A0A3Q0KQV6_SCHMA Loading...

DNA-directed RNA polymerase subunit AlphaSync

DNA-dependent RNA polymerase catalyzes the transcription of DNA into RNA using the four ribonucleoside triphosphates as substrates.

AlphaFold DB , UniProt , Accession A0A3Q0KQV6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,379 aa.

						>A0A3Q0KQV6_SCHMA|A0A3Q0KQV6
MPSLYKPPDLPRIVENIKFQLCSEGDLKRLSHVQVLKCLLYAEGQSNRRALDYGLLDPRLGANKRDELCATCGLDYQTCIGHWGYFDLPTPIYHVGYTWHIVKILQTICKTCSRVLLPEQQRARFSISCSNPSLDYVHKKQLRKAIHKLSSRVHVCPFCSALNGVVTKGTSLSYVVHDIFRHAKAKVDEYVNEFAKVITENTDLAPVVRKGLEIIRPGKALQLFSKIPEEDLPLLLMPFDSQWTTHPRNLIVQRVPVCPSAIRPSVVSEVRSGTNEDDLTQMYQWILAQAATIEEDIGEADQIACLDNLHAEFARLINSQQSGLPPVQDHKFMRGLLQRLAGKHGRFRGSLLGKRTNFTARTVISPDPNMRIDEVCIPVHCAKLLTYPERVTDFNLNFLRSLVLNGPNNYPGAMFVSYKLRGERKRQAEASGNSDVVKRFLASERAREDVAKYLQSGDIVERHLLDDDIVLFNRQPSLHRVSIQAFRAVVKPFRTFRFNPCCCTPFNADFDGDEMNIHLPQTEAARAEAKHLMLSLKNIVSPKNGEPLISPIQDLITATHLLTLKDVFLNRDQACTLAAQLLAGNHLGRLLSLPKPAILWPVALWTGKQIFGLILSPHPSTGIKVNLRVPTKSMYSSKGQEMCPNDGFVLIQNSELLAGCVDKKLLGGGSKSSIFYTLLRDYGREACADAMWRLGRIALFFLAHRGFSIGLGEVMPSSDLVASKTALISRGFATCDDYINQYQMNTLVCNPGCSMEDTLESNISQELSKIRDEAGAACKRQLHPSNSPLVMAQSGSKGSFLNISQMIACVGQQVIGGKRVPDVINGRSLVHFPPGSRTPEAKGFVGNSFYSGLSPSEFFFHAMSGREGLTDTAVKTADTGYMQRRLVKFLEDLAVAYDDTVRDSRGDIIQFRYGSDGLDPLEMETDTFPVNFVKEMEHIRTSYDCPHEVGMSAEELELAVEVVFQLDAFRHLDSRLCSAIKEFIHNSVCPRIRKWQEWCTEHANGSNLINQNERLTRTQLRIFLTHVKEKYEKALIEPGTAVGALCGQSVGEPATQMTLKTFHFAGVASMNITQGVPRMREIVNAAARIKTPLICVTLTDPFSASLARQVKLSIEPTRLADISLSLSQCLTPEYVYVAIKLDKKRMDRRGITTPQVATAIQTTKLKKTKLSRVTYSKDYIFVYPVDLNALETVVKLVEDVIVKGIPGVSRVVIQQDKGEHIIFVEGARLREVMCIPGVVAERTRSNNILEVEQVLGVEAARRVVIDELLAVMEGHGVEVNVRHVMLLADVMTNKGEVCGYQRTGMAKAKNSVLCLASFERTGDHLFEAAYHCQDDQLTGVTENIILGNPTRVGTGTFDLLSDRWEKNLQLDMKPTLLNF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	69.5	Low	231 Å²	231	144.3 Å²	144.3	100%	1.138	78%	0.78	S	S	*	*				0	134.5	0	-71.2	-159.3	173.3	0	0	108.3	S3	M1-S3 PolarHBondContact O-N 2.82Å
2	P	54.8	Low	70.7	Confident	126 Å²	126	152.2 Å²	152.2	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.9	168.2	26.9	-29.9	0	0	0	107.7	L4	P2-L4 PolarHBondContact O-N 3.43Å
3	S	64.3	Low	71.7	Confident	114 Å²	114	149.5 Å²	149.5	80%	0.797	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-57.9	122.3	175.3	52.2	0	0	0	0	108.5	M1 Y5	M1-S3 PolarHBondContact O-N 2.82Å; S3-Y5 PolarHBondContact O-N 3.13Å
4	L	74	Confident	73	Confident	170 Å²	170	143.9 Å²	143.9	89%	0.89	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-46.8	127.4	169	-92.8	147.3	0	0	0	108.7	P2 K6	P2-L4 PolarHBondContact O-N 3.43Å; L4-K6 PolarHBondContact O-N 3.2Å
5	Y	79	Confident	74	Confident	190 Å²	190	144.5 Å²	144.5	75%	0.745	75%	0.748	S	S	*	*			trans	-58.1	113.3	178.5	174.5	-100.6	0	0	0	108.9	S3 P7	S3-Y5 PolarHBondContact O-N 3.13Å; Y5-P7 HydrophobicContact CE1-CB 4.04Å
6	K	75.4	Confident	75.1	Confident	174 Å²	174	139.9 Å²	139.9	76%	0.757	73%	0.726	S	S	*	*			trans	-100.5	115.9	170.4	-160.7	179.3	-178.2	-171.6	0	106.4	L4	L4-K6 PolarHBondContact O-N 3.2Å
7	P	74.9	Confident	76	Confident	83 Å²	83	134.4 Å²	134.4	54%	0.539	70%	0.697	S	S	.	*			trans	-58.3	142.9	178	23	-30.8	0	0	0	109.3	Y5	Y5-P7 HydrophobicContact CE1-CB 4.04Å
8	P	75	Confident	76.8	Confident	84 Å²	84	131.2 Å²	131.2	55%	0.545	68%	0.677	S	S	.	*			trans	-60.7	143.5	176.4	24.9	-32.2	0	0	0	109.9	L10	P8-L10 VanDerWaalsContact C-N 3.28Å; P8-L10 HydrophobicContact CG-CG 4.43Å; P8-L10 PolarHBondContact O-N 3.37Å
9	D	72.6	Confident	77.5	Confident	159 Å²	159	126.2 Å²	126.2	85%	0.85	65%	0.649	S	S	*	*			trans	-66.8	89.8	174.1	-76.4	-34	0	0	0	109.2
10	L	76.1	Confident	78	Confident	131 Å²	131	122.9 Å²	122.9	69%	0.686	63%	0.631	S	S	*	*			trans	-80.6	132.3	176.3	-72	165.8	0	0	0	109.3	P8 R12	P8-L10 VanDerWaalsContact C-N 3.28Å; P8-L10 HydrophobicContact CG-CG 4.43Å; P8-L10 PolarHBondContact O-N 3.37Å; L10-R12 PolarHBondContact O-N 3.18Å
11	P	77.1	Confident	78.6	Confident	125 Å²	125	117.3 Å²	117.3	81%	0.812	60%	0.602	S	S	*	*			trans	-61.3	137.6	174.6	26.1	-32.4	0	0	0	110
12	R	83.2	Confident	80.7	Confident	239 Å²	239	109.4 Å²	109.4	90%	0.902	57%	0.569	S	S	*	*			trans	-115.2	148.1	176.1	-62.9	-170.7	-178.9	-167.7	-0.1	110	L10	L10-R12 PolarHBondContact O-N 3.18Å
13	I	84.6	Confident	82.2	Confident	118 Å²	118	104.5 Å²	104.5	61%	0.605	54%	0.537	S	S	*	.			trans	-100.4	139.5	175.1	-59.7	175.3	0	0	0	108.1
14	V	89.5	Confident	83.3	Confident	70 Å²	70	101.8 Å²	101.8	42%	0.424	51%	0.512	S	S	.	.			trans	-82.3	119.1	175	-171.5	0	0	0	0	108.3	I17 L1337 N1348	V14-I17 HydrophobicContact CG1-CG1 4.23Å; V14-L1337 HydrophobicContact CB-CD1 4.02Å; V14-L1337 HydrophobicContact CG1-CD1 3.6Å; V14-L1337 VanDerWaalsContact O-CD1 3.3Å; V14-L1337 WeakPolarHBondContact O-CD1 3.48Å; V14-N1348 PolarHBondContact O-ND2 3.05Å
15	E	88.6	Confident	83.9	Confident	153 Å²	153	95.4 Å²	95.4	72%	0.715	49%	0.488	S	S	*	.			trans	-91	-41.7	-179	-66.4	-174.8	161.5	0	0	113	L1337	E15-L1337 WeakPolarHBondContact O-CB 3.13Å; E15-L1337 WeakPolarHBondContact O-CG 3.2Å; E15-L1337 PolarHBondContact O-N 3.1Å; E15-L1337 VanDerWaalsContact O-N 3.07Å
16	N	90.5	Very high	84.3	Confident	72 Å²	72	88.5 Å²	88.5	39%	0.385	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159.6	179.3	64.4	-5.3	0	0	0	112.4	D1334 D1335	N16-D1334 WeakPolarHBondContact CB-OD1 3.46Å; N16-D1334 PolarHBondContact ND2-OD1 3.23Å; N16-D1334 PolarHBondContact ND2-OD2 3.02Å; N16-D1335 CarbonylContact C-O 3.57Å; N16-D1335 VanDerWaalsContact CA-O 3.31Å; N16-D1335 WeakPolarHBondContact CA-O 3.26Å
17	I	91.4	Very high	85	Confident	46 Å²	46	81.3 Å²	81.3	24%	0.236	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.6	173.9	-67.8	175.8	0	0	0	109.1	V14 F19 L1313 D1335 L1337 L1346	V14-I17 HydrophobicContact CG1-CG1 4.23Å; I17-F19 HydrophobicContact CG2-CD2 4.34Å; I17-F19 HydrophobicContact CG2-CE2 3.94Å; I17-F19 HydrophobicContact CG2-CZ 4.07Å; I17-L1313 HydrophobicContact CD1-CD1 4.04Å; I17-D1335 PolarHBondContact N-O 2.96Å; I17-D1335 WeakPolarHBondContact O-CB 3.19Å; I17-D1335 PolarHBondContact O-N 3.48Å; I17-L1337 HydrophobicContact CD1-CD1 4.37Å; I17-L1337 HydrophobicContact CD1-CD2 4.08Å; I17-L1337 HydrophobicContact CG1-CD1 4.16Å; I17-L1337 HydrophobicContact CG1-CD2 4.25Å; I17-L1346 HydrophobicContact CD1-CD1 3.74Å; I17-L1346 HydrophobicContact CD1-CD2 3.98Å; I17-L1346 HydrophobicContact CD1-CG 4.43Å
18	K	89.3	Confident	85.8	Confident	77 Å²	77	82.9 Å²	82.9	34%	0.335	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117	174.9	-160.1	169.1	-175.3	176.1	0	110.8	W243 C1332 D1334	K18-W243 HydrophobicContact CD-CB 4.22Å; K18-W243 HydrophobicContact CD-CD2 4.31Å; K18-W243 HydrophobicContact CD-CG 3.89Å; K18-W243 VanDerWaalsContact NZ-CD1 3.32Å; K18-C1332 VanDerWaalsContact CE-SG 3.55Å; K18-D1334 HydrophobicContact CG-CB 4.45Å
19	F	90.8	Very high	86.6	Confident	36 Å²	36	88.3 Å²	88.3	16%	0.158	44%	0.441	C	S	.	.			trans	-80.6	140.4	174	-66.1	-90.5	0	0	0	109.7	I17 V1312 L1313 L1325 A1328 C1332 Q1333 D1335	I17-F19 HydrophobicContact CG2-CD2 4.34Å; I17-F19 HydrophobicContact CG2-CE2 3.94Å; I17-F19 HydrophobicContact CG2-CZ 4.07Å; F19-V1312 HydrophobicContact CD2-CB 4.41Å; F19-V1312 HydrophobicContact CD2-CG1 4.42Å; F19-V1312 HydrophobicContact CD2-CG2 4.35Å; F19-V1312 HydrophobicContact CE1-CG1 4.46Å; F19-V1312 HydrophobicContact CE2-CB 3.74Å; F19-V1312 HydrophobicContact CE2-CG1 3.88Å; F19-V1312 HydrophobicContact CE2-CG2 4.12Å; F19-V1312 HydrophobicContact CZ-CB 4.14Å; F19-V1312 HydrophobicContact CZ-CG1 3.9Å; F19-L1313 HydrophobicContact CZ-CD2 4.14Å; F19-L1313 HydrophobicContact CZ-CG 4.44Å; F19-L1325 HydrophobicContact CE1-CD2 3.83Å; F19-L1325 HydrophobicContact CZ-CD2 4.35Å; F19-A1328 HydrophobicContact CB-CB 4.16Å; F19-A1328 HydrophobicContact CD2-CB 4.12Å; F19-A1328 HydrophobicContact CG-CB 4.01Å; F19-C1332 CarbonylContact O-C 3.46Å; F19-C1332 WeakPolarHBondContact O-CA 3.24Å; F19-C1332 PolarHBondContact O-SG 2.99Å; F19-Q1333 PolarHBondContact N-O 3.39Å; F19-D1335 HydrophobicContact CD2-CB 4.39Å; F19-D1335 HydrophobicContact CE2-CB 3.87Å
20	Q	87.6	Confident	87.5	Confident	59 Å²	59	85.1 Å²	85.1	28%	0.276	42%	0.424	S	S	.	.			trans	-150.1	152.6	177.9	-164.8	-166.6	1.5	0	0	111.3	W243 T244	Q20-W243 VanDerWaalsContact OE1-CE3 3.25Å; Q20-T244 PolarHBondContact NE2-O 3.4Å
21	L	89.2	Confident	88.3	Confident	7 Å²	7	79.6 Å²	79.6	4%	0.037	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-74.4	123.2	162.7	-63	171.2	0	0	0	110.2	Y97 M237 N249 L250 A1329	L21-Y97 HydrophobicContact CD2-CD2 4.42Å; L21-Y97 HydrophobicContact CD2-CE1 3.89Å; L21-Y97 HydrophobicContact CD2-CE2 3.64Å; L21-Y97 VanDerWaalsContact CD2-OH 3.24Å; L21-Y97 WeakPolarHBondContact CD2-OH 3.35Å; L21-M237 HydrophobicContact CD1-CE 3.82Å; L21-N249 HydrophobicContact CB-CB 4.07Å; L21-N249 HydrophobicContact CD1-CB 4.44Å; L21-L250 HydrophobicContact CD1-CD2 3.51Å; L21-L250 HydrophobicContact CD1-CG 4.14Å; L21-L250 HydrophobicContact CD2-CD2 4.14Å; L21-A1329 HydrophobicContact CD2-CB 4.35Å
22	C	86.3	Confident	89.1	Confident	64 Å²	64	79.1 Å²	79.1	43%	0.432	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-72.5	131	174.5	-136.9	0	0	0	0	109.9	L27	C22-L27 HydrophobicContact CB-CG 4.11Å
23	S	87.7	Confident	89.6	Confident	23 Å²	23	68 Å²	68	16%	0.161	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-78.7	163.2	170	76.8	0	0	0	0	110.8	G25 D26 L27	S23-G25 PolarHBondContact O-N 3.33Å; S23-D26 VanDerWaalsContact CB-OD2 3.29Å; S23-D26 WeakPolarHBondContact CB-OD2 3.29Å; S23-D26 PolarHBondContact N-OD2 2.65Å; S23-D26 VanDerWaalsContact N-OD2 3.13Å; S23-D26 PolarHBondContact O-N 3.2Å; S23-D26 VanDerWaalsContact O-N 3.11Å; S23-D26 PolarHBondContact OG-N 2.73Å; S23-D26 PolarHBondContact OG-OD1 2.75Å; S23-D26 PolarHBondContact OG-OD2 3.3Å; S23-L27 PolarHBondContact O-N 2.86Å
24	E	85.6	Confident	90.1	Very high	58 Å²	58	65.6 Å²	65.6	27%	0.271	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-35.5	175.1	-74.4	164.4	-158.6	0	0	112.7	D26 K28 Q253 R254	E24-D26 VanDerWaalsContact C-N 3.34Å; E24-K28 PolarHBondContact O-N 3.21Å; E24-Q253 WeakPolarHBondContact OE1-CB 3.49Å; E24-Q253 WeakPolarHBondContact OE1-CG 3.28Å; E24-Q253 PolarHBondContact OE1-NE2 3.45Å; E24-Q253 PolarHBondContact OE2-NE2 3.09Å; E24-R254 HydrophobicContact CG-CB 4.16Å; E24-R254 PolarHBondContact O-NH1 3.34Å
25	G	88	Confident	90.3	Very high	36 Å²	36	62.3 Å²	62.3	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-67.3	-34.9	175.5	0	0	0	0	0	112.3	S23 R29	S23-G25 PolarHBondContact O-N 3.33Å; G25-R29 WeakPolarHBondContact O-CG 3.38Å; G25-R29 PolarHBondContact O-N 3.35Å; G25-R29 VanDerWaalsContact O-N 3.12Å; G25-R29 PolarHBondContact O-NE 3.43Å
26	D	87.5	Confident	90.4	Very high	45 Å²	45	60.4 Å²	60.4	24%	0.241	30%	0.302	C	S	.	.	H	α-helix	trans	-71.5	-44.3	176.1	-56.1	-34.4	0	0	0	111	S23 E24 K28 R29 L30	S23-D26 VanDerWaalsContact CB-OD2 3.29Å; S23-D26 WeakPolarHBondContact CB-OD2 3.29Å; S23-D26 PolarHBondContact N-OD2 2.65Å; S23-D26 VanDerWaalsContact N-OD2 3.13Å; S23-D26 PolarHBondContact O-N 3.2Å; S23-D26 VanDerWaalsContact O-N 3.11Å; S23-D26 PolarHBondContact OG-N 2.73Å; S23-D26 PolarHBondContact OG-OD1 2.75Å; S23-D26 PolarHBondContact OG-OD2 3.3Å; E24-D26 VanDerWaalsContact C-N 3.34Å; D26-K28 VanDerWaalsContact C-N 3.29Å; D26-K28 PolarHBondContact O-N 3.41Å; D26-R29 PolarHBondContact O-N 2.92Å; D26-R29 VanDerWaalsContact O-N 3.11Å; D26-R29 IonicContact OD1-CZ 2.73Å; D26-R29 IonicContact OD1-NE 3.7Å; D26-R29 IonicContact OD1-NH2 3.65Å; D26-R29 PolarHBondContact OD1-NH2 3.34Å; D26-L30 WeakPolarHBondContact O-CB 3.43Å; D26-L30 PolarHBondContact O-N 3.29Å
27	L	90.2	Very high	90.3	Very high	23 Å²	23	61.1 Å²	61.1	12%	0.12	30%	0.302	C	S	.	.	H	α-helix	trans	-56.7	-43.3	175.4	-80.8	164.6	0	0	0	112.1	C22 S23 L30 S31 P256	C22-L27 HydrophobicContact CB-CG 4.11Å; S23-L27 PolarHBondContact O-N 2.86Å; L27-L30 PolarHBondContact O-N 2.81Å; L27-S31 WeakPolarHBondContact O-CB 3.25Å; L27-S31 PolarHBondContact O-N 3.34Å; L27-S31 VanDerWaalsContact O-N 3.12Å; L27-S31 PolarHBondContact O-OG 3.13Å; L27-P256 HydrophobicContact CD2-CB 3.74Å; L27-P256 HydrophobicContact CD2-CG 4Å
28	K	91.1	Very high	90	Very high	115 Å²	115	61.1 Å²	61.1	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-66.4	-39	176.6	-172.1	170.4	-176.6	174.5	0	112.1	E24 D26 S31 Y85	E24-K28 PolarHBondContact O-N 3.21Å; D26-K28 VanDerWaalsContact C-N 3.29Å; D26-K28 PolarHBondContact O-N 3.41Å; K28-S31 PolarHBondContact O-N 3.47Å; K28-Y85 WeakPolarHBondContact CE-OH 3.45Å; K28-Y85 HydrophobicContact CG-CE1 4.08Å
29	R	91.9	Very high	89.8	Confident	198 Å²	198	61.7 Å²	61.7	75%	0.747	31%	0.311	S	S	*	.	H	α-helix	trans	-67.5	-34.8	176.2	-78.7	-175.6	-79	179.4	-5.5	112.9	G25 D26	G25-R29 WeakPolarHBondContact O-CG 3.38Å; G25-R29 PolarHBondContact O-N 3.35Å; G25-R29 VanDerWaalsContact O-N 3.12Å; G25-R29 PolarHBondContact O-NE 3.43Å; D26-R29 PolarHBondContact O-N 2.92Å; D26-R29 VanDerWaalsContact O-N 3.11Å; D26-R29 IonicContact OD1-CZ 2.73Å; D26-R29 IonicContact OD1-NE 3.7Å; D26-R29 IonicContact OD1-NH2 3.65Å; D26-R29 PolarHBondContact OD1-NH2 3.34Å
30	L	90.6	Very high	89.5	Confident	92 Å²	92	61.1 Å²	61.1	48%	0.482	31%	0.31	S	S	.	.	H	α-helix	trans	-73.8	-29.7	179	-164	91.6	0	0	0	112.5	D26 L27 W83	D26-L30 WeakPolarHBondContact O-CB 3.43Å; D26-L30 PolarHBondContact O-N 3.29Å; L27-L30 PolarHBondContact O-N 2.81Å; L30-W83 HydrophobicContact CD2-CB 4.09Å; L30-W83 HydrophobicContact CD2-CD2 3.98Å; L30-W83 HydrophobicContact CD2-CG 3.63Å; L30-W83 HydrophobicContact CG-CG 4.38Å
31	S	94	Very high	89.4	Confident	16 Å²	16	60.5 Å²	60.5	11%	0.112	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	139.6	-170.1	-59.2	0	0	0	0	112.6	L27 K28 W83 G84 Y85	L27-S31 WeakPolarHBondContact O-CB 3.25Å; L27-S31 PolarHBondContact O-N 3.34Å; L27-S31 VanDerWaalsContact O-N 3.12Å; L27-S31 PolarHBondContact O-OG 3.13Å; K28-S31 PolarHBondContact O-N 3.47Å; S31-W83 CarbonylContact C-O 3.48Å; S31-W83 WeakPolarHBondContact CA-O 3.49Å; S31-G84 PolarHBondContact OG-O 3.25Å; S31-Y85 VanDerWaalsContact CB-CD1 3.45Å
32	H	93.4	Very high	88.9	Confident	115 Å²	115	61.7 Å²	61.7	53%	0.532	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-27.9	177.8	-79.1	-84	0	0	0	113.7	H82 W83	H32-H82 HydrophobicContact CB-CB 4.49Å; H32-H82 AromaticContact CD2-CG 3.99Å; H32-H82 AromaticContact CD2-ND1 3.66Å; H32-H82 AromaticContact NE2-ND1 3.57Å; H32-W83 PolarHBondContact N-O 3.41Å
33	V	93.4	Very high	88.1	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.03	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	135.4	-177.1	168.7	0	0	0	0	110.8	V35 Y53 R59 L60 G84 Y85	V33-V35 HydrophobicContact CG1-CG2 4.46Å; V33-Y53 HydrophobicContact CG1-CD1 4.48Å; V33-R59 HydrophobicContact CG2-CB 3.47Å; V33-R59 VanDerWaalsContact CG2-CB 3.47Å; V33-R59 HydrophobicContact CG2-CG 4.17Å; V33-L60 HydrophobicContact CB-CD2 4.13Å; V33-G84 CarbonylContact O-C 3.39Å; V33-G84 WeakPolarHBondContact O-CA 3.29Å; V33-Y85 PolarHBondContact O-N 2.93Å
34	Q	95.1	Very high	86.9	Confident	67 Å²	67	70 Å²	70	31%	0.313	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118	162.6	-174.9	170.1	-2.9	0	0	108.8	L36 Y85	Q34-L36 HydrophobicContact CG-CD2 3.92Å; Q34-L36 HydrophobicContact CG-CG 4.34Å; Q34-Y85 CarbonylContact C-O 3.59Å; Q34-Y85 VanDerWaalsContact CA-O 3.32Å; Q34-Y85 WeakPolarHBondContact CA-O 3.47Å; Q34-Y85 HydrophobicContact CB-CE1 3.98Å; Q34-Y85 HydrophobicContact CB-CE2 4.18Å; Q34-Y85 HydrophobicContact CG-CD2 4.29Å; Q34-Y85 HydrophobicContact CG-CE1 4.43Å; Q34-Y85 HydrophobicContact CG-CE2 3.72Å; Q34-Y85 PolarHBondContact OE1-OH 3.26Å
35	V	93.8	Very high	85.6	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.006	38%	0.381	C	S	.	.			trans	-82.4	124	176.9	-179.2	0	0	0	0	108.3	V33 L55 L60 Y85 F86 V257 L287	V33-V35 HydrophobicContact CG1-CG2 4.46Å; V35-L55 HydrophobicContact CG1-CD2 3.93Å; V35-L55 HydrophobicContact CG1-CG 4.11Å; V35-L60 HydrophobicContact CG2-CD1 4.27Å; V35-Y85 PolarHBondContact N-O 3.11Å; V35-F86 VanDerWaalsContact O-CB 3.25Å; V35-F86 WeakPolarHBondContact O-CB 3.43Å; V35-V257 HydrophobicContact CB-CG2 4.46Å; V35-V257 HydrophobicContact CG2-CB 4.46Å; V35-V257 HydrophobicContact CG2-CG1 4.48Å; V35-V257 HydrophobicContact CG2-CG2 4.05Å; V35-L287 HydrophobicContact CG1-CD1 3.8Å
36	L	90.8	Very high	84.2	Confident	113 Å²	113	76.7 Å²	76.7	59%	0.592	41%	0.405	S	S	*	.			trans	-118.8	-24.5	-176.6	-62.8	173	0	0	0	112.3	Q34 Y53	Q34-L36 HydrophobicContact CG-CD2 3.92Å; Q34-L36 HydrophobicContact CG-CG 4.34Å; L36-Y53 PolarHBondContact N-O 3.2Å
37	K	88.5	Confident	83.1	Confident	88 Å²	88	81 Å²	81	38%	0.383	43%	0.428	S	S	.	.			trans	-104.8	133.6	-175	-61.6	177.1	-173.1	160.4	0	111.1	L51 D52 Y53	K37-L51 HydrophobicContact CD-CD2 4.3Å; K37-D52 PolarHBondContact NZ-O 3.11Å; K37-Y53 PolarHBondContact N-O 2.95Å; K37-Y53 VanDerWaalsContact N-O 3.1Å
38	C	84.5	Confident	82.2	Confident	45 Å²	45	84.3 Å²	84.3	30%	0.304	44%	0.439	S	S	.	.			trans	-82.2	-24.7	173.8	63	0	0	0	0	113	Q284 L287	C38-Q284 HydrophobicContact CB-CG 4.44Å; C38-Q284 WeakPolarHBondContact O-CG 3.47Å; C38-Q284 PolarHBondContact O-NE2 3.12Å; C38-L287 HydrophobicContact CB-CB 3.99Å
39	L	85.2	Confident	81.7	Confident	90 Å²	90	85.9 Å²	85.9	47%	0.471	44%	0.442	S	S	.	.			trans	-69.8	135.6	176.2	-74.6	163.8	0	0	0	111.1	L51	L39-L51 HydrophobicContact CB-CD1 3.61Å; L39-L51 WeakPolarHBondContact O-CD1 3.49Å
40	L	85.7	Confident	81.3	Confident	23 Å²	23	77 Å²	77	12%	0.12	41%	0.41	C	S	.	.			trans	-83.7	-41.7	-174.6	-61.1	173.4	0	0	0	112.8	L51 L55 L56 E276 T280	L40-L51 PolarHBondContact O-N 3.35Å; L40-L55 HydrophobicContact CD2-CB 3.93Å; L40-L55 HydrophobicContact CD2-CD1 4.04Å; L40-L56 HydrophobicContact CB-CD1 4.17Å; L40-L56 HydrophobicContact CD2-CD1 4.36Å; L40-L56 HydrophobicContact CD2-CG 4.27Å; L40-E276 HydrophobicContact CD1-CG 4.02Å; L40-T280 HydrophobicContact CD2-CG2 3.67Å
41	Y	85.7	Confident	81.1	Confident	46 Å²	46	74.1 Å²	74.1	18%	0.18	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-126.9	148.4	-173.4	-62.1	-72.8	0	0	0	110.6	R48 L51 L56 T274 E276	Y41-R48 HydrophobicContact CD1-CB 3.88Å; Y41-R48 WeakPolarHBondContact CD1-O 3.44Å; Y41-R48 HydrophobicContact CE1-CB 4.13Å; Y41-R48 HydrophobicContact CG-CB 4.41Å; Y41-L51 VanDerWaalsContact C-CD1 3.48Å; Y41-L51 VanDerWaalsContact O-CD1 3.31Å; Y41-L51 WeakPolarHBondContact O-CD1 3.43Å; Y41-L56 HydrophobicContact CE1-CD1 4.02Å; Y41-L56 HydrophobicContact CE2-CD1 4.14Å; Y41-L56 WeakPolarHBondContact OH-CD1 3.27Å; Y41-T274 PolarHBondContact OH-OG1 2.81Å; Y41-E276 PolarHBondContact OH-OE1 3.39Å
42	A	77	Confident	80.8	Confident	32 Å²	32	77.1 Å²	77.1	26%	0.264	41%	0.41	S	S	.	.			trans	-69.6	132.8	174.9	0	0	0	0	0	110.8	R49 L51	A42-R49 PolarHBondContact N-O 3.35Å; A42-L51 HydrophobicContact CB-CD2 4.18Å; A42-L51 HydrophobicContact CB-CG 4.26Å
43	E	69.9	Low	80.7	Confident	173 Å²	173	76.7 Å²	76.7	81%	0.808	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	140.6	176.2	-67.4	-175.2	163.6	0	0	111
44	G	63.1	Low	80.6	Confident	88 Å²	88	76.5 Å²	76.5	91%	0.907	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	2.7	172.4	0	0	0	0	0	117.2
45	Q	57.8	Low	80.4	Confident	110 Å²	110	73.3 Å²	73.3	51%	0.514	39%	0.388	S	S	.	.			trans	-111.8	128	175.2	-72	-171.6	-12.6	0	0	113	N47 R48	Q45-N47 PolarHBondContact O-N 3.45Å; Q45-R48 PolarHBondContact O-N 2.66Å
46	S	59.4	Low	80.3	Confident	125 Å²	125	73.3 Å²	73.3	87%	0.874	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	178.6	51.2	0	0	0	0	113.8	R48	S46-R48 PolarHBondContact O-N 3.33Å
47	N	64.2	Low	80.3	Confident	136 Å²	136	68 Å²	68	73%	0.727	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	1.5	-174.5	-101.7	-1.5	0	0	0	115.8	Q45 R49	Q45-N47 PolarHBondContact O-N 3.45Å; N47-R49 VanDerWaalsContact C-N 3.33Å; N47-R49 PolarHBondContact O-N 2.69Å
48	R	72.2	Confident	80.4	Confident	92 Å²	92	65.2 Å²	65.2	35%	0.347	35%	0.352	S	S	.	.			trans	42.8	59.2	-177.2	-71.4	-166.2	175.7	143.4	6.3	112.4	Y41 Q45 S46 S272 G273	Y41-R48 HydrophobicContact CD1-CB 3.88Å; Y41-R48 WeakPolarHBondContact CD1-O 3.44Å; Y41-R48 HydrophobicContact CE1-CB 4.13Å; Y41-R48 HydrophobicContact CG-CB 4.41Å; Q45-R48 PolarHBondContact O-N 2.66Å; S46-R48 PolarHBondContact O-N 3.33Å; R48-S272 VanDerWaalsContact CZ-O 3.26Å; R48-S272 PolarHBondContact NH1-O 3.39Å; R48-S272 VanDerWaalsContact NH1-O 3.12Å; R48-S272 PolarHBondContact NH2-O 2.86Å; R48-G273 VanDerWaalsContact NH1-N 3.12Å
49	R	78.8	Confident	80.8	Confident	149 Å²	149	66.1 Å²	66.1	56%	0.562	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-71.4	132.4	174	-171	176.4	173.1	177.3	-3.5	108.8	A42 N47	A42-R49 PolarHBondContact N-O 3.35Å; N47-R49 VanDerWaalsContact C-N 3.33Å; N47-R49 PolarHBondContact O-N 2.69Å
50	A	83.7	Confident	81.1	Confident	10 Å²	10	61.9 Å²	61.9	8%	0.083	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-63.5	143.2	173.8	0	0	0	0	0	110.2	L56	A50-L56 HydrophobicContact CB-CB 3.88Å; A50-L56 WeakPolarHBondContact CB-O 3.44Å
51	L	86.3	Confident	81.4	Confident	33 Å²	33	60.9 Å²	60.9	17%	0.173	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-74.3	135.2	178.4	-86.8	154.8	0	0	0	111.6	K37 L39 L40 Y41 A42 Y53 G54	K37-L51 HydrophobicContact CD-CD2 4.3Å; L39-L51 HydrophobicContact CB-CD1 3.61Å; L39-L51 WeakPolarHBondContact O-CD1 3.49Å; L40-L51 PolarHBondContact O-N 3.35Å; Y41-L51 VanDerWaalsContact C-CD1 3.48Å; Y41-L51 VanDerWaalsContact O-CD1 3.31Å; Y41-L51 WeakPolarHBondContact O-CD1 3.43Å; A42-L51 HydrophobicContact CB-CD2 4.18Å; A42-L51 HydrophobicContact CB-CG 4.26Å; L51-Y53 PolarHBondContact O-N 3.19Å; L51-G54 PolarHBondContact O-N 3.24Å
52	D	87.7	Confident	81.4	Confident	78 Å²	78	58.9 Å²	58.9	42%	0.417	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	134.5	167.9	-62.8	-24.9	0	0	0	109.8	K37 G54	K37-D52 PolarHBondContact NZ-O 3.11Å; D52-G54 PolarHBondContact O-N 3.23Å
53	Y	92	Very high	81.5	Confident	107 Å²	107	58.2 Å²	58.2	42%	0.42	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	21	-173	-53.7	-91	0	0	0	114	V33 L36 K37 L51 D57	V33-Y53 HydrophobicContact CG1-CD1 4.48Å; L36-Y53 PolarHBondContact N-O 3.2Å; K37-Y53 PolarHBondContact N-O 2.95Å; K37-Y53 VanDerWaalsContact N-O 3.1Å; L51-Y53 PolarHBondContact O-N 3.19Å; Y53-D57 PolarHBondContact N-OD2 2.78Å
54	G	91.6	Very high	81.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-97.9	-179.2	171.5	0	0	0	0	0	113.3	L51 D52 L56 D57	L51-G54 PolarHBondContact O-N 3.24Å; D52-G54 PolarHBondContact O-N 3.23Å; G54-L56 VanDerWaalsContact C-N 3.28Å; G54-L56 PolarHBondContact O-N 3.14Å; G54-D57 WeakPolarHBondContact O-CB 3.48Å; G54-D57 PolarHBondContact O-N 3.33Å
55	L	91.4	Very high	82.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-21.5	-178.7	-72.5	168	0	0	0	114.4	V35 L40 V257 R263 T280 Y283 Q284 L287	V35-L55 HydrophobicContact CG1-CD2 3.93Å; V35-L55 HydrophobicContact CG1-CG 4.11Å; L40-L55 HydrophobicContact CD2-CB 3.93Å; L40-L55 HydrophobicContact CD2-CD1 4.04Å; L55-V257 HydrophobicContact CD2-CG1 4.09Å; L55-V257 HydrophobicContact CD2-CG2 4.41Å; L55-R263 VanDerWaalsContact O-CZ 3.23Å; L55-R263 PolarHBondContact O-NH1 3.03Å; L55-R263 PolarHBondContact O-NH2 2.95Å; L55-T280 HydrophobicContact CB-CG2 4.34Å; L55-T280 HydrophobicContact CD1-CG2 4.45Å; L55-Y283 HydrophobicContact CD2-CD2 4.43Å; L55-Y283 HydrophobicContact CD2-CG 4.19Å; L55-Q284 HydrophobicContact CD1-CB 3.87Å; L55-L287 HydrophobicContact CD1-CD1 4.13Å; L55-L287 HydrophobicContact CD2-CD1 3.89Å; L55-L287 HydrophobicContact CG-CD1 3.98Å
56	L	90.5	Very high	83.7	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	20.2	178.9	-63	178.1	0	0	0	111.9	L40 Y41 A50 G54 N63 T280	L40-L56 HydrophobicContact CB-CD1 4.17Å; L40-L56 HydrophobicContact CD2-CD1 4.36Å; L40-L56 HydrophobicContact CD2-CG 4.27Å; Y41-L56 HydrophobicContact CE1-CD1 4.02Å; Y41-L56 HydrophobicContact CE2-CD1 4.14Å; Y41-L56 WeakPolarHBondContact OH-CD1 3.27Å; A50-L56 HydrophobicContact CB-CB 3.88Å; A50-L56 WeakPolarHBondContact CB-O 3.44Å; G54-L56 VanDerWaalsContact C-N 3.28Å; G54-L56 PolarHBondContact O-N 3.14Å; L56-N63 PolarHBondContact O-ND2 2.98Å; L56-T280 HydrophobicContact CD2-CG2 4.29Å
57	D	91.6	Very high	84.7	Confident	2 Å²	2	57 Å²	57	1%	0.011	26%	0.259	C	S	.	.			trans	-55.5	127.6	179.7	-170.8	-45.3	0	0	0	111	Y53 G54 R59 L60	Y53-D57 PolarHBondContact N-OD2 2.78Å; G54-D57 WeakPolarHBondContact O-CB 3.48Å; G54-D57 PolarHBondContact O-N 3.33Å; D57-R59 PolarHBondContact O-N 3.42Å; D57-R59 VanDerWaalsContact OD1-CB 3.25Å; D57-R59 WeakPolarHBondContact OD1-CB 2.83Å; D57-R59 WeakPolarHBondContact OD1-CG 3.2Å; D57-R59 PolarHBondContact OD1-N 3.33Å; D57-R59 IonicContact OD1-NE 3.46Å; D57-R59 PolarHBondContact OD1-NE 2.69Å; D57-R59 VanDerWaalsContact OD1-NE 3.09Å; D57-R59 IonicContact OD2-CZ 3.12Å; D57-R59 VanDerWaalsContact OD2-CZ 3.32Å; D57-R59 IonicContact OD2-NE 2.75Å; D57-R59 PolarHBondContact OD2-NE 3.41Å; D57-R59 VanDerWaalsContact OD2-NE 3.13Å; D57-R59 IonicContact OD2-NH2 2.65Å; D57-R59 PolarHBondContact OD2-NH2 2.93Å; D57-L60 HydrophobicContact CB-CD1 4.42Å; D57-L60 HydrophobicContact CB-CG 4.42Å; D57-L60 WeakPolarHBondContact O-CB 3.26Å; D57-L60 PolarHBondContact O-N 2.89Å
58	P	90	Very high	85.9	Confident	30 Å²	30	55.9 Å²	55.9	20%	0.195	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.8	-12.6	-177.7	13.3	-19.1	0	0	0	114.4	L60 G61 A70	P58-L60 VanDerWaalsContact C-N 3.25Å; P58-L60 PolarHBondContact O-N 3.07Å; P58-G61 CarbonylContact O-C 3.54Å; P58-G61 PolarHBondContact O-N 2.94Å; P58-A70 HydrophobicContact CB-CB 4.33Å; P58-A70 PolarHBondContact O-N 3.44Å; P58-A70 VanDerWaalsContact O-N 3.13Å
59	R	92.6	Very high	86.8	Confident	64 Å²	64	51.7 Å²	51.7	24%	0.242	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-68.8	-21.4	168.9	-67.4	176.9	-74.1	-174.8	0.3	112.9	V33 D57 G61 A70 T71 H82	V33-R59 HydrophobicContact CG2-CB 3.47Å; V33-R59 VanDerWaalsContact CG2-CB 3.47Å; V33-R59 HydrophobicContact CG2-CG 4.17Å; D57-R59 PolarHBondContact O-N 3.42Å; D57-R59 VanDerWaalsContact OD1-CB 3.25Å; D57-R59 WeakPolarHBondContact OD1-CB 2.83Å; D57-R59 WeakPolarHBondContact OD1-CG 3.2Å; D57-R59 PolarHBondContact OD1-N 3.33Å; D57-R59 IonicContact OD1-NE 3.46Å; D57-R59 PolarHBondContact OD1-NE 2.69Å; D57-R59 VanDerWaalsContact OD1-NE 3.09Å; D57-R59 IonicContact OD2-CZ 3.12Å; D57-R59 VanDerWaalsContact OD2-CZ 3.32Å; D57-R59 IonicContact OD2-NE 2.75Å; D57-R59 PolarHBondContact OD2-NE 3.41Å; D57-R59 VanDerWaalsContact OD2-NE 3.13Å; D57-R59 IonicContact OD2-NH2 2.65Å; D57-R59 PolarHBondContact OD2-NH2 2.93Å; R59-G61 VanDerWaalsContact C-N 3.26Å; R59-A70 HydrophobicContact CG-CB 3.76Å; R59-T71 VanDerWaalsContact CA-OG1 3.26Å; R59-T71 WeakPolarHBondContact CA-OG1 3.43Å; R59-T71 PolarHBondContact O-OG1 3.33Å; R59-H82 WeakPolarHBondContact O-CB 3.16Å
60	L	92.8	Very high	87.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-80.8	-7	174.1	-59.4	175.5	0	0	0	112.9	V33 V35 D57 P58 H82 V257 S260	V33-L60 HydrophobicContact CB-CD2 4.13Å; V35-L60 HydrophobicContact CG2-CD1 4.27Å; D57-L60 HydrophobicContact CB-CD1 4.42Å; D57-L60 HydrophobicContact CB-CG 4.42Å; D57-L60 WeakPolarHBondContact O-CB 3.26Å; D57-L60 PolarHBondContact O-N 2.89Å; P58-L60 VanDerWaalsContact C-N 3.25Å; P58-L60 PolarHBondContact O-N 3.07Å; L60-H82 PolarHBondContact O-N 3.42Å; L60-V257 HydrophobicContact CD1-CG1 4.31Å; L60-S260 PolarHBondContact O-N 2.87Å
61	G	90.8	Very high	87.8	Confident	2 Å²	2	49.8 Å²	49.8	2%	0.021	25%	0.248	C	C	.	.			trans	133.6	161.4	-177.3	0	0	0	0	0	111.4	P58 R59 N63	P58-G61 CarbonylContact O-C 3.54Å; P58-G61 PolarHBondContact O-N 2.94Å; R59-G61 VanDerWaalsContact C-N 3.26Å; G61-N63 PolarHBondContact O-N 3.46Å
62	A	85.8	Confident	88	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.033	26%	0.256	C	S	.	.			trans	-66.7	130.7	171.5	0	0	0	0	0	110.1	E67 Y76	A62-E67 VanDerWaalsContact CB-O 3.28Å; A62-E67 WeakPolarHBondContact CB-O 3.32Å; A62-Y76 HydrophobicContact CB-CD2 4.47Å; A62-Y76 WeakPolarHBondContact O-CD2 3.34Å
63	N	79.4	Confident	88.1	Confident	18 Å²	18	49.2 Å²	49.2	10%	0.096	26%	0.26	C	S	.	.			trans	-93.6	-31.7	178	-59.4	-40.1	0	0	0	112	L56 G61 S260	L56-N63 PolarHBondContact O-ND2 2.98Å; G61-N63 PolarHBondContact O-N 3.46Å; N63-S260 WeakPolarHBondContact OD1-CB 3.48Å; N63-S260 PolarHBondContact OD1-OG 3.27Å
64	K	77.8	Confident	87.8	Confident	63 Å²	63	47.9 Å²	47.9	27%	0.274	26%	0.259	S	S	.	.	S	Bend	trans	-115.6	155.9	-177.6	-61.8	174	-173.1	166.8	0	109.5	D66 E67	K64-D66 PolarHBondContact O-N 3.3Å; K64-E67 HydrophobicContact CB-CB 4.45Å; K64-E67 PolarHBondContact O-N 3.2Å
65	R	78	Confident	87.6	Confident	198 Å²	198	50.9 Å²	50.9	75%	0.747	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.3	176.8	-75.6	-176.3	176	178.6	-1	113.1	Y76	R65-Y76 HydrophobicContact CG-CD1 4.43Å
66	D	81.4	Confident	87.3	Confident	156 Å²	156	54.8 Å²	54.8	83%	0.834	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-6.8	-173.5	-36.7	-31.2	0	0	0	112.2	K64	K64-D66 PolarHBondContact O-N 3.3Å
67	E	81	Confident	86.9	Confident	53 Å²	53	62.2 Å²	62.2	25%	0.248	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-97	142.2	176.9	-86.6	177.1	163.6	0	0	110.9	A62 K64	A62-E67 VanDerWaalsContact CB-O 3.28Å; A62-E67 WeakPolarHBondContact CB-O 3.32Å; K64-E67 HydrophobicContact CB-CB 4.45Å; K64-E67 PolarHBondContact O-N 3.2Å
68	L	88.5	Confident	86.6	Confident	114 Å²	114	66 Å²	66	60%	0.597	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-94.7	148	168	-62.6	174.9	0	0	0	109.6	A70 D75	L68-A70 PolarHBondContact O-N 3.24Å; L68-D75 HydrophobicContact CD2-CB 4.07Å
69	C	90.5	Very high	86.6	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.02	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-66.7	130.2	173.9	178.4	0	0	0	0	110.7	T71 C72 G73 L74 C79 H82	C69-T71 PolarHBondContact O-N 3.25Å; C69-T71 PolarHBondContact SG-N 2.99Å; C69-T71 VanDerWaalsContact SG-N 3.39Å; C69-C72 VanDerWaalsContact SG-SG 3.64Å; C69-G73 WeakPolarHBondContact O-CA 3.33Å; C69-G73 PolarHBondContact O-N 3.02Å; C69-L74 PolarHBondContact N-O 3.19Å; C69-C79 HydrophobicContact CB-CB 4.43Å; C69-H82 PolarHBondContact SG-CD2 3.31Å
