	-47.5	178.2	-60.9	0	0	0	0	111.5	F623 L707 F708 K713 S714 A715	F623-S711 WeakPolarHBondContact CE1-O 3.47Å; L707-S711 WeakPolarHBondContact O-CB 3.31Å; L707-S711 PolarHBondContact O-N 2.87Å; L707-S711 PolarHBondContact O-OG 3.4Å; F708-S711 PolarHBondContact O-N 3.31Å; S711-K713 PolarHBondContact O-N 2.86Å; S711-S714 PolarHBondContact O-N 2.86Å; S711-A715 WeakPolarHBondContact O-CB 3.4Å; S711-A715 PolarHBondContact O-N 2.78Å
712	L	94.5	Very high	89.9	Confident	6 Å²	6	47 Å²	47	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-56.4	-50.5	176	176.3	60.6	0	0	0	110.9	L644 V649 Y669 V675 L686 F708 S714 A715 M716	L644-L712 HydrophobicContact CD1-CB 4.48Å; L644-L712 HydrophobicContact CD2-CD1 3.96Å; V649-L712 HydrophobicContact CG2-CD1 3.84Å; Y669-L712 HydrophobicContact CD1-CD1 4.22Å; Y669-L712 HydrophobicContact CE1-CD1 3.53Å; V675-L712 HydrophobicContact CG2-CD2 4.02Å; L686-L712 HydrophobicContact CD2-CD2 4.26Å; F708-L712 HydrophobicContact CE1-CD2 4.05Å; F708-L712 HydrophobicContact CZ-CB 4.48Å; F708-L712 HydrophobicContact CZ-CD2 4.06Å; F708-L712 VanDerWaalsContact O-CB 3.29Å; F708-L712 WeakPolarHBondContact O-CB 3.25Å; F708-L712 PolarHBondContact O-N 2.89Å; L712-S714 VanDerWaalsContact C-N 3.31Å; L712-S714 PolarHBondContact O-N 3.01Å; L712-A715 PolarHBondContact O-N 3.48Å; L712-M716 HydrophobicContact CD1-CG 4.29Å; L712-M716 HydrophobicContact CD1-SD 3.85Å; L712-M716 HydrophobicContact CG-SD 3.97Å; L712-M716 WeakPolarHBondContact O-CG 3.28Å; L712-M716 PolarHBondContact O-N 2.67Å
713	K	91.5	Very high	89	Confident	112 Å²	112	50.2 Å²	50.2	49%	0.487	28%	0.28	S	S	.	.	H	α-helix	trans	-58.8	-41.7	176.5	-177.4	179.8	178	-178.1	0	112.5	L709 S711 I717	L709-K713 WeakPolarHBondContact O-CB 3.02Å; L709-K713 PolarHBondContact O-N 2.81Å; S711-K713 PolarHBondContact O-N 2.86Å; K713-I717 HydrophobicContact CG-CD1 3.98Å; K713-I717 WeakPolarHBondContact O-CD1 3.47Å; K713-I717 VanDerWaalsContact O-CG1 3.24Å; K713-I717 WeakPolarHBondContact O-CG1 3.18Å; K713-I717 PolarHBondContact O-N 2.92Å; K713-I717 VanDerWaalsContact O-N 3.15Å
714	S	92.1	Very high	88.4	Confident	44 Å²	44	54 Å²	54	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-70.5	-40.2	-179.4	-171	0	0	0	0	112.3	F623 A710 S711 L712 I717 K718	F623-S714 WeakPolarHBondContact CE2-OG 3.35Å; F623-S714 VanDerWaalsContact CZ-CB 3.46Å; F623-S714 WeakPolarHBondContact CZ-OG 3.45Å; A710-S714 VanDerWaalsContact O-CB 3.3Å; A710-S714 WeakPolarHBondContact O-CB 3.36Å; A710-S714 PolarHBondContact O-N 2.9Å; S711-S714 PolarHBondContact O-N 2.86Å; L712-S714 VanDerWaalsContact C-N 3.31Å; L712-S714 PolarHBondContact O-N 3.01Å; S714-I717 PolarHBondContact O-N 2.79Å; S714-K718 WeakPolarHBondContact O-CG 3.39Å; S714-K718 PolarHBondContact O-N 3.03Å
715	A	92.7	Very high	87.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-48.2	173.5	0	0	0	0	0	111.5	F623 L644 Y669 S711 L712 I717 K718 G719	F623-A715 HydrophobicContact CB-CB 3.88Å; F623-A715 HydrophobicContact CD1-CB 3.82Å; F623-A715 HydrophobicContact CD2-CB 3.87Å; F623-A715 HydrophobicContact CE1-CB 4.42Å; F623-A715 HydrophobicContact CE2-CB 4.42Å; F623-A715 HydrophobicContact CG-CB 3.55Å; L644-A715 HydrophobicContact CB-CB 4.28Å; Y669-A715 VanDerWaalsContact OH-CB 3.29Å; Y669-A715 WeakPolarHBondContact OH-CB 3.43Å; S711-A715 WeakPolarHBondContact O-CB 3.4Å; S711-A715 PolarHBondContact O-N 2.78Å; L712-A715 PolarHBondContact O-N 3.48Å; A715-I717 VanDerWaalsContact C-N 3.3Å; A715-I717 PolarHBondContact O-N 2.93Å; A715-K718 PolarHBondContact O-N 3.39Å; A715-K718 VanDerWaalsContact O-N 3.16Å; A715-G719 PolarHBondContact O-N 2.84Å
716	M	90.3	Very high	87.6	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.03	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-31.2	178.4	-66.5	175.3	69.8	0	0	113.9	Y669 L712 R721 Y725 P726	Y669-M716 HydrophobicContact CD1-CE 4.29Å; Y669-M716 HydrophobicContact CD1-CG 3.45Å; Y669-M716 VanDerWaalsContact CD1-CG 3.45Å; Y669-M716 HydrophobicContact CD1-SD 3.88Å; Y669-M716 HydrophobicContact CD2-CG 3.93Å; Y669-M716 HydrophobicContact CE1-CG 3.57Å; Y669-M716 HydrophobicContact CE1-SD 4.22Å; Y669-M716 HydrophobicContact CE2-CG 4.03Å; Y669-M716 HydrophobicContact CG-CE 4.4Å; Y669-M716 HydrophobicContact CG-CG 3.66Å; Y669-M716 HydrophobicContact CG-SD 4.43Å; L712-M716 HydrophobicContact CD1-CG 4.29Å; L712-M716 HydrophobicContact CD1-SD 3.85Å; L712-M716 HydrophobicContact CG-SD 3.97Å; L712-M716 WeakPolarHBondContact O-CG 3.28Å; L712-M716 PolarHBondContact O-N 2.67Å; M716-R721 VanDerWaalsContact CE-NH1 3.27Å; M716-Y725 HydrophobicContact CB-CD1 4.31Å; M716-Y725 HydrophobicContact CB-CE1 4.38Å; M716-Y725 HydrophobicContact CE-CD1 4.21Å; M716-P726 HydrophobicContact CE-CG 3.84Å
717	I	89	Confident	87.4	Confident	86 Å²	86	57.7 Å²	57.7	44%	0.441	32%	0.324	S	S	.	.	H	α-helix	trans	-74.3	-40.2	173.9	-69.9	163.3	0	0	0	111	K713 S714 A715 Y725	K713-I717 HydrophobicContact CG-CD1 3.98Å; K713-I717 WeakPolarHBondContact O-CD1 3.47Å; K713-I717 VanDerWaalsContact O-CG1 3.24Å; K713-I717 WeakPolarHBondContact O-CG1 3.18Å; K713-I717 PolarHBondContact O-N 2.92Å; K713-I717 VanDerWaalsContact O-N 3.15Å; S714-I717 PolarHBondContact O-N 2.79Å; A715-I717 VanDerWaalsContact C-N 3.3Å; A715-I717 PolarHBondContact O-N 2.93Å; I717-Y725 HydrophobicContact CG1-CE1 4.33Å; I717-Y725 HydrophobicContact CG1-CE2 4.06Å
718	K	85.9	Confident	87.4	Confident	135 Å²	135	61.1 Å²	61.1	59%	0.587	34%	0.342	S	S	*	.	H	α-helix	trans	-71.2	-33.4	177.8	-71.4	-171.6	-170.9	175.4	0	112.6	F623 S714 A715 C720	F623-K718 HydrophobicContact CD2-CD 3.95Å; F623-K718 HydrophobicContact CE2-CD 3.8Å; S714-K718 WeakPolarHBondContact O-CG 3.39Å; S714-K718 PolarHBondContact O-N 3.03Å; A715-K718 PolarHBondContact O-N 3.39Å; A715-K718 VanDerWaalsContact O-N 3.16Å; K718-C720 PolarHBondContact O-N 2.87Å
719	G	82.1	Confident	87.3	Confident	24 Å²	24	64.2 Å²	64.2	25%	0.247	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	23.5	175.8	0	0	0	0	0	115.6	D646 A715 R721	D646-G719 WeakPolarHBondContact O-CA 3.26Å; A715-G719 PolarHBondContact O-N 2.84Å; G719-R721 PolarHBondContact O-N 3.02Å
720	C	69.7	Low	87.1	Confident	117 Å²	117	67.9 Å²	67.9	79%	0.791	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	19	174.2	-62.8	0	0	0	0	116.3	K718 E722	K718-C720 PolarHBondContact O-N 2.87Å; C720-E722 PolarHBondContact O-N 3.4Å
721	R	77.3	Confident	86.8	Confident	46 Å²	46	68.8 Å²	68.8	17%	0.174	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-68.7	123.8	177.1	173.9	176.9	170.7	167.3	6.6	110.2	Y669 M716 G719 P724 Y725	Y669-R721 VanDerWaalsContact C-NH1 3.32Å; Y669-R721 PolarHBondContact O-NH1 2.72Å; M716-R721 VanDerWaalsContact CE-NH1 3.27Å; G719-R721 PolarHBondContact O-N 3.02Å; R721-P724 PolarHBondContact NH2-O 3.26Å; R721-Y725 HydrophobicContact CB-CE1 4.3Å; R721-Y725 HydrophobicContact CG-CD1 4.46Å; R721-Y725 HydrophobicContact CG-CE1 4.31Å; R721-Y725 WeakPolarHBondContact O-CE1 3.19Å; R721-Y725 PolarHBondContact O-OH 3.03Å
722	E	73.4	Confident	86.6	Confident	166 Å²	166	68.8 Å²	68.8	78%	0.776	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-67.9	144.2	173.2	-62.4	-165	153.3	0	0	112.3	C720	C720-E722 PolarHBondContact O-N 3.4Å
723	P	77.5	Confident	86.4	Confident	97 Å²	97	71.8 Å²	71.8	63%	0.63	40%	0.397	S	S	*	.	S	Bend	trans	-69.4	150.9	174.8	29.7	-34.9	0	0	0	111.6	Y725	P723-Y725 HydrophobicContact CB-CD2 4.48Å; P723-Y725 HydrophobicContact CB-CE2 4.33Å
724	P	80.1	Confident	86.3	Confident	114 Å²	114	73.2 Å²	73.2	74%	0.74	41%	0.407	S	S	*	.	P	Polyproline II helix	cis	-80.8	137	14.5	30.8	-35.4	0	0	0	114.4	R721	R721-P724 PolarHBondContact NH2-O 3.26Å
725	Y	85.7	Confident	86.2	Confident	86 Å²	86	73.1 Å²	73.1	34%	0.337	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-73.5	153.3	162.6	-55.6	-65.2	0	0	0	110	M716 I717 R721 P723	M716-Y725 HydrophobicContact CB-CD1 4.31Å; M716-Y725 HydrophobicContact CB-CE1 4.38Å; M716-Y725 HydrophobicContact CE-CD1 4.21Å; I717-Y725 HydrophobicContact CG1-CE1 4.33Å; I717-Y725 HydrophobicContact CG1-CE2 4.06Å; R721-Y725 HydrophobicContact CB-CE1 4.3Å; R721-Y725 HydrophobicContact CG-CD1 4.46Å; R721-Y725 HydrophobicContact CG-CE1 4.31Å; R721-Y725 WeakPolarHBondContact O-CE1 3.19Å; R721-Y725 PolarHBondContact O-OH 3.03Å; P723-Y725 HydrophobicContact CB-CD2 4.48Å; P723-Y725 HydrophobicContact CB-CE2 4.33Å
726	P	88.2	Confident	86.1	Confident	21 Å²	21	78 Å²	78	14%	0.136	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-55.5	144.5	176.8	-26.6	38.7	0	0	0	111.8	L672 M716	L672-P726 HydrophobicContact CB-CG 3.98Å; L672-P726 HydrophobicContact CD2-CB 4.2Å; L672-P726 HydrophobicContact CD2-CG 3.99Å; L672-P726 HydrophobicContact CG-CB 4.44Å; L672-P726 HydrophobicContact CG-CG 4.24Å; L672-P726 WeakPolarHBondContact O-CG 3.35Å; M716-P726 HydrophobicContact CE-CG 3.84Å
727	S	91.1	Very high	86.2	Confident	67 Å²	67	81.9 Å²	81.9	47%	0.469	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	146.4	175.7	50.1	0	0	0	0	110.9	Y674 V675	Y674-S727 WeakPolarHBondContact CA-O 3.49Å; Y674-S727 WeakPolarHBondContact CB-O 3.41Å; Y674-S727 WeakPolarHBondContact CB-OG 3.5Å; V675-S727 PolarHBondContact N-O 2.7Å
728	I	94	Very high	86.4	Confident	77 Å²	77	78.4 Å²	78.4	40%	0.395	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	116	169.7	-55.6	173.3	0	0	0	106.6	V675 V677 L709 T730	V675-I728 HydrophobicContact CB-CG1 4.43Å; V675-I728 CarbonylContact O-C 3.49Å; V675-I728 WeakPolarHBondContact O-CA 3.43Å; V677-I728 HydrophobicContact CG2-CG2 3.82Å; L709-I728 HydrophobicContact CD2-CD1 4.35Å; L709-I728 HydrophobicContact CD2-CG2 4.2Å; I728-T730 HydrophobicContact CG2-CG2 4.1Å
729	L	93.9	Very high	86.8	Confident	65 Å²	65	72.1 Å²	72.1	34%	0.34	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128	177.1	-52.5	-178.4	0	0	0	108.5	Y674 V675 V677	Y674-L729 HydrophobicContact CD2-CD1 3.59Å; Y674-L729 HydrophobicContact CD2-CG 4.11Å; Y674-L729 HydrophobicContact CE2-CD1 3.75Å; Y674-L729 HydrophobicContact CG-CD1 4.33Å; V675-L729 PolarHBondContact O-N 2.71Å; V677-L729 PolarHBondContact N-O 2.78Å
730	T	92.5	Very high	87.3	Confident	93 Å²	93	71.8 Å²	71.8	57%	0.571	40%	0.395	S	S	*	.			trans	-126.6	7.3	-176.2	57.8	0	0	0	0	112.8	V677 I728	V677-T730 HydrophobicContact CB-CG2 4.16Å; V677-T730 HydrophobicContact CG2-CG2 4.03Å; I728-T730 HydrophobicContact CG2-CG2 4.1Å
731	D	87.8	Confident	88.4	Confident	78 Å²	78	72.3 Å²	72.3	42%	0.417	38%	0.384	S	S	.	.			trans	-77.4	-28.8	-179	66.8	-66.3	0	0	0	112.5	T733 K736	D731-T733 PolarHBondContact O-N 2.94Å; D731-T733 VanDerWaalsContact O-N 3.1Å; D731-T733 WeakPolarHBondContact OD2-CB 3.46Å; D731-T733 PolarHBondContact OD2-N 3.29Å; D731-T733 VanDerWaalsContact OD2-N 3.07Å; D731-T733 PolarHBondContact OD2-OG1 2.73Å; D731-K736 WeakPolarHBondContact O-CD 3.36Å; D731-K736 WeakPolarHBondContact O-CE 3.4Å; D731-K736 PolarHBondContact O-NZ 3.02Å
732	A	90.4	Very high	89.2	Confident	5 Å²	5	70.8 Å²	70.8	4%	0.041	38%	0.379	C	S	.	.			trans	48.7	31.4	-178.2	0	0	0	0	0	113.9	L679 M734 E735 K736	L679-A732 HydrophobicContact CD2-CB 4.34Å; A732-M734 VanDerWaalsContact C-N 3.31Å; A732-M734 PolarHBondContact O-N 3.16Å; A732-E735 PolarHBondContact O-N 2.91Å; A732-K736 WeakPolarHBondContact O-CG 3.43Å; A732-K736 PolarHBondContact O-N 3.16Å
733	T	90.2	Very high	90.2	Very high	69 Å²	69	63 Å²	63	42%	0.423	34%	0.343	S	S	.	.	H	α-helix	trans	-59.4	-37.8	-167	-65.6	0	0	0	0	113.2	D731 L737	D731-T733 PolarHBondContact O-N 2.94Å; D731-T733 VanDerWaalsContact O-N 3.1Å; D731-T733 WeakPolarHBondContact OD2-CB 3.46Å; D731-T733 PolarHBondContact OD2-N 3.29Å; D731-T733 VanDerWaalsContact OD2-N 3.07Å; D731-T733 PolarHBondContact OD2-OG1 2.73Å; T733-L737 HydrophobicContact CG2-CD1 3.84Å; T733-L737 HydrophobicContact CG2-CG 4.4Å; T733-L737 WeakPolarHBondContact O-CB 3.42Å; T733-L737 WeakPolarHBondContact O-CG 3.28Å; T733-L737 PolarHBondContact O-N 3.26Å
734	M	88.8	Confident	90.9	Very high	142 Å²	142	58.8 Å²	58.8	70%	0.7	32%	0.316	S	S	*	.	H	α-helix	trans	-69.1	-43.1	-179.6	-68.8	-58.2	-60.8	0	0	112.5	A732 L737 A738	A732-M734 VanDerWaalsContact C-N 3.31Å; A732-M734 PolarHBondContact O-N 3.16Å; M734-L737 PolarHBondContact O-N 2.84Å; M734-A738 PolarHBondContact O-N 3.15Å
735	E	89.9	Confident	91.4	Very high	41 Å²	41	60 Å²	60	19%	0.192	31%	0.311	C	S	.	.	H	α-helix	trans	-65.2	-44.7	176.5	-64.7	159.3	-144.2	0	0	110.5	G678 L679 A732 L737 A738 L739	G678-E735 WeakPolarHBondContact CA-OE2 3.21Å; L679-E735 HydrophobicContact CD1-CB 4.15Å; L679-E735 HydrophobicContact CD2-CB 4.09Å; L679-E735 HydrophobicContact CG-CB 3.82Å; L679-E735 PolarHBondContact N-OE2 2.89Å; A732-E735 PolarHBondContact O-N 2.91Å; E735-L737 VanDerWaalsContact C-N 3.3Å; E735-L737 PolarHBondContact O-N 3.33Å; E735-A738 PolarHBondContact O-N 3.35Å; E735-L739 WeakPolarHBondContact O-CB 3.22Å; E735-L739 PolarHBondContact O-N 3.4Å
736	K	91.3	Very high	91.6	Very high	102 Å²	102	59.3 Å²	59.3	44%	0.443	31%	0.312	S	S	.	.	H	α-helix	trans	-57.2	-42.8	173.9	-70.7	174.6	-178.5	159.9	0	111.7	L679 D731 A732 A740	L679-K736 HydrophobicContact CD2-CB 4.34Å; L679-K736 HydrophobicContact CD2-CD 4.35Å; L679-K736 HydrophobicContact CD2-CG 3.33Å; D731-K736 WeakPolarHBondContact O-CD 3.36Å; D731-K736 WeakPolarHBondContact O-CE 3.4Å; D731-K736 PolarHBondContact O-NZ 3.02Å; A732-K736 WeakPolarHBondContact O-CG 3.43Å; A732-K736 PolarHBondContact O-N 3.16Å; K736-A740 WeakPolarHBondContact O-CB 3.49Å; K736-A740 PolarHBondContact O-N 3.15Å
737	L	91.8	Very high	91.6	Very high	88 Å²	88	59.6 Å²	59.6	46%	0.461	31%	0.314	S	S	.	.	H	α-helix	trans	-72.1	-24	176.8	-74.4	171.3	0	0	0	113.9	T733 M734 E735 K741	T733-L737 HydrophobicContact CG2-CD1 3.84Å; T733-L737 HydrophobicContact CG2-CG 4.4Å; T733-L737 WeakPolarHBondContact O-CB 3.42Å; T733-L737 WeakPolarHBondContact O-CG 3.28Å; T733-L737 PolarHBondContact O-N 3.26Å; M734-L737 PolarHBondContact O-N 2.84Å; E735-L737 VanDerWaalsContact C-N 3.3Å; E735-L737 PolarHBondContact O-N 3.33Å; L737-K741 WeakPolarHBondContact O-CD 3.12Å; L737-K741 WeakPolarHBondContact O-CE 3.43Å; L737-K741 WeakPolarHBondContact O-CG 3.24Å
738	A	92.1	Very high	91.6	Very high	13 Å²	13	65.5 Å²	65.5	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-79.8	-50.2	174	0	0	0	0	0	110.8	M734 E735 A740 K741 F742 F924	M734-A738 PolarHBondContact O-N 3.15Å; E735-A738 PolarHBondContact O-N 3.35Å; A738-A740 VanDerWaalsContact C-N 3.35Å; A738-A740 PolarHBondContact O-N 3.13Å; A738-K741 WeakPolarHBondContact O-CB 3.44Å; A738-K741 PolarHBondContact O-N 2.93Å; A738-K741 VanDerWaalsContact O-N 3.1Å; A738-F742 PolarHBondContact O-N 2.88Å; A738-F742 VanDerWaalsContact O-N 3.08Å; A738-F924 HydrophobicContact CB-CE2 3.85Å
739	L	94	Very high	91.4	Very high	3 Å²	3	64.6 Å²	64.6	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-58.5	-43.9	176.4	178.1	59.2	0	0	0	111.9	L679 E735 K741 F742 V743 V756 Y759 V906 F924	L679-L739 HydrophobicContact CD1-CB 4.35Å; L679-L739 HydrophobicContact CD1-CD2 3.7Å; E735-L739 WeakPolarHBondContact O-CB 3.22Å; E735-L739 PolarHBondContact O-N 3.4Å; L739-K741 VanDerWaalsContact C-N 3.27Å; L739-K741 PolarHBondContact O-N 3.32Å; L739-F742 HydrophobicContact CD1-CD1 4.11Å; L739-F742 PolarHBondContact O-N 3.16Å; L739-V743 HydrophobicContact CD1-CG2 3.96Å; L739-V743 HydrophobicContact CG-CG2 4.38Å; L739-V743 WeakPolarHBondContact O-CG2 3.37Å; L739-V743 PolarHBondContact O-N 3.3Å; L739-V756 HydrophobicContact CD2-CG1 4.36Å; L739-V756 HydrophobicContact CD2-CG2 4.1Å; L739-V756 HydrophobicContact CG-CG2 4.39Å; L739-Y759 HydrophobicContact CD2-CD2 3.83Å; L739-Y759 HydrophobicContact CD2-CE2 4.42Å; L739-V906 HydrophobicContact CD1-CG1 4.23Å; L739-V906 HydrophobicContact CD1-CG2 4.02Å; L739-V906 HydrophobicContact CD2-CG1 4.13Å; L739-F924 HydrophobicContact CB-CE2 4.3Å; L739-F924 HydrophobicContact CB-CZ 3.92Å; L739-F924 HydrophobicContact CD1-CD1 4.44Å; L739-F924 HydrophobicContact CD1-CE1 3.97Å; L739-F924 HydrophobicContact CD1-CZ 4.15Å
740	A	94	Very high	91.2	Very high	17 Å²	17	68.2 Å²	68.2	14%	0.14	35%	0.346	C	S	.	.	H	α-helix	trans	-62.1	-32.6	177.3	0	0	0	0	0	113	K736 A738 A744 V754	K736-A740 WeakPolarHBondContact O-CB 3.49Å; K736-A740 PolarHBondContact O-N 3.15Å; A738-A740 VanDerWaalsContact C-N 3.35Å; A738-A740 PolarHBondContact O-N 3.13Å; A740-A744 WeakPolarHBondContact O-CB 3.32Å; A740-A744 PolarHBondContact O-N 3.37Å; A740-V754 HydrophobicContact CB-CB 4.35Å; A740-V754 HydrophobicContact CB-CG1 4.29Å
741	K	92.5	Very high	91	Very high	129 Å²	129	66.1 Å²	66.1	56%	0.561	34%	0.338	S	S	*	.	H	α-helix	trans	-71.2	-42.8	174	-69.5	163	-167.4	160.9	0	111.9	L737 A738 L739 A744 Q745	L737-K741 WeakPolarHBondContact O-CD 3.12Å; L737-K741 WeakPolarHBondContact O-CE 3.43Å; L737-K741 WeakPolarHBondContact O-CG 3.24Å; A738-K741 WeakPolarHBondContact O-CB 3.44Å; A738-K741 PolarHBondContact O-N 2.93Å; A738-K741 VanDerWaalsContact O-N 3.1Å; L739-K741 VanDerWaalsContact C-N 3.27Å; L739-K741 PolarHBondContact O-N 3.32Å; K741-A744 PolarHBondContact O-N 3.3Å; K741-Q745 WeakPolarHBondContact O-CB 3.42Å; K741-Q745 PolarHBondContact O-N 3.12Å
742	F	94	Very high	91.1	Very high	14 Å²	14	67.6 Å²	67.6	6%	0.061	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-53.2	176	165.6	-114	0	0	0	111.2	A738 L739 A744 Q745 E746 C915 F924	A738-F742 PolarHBondContact O-N 2.88Å; A738-F742 VanDerWaalsContact O-N 3.08Å; L739-F742 HydrophobicContact CD1-CD1 4.11Å; L739-F742 PolarHBondContact O-N 3.16Å; F742-A744 VanDerWaalsContact C-N 3.31Å; F742-A744 PolarHBondContact O-N 2.99Å; F742-Q745 WeakPolarHBondContact O-CB 3.46Å; F742-Q745 PolarHBondContact O-N 3.44Å; F742-Q745 VanDerWaalsContact O-N 3.11Å; F742-E746 HydrophobicContact CD2-CG 4Å; F742-E746 HydrophobicContact CE2-CG 3.53Å; F742-E746 HydrophobicContact CZ-CG 3.9Å; F742-E746 PolarHBondContact O-N 3.22Å; F742-C915 HydrophobicContact CE1-CB 3.89Å; F742-C915 HydrophobicContact CZ-CB 3.91Å; F742-F924 HydrophobicContact CB-CB 3.7Å; F742-F924 HydrophobicContact CB-CD2 3.82Å; F742-F924 HydrophobicContact CB-CG 3.85Å; F742-F924 HydrophobicContact CD1-CB 3.72Å; F742-F924 HydrophobicContact CD1-CD1 4.12Å; F742-F924 AromaticContact CD1-CG 3.93Å; F742-F924 HydrophobicContact CD1-CG 3.93Å; F742-F924 HydrophobicContact CD2-CB 3.38Å; F742-F924 HydrophobicContact CD2-CG 4.36Å; F742-F924 HydrophobicContact CE1-CB 4.18Å; F742-F924 HydrophobicContact CE2-CB 3.87Å; F742-F924 HydrophobicContact CG-CB 3.29Å; F742-F924 HydrophobicContact CG-CD1 4.43Å; F742-F924 HydrophobicContact CG-CD2 4.28Å; F742-F924 AromaticContact CG-CG 3.78Å; F742-F924 HydrophobicContact CG-CG 3.78Å; F742-F924 HydrophobicContact CZ-CB 4.25Å
743	V	94.4	Very high	91	Very high	2 Å²	2	70.4 Å²	70.4	1%	0.012	38%	0.378	C	S	.	.	H	α-helix	trans	-59.5	-41.6	177.6	170.1	0	0	0	0	111.3	L739 Q745 E746 S747 V754 V906 T908 F913	L739-V743 HydrophobicContact CD1-CG2 3.96Å; L739-V743 HydrophobicContact CG-CG2 4.38Å; L739-V743 WeakPolarHBondContact O-CG2 3.37Å; L739-V743 PolarHBondContact O-N 3.3Å; V743-Q745 VanDerWaalsContact C-N 3.32Å; V743-Q745 PolarHBondContact O-N 2.84Å; V743-E746 PolarHBondContact O-N 2.94Å; V743-S747 VanDerWaalsContact O-CB 3.24Å; V743-S747 WeakPolarHBondContact O-CB 3.41Å; V743-S747 PolarHBondContact O-N 3.11Å; V743-S747 PolarHBondContact O-OG 3.32Å; V743-V754 HydrophobicContact CB-CG1 3.87Å; V743-V754 HydrophobicContact CB-CG2 4.38Å; V743-V754 HydrophobicContact CG1-CB 4.39Å; V743-V754 HydrophobicContact CG1-CG1 3.5Å; V743-V754 HydrophobicContact CG1-CG2 3.93Å; V743-V906 HydrophobicContact CG2-CG1 4.48Å; V743-T908 HydrophobicContact CG1-CG2 3.64Å; V743-T908 HydrophobicContact CG2-CG2 4.34Å; V743-F913 HydrophobicContact CG1-CE2 4.2Å; V743-F913 HydrophobicContact CG2-CE2 4.44Å
744	A	92.9	Very high	91.1	Very high	8 Å²	8	68.3 Å²	68.3	7%	0.066	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-39.2	175.9	0	0	0	0	0	112.9	A740 K741 F742 K748 C749 A751 V754	A740-A744 WeakPolarHBondContact O-CB 3.32Å; A740-A744 PolarHBondContact O-N 3.37Å; K741-A744 PolarHBondContact O-N 3.3Å; F742-A744 VanDerWaalsContact C-N 3.31Å; F742-A744 PolarHBondContact O-N 2.99Å; A744-K748 CarbonylContact O-C 3.58Å; A744-K748 VanDerWaalsContact O-CA 3.24Å; A744-K748 WeakPolarHBondContact O-CA 3.24Å; A744-K748 PolarHBondContact O-N 2.84Å; A744-C749 PolarHBondContact O-N 2.83Å; A744-A751 HydrophobicContact CB-CB 3.99Å; A744-V754 HydrophobicContact CB-CG2 3.86Å
745	Q	90.6	Very high	91.2	Very high	139 Å²	139	64.5 Å²	64.5	65%	0.65	35%	0.35	S	S	*	.	H	α-helix	trans	-66.5	-45.9	177.3	-175.4	178.5	-65.1	0	0	111.9	K741 F742 V743	K741-Q745 WeakPolarHBondContact O-CB 3.42Å; K741-Q745 PolarHBondContact O-N 3.12Å; F742-Q745 WeakPolarHBondContact O-CB 3.46Å; F742-Q745 PolarHBondContact O-N 3.44Å; F742-Q745 VanDerWaalsContact O-N 3.11Å; V743-Q745 VanDerWaalsContact C-N 3.32Å; V743-Q745 PolarHBondContact O-N 2.84Å
746	E	89.3	Confident	91.4	Very high	73 Å²	73	65 Å²	65	34%	0.341	36%	0.355	S	S	.	.	H	α-helix	trans	-71.3	-44.9	-180	-65.9	-59.6	125.7	0	0	112.4	F742 V743 K748 F913	F742-E746 HydrophobicContact CD2-CG 4Å; F742-E746 HydrophobicContact CE2-CG 3.53Å; F742-E746 HydrophobicContact CZ-CG 3.9Å; F742-E746 PolarHBondContact O-N 3.22Å; V743-E746 PolarHBondContact O-N 2.94Å; E746-K748 VanDerWaalsContact C-N 3.27Å; E746-K748 PolarHBondContact O-N 3.24Å; E746-F913 HydrophobicContact CB-CE1 3.67Å; E746-F913 HydrophobicContact CB-CZ 4.3Å; E746-F913 HydrophobicContact CG-CE1 4.38Å
747	S	88.1	Confident	91.5	Very high	27 Å²	27	64.2 Å²	64.2	19%	0.189	35%	0.353	C	S	.	.	H	α-helix	trans	-73.8	-14.3	175.5	-68.5	0	0	0	0	113.8	V743 R911	V743-S747 VanDerWaalsContact O-CB 3.24Å; V743-S747 WeakPolarHBondContact O-CB 3.41Å; V743-S747 PolarHBondContact O-N 3.11Å; V743-S747 PolarHBondContact O-OG 3.32Å; S747-R911 WeakPolarHBondContact OG-CD 3.43Å
748	K	90.2	Very high	91.7	Very high	190 Å²	190	60 Å²	60	83%	0.826	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	41.6	-177.8	-55.5	168.4	-171.3	170.6	0	113.1	A744 E746	A744-K748 CarbonylContact O-C 3.58Å; A744-K748 VanDerWaalsContact O-CA 3.24Å; A744-K748 WeakPolarHBondContact O-CA 3.24Å; A744-K748 PolarHBondContact O-N 2.84Å; E746-K748 VanDerWaalsContact C-N 3.27Å; E746-K748 PolarHBondContact O-N 3.24Å
749	C	91.4	Very high	91.9	Very high	58 Å²	58	59.6 Å²	59.6	39%	0.392	33%	0.327	S	S	.	.	S	Bend	trans	-117.7	-177.6	175.7	62.8	0	0	0	0	111.4	A744	A744-C749 PolarHBondContact O-N 2.83Å
750	E	89.4	Confident	92	Very high	142 Å²	142	59.5 Å²	59.5	66%	0.664	33%	0.326	S	S	*	.			trans	-84.5	142.1	173	-63.1	-174.3	165.4	0	0	110.6	S752 A753	E750-S752 PolarHBondContact O-N 3.45Å; E750-S752 VanDerWaalsContact O-N 3.13Å; E750-A753 WeakPolarHBondContact O-CA 3.3Å; E750-A753 WeakPolarHBondContact O-CB 3.39Å; E750-A753 PolarHBondContact O-N 2.97Å
751	A	88.3	Confident	92.1	Very high	48 Å²	48	58.8 Å²	58.8	40%	0.397	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-62.2	-21.7	179.8	0	0	0	0	0	114	A744 A753	A744-A751 HydrophobicContact CB-CB 3.99Å; A751-A753 VanDerWaalsContact C-N 3.27Å; A751-A753 PolarHBondContact O-N 2.87Å
752	S	88.6	Confident	92.2	Very high	109 Å²	109	52.6 Å²	52.6	76%	0.762	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-74.4	-10.9	171	34.4	0	0	0	0	114.4	E750	E750-S752 PolarHBondContact O-N 3.45Å; E750-S752 VanDerWaalsContact O-N 3.13Å