70	A	91.5	Very high	86.5	Confident	68 Å²	68	69.8 Å²	69.8	56%	0.562	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-15	179.6	0	0	0	0	0	113.8	P58 R59 L68	P58-A70 HydrophobicContact CB-CB 4.33Å; P58-A70 PolarHBondContact O-N 3.44Å; P58-A70 VanDerWaalsContact O-N 3.13Å; R59-A70 HydrophobicContact CG-CB 3.76Å; L68-A70 PolarHBondContact O-N 3.24Å
71	T	92.1	Very high	86.5	Confident	52 Å²	52	70.5 Å²	70.5	32%	0.319	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-47.1	-176.7	-52.1	0	0	0	0	112.5	R59 C69	R59-T71 VanDerWaalsContact CA-OG1 3.26Å; R59-T71 WeakPolarHBondContact CA-OG1 3.43Å; R59-T71 PolarHBondContact O-OG1 3.33Å; C69-T71 PolarHBondContact O-N 3.25Å; C69-T71 PolarHBondContact SG-N 2.99Å; C69-T71 VanDerWaalsContact SG-N 3.39Å
72	C	91.1	Very high	86.6	Confident	51 Å²	51	71.9 Å²	71.9	35%	0.345	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-9.9	-179.4	57.1	0	0	0	0	114.6	C69 L74 H82	C69-C72 VanDerWaalsContact SG-SG 3.64Å; C72-L74 HydrophobicContact CB-CD1 4.3Å; C72-L74 HydrophobicContact CB-CG 4.22Å; C72-L74 PolarHBondContact O-N 2.92Å; C72-H82 PolarHBondContact SG-NE2 3.18Å
73	G	89.5	Confident	87.1	Confident	47 Å²	47	76 Å²	76	49%	0.485	40%	0.399	S	S	.	.			trans	70.9	3.5	-176.9	0	0	0	0	0	114.8	C69	C69-G73 WeakPolarHBondContact O-CA 3.33Å; C69-G73 PolarHBondContact O-N 3.02Å
74	L	87.2	Confident	87.9	Confident	79 Å²	79	75.1 Å²	75.1	41%	0.414	39%	0.394	S	S	.	.			trans	-82.7	156.9	179.6	-63	176.7	0	0	0	111.8	C69 C72 C79	C69-L74 PolarHBondContact N-O 3.19Å; C72-L74 HydrophobicContact CB-CD1 4.3Å; C72-L74 HydrophobicContact CB-CG 4.22Å; C72-L74 PolarHBondContact O-N 2.92Å; L74-C79 HydrophobicContact CB-CB 4.09Å
75	D	87	Confident	88.7	Confident	64 Å²	64	72.8 Å²	72.8	34%	0.342	38%	0.384	S	S	.	.			trans	-76.1	175.4	177.2	75.9	0.6	0	0	0	112.6	L68 Q77 T78 C79	L68-D75 HydrophobicContact CD2-CB 4.07Å; D75-Q77 VanDerWaalsContact C-N 3.26Å; D75-Q77 PolarHBondContact O-N 2.66Å; D75-Q77 PolarHBondContact OD1-N 3.18Å; D75-Q77 VanDerWaalsContact OD1-N 3.1Å; D75-T78 PolarHBondContact O-N 2.99Å; D75-T78 WeakPolarHBondContact OD1-CB 3.14Å; D75-T78 PolarHBondContact OD1-N 3.4Å; D75-T78 PolarHBondContact OD1-OG1 2.95Å; D75-C79 WeakPolarHBondContact O-CB 3.29Å; D75-C79 PolarHBondContact O-N 3.05Å
76	Y	83.9	Confident	89.5	Confident	81 Å²	81	63.4 Å²	63.4	32%	0.318	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.5	179.6	-179.8	-93.5	0	0	0	114.6	A62 R65	A62-Y76 HydrophobicContact CB-CD2 4.47Å; A62-Y76 WeakPolarHBondContact O-CD2 3.34Å; R65-Y76 HydrophobicContact CG-CD1 4.43Å
77	Q	83.1	Confident	90	Very high	158 Å²	158	59 Å²	59	74%	0.738	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-31.9	-176.1	-68.9	-172.2	5.4	0	0	113	D75	D75-Q77 VanDerWaalsContact C-N 3.26Å; D75-Q77 PolarHBondContact O-N 2.66Å; D75-Q77 PolarHBondContact OD1-N 3.18Å; D75-Q77 VanDerWaalsContact OD1-N 3.1Å
78	T	85.9	Confident	90.6	Very high	82 Å²	82	57.1 Å²	57.1	50%	0.503	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-26.4	-177.2	52.5	0	0	0	0	113.1	D75 I80	D75-T78 PolarHBondContact O-N 2.99Å; D75-T78 WeakPolarHBondContact OD1-CB 3.14Å; D75-T78 PolarHBondContact OD1-N 3.4Å; D75-T78 PolarHBondContact OD1-OG1 2.95Å; T78-I80 PolarHBondContact O-N 3.2Å
79	C	89.5	Confident	90.6	Very high	12 Å²	12	53.8 Å²	53.8	8%	0.081	30%	0.302	C	S	.	.			trans	-65.6	122.6	176.5	-175	0	0	0	0	111.4	C69 L74 D75 G81	C69-C79 HydrophobicContact CB-CB 4.43Å; L74-C79 HydrophobicContact CB-CB 4.09Å; D75-C79 WeakPolarHBondContact O-CB 3.29Å; D75-C79 PolarHBondContact O-N 3.05Å; C79-G81 VanDerWaalsContact C-N 3.26Å; C79-G81 PolarHBondContact O-N 3.37Å; C79-G81 PolarHBondContact SG-N 2.88Å; C79-G81 VanDerWaalsContact SG-N 3.39Å
80	I	89.9	Confident	90.6	Very high	161 Å²	161	55.6 Å²	55.6	83%	0.826	31%	0.313	S	S	*	.			trans	-74.7	-22.6	175.9	-52.3	168.2	0	0	0	111.1	T78	T78-I80 PolarHBondContact O-N 3.2Å
81	G	92	Very high	90.6	Very high	14 Å²	14	53.6 Å²	53.6	14%	0.144	29%	0.294	C	S	.	.			trans	93.3	159.9	-176.3	0	0	0	0	0	113.5	C79	C79-G81 VanDerWaalsContact C-N 3.26Å; C79-G81 PolarHBondContact O-N 3.37Å; C79-G81 PolarHBondContact SG-N 2.88Å; C79-G81 VanDerWaalsContact SG-N 3.39Å
82	H	94.8	Very high	90.7	Very high	31 Å²	31	51.1 Å²	51.1	14%	0.144	28%	0.279	C	S	.	.			trans	-127.6	143.3	-174.5	-58	-81.4	0	0	0	111.1	H32 R59 L60 C69 C72 P259	H32-H82 HydrophobicContact CB-CB 4.49Å; H32-H82 AromaticContact CD2-CG 3.99Å; H32-H82 AromaticContact CD2-ND1 3.66Å; H32-H82 AromaticContact NE2-ND1 3.57Å; R59-H82 WeakPolarHBondContact O-CB 3.16Å; L60-H82 PolarHBondContact O-N 3.42Å; C69-H82 PolarHBondContact SG-CD2 3.31Å; C72-H82 PolarHBondContact SG-NE2 3.18Å; H82-P259 WeakPolarHBondContact O-CA 3.42Å
83	W	95.2	Very high	90.7	Very high	91 Å²	91	49 Å²	49	35%	0.345	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	148.6	-177.9	-69.2	87.2	0	0	0	111.9	L30 S31 H32 P256 C258 P259	L30-W83 HydrophobicContact CD2-CB 4.09Å; L30-W83 HydrophobicContact CD2-CD2 3.98Å; L30-W83 HydrophobicContact CD2-CG 3.63Å; L30-W83 HydrophobicContact CG-CG 4.38Å; S31-W83 CarbonylContact C-O 3.48Å; S31-W83 WeakPolarHBondContact CA-O 3.49Å; H32-W83 PolarHBondContact N-O 3.41Å; W83-P256 HydrophobicContact CE3-CB 4.22Å; W83-P256 HydrophobicContact CZ3-CB 4.23Å; W83-C258 HydrophobicContact CZ3-CB 4.36Å; W83-P259 HydrophobicContact CD2-CG 4.26Å; W83-P259 HydrophobicContact CG-CG 4.32Å
84	G	95.2	Very high	90.9	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	176	165.9	0	0	0	0	0	111.2	S31 V33 V257	S31-G84 PolarHBondContact OG-O 3.25Å; V33-G84 CarbonylContact O-C 3.39Å; V33-G84 WeakPolarHBondContact O-CA 3.29Å; G84-V257 PolarHBondContact N-O 3.39Å; G84-V257 PolarHBondContact O-N 2.68Å
85	Y	95.8	Very high	91	Very high	13 Å²	13	45 Å²	45	5%	0.051	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.1	170.1	74.6	-84.9	0	0	0	111.6	K28 S31 V33 Q34 V35 R254 V255	K28-Y85 WeakPolarHBondContact CE-OH 3.45Å; K28-Y85 HydrophobicContact CG-CE1 4.08Å; S31-Y85 VanDerWaalsContact CB-CD1 3.45Å; V33-Y85 PolarHBondContact O-N 2.93Å; Q34-Y85 CarbonylContact C-O 3.59Å; Q34-Y85 VanDerWaalsContact CA-O 3.32Å; Q34-Y85 WeakPolarHBondContact CA-O 3.47Å; Q34-Y85 HydrophobicContact CB-CE1 3.98Å; Q34-Y85 HydrophobicContact CB-CE2 4.18Å; Q34-Y85 HydrophobicContact CG-CD2 4.29Å; Q34-Y85 HydrophobicContact CG-CE1 4.43Å; Q34-Y85 HydrophobicContact CG-CE2 3.72Å; Q34-Y85 PolarHBondContact OE1-OH 3.26Å; V35-Y85 PolarHBondContact N-O 3.11Å; Y85-R254 HydrophobicContact CD2-CG 3.66Å; Y85-R254 VanDerWaalsContact CE2-NE 3.32Å; Y85-R254 HydrophobicContact CG-CG 4.07Å; Y85-V255 VanDerWaalsContact CA-O 3.31Å; Y85-V255 WeakPolarHBondContact CA-O 3.29Å
86	F	94	Very high	91.2	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.009	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.9	159.8	59.5	-94	0	0	0	110.1	V35 L88 V255 V257 Y283 I286 L287	V35-F86 VanDerWaalsContact O-CB 3.25Å; V35-F86 WeakPolarHBondContact O-CB 3.43Å; F86-L88 HydrophobicContact CD2-CD2 4.39Å; F86-L88 HydrophobicContact CE2-CD2 3.94Å; F86-V255 HydrophobicContact CD1-CB 4.42Å; F86-V255 HydrophobicContact CD2-CB 4.16Å; F86-V255 HydrophobicContact CE1-CB 3.92Å; F86-V255 HydrophobicContact CE1-CG1 3.83Å; F86-V255 HydrophobicContact CE2-CB 3.62Å; F86-V255 HydrophobicContact CE2-CG1 4.19Å; F86-V255 HydrophobicContact CE2-CG2 3.8Å; F86-V255 HydrophobicContact CZ-CB 3.49Å; F86-V255 VanDerWaalsContact CZ-CB 3.49Å; F86-V255 HydrophobicContact CZ-CG1 3.54Å; F86-V255 HydrophobicContact CZ-CG2 3.99Å; F86-V255 PolarHBondContact N-O 3.01Å; F86-V255 PolarHBondContact O-N 3.13Å; F86-V257 HydrophobicContact CD1-CG2 3.44Å; F86-V257 VanDerWaalsContact CD1-CG2 3.44Å; F86-V257 HydrophobicContact CE1-CG2 3.71Å; F86-Y283 AromaticContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CE1 4.37Å; F86-Y283 HydrophobicContact CZ-CD1 4.21Å; F86-I286 HydrophobicContact CE2-CB 4.48Å; F86-I286 HydrophobicContact CE2-CG2 3.6Å; F86-I286 HydrophobicContact CZ-CB 4.18Å; F86-I286 HydrophobicContact CZ-CG2 3.68Å; F86-L287 HydrophobicContact CB-CD2 3.83Å; F86-L287 HydrophobicContact CD1-CD1 4.33Å; F86-L287 HydrophobicContact CD1-CD2 4.05Å; F86-L287 HydrophobicContact CD1-CG 4.14Å; F86-L287 HydrophobicContact CD2-CD2 3.75Å; F86-L287 HydrophobicContact CD2-CG 4.25Å; F86-L287 HydrophobicContact CE1-CG 4.23Å; F86-L287 HydrophobicContact CE2-CD2 4.29Å; F86-L287 HydrophobicContact CE2-CG 4.32Å; F86-L287 HydrophobicContact CG-CD2 3.62Å; F86-L287 HydrophobicContact CG-CG 4.16Å; F86-L287 HydrophobicContact CZ-CG 4.31Å
87	D	93.5	Very high	91.6	Very high	62 Å²	62	40 Å²	40	33%	0.332	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	143.8	179.6	-68.9	-29	0	0	0	109.5	R254	D87-R254 IonicContact OD1-CZ 3.78Å; D87-R254 IonicContact OD1-NE 2.66Å; D87-R254 PolarHBondContact OD1-NE 2.95Å; D87-R254 IonicContact OD1-NH2 3.47Å; D87-R254 PolarHBondContact OD1-NH2 3.14Å; D87-R254 IonicContact OD2-NH2 2.65Å; D87-R254 PolarHBondContact OD2-NH2 2.68Å; D87-R254 VanDerWaalsContact OD2-NH2 3.17Å
88	L	92.2	Very high	91.9	Very high	15 Å²	15	33 Å²	33	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.4	174.1	-64.1	172.6	0	0	0	109.1	F86 T90 I92 V252 Q253 V255 I286 A290 L309	F86-L88 HydrophobicContact CD2-CD2 4.39Å; F86-L88 HydrophobicContact CE2-CD2 3.94Å; L88-T90 WeakPolarHBondContact CB-O 3.44Å; L88-T90 PolarHBondContact O-N 3.47Å; L88-I92 HydrophobicContact CD1-CD1 3.46Å; L88-I92 VanDerWaalsContact CD1-CD1 3.46Å; L88-I92 HydrophobicContact CD1-CG1 3.59Å; L88-I92 HydrophobicContact CD1-CG2 4.42Å; L88-V252 HydrophobicContact CD1-CG1 4.11Å; L88-Q253 WeakPolarHBondContact CB-O 3.49Å; L88-Q253 PolarHBondContact N-O 2.95Å; L88-V255 HydrophobicContact CD1-CG2 3.78Å; L88-V255 HydrophobicContact CD2-CG2 4.06Å; L88-V255 HydrophobicContact CG-CG2 3.93Å; L88-I286 HydrophobicContact CD2-CG2 4.1Å; L88-A290 HydrophobicContact CD2-CB 4.5Å; L88-L309 HydrophobicContact CD2-CD1 4.23Å; L88-L309 HydrophobicContact CD2-CD2 4.36Å
89	P	89.7	Confident	92.1	Very high	43 Å²	43	37.8 Å²	37.8	28%	0.279	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	-26.4	179.7	26.6	-35.4	0	0	0	112.5	A290 I293 E294	P89-A290 HydrophobicContact CG-CB 4.27Å; P89-I293 HydrophobicContact CB-CG2 4.2Å; P89-I293 HydrophobicContact CG-CB 3.95Å; P89-I293 HydrophobicContact CG-CG2 3.81Å; P89-E294 HydrophobicContact CB-CG 3.65Å; P89-E294 HydrophobicContact CG-CG 4.23Å
90	T	89.2	Confident	92.3	Very high	42 Å²	42	38.1 Å²	38.1	26%	0.258	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.1	176.6	54.8	0	0	0	0	110.8	L88 I293 L306	L88-T90 WeakPolarHBondContact CB-O 3.44Å; L88-T90 PolarHBondContact O-N 3.47Å; T90-I293 HydrophobicContact CG2-CG2 4.42Å; T90-L306 VanDerWaalsContact OG1-CD1 3.26Å; T90-L306 WeakPolarHBondContact OG1-CD1 3.34Å
91	P	93.1	Very high	92.5	Very high	26 Å²	26	30.5 Å²	30.5	17%	0.169	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	142.9	177.6	-17.2	28.9	0	0	0	111.7	P217 L221 I251 V252 Q253	P91-P217 HydrophobicContact CB-CB 4.19Å; P91-P217 VanDerWaalsContact O-CB 3.24Å; P91-P217 WeakPolarHBondContact O-CB 3.33Å; P91-P217 WeakPolarHBondContact O-CG 3.44Å; P91-L221 HydrophobicContact CB-CD2 4.49Å; P91-L221 HydrophobicContact CG-CD2 4.09Å; P91-I251 HydrophobicContact CB-CG2 3.61Å; P91-V252 WeakPolarHBondContact CA-O 3.48Å; P91-Q253 HydrophobicContact CB-CG 3.91Å; P91-Q253 HydrophobicContact CG-CG 4.04Å
92	I	92.8	Very high	92.6	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.8	177	66.1	175.2	0	0	0	112.2	L88 V252 L306 L309 H310 F313	L88-I92 HydrophobicContact CD1-CD1 3.46Å; L88-I92 VanDerWaalsContact CD1-CD1 3.46Å; L88-I92 HydrophobicContact CD1-CG1 3.59Å; L88-I92 HydrophobicContact CD1-CG2 4.42Å; I92-V252 HydrophobicContact CG1-CB 3.8Å; I92-V252 HydrophobicContact CG1-CG1 4.35Å; I92-V252 PolarHBondContact N-O 3.46Å; I92-V252 PolarHBondContact O-N 3.43Å; I92-L306 HydrophobicContact CG2-CD1 4.2Å; I92-L309 HydrophobicContact CG2-CD2 3.9Å; I92-L309 HydrophobicContact CG2-CG 4.37Å; I92-H310 VanDerWaalsContact CA-NE2 3.26Å; I92-H310 WeakPolarHBondContact CA-NE2 3.49Å; I92-H310 VanDerWaalsContact CB-NE2 3.28Å; I92-H310 WeakPolarHBondContact CB-NE2 3.31Å; I92-F313 HydrophobicContact CD1-CB 3.56Å; I92-F313 HydrophobicContact CD1-CD1 3.61Å; I92-F313 HydrophobicContact CD1-CD2 3.91Å; I92-F313 HydrophobicContact CD1-CE1 4.3Å; I92-F313 HydrophobicContact CD1-CG 3.39Å; I92-F313 HydrophobicContact CG1-CD1 4.47Å
93	Y	92.3	Very high	92.6	Very high	7 Å²	7	32.4 Å²	32.4	3%	0.027	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	133	172.5	-69	-46.5	0	0	0	111.5	V95 I101 L172 V175 I215 R216 P217 A220 I251 H310	Y93-V95 PolarHBondContact O-N 3.12Å; Y93-I101 HydrophobicContact CD1-CD1 3.67Å; Y93-I101 HydrophobicContact CD1-CG2 4.16Å; Y93-I101 HydrophobicContact CE1-CD1 4.34Å; Y93-I101 HydrophobicContact CE1-CG2 3.81Å; Y93-I101 HydrophobicContact CG-CD1 4.33Å; Y93-L172 WeakPolarHBondContact CD2-O 3.41Å; Y93-V175 HydrophobicContact CE2-CG2 4.07Å; Y93-I215 PolarHBondContact OH-O 2.56Å; Y93-R216 PolarHBondContact OH-O 3.1Å; Y93-P217 HydrophobicContact CD1-CB 4.01Å; Y93-P217 HydrophobicContact CD1-CG 4.1Å; Y93-P217 HydrophobicContact CD2-CG 3.79Å; Y93-P217 HydrophobicContact CE1-CB 3.91Å; Y93-P217 HydrophobicContact CE1-CG 4.11Å; Y93-P217 HydrophobicContact CE2-CB 4.45Å; Y93-P217 HydrophobicContact CE2-CG 3.78Å; Y93-P217 HydrophobicContact CG-CB 4.35Å; Y93-P217 HydrophobicContact CG-CG 3.96Å; Y93-A220 HydrophobicContact CE1-CB 3.8Å; Y93-A220 WeakPolarHBondContact OH-CB 3.31Å; Y93-I251 HydrophobicContact CD1-CG1 4.35Å; Y93-I251 HydrophobicContact CE1-CD1 4.36Å; Y93-I251 HydrophobicContact CE1-CG1 4.48Å; Y93-H310 PolarHBondContact N-NE2 2.82Å
94	H	92.7	Very high	92.5	Very high	26 Å²	26	28.1 Å²	28.1	12%	0.12	14%	0.139	C	C	.	.			trans	-72.8	121.5	169.7	-168.7	-79.3	0	0	0	110.9	G96 Y97 T98 L250 V252 F313 F1326	H94-G96 VanDerWaalsContact C-N 3.25Å; H94-G96 PolarHBondContact ND1-N 2.99Å; H94-G96 PolarHBondContact O-N 3.49Å; H94-Y97 HydrophobicContact CB-CD2 3.65Å; H94-Y97 HydrophobicContact CB-CE2 4.5Å; H94-Y97 HydrophobicContact CB-CG 4.47Å; H94-Y97 AromaticContact CE1-CD2 3.99Å; H94-Y97 AromaticContact CE1-CE2 3.87Å; H94-Y97 AromaticContact CG-CD2 3.44Å; H94-Y97 VanDerWaalsContact CG-CD2 3.44Å; H94-Y97 AromaticContact CG-CE2 3.89Å; H94-Y97 AromaticContact ND1-CD2 3.24Å; H94-Y97 WeakPolarHBondContact ND1-CD2 3.34Å; H94-Y97 AromaticContact ND1-CE2 3.59Å; H94-Y97 PolarHBondContact O-N 3.41Å; H94-T98 PolarHBondContact O-N 3Å; H94-T98 VanDerWaalsContact O-N 3.17Å; H94-T98 PolarHBondContact O-OG1 3.17Å; H94-L250 WeakPolarHBondContact CB-O 3.37Å; H94-V252 HydrophobicContact CB-CG2 3.78Å; H94-F313 AromaticContact CD2-CE1 3.83Å; H94-F313 AromaticContact CD2-CZ 3.9Å; H94-F1326 AromaticContact CE1-CE1 3.5Å; H94-F1326 VanDerWaalsContact CE1-CE1 3.5Å; H94-F1326 WeakPolarHBondContact CE1-CE1 3.11Å; H94-F1326 AromaticContact CE1-CZ 3.94Å
95	V	90	Very high	92.5	Very high	15 Å²	15	28.1 Å²	28.1	9%	0.091	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-34.2	-175.6	70.7	0	0	0	0	113.4	Y93 Y97 T98 A314 I317 Q321	Y93-V95 PolarHBondContact O-N 3.12Å; V95-Y97 VanDerWaalsContact C-N 3.26Å; V95-Y97 PolarHBondContact O-N 2.86Å; V95-T98 PolarHBondContact O-OG1 2.95Å; V95-A314 HydrophobicContact CB-CB 4.04Å; V95-A314 HydrophobicContact CG1-CB 4.38Å; V95-A314 HydrophobicContact CG2-CB 4.07Å; V95-I317 HydrophobicContact CG1-CB 3.55Å; V95-I317 HydrophobicContact CG1-CG1 4.12Å; V95-I317 HydrophobicContact CG1-CG2 3.61Å; V95-Q321 HydrophobicContact CG2-CB 4.49Å; V95-Q321 HydrophobicContact CG2-CG 3.76Å
96	G	89.7	Confident	92.5	Very high	19 Å²	19	29.7 Å²	29.7	20%	0.196	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.4	176	0	0	0	0	0	113.8	H94	H94-G96 VanDerWaalsContact C-N 3.25Å; H94-G96 PolarHBondContact ND1-N 2.99Å; H94-G96 PolarHBondContact O-N 3.49Å
97	Y	92.9	Very high	92.5	Very high	22 Å²	22	30 Å²	30	9%	0.086	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	0.1	-175.8	-60.3	-63.4	0	0	0	113.9	L21 H94 V95 W99 H100 I101 L250 F1326 A1329	L21-Y97 HydrophobicContact CD2-CD2 4.42Å; L21-Y97 HydrophobicContact CD2-CE1 3.89Å; L21-Y97 HydrophobicContact CD2-CE2 3.64Å; L21-Y97 VanDerWaalsContact CD2-OH 3.24Å; L21-Y97 WeakPolarHBondContact CD2-OH 3.35Å; H94-Y97 HydrophobicContact CB-CD2 3.65Å; H94-Y97 HydrophobicContact CB-CE2 4.5Å; H94-Y97 HydrophobicContact CB-CG 4.47Å; H94-Y97 AromaticContact CE1-CD2 3.99Å; H94-Y97 AromaticContact CE1-CE2 3.87Å; H94-Y97 AromaticContact CG-CD2 3.44Å; H94-Y97 VanDerWaalsContact CG-CD2 3.44Å; H94-Y97 AromaticContact CG-CE2 3.89Å; H94-Y97 AromaticContact ND1-CD2 3.24Å; H94-Y97 WeakPolarHBondContact ND1-CD2 3.34Å; H94-Y97 AromaticContact ND1-CE2 3.59Å; H94-Y97 PolarHBondContact O-N 3.41Å; V95-Y97 VanDerWaalsContact C-N 3.26Å; V95-Y97 PolarHBondContact O-N 2.86Å; Y97-W99 VanDerWaalsContact C-N 3.27Å; Y97-W99 PolarHBondContact O-N 2.71Å; Y97-W99 VanDerWaalsContact O-N 3.14Å; Y97-H100 AromaticContact CD1-CD2 3.88Å; Y97-H100 WeakPolarHBondContact O-CA 3.38Å; Y97-H100 WeakPolarHBondContact O-CB 3.25Å; Y97-H100 PolarHBondContact O-N 3.06Å; Y97-I101 WeakPolarHBondContact O-CG1 3.46Å; Y97-I101 PolarHBondContact O-N 2.84Å; Y97-L250 HydrophobicContact CD1-CD2 3.73Å; Y97-L250 HydrophobicContact CD2-CD2 4Å; Y97-L250 HydrophobicContact CE1-CD2 4.3Å; Y97-L250 HydrophobicContact CG-CD2 3.6Å; Y97-F1326 HydrophobicContact CD1-CB 4.28Å; Y97-F1326 HydrophobicContact CE1-CB 3.77Å; Y97-F1326 HydrophobicContact CE1-CD1 4.07Å; Y97-F1326 HydrophobicContact CE1-CG 4.31Å; Y97-F1326 WeakPolarHBondContact CE1-O 3.4Å; Y97-F1326 HydrophobicContact CE2-CD1 4.19Å; Y97-F1326 AromaticContact CZ-CD1 3.7Å; Y97-A1329 WeakPolarHBondContact OH-CB 3.25Å
98	T	90	Very high	92.6	Very high	11 Å²	11	27 Å²	27	7%	0.067	13%	0.133	C	C	.	.	H	α-helix	trans	-52.2	-42.8	-176.2	-49.2	0	0	0	0	112.9	H94 V95 H100 I101 V102 K168	H94-T98 PolarHBondContact O-N 3Å; H94-T98 VanDerWaalsContact O-N 3.17Å; H94-T98 PolarHBondContact O-OG1 3.17Å; V95-T98 PolarHBondContact O-OG1 2.95Å; T98-H100 VanDerWaalsContact C-N 3.34Å; T98-H100 PolarHBondContact O-N 3.2Å; T98-I101 PolarHBondContact O-N 2.66Å; T98-V102 VanDerWaalsContact O-CG2 3.31Å; T98-V102 WeakPolarHBondContact O-CG2 3.48Å; T98-V102 PolarHBondContact O-N 3.35Å; T98-K168 HydrophobicContact CG2-CD 4.45Å; T98-K168 HydrophobicContact CG2-CG 4.45Å
99	W	90.3	Very high	92.7	Very high	181 Å²	181	26.3 Å²	26.3	69%	0.686	13%	0.13	S	C	*	.	H	α-helix	trans	-66.1	-34.5	176.6	-79.8	108.6	0	0	0	113.4	Y97 K103	Y97-W99 VanDerWaalsContact C-N 3.27Å; Y97-W99 PolarHBondContact O-N 2.71Å; Y97-W99 VanDerWaalsContact O-N 3.14Å; W99-K103 WeakPolarHBondContact O-CB 3.37Å; W99-K103 VanDerWaalsContact O-CG 3.31Å; W99-K103 WeakPolarHBondContact O-CG 3.36Å; W99-K103 PolarHBondContact O-N 3.46Å; W99-K103 VanDerWaalsContact O-N 3.1Å
100	H	92.8	Very high	92.9	Very high	19 Å²	19	24.9 Å²	24.9	9%	0.088	12%	0.119	C	C	.	.	H	α-helix	trans	-70.8	-42.5	176.2	-63.6	-62.2	0	0	0	111	Y97 T98 K103 I104 R143 Y1330	Y97-H100 AromaticContact CD1-CD2 3.88Å; Y97-H100 WeakPolarHBondContact O-CA 3.38Å; Y97-H100 WeakPolarHBondContact O-CB 3.25Å; Y97-H100 PolarHBondContact O-N 3.06Å; T98-H100 VanDerWaalsContact C-N 3.34Å; T98-H100 PolarHBondContact O-N 3.2Å; H100-K103 PolarHBondContact O-N 2.7Å; H100-I104 VanDerWaalsContact O-CG1 3.32Å; H100-I104 WeakPolarHBondContact O-CG1 3.31Å; H100-I104 PolarHBondContact O-N 3.1Å; H100-R143 PolarHBondContact CE1-NH1 2.8Å; H100-R143 VanDerWaalsContact CE1-NH1 3.29Å; H100-R143 VanDerWaalsContact ND1-CZ 3.29Å; H100-R143 PolarHBondContact ND1-NH1 3.11Å; H100-R143 PolarHBondContact ND1-NH2 3.32Å; H100-Y1330 HydrophobicContact CB-CD2 3.79Å; H100-Y1330 HydrophobicContact CB-CE2 3.83Å; H100-Y1330 AromaticContact CG-CD2 3.81Å
101	I	94.5	Very high	93.1	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-58.6	-51.1	175.4	-65.8	170.9	0	0	0	110.3	Y93 Y97 T98 K103 I104 L105 F224 L250	Y93-I101 HydrophobicContact CD1-CD1 3.67Å; Y93-I101 HydrophobicContact CD1-CG2 4.16Å; Y93-I101 HydrophobicContact CE1-CD1 4.34Å; Y93-I101 HydrophobicContact CE1-CG2 3.81Å; Y93-I101 HydrophobicContact CG-CD1 4.33Å; Y97-I101 WeakPolarHBondContact O-CG1 3.46Å; Y97-I101 PolarHBondContact O-N 2.84Å; T98-I101 PolarHBondContact O-N 2.66Å; I101-K103 VanDerWaalsContact C-N 3.32Å; I101-K103 PolarHBondContact O-N 3.2Å; I101-I104 PolarHBondContact O-N 3.22Å; I101-L105 HydrophobicContact CG2-CD1 4.11Å; I101-L105 WeakPolarHBondContact O-CG 3.36Å; I101-L105 PolarHBondContact O-N 2.92Å; I101-F224 HydrophobicContact CB-CZ 4.45Å; I101-F224 HydrophobicContact CG1-CE2 4.3Å; I101-F224 HydrophobicContact CG2-CE2 4.13Å; I101-F224 HydrophobicContact CG2-CZ 3.9Å; I101-L250 HydrophobicContact CD1-CB 4.2Å; I101-L250 HydrophobicContact CG1-CB 4.03Å; I101-L250 HydrophobicContact CG1-CD1 4.2Å
102	V	94.1	Very high	93	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.024	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-43.9	177.4	172.8	0	0	0	0	111.1	T98 I104 L105 Q106 K168 V175	T98-V102 VanDerWaalsContact O-CG2 3.31Å; T98-V102 WeakPolarHBondContact O-CG2 3.48Å; T98-V102 PolarHBondContact O-N 3.35Å; V102-I104 PolarHBondContact O-N 3.39Å; V102-L105 PolarHBondContact O-N 2.6Å; V102-Q106 VanDerWaalsContact O-CG 3.29Å; V102-Q106 WeakPolarHBondContact O-CG 3.37Å; V102-Q106 PolarHBondContact O-N 3.13Å; V102-K168 HydrophobicContact CG2-CB 4.4Å; V102-V175 HydrophobicContact CG2-CG1 4.19Å; V102-V175 HydrophobicContact CG2-CG2 3.95Å
103	K	93.8	Very high	93.1	Very high	81 Å²	81	28.1 Å²	28.1	35%	0.352	14%	0.14	S	C	.	.	H	α-helix	trans	-64.6	-38.6	177.3	-78.7	175.6	175.9	176.8	0	112.9	W99 H100 I101 Q106 T107	W99-K103 WeakPolarHBondContact O-CB 3.37Å; W99-K103 VanDerWaalsContact O-CG 3.31Å; W99-K103 WeakPolarHBondContact O-CG 3.36Å; W99-K103 PolarHBondContact O-N 3.46Å; W99-K103 VanDerWaalsContact O-N 3.1Å; H100-K103 PolarHBondContact O-N 2.7Å; I101-K103 VanDerWaalsContact C-N 3.32Å; I101-K103 PolarHBondContact O-N 3.2Å; K103-Q106 WeakPolarHBondContact O-CB 3.26Å; K103-Q106 PolarHBondContact O-N 3.25Å; K103-T107 WeakPolarHBondContact O-CB 3.22Å; K103-T107 PolarHBondContact O-N 3.26Å; K103-T107 VanDerWaalsContact O-N 3.11Å; K103-T107 PolarHBondContact O-OG1 3.08Å
104	I	94.7	Very high	93.1	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-46.9	175.2	-68.7	163.4	0	0	0	109.5	H100 I101 V102 Q106 T107 I108 F224 I227 L235 P247 L250 Y1330	H100-I104 VanDerWaalsContact O-CG1 3.32Å; H100-I104 WeakPolarHBondContact O-CG1 3.31Å; H100-I104 PolarHBondContact O-N 3.1Å; I101-I104 PolarHBondContact O-N 3.22Å; V102-I104 PolarHBondContact O-N 3.39Å; I104-Q106 PolarHBondContact O-N 2.95Å; I104-T107 CarbonylContact O-C 3.57Å; I104-T107 WeakPolarHBondContact O-CA 3.24Å; I104-T107 WeakPolarHBondContact O-CB 3.47Å; I104-T107 PolarHBondContact O-N 3.04Å; I104-I108 HydrophobicContact CG2-CD1 4.14Å; I104-I108 HydrophobicContact CG2-CG2 4.14Å; I104-I108 WeakPolarHBondContact O-CG1 3.22Å; I104-I108 PolarHBondContact O-N 2.74Å; I104-F224 HydrophobicContact CB-CE1 4.13Å; I104-F224 HydrophobicContact CB-CZ 4.21Å; I104-F224 HydrophobicContact CG2-CD1 4.1Å; I104-F224 HydrophobicContact CG2-CE1 3.48Å; I104-F224 VanDerWaalsContact CG2-CE1 3.48Å; I104-F224 HydrophobicContact CG2-CZ 4.04Å; I104-I227 HydrophobicContact CG2-CD1 4.38Å; I104-L235 HydrophobicContact CG2-CD1 4.26Å; I104-P247 HydrophobicContact CD1-CB 4.33Å; I104-L250 HydrophobicContact CD1-CD1 3.53Å; I104-Y1330 HydrophobicContact CD1-CE2 3.86Å
105	L	95.3	Very high	93.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-27.1	177.2	-66.8	171.2	0	0	0	113.5	I101 V102 T107 K110 V166 V175 I215 L223 F224	I101-L105 HydrophobicContact CG2-CD1 4.11Å; I101-L105 WeakPolarHBondContact O-CG 3.36Å; I101-L105 PolarHBondContact O-N 2.92Å; V102-L105 PolarHBondContact O-N 2.6Å; L105-T107 VanDerWaalsContact C-N 3.33Å; L105-K110 WeakPolarHBondContact O-CD 3.41Å; L105-K110 PolarHBondContact O-NZ 3.28Å; L105-K110 VanDerWaalsContact O-NZ 3.09Å; L105-V166 HydrophobicContact CB-CG1 3.95Å; L105-V175 HydrophobicContact CD1-CB 4.16Å; L105-V175 HydrophobicContact CD1-CG1 4Å; L105-V175 HydrophobicContact CD1-CG2 4.19Å; L105-I215 HydrophobicContact CD1-CD1 4.44Å; L105-I215 HydrophobicContact CD1-CG2 4.29Å; L105-I215 HydrophobicContact CD2-CD1 4.42Å; L105-L223 HydrophobicContact CD2-CD1 4.02Å; L105-F224 HydrophobicContact CD2-CE1 3.8Å; L105-F224 HydrophobicContact CD2-CZ 4.3Å; L105-F224 HydrophobicContact CG-CE1 4.11Å; L105-F224 HydrophobicContact CG-CZ 4.22Å
106	Q	94.4	Very high	93.4	Very high	46 Å²	46	29 Å²	29	22%	0.215	14%	0.14	C	C	.	.	H	α-helix	trans	-75.4	-21	169.9	-71.3	170.8	-15.5	0	0	113.3	V102 K103 I104 H147 V166	V102-Q106 VanDerWaalsContact O-CG 3.29Å; V102-Q106 WeakPolarHBondContact O-CG 3.37Å; V102-Q106 PolarHBondContact O-N 3.13Å; K103-Q106 WeakPolarHBondContact O-CB 3.26Å; K103-Q106 PolarHBondContact O-N 3.25Å; I104-Q106 PolarHBondContact O-N 2.95Å; Q106-H147 PolarHBondContact OE1-CE1 2.93Å; Q106-H147 PolarHBondContact OE1-NE2 2.81Å; Q106-V166 HydrophobicContact CG-CB 3.75Å; Q106-V166 HydrophobicContact CG-CG1 4.41Å; Q106-V166 PolarHBondContact NE2-O 3.17Å
107	T	94.9	Very high	93.4	Very high	8 Å²	8	28.1 Å²	28.1	5%	0.049	13%	0.131	C	C	.	.	H	α-helix	trans	-97.4	-29.5	-174.8	-51.8	0	0	0	0	112.1	K103 I104 L105 V115 L116 I146 S150 L235	K103-T107 WeakPolarHBondContact O-CB 3.22Å; K103-T107 PolarHBondContact O-N 3.26Å; K103-T107 VanDerWaalsContact O-N 3.11Å; K103-T107 PolarHBondContact O-OG1 3.08Å; I104-T107 CarbonylContact O-C 3.57Å; I104-T107 WeakPolarHBondContact O-CA 3.24Å; I104-T107 WeakPolarHBondContact O-CB 3.47Å; I104-T107 PolarHBondContact O-N 3.04Å; L105-T107 VanDerWaalsContact C-N 3.33Å; T107-V115 HydrophobicContact CG2-CG1 4.04Å; T107-L116 WeakPolarHBondContact O-CB 3.36Å; T107-L116 PolarHBondContact O-N 3.22Å; T107-I146 HydrophobicContact CG2-CG2 4.34Å; T107-S150 WeakPolarHBondContact CG2-OG 3.25Å; T107-L235 HydrophobicContact CG2-CD2 3.87Å
108	I	95.1	Very high	93.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-100.9	158.7	-178.8	71.9	177.9	0	0	0	112.8	I104 K110 R114 V115 L116 F224 I227 L235	I104-I108 HydrophobicContact CG2-CD1 4.14Å; I104-I108 HydrophobicContact CG2-CG2 4.14Å; I104-I108 WeakPolarHBondContact O-CG1 3.22Å; I104-I108 PolarHBondContact O-N 2.74Å; I108-K110 PolarHBondContact O-NZ 3.46Å; I108-R114 CarbonylContact C-O 3.47Å; I108-R114 WeakPolarHBondContact CA-O 3.46Å; I108-V115 HydrophobicContact CG2-CG2 4.3Å; I108-L116 WeakPolarHBondContact O-CD1 3.37Å; I108-F224 HydrophobicContact CD1-CD1 4.11Å; I108-F224 HydrophobicContact CD1-CE1 4.15Å; I108-I227 HydrophobicContact CD1-CD1 4.02Å; I108-I227 HydrophobicContact CD1-CG1 4.29Å; I108-I227 HydrophobicContact CG2-CD1 4.33Å; I108-L235 HydrophobicContact CG2-CD2 4.5Å
109	C	95	Very high	93.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.171	C	C	.	.			trans	-73	133.8	169.3	-178	0	0	0	0	111.1	T111 C112 S113 R114 L116 C156 C159 N163	C109-T111 PolarHBondContact O-N 2.91Å; C109-T111 PolarHBondContact SG-N 2.98Å; C109-T111 VanDerWaalsContact SG-N 3.41Å; C109-C112 VanDerWaalsContact CB-SG 3.57Å; C109-S113 WeakPolarHBondContact O-CA 3.3Å; C109-S113 PolarHBondContact O-N 3.25Å; C109-R114 PolarHBondContact N-O 3.16Å; C109-L116 HydrophobicContact CB-CD2 3.9Å; C109-C156 HydrophobicContact CB-CB 4.35Å; C109-C159 VanDerWaalsContact SG-SG 3.63Å; C109-N163 VanDerWaalsContact CA-OD1 3.31Å; C109-N163 WeakPolarHBondContact CA-OD1 3.42Å; C109-N163 PolarHBondContact SG-ND2 3.46Å; C109-N163 VanDerWaalsContact SG-ND2 3.42Å
110	K	94	Very high	93	Very high	12 Å²	12	35.6 Å²	35.6	5%	0.052	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-2.2	179	-83.7	67.5	72.8	-173.5	0	113.8	L105 I108 N163 V166 H177 I215 L223	L105-K110 WeakPolarHBondContact O-CD 3.41Å; L105-K110 PolarHBondContact O-NZ 3.28Å; L105-K110 VanDerWaalsContact O-NZ 3.09Å; I108-K110 PolarHBondContact O-NZ 3.46Å; K110-N163 WeakPolarHBondContact CE-OD1 3.12Å; K110-N163 PolarHBondContact N-OD1 3.46Å; K110-N163 PolarHBondContact NZ-OD1 2.83Å; K110-V166 HydrophobicContact CD-CG2 4.38Å; K110-H177 VanDerWaalsContact CE-CE1 3.41Å; K110-H177 WeakPolarHBondContact CE-CE1 3.18Å; K110-H177 WeakPolarHBondContact CE-NE2 3.25Å; K110-I215 HydrophobicContact CG-CD1 3.97Å; K110-L223 HydrophobicContact CG-CD1 4.41Å; K110-L223 VanDerWaalsContact O-CD2 3.25Å; K110-L223 WeakPolarHBondContact O-CD2 3.47Å
111	T	91.9	Very high	92.8	Very high	95 Å²	95	38.1 Å²	38.1	58%	0.583	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-54.9	-179.7	-35.4	0	0	0	0	111.3	C109 A161	C109-T111 PolarHBondContact O-N 2.91Å; C109-T111 PolarHBondContact SG-N 2.98Å; C109-T111 VanDerWaalsContact SG-N 3.41Å; T111-A161 HydrophobicContact CG2-CB 4.47Å; T111-A161 VanDerWaalsContact OG1-CB 3.26Å; T111-A161 WeakPolarHBondContact OG1-CB 3.31Å
112	C	92.8	Very high	92.5	Very high	42 Å²	42	39.3 Å²	39.3	28%	0.284	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	0.3	-178.4	73.7	0	0	0	0	115.1	C109 R114 C156 C159	C109-C112 VanDerWaalsContact CB-SG 3.57Å; C112-R114 PolarHBondContact O-N 3.28Å; C112-C156 VanDerWaalsContact SG-SG 3.68Å; C112-C159 HydrophobicContact CB-CB 4.06Å
113	S	94.3	Very high	92.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.			trans	60.1	0.3	180	-65	0	0	0	0	117.5	C109 L223	C109-S113 WeakPolarHBondContact O-CA 3.3Å; C109-S113 PolarHBondContact O-N 3.25Å; S113-L223 WeakPolarHBondContact CB-O 3.21Å; S113-L223 PolarHBondContact OG-O 3.36Å
114	R	93.1	Very high	91.9	Very high	64 Å²	64	47 Å²	47	24%	0.242	23%	0.233	C	C	.	.			trans	-71.1	152.1	174.9	-67.1	-128.3	177.6	-145.7	-4.7	112.7	I108 C109 C112 F158 P228 E230 D231	I108-R114 CarbonylContact C-O 3.47Å; I108-R114 WeakPolarHBondContact CA-O 3.46Å; C109-R114 PolarHBondContact N-O 3.16Å; C112-R114 PolarHBondContact O-N 3.28Å; R114-F158 HydrophobicContact CB-CD2 3.85Å; R114-F158 HydrophobicContact CB-CE2 4.18Å; R114-F158 HydrophobicContact CB-CG 4.42Å; R114-F158 HydrophobicContact CG-CD2 4.45Å; R114-P228 HydrophobicContact CG-CG 4.07Å; R114-E230 IonicContact CZ-OE1 2.88Å; R114-E230 VanDerWaalsContact NH1-CD 3.26Å; R114-E230 IonicContact NH1-OE1 2.87Å; R114-E230 PolarHBondContact NH1-OE1 3.27Å; R114-E230 IonicContact NH1-OE2 2.87Å; R114-E230 IonicContact NH2-OE1 2.82Å; R114-E230 PolarHBondContact NH2-OE1 3.2Å; R114-D231 WeakPolarHBondContact CA-OD2 3.45Å
115	V	93.6	Very high	91.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-65.6	132.5	175	169.6	0	0	0	0	110.6	T107 I108 L117 D231 L234 L235	T107-V115 HydrophobicContact CG2-CG1 4.04Å; I108-V115 HydrophobicContact CG2-CG2 4.3Å; V115-L117 HydrophobicContact CG1-CB 4.27Å; V115-L117 HydrophobicContact CG1-CD1 3.98Å; V115-L117 HydrophobicContact CG1-CG 3.98Å; V115-L117 PolarHBondContact O-N 3.01Å; V115-D231 HydrophobicContact CG2-CB 3.92Å; V115-D231 PolarHBondContact N-OD2 3.43Å; V115-D231 VanDerWaalsContact N-OD2 3.07Å; V115-L234 HydrophobicContact CB-CD1 4.25Å; V115-L234 HydrophobicContact CG1-CD1 4.29Å; V115-L234 HydrophobicContact CG2-CB 4.35Å; V115-L234 HydrophobicContact CG2-CD1 4.41Å; V115-L235 HydrophobicContact CG2-CD2 4.11Å; V115-L235 HydrophobicContact CG2-CG 4.39Å
116	L	93.7	Very high	91.2	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	25%	0.252	C	S	.	.	S	Bend	trans	-77.5	61.5	-177.4	-64.7	170.1	0	0	0	111.7	T107 I108 C109 S150 V153 C156 N163	T107-L116 WeakPolarHBondContact O-CB 3.36Å; T107-L116 PolarHBondContact O-N 3.22Å; I108-L116 WeakPolarHBondContact O-CD1 3.37Å; C109-L116 HydrophobicContact CB-CD2 3.9Å; L116-S150 WeakPolarHBondContact O-CA 3.41Å; L116-V153 HydrophobicContact CB-CB 4.18Å; L116-V153 HydrophobicContact CB-CG1 4.27Å; L116-C156 HydrophobicContact CD2-CB 3.99Å; L116-N163 HydrophobicContact CD1-CB 3.93Å
117	L	91.2	Very high	90.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.274	C	S	.	.			trans	-125.6	140.4	173.2	-77.3	174.7	0	0	0	110.6	V115 Q121 R122 F125 I146 L149	V115-L117 HydrophobicContact CG1-CB 4.27Å; V115-L117 HydrophobicContact CG1-CD1 3.98Å; V115-L117 HydrophobicContact CG1-CG 3.98Å; V115-L117 PolarHBondContact O-N 3.01Å; L117-Q121 HydrophobicContact CD2-CB 4.44Å; L117-R122 HydrophobicContact CB-CB 4.34Å; L117-F125 HydrophobicContact CD1-CD2 4.09Å; L117-I146 HydrophobicContact CD1-CG2 4.06Å; L117-L149 HydrophobicContact CD2-CB 3.9Å
118	P	89.7	Confident	90.3	Very high	55 Å²	55	56.5 Å²	56.5	36%	0.357	29%	0.29	S	S	.	.			trans	-59.5	148.5	167.2	-19.3	31	0	0	0	111.2	Q120 Q121 R122	P118-Q120 VanDerWaalsContact C-N 3.35Å; P118-Q120 PolarHBondContact O-N 3.34Å; P118-Q121 PolarHBondContact O-N 3.34Å; P118-R122 PolarHBondContact O-N 3.01Å
119	E	87	Confident	89.7	Confident	137 Å²	137	57.3 Å²	57.3	64%	0.64	30%	0.295	S	S	*	.	H	α-helix	trans	-58.5	-39.4	-170.3	-165.5	150.5	-152.5	0	0	114.1	Q121 R122 A123	E119-Q121 PolarHBondContact O-N 3.45Å; E119-R122 WeakPolarHBondContact O-CB 3.47Å; E119-R122 PolarHBondContact O-N 3.29Å; E119-A123 PolarHBondContact O-N 3.38Å
120	Q	86.9	Confident	88.9	Confident	179 Å²	179	60.7 Å²	60.7	84%	0.836	32%	0.319	S	S	*	.	H	α-helix	trans	-60.7	-42.5	173.7	-78.3	-176.9	-12.8	0	0	113.1	P118 R124	P118-Q120 VanDerWaalsContact C-N 3.35Å; P118-Q120 PolarHBondContact O-N 3.34Å; Q120-R124 PolarHBondContact O-N 2.75Å
121	Q	88.8	Confident	88.2	Confident	73 Å²	73	63.7 Å²	63.7	34%	0.341	34%	0.335	S	S	.	.	H	α-helix	trans	-71.6	-39	178.8	-66.5	-176.1	-0.6	0	0	110.7	L117 P118 E119 R124 F125	L117-Q121 HydrophobicContact CD2-CB 4.44Å; P118-Q121 PolarHBondContact O-N 3.34Å; E119-Q121 PolarHBondContact O-N 3.45Å; Q121-R124 PolarHBondContact O-N 2.84Å; Q121-F125 HydrophobicContact CB-CD2 4.4Å; Q121-F125 HydrophobicContact CB-CE2 4.42Å; Q121-F125 WeakPolarHBondContact O-CD2 3.49Å; Q121-F125 PolarHBondContact O-N 3.13Å
122	R	88.6	Confident	87.2	Confident	25 Å²	25	65.5 Å²	65.5	9%	0.094	35%	0.348	C	S	.	.	H	α-helix	trans	-57.2	-50	175.6	-172.9	177.5	173.1	-128.3	-11.4	111.1	L117 P118 E119 R124 F125 S126 E230 D231 L234	L117-R122 HydrophobicContact CB-CB 4.34Å; P118-R122 PolarHBondContact O-N 3.01Å; E119-R122 WeakPolarHBondContact O-CB 3.47Å; E119-R122 PolarHBondContact O-N 3.29Å; R122-R124 PolarHBondContact O-N 3.43Å; R122-F125 PolarHBondContact O-N 3.2Å; R122-S126 VanDerWaalsContact O-CB 3.27Å; R122-S126 WeakPolarHBondContact O-CB 3.46Å; R122-S126 PolarHBondContact O-N 3.01Å; R122-E230 IonicContact CZ-OE2 3.6Å; R122-E230 IonicContact NH1-OE2 3.42Å; R122-E230 IonicContact NH2-OE1 2.73Å; R122-E230 IonicContact NH2-OE2 3.98Å; R122-E230 PolarHBondContact NH2-OE2 3.36Å; R122-D231 IonicContact CZ-OD1 2.65Å; R122-D231 IonicContact NE-OD1 3.04Å; R122-D231 PolarHBondContact NE-OD1 3.46Å; R122-D231 IonicContact NH2-OD1 3.67Å; R122-D231 PolarHBondContact NH2-OD1 2.89Å; R122-L234 HydrophobicContact CG-CD1 3.6Å
123	A	86.5	Confident	86.3	Confident	57 Å²	57	68.2 Å²	68.2	47%	0.471	37%	0.368	S	S	.	.	H	α-helix	trans	-59.3	-45.9	176.8	0	0	0	0	0	112	E119 S126 I127	E119-A123 PolarHBondContact O-N 3.38Å; A123-S126 PolarHBondContact O-N 3.23Å; A123-I127 WeakPolarHBondContact O-CG1 3.31Å; A123-I127 PolarHBondContact O-N 2.83Å
124	R	89.3	Confident	85.6	Confident	190 Å²	190	69.5 Å²	69.5	72%	0.717	38%	0.375	S	S	*	.	H	α-helix	trans	-60.8	-49	178.6	-175.6	179.9	178.2	176.6	1.4	112.6	Q120 Q121 R122 S128	Q120-R124 PolarHBondContact O-N 2.75Å; Q121-R124 PolarHBondContact O-N 2.84Å; R122-R124 PolarHBondContact O-N 3.43Å; R124-S128 PolarHBondContact O-N 3.25Å; R124-S128 PolarHBondContact O-OG 3.43Å
125	F	90.3	Very high	84.9	Confident	33 Å²	33	68.3 Å²	68.3	15%	0.145	37%	0.373	C	S	.	.	H	α-helix	trans	-70.3	-34.4	-179.5	-76.1	-61.6	0	0	0	112.3	L117 Q121 R122 I127 S128 C129 L142 I146 L149 L234	L117-F125 HydrophobicContact CD1-CD2 4.09Å; Q121-F125 HydrophobicContact CB-CD2 4.4Å; Q121-F125 HydrophobicContact CB-CE2 4.42Å; Q121-F125 WeakPolarHBondContact O-CD2 3.49Å; Q121-F125 PolarHBondContact O-N 3.13Å; R122-F125 PolarHBondContact O-N 3.2Å; F125-I127 VanDerWaalsContact C-N 3.34Å; F125-I127 PolarHBondContact O-N 3.03Å; F125-S128 PolarHBondContact O-N 3.41Å; F125-S128 VanDerWaalsContact O-N 3.15Å; F125-C129 WeakPolarHBondContact O-CB 3.43Å; F125-C129 PolarHBondContact O-N 3.48Å; F125-C129 PolarHBondContact O-SG 2.92Å; F125-L142 HydrophobicContact CD1-CD2 3.88Å; F125-L142 HydrophobicContact CE1-CD2 4.3Å; F125-I146 HydrophobicContact CB-CD1 4.19Å; F125-I146 HydrophobicContact CB-CG1 4.35Å; F125-I146 HydrophobicContact CD1-CD1 4.24Å; F125-I146 HydrophobicContact CD1-CG1 3.89Å; F125-I146 HydrophobicContact CD2-CG1 4.18Å; F125-I146 HydrophobicContact CE1-CG1 4.22Å; F125-I146 HydrophobicContact CE2-CG1 4.49Å; F125-I146 HydrophobicContact CG-CD1 4.22Å; F125-I146 HydrophobicContact CG-CG1 3.88Å; F125-L149 HydrophobicContact CE2-CD1 3.58Å; F125-L149 HydrophobicContact CZ-CD1 3.71Å; F125-L234 HydrophobicContact CB-CD2 3.84Å
126	S	85.4	Confident	84.4	Confident	37 Å²	37	68.4 Å²	68.4	26%	0.259	37%	0.373	S	S	.	.	H	α-helix	trans	-56.6	-48.2	177.8	-172	0	0	0	0	111.1	R122 A123 S128 C129 S130	R122-S126 VanDerWaalsContact O-CB 3.27Å; R122-S126 WeakPolarHBondContact O-CB 3.46Å; R122-S126 PolarHBondContact O-N 3.01Å; A123-S126 PolarHBondContact O-N 3.23Å; S126-S128 VanDerWaalsContact C-N 3.33Å; S126-S128 PolarHBondContact O-N 3.37Å; S126-C129 PolarHBondContact O-N 3.07Å; S126-C129 VanDerWaalsContact O-N 3.14Å; S126-S130 WeakPolarHBondContact O-CB 3.32Å; S126-S130 PolarHBondContact O-N 3.46Å; S126-S130 PolarHBondContact O-OG 2.86Å
127	I	84.4	Confident	83.8	Confident	133 Å²	133	69.1 Å²	69.1	68%	0.682	38%	0.378	S	S	*	.	H	α-helix	trans	-57.3	-45.4	176.2	-62.3	165.7	0	0	0	111.2	A123 F125	A123-I127 WeakPolarHBondContact O-CG1 3.31Å; A123-I127 PolarHBondContact O-N 2.83Å; F125-I127 VanDerWaalsContact C-N 3.34Å; F125-I127 PolarHBondContact O-N 3.03Å
128	S	85.1	Confident	83.5	Confident	53 Å²	53	73.8 Å²	73.8	37%	0.371	40%	0.4	S	S	.	.	H	α-helix	trans	-68.1	-33.9	179.2	-56.5	0	0	0	0	113.3	R124 F125 S126	R124-S128 PolarHBondContact O-N 3.25Å; R124-S128 PolarHBondContact O-OG 3.43Å; F125-S128 PolarHBondContact O-N 3.41Å; F125-S128 VanDerWaalsContact O-N 3.15Å; S126-S128 VanDerWaalsContact C-N 3.33Å; S126-S128 PolarHBondContact O-N 3.37Å
129	C	83.2	Confident	83.3	Confident	17 Å²	17	72.9 Å²	72.9	12%	0.115	39%	0.39	C	S	.	.	H	α-helix	trans	-78.3	-27.2	-178.4	-65.5	0	0	0	0	112.5	F125 S126 N131 P233 L236	F125-C129 WeakPolarHBondContact O-CB 3.43Å; F125-C129 PolarHBondContact O-N 3.48Å; F125-C129 PolarHBondContact O-SG 2.92Å; S126-C129 PolarHBondContact O-N 3.07Å; S126-C129 VanDerWaalsContact O-N 3.14Å; C129-N131 VanDerWaalsContact C-N 3.27Å; C129-N131 PolarHBondContact O-N 3.15Å; C129-P233 HydrophobicContact CB-CB 4.29Å; C129-P233 WeakPolarHBondContact CB-O 3.22Å; C129-L236 HydrophobicContact CB-CD2 3.72Å; C129-L236 VanDerWaalsContact SG-CD2 3.5Å
130	S	77.5	Confident	83.2	Confident	70 Å²	70	68.6 Å²	68.6	49%	0.49	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-2	179.9	-61.6	0	0	0	0	114.1	S126 P132	S126-S130 WeakPolarHBondContact O-CB 3.32Å; S126-S130 PolarHBondContact O-N 3.46Å; S126-S130 PolarHBondContact O-OG 2.86Å; S130-P132 VanDerWaalsContact O-CD 3.25Å; S130-P132 WeakPolarHBondContact O-CD 3.46Å
131	N	79.4	Confident	83.2	Confident	76 Å²	76	64.9 Å²	64.9	41%	0.406	35%	0.352	S	S	.	.			trans	-66.7	118.1	176.4	-174.8	-6.2	0	0	0	110.8	C129 S133 L134	C129-N131 VanDerWaalsContact C-N 3.27Å; C129-N131 PolarHBondContact O-N 3.15Å; N131-S133 VanDerWaalsContact C-N 3.27Å; N131-S133 PolarHBondContact ND2-OG 2.91Å; N131-S133 PolarHBondContact O-N 3.44Å; N131-S133 PolarHBondContact OD1-N 3.04Å; N131-S133 PolarHBondContact OD1-OG 3.42Å; N131-L134 HydrophobicContact CB-CB 4.46Å; N131-L134 HydrophobicContact CB-CD1 4.29Å; N131-L134 WeakPolarHBondContact O-CB 3.37Å; N131-L134 PolarHBondContact O-N 2.91Å
132	P	70.8	Confident	83.3	Confident	132 Å²	132	62.9 Å²	62.9	86%	0.857	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.2	179.7	-18.8	31.3	0	0	0	113.4	S130 L134	S130-P132 VanDerWaalsContact O-CD 3.25Å; S130-P132 WeakPolarHBondContact O-CD 3.46Å; P132-L134 PolarHBondContact O-N 2.98Å
133	S	73.7	Confident	83.4	Confident	99 Å²	99	62.9 Å²	62.9	69%	0.692	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	15.1	-177.1	76.2	0	0	0	0	113.2	N131 D135	N131-S133 VanDerWaalsContact C-N 3.27Å; N131-S133 PolarHBondContact ND2-OG 2.91Å; N131-S133 PolarHBondContact O-N 3.44Å; N131-S133 PolarHBondContact OD1-N 3.04Å; N131-S133 PolarHBondContact OD1-OG 3.42Å; S133-D135 PolarHBondContact O-N 2.86Å
134	L	78.9	Confident	83.6	Confident	27 Å²	27	67.9 Å²	67.9	14%	0.141	35%	0.354	C	S	.	.			trans	-72.7	119.8	-175.1	-156.1	86.5	0	0	0	111.2	N131 P132 H138 K139 L142	N131-L134 HydrophobicContact CB-CB 4.46Å; N131-L134 HydrophobicContact CB-CD1 4.29Å; N131-L134 WeakPolarHBondContact O-CB 3.37Å; N131-L134 PolarHBondContact O-N 2.91Å; P132-L134 PolarHBondContact O-N 2.98Å; L134-H138 HydrophobicContact CD1-CB 4.47Å; L134-H138 HydrophobicContact CG-CB 4.18Å; L134-K139 HydrophobicContact CD2-CB 4.47Å; L134-K139 HydrophobicContact CD2-CG 3.65Å; L134-K139 HydrophobicContact CG-CG 4.37Å; L134-K139 VanDerWaalsContact O-CE 3.26Å; L134-K139 WeakPolarHBondContact O-CE 3.11Å; L134-L142 HydrophobicContact CD1-CD1 4.05Å; L134-L142 HydrophobicContact CD2-CD1 3.55Å; L134-L142 HydrophobicContact CG-CD1 4.37Å
135	D	78.8	Confident	83.8	Confident	40 Å²	40	60.8 Å²	60.8	21%	0.214	34%	0.337	C	S	.	.			trans	-67.1	154.2	-177.5	-162	12.1	0	0	0	113.2	S133 V137 H138 K139 R905 N1310	S133-D135 PolarHBondContact O-N 2.86Å; D135-V137 VanDerWaalsContact C-N 3.28Å; D135-V137 PolarHBondContact O-N 3.43Å; D135-H138 PolarHBondContact O-N 3.05Å; D135-H138 VanDerWaalsContact O-N 3.13Å; D135-K139 WeakPolarHBondContact O-CG 3.29Å; D135-K139 PolarHBondContact O-N 3.38Å; D135-R905 IonicContact OD1-NH1 2.78Å; D135-R905 IonicContact OD2-CZ 2.69Å; D135-R905 IonicContact OD2-NH1 3.07Å; D135-R905 PolarHBondContact OD2-NH1 3.49Å; D135-N1310 PolarHBondContact OD1-ND2 3.43Å; D135-N1310 PolarHBondContact OD1-OD1 3.3Å; D135-N1310 VanDerWaalsContact OD1-OD1 3.14Å; D135-N1310 PolarHBondContact OD2-OD1 3.42Å
136	Y	82.5	Confident	83.9	Confident	1 Å²	1	59.3 Å²	59.3	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-37.7	-177.8	-175	-133.8	0	0	0	112.7	K139 K140 N1310 L1315 E1327 A1328 Q1333	Y136-K139 WeakPolarHBondContact O-CB 3.36Å; Y136-K139 PolarHBondContact O-N 2.91Å; Y136-K140 VanDerWaalsContact CE1-NZ 3.29Å; Y136-K140 VanDerWaalsContact CZ-NZ 3.31Å; Y136-K140 PolarHBondContact O-N 3.13Å; Y136-K140 WeakPolarHBondContact OH-CE 3.24Å; Y136-K140 PolarHBondContact OH-NZ 2.98Å; Y136-N1310 HydrophobicContact CD1-CB 3.89Å; Y136-N1310 HydrophobicContact CG-CB 4.25Å; Y136-L1315 HydrophobicContact CE1-CD1 4.23Å; Y136-E1327 WeakPolarHBondContact OH-CB 3.27Å; Y136-E1327 WeakPolarHBondContact OH-CG 3.46Å; Y136-A1328 PolarHBondContact OH-N 3.16Å; Y136-Q1333 HydrophobicContact CD2-CG 4.06Å; Y136-Q1333 HydrophobicContact CG-CG 4.38Å
137	V	81.8	Confident	84.3	Confident	18 Å²	18	59.4 Å²	59.4	11%	0.109	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-45.7	176.5	-179.2	0	0	0	0	111	D135 K139 K140 Q141 A1306	D135-V137 VanDerWaalsContact C-N 3.28Å; D135-V137 PolarHBondContact O-N 3.43Å; V137-K139 VanDerWaalsContact C-N 3.33Å; V137-K139 PolarHBondContact O-N 3.28Å; V137-K140 PolarHBondContact O-N 3.29Å; V137-K140 VanDerWaalsContact O-N 3.15Å; V137-Q141 WeakPolarHBondContact O-CG 3.49Å; V137-Q141 PolarHBondContact O-N 3.03Å; V137-Q141 VanDerWaalsContact O-N 3.09Å; V137-A1306 WeakPolarHBondContact CG2-O 3.22Å
138	H	84.5	Confident	84.7	Confident	97 Å²	97	58.9 Å²	58.9	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-38.4	178	-69.5	116.6	0	0	0	111.7	L134 D135 K140 Q141 L142	L134-H138 HydrophobicContact CD1-CB 4.47Å; L134-H138 HydrophobicContact CG-CB 4.18Å; D135-H138 PolarHBondContact O-N 3.05Å; D135-H138 VanDerWaalsContact O-N 3.13Å; H138-K140 VanDerWaalsContact C-N 3.34Å; H138-K140 PolarHBondContact O-N 3.48Å; H138-Q141 PolarHBondContact O-N 3.09Å; H138-L142 WeakPolarHBondContact O-CB 3.39Å; H138-L142 PolarHBondContact O-N 3.39Å
139	K	86.2	Confident	85.1	Confident	37 Å²	37	59.1 Å²	59.1	16%	0.161	32%	0.316	C	S	.	.	H	α-helix	trans	-53.3	-50.7	170.5	-73.9	177	-174.3	175.2	0	111	L134 D135 Y136 V137 Q141 L142 R143 L236	L134-K139 HydrophobicContact CD2-CB 4.47Å; L134-K139 HydrophobicContact CD2-CG 3.65Å; L134-K139 HydrophobicContact CG-CG 4.37Å; L134-K139 VanDerWaalsContact O-CE 3.26Å; L134-K139 WeakPolarHBondContact O-CE 3.11Å; D135-K139 WeakPolarHBondContact O-CG 3.29Å; D135-K139 PolarHBondContact O-N 3.38Å; Y136-K139 WeakPolarHBondContact O-CB 3.36Å; Y136-K139 PolarHBondContact O-N 2.91Å; V137-K139 VanDerWaalsContact C-N 3.33Å; V137-K139 PolarHBondContact O-N 3.28Å; K139-Q141 VanDerWaalsContact C-N 3.31Å; K139-Q141 PolarHBondContact O-N 3.4Å; K139-L142 PolarHBondContact O-N 2.87Å; K139-R143 PolarHBondContact O-N 3.44Å; K139-L236 VanDerWaalsContact C-CD1 3.44Å; K139-L236 HydrophobicContact CB-CD1 3.78Å; K139-L236 HydrophobicContact CG-CD1 4.27Å; K139-L236 WeakPolarHBondContact O-CD1 3.33Å
140	K	85.6	Confident	85.5	Confident	46 Å²	46	58.3 Å²	58.3	20%	0.2	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-40	179.7	-65.9	-177.2	-168.7	-164.4	0	112.8	Y136 V137 H138 K144 E1327	Y136-K140 VanDerWaalsContact CE1-NZ 3.29Å; Y136-K140 VanDerWaalsContact CZ-NZ 3.31Å; Y136-K140 PolarHBondContact O-N 3.13Å; Y136-K140 WeakPolarHBondContact OH-CE 3.24Å; Y136-K140 PolarHBondContact OH-NZ 2.98Å; V137-K140 PolarHBondContact O-N 3.29Å; V137-K140 VanDerWaalsContact O-N 3.15Å; H138-K140 VanDerWaalsContact C-N 3.34Å; H138-K140 PolarHBondContact O-N 3.48Å; K140-K144 WeakPolarHBondContact O-CB 3.49Å; K140-K144 PolarHBondContact O-N 3.02Å; K140-E1327 WeakPolarHBondContact CD-OE1 3.16Å; K140-E1327 WeakPolarHBondContact CE-OE1 3.41Å; K140-E1327 VanDerWaalsContact CE-OE2 3.3Å; K140-E1327 WeakPolarHBondContact CE-OE2 2.92Å; K140-E1327 VanDerWaalsContact NZ-CD 3.26Å; K140-E1327 IonicContact NZ-OE1 3.53Å; K140-E1327 IonicContact NZ-OE2 3.32Å; K140-E1327 PolarHBondContact NZ-OE2 2.91Å
141	Q	86.8	Confident	86	Confident	102 Å²	102	57.3 Å²	57.3	48%	0.477	30%	0.304	S	S	.	.	H	α-helix	trans	-65.7	-47.3	177.9	-68	178.4	2.2	0	0	111.9	V137 H138 K139 K144 A145	V137-Q141 WeakPolarHBondContact O-CG 3.49Å; V137-Q141 PolarHBondContact O-N 3.03Å; V137-Q141 VanDerWaalsContact O-N 3.09Å; H138-Q141 PolarHBondContact O-N 3.09Å; K139-Q141 VanDerWaalsContact C-N 3.31Å; K139-Q141 PolarHBondContact O-N 3.4Å; Q141-K144 PolarHBondContact O-N 3.02Å; Q141-A145 PolarHBondContact O-N 2.98Å
142	L	90.3	Very high	86.5	Confident	30 Å²	30	61.4 Å²	61.4	16%	0.157	31%	0.314	C	S	.	.	H	α-helix	trans	-58.3	-48.9	176.3	-95.9	147.3	0	0	0	111.4	F125 L134 H138 K139 K144 A145 I146 L236	F125-L142 HydrophobicContact CD1-CD2 3.88Å; F125-L142 HydrophobicContact CE1-CD2 4.3Å; L134-L142 HydrophobicContact CD1-CD1 4.05Å; L134-L142 HydrophobicContact CD2-CD1 3.55Å; L134-L142 HydrophobicContact CG-CD1 4.37Å; H138-L142 WeakPolarHBondContact O-CB 3.39Å; H138-L142 PolarHBondContact O-N 3.39Å; K139-L142 PolarHBondContact O-N 2.87Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-K144 PolarHBondContact O-N 2.79Å; L142-A145 WeakPolarHBondContact O-CB 3.26Å; L142-A145 PolarHBondContact O-N 2.85Å; L142-A145 VanDerWaalsContact O-N 3.12Å; L142-I146 WeakPolarHBondContact O-CG1 3.49Å; L142-I146 PolarHBondContact O-N 2.9Å; L142-L236 HydrophobicContact CB-CD1 4.08Å
143	R	90.9	Very high	87.4	Confident	25 Å²	25	56.9 Å²	56.9	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-57.3	-43.1	175.9	-177.8	178.8	-177.9	175.6	10.4	112.2	H100 K139 A145 H147 L236 Y1330 H1331	H100-R143 PolarHBondContact CE1-NH1 2.8Å; H100-R143 VanDerWaalsContact CE1-NH1 3.29Å; H100-R143 VanDerWaalsContact ND1-CZ 3.29Å; H100-R143 PolarHBondContact ND1-NH1 3.11Å; H100-R143 PolarHBondContact ND1-NH2 3.32Å; K139-R143 PolarHBondContact O-N 3.44Å; R143-A145 VanDerWaalsContact C-N 3.34Å; R143-H147 WeakPolarHBondContact O-CB 3.32Å; R143-H147 PolarHBondContact O-N 3.1Å; R143-L236 HydrophobicContact CB-CD1 3.88Å; R143-Y1330 VanDerWaalsContact NH1-CD1 3.29Å; R143-Y1330 PolarHBondContact NH2-OH 3.45Å; R143-H1331 PolarHBondContact NH1-NE2 3.13Å
144	K	91.1	Very high	88.1	Confident	162 Å²	162	55.1 Å²	55.1	70%	0.704	26%	0.264	S	S	*	.	H	α-helix	trans	-66	-37.7	178.9	-171.2	179.4	179.6	-176.7	0	111.6	K140 Q141 L142 K148	K140-K144 WeakPolarHBondContact O-CB 3.49Å; K140-K144 PolarHBondContact O-N 3.02Å; Q141-K144 PolarHBondContact O-N 3.02Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-K144 PolarHBondContact O-N 2.79Å; K144-K148 VanDerWaalsContact O-CB 3.28Å; K144-K148 WeakPolarHBondContact O-CB 3.43Å; K144-K148 PolarHBondContact O-N 3.29Å
145	A	92.8	Very high	88.6	Confident	42 Å²	42	57.7 Å²	57.7	35%	0.347	28%	0.281	S	S	.	.	H	α-helix	trans	-66.4	-48.8	175.9	0	0	0	0	0	111.5	Q141 L142 R143 K148 L149	Q141-A145 PolarHBondContact O-N 2.98Å; L142-A145 WeakPolarHBondContact O-CB 3.26Å; L142-A145 PolarHBondContact O-N 2.85Å; L142-A145 VanDerWaalsContact O-N 3.12Å; R143-A145 VanDerWaalsContact C-N 3.34Å; A145-K148 PolarHBondContact O-N 3.07Å; A145-L149 WeakPolarHBondContact O-CG 3.49Å; A145-L149 PolarHBondContact O-N 2.82Å
146	I	93.1	Very high	89.2	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-52.3	176.9	-69.2	168.9	0	0	0	110.2	T107 L117 F125 L142 K148 L149 S150 L234	T107-I146 HydrophobicContact CG2-CG2 4.34Å; L117-I146 HydrophobicContact CD1-CG2 4.06Å; F125-I146 HydrophobicContact CB-CD1 4.19Å; F125-I146 HydrophobicContact CB-CG1 4.35Å; F125-I146 HydrophobicContact CD1-CD1 4.24Å; F125-I146 HydrophobicContact CD1-CG1 3.89Å; F125-I146 HydrophobicContact CD2-CG1 4.18Å; F125-I146 HydrophobicContact CE1-CG1 4.22Å; F125-I146 HydrophobicContact CE2-CG1 4.49Å; F125-I146 HydrophobicContact CG-CD1 4.22Å; F125-I146 HydrophobicContact CG-CG1 3.88Å; L142-I146 WeakPolarHBondContact O-CG1 3.49Å; L142-I146 PolarHBondContact O-N 2.9Å; I146-K148 VanDerWaalsContact C-N 3.33Å; I146-K148 PolarHBondContact O-N 3.04Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-L149 VanDerWaalsContact O-N 3.13Å; I146-S150 WeakPolarHBondContact O-CB 2.83Å; I146-S150 PolarHBondContact O-N 2.78Å; I146-S150 PolarHBondContact O-OG 2.9Å; I146-L234 WeakPolarHBondContact CD1-O 3.29Å
147	H	93.5	Very high	89.6	Confident	38 Å²	38	59 Å²	59	18%	0.176	29%	0.291	C	S	.	.	H	α-helix	trans	-56.4	-43.3	178.8	173.2	-98.6	0	0	0	112.9	Q106 R143 L149 S150 S151	Q106-H147 PolarHBondContact OE1-CE1 2.93Å; Q106-H147 PolarHBondContact OE1-NE2 2.81Å; R143-H147 WeakPolarHBondContact O-CB 3.32Å; R143-H147 PolarHBondContact O-N 3.1Å; H147-L149 VanDerWaalsContact C-N 3.3Å; H147-L149 PolarHBondContact O-N 2.88Å; H147-S150 WeakPolarHBondContact CA-OG 3.44Å; H147-S150 PolarHBondContact O-N 2.89Å; H147-S150 PolarHBondContact O-OG 2.94Å; H147-S150 VanDerWaalsContact O-OG 3.05Å; H147-S151 WeakPolarHBondContact O-CB 3.46Å; H147-S151 PolarHBondContact O-N 3.38Å; H147-S151 PolarHBondContact O-OG 3.28Å
148	K	93.1	Very high	90	Very high	122 Å²	122	61.7 Å²	61.7	53%	0.53	30%	0.302	S	S	.	.	H	α-helix	trans	-65.2	-33.7	179.9	-176.8	-178.8	178.7	-173.8	0	112.6	K144 A145 I146 R152	K144-K148 VanDerWaalsContact O-CB 3.28Å; K144-K148 WeakPolarHBondContact O-CB 3.43Å; K144-K148 PolarHBondContact O-N 3.29Å; A145-K148 PolarHBondContact O-N 3.07Å; I146-K148 VanDerWaalsContact C-N 3.33Å; I146-K148 PolarHBondContact O-N 3.04Å; K148-R152 WeakPolarHBondContact O-CD 3.49Å; K148-R152 WeakPolarHBondContact O-CG 3.43Å
149	L	92.8	Very high	90.4	Very high	59 Å²	59	59.6 Å²	59.6	31%	0.309	30%	0.297	S	S	.	.	H	α-helix	trans	-76.4	-49.7	176.6	-69.8	171	0	0	0	110.4	L117 F125 A145 I146 H147 S151 R152	L117-L149 HydrophobicContact CD2-CB 3.9Å; F125-L149 HydrophobicContact CE2-CD1 3.58Å; F125-L149 HydrophobicContact CZ-CD1 3.71Å; A145-L149 WeakPolarHBondContact O-CG 3.49Å; A145-L149 PolarHBondContact O-N 2.82Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-L149 VanDerWaalsContact O-N 3.13Å; H147-L149 VanDerWaalsContact C-N 3.3Å; H147-L149 PolarHBondContact O-N 2.88Å; L149-S151 PolarHBondContact O-N 2.96Å; L149-R152 PolarHBondContact O-N 3.45Å
150	S	91.1	Very high	90.5	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-38.3	-178.1	64.3	0	0	0	0	112.9	T107 L116 I146 H147 R152 V153	T107-S150 WeakPolarHBondContact CG2-OG 3.25Å; L116-S150 WeakPolarHBondContact O-CA 3.41Å; I146-S150 WeakPolarHBondContact O-CB 2.83Å; I146-S150 PolarHBondContact O-N 2.78Å; I146-S150 PolarHBondContact O-OG 2.9Å; H147-S150 WeakPolarHBondContact CA-OG 3.44Å; H147-S150 PolarHBondContact O-N 2.89Å; H147-S150 PolarHBondContact O-OG 2.94Å; H147-S150 VanDerWaalsContact O-OG 3.05Å; S150-R152 PolarHBondContact O-N 2.86Å; S150-R152 VanDerWaalsContact O-N 3.09Å; S150-V153 PolarHBondContact O-N 3.4Å
151	S	89.7	Confident	90.7	Very high	49 Å²	49	60.9 Å²	60.9	34%	0.343	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11	-179.3	74.6	0	0	0	0	113.8	H147 L149	H147-S151 WeakPolarHBondContact O-CB 3.46Å; H147-S151 PolarHBondContact O-N 3.38Å; H147-S151 PolarHBondContact O-OG 3.28Å; L149-S151 PolarHBondContact O-N 2.96Å
152	R	88.9	Confident	90.7	Very high	162 Å²	162	57.9 Å²	57.9	61%	0.611	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-9.1	175.8	-66.1	174.4	178.6	-166.2	-6.3	112.6	K148 L149 S150 H154	K148-R152 WeakPolarHBondContact O-CD 3.49Å; K148-R152 WeakPolarHBondContact O-CG 3.43Å; L149-R152 PolarHBondContact O-N 3.45Å; S150-R152 PolarHBondContact O-N 2.86Å; S150-R152 VanDerWaalsContact O-N 3.09Å; R152-H154 PolarHBondContact O-N 3.47Å
153	V	89.4	Confident	90.7	Very high	36 Å²	36	56.6 Å²	56.6	22%	0.218	30%	0.299	C	S	.	.			trans	-89.5	106	-179.3	178.2	0	0	0	0	108.6	L116 S150 V155	L116-V153 HydrophobicContact CB-CB 4.18Å; L116-V153 HydrophobicContact CB-CG1 4.27Å; S150-V153 PolarHBondContact O-N 3.4Å; V153-V155 WeakPolarHBondContact CG1-O 3.4Å
154	H	88.5	Confident	90.5	Very high	63 Å²	63	55.9 Å²	55.9	29%	0.292	30%	0.299	S	S	.	.			trans	-93.5	-15.2	-176.1	-58.4	-53	0	0	0	114.3	R152 N163 H182	R152-H154 PolarHBondContact O-N 3.47Å; H154-N163 WeakPolarHBondContact CA-O 3.49Å; H154-N163 PolarHBondContact ND1-O 3.38Å; H154-N163 PolarHBondContact O-N 3.24Å; H154-H182 AromaticContact CE1-CD2 3.25Å; H154-H182 PolarHBondContact CE1-CD2 3.12Å; H154-H182 AromaticContact CE1-CG 3.89Å; H154-H182 AromaticContact CE1-NE2 3.83Å; H154-H182 AromaticContact ND1-CD2 3.75Å; H154-H182 AromaticContact NE2-CD2 3.56Å; H154-H182 AromaticContact NE2-CG 3.75Å
155	V	90.4	Very high	90.5	Very high	80 Å²	80	50.1 Å²	50.1	49%	0.485	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-120	126	175.5	-178.7	0	0	0	0	107.3	V153 L162	V153-V155 WeakPolarHBondContact CG1-O 3.4Å; V155-L162 HydrophobicContact CG2-CD2 4.21Å
156	C	91.5	Very high	90.5	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	26%	0.261	C	S	.	.			trans	-66	127.9	-178.5	-178.5	0	0	0	0	110.4	C109 C112 L116 F158 C159 S160 A161	C109-C156 HydrophobicContact CB-CB 4.35Å; C112-C156 VanDerWaalsContact SG-SG 3.68Å; L116-C156 HydrophobicContact CD2-CB 3.99Å; C156-F158 PolarHBondContact O-N 3.17Å; C156-F158 PolarHBondContact SG-N 3.3Å; C156-F158 VanDerWaalsContact SG-N 3.44Å; C156-C159 VanDerWaalsContact SG-SG 3.61Å; C156-S160 VanDerWaalsContact O-CA 3.24Å; C156-S160 WeakPolarHBondContact O-CA 3.46Å; C156-S160 PolarHBondContact O-N 3.1Å; C156-A161 PolarHBondContact N-O 3.25Å
157	P	89.9	Confident	90.5	Very high	67 Å²	67	51.3 Å²	51.3	44%	0.435	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.1	178	24.9	-31	0	0	0	113.9
158	F	89.9	Confident	90.3	Very high	75 Å²	75	53.2 Å²	53.2	33%	0.329	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-43.4	-176.5	-61	-80.9	0	0	0	113.7	R114 C156	R114-F158 HydrophobicContact CB-CD2 3.85Å; R114-F158 HydrophobicContact CB-CE2 4.18Å; R114-F158 HydrophobicContact CB-CG 4.42Å; R114-F158 HydrophobicContact CG-CD2 4.45Å; C156-F158 PolarHBondContact O-N 3.17Å; C156-F158 PolarHBondContact SG-N 3.3Å; C156-F158 VanDerWaalsContact SG-N 3.44Å
159	C	92.3	Very high	89.8	Confident	53 Å²	53	48 Å²	48	36%	0.358	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	1.9	-176.2	70	0	0	0	0	114	C109 C112 C156 A161	C109-C159 VanDerWaalsContact SG-SG 3.63Å; C112-C159 HydrophobicContact CB-CB 4.06Å; C156-C159 VanDerWaalsContact SG-SG 3.61Å; C159-A161 PolarHBondContact O-N 3.18Å; C159-A161 VanDerWaalsContact SG-CB 3.52Å
160	S	89	Confident	89.3	Confident	90 Å²	90	51.2 Å²	51.2	63%	0.629	29%	0.291	S	S	*	.			trans	60.9	7.7	-178.9	-55	0	0	0	0	115.9	C156	C156-S160 VanDerWaalsContact O-CA 3.24Å; C156-S160 WeakPolarHBondContact O-CA 3.46Å; C156-S160 PolarHBondContact O-N 3.1Å
161	A	88.9	Confident	88.8	Confident	21 Å²	21	52.5 Å²	52.5	17%	0.174	30%	0.3	C	S	.	.			trans	-68.3	147.4	176.3	0	0	0	0	0	112.5	T111 C156 C159 N163	T111-A161 HydrophobicContact CG2-CB 4.47Å; T111-A161 VanDerWaalsContact OG1-CB 3.26Å; T111-A161 WeakPolarHBondContact OG1-CB 3.31Å; C156-A161 PolarHBondContact N-O 3.25Å; C159-A161 PolarHBondContact O-N 3.18Å; C159-A161 VanDerWaalsContact SG-CB 3.52Å; A161-N163 PolarHBondContact O-ND2 2.81Å
162	L	88.6	Confident	88.4	Confident	39 Å²	39	50.9 Å²	50.9	20%	0.204	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-75.7	133.7	176.4	-70.4	159.4	0	0	0	110.9	V155 I179 F180 A183 K186	V155-L162 HydrophobicContact CG2-CD2 4.21Å; L162-I179 HydrophobicContact CB-CG2 4.11Å; L162-F180 HydrophobicContact CD1-CE1 4.17Å; L162-A183 HydrophobicContact CD2-CB 4.06Å; L162-K186 HydrophobicContact CD1-CD 3.6Å
163	N	89.6	Confident	88.2	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.016	26%	0.258	C	S	.	.			trans	-128.5	101.2	178.2	-72	-86.1	0	0	0	108.7	C109 K110 L116 H154 A161	C109-N163 VanDerWaalsContact CA-OD1 3.31Å; C109-N163 WeakPolarHBondContact CA-OD1 3.42Å; C109-N163 PolarHBondContact SG-ND2 3.46Å; C109-N163 VanDerWaalsContact SG-ND2 3.42Å; K110-N163 WeakPolarHBondContact CE-OD1 3.12Å; K110-N163 PolarHBondContact N-OD1 3.46Å; K110-N163 PolarHBondContact NZ-OD1 2.83Å; L116-N163 HydrophobicContact CD1-CB 3.93Å; H154-N163 WeakPolarHBondContact CA-O 3.49Å; H154-N163 PolarHBondContact ND1-O 3.38Å; H154-N163 PolarHBondContact O-N 3.24Å; A161-N163 PolarHBondContact O-ND2 2.81Å
164	G	87.2	Confident	88.2	Confident	10 Å²	10	43.9 Å²	43.9	10%	0.103	26%	0.257	C	S	.	.			trans	-84.6	-163.5	179.6	0	0	0	0	0	113.4	H177 D178	G164-H177 PolarHBondContact N-NE2 2.87Å; G164-D178 CarbonylContact C-O 3.54Å; G164-D178 WeakPolarHBondContact CA-O 3.5Å
165	V	90.6	Very high	88.4	Confident	41 Å²	41	41 Å²	41	25%	0.248	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.2	-176.5	-176.9	0	0	0	0	109.4	T167 D178 R181 H182	V165-T167 HydrophobicContact CG1-CG2 4.12Å; V165-D178 PolarHBondContact N-O 2.91Å; V165-D178 PolarHBondContact O-N 3.2Å; V165-R181 HydrophobicContact CG2-CB 4.13Å; V165-R181 HydrophobicContact CG2-CG 4.06Å; V165-H182 VanDerWaalsContact CG2-NE2 3.31Å; V165-H182 WeakPolarHBondContact CG2-NE2 3.41Å
166	V	93.3	Very high	88.5	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.3	175.8	-179.3	0	0	0	0	109.5	L105 Q106 K110 V175 V176 H177	L105-V166 HydrophobicContact CB-CG1 3.95Å; Q106-V166 HydrophobicContact CG-CB 3.75Å; Q106-V166 HydrophobicContact CG-CG1 4.41Å; Q106-V166 PolarHBondContact NE2-O 3.17Å; K110-V166 HydrophobicContact CD-CG2 4.38Å; V166-V175 HydrophobicContact CG1-CG1 3.35Å; V166-V176 CarbonylContact C-O 3.47Å; V166-V176 VanDerWaalsContact CA-O 3.31Å; V166-V176 WeakPolarHBondContact CA-O 3.16Å; V166-H177 HydrophobicContact CG2-CB 4.2Å
167	T	92.2	Very high	88.6	Confident	68 Å²	68	38.4 Å²	38.4	42%	0.417	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	153	178.7	52.5	0	0	0	0	111.3	V165 V175 V176	V165-T167 HydrophobicContact CG1-CG2 4.12Å; T167-V175 VanDerWaalsContact O-CG1 3.3Å; T167-V175 WeakPolarHBondContact O-CG1 3.44Å; T167-V176 PolarHBondContact N-O 3.38Å; T167-V176 PolarHBondContact O-N 2.9Å
168	K	88.7	Confident	88.6	Confident	78 Å²	78	36.6 Å²	36.6	34%	0.339	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	138.5	172.6	-171.2	-169.3	168.9	-171.2	0	110.2	T98 V102	T98-K168 HydrophobicContact CG2-CD 4.45Å; T98-K168 HydrophobicContact CG2-CG 4.45Å; V102-K168 HydrophobicContact CG2-CB 4.4Å
169	G	84.4	Confident	88.4	Confident	11 Å²	11	34.4 Å²	34.4	11%	0.113	21%	0.206	C	C	.	.			trans	-66.9	172.5	171.7	0	0	0	0	0	113.1	S171 Y174	G169-S171 CarbonylContact C-O 3.58Å; G169-Y174 WeakPolarHBondContact CA-O 3.42Å; G169-Y174 PolarHBondContact N-O 3.42Å; G169-Y174 VanDerWaalsContact N-O 3.14Å
170	T	81.4	Confident	87.9	Confident	127 Å²	127	32.6 Å²	32.6	78%	0.779	19%	0.193	S	C	*	.	S	Bend	trans	-70.1	-41.6	173.2	46.7	0	0	0	0	110.9	Y174	T170-Y174 PolarHBondContact OG1-OH 3.31Å