753	A	88.8	Confident	92.1	Very high	64 Å²	64	52.5 Å²	52.5	53%	0.529	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-108.7	11.2	176.6	0	0	0	0	0	112.6	E750 A751	E750-A753 WeakPolarHBondContact O-CA 3.3Å; E750-A753 WeakPolarHBondContact O-CB 3.39Å; E750-A753 PolarHBondContact O-N 2.97Å; A751-A753 VanDerWaalsContact C-N 3.27Å; A751-A753 PolarHBondContact O-N 2.87Å
754	V	92.2	Very high	91.9	Very high	26 Å²	26	53 Å²	53	16%	0.158	29%	0.294	C	S	.	.			trans	-93	109.9	176.5	173.2	0	0	0	0	110.3	A740 V743 A744 V756	A740-V754 HydrophobicContact CB-CB 4.35Å; A740-V754 HydrophobicContact CB-CG1 4.29Å; V743-V754 HydrophobicContact CB-CG1 3.87Å; V743-V754 HydrophobicContact CB-CG2 4.38Å; V743-V754 HydrophobicContact CG1-CB 4.39Å; V743-V754 HydrophobicContact CG1-CG1 3.5Å; V743-V754 HydrophobicContact CG1-CG2 3.93Å; A744-V754 HydrophobicContact CB-CG2 3.86Å; V754-V756 HydrophobicContact CG1-CG2 4.18Å
755	T	91.8	Very high	91.7	Very high	61 Å²	61	53.1 Å²	53.1	37%	0.374	29%	0.294	S	S	.	.			trans	-96.9	127.4	162.6	-45.4	0	0	0	0	109.5	H757 T908 E909	T755-H757 VanDerWaalsContact CG2-CE1 3.45Å; T755-H757 WeakPolarHBondContact CG2-CE1 3.35Å; T755-T908 WeakPolarHBondContact O-CA 3.32Å; T755-E909 WeakPolarHBondContact CB-OE1 3.48Å; T755-E909 PolarHBondContact OG1-OE1 2.85Å
756	V	93.6	Very high	90.9	Very high	52 Å²	52	48.7 Å²	48.7	32%	0.315	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.2	168	177	0	0	0	0	107.8	L739 V754 F758 V906	L739-V756 HydrophobicContact CD2-CG1 4.36Å; L739-V756 HydrophobicContact CD2-CG2 4.1Å; L739-V756 HydrophobicContact CG-CG2 4.39Å; V754-V756 HydrophobicContact CG1-CG2 4.18Å; V756-F758 WeakPolarHBondContact CG1-O 3.39Å; V756-V906 HydrophobicContact CG1-CG1 3.86Å; V756-V906 HydrophobicContact CG2-CG1 4.29Å
757	H	94	Very high	89.7	Confident	85 Å²	85	46.3 Å²	46.3	39%	0.394	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-18.3	-179.1	-61.1	-41.8	0	0	0	113.5	T755 I907 T908 E909	T755-H757 VanDerWaalsContact CG2-CE1 3.45Å; T755-H757 WeakPolarHBondContact CG2-CE1 3.35Å; H757-I907 HydrophobicContact CB-CG2 4.24Å; H757-I907 PolarHBondContact N-O 2.99Å; H757-T908 PolarHBondContact CD2-O 3.16Å; H757-E909 WeakPolarHBondContact NE2-CG 3.29Å
758	F	96	Very high	88.2	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	137.1	177.4	174.3	-86.7	0	0	0	109.2	V756 L905 V906 I907 L966 R974 F975 A978	V756-F758 WeakPolarHBondContact CG1-O 3.39Å; F758-L905 HydrophobicContact CE1-CB 4.4Å; F758-L905 HydrophobicContact CE1-CD2 4.24Å; F758-L905 HydrophobicContact CE1-CG 4.47Å; F758-V906 WeakPolarHBondContact O-CA 3.23Å; F758-I907 HydrophobicContact CB-CB 3.99Å; F758-I907 HydrophobicContact CB-CD1 3.83Å; F758-I907 HydrophobicContact CB-CG1 4.05Å; F758-I907 HydrophobicContact CD1-CD1 4.32Å; F758-I907 HydrophobicContact CD1-CG1 4.39Å; F758-I907 HydrophobicContact CG-CD1 4.18Å; F758-I907 PolarHBondContact O-N 3.28Å; F758-L966 HydrophobicContact CZ-CD2 4.34Å; F758-R974 HydrophobicContact CD2-CG 4.34Å; F758-R974 HydrophobicContact CE2-CB 4.42Å; F758-R974 HydrophobicContact CE2-CG 4.21Å; F758-F975 HydrophobicContact CD1-CD2 4.17Å; F758-F975 HydrophobicContact CD2-CB 4.38Å; F758-F975 HydrophobicContact CE1-CB 4.42Å; F758-F975 AromaticContact CE1-CD2 3.9Å; F758-F975 HydrophobicContact CE1-CD2 3.9Å; F758-F975 VanDerWaalsContact CE2-CA 3.48Å; F758-F975 HydrophobicContact CE2-CB 3.69Å; F758-F975 HydrophobicContact CE2-CD2 4.47Å; F758-F975 HydrophobicContact CZ-CB 3.72Å; F758-F975 HydrophobicContact CZ-CD2 4.06Å; F758-F975 HydrophobicContact CZ-CG 4.35Å; F758-A978 HydrophobicContact CB-CB 3.78Å; F758-A978 HydrophobicContact CD2-CB 4.35Å; F758-A978 HydrophobicContact CG-CB 4.43Å
759	Y	96.5	Very high	86.3	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.016	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.7	161	179.5	-90	0	0	0	108.6	L679 D680 Q682 L739 L761 C904 L905 V906 R974	L679-Y759 HydrophobicContact CB-CD1 3.34Å; L679-Y759 HydrophobicContact CB-CD2 4.28Å; L679-Y759 HydrophobicContact CB-CE1 3.71Å; L679-Y759 HydrophobicContact CB-CG 3.67Å; L679-Y759 HydrophobicContact CD1-CD1 4.19Å; L679-Y759 HydrophobicContact CD1-CD2 3.64Å; L679-Y759 HydrophobicContact CD1-CE1 4.21Å; L679-Y759 HydrophobicContact CD1-CE2 3.65Å; L679-Y759 HydrophobicContact CD1-CG 3.91Å; L679-Y759 HydrophobicContact CG-CD1 4.41Å; L679-Y759 HydrophobicContact CG-CG 4.43Å; D680-Y759 VanDerWaalsContact CB-O 3.26Å; D680-Y759 WeakPolarHBondContact CB-O 3.25Å; D680-Y759 PolarHBondContact OD2-N 3.11Å; Q682-Y759 HydrophobicContact CB-CD1 4.25Å; Q682-Y759 HydrophobicContact CB-CE1 4.09Å; Q682-Y759 HydrophobicContact CG-CD1 3.82Å; Q682-Y759 HydrophobicContact CG-CE1 4.13Å; L739-Y759 HydrophobicContact CD2-CD2 3.83Å; L739-Y759 HydrophobicContact CD2-CE2 4.42Å; Y759-L761 HydrophobicContact CE1-CD2 4.47Å; Y759-C904 HydrophobicContact CE2-CB 3.89Å; Y759-C904 PolarHBondContact OH-SG 3.27Å; Y759-C904 VanDerWaalsContact OH-SG 3.33Å; Y759-L905 WeakPolarHBondContact CA-O 3.32Å; Y759-V906 HydrophobicContact CD2-CG2 4.04Å; Y759-V906 HydrophobicContact CE2-CG2 4.47Å; Y759-R974 PolarHBondContact O-NH1 3.49Å; Y759-R974 PolarHBondContact O-NH2 3.02Å
760	G	95.4	Very high	84	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	149.1	-179.5	0	0	0	0	0	113.2	L905	G760-L905 PolarHBondContact N-O 2.73Å; G760-L905 PolarHBondContact O-N 2.85Å
761	L	95.4	Very high	81.4	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119	173.5	-63.4	178.1	0	0	0	109.7	H632 M633 Q682 T683 D698 A700 Y759	H632-L761 HydrophobicContact CB-CD1 4.22Å; M633-L761 HydrophobicContact CG-CD2 3.51Å; Q682-L761 HydrophobicContact CB-CD1 4.1Å; Q682-L761 HydrophobicContact CB-CG 4Å; Q682-L761 WeakPolarHBondContact O-CD1 3.36Å; T683-L761 HydrophobicContact CG2-CD1 4.01Å; D698-L761 HydrophobicContact CB-CD1 4.08Å; A700-L761 HydrophobicContact CB-CB 3.74Å; A700-L761 HydrophobicContact CB-CD1 4.23Å; Y759-L761 HydrophobicContact CE1-CD2 4.47Å
762	V	94.9	Very high	79.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	171	-171.4	-52.8	0	0	0	0	111.2	H632 P902 C903 L905 I964 Y965 L966	H632-V762 PolarHBondContact NE2-N 3.33Å; H632-V762 PolarHBondContact NE2-O 2.94Å; V762-P902 WeakPolarHBondContact O-CA 3.41Å; V762-C903 PolarHBondContact N-O 3.1Å; V762-C903 PolarHBondContact O-N 2.82Å; V762-L905 HydrophobicContact CB-CB 4.46Å; V762-L905 HydrophobicContact CG1-CB 3.83Å; V762-L905 HydrophobicContact CG1-CD2 3.83Å; V762-L905 HydrophobicContact CG1-CG 4.5Å; V762-L905 HydrophobicContact CG2-CB 3.75Å; V762-L905 HydrophobicContact CG2-CD2 4.32Å; V762-L905 HydrophobicContact CG2-CG 4.48Å; V762-I964 HydrophobicContact CB-CG2 3.93Å; V762-I964 HydrophobicContact CG1-CG2 4.04Å; V762-I964 HydrophobicContact CG2-CG2 4.15Å; V762-Y965 CarbonylContact C-O 3.59Å; V762-Y965 WeakPolarHBondContact CA-O 3.22Å; V762-Y965 WeakPolarHBondContact CB-O 3.31Å; V762-L966 HydrophobicContact CG1-CD2 3.92Å; V762-L966 HydrophobicContact CG1-CG 3.9Å
763	H	92.2	Very high	76.2	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.056	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.1	159.5	-53.9	63.5	0	0	0	108.8	H632 L637 C900 I901 Y965 I1012 W1016	H632-H763 AromaticContact CE1-CE1 3.66Å; L637-H763 WeakPolarHBondContact CD2-NE2 3.35Å; H763-C900 HydrophobicContact CB-CB 3.79Å; H763-I901 CarbonylContact C-O 3.59Å; H763-I901 WeakPolarHBondContact CA-O 3.31Å; H763-Y965 PolarHBondContact N-O 3.41Å; H763-Y965 PolarHBondContact O-N 3.04Å; H763-I1012 HydrophobicContact CB-CD1 3.81Å; H763-W1016 AromaticContact CE1-CZ2 3.96Å
764	W	91.3	Very high	73.6	Confident	11 Å²	11	53.6 Å²	53.6	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.5	-175.3	171.6	69.1	0	0	0	109.8	D766 P767 C900 I901 T914 L927 W962	W764-D766 HydrophobicContact CZ3-CB 4.18Å; W764-D766 PolarHBondContact O-N 2.78Å; W764-P767 VanDerWaalsContact CZ2-CD 3.45Å; W764-P767 HydrophobicContact CZ2-CG 4.22Å; W764-C900 CarbonylContact O-C 3.51Å; W764-C900 WeakPolarHBondContact O-CA 3.45Å; W764-I901 PolarHBondContact N-O 2.94Å; W764-I901 PolarHBondContact O-N 3.48Å; W764-T914 HydrophobicContact CB-CG2 4.33Å; W764-T914 HydrophobicContact CD2-CG2 4.22Å; W764-T914 HydrophobicContact CG-CG2 3.99Å; W764-L927 HydrophobicContact CZ3-CB 4.18Å; W764-W962 AromaticContact NE1-CD1 3.89Å; W764-W962 AromaticContact NE1-CD2 3.49Å; W764-W962 AromaticContact NE1-CE3 3.82Å; W764-W962 AromaticContact NE1-CG 3.43Å
765	E	87.2	Confident	70.4	Confident	12 Å²	12	57.6 Å²	57.6	6%	0.056	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.1	172.2	-74.7	177.1	-152.4	0	0	110.1	P767 P899 C900 V963 Y965 K1004	E765-P767 WeakPolarHBondContact O-CD 3.18Å; E765-P899 WeakPolarHBondContact CA-O 3.41Å; E765-P899 HydrophobicContact CG-CB 4.48Å; E765-P899 HydrophobicContact CG-CG 4.31Å; E765-C900 HydrophobicContact CG-CB 4.43Å; E765-V963 HydrophobicContact CB-CB 4.16Å; E765-V963 HydrophobicContact CG-CB 4.22Å; E765-V963 PolarHBondContact N-O 2.81Å; E765-Y965 HydrophobicContact CG-CE2 4.04Å; E765-Y965 WeakPolarHBondContact OE1-CE2 3.3Å; E765-Y965 PolarHBondContact OE1-OH 2.96Å; E765-K1004 VanDerWaalsContact OE2-CE 3.3Å; E765-K1004 WeakPolarHBondContact OE2-CE 3.45Å; E765-K1004 IonicContact OE2-NZ 2.58Å; E765-K1004 PolarHBondContact OE2-NZ 3.07Å
766	D	73.7	Confident	67.6	Low	45 Å²	45	60.7 Å²	60.7	24%	0.241	35%	0.349	C	S	.	.			trans	-72.3	112.3	175.9	-175.8	-6.9	0	0	0	110.4	W764 M768 E769 P899 I901	W764-D766 HydrophobicContact CZ3-CB 4.18Å; W764-D766 PolarHBondContact O-N 2.78Å; D766-M768 PolarHBondContact O-N 2.86Å; D766-M768 VanDerWaalsContact O-N 3.1Å; D766-M768 VanDerWaalsContact OD1-CB 3.28Å; D766-M768 WeakPolarHBondContact OD1-CB 3.21Å; D766-M768 PolarHBondContact OD1-N 3.4Å; D766-E769 PolarHBondContact O-N 2.71Å; D766-E769 VanDerWaalsContact O-N 3.15Å; D766-P899 PolarHBondContact N-O 2.71Å; D766-I901 HydrophobicContact CB-CD1 3.94Å
767	P	64.5	Low	64.4	Low	24 Å²	24	62.3 Å²	62.3	16%	0.156	36%	0.362	C	S	.	.	H	α-helix	trans	-70.3	-7.6	-178.5	-13.2	29.5	0	0	0	113.5	W764 E765 Q960	W764-P767 VanDerWaalsContact CZ2-CD 3.45Å; W764-P767 HydrophobicContact CZ2-CG 4.22Å; E765-P767 WeakPolarHBondContact O-CD 3.18Å; P767-Q960 HydrophobicContact CB-CB 3.6Å; P767-Q960 HydrophobicContact CB-CG 4.15Å; P767-Q960 HydrophobicContact CG-CB 4.38Å
768	M	55.8	Low	61.2	Low	153 Å²	153	67.8 Å²	67.8	75%	0.754	39%	0.388	S	S	*	.	H	α-helix	trans	-74.6	-24.4	172.3	-64.2	-165.2	60.2	0	0	113.1	D766	D766-M768 PolarHBondContact O-N 2.86Å; D766-M768 VanDerWaalsContact O-N 3.1Å; D766-M768 VanDerWaalsContact OD1-CB 3.28Å; D766-M768 WeakPolarHBondContact OD1-CB 3.21Å; D766-M768 PolarHBondContact OD1-N 3.4Å
769	E	50.9	Low	58	Low	111 Å²	111	72.5 Å²	72.5	52%	0.519	42%	0.42	S	S	.	.	H	α-helix	trans	-72.7	-39.4	170.8	-68.3	-149	129.4	0	0	111.2	D766 A771 L772	D766-E769 PolarHBondContact O-N 2.71Å; D766-E769 VanDerWaalsContact O-N 3.15Å; E769-A771 PolarHBondContact O-N 3.48Å; E769-L772 WeakPolarHBondContact O-CB 3.47Å; E769-L772 PolarHBondContact O-N 3.39Å
770	E	43.4	Very low	54.7	Low	118 Å²	118	77.3 Å²	77.3	55%	0.551	45%	0.454	S	S	*	.	H	α-helix	trans	-69.4	-15.8	-178.3	-136.2	175.9	-146.8	0	0	113.5	L772 G773 K1004	E770-L772 PolarHBondContact O-N 3.4Å; E770-G773 PolarHBondContact O-N 3.17Å; E770-K1004 IonicContact OE1-NZ 3.98Å; E770-K1004 PolarHBondContact OE1-NZ 3.49Å
771	A	35.2	Very low	51.6	Low	83 Å²	83	82.8 Å²	82.8	69%	0.686	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20	168.6	0	0	0	0	0	113.2	E769 G773	E769-A771 PolarHBondContact O-N 3.48Å; A771-G773 PolarHBondContact O-N 3.22Å; A771-G773 VanDerWaalsContact O-N 3.16Å
772	L	38.7	Very low	48.4	Very low	157 Å²	157	86.4 Å²	86.4	82%	0.822	52%	0.52	S	S	*	.	S	Bend	trans	-84.7	52.2	166.1	-65.3	168.3	0	0	0	110.6	E769 E770	E769-L772 WeakPolarHBondContact O-CB 3.47Å; E769-L772 PolarHBondContact O-N 3.39Å; E770-L772 PolarHBondContact O-N 3.4Å
773	G	29.6	Very low	45.6	Very low	35 Å²	35	96.2 Å²	96.2	36%	0.361	57%	0.565	S	S	.	*			trans	-56.9	158.5	-173.1	0	0	0	0	0	114.3	E770 A771 V775	E770-G773 PolarHBondContact O-N 3.17Å; A771-G773 PolarHBondContact O-N 3.22Å; A771-G773 VanDerWaalsContact O-N 3.16Å; G773-V775 VanDerWaalsContact C-N 3.34Å; G773-V775 PolarHBondContact O-N 3.11Å
774	P	32.8	Very low	43.4	Very low	134 Å²	134	97.5 Å²	97.5	87%	0.87	58%	0.582	S	S	*	*			trans	-71.2	82.1	-167.7	29.4	-36.8	0	0	0	113
775	V	26.6	Very low	41.6	Very low	109 Å²	109	100.9 Å²	100.9	66%	0.661	60%	0.604	S	S	*	*			trans	-59.9	130.5	159.2	-177.9	0	0	0	0	107.5	G773 C777	G773-V775 VanDerWaalsContact C-N 3.34Å; G773-V775 PolarHBondContact O-N 3.11Å; V775-C777 PolarHBondContact O-N 2.81Å
776	P	31.7	Very low	40.4	Very low	126 Å²	126	104 Å²	104	82%	0.818	62%	0.621	S	S	*	*			trans	-73.6	65.4	172.5	31.2	-35.3	0	0	0	110.4	Q778	P776-Q778 PolarHBondContact O-N 3.18Å
777	C	26.6	Very low	40.6	Very low	86 Å²	86	105.5 Å²	105.5	58%	0.581	63%	0.631	S	S	*	*			trans	-62.3	120.2	174	-75.6	0	0	0	0	109.3	V775 C779	V775-C777 PolarHBondContact O-N 2.81Å; C777-C779 PolarHBondContact O-N 3.44Å
778	Q	27.4	Very low	41.7	Very low	201 Å²	201	106 Å²	106	94%	0.939	63%	0.631	S	S	*	*	S	Bend	trans	-74	36.1	165.9	-65.6	-174.8	-22.6	0	0	111.7	P776	P776-Q778 PolarHBondContact O-N 3.18Å
779	C	28.2	Very low	43.5	Very low	100 Å²	100	102.1 Å²	102.1	68%	0.676	61%	0.611	S	S	*	*			trans	-144.8	98.2	178.7	-63.5	0	0	0	0	107	C777	C777-C779 PolarHBondContact O-N 3.44Å
780	S	27	Very low	45.4	Very low	104 Å²	104	97.7 Å²	97.7	73%	0.727	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-53.8	139.4	148.3	49	0	0	0	0	108	A782	S780-A782 PolarHBondContact O-N 3.16Å; S780-A782 VanDerWaalsContact O-N 3.16Å
781	P	30.6	Very low	47.6	Very low	116 Å²	116	96 Å²	96	75%	0.753	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-57.5	125.4	171.3	25.7	-33	0	0	0	108.3
782	A	29.1	Very low	50.4	Low	78 Å²	78	92 Å²	92	65%	0.645	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-66.7	145.4	179	0	0	0	0	0	110	S780 G784 T785	S780-A782 PolarHBondContact O-N 3.16Å; S780-A782 VanDerWaalsContact O-N 3.16Å; A782-G784 PolarHBondContact O-N 3.09Å; A782-T785 PolarHBondContact O-OG1 3.06Å
783	E	34.5	Very low	52.9	Low	205 Å²	205	87.6 Å²	87.6	96%	0.958	53%	0.53	S	S	*	.	S	Bend	trans	-56.2	125.1	177.7	-64.5	173.7	114.8	0	0	110.4
784	G	46.8	Very low	55.8	Low	40 Å²	40	87.9 Å²	87.9	41%	0.412	52%	0.521	S	S	.	.			trans	85.6	53.5	177.7	0	0	0	0	0	114.9	A782 I786	A782-G784 PolarHBondContact O-N 3.09Å; G784-I786 PolarHBondContact O-N 3.42Å
785	T	54.1	Low	58.4	Low	82 Å²	82	84.3 Å²	84.3	50%	0.503	49%	0.491	S	S	.	.			trans	-71.8	97	168.8	-60.9	0	0	0	0	109.8	A782 T787	A782-T785 PolarHBondContact O-OG1 3.06Å; T785-T787 PolarHBondContact O-N 3.04Å
786	I	62.5	Low	60.7	Low	78 Å²	78	80 Å²	80	40%	0.4	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	122.1	174	-63.8	171	0	0	0	108.9	G784 E789 V812	G784-I786 PolarHBondContact O-N 3.42Å; I786-E789 HydrophobicContact CG2-CB 4.03Å; I786-E789 HydrophobicContact CG2-CG 4.3Å; I786-V812 HydrophobicContact CD1-CG1 4.04Å; I786-V812 HydrophobicContact CG1-CG1 3.96Å; I786-V812 HydrophobicContact CG2-CG1 3.84Å
787	T	77.5	Confident	62.2	Low	76 Å²	76	78.2 Å²	78.2	47%	0.466	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-31	179.7	62.2	0	0	0	0	111.9	T785 L813	T785-T787 PolarHBondContact O-N 3.04Å; T787-L813 PolarHBondContact N-O 3.43Å; T787-L813 WeakPolarHBondContact OG1-CG 3.27Å; T787-L813 PolarHBondContact OG1-O 3.45Å; T787-L813 VanDerWaalsContact OG1-O 3.04Å
788	K	87.6	Confident	64	Low	33 Å²	33	78.3 Å²	78.3	14%	0.143	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	138.7	169	-169.7	168	173.6	67	0	111.2	L813 D877 W878 H881	K788-L813 HydrophobicContact CB-CB 4.44Å; K788-L813 PolarHBondContact N-O 3.41Å; K788-L813 PolarHBondContact O-N 2.92Å; K788-D877 WeakPolarHBondContact CE-OD2 3.45Å; K788-D877 IonicContact NZ-OD2 3.28Å; K788-D877 PolarHBondContact NZ-OD2 3.46Å; K788-W878 HydrophobicContact CB-CH2 4.31Å; K788-W878 HydrophobicContact CB-CZ3 4.19Å; K788-W878 HydrophobicContact CD-CD2 3.78Å; K788-W878 HydrophobicContact CD-CE3 3.76Å; K788-W878 HydrophobicContact CD-CG 4.31Å; K788-W878 HydrophobicContact CD-CH2 4.3Å; K788-W878 HydrophobicContact CD-CZ2 4.33Å; K788-W878 HydrophobicContact CD-CZ3 4.02Å; K788-W878 VanDerWaalsContact CE-CE2 3.43Å; K788-W878 VanDerWaalsContact CE-CG 3.49Å; K788-W878 HydrophobicContact CG-CD2 4.39Å; K788-W878 HydrophobicContact CG-CE3 4.23Å; K788-W878 HydrophobicContact CG-CH2 3.88Å; K788-W878 HydrophobicContact CG-CZ2 4.05Å; K788-W878 HydrophobicContact CG-CZ3 3.97Å; K788-H881 HydrophobicContact CD-CB 3.94Å
789	E	92.1	Very high	65.5	Low	73 Å²	73	70.5 Å²	70.5	34%	0.341	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	158.6	166.8	62.4	167.5	-128.4	0	0	111.4	I786 F810 V811 V812 R824	I786-E789 HydrophobicContact CG2-CB 4.03Å; I786-E789 HydrophobicContact CG2-CG 4.3Å; E789-F810 HydrophobicContact CB-CE2 4.31Å; E789-F810 HydrophobicContact CB-CZ 3.8Å; E789-F810 HydrophobicContact CG-CZ 4.15Å; E789-V811 CarbonylContact C-O 3.44Å; E789-V811 VanDerWaalsContact CA-O 3.28Å; E789-V811 WeakPolarHBondContact CA-O 3.44Å; E789-V812 HydrophobicContact CB-CG2 4.15Å; E789-R824 IonicContact OE1-CZ 3.69Å; E789-R824 IonicContact OE1-NE 2.87Å; E789-R824 PolarHBondContact OE1-NE 3.04Å; E789-R824 IonicContact OE1-NH2 3.94Å; E789-R824 PolarHBondContact OE1-NH2 3.46Å
790	G	91.3	Very high	66.8	Low	17 Å²	17	77.6 Å²	77.6	18%	0.175	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.3	169.7	178.2	0	0	0	0	0	113.8	F810 V811	G790-F810 WeakPolarHBondContact O-CD2 3.41Å; G790-V811 PolarHBondContact N-O 2.7Å; G790-V811 PolarHBondContact O-N 3.02Å
791	M	90.8	Very high	68.2	Low	82 Å²	82	79.8 Å²	79.8	40%	0.404	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.8	176.8	-155.9	73.1	-179.6	0	0	110	A808 F810	M791-A808 HydrophobicContact CE-CB 3.71Å; M791-F810 HydrophobicContact SD-CB 3.88Å; M791-F810 HydrophobicContact SD-CD2 4.21Å
792	L	93.2	Very high	69.6	Low	0 Å²	0	77.1 Å²	77.1	0%	0	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	171.6	176.3	-69.4	178.7	0	0	0	110.2	A808 C809 V811 F855 L867 A869 W878	L792-A808 CarbonylContact O-C 3.42Å; L792-A808 WeakPolarHBondContact O-CA 3.22Å; L792-C809 PolarHBondContact N-O 3.35Å; L792-C809 PolarHBondContact O-N 2.83Å; L792-V811 HydrophobicContact CB-CG2 4.1Å; L792-V811 HydrophobicContact CD1-CB 4.16Å; L792-V811 HydrophobicContact CD1-CG1 4.4Å; L792-V811 HydrophobicContact CD1-CG2 4.06Å; L792-V811 HydrophobicContact CG-CG2 4.4Å; L792-F855 HydrophobicContact CD1-CE1 4.46Å; L792-F855 HydrophobicContact CD1-CZ 3.91Å; L792-L867 HydrophobicContact CD1-CB 4.41Å; L792-L867 HydrophobicContact CD1-CD1 3.95Å; L792-A869 HydrophobicContact CD2-CB 3.81Å; L792-W878 HydrophobicContact CD1-CD2 4Å; L792-W878 HydrophobicContact CD1-CG 4.26Å; L792-W878 HydrophobicContact CD1-CZ2 4.19Å; L792-W878 HydrophobicContact CG-CZ2 4.49Å
793	H	91	Very high	71.2	Confident	64 Å²	64	80.3 Å²	80.3	30%	0.296	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.4	168	-62.2	82.5	0	0	0	110.1	W806 K807 R851 L867 S868	H793-W806 HydrophobicContact CB-CE3 4.13Å; H793-W806 WeakPolarHBondContact O-CZ3 3.39Å; H793-K807 CarbonylContact C-O 3.55Å; H793-K807 WeakPolarHBondContact CA-O 3.3Å; H793-R851 PolarHBondContact CD2-NH2 3.22Å; H793-R851 VanDerWaalsContact CD2-NH2 3.29Å; H793-R851 PolarHBondContact ND1-NH2 2.81Å; H793-L867 CarbonylContact O-C 3.11Å; H793-L867 VanDerWaalsContact O-CA 3.22Å; H793-L867 WeakPolarHBondContact O-CA 3.47Å; H793-S868 PolarHBondContact N-O 2.61Å; H793-S868 PolarHBondContact O-N 3.1Å
794	Y	90.6	Very high	73	Confident	41 Å²	41	73.6 Å²	73.6	16%	0.161	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	152.3	174.7	79.3	-74	0	0	0	112	A796 W806 K807 C809 Q820 L830 E866	Y794-A796 HydrophobicContact CD2-CB 4.23Å; Y794-A796 HydrophobicContact CE2-CB 3.72Å; Y794-A796 PolarHBondContact O-N 3.03Å; Y794-W806 WeakPolarHBondContact O-CA 3.42Å; Y794-K807 HydrophobicContact CD1-CB 4Å; Y794-K807 WeakPolarHBondContact CD1-O 3.5Å; Y794-K807 HydrophobicContact CE1-CB 3.49Å; Y794-K807 VanDerWaalsContact CE1-CB 3.49Å; Y794-K807 HydrophobicContact CE1-CD 4.36Å; Y794-K807 PolarHBondContact N-O 2.83Å; Y794-K807 PolarHBondContact O-N 2.65Å; Y794-C809 HydrophobicContact CD1-CB 3.61Å; Y794-C809 VanDerWaalsContact CD1-SG 3.57Å; Y794-C809 HydrophobicContact CE1-CB 3.94Å; Y794-Q820 VanDerWaalsContact CD2-NE2 3.35Å; Y794-L830 HydrophobicContact CE1-CD1 4.48Å; Y794-E866 WeakPolarHBondContact CA-O 3.34Å
795	K	87.1	Confident	74.6	Confident	59 Å²	59	76.4 Å²	76.4	26%	0.257	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	106.3	177.5	-170.4	169	169	170.8	0	110.6	E804 H805 W806 E866	K795-E804 VanDerWaalsContact CE-CD 3.49Å; K795-E804 WeakPolarHBondContact CE-OE1 3.43Å; K795-E804 IonicContact NZ-OE1 3.84Å; K795-E804 PolarHBondContact NZ-OE1 3.07Å; K795-E804 IonicContact NZ-OE2 2.76Å; K795-H805 CarbonylContact C-O 3.55Å; K795-W806 HydrophobicContact CB-CD2 4.16Å; K795-W806 HydrophobicContact CB-CE3 4.21Å; K795-W806 HydrophobicContact CB-CH2 4.11Å; K795-W806 HydrophobicContact CB-CZ2 4.04Å; K795-W806 HydrophobicContact CB-CZ3 4.17Å; K795-W806 HydrophobicContact CD-CZ2 4.03Å; K795-W806 HydrophobicContact CG-CZ2 4.32Å; K795-E866 HydrophobicContact CB-CB 4.01Å; K795-E866 HydrophobicContact CD-CB 4.18Å; K795-E866 WeakPolarHBondContact CD-OE2 3.25Å; K795-E866 WeakPolarHBondContact CE-OE2 3.36Å; K795-E866 PolarHBondContact N-O 3.1Å; K795-E866 VanDerWaalsContact N-O 3.13Å; K795-E866 IonicContact NZ-OE2 3.47Å; K795-E866 PolarHBondContact NZ-OE2 2.81Å
796	A	75.6	Confident	76.2	Confident	18 Å²	18	74.7 Å²	74.7	15%	0.149	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	72.6	-172.1	0	0	0	0	0	111.8	Y794 H805 K807	Y794-A796 HydrophobicContact CD2-CB 4.23Å; Y794-A796 HydrophobicContact CE2-CB 3.72Å; Y794-A796 PolarHBondContact O-N 3.03Å; A796-H805 CarbonylContact C-O 3.58Å; A796-H805 PolarHBondContact N-O 2.95Å; A796-K807 HydrophobicContact CB-CB 4.13Å; A796-K807 HydrophobicContact CB-CD 3.58Å; A796-K807 HydrophobicContact CB-CG 3.71Å
797	S	63.8	Low	77.4	Confident	89 Å²	89	76.5 Å²	76.5	62%	0.622	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	71.2	155.5	-179.9	-164.4	0	0	0	0	116.1	H805	S797-H805 PolarHBondContact O-N 2.81Å; S797-H805 VanDerWaalsContact O-N 3.11Å
798	T	63.2	Low	78	Confident	88 Å²	88	75.1 Å²	75.1	54%	0.54	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.6	168.5	42.3	0	0	0	0	109.3
799	S	60	Low	78.3	Confident	37 Å²	37	73.6 Å²	73.6	26%	0.259	38%	0.383	S	S	.	.			trans	-69.3	161.1	175.1	59.9	0	0	0	0	112	L801 G802 K803 H805	S799-L801 PolarHBondContact O-N 3.04Å; S799-G802 PolarHBondContact O-N 2.91Å; S799-K803 PolarHBondContact N-O 3.1Å; S799-K803 WeakPolarHBondContact OG-CB 3.42Å; S799-K803 PolarHBondContact OG-N 3.23Å; S799-K803 PolarHBondContact OG-O 3.05Å; S799-H805 VanDerWaalsContact CB-CE1 3.47Å; S799-H805 WeakPolarHBondContact CB-CE1 3.44Å; S799-H805 PolarHBondContact OG-CE1 3.46Å
800	Y	54.8	Low	78.3	Confident	249 Å²	249	71 Å²	71	98%	0.976	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-11.3	173.2	-62.7	-79.7	0	0	0	115.3
801	L	55.9	Low	78.4	Confident	151 Å²	151	70.3 Å²	70.3	79%	0.791	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	10.2	174.3	-112.2	75.1	0	0	0	113.9	S799 K803	S799-L801 PolarHBondContact O-N 3.04Å; L801-K803 PolarHBondContact O-N 2.9Å