171	S	81.4	Confident	87.4	Confident	27 Å²	27	35.4 Å²	35.4	19%	0.189	19%	0.189	C	C	.	.	S	Bend	trans	-83.9	158.3	168.3	-173.1	0	0	0	0	111.3	G169 S173 D307	G169-S171 CarbonylContact C-O 3.58Å; S171-S173 PolarHBondContact O-N 3.01Å; S171-S173 PolarHBondContact OG-OG 3.05Å; S171-D307 WeakPolarHBondContact CB-OD2 3.15Å; S171-D307 PolarHBondContact OG-OD2 3.43Å
172	L	80.5	Confident	86.7	Confident	16 Å²	16	39.7 Å²	39.7	8%	0.084	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.1	174.6	-69.9	168.1	0	0	0	112.7	Y93 A314 Q321 L324	Y93-L172 WeakPolarHBondContact CD2-O 3.41Å; L172-A314 HydrophobicContact CD1-CB 3.96Å; L172-Q321 HydrophobicContact CD1-CG 4.34Å; L172-L324 HydrophobicContact CD1-CD2 3.73Å
173	S	84.6	Confident	86.1	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-11.6	-172.4	60.6	0	0	0	0	115.1	S171 P217 D307 H310	S171-S173 PolarHBondContact O-N 3.01Å; S171-S173 PolarHBondContact OG-OG 3.05Å; S173-P217 VanDerWaalsContact O-CD 3.32Å; S173-P217 WeakPolarHBondContact O-CD 3.35Å; S173-D307 WeakPolarHBondContact CB-OD1 3.44Å; S173-D307 PolarHBondContact OG-OD1 3.03Å; S173-H310 VanDerWaalsContact CB-ND1 3.3Å; S173-H310 WeakPolarHBondContact CB-ND1 3.47Å
174	Y	89.9	Confident	85.2	Confident	50 Å²	50	46.8 Å²	46.8	20%	0.196	24%	0.239	C	C	.	.			trans	-148	160.3	-177.3	69.4	-90.6	0	0	0	114.5	G169 T170 V176 I214	G169-Y174 WeakPolarHBondContact CA-O 3.42Å; G169-Y174 PolarHBondContact N-O 3.42Å; G169-Y174 VanDerWaalsContact N-O 3.14Å; T170-Y174 PolarHBondContact OG1-OH 3.31Å; Y174-V176 HydrophobicContact CD2-CG2 3.88Å; Y174-V176 HydrophobicContact CE2-CG2 3.59Å; Y174-I214 HydrophobicContact CD2-CG2 3.71Å; Y174-I214 HydrophobicContact CG-CG2 3.8Å
175	V	92.7	Very high	84.4	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.3	172.8	-178.9	0	0	0	0	108.2	Y93 V102 L105 V166 T167 I215	Y93-V175 HydrophobicContact CE2-CG2 4.07Å; V102-V175 HydrophobicContact CG2-CG1 4.19Å; V102-V175 HydrophobicContact CG2-CG2 3.95Å; L105-V175 HydrophobicContact CD1-CB 4.16Å; L105-V175 HydrophobicContact CD1-CG1 4Å; L105-V175 HydrophobicContact CD1-CG2 4.19Å; V166-V175 HydrophobicContact CG1-CG1 3.35Å; T167-V175 VanDerWaalsContact O-CG1 3.3Å; T167-V175 WeakPolarHBondContact O-CG1 3.44Å; V175-I215 HydrophobicContact CB-CB 4.4Å; V175-I215 PolarHBondContact N-O 2.82Å; V175-I215 PolarHBondContact O-N 3.02Å
176	V	92.6	Very high	83.5	Confident	25 Å²	25	53.6 Å²	53.6	15%	0.152	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.5	-179.4	-178.1	0	0	0	0	109.6	V166 T167 Y174 L212	V166-V176 CarbonylContact C-O 3.47Å; V166-V176 VanDerWaalsContact CA-O 3.31Å; V166-V176 WeakPolarHBondContact CA-O 3.16Å; T167-V176 PolarHBondContact N-O 3.38Å; T167-V176 PolarHBondContact O-N 2.9Å; Y174-V176 HydrophobicContact CD2-CG2 3.88Å; Y174-V176 HydrophobicContact CE2-CG2 3.59Å; V176-L212 HydrophobicContact CG1-CB 4.31Å; V176-L212 HydrophobicContact CG1-CD2 3.83Å; V176-L212 HydrophobicContact CG1-CG 4.5Å
177	H	92.8	Very high	82.6	Confident	3 Å²	3	54.5 Å²	54.5	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	108.4	172.1	174.2	-142.9	0	0	0	109.3	K110 G164 V166 I179 E213 I215	K110-H177 VanDerWaalsContact CE-CE1 3.41Å; K110-H177 WeakPolarHBondContact CE-CE1 3.18Å; K110-H177 WeakPolarHBondContact CE-NE2 3.25Å; G164-H177 PolarHBondContact N-NE2 2.87Å; V166-H177 HydrophobicContact CG2-CB 4.2Å; H177-I179 PolarHBondContact O-N 3.5Å; H177-E213 HydrophobicContact CB-CB 4.17Å; H177-E213 IonicContact CE1-OE2 3.82Å; H177-E213 IonicContact CG-OE2 3.75Å; H177-E213 PolarHBondContact N-O 3.31Å; H177-E213 IonicContact ND1-OE2 3.06Å; H177-E213 PolarHBondContact ND1-OE2 2.93Å; H177-E213 PolarHBondContact O-N 2.81Å; H177-I215 HydrophobicContact CB-CD1 3.88Å; H177-I215 HydrophobicContact CB-CG1 4.33Å
178	D	89.6	Confident	81.6	Confident	28 Å²	28	55.8 Å²	55.8	15%	0.15	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	88.6	178.5	-179.3	-13.6	0	0	0	109	G164 V165 F180 R181 L212	G164-D178 CarbonylContact C-O 3.54Å; G164-D178 WeakPolarHBondContact CA-O 3.5Å; V165-D178 PolarHBondContact N-O 2.91Å; V165-D178 PolarHBondContact O-N 3.2Å; D178-F180 PolarHBondContact O-N 2.66Å; D178-R181 PolarHBondContact OD1-N 2.81Å; D178-R181 WeakPolarHBondContact OD2-CD 3.38Å; D178-R181 IonicContact OD2-NH1 3.55Å; D178-L212 HydrophobicContact CB-CD2 3.76Å
179	I	85.8	Confident	81	Confident	29 Å²	29	58.3 Å²	58.3	15%	0.149	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-43	-168.3	-57.9	166.6	0	0	0	111.1	L162 H177 G211 E213	L162-I179 HydrophobicContact CB-CG2 4.11Å; H177-I179 PolarHBondContact O-N 3.5Å; I179-G211 PolarHBondContact N-O 3.17Å; I179-E213 HydrophobicContact CD1-CB 4.04Å; I179-E213 HydrophobicContact CG1-CB 4.43Å
180	F	81.9	Confident	80.6	Confident	16 Å²	16	61.1 Å²	61.1	7%	0.07	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	5.7	-167.1	-55.1	-67.7	0	0	0	115.3	L162 D178 H182 A183 K186 V187 Y190	L162-F180 HydrophobicContact CD1-CE1 4.17Å; D178-F180 PolarHBondContact O-N 2.66Å; F180-H182 PolarHBondContact O-N 2.83Å; F180-A183 CarbonylContact O-C 3.4Å; F180-A183 PolarHBondContact O-N 3.11Å; F180-K186 HydrophobicContact CD1-CB 4.48Å; F180-K186 HydrophobicContact CE1-CB 4.46Å; F180-V187 HydrophobicContact CB-CG2 3.47Å; F180-V187 VanDerWaalsContact CB-CG2 3.47Å; F180-V187 HydrophobicContact CD1-CG2 4.41Å; F180-V187 HydrophobicContact CD2-CG2 4.32Å; F180-V187 HydrophobicContact CG-CG2 3.84Å; F180-Y190 HydrophobicContact CD2-CD1 4.46Å; F180-Y190 AromaticContact CE2-CD1 3.43Å; F180-Y190 HydrophobicContact CE2-CD1 3.43Å; F180-Y190 VanDerWaalsContact CE2-CD1 3.43Å; F180-Y190 HydrophobicContact CE2-CD2 4.12Å; F180-Y190 AromaticContact CE2-CE1 3.87Å; F180-Y190 HydrophobicContact CE2-CE1 3.87Å; F180-Y190 HydrophobicContact CE2-CE2 4.48Å; F180-Y190 AromaticContact CE2-CG 3.56Å; F180-Y190 HydrophobicContact CE2-CG 3.56Å; F180-Y190 AromaticContact CZ-CD1 3.84Å; F180-Y190 HydrophobicContact CZ-CD1 3.84Å; F180-Y190 AromaticContact CZ-CD2 3.71Å; F180-Y190 HydrophobicContact CZ-CD2 3.71Å; F180-Y190 HydrophobicContact CZ-CE1 4.43Å; F180-Y190 HydrophobicContact CZ-CE2 4.3Å; F180-Y190 AromaticContact CZ-CG 3.42Å; F180-Y190 HydrophobicContact CZ-CG 3.42Å; F180-Y190 VanDerWaalsContact CZ-CG 3.42Å
181	R	79.3	Confident	80.3	Confident	148 Å²	148	56 Å²	56	56%	0.558	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-41.7	178.7	-171.5	132.4	-179.1	162.9	1.2	114.5	V165 D178	V165-R181 HydrophobicContact CG2-CB 4.13Å; V165-R181 HydrophobicContact CG2-CG 4.06Å; D178-R181 PolarHBondContact OD1-N 2.81Å; D178-R181 WeakPolarHBondContact OD2-CD 3.38Å; D178-R181 IonicContact OD2-NH1 3.55Å
182	H	74.7	Confident	80.2	Confident	111 Å²	111	60.1 Å²	60.1	51%	0.514	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	2.3	-177.8	-62.4	-64.6	0	0	0	113.7	H154 V165 F180	H154-H182 AromaticContact CE1-CD2 3.25Å; H154-H182 PolarHBondContact CE1-CD2 3.12Å; H154-H182 AromaticContact CE1-CG 3.89Å; H154-H182 AromaticContact CE1-NE2 3.83Å; H154-H182 AromaticContact ND1-CD2 3.75Å; H154-H182 AromaticContact NE2-CD2 3.56Å; H154-H182 AromaticContact NE2-CG 3.75Å; V165-H182 VanDerWaalsContact CG2-NE2 3.31Å; V165-H182 WeakPolarHBondContact CG2-NE2 3.41Å; F180-H182 PolarHBondContact O-N 2.83Å
183	A	75.5	Confident	80.2	Confident	24 Å²	24	66.4 Å²	66.4	20%	0.198	33%	0.328	C	S	.	.			trans	-132.8	52.4	-174.8	0	0	0	0	0	111.5	L162 F180 A185 K186	L162-A183 HydrophobicContact CD2-CB 4.06Å; F180-A183 CarbonylContact O-C 3.4Å; F180-A183 PolarHBondContact O-N 3.11Å; A183-A185 PolarHBondContact O-N 3.25Å; A183-A185 VanDerWaalsContact O-N 3.12Å; A183-K186 PolarHBondContact O-N 3.31Å; A183-K186 VanDerWaalsContact O-N 3.1Å
184	K	70.8	Confident	80	Confident	167 Å²	167	69.9 Å²	69.9	73%	0.726	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-55.1	-32.2	-176.8	-70	-172.1	178.2	-175.6	0	113.9	K186 V187	K184-K186 PolarHBondContact O-N 3.09Å; K184-V187 WeakPolarHBondContact O-CB 3.33Å; K184-V187 WeakPolarHBondContact O-CG2 3.46Å; K184-V187 PolarHBondContact O-N 3.2Å; K184-V187 VanDerWaalsContact O-N 3.14Å
185	A	69.1	Low	79.4	Confident	94 Å²	94	69.8 Å²	69.8	78%	0.777	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-63.4	-23.1	-179.3	0	0	0	0	0	114	A183	A183-A185 PolarHBondContact O-N 3.25Å; A183-A185 VanDerWaalsContact O-N 3.12Å
186	K	72	Confident	78.8	Confident	100 Å²	100	78.1 Å²	78.1	44%	0.435	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-94.9	-0.8	178.3	-71.3	-172.3	168.9	-165.7	0	113.8	L162 F180 A183 K184 D188 Y190	L162-K186 HydrophobicContact CD1-CD 3.6Å; F180-K186 HydrophobicContact CD1-CB 4.48Å; F180-K186 HydrophobicContact CE1-CB 4.46Å; A183-K186 PolarHBondContact O-N 3.31Å; A183-K186 VanDerWaalsContact O-N 3.1Å; K184-K186 PolarHBondContact O-N 3.09Å; K186-D188 VanDerWaalsContact C-N 3.34Å; K186-Y190 PolarHBondContact O-N 3.13Å
187	V	74.7	Confident	78.2	Confident	20 Å²	20	80.1 Å²	80.1	12%	0.121	40%	0.401	C	S	.	.	H	α-helix	trans	-65.2	-42	179.4	174.9	0	0	0	0	110.4	F180 K184 E189 Y190 V191 R209	F180-V187 HydrophobicContact CB-CG2 3.47Å; F180-V187 VanDerWaalsContact CB-CG2 3.47Å; F180-V187 HydrophobicContact CD1-CG2 4.41Å; F180-V187 HydrophobicContact CD2-CG2 4.32Å; F180-V187 HydrophobicContact CG-CG2 3.84Å; K184-V187 WeakPolarHBondContact O-CB 3.33Å; K184-V187 WeakPolarHBondContact O-CG2 3.46Å; K184-V187 PolarHBondContact O-N 3.2Å; K184-V187 VanDerWaalsContact O-N 3.14Å; V187-E189 PolarHBondContact O-N 2.96Å; V187-Y190 PolarHBondContact O-N 3.33Å; V187-V191 HydrophobicContact CG1-CG2 3.95Å; V187-V191 WeakPolarHBondContact O-CB 3.24Å; V187-V191 WeakPolarHBondContact O-CG2 3.47Å; V187-V191 PolarHBondContact O-N 2.89Å; V187-R209 HydrophobicContact CG1-CG 4.37Å
188	D	71.7	Confident	77.6	Confident	95 Å²	95	81.3 Å²	81.3	51%	0.508	41%	0.407	S	S	.	.	H	α-helix	trans	-68.7	-35.9	-176.1	-63.9	-40.7	0	0	0	112	K186 N192	K186-D188 VanDerWaalsContact C-N 3.34Å; D188-N192 WeakPolarHBondContact O-CB 3.08Å; D188-N192 PolarHBondContact O-N 3.05Å; D188-N192 VanDerWaalsContact O-N 3.09Å; D188-N192 PolarHBondContact O-ND2 3.09Å
189	E	75.1	Confident	77.1	Confident	132 Å²	132	85.4 Å²	85.4	62%	0.617	43%	0.433	S	S	*	.	H	α-helix	trans	-60.1	-46.9	170.5	-75.5	-180	163.2	0	0	111.4	V187 N192 E193	V187-E189 PolarHBondContact O-N 2.96Å; E189-N192 PolarHBondContact O-N 2.79Å; E189-E193 PolarHBondContact O-N 3.48Å
190	Y	76.3	Confident	77	Confident	70 Å²	70	92 Å²	92	28%	0.275	46%	0.463	S	S	.	.	H	α-helix	trans	-67.2	-39.8	179.6	-175.8	-103.2	0	0	0	112.9	F180 K186 V187 N192 E193 F194 V208	F180-Y190 HydrophobicContact CD2-CD1 4.46Å; F180-Y190 AromaticContact CE2-CD1 3.43Å; F180-Y190 HydrophobicContact CE2-CD1 3.43Å; F180-Y190 VanDerWaalsContact CE2-CD1 3.43Å; F180-Y190 HydrophobicContact CE2-CD2 4.12Å; F180-Y190 AromaticContact CE2-CE1 3.87Å; F180-Y190 HydrophobicContact CE2-CE1 3.87Å; F180-Y190 HydrophobicContact CE2-CE2 4.48Å; F180-Y190 AromaticContact CE2-CG 3.56Å; F180-Y190 HydrophobicContact CE2-CG 3.56Å; F180-Y190 AromaticContact CZ-CD1 3.84Å; F180-Y190 HydrophobicContact CZ-CD1 3.84Å; F180-Y190 AromaticContact CZ-CD2 3.71Å; F180-Y190 HydrophobicContact CZ-CD2 3.71Å; F180-Y190 HydrophobicContact CZ-CE1 4.43Å; F180-Y190 HydrophobicContact CZ-CE2 4.3Å; F180-Y190 AromaticContact CZ-CG 3.42Å; F180-Y190 HydrophobicContact CZ-CG 3.42Å; F180-Y190 VanDerWaalsContact CZ-CG 3.42Å; K186-Y190 PolarHBondContact O-N 3.13Å; V187-Y190 PolarHBondContact O-N 3.33Å; Y190-N192 VanDerWaalsContact C-N 3.27Å; Y190-N192 PolarHBondContact O-N 3.16Å; Y190-E193 WeakPolarHBondContact O-CB 3.34Å; Y190-E193 PolarHBondContact O-N 2.78Å; Y190-F194 HydrophobicContact CD1-CE2 4.45Å; Y190-F194 HydrophobicContact CD2-CE2 4.42Å; Y190-F194 HydrophobicContact CE1-CD2 4.24Å; Y190-F194 AromaticContact CE1-CE2 3.84Å; Y190-F194 HydrophobicContact CE1-CE2 3.84Å; Y190-F194 AromaticContact CE2-CE2 3.82Å; Y190-F194 HydrophobicContact CE2-CE2 3.82Å; Y190-F194 AromaticContact CZ-CE2 3.5Å; Y190-F194 VanDerWaalsContact CZ-CE2 3.5Å; Y190-F194 WeakPolarHBondContact O-CD2 3.5Å; Y190-V208 HydrophobicContact CD1-CG1 4.44Å; Y190-V208 HydrophobicContact CE1-CG1 4.26Å
191	V	76.1	Confident	77	Confident	18 Å²	18	94.8 Å²	94.8	11%	0.109	48%	0.479	C	S	.	.	H	α-helix	trans	-65	-35.3	177.8	172.3	0	0	0	0	111	V187 E193 F194 A195 I198 V208 R209	V187-V191 HydrophobicContact CG1-CG2 3.95Å; V187-V191 WeakPolarHBondContact O-CB 3.24Å; V187-V191 WeakPolarHBondContact O-CG2 3.47Å; V187-V191 PolarHBondContact O-N 2.89Å; V191-E193 VanDerWaalsContact C-N 3.3Å; V191-E193 PolarHBondContact O-N 3.25Å; V191-F194 CarbonylContact O-C 3.53Å; V191-F194 PolarHBondContact O-N 3.42Å; V191-F194 VanDerWaalsContact O-N 3.11Å; V191-A195 PolarHBondContact O-N 3.42Å; V191-I198 HydrophobicContact CG1-CD1 3.78Å; V191-V208 HydrophobicContact CG2-CG1 4.4Å; V191-R209 HydrophobicContact CG2-CB 4.37Å; V191-R209 HydrophobicContact CG2-CG 3.54Å
192	N	79.3	Confident	77	Confident	114 Å²	114	92.6 Å²	92.6	61%	0.61	48%	0.482	S	S	*	.	H	α-helix	trans	-65	-31.2	176.8	-75	-20.8	0	0	0	112.8	D188 E189 Y190 F194 A195	D188-N192 WeakPolarHBondContact O-CB 3.08Å; D188-N192 PolarHBondContact O-N 3.05Å; D188-N192 VanDerWaalsContact O-N 3.09Å; D188-N192 PolarHBondContact O-ND2 3.09Å; E189-N192 PolarHBondContact O-N 2.79Å; Y190-N192 VanDerWaalsContact C-N 3.27Å; Y190-N192 PolarHBondContact O-N 3.16Å; N192-F194 PolarHBondContact O-N 3.43Å; N192-A195 VanDerWaalsContact O-CB 3.24Å; N192-A195 WeakPolarHBondContact O-CB 3.31Å; N192-A195 PolarHBondContact O-N 3.03Å; N192-A195 VanDerWaalsContact O-N 3.14Å
193	E	80.5	Confident	77.3	Confident	149 Å²	149	93.2 Å²	93.2	70%	0.696	49%	0.489	S	S	*	.	H	α-helix	trans	-60.7	-29.4	173.1	-66.6	-177.9	166.2	0	0	112.2	E189 Y190 V191	E189-E193 PolarHBondContact O-N 3.48Å; Y190-E193 WeakPolarHBondContact O-CB 3.34Å; Y190-E193 PolarHBondContact O-N 2.78Å; V191-E193 VanDerWaalsContact C-N 3.3Å; V191-E193 PolarHBondContact O-N 3.25Å
194	F	79.8	Confident	77.5	Confident	73 Å²	73	94.9 Å²	94.9	32%	0.32	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	10.9	178.1	-66.7	-84.3	0	0	0	113.8	Y190 V191 N192 K196 V197 I198 V208	Y190-F194 HydrophobicContact CD1-CE2 4.45Å; Y190-F194 HydrophobicContact CD2-CE2 4.42Å; Y190-F194 HydrophobicContact CE1-CD2 4.24Å; Y190-F194 AromaticContact CE1-CE2 3.84Å; Y190-F194 HydrophobicContact CE1-CE2 3.84Å; Y190-F194 AromaticContact CE2-CE2 3.82Å; Y190-F194 HydrophobicContact CE2-CE2 3.82Å; Y190-F194 AromaticContact CZ-CE2 3.5Å; Y190-F194 VanDerWaalsContact CZ-CE2 3.5Å; Y190-F194 WeakPolarHBondContact O-CD2 3.5Å; V191-F194 CarbonylContact O-C 3.53Å; V191-F194 PolarHBondContact O-N 3.42Å; V191-F194 VanDerWaalsContact O-N 3.11Å; N192-F194 PolarHBondContact O-N 3.43Å; F194-K196 PolarHBondContact O-N 3.27Å; F194-K196 VanDerWaalsContact O-N 3.13Å; F194-V197 PolarHBondContact O-N 3.14Å; F194-I198 HydrophobicContact CB-CD1 4.07Å; F194-I198 HydrophobicContact CB-CG1 4.34Å; F194-I198 WeakPolarHBondContact O-CG1 3.42Å; F194-I198 PolarHBondContact O-N 3.48Å; F194-V208 HydrophobicContact CB-CG1 4.08Å; F194-V208 HydrophobicContact CD2-CG1 3.89Å; F194-V208 HydrophobicContact CG-CG1 4.11Å
195	A	77	Confident	77.7	Confident	47 Å²	47	88.2 Å²	88.2	39%	0.388	47%	0.471	S	S	.	.	H	α-helix	trans	-53.6	-39.5	-175.2	0	0	0	0	0	112.8	V191 N192 I198 T199	V191-A195 PolarHBondContact O-N 3.42Å; N192-A195 VanDerWaalsContact O-CB 3.24Å; N192-A195 WeakPolarHBondContact O-CB 3.31Å; N192-A195 PolarHBondContact O-N 3.03Å; N192-A195 VanDerWaalsContact O-N 3.14Å; A195-I198 PolarHBondContact O-N 3.23Å; A195-T199 PolarHBondContact O-N 3.26Å; A195-T199 PolarHBondContact O-OG1 3.24Å; A195-T199 VanDerWaalsContact O-OG1 3.06Å
196	K	80.2	Confident	78.1	Confident	177 Å²	177	87.5 Å²	87.5	77%	0.77	46%	0.458	S	S	*	.	H	α-helix	trans	-60.9	-42.5	176	-98.1	-175.2	174.1	-177.9	0	113.7	F194 T199 E200	F194-K196 PolarHBondContact O-N 3.27Å; F194-K196 VanDerWaalsContact O-N 3.13Å; K196-T199 VanDerWaalsContact C-OG1 3.29Å; K196-T199 WeakPolarHBondContact CA-OG1 3.42Å; K196-T199 PolarHBondContact O-OG1 3.11Å; K196-E200 PolarHBondContact O-N 2.96Å
197	V	80	Confident	78.4	Confident	68 Å²	68	86.9 Å²	86.9	41%	0.412	46%	0.462	S	S	.	.	H	α-helix	trans	-77.1	-35.7	-177.9	-176.5	0	0	0	0	110.4	F194 T199 E200 N201 L204	F194-V197 PolarHBondContact O-N 3.14Å; V197-T199 VanDerWaalsContact C-N 3.27Å; V197-T199 PolarHBondContact O-N 3.37Å; V197-E200 PolarHBondContact O-N 3.43Å; V197-E200 VanDerWaalsContact O-N 3.13Å; V197-N201 PolarHBondContact O-N 3.13Å; V197-N201 VanDerWaalsContact O-N 3.07Å; V197-L204 HydrophobicContact CG1-CD1 3.89Å
198	I	80.1	Confident	78.5	Confident	27 Å²	27	87.3 Å²	87.3	14%	0.138	47%	0.465	C	S	.	.	H	α-helix	trans	-64.8	-33.9	175.8	-66.7	167.8	0	0	0	111.1	V191 F194 A195 E200 N201 T202 A205 V208	V191-I198 HydrophobicContact CG1-CD1 3.78Å; F194-I198 HydrophobicContact CB-CD1 4.07Å; F194-I198 HydrophobicContact CB-CG1 4.34Å; F194-I198 WeakPolarHBondContact O-CG1 3.42Å; F194-I198 PolarHBondContact O-N 3.48Å; A195-I198 PolarHBondContact O-N 3.23Å; I198-E200 VanDerWaalsContact C-N 3.31Å; I198-N201 CarbonylContact O-C 3.55Å; I198-N201 VanDerWaalsContact O-C 3.24Å; I198-T202 WeakPolarHBondContact O-CA 3.39Å; I198-T202 PolarHBondContact O-N 2.98Å; I198-A205 HydrophobicContact CG2-CB 3.78Å; I198-V208 HydrophobicContact CD1-CB 4.41Å; I198-V208 HydrophobicContact CD1-CG1 4.36Å
199	T	79.5	Confident	78.7	Confident	114 Å²	114	90 Å²	90	70%	0.699	47%	0.468	S	S	*	.	H	α-helix	trans	-68.3	-27.8	173.4	40	0	0	0	0	113.6	A195 K196 V197	A195-T199 PolarHBondContact O-N 3.26Å; A195-T199 PolarHBondContact O-OG1 3.24Å; A195-T199 VanDerWaalsContact O-OG1 3.06Å; K196-T199 VanDerWaalsContact C-OG1 3.29Å; K196-T199 WeakPolarHBondContact CA-OG1 3.42Å; K196-T199 PolarHBondContact O-OG1 3.11Å; V197-T199 VanDerWaalsContact C-N 3.27Å; V197-T199 PolarHBondContact O-N 3.37Å
200	E	83.9	Confident	78.7	Confident	167 Å²	167	89.9 Å²	89.9	78%	0.78	47%	0.465	S	S	*	.	H	α-helix	trans	-79.4	-34.8	176.3	-70.3	175.1	176	0	0	112.4	K196 V197 I198	K196-E200 PolarHBondContact O-N 2.96Å; V197-E200 PolarHBondContact O-N 3.43Å; V197-E200 VanDerWaalsContact O-N 3.13Å; I198-E200 VanDerWaalsContact C-N 3.31Å
201	N	82.2	Confident	78.7	Confident	75 Å²	75	86.6 Å²	86.6	40%	0.401	45%	0.453	S	S	.	.			trans	-139.6	99.2	175.9	-171.5	-14.6	0	0	0	110.9	V197 I198 D203 L204	V197-N201 PolarHBondContact O-N 3.13Å; V197-N201 VanDerWaalsContact O-N 3.07Å; I198-N201 CarbonylContact O-C 3.55Å; I198-N201 VanDerWaalsContact O-C 3.24Å; N201-D203 PolarHBondContact O-N 3.31Å; N201-D203 VanDerWaalsContact O-N 3.15Å; N201-D203 WeakPolarHBondContact OD1-CB 3.41Å; N201-D203 PolarHBondContact OD1-N 3.22Å; N201-L204 HydrophobicContact CB-CD1 3.89Å; N201-L204 HydrophobicContact CB-CG 4.13Å; N201-L204 WeakPolarHBondContact O-CB 3.28Å; N201-L204 PolarHBondContact O-N 3.08Å; N201-L204 VanDerWaalsContact O-N 3.11Å
202	T	78.4	Confident	79.1	Confident	103 Å²	103	89.6 Å²	89.6	63%	0.632	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-61	-24.2	-176.1	42	0	0	0	0	113.7	I198 L204 A205	I198-T202 WeakPolarHBondContact O-CA 3.39Å; I198-T202 PolarHBondContact O-N 2.98Å; T202-L204 PolarHBondContact O-N 2.94Å; T202-A205 WeakPolarHBondContact O-CB 3.42Å; T202-A205 PolarHBondContact O-N 3Å
203	D	80.9	Confident	79.5	Confident	123 Å²	123	87 Å²	87	66%	0.658	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-69.9	-16.5	180	-62.8	-19.9	0	0	0	112.6	N201 P206	N201-D203 PolarHBondContact O-N 3.31Å; N201-D203 VanDerWaalsContact O-N 3.15Å; N201-D203 WeakPolarHBondContact OD1-CB 3.41Å; N201-D203 PolarHBondContact OD1-N 3.22Å; D203-P206 VanDerWaalsContact O-CD 3.29Å; D203-P206 WeakPolarHBondContact O-CD 3.49Å; D203-P206 WeakPolarHBondContact O-CG 3.39Å
204	L	80.3	Confident	80	Confident	60 Å²	60	84.4 Å²	84.4	31%	0.314	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-76.3	-22.6	176.6	-64.7	175.1	0	0	0	112.8	V197 N201 T202 V207 V208	V197-L204 HydrophobicContact CG1-CD1 3.89Å; N201-L204 HydrophobicContact CB-CD1 3.89Å; N201-L204 HydrophobicContact CB-CG 4.13Å; N201-L204 WeakPolarHBondContact O-CB 3.28Å; N201-L204 PolarHBondContact O-N 3.08Å; N201-L204 VanDerWaalsContact O-N 3.11Å; T202-L204 PolarHBondContact O-N 2.94Å; L204-V207 WeakPolarHBondContact O-CB 3.04Å; L204-V207 PolarHBondContact O-N 2.59Å; L204-V208 HydrophobicContact CB-CG2 4.4Å; L204-V208 WeakPolarHBondContact O-CG2 3.17Å; L204-V208 PolarHBondContact O-N 2.73Å
205	A	74.7	Confident	80.6	Confident	27 Å²	27	81 Å²	81	22%	0.223	43%	0.427	C	S	.	.	H	α-helix	trans	-52.1	-50.8	-179.3	0	0	0	0	0	114	I198 T202 V207 R209	I198-A205 HydrophobicContact CG2-CB 3.78Å; T202-A205 WeakPolarHBondContact O-CB 3.42Å; T202-A205 PolarHBondContact O-N 3Å; A205-V207 VanDerWaalsContact C-N 3.27Å; A205-V207 PolarHBondContact O-N 3.04Å; A205-R209 WeakPolarHBondContact O-CB 3.31Å; A205-R209 WeakPolarHBondContact O-CG 3.33Å; A205-R209 PolarHBondContact O-N 3.47Å; A205-R209 VanDerWaalsContact O-N 3.14Å
206	P	78.2	Confident	81.3	Confident	78 Å²	78	82.5 Å²	82.5	51%	0.506	42%	0.423	S	S	.	.	H	α-helix	trans	-68.2	-23.5	176.8	26.1	-35.7	0	0	0	113.7	D203 K210	D203-P206 VanDerWaalsContact O-CD 3.29Å; D203-P206 WeakPolarHBondContact O-CD 3.49Å; D203-P206 WeakPolarHBondContact O-CG 3.39Å; P206-K210 WeakPolarHBondContact O-CG 2.95Å
207	V	76.8	Confident	81.8	Confident	87 Å²	87	74.2 Å²	74.2	53%	0.527	39%	0.387	S	S	.	.	H	α-helix	trans	-79.1	-49.4	179.4	-176.4	0	0	0	0	110.4	L204 A205 R209 K210	L204-V207 WeakPolarHBondContact O-CB 3.04Å; L204-V207 PolarHBondContact O-N 2.59Å; A205-V207 VanDerWaalsContact C-N 3.27Å; A205-V207 PolarHBondContact O-N 3.04Å; V207-R209 VanDerWaalsContact C-N 3.32Å; V207-R209 PolarHBondContact O-N 3.33Å; V207-K210 WeakPolarHBondContact O-CB 3.34Å; V207-K210 PolarHBondContact O-N 3.16Å; V207-K210 VanDerWaalsContact O-N 3.11Å
208	V	77.5	Confident	82.4	Confident	29 Å²	29	72.4 Å²	72.4	18%	0.176	38%	0.382	C	S	.	.	H	α-helix	trans	-62	-39.9	178.6	176.3	0	0	0	0	111	Y190 V191 F194 I198 L204 K210 G211	Y190-V208 HydrophobicContact CD1-CG1 4.44Å; Y190-V208 HydrophobicContact CE1-CG1 4.26Å; V191-V208 HydrophobicContact CG2-CG1 4.4Å; F194-V208 HydrophobicContact CB-CG1 4.08Å; F194-V208 HydrophobicContact CD2-CG1 3.89Å; F194-V208 HydrophobicContact CG-CG1 4.11Å; I198-V208 HydrophobicContact CD1-CB 4.41Å; I198-V208 HydrophobicContact CD1-CG1 4.36Å; L204-V208 HydrophobicContact CB-CG2 4.4Å; L204-V208 WeakPolarHBondContact O-CG2 3.17Å; L204-V208 PolarHBondContact O-N 2.73Å; V208-K210 PolarHBondContact O-N 3.38Å; V208-K210 VanDerWaalsContact O-N 3.11Å; V208-G211 PolarHBondContact O-N 2.88Å
209	R	76.2	Confident	83	Confident	152 Å²	152	75.3 Å²	75.3	57%	0.574	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.7	175.5	-89.5	179.9	171.5	179.5	0.1	114.5	V187 V191 A205 V207 G211	V187-R209 HydrophobicContact CG1-CG 4.37Å; V191-R209 HydrophobicContact CG2-CB 4.37Å; V191-R209 HydrophobicContact CG2-CG 3.54Å; A205-R209 WeakPolarHBondContact O-CB 3.31Å; A205-R209 WeakPolarHBondContact O-CG 3.33Å; A205-R209 PolarHBondContact O-N 3.47Å; A205-R209 VanDerWaalsContact O-N 3.14Å; V207-R209 VanDerWaalsContact C-N 3.32Å; V207-R209 PolarHBondContact O-N 3.33Å; R209-G211 VanDerWaalsContact C-N 3.3Å
210	K	74.6	Confident	83.7	Confident	129 Å²	129	69.9 Å²	69.9	56%	0.561	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-19.8	175.4	-65.6	174.5	-178.2	174.4	0	112.3	P206 V207 V208 L212	P206-K210 WeakPolarHBondContact O-CG 2.95Å; V207-K210 WeakPolarHBondContact O-CB 3.34Å; V207-K210 PolarHBondContact O-N 3.16Å; V207-K210 VanDerWaalsContact O-N 3.11Å; V208-K210 PolarHBondContact O-N 3.38Å; V208-K210 VanDerWaalsContact O-N 3.11Å; K210-L212 VanDerWaalsContact C-N 3.28Å; K210-L212 HydrophobicContact CB-CD1 4.03Å; K210-L212 HydrophobicContact CB-CG 3.78Å; K210-L212 HydrophobicContact CD-CD1 4.13Å; K210-L212 PolarHBondContact O-N 2.88Å
211	G	76.4	Confident	84.2	Confident	2 Å²	2	63.1 Å²	63.1	2%	0.021	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	47.3	-177.7	0	0	0	0	0	113.7	I179 V208 R209	I179-G211 PolarHBondContact N-O 3.17Å; V208-G211 PolarHBondContact O-N 2.88Å; R209-G211 VanDerWaalsContact C-N 3.3Å
212	L	84	Confident	84.8	Confident	81 Å²	81	65 Å²	65	42%	0.424	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	113.6	178.2	-61	174.4	0	0	0	109.1	V176 D178 K210	V176-L212 HydrophobicContact CG1-CB 4.31Å; V176-L212 HydrophobicContact CG1-CD2 3.83Å; V176-L212 HydrophobicContact CG1-CG 4.5Å; D178-L212 HydrophobicContact CB-CD2 3.76Å; K210-L212 VanDerWaalsContact C-N 3.28Å; K210-L212 HydrophobicContact CB-CD1 4.03Å; K210-L212 HydrophobicContact CB-CG 3.78Å; K210-L212 HydrophobicContact CD-CD1 4.13Å; K210-L212 PolarHBondContact O-N 2.88Å
213	E	88.8	Confident	85.7	Confident	59 Å²	59	60.4 Å²	60.4	28%	0.276	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.1	169.5	178.9	-173.7	-164.2	0	0	109.4	H177 I179 I215	H177-E213 HydrophobicContact CB-CB 4.17Å; H177-E213 IonicContact CE1-OE2 3.82Å; H177-E213 IonicContact CG-OE2 3.75Å; H177-E213 PolarHBondContact N-O 3.31Å; H177-E213 IonicContact ND1-OE2 3.06Å; H177-E213 PolarHBondContact ND1-OE2 2.93Å; H177-E213 PolarHBondContact O-N 2.81Å; I179-E213 HydrophobicContact CD1-CB 4.04Å; I179-E213 HydrophobicContact CG1-CB 4.43Å; E213-I215 HydrophobicContact CG-CG1 4.4Å
214	I	90.4	Very high	86.3	Confident	95 Å²	95	54.5 Å²	54.5	49%	0.487	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	110.9	176.7	-60.9	178.8	0	0	0	109	Y174 R216	Y174-I214 HydrophobicContact CD2-CG2 3.71Å; Y174-I214 HydrophobicContact CG-CG2 3.8Å; I214-R216 HydrophobicContact CG2-CG 4.26Å; I214-R216 PolarHBondContact O-N 3.46Å
215	I	92.4	Very high	86.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	96.7	178	-53.3	177.9	0	0	0	109.1	Y93 L105 K110 V175 H177 E213 K219 A220	Y93-I215 PolarHBondContact OH-O 2.56Å; L105-I215 HydrophobicContact CD1-CD1 4.44Å; L105-I215 HydrophobicContact CD1-CG2 4.29Å; L105-I215 HydrophobicContact CD2-CD1 4.42Å; K110-I215 HydrophobicContact CG-CD1 3.97Å; V175-I215 HydrophobicContact CB-CB 4.4Å; V175-I215 PolarHBondContact N-O 2.82Å; V175-I215 PolarHBondContact O-N 3.02Å; H177-I215 HydrophobicContact CB-CD1 3.88Å; H177-I215 HydrophobicContact CB-CG1 4.33Å; E213-I215 HydrophobicContact CG-CG1 4.4Å; I215-K219 HydrophobicContact CG2-CB 4.31Å; I215-K219 HydrophobicContact CG2-CG 4.37Å; I215-A220 HydrophobicContact CG2-CB 3.98Å
216	R	91.3	Very high	87.8	Confident	80 Å²	80	60.2 Å²	60.2	30%	0.302	30%	0.301	S	S	.	.			trans	-76.7	163.9	169.2	-70.9	-171.2	-179.1	-129.7	-1.7	111.6	Y93 I214 G218 K219 A220 I303	Y93-R216 PolarHBondContact OH-O 3.1Å; I214-R216 HydrophobicContact CG2-CG 4.26Å; I214-R216 PolarHBondContact O-N 3.46Å; R216-G218 VanDerWaalsContact C-N 3.29Å; R216-G218 PolarHBondContact O-N 3.07Å; R216-K219 PolarHBondContact O-N 3.47Å; R216-A220 PolarHBondContact O-N 3.35Å; R216-I303 VanDerWaalsContact NH2-CG1 3.32Å
217	P	91.8	Very high	88.5	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.013	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-36.5	-173.9	-20.7	31.8	0	0	0	112.9	P91 Y93 S173 K219 A220 L221 I251	P91-P217 HydrophobicContact CB-CB 4.19Å; P91-P217 VanDerWaalsContact O-CB 3.24Å; P91-P217 WeakPolarHBondContact O-CB 3.33Å; P91-P217 WeakPolarHBondContact O-CG 3.44Å; Y93-P217 HydrophobicContact CD1-CB 4.01Å; Y93-P217 HydrophobicContact CD1-CG 4.1Å; Y93-P217 HydrophobicContact CD2-CG 3.79Å; Y93-P217 HydrophobicContact CE1-CB 3.91Å; Y93-P217 HydrophobicContact CE1-CG 4.11Å; Y93-P217 HydrophobicContact CE2-CB 4.45Å; Y93-P217 HydrophobicContact CE2-CG 3.78Å; Y93-P217 HydrophobicContact CG-CB 4.35Å; Y93-P217 HydrophobicContact CG-CG 3.96Å; S173-P217 VanDerWaalsContact O-CD 3.32Å; S173-P217 WeakPolarHBondContact O-CD 3.35Å; P217-K219 VanDerWaalsContact C-N 3.34Å; P217-K219 PolarHBondContact O-N 3.25Å; P217-A220 PolarHBondContact O-N 3.48Å; P217-L221 WeakPolarHBondContact O-CB 3.48Å; P217-L221 PolarHBondContact O-N 2.76Å; P217-I251 HydrophobicContact CB-CG2 4.12Å; P217-I251 WeakPolarHBondContact O-CD1 3.4Å
218	G	92.6	Very high	89.2	Confident	31 Å²	31	54 Å²	54	32%	0.32	26%	0.262	S	S	.	.	H	α-helix	trans	-58.5	-42.2	174.8	0	0	0	0	0	113.2	R216 L221 Q222	R216-G218 VanDerWaalsContact C-N 3.29Å; R216-G218 PolarHBondContact O-N 3.07Å; G218-L221 PolarHBondContact O-N 3.33Å; G218-Q222 PolarHBondContact O-N 2.75Å; G218-Q222 VanDerWaalsContact O-N 3.16Å
219	K	93	Very high	89.6	Confident	87 Å²	87	58.3 Å²	58.3	38%	0.378	28%	0.28	S	S	.	.	H	α-helix	trans	-70	-42.5	175.7	-174.6	63.8	175.4	-170.5	0	111.7	I215 R216 P217 L221 Q222 L223	I215-K219 HydrophobicContact CG2-CB 4.31Å; I215-K219 HydrophobicContact CG2-CG 4.37Å; R216-K219 PolarHBondContact O-N 3.47Å; P217-K219 VanDerWaalsContact C-N 3.34Å; P217-K219 PolarHBondContact O-N 3.25Å; K219-L221 VanDerWaalsContact C-N 3.26Å; K219-L221 PolarHBondContact O-N 3.5Å; K219-Q222 PolarHBondContact O-N 3.34Å; K219-L223 HydrophobicContact CG-CD1 4.49Å; K219-L223 WeakPolarHBondContact O-CG 3.35Å; K219-L223 PolarHBondContact O-N 3.06Å
220	A	94.1	Very high	90.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-37.7	175.3	0	0	0	0	0	111.8	Y93 I215 R216 P217 L223 F224 I251	Y93-A220 HydrophobicContact CE1-CB 3.8Å; Y93-A220 WeakPolarHBondContact OH-CB 3.31Å; I215-A220 HydrophobicContact CG2-CB 3.98Å; R216-A220 PolarHBondContact O-N 3.35Å; P217-A220 PolarHBondContact O-N 3.48Å; A220-L223 PolarHBondContact O-N 3.35Å; A220-F224 VanDerWaalsContact O-CB 3.31Å; A220-F224 WeakPolarHBondContact O-CB 3.38Å; A220-F224 WeakPolarHBondContact O-CD1 3.41Å; A220-F224 WeakPolarHBondContact O-CG 3.26Å; A220-F224 PolarHBondContact O-N 2.79Å; A220-I251 HydrophobicContact CB-CD1 3.68Å
221	L	94.5	Very high	90.8	Very high	26 Å²	26	49.7 Å²	49.7	14%	0.136	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-43.8	176.3	-177.8	67.7	0	0	0	111.8	P91 P217 G218 K219 F224 S225 R248 I251 Q253	P91-L221 HydrophobicContact CB-CD2 4.49Å; P91-L221 HydrophobicContact CG-CD2 4.09Å; P217-L221 WeakPolarHBondContact O-CB 3.48Å; P217-L221 PolarHBondContact O-N 2.76Å; G218-L221 PolarHBondContact O-N 3.33Å; K219-L221 VanDerWaalsContact C-N 3.26Å; K219-L221 PolarHBondContact O-N 3.5Å; L221-F224 PolarHBondContact O-N 2.81Å; L221-S225 VanDerWaalsContact O-CB 3.29Å; L221-S225 WeakPolarHBondContact O-CB 3.24Å; L221-S225 PolarHBondContact O-N 2.77Å; L221-S225 PolarHBondContact O-OG 3.17Å; L221-R248 HydrophobicContact CD1-CB 3.97Å; L221-I251 VanDerWaalsContact CA-CD1 3.5Å; L221-I251 HydrophobicContact CB-CD1 3.74Å; L221-I251 HydrophobicContact CB-CG2 4.46Å; L221-I251 HydrophobicContact CD1-CB 4.25Å; L221-I251 HydrophobicContact CD1-CD1 4.36Å; L221-I251 HydrophobicContact CD1-CG2 4.49Å; L221-Q253 HydrophobicContact CD2-CG 4.46Å; L221-Q253 VanDerWaalsContact CD2-NE2 3.31Å