802	G	59.3	Low	78.4	Confident	60 Å²	60	67 Å²	67	62%	0.619	35%	0.347	S	S	*	.	S	Bend	trans	73.6	-0.4	-175.9	0	0	0	0	0	114.8	S799 E804	S799-G802 PolarHBondContact O-N 2.91Å; G802-E804 PolarHBondContact O-N 3.14Å
803	K	62.9	Low	78.2	Confident	144 Å²	144	67 Å²	67	63%	0.626	35%	0.347	S	S	*	.			trans	-76.4	123.3	176.9	-67.1	-170.5	175.4	-171.6	0	110.8	S799 L801 H805	S799-K803 PolarHBondContact N-O 3.1Å; S799-K803 WeakPolarHBondContact OG-CB 3.42Å; S799-K803 PolarHBondContact OG-N 3.23Å; S799-K803 PolarHBondContact OG-O 3.05Å; L801-K803 PolarHBondContact O-N 2.9Å; K803-H805 PolarHBondContact O-ND1 3.13Å
804	E	73.2	Confident	77.8	Confident	64 Å²	64	64.6 Å²	64.6	30%	0.299	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	137.7	167.6	-50.3	-169	153.7	0	0	110.6	K795 G802 W806 T849	K795-E804 VanDerWaalsContact CE-CD 3.49Å; K795-E804 WeakPolarHBondContact CE-OE1 3.43Å; K795-E804 IonicContact NZ-OE1 3.84Å; K795-E804 PolarHBondContact NZ-OE1 3.07Å; K795-E804 IonicContact NZ-OE2 2.76Å; G802-E804 PolarHBondContact O-N 3.14Å; E804-W806 PolarHBondContact OE2-NE1 3.48Å; E804-T849 WeakPolarHBondContact OE1-CG2 3.31Å
805	H	80.1	Confident	77	Confident	99 Å²	99	66 Å²	66	46%	0.458	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.5	169.2	-72.6	55.3	0	0	0	108.3	K795 A796 S797 S799 K803	K795-H805 CarbonylContact C-O 3.55Å; A796-H805 CarbonylContact C-O 3.58Å; A796-H805 PolarHBondContact N-O 2.95Å; S797-H805 PolarHBondContact O-N 2.81Å; S797-H805 VanDerWaalsContact O-N 3.11Å; S799-H805 VanDerWaalsContact CB-CE1 3.47Å; S799-H805 WeakPolarHBondContact CB-CE1 3.44Å; S799-H805 PolarHBondContact OG-CE1 3.46Å; K803-H805 PolarHBondContact O-ND1 3.13Å
806	W	86.9	Confident	76.3	Confident	46 Å²	46	63.7 Å²	63.7	17%	0.174	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.5	178.7	-73.8	82	0	0	0	108.9	H793 Y794 K795 E804 T849 R851 A854 E866	H793-W806 HydrophobicContact CB-CE3 4.13Å; H793-W806 WeakPolarHBondContact O-CZ3 3.39Å; Y794-W806 WeakPolarHBondContact O-CA 3.42Å; K795-W806 HydrophobicContact CB-CD2 4.16Å; K795-W806 HydrophobicContact CB-CE3 4.21Å; K795-W806 HydrophobicContact CB-CH2 4.11Å; K795-W806 HydrophobicContact CB-CZ2 4.04Å; K795-W806 HydrophobicContact CB-CZ3 4.17Å; K795-W806 HydrophobicContact CD-CZ2 4.03Å; K795-W806 HydrophobicContact CG-CZ2 4.32Å; E804-W806 PolarHBondContact OE2-NE1 3.48Å; W806-T849 HydrophobicContact CZ2-CG2 4.2Å; W806-R851 VanDerWaalsContact CB-NH1 3.29Å; W806-R851 VanDerWaalsContact CE2-CD 3.41Å; W806-R851 HydrophobicContact CZ2-CB 4.19Å; W806-A854 HydrophobicContact CH2-CB 4.44Å; W806-E866 HydrophobicContact CH2-CB 4.03Å
807	K	89.3	Confident	76.8	Confident	117 Å²	117	64.3 Å²	64.3	51%	0.509	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.2	177.8	-70.2	179.7	-173.3	178.3	0	109.3	H793 Y794 A796	H793-K807 CarbonylContact C-O 3.55Å; H793-K807 WeakPolarHBondContact CA-O 3.3Å; Y794-K807 HydrophobicContact CD1-CB 4Å; Y794-K807 WeakPolarHBondContact CD1-O 3.5Å; Y794-K807 HydrophobicContact CE1-CB 3.49Å; Y794-K807 VanDerWaalsContact CE1-CB 3.49Å; Y794-K807 HydrophobicContact CE1-CD 4.36Å; Y794-K807 PolarHBondContact N-O 2.83Å; Y794-K807 PolarHBondContact O-N 2.65Å; A796-K807 HydrophobicContact CB-CB 4.13Å; A796-K807 HydrophobicContact CB-CD 3.58Å; A796-K807 HydrophobicContact CB-CG 3.71Å
808	A	90.2	Very high	78	Confident	47 Å²	47	60.3 Å²	60.3	39%	0.388	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	151.8	167.3	0	0	0	0	0	110	M791 L792	M791-A808 HydrophobicContact CE-CB 3.71Å; L792-A808 CarbonylContact O-C 3.42Å; L792-A808 WeakPolarHBondContact O-CA 3.22Å
809	C	92.3	Very high	79.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	145.7	172	55.9	0	0	0	0	109.8	L792 Y794 Q820 Y821	L792-C809 PolarHBondContact N-O 3.35Å; L792-C809 PolarHBondContact O-N 2.83Å; Y794-C809 HydrophobicContact CD1-CB 3.61Å; Y794-C809 VanDerWaalsContact CD1-SG 3.57Å; Y794-C809 HydrophobicContact CE1-CB 3.94Å; C809-Q820 HydrophobicContact CB-CG 3.81Å; C809-Q820 PolarHBondContact SG-NE2 2.77Å; C809-Q820 VanDerWaalsContact SG-NE2 3.41Å; C809-Y821 CarbonylContact C-O 3.57Å; C809-Y821 VanDerWaalsContact CA-O 3.32Å; C809-Y821 WeakPolarHBondContact CA-O 3.47Å; C809-Y821 VanDerWaalsContact CB-O 3.23Å; C809-Y821 WeakPolarHBondContact CB-O 3.24Å
810	F	92.6	Very high	80.8	Confident	18 Å²	18	57.6 Å²	57.6	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.3	171.1	-175.4	-112.9	0	0	0	109.4	E789 G790 M791 V812 Y821 R824	E789-F810 HydrophobicContact CB-CE2 4.31Å; E789-F810 HydrophobicContact CB-CZ 3.8Å; E789-F810 HydrophobicContact CG-CZ 4.15Å; G790-F810 WeakPolarHBondContact O-CD2 3.41Å; M791-F810 HydrophobicContact SD-CB 3.88Å; M791-F810 HydrophobicContact SD-CD2 4.21Å; F810-V812 HydrophobicContact CD1-CG2 3.73Å; F810-V812 HydrophobicContact CE1-CG2 3.29Å; F810-V812 HydrophobicContact CZ-CG2 4.01Å; F810-Y821 HydrophobicContact CD1-CD2 4.34Å; F810-Y821 PolarHBondContact N-O 3.13Å; F810-Y821 PolarHBondContact O-N 3.28Å; F810-R824 HydrophobicContact CB-CB 4.34Å; F810-R824 HydrophobicContact CD1-CB 3.99Å; F810-R824 HydrophobicContact CD1-CG 4Å; F810-R824 HydrophobicContact CD2-CB 3.98Å; F810-R824 HydrophobicContact CD2-CG 4.15Å; F810-R824 HydrophobicContact CE1-CB 4.25Å; F810-R824 HydrophobicContact CE1-CG 3.73Å; F810-R824 HydrophobicContact CE2-CB 4.26Å; F810-R824 HydrophobicContact CE2-CG 3.91Å; F810-R824 HydrophobicContact CG-CB 3.84Å; F810-R824 HydrophobicContact CG-CG 4.19Å; F810-R824 HydrophobicContact CZ-CB 4.37Å; F810-R824 HydrophobicContact CZ-CG 3.68Å
811	V	93.2	Very high	82.5	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.018	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134	-173.4	179.8	0	0	0	0	109.5	E789 G790 L792 L818 Y819 Q820 W878	E789-V811 CarbonylContact C-O 3.44Å; E789-V811 VanDerWaalsContact CA-O 3.28Å; E789-V811 WeakPolarHBondContact CA-O 3.44Å; G790-V811 PolarHBondContact N-O 2.7Å; G790-V811 PolarHBondContact O-N 3.02Å; L792-V811 HydrophobicContact CB-CG2 4.1Å; L792-V811 HydrophobicContact CD1-CB 4.16Å; L792-V811 HydrophobicContact CD1-CG1 4.4Å; L792-V811 HydrophobicContact CD1-CG2 4.06Å; L792-V811 HydrophobicContact CG-CG2 4.4Å; V811-L818 HydrophobicContact CG1-CD1 3.47Å; V811-L818 VanDerWaalsContact CG1-CD1 3.47Å; V811-L818 HydrophobicContact CG1-CG 4.28Å; V811-Y819 WeakPolarHBondContact CA-O 3.46Å; V811-Q820 HydrophobicContact CG2-CG 4.34Å; V811-W878 HydrophobicContact CB-CH2 4.04Å; V811-W878 HydrophobicContact CB-CZ2 4.34Å; V811-W878 HydrophobicContact CG1-CH2 3.76Å; V811-W878 HydrophobicContact CG1-CZ2 4.46Å; V811-W878 HydrophobicContact CG1-CZ3 3.98Å
812	V	91.5	Very high	83.9	Confident	12 Å²	12	43.2 Å²	43.2	7%	0.073	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	119.2	-174.7	-175.3	0	0	0	0	109.4	I786 E789 F810 Y819 Y821	I786-V812 HydrophobicContact CD1-CG1 4.04Å; I786-V812 HydrophobicContact CG1-CG1 3.96Å; I786-V812 HydrophobicContact CG2-CG1 3.84Å; E789-V812 HydrophobicContact CB-CG2 4.15Å; F810-V812 HydrophobicContact CD1-CG2 3.73Å; F810-V812 HydrophobicContact CE1-CG2 3.29Å; F810-V812 HydrophobicContact CZ-CG2 4.01Å; V812-Y819 PolarHBondContact N-O 3.2Å; V812-Y819 PolarHBondContact O-N 3.45Å; V812-Y821 HydrophobicContact CB-CE2 4.33Å; V812-Y821 HydrophobicContact CG2-CD2 4.2Å; V812-Y821 HydrophobicContact CG2-CE2 4.03Å
813	L	88.3	Confident	85.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.7	170.9	-175.2	65.6	0	0	0	107.9	T787 K788 I817 L818 M835 W878 H881 L882 A885	T787-L813 PolarHBondContact N-O 3.43Å; T787-L813 WeakPolarHBondContact OG1-CG 3.27Å; T787-L813 PolarHBondContact OG1-O 3.45Å; T787-L813 VanDerWaalsContact OG1-O 3.04Å; K788-L813 HydrophobicContact CB-CB 4.44Å; K788-L813 PolarHBondContact N-O 3.41Å; K788-L813 PolarHBondContact O-N 2.92Å; L813-I817 WeakPolarHBondContact CA-O 3.37Å; L813-L818 HydrophobicContact CB-CD1 4.14Å; L813-L818 HydrophobicContact CD1-CB 4.06Å; L813-L818 HydrophobicContact CD1-CD1 4.15Å; L813-M835 HydrophobicContact CD1-CG 3.72Å; L813-W878 HydrophobicContact CB-CZ3 4.43Å; L813-H881 HydrophobicContact CD2-CB 4.17Å; L813-L882 HydrophobicContact CD1-CD2 4.42Å; L813-L882 HydrophobicContact CD2-CD2 4.4Å; L813-A885 HydrophobicContact CD1-CB 4.07Å; L813-A885 HydrophobicContact CD2-CB 4.1Å
814	S	83.4	Confident	86.2	Confident	14 Å²	14	45.2 Å²	45.2	10%	0.098	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	132.4	-174.7	-172.4	0	0	0	0	110.7	G816 I817	S814-G816 PolarHBondContact O-N 3.29Å; S814-G816 VanDerWaalsContact O-N 3.1Å; S814-I817 PolarHBondContact N-O 2.94Å; S814-I817 PolarHBondContact O-N 3.02Å
815	N	73.2	Confident	86.6	Confident	72 Å²	72	47.7 Å²	47.7	39%	0.385	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	35.1	-176.7	-60.6	-8	0	0	0	114.3	I817	N815-I817 VanDerWaalsContact C-N 3.28Å; N815-I817 PolarHBondContact O-N 2.97Å
816	G	73.8	Confident	86.6	Confident	10 Å²	10	46.1 Å²	46.1	10%	0.103	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	-0.2	-176.7	0	0	0	0	0	115.4	S814 M835 V890	S814-G816 PolarHBondContact O-N 3.29Å; S814-G816 VanDerWaalsContact O-N 3.1Å; G816-M835 WeakPolarHBondContact O-CA 3.43Å; G816-M835 WeakPolarHBondContact O-CB 3.32Å; G816-M835 WeakPolarHBondContact O-CG 3.18Å; G816-M835 PolarHBondContact O-N 3.29Å; G816-V890 WeakPolarHBondContact O-CG2 3.22Å
817	I	84.9	Confident	86.1	Confident	31 Å²	31	50.4 Å²	50.4	16%	0.159	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.9	175.9	-57.1	173.4	0	0	0	109.1	L813 S814 N815 Y819 V833 V890	L813-I817 WeakPolarHBondContact CA-O 3.37Å; S814-I817 PolarHBondContact N-O 2.94Å; S814-I817 PolarHBondContact O-N 3.02Å; N815-I817 VanDerWaalsContact C-N 3.28Å; N815-I817 PolarHBondContact O-N 2.97Å; I817-Y819 HydrophobicContact CB-CD2 4.38Å; I817-Y819 HydrophobicContact CB-CE2 3.65Å; I817-Y819 HydrophobicContact CG2-CD1 4.25Å; I817-Y819 HydrophobicContact CG2-CD2 4.06Å; I817-Y819 HydrophobicContact CG2-CE1 3.76Å; I817-Y819 HydrophobicContact CG2-CE2 3.55Å; I817-Y819 HydrophobicContact CG2-CG 4.39Å; I817-V833 CarbonylContact C-O 3.57Å; I817-V833 WeakPolarHBondContact CA-O 3.34Å; I817-V833 WeakPolarHBondContact CG2-O 3.36Å; I817-V890 HydrophobicContact CG1-CG2 3.75Å
818	L	89.3	Confident	85.5	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.026	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	112	174.1	-177.5	70.5	0	0	0	109.6	V811 L813 S832 V833 M835 V857 W878 L882	V811-L818 HydrophobicContact CG1-CD1 3.47Å; V811-L818 VanDerWaalsContact CG1-CD1 3.47Å; V811-L818 HydrophobicContact CG1-CG 4.28Å; L813-L818 HydrophobicContact CB-CD1 4.14Å; L813-L818 HydrophobicContact CD1-CB 4.06Å; L813-L818 HydrophobicContact CD1-CD1 4.15Å; L818-S832 CarbonylContact O-C 3.55Å; L818-S832 WeakPolarHBondContact O-CA 3.4Å; L818-V833 HydrophobicContact CB-CB 4.39Å; L818-V833 PolarHBondContact N-O 3.49Å; L818-V833 PolarHBondContact O-N 2.81Å; L818-M835 HydrophobicContact CB-CG 3.75Å; L818-M835 HydrophobicContact CB-SD 3.52Å; L818-M835 VanDerWaalsContact CB-SD 3.52Å; L818-M835 HydrophobicContact CD2-SD 3.9Å; L818-M835 HydrophobicContact CG-SD 4.33Å; L818-V857 HydrophobicContact CD2-CG2 4.39Å; L818-W878 HydrophobicContact CD1-CZ3 4.41Å; L818-L882 HydrophobicContact CD1-CD2 3.82Å; L818-L882 HydrophobicContact CD2-CD2 3.81Å; L818-L882 HydrophobicContact CG-CD2 4.33Å
819	Y	91	Very high	85.3	Confident	58 Å²	58	51.2 Å²	51.2	23%	0.227	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.9	175.2	-57.8	-87	0	0	0	110.8	V811 V812 I817 Y821 P829 L831	V811-Y819 WeakPolarHBondContact CA-O 3.46Å; V812-Y819 PolarHBondContact N-O 3.2Å; V812-Y819 PolarHBondContact O-N 3.45Å; I817-Y819 HydrophobicContact CB-CD2 4.38Å; I817-Y819 HydrophobicContact CB-CE2 3.65Å; I817-Y819 HydrophobicContact CG2-CD1 4.25Å; I817-Y819 HydrophobicContact CG2-CD2 4.06Å; I817-Y819 HydrophobicContact CG2-CE1 3.76Å; I817-Y819 HydrophobicContact CG2-CE2 3.55Å; I817-Y819 HydrophobicContact CG2-CG 4.39Å; Y819-Y821 HydrophobicContact CG-CE2 4.41Å; Y819-P829 HydrophobicContact CD1-CB 4.37Å; Y819-P829 HydrophobicContact CD1-CG 4.23Å; Y819-L831 WeakPolarHBondContact CA-O 3.42Å
820	Q	90.9	Very high	84.9	Confident	10 Å²	10	55.5 Å²	55.5	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.5	172.7	-175.2	-168.1	7.1	0	0	109	Y794 C809 V811 P829 L830 L831	Y794-Q820 VanDerWaalsContact CD2-NE2 3.35Å; C809-Q820 HydrophobicContact CB-CG 3.81Å; C809-Q820 PolarHBondContact SG-NE2 2.77Å; C809-Q820 VanDerWaalsContact SG-NE2 3.41Å; V811-Q820 HydrophobicContact CG2-CG 4.34Å; Q820-P829 CarbonylContact O-C 3.53Å; Q820-P829 WeakPolarHBondContact O-CA 3.45Å; Q820-P829 WeakPolarHBondContact O-CB 3.28Å; Q820-L830 PolarHBondContact O-N 3.38Å; Q820-L831 HydrophobicContact CB-CB 4.1Å; Q820-L831 PolarHBondContact N-O 3.26Å; Q820-L831 PolarHBondContact O-N 3.02Å
821	Y	90.6	Very high	84.5	Confident	44 Å²	44	55.8 Å²	55.8	17%	0.173	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154.9	176.6	-60.8	-92.7	0	0	0	110.2	C809 F810 V812 Y819 D826 P829	C809-Y821 CarbonylContact C-O 3.57Å; C809-Y821 VanDerWaalsContact CA-O 3.32Å; C809-Y821 WeakPolarHBondContact CA-O 3.47Å; C809-Y821 VanDerWaalsContact CB-O 3.23Å; C809-Y821 WeakPolarHBondContact CB-O 3.24Å; F810-Y821 HydrophobicContact CD1-CD2 4.34Å; F810-Y821 PolarHBondContact N-O 3.13Å; F810-Y821 PolarHBondContact O-N 3.28Å; V812-Y821 HydrophobicContact CB-CE2 4.33Å; V812-Y821 HydrophobicContact CG2-CD2 4.2Å; V812-Y821 HydrophobicContact CG2-CE2 4.03Å; Y819-Y821 HydrophobicContact CG-CE2 4.41Å; Y821-D826 VanDerWaalsContact CD1-O 3.26Å; Y821-D826 WeakPolarHBondContact CD1-O 3.26Å; Y821-P829 HydrophobicContact CD1-CB 4.09Å; Y821-P829 HydrophobicContact CE1-CB 3.84Å; Y821-P829 HydrophobicContact CE1-CG 4.29Å
822	P	85.6	Confident	84.2	Confident	53 Å²	53	59 Å²	59	34%	0.344	32%	0.317	S	S	.	.	S	Bend	trans	-63.4	-49.5	173	-8.6	21.2	0	0	0	111.5	D826 L830	P822-D826 VanDerWaalsContact CB-OD2 3.24Å; P822-D826 WeakPolarHBondContact CB-OD2 3.26Å; P822-D826 VanDerWaalsContact CD-OD2 3.27Å; P822-D826 WeakPolarHBondContact CD-OD2 3.4Å; P822-D826 HydrophobicContact CG-CB 4.38Å; P822-D826 WeakPolarHBondContact CG-OD2 3.42Å; P822-L830 HydrophobicContact CB-CD1 4.22Å; P822-L830 HydrophobicContact CG-CD1 4.01Å; P822-L830 HydrophobicContact CG-CD2 4.06Å; P822-L830 HydrophobicContact CG-CG 3.85Å
823	D	85.3	Confident	83.8	Confident	82 Å²	82	58.7 Å²	58.7	44%	0.439	32%	0.315	S	S	.	.	S	Bend	trans	-138.6	166	173.1	-156.7	-16	0	0	0	110.9	T825 D826	D823-T825 PolarHBondContact O-N 3.27Å; D823-T825 VanDerWaalsContact O-N 3.14Å; D823-D826 PolarHBondContact N-OD2 2.96Å; D823-D826 PolarHBondContact O-N 3.31Å; D823-D826 VanDerWaalsContact O-N 3.13Å
824	R	84.5	Confident	83.4	Confident	164 Å²	164	61 Å²	61	62%	0.619	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-16.3	-178.5	-171.7	170.7	-166.6	-141	7.8	113.9	E789 F810	E789-R824 IonicContact OE1-CZ 3.69Å; E789-R824 IonicContact OE1-NE 2.87Å; E789-R824 PolarHBondContact OE1-NE 3.04Å; E789-R824 IonicContact OE1-NH2 3.94Å; E789-R824 PolarHBondContact OE1-NH2 3.46Å; F810-R824 HydrophobicContact CB-CB 4.34Å; F810-R824 HydrophobicContact CD1-CB 3.99Å; F810-R824 HydrophobicContact CD1-CG 4Å; F810-R824 HydrophobicContact CD2-CB 3.98Å; F810-R824 HydrophobicContact CD2-CG 4.15Å; F810-R824 HydrophobicContact CE1-CB 4.25Å; F810-R824 HydrophobicContact CE1-CG 3.73Å; F810-R824 HydrophobicContact CE2-CB 4.26Å; F810-R824 HydrophobicContact CE2-CG 3.91Å; F810-R824 HydrophobicContact CG-CB 3.84Å; F810-R824 HydrophobicContact CG-CG 4.19Å; F810-R824 HydrophobicContact CZ-CB 4.37Å; F810-R824 HydrophobicContact CZ-CG 3.68Å
825	T	81.1	Confident	83.1	Confident	117 Å²	117	60.3 Å²	60.3	72%	0.718	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-7.7	177.5	51.4	0	0	0	0	114.1	D823	D823-T825 PolarHBondContact O-N 3.27Å; D823-T825 VanDerWaalsContact O-N 3.14Å
826	D	81.7	Confident	82.5	Confident	65 Å²	65	57.1 Å²	57.1	35%	0.348	31%	0.307	S	S	.	.			trans	-84.4	135.5	-176	-65.8	-44.4	0	0	0	112	Y821 P822 D823	Y821-D826 VanDerWaalsContact CD1-O 3.26Å; Y821-D826 WeakPolarHBondContact CD1-O 3.26Å; P822-D826 VanDerWaalsContact CB-OD2 3.24Å; P822-D826 WeakPolarHBondContact CB-OD2 3.26Å; P822-D826 VanDerWaalsContact CD-OD2 3.27Å; P822-D826 WeakPolarHBondContact CD-OD2 3.4Å; P822-D826 HydrophobicContact CG-CB 4.38Å; P822-D826 WeakPolarHBondContact CG-OD2 3.42Å; D823-D826 PolarHBondContact N-OD2 2.96Å; D823-D826 PolarHBondContact O-N 3.31Å; D823-D826 VanDerWaalsContact O-N 3.13Å
827	V	75.8	Confident	82	Confident	137 Å²	137	60 Å²	60	83%	0.83	34%	0.337	S	S	*	.	S	Bend	trans	-87.8	-17.4	-179.6	-170.7	0	0	0	0	111.9
828	I	76.4	Confident	80.7	Confident	136 Å²	136	67 Å²	67	70%	0.697	37%	0.369	S	S	*	.	S	Bend	trans	-109.4	120.7	-175.1	-56	176.4	0	0	0	109.2
829	P	85.9	Confident	79.5	Confident	44 Å²	44	71 Å²	71	29%	0.286	39%	0.387	S	S	.	.			trans	-74.3	144.8	175.1	30.5	-33.5	0	0	0	111.5	Y819 Q820 Y821 L831	Y819-P829 HydrophobicContact CD1-CB 4.37Å; Y819-P829 HydrophobicContact CD1-CG 4.23Å; Q820-P829 CarbonylContact O-C 3.53Å; Q820-P829 WeakPolarHBondContact O-CA 3.45Å; Q820-P829 WeakPolarHBondContact O-CB 3.28Å; Y821-P829 HydrophobicContact CD1-CB 4.09Å; Y821-P829 HydrophobicContact CE1-CB 3.84Å; Y821-P829 HydrophobicContact CE1-CG 4.29Å; P829-L831 VanDerWaalsContact C-N 3.31Å
830	L	84.1	Confident	78.9	Confident	91 Å²	91	68.3 Å²	68.3	48%	0.476	38%	0.377	S	S	.	.	S	Bend	trans	-68.7	-30.9	166.2	-66.8	171.9	0	0	0	112.1	Y794 Q820 P822	Y794-L830 HydrophobicContact CE1-CD1 4.48Å; Q820-L830 PolarHBondContact O-N 3.38Å; P822-L830 HydrophobicContact CB-CD1 4.22Å; P822-L830 HydrophobicContact CG-CD1 4.01Å; P822-L830 HydrophobicContact CG-CD2 4.06Å; P822-L830 HydrophobicContact CG-CG 3.85Å
831	L	83.5	Confident	77.9	Confident	24 Å²	24	70.5 Å²	70.5	13%	0.126	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	141.9	-176.9	177.5	65.9	0	0	0	109.7	Y819 Q820 P829 V833 L865	Y819-L831 WeakPolarHBondContact CA-O 3.42Å; Q820-L831 HydrophobicContact CB-CB 4.1Å; Q820-L831 PolarHBondContact N-O 3.26Å; Q820-L831 PolarHBondContact O-N 3.02Å; P829-L831 VanDerWaalsContact C-N 3.31Å; L831-V833 HydrophobicContact CD1-CG2 4.08Å; L831-V833 HydrophobicContact CD2-CG2 3.95Å; L831-V833 HydrophobicContact CG-CG2 3.91Å; L831-L865 HydrophobicContact CD2-CD1 3.96Å; L831-L865 HydrophobicContact CD2-CD2 3.88Å; L831-L865 HydrophobicContact CD2-CG 4.42Å
832	S	87.4	Confident	77.6	Confident	69 Å²	69	68.9 Å²	68.9	48%	0.483	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127.7	166	55.8	0	0	0	0	108.6	L818	L818-S832 CarbonylContact O-C 3.55Å; L818-S832 WeakPolarHBondContact O-CA 3.4Å
833	V	82.9	Confident	77.6	Confident	7 Å²	7	67.2 Å²	67.2	4%	0.042	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.5	179.1	173	0	0	0	0	108.9	I817 L818 L831 M835 C840 L859	I817-V833 CarbonylContact C-O 3.57Å; I817-V833 WeakPolarHBondContact CA-O 3.34Å; I817-V833 WeakPolarHBondContact CG2-O 3.36Å; L818-V833 HydrophobicContact CB-CB 4.39Å; L818-V833 PolarHBondContact N-O 3.49Å; L818-V833 PolarHBondContact O-N 2.81Å; L831-V833 HydrophobicContact CD1-CG2 4.08Å; L831-V833 HydrophobicContact CD2-CG2 3.95Å; L831-V833 HydrophobicContact CG-CG2 3.91Å; V833-M835 HydrophobicContact CB-SD 4.37Å; V833-M835 HydrophobicContact CG1-SD 3.82Å; V833-M835 PolarHBondContact O-N 2.9Å; V833-C840 HydrophobicContact CG1-CB 3.92Å; V833-L859 HydrophobicContact CB-CD2 4.3Å; V833-L859 HydrophobicContact CG1-CD2 3.53Å; V833-L859 HydrophobicContact CG2-CD1 4.17Å; V833-L859 HydrophobicContact CG2-CD2 3.75Å
834	N	79.8	Confident	77.7	Confident	47 Å²	47	69.4 Å²	69.4	25%	0.251	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	116.2	166.3	-175.4	-19.4	0	0	0	108.9	G836 Q839 C840 V890	N834-G836 PolarHBondContact O-N 2.87Å; N834-G836 WeakPolarHBondContact OD1-CA 3.33Å; N834-G836 PolarHBondContact OD1-N 3.26Å; N834-G836 VanDerWaalsContact OD1-N 3.11Å; N834-G836 PolarHBondContact OD1-O 3.44Å; N834-G836 VanDerWaalsContact OD1-O 3.12Å; N834-Q839 HydrophobicContact CB-CB 4.27Å; N834-Q839 HydrophobicContact CB-CG 4.49Å; N834-Q839 VanDerWaalsContact CB-OE1 3.24Å; N834-C840 VanDerWaalsContact O-CB 3.31Å; N834-C840 WeakPolarHBondContact O-CB 3.36Å; N834-V890 VanDerWaalsContact OD1-CB 3.26Å; N834-V890 WeakPolarHBondContact OD1-CB 3.37Å; N834-V890 WeakPolarHBondContact OD1-CG2 3.33Å
835	M	77.3	Confident	77.9	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	39%	0.385	C	S	.	.	S	Bend	trans	-84.5	56.6	175.4	-50.5	-64.5	-59.9	0	0	109.4	L813 G816 L818 V833 C840 V857 L882 A885 V886	L813-M835 HydrophobicContact CD1-CG 3.72Å; G816-M835 WeakPolarHBondContact O-CA 3.43Å; G816-M835 WeakPolarHBondContact O-CB 3.32Å; G816-M835 WeakPolarHBondContact O-CG 3.18Å; G816-M835 PolarHBondContact O-N 3.29Å; L818-M835 HydrophobicContact CB-CG 3.75Å; L818-M835 HydrophobicContact CB-SD 3.52Å; L818-M835 VanDerWaalsContact CB-SD 3.52Å; L818-M835 HydrophobicContact CD2-SD 3.9Å; L818-M835 HydrophobicContact CG-SD 4.33Å; V833-M835 HydrophobicContact CB-SD 4.37Å; V833-M835 HydrophobicContact CG1-SD 3.82Å; V833-M835 PolarHBondContact O-N 2.9Å; M835-C840 WeakPolarHBondContact CE-SG 3.35Å; M835-C840 HydrophobicContact SD-CB 4.36Å; M835-V857 HydrophobicContact CE-CG1 3.96Å; M835-V857 HydrophobicContact SD-CG1 4.4Å; M835-L882 HydrophobicContact CE-CB 4.12Å; M835-L882 HydrophobicContact CE-CD2 3.58Å; M835-L882 HydrophobicContact CE-CG 4.44Å; M835-L882 HydrophobicContact SD-CD2 4.29Å; M835-A885 HydrophobicContact CB-CB 3.81Å; M835-A885 HydrophobicContact CG-CB 4.37Å; M835-A885 CarbonylContact O-C 3.56Å; M835-V886 HydrophobicContact CB-CG2 4.03Å; M835-V886 HydrophobicContact CE-CG2 3.71Å; M835-V886 VanDerWaalsContact O-CA 3.32Å; M835-V886 WeakPolarHBondContact O-CA 3.36Å; M835-V886 PolarHBondContact O-N 2.93Å
836	G	60.3	Low	77.9	Confident	6 Å²	6	63.3 Å²	63.3	6%	0.062	36%	0.357	C	S	.	.	S	Bend	trans	-178.3	142	-172.1	0	0	0	0	0	112.3	N834	N834-G836 PolarHBondContact O-N 2.87Å; N834-G836 WeakPolarHBondContact OD1-CA 3.33Å; N834-G836 PolarHBondContact OD1-N 3.26Å; N834-G836 VanDerWaalsContact OD1-N 3.11Å; N834-G836 PolarHBondContact OD1-O 3.44Å; N834-G836 VanDerWaalsContact OD1-O 3.12Å
837	G	63	Low	77.3	Confident	70 Å²	70	67.3 Å²	67.3	72%	0.722	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	63.1	-152.1	-171.9	0	0	0	0	0	112.3	Q839	G837-Q839 VanDerWaalsContact C-N 3.33Å; G837-Q839 PolarHBondContact O-N 2.93Å
838	E	58.8	Low	76.5	Confident	178 Å²	178	65.2 Å²	65.2	83%	0.832	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-62.5	-31.4	-167.6	-69.4	154.5	-157.4	0	0	114.5	C840 A860	E838-C840 VanDerWaalsContact C-N 3.29Å; E838-C840 PolarHBondContact O-N 3.36Å; E838-A860 WeakPolarHBondContact O-CB 3.36Å
839	Q	63.8	Low	75.9	Confident	88 Å²	88	59.7 Å²	59.7	41%	0.411	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-66.6	-23.6	-169.9	-68.7	-172.2	5	0	0	114.9	N834 G837 L859 A860	N834-Q839 HydrophobicContact CB-CB 4.27Å; N834-Q839 HydrophobicContact CB-CG 4.49Å; N834-Q839 VanDerWaalsContact CB-OE1 3.24Å; G837-Q839 VanDerWaalsContact C-N 3.33Å; G837-Q839 PolarHBondContact O-N 2.93Å; Q839-L859 WeakPolarHBondContact O-CA 3.44Å; Q839-A860 PolarHBondContact O-N 2.85Å
840	C	78.9	Confident	74.9	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.02	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	103.8	-174.1	-173.3	0	0	0	0	114.3	V833 N834 M835 E838 G842 V857 I858 V886	V833-C840 HydrophobicContact CG1-CB 3.92Å; N834-C840 VanDerWaalsContact O-CB 3.31Å; N834-C840 WeakPolarHBondContact O-CB 3.36Å; M835-C840 WeakPolarHBondContact CE-SG 3.35Å; M835-C840 HydrophobicContact SD-CB 4.36Å; E838-C840 VanDerWaalsContact C-N 3.29Å; E838-C840 PolarHBondContact O-N 3.36Å; C840-G842 PolarHBondContact O-N 2.77Å; C840-V857 VanDerWaalsContact SG-CG1 3.59Å; C840-I858 CarbonylContact C-O 3.58Å; C840-I858 VanDerWaalsContact CA-O 3.3Å; C840-I858 WeakPolarHBondContact CA-O 2.91Å; C840-I858 PolarHBondContact SG-O 3.43Å; C840-I858 VanDerWaalsContact SG-O 3.33Å; C840-V886 HydrophobicContact CB-CG2 4.47Å
841	G	69.9	Low	74.7	Confident	56 Å²	56	65.3 Å²	65.3	58%	0.577	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	31.7	176.1	0	0	0	0	0	115.3	I858	G841-I858 PolarHBondContact N-O 3.43Å
842	G	83	Confident	74.6	Confident	9 Å²	9	68.3 Å²	68.3	9%	0.093	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87.6	-157.2	178.9	0	0	0	0	0	115.2	C840 I858	C840-G842 PolarHBondContact O-N 2.77Å; G842-I858 PolarHBondContact O-N 3.07Å
843	C	87.3	Confident	74.7	Confident	18 Å²	18	68 Å²	68	12%	0.122	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	157	178.2	76.6	0	0	0	0	113.1	Q856	C843-Q856 CarbonylContact C-O 3.53Å; C843-Q856 WeakPolarHBondContact CA-O 3.38Å; C843-Q856 WeakPolarHBondContact CB-O 3.48Å
844	R	85.6	Confident	75.1	Confident	128 Å²	128	68 Å²	68	48%	0.483	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.9	-179.6	64.2	-178.4	-179.3	-144	-2.9	111.8	F855 Q856 I858	R844-F855 CarbonylContact O-C 3.56Å; R844-F855 WeakPolarHBondContact O-CA 3.13Å; R844-F855 WeakPolarHBondContact O-CB 3.2Å; R844-Q856 HydrophobicContact CG-CB 4.03Å; R844-Q856 VanDerWaalsContact CZ-OE1 3.27Å; R844-Q856 PolarHBondContact N-O 3.02Å; R844-Q856 PolarHBondContact O-N 3.13Å; R844-I858 HydrophobicContact CG-CD1 4.23Å; R844-I858 HydrophobicContact CG-CG1 4.44Å
845	R	88.7	Confident	75.7	Confident	132 Å²	132	65.7 Å²	65.7	50%	0.498	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	139.7	172.3	-66.4	-180	177.4	-152.8	-8.3	109.9	E872 M875 M879	R845-E872 IonicContact CZ-OE1 2.65Å; R845-E872 IonicContact NH1-OE1 3.21Å; R845-E872 PolarHBondContact NH1-OE1 2.88Å; R845-E872 IonicContact NH2-OE1 2.81Å; R845-E872 PolarHBondContact NH2-OE1 3.34Å; R845-M875 HydrophobicContact CG-CE 4.35Å; R845-M875 HydrophobicContact CG-SD 4.43Å; R845-M879 HydrophobicContact CG-CE 4.03Å; R845-M879 HydrophobicContact CG-SD 3.62Å
846	S	81.7	Confident	76.3	Confident	21 Å²	21	66.3 Å²	66.3	15%	0.147	37%	0.365	C	S	.	.			trans	-83.4	134.1	173.7	-176.7	0	0	0	0	109.4	T848 A854 E866	S846-T848 PolarHBondContact OG-OG1 3.04Å; S846-A854 PolarHBondContact N-O 3.5Å; S846-E866 PolarHBondContact OG-OE1 3.29Å
847	N	68.4	Low	77.7	Confident	150 Å²	150	66 Å²	66	80%	0.802	36%	0.362	S	S	*	.			trans	-116.1	3.8	172.9	64.5	-11.6	0	0	0	112.4
848	T	59.9	Low	78.8	Confident	93 Å²	93	65 Å²	65	57%	0.571	34%	0.34	S	S	*	.	S	Bend	trans	-102.3	-0.2	-171.7	36.2	0	0	0	0	114.5	S846 Q856 E866	S846-T848 PolarHBondContact OG-OG1 3.04Å; T848-Q856 PolarHBondContact OG1-NE2 2.84Å; T848-E866 PolarHBondContact OG1-OE1 2.94Å
849	T	63.3	Low	79.9	Confident	20 Å²	20	57.5 Å²	57.5	12%	0.123	31%	0.305	C	S	.	.	S	Bend	trans	-127.3	141.6	-174.8	63.7	0	0	0	0	111.4	E804 W806 R851 E866	E804-T849 WeakPolarHBondContact OE1-CG2 3.31Å; W806-T849 HydrophobicContact CZ2-CG2 4.2Å; T849-R851 PolarHBondContact O-N 2.95Å; T849-E866 WeakPolarHBondContact CG2-OE2 3.18Å
850	D	65.8	Low	80.3	Confident	180 Å²	180	56.4 Å²	56.4	96%	0.963	31%	0.311	S	S	*	.	S	Bend	trans	-70.4	9.4	175.6	-71.5	-33.8	0	0	0	113
851	R	79.7	Confident	79.7	Confident	72 Å²	72	62.1 Å²	62.1	27%	0.272	34%	0.341	S	S	.	.	S	Bend	trans	-98.3	127	-172.8	-170.3	174.8	179.1	103.5	9.5	110.5	H793 W806 T849 A854 S868	H793-R851 PolarHBondContact CD2-NH2 3.22Å; H793-R851 VanDerWaalsContact CD2-NH2 3.29Å; H793-R851 PolarHBondContact ND1-NH2 2.81Å; W806-R851 VanDerWaalsContact CB-NH1 3.29Å; W806-R851 VanDerWaalsContact CE2-CD 3.41Å; W806-R851 HydrophobicContact CZ2-CB 4.19Å; T849-R851 PolarHBondContact O-N 2.95Å; R851-A854 WeakPolarHBondContact O-CB 3.41Å; R851-S868 WeakPolarHBondContact CD-OG 3.37Å; R851-S868 VanDerWaalsContact NE-CB 3.29Å; R851-S868 PolarHBondContact NE-OG 2.9Å
852	P	81.1	Confident	79.8	Confident	88 Å²	88	66.6 Å²	66.6	57%	0.571	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	152.8	178.5	28.6	-35.7	0	0	0	111.9	A854 S868	P852-A854 PolarHBondContact O-N 3.37Å; P852-S868 PolarHBondContact O-OG 3.07Å; P852-S868 VanDerWaalsContact O-OG 3.07Å
853	H	90.3	Very high	79.5	Confident	62 Å²	62	72 Å²	72	29%	0.287	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	34.2	173.4	-43.1	-50.4	0	0	0	113.9	S868 A869 D870 S871 E872 M875	H853-S868 WeakPolarHBondContact O-CA 3.28Å; H853-A869 PolarHBondContact O-N 2.84Å; H853-A869 VanDerWaalsContact O-N 3.12Å; H853-D870 PolarHBondContact CD2-O 3.46Å; H853-S871 VanDerWaalsContact CD2-CA 3.41Å; H853-S871 WeakPolarHBondContact CD2-CA 3.37Å; H853-E872 PolarHBondContact CE1-N 3.13Å; H853-E872 PolarHBondContact ND1-N 2.81Å; H853-M875 VanDerWaalsContact C-SD 3.5Å; H853-M875 HydrophobicContact CB-CB 4.22Å; H853-M875 HydrophobicContact CB-SD 4.35Å
854	A	90.4	Very high	79.4	Confident	6 Å²	6	73.1 Å²	73.1	5%	0.05	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	139.8	180	0	0	0	0	0	112.9	W806 S846 R851 P852 L867	W806-A854 HydrophobicContact CH2-CB 4.44Å; S846-A854 PolarHBondContact N-O 3.5Å; R851-A854 WeakPolarHBondContact O-CB 3.41Å; P852-A854 PolarHBondContact O-N 3.37Å; A854-L867 CarbonylContact C-O 3.21Å; A854-L867 VanDerWaalsContact CA-O 3.25Å; A854-L867 WeakPolarHBondContact CA-O 3.26Å
855	F	92.3	Very high	79.5	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	157.4	179.6	65	-80.9	0	0	0	111.3	L792 R844 V857 E866 L867 M875 W878 M879 L882	L792-F855 HydrophobicContact CD1-CE1 4.46Å; L792-F855 HydrophobicContact CD1-CZ 3.91Å; R844-F855 CarbonylContact O-C 3.56Å; R844-F855 WeakPolarHBondContact O-CA 3.13Å; R844-F855 WeakPolarHBondContact O-CB 3.2Å; F855-V857 HydrophobicContact CE2-CG2 4.41Å; F855-E866 WeakPolarHBondContact O-CA 3.48Å; F855-L867 HydrophobicContact CD1-CB 4.22Å; F855-L867 HydrophobicContact CD2-CB 4.34Å; F855-L867 HydrophobicContact CE1-CB 3.77Å; F855-L867 HydrophobicContact CE2-CB 3.89Å; F855-L867 HydrophobicContact CE2-CD1 3.85Å; F855-L867 HydrophobicContact CE2-CG 4.42Å; F855-L867 HydrophobicContact CZ-CB 3.6Å; F855-L867 HydrophobicContact CZ-CD1 3.89Å; F855-L867 HydrophobicContact CZ-CG 4.39Å; F855-L867 PolarHBondContact N-O 2.84Å; F855-L867 PolarHBondContact O-N 3.03Å; F855-L867 VanDerWaalsContact O-O 3.13Å; F855-M875 HydrophobicContact CB-CG 4.31Å; F855-M875 HydrophobicContact CD1-CG 3.79Å; F855-M875 HydrophobicContact CE1-CG 4.49Å; F855-M875 HydrophobicContact CG-CG 4.34Å; F855-W878 HydrophobicContact CE1-CB 4.49Å; F855-W878 HydrophobicContact CE2-CB 4.47Å; F855-W878 HydrophobicContact CZ-CB 3.92Å; F855-W878 HydrophobicContact CZ-CG 4.37Å; F855-M879 HydrophobicContact CB-CG 4.19Å; F855-M879 HydrophobicContact CB-SD 4.02Å; F855-M879 HydrophobicContact CD2-CG 4.11Å; F855-M879 HydrophobicContact CG-CG 4.19Å; F855-L882 HydrophobicContact CD2-CD1 4.43Å; F855-L882 HydrophobicContact CE2-CD1 3.65Å; F855-L882 HydrophobicContact CZ-CD1 4.5Å
856	Q	90.6	Very high	79.5	Confident	13 Å²	13	62.6 Å²	62.6	6%	0.061	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.1	-179.2	-77.7	169.1	8.7	0	0	109.1	C843 R844 T848 C864 E866	C843-Q856 CarbonylContact C-O 3.53Å; C843-Q856 WeakPolarHBondContact CA-O 3.38Å; C843-Q856 WeakPolarHBondContact CB-O 3.48Å; R844-Q856 HydrophobicContact CG-CB 4.03Å; R844-Q856 VanDerWaalsContact CZ-OE1 3.27Å; R844-Q856 PolarHBondContact N-O 3.02Å; R844-Q856 PolarHBondContact O-N 3.13Å; T848-Q856 PolarHBondContact OG1-NE2 2.84Å; Q856-C864 HydrophobicContact CB-CB 4.23Å; Q856-C864 HydrophobicContact CG-CB 4.37Å; Q856-E866 HydrophobicContact CG-CG 3.48Å; Q856-E866 VanDerWaalsContact CG-CG 3.48Å; Q856-E866 PolarHBondContact NE2-OE1 3.34Å
857	V	89.6	Confident	80.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	125.2	159.9	-169.5	0	0	0	0	107.5	L818 M835 C840 F855 L859 C864 L865 L867 L882	L818-V857 HydrophobicContact CD2-CG2 4.39Å; M835-V857 HydrophobicContact CE-CG1 3.96Å; M835-V857 HydrophobicContact SD-CG1 4.4Å; C840-V857 VanDerWaalsContact SG-CG1 3.59Å; F855-V857 HydrophobicContact CE2-CG2 4.41Å; V857-L859 HydrophobicContact CG1-CD2 4.08Å; V857-C864 CarbonylContact O-C 3.6Å; V857-C864 VanDerWaalsContact O-CA 3.25Å; V857-C864 WeakPolarHBondContact O-CA 3.45Å; V857-C864 VanDerWaalsContact O-CB 3.26Å; V857-C864 WeakPolarHBondContact O-CB 3.39Å; V857-L865 HydrophobicContact CB-CB 4.21Å; V857-L865 PolarHBondContact N-O 3.41Å; V857-L865 PolarHBondContact O-N 2.93Å; V857-L867 HydrophobicContact CG2-CD1 4.14Å; V857-L882 HydrophobicContact CG2-CD1 4.08Å
858	I	85.8	Confident	81.2	Confident	49 Å²	49	54.6 Å²	54.6	25%	0.251	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	115.9	-176.2	-56.2	175.1	0	0	0	107.3	C840 G841 G842 R844	C840-I858 CarbonylContact C-O 3.58Å; C840-I858 VanDerWaalsContact CA-O 3.3Å; C840-I858 WeakPolarHBondContact CA-O 2.91Å; C840-I858 PolarHBondContact SG-O 3.43Å; C840-I858 VanDerWaalsContact SG-O 3.33Å; G841-I858 PolarHBondContact N-O 3.43Å; G842-I858 PolarHBondContact O-N 3.07Å; R844-I858 HydrophobicContact CG-CD1 4.23Å; R844-I858 HydrophobicContact CG-CG1 4.44Å
859	L	82.5	Confident	82.8	Confident	19 Å²	19	50.4 Å²	50.4	10%	0.099	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.9	176.2	-50.1	-178.9	0	0	0	107.8	V833 Q839 V857 R862 L865	V833-L859 HydrophobicContact CB-CD2 4.3Å; V833-L859 HydrophobicContact CG1-CD2 3.53Å; V833-L859 HydrophobicContact CG2-CD1 4.17Å; V833-L859 HydrophobicContact CG2-CD2 3.75Å; Q839-L859 WeakPolarHBondContact O-CA 3.44Å; V857-L859 HydrophobicContact CG1-CD2 4.08Å; L859-R862 HydrophobicContact CB-CB 4.05Å; L859-R862 HydrophobicContact CD1-CB 3.89Å; L859-L865 HydrophobicContact CD1-CB 4.34Å
860	A	70.9	Confident	84.1	Confident	65 Å²	65	55 Å²	55	54%	0.537	30%	0.298	S	S	.	.	S	Bend	trans	-76.4	-58.7	176.1	0	0	0	0	0	111.1	E838 Q839 R862	E838-A860 WeakPolarHBondContact O-CB 3.36Å; Q839-A860 PolarHBondContact O-N 2.85Å; A860-R862 PolarHBondContact O-N 3.36Å; A860-R862 VanDerWaalsContact O-N 3.16Å
861	D	67.5	Low	85.3	Confident	123 Å²	123	48 Å²	48	66%	0.658	26%	0.264	S	S	*	.	S	Bend	trans	-79.3	0.9	-170.9	-34.1	-48.8	0	0	0	114
862	R	70.4	Confident	85.8	Confident	150 Å²	150	49.4 Å²	49.4	57%	0.566	27%	0.273	S	S	*	.	S	Bend	trans	-146.2	151.2	-166.8	-62.8	-173	-173.9	-159.1	-1.2	111.7	L859 A860 C864	L859-R862 HydrophobicContact CB-CB 4.05Å; L859-R862 HydrophobicContact CD1-CB 3.89Å; A860-R862 PolarHBondContact O-N 3.36Å; A860-R862 VanDerWaalsContact O-N 3.16Å; R862-C864 PolarHBondContact O-N 2.89Å
863	P	77.5	Confident	86.2	Confident	122 Å²	122	48.8 Å²	48.8	79%	0.792	28%	0.276	S	S	*	.			trans	-56.1	140.3	168.4	25.9	-35	0	0	0	110.4	L865	P863-L865 PolarHBondContact O-N 3.42Å
864	C	84.4	Confident	86.3	Confident	43 Å²	43	49.2 Å²	49.2	29%	0.291	28%	0.278	S	S	.	.			trans	-55.7	133.4	-175.4	58.3	0	0	0	0	112.2	Q856 V857 R862 E866	Q856-C864 HydrophobicContact CB-CB 4.23Å; Q856-C864 HydrophobicContact CG-CB 4.37Å; V857-C864 CarbonylContact O-C 3.6Å; V857-C864 VanDerWaalsContact O-CA 3.25Å; V857-C864 WeakPolarHBondContact O-CA 3.45Å; V857-C864 VanDerWaalsContact O-CB 3.26Å; V857-C864 WeakPolarHBondContact O-CB 3.39Å; R862-C864 PolarHBondContact O-N 2.89Å; C864-E866 PolarHBondContact O-N 2.74Å
865	L	87.9	Confident	86.4	Confident	21 Å²	21	49.3 Å²	49.3	11%	0.11	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	101.9	-179.7	-178.9	69.5	0	0	0	109.1	L831 V857 L859 P863 L867	L831-L865 HydrophobicContact CD2-CD1 3.96Å; L831-L865 HydrophobicContact CD2-CD2 3.88Å; L831-L865 HydrophobicContact CD2-CG 4.42Å; V857-L865 HydrophobicContact CB-CB 4.21Å; V857-L865 PolarHBondContact N-O 3.41Å; V857-L865 PolarHBondContact O-N 2.93Å; L859-L865 HydrophobicContact CD1-CB 4.34Å; P863-L865 PolarHBondContact O-N 3.42Å; L865-L867 HydrophobicContact CD1-CD2 4.36Å; L865-L867 HydrophobicContact CD2-CD1 4Å; L865-L867 HydrophobicContact CD2-CD2 4.09Å; L865-L867 HydrophobicContact CD2-CG 4.11Å; L865-L867 HydrophobicContact CG-CD1 4.39Å; L865-L867 HydrophobicContact CG-CD2 3.95Å; L865-L867 HydrophobicContact CG-CG 3.97Å; L865-L867 PolarHBondContact O-N 3.1Å
866	E	90.2	Very high	86.2	Confident	17 Å²	17	51.1 Å²	51.1	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	112.9	173.5	-80.3	-163.3	133.9	0	0	110.9	Y794 K795 W806 S846 T848 T849 F855 Q856 C864	Y794-E866 WeakPolarHBondContact CA-O 3.34Å; K795-E866 HydrophobicContact CB-CB 4.01Å; K795-E866 HydrophobicContact CD-CB 4.18Å; K795-E866 WeakPolarHBondContact CD-OE2 3.25Å; K795-E866 WeakPolarHBondContact CE-OE2 3.36Å; K795-E866 PolarHBondContact N-O 3.1Å; K795-E866 VanDerWaalsContact N-O 3.13Å; K795-E866 IonicContact NZ-OE2 3.47Å; K795-E866 PolarHBondContact NZ-OE2 2.81Å; W806-E866 HydrophobicContact CH2-CB 4.03Å; S846-E866 PolarHBondContact OG-OE1 3.29Å; T848-E866 PolarHBondContact OG1-OE1 2.94Å; T849-E866 WeakPolarHBondContact CG2-OE2 3.18Å; F855-E866 WeakPolarHBondContact O-CA 3.48Å; Q856-E866 HydrophobicContact CG-CG 3.48Å; Q856-E866 VanDerWaalsContact CG-CG 3.48Å; Q856-E866 PolarHBondContact NE2-OE1 3.34Å; C864-E866 PolarHBondContact O-N 2.74Å
867	L	92.6	Very high	86.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	157.6	176.8	-62	178	0	0	0	110.3	L792 H793 A854 F855 V857 L865	L792-L867 HydrophobicContact CD1-CB 4.41Å; L792-L867 HydrophobicContact CD1-CD1 3.95Å; H793-L867 CarbonylContact O-C 3.11Å; H793-L867 VanDerWaalsContact O-CA 3.22Å; H793-L867 WeakPolarHBondContact O-CA 3.47Å; A854-L867 CarbonylContact C-O 3.21Å; A854-L867 VanDerWaalsContact CA-O 3.25Å; A854-L867 WeakPolarHBondContact CA-O 3.26Å; F855-L867 HydrophobicContact CD1-CB 4.22Å; F855-L867 HydrophobicContact CD2-CB 4.34Å; F855-L867 HydrophobicContact CE1-CB 3.77Å; F855-L867 HydrophobicContact CE2-CB 3.89Å; F855-L867 HydrophobicContact CE2-CD1 3.85Å; F855-L867 HydrophobicContact CE2-CG 4.42Å; F855-L867 HydrophobicContact CZ-CB 3.6Å; F855-L867 HydrophobicContact CZ-CD1 3.89Å; F855-L867 HydrophobicContact CZ-CG 4.39Å; F855-L867 PolarHBondContact N-O 2.84Å; F855-L867 PolarHBondContact O-N 3.03Å; F855-L867 VanDerWaalsContact O-O 3.13Å; V857-L867 HydrophobicContact CG2-CD1 4.14Å; L865-L867 HydrophobicContact CD1-CD2 4.36Å; L865-L867 HydrophobicContact CD2-CD1 4Å; L865-L867 HydrophobicContact CD2-CD2 4.09Å; L865-L867 HydrophobicContact CD2-CG 4.11Å; L865-L867 HydrophobicContact CG-CD1 4.39Å; L865-L867 HydrophobicContact CG-CD2 3.95Å; L865-L867 HydrophobicContact CG-CG 3.97Å; L865-L867 PolarHBondContact O-N 3.1Å
868	S	92.7	Very high	86.3	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.014	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	124.1	176.8	161.5	0	0	0	0	110	H793 R851 P852 H853	H793-S868 PolarHBondContact N-O 2.61Å; H793-S868 PolarHBondContact O-N 3.1Å; R851-S868 WeakPolarHBondContact CD-OG 3.37Å; R851-S868 VanDerWaalsContact NE-CB 3.29Å; R851-S868 PolarHBondContact NE-OG 2.9Å; P852-S868 PolarHBondContact O-OG 3.07Å; P852-S868 VanDerWaalsContact O-OG 3.07Å; H853-S868 WeakPolarHBondContact O-CA 3.28Å
869	A	93.8	Very high	86.4	Confident	5 Å²	5	52.5 Å²	52.5	4%	0.041	30%	0.3	C	S	.	.			trans	-84.5	174.3	175.8	0	0	0	0	0	111.6	L792 H853 S871 E874 M875	L792-A869 HydrophobicContact CD2-CB 3.81Å; H853-A869 PolarHBondContact O-N 2.84Å; H853-A869 VanDerWaalsContact O-N 3.12Å; A869-S871 VanDerWaalsContact C-N 3.33Å; A869-E874 HydrophobicContact CB-CB 3.82Å; A869-M875 HydrophobicContact CB-CB 4.09Å
870	D	90.3	Very high	86.6	Confident	116 Å²	116	58 Å²	58	62%	0.62	33%	0.326	S	S	*	.	S	Bend	trans	-76.3	-22.5	175.4	81	-19.5	0	0	0	113.3	H853	H853-D870 PolarHBondContact CD2-O 3.46Å
871	S	91	Very high	87.2	Confident	34 Å²	34	57.3 Å²	57.3	24%	0.238	31%	0.311	C	S	.	.	S	Bend	trans	-152	159.7	-167.7	62	0	0	0	0	112.1	H853 A869 A873 E874 M875	H853-S871 VanDerWaalsContact CD2-CA 3.41Å; H853-S871 WeakPolarHBondContact CD2-CA 3.37Å; A869-S871 VanDerWaalsContact C-N 3.33Å; S871-A873 VanDerWaalsContact C-N 3.26Å; S871-A873 PolarHBondContact O-N 3.05Å; S871-E874 PolarHBondContact O-N 3.1Å; S871-E874 PolarHBondContact OG-N 3.03Å; S871-M875 PolarHBondContact O-N 2.89Å
872	E	90.6	Very high	88.1	Confident	101 Å²	101	51.5 Å²	51.5	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-30.5	175.8	177.9	159.9	-157.2	0	0	112.2	R845 H853 M875 A876	R845-E872 IonicContact CZ-OE1 2.65Å; R845-E872 IonicContact NH1-OE1 3.21Å; R845-E872 PolarHBondContact NH1-OE1 2.88Å; R845-E872 IonicContact NH2-OE1 2.81Å; R845-E872 PolarHBondContact NH2-OE1 3.34Å; H853-E872 PolarHBondContact CE1-N 3.13Å; H853-E872 PolarHBondContact ND1-N 2.81Å; E872-M875 HydrophobicContact CG-CE 4.01Å; E872-A876 WeakPolarHBondContact O-CB 3.46Å; E872-A876 PolarHBondContact O-N 3.22Å
873	A	89.3	Confident	88.6	Confident	75 Å²	75	47 Å²	47	62%	0.62	27%	0.271	S	S	*	.	H	α-helix	trans	-65.8	-49.8	176.3	0	0	0	0	0	111.5	S871 M875 A876 D877	S871-A873 VanDerWaalsContact C-N 3.26Å; S871-A873 PolarHBondContact O-N 3.05Å; A873-M875 PolarHBondContact O-N 3.05Å; A873-A876 PolarHBondContact O-N 3.19Å; A873-D877 WeakPolarHBondContact O-CB 3.37Å; A873-D877 PolarHBondContact O-N 2.87Å
874	E	92.6	Very high	88.6	Confident	71 Å²	71	45.8 Å²	45.8	33%	0.332	26%	0.255	S	S	.	.	H	α-helix	trans	-63.3	-39.9	175.1	-77.8	-151.2	164.3	0	0	112.3	A869 S871 A876 D877 W878	A869-E874 HydrophobicContact CB-CB 3.82Å; S871-E874 PolarHBondContact O-N 3.1Å; S871-E874 PolarHBondContact OG-N 3.03Å; E874-A876 PolarHBondContact O-N 3.21Å; E874-D877 PolarHBondContact O-N 3.36Å; E874-W878 WeakPolarHBondContact O-CB 3.37Å; E874-W878 VanDerWaalsContact O-CD1 3.27Å; E874-W878 PolarHBondContact O-N 2.83Å
875	M	92.4	Very high	88.2	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.039	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-47.4	175.1	177.4	-171.8	67.5	0	0	111.5	R845 H853 F855 A869 S871 E872 A873 M879	R845-M875 HydrophobicContact CG-CE 4.35Å; R845-M875 HydrophobicContact CG-SD 4.43Å; H853-M875 VanDerWaalsContact C-SD 3.5Å; H853-M875 HydrophobicContact CB-CB 4.22Å; H853-M875 HydrophobicContact CB-SD 4.35Å; F855-M875 HydrophobicContact CB-CG 4.31Å; F855-M875 HydrophobicContact CD1-CG 3.79Å; F855-M875 HydrophobicContact CE1-CG 4.49Å; F855-M875 HydrophobicContact CG-CG 4.34Å; A869-M875 HydrophobicContact CB-CB 4.09Å; S871-M875 PolarHBondContact O-N 2.89Å; E872-M875 HydrophobicContact CG-CE 4.01Å; A873-M875 PolarHBondContact O-N 3.05Å; M875-M879 HydrophobicContact CG-SD 4.3Å; M875-M879 WeakPolarHBondContact O-CB 3.37Å; M875-M879 VanDerWaalsContact O-CG 3.29Å; M875-M879 WeakPolarHBondContact O-CG 3.15Å; M875-M879 PolarHBondContact O-N 3.19Å
876	A	87.8	Confident	87.7	Confident	39 Å²	39	45.3 Å²	45.3	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-43.1	179.9	0	0	0	0	0	111.8	E872 A873 E874 M879 Q880	E872-A876 WeakPolarHBondContact O-CB 3.46Å; E872-A876 PolarHBondContact O-N 3.22Å; A873-A876 PolarHBondContact O-N 3.19Å; E874-A876 PolarHBondContact O-N 3.21Å; A876-M879 PolarHBondContact O-N 2.6Å; A876-Q880 WeakPolarHBondContact O-CB 3.43Å; A876-Q880 PolarHBondContact O-N 3.27Å
877	D	90.4	Very high	86.6	Confident	59 Å²	59	49 Å²	49	32%	0.316	28%	0.28	S	S	.	.	H	α-helix	trans	-67.1	-41.4	179	-175.2	44.1	0	0	0	112.5	K788 A873 E874 Q880 H881	K788-D877 WeakPolarHBondContact CE-OD2 3.45Å; K788-D877 IonicContact NZ-OD2 3.28Å; K788-D877 PolarHBondContact NZ-OD2 3.46Å; A873-D877 WeakPolarHBondContact O-CB 3.37Å; A873-D877 PolarHBondContact O-N 2.87Å; E874-D877 PolarHBondContact O-N 3.36Å; D877-Q880 PolarHBondContact O-N 3.09Å; D877-H881 PolarHBondContact O-N 2.96Å; D877-H881 PolarHBondContact O-ND1 2.77Å; D877-H881 IonicContact OD1-CE1 2.83Å; D877-H881 PolarHBondContact OD1-CE1 3.25Å; D877-H881 IonicContact OD1-ND1 3.31Å; D877-H881 PolarHBondContact OD1-ND1 2.67Å; D877-H881 VanDerWaalsContact OD1-ND1 3.12Å
878	W	93	Very high	85.1	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-48.3	170.4	-89.8	109.3	0	0	0	111.9	K788 L792 V811 L813 L818 F855 E874 Q880 H881 L882	K788-W878 HydrophobicContact CB-CH2 4.31Å; K788-W878 HydrophobicContact CB-CZ3 4.19Å; K788-W878 HydrophobicContact CD-CD2 3.78Å; K788-W878 HydrophobicContact CD-CE3 3.76Å; K788-W878 HydrophobicContact CD-CG 4.31Å; K788-W878 HydrophobicContact CD-CH2 4.3Å; K788-W878 HydrophobicContact CD-CZ2 4.33Å; K788-W878 HydrophobicContact CD-CZ3 4.02Å; K788-W878 VanDerWaalsContact CE-CE2 3.43Å; K788-W878 VanDerWaalsContact CE-CG 3.49Å; K788-W878 HydrophobicContact CG-CD2 4.39Å; K788-W878 HydrophobicContact CG-CE3 4.23Å; K788-W878 HydrophobicContact CG-CH2 3.88Å; K788-W878 HydrophobicContact CG-CZ2 4.05Å; K788-W878 HydrophobicContact CG-CZ3 3.97Å; L792-W878 HydrophobicContact CD1-CD2 4Å; L792-W878 HydrophobicContact CD1-CG 4.26Å; L792-W878 HydrophobicContact CD1-CZ2 4.19Å; L792-W878 HydrophobicContact CG-CZ2 4.49Å; V811-W878 HydrophobicContact CB-CH2 4.04Å; V811-W878 HydrophobicContact CB-CZ2 4.34Å; V811-W878 HydrophobicContact CG1-CH2 3.76Å; V811-W878 HydrophobicContact CG1-CZ2 4.46Å; V811-W878 HydrophobicContact CG1-CZ3 3.98Å; L813-W878 HydrophobicContact CB-CZ3 4.43Å; L818-W878 HydrophobicContact CD1-CZ3 4.41Å; F855-W878 HydrophobicContact CE1-CB 4.49Å; F855-W878 HydrophobicContact CE2-CB 4.47Å; F855-W878 HydrophobicContact CZ-CB 3.92Å; F855-W878 HydrophobicContact CZ-CG 4.37Å; E874-W878 WeakPolarHBondContact O-CB 3.37Å; E874-W878 VanDerWaalsContact O-CD1 3.27Å; E874-W878 PolarHBondContact O-N 2.83Å; W878-Q880 VanDerWaalsContact C-N 3.31Å; W878-Q880 PolarHBondContact O-N 3.08Å; W878-H881 PolarHBondContact O-N 2.83Å; W878-L882 HydrophobicContact CE3-CG 4.5Å; W878-L882 WeakPolarHBondContact O-CB 3.49Å; W878-L882 WeakPolarHBondContact O-CD1 3.25Å; W878-L882 WeakPolarHBondContact O-CG 3.48Å; W878-L882 PolarHBondContact O-N 2.77Å
879	M	87.8	Confident	83.5	Confident	29 Å²	29	56.9 Å²	56.9	14%	0.143	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-40.9	177.7	-75.2	-173.9	66.8	0	0	112.1	R845 F855 M875 A876 L882 C883	R845-M879 HydrophobicContact CG-CE 4.03Å; R845-M879 HydrophobicContact CG-SD 3.62Å; F855-M879 HydrophobicContact CB-CG 4.19Å; F855-M879 HydrophobicContact CB-SD 4.02Å; F855-M879 HydrophobicContact CD2-CG 4.11Å; F855-M879 HydrophobicContact CG-CG 4.19Å; M875-M879 HydrophobicContact CG-SD 4.3Å; M875-M879 WeakPolarHBondContact O-CB 3.37Å; M875-M879 VanDerWaalsContact O-CG 3.29Å; M875-M879 WeakPolarHBondContact O-CG 3.15Å; M875-M879 PolarHBondContact O-N 3.19Å; A876-M879 PolarHBondContact O-N 2.6Å; M879-L882 PolarHBondContact O-N 2.94Å; M879-C883 WeakPolarHBondContact O-CB 3.39Å; M879-C883 PolarHBondContact O-N 2.72Å; M879-C883 PolarHBondContact O-SG 3.3Å; M879-C883 VanDerWaalsContact O-SG 3.4Å
880	Q	86.1	Confident	81.3	Confident	136 Å²	136	58.2 Å²	58.2	64%	0.636	33%	0.328	S	S	*	.	H	α-helix	trans	-62.3	-47.3	177	-179.1	173.5	-34.5	0	0	112	A876 D877 W878 C883 Q884	A876-Q880 WeakPolarHBondContact O-CB 3.43Å; A876-Q880 PolarHBondContact O-N 3.27Å; D877-Q880 PolarHBondContact O-N 3.09Å; W878-Q880 VanDerWaalsContact C-N 3.31Å; W878-Q880 PolarHBondContact O-N 3.08Å; Q880-C883 PolarHBondContact O-N 3.17Å; Q880-Q884 WeakPolarHBondContact O-CB 3.35Å; Q880-Q884 PolarHBondContact O-N 2.97Å