222	Q	94.9	Very high	91.4	Very high	113 Å²	113	49.6 Å²	49.6	53%	0.528	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-44.8	173.3	-72.5	-179.3	-7.3	0	0	111.7	G218 K219 S225 K226	G218-Q222 PolarHBondContact O-N 2.75Å; G218-Q222 VanDerWaalsContact O-N 3.16Å; K219-Q222 PolarHBondContact O-N 3.34Å; Q222-S225 PolarHBondContact O-N 3.01Å; Q222-K226 WeakPolarHBondContact O-CG 3.45Å; Q222-K226 PolarHBondContact O-N 2.9Å
223	L	95.6	Very high	91.5	Very high	7 Å²	7	47 Å²	47	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-47.6	178.2	-69.8	173.9	0	0	0	111.3	L105 K110 S113 K219 A220 S225 K226	L105-L223 HydrophobicContact CD2-CD1 4.02Å; K110-L223 HydrophobicContact CG-CD1 4.41Å; K110-L223 VanDerWaalsContact O-CD2 3.25Å; K110-L223 WeakPolarHBondContact O-CD2 3.47Å; S113-L223 WeakPolarHBondContact CB-O 3.21Å; S113-L223 PolarHBondContact OG-O 3.36Å; K219-L223 HydrophobicContact CG-CD1 4.49Å; K219-L223 WeakPolarHBondContact O-CG 3.35Å; K219-L223 PolarHBondContact O-N 3.06Å; A220-L223 PolarHBondContact O-N 3.35Å; L223-S225 VanDerWaalsContact C-N 3.33Å; L223-S225 PolarHBondContact O-N 3.39Å; L223-K226 PolarHBondContact O-N 2.96Å
224	F	94.8	Very high	91.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-38.8	-179.7	-70.5	-5.3	0	0	0	111.9	I101 I104 L105 I108 A220 L221 K226 I227 H246 P247 R248 I251	I101-F224 HydrophobicContact CB-CZ 4.45Å; I101-F224 HydrophobicContact CG1-CE2 4.3Å; I101-F224 HydrophobicContact CG2-CE2 4.13Å; I101-F224 HydrophobicContact CG2-CZ 3.9Å; I104-F224 HydrophobicContact CB-CE1 4.13Å; I104-F224 HydrophobicContact CB-CZ 4.21Å; I104-F224 HydrophobicContact CG2-CD1 4.1Å; I104-F224 HydrophobicContact CG2-CE1 3.48Å; I104-F224 VanDerWaalsContact CG2-CE1 3.48Å; I104-F224 HydrophobicContact CG2-CZ 4.04Å; L105-F224 HydrophobicContact CD2-CE1 3.8Å; L105-F224 HydrophobicContact CD2-CZ 4.3Å; L105-F224 HydrophobicContact CG-CE1 4.11Å; L105-F224 HydrophobicContact CG-CZ 4.22Å; I108-F224 HydrophobicContact CD1-CD1 4.11Å; I108-F224 HydrophobicContact CD1-CE1 4.15Å; A220-F224 VanDerWaalsContact O-CB 3.31Å; A220-F224 WeakPolarHBondContact O-CB 3.38Å; A220-F224 WeakPolarHBondContact O-CD1 3.41Å; A220-F224 WeakPolarHBondContact O-CG 3.26Å; A220-F224 PolarHBondContact O-N 2.79Å; L221-F224 PolarHBondContact O-N 2.81Å; F224-K226 PolarHBondContact O-N 3.44Å; F224-I227 HydrophobicContact CB-CD1 4.46Å; F224-I227 HydrophobicContact CD1-CD1 4.06Å; F224-I227 WeakPolarHBondContact O-CB 3.43Å; F224-I227 WeakPolarHBondContact O-CG1 3.28Å; F224-I227 PolarHBondContact O-N 3.06Å; F224-H246 PolarHBondContact O-CE1 3.21Å; F224-P247 HydrophobicContact CB-CB 3.97Å; F224-P247 HydrophobicContact CD1-CB 4.36Å; F224-P247 HydrophobicContact CD2-CB 4.09Å; F224-P247 VanDerWaalsContact CD2-O 3.29Å; F224-P247 WeakPolarHBondContact CD2-O 3.19Å; F224-P247 HydrophobicContact CG-CB 3.89Å; F224-R248 HydrophobicContact CB-CB 4.47Å; F224-I251 HydrophobicContact CD2-CD1 3.84Å; F224-I251 HydrophobicContact CD2-CG1 4.28Å; F224-I251 HydrophobicContact CE2-CD1 4.07Å; F224-I251 HydrophobicContact CE2-CG1 4.34Å
225	S	92.5	Very high	91.6	Very high	61 Å²	61	40.1 Å²	40.1	43%	0.427	20%	0.202	S	C	.	.	H	α-helix	trans	-68.9	-20.7	177.7	-57	0	0	0	0	113.7	L221 Q222 L223	L221-S225 VanDerWaalsContact O-CB 3.29Å; L221-S225 WeakPolarHBondContact O-CB 3.24Å; L221-S225 PolarHBondContact O-N 2.77Å; L221-S225 PolarHBondContact O-OG 3.17Å; Q222-S225 PolarHBondContact O-N 3.01Å; L223-S225 VanDerWaalsContact C-N 3.33Å; L223-S225 PolarHBondContact O-N 3.39Å
226	K	93.9	Very high	91.4	Very high	146 Å²	146	40.6 Å²	40.6	64%	0.635	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	0	176.6	-72.1	-179.1	179.9	-173.6	0	113.9	Q222 L223 F224 P228	Q222-K226 WeakPolarHBondContact O-CG 3.45Å; Q222-K226 PolarHBondContact O-N 2.9Å; L223-K226 PolarHBondContact O-N 2.96Å; F224-K226 PolarHBondContact O-N 3.44Å; K226-P228 WeakPolarHBondContact O-CD 3.49Å
227	I	92.7	Very high	91.1	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.036	19%	0.19	C	C	.	.	S	Bend	trans	-67.7	125.5	177.9	-63.8	171.8	0	0	0	108.6	I104 I108 F224 D231 L232 L235 P247	I104-I227 HydrophobicContact CG2-CD1 4.38Å; I108-I227 HydrophobicContact CD1-CD1 4.02Å; I108-I227 HydrophobicContact CD1-CG1 4.29Å; I108-I227 HydrophobicContact CG2-CD1 4.33Å; F224-I227 HydrophobicContact CB-CD1 4.46Å; F224-I227 HydrophobicContact CD1-CD1 4.06Å; F224-I227 WeakPolarHBondContact O-CB 3.43Å; F224-I227 WeakPolarHBondContact O-CG1 3.28Å; F224-I227 PolarHBondContact O-N 3.06Å; I227-D231 HydrophobicContact CG2-CB 4.19Å; I227-L232 HydrophobicContact CG2-CD2 4.07Å; I227-L235 HydrophobicContact CD1-CD1 4.14Å; I227-L235 HydrophobicContact CG2-CD1 4.48Å; I227-P247 HydrophobicContact CD1-CB 4.08Å; I227-P247 HydrophobicContact CD1-CG 3.91Å
228	P	90.6	Very high	90.2	Very high	28 Å²	28	38.9 Å²	38.9	18%	0.182	20%	0.204	C	C	.	.			trans	-62.2	142.3	175.1	-20.8	32.4	0	0	0	111.8	R114 K226 E230 D231	R114-P228 HydrophobicContact CG-CG 4.07Å; K226-P228 WeakPolarHBondContact O-CD 3.49Å; P228-E230 HydrophobicContact CB-CG 3.69Å; P228-E230 PolarHBondContact O-N 3.42Å; P228-D231 WeakPolarHBondContact O-CB 3.26Å; P228-D231 PolarHBondContact O-N 3.42Å
229	E	87	Confident	88.8	Confident	118 Å²	118	40.7 Å²	40.7	55%	0.551	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-60.4	-33.9	-178.4	-64.4	177	165.5	0	0	112.5	D231 L232 P233 F239	E229-D231 PolarHBondContact O-N 3.08Å; E229-L232 HydrophobicContact CB-CD1 4.33Å; E229-L232 HydrophobicContact CG-CD1 4.42Å; E229-L232 WeakPolarHBondContact O-CB 3.2Å; E229-L232 PolarHBondContact O-N 3.4Å; E229-L232 VanDerWaalsContact O-N 3.11Å; E229-P233 WeakPolarHBondContact O-CD 3.45Å; E229-F239 HydrophobicContact CB-CD1 4.08Å; E229-F239 HydrophobicContact CB-CE1 3.78Å; E229-F239 HydrophobicContact CB-CE2 4.25Å; E229-F239 HydrophobicContact CB-CG 4.45Å; E229-F239 HydrophobicContact CB-CZ 3.91Å; E229-F239 HydrophobicContact CG-CD2 4.46Å; E229-F239 HydrophobicContact CG-CE1 3.99Å; E229-F239 HydrophobicContact CG-CE2 3.81Å; E229-F239 HydrophobicContact CG-CZ 3.58Å; E229-F239 WeakPolarHBondContact OE1-CZ 3.46Å; E229-F239 VanDerWaalsContact OE2-CE1 3.26Å; E229-F239 WeakPolarHBondContact OE2-CE1 3.24Å; E229-F239 WeakPolarHBondContact OE2-CZ 3.5Å
230	E	86.1	Confident	87.1	Confident	100 Å²	100	44.3 Å²	44.3	47%	0.467	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-61.1	-20.6	173.6	52.8	173	159.4	0	0	114.4	R114 R122 P228	R114-E230 IonicContact CZ-OE1 2.88Å; R114-E230 VanDerWaalsContact NH1-CD 3.26Å; R114-E230 IonicContact NH1-OE1 2.87Å; R114-E230 PolarHBondContact NH1-OE1 3.27Å; R114-E230 IonicContact NH1-OE2 2.87Å; R114-E230 IonicContact NH2-OE1 2.82Å; R114-E230 PolarHBondContact NH2-OE1 3.2Å; R122-E230 IonicContact CZ-OE2 3.6Å; R122-E230 IonicContact NH1-OE2 3.42Å; R122-E230 IonicContact NH2-OE1 2.73Å; R122-E230 IonicContact NH2-OE2 3.98Å; R122-E230 PolarHBondContact NH2-OE2 3.36Å; P228-E230 HydrophobicContact CB-CG 3.69Å; P228-E230 PolarHBondContact O-N 3.42Å
231	D	89.2	Confident	85.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-93.1	-12.5	177.6	-80.3	-9.2	0	0	0	112.9	R114 V115 R122 I227 P228 E229 L234 L235	R114-D231 WeakPolarHBondContact CA-OD2 3.45Å; V115-D231 HydrophobicContact CG2-CB 3.92Å; V115-D231 PolarHBondContact N-OD2 3.43Å; V115-D231 VanDerWaalsContact N-OD2 3.07Å; R122-D231 IonicContact CZ-OD1 2.65Å; R122-D231 IonicContact NE-OD1 3.04Å; R122-D231 PolarHBondContact NE-OD1 3.46Å; R122-D231 IonicContact NH2-OD1 3.67Å; R122-D231 PolarHBondContact NH2-OD1 2.89Å; I227-D231 HydrophobicContact CG2-CB 4.19Å; P228-D231 WeakPolarHBondContact O-CB 3.26Å; P228-D231 PolarHBondContact O-N 3.42Å; E229-D231 PolarHBondContact O-N 3.08Å; D231-L234 WeakPolarHBondContact O-CB 3.41Å; D231-L234 PolarHBondContact O-N 3.22Å; D231-L234 VanDerWaalsContact O-N 3.13Å; D231-L235 PolarHBondContact O-N 2.86Å
232	L	88.9	Confident	83.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-41.5	-179.5	-63.2	173.6	0	0	0	113.5	I227 E229 L234 L235 L236 M237 F239 P247	I227-L232 HydrophobicContact CG2-CD2 4.07Å; E229-L232 HydrophobicContact CB-CD1 4.33Å; E229-L232 HydrophobicContact CG-CD1 4.42Å; E229-L232 WeakPolarHBondContact O-CB 3.2Å; E229-L232 PolarHBondContact O-N 3.4Å; E229-L232 VanDerWaalsContact O-N 3.11Å; L232-L234 PolarHBondContact O-N 3.2Å; L232-L235 WeakPolarHBondContact O-CB 3.34Å; L232-L235 PolarHBondContact O-N 3.36Å; L232-L236 PolarHBondContact O-N 3.26Å; L232-M237 CarbonylContact C-O 3.56Å; L232-M237 PolarHBondContact O-N 2.9Å; L232-F239 HydrophobicContact CB-CB 4.39Å; L232-F239 HydrophobicContact CD1-CB 4.1Å; L232-F239 HydrophobicContact CD1-CD2 3.41Å; L232-F239 VanDerWaalsContact CD1-CD2 3.41Å; L232-F239 HydrophobicContact CD1-CE2 4.11Å; L232-F239 HydrophobicContact CD1-CG 3.9Å; L232-P247 VanDerWaalsContact CD2-CD 3.44Å; L232-P247 HydrophobicContact CD2-CG 3.89Å
233	P	86.7	Confident	82.6	Confident	28 Å²	28	55 Å²	55	18%	0.182	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-57.8	-33	174	-26.2	35.9	0	0	0	113	C129 E229 L235 L236	C129-P233 HydrophobicContact CB-CB 4.29Å; C129-P233 WeakPolarHBondContact CB-O 3.22Å; E229-P233 WeakPolarHBondContact O-CD 3.45Å; P233-L235 VanDerWaalsContact C-N 3.26Å; P233-L235 PolarHBondContact O-N 2.91Å; P233-L236 VanDerWaalsContact O-CA 3.29Å; P233-L236 WeakPolarHBondContact O-CA 3.47Å; P233-L236 WeakPolarHBondContact O-CD2 3.25Å; P233-L236 PolarHBondContact O-N 3.24Å
234	L	89.6	Confident	81.4	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-70	-24.7	178.2	-58.4	167.2	0	0	0	112.6	V115 R122 F125 I146 D231 L232 L236	V115-L234 HydrophobicContact CB-CD1 4.25Å; V115-L234 HydrophobicContact CG1-CD1 4.29Å; V115-L234 HydrophobicContact CG2-CB 4.35Å; V115-L234 HydrophobicContact CG2-CD1 4.41Å; R122-L234 HydrophobicContact CG-CD1 3.6Å; F125-L234 HydrophobicContact CB-CD2 3.84Å; I146-L234 WeakPolarHBondContact CD1-O 3.29Å; D231-L234 WeakPolarHBondContact O-CB 3.41Å; D231-L234 PolarHBondContact O-N 3.22Å; D231-L234 VanDerWaalsContact O-N 3.13Å; L232-L234 PolarHBondContact O-N 3.2Å; L234-L236 PolarHBondContact O-N 3.22Å
235	L	90.4	Very high	80.8	Confident	6 Å²	6	57.9 Å²	57.9	3%	0.031	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-82.6	0.5	170.2	-58.5	179.7	0	0	0	112.4	I104 T107 I108 V115 I227 D231 L232 P233 M237 P247 Y1330	I104-L235 HydrophobicContact CG2-CD1 4.26Å; T107-L235 HydrophobicContact CG2-CD2 3.87Å; I108-L235 HydrophobicContact CG2-CD2 4.5Å; V115-L235 HydrophobicContact CG2-CD2 4.11Å; V115-L235 HydrophobicContact CG2-CG 4.39Å; I227-L235 HydrophobicContact CD1-CD1 4.14Å; I227-L235 HydrophobicContact CG2-CD1 4.48Å; D231-L235 PolarHBondContact O-N 2.86Å; L232-L235 WeakPolarHBondContact O-CB 3.34Å; L232-L235 PolarHBondContact O-N 3.36Å; P233-L235 VanDerWaalsContact C-N 3.26Å; P233-L235 PolarHBondContact O-N 2.91Å; L235-M237 VanDerWaalsContact C-N 3.28Å; L235-P247 HydrophobicContact CD1-CG 3.99Å; L235-Y1330 WeakPolarHBondContact O-CE1 3.5Å; L235-Y1330 PolarHBondContact O-OH 3.24Å
236	L	88.2	Confident	80.6	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.052	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	43.8	-170.8	-65.2	-172.3	0	0	0	113.2	C129 K139 L142 R143 L232 P233 L234 H1331	C129-L236 HydrophobicContact CB-CD2 3.72Å; C129-L236 VanDerWaalsContact SG-CD2 3.5Å; K139-L236 VanDerWaalsContact C-CD1 3.44Å; K139-L236 HydrophobicContact CB-CD1 3.78Å; K139-L236 HydrophobicContact CG-CD1 4.27Å; K139-L236 WeakPolarHBondContact O-CD1 3.33Å; L142-L236 HydrophobicContact CB-CD1 4.08Å; R143-L236 HydrophobicContact CB-CD1 3.88Å; L232-L236 PolarHBondContact O-N 3.26Å; P233-L236 VanDerWaalsContact O-CA 3.29Å; P233-L236 WeakPolarHBondContact O-CA 3.47Å; P233-L236 WeakPolarHBondContact O-CD2 3.25Å; P233-L236 PolarHBondContact O-N 3.24Å; L234-L236 PolarHBondContact O-N 3.22Å; L236-H1331 PolarHBondContact O-ND1 3.17Å
237	M	86.2	Confident	80.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.			trans	-111.2	113.3	167.2	-72.6	-176.7	139.4	0	0	107.8	L21 L232 L235 T245 P247 L250 Y1330	L21-M237 HydrophobicContact CD1-CE 3.82Å; L232-M237 CarbonylContact C-O 3.56Å; L232-M237 PolarHBondContact O-N 2.9Å; L235-M237 VanDerWaalsContact C-N 3.28Å; M237-T245 HydrophobicContact CB-CG2 4.21Å; M237-P247 HydrophobicContact SD-CB 4.47Å; M237-P247 HydrophobicContact SD-CG 3.72Å; M237-L250 HydrophobicContact CE-CD1 4.28Å; M237-L250 HydrophobicContact CE-CD2 4.39Å; M237-L250 HydrophobicContact CE-CG 4.45Å; M237-Y1330 HydrophobicContact CE-CD1 4.48Å; M237-Y1330 HydrophobicContact CE-CD2 3.52Å; M237-Y1330 HydrophobicContact CE-CE1 4.38Å; M237-Y1330 HydrophobicContact CE-CE2 3.45Å; M237-Y1330 VanDerWaalsContact CE-CE2 3.45Å; M237-Y1330 HydrophobicContact CE-CG 4.04Å; M237-Y1330 HydrophobicContact CG-CE1 4.16Å; M237-Y1330 HydrophobicContact SD-CE2 4.24Å
238	P	72.6	Confident	80.5	Confident	47 Å²	47	55 Å²	55	31%	0.305	27%	0.271	S	S	.	.			trans	-67.2	135.3	-179.2	24.9	-32.2	0	0	0	111.1	T245 C1332	P238-T245 HydrophobicContact CG-CG2 3.95Å; P238-T245 PolarHBondContact O-N 2.81Å; P238-C1332 HydrophobicContact CG-CB 3.73Å
239	F	64.1	Low	80.5	Confident	69 Å²	69	55.2 Å²	55.2	30%	0.303	27%	0.27	S	S	.	.			trans	-111.9	-17.7	178.6	-173.8	-105	0	0	0	112.8	E229 L232 T244	E229-F239 HydrophobicContact CB-CD1 4.08Å; E229-F239 HydrophobicContact CB-CE1 3.78Å; E229-F239 HydrophobicContact CB-CE2 4.25Å; E229-F239 HydrophobicContact CB-CG 4.45Å; E229-F239 HydrophobicContact CB-CZ 3.91Å; E229-F239 HydrophobicContact CG-CD2 4.46Å; E229-F239 HydrophobicContact CG-CE1 3.99Å; E229-F239 HydrophobicContact CG-CE2 3.81Å; E229-F239 HydrophobicContact CG-CZ 3.58Å; E229-F239 WeakPolarHBondContact OE1-CZ 3.46Å; E229-F239 VanDerWaalsContact OE2-CE1 3.26Å; E229-F239 WeakPolarHBondContact OE2-CE1 3.24Å; E229-F239 WeakPolarHBondContact OE2-CZ 3.5Å; L232-F239 HydrophobicContact CB-CB 4.39Å; L232-F239 HydrophobicContact CD1-CB 4.1Å; L232-F239 HydrophobicContact CD1-CD2 3.41Å; L232-F239 VanDerWaalsContact CD1-CD2 3.41Å; L232-F239 HydrophobicContact CD1-CE2 4.11Å; L232-F239 HydrophobicContact CD1-CG 3.9Å; F239-T244 HydrophobicContact CD2-CG2 4.46Å; F239-T244 VanDerWaalsContact O-CG2 3.28Å; F239-T244 WeakPolarHBondContact O-CG2 3.32Å
240	D	57	Low	80.8	Confident	163 Å²	163	49.6 Å²	49.6	87%	0.872	24%	0.244	S	C	*	.	S	Bend	trans	-109.5	44.2	-164.3	-154.2	7.7	0	0	0	114.6
241	S	56.3	Low	81.1	Confident	51 Å²	51	45 Å²	45	36%	0.357	22%	0.223	S	C	.	.	S	Bend	trans	-145.9	166.6	170.1	69.6	0	0	0	0	109.3	W243	S241-W243 CarbonylContact O-C 3.57Å; S241-W243 PolarHBondContact O-N 2.83Å; S241-W243 PolarHBondContact OG-O 2.79Å
242	Q	65.5	Low	81.4	Confident	191 Å²	191	45.9 Å²	45.9	89%	0.893	23%	0.228	S	C	*	.	S	Bend	trans	-44.1	-16.5	171.5	-87.7	178.6	-14.6	0	0	114.6
243	W	65.9	Low	81.5	Confident	120 Å²	120	48.7 Å²	48.7	46%	0.455	24%	0.241	S	C	.	.	S	Bend	trans	-115.2	89.2	-178.1	-53.1	87.4	0	0	0	109.9	K18 Q20 S241	K18-W243 HydrophobicContact CD-CB 4.22Å; K18-W243 HydrophobicContact CD-CD2 4.31Å; K18-W243 HydrophobicContact CD-CG 3.89Å; K18-W243 VanDerWaalsContact NZ-CD1 3.32Å; Q20-W243 VanDerWaalsContact OE1-CE3 3.25Å; S241-W243 CarbonylContact O-C 3.57Å; S241-W243 PolarHBondContact O-N 2.83Å; S241-W243 PolarHBondContact OG-O 2.79Å
244	T	72.2	Confident	81.9	Confident	67 Å²	67	48.9 Å²	48.9	41%	0.411	24%	0.238	S	C	.	.			trans	-91.6	138.3	177	57.6	0	0	0	0	111.4	Q20 F239	Q20-T244 PolarHBondContact NE2-O 3.4Å; F239-T244 HydrophobicContact CD2-CG2 4.46Å; F239-T244 VanDerWaalsContact O-CG2 3.28Å; F239-T244 WeakPolarHBondContact O-CG2 3.32Å
245	T	80.6	Confident	82.1	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.012	24%	0.238	C	C	.	.			trans	-122.4	137.2	171.9	154.8	0	0	0	0	109.9	M237 P238 C1332	M237-T245 HydrophobicContact CB-CG2 4.21Å; P238-T245 HydrophobicContact CG-CG2 3.95Å; P238-T245 PolarHBondContact O-N 2.81Å; T245-C1332 HydrophobicContact CG2-CB 3.62Å
246	H	89.1	Confident	82.2	Confident	26 Å²	26	50.5 Å²	50.5	12%	0.12	25%	0.249	C	C	.	.			trans	-128.9	141.4	-176.7	-164.4	-91.3	0	0	0	111.5	F224 R248 N249	F224-H246 PolarHBondContact O-CE1 3.21Å; H246-R248 HydrophobicContact CB-CG 4.19Å; H246-R248 WeakPolarHBondContact ND1-CB 3.49Å; H246-R248 VanDerWaalsContact ND1-CG 3.29Å; H246-R248 WeakPolarHBondContact ND1-CG 3.42Å; H246-R248 PolarHBondContact ND1-N 2.81Å; H246-R248 PolarHBondContact O-N 2.92Å; H246-N249 WeakPolarHBondContact O-CB 3.43Å; H246-N249 PolarHBondContact O-N 3.45Å
247	P	91.7	Very high	82.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-53	-29.9	178.5	-30.1	35.6	0	0	0	114.4	I104 F224 I227 L232 L235 M237 N249 L250	I104-P247 HydrophobicContact CD1-CB 4.33Å; F224-P247 HydrophobicContact CB-CB 3.97Å; F224-P247 HydrophobicContact CD1-CB 4.36Å; F224-P247 HydrophobicContact CD2-CB 4.09Å; F224-P247 VanDerWaalsContact CD2-O 3.29Å; F224-P247 WeakPolarHBondContact CD2-O 3.19Å; F224-P247 HydrophobicContact CG-CB 3.89Å; I227-P247 HydrophobicContact CD1-CB 4.08Å; I227-P247 HydrophobicContact CD1-CG 3.91Å; L232-P247 VanDerWaalsContact CD2-CD 3.44Å; L232-P247 HydrophobicContact CD2-CG 3.89Å; L235-P247 HydrophobicContact CD1-CG 3.99Å; M237-P247 HydrophobicContact SD-CB 4.47Å; M237-P247 HydrophobicContact SD-CG 3.72Å; P247-N249 PolarHBondContact O-N 2.92Å; P247-L250 VanDerWaalsContact O-CB 3.27Å; P247-L250 WeakPolarHBondContact O-CB 3.43Å; P247-L250 WeakPolarHBondContact O-CG 3.39Å; P247-L250 PolarHBondContact O-N 3.44Å; P247-L250 VanDerWaalsContact O-N 3.1Å
248	R	91.9	Very high	82.9	Confident	127 Å²	127	50.5 Å²	50.5	48%	0.479	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-58.3	-32.1	176.3	79.6	-171.6	171.8	-172.7	-5.2	113.1	L221 F224 H246 L250 I251	L221-R248 HydrophobicContact CD1-CB 3.97Å; F224-R248 HydrophobicContact CB-CB 4.47Å; H246-R248 HydrophobicContact CB-CG 4.19Å; H246-R248 WeakPolarHBondContact ND1-CB 3.49Å; H246-R248 VanDerWaalsContact ND1-CG 3.29Å; H246-R248 WeakPolarHBondContact ND1-CG 3.42Å; H246-R248 PolarHBondContact ND1-N 2.81Å; H246-R248 PolarHBondContact O-N 2.92Å; R248-L250 PolarHBondContact O-N 3.32Å; R248-I251 PolarHBondContact O-N 3.01Å
249	N	91.2	Very high	83.9	Confident	32 Å²	32	48.5 Å²	48.5	17%	0.171	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-73.1	-5.1	-179.3	-58.3	-7.4	0	0	0	112.5	L21 H246 P247 I251	L21-N249 HydrophobicContact CB-CB 4.07Å; L21-N249 HydrophobicContact CD1-CB 4.44Å; H246-N249 WeakPolarHBondContact O-CB 3.43Å; H246-N249 PolarHBondContact O-N 3.45Å; P247-N249 PolarHBondContact O-N 2.92Å; N249-I251 VanDerWaalsContact C-N 3.28Å
250	L	93.1	Very high	85.1	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-77.7	-17.1	172.2	-60.7	172.1	0	0	0	112.6	L21 H94 Y97 I101 I104 M237 P247 R248 Y1330	L21-L250 HydrophobicContact CD1-CD2 3.51Å; L21-L250 HydrophobicContact CD1-CG 4.14Å; L21-L250 HydrophobicContact CD2-CD2 4.14Å; H94-L250 WeakPolarHBondContact CB-O 3.37Å; Y97-L250 HydrophobicContact CD1-CD2 3.73Å; Y97-L250 HydrophobicContact CD2-CD2 4Å; Y97-L250 HydrophobicContact CE1-CD2 4.3Å; Y97-L250 HydrophobicContact CG-CD2 3.6Å; I101-L250 HydrophobicContact CD1-CB 4.2Å; I101-L250 HydrophobicContact CG1-CB 4.03Å; I101-L250 HydrophobicContact CG1-CD1 4.2Å; I104-L250 HydrophobicContact CD1-CD1 3.53Å; M237-L250 HydrophobicContact CE-CD1 4.28Å; M237-L250 HydrophobicContact CE-CD2 4.39Å; M237-L250 HydrophobicContact CE-CG 4.45Å; P247-L250 VanDerWaalsContact O-CB 3.27Å; P247-L250 WeakPolarHBondContact O-CB 3.43Å; P247-L250 WeakPolarHBondContact O-CG 3.39Å; P247-L250 PolarHBondContact O-N 3.44Å; P247-L250 VanDerWaalsContact O-N 3.1Å; R248-L250 PolarHBondContact O-N 3.32Å; L250-Y1330 HydrophobicContact CD1-CD2 4.37Å; L250-Y1330 HydrophobicContact CD1-CE2 4.19Å; L250-Y1330 HydrophobicContact CD2-CD2 4.15Å
251	I	94	Very high	86.6	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.015	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.2	178.9	-59.8	-179.9	0	0	0	107.5	P91 Y93 P217 A220 L221 F224 R248 N249	P91-I251 HydrophobicContact CB-CG2 3.61Å; Y93-I251 HydrophobicContact CD1-CG1 4.35Å; Y93-I251 HydrophobicContact CE1-CD1 4.36Å; Y93-I251 HydrophobicContact CE1-CG1 4.48Å; P217-I251 HydrophobicContact CB-CG2 4.12Å; P217-I251 WeakPolarHBondContact O-CD1 3.4Å; A220-I251 HydrophobicContact CB-CD1 3.68Å; L221-I251 VanDerWaalsContact CA-CD1 3.5Å; L221-I251 HydrophobicContact CB-CD1 3.74Å; L221-I251 HydrophobicContact CB-CG2 4.46Å; L221-I251 HydrophobicContact CD1-CB 4.25Å; L221-I251 HydrophobicContact CD1-CD1 4.36Å; L221-I251 HydrophobicContact CD1-CG2 4.49Å; F224-I251 HydrophobicContact CD2-CD1 3.84Å; F224-I251 HydrophobicContact CD2-CG1 4.28Å; F224-I251 HydrophobicContact CE2-CD1 4.07Å; F224-I251 HydrophobicContact CE2-CG1 4.34Å; R248-I251 PolarHBondContact O-N 3.01Å; N249-I251 VanDerWaalsContact C-N 3.28Å
252	V	93.6	Very high	88.2	Confident	18 Å²	18	41.4 Å²	41.4	11%	0.109	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	119.8	-173.1	-174.8	0	0	0	0	108.5	L88 P91 I92 H94 R254 V255 F313	L88-V252 HydrophobicContact CD1-CG1 4.11Å; P91-V252 WeakPolarHBondContact CA-O 3.48Å; I92-V252 HydrophobicContact CG1-CB 3.8Å; I92-V252 HydrophobicContact CG1-CG1 4.35Å; I92-V252 PolarHBondContact N-O 3.46Å; I92-V252 PolarHBondContact O-N 3.43Å; H94-V252 HydrophobicContact CB-CG2 3.78Å; V252-R254 WeakPolarHBondContact CG1-O 3.43Å; V252-V255 HydrophobicContact CG1-CG2 4.06Å; V252-F313 HydrophobicContact CG1-CE2 4.34Å; V252-F313 HydrophobicContact CG1-CZ 4.15Å; V252-F313 HydrophobicContact CG2-CE1 4.06Å; V252-F313 HydrophobicContact CG2-CZ 3.97Å
253	Q	92.5	Very high	89.4	Confident	59 Å²	59	32.4 Å²	32.4	28%	0.276	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-17.4	166.1	-50.7	172.2	66	0	0	111.6	E24 L88 P91 L221	E24-Q253 WeakPolarHBondContact OE1-CB 3.49Å; E24-Q253 WeakPolarHBondContact OE1-CG 3.28Å; E24-Q253 PolarHBondContact OE1-NE2 3.45Å; E24-Q253 PolarHBondContact OE2-NE2 3.09Å; L88-Q253 WeakPolarHBondContact CB-O 3.49Å; L88-Q253 PolarHBondContact N-O 2.95Å; P91-Q253 HydrophobicContact CB-CG 3.91Å; P91-Q253 HydrophobicContact CG-CG 4.04Å; L221-Q253 HydrophobicContact CD2-CG 4.46Å; L221-Q253 VanDerWaalsContact CD2-NE2 3.31Å
254	R	93.6	Very high	90.5	Very high	32 Å²	32	29.1 Å²	29.1	12%	0.121	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.3	179.7	179.5	171.5	-72.7	135.3	9.8	109.7	E24 Y85 D87 V252	E24-R254 HydrophobicContact CG-CB 4.16Å; E24-R254 PolarHBondContact O-NH1 3.34Å; Y85-R254 HydrophobicContact CD2-CG 3.66Å; Y85-R254 VanDerWaalsContact CE2-NE 3.32Å; Y85-R254 HydrophobicContact CG-CG 4.07Å; D87-R254 IonicContact OD1-CZ 3.78Å; D87-R254 IonicContact OD1-NE 2.66Å; D87-R254 PolarHBondContact OD1-NE 2.95Å; D87-R254 IonicContact OD1-NH2 3.47Å; D87-R254 PolarHBondContact OD1-NH2 3.14Å; D87-R254 IonicContact OD2-NH2 2.65Å; D87-R254 PolarHBondContact OD2-NH2 2.68Å; D87-R254 VanDerWaalsContact OD2-NH2 3.17Å; V252-R254 WeakPolarHBondContact CG1-O 3.43Å
255	V	93.9	Very high	91.1	Very high	1 Å²	1	27 Å²	27	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.4	179.2	179.6	0	0	0	0	109.3	Y85 F86 L88 V252 Y283 F313 L316	Y85-V255 VanDerWaalsContact CA-O 3.31Å; Y85-V255 WeakPolarHBondContact CA-O 3.29Å; F86-V255 HydrophobicContact CD1-CB 4.42Å; F86-V255 HydrophobicContact CD2-CB 4.16Å; F86-V255 HydrophobicContact CE1-CB 3.92Å; F86-V255 HydrophobicContact CE1-CG1 3.83Å; F86-V255 HydrophobicContact CE2-CB 3.62Å; F86-V255 HydrophobicContact CE2-CG1 4.19Å; F86-V255 HydrophobicContact CE2-CG2 3.8Å; F86-V255 HydrophobicContact CZ-CB 3.49Å; F86-V255 VanDerWaalsContact CZ-CB 3.49Å; F86-V255 HydrophobicContact CZ-CG1 3.54Å; F86-V255 HydrophobicContact CZ-CG2 3.99Å; F86-V255 PolarHBondContact N-O 3.01Å; F86-V255 PolarHBondContact O-N 3.13Å; L88-V255 HydrophobicContact CD1-CG2 3.78Å; L88-V255 HydrophobicContact CD2-CG2 4.06Å; L88-V255 HydrophobicContact CG-CG2 3.93Å; V252-V255 HydrophobicContact CG1-CG2 4.06Å; V255-Y283 HydrophobicContact CG1-CD1 4.47Å; V255-Y283 HydrophobicContact CG1-CE1 4.03Å; V255-F313 HydrophobicContact CG1-CE2 4.11Å; V255-F313 HydrophobicContact CG2-CD2 4.03Å; V255-F313 HydrophobicContact CG2-CE2 3.85Å; V255-L316 HydrophobicContact CG1-CD2 4.39Å
256	P	94.1	Very high	91.2	Very high	42 Å²	42	31.2 Å²	31.2	27%	0.273	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.3	170.7	24.5	-29.2	0	0	0	111.2	L27 W83 Y283	L27-P256 HydrophobicContact CD2-CB 3.74Å; L27-P256 HydrophobicContact CD2-CG 4Å; W83-P256 HydrophobicContact CE3-CB 4.22Å; W83-P256 HydrophobicContact CZ3-CB 4.23Å; P256-Y283 WeakPolarHBondContact O-CE1 3.4Å; P256-Y283 PolarHBondContact O-OH 3.17Å
257	V	94.8	Very high	90.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.6	169.6	-177.8	0	0	0	0	108.1	V35 L55 L60 G84 F86 Y283	V35-V257 HydrophobicContact CB-CG2 4.46Å; V35-V257 HydrophobicContact CG2-CB 4.46Å; V35-V257 HydrophobicContact CG2-CG1 4.48Å; V35-V257 HydrophobicContact CG2-CG2 4.05Å; L55-V257 HydrophobicContact CD2-CG1 4.09Å; L55-V257 HydrophobicContact CD2-CG2 4.41Å; L60-V257 HydrophobicContact CD1-CG1 4.31Å; G84-V257 PolarHBondContact N-O 3.39Å; G84-V257 PolarHBondContact O-N 2.68Å; F86-V257 HydrophobicContact CD1-CG2 3.44Å; F86-V257 VanDerWaalsContact CD1-CG2 3.44Å; F86-V257 HydrophobicContact CE1-CG2 3.71Å; V257-Y283 HydrophobicContact CG1-CD2 4.39Å; V257-Y283 HydrophobicContact CG1-CE2 4.25Å
258	C	93.3	Very high	89.7	Confident	10 Å²	10	36.4 Å²	36.4	7%	0.068	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-59.6	148.9	177.7	-66.5	0	0	0	0	111.5	W83 I262 R263 Y283	W83-C258 HydrophobicContact CZ3-CB 4.36Å; C258-I262 HydrophobicContact CB-CB 4.4Å; C258-I262 HydrophobicContact CB-CD1 4.39Å; C258-R263 VanDerWaalsContact O-CZ 3.32Å; C258-R263 PolarHBondContact O-NE 2.9Å; C258-R263 PolarHBondContact O-NH2 3.09Å; C258-Y283 PolarHBondContact N-OH 3.17Å; C258-Y283 PolarHBondContact SG-OH 3.47Å; C258-Y283 VanDerWaalsContact SG-OH 3.39Å
259	P	93.4	Very high	88.5	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.026	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-54.6	151.6	171.2	-24.6	31.6	0	0	0	113.2	H82 W83 A261 I262	H82-P259 WeakPolarHBondContact O-CA 3.42Å; W83-P259 HydrophobicContact CD2-CG 4.26Å; W83-P259 HydrophobicContact CG-CG 4.32Å; P259-A261 PolarHBondContact O-N 3.29Å; P259-I262 HydrophobicContact CG-CD1 4.48Å; P259-I262 PolarHBondContact O-N 3.07Å
260	S	89.6	Confident	87.3	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.014	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.9	-30.2	179.2	-61.7	0	0	0	0	113.6	L60 N63 I262 R263	L60-S260 PolarHBondContact O-N 2.87Å; N63-S260 WeakPolarHBondContact OD1-CB 3.48Å; N63-S260 PolarHBondContact OD1-OG 3.27Å; S260-I262 PolarHBondContact O-N 2.61Å; S260-I262 VanDerWaalsContact O-N 3.14Å; S260-R263 CarbonylContact O-C 3.53Å; S260-R263 VanDerWaalsContact O-C 3.25Å; S260-R263 PolarHBondContact O-N 3.2Å
261	A	88.3	Confident	85.7	Confident	48 Å²	48	54.6 Å²	54.6	40%	0.397	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-58.6	-25.8	176.4	0	0	0	0	0	113.7	P259	P259-A261 PolarHBondContact O-N 3.29Å
262	I	90.4	Very high	84.4	Confident	85 Å²	85	60 Å²	60	44%	0.436	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-86.6	-20.6	179.7	-56.2	-176.5	0	0	0	111.9	C258 P259 S260 P264	C258-I262 HydrophobicContact CB-CB 4.4Å; C258-I262 HydrophobicContact CB-CD1 4.39Å; P259-I262 HydrophobicContact CG-CD1 4.48Å; P259-I262 PolarHBondContact O-N 3.07Å; S260-I262 PolarHBondContact O-N 2.61Å; S260-I262 VanDerWaalsContact O-N 3.14Å; I262-P264 VanDerWaalsContact C-CD 3.5Å; I262-P264 WeakPolarHBondContact O-CD 3.48Å
263	R	91.2	Very high	83.3	Confident	1 Å²	1	60 Å²	60	0%	0.004	34%	0.337	C	S	.	.	S	Bend	trans	-130.5	65.7	-173.9	48.5	-175.3	-179	104.2	9	110.2	L55 C258 S260 D277 T280	L55-R263 VanDerWaalsContact O-CZ 3.23Å; L55-R263 PolarHBondContact O-NH1 3.03Å; L55-R263 PolarHBondContact O-NH2 2.95Å; C258-R263 VanDerWaalsContact O-CZ 3.32Å; C258-R263 PolarHBondContact O-NE 2.9Å; C258-R263 PolarHBondContact O-NH2 3.09Å; S260-R263 CarbonylContact O-C 3.53Å; S260-R263 VanDerWaalsContact O-C 3.25Å; S260-R263 PolarHBondContact O-N 3.2Å; R263-D277 HydrophobicContact CB-CB 3.91Å; R263-T280 PolarHBondContact NH1-OG1 3.13Å
264	P	87.2	Confident	82.5	Confident	51 Å²	51	58.8 Å²	58.8	33%	0.331	33%	0.333	S	S	.	.			trans	-66.5	139.3	-172	28	-35	0	0	0	111.8	I262	I262-P264 VanDerWaalsContact C-CD 3.5Å; I262-P264 WeakPolarHBondContact O-CD 3.48Å
265	S	85.2	Confident	82.1	Confident	24 Å²	24	62.6 Å²	62.6	17%	0.168	36%	0.356	C	S	.	.			trans	-82.6	134.1	170.9	-53.4	0	0	0	0	110	E276	S265-E276 VanDerWaalsContact CB-OE2 3.25Å; S265-E276 WeakPolarHBondContact CB-OE2 3.34Å; S265-E276 PolarHBondContact OG-OE2 2.65Å
266	V	82.7	Confident	81.7	Confident	90 Å²	90	63.6 Å²	63.6	55%	0.545	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	115	176.9	-177	0	0	0	0	109.1	N275	V266-N275 PolarHBondContact N-O 2.98Å; V266-N275 PolarHBondContact O-N 2.91Å
267	V	76.3	Confident	81.5	Confident	91 Å²	91	62.8 Å²	62.8	55%	0.552	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	122.8	172.8	-168.1	0	0	0	0	108.1	T274	V267-T274 HydrophobicContact CG2-CG2 4.35Å
268	S	73.2	Confident	81.4	Confident	44 Å²	44	64.5 Å²	64.5	31%	0.308	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128	171.4	-167.1	0	0	0	0	109.1	V270 G273	S268-V270 VanDerWaalsContact C-N 3.3Å; S268-G273 PolarHBondContact N-O 2.89Å
269	E	66.2	Low	81.4	Confident	199 Å²	199	64 Å²	64	93%	0.93	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-27.3	175.7	-68.7	-178.6	172.7	0	0	112.3
270	V	66.7	Low	81.4	Confident	137 Å²	137	63.9 Å²	63.9	83%	0.83	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-35.3	-168.4	-176.2	0	0	0	0	112.9	S268	S268-V270 VanDerWaalsContact C-N 3.3Å