881	H	83.9	Confident	79.3	Confident	49 Å²	49	57 Å²	57	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-65.3	-37.9	178.2	-76.4	81.4	0	0	0	112.6	K788 L813 D877 W878 Q884 A885	K788-H881 HydrophobicContact CD-CB 3.94Å; L813-H881 HydrophobicContact CD2-CB 4.17Å; D877-H881 PolarHBondContact O-N 2.96Å; D877-H881 PolarHBondContact O-ND1 2.77Å; D877-H881 IonicContact OD1-CE1 2.83Å; D877-H881 PolarHBondContact OD1-CE1 3.25Å; D877-H881 IonicContact OD1-ND1 3.31Å; D877-H881 PolarHBondContact OD1-ND1 2.67Å; D877-H881 VanDerWaalsContact OD1-ND1 3.12Å; W878-H881 PolarHBondContact O-N 2.83Å; H881-Q884 PolarHBondContact O-N 2.81Å; H881-A885 PolarHBondContact O-N 2.86Å
882	L	86.6	Confident	76.8	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-67.1	-44.9	176.7	-68.7	165.8	0	0	0	111.8	L813 L818 M835 F855 V857 W878 M879 Q884 A885 V886	L813-L882 HydrophobicContact CD1-CD2 4.42Å; L813-L882 HydrophobicContact CD2-CD2 4.4Å; L818-L882 HydrophobicContact CD1-CD2 3.82Å; L818-L882 HydrophobicContact CD2-CD2 3.81Å; L818-L882 HydrophobicContact CG-CD2 4.33Å; M835-L882 HydrophobicContact CE-CB 4.12Å; M835-L882 HydrophobicContact CE-CD2 3.58Å; M835-L882 HydrophobicContact CE-CG 4.44Å; M835-L882 HydrophobicContact SD-CD2 4.29Å; F855-L882 HydrophobicContact CD2-CD1 4.43Å; F855-L882 HydrophobicContact CE2-CD1 3.65Å; F855-L882 HydrophobicContact CZ-CD1 4.5Å; V857-L882 HydrophobicContact CG2-CD1 4.08Å; W878-L882 HydrophobicContact CE3-CG 4.5Å; W878-L882 WeakPolarHBondContact O-CB 3.49Å; W878-L882 WeakPolarHBondContact O-CD1 3.25Å; W878-L882 WeakPolarHBondContact O-CG 3.48Å; W878-L882 PolarHBondContact O-N 2.77Å; M879-L882 PolarHBondContact O-N 2.94Å; L882-Q884 VanDerWaalsContact C-N 3.33Å; L882-Q884 PolarHBondContact O-N 2.66Å; L882-A885 PolarHBondContact O-N 3.33Å; L882-V886 WeakPolarHBondContact O-CG2 3.4Å; L882-V886 PolarHBondContact O-N 3.47Å
883	C	80.8	Confident	74	Confident	57 Å²	57	61.5 Å²	61.5	39%	0.385	35%	0.345	S	S	.	.	H	α-helix	trans	-63.4	-38.2	173.4	-72.2	0	0	0	0	112	M879 Q880 V886 S887	M879-C883 WeakPolarHBondContact O-CB 3.39Å; M879-C883 PolarHBondContact O-N 2.72Å; M879-C883 PolarHBondContact O-SG 3.3Å; M879-C883 VanDerWaalsContact O-SG 3.4Å; Q880-C883 PolarHBondContact O-N 3.17Å; C883-V886 PolarHBondContact O-N 2.79Å; C883-S887 WeakPolarHBondContact O-CB 3.15Å; C883-S887 PolarHBondContact O-N 3.09Å; C883-S887 PolarHBondContact O-OG 3.13Å
884	Q	76.6	Confident	71.8	Confident	95 Å²	95	62.1 Å²	62.1	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-65.5	-39.4	176	-164.9	-176.3	36	0	0	111.8	Q880 H881 L882 S887 K888	Q880-Q884 WeakPolarHBondContact O-CB 3.35Å; Q880-Q884 PolarHBondContact O-N 2.97Å; H881-Q884 PolarHBondContact O-N 2.81Å; L882-Q884 VanDerWaalsContact C-N 3.33Å; L882-Q884 PolarHBondContact O-N 2.66Å; Q884-S887 WeakPolarHBondContact CA-OG 3.46Å; Q884-S887 PolarHBondContact O-N 2.82Å; Q884-S887 PolarHBondContact O-OG 2.82Å; Q884-K888 HydrophobicContact CG-CD 4.39Å; Q884-K888 WeakPolarHBondContact O-CG 3.29Å; Q884-K888 PolarHBondContact O-N 2.93Å
885	A	76.8	Confident	69.4	Low	12 Å²	12	63 Å²	63	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-61.8	-49.5	173.6	0	0	0	0	0	111.4	L813 M835 H881 L882 S887 K888 G889	L813-A885 HydrophobicContact CD1-CB 4.07Å; L813-A885 HydrophobicContact CD2-CB 4.1Å; M835-A885 HydrophobicContact CB-CB 3.81Å; M835-A885 HydrophobicContact CG-CB 4.37Å; M835-A885 CarbonylContact O-C 3.56Å; H881-A885 PolarHBondContact O-N 2.86Å; L882-A885 PolarHBondContact O-N 3.33Å; A885-S887 VanDerWaalsContact C-N 3.27Å; A885-S887 PolarHBondContact O-N 3.05Å; A885-K888 CarbonylContact O-C 3.59Å; A885-K888 PolarHBondContact O-N 2.91Å; A885-G889 PolarHBondContact O-N 2.59Å
886	V	77.2	Confident	66.8	Low	43 Å²	43	66.3 Å²	66.3	26%	0.261	39%	0.394	S	S	.	.	H	α-helix	trans	-59	-36.9	177	174.2	0	0	0	0	112.4	M835 C840 L882 C883 K888	M835-V886 HydrophobicContact CB-CG2 4.03Å; M835-V886 HydrophobicContact CE-CG2 3.71Å; M835-V886 VanDerWaalsContact O-CA 3.32Å; M835-V886 WeakPolarHBondContact O-CA 3.36Å; M835-V886 PolarHBondContact O-N 2.93Å; C840-V886 HydrophobicContact CB-CG2 4.47Å; L882-V886 WeakPolarHBondContact O-CG2 3.4Å; L882-V886 PolarHBondContact O-N 3.47Å; C883-V886 PolarHBondContact O-N 2.79Å; V886-K888 VanDerWaalsContact C-N 3.26Å; V886-K888 PolarHBondContact O-N 2.88Å
887	S	66	Low	64.9	Low	94 Å²	94	68 Å²	68	66%	0.657	40%	0.401	S	S	*	.	H	α-helix	trans	-71.2	-14.5	174.8	69.2	0	0	0	0	115.3	C883 Q884 A885	C883-S887 WeakPolarHBondContact O-CB 3.15Å; C883-S887 PolarHBondContact O-N 3.09Å; C883-S887 PolarHBondContact O-OG 3.13Å; Q884-S887 WeakPolarHBondContact CA-OG 3.46Å; Q884-S887 PolarHBondContact O-N 2.82Å; Q884-S887 PolarHBondContact O-OG 2.82Å; A885-S887 VanDerWaalsContact C-N 3.27Å; A885-S887 PolarHBondContact O-N 3.05Å
888	K	62.8	Low	63.2	Low	145 Å²	145	67.6 Å²	67.6	63%	0.63	40%	0.403	S	S	*	.	H	α-helix	trans	-105.7	-23.4	178.3	-72.4	179.2	174	-173.7	0	113.1	Q884 A885 V886	Q884-K888 HydrophobicContact CG-CD 4.39Å; Q884-K888 WeakPolarHBondContact O-CG 3.29Å; Q884-K888 PolarHBondContact O-N 2.93Å; A885-K888 CarbonylContact O-C 3.59Å; A885-K888 PolarHBondContact O-N 2.91Å; V886-K888 VanDerWaalsContact C-N 3.26Å; V886-K888 PolarHBondContact O-N 2.88Å
889	G	57.7	Low	61.8	Low	23 Å²	23	69.4 Å²	69.4	24%	0.237	42%	0.415	C	S	.	.			trans	67.4	-177.8	-173.6	0	0	0	0	0	114.3	A885	A885-G889 PolarHBondContact O-N 2.59Å
890	V	49.1	Very low	61.5	Low	34 Å²	34	68.3 Å²	68.3	21%	0.206	41%	0.41	C	S	.	.			trans	-94.5	111.7	164.6	168.4	0	0	0	0	108.7	G816 I817 N834 P892	G816-V890 WeakPolarHBondContact O-CG2 3.22Å; I817-V890 HydrophobicContact CG1-CG2 3.75Å; N834-V890 VanDerWaalsContact OD1-CB 3.26Å; N834-V890 WeakPolarHBondContact OD1-CB 3.37Å; N834-V890 WeakPolarHBondContact OD1-CG2 3.33Å; V890-P892 WeakPolarHBondContact O-CD 3.4Å
891	I	46.9	Very low	61.5	Low	91 Å²	91	64.3 Å²	64.3	47%	0.467	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-67.4	123.6	163.9	-57.2	172	0	0	0	107.2	Q893 I895 P897	I891-Q893 PolarHBondContact O-N 3.01Å; I891-I895 WeakPolarHBondContact CG2-O 3.35Å; I891-P897 HydrophobicContact CD1-CB 4.38Å; I891-P897 HydrophobicContact CD1-CG 4.13Å
892	P	39	Very low	61.8	Low	81 Å²	81	62.8 Å²	62.8	53%	0.526	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-58.6	129.7	178.9	-25.5	35.2	0	0	0	111.7	V890 G894 I895	V890-P892 WeakPolarHBondContact O-CD 3.4Å; P892-G894 PolarHBondContact O-N 2.93Å; P892-I895 HydrophobicContact CB-CD1 4.2Å; P892-I895 PolarHBondContact O-N 3.31Å
893	Q	32.6	Very low	62	Low	148 Å²	148	62.7 Å²	62.7	69%	0.692	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	127.1	-174.7	-64.9	-175.4	3.9	0	0	111.2	I891	I891-Q893 PolarHBondContact O-N 3.01Å
894	G	41.1	Very low	62.7	Low	88 Å²	88	60 Å²	60	91%	0.907	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.9	3.8	-178.2	0	0	0	0	0	115.6	P892	P892-G894 PolarHBondContact O-N 2.93Å
895	I	42.7	Very low	63.6	Low	88 Å²	88	55.5 Å²	55.5	45%	0.451	35%	0.347	S	S	.	.			trans	-119	125.8	175.4	-51.4	-177.5	0	0	0	109.3	I891 P892	I891-I895 WeakPolarHBondContact CG2-O 3.35Å; P892-I895 HydrophobicContact CB-CD1 4.2Å; P892-I895 PolarHBondContact O-N 3.31Å
896	A	37.8	Very low	64.6	Low	79 Å²	79	54.9 Å²	54.9	65%	0.653	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-72.6	133.1	167.1	0	0	0	0	0	109.2
897	P	48.4	Very low	65.5	Low	74 Å²	74	52.9 Å²	52.9	48%	0.481	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-61.6	150.1	173.3	29	-35	0	0	0	110.1	I891	I891-P897 HydrophobicContact CD1-CB 4.38Å; I891-P897 HydrophobicContact CD1-CG 4.13Å
898	S	55.1	Low	66.8	Low	50 Å²	50	48.6 Å²	48.6	35%	0.35	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-73.1	131.1	163.4	-174.8	0	0	0	0	107.8	C900	S898-C900 PolarHBondContact O-N 3.12Å; S898-C900 PolarHBondContact OG-N 3.47Å
899	P	64	Low	68.2	Low	41 Å²	41	47 Å²	47	27%	0.266	30%	0.295	S	S	.	.	S	Bend	trans	-70.9	-8.2	173.3	30.9	-35.4	0	0	0	112.4	E765 D766	E765-P899 WeakPolarHBondContact CA-O 3.41Å; E765-P899 HydrophobicContact CG-CB 4.48Å; E765-P899 HydrophobicContact CG-CG 4.31Å; D766-P899 PolarHBondContact N-O 2.71Å
900	C	80.9	Confident	69.8	Low	6 Å²	6	48.9 Å²	48.9	4%	0.041	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107.4	-176.1	-39.7	0	0	0	0	110.3	H763 W764 E765 S898 Y965 I1012	H763-C900 HydrophobicContact CB-CB 3.79Å; W764-C900 CarbonylContact O-C 3.51Å; W764-C900 WeakPolarHBondContact O-CA 3.45Å; E765-C900 HydrophobicContact CG-CB 4.43Å; S898-C900 PolarHBondContact O-N 3.12Å; S898-C900 PolarHBondContact OG-N 3.47Å; C900-Y965 HydrophobicContact CB-CD2 4.46Å; C900-I1012 HydrophobicContact CB-CD1 4.07Å; C900-I1012 HydrophobicContact CB-CG1 4.42Å
901	I	85.6	Confident	71.8	Confident	51 Å²	51	50 Å²	50	26%	0.262	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123	177	-58.9	177.2	0	0	0	109	H763 W764 D766 C903 L927	H763-I901 CarbonylContact C-O 3.59Å; H763-I901 WeakPolarHBondContact CA-O 3.31Å; W764-I901 PolarHBondContact N-O 2.94Å; W764-I901 PolarHBondContact O-N 3.48Å; D766-I901 HydrophobicContact CB-CD1 3.94Å; I901-C903 PolarHBondContact O-N 3.15Å; I901-L927 HydrophobicContact CG2-CD1 4.46Å
902	P	89.8	Confident	74.1	Confident	17 Å²	17	45.7 Å²	45.7	11%	0.11	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	130.2	168.7	24.8	-27.5	0	0	0	109.8	G635 L637 V762 H916	G635-P902 WeakPolarHBondContact CA-O 3.24Å; L637-P902 HydrophobicContact CB-CB 4.17Å; L637-P902 HydrophobicContact CB-CG 3.91Å; V762-P902 WeakPolarHBondContact O-CA 3.41Å; P902-H916 PolarHBondContact O-NE2 3.39Å
903	C	91.1	Very high	76.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	170.9	-176.3	61.1	0	0	0	0	112.6	V762 I901 L927	V762-C903 PolarHBondContact N-O 3.1Å; V762-C903 PolarHBondContact O-N 2.82Å; I901-C903 PolarHBondContact O-N 3.15Å; C903-L927 HydrophobicContact CB-CD1 3.65Å
904	C	94.8	Very high	79.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	140.4	171.1	-43.4	0	0	0	0	110	Y759 T914 C915	Y759-C904 HydrophobicContact CE2-CB 3.89Å; Y759-C904 PolarHBondContact OH-SG 3.27Å; Y759-C904 VanDerWaalsContact OH-SG 3.33Å; C904-T914 CarbonylContact O-C 3.53Å; C904-T914 WeakPolarHBondContact O-CA 3.29Å; C904-C915 WeakPolarHBondContact CB-O 3.2Å; C904-C915 PolarHBondContact N-O 2.89Å; C904-C915 PolarHBondContact O-N 3.38Å
905	L	96.6	Very high	82	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131	175.4	-172.2	70.7	0	0	0	110.1	F758 Y759 G760 V762 L912 F913 T914 I964 F975	F758-L905 HydrophobicContact CE1-CB 4.4Å; F758-L905 HydrophobicContact CE1-CD2 4.24Å; F758-L905 HydrophobicContact CE1-CG 4.47Å; Y759-L905 WeakPolarHBondContact CA-O 3.32Å; G760-L905 PolarHBondContact N-O 2.73Å; G760-L905 PolarHBondContact O-N 2.85Å; V762-L905 HydrophobicContact CB-CB 4.46Å; V762-L905 HydrophobicContact CG1-CB 3.83Å; V762-L905 HydrophobicContact CG1-CD2 3.83Å; V762-L905 HydrophobicContact CG1-CG 4.5Å; V762-L905 HydrophobicContact CG2-CB 3.75Å; V762-L905 HydrophobicContact CG2-CD2 4.32Å; V762-L905 HydrophobicContact CG2-CG 4.48Å; L905-L912 HydrophobicContact CD1-CD1 3.85Å; L905-L912 HydrophobicContact CD1-CD2 4.43Å; L905-L912 HydrophobicContact CD1-CG 4.11Å; L905-L912 HydrophobicContact CG-CD1 4.13Å; L905-F913 WeakPolarHBondContact CA-O 3.32Å; L905-T914 HydrophobicContact CD1-CG2 3.55Å; L905-I964 HydrophobicContact CD1-CD1 4.2Å; L905-I964 HydrophobicContact CD2-CD1 3.99Å; L905-I964 HydrophobicContact CD2-CG2 3.96Å; L905-F975 HydrophobicContact CD2-CD2 3.71Å; L905-F975 HydrophobicContact CD2-CE2 3.4Å; L905-F975 HydrophobicContact CD2-CZ 4.02Å; L905-F975 HydrophobicContact CG-CE2 4.31Å
906	V	96.9	Very high	84.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.7	-172.1	-167	0	0	0	0	110.9	L739 V743 V756 F758 Y759 L912 F913	L739-V906 HydrophobicContact CD1-CG1 4.23Å; L739-V906 HydrophobicContact CD1-CG2 4.02Å; L739-V906 HydrophobicContact CD2-CG1 4.13Å; V743-V906 HydrophobicContact CG2-CG1 4.48Å; V756-V906 HydrophobicContact CG1-CG1 3.86Å; V756-V906 HydrophobicContact CG2-CG1 4.29Å; F758-V906 WeakPolarHBondContact O-CA 3.23Å; Y759-V906 HydrophobicContact CD2-CG2 4.04Å; Y759-V906 HydrophobicContact CE2-CG2 4.47Å; V906-L912 WeakPolarHBondContact O-CA 3.49Å; V906-F913 HydrophobicContact CB-CB 4.34Å; V906-F913 PolarHBondContact N-O 3.41Å; V906-F913 PolarHBondContact O-N 2.9Å
907	I	96.4	Very high	86.5	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134.3	171.1	-59.3	170.5	0	0	0	109.7	H757 F758 L912 L932 F975 A978 L979	H757-I907 HydrophobicContact CB-CG2 4.24Å; H757-I907 PolarHBondContact N-O 2.99Å; F758-I907 HydrophobicContact CB-CB 3.99Å; F758-I907 HydrophobicContact CB-CD1 3.83Å; F758-I907 HydrophobicContact CB-CG1 4.05Å; F758-I907 HydrophobicContact CD1-CD1 4.32Å; F758-I907 HydrophobicContact CD1-CG1 4.39Å; F758-I907 HydrophobicContact CG-CD1 4.18Å; F758-I907 PolarHBondContact O-N 3.28Å; I907-L912 HydrophobicContact CD1-CD1 4.44Å; I907-L912 HydrophobicContact CG1-CD1 3.55Å; I907-L932 HydrophobicContact CG2-CD1 4.29Å; I907-L932 HydrophobicContact CG2-CD2 4.43Å; I907-F975 HydrophobicContact CD1-CD2 3.82Å; I907-F975 HydrophobicContact CD1-CE2 3.76Å; I907-F975 HydrophobicContact CG1-CE2 4.32Å; I907-A978 HydrophobicContact CD1-CB 3.92Å; I907-L979 HydrophobicContact CD1-CB 3.89Å
908	T	94.8	Very high	88.1	Confident	5 Å²	5	23.4 Å²	23.4	3%	0.031	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-174.3	173	70.7	0	0	0	0	110.5	V743 T755 H757 D910 R911 F913 L932	V743-T908 HydrophobicContact CG1-CG2 3.64Å; V743-T908 HydrophobicContact CG2-CG2 4.34Å; T755-T908 WeakPolarHBondContact O-CA 3.32Å; H757-T908 PolarHBondContact CD2-O 3.16Å; T908-D910 VanDerWaalsContact C-N 3.3Å; T908-D910 PolarHBondContact O-N 3.36Å; T908-R911 PolarHBondContact N-O 2.98Å; T908-R911 PolarHBondContact OG1-N 3.15Å; T908-R911 VanDerWaalsContact OG1-N 3.11Å; T908-R911 PolarHBondContact OG1-O 3.36Å; T908-F913 HydrophobicContact CG2-CD2 4.21Å; T908-F913 HydrophobicContact CG2-CE2 3.82Å; T908-L932 VanDerWaalsContact O-CD1 3.25Å; T908-L932 WeakPolarHBondContact O-CD1 3.47Å
909	E	90.9	Very high	88.9	Confident	110 Å²	110	22.6 Å²	22.6	51%	0.514	12%	0.117	S	C	.	.	S	Bend	trans	-61.6	-31.1	177.4	-68.8	176.1	-157.1	0	0	114.2	T755 H757	T755-E909 WeakPolarHBondContact CB-OE1 3.48Å; T755-E909 PolarHBondContact OG1-OE1 2.85Å; H757-E909 WeakPolarHBondContact NE2-CG 3.29Å
910	D	90.5	Very high	89.4	Confident	64 Å²	64	29.1 Å²	29.1	34%	0.342	14%	0.144	S	C	.	.	S	Bend	trans	-122.7	-11.4	-176.5	88.4	-44.4	0	0	0	115.2	T908 R931 L932	T908-D910 VanDerWaalsContact C-N 3.3Å; T908-D910 PolarHBondContact O-N 3.36Å; D910-R931 CarbonylContact O-C 3.58Å; D910-R931 WeakPolarHBondContact O-CA 3.33Å; D910-L932 PolarHBondContact O-N 3.47Å
911	R	92.9	Very high	89.2	Confident	58 Å²	58	33.3 Å²	33.3	22%	0.219	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	161.4	-166.4	-79.2	160.7	-150.5	-79.8	-20.8	115.3	S747 T908 F913 A930 R931	S747-R911 WeakPolarHBondContact OG-CD 3.43Å; T908-R911 PolarHBondContact N-O 2.98Å; T908-R911 PolarHBondContact OG1-N 3.15Å; T908-R911 VanDerWaalsContact OG1-N 3.11Å; T908-R911 PolarHBondContact OG1-O 3.36Å; R911-F913 HydrophobicContact CB-CD2 4.14Å; R911-F913 HydrophobicContact CB-CE2 3.44Å; R911-F913 VanDerWaalsContact CB-CE2 3.44Å; R911-F913 HydrophobicContact CB-CZ 3.75Å; R911-F913 HydrophobicContact CG-CE2 4.36Å; R911-F913 HydrophobicContact CG-CZ 4.2Å; R911-A930 WeakPolarHBondContact CA-O 3.21Å; R911-R931 HydrophobicContact CG-CG 4.38Å
912	L	94.5	Very high	88.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.5	167.2	-174.6	73.4	0	0	0	108.5	L905 V906 I907 T929 A930 L949 W962 F975	L905-L912 HydrophobicContact CD1-CD1 3.85Å; L905-L912 HydrophobicContact CD1-CD2 4.43Å; L905-L912 HydrophobicContact CD1-CG 4.11Å; L905-L912 HydrophobicContact CG-CD1 4.13Å; V906-L912 WeakPolarHBondContact O-CA 3.49Å; I907-L912 HydrophobicContact CD1-CD1 4.44Å; I907-L912 HydrophobicContact CG1-CD1 3.55Å; L912-T929 WeakPolarHBondContact O-CA 3.14Å; L912-A930 PolarHBondContact N-O 3.46Å; L912-A930 PolarHBondContact O-N 3.37Å; L912-L949 HydrophobicContact CD2-CD1 3.35Å; L912-W962 HydrophobicContact CB-CZ3 4.5Å; L912-W962 HydrophobicContact CD2-CE3 3.7Å; L912-W962 HydrophobicContact CD2-CZ3 3.53Å; L912-W962 HydrophobicContact CG-CE3 4.49Å; L912-W962 HydrophobicContact CG-CZ3 3.85Å; L912-F975 HydrophobicContact CD1-CE2 4.13Å
913	F	93.9	Very high	88.6	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.8	177.8	-58	-93.8	0	0	0	110.8	V743 E746 L905 V906 T908 R911 G928 T929	V743-F913 HydrophobicContact CG1-CE2 4.2Å; V743-F913 HydrophobicContact CG2-CE2 4.44Å; E746-F913 HydrophobicContact CB-CE1 3.67Å; E746-F913 HydrophobicContact CB-CZ 4.3Å; E746-F913 HydrophobicContact CG-CE1 4.38Å; L905-F913 WeakPolarHBondContact CA-O 3.32Å; V906-F913 HydrophobicContact CB-CB 4.34Å; V906-F913 PolarHBondContact N-O 3.41Å; V906-F913 PolarHBondContact O-N 2.9Å; T908-F913 HydrophobicContact CG2-CD2 4.21Å; T908-F913 HydrophobicContact CG2-CE2 3.82Å; R911-F913 HydrophobicContact CB-CD2 4.14Å; R911-F913 HydrophobicContact CB-CE2 3.44Å; R911-F913 VanDerWaalsContact CB-CE2 3.44Å; R911-F913 HydrophobicContact CB-CZ 3.75Å; R911-F913 HydrophobicContact CG-CE2 4.36Å; R911-F913 HydrophobicContact CG-CZ 4.2Å; F913-G928 WeakPolarHBondContact CA-O 3.45Å; F913-T929 HydrophobicContact CD1-CG2 3.64Å; F913-T929 WeakPolarHBondContact CD1-OG1 3.37Å; F913-T929 HydrophobicContact CE1-CG2 3.47Å; F913-T929 VanDerWaalsContact CE1-CG2 3.47Å; F913-T929 HydrophobicContact CZ-CG2 4.26Å
914	T	93.8	Very high	88.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.9	157.9	49.2	0	0	0	0	109.1	W764 C904 L905 L927 G928 W962	W764-T914 HydrophobicContact CB-CG2 4.33Å; W764-T914 HydrophobicContact CD2-CG2 4.22Å; W764-T914 HydrophobicContact CG-CG2 3.99Å; C904-T914 CarbonylContact O-C 3.53Å; C904-T914 WeakPolarHBondContact O-CA 3.29Å; L905-T914 HydrophobicContact CD1-CG2 3.55Å; T914-L927 WeakPolarHBondContact O-CB 3.48Å; T914-L927 PolarHBondContact O-N 2.84Å; T914-G928 PolarHBondContact N-O 2.94Å; T914-G928 PolarHBondContact O-N 2.78Å; T914-G928 VanDerWaalsContact OG1-CA 3.31Å; T914-G928 WeakPolarHBondContact OG1-CA 3.42Å; T914-G928 PolarHBondContact OG1-N 3.3Å; T914-G928 PolarHBondContact OG1-O 3.42Å; T914-W962 HydrophobicContact CG2-CE3 4.45Å; T914-W962 HydrophobicContact CG2-CZ3 4.07Å
915	C	91.1	Very high	88	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161	-177.1	56.7	0	0	0	0	113.7	F742 C904 R925	F742-C915 HydrophobicContact CE1-CB 3.89Å; F742-C915 HydrophobicContact CZ-CB 3.91Å; C904-C915 WeakPolarHBondContact CB-O 3.2Å; C904-C915 PolarHBondContact N-O 2.89Å; C904-C915 PolarHBondContact O-N 3.38Å; C915-R925 CarbonylContact C-O 3.58Å; C915-R925 WeakPolarHBondContact CA-O 3.41Å; C915-R925 WeakPolarHBondContact CB-O 3.36Å
916	H	89.6	Confident	87.6	Confident	27 Å²	27	48.3 Å²	48.3	13%	0.125	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	147.5	163.2	-69.4	143.3	0	0	0	110.2	M633 G635 P902 F924 R925	M633-H916 CarbonylContact O-C 3.39Å; M633-H916 WeakPolarHBondContact O-CA 3.25Å; M633-H916 WeakPolarHBondContact O-CB 3.46Å; M633-H916 PolarHBondContact O-CD2 3.03Å; G635-H916 VanDerWaalsContact CA-NE2 3.29Å; G635-H916 WeakPolarHBondContact CA-NE2 3.24Å; G635-H916 PolarHBondContact N-NE2 3.4Å; P902-H916 PolarHBondContact O-NE2 3.39Å; H916-F924 CarbonylContact O-C 3.56Å; H916-F924 VanDerWaalsContact O-CA 3.31Å; H916-F924 WeakPolarHBondContact O-CA 3.36Å; H916-R925 PolarHBondContact N-O 2.9Å; H916-R925 PolarHBondContact O-N 2.7Å
917	E	85.3	Confident	87.1	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.023	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.8	170.3	-176.2	175.7	178.5	0	0	109.9	M633 E634 C919 S922 F923 F924	M633-E917 HydrophobicContact CE-CB 3.82Å; M633-E917 HydrophobicContact CE-CG 4.14Å; M633-E917 WeakPolarHBondContact CE-OE2 3.31Å; M633-E917 PolarHBondContact O-N 2.92Å; E634-E917 VanDerWaalsContact CG-O 3.23Å; E634-E917 WeakPolarHBondContact CG-O 3.49Å; E917-C919 PolarHBondContact O-N 3.47Å; E917-S922 WeakPolarHBondContact OE1-CA 3.47Å; E917-S922 WeakPolarHBondContact OE1-CB 3.24Å; E917-S922 PolarHBondContact OE1-OG 3.36Å; E917-S922 VanDerWaalsContact OE1-OG 3.13Å; E917-F923 WeakPolarHBondContact CA-O 3.43Å; E917-F924 HydrophobicContact CB-CD1 3.92Å; E917-F924 HydrophobicContact CB-CE1 3.74Å; E917-F924 HydrophobicContact CB-CZ 4.18Å; E917-F924 HydrophobicContact CG-CD1 4.28Å; E917-F924 HydrophobicContact CG-CD2 4.42Å; E917-F924 HydrophobicContact CG-CE1 3.97Å; E917-F924 HydrophobicContact CG-CE2 4.09Å; E917-F924 HydrophobicContact CG-CZ 3.87Å; E917-F924 WeakPolarHBondContact OE2-CE1 3.33Å; E917-F924 WeakPolarHBondContact OE2-CZ 3.48Å
918	D	81.9	Confident	86.6	Confident	58 Å²	58	51 Å²	51	31%	0.31	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	107.8	162.5	165.5	0.4	0	0	0	108.7	Q920 T921 S922 F923	D918-Q920 PolarHBondContact O-N 3.02Å; D918-Q920 VanDerWaalsContact O-N 3.11Å; D918-Q920 WeakPolarHBondContact OD1-CA 3.19Å; D918-Q920 VanDerWaalsContact OD1-CB 3.32Å; D918-Q920 WeakPolarHBondContact OD1-CB 3.38Å; D918-Q920 PolarHBondContact OD1-N 2.87Å; D918-T921 PolarHBondContact O-N 3.13Å; D918-T921 PolarHBondContact OD1-N 2.93Å; D918-T921 WeakPolarHBondContact OD2-CB 3.35Å; D918-T921 VanDerWaalsContact OD2-CG2 3.25Å; D918-T921 WeakPolarHBondContact OD2-CG2 3.49Å; D918-T921 PolarHBondContact OD2-OG1 3.26Å; D918-S922 VanDerWaalsContact O-CA 3.28Å; D918-S922 WeakPolarHBondContact O-CA 3.39Å; D918-S922 PolarHBondContact O-N 2.99Å; D918-F923 HydrophobicContact CB-CB 4.39Å; D918-F923 PolarHBondContact N-O 3.32Å
919	C	71.4	Confident	86.4	Confident	32 Å²	32	52.7 Å²	52.7	22%	0.216	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-7.8	-174.5	-53.2	0	0	0	0	114.1	E634 L696 E917	E634-C919 PolarHBondContact OE1-SG 3.32Å; L696-C919 HydrophobicContact CD2-CB 4.01Å; L696-C919 VanDerWaalsContact CD2-SG 3.56Å; E917-C919 PolarHBondContact O-N 3.47Å
920	Q	74	Confident	86.5	Confident	179 Å²	179	47.6 Å²	47.6	84%	0.836	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-34.3	177.4	-51.2	-171.7	24.2	0	0	112.2	D918	D918-Q920 PolarHBondContact O-N 3.02Å; D918-Q920 VanDerWaalsContact O-N 3.11Å; D918-Q920 WeakPolarHBondContact OD1-CA 3.19Å; D918-Q920 VanDerWaalsContact OD1-CB 3.32Å; D918-Q920 WeakPolarHBondContact OD1-CB 3.38Å; D918-Q920 PolarHBondContact OD1-N 2.87Å
921	T	77.9	Confident	86.5	Confident	94 Å²	94	48.9 Å²	48.9	58%	0.577	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-10.1	-179.5	68.5	0	0	0	0	114.2	D918 F923	D918-T921 PolarHBondContact O-N 3.13Å; D918-T921 PolarHBondContact OD1-N 2.93Å; D918-T921 WeakPolarHBondContact OD2-CB 3.35Å; D918-T921 VanDerWaalsContact OD2-CG2 3.25Å; D918-T921 WeakPolarHBondContact OD2-CG2 3.49Å; D918-T921 PolarHBondContact OD2-OG1 3.26Å; T921-F923 PolarHBondContact O-N 3.5Å; T921-F923 WeakPolarHBondContact OG1-CB 3.45Å; T921-F923 PolarHBondContact OG1-N 3.17Å
922	S	79.6	Confident	86.5	Confident	51 Å²	51	46.1 Å²	46.1	36%	0.357	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	38.4	-166.2	-70.1	0	0	0	0	112.6	E917 D918	E917-S922 WeakPolarHBondContact OE1-CA 3.47Å; E917-S922 WeakPolarHBondContact OE1-CB 3.24Å; E917-S922 PolarHBondContact OE1-OG 3.36Å; E917-S922 VanDerWaalsContact OE1-OG 3.13Å; D918-S922 VanDerWaalsContact O-CA 3.28Å; D918-S922 WeakPolarHBondContact O-CA 3.39Å; D918-S922 PolarHBondContact O-N 2.99Å
923	F	83.6	Confident	86.3	Confident	131 Å²	131	47.7 Å²	47.7	58%	0.575	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.9	173	174.5	-97	0	0	0	110.1	E917 D918 T921 R925	E917-F923 WeakPolarHBondContact CA-O 3.43Å; D918-F923 HydrophobicContact CB-CB 4.39Å; D918-F923 PolarHBondContact N-O 3.32Å; T921-F923 PolarHBondContact O-N 3.5Å; T921-F923 WeakPolarHBondContact OG1-CB 3.45Å; T921-F923 PolarHBondContact OG1-N 3.17Å; F923-R925 HydrophobicContact CE1-CB 4.25Å
924	F	87.6	Confident	86.1	Confident	13 Å²	13	48.3 Å²	48.3	6%	0.057	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.1	177.4	-71.2	-94.8	0	0	0	111.7	A738 L739 F742 H916 E917	A738-F924 HydrophobicContact CB-CE2 3.85Å; L739-F924 HydrophobicContact CB-CE2 4.3Å; L739-F924 HydrophobicContact CB-CZ 3.92Å; L739-F924 HydrophobicContact CD1-CD1 4.44Å; L739-F924 HydrophobicContact CD1-CE1 3.97Å; L739-F924 HydrophobicContact CD1-CZ 4.15Å; F742-F924 HydrophobicContact CB-CB 3.7Å; F742-F924 HydrophobicContact CB-CD2 3.82Å; F742-F924 HydrophobicContact CB-CG 3.85Å; F742-F924 HydrophobicContact CD1-CB 3.72Å; F742-F924 HydrophobicContact CD1-CD1 4.12Å; F742-F924 AromaticContact CD1-CG 3.93Å; F742-F924 HydrophobicContact CD1-CG 3.93Å; F742-F924 HydrophobicContact CD2-CB 3.38Å; F742-F924 HydrophobicContact CD2-CG 4.36Å; F742-F924 HydrophobicContact CE1-CB 4.18Å; F742-F924 HydrophobicContact CE2-CB 3.87Å; F742-F924 HydrophobicContact CG-CB 3.29Å; F742-F924 HydrophobicContact CG-CD1 4.43Å; F742-F924 HydrophobicContact CG-CD2 4.28Å; F742-F924 AromaticContact CG-CG 3.78Å; F742-F924 HydrophobicContact CG-CG 3.78Å; F742-F924 HydrophobicContact CZ-CB 4.25Å; H916-F924 CarbonylContact O-C 3.56Å; H916-F924 VanDerWaalsContact O-CA 3.31Å; H916-F924 WeakPolarHBondContact O-CA 3.36Å; E917-F924 HydrophobicContact CB-CD1 3.92Å; E917-F924 HydrophobicContact CB-CE1 3.74Å; E917-F924 HydrophobicContact CB-CZ 4.18Å; E917-F924 HydrophobicContact CG-CD1 4.28Å; E917-F924 HydrophobicContact CG-CD2 4.42Å; E917-F924 HydrophobicContact CG-CE1 3.97Å; E917-F924 HydrophobicContact CG-CE2 4.09Å; E917-F924 HydrophobicContact CG-CZ 3.87Å; E917-F924 WeakPolarHBondContact OE2-CE1 3.33Å; E917-F924 WeakPolarHBondContact OE2-CZ 3.48Å
925	R	85.8	Confident	86.1	Confident	152 Å²	152	48.4 Å²	48.4	57%	0.574	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.1	172.3	177.7	-176	171.9	-142.9	-5.2	109.4	C915 H916 F923	C915-R925 CarbonylContact C-O 3.58Å; C915-R925 WeakPolarHBondContact CA-O 3.41Å; C915-R925 WeakPolarHBondContact CB-O 3.36Å; H916-R925 PolarHBondContact N-O 2.9Å; H916-R925 PolarHBondContact O-N 2.7Å; F923-R925 HydrophobicContact CE1-CB 4.25Å
926	S	87.4	Confident	86.1	Confident	36 Å²	36	51 Å²	51	25%	0.252	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	136	171.3	-162.4	0	0	0	0	111.1	T929	S926-T929 PolarHBondContact OG-OG1 3.46Å
927	L	86.4	Confident	86.2	Confident	46 Å²	46	49.7 Å²	49.7	24%	0.241	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-51.9	173.9	-59.5	173.8	0	0	0	109.8	W764 I901 C903 T914	W764-L927 HydrophobicContact CZ3-CB 4.18Å; I901-L927 HydrophobicContact CG2-CD1 4.46Å; C903-L927 HydrophobicContact CB-CD1 3.65Å; T914-L927 WeakPolarHBondContact O-CB 3.48Å; T914-L927 PolarHBondContact O-N 2.84Å
928	G	86	Confident	86.7	Confident	11 Å²	11	49.4 Å²	49.4	11%	0.113	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.5	177.9	0	0	0	0	0	111	F913 T914	F913-G928 WeakPolarHBondContact CA-O 3.45Å; T914-G928 PolarHBondContact N-O 2.94Å; T914-G928 PolarHBondContact O-N 2.78Å; T914-G928 VanDerWaalsContact OG1-CA 3.31Å; T914-G928 WeakPolarHBondContact OG1-CA 3.42Å; T914-G928 PolarHBondContact OG1-N 3.3Å; T914-G928 PolarHBondContact OG1-O 3.42Å
929	T	91.3	Very high	87.2	Confident	39 Å²	39	47.1 Å²	47.1	24%	0.239	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	131	176.3	-57.6	0	0	0	0	109.5	L912 F913 S926	L912-T929 WeakPolarHBondContact O-CA 3.14Å; F913-T929 HydrophobicContact CD1-CG2 3.64Å; F913-T929 WeakPolarHBondContact CD1-OG1 3.37Å; F913-T929 HydrophobicContact CE1-CG2 3.47Å; F913-T929 VanDerWaalsContact CE1-CG2 3.47Å; F913-T929 HydrophobicContact CZ-CG2 4.26Å; S926-T929 PolarHBondContact OG-OG1 3.46Å
930	A	91.4	Very high	88.2	Confident	3 Å²	3	47.3 Å²	47.3	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.9	174	0	0	0	0	0	109.8	R911 L912 F951 L959 W962	R911-A930 WeakPolarHBondContact CA-O 3.21Å; L912-A930 PolarHBondContact N-O 3.46Å; L912-A930 PolarHBondContact O-N 3.37Å; A930-F951 HydrophobicContact CB-CD1 4.3Å; A930-F951 HydrophobicContact CB-CE1 3.47Å; A930-F951 VanDerWaalsContact CB-CE1 3.47Å; A930-F951 HydrophobicContact CB-CZ 3.87Å; A930-L959 HydrophobicContact CB-CD1 3.71Å; A930-W962 HydrophobicContact CB-CH2 3.98Å; A930-W962 HydrophobicContact CB-CZ2 3.93Å
931	R	91.4	Very high	88.9	Confident	92 Å²	92	40.9 Å²	40.9	35%	0.347	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	141.8	166	-59.4	177.1	-67.2	-177.3	4.2	108.3	D910 R911 A933 D934	D910-R931 CarbonylContact O-C 3.58Å; D910-R931 WeakPolarHBondContact O-CA 3.33Å; R911-R931 HydrophobicContact CG-CG 4.38Å; R931-A933 HydrophobicContact CB-CB 4.49Å; R931-A933 PolarHBondContact O-N 2.92Å; R931-D934 WeakPolarHBondContact CB-OD2 3.21Å; R931-D934 IonicContact CZ-OD1 3.48Å; R931-D934 IonicContact CZ-OD2 3.96Å; R931-D934 IonicContact NE-OD1 2.72Å; R931-D934 IonicContact NE-OD2 2.67Å; R931-D934 PolarHBondContact NE-OD2 2.99Å; R931-D934 VanDerWaalsContact NH2-CG 3.3Å; R931-D934 IonicContact NH2-OD1 2.67Å; R931-D934 PolarHBondContact NH2-OD1 2.93Å; R931-D934 IonicContact NH2-OD2 3.45Å; R931-D934 PolarHBondContact NH2-OD2 3.14Å; R931-D934 VanDerWaalsContact NH2-OD2 3.11Å; R931-D934 PolarHBondContact O-N 2.57Å
932	L	91.8	Very high	89.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-53.6	-38.2	169	-73.7	177.1	0	0	0	110.7	I907 T908 D910 D934 I935 L979 W983 I986	I907-L932 HydrophobicContact CG2-CD1 4.29Å; I907-L932 HydrophobicContact CG2-CD2 4.43Å; T908-L932 VanDerWaalsContact O-CD1 3.25Å; T908-L932 WeakPolarHBondContact O-CD1 3.47Å; D910-L932 PolarHBondContact O-N 3.47Å; L932-D934 PolarHBondContact O-N 2.86Å; L932-I935 HydrophobicContact CD2-CD1 4.18Å; L932-I935 PolarHBondContact O-N 3.47Å; L932-L979 HydrophobicContact CD2-CD1 3.34Å; L932-W983 VanDerWaalsContact O-CE3 3.22Å; L932-W983 WeakPolarHBondContact O-CZ3 3.5Å; L932-I986 HydrophobicContact CB-CD1 3.58Å; L932-I986 HydrophobicContact CD1-CD1 4.3Å
933	A	90.6	Very high	89.4	Confident	33 Å²	33	45.6 Å²	45.6	27%	0.273	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-65.1	-14	177.4	0	0	0	0	0	115.7	R931 I986 Y987	R931-A933 HydrophobicContact CB-CB 4.49Å; R931-A933 PolarHBondContact O-N 2.92Å; A933-I986 HydrophobicContact CB-CG2 4.44Å; A933-Y987 HydrophobicContact CB-CE2 4.4Å; A933-Y987 PolarHBondContact O-OH 3.36Å
934	D	91.3	Very high	89.7	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.064	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-92.4	-8	178.1	-66.4	-41.6	0	0	0	113.1	R931 L932 F951 S952	R931-D934 WeakPolarHBondContact CB-OD2 3.21Å; R931-D934 IonicContact CZ-OD1 3.48Å; R931-D934 IonicContact CZ-OD2 3.96Å; R931-D934 IonicContact NE-OD1 2.72Å; R931-D934 IonicContact NE-OD2 2.67Å; R931-D934 PolarHBondContact NE-OD2 2.99Å; R931-D934 VanDerWaalsContact NH2-CG 3.3Å; R931-D934 IonicContact NH2-OD1 2.67Å; R931-D934 PolarHBondContact NH2-OD1 2.93Å; R931-D934 IonicContact NH2-OD2 3.45Å; R931-D934 PolarHBondContact NH2-OD2 3.14Å; R931-D934 VanDerWaalsContact NH2-OD2 3.11Å; R931-D934 PolarHBondContact O-N 2.57Å; L932-D934 PolarHBondContact O-N 2.86Å; D934-F951 HydrophobicContact CB-CD1 4.32Å; D934-F951 CarbonylContact O-C 3.55Å; D934-F951 VanDerWaalsContact O-CA 3.29Å; D934-F951 WeakPolarHBondContact O-CA 3.38Å; D934-S952 PolarHBondContact O-N 2.7Å
935	I	92.4	Very high	89.9	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.015	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	156.1	173.8	-58.2	171.4	0	0	0	109	L932 E950 F951 L979 W983 L991	L932-I935 HydrophobicContact CD2-CD1 4.18Å; L932-I935 PolarHBondContact O-N 3.47Å; I935-E950 CarbonylContact C-O 3.45Å; I935-F951 HydrophobicContact CD1-CE1 4.44Å; I935-F951 HydrophobicContact CG1-CD1 3.93Å; I935-F951 HydrophobicContact CG1-CE1 3.57Å; I935-F951 HydrophobicContact CG1-CZ 4.47Å; I935-L979 HydrophobicContact CD1-CD1 3.8Å; I935-W983 HydrophobicContact CB-CE3 4.14Å; I935-W983 HydrophobicContact CB-CZ3 3.9Å; I935-W983 WeakPolarHBondContact O-CH2 3.46Å; I935-W983 WeakPolarHBondContact O-CZ3 3.3Å; I935-L991 HydrophobicContact CG2-CD1 4.13Å
936	T	91.4	Very high	90.2	Very high	53 Å²	53	35.9 Å²	35.9	33%	0.325	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	-30.2	178.2	62.8	0	0	0	0	113.2	E950	T936-E950 PolarHBondContact N-O 3.13Å; T936-E950 PolarHBondContact OG1-O 2.82Å
937	A	92.5	Very high	90.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	162.8	173.3	0	0	0	0	0	110.8	E950 P992 K994	A937-E950 HydrophobicContact CB-CB 4.48Å; A937-E950 PolarHBondContact O-N 2.91Å; A937-P992 CarbonylContact C-O 3.5Å; A937-P992 WeakPolarHBondContact CA-O 3.44Å; A937-P992 HydrophobicContact CB-CB 4.34Å; A937-P992 VanDerWaalsContact CB-O 3.3Å; A937-P992 WeakPolarHBondContact CB-O 3.49Å; A937-K994 HydrophobicContact CB-CD 3.5Å; A937-K994 VanDerWaalsContact CB-CD 3.5Å; A937-K994 VanDerWaalsContact CB-CE 3.45Å; A937-K994 HydrophobicContact CB-CG 3.96Å
938	I	94.3	Very high	90.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.4	163.6	-52.3	176.7	0	0	0	108.5	T940 C947 V948 L949 L976 L979 L991 P992 H993 K994	I938-T940 HydrophobicContact CG2-CG2 3.92Å; I938-C947 HydrophobicContact CG2-CB 4.17Å; I938-V948 WeakPolarHBondContact CA-O 3.44Å; I938-L949 HydrophobicContact CD1-CD2 4.36Å; I938-L949 HydrophobicContact CG1-CD2 3.95Å; I938-L949 HydrophobicContact CG2-CD2 4.23Å; I938-L976 HydrophobicContact CD1-CD2 3.72Å; I938-L976 HydrophobicContact CG2-CD2 3.86Å; I938-L979 HydrophobicContact CD1-CD2 3.53Å; I938-L979 HydrophobicContact CD1-CG 4.1Å; I938-L979 HydrophobicContact CG1-CD2 4.3Å; I938-L991 HydrophobicContact CD1-CD2 3.5Å; I938-L991 VanDerWaalsContact CD1-CD2 3.5Å; I938-L991 HydrophobicContact CD1-CG 3.94Å; I938-L991 HydrophobicContact CG1-CD1 4.42Å; I938-L991 HydrophobicContact CG1-CD2 3.82Å; I938-L991 HydrophobicContact CG1-CG 3.94Å; I938-P992 PolarHBondContact N-O 3.38Å; I938-H993 CarbonylContact O-C 3.56Å; I938-H993 WeakPolarHBondContact O-CA 3.41Å; I938-K994 PolarHBondContact O-N 3.36Å
939	S	93.1	Very high	91.2	Very high	9 Å²	9	32.1 Å²	32.1	6%	0.063	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.5	170.3	-82.7	0	0	0	0	110.4	C947 V948 E950 K994	S939-C947 WeakPolarHBondContact O-CA 3.48Å; S939-V948 PolarHBondContact N-O 3.13Å; S939-V948 PolarHBondContact O-N 3.43Å; S939-E950 PolarHBondContact OG-OE1 3.09Å; S939-K994 WeakPolarHBondContact CA-O 3.34Å; S939-K994 VanDerWaalsContact OG-CB 3.3Å; S939-K994 WeakPolarHBondContact OG-CB 3.25Å
940	T	91.6	Very high	91.2	Very high	37 Å²	37	32.5 Å²	32.5	23%	0.227	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164.5	-176.2	47	0	0	0	0	112.2	I938 C947 L976	I938-T940 HydrophobicContact CG2-CG2 3.92Å; T940-C947 HydrophobicContact CG2-CB 3.76Å; T940-L976 HydrophobicContact CG2-CD1 3.97Å; T940-L976 HydrophobicContact CG2-CD2 4.27Å
941	E	88.4	Confident	91.2	Very high	44 Å²	44	33.2 Å²	33.2	21%	0.206	19%	0.188	C	C	.	.			trans	-129.5	142.5	172.2	-178.2	160.8	-127.6	0	0	112	G943 K944 Y946 K1002	E941-G943 PolarHBondContact O-N 2.83Å; E941-K944 HydrophobicContact CB-CB 4.14Å; E941-K944 HydrophobicContact CB-CG 3.8Å; E941-K944 HydrophobicContact CG-CB 4.49Å; E941-K944 HydrophobicContact CG-CG 3.66Å; E941-K944 PolarHBondContact O-N 3.13Å; E941-Y946 PolarHBondContact OE2-OH 2.93Å; E941-K1002 WeakPolarHBondContact OE1-CD 3.24Å; E941-K1002 VanDerWaalsContact OE1-CE 3.29Å; E941-K1002 WeakPolarHBondContact OE1-CE 3.48Å; E941-K1002 IonicContact OE1-NZ 2.71Å; E941-K1002 PolarHBondContact OE1-NZ 2.85Å
942	L	84.6	Confident	90.9	Very high	173 Å²	173	30.3 Å²	30.3	91%	0.906	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	126.2	-176.5	-70.8	169.4	0	0	0	111.4	K944	L942-K944 VanDerWaalsContact C-N 3.34Å
943	G	83.6	Confident	90	Very high	70 Å²	70	38.3 Å²	38.3	72%	0.722	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.9	27.6	-179.6	0	0	0	0	0	113.7	E941	E941-G943 PolarHBondContact O-N 2.83Å
944	K	89.9	Confident	88.8	Confident	51 Å²	51	44.3 Å²	44.3	22%	0.222	25%	0.247	C	C	.	.			trans	-121.7	155.4	174.5	-63.4	-62.3	-169.4	176.1	0	110.7	E941 L942 Y946 L972 E1006	E941-K944 HydrophobicContact CB-CB 4.14Å; E941-K944 HydrophobicContact CB-CG 3.8Å; E941-K944 HydrophobicContact CG-CB 4.49Å; E941-K944 HydrophobicContact CG-CG 3.66Å; E941-K944 PolarHBondContact O-N 3.13Å; L942-K944 VanDerWaalsContact C-N 3.34Å; K944-Y946 HydrophobicContact CB-CD1 3.71Å; K944-Y946 HydrophobicContact CB-CE1 3.56Å; K944-Y946 HydrophobicContact CD-CE1 4.12Å; K944-Y946 HydrophobicContact CG-CD1 4.34Å; K944-Y946 HydrophobicContact CG-CE1 3.72Å; K944-L972 WeakPolarHBondContact O-CD2 3.49Å; K944-E1006 VanDerWaalsContact CE-OE1 3.25Å; K944-E1006 WeakPolarHBondContact CE-OE1 3.23Å; K944-E1006 IonicContact NZ-OE1 3.51Å; K944-E1006 PolarHBondContact NZ-OE1 3.19Å
945	E	91.9	Very high	87.5	Confident	42 Å²	42	44.4 Å²	44.4	20%	0.196	25%	0.248	C	C	.	.	S	Bend	trans	-103.2	23.1	-170.6	-64.6	149	149	0	0	111.8	L966 T969 L1009 H1013	E945-L966 PolarHBondContact O-N 3.28Å; E945-T969 HydrophobicContact CG-CG2 3.81Å; E945-L1009 HydrophobicContact CB-CD1 4.35Å; E945-H1013 VanDerWaalsContact CD-NE2 3.31Å; E945-H1013 IonicContact OE1-NE2 3.03Å; E945-H1013 IonicContact OE2-NE2 2.85Å; E945-H1013 PolarHBondContact OE2-NE2 3.14Å
946	Y	93.1	Very high	85.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	155.9	-175	76.3	-96.4	0	0	0	112.5	E941 K944 I964 Y965 I996 F1005 L1009	E941-Y946 PolarHBondContact OE2-OH 2.93Å; K944-Y946 HydrophobicContact CB-CD1 3.71Å; K944-Y946 HydrophobicContact CB-CE1 3.56Å; K944-Y946 HydrophobicContact CD-CE1 4.12Å; K944-Y946 HydrophobicContact CG-CD1 4.34Å; K944-Y946 HydrophobicContact CG-CE1 3.72Å; Y946-I964 CarbonylContact C-O 3.55Å; Y946-I964 VanDerWaalsContact CA-O 3.26Å; Y946-I964 WeakPolarHBondContact CA-O 3.49Å; Y946-Y965 VanDerWaalsContact CB-CD1 3.42Å; Y946-Y965 HydrophobicContact CG-CD1 4.3Å; Y946-Y965 HydrophobicContact CG-CE1 4.12Å; Y946-I996 HydrophobicContact CE2-CD1 3.58Å; Y946-F1005 HydrophobicContact CD1-CB 4.42Å; Y946-F1005 HydrophobicContact CD2-CB 4.05Å; Y946-F1005 HydrophobicContact CD2-CD2 4.07Å; Y946-F1005 HydrophobicContact CD2-CG 4.25Å; Y946-F1005 HydrophobicContact CE1-CB 4.13Å; Y946-F1005 HydrophobicContact CE2-CB 3.73Å; Y946-F1005 AromaticContact CE2-CD2 3.45Å; Y946-F1005 HydrophobicContact CE2-CD2 3.45Å; Y946-F1005 VanDerWaalsContact CE2-CD2 3.45Å; Y946-F1005 HydrophobicContact CE2-CE2 4.34Å; Y946-F1005 AromaticContact CE2-CG 3.93Å; Y946-F1005 HydrophobicContact CE2-CG 3.93Å; Y946-F1005 HydrophobicContact CG-CB 4.42Å; Y946-L1009 HydrophobicContact CD1-CD2 4.47Å
947	C	94.1	Very high	84.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.7	172.2	66.3	0	0	0	0	112	I938 S939 T940 I964 L972	I938-C947 HydrophobicContact CG2-CB 4.17Å; S939-C947 WeakPolarHBondContact O-CA 3.48Å; T940-C947 HydrophobicContact CG2-CB 3.76Å; C947-I964 PolarHBondContact N-O 3.03Å; C947-I964 PolarHBondContact O-N 3Å; C947-L972 HydrophobicContact CB-CD1 3.88Å
948	V	93.6	Very high	82.9	Confident	13 Å²	13	60 Å²	60	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.7	173.8	-172.4	0	0	0	0	109.6	I938 S939 P961 W962 V963 I996 F1005	I938-V948 WeakPolarHBondContact CA-O 3.44Å; S939-V948 PolarHBondContact N-O 3.13Å; S939-V948 PolarHBondContact O-N 3.43Å; V948-P961 HydrophobicContact CG1-CB 3.74Å; V948-W962 CarbonylContact C-O 3.56Å; V948-W962 WeakPolarHBondContact CA-O 3.33Å; V948-V963 HydrophobicContact CG2-CG1 4.33Å; V948-V963 HydrophobicContact CG2-CG2 4.33Å; V948-I996 HydrophobicContact CG2-CD1 4.48Å; V948-F1005 HydrophobicContact CG2-CD2 4.38Å; V948-F1005 HydrophobicContact CG2-CE2 3.49Å; V948-F1005 VanDerWaalsContact CG2-CE2 3.49Å; V948-F1005 HydrophobicContact CG2-CZ 3.64Å
949	L	93.1	Very high	81.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121	173	-53.2	-176.4	0	0	0	109.6	L912 I938 F951 P961 W962 I964 F975 L979	L912-L949 HydrophobicContact CD2-CD1 3.35Å; I938-L949 HydrophobicContact CD1-CD2 4.36Å; I938-L949 HydrophobicContact CG1-CD2 3.95Å; I938-L949 HydrophobicContact CG2-CD2 4.23Å; L949-F951 HydrophobicContact CB-CE2 4.08Å; L949-F951 HydrophobicContact CB-CZ 4Å; L949-F951 HydrophobicContact CD1-CZ 4.35Å; L949-P961 CarbonylContact O-C 3.49Å; L949-P961 WeakPolarHBondContact O-CA 3.32Å; L949-P961 WeakPolarHBondContact O-CB 3.41Å; L949-W962 HydrophobicContact CB-CB 4.36Å; L949-W962 PolarHBondContact N-O 2.96Å; L949-W962 PolarHBondContact O-N 3.04Å; L949-W962 VanDerWaalsContact O-N 3.08Å; L949-I964 HydrophobicContact CD1-CD1 3.74Å; L949-I964 HydrophobicContact CG-CD1 4.19Å; L949-F975 HydrophobicContact CD1-CZ 4.37Å; L949-F975 HydrophobicContact CD2-CE1 4.44Å; L949-F975 HydrophobicContact CD2-CZ 4.45Å; L949-L979 HydrophobicContact CD2-CD2 3.61Å
950	E	91.8	Very high	81.3	Confident	47 Å²	47	67.2 Å²	67.2	22%	0.22	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.5	179.8	-66.6	173.4	-137.6	0	0	110.6	I935 T936 A937 S939 K994	I935-E950 CarbonylContact C-O 3.45Å; T936-E950 PolarHBondContact N-O 3.13Å; T936-E950 PolarHBondContact OG1-O 2.82Å; A937-E950 HydrophobicContact CB-CB 4.48Å; A937-E950 PolarHBondContact O-N 2.91Å; S939-E950 PolarHBondContact OG-OE1 3.09Å; E950-K994 WeakPolarHBondContact OE1-CD 3.38Å; E950-K994 WeakPolarHBondContact OE2-CD 3.46Å; E950-K994 IonicContact OE2-NZ 3.22Å; E950-K994 PolarHBondContact OE2-NZ 2.76Å
951	F	90.6	Very high	81.1	Confident	18 Å²	18	68.2 Å²	68.2	8%	0.079	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	158.4	-177.3	-60.5	-81	0	0	0	113.9	A930 D934 I935 L949 L959 Q960 W962	A930-F951 HydrophobicContact CB-CD1 4.3Å; A930-F951 HydrophobicContact CB-CE1 3.47Å; A930-F951 VanDerWaalsContact CB-CE1 3.47Å; A930-F951 HydrophobicContact CB-CZ 3.87Å; D934-F951 HydrophobicContact CB-CD1 4.32Å; D934-F951 CarbonylContact O-C 3.55Å; D934-F951 VanDerWaalsContact O-CA 3.29Å; D934-F951 WeakPolarHBondContact O-CA 3.38Å; I935-F951 HydrophobicContact CD1-CE1 4.44Å; I935-F951 HydrophobicContact CG1-CD1 3.93Å; I935-F951 HydrophobicContact CG1-CE1 3.57Å; I935-F951 HydrophobicContact CG1-CZ 4.47Å; L949-F951 HydrophobicContact CB-CE2 4.08Å; L949-F951 HydrophobicContact CB-CZ 4Å; L949-F951 HydrophobicContact CD1-CZ 4.35Å; F951-L959 HydrophobicContact CB-CB 3.98Å; F951-L959 HydrophobicContact CD1-CD1 4.03Å; F951-L959 HydrophobicContact CD2-CB 3.92Å; F951-L959 HydrophobicContact CE1-CD1 4.29Å; F951-L959 HydrophobicContact CG-CB 3.92Å; F951-L959 HydrophobicContact CG-CD1 4.15Å; F951-Q960 WeakPolarHBondContact CD2-O 3.39Å; F951-W962 HydrophobicContact CE2-CB 4.01Å; F951-W962 AromaticContact CE2-CD1 3.49Å; F951-W962 VanDerWaalsContact CE2-CD1 3.49Å; F951-W962 HydrophobicContact CE2-CD2 4.04Å; F951-W962 AromaticContact CE2-CG 3.58Å; F951-W962 HydrophobicContact CE2-CG 3.58Å; F951-W962 AromaticContact CE2-NE1 3.84Å; F951-W962 HydrophobicContact CZ-CB 4.45Å; F951-W962 AromaticContact CZ-CD2 3.93Å; F951-W962 HydrophobicContact CZ-CD2 3.93Å; F951-W962 HydrophobicContact CZ-CE3 4.45Å; F951-W962 AromaticContact CZ-CG 3.94Å; F951-W962 HydrophobicContact CZ-CG 3.94Å
952	S	85.3	Confident	81.2	Confident	32 Å²	32	66.4 Å²	66.4	22%	0.224	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-74.9	128.6	178.3	-175.3	0	0	0	0	112	D934 D954 S955	D934-S952 PolarHBondContact O-N 2.7Å; S952-D954 PolarHBondContact O-N 3.4Å; S952-D954 PolarHBondContact OG-N 2.95Å; S952-S955 VanDerWaalsContact O-CB 3.28Å; S952-S955 WeakPolarHBondContact O-CB 3.17Å; S952-S955 PolarHBondContact O-N 2.93Å
953	Q	73.3	Confident	81.6	Confident	167 Å²	167	58.6 Å²	58.6	78%	0.78	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.5	175	-63.8	-176.6	-4.2	0	0	113.2	S955 L958	Q953-S955 PolarHBondContact O-N 3.23Å; Q953-L958 HydrophobicContact CB-CD2 4.3Å
954	D	65.1	Low	82.1	Confident	159 Å²	159	55.2 Å²	55.2	85%	0.85	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-1	174.1	-63.5	-42.7	0	0	0	112.9	S952	S952-D954 PolarHBondContact O-N 3.4Å; S952-D954 PolarHBondContact OG-N 2.95Å
955	S	63.3	Low	82.3	Confident	15 Å²	15	52.9 Å²	52.9	11%	0.105	28%	0.278	C	S	.	.	S	Bend	trans	-65.5	143.8	174.7	173.6	0	0	0	0	111.9	S952 Q953 Q957	S952-S955 VanDerWaalsContact O-CB 3.28Å; S952-S955 WeakPolarHBondContact O-CB 3.17Å; S952-S955 PolarHBondContact O-N 2.93Å; Q953-S955 PolarHBondContact O-N 3.23Å; S955-Q957 VanDerWaalsContact CB-O 3.26Å; S955-Q957 WeakPolarHBondContact CB-O 3.39Å; S955-Q957 PolarHBondContact O-N 3.01Å; S955-Q957 VanDerWaalsContact O-N 3.12Å; S955-Q957 PolarHBondContact OG-N 3.34Å; S955-Q957 VanDerWaalsContact OG-N 3.08Å; S955-Q957 PolarHBondContact OG-O 3.44Å
956	P	56.3	Low	82.4	Confident	116 Å²	116	51.3 Å²	51.3	75%	0.753	27%	0.271	S	S	*	.	S	Bend	trans	-65	-9.9	170.2	30.3	-37	0	0	0	113.4
957	Q	60.9	Low	82.3	Confident	126 Å²	126	52.3 Å²	52.3	59%	0.589	28%	0.278	S	S	*	.	S	Bend	trans	-120.7	110.3	169.4	-68.9	174.6	-51.1	0	0	108.1	S955 L959	S955-Q957 VanDerWaalsContact CB-O 3.26Å; S955-Q957 WeakPolarHBondContact CB-O 3.39Å; S955-Q957 PolarHBondContact O-N 3.01Å; S955-Q957 VanDerWaalsContact O-N 3.12Å; S955-Q957 PolarHBondContact OG-N 3.34Å; S955-Q957 VanDerWaalsContact OG-N 3.08Å; S955-Q957 PolarHBondContact OG-O 3.44Å; Q957-L959 VanDerWaalsContact C-N 3.31Å; Q957-L959 PolarHBondContact O-N 3.31Å
958	L	62.9	Low	82.1	Confident	141 Å²	141	53 Å²	53	74%	0.738	28%	0.283	S	S	*	.			trans	-69.2	87.6	174.6	-83.8	161.7	0	0	0	109.9	Q953	Q953-L958 HydrophobicContact CB-CD2 4.3Å
959	L	71.1	Confident	82.1	Confident	44 Å²	44	55.4 Å²	55.4	23%	0.23	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-80.6	127.5	173.8	-64.3	176.7	0	0	0	109.7	A930 F951 Q957	A930-L959 HydrophobicContact CB-CD1 3.71Å; F951-L959 HydrophobicContact CB-CB 3.98Å; F951-L959 HydrophobicContact CD1-CD1 4.03Å; F951-L959 HydrophobicContact CD2-CB 3.92Å; F951-L959 HydrophobicContact CE1-CD1 4.29Å; F951-L959 HydrophobicContact CG-CB 3.92Å; F951-L959 HydrophobicContact CG-CD1 4.15Å; Q957-L959 VanDerWaalsContact C-N 3.31Å; Q957-L959 PolarHBondContact O-N 3.31Å
960	Q	81.9	Confident	82.1	Confident	116 Å²	116	58.5 Å²	58.5	54%	0.542	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-69.4	158.5	163.3	-66	-64.6	-0.9	0	0	110	P767 F951	P767-Q960 HydrophobicContact CB-CB 3.6Å; P767-Q960 HydrophobicContact CB-CG 4.15Å; P767-Q960 HydrophobicContact CG-CB 4.38Å; F951-Q960 WeakPolarHBondContact CD2-O 3.39Å
961	P	87.6	Confident	82.3	Confident	58 Å²	58	56.6 Å²	56.6	38%	0.377	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-55.6	140.6	174.7	-22.7	33.7	0	0	0	111.8	V948 L949	V948-P961 HydrophobicContact CG1-CB 3.74Å; L949-P961 CarbonylContact O-C 3.49Å; L949-P961 WeakPolarHBondContact O-CA 3.32Å; L949-P961 WeakPolarHBondContact O-CB 3.41Å