271	R	60.1	Low	81.4	Confident	206 Å²	206	66.9 Å²	66.9	78%	0.777	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	121	170.7	-74.8	-179.2	179.5	-179.1	-0.9	104.9	G273	R271-G273 WeakPolarHBondContact O-CA 3.38Å; R271-G273 PolarHBondContact O-N 3.14Å
272	S	65.9	Low	81.6	Confident	115 Å²	115	64.7 Å²	64.7	80%	0.804	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	77.6	175.1	-49.1	0	0	0	0	110.4	R48	R48-S272 VanDerWaalsContact CZ-O 3.26Å; R48-S272 PolarHBondContact NH1-O 3.39Å; R48-S272 VanDerWaalsContact NH1-O 3.12Å; R48-S272 PolarHBondContact NH2-O 2.86Å
273	G	69.8	Low	81.7	Confident	20 Å²	20	60.8 Å²	60.8	21%	0.206	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	127.5	-149.1	0	0	0	0	0	108	R48 S268 R271	R48-G273 VanDerWaalsContact NH1-N 3.12Å; S268-G273 PolarHBondContact N-O 2.89Å; R271-G273 WeakPolarHBondContact O-CA 3.38Å; R271-G273 PolarHBondContact O-N 3.14Å
274	T	77.1	Confident	81.8	Confident	33 Å²	33	63.1 Å²	63.1	20%	0.202	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.5	174.6	56.1	0	0	0	0	108.5	Y41 V267 E276	Y41-T274 PolarHBondContact OH-OG1 2.81Å; V267-T274 HydrophobicContact CG2-CG2 4.35Å; T274-E276 VanDerWaalsContact CB-OE1 3.27Å; T274-E276 WeakPolarHBondContact CB-OE1 3.14Å; T274-E276 PolarHBondContact OG1-OE1 2.86Å
275	N	83.8	Confident	81.9	Confident	112 Å²	112	63.1 Å²	63.1	60%	0.599	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.7	167.7	-79.5	-35.7	0	0	0	107.7	V266	V266-N275 PolarHBondContact N-O 2.98Å; V266-N275 PolarHBondContact O-N 2.91Å
276	E	85.9	Confident	82.2	Confident	21 Å²	21	62 Å²	62	10%	0.098	33%	0.33	C	S	.	.			trans	-87.8	149.8	178.3	-54.8	-54.8	149.5	0	0	111.3	L40 Y41 S265 T274 T280 Q281	L40-E276 HydrophobicContact CD1-CG 4.02Å; Y41-E276 PolarHBondContact OH-OE1 3.39Å; S265-E276 VanDerWaalsContact CB-OE2 3.25Å; S265-E276 WeakPolarHBondContact CB-OE2 3.34Å; S265-E276 PolarHBondContact OG-OE2 2.65Å; T274-E276 VanDerWaalsContact CB-OE1 3.27Å; T274-E276 WeakPolarHBondContact CB-OE1 3.14Å; T274-E276 PolarHBondContact OG1-OE1 2.86Å; E276-T280 HydrophobicContact CB-CG2 4.46Å; E276-Q281 PolarHBondContact O-NE2 3Å
277	D	91	Very high	82.6	Confident	26 Å²	26	58.4 Å²	58.4	14%	0.139	31%	0.308	C	S	.	.			trans	-61.6	143.3	175.8	-176.5	-69.7	0	0	0	111.6	R263 L279 T280 Q281 R339	R263-D277 HydrophobicContact CB-CB 3.91Å; D277-L279 PolarHBondContact O-N 3.36Å; D277-L279 VanDerWaalsContact O-N 3.1Å; D277-L279 WeakPolarHBondContact OD1-CB 3.48Å; D277-L279 PolarHBondContact OD1-N 2.62Å; D277-T280 WeakPolarHBondContact O-CB 3.37Å; D277-T280 PolarHBondContact O-N 3.14Å; D277-Q281 PolarHBondContact O-N 3.29Å; D277-R339 IonicContact OD1-CZ 3.71Å; D277-R339 VanDerWaalsContact OD1-CZ 3.31Å; D277-R339 IonicContact OD1-NH1 3.16Å; D277-R339 PolarHBondContact OD1-NH1 3.09Å; D277-R339 IonicContact OD1-NH2 2.72Å; D277-R339 PolarHBondContact OD1-NH2 2.85Å; D277-R339 IonicContact OD2-CZ 3.7Å; D277-R339 IonicContact OD2-NH1 3.55Å; D277-R339 PolarHBondContact OD2-NH1 3.44Å; D277-R339 IonicContact OD2-NH2 3.7Å; D277-R339 PolarHBondContact OD2-NH2 2.63Å; D277-R339 VanDerWaalsContact OD2-NH2 3.1Å
278	D	91.9	Very high	83.3	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.193	30%	0.296	C	S	.	.	H	α-helix	trans	-47.2	-38.7	177.2	-62.2	-11	0	0	0	113.2	T280 Q281 M282 M333 R334	D278-T280 VanDerWaalsContact C-N 3.34Å; D278-T280 PolarHBondContact O-N 2.71Å; D278-Q281 PolarHBondContact O-N 2.9Å; D278-M282 HydrophobicContact CB-CE 4.3Å; D278-M282 VanDerWaalsContact O-CG 3.3Å; D278-M282 WeakPolarHBondContact O-CG 3.49Å; D278-M282 PolarHBondContact O-N 2.78Å; D278-M333 HydrophobicContact CB-CB 4.09Å; D278-M333 HydrophobicContact CB-CG 4.39Å; D278-M333 HydrophobicContact CB-SD 4.38Å; D278-R334 PolarHBondContact OD2-N 2.95Å
279	L	93.4	Very high	84	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-38.1	179.5	-65.8	176.2	0	0	0	111.8	D277 Q281 M282 Y283 L316 L336	D277-L279 PolarHBondContact O-N 3.36Å; D277-L279 VanDerWaalsContact O-N 3.1Å; D277-L279 WeakPolarHBondContact OD1-CB 3.48Å; D277-L279 PolarHBondContact OD1-N 2.62Å; L279-Q281 VanDerWaalsContact C-N 3.32Å; L279-M282 HydrophobicContact CD2-SD 4.4Å; L279-M282 PolarHBondContact O-N 2.97Å; L279-Y283 HydrophobicContact CB-CE2 4.41Å; L279-Y283 WeakPolarHBondContact O-CD2 3.2Å; L279-Y283 PolarHBondContact O-N 2.92Å; L279-L316 HydrophobicContact CD2-CD1 3.74Å; L279-L336 HydrophobicContact CD1-CD2 4.02Å; L279-L336 HydrophobicContact CD2-CD2 4.05Å; L279-L336 HydrophobicContact CD2-CG 4.31Å
280	T	92.7	Very high	85.1	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-41	177.3	-59.7	0	0	0	0	110.4	L40 L55 L56 R263 E276 D277 D278 Y283 Q284	L40-T280 HydrophobicContact CD2-CG2 3.67Å; L55-T280 HydrophobicContact CB-CG2 4.34Å; L55-T280 HydrophobicContact CD1-CG2 4.45Å; L56-T280 HydrophobicContact CD2-CG2 4.29Å; R263-T280 PolarHBondContact NH1-OG1 3.13Å; E276-T280 HydrophobicContact CB-CG2 4.46Å; D277-T280 WeakPolarHBondContact O-CB 3.37Å; D277-T280 PolarHBondContact O-N 3.14Å; D278-T280 VanDerWaalsContact C-N 3.34Å; D278-T280 PolarHBondContact O-N 2.71Å; T280-Y283 PolarHBondContact O-N 3.27Å; T280-Q284 PolarHBondContact O-N 2.88Å
281	Q	90.3	Very high	86.1	Confident	65 Å²	65	42.7 Å²	42.7	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-42.7	175.1	-64.8	178.1	51.7	0	0	111.9	E276 D277 D278 L279 Y283 Q284 W285 M333	E276-Q281 PolarHBondContact O-NE2 3Å; D277-Q281 PolarHBondContact O-N 3.29Å; D278-Q281 PolarHBondContact O-N 2.9Å; L279-Q281 VanDerWaalsContact C-N 3.32Å; Q281-Y283 PolarHBondContact O-N 3.23Å; Q281-Q284 WeakPolarHBondContact O-CB 3.16Å; Q281-Q284 PolarHBondContact O-N 3.37Å; Q281-W285 PolarHBondContact O-N 3.41Å; Q281-M333 HydrophobicContact CB-SD 4.3Å
282	M	91.8	Very high	87.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-43	175.6	-68.8	176.4	-165.4	0	0	112.2	D278 L279 Q284 W285 I286 L316 M333	D278-M282 HydrophobicContact CB-CE 4.3Å; D278-M282 VanDerWaalsContact O-CG 3.3Å; D278-M282 WeakPolarHBondContact O-CG 3.49Å; D278-M282 PolarHBondContact O-N 2.78Å; L279-M282 HydrophobicContact CD2-SD 4.4Å; L279-M282 PolarHBondContact O-N 2.97Å; M282-Q284 VanDerWaalsContact C-N 3.3Å; M282-Q284 PolarHBondContact O-N 3.27Å; M282-W285 PolarHBondContact O-N 3.15Å; M282-I286 VanDerWaalsContact O-CG1 3.28Å; M282-I286 WeakPolarHBondContact O-CG1 3.28Å; M282-I286 PolarHBondContact O-N 3.49Å; M282-L316 HydrophobicContact CB-CD1 3.92Å; M282-L316 VanDerWaalsContact SD-CA 3.52Å; M282-L316 HydrophobicContact SD-CB 4.27Å; M282-L316 HydrophobicContact SD-CD1 4.04Å; M282-M333 HydrophobicContact CE-CB 3.28Å; M282-M333 HydrophobicContact CE-CE 4.28Å; M282-M333 HydrophobicContact CE-CG 4.41Å; M282-M333 HydrophobicContact CE-SD 4.38Å; M282-M333 HydrophobicContact CG-CE 3.98Å; M282-M333 HydrophobicContact CG-SD 4.44Å
283	Y	94.4	Very high	88.4	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-40.4	174.6	-73.1	-52.6	0	0	0	112.1	L55 F86 V255 P256 V257 C258 L279 T280 Q281 W285 I286 L287 L316	L55-Y283 HydrophobicContact CD2-CD2 4.43Å; L55-Y283 HydrophobicContact CD2-CG 4.19Å; F86-Y283 AromaticContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CD1 3.79Å; F86-Y283 HydrophobicContact CE1-CE1 4.37Å; F86-Y283 HydrophobicContact CZ-CD1 4.21Å; V255-Y283 HydrophobicContact CG1-CD1 4.47Å; V255-Y283 HydrophobicContact CG1-CE1 4.03Å; P256-Y283 WeakPolarHBondContact O-CE1 3.4Å; P256-Y283 PolarHBondContact O-OH 3.17Å; V257-Y283 HydrophobicContact CG1-CD2 4.39Å; V257-Y283 HydrophobicContact CG1-CE2 4.25Å; C258-Y283 PolarHBondContact N-OH 3.17Å; C258-Y283 PolarHBondContact SG-OH 3.47Å; C258-Y283 VanDerWaalsContact SG-OH 3.39Å; L279-Y283 HydrophobicContact CB-CE2 4.41Å; L279-Y283 WeakPolarHBondContact O-CD2 3.2Å; L279-Y283 PolarHBondContact O-N 2.92Å; T280-Y283 PolarHBondContact O-N 3.27Å; Q281-Y283 PolarHBondContact O-N 3.23Å; Y283-W285 VanDerWaalsContact C-N 3.33Å; Y283-W285 PolarHBondContact O-N 3.46Å; Y283-I286 PolarHBondContact O-N 3.5Å; Y283-L287 WeakPolarHBondContact O-CB 3.41Å; Y283-L287 PolarHBondContact O-N 3.5Å; Y283-L316 HydrophobicContact CD1-CD1 4.41Å; Y283-L316 HydrophobicContact CD1-CD2 4.13Å; Y283-L316 HydrophobicContact CE1-CD1 4.14Å; Y283-L316 HydrophobicContact CE1-CD2 3.66Å
284	Q	92.1	Very high	89	Confident	49 Å²	49	36.2 Å²	36.2	23%	0.229	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-43.5	177.1	179.2	176	27.4	0	0	111.4	C38 L55 T280 Q281 M282 L287 A288	C38-Q284 HydrophobicContact CB-CG 4.44Å; C38-Q284 WeakPolarHBondContact O-CG 3.47Å; C38-Q284 PolarHBondContact O-NE2 3.12Å; L55-Q284 HydrophobicContact CD1-CB 3.87Å; T280-Q284 PolarHBondContact O-N 2.88Å; Q281-Q284 WeakPolarHBondContact O-CB 3.16Å; Q281-Q284 PolarHBondContact O-N 3.37Å; M282-Q284 VanDerWaalsContact C-N 3.3Å; M282-Q284 PolarHBondContact O-N 3.27Å; Q284-L287 PolarHBondContact O-N 3.1Å; Q284-A288 WeakPolarHBondContact O-CB 3.34Å; Q284-A288 PolarHBondContact O-N 2.97Å
285	W	89.4	Confident	89.4	Confident	51 Å²	51	40.4 Å²	40.4	19%	0.193	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-39.9	177.9	-64.3	-10.8	0	0	0	112.8	Q281 M282 Y283 A288 Q289 E312 H330 M333	Q281-W285 PolarHBondContact O-N 3.41Å; M282-W285 PolarHBondContact O-N 3.15Å; Y283-W285 VanDerWaalsContact C-N 3.33Å; Y283-W285 PolarHBondContact O-N 3.46Å; W285-A288 PolarHBondContact O-N 3.32Å; W285-Q289 WeakPolarHBondContact O-CG 3.19Å; W285-Q289 PolarHBondContact O-N 3.32Å; W285-E312 HydrophobicContact CB-CG 4.43Å; W285-H330 HydrophobicContact CH2-CB 4.14Å; W285-H330 AromaticContact CH2-CD2 3.18Å; W285-H330 WeakPolarHBondContact CH2-CD2 3.37Å; W285-H330 AromaticContact CH2-CG 3.64Å; W285-H330 AromaticContact CH2-NE2 3.69Å; W285-H330 AromaticContact CZ2-CD2 3.57Å; W285-H330 AromaticContact CZ2-NE2 3.54Å; W285-M333 HydrophobicContact CE3-CE 3.81Å; W285-M333 HydrophobicContact CH2-CE 3.17Å; W285-M333 HydrophobicContact CH2-SD 4.2Å; W285-M333 HydrophobicContact CZ2-CE 4.12Å; W285-M333 HydrophobicContact CZ3-CE 3.02Å; W285-M333 HydrophobicContact CZ3-SD 4.49Å
286	I	92.1	Very high	88.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-45.2	175.3	-64.1	164.2	0	0	0	110.2	F86 L88 M282 Y283 A288 Q289 A290 L309 E312 F313 L316	F86-I286 HydrophobicContact CE2-CB 4.48Å; F86-I286 HydrophobicContact CE2-CG2 3.6Å; F86-I286 HydrophobicContact CZ-CB 4.18Å; F86-I286 HydrophobicContact CZ-CG2 3.68Å; L88-I286 HydrophobicContact CD2-CG2 4.1Å; M282-I286 VanDerWaalsContact O-CG1 3.28Å; M282-I286 WeakPolarHBondContact O-CG1 3.28Å; M282-I286 PolarHBondContact O-N 3.49Å; Y283-I286 PolarHBondContact O-N 3.5Å; I286-A288 VanDerWaalsContact C-N 3.35Å; I286-A288 PolarHBondContact O-N 2.87Å; I286-Q289 PolarHBondContact O-N 2.97Å; I286-A290 VanDerWaalsContact O-CB 3.31Å; I286-A290 WeakPolarHBondContact O-CB 3.34Å; I286-A290 PolarHBondContact O-N 3.32Å; I286-L309 HydrophobicContact CG2-CD1 3.87Å; I286-E312 HydrophobicContact CG1-CB 3.84Å; I286-F313 HydrophobicContact CD1-CB 4.45Å; I286-F313 HydrophobicContact CD1-CD2 4.32Å; I286-L316 HydrophobicContact CD1-CB 4.1Å; I286-L316 HydrophobicContact CD1-CD2 3.86Å
287	L	91.7	Very high	88.7	Confident	16 Å²	16	44.8 Å²	44.8	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-40.6	176.3	-82	165.2	0	0	0	112.1	V35 C38 L55 F86 Y283 Q284 A290 A291	V35-L287 HydrophobicContact CG1-CD1 3.8Å; C38-L287 HydrophobicContact CB-CB 3.99Å; L55-L287 HydrophobicContact CD1-CD1 4.13Å; L55-L287 HydrophobicContact CD2-CD1 3.89Å; L55-L287 HydrophobicContact CG-CD1 3.98Å; F86-L287 HydrophobicContact CB-CD2 3.83Å; F86-L287 HydrophobicContact CD1-CD1 4.33Å; F86-L287 HydrophobicContact CD1-CD2 4.05Å; F86-L287 HydrophobicContact CD1-CG 4.14Å; F86-L287 HydrophobicContact CD2-CD2 3.75Å; F86-L287 HydrophobicContact CD2-CG 4.25Å; F86-L287 HydrophobicContact CE1-CG 4.23Å; F86-L287 HydrophobicContact CE2-CD2 4.29Å; F86-L287 HydrophobicContact CE2-CG 4.32Å; F86-L287 HydrophobicContact CG-CD2 3.62Å; F86-L287 HydrophobicContact CG-CG 4.16Å; F86-L287 HydrophobicContact CZ-CG 4.31Å; Y283-L287 WeakPolarHBondContact O-CB 3.41Å; Y283-L287 PolarHBondContact O-N 3.5Å; Q284-L287 PolarHBondContact O-N 3.1Å; L287-A290 PolarHBondContact O-N 2.78Å; L287-A291 WeakPolarHBondContact O-CB 3.4Å; L287-A291 PolarHBondContact O-N 2.82Å
288	A	90	Very high	88.3	Confident	35 Å²	35	45.6 Å²	45.6	29%	0.289	25%	0.25	S	C	.	.	H	α-helix	trans	-63.4	-48	177.1	0	0	0	0	0	111.6	Q284 W285 I286 A290 A291 T292	Q284-A288 WeakPolarHBondContact O-CB 3.34Å; Q284-A288 PolarHBondContact O-N 2.97Å; W285-A288 PolarHBondContact O-N 3.32Å; I286-A288 VanDerWaalsContact C-N 3.35Å; I286-A288 PolarHBondContact O-N 2.87Å; A288-A290 VanDerWaalsContact C-N 3.34Å; A288-A290 PolarHBondContact O-N 3.2Å; A288-A291 PolarHBondContact O-N 3.31Å; A288-T292 PolarHBondContact O-N 2.88Å; A288-T292 VanDerWaalsContact O-N 3.08Å; A288-T292 PolarHBondContact O-OG1 2.88Å
289	Q	88.4	Confident	87.6	Confident	52 Å²	52	51.7 Å²	51.7	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-37.1	177	-68	-63	-37.4	0	0	112.3	W285 I286 T292 I293 L309	W285-Q289 WeakPolarHBondContact O-CG 3.19Å; W285-Q289 PolarHBondContact O-N 3.32Å; I286-Q289 PolarHBondContact O-N 2.97Å; Q289-T292 PolarHBondContact O-N 3.12Å; Q289-I293 WeakPolarHBondContact O-CG1 3.34Å; Q289-I293 PolarHBondContact O-N 2.69Å; Q289-L309 HydrophobicContact CB-CB 4.46Å; Q289-L309 HydrophobicContact CB-CD1 4.02Å
290	A	89.1	Confident	86.9	Confident	6 Å²	6	55.2 Å²	55.2	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-62.6	-45	174	0	0	0	0	0	111.7	L88 P89 I286 L287 A288 T292 I293 E294 L309	L88-A290 HydrophobicContact CD2-CB 4.5Å; P89-A290 HydrophobicContact CG-CB 4.27Å; I286-A290 VanDerWaalsContact O-CB 3.31Å; I286-A290 WeakPolarHBondContact O-CB 3.34Å; I286-A290 PolarHBondContact O-N 3.32Å; L287-A290 PolarHBondContact O-N 2.78Å; A288-A290 VanDerWaalsContact C-N 3.34Å; A288-A290 PolarHBondContact O-N 3.2Å; A290-T292 VanDerWaalsContact C-N 3.32Å; A290-T292 PolarHBondContact O-N 2.9Å; A290-I293 PolarHBondContact O-N 3.09Å; A290-E294 PolarHBondContact O-N 2.94Å; A290-L309 HydrophobicContact CB-CD1 4.44Å
291	A	88.2	Confident	86.5	Confident	48 Å²	48	60 Å²	60	40%	0.397	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-40.5	176.9	0	0	0	0	0	112.1	L287 A288 I293 E294 E295	L287-A291 WeakPolarHBondContact O-CB 3.4Å; L287-A291 PolarHBondContact O-N 2.82Å; A288-A291 PolarHBondContact O-N 3.31Å; A291-I293 VanDerWaalsContact C-N 3.29Å; A291-I293 PolarHBondContact O-N 3.19Å; A291-E294 PolarHBondContact O-N 3.06Å; A291-E295 PolarHBondContact O-N 3.3Å
292	T	87.7	Confident	86	Confident	51 Å²	51	60.7 Å²	60.7	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-30.2	177.2	-48.8	0	0	0	0	113.2	A288 Q289 A290 E294 E295	A288-T292 PolarHBondContact O-N 2.88Å; A288-T292 VanDerWaalsContact O-N 3.08Å; A288-T292 PolarHBondContact O-OG1 2.88Å; Q289-T292 PolarHBondContact O-N 3.12Å; A290-T292 VanDerWaalsContact C-N 3.32Å; A290-T292 PolarHBondContact O-N 2.9Å; T292-E294 VanDerWaalsContact C-N 3.34Å; T292-E295 PolarHBondContact O-N 2.97Å
293	I	85.2	Confident	85.5	Confident	8 Å²	8	64 Å²	64	4%	0.041	35%	0.352	C	S	.	.	H	α-helix	trans	-74.3	-26.4	177.4	-68.9	164.7	0	0	0	112	P89 T90 Q289 A290 A291 E295 Q302 C305 L309	P89-I293 HydrophobicContact CB-CG2 4.2Å; P89-I293 HydrophobicContact CG-CB 3.95Å; P89-I293 HydrophobicContact CG-CG2 3.81Å; T90-I293 HydrophobicContact CG2-CG2 4.42Å; Q289-I293 WeakPolarHBondContact O-CG1 3.34Å; Q289-I293 PolarHBondContact O-N 2.69Å; A290-I293 PolarHBondContact O-N 3.09Å; A291-I293 VanDerWaalsContact C-N 3.29Å; A291-I293 PolarHBondContact O-N 3.19Å; I293-E295 VanDerWaalsContact C-N 3.29Å; I293-Q302 HydrophobicContact CG2-CG 4.44Å; I293-C305 HydrophobicContact CD1-CB 4.12Å; I293-C305 HydrophobicContact CG1-CB 3.61Å; I293-L309 HydrophobicContact CD1-CB 4.1Å; I293-L309 HydrophobicContact CD1-CD2 3.79Å; I293-L309 HydrophobicContact CD1-CG 4.47Å
294	E	83.8	Confident	85.1	Confident	145 Å²	145	66.1 Å²	66.1	68%	0.678	37%	0.371	S	S	*	.	H	α-helix	trans	-76.8	-16.9	174.8	-68.7	-174.5	162.7	0	0	112.8	P89 A290 A291 T292	P89-E294 HydrophobicContact CB-CG 3.65Å; P89-E294 HydrophobicContact CG-CG 4.23Å; A290-E294 PolarHBondContact O-N 2.94Å; A291-E294 PolarHBondContact O-N 3.06Å; T292-E294 VanDerWaalsContact C-N 3.34Å
295	E	84.5	Confident	84.8	Confident	122 Å²	122	64.7 Å²	64.7	57%	0.57	37%	0.366	S	S	*	.	S	Bend	trans	-71.8	152.8	170.4	-64.5	178.8	174.3	0	0	110.9	A291 T292 I293 I297	A291-E295 PolarHBondContact O-N 3.3Å; T292-E295 PolarHBondContact O-N 2.97Å; I293-E295 VanDerWaalsContact C-N 3.29Å; E295-I297 VanDerWaalsContact C-N 3.29Å; E295-I297 PolarHBondContact O-N 2.84Å
296	D	74.6	Confident	84.6	Confident	179 Å²	179	63.1 Å²	63.1	96%	0.957	36%	0.361	S	S	*	.			trans	-78.9	75.9	-173.3	-144.5	9.1	0	0	0	110.8
297	I	80.7	Confident	84.3	Confident	45 Å²	45	65.2 Å²	65.2	23%	0.231	37%	0.372	C	S	.	.			trans	-100.6	153.9	-178.4	57.7	174.5	0	0	0	112.4	E295 D301 Q302 C305	E295-I297 VanDerWaalsContact C-N 3.29Å; E295-I297 PolarHBondContact O-N 2.84Å; I297-D301 HydrophobicContact CB-CB 4.49Å; I297-D301 HydrophobicContact CD1-CB 4.49Å; I297-Q302 HydrophobicContact CD1-CB 4.12Å; I297-Q302 HydrophobicContact CD1-CG 4.1Å; I297-Q302 HydrophobicContact CG1-CB 4.16Å; I297-Q302 HydrophobicContact CG1-CG 4.11Å; I297-C305 HydrophobicContact CD1-CB 4.44Å
298	G	81.7	Confident	84.1	Confident	44 Å²	44	67.6 Å²	67.6	45%	0.454	39%	0.385	S	S	.	.			trans	-64.2	152.3	178.2	0	0	0	0	0	113.3	A300 D301 Q302	G298-A300 VanDerWaalsContact C-N 3.28Å; G298-A300 PolarHBondContact O-N 3.22Å; G298-A300 VanDerWaalsContact O-N 3.15Å; G298-D301 PolarHBondContact O-N 3.36Å; G298-Q302 PolarHBondContact O-N 2.96Å
299	E	78.4	Confident	84.1	Confident	164 Å²	164	66 Å²	66	77%	0.766	37%	0.371	S	S	*	.	H	α-helix	trans	-53.5	-40.2	-174.5	-75.5	-170.7	154.8	0	0	113.8	Q302 I303	E299-Q302 WeakPolarHBondContact O-CB 3.36Å; E299-Q302 PolarHBondContact O-N 3.47Å; E299-I303 VanDerWaalsContact O-CG1 3.24Å; E299-I303 WeakPolarHBondContact O-CG1 3.49Å; E299-I303 PolarHBondContact O-N 3.13Å
300	A	79.4	Confident	84.1	Confident	74 Å²	74	63.7 Å²	63.7	61%	0.612	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-43.2	179.6	0	0	0	0	0	112.2	G298 Q302 I303 A304	G298-A300 VanDerWaalsContact C-N 3.28Å; G298-A300 PolarHBondContact O-N 3.22Å; G298-A300 VanDerWaalsContact O-N 3.15Å; A300-Q302 VanDerWaalsContact C-N 3.33Å; A300-I303 PolarHBondContact O-N 3.49Å; A300-A304 PolarHBondContact O-N 3.05Å; A300-A304 VanDerWaalsContact O-N 3.12Å
301	D	82.5	Confident	84.1	Confident	99 Å²	99	63.6 Å²	63.6	53%	0.529	36%	0.36	S	S	.	.	H	α-helix	trans	-69.8	-35.2	177.7	-64.8	-36.7	0	0	0	111	I297 G298 I303 A304 C305	I297-D301 HydrophobicContact CB-CB 4.49Å; I297-D301 HydrophobicContact CD1-CB 4.49Å; G298-D301 PolarHBondContact O-N 3.36Å; D301-I303 VanDerWaalsContact C-N 3.31Å; D301-I303 PolarHBondContact O-N 3.42Å; D301-A304 PolarHBondContact O-N 3.07Å; D301-C305 WeakPolarHBondContact O-CB 3.43Å; D301-C305 PolarHBondContact O-N 2.99Å; D301-C305 PolarHBondContact O-SG 3.17Å
302	Q	80.4	Confident	84.2	Confident	81 Å²	81	62.3 Å²	62.3	38%	0.379	35%	0.346	S	S	.	.	H	α-helix	trans	-62.5	-39	174.8	-146.8	179.2	33.2	0	0	111.6	I293 I297 G298 E299 A300 L306	I293-Q302 HydrophobicContact CG2-CG 4.44Å; I297-Q302 HydrophobicContact CD1-CB 4.12Å; I297-Q302 HydrophobicContact CD1-CG 4.1Å; I297-Q302 HydrophobicContact CG1-CB 4.16Å; I297-Q302 HydrophobicContact CG1-CG 4.11Å; G298-Q302 PolarHBondContact O-N 2.96Å; E299-Q302 WeakPolarHBondContact O-CB 3.36Å; E299-Q302 PolarHBondContact O-N 3.47Å; A300-Q302 VanDerWaalsContact C-N 3.33Å; Q302-L306 WeakPolarHBondContact O-CB 3.1Å; Q302-L306 PolarHBondContact O-N 3.42Å
303	I	82.2	Confident	84.4	Confident	71 Å²	71	60.2 Å²	60.2	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-65.4	-44	173.7	-64.4	168.4	0	0	0	111	R216 E299 A300 D301 L306 D307	R216-I303 VanDerWaalsContact NH2-CG1 3.32Å; E299-I303 VanDerWaalsContact O-CG1 3.24Å; E299-I303 WeakPolarHBondContact O-CG1 3.49Å; E299-I303 PolarHBondContact O-N 3.13Å; A300-I303 PolarHBondContact O-N 3.49Å; D301-I303 VanDerWaalsContact C-N 3.31Å; D301-I303 PolarHBondContact O-N 3.42Å; I303-L306 WeakPolarHBondContact O-CB 3.17Å; I303-L306 PolarHBondContact O-N 3.33Å; I303-D307 PolarHBondContact O-N 3.15Å
304	A	84.4	Confident	84.7	Confident	49 Å²	49	60 Å²	60	41%	0.405	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-43.6	178.4	0	0	0	0	0	111.9	A300 D301 L306 D307 N308	A300-A304 PolarHBondContact O-N 3.05Å; A300-A304 VanDerWaalsContact O-N 3.12Å; D301-A304 PolarHBondContact O-N 3.07Å; A304-L306 VanDerWaalsContact C-N 3.33Å; A304-L306 PolarHBondContact O-N 3.06Å; A304-D307 PolarHBondContact O-N 2.89Å; A304-N308 PolarHBondContact O-N 3.42Å; A304-N308 PolarHBondContact O-ND2 3.32Å
305	C	85.8	Confident	85	Confident	19 Å²	19	54 Å²	54	13%	0.128	30%	0.303	C	S	.	.	H	α-helix	trans	-62.6	-39.1	174.9	-67.6	0	0	0	0	111.6	I293 I297 D301 D307 N308 L309	I293-C305 HydrophobicContact CD1-CB 4.12Å; I293-C305 HydrophobicContact CG1-CB 3.61Å; I297-C305 HydrophobicContact CD1-CB 4.44Å; D301-C305 WeakPolarHBondContact O-CB 3.43Å; D301-C305 PolarHBondContact O-N 2.99Å; D301-C305 PolarHBondContact O-SG 3.17Å; C305-D307 VanDerWaalsContact C-N 3.34Å; C305-D307 PolarHBondContact O-N 3.41Å; C305-N308 PolarHBondContact O-N 2.69Å; C305-L309 WeakPolarHBondContact O-CB 3.3Å; C305-L309 PolarHBondContact O-N 3.06Å
306	L	85.2	Confident	85.4	Confident	17 Å²	17	48.4 Å²	48.4	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-38.5	174.8	-177.9	65.6	0	0	0	112.7	T90 I92 Q302 I303 A304 L309 H310	T90-L306 VanDerWaalsContact OG1-CD1 3.26Å; T90-L306 WeakPolarHBondContact OG1-CD1 3.34Å; I92-L306 HydrophobicContact CG2-CD1 4.2Å; Q302-L306 WeakPolarHBondContact O-CB 3.1Å; Q302-L306 PolarHBondContact O-N 3.42Å; I303-L306 WeakPolarHBondContact O-CB 3.17Å; I303-L306 PolarHBondContact O-N 3.33Å; A304-L306 VanDerWaalsContact C-N 3.33Å; A304-L306 PolarHBondContact O-N 3.06Å; L306-L309 HydrophobicContact CD1-CD2 4.47Å; L306-H310 PolarHBondContact O-N 3.12Å; L306-H310 PolarHBondContact O-ND1 2.98Å
307	D	86.4	Confident	86.3	Confident	44 Å²	44	40.6 Å²	40.6	24%	0.235	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-40.1	176	-86.5	25.8	0	0	0	111.2	S171 S173 I303 A304 C305 H310 A311	S171-D307 WeakPolarHBondContact CB-OD2 3.15Å; S171-D307 PolarHBondContact OG-OD2 3.43Å; S173-D307 WeakPolarHBondContact CB-OD1 3.44Å; S173-D307 PolarHBondContact OG-OD1 3.03Å; I303-D307 PolarHBondContact O-N 3.15Å; A304-D307 PolarHBondContact O-N 2.89Å; C305-D307 VanDerWaalsContact C-N 3.34Å; C305-D307 PolarHBondContact O-N 3.41Å; D307-H310 PolarHBondContact O-N 3.1Å; D307-A311 WeakPolarHBondContact O-CB 3.5Å; D307-A311 PolarHBondContact O-N 3.14Å
308	N	87.3	Confident	86.8	Confident	67 Å²	67	39.7 Å²	39.7	36%	0.358	23%	0.23	S	C	.	.	H	α-helix	trans	-65.2	-44.9	173.3	-70.2	-24.7	0	0	0	111.9	A304 C305 H310 A311 E312	A304-N308 PolarHBondContact O-N 3.42Å; A304-N308 PolarHBondContact O-ND2 3.32Å; C305-N308 PolarHBondContact O-N 2.69Å; N308-H310 VanDerWaalsContact C-N 3.32Å; N308-H310 PolarHBondContact O-N 3.48Å; N308-A311 WeakPolarHBondContact O-CA 3.22Å; N308-A311 WeakPolarHBondContact O-CB 3.38Å; N308-A311 PolarHBondContact O-N 2.86Å; N308-E312 WeakPolarHBondContact O-CG 3.24Å; N308-E312 PolarHBondContact O-N 3.09Å
309	L	89.7	Confident	87.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-45.7	175.5	-178.8	70	0	0	0	111.2	L88 I92 I286 Q289 A290 I293 C305 L306 A311 E312 F313	L88-L309 HydrophobicContact CD2-CD1 4.23Å; L88-L309 HydrophobicContact CD2-CD2 4.36Å; I92-L309 HydrophobicContact CG2-CD2 3.9Å; I92-L309 HydrophobicContact CG2-CG 4.37Å; I286-L309 HydrophobicContact CG2-CD1 3.87Å; Q289-L309 HydrophobicContact CB-CB 4.46Å; Q289-L309 HydrophobicContact CB-CD1 4.02Å; A290-L309 HydrophobicContact CB-CD1 4.44Å; I293-L309 HydrophobicContact CD1-CB 4.1Å; I293-L309 HydrophobicContact CD1-CD2 3.79Å; I293-L309 HydrophobicContact CD1-CG 4.47Å; C305-L309 WeakPolarHBondContact O-CB 3.3Å; C305-L309 PolarHBondContact O-N 3.06Å; L306-L309 HydrophobicContact CD1-CD2 4.47Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A311 PolarHBondContact O-N 3.21Å; L309-E312 PolarHBondContact O-N 3.25Å; L309-F313 WeakPolarHBondContact O-CB 3.25Å; L309-F313 PolarHBondContact O-N 3.08Å
310	H	89	Confident	87.4	Confident	4 Å²	4	37 Å²	37	2%	0.019	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-41.9	173.3	-86.2	106.8	0	0	0	112.3	I92 Y93 S173 L306 D307 N308 A314	I92-H310 VanDerWaalsContact CA-NE2 3.26Å; I92-H310 WeakPolarHBondContact CA-NE2 3.49Å; I92-H310 VanDerWaalsContact CB-NE2 3.28Å; I92-H310 WeakPolarHBondContact CB-NE2 3.31Å; Y93-H310 PolarHBondContact N-NE2 2.82Å; S173-H310 VanDerWaalsContact CB-ND1 3.3Å; S173-H310 WeakPolarHBondContact CB-ND1 3.47Å; L306-H310 PolarHBondContact O-N 3.12Å; L306-H310 PolarHBondContact O-ND1 2.98Å; D307-H310 PolarHBondContact O-N 3.1Å; N308-H310 VanDerWaalsContact C-N 3.32Å; N308-H310 PolarHBondContact O-N 3.48Å; H310-A314 WeakPolarHBondContact O-CB 3.44Å; H310-A314 PolarHBondContact O-N 3.47Å
311	A	88.6	Confident	87.6	Confident	4 Å²	4	36 Å²	36	3%	0.033	19%	0.191	C	C	.	.	H	α-helix	trans	-64.9	-44.2	179.2	0	0	0	0	0	111.7	D307 N308 L309 A314 R315 L324 P325	D307-A311 WeakPolarHBondContact O-CB 3.5Å; D307-A311 PolarHBondContact O-N 3.14Å; N308-A311 WeakPolarHBondContact O-CA 3.22Å; N308-A311 WeakPolarHBondContact O-CB 3.38Å; N308-A311 PolarHBondContact O-N 2.86Å; L309-A311 VanDerWaalsContact C-N 3.33Å; L309-A311 PolarHBondContact O-N 3.21Å; A311-A314 PolarHBondContact O-N 2.85Å; A311-R315 WeakPolarHBondContact O-CG 3.44Å; A311-R315 PolarHBondContact O-N 3.05Å; A311-L324 HydrophobicContact CB-CD2 4.04Å; A311-P325 HydrophobicContact CB-CG 3.84Å
312	E	89.8	Confident	87.4	Confident	21 Å²	21	36.1 Å²	36.1	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-66.8	-43.2	177.9	-62.4	-49.4	154.4	0	0	112.1	W285 I286 N308 L309 A314 R315 L316	W285-E312 HydrophobicContact CB-CG 4.43Å; I286-E312 HydrophobicContact CG1-CB 3.84Å; N308-E312 WeakPolarHBondContact O-CG 3.24Å; N308-E312 PolarHBondContact O-N 3.09Å; L309-E312 PolarHBondContact O-N 3.25Å; E312-A314 VanDerWaalsContact C-N 3.3Å; E312-A314 PolarHBondContact O-N 3.49Å; E312-R315 WeakPolarHBondContact O-CB 3.41Å; E312-R315 PolarHBondContact O-N 3.23Å; E312-R315 VanDerWaalsContact O-N 3.15Å; E312-R315 IonicContact OE1-CZ 3.63Å; E312-R315 IonicContact OE1-NH1 3.88Å; E312-R315 PolarHBondContact OE1-NH1 2.98Å; E312-R315 IonicContact OE1-NH2 3.49Å; E312-R315 IonicContact OE2-CZ 2.76Å; E312-R315 IonicContact OE2-NH1 2.9Å; E312-R315 PolarHBondContact OE2-NH1 3.41Å; E312-L316 PolarHBondContact O-N 2.93Å
313	F	92.2	Very high	87.1	Confident	8 Å²	8	35.4 Å²	35.4	4%	0.035	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-39.6	173.1	-176.4	-99.8	0	0	0	111.9	I92 H94 V252 V255 I286 L309 R315 L316 I317	I92-F313 HydrophobicContact CD1-CB 3.56Å; I92-F313 HydrophobicContact CD1-CD1 3.61Å; I92-F313 HydrophobicContact CD1-CD2 3.91Å; I92-F313 HydrophobicContact CD1-CE1 4.3Å; I92-F313 HydrophobicContact CD1-CG 3.39Å; I92-F313 HydrophobicContact CG1-CD1 4.47Å; H94-F313 AromaticContact CD2-CE1 3.83Å; H94-F313 AromaticContact CD2-CZ 3.9Å; V252-F313 HydrophobicContact CG1-CE2 4.34Å; V252-F313 HydrophobicContact CG1-CZ 4.15Å; V252-F313 HydrophobicContact CG2-CE1 4.06Å; V252-F313 HydrophobicContact CG2-CZ 3.97Å; V255-F313 HydrophobicContact CG1-CE2 4.11Å; V255-F313 HydrophobicContact CG2-CD2 4.03Å; V255-F313 HydrophobicContact CG2-CE2 3.85Å; I286-F313 HydrophobicContact CD1-CB 4.45Å; I286-F313 HydrophobicContact CD1-CD2 4.32Å; L309-F313 WeakPolarHBondContact O-CB 3.25Å; L309-F313 PolarHBondContact O-N 3.08Å; F313-R315 VanDerWaalsContact C-N 3.31Å; F313-R315 PolarHBondContact O-N 2.87Å; F313-L316 HydrophobicContact CD2-CD2 4.33Å; F313-L316 HydrophobicContact CE2-CD2 4.34Å; F313-L316 WeakPolarHBondContact O-CB 3.38Å; F313-L316 PolarHBondContact O-N 3.38Å; F313-I317 HydrophobicContact CE1-CG1 4.01Å; F313-I317 HydrophobicContact CZ-CD1 4.21Å; F313-I317 HydrophobicContact CZ-CG1 4.09Å; F313-I317 PolarHBondContact O-N 3.29Å
314	A	91.5	Very high	86.9	Confident	3 Å²	3	33.5 Å²	33.5	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-36.4	175	0	0	0	0	0	111.9	V95 L172 H310 A311 E312 I317 N318 L324	V95-A314 HydrophobicContact CB-CB 4.04Å; V95-A314 HydrophobicContact CG1-CB 4.38Å; V95-A314 HydrophobicContact CG2-CB 4.07Å; L172-A314 HydrophobicContact CD1-CB 3.96Å; H310-A314 WeakPolarHBondContact O-CB 3.44Å; H310-A314 PolarHBondContact O-N 3.47Å; A311-A314 PolarHBondContact O-N 2.85Å; E312-A314 VanDerWaalsContact C-N 3.3Å; E312-A314 PolarHBondContact O-N 3.49Å; A314-I317 PolarHBondContact O-N 3.01Å; A314-N318 CarbonylContact O-C 3.6Å; A314-N318 VanDerWaalsContact O-C 3.27Å; A314-N318 WeakPolarHBondContact O-CA 3.44Å; A314-N318 PolarHBondContact O-N 3.2Å; A314-N318 VanDerWaalsContact O-O 3.09Å; A314-L324 HydrophobicContact CB-CD2 3.77Å
315	R	90.6	Very high	86.4	Confident	20 Å²	20	34 Å²	34	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-66.5	-36.7	174.5	-72.8	175.4	-165.1	155	9	112.8	A311 E312 F313 I317 S319 L324 P325	A311-R315 WeakPolarHBondContact O-CG 3.44Å; A311-R315 PolarHBondContact O-N 3.05Å; E312-R315 WeakPolarHBondContact O-CB 3.41Å; E312-R315 PolarHBondContact O-N 3.23Å; E312-R315 VanDerWaalsContact O-N 3.15Å; E312-R315 IonicContact OE1-CZ 3.63Å; E312-R315 IonicContact OE1-NH1 3.88Å; E312-R315 PolarHBondContact OE1-NH1 2.98Å; E312-R315 IonicContact OE1-NH2 3.49Å; E312-R315 IonicContact OE2-CZ 2.76Å; E312-R315 IonicContact OE2-NH1 2.9Å; E312-R315 PolarHBondContact OE2-NH1 3.41Å; F313-R315 VanDerWaalsContact C-N 3.31Å; F313-R315 PolarHBondContact O-N 2.87Å; R315-I317 VanDerWaalsContact C-N 3.33Å; R315-I317 PolarHBondContact O-N 2.85Å; R315-S319 PolarHBondContact O-N 3.46Å; R315-S319 PolarHBondContact O-OG 3.3Å; R315-L324 HydrophobicContact CG-CD1 3.81Å; R315-P325 PolarHBondContact NH2-O 3.47Å