962	W	91.8	Very high	82.5	Confident	6 Å²	6	56 Å²	56	2%	0.023	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.1	174.1	-70.4	9.2	0	0	0	109.3	W764 L912 T914 A930 V948 L949 F951 I964	W764-W962 AromaticContact NE1-CD1 3.89Å; W764-W962 AromaticContact NE1-CD2 3.49Å; W764-W962 AromaticContact NE1-CE3 3.82Å; W764-W962 AromaticContact NE1-CG 3.43Å; L912-W962 HydrophobicContact CB-CZ3 4.5Å; L912-W962 HydrophobicContact CD2-CE3 3.7Å; L912-W962 HydrophobicContact CD2-CZ3 3.53Å; L912-W962 HydrophobicContact CG-CE3 4.49Å; L912-W962 HydrophobicContact CG-CZ3 3.85Å; T914-W962 HydrophobicContact CG2-CE3 4.45Å; T914-W962 HydrophobicContact CG2-CZ3 4.07Å; A930-W962 HydrophobicContact CB-CH2 3.98Å; A930-W962 HydrophobicContact CB-CZ2 3.93Å; V948-W962 CarbonylContact C-O 3.56Å; V948-W962 WeakPolarHBondContact CA-O 3.33Å; L949-W962 HydrophobicContact CB-CB 4.36Å; L949-W962 PolarHBondContact N-O 2.96Å; L949-W962 PolarHBondContact O-N 3.04Å; L949-W962 VanDerWaalsContact O-N 3.08Å; F951-W962 HydrophobicContact CE2-CB 4.01Å; F951-W962 AromaticContact CE2-CD1 3.49Å; F951-W962 VanDerWaalsContact CE2-CD1 3.49Å; F951-W962 HydrophobicContact CE2-CD2 4.04Å; F951-W962 AromaticContact CE2-CG 3.58Å; F951-W962 HydrophobicContact CE2-CG 3.58Å; F951-W962 AromaticContact CE2-NE1 3.84Å; F951-W962 HydrophobicContact CZ-CB 4.45Å; F951-W962 AromaticContact CZ-CD2 3.93Å; F951-W962 HydrophobicContact CZ-CD2 3.93Å; F951-W962 HydrophobicContact CZ-CE3 4.45Å; F951-W962 AromaticContact CZ-CG 3.94Å; F951-W962 HydrophobicContact CZ-CG 3.94Å; W962-I964 HydrophobicContact CB-CG1 4.48Å
963	V	92.3	Very high	82.9	Confident	9 Å²	9	59.2 Å²	59.2	6%	0.055	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.5	171	-166.4	0	0	0	0	108.1	E765 V948 Y965 F1005	E765-V963 HydrophobicContact CB-CB 4.16Å; E765-V963 HydrophobicContact CG-CB 4.22Å; E765-V963 PolarHBondContact N-O 2.81Å; V948-V963 HydrophobicContact CG2-CG1 4.33Å; V948-V963 HydrophobicContact CG2-CG2 4.33Å; V963-Y965 HydrophobicContact CB-CE2 4.3Å; V963-Y965 HydrophobicContact CG1-CD2 4.36Å; V963-Y965 HydrophobicContact CG1-CE2 3.52Å; V963-F1005 HydrophobicContact CB-CE1 4.37Å; V963-F1005 HydrophobicContact CG1-CD1 3.93Å; V963-F1005 HydrophobicContact CG1-CE1 3.77Å; V963-F1005 HydrophobicContact CG1-CZ 4.25Å; V963-F1005 HydrophobicContact CG2-CE1 3.68Å; V963-F1005 HydrophobicContact CG2-CZ 3.95Å
964	I	94.4	Very high	84	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.9	-174.5	-56.7	176.9	0	0	0	108.7	V762 L905 Y946 C947 L949 W962 L966 F975	V762-I964 HydrophobicContact CB-CG2 3.93Å; V762-I964 HydrophobicContact CG1-CG2 4.04Å; V762-I964 HydrophobicContact CG2-CG2 4.15Å; L905-I964 HydrophobicContact CD1-CD1 4.2Å; L905-I964 HydrophobicContact CD2-CD1 3.99Å; L905-I964 HydrophobicContact CD2-CG2 3.96Å; Y946-I964 CarbonylContact C-O 3.55Å; Y946-I964 VanDerWaalsContact CA-O 3.26Å; Y946-I964 WeakPolarHBondContact CA-O 3.49Å; C947-I964 PolarHBondContact N-O 3.03Å; C947-I964 PolarHBondContact O-N 3Å; L949-I964 HydrophobicContact CD1-CD1 3.74Å; L949-I964 HydrophobicContact CG-CD1 4.19Å; W962-I964 HydrophobicContact CB-CG1 4.48Å; I964-L966 HydrophobicContact CG2-CD1 4Å; I964-L966 HydrophobicContact CG2-CG 4.49Å; I964-F975 HydrophobicContact CD1-CE1 4.47Å; I964-F975 HydrophobicContact CD1-CZ 3.99Å
965	Y	93.6	Very high	85.5	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.9	176	-55.5	-97.6	0	0	0	109.6	V762 H763 E765 C900 Y946 V963 F1005 A1008 L1009 I1012	V762-Y965 CarbonylContact C-O 3.59Å; V762-Y965 WeakPolarHBondContact CA-O 3.22Å; V762-Y965 WeakPolarHBondContact CB-O 3.31Å; H763-Y965 PolarHBondContact N-O 3.41Å; H763-Y965 PolarHBondContact O-N 3.04Å; E765-Y965 HydrophobicContact CG-CE2 4.04Å; E765-Y965 WeakPolarHBondContact OE1-CE2 3.3Å; E765-Y965 PolarHBondContact OE1-OH 2.96Å; C900-Y965 HydrophobicContact CB-CD2 4.46Å; Y946-Y965 VanDerWaalsContact CB-CD1 3.42Å; Y946-Y965 HydrophobicContact CG-CD1 4.3Å; Y946-Y965 HydrophobicContact CG-CE1 4.12Å; V963-Y965 HydrophobicContact CB-CE2 4.3Å; V963-Y965 HydrophobicContact CG1-CD2 4.36Å; V963-Y965 HydrophobicContact CG1-CE2 3.52Å; Y965-F1005 HydrophobicContact CE1-CB 4.46Å; Y965-F1005 VanDerWaalsContact OH-CD1 3.3Å; Y965-F1005 WeakPolarHBondContact OH-CD1 3.33Å; Y965-A1008 HydrophobicContact CE1-CB 4.19Å; Y965-A1008 VanDerWaalsContact OH-CB 3.28Å; Y965-A1008 WeakPolarHBondContact OH-CB 3.4Å; Y965-L1009 HydrophobicContact CD1-CB 4.11Å; Y965-L1009 HydrophobicContact CD1-CD1 4.12Å; Y965-L1009 HydrophobicContact CE1-CB 4.13Å; Y965-I1012 HydrophobicContact CD1-CD1 4.1Å; Y965-I1012 HydrophobicContact CD2-CD1 4.02Å; Y965-I1012 HydrophobicContact CG-CD1 3.7Å
966	L	93.9	Very high	87	Confident	9 Å²	9	46.9 Å²	46.9	5%	0.047	26%	0.256	C	S	.	.			trans	-113.7	171.8	177.8	-61.1	98.8	0	0	0	110.2	F758 V762 E945 I964 E971 L972 F975	F758-L966 HydrophobicContact CZ-CD2 4.34Å; V762-L966 HydrophobicContact CG1-CD2 3.92Å; V762-L966 HydrophobicContact CG1-CG 3.9Å; E945-L966 PolarHBondContact O-N 3.28Å; I964-L966 HydrophobicContact CG2-CD1 4Å; I964-L966 HydrophobicContact CG2-CG 4.49Å; L966-E971 HydrophobicContact CB-CB 4.28Å; L966-E971 HydrophobicContact CD2-CB 4.13Å; L966-L972 HydrophobicContact CD1-CB 4.15Å; L966-L972 HydrophobicContact CD1-CD1 3.72Å; L966-F975 HydrophobicContact CD2-CB 4Å
967	S	90.8	Very high	88.8	Confident	21 Å²	21	46.1 Å²	46.1	15%	0.147	25%	0.25	C	C	.	.	S	Bend	trans	-69.3	-32.8	-176.1	52.1	0	0	0	0	114.6	A700	A700-S967 VanDerWaalsContact O-CB 3.23Å; A700-S967 WeakPolarHBondContact O-CB 3.43Å; A700-S967 PolarHBondContact O-OG 2.89Å
968	C	91.1	Very high	90.5	Very high	16 Å²	16	40.9 Å²	40.9	11%	0.108	23%	0.228	C	C	.	.	S	Bend	trans	-159.6	166.5	-175.6	68.6	0	0	0	0	110.8	D701 S970 E971 L972	D701-C968 PolarHBondContact OD2-SG 3.29Å; C968-S970 VanDerWaalsContact C-N 3.29Å; C968-S970 PolarHBondContact O-N 3.4Å; C968-S970 PolarHBondContact SG-OG 3.06Å; C968-E971 PolarHBondContact O-N 3.01Å; C968-L972 PolarHBondContact O-N 3.12Å
969	T	92.9	Very high	92.1	Very high	62 Å²	62	34.2 Å²	34.2	38%	0.38	19%	0.193	S	C	.	.	H	α-helix	trans	-66.5	-29.4	-177.4	58.1	0	0	0	0	113	E945 L972 D973	E945-T969 HydrophobicContact CG-CG2 3.81Å; T969-L972 WeakPolarHBondContact O-CB 3.43Å; T969-L972 PolarHBondContact O-N 3.13Å; T969-D973 PolarHBondContact O-N 3.28Å
970	S	93.2	Very high	93.2	Very high	65 Å²	65	33.3 Å²	33.3	46%	0.455	19%	0.19	S	C	.	.	H	α-helix	trans	-67.3	-36.5	176.8	23.6	0	0	0	0	112.9	C968 D973 R974	C968-S970 VanDerWaalsContact C-N 3.29Å; C968-S970 PolarHBondContact O-N 3.4Å; C968-S970 PolarHBondContact SG-OG 3.06Å; S970-D973 PolarHBondContact O-N 2.97Å; S970-R974 WeakPolarHBondContact O-CB 3.4Å; S970-R974 PolarHBondContact O-N 2.85Å
971	E	94.9	Very high	93.8	Very high	7 Å²	7	31.7 Å²	31.7	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-70.8	-35.1	173.2	-74.1	-62.3	97	0	0	111.6	Q682 V702 L966 C968 R974 F975	Q682-E971 PolarHBondContact NE2-OE2 3.36Å; V702-E971 WeakPolarHBondContact CG2-OE1 2.94Å; L966-E971 HydrophobicContact CB-CB 4.28Å; L966-E971 HydrophobicContact CD2-CB 4.13Å; C968-E971 PolarHBondContact O-N 3.01Å; E971-R974 VanDerWaalsContact CD-NE 3.3Å; E971-R974 PolarHBondContact O-N 2.84Å; E971-R974 WeakPolarHBondContact OE1-CD 3.19Å; E971-R974 IonicContact OE1-CZ 3.46Å; E971-R974 IonicContact OE1-NE 2.95Å; E971-R974 PolarHBondContact OE1-NE 2.83Å; E971-R974 IonicContact OE1-NH2 2.76Å; E971-R974 IonicContact OE2-CZ 3.11Å; E971-R974 VanDerWaalsContact OE2-CZ 3.28Å; E971-R974 IonicContact OE2-NE 3.83Å; E971-R974 PolarHBondContact OE2-NE 3.48Å; E971-R974 IonicContact OE2-NH2 2.68Å; E971-R974 PolarHBondContact OE2-NH2 3.03Å; E971-F975 WeakPolarHBondContact O-CB 3.46Å; E971-F975 PolarHBondContact O-N 2.81Å
972	L	95.1	Very high	94	Very high	7 Å²	7	29.2 Å²	29.2	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-47.5	170.2	176.4	63.3	0	0	0	111.4	K944 C947 L966 C968 T969 R974 F975 L976	K944-L972 WeakPolarHBondContact O-CD2 3.49Å; C947-L972 HydrophobicContact CB-CD1 3.88Å; L966-L972 HydrophobicContact CD1-CB 4.15Å; L966-L972 HydrophobicContact CD1-CD1 3.72Å; C968-L972 PolarHBondContact O-N 3.12Å; T969-L972 WeakPolarHBondContact O-CB 3.43Å; T969-L972 PolarHBondContact O-N 3.13Å; L972-R974 VanDerWaalsContact C-N 3.3Å; L972-R974 PolarHBondContact O-N 2.97Å; L972-F975 HydrophobicContact CD1-CD1 4.34Å; L972-F975 PolarHBondContact O-N 3.05Å; L972-L976 HydrophobicContact CD1-CD1 3.89Å; L972-L976 HydrophobicContact CD1-CD2 4.34Å; L972-L976 HydrophobicContact CD1-CG 3.87Å; L972-L976 HydrophobicContact CD2-CD1 4.45Å; L972-L976 HydrophobicContact CG-CD1 3.81Å; L972-L976 HydrophobicContact CG-CG 4.22Å; L972-L976 WeakPolarHBondContact O-CB 3.43Å; L972-L976 VanDerWaalsContact O-CG 3.23Å; L972-L976 WeakPolarHBondContact O-CG 3.35Å; L972-L976 PolarHBondContact O-N 2.91Å
973	D	94.9	Very high	94.1	Very high	98 Å²	98	29.8 Å²	29.8	52%	0.524	18%	0.179	S	C	.	.	H	α-helix	trans	-62.3	-37.2	176.7	-75	-30.5	0	0	0	111.9	T969 S970 T977	T969-D973 PolarHBondContact O-N 3.28Å; S970-D973 PolarHBondContact O-N 2.97Å; D973-T977 VanDerWaalsContact O-CB 3.27Å; D973-T977 WeakPolarHBondContact O-CB 3.24Å; D973-T977 PolarHBondContact O-N 3.03Å; D973-T977 PolarHBondContact O-OG1 3.19Å
974	R	95.4	Very high	94.1	Very high	64 Å²	64	33.7 Å²	33.7	24%	0.242	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-47.8	173.9	-169	174.6	75.4	83.9	-1.5	111.5	D680 Q682 F758 Y759 S970 E971 L972 T977 A978	D680-R974 IonicContact OD2-CZ 2.84Å; D680-R974 IonicContact OD2-NH1 3.54Å; D680-R974 PolarHBondContact OD2-NH1 3.27Å; Q682-R974 VanDerWaalsContact NE2-NH2 3.14Å; F758-R974 HydrophobicContact CD2-CG 4.34Å; F758-R974 HydrophobicContact CE2-CB 4.42Å; F758-R974 HydrophobicContact CE2-CG 4.21Å; Y759-R974 PolarHBondContact O-NH1 3.49Å; Y759-R974 PolarHBondContact O-NH2 3.02Å; S970-R974 WeakPolarHBondContact O-CB 3.4Å; S970-R974 PolarHBondContact O-N 2.85Å; E971-R974 VanDerWaalsContact CD-NE 3.3Å; E971-R974 PolarHBondContact O-N 2.84Å; E971-R974 WeakPolarHBondContact OE1-CD 3.19Å; E971-R974 IonicContact OE1-CZ 3.46Å; E971-R974 IonicContact OE1-NE 2.95Å; E971-R974 PolarHBondContact OE1-NE 2.83Å; E971-R974 IonicContact OE1-NH2 2.76Å; E971-R974 IonicContact OE2-CZ 3.11Å; E971-R974 VanDerWaalsContact OE2-CZ 3.28Å; E971-R974 IonicContact OE2-NE 3.83Å; E971-R974 PolarHBondContact OE2-NE 3.48Å; E971-R974 IonicContact OE2-NH2 2.68Å; E971-R974 PolarHBondContact OE2-NH2 3.03Å; L972-R974 VanDerWaalsContact C-N 3.3Å; L972-R974 PolarHBondContact O-N 2.97Å; R974-T977 PolarHBondContact O-N 2.58Å; R974-A978 PolarHBondContact O-N 3.01Å; R974-A978 VanDerWaalsContact O-N 3.11Å
975	F	96.3	Very high	94	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.5	-51.8	175.2	169.1	-108.1	0	0	0	112.1	F758 L905 I907 L912 L949 I964 L966 E971 L972 T977 A978 L979	F758-F975 HydrophobicContact CD1-CD2 4.17Å; F758-F975 HydrophobicContact CD2-CB 4.38Å; F758-F975 HydrophobicContact CE1-CB 4.42Å; F758-F975 AromaticContact CE1-CD2 3.9Å; F758-F975 HydrophobicContact CE1-CD2 3.9Å; F758-F975 VanDerWaalsContact CE2-CA 3.48Å; F758-F975 HydrophobicContact CE2-CB 3.69Å; F758-F975 HydrophobicContact CE2-CD2 4.47Å; F758-F975 HydrophobicContact CZ-CB 3.72Å; F758-F975 HydrophobicContact CZ-CD2 4.06Å; F758-F975 HydrophobicContact CZ-CG 4.35Å; L905-F975 HydrophobicContact CD2-CD2 3.71Å; L905-F975 HydrophobicContact CD2-CE2 3.4Å; L905-F975 HydrophobicContact CD2-CZ 4.02Å; L905-F975 HydrophobicContact CG-CE2 4.31Å; I907-F975 HydrophobicContact CD1-CD2 3.82Å; I907-F975 HydrophobicContact CD1-CE2 3.76Å; I907-F975 HydrophobicContact CG1-CE2 4.32Å; L912-F975 HydrophobicContact CD1-CE2 4.13Å; L949-F975 HydrophobicContact CD1-CZ 4.37Å; L949-F975 HydrophobicContact CD2-CE1 4.44Å; L949-F975 HydrophobicContact CD2-CZ 4.45Å; I964-F975 HydrophobicContact CD1-CE1 4.47Å; I964-F975 HydrophobicContact CD1-CZ 3.99Å; L966-F975 HydrophobicContact CD2-CB 4Å; E971-F975 WeakPolarHBondContact O-CB 3.46Å; E971-F975 PolarHBondContact O-N 2.81Å; L972-F975 HydrophobicContact CD1-CD1 4.34Å; L972-F975 PolarHBondContact O-N 3.05Å; F975-T977 VanDerWaalsContact C-N 3.27Å; F975-T977 PolarHBondContact O-N 2.87Å; F975-A978 PolarHBondContact O-N 3.01Å; F975-L979 HydrophobicContact CE1-CD2 3.83Å; F975-L979 HydrophobicContact CE2-CD2 4.3Å; F975-L979 HydrophobicContact CZ-CD2 3.57Å; F975-L979 VanDerWaalsContact O-CB 3.28Å; F975-L979 WeakPolarHBondContact O-CB 3.37Å; F975-L979 PolarHBondContact O-N 2.95Å
976	L	95.3	Very high	93.9	Very high	19 Å²	19	40.6 Å²	40.6	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-35.8	-179.6	-68.9	174.8	0	0	0	112	I938 T940 L972 S980	I938-L976 HydrophobicContact CD1-CD2 3.72Å; I938-L976 HydrophobicContact CG2-CD2 3.86Å; T940-L976 HydrophobicContact CG2-CD1 3.97Å; T940-L976 HydrophobicContact CG2-CD2 4.27Å; L972-L976 HydrophobicContact CD1-CD1 3.89Å; L972-L976 HydrophobicContact CD1-CD2 4.34Å; L972-L976 HydrophobicContact CD1-CG 3.87Å; L972-L976 HydrophobicContact CD2-CD1 4.45Å; L972-L976 HydrophobicContact CG-CD1 3.81Å; L972-L976 HydrophobicContact CG-CG 4.22Å; L972-L976 WeakPolarHBondContact O-CB 3.43Å; L972-L976 VanDerWaalsContact O-CG 3.23Å; L972-L976 WeakPolarHBondContact O-CG 3.35Å; L972-L976 PolarHBondContact O-N 2.91Å; L976-S980 WeakPolarHBondContact O-CB 3.46Å; L976-S980 PolarHBondContact O-N 2.88Å; L976-S980 PolarHBondContact O-OG 2.99Å
977	T	95.4	Very high	93.8	Very high	100 Å²	100	45.2 Å²	45.2	61%	0.613	26%	0.26	S	S	*	.	H	α-helix	trans	-66	-48.7	175.8	-61.2	0	0	0	0	111.5	D973 R974 F975 S981	D973-T977 VanDerWaalsContact O-CB 3.27Å; D973-T977 WeakPolarHBondContact O-CB 3.24Å; D973-T977 PolarHBondContact O-N 3.03Å; D973-T977 PolarHBondContact O-OG1 3.19Å; R974-T977 PolarHBondContact O-N 2.58Å; F975-T977 VanDerWaalsContact C-N 3.27Å; F975-T977 PolarHBondContact O-N 2.87Å; T977-S981 WeakPolarHBondContact O-CB 3.34Å; T977-S981 PolarHBondContact O-N 3.34Å
978	A	95.8	Very high	93.8	Very high	16 Å²	16	52.4 Å²	52.4	13%	0.132	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-44	177.4	0	0	0	0	0	111.9	F758 I907 R974 F975 S981 G982	F758-A978 HydrophobicContact CB-CB 3.78Å; F758-A978 HydrophobicContact CD2-CB 4.35Å; F758-A978 HydrophobicContact CG-CB 4.43Å; I907-A978 HydrophobicContact CD1-CB 3.92Å; R974-A978 PolarHBondContact O-N 3.01Å; R974-A978 VanDerWaalsContact O-N 3.11Å; F975-A978 PolarHBondContact O-N 3.01Å; A978-S981 WeakPolarHBondContact O-CB 3.48Å; A978-S981 PolarHBondContact O-N 2.93Å; A978-G982 PolarHBondContact O-N 3.4Å
979	L	95.7	Very high	93.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-45.7	178.8	179.9	55	0	0	0	112.3	I907 L932 I935 I938 L949 F975 S981 G982 W983 L991	I907-L979 HydrophobicContact CD1-CB 3.89Å; L932-L979 HydrophobicContact CD2-CD1 3.34Å; I935-L979 HydrophobicContact CD1-CD1 3.8Å; I938-L979 HydrophobicContact CD1-CD2 3.53Å; I938-L979 HydrophobicContact CD1-CG 4.1Å; I938-L979 HydrophobicContact CG1-CD2 4.3Å; L949-L979 HydrophobicContact CD2-CD2 3.61Å; F975-L979 HydrophobicContact CE1-CD2 3.83Å; F975-L979 HydrophobicContact CE2-CD2 4.3Å; F975-L979 HydrophobicContact CZ-CD2 3.57Å; F975-L979 VanDerWaalsContact O-CB 3.28Å; F975-L979 WeakPolarHBondContact O-CB 3.37Å; F975-L979 PolarHBondContact O-N 2.95Å; L979-S981 VanDerWaalsContact C-N 3.31Å; L979-S981 PolarHBondContact O-N 3.46Å; L979-G982 PolarHBondContact O-N 2.94Å; L979-W983 WeakPolarHBondContact O-CB 3.44Å; L979-W983 PolarHBondContact O-N 2.18Å; L979-L991 HydrophobicContact CG-CD2 4.08Å
980	S	94.3	Very high	93.8	Very high	25 Å²	25	58 Å²	58	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-65.2	-35.6	176.9	-59.2	0	0	0	0	111.9	L976 K984	L976-S980 WeakPolarHBondContact O-CB 3.46Å; L976-S980 PolarHBondContact O-N 2.88Å; L976-S980 PolarHBondContact O-OG 2.99Å; S980-K984 WeakPolarHBondContact O-CB 3.31Å; S980-K984 PolarHBondContact O-N 3.37Å
981	S	94.2	Very high	93.7	Very high	83 Å²	83	55.1 Å²	55.1	58%	0.58	30%	0.3	S	S	*	.	H	α-helix	trans	-63.8	-50.2	174.9	-169.2	0	0	0	0	111.8	T977 A978 L979 K984 A985	T977-S981 WeakPolarHBondContact O-CB 3.34Å; T977-S981 PolarHBondContact O-N 3.34Å; A978-S981 WeakPolarHBondContact O-CB 3.48Å; A978-S981 PolarHBondContact O-N 2.93Å; L979-S981 VanDerWaalsContact C-N 3.31Å; L979-S981 PolarHBondContact O-N 3.46Å; S981-K984 PolarHBondContact O-N 2.82Å; S981-A985 PolarHBondContact O-N 3.17Å
982	G	92.4	Very high	93.5	Very high	5 Å²	5	58 Å²	58	5%	0.052	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-45.7	177	0	0	0	0	0	112.8	A978 L979 K984 A985 I986	A978-G982 PolarHBondContact O-N 3.4Å; L979-G982 PolarHBondContact O-N 2.94Å; G982-K984 VanDerWaalsContact C-N 3.34Å; G982-K984 PolarHBondContact O-N 3.12Å; G982-A985 WeakPolarHBondContact O-CB 3.3Å; G982-A985 PolarHBondContact O-N 2.79Å; G982-I986 PolarHBondContact O-N 3.2Å
983	W	93.4	Very high	93.3	Very high	19 Å²	19	62.8 Å²	62.8	7%	0.072	34%	0.341	C	S	.	.	H	α-helix	trans	-58.3	-44.9	173.8	175.7	-88.7	0	0	0	112.6	L932 I935 L979 A985 I986 Y987 L991	L932-W983 VanDerWaalsContact O-CE3 3.22Å; L932-W983 WeakPolarHBondContact O-CZ3 3.5Å; I935-W983 HydrophobicContact CB-CE3 4.14Å; I935-W983 HydrophobicContact CB-CZ3 3.9Å; I935-W983 WeakPolarHBondContact O-CH2 3.46Å; I935-W983 WeakPolarHBondContact O-CZ3 3.3Å; L979-W983 WeakPolarHBondContact O-CB 3.44Å; L979-W983 PolarHBondContact O-N 2.18Å; W983-A985 VanDerWaalsContact C-N 3.31Å; W983-A985 PolarHBondContact O-N 2.85Å; W983-I986 PolarHBondContact O-N 3.38Å; W983-I986 VanDerWaalsContact O-N 3.12Å; W983-Y987 AromaticContact CD2-CD2 3.74Å; W983-Y987 HydrophobicContact CD2-CD2 3.74Å; W983-Y987 HydrophobicContact CD2-CE2 4.19Å; W983-Y987 AromaticContact CE2-CD2 3.47Å; W983-Y987 VanDerWaalsContact CE2-CD2 3.47Å; W983-Y987 AromaticContact CE3-CD2 3.92Å; W983-Y987 HydrophobicContact CE3-CD2 3.92Å; W983-Y987 AromaticContact CE3-CE2 3.88Å; W983-Y987 HydrophobicContact CE3-CE2 3.88Å; W983-Y987 HydrophobicContact CG-CD2 4.47Å; W983-Y987 AromaticContact CH2-CD2 3.6Å; W983-Y987 HydrophobicContact CH2-CD2 3.6Å; W983-Y987 AromaticContact CH2-CE2 3.29Å; W983-Y987 HydrophobicContact CH2-CE2 3.29Å; W983-Y987 HydrophobicContact CH2-CG 4.48Å; W983-Y987 AromaticContact CH2-CZ 3.97Å; W983-Y987 AromaticContact CZ2-CD2 3.42Å; W983-Y987 HydrophobicContact CZ2-CD2 3.42Å; W983-Y987 VanDerWaalsContact CZ2-CD2 3.42Å; W983-Y987 AromaticContact CZ2-CE2 3.65Å; W983-Y987 HydrophobicContact CZ2-CE2 3.65Å; W983-Y987 HydrophobicContact CZ2-CG 4.02Å; W983-Y987 AromaticContact CZ3-CD2 3.84Å; W983-Y987 HydrophobicContact CZ3-CD2 3.84Å; W983-Y987 AromaticContact CZ3-CE2 3.42Å; W983-Y987 HydrophobicContact CZ3-CE2 3.42Å; W983-Y987 VanDerWaalsContact CZ3-CE2 3.42Å; W983-Y987 PolarHBondContact O-N 2.86Å; W983-L991 HydrophobicContact CB-CB 4.3Å; W983-L991 HydrophobicContact CB-CD2 3.86Å; W983-L991 HydrophobicContact CD2-CD1 3.87Å; W983-L991 HydrophobicContact CD2-CD2 4.38Å; W983-L991 HydrophobicContact CD2-CG 4.49Å; W983-L991 HydrophobicContact CE3-CD1 4.32Å; W983-L991 HydrophobicContact CG-CB 3.87Å; W983-L991 HydrophobicContact CG-CD1 4.07Å; W983-L991 HydrophobicContact CG-CD2 3.95Å; W983-L991 HydrophobicContact CG-CG 4.17Å; W983-L991 HydrophobicContact CZ2-CD1 4.49Å
984	K	93.2	Very high	93.1	Very high	91 Å²	91	62.5 Å²	62.5	40%	0.396	34%	0.336	S	S	.	.	H	α-helix	trans	-67.8	-29.6	-179.7	-171.7	168.4	-169.9	161.6	0	112.6	S980 S981 G982 I986 Q988 D990	S980-K984 WeakPolarHBondContact O-CB 3.31Å; S980-K984 PolarHBondContact O-N 3.37Å; S981-K984 PolarHBondContact O-N 2.82Å; G982-K984 VanDerWaalsContact C-N 3.34Å; G982-K984 PolarHBondContact O-N 3.12Å; K984-I986 VanDerWaalsContact C-N 3.33Å; K984-Q988 WeakPolarHBondContact O-CA 3.49Å; K984-Q988 PolarHBondContact O-N 3.39Å; K984-D990 WeakPolarHBondContact CD-OD1 3.44Å; K984-D990 WeakPolarHBondContact CE-OD1 3.48Å; K984-D990 VanDerWaalsContact NZ-CG 3.33Å; K984-D990 IonicContact NZ-OD1 3.27Å; K984-D990 PolarHBondContact NZ-OD1 3.1Å; K984-D990 IonicContact NZ-OD2 3.46Å; K984-D990 PolarHBondContact NZ-OD2 3.27Å
985	A	92.4	Very high	92.4	Very high	81 Å²	81	62.1 Å²	62.1	67%	0.669	35%	0.346	S	S	*	.	H	α-helix	trans	-64.5	-36.7	170.8	0	0	0	0	0	112.2	S981 G982 W983	S981-A985 PolarHBondContact O-N 3.17Å; G982-A985 WeakPolarHBondContact O-CB 3.3Å; G982-A985 PolarHBondContact O-N 2.79Å; W983-A985 VanDerWaalsContact C-N 3.31Å; W983-A985 PolarHBondContact O-N 2.85Å
986	I	91.9	Very high	91.8	Very high	64 Å²	64	62.9 Å²	62.9	33%	0.328	35%	0.35	S	S	.	.	H	α-helix	trans	-75.5	-51	179.1	-61.5	167.6	0	0	0	111.5	L932 A933 G982 W983 K984	L932-I986 HydrophobicContact CB-CD1 3.58Å; L932-I986 HydrophobicContact CD1-CD1 4.3Å; A933-I986 HydrophobicContact CB-CG2 4.44Å; G982-I986 PolarHBondContact O-N 3.2Å; W983-I986 PolarHBondContact O-N 3.38Å; W983-I986 VanDerWaalsContact O-N 3.12Å; K984-I986 VanDerWaalsContact C-N 3.33Å
987	Y	91.1	Very high	90.9	Very high	107 Å²	107	70.3 Å²	70.3	42%	0.42	38%	0.384	S	S	.	.	H	α-helix	trans	-103.5	-6.8	-169.9	-71.1	-78.4	0	0	0	115.8	A933 W983 V989	A933-Y987 HydrophobicContact CB-CE2 4.4Å; A933-Y987 PolarHBondContact O-OH 3.36Å; W983-Y987 AromaticContact CD2-CD2 3.74Å; W983-Y987 HydrophobicContact CD2-CD2 3.74Å; W983-Y987 HydrophobicContact CD2-CE2 4.19Å; W983-Y987 AromaticContact CE2-CD2 3.47Å; W983-Y987 VanDerWaalsContact CE2-CD2 3.47Å; W983-Y987 AromaticContact CE3-CD2 3.92Å; W983-Y987 HydrophobicContact CE3-CD2 3.92Å; W983-Y987 AromaticContact CE3-CE2 3.88Å; W983-Y987 HydrophobicContact CE3-CE2 3.88Å; W983-Y987 HydrophobicContact CG-CD2 4.47Å; W983-Y987 AromaticContact CH2-CD2 3.6Å; W983-Y987 HydrophobicContact CH2-CD2 3.6Å; W983-Y987 AromaticContact CH2-CE2 3.29Å; W983-Y987 HydrophobicContact CH2-CE2 3.29Å; W983-Y987 HydrophobicContact CH2-CG 4.48Å; W983-Y987 AromaticContact CH2-CZ 3.97Å; W983-Y987 AromaticContact CZ2-CD2 3.42Å; W983-Y987 HydrophobicContact CZ2-CD2 3.42Å; W983-Y987 VanDerWaalsContact CZ2-CD2 3.42Å; W983-Y987 AromaticContact CZ2-CE2 3.65Å; W983-Y987 HydrophobicContact CZ2-CE2 3.65Å; W983-Y987 HydrophobicContact CZ2-CG 4.02Å; W983-Y987 AromaticContact CZ3-CD2 3.84Å; W983-Y987 HydrophobicContact CZ3-CD2 3.84Å; W983-Y987 AromaticContact CZ3-CE2 3.42Å; W983-Y987 HydrophobicContact CZ3-CE2 3.42Å; W983-Y987 VanDerWaalsContact CZ3-CE2 3.42Å; W983-Y987 PolarHBondContact O-N 2.86Å; Y987-V989 PolarHBondContact O-N 3.27Å; Y987-V989 VanDerWaalsContact O-N 3.1Å
988	Q	91.9	Very high	90.2	Very high	172 Å²	172	71.1 Å²	71.1	80%	0.804	38%	0.38	S	S	*	.	S	Bend	trans	59.8	15.2	-177.7	-55.3	175	34.2	0	0	114.5	K984	K984-Q988 WeakPolarHBondContact O-CA 3.49Å; K984-Q988 PolarHBondContact O-N 3.39Å
989	V	92	Very high	89.4	Confident	85 Å²	85	74 Å²	74	52%	0.515	40%	0.404	S	S	.	.	S	Bend	trans	-131.9	157.6	176	-61.6	0	0	0	0	110.2	Y987	Y987-V989 PolarHBondContact O-N 3.27Å; Y987-V989 VanDerWaalsContact O-N 3.1Å
990	D	90.7	Very high	88.6	Confident	109 Å²	109	77.1 Å²	77.1	58%	0.583	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-68.3	147.1	176	-62.3	-67.8	0	0	0	111.9	K984 P992	K984-D990 WeakPolarHBondContact CD-OD1 3.44Å; K984-D990 WeakPolarHBondContact CE-OD1 3.48Å; K984-D990 VanDerWaalsContact NZ-CG 3.33Å; K984-D990 IonicContact NZ-OD1 3.27Å; K984-D990 PolarHBondContact NZ-OD1 3.1Å; K984-D990 IonicContact NZ-OD2 3.46Å; K984-D990 PolarHBondContact NZ-OD2 3.27Å; D990-P992 WeakPolarHBondContact O-CD 3.32Å