316	L	93.7	Very high	85.6	Confident	3 Å²	3	39 Å²	39	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-56.9	-46.2	173.6	179.4	71.8	0	0	0	111.7	V255 L279 M282 Y283 I286 E312 F313 G335 L336	V255-L316 HydrophobicContact CG1-CD2 4.39Å; L279-L316 HydrophobicContact CD2-CD1 3.74Å; M282-L316 HydrophobicContact CB-CD1 3.92Å; M282-L316 VanDerWaalsContact SD-CA 3.52Å; M282-L316 HydrophobicContact SD-CB 4.27Å; M282-L316 HydrophobicContact SD-CD1 4.04Å; Y283-L316 HydrophobicContact CD1-CD1 4.41Å; Y283-L316 HydrophobicContact CD1-CD2 4.13Å; Y283-L316 HydrophobicContact CE1-CD1 4.14Å; Y283-L316 HydrophobicContact CE1-CD2 3.66Å; I286-L316 HydrophobicContact CD1-CB 4.1Å; I286-L316 HydrophobicContact CD1-CD2 3.86Å; E312-L316 PolarHBondContact O-N 2.93Å; F313-L316 HydrophobicContact CD2-CD2 4.33Å; F313-L316 HydrophobicContact CE2-CD2 4.34Å; F313-L316 WeakPolarHBondContact O-CB 3.38Å; F313-L316 PolarHBondContact O-N 3.38Å; L316-G335 CarbonylContact O-C 3.32Å; L316-G335 VanDerWaalsContact O-CA 3.27Å; L316-G335 WeakPolarHBondContact O-CA 3.49Å; L316-L336 PolarHBondContact O-N 3.14Å
317	I	93.8	Very high	84.6	Confident	15 Å²	15	41 Å²	41	8%	0.077	25%	0.249	C	C	.	.	H	α-helix	trans	-78	-56.2	179.7	-56.3	-56.4	0	0	0	111.3	V95 F313 A314 R315 L336 L337 F1326	V95-I317 HydrophobicContact CG1-CB 3.55Å; V95-I317 HydrophobicContact CG1-CG1 4.12Å; V95-I317 HydrophobicContact CG1-CG2 3.61Å; F313-I317 HydrophobicContact CE1-CG1 4.01Å; F313-I317 HydrophobicContact CZ-CD1 4.21Å; F313-I317 HydrophobicContact CZ-CG1 4.09Å; F313-I317 PolarHBondContact O-N 3.29Å; A314-I317 PolarHBondContact O-N 3.01Å; R315-I317 VanDerWaalsContact C-N 3.33Å; R315-I317 PolarHBondContact O-N 2.85Å; I317-L336 HydrophobicContact CD1-CD1 4.02Å; I317-L337 WeakPolarHBondContact O-CB 3.28Å; I317-L337 PolarHBondContact O-N 2.87Å; I317-F1326 HydrophobicContact CG2-CE2 4.48Å; I317-F1326 HydrophobicContact CG2-CZ 3.73Å
318	N	90.9	Very high	83.1	Confident	26 Å²	26	47.2 Å²	47.2	14%	0.139	28%	0.276	C	S	.	.			trans	-139.4	95.9	-177	-178.3	17.4	0	0	0	111.8	A314 Q320 Q321 L337 Q338	A314-N318 CarbonylContact O-C 3.6Å; A314-N318 VanDerWaalsContact O-C 3.27Å; A314-N318 WeakPolarHBondContact O-CA 3.44Å; A314-N318 PolarHBondContact O-N 3.2Å; A314-N318 VanDerWaalsContact O-O 3.09Å; N318-Q320 PolarHBondContact O-N 3.41Å; N318-Q320 VanDerWaalsContact O-N 3.11Å; N318-Q320 PolarHBondContact OD1-N 3.48Å; N318-Q321 PolarHBondContact ND2-OE1 2.87Å; N318-Q321 WeakPolarHBondContact O-CB 3.27Å; N318-Q321 PolarHBondContact O-N 2.9Å; N318-Q321 VanDerWaalsContact O-N 3.16Å; N318-L337 HydrophobicContact CB-CD1 4.36Å; N318-Q338 PolarHBondContact OD1-NE2 3.43Å
319	S	87.9	Confident	81.5	Confident	20 Å²	20	51.7 Å²	51.7	14%	0.14	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-10.9	-178.7	-35.2	0	0	0	0	114.4	R315 M333 G335	R315-S319 PolarHBondContact O-N 3.46Å; R315-S319 PolarHBondContact O-OG 3.3Å; S319-M333 VanDerWaalsContact CB-O 3.27Å; S319-M333 WeakPolarHBondContact CB-O 3.39Å; S319-M333 PolarHBondContact OG-O 2.98Å; S319-M333 VanDerWaalsContact OG-O 3.1Å; S319-G335 WeakPolarHBondContact OG-CA 3.05Å; S319-G335 PolarHBondContact OG-N 3.18Å
320	Q	84.9	Confident	80.2	Confident	133 Å²	133	56.7 Å²	56.7	62%	0.621	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	16	177.2	-67.8	-178.7	-24	0	0	112.9	N318 S322 F332	N318-Q320 PolarHBondContact O-N 3.41Å; N318-Q320 VanDerWaalsContact O-N 3.11Å; N318-Q320 PolarHBondContact OD1-N 3.48Å; Q320-S322 PolarHBondContact O-N 2.8Å; Q320-F332 HydrophobicContact CG-CE2 3.73Å; Q320-F332 HydrophobicContact CG-CZ 3.89Å
321	Q	82.2	Confident	79.4	Confident	51 Å²	51	65.9 Å²	65.9	24%	0.238	36%	0.363	C	S	.	.			trans	-62.5	129.3	178.5	-173.3	72.7	-2.9	0	0	110.9	V95 L172 N318 L324	V95-Q321 HydrophobicContact CG2-CB 4.49Å; V95-Q321 HydrophobicContact CG2-CG 3.76Å; L172-Q321 HydrophobicContact CD1-CG 4.34Å; N318-Q321 PolarHBondContact ND2-OE1 2.87Å; N318-Q321 WeakPolarHBondContact O-CB 3.27Å; N318-Q321 PolarHBondContact O-N 2.9Å; N318-Q321 VanDerWaalsContact O-N 3.16Å; Q321-L324 HydrophobicContact CB-CD1 3.8Å; Q321-L324 HydrophobicContact CB-CG 4.07Å; Q321-L324 WeakPolarHBondContact O-CG 3.38Å
322	S	79.2	Confident	79	Confident	103 Å²	103	71.3 Å²	71.3	72%	0.72	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	135.8	175.9	-46.2	0	0	0	0	111.2	Q320	Q320-S322 PolarHBondContact O-N 2.8Å
323	G	74.8	Confident	78.8	Confident	66 Å²	66	71.3 Å²	71.3	68%	0.68	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	13.5	179.3	0	0	0	0	0	114.9
324	L	77.1	Confident	78.7	Confident	31 Å²	31	78.1 Å²	78.1	16%	0.162	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-75.9	140.3	167.8	-69.2	171.1	0	0	0	110.3	L172 A311 A314 R315 Q321	L172-L324 HydrophobicContact CD1-CD2 3.73Å; A311-L324 HydrophobicContact CB-CD2 4.04Å; A314-L324 HydrophobicContact CB-CD2 3.77Å; R315-L324 HydrophobicContact CG-CD1 3.81Å; Q321-L324 HydrophobicContact CB-CD1 3.8Å; Q321-L324 HydrophobicContact CB-CG 4.07Å; Q321-L324 WeakPolarHBondContact O-CG 3.38Å
325	P	74.4	Confident	78.7	Confident	59 Å²	59	78 Å²	78	38%	0.383	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-60.3	138	171.5	22.4	-29.7	0	0	0	110.2	A311 R315 V327	A311-P325 HydrophobicContact CB-CG 3.84Å; R315-P325 PolarHBondContact NH2-O 3.47Å; P325-V327 PolarHBondContact O-N 3.27Å
326	P	67.5	Low	78.9	Confident	125 Å²	125	79.6 Å²	79.6	81%	0.812	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-62.4	133	177.9	25.8	-32.1	0	0	0	109.7	Q328	P326-Q328 PolarHBondContact O-N 3.3Å
327	V	64.6	Low	78.8	Confident	59 Å²	59	81.3 Å²	81.3	36%	0.358	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-80.2	118.7	175.7	-148.8	0	0	0	0	107.3	P325 D329 H330	P325-V327 PolarHBondContact O-N 3.27Å; V327-D329 PolarHBondContact O-N 3.23Å; V327-H330 HydrophobicContact CB-CB 4.27Å; V327-H330 HydrophobicContact CG1-CB 3.94Å
328	Q	54.6	Low	78.7	Confident	174 Å²	174	82 Å²	82	81%	0.813	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	128	168.1	-73.1	179.5	-19.5	0	0	107.8	P326 H330	P326-Q328 PolarHBondContact O-N 3.3Å; Q328-H330 PolarHBondContact O-N 2.87Å
329	D	55.3	Low	78.9	Confident	160 Å²	160	82.8 Å²	82.8	86%	0.856	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	17.9	171.8	-62.8	-27	0	0	0	120.8	V327	V327-D329 PolarHBondContact O-N 3.23Å
330	H	61.5	Low	79.1	Confident	105 Å²	105	84.7 Å²	84.7	49%	0.486	44%	0.442	S	S	.	.			trans	-118.6	133.6	179.2	-65.4	-35.3	0	0	0	116	W285 V327 Q328	W285-H330 HydrophobicContact CH2-CB 4.14Å; W285-H330 AromaticContact CH2-CD2 3.18Å; W285-H330 WeakPolarHBondContact CH2-CD2 3.37Å; W285-H330 AromaticContact CH2-CG 3.64Å; W285-H330 AromaticContact CH2-NE2 3.69Å; W285-H330 AromaticContact CZ2-CD2 3.57Å; W285-H330 AromaticContact CZ2-NE2 3.54Å; V327-H330 HydrophobicContact CB-CB 4.27Å; V327-H330 HydrophobicContact CG1-CB 3.94Å; Q328-H330 PolarHBondContact O-N 2.87Å
331	K	72	Confident	79.4	Confident	197 Å²	197	79.7 Å²	79.7	86%	0.857	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-62.7	143.4	173.3	-147.9	175.5	-171.9	177.1	0	109	M333	K331-M333 WeakPolarHBondContact O-CG 3.38Å; K331-M333 PolarHBondContact O-N 3.03Å; K331-M333 VanDerWaalsContact O-N 3.11Å
332	F	81.1	Confident	79.6	Confident	118 Å²	118	79.4 Å²	79.4	52%	0.518	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-53.8	120.4	176.8	174.5	-97.2	0	0	0	111	Q320 R334 Q338	Q320-F332 HydrophobicContact CG-CE2 3.73Å; Q320-F332 HydrophobicContact CG-CZ 3.89Å; F332-R334 HydrophobicContact CE1-CG 4.09Å; F332-Q338 HydrophobicContact CZ-CG 4Å
333	M	85.6	Confident	79.9	Confident	21 Å²	21	81.5 Å²	81.5	10%	0.103	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-102.3	146.8	179.3	-68.3	-164.3	-71.8	0	0	111.5	D278 Q281 M282 W285 S319 K331	D278-M333 HydrophobicContact CB-CB 4.09Å; D278-M333 HydrophobicContact CB-CG 4.39Å; D278-M333 HydrophobicContact CB-SD 4.38Å; Q281-M333 HydrophobicContact CB-SD 4.3Å; M282-M333 HydrophobicContact CE-CB 3.28Å; M282-M333 HydrophobicContact CE-CE 4.28Å; M282-M333 HydrophobicContact CE-CG 4.41Å; M282-M333 HydrophobicContact CE-SD 4.38Å; M282-M333 HydrophobicContact CG-CE 3.98Å; M282-M333 HydrophobicContact CG-SD 4.44Å; W285-M333 HydrophobicContact CE3-CE 3.81Å; W285-M333 HydrophobicContact CH2-CE 3.17Å; W285-M333 HydrophobicContact CH2-SD 4.2Å; W285-M333 HydrophobicContact CZ2-CE 4.12Å; W285-M333 HydrophobicContact CZ3-CE 3.02Å; W285-M333 HydrophobicContact CZ3-SD 4.49Å; S319-M333 VanDerWaalsContact CB-O 3.27Å; S319-M333 WeakPolarHBondContact CB-O 3.39Å; S319-M333 PolarHBondContact OG-O 2.98Å; S319-M333 VanDerWaalsContact OG-O 3.1Å; K331-M333 WeakPolarHBondContact O-CG 3.38Å; K331-M333 PolarHBondContact O-N 3.03Å; K331-M333 VanDerWaalsContact O-N 3.11Å
334	R	89.6	Confident	80.6	Confident	151 Å²	151	86.1 Å²	86.1	57%	0.57	43%	0.434	S	S	*	.			trans	-94.9	100.5	-176.1	-70.7	-179.3	-76.7	178.6	-6	112.2	D278 F332 Q338 R339	D278-R334 PolarHBondContact OD2-N 2.95Å; F332-R334 HydrophobicContact CE1-CG 4.09Å; R334-Q338 HydrophobicContact CB-CB 4.36Å; R334-R339 PolarHBondContact O-NE 3.19Å; R334-R339 VanDerWaalsContact O-NE 3.13Å
335	G	92	Very high	81.2	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	43%	0.428	C	S	.	.			trans	-66.7	179.9	168.8	0	0	0	0	0	113.7	L316 S319 L337 Q338 R339	L316-G335 CarbonylContact O-C 3.32Å; L316-G335 VanDerWaalsContact O-CA 3.27Å; L316-G335 WeakPolarHBondContact O-CA 3.49Å; S319-G335 WeakPolarHBondContact OG-CA 3.05Å; S319-G335 PolarHBondContact OG-N 3.18Å; G335-L337 PolarHBondContact O-N 3.25Å; G335-Q338 PolarHBondContact O-N 3.04Å; G335-R339 WeakPolarHBondContact O-CG 3.39Å; G335-R339 PolarHBondContact O-N 3.35Å
336	L	93.8	Very high	82.1	Confident	55 Å²	55	87.9 Å²	87.9	29%	0.288	43%	0.432	S	S	.	.	H	α-helix	trans	-60.8	-44.2	-174.3	-66.9	175.1	0	0	0	112.6	L279 L316 I317 Q338 R339 L340	L279-L336 HydrophobicContact CD1-CD2 4.02Å; L279-L336 HydrophobicContact CD2-CD2 4.05Å; L279-L336 HydrophobicContact CD2-CG 4.31Å; L316-L336 PolarHBondContact O-N 3.14Å; I317-L336 HydrophobicContact CD1-CD1 4.02Å; L336-Q338 PolarHBondContact O-N 3.27Å; L336-R339 WeakPolarHBondContact O-CB 3.47Å; L336-R339 PolarHBondContact O-N 3.4Å; L336-R339 VanDerWaalsContact O-N 3.13Å; L336-L340 WeakPolarHBondContact O-CG 3.46Å; L336-L340 PolarHBondContact O-N 3.45Å; L336-L340 VanDerWaalsContact O-N 3.12Å
337	L	92.8	Very high	83.3	Confident	38 Å²	38	82.6 Å²	82.6	20%	0.199	40%	0.396	C	S	.	.	H	α-helix	trans	-69	-35.2	-176.1	-151.3	149.4	0	0	0	111.8	I317 N318 G335 R339 L340 A341 F1326	I317-L337 WeakPolarHBondContact O-CB 3.28Å; I317-L337 PolarHBondContact O-N 2.87Å; N318-L337 HydrophobicContact CB-CD1 4.36Å; G335-L337 PolarHBondContact O-N 3.25Å; L337-R339 VanDerWaalsContact C-N 3.28Å; L337-R339 PolarHBondContact O-N 3.03Å; L337-L340 PolarHBondContact O-N 3.44Å; L337-A341 HydrophobicContact CD2-CB 4.27Å; L337-A341 VanDerWaalsContact O-CB 3.27Å; L337-A341 WeakPolarHBondContact O-CB 3.35Å; L337-A341 PolarHBondContact O-N 2.89Å; L337-F1326 HydrophobicContact CD1-CE2 3.85Å; L337-F1326 HydrophobicContact CD1-CZ 4.39Å
338	Q	92	Very high	84.4	Confident	30 Å²	30	84.4 Å²	84.4	14%	0.14	40%	0.396	C	S	.	.	H	α-helix	trans	-65.3	-29.9	173	-73.5	67.3	32.3	0	0	112.5	N318 F332 R334 G335 L336	N318-Q338 PolarHBondContact OD1-NE2 3.43Å; F332-Q338 HydrophobicContact CZ-CG 4Å; R334-Q338 HydrophobicContact CB-CB 4.36Å; G335-Q338 PolarHBondContact O-N 3.04Å; L336-Q338 PolarHBondContact O-N 3.27Å
339	R	93.4	Very high	86.1	Confident	42 Å²	42	78 Å²	78	16%	0.158	38%	0.377	C	S	.	.	H	α-helix	trans	-76.3	-30.4	175.1	-66.7	175	-174.9	-131.4	-11.2	112.2	D277 R334 G335 L336 L337 G345 R346	D277-R339 IonicContact OD1-CZ 3.71Å; D277-R339 VanDerWaalsContact OD1-CZ 3.31Å; D277-R339 IonicContact OD1-NH1 3.16Å; D277-R339 PolarHBondContact OD1-NH1 3.09Å; D277-R339 IonicContact OD1-NH2 2.72Å; D277-R339 PolarHBondContact OD1-NH2 2.85Å; D277-R339 IonicContact OD2-CZ 3.7Å; D277-R339 IonicContact OD2-NH1 3.55Å; D277-R339 PolarHBondContact OD2-NH1 3.44Å; D277-R339 IonicContact OD2-NH2 3.7Å; D277-R339 PolarHBondContact OD2-NH2 2.63Å; D277-R339 VanDerWaalsContact OD2-NH2 3.1Å; R334-R339 PolarHBondContact O-NE 3.19Å; R334-R339 VanDerWaalsContact O-NE 3.13Å; G335-R339 WeakPolarHBondContact O-CG 3.39Å; G335-R339 PolarHBondContact O-N 3.35Å; L336-R339 WeakPolarHBondContact O-CB 3.47Å; L336-R339 PolarHBondContact O-N 3.4Å; L336-R339 VanDerWaalsContact O-N 3.13Å; L337-R339 VanDerWaalsContact C-N 3.28Å; L337-R339 PolarHBondContact O-N 3.03Å; R339-G345 CarbonylContact O-C 3.54Å; R339-G345 WeakPolarHBondContact O-CA 3.28Å; R339-R346 WeakPolarHBondContact O-CG 3.42Å; R339-R346 PolarHBondContact O-N 3.35Å
340	L	93.4	Very high	87.8	Confident	60 Å²	60	72.8 Å²	72.8	31%	0.314	35%	0.353	S	S	.	.	H	α-helix	trans	-82.8	-44.2	178.8	-65.6	175.1	0	0	0	112.2	L336 L337 G345 R346 F347 T1321 L1325	L336-L340 WeakPolarHBondContact O-CG 3.46Å; L336-L340 PolarHBondContact O-N 3.45Å; L336-L340 VanDerWaalsContact O-N 3.12Å; L337-L340 PolarHBondContact O-N 3.44Å; L340-G345 CarbonylContact O-C 3.58Å; L340-R346 HydrophobicContact CD2-CB 4.28Å; L340-R346 HydrophobicContact CD2-CG 4.45Å; L340-R346 PolarHBondContact O-N 2.92Å; L340-F347 HydrophobicContact CB-CD2 4.3Å; L340-F347 HydrophobicContact CB-CE2 4.3Å; L340-F347 HydrophobicContact CD2-CE2 4.3Å; L340-T1321 HydrophobicContact CB-CG2 4.22Å; L340-L1325 HydrophobicContact CD1-CD1 4.16Å
341	A	89.9	Confident	89.2	Confident	29 Å²	29	70.9 Å²	70.9	24%	0.24	35%	0.346	C	S	.	.	S	Bend	trans	-89.8	164.6	-172.5	0	0	0	0	0	113.7	L337 G345	L337-A341 HydrophobicContact CD2-CB 4.27Å; L337-A341 VanDerWaalsContact O-CB 3.27Å; L337-A341 WeakPolarHBondContact O-CB 3.35Å; L337-A341 PolarHBondContact O-N 2.89Å; A341-G345 VanDerWaalsContact O-CA 3.27Å; A341-G345 WeakPolarHBondContact O-CA 3.38Å
342	G	87.2	Confident	90.1	Very high	45 Å²	45	64 Å²	64	46%	0.464	32%	0.318	S	S	.	.	S	Bend	trans	87.4	178.5	176.5	0	0	0	0	0	114.3	G345	G342-G345 PolarHBondContact O-N 3.42Å
343	K	86	Confident	90.5	Very high	147 Å²	147	60 Å²	60	64%	0.639	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-39.2	-176.3	-173.9	-179.7	179	-178.3	0	112.5	G349	K343-G349 PolarHBondContact O-N 3.03Å
344	H	88.9	Confident	90.7	Very high	162 Å²	162	66.3 Å²	66.3	75%	0.75	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	1.1	177.2	-57.8	-66.8	0	0	0	113.1
345	G	90.7	Very high	90.7	Very high	3 Å²	3	71.1 Å²	71.1	3%	0.031	36%	0.355	C	S	.	.	S	Bend	trans	-69.5	161.4	174.1	0	0	0	0	0	111.6	R339 L340 A341 G342 F347 R348 G349	R339-G345 CarbonylContact O-C 3.54Å; R339-G345 WeakPolarHBondContact O-CA 3.28Å; L340-G345 CarbonylContact O-C 3.58Å; A341-G345 VanDerWaalsContact O-CA 3.27Å; A341-G345 WeakPolarHBondContact O-CA 3.38Å; G342-G345 PolarHBondContact O-N 3.42Å; G345-F347 PolarHBondContact O-N 3.35Å; G345-R348 PolarHBondContact O-N 3.47Å; G345-G349 PolarHBondContact O-N 3.31Å
346	R	92.7	Very high	90.6	Very high	125 Å²	125	74.4 Å²	74.4	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-55.7	-45.3	-174.1	-67.5	-69.5	175.6	-97.3	-0.3	113.2	R339 L340 R348 S350 L351	R339-R346 WeakPolarHBondContact O-CG 3.42Å; R339-R346 PolarHBondContact O-N 3.35Å; L340-R346 HydrophobicContact CD2-CB 4.28Å; L340-R346 HydrophobicContact CD2-CG 4.45Å; L340-R346 PolarHBondContact O-N 2.92Å; R346-R348 VanDerWaalsContact C-N 3.34Å; R346-R348 PolarHBondContact O-N 2.93Å; R346-S350 PolarHBondContact O-N 3.5Å; R346-S350 VanDerWaalsContact O-N 3.11Å; R346-L351 WeakPolarHBondContact O-CB 3.49Å; R346-L351 WeakPolarHBondContact O-CG 3.28Å; R346-L351 PolarHBondContact O-N 3.32Å
347	F	91.7	Very high	90.6	Very high	14 Å²	14	78.3 Å²	78.3	6%	0.061	40%	0.397	C	S	.	.	I	π-helix	trans	-57.4	-43.9	-178.5	-79.7	-79.3	0	0	0	113.1	L340 G345 L351 L352 L1313 A1316 T1321 L1325 I1345	L340-F347 HydrophobicContact CB-CD2 4.3Å; L340-F347 HydrophobicContact CB-CE2 4.3Å; L340-F347 HydrophobicContact CD2-CE2 4.3Å; G345-F347 PolarHBondContact O-N 3.35Å; F347-L351 HydrophobicContact CD1-CD1 4.3Å; F347-L352 WeakPolarHBondContact O-CB 3.49Å; F347-L352 WeakPolarHBondContact O-CG 3.31Å; F347-L352 PolarHBondContact O-N 3.43Å; F347-L1313 HydrophobicContact CE1-CD2 4.08Å; F347-L1313 HydrophobicContact CZ-CD2 4.42Å; F347-A1316 HydrophobicContact CE1-CB 4.37Å; F347-A1316 HydrophobicContact CZ-CB 4.15Å; F347-T1321 HydrophobicContact CD2-CG2 3.42Å; F347-T1321 VanDerWaalsContact CD2-CG2 3.42Å; F347-T1321 HydrophobicContact CE2-CG2 3.29Å; F347-T1321 HydrophobicContact CG-CG2 4.45Å; F347-T1321 HydrophobicContact CZ-CG2 4.23Å; F347-L1325 HydrophobicContact CE2-CD1 4.19Å; F347-L1325 HydrophobicContact CZ-CD1 4.34Å; F347-I1345 HydrophobicContact CD1-CD1 4.18Å; F347-I1345 HydrophobicContact CE1-CD1 4.44Å
348	R	89.3	Confident	90.7	Very high	97 Å²	97	80 Å²	80	37%	0.366	40%	0.402	S	S	.	.	I	π-helix	trans	-93.8	-42.3	-175.5	-69.2	-177.8	63.2	-172.6	0.1	113.6	G345 R346 G353	G345-R348 PolarHBondContact O-N 3.47Å; R346-R348 VanDerWaalsContact C-N 3.34Å; R346-R348 PolarHBondContact O-N 2.93Å; R348-G353 PolarHBondContact O-N 2.94Å; R348-G353 VanDerWaalsContact O-N 3.16Å
349	G	88.6	Confident	90.9	Very high	39 Å²	39	81.5 Å²	81.5	40%	0.402	41%	0.414	S	S	.	.	I	π-helix	trans	-96.2	-8.3	-170	0	0	0	0	0	115.1	K343 G345 G353	K343-G349 PolarHBondContact O-N 3.03Å; G345-G349 PolarHBondContact O-N 3.31Å; G349-G353 CarbonylContact C-O 3.57Å
350	S	91.4	Very high	90.9	Very high	51 Å²	51	80.3 Å²	80.3	36%	0.357	41%	0.413	S	S	.	.	I	π-helix	trans	-130.2	-36	-179.9	-50.3	0	0	0	0	113.6	R346 G353	R346-S350 PolarHBondContact O-N 3.5Å; R346-S350 VanDerWaalsContact O-N 3.11Å; S350-G353 CarbonylContact C-O 3.57Å; S350-G353 VanDerWaalsContact CA-O 3.28Å; S350-G353 WeakPolarHBondContact CA-O 3.24Å; S350-G353 PolarHBondContact N-O 3.01Å; S350-G353 VanDerWaalsContact N-O 3.12Å
351	L	92.2	Very high	91	Very high	64 Å²	64	84.1 Å²	84.1	34%	0.335	42%	0.423	S	S	.	.	I	π-helix	trans	-91.1	-65.5	-177.1	-63	171.5	0	0	0	111.2	R346 F347 I1345	R346-L351 WeakPolarHBondContact O-CB 3.49Å; R346-L351 WeakPolarHBondContact O-CG 3.28Å; R346-L351 PolarHBondContact O-N 3.32Å; F347-L351 HydrophobicContact CD1-CD1 4.3Å; L351-I1345 HydrophobicContact CB-CG1 4.19Å; L351-I1345 HydrophobicContact CB-CG2 4.4Å; L351-I1345 HydrophobicContact CD1-CG2 4Å; L351-I1345 HydrophobicContact CD2-CG2 4.4Å; L351-I1345 HydrophobicContact CG-CG2 4.49Å
352	L	90.3	Very high	91.3	Very high	52 Å²	52	84 Å²	84	27%	0.272	42%	0.42	S	S	.	.	I	π-helix	trans	-69.7	-40.7	179.1	-72.1	175.3	0	0	0	113	F347 T1341 I1344 I1345	F347-L352 WeakPolarHBondContact O-CB 3.49Å; F347-L352 WeakPolarHBondContact O-CG 3.31Å; F347-L352 PolarHBondContact O-N 3.43Å; L352-T1341 HydrophobicContact CD2-CG2 4.19Å; L352-I1344 HydrophobicContact CD2-CG2 4.31Å; L352-I1345 HydrophobicContact CD2-CD1 4.49Å; L352-I1345 HydrophobicContact CD2-CG1 4.12Å; L352-I1345 HydrophobicContact CG-CG1 4.39Å
353	G	89	Confident	91.8	Very high	34 Å²	34	84.6 Å²	84.6	35%	0.351	41%	0.414	S	S	.	.	S	Bend	trans	-113.3	123.4	172.9	0	0	0	0	0	109.3	R348 G349 S350	R348-G353 PolarHBondContact O-N 2.94Å; R348-G353 VanDerWaalsContact O-N 3.16Å; G349-G353 CarbonylContact C-O 3.57Å; S350-G353 CarbonylContact C-O 3.57Å; S350-G353 VanDerWaalsContact CA-O 3.28Å; S350-G353 WeakPolarHBondContact CA-O 3.24Å; S350-G353 PolarHBondContact N-O 3.01Å; S350-G353 VanDerWaalsContact N-O 3.12Å
354	K	89.2	Confident	92.3	Very high	154 Å²	154	77.9 Å²	77.9	67%	0.67	39%	0.385	S	S	*	.			trans	-130.8	150.1	176.9	61.7	-172.5	170.3	-169.5	0	110.8
355	R	89.8	Confident	92.7	Very high	252 Å²	252	71 Å²	71	95%	0.951	36%	0.355	S	S	*	.			trans	-71	133.4	169.6	-67.9	-171.8	177.4	-157	-0.5	108.6
356	T	90.9	Very high	92.9	Very high	70 Å²	70	73.8 Å²	73.8	43%	0.429	37%	0.373	S	S	.	.			trans	-109.6	144.7	-178.2	48.4	0	0	0	0	110.4	T359	T356-T359 PolarHBondContact O-OG1 2.76Å; T356-T359 WeakPolarHBondContact OG1-CG2 3.5Å
357	N	92.6	Very high	92.9	Very high	137 Å²	137	69 Å²	69	73%	0.733	36%	0.357	S	S	*	.	S	Bend	trans	-82.5	172.2	172.1	-64.1	-17.1	0	0	0	110.3	T359	N357-T359 VanDerWaalsContact C-N 3.34Å; N357-T359 PolarHBondContact O-N 3.02Å
358	F	95.1	Very high	92.9	Very high	72 Å²	72	69.9 Å²	69.9	32%	0.316	36%	0.364	S	S	.	.	S	Bend	trans	57.6	45.8	179	-52.4	-83.3	0	0	0	112.9	L385 L519 Q521	F358-L385 VanDerWaalsContact C-CD2 3.43Å; F358-L385 HydrophobicContact CB-CD2 4.43Å; F358-L519 HydrophobicContact CB-CB 4.49Å; F358-L519 PolarHBondContact O-N 2.7Å; F358-L519 VanDerWaalsContact O-N 3.11Å; F358-Q521 HydrophobicContact CD2-CG 3.7Å; F358-Q521 HydrophobicContact CE2-CG 4.09Å; F358-Q521 HydrophobicContact CG-CG 4.13Å
359	T	95.8	Very high	92.9	Very high	63 Å²	63	69.7 Å²	69.7	39%	0.387	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	151.7	177.4	59.9	0	0	0	0	111	T356 N357 I517 H518	T356-T359 PolarHBondContact O-OG1 2.76Å; T356-T359 WeakPolarHBondContact OG1-CG2 3.5Å; N357-T359 VanDerWaalsContact C-N 3.34Å; N357-T359 PolarHBondContact O-N 3.02Å; T359-I517 CarbonylContact C-O 3.54Å; T359-I517 WeakPolarHBondContact CA-O 3.14Å; T359-I517 WeakPolarHBondContact CB-O 3.3Å; T359-H518 HydrophobicContact CG2-CB 4.23Å; T359-H518 WeakPolarHBondContact CG2-CD2 3.46Å
360	A	95.3	Very high	93.1	Very high	16 Å²	16	68.5 Å²	68.5	13%	0.132	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	149	173.3	0	0	0	0	0	109.7	C381 L385 F496 N516 I517	A360-C381 HydrophobicContact CB-CB 4.43Å; A360-L385 HydrophobicContact CB-CD1 4.01Å; A360-F496 HydrophobicContact CB-CZ 4.03Å; A360-N516 CarbonylContact O-C 3.24Å; A360-N516 WeakPolarHBondContact O-CA 3.5Å; A360-I517 PolarHBondContact N-O 3.3Å; A360-I517 PolarHBondContact O-N 2.87Å
361	R	95.5	Very high	93.1	Very high	141 Å²	141	67.6 Å²	67.6	53%	0.532	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.2	177.4	-179.4	175.5	173.6	145.6	-0	109.4	E514 M515 N516	R361-E514 HydrophobicContact CG-CB 4.3Å; R361-E514 IonicContact CZ-OE2 3.77Å; R361-E514 IonicContact NE-OE2 2.68Å; R361-E514 PolarHBondContact NE-OE2 2.86Å; R361-E514 IonicContact NH2-OE2 3.9Å; R361-E514 PolarHBondContact NH2-OE2 2.63Å; R361-M515 WeakPolarHBondContact CA-O 3.34Å; R361-N516 WeakPolarHBondContact CB-OD1 3.24Å; R361-N516 VanDerWaalsContact CD-OD1 3.29Å; R361-N516 WeakPolarHBondContact CD-OD1 3.39Å; R361-N516 VanDerWaalsContact CG-OD1 3.28Å; R361-N516 WeakPolarHBondContact CG-OD1 3.27Å
362	T	95.9	Very high	93.2	Very high	27 Å²	27	64.5 Å²	64.5	17%	0.166	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	155.4	-175.9	-52.3	0	0	0	0	110.1	R494 M515	T362-R494 WeakPolarHBondContact CG2-O 3.26Å; T362-M515 PolarHBondContact N-O 3.39Å; T362-M515 PolarHBondContact O-N 2.86Å; T362-M515 VanDerWaalsContact O-N 3.11Å
363	V	97	Very high	93.4	Very high	56 Å²	56	62.1 Å²	62.1	34%	0.339	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	140.3	172	179.7	0	0	0	0	110.5	T495 F496 D513 E514	V363-T495 WeakPolarHBondContact O-CA 3.36Å; V363-T495 WeakPolarHBondContact O-CB 3.49Å; V363-F496 PolarHBondContact O-N 2.96Å; V363-D513 WeakPolarHBondContact CA-O 3.23Å; V363-E514 HydrophobicContact CG2-CG 4Å
364	I	97	Very high	93.7	Very high	6 Å²	6	62.5 Å²	62.5	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	153	177	59.2	165.5	0	0	0	112.3	F472 F496 F498 A508 F510 D513 M515	I364-F472 HydrophobicContact CG2-CZ 3.87Å; I364-F496 CarbonylContact C-O 3.57Å; I364-F496 WeakPolarHBondContact CA-O 3.5Å; I364-F496 HydrophobicContact CG2-CB 4.21Å; I364-F498 HydrophobicContact CB-CE1 3.96Å; I364-F498 HydrophobicContact CD1-CE1 3.91Å; I364-F498 HydrophobicContact CD1-CZ 4.12Å; I364-F498 HydrophobicContact CG2-CE1 4Å; I364-A508 HydrophobicContact CD1-CB 3.74Å; I364-F510 HydrophobicContact CB-CD1 4.26Å; I364-F510 HydrophobicContact CB-CE1 4.26Å; I364-F510 HydrophobicContact CD1-CD1 3.67Å; I364-F510 HydrophobicContact CD1-CE1 3.82Å; I364-F510 HydrophobicContact CG1-CD1 3.78Å; I364-F510 HydrophobicContact CG1-CE1 4.15Å; I364-D513 HydrophobicContact CD1-CB 3.78Å; I364-D513 HydrophobicContact CG1-CB 3.83Å; I364-D513 WeakPolarHBondContact CG1-O 3.45Å; I364-D513 PolarHBondContact N-O 3.3Å; I364-M515 HydrophobicContact CD1-SD 4.08Å; I364-M515 HydrophobicContact CG2-CB 3.68Å; I364-M515 HydrophobicContact CG2-CG 3.69Å; I364-M515 HydrophobicContact CG2-SD 3.82Å
365	S	96.4	Very high	94.1	Very high	18 Å²	18	55.1 Å²	55.1	13%	0.126	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.4	174.8	46.7	0	0	0	0	110.3	T495 F496 R497 F510	S365-T495 VanDerWaalsContact OG-CB 3.26Å; S365-T495 WeakPolarHBondContact OG-CB 2.82Å; S365-T495 PolarHBondContact OG-OG1 2.93Å; S365-F496 PolarHBondContact N-O 2.93Å; S365-F496 PolarHBondContact OG-O 3.21Å; S365-R497 VanDerWaalsContact O-CA 3.26Å; S365-R497 WeakPolarHBondContact O-CA 3.49Å; S365-R497 WeakPolarHBondContact OG-CG 3.43Å; S365-F510 VanDerWaalsContact C-CE1 3.43Å
366	P	94.8	Very high	94.4	Very high	62 Å²	62	43.2 Å²	43.2	40%	0.403	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	142.2	-179.6	28.4	-33.4	0	0	0	111.2	P500 F510	P366-P500 HydrophobicContact CB-CG 3.91Å; P366-F510 HydrophobicContact CB-CD2 4.14Å; P366-F510 HydrophobicContact CB-CE1 4.31Å; P366-F510 HydrophobicContact CB-CE2 3.73Å; P366-F510 HydrophobicContact CB-CZ 3.83Å; P366-F510 HydrophobicContact CG-CD2 4.34Å; P366-F510 HydrophobicContact CG-CE2 4.42Å; P366-F510 HydrophobicContact CG-CG 4.48Å
367	D	93.4	Very high	94.7	Very high	25 Å²	25	40 Å²	40	13%	0.134	21%	0.21	C	C	.	.			trans	-143	101.6	164	-167.5	-17.3	0	0	0	110.6	N369 M370 R497 F498 N499	D367-N369 PolarHBondContact O-N 3.46Å; D367-N369 WeakPolarHBondContact OD1-CB 3.42Å; D367-N369 PolarHBondContact OD1-N 3.47Å; D367-N369 PolarHBondContact OD1-ND2 3.03Å; D367-M370 HydrophobicContact CB-CG 3.87Å; D367-M370 PolarHBondContact O-N 3.25Å; D367-R497 HydrophobicContact CB-CB 3.84Å; D367-R497 HydrophobicContact CB-CG 4.34Å; D367-F498 PolarHBondContact N-O 3.05Å; D367-N499 WeakPolarHBondContact O-CA 3.5Å
368	P	90.3	Very high	95	Very high	32 Å²	32	33.6 Å²	33.6	21%	0.208	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.3	-177.8	32.1	-36.1	0	0	0	113.3	M370 L699	P368-M370 VanDerWaalsContact C-N 3.29Å; P368-L699 HydrophobicContact CB-CD1 3.42Å; P368-L699 VanDerWaalsContact CB-CD1 3.42Å; P368-L699 HydrophobicContact CG-CD1 3.45Å; P368-L699 VanDerWaalsContact CG-CD1 3.45Å
369	N	90.4	Very high	95	Very high	93 Å²	93	31.8 Å²	31.8	50%	0.497	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.7	176.9	-59.5	-60.4	0	0	0	112.6	D367 W692	D367-N369 PolarHBondContact O-N 3.46Å; D367-N369 WeakPolarHBondContact OD1-CB 3.42Å; D367-N369 PolarHBondContact OD1-N 3.47Å; D367-N369 PolarHBondContact OD1-ND2 3.03Å; N369-W692 PolarHBondContact O-NE1 3.48Å
370	M	92.1	Very high	95	Very high	13 Å²	13	34.7 Å²	34.7	6%	0.064	18%	0.18	C	C	.	.	S	Bend	trans	-75	144.4	175.3	-59.9	-54.1	-56.4	0	0	110.4	D367 P368 E374 V489 N499	D367-M370 HydrophobicContact CB-CG 3.87Å; D367-M370 PolarHBondContact O-N 3.25Å; P368-M370 VanDerWaalsContact C-N 3.29Å; M370-E374 HydrophobicContact CE-CB 3.46Å; M370-E374 VanDerWaalsContact CE-CB 3.46Å; M370-E374 HydrophobicContact CE-CG 4.32Å; M370-E374 WeakPolarHBondContact CE-OE2 3.3Å; M370-V489 HydrophobicContact CE-CB 3.74Å; M370-V489 HydrophobicContact CE-CG1 4.1Å; M370-V489 HydrophobicContact CE-CG2 3.67Å; M370-N499 PolarHBondContact O-ND2 2.96Å
371	R	92.7	Very high	95	Very high	32 Å²	32	34.9 Å²	34.9	12%	0.121	18%	0.18	C	C	.	.			trans	-65.7	160.7	167.5	-65.6	174.2	62.5	102.4	8	110.2	D373 E374 N585 D689 W692	R371-D373 VanDerWaalsContact CB-OD1 3.3Å; R371-D373 WeakPolarHBondContact CB-OD1 3.31Å; R371-D373 IonicContact NE-OD1 3.23Å; R371-D373 PolarHBondContact NE-OD1 3.27Å; R371-D373 PolarHBondContact O-N 3.26Å; R371-D373 VanDerWaalsContact O-N 3.13Å; R371-E374 HydrophobicContact CB-CG 4.03Å; R371-E374 WeakPolarHBondContact CB-OE2 3.2Å; R371-E374 PolarHBondContact N-OE2 2.8Å; R371-E374 PolarHBondContact O-N 3.46Å; R371-N585 PolarHBondContact NH1-ND2 3.46Å; R371-D689 IonicContact CZ-OD1 3.31Å; R371-D689 IonicContact NH1-OD1 2.65Å; R371-D689 PolarHBondContact NH1-OD1 3.43Å; R371-D689 IonicContact NH2-OD1 2.73Å; R371-D689 PolarHBondContact NH2-OD1 3.4Å; R371-W692 HydrophobicContact CG-CG 4.24Å
372	I	93.8	Very high	95	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.7	179.3	61.7	166.8	0	0	0	113.4	F486 N499 C501 C502 S535 L536 I539 I549 A688 M691	I372-F486 VanDerWaalsContact O-CE1 3.23Å; I372-F486 WeakPolarHBondContact O-CE1 3.05Å; I372-N499 HydrophobicContact CG2-CB 4.37Å; I372-C501 HydrophobicContact CG2-CB 4.14Å; I372-C502 PolarHBondContact O-SG 2.98Å; I372-S535 WeakPolarHBondContact O-CB 3.45Å; I372-S535 PolarHBondContact O-OG 3.42Å; I372-L536 HydrophobicContact CD1-CD2 4.12Å; I372-L536 HydrophobicContact CG1-CD2 4.07Å; I372-I539 HydrophobicContact CD1-CD1 4.18Å; I372-I539 HydrophobicContact CD1-CG1 4.4Å; I372-I549 HydrophobicContact CB-CG2 4.42Å; I372-I549 HydrophobicContact CD1-CG2 4.28Å; I372-I549 HydrophobicContact CG2-CG2 4.34Å; I372-A688 HydrophobicContact CD1-CB 3.57Å; I372-A688 HydrophobicContact CG1-CB 3.68Å; I372-M691 HydrophobicContact CD1-SD 4.25Å; I372-M691 HydrophobicContact CG2-CB 4.31Å; I372-M691 HydrophobicContact CG2-SD 4.25Å
373	D	94.9	Very high	95	Very high	2 Å²	2	30 Å²	30	1%	0.011	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	7.8	179.9	69.3	-53.6	0	0	0	114.3	R371 F486 R487 L536	R371-D373 VanDerWaalsContact CB-OD1 3.3Å; R371-D373 WeakPolarHBondContact CB-OD1 3.31Å; R371-D373 IonicContact NE-OD1 3.23Å; R371-D373 PolarHBondContact NE-OD1 3.27Å; R371-D373 PolarHBondContact O-N 3.26Å; R371-D373 VanDerWaalsContact O-N 3.13Å; D373-F486 WeakPolarHBondContact O-CA 3.33Å; D373-R487 PolarHBondContact O-N 3.1Å; D373-R487 IonicContact OD2-CZ 2.67Å; D373-R487 IonicContact OD2-NE 3.69Å; D373-R487 PolarHBondContact OD2-NE 3.46Å; D373-R487 IonicContact OD2-NH2 3.67Å; D373-R487 PolarHBondContact OD2-NH2 3.02Å; D373-L536 HydrophobicContact CB-CD1 4.04Å; D373-L536 HydrophobicContact CB-CD2 3.85Å; D373-L536 HydrophobicContact CB-CG 3.52Å; D373-L536 WeakPolarHBondContact OD2-CD1 3.16Å
374	E	95.3	Very high	94.9	Very high	41 Å²	41	33.5 Å²	33.5	19%	0.192	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	144.4	179.1	-65.6	168.4	166.2	0	0	111.4	M370 R371 R487 V489	M370-E374 HydrophobicContact CE-CB 3.46Å; M370-E374 VanDerWaalsContact CE-CB 3.46Å; M370-E374 HydrophobicContact CE-CG 4.32Å; M370-E374 WeakPolarHBondContact CE-OE2 3.3Å; R371-E374 HydrophobicContact CB-CG 4.03Å; R371-E374 WeakPolarHBondContact CB-OE2 3.2Å; R371-E374 PolarHBondContact N-OE2 2.8Å; R371-E374 PolarHBondContact O-N 3.46Å; E374-R487 CarbonylContact C-O 3.54Å; E374-R487 VanDerWaalsContact CA-O 3.31Å; E374-R487 WeakPolarHBondContact CA-O 3.27Å; E374-R487 HydrophobicContact CG-CB 4.42Å; E374-V489 HydrophobicContact CB-CG2 4.18Å; E374-V489 HydrophobicContact CG-CG2 4.2Å