991	L	91.9	Very high	88	Confident	6 Å²	6	79.2 Å²	79.2	3%	0.031	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-70.3	124.8	-178.3	-179.5	35.9	0	0	0	110.1	I935 I938 L979 W983 H993	I935-L991 HydrophobicContact CG2-CD1 4.13Å; I938-L991 HydrophobicContact CD1-CD2 3.5Å; I938-L991 VanDerWaalsContact CD1-CD2 3.5Å; I938-L991 HydrophobicContact CD1-CG 3.94Å; I938-L991 HydrophobicContact CG1-CD1 4.42Å; I938-L991 HydrophobicContact CG1-CD2 3.82Å; I938-L991 HydrophobicContact CG1-CG 3.94Å; L979-L991 HydrophobicContact CG-CD2 4.08Å; W983-L991 HydrophobicContact CB-CB 4.3Å; W983-L991 HydrophobicContact CB-CD2 3.86Å; W983-L991 HydrophobicContact CD2-CD1 3.87Å; W983-L991 HydrophobicContact CD2-CD2 4.38Å; W983-L991 HydrophobicContact CD2-CG 4.49Å; W983-L991 HydrophobicContact CE3-CD1 4.32Å; W983-L991 HydrophobicContact CG-CB 3.87Å; W983-L991 HydrophobicContact CG-CD1 4.07Å; W983-L991 HydrophobicContact CG-CD2 3.95Å; W983-L991 HydrophobicContact CG-CG 4.17Å; W983-L991 HydrophobicContact CZ2-CD1 4.49Å; L991-H993 PolarHBondContact O-CD2 3.43Å; L991-H993 VanDerWaalsContact O-CD2 3.23Å; L991-H993 PolarHBondContact O-N 2.94Å; L991-H993 VanDerWaalsContact O-N 3.14Å
992	P	91.1	Very high	87.5	Confident	67 Å²	67	78 Å²	78	44%	0.435	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-60	117.4	180	-29.3	37.1	0	0	0	113.5	A937 I938 D990	A937-P992 CarbonylContact C-O 3.5Å; A937-P992 WeakPolarHBondContact CA-O 3.44Å; A937-P992 HydrophobicContact CB-CB 4.34Å; A937-P992 VanDerWaalsContact CB-O 3.3Å; A937-P992 WeakPolarHBondContact CB-O 3.49Å; I938-P992 PolarHBondContact N-O 3.38Å; D990-P992 WeakPolarHBondContact O-CD 3.32Å
993	H	90.9	Very high	87.1	Confident	107 Å²	107	82.4 Å²	82.4	50%	0.495	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.3	169	-71.9	-94.6	0	0	0	110.8	I938 L991	I938-H993 CarbonylContact O-C 3.56Å; I938-H993 WeakPolarHBondContact O-CA 3.41Å; L991-H993 PolarHBondContact O-CD2 3.43Å; L991-H993 VanDerWaalsContact O-CD2 3.23Å; L991-H993 PolarHBondContact O-N 2.94Å; L991-H993 VanDerWaalsContact O-N 3.14Å
994	K	89	Confident	86.8	Confident	93 Å²	93	84.8 Å²	84.8	40%	0.404	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	155.7	173.3	-74.7	171	-178.4	161.7	0	109.9	A937 I938 S939 E950	A937-K994 HydrophobicContact CB-CD 3.5Å; A937-K994 VanDerWaalsContact CB-CD 3.5Å; A937-K994 VanDerWaalsContact CB-CE 3.45Å; A937-K994 HydrophobicContact CB-CG 3.96Å; I938-K994 PolarHBondContact O-N 3.36Å; S939-K994 WeakPolarHBondContact CA-O 3.34Å; S939-K994 VanDerWaalsContact OG-CB 3.3Å; S939-K994 WeakPolarHBondContact OG-CB 3.25Å; E950-K994 WeakPolarHBondContact OE1-CD 3.38Å; E950-K994 WeakPolarHBondContact OE2-CD 3.46Å; E950-K994 IonicContact OE2-NZ 3.22Å; E950-K994 PolarHBondContact OE2-NZ 2.76Å
995	A	82.6	Confident	86.5	Confident	56 Å²	56	81 Å²	81	46%	0.463	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.8	169.8	0	0	0	0	0	109.6	H997	A995-H997 PolarHBondContact O-CD2 3.04Å; A995-H997 PolarHBondContact O-N 3.34Å
996	I	83.4	Confident	86.1	Confident	16 Å²	16	80.4 Å²	80.4	8%	0.082	42%	0.416	C	S	.	.			trans	-68.5	116.3	169.7	-56.2	171	0	0	0	107.2	Y946 V948 I1001 K1002 F1005	Y946-I996 HydrophobicContact CE2-CD1 3.58Å; V948-I996 HydrophobicContact CG2-CD1 4.48Å; I996-I1001 HydrophobicContact CG2-CG2 4.21Å; I996-K1002 HydrophobicContact CB-CG 4.33Å; I996-K1002 HydrophobicContact CG2-CG 3.65Å; I996-K1002 WeakPolarHBondContact O-CE 3.4Å; I996-K1002 PolarHBondContact O-NZ 3.03Å; I996-F1005 HydrophobicContact CD1-CD2 4.11Å; I996-F1005 HydrophobicContact CD1-CE2 4.09Å
997	H	74.8	Confident	85.7	Confident	174 Å²	174	81 Å²	81	81%	0.806	42%	0.42	S	S	*	.			trans	-102	-22.5	-175.1	-75.3	-66.4	0	0	0	114.1	A995	A995-H997 PolarHBondContact O-CD2 3.04Å; A995-H997 PolarHBondContact O-N 3.34Å
998	E	82.7	Confident	85.3	Confident	117 Å²	117	76.1 Å²	76.1	55%	0.547	40%	0.402	S	S	.	.			trans	-89.4	119.8	-176.7	-138.7	-171.8	128.3	0	0	111.5	S1000 I1001 K1002	E998-S1000 VanDerWaalsContact C-N 3.31Å; E998-S1000 WeakPolarHBondContact CG-OG 3.46Å; E998-S1000 PolarHBondContact O-N 2.85Å; E998-S1000 PolarHBondContact OE1-OG 3.08Å; E998-I1001 HydrophobicContact CB-CB 4.26Å; E998-I1001 HydrophobicContact CB-CD1 3.95Å; E998-I1001 HydrophobicContact CB-CG1 4.1Å; E998-I1001 PolarHBondContact O-N 3.22Å; E998-K1002 PolarHBondContact O-N 2.99Å; E998-K1002 VanDerWaalsContact O-N 3.1Å
999	A	78.5	Confident	85	Confident	77 Å²	77	68.4 Å²	68.4	64%	0.636	37%	0.366	S	S	*	.	H	α-helix	trans	-68	-29.1	-175.5	0	0	0	0	0	113.5	Q1003	A999-Q1003 WeakPolarHBondContact O-CB 3.46Å; A999-Q1003 PolarHBondContact O-N 3.23Å
1000	S	78.3	Confident	84.5	Confident	66 Å²	66	67 Å²	67	46%	0.462	36%	0.36	S	S	.	.	H	α-helix	trans	-56.2	-50.5	169.3	42.9	0	0	0	0	112	E998 Q1003 K1004	E998-S1000 VanDerWaalsContact C-N 3.31Å; E998-S1000 WeakPolarHBondContact CG-OG 3.46Å; E998-S1000 PolarHBondContact O-N 2.85Å; E998-S1000 PolarHBondContact OE1-OG 3.08Å; S1000-Q1003 PolarHBondContact O-N 3.12Å; S1000-K1004 PolarHBondContact O-N 3.29Å
1001	I	81.7	Confident	83.8	Confident	69 Å²	69	64.9 Å²	64.9	35%	0.354	35%	0.348	S	S	.	.	H	α-helix	trans	-68.5	-40.5	-179.1	-64.7	177.3	0	0	0	110.4	I996 E998 Q1003 K1004 F1005	I996-I1001 HydrophobicContact CG2-CG2 4.21Å; E998-I1001 HydrophobicContact CB-CB 4.26Å; E998-I1001 HydrophobicContact CB-CD1 3.95Å; E998-I1001 HydrophobicContact CB-CG1 4.1Å; E998-I1001 PolarHBondContact O-N 3.22Å; I1001-Q1003 PolarHBondContact O-N 3.3Å; I1001-K1004 WeakPolarHBondContact O-CB 3.36Å; I1001-K1004 PolarHBondContact O-N 2.9Å; I1001-F1005 HydrophobicContact CG2-CD2 3.96Å; I1001-F1005 HydrophobicContact CG2-CE1 4.37Å; I1001-F1005 HydrophobicContact CG2-CE2 3.27Å; I1001-F1005 HydrophobicContact CG2-CZ 3.52Å; I1001-F1005 WeakPolarHBondContact O-CD2 3.47Å; I1001-F1005 WeakPolarHBondContact O-CG 3.3Å; I1001-F1005 PolarHBondContact O-N 3.26Å; I1001-F1005 VanDerWaalsContact O-N 3.12Å
1002	K	84.1	Confident	83.2	Confident	57 Å²	57	65 Å²	65	25%	0.248	35%	0.349	C	S	.	.	H	α-helix	trans	-58.3	-47.1	171.1	-69.6	-166.8	179.1	-168.2	0	112.5	E941 I996 E998 K1004 F1005 E1006	E941-K1002 WeakPolarHBondContact OE1-CD 3.24Å; E941-K1002 VanDerWaalsContact OE1-CE 3.29Å; E941-K1002 WeakPolarHBondContact OE1-CE 3.48Å; E941-K1002 IonicContact OE1-NZ 2.71Å; E941-K1002 PolarHBondContact OE1-NZ 2.85Å; I996-K1002 HydrophobicContact CB-CG 4.33Å; I996-K1002 HydrophobicContact CG2-CG 3.65Å; I996-K1002 WeakPolarHBondContact O-CE 3.4Å; I996-K1002 PolarHBondContact O-NZ 3.03Å; E998-K1002 PolarHBondContact O-N 2.99Å; E998-K1002 VanDerWaalsContact O-N 3.1Å; K1002-K1004 VanDerWaalsContact C-N 3.3Å; K1002-K1004 PolarHBondContact O-N 3.11Å; K1002-F1005 PolarHBondContact O-N 3.22Å; K1002-F1005 VanDerWaalsContact O-N 3.11Å; K1002-E1006 WeakPolarHBondContact O-CG 3.42Å; K1002-E1006 PolarHBondContact O-N 3.01Å
1003	Q	83.9	Confident	82.4	Confident	97 Å²	97	65.3 Å²	65.3	45%	0.453	34%	0.344	S	S	.	.	H	α-helix	trans	-61.1	-40.4	178.9	-166.1	66.8	64.9	0	0	111	A999 S1000 I1001 F1005 E1006 D1007	A999-Q1003 WeakPolarHBondContact O-CB 3.46Å; A999-Q1003 PolarHBondContact O-N 3.23Å; S1000-Q1003 PolarHBondContact O-N 3.12Å; I1001-Q1003 PolarHBondContact O-N 3.3Å; Q1003-F1005 VanDerWaalsContact C-N 3.33Å; Q1003-F1005 PolarHBondContact O-N 3.13Å; Q1003-E1006 PolarHBondContact O-N 3.16Å; Q1003-D1007 PolarHBondContact NE2-OD1 3.37Å; Q1003-D1007 WeakPolarHBondContact O-CB 3.49Å; Q1003-D1007 PolarHBondContact O-N 3.39Å
1004	K	85.6	Confident	81	Confident	69 Å²	69	61.7 Å²	61.7	30%	0.3	33%	0.331	S	S	.	.	H	α-helix	trans	-54.5	-48.2	172.5	-173.7	-158.3	166.1	-168.2	0	111.5	E765 E770 S1000 I1001 K1002 D1007 A1008	E765-K1004 VanDerWaalsContact OE2-CE 3.3Å; E765-K1004 WeakPolarHBondContact OE2-CE 3.45Å; E765-K1004 IonicContact OE2-NZ 2.58Å; E765-K1004 PolarHBondContact OE2-NZ 3.07Å; E770-K1004 IonicContact OE1-NZ 3.98Å; E770-K1004 PolarHBondContact OE1-NZ 3.49Å; S1000-K1004 PolarHBondContact O-N 3.29Å; I1001-K1004 WeakPolarHBondContact O-CB 3.36Å; I1001-K1004 PolarHBondContact O-N 2.9Å; K1002-K1004 VanDerWaalsContact C-N 3.3Å; K1002-K1004 PolarHBondContact O-N 3.11Å; K1004-D1007 PolarHBondContact O-N 2.88Å; K1004-A1008 VanDerWaalsContact O-CB 3.28Å; K1004-A1008 WeakPolarHBondContact O-CB 3.44Å; K1004-A1008 PolarHBondContact O-N 2.99Å
1005	F	87.4	Confident	79.4	Confident	11 Å²	11	59.5 Å²	59.5	5%	0.048	33%	0.33	C	S	.	.	H	α-helix	trans	-73.9	-34.7	-177.5	-57	-30.4	0	0	0	113.3	Y946 V948 V963 Y965 I996 I1001 K1002 Q1003 L1009	Y946-F1005 HydrophobicContact CD1-CB 4.42Å; Y946-F1005 HydrophobicContact CD2-CB 4.05Å; Y946-F1005 HydrophobicContact CD2-CD2 4.07Å; Y946-F1005 HydrophobicContact CD2-CG 4.25Å; Y946-F1005 HydrophobicContact CE1-CB 4.13Å; Y946-F1005 HydrophobicContact CE2-CB 3.73Å; Y946-F1005 AromaticContact CE2-CD2 3.45Å; Y946-F1005 HydrophobicContact CE2-CD2 3.45Å; Y946-F1005 VanDerWaalsContact CE2-CD2 3.45Å; Y946-F1005 HydrophobicContact CE2-CE2 4.34Å; Y946-F1005 AromaticContact CE2-CG 3.93Å; Y946-F1005 HydrophobicContact CE2-CG 3.93Å; Y946-F1005 HydrophobicContact CG-CB 4.42Å; V948-F1005 HydrophobicContact CG2-CD2 4.38Å; V948-F1005 HydrophobicContact CG2-CE2 3.49Å; V948-F1005 VanDerWaalsContact CG2-CE2 3.49Å; V948-F1005 HydrophobicContact CG2-CZ 3.64Å; V963-F1005 HydrophobicContact CB-CE1 4.37Å; V963-F1005 HydrophobicContact CG1-CD1 3.93Å; V963-F1005 HydrophobicContact CG1-CE1 3.77Å; V963-F1005 HydrophobicContact CG1-CZ 4.25Å; V963-F1005 HydrophobicContact CG2-CE1 3.68Å; V963-F1005 HydrophobicContact CG2-CZ 3.95Å; Y965-F1005 HydrophobicContact CE1-CB 4.46Å; Y965-F1005 VanDerWaalsContact OH-CD1 3.3Å; Y965-F1005 WeakPolarHBondContact OH-CD1 3.33Å; I996-F1005 HydrophobicContact CD1-CD2 4.11Å; I996-F1005 HydrophobicContact CD1-CE2 4.09Å; I1001-F1005 HydrophobicContact CG2-CD2 3.96Å; I1001-F1005 HydrophobicContact CG2-CE1 4.37Å; I1001-F1005 HydrophobicContact CG2-CE2 3.27Å; I1001-F1005 HydrophobicContact CG2-CZ 3.52Å; I1001-F1005 WeakPolarHBondContact O-CD2 3.47Å; I1001-F1005 WeakPolarHBondContact O-CG 3.3Å; I1001-F1005 PolarHBondContact O-N 3.26Å; I1001-F1005 VanDerWaalsContact O-N 3.12Å; K1002-F1005 PolarHBondContact O-N 3.22Å; K1002-F1005 VanDerWaalsContact O-N 3.11Å; Q1003-F1005 VanDerWaalsContact C-N 3.33Å; Q1003-F1005 PolarHBondContact O-N 3.13Å; F1005-L1009 VanDerWaalsContact O-CB 3.29Å; F1005-L1009 WeakPolarHBondContact O-CB 3.48Å; F1005-L1009 PolarHBondContact O-N 3.26Å
1006	E	85.3	Confident	78	Confident	69 Å²	69	58.9 Å²	58.9	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-65.8	-42.6	170.6	-71.7	-167.3	139.4	0	0	111.5	K944 K1002 Q1003 S1010	K944-E1006 VanDerWaalsContact CE-OE1 3.25Å; K944-E1006 WeakPolarHBondContact CE-OE1 3.23Å; K944-E1006 IonicContact NZ-OE1 3.51Å; K944-E1006 PolarHBondContact NZ-OE1 3.19Å; K1002-E1006 WeakPolarHBondContact O-CG 3.42Å; K1002-E1006 PolarHBondContact O-N 3.01Å; Q1003-E1006 PolarHBondContact O-N 3.16Å; E1006-S1010 VanDerWaalsContact O-CB 3.27Å; E1006-S1010 WeakPolarHBondContact O-CB 3.27Å; E1006-S1010 PolarHBondContact O-N 3.38Å
1007	D	82.9	Confident	75.8	Confident	76 Å²	76	63.7 Å²	63.7	41%	0.406	34%	0.338	S	S	.	.	H	α-helix	trans	-63.4	-45	176.2	-69.8	-6.8	0	0	0	110.1	Q1003 K1004 S1010 L1011	Q1003-D1007 PolarHBondContact NE2-OD1 3.37Å; Q1003-D1007 WeakPolarHBondContact O-CB 3.49Å; Q1003-D1007 PolarHBondContact O-N 3.39Å; K1004-D1007 PolarHBondContact O-N 2.88Å; D1007-S1010 CarbonylContact O-C 3.54Å; D1007-S1010 WeakPolarHBondContact O-CB 3.41Å; D1007-S1010 PolarHBondContact O-N 3.28Å; D1007-S1010 PolarHBondContact O-OG 3.04Å; D1007-L1011 WeakPolarHBondContact O-CB 3.34Å; D1007-L1011 VanDerWaalsContact O-CG 3.32Å; D1007-L1011 WeakPolarHBondContact O-CG 3.47Å; D1007-L1011 PolarHBondContact O-N 2.95Å
1008	A	83.6	Confident	74.3	Confident	5 Å²	5	60.5 Å²	60.5	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-63.6	-46.3	176.3	0	0	0	0	0	113.1	Y965 K1004 S1010 L1011 I1012	Y965-A1008 HydrophobicContact CE1-CB 4.19Å; Y965-A1008 VanDerWaalsContact OH-CB 3.28Å; Y965-A1008 WeakPolarHBondContact OH-CB 3.4Å; K1004-A1008 VanDerWaalsContact O-CB 3.28Å; K1004-A1008 WeakPolarHBondContact O-CB 3.44Å; K1004-A1008 PolarHBondContact O-N 2.99Å; A1008-S1010 VanDerWaalsContact C-N 3.28Å; A1008-S1010 PolarHBondContact O-N 3.25Å; A1008-L1011 CarbonylContact O-C 3.27Å; A1008-L1011 WeakPolarHBondContact O-CA 3.35Å; A1008-L1011 WeakPolarHBondContact O-CB 3.49Å; A1008-L1011 PolarHBondContact O-N 3.43Å; A1008-I1012 WeakPolarHBondContact O-CG1 3.5Å; A1008-I1012 PolarHBondContact O-N 3.06Å
1009	L	84.8	Confident	72.1	Confident	11 Å²	11	56.6 Å²	56.6	6%	0.058	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-40.1	172.5	-177.8	65	0	0	0	110.9	E945 Y946 Y965 F1005 L1011 I1012 H1013	E945-L1009 HydrophobicContact CB-CD1 4.35Å; Y946-L1009 HydrophobicContact CD1-CD2 4.47Å; Y965-L1009 HydrophobicContact CD1-CB 4.11Å; Y965-L1009 HydrophobicContact CD1-CD1 4.12Å; Y965-L1009 HydrophobicContact CE1-CB 4.13Å; F1005-L1009 VanDerWaalsContact O-CB 3.29Å; F1005-L1009 WeakPolarHBondContact O-CB 3.48Å; F1005-L1009 PolarHBondContact O-N 3.26Å; L1009-L1011 VanDerWaalsContact C-N 3.3Å; L1009-L1011 PolarHBondContact O-N 3.02Å; L1009-I1012 PolarHBondContact O-N 2.75Å; L1009-H1013 WeakPolarHBondContact O-CB 3.38Å; L1009-H1013 PolarHBondContact O-N 2.86Å
1010	S	81.7	Confident	70	Confident	54 Å²	54	55.1 Å²	55.1	38%	0.378	29%	0.286	S	S	.	.	H	α-helix	trans	-66.6	-30.2	173.5	89.9	0	0	0	0	112.6	E1006 D1007 A1008 S1014	E1006-S1010 VanDerWaalsContact O-CB 3.27Å; E1006-S1010 WeakPolarHBondContact O-CB 3.27Å; E1006-S1010 PolarHBondContact O-N 3.38Å; D1007-S1010 CarbonylContact O-C 3.54Å; D1007-S1010 WeakPolarHBondContact O-CB 3.41Å; D1007-S1010 PolarHBondContact O-N 3.28Å; D1007-S1010 PolarHBondContact O-OG 3.04Å; A1008-S1010 VanDerWaalsContact C-N 3.28Å; A1008-S1010 PolarHBondContact O-N 3.25Å; S1010-S1014 WeakPolarHBondContact O-CA 3.38Å; S1010-S1014 WeakPolarHBondContact O-CB 3.33Å; S1010-S1014 PolarHBondContact O-N 3.1Å; S1010-S1014 PolarHBondContact O-OG 3.37Å
1011	L	75.8	Confident	67.8	Low	66 Å²	66	54.7 Å²	54.7	35%	0.346	28%	0.283	S	S	.	.	H	α-helix	trans	-74.2	-33.8	175	-77	171.1	0	0	0	111.9	D1007 A1008 L1009 A1015 R1018	D1007-L1011 WeakPolarHBondContact O-CB 3.34Å; D1007-L1011 VanDerWaalsContact O-CG 3.32Å; D1007-L1011 WeakPolarHBondContact O-CG 3.47Å; D1007-L1011 PolarHBondContact O-N 2.95Å; A1008-L1011 CarbonylContact O-C 3.27Å; A1008-L1011 WeakPolarHBondContact O-CA 3.35Å; A1008-L1011 WeakPolarHBondContact O-CB 3.49Å; A1008-L1011 PolarHBondContact O-N 3.43Å; L1009-L1011 VanDerWaalsContact C-N 3.3Å; L1009-L1011 PolarHBondContact O-N 3.02Å; L1011-A1015 WeakPolarHBondContact O-CB 3.26Å; L1011-A1015 PolarHBondContact O-N 2.98Å; L1011-R1018 PolarHBondContact O-NH2 3.36Å
1012	I	78.4	Confident	65.7	Low	7 Å²	7	56.2 Å²	56.2	4%	0.036	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-59.4	169.3	-65.3	164.3	0	0	0	109.1	H763 C900 Y965 A1008 L1009 S1014 A1015 W1016	H763-I1012 HydrophobicContact CB-CD1 3.81Å; C900-I1012 HydrophobicContact CB-CD1 4.07Å; C900-I1012 HydrophobicContact CB-CG1 4.42Å; Y965-I1012 HydrophobicContact CD1-CD1 4.1Å; Y965-I1012 HydrophobicContact CD2-CD1 4.02Å; Y965-I1012 HydrophobicContact CG-CD1 3.7Å; A1008-I1012 WeakPolarHBondContact O-CG1 3.5Å; A1008-I1012 PolarHBondContact O-N 3.06Å; L1009-I1012 PolarHBondContact O-N 2.75Å; I1012-S1014 VanDerWaalsContact C-N 3.27Å; I1012-S1014 PolarHBondContact O-N 2.65Å; I1012-A1015 WeakPolarHBondContact O-CB 3.37Å; I1012-A1015 PolarHBondContact O-N 3.13Å; I1012-W1016 HydrophobicContact CG2-CZ2 4.01Å; I1012-W1016 PolarHBondContact O-N 3.37Å
1013	H	75.1	Confident	63.2	Low	75 Å²	75	59.5 Å²	59.5	35%	0.347	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-34.4	179.4	-68.7	171	0	0	0	113.4	E945 L1009 W1016 Q1017	E945-H1013 VanDerWaalsContact CD-NE2 3.31Å; E945-H1013 IonicContact OE1-NE2 3.03Å; E945-H1013 IonicContact OE2-NE2 2.85Å; E945-H1013 PolarHBondContact OE2-NE2 3.14Å; L1009-H1013 WeakPolarHBondContact O-CB 3.38Å; L1009-H1013 PolarHBondContact O-N 2.86Å; H1013-W1016 CarbonylContact O-C 3.23Å; H1013-W1016 WeakPolarHBondContact O-CB 3.24Å; H1013-W1016 PolarHBondContact O-N 2.86Å; H1013-Q1017 WeakPolarHBondContact O-CG 3.25Å; H1013-Q1017 PolarHBondContact O-N 2.95Å
1014	S	62.4	Low	60.8	Low	31 Å²	31	66.4 Å²	66.4	22%	0.217	34%	0.342	C	S	.	.	H	α-helix	trans	-87.3	-14.4	176.2	70.5	0	0	0	0	113.9	S1010 I1012 W1016 Q1017 R1018	S1010-S1014 WeakPolarHBondContact O-CA 3.38Å; S1010-S1014 WeakPolarHBondContact O-CB 3.33Å; S1010-S1014 PolarHBondContact O-N 3.1Å; S1010-S1014 PolarHBondContact O-OG 3.37Å; I1012-S1014 VanDerWaalsContact C-N 3.27Å; I1012-S1014 PolarHBondContact O-N 2.65Å; S1014-W1016 VanDerWaalsContact C-N 3.34Å; S1014-Q1017 CarbonylContact O-C 3.56Å; S1014-Q1017 PolarHBondContact O-N 3.36Å; S1014-R1018 VanDerWaalsContact O-CB 3.25Å; S1014-R1018 WeakPolarHBondContact O-CB 3.45Å; S1014-R1018 WeakPolarHBondContact O-CG 3.5Å; S1014-R1018 PolarHBondContact O-N 3.47Å; S1014-R1018 PolarHBondContact O-NE 2.99Å; S1014-R1018 PolarHBondContact OG-NH2 2.84Å
1015	A	55.4	Low	58.2	Low	47 Å²	47	66.6 Å²	66.6	39%	0.388	36%	0.363	S	S	.	.	H	α-helix	trans	-66.3	-44.4	160.2	0	0	0	0	0	108.8	L1011 I1012 Q1017 R1018 S1019	L1011-A1015 WeakPolarHBondContact O-CB 3.26Å; L1011-A1015 PolarHBondContact O-N 2.98Å; I1012-A1015 WeakPolarHBondContact O-CB 3.37Å; I1012-A1015 PolarHBondContact O-N 3.13Å; A1015-Q1017 PolarHBondContact O-N 3.15Å; A1015-R1018 PolarHBondContact O-N 2.64Å; A1015-S1019 PolarHBondContact O-OG 3.46Å
1016	W	51.4	Low	55.5	Low	43 Å²	43	77.9 Å²	77.9	16%	0.163	41%	0.405	C	S	.	.	H	α-helix	trans	-63.2	-20.4	172.3	-53.9	0.5	0	0	0	113.6	L637 L639 H763 I1012 H1013 S1014 S1019	L637-W1016 VanDerWaalsContact CD2-NE1 3.34Å; L639-W1016 HydrophobicContact CD1-CB 4.3Å; L639-W1016 WeakPolarHBondContact CD2-O 3.43Å; H763-W1016 AromaticContact CE1-CZ2 3.96Å; I1012-W1016 HydrophobicContact CG2-CZ2 4.01Å; I1012-W1016 PolarHBondContact O-N 3.37Å; H1013-W1016 CarbonylContact O-C 3.23Å; H1013-W1016 WeakPolarHBondContact O-CB 3.24Å; H1013-W1016 PolarHBondContact O-N 2.86Å; S1014-W1016 VanDerWaalsContact C-N 3.34Å; W1016-S1019 PolarHBondContact O-OG 3.16Å; W1016-S1019 VanDerWaalsContact O-OG 3.07Å
1017	Q	38	Very low	52.7	Low	116 Å²	116	79.7 Å²	79.7	54%	0.542	43%	0.432	S	S	.	.	H	α-helix	trans	-101.5	-12.5	173.8	-68.6	177.6	-22.6	0	0	115	H1013 S1014 A1015 D1020 S1021	H1013-Q1017 WeakPolarHBondContact O-CG 3.25Å; H1013-Q1017 PolarHBondContact O-N 2.95Å; S1014-Q1017 CarbonylContact O-C 3.56Å; S1014-Q1017 PolarHBondContact O-N 3.36Å; A1015-Q1017 PolarHBondContact O-N 3.15Å; Q1017-D1020 VanDerWaalsContact C-N 3.35Å; Q1017-D1020 CarbonylContact O-C 3.59Å; Q1017-D1020 VanDerWaalsContact O-C 3.27Å; Q1017-D1020 VanDerWaalsContact O-CA 3.28Å; Q1017-D1020 WeakPolarHBondContact O-CA 3.48Å; Q1017-D1020 WeakPolarHBondContact O-CB 3.41Å; Q1017-D1020 PolarHBondContact O-N 2.92Å; Q1017-S1021 PolarHBondContact O-N 3.03Å
1018	R	42.8	Very low	50.3	Low	108 Å²	108	81.6 Å²	81.6	41%	0.408	45%	0.451	S	S	.	.	H	α-helix	trans	-79.2	-26.3	178.1	-85.3	172.7	-90.7	132.8	-2.9	111.6	K654 L1011 S1014 A1015 D1020	K654-R1018 PolarHBondContact NZ-O 2.8Å; L1011-R1018 PolarHBondContact O-NH2 3.36Å; S1014-R1018 VanDerWaalsContact O-CB 3.25Å; S1014-R1018 WeakPolarHBondContact O-CB 3.45Å; S1014-R1018 WeakPolarHBondContact O-CG 3.5Å; S1014-R1018 PolarHBondContact O-N 3.47Å; S1014-R1018 PolarHBondContact O-NE 2.99Å; S1014-R1018 PolarHBondContact OG-NH2 2.84Å; A1015-R1018 PolarHBondContact O-N 2.64Å; R1018-D1020 PolarHBondContact O-N 3.27Å
1019	S	37.4	Very low	47.5	Very low	35 Å²	35	92.7 Å²	92.7	25%	0.245	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.2	154.6	35.3	0	0	0	0	113.6	L639 K654 A1015 W1016	L639-S1019 WeakPolarHBondContact CB-OG 3.36Å; L639-S1019 WeakPolarHBondContact CD2-OG 3.36Å; K654-S1019 WeakPolarHBondContact CB-O 3.2Å; K654-S1019 WeakPolarHBondContact CD-O 3.39Å; K654-S1019 WeakPolarHBondContact CE-O 3.29Å; K654-S1019 VanDerWaalsContact CG-O 3.26Å; K654-S1019 WeakPolarHBondContact CG-O 3.18Å; K654-S1019 PolarHBondContact NZ-O 3.22Å; A1015-S1019 PolarHBondContact O-OG 3.46Å; W1016-S1019 PolarHBondContact O-OG 3.16Å; W1016-S1019 VanDerWaalsContact O-OG 3.07Å
1020	D	34.8	Very low	44.6	Very low	46 Å²	46	99.2 Å²	99.2	25%	0.246	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	17.7	-174.1	-155.6	-2.9	0	0	0	114	Y641 Q1017 R1018 L1022	Y641-D1020 WeakPolarHBondContact OH-CB 3.18Å; Y641-D1020 PolarHBondContact OH-OD1 2.83Å; Y641-D1020 PolarHBondContact OH-OD2 2.93Å; Q1017-D1020 VanDerWaalsContact C-N 3.35Å; Q1017-D1020 CarbonylContact O-C 3.59Å; Q1017-D1020 VanDerWaalsContact O-C 3.27Å; Q1017-D1020 VanDerWaalsContact O-CA 3.28Å; Q1017-D1020 WeakPolarHBondContact O-CA 3.48Å; Q1017-D1020 WeakPolarHBondContact O-CB 3.41Å; Q1017-D1020 PolarHBondContact O-N 2.92Å; R1018-D1020 PolarHBondContact O-N 3.27Å; D1020-L1022 VanDerWaalsContact C-N 3.26Å; D1020-L1022 PolarHBondContact O-N 3.02Å
1021	S	31.8	Very low	42.1	Very low	56 Å²	56	101.6 Å²	101.6	39%	0.392	54%	0.541	S	S	.	.			trans	-76.6	59.8	-170.9	78.4	0	0	0	0	115	K654 Q1017 C1023	K654-S1021 PolarHBondContact NZ-OG 2.71Å; Q1017-S1021 PolarHBondContact O-N 3.03Å; S1021-C1023 PolarHBondContact O-N 2.74Å
1022	L	36.5	Very low	39.9	Very low	101 Å²	101	109.4 Å²	109.4	53%	0.529	57%	0.566	S	S	.	*			trans	-61.4	-23.8	167.7	-74.7	167.7	0	0	0	111.9	P660 D1020 R1024	P660-L1022 HydrophobicContact CB-CD2 4.35Å; D1020-L1022 VanDerWaalsContact C-N 3.26Å; D1020-L1022 PolarHBondContact O-N 3.02Å; L1022-R1024 PolarHBondContact O-N 3.21Å; L1022-R1024 VanDerWaalsContact O-N 3.16Å
1023	C	32.1	Very low	37.6	Very low	126 Å²	126	119.1 Å²	119.1	85%	0.851	63%	0.632	S	S	*	*			trans	-87.1	65.8	179.9	-62.4	0	0	0	0	114.3	S1021	S1021-C1023 PolarHBondContact O-N 2.74Å
1024	R	32.7	Very low	35.8	Very low	243 Å²	243	121.3 Å²	121.3	92%	0.917	65%	0.646	S	S	*	*			trans	-127.9	49.6	165.3	-137.1	-178.9	-158.5	-131.9	5.3	114	L1022	L1022-R1024 PolarHBondContact O-N 3.21Å; L1022-R1024 VanDerWaalsContact O-N 3.16Å
1025	G	31.3	Very low	34.4	Very low	72 Å²	72	126.1 Å²	126.1	74%	0.742	67%	0.669	S	S	*	*	S	Bend	trans	-146.1	0.9	-177.4	0	0	0	0	0	118.5
1026	R	31.2	Very low	33.2	Very low	249 Å²	249	130.4 Å²	130.4	94%	0.94	68%	0.684	S	S	*	*	S	Bend	trans	-155.8	29.6	-178.2	-146.9	170.3	-79.7	-112.3	3.9	117.2
1027	A	27.7	Very low	32.1	Very low	106 Å²	106	135.6 Å²	135.6	88%	0.876	72%	0.715	S	S	*	*	S	Bend	trans	-115.9	35	-174.4	0	0	0	0	0	114.9
1028	S	31.4	Very low	31.8	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	73%	0.726	S	S	*	*	S	Bend	trans	-155.9	45.6	174.1	72.2	0	0	0	0	114.1
1029	R	24.9	Very low	31	Very low	238 Å²	238	138.7 Å²	138.7	90%	0.898	75%	0.747	S	S	*	*			trans	-161.1	93	167.3	-124.7	176.6	-175.9	-172.9	-0.6	113.7
1030	D	24.5	Very low	30.6	Very low	149 Å²	149	146.1 Å²	146.1	80%	0.797	78%	0.783	S	S	*	*				-102.3	141.9	129.7	-92.2	-52.1	0	0	0	105.7
1031	P	28.9	Very low	30.2	Very low	103 Å²	103	153.8 Å²	153.8	67%	0.669	82%	0.824	S	S	*	*				-138.3	136.6	70.5	36	-19.6	0	0	0	116.4
1032	W	29.6	Very low	30.1	Very low	231 Å²	231	162 Å²	162	88%	0.875	86%	0.86	S	S	*	*			trans	42.2	82.7	135.1	-61.4	85.5	0	0	0	118
1033	C	30.4	Very low	29.5	Very low	210 Å²	210	167.5 Å²	167.5	100%	1.419	89%	0.89	S	S	*	*			trans	-172.1	0	139.1	-104.5	0	0	0	0	109.9

Retrieved 1,033 of 1,033 residues in 275.2 ms (Link to these results)

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