375	V	96.9	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130	170.6	67.6	0	0	0	0	109.6	I377 V470 F472 F486 R487 A488 V489 F498	V375-I377 HydrophobicContact CG1-CG1 4.33Å; V375-V470 HydrophobicContact CG1-CG2 3.63Å; V375-F472 HydrophobicContact CG2-CE1 4.49Å; V375-F472 HydrophobicContact CG2-CZ 4.45Å; V375-F486 HydrophobicContact CB-CB 3.87Å; V375-F486 HydrophobicContact CB-CD1 4.3Å; V375-F486 HydrophobicContact CB-CG 4.12Å; V375-F486 HydrophobicContact CG1-CB 3.54Å; V375-F486 HydrophobicContact CG1-CG 4.26Å; V375-R487 PolarHBondContact N-O 3.32Å; V375-A488 CarbonylContact O-C 3.56Å; V375-A488 WeakPolarHBondContact O-CA 3.22Å; V375-V489 PolarHBondContact O-N 3.19Å; V375-F498 HydrophobicContact CG2-CB 4.36Å
376	C	97.1	Very high	94.8	Very high	2 Å²	2	33 Å²	33	1%	0.014	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	124.3	177.3	-107.6	0	0	0	0	110.4	V489 K491 F496 R497	C376-V489 CarbonylContact C-O 3.25Å; C376-V489 WeakPolarHBondContact CA-O 3.4Å; C376-K491 WeakPolarHBondContact SG-CG 3.23Å; C376-F496 WeakPolarHBondContact O-CA 3.38Å; C376-R497 HydrophobicContact CB-CB 3.55Å; C376-R497 WeakPolarHBondContact CB-O 3.25Å; C376-R497 PolarHBondContact N-O 3.23Å; C376-R497 PolarHBondContact O-N 2.86Å
377	I	97.3	Very high	94.9	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.4	-179	-57.6	-172	0	0	0	109.7	V375 C381 A382 L464 V470 A488 V489 V490 K491 F496 I517	V375-I377 HydrophobicContact CG1-CG1 4.33Å; I377-C381 HydrophobicContact CG2-CB 3.93Å; I377-A382 HydrophobicContact CG2-CB 4.45Å; I377-L464 HydrophobicContact CD1-CD1 3.78Å; I377-L464 HydrophobicContact CD1-CD2 3.97Å; I377-V470 HydrophobicContact CD1-CG1 4.05Å; I377-V470 HydrophobicContact CD1-CG2 4.15Å; I377-A488 HydrophobicContact CD1-CB 3.51Å; I377-A488 HydrophobicContact CG1-CB 4.14Å; I377-V489 PolarHBondContact N-O 3.44Å; I377-V490 WeakPolarHBondContact O-CA 3.48Å; I377-K491 PolarHBondContact O-N 3.43Å; I377-F496 HydrophobicContact CG2-CE1 4.35Å; I377-I517 HydrophobicContact CD1-CD1 3.66Å; I377-I517 HydrophobicContact CG1-CD1 3.72Å
378	P	97.2	Very high	95	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.019	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	136	171	-31.4	39.5	0	0	0	113.2	H380 C381 A382 K491 F493 F496	P378-H380 PolarHBondContact O-N 3.06Å; P378-H380 VanDerWaalsContact O-N 3.11Å; P378-C381 HydrophobicContact CB-CB 4.37Å; P378-C381 WeakPolarHBondContact O-CB 3.17Å; P378-C381 PolarHBondContact O-N 2.72Å; P378-A382 PolarHBondContact O-N 3.45Å; P378-K491 WeakPolarHBondContact CA-O 3.47Å; P378-F493 VanDerWaalsContact CA-O 3.32Å; P378-F493 WeakPolarHBondContact CA-O 3.38Å; P378-F493 WeakPolarHBondContact CB-O 3.48Å; P378-F496 HydrophobicContact CG-CD1 4.44Å; P378-F496 HydrophobicContact CG-CE1 4.48Å
379	V	96.5	Very high	95.2	Very high	33 Å²	33	30.7 Å²	30.7	20%	0.2	16%	0.156	C	C	.	.	H	α-helix	trans	-51.8	-36.4	172.5	170.8	0	0	0	0	112	C381 A382 K383 Y410 V490 K491	V379-C381 PolarHBondContact O-N 3.42Å; V379-A382 PolarHBondContact O-N 2.97Å; V379-K383 HydrophobicContact CG1-CD 4.33Å; V379-K383 HydrophobicContact CG1-CG 4.43Å; V379-K383 WeakPolarHBondContact O-CG 3.4Å; V379-K383 PolarHBondContact O-N 3.46Å; V379-Y410 HydrophobicContact CG1-CG 4.41Å; V379-V490 HydrophobicContact CB-CG1 4.29Å; V379-V490 HydrophobicContact CG2-CG1 3.58Å; V379-K491 WeakPolarHBondContact CG2-O 3.01Å; V379-K491 PolarHBondContact N-O 3.21Å
380	H	95	Very high	95.5	Very high	124 Å²	124	34 Å²	34	57%	0.574	16%	0.161	S	C	*	.	H	α-helix	trans	-59.9	-43.5	176.3	-76.9	-83.3	0	0	0	112.7	P378	P378-H380 PolarHBondContact O-N 3.06Å; P378-H380 VanDerWaalsContact O-N 3.11Å
381	C	95.4	Very high	95.6	Very high	21 Å²	21	33.5 Å²	33.5	14%	0.142	16%	0.159	C	C	.	.	H	α-helix	trans	-70.7	-41.1	176.1	-62.4	0	0	0	0	110.8	A360 I377 P378 V379 K383 L384 L385	A360-C381 HydrophobicContact CB-CB 4.43Å; I377-C381 HydrophobicContact CG2-CB 3.93Å; P378-C381 HydrophobicContact CB-CB 4.37Å; P378-C381 WeakPolarHBondContact O-CB 3.17Å; P378-C381 PolarHBondContact O-N 2.72Å; V379-C381 PolarHBondContact O-N 3.42Å; C381-K383 VanDerWaalsContact C-N 3.3Å; C381-K383 PolarHBondContact O-N 3.37Å; C381-L384 PolarHBondContact O-N 3.47Å; C381-L384 VanDerWaalsContact O-N 3.11Å; C381-L385 WeakPolarHBondContact O-CG 3.04Å; C381-L385 PolarHBondContact O-N 2.92Å
382	A	96.1	Very high	95.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-31.5	-177.9	0	0	0	0	0	113.6	I377 P378 V379 L385 Y410 H463 L464 V490	I377-A382 HydrophobicContact CG2-CB 4.45Å; P378-A382 PolarHBondContact O-N 3.45Å; V379-A382 PolarHBondContact O-N 2.97Å; A382-L385 VanDerWaalsContact O-O 3.04Å; A382-Y410 HydrophobicContact CB-CE2 3.99Å; A382-H463 WeakPolarHBondContact O-CB 3.42Å; A382-L464 HydrophobicContact CB-CB 4.19Å; A382-L464 HydrophobicContact CB-CD2 4.14Å; A382-L464 PolarHBondContact O-N 2.8Å; A382-L464 VanDerWaalsContact O-N 3.1Å; A382-V490 HydrophobicContact CB-CG1 3.8Å; A382-V490 HydrophobicContact CB-CG2 3.87Å
383	K	94.9	Very high	95.8	Very high	64 Å²	64	41 Å²	41	28%	0.278	20%	0.203	S	C	.	.	H	α-helix	trans	-70.3	-32.8	173.4	-71.1	179.8	-176.5	-177.3	0	113.2	V379 C381 N408 Y410 H463	V379-K383 HydrophobicContact CG1-CD 4.33Å; V379-K383 HydrophobicContact CG1-CG 4.43Å; V379-K383 WeakPolarHBondContact O-CG 3.4Å; V379-K383 PolarHBondContact O-N 3.46Å; C381-K383 VanDerWaalsContact C-N 3.3Å; C381-K383 PolarHBondContact O-N 3.37Å; K383-N408 WeakPolarHBondContact CE-O 3.43Å; K383-N408 PolarHBondContact NZ-O 3.29Å; K383-Y410 HydrophobicContact CG-CD2 4.38Å; K383-H463 PolarHBondContact O-CD2 2.96Å
384	L	94.4	Very high	95.8	Very high	131 Å²	131	50.5 Å²	50.5	69%	0.686	25%	0.245	S	C	*	.	H	α-helix	trans	-83.9	-39.2	-178.5	-66.6	173.8	0	0	0	112.3	C381 T386	C381-L384 PolarHBondContact O-N 3.47Å; C381-L384 VanDerWaalsContact O-N 3.11Å; L384-T386 PolarHBondContact O-N 3.44Å
385	L	95.9	Very high	95.8	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	24%	0.242	C	C	.	.	S	Bend	trans	-76.5	113.4	176	-64.9	176	0	0	0	109.2	F358 A360 C381 A382 L464 I517 L519	F358-L385 VanDerWaalsContact C-CD2 3.43Å; F358-L385 HydrophobicContact CB-CD2 4.43Å; A360-L385 HydrophobicContact CB-CD1 4.01Å; C381-L385 WeakPolarHBondContact O-CG 3.04Å; C381-L385 PolarHBondContact O-N 2.92Å; A382-L385 VanDerWaalsContact O-O 3.04Å; L385-L464 HydrophobicContact CB-CB 4.41Å; L385-L464 HydrophobicContact CB-CD1 4.33Å; L385-L464 HydrophobicContact CD1-CD1 4.23Å; L385-L464 PolarHBondContact O-N 3.43Å; L385-L464 VanDerWaalsContact O-N 3.07Å; L385-I517 HydrophobicContact CD1-CG2 4.24Å; L385-L519 HydrophobicContact CB-CD2 4.13Å
386	T	95.7	Very high	95.7	Very high	6 Å²	6	51 Å²	51	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.4	-178.9	48.8	0	0	0	0	111.8	L384 M414 R462 L519 Q521	L384-T386 PolarHBondContact O-N 3.44Å; T386-M414 HydrophobicContact CG2-CB 3.97Å; T386-M414 HydrophobicContact CG2-CG 3.83Å; T386-R462 CarbonylContact C-O 3.6Å; T386-R462 WeakPolarHBondContact CA-O 3.28Å; T386-R462 WeakPolarHBondContact CB-O 3.33Å; T386-L519 VanDerWaalsContact O-CD2 3.27Å; T386-L519 WeakPolarHBondContact O-CD2 3.47Å; T386-Q521 PolarHBondContact O-NE2 2.85Å; T386-Q521 VanDerWaalsContact O-NE2 3.1Å
387	Y	97.2	Very high	95.6	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.4	174.6	-176	-106.6	0	0	0	109.7	E389 E461 R462 P520 E523	Y387-E389 HydrophobicContact CD1-CB 4.05Å; Y387-E389 HydrophobicContact CE1-CB 4.25Å; Y387-E389 HydrophobicContact CE1-CG 4.48Å; Y387-E389 PolarHBondContact O-N 3.29Å; Y387-E389 VanDerWaalsContact O-N 3.08Å; Y387-E461 WeakPolarHBondContact O-CA 3.46Å; Y387-R462 PolarHBondContact N-O 2.84Å; Y387-R462 PolarHBondContact O-N 3.24Å; Y387-R462 VanDerWaalsContact O-N 3.12Å; Y387-P520 WeakPolarHBondContact CD2-O 3.42Å; Y387-P520 WeakPolarHBondContact CE2-O 3.49Å; Y387-E523 WeakPolarHBondContact OH-CG 3.34Å; Y387-E523 PolarHBondContact OH-OE1 3.43Å; Y387-E523 PolarHBondContact OH-OE2 3.41Å
388	P	95.7	Very high	95.5	Very high	34 Å²	34	61.1 Å²	61.1	22%	0.221	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	89.3	179	31.4	-34.2	0	0	0	110.4	I459 E461 Q521	P388-I459 HydrophobicContact CB-CG2 3.67Å; P388-E461 HydrophobicContact CB-CG 4.21Å; P388-Q521 VanDerWaalsContact CD-OE1 3.25Å; P388-Q521 WeakPolarHBondContact CG-O 3.3Å
389	E	95.6	Very high	95.4	Very high	32 Å²	32	61 Å²	61	15%	0.15	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.9	179.5	-164.6	160.8	145.6	0	0	111.3	Y387 N395 L399 V460 R462	Y387-E389 HydrophobicContact CD1-CB 4.05Å; Y387-E389 HydrophobicContact CE1-CB 4.25Å; Y387-E389 HydrophobicContact CE1-CG 4.48Å; Y387-E389 PolarHBondContact O-N 3.29Å; Y387-E389 VanDerWaalsContact O-N 3.08Å; E389-N395 PolarHBondContact OE1-ND2 2.95Å; E389-L399 HydrophobicContact CB-CD1 4.49Å; E389-L399 HydrophobicContact CB-CD2 4.24Å; E389-L399 HydrophobicContact CG-CD1 4.32Å; E389-L399 HydrophobicContact CG-CD2 4.4Å; E389-V460 PolarHBondContact N-O 3.25Å; E389-V460 PolarHBondContact O-N 3.42Å; E389-R462 HydrophobicContact CB-CG 4.45Å; E389-R462 IonicContact OE2-CZ 2.88Å; E389-R462 VanDerWaalsContact OE2-CZ 3.29Å; E389-R462 IonicContact OE2-NE 3.13Å; E389-R462 PolarHBondContact OE2-NE 2.81Å; E389-R462 IonicContact OE2-NH2 2.67Å; E389-R462 PolarHBondContact OE2-NH2 2.99Å
390	R	95.2	Very high	95.3	Very high	163 Å²	163	63.1 Å²	63.1	62%	0.615	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.9	175.8	-177.3	175.9	-99	-168.6	-2.4	109.9	T392 N395 D458	R390-T392 PolarHBondContact O-N 3Å; R390-N395 PolarHBondContact O-ND2 3.29Å; R390-D458 WeakPolarHBondContact CA-O 3.28Å
391	V	95.6	Very high	95.3	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.012	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-70.8	128.1	175.5	-175.1	0	0	0	0	109.2	L396 L399 L454 Q455 S456 G457 D458 V460	V391-L396 HydrophobicContact CG1-CB 4.19Å; V391-L396 HydrophobicContact CG1-CD1 3.79Å; V391-L396 HydrophobicContact CG1-CG 4.31Å; V391-L399 HydrophobicContact CB-CD1 4.29Å; V391-L399 HydrophobicContact CG2-CD1 3.72Å; V391-L454 HydrophobicContact CG1-CD2 4.32Å; V391-L454 HydrophobicContact CG1-CG 4.48Å; V391-L454 HydrophobicContact CG2-CD1 4.29Å; V391-L454 HydrophobicContact CG2-CD2 3.98Å; V391-L454 HydrophobicContact CG2-CG 4.07Å; V391-Q455 WeakPolarHBondContact CB-O 3.47Å; V391-Q455 WeakPolarHBondContact CG1-O 3.38Å; V391-S456 WeakPolarHBondContact O-CA 3.27Å; V391-G457 PolarHBondContact O-N 3.26Å; V391-D458 HydrophobicContact CG2-CB 4.1Å; V391-D458 WeakPolarHBondContact CG2-O 3.47Å; V391-D458 PolarHBondContact N-O 3.2Å; V391-V460 HydrophobicContact CG2-CG2 3.79Å
392	T	95.2	Very high	95.3	Very high	54 Å²	54	58.9 Å²	58.9	33%	0.331	29%	0.286	S	S	.	.			trans	-130.3	167.8	175	65.5	0	0	0	0	108.3	R390 F394 N395 L396	R390-T392 PolarHBondContact O-N 3Å; T392-F394 PolarHBondContact O-N 3.46Å; T392-F394 VanDerWaalsContact O-N 3.16Å; T392-N395 WeakPolarHBondContact CA-OD1 3.47Å; T392-N395 PolarHBondContact N-OD1 3.45Å; T392-N395 PolarHBondContact O-N 3.03Å; T392-N395 PolarHBondContact O-OD1 3.22Å; T392-N395 PolarHBondContact OG1-N 3.46Å; T392-N395 PolarHBondContact OG1-OD1 2.82Å; T392-L396 WeakPolarHBondContact O-CB 3.46Å; T392-L396 PolarHBondContact O-N 3.32Å
393	D	94.8	Very high	95.3	Very high	134 Å²	134	58.9 Å²	58.9	72%	0.717	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-26	-179.7	-55.8	-28.4	0	0	0	112.3	S456	D393-S456 PolarHBondContact OD1-OG 2.97Å
394	F	95.3	Very high	95.2	Very high	202 Å²	202	59.8 Å²	59.8	89%	0.886	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-38.9	179.8	-59.5	-75.8	0	0	0	113.8	T392	T392-F394 PolarHBondContact O-N 3.46Å; T392-F394 VanDerWaalsContact O-N 3.16Å
395	N	95.1	Very high	95.2	Very high	23 Å²	23	56.6 Å²	56.6	12%	0.123	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-1.7	-176	68.1	-1.4	0	0	0	113.6	E389 R390 T392 N397 F398 L399	E389-N395 PolarHBondContact OE1-ND2 2.95Å; R390-N395 PolarHBondContact O-ND2 3.29Å; T392-N395 WeakPolarHBondContact CA-OD1 3.47Å; T392-N395 PolarHBondContact N-OD1 3.45Å; T392-N395 PolarHBondContact O-N 3.03Å; T392-N395 PolarHBondContact O-OD1 3.22Å; T392-N395 PolarHBondContact OG1-N 3.46Å; T392-N395 PolarHBondContact OG1-OD1 2.82Å; N395-N397 PolarHBondContact O-N 3.43Å; N395-F398 WeakPolarHBondContact O-CB 3.3Å; N395-F398 PolarHBondContact O-N 3.33Å; N395-F398 VanDerWaalsContact O-N 3.08Å; N395-L399 HydrophobicContact CB-CD1 4.42Å; N395-L399 HydrophobicContact CB-CG 4.38Å; N395-L399 WeakPolarHBondContact O-CG 3.31Å; N395-L399 PolarHBondContact O-N 3.06Å
396	L	94	Very high	95.1	Very high	30 Å²	30	56.2 Å²	56.2	16%	0.157	28%	0.275	C	S	.	.	H	α-helix	trans	-52.4	-49.2	-177.3	-177.7	121.6	0	0	0	113.1	V391 T392 F398 R400	V391-L396 HydrophobicContact CG1-CB 4.19Å; V391-L396 HydrophobicContact CG1-CD1 3.79Å; V391-L396 HydrophobicContact CG1-CG 4.31Å; T392-L396 WeakPolarHBondContact O-CB 3.46Å; T392-L396 PolarHBondContact O-N 3.32Å; L396-F398 VanDerWaalsContact C-N 3.33Å; L396-F398 PolarHBondContact O-N 3.2Å; L396-R400 WeakPolarHBondContact O-CB 3.49Å; L396-R400 PolarHBondContact O-N 3.12Å
397	N	94.5	Very high	94.9	Very high	119 Å²	119	56.4 Å²	56.4	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-66.2	-37.5	-179.8	-69.7	-28.8	0	0	0	112.2	N395 S401	N395-N397 PolarHBondContact O-N 3.43Å; N397-S401 PolarHBondContact O-N 3.47Å
398	F	95.9	Very high	94.7	Very high	96 Å²	96	61.7 Å²	61.7	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-67.9	-47.9	177.8	176.7	-110.2	0	0	0	111.6	N395 L396 R400 S401 L402 L465	N395-F398 WeakPolarHBondContact O-CB 3.3Å; N395-F398 PolarHBondContact O-N 3.33Å; N395-F398 VanDerWaalsContact O-N 3.08Å; L396-F398 VanDerWaalsContact C-N 3.33Å; L396-F398 PolarHBondContact O-N 3.2Å; F398-R400 VanDerWaalsContact C-N 3.3Å; F398-R400 PolarHBondContact O-N 3.03Å; F398-S401 PolarHBondContact O-N 3.46Å; F398-S401 PolarHBondContact O-OG 3.36Å; F398-L402 HydrophobicContact CD1-CD1 4.27Å; F398-L402 HydrophobicContact CE1-CD1 3.73Å; F398-L402 HydrophobicContact CZ-CD1 3.92Å; F398-L402 HydrophobicContact CZ-CG 4.44Å; F398-L402 PolarHBondContact O-N 2.93Å; F398-L465 HydrophobicContact CE1-CD1 3.81Å; F398-L465 HydrophobicContact CZ-CD1 3.59Å
399	L	95.5	Very high	94.5	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-34.7	177.6	-66.6	178.4	0	0	0	111.8	E389 V391 N395 S401 L402 V403 L454 V460	E389-L399 HydrophobicContact CB-CD1 4.49Å; E389-L399 HydrophobicContact CB-CD2 4.24Å; E389-L399 HydrophobicContact CG-CD1 4.32Å; E389-L399 HydrophobicContact CG-CD2 4.4Å; V391-L399 HydrophobicContact CB-CD1 4.29Å; V391-L399 HydrophobicContact CG2-CD1 3.72Å; N395-L399 HydrophobicContact CB-CD1 4.42Å; N395-L399 HydrophobicContact CB-CG 4.38Å; N395-L399 WeakPolarHBondContact O-CG 3.31Å; N395-L399 PolarHBondContact O-N 3.06Å; L399-S401 VanDerWaalsContact C-N 3.32Å; L399-S401 PolarHBondContact O-N 2.67Å; L399-L402 HydrophobicContact CD2-CD1 4.17Å; L399-L402 PolarHBondContact O-N 2.77Å; L399-V403 WeakPolarHBondContact O-CG2 3.33Å; L399-V403 PolarHBondContact O-N 3.03Å; L399-L454 HydrophobicContact CB-CD2 4.3Å; L399-V460 HydrophobicContact CB-CG2 4.35Å; L399-V460 HydrophobicContact CD1-CB 4.43Å; L399-V460 HydrophobicContact CD1-CG2 4.38Å; L399-V460 HydrophobicContact CD2-CB 4.42Å
400	R	94.6	Very high	94.4	Very high	79 Å²	79	66.4 Å²	66.4	30%	0.298	33%	0.325	S	S	.	.	H	α-helix	trans	-59.7	-41	174.9	-173.9	179.3	-78.6	153	-1.6	111.8	L396 F398 V403 L404 A451 L454	L396-R400 WeakPolarHBondContact O-CB 3.49Å; L396-R400 PolarHBondContact O-N 3.12Å; F398-R400 VanDerWaalsContact C-N 3.3Å; F398-R400 PolarHBondContact O-N 3.03Å; R400-V403 PolarHBondContact O-N 3.15Å; R400-L404 WeakPolarHBondContact O-CG 3.49Å; R400-L404 PolarHBondContact O-N 3.33Å; R400-L404 VanDerWaalsContact O-N 3.17Å; R400-A451 HydrophobicContact CG-CB 3.92Å; R400-A451 PolarHBondContact NE-O 2.75Å; R400-L454 HydrophobicContact CB-CD2 4.47Å
401	S	95.3	Very high	94.4	Very high	53 Å²	53	61 Å²	61	37%	0.371	31%	0.311	S	S	.	.	H	α-helix	trans	-67.1	-37.9	177	72.6	0	0	0	0	112.3	N397 F398 L399 L404 N405	N397-S401 PolarHBondContact O-N 3.47Å; F398-S401 PolarHBondContact O-N 3.46Å; F398-S401 PolarHBondContact O-OG 3.36Å; L399-S401 VanDerWaalsContact C-N 3.32Å; L399-S401 PolarHBondContact O-N 2.67Å; S401-L404 PolarHBondContact O-N 2.82Å; S401-N405 PolarHBondContact O-N 3.19Å; S401-N405 VanDerWaalsContact O-N 3.08Å
402	L	95.7	Very high	94.4	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-65.3	-38.8	175.3	-62.4	179	0	0	0	112.8	F398 L399 L404 N405 G406 P411 G412 A413 R462 L465	F398-L402 HydrophobicContact CD1-CD1 4.27Å; F398-L402 HydrophobicContact CE1-CD1 3.73Å; F398-L402 HydrophobicContact CZ-CD1 3.92Å; F398-L402 HydrophobicContact CZ-CG 4.44Å; F398-L402 PolarHBondContact O-N 2.93Å; L399-L402 HydrophobicContact CD2-CD1 4.17Å; L399-L402 PolarHBondContact O-N 2.77Å; L402-L404 VanDerWaalsContact C-N 3.33Å; L402-N405 PolarHBondContact O-N 3.09Å; L402-G406 PolarHBondContact O-N 2.94Å; L402-G406 VanDerWaalsContact O-N 3.12Å; L402-P411 HydrophobicContact CD2-CB 3.72Å; L402-P411 HydrophobicContact CD2-CG 3.99Å; L402-G412 CarbonylContact O-C 3.41Å; L402-G412 WeakPolarHBondContact O-CA 3.04Å; L402-A413 PolarHBondContact O-N 3.32Å; L402-R462 HydrophobicContact CD1-CB 3.96Å; L402-L465 HydrophobicContact CD1-CD1 4.4Å
403	V	94.6	Very high	94.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.6	-41.7	175.4	171.1	0	0	0	0	110.9	L399 R400 G406 A413 V416 L441 R447 V450 A451 V460	L399-V403 WeakPolarHBondContact O-CG2 3.33Å; L399-V403 PolarHBondContact O-N 3.03Å; R400-V403 PolarHBondContact O-N 3.15Å; V403-G406 PolarHBondContact O-N 3.49Å; V403-A413 HydrophobicContact CG2-CB 4.48Å; V403-V416 HydrophobicContact CG2-CG2 3.92Å; V403-L441 HydrophobicContact CB-CD1 4.38Å; V403-L441 HydrophobicContact CG1-CD1 4.02Å; V403-L441 HydrophobicContact CG1-CD2 3.92Å; V403-L441 HydrophobicContact CG2-CD1 4.28Å; V403-R447 WeakPolarHBondContact O-CB 3.45Å; V403-R447 WeakPolarHBondContact O-CG 3.21Å; V403-V450 HydrophobicContact CG1-CB 4.34Å; V403-V450 HydrophobicContact CG1-CG1 4.18Å; V403-A451 HydrophobicContact CG1-CB 4.08Å; V403-V460 HydrophobicContact CG2-CG1 3.84Å; V403-V460 HydrophobicContact CG2-CG2 4.18Å
404	L	94.4	Very high	94.3	Very high	83 Å²	83	53.9 Å²	53.9	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.4	-70.5	169.8	0	0	0	112.1	R400 S401 L402 G406 R447 E448 A451	R400-L404 WeakPolarHBondContact O-CG 3.49Å; R400-L404 PolarHBondContact O-N 3.33Å; R400-L404 VanDerWaalsContact O-N 3.17Å; S401-L404 PolarHBondContact O-N 2.82Å; L402-L404 VanDerWaalsContact C-N 3.33Å; L404-G406 VanDerWaalsContact C-N 3.27Å; L404-G406 PolarHBondContact O-N 3.23Å; L404-R447 VanDerWaalsContact O-CD 3.29Å; L404-R447 WeakPolarHBondContact O-CD 3.25Å; L404-E448 HydrophobicContact CD2-CG 4.35Å; L404-A451 HydrophobicContact CD2-CB 3.74Å; L404-A451 HydrophobicContact CG-CB 3.89Å
405	N	94.1	Very high	94.2	Very high	64 Å²	64	46.9 Å²	46.9	34%	0.342	24%	0.24	S	C	.	.	H	α-helix	trans	-61.7	-35.6	175.1	-74.9	-10.9	0	0	0	112.6	S401 L402 N409 P411	S401-N405 PolarHBondContact O-N 3.19Å; S401-N405 VanDerWaalsContact O-N 3.08Å; L402-N405 PolarHBondContact O-N 3.09Å; N405-N409 HydrophobicContact CB-CB 4.41Å; N405-P411 WeakPolarHBondContact CB-O 3.39Å; N405-P411 PolarHBondContact ND2-O 2.95Å
406	G	92.5	Very high	94.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	-163.9	177.7	0	0	0	0	0	114.1	L402 V403 L404 G412 A413	L402-G406 PolarHBondContact O-N 2.94Å; L402-G406 VanDerWaalsContact O-N 3.12Å; V403-G406 PolarHBondContact O-N 3.49Å; L404-G406 VanDerWaalsContact C-N 3.27Å; L404-G406 PolarHBondContact O-N 3.23Å; G406-G412 VanDerWaalsContact O-CA 3.32Å; G406-G412 WeakPolarHBondContact O-CA 3.48Å; G406-A413 CarbonylContact C-O 3.56Å; G406-A413 PolarHBondContact O-N 3.39Å
407	P	93.2	Very high	94	Very high	11 Å²	11	45.1 Å²	45.1	7%	0.071	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-24	-168.7	27.4	-33.9	0	0	0	114.5	M414 L441 H463	P407-M414 HydrophobicContact CB-CG 4.17Å; P407-M414 HydrophobicContact CB-SD 3.59Å; P407-M414 VanDerWaalsContact CB-SD 3.59Å; P407-L441 WeakPolarHBondContact CD-O 3.41Å; P407-H463 PolarHBondContact O-CE1 3.24Å; P407-H463 PolarHBondContact O-NE2 3.22Å
408	N	91.6	Very high	93.7	Very high	115 Å²	115	42.2 Å²	42.2	62%	0.615	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-32.5	-173.3	-68.6	-24.2	0	0	0	113.1	K383	K383-N408 WeakPolarHBondContact CE-O 3.43Å; K383-N408 PolarHBondContact NZ-O 3.29Å
409	N	92.3	Very high	92.9	Very high	101 Å²	101	43.6 Å²	43.6	54%	0.54	22%	0.218	S	C	.	.	S	Bend	trans	-95	128.2	-179.3	-70.3	-17.8	0	0	0	109.9	N405 P411 G412	N405-N409 HydrophobicContact CB-CB 4.41Å; N409-P411 CarbonylContact O-C 3.52Å; N409-G412 PolarHBondContact O-N 3.22Å
410	Y	93.8	Very high	91.9	Very high	64 Å²	64	45.1 Å²	45.1	25%	0.251	23%	0.226	S	C	.	.	S	Bend	trans	-96.8	135.9	176.5	-178.9	-90	0	0	0	109.9	V379 A382 K383 H463 L464 V490	V379-Y410 HydrophobicContact CG1-CG 4.41Å; A382-Y410 HydrophobicContact CB-CE2 3.99Å; K383-Y410 HydrophobicContact CG-CD2 4.38Å; Y410-H463 HydrophobicContact CD2-CB 4.21Å; Y410-H463 HydrophobicContact CE2-CB 4.16Å; Y410-L464 WeakPolarHBondContact CE2-O 3.49Å; Y410-L464 PolarHBondContact OH-O 3.26Å; Y410-V490 HydrophobicContact CE1-CB 4.16Å; Y410-V490 HydrophobicContact CE1-CG1 3.9Å; Y410-V490 HydrophobicContact CE2-CG1 4.18Å; Y410-V490 WeakPolarHBondContact OH-CB 3.31Å; Y410-V490 WeakPolarHBondContact OH-CG2 3.3Å
411	P	95.4	Very high	90.9	Very high	49 Å²	49	48.2 Å²	48.2	32%	0.318	24%	0.237	S	C	.	.	S	Bend	cis	-77	146.6	-7.6	31.9	-34.9	0	0	0	112.1	L402 N405 N409 L465	L402-P411 HydrophobicContact CD2-CB 3.72Å; L402-P411 HydrophobicContact CD2-CG 3.99Å; N405-P411 WeakPolarHBondContact CB-O 3.39Å; N405-P411 PolarHBondContact ND2-O 2.95Å; N409-P411 CarbonylContact O-C 3.52Å; P411-L465 HydrophobicContact CB-CD2 3.41Å; P411-L465 VanDerWaalsContact CB-CD2 3.41Å; P411-L465 HydrophobicContact CG-CD2 4.48Å
412	G	95.2	Very high	89.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.247	C	C	.	.			trans	-159.9	-164.7	-173.3	0	0	0	0	0	112.9	L402 G406 N409 H463	L402-G412 CarbonylContact O-C 3.41Å; L402-G412 WeakPolarHBondContact O-CA 3.04Å; G406-G412 VanDerWaalsContact O-CA 3.32Å; G406-G412 WeakPolarHBondContact O-CA 3.48Å; N409-G412 PolarHBondContact O-N 3.22Å; G412-H463 PolarHBondContact N-ND1 3.33Å; G412-H463 PolarHBondContact O-N 3.41Å
413	A	94.8	Very high	88.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147.9	-180	0	0	0	0	0	112.9	L402 V403 G406 L441 V460 R462	L402-A413 PolarHBondContact O-N 3.32Å; V403-A413 HydrophobicContact CG2-CB 4.48Å; G406-A413 CarbonylContact C-O 3.56Å; G406-A413 PolarHBondContact O-N 3.39Å; A413-L441 HydrophobicContact CB-CD1 3.78Å; A413-L441 WeakPolarHBondContact O-CD1 3.42Å; A413-V460 HydrophobicContact CB-CG1 3.76Å; A413-R462 HydrophobicContact CB-CB 4.49Å
414	M	92.7	Very high	87.5	Confident	41 Å²	41	64.3 Å²	64.3	20%	0.202	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-49.9	-178.1	-79.6	-90.4	-74.4	0	0	112.4	T386 P407 F440 L441 E461	T386-M414 HydrophobicContact CG2-CB 3.97Å; T386-M414 HydrophobicContact CG2-CG 3.83Å; P407-M414 HydrophobicContact CB-CG 4.17Å; P407-M414 HydrophobicContact CB-SD 3.59Å; P407-M414 VanDerWaalsContact CB-SD 3.59Å; M414-F440 HydrophobicContact CE-CE2 4.26Å; M414-F440 VanDerWaalsContact O-CD2 3.25Å; M414-F440 WeakPolarHBondContact O-CD2 3.31Å; M414-F440 HydrophobicContact SD-CE2 3.99Å; M414-L441 WeakPolarHBondContact O-CB 3.41Å; M414-L441 PolarHBondContact O-N 3.09Å; M414-E461 PolarHBondContact N-O 2.92Å
415	F	93.5	Very high	86.4	Confident	55 Å²	55	64 Å²	64	24%	0.241	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	152.7	-175.5	-57.2	-85	0	0	0	111.8	K438 R439 F440 E461	F415-K438 HydrophobicContact CB-CG 4.14Å; F415-K438 HydrophobicContact CD1-CG 4.3Å; F415-K438 HydrophobicContact CG-CG 4.45Å; F415-R439 VanDerWaalsContact CA-O 3.3Å; F415-R439 WeakPolarHBondContact CA-O 3.5Å; F415-F440 HydrophobicContact CD1-CB 3.91Å; F415-F440 AromaticContact CD1-CD2 3.73Å; F415-F440 HydrophobicContact CD1-CD2 3.73Å; F415-F440 HydrophobicContact CD1-CG 4.26Å; F415-F440 HydrophobicContact CE1-CB 3.74Å; F415-F440 AromaticContact CE1-CD2 3.3Å; F415-F440 HydrophobicContact CE1-CD2 3.3Å; F415-F440 HydrophobicContact CE1-CE2 4.17Å; F415-F440 AromaticContact CE1-CG 3.79Å; F415-F440 HydrophobicContact CE1-CG 3.79Å; F415-F440 HydrophobicContact CE2-CD2 4.43Å; F415-F440 HydrophobicContact CG-CD2 4.45Å; F415-F440 AromaticContact CZ-CD2 3.69Å; F415-F440 HydrophobicContact CZ-CD2 3.69Å; F415-F440 HydrophobicContact CZ-CE2 4.1Å; F415-F440 HydrophobicContact CZ-CG 4.48Å; F415-E461 HydrophobicContact CB-CB 4.15Å; F415-E461 HydrophobicContact CB-CG 4.48Å; F415-E461 WeakPolarHBondContact CD2-OE2 3.3Å; F415-E461 PolarHBondContact O-N 3Å
416	V	92.8	Very high	85.1	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.4	166.2	-178.3	0	0	0	0	108.9	V403 Y418 R439 L441 V450 L454 I459 V460	V403-V416 HydrophobicContact CG2-CG2 3.92Å; V416-Y418 HydrophobicContact CG1-CD1 4.3Å; V416-R439 PolarHBondContact N-O 3.13Å; V416-R439 PolarHBondContact O-N 2.85Å; V416-L441 HydrophobicContact CG2-CD1 3.94Å; V416-L441 HydrophobicContact CG2-CD2 4.22Å; V416-L441 HydrophobicContact CG2-CG 4.33Å; V416-V450 HydrophobicContact CB-CG1 3.77Å; V416-V450 HydrophobicContact CG1-CG1 3.79Å; V416-V450 HydrophobicContact CG2-CG1 3.69Å; V416-L454 HydrophobicContact CG1-CD1 3.95Å; V416-I459 CarbonylContact C-O 3.46Å; V416-I459 WeakPolarHBondContact CA-O 3.46Å; V416-V460 HydrophobicContact CG1-CG2 4.33Å; V416-V460 HydrophobicContact CG2-CG1 4.39Å; V416-V460 HydrophobicContact CG2-CG2 4.15Å
417	S	92.2	Very high	83.9	Confident	15 Å²	15	76.5 Å²	76.5	11%	0.105	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119	174.3	-54.2	0	0	0	0	109	V437 I459	S417-V437 WeakPolarHBondContact CA-O 3.48Å; S417-I459 PolarHBondContact N-O 3.32Å; S417-I459 PolarHBondContact O-N 3.17Å
418	Y	87.1	Confident	82.6	Confident	58 Å²	58	76.4 Å²	76.4	23%	0.227	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	154.5	178.3	59.1	-87.7	0	0	0	110.1	V416 V437 R439 D458	V416-Y418 HydrophobicContact CG1-CD1 4.3Å; Y418-V437 HydrophobicContact CE1-CB 4.49Å; Y418-V437 HydrophobicContact CE1-CG1 4.29Å; Y418-V437 HydrophobicContact CE2-CB 4.19Å; Y418-V437 HydrophobicContact CE2-CG1 4.49Å; Y418-V437 PolarHBondContact N-O 3.29Å; Y418-V437 VanDerWaalsContact N-O 3.08Å; Y418-V437 PolarHBondContact O-N 3.2Å; Y418-R439 HydrophobicContact CE1-CB 4.15Å; Y418-D458 VanDerWaalsContact CB-OD1 3.31Å; Y418-D458 WeakPolarHBondContact CB-OD1 3.43Å
419	K	80.2	Confident	81.4	Confident	125 Å²	125	76.1 Å²	76.1	54%	0.543	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	135.4	177.6	-72	-170.3	174.6	-159.2	0	111	D435 V436	K419-D435 WeakPolarHBondContact CA-O 3.32Å; K419-D435 IonicContact NZ-OD2 3.63Å; K419-V436 HydrophobicContact CG-CG2 4.22Å
420	L	74.7	Confident	80.1	Confident	33 Å²	33	75.7 Å²	75.7	17%	0.173	36%	0.363	C	S	.	.			trans	-61.6	144.6	168.5	-70.4	167.7	0	0	0	109.8	R424 K425 A428 D435 V437	L420-R424 HydrophobicContact CB-CB 4.36Å; L420-R424 HydrophobicContact CD2-CB 4.1Å; L420-K425 HydrophobicContact CB-CB 4.38Å; L420-K425 WeakPolarHBondContact O-CB 3.4Å; L420-A428 HydrophobicContact CD1-CB 4.15Å; L420-D435 PolarHBondContact N-O 3.37Å; L420-V437 HydrophobicContact CD1-CG2 3.74Å; L420-V437 HydrophobicContact CD2-CG2 3.88Å; L420-V437 HydrophobicContact CG-CG2 3.65Å
421	R	72.2	Confident	78.6	Confident	143 Å²	143	76.3 Å²	76.3	54%	0.54	38%	0.377	S	S	.	.			trans	-126.6	155.9	-178.1	-56.9	-172.2	-174.5	-167.3	7.9	110.8
422	G	75.7	Confident	77.1	Confident	56 Å²	56	77.3 Å²	77.3	58%	0.577	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	-140.6	177.6	0	0	0	0	0	113.6	R424 K425 R426	G422-R424 VanDerWaalsContact C-N 3.29Å; G422-R424 PolarHBondContact O-N 3.11Å; G422-K425 WeakPolarHBondContact O-CB 3.5Å; G422-K425 PolarHBondContact O-N 3.17Å; G422-R426 PolarHBondContact O-N 3.42Å
423	E	69.3	Low	75.6	Confident	159 Å²	159	82.7 Å²	82.7	74%	0.743	43%	0.425	S	S	*	.	H	α-helix	trans	-59	-36	-179.3	-82.8	-174.8	147.7	0	0	113.5	K425 R426 Q427	E423-K425 PolarHBondContact O-N 2.52Å; E423-R426 PolarHBondContact O-N 3.17Å; E423-R426 VanDerWaalsContact O-N 3.13Å; E423-Q427 PolarHBondContact O-N 2.73Å
424	R	70.3	Confident	74.3	Confident	178 Å²	178	86.6 Å²	86.6	67%	0.672	45%	0.452	S	S	*	.	H	α-helix	trans	-62.6	-34	179.6	-70.7	-173.3	-179.2	171.9	1	112.5	L420 G422 A428	L420-R424 HydrophobicContact CB-CB 4.36Å; L420-R424 HydrophobicContact CD2-CB 4.1Å; G422-R424 VanDerWaalsContact C-N 3.29Å; G422-R424 PolarHBondContact O-N 3.11Å; R424-A428 WeakPolarHBondContact O-CB 3.37Å; R424-A428 PolarHBondContact O-N 2.82Å
425	K	71.2	Confident	73.4	Confident	78 Å²	78	86.3 Å²	86.3	34%	0.339	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-49.6	173.4	-175.5	-179.6	166.9	-177.7	0	110.6	L420 G422 E423 Q427 A428 E429 D435	L420-K425 HydrophobicContact CB-CB 4.38Å; L420-K425 WeakPolarHBondContact O-CB 3.4Å; G422-K425 WeakPolarHBondContact O-CB 3.5Å; G422-K425 PolarHBondContact O-N 3.17Å; E423-K425 PolarHBondContact O-N 2.52Å; K425-Q427 VanDerWaalsContact C-N 3.28Å; K425-Q427 PolarHBondContact O-N 2.94Å; K425-A428 PolarHBondContact O-N 3.14Å; K425-E429 WeakPolarHBondContact CE-OE1 3.2Å; K425-E429 HydrophobicContact CG-CG 4.46Å; K425-E429 IonicContact NZ-OE1 3.56Å; K425-E429 WeakPolarHBondContact O-CG 3.5Å; K425-E429 PolarHBondContact O-N 3.11Å; K425-D435 HydrophobicContact CG-CB 4.36Å
426	R	66.4	Low	72.8	Confident	194 Å²	194	86.6 Å²	86.6	73%	0.732	46%	0.457	S	S	*	.	H	α-helix	trans	-60.1	-38.7	178.8	-70.7	-174.4	-172.9	176.9	2.7	112	G422 E423 A430	G422-R426 PolarHBondContact O-N 3.42Å; E423-R426 PolarHBondContact O-N 3.17Å; E423-R426 VanDerWaalsContact O-N 3.13Å; R426-A430 WeakPolarHBondContact O-CB 3.31Å; R426-A430 PolarHBondContact O-N 3.29Å
427	Q	67	Low	72.3	Confident	132 Å²	132	88.8 Å²	88.8	62%	0.617	47%	0.47	S	S	*	.	H	α-helix	trans	-66.5	-44.2	175.1	-81.6	-178.3	-11	0	0	112.4	E423 K425 A430 S431	E423-Q427 PolarHBondContact O-N 2.73Å; K425-Q427 VanDerWaalsContact C-N 3.28Å; K425-Q427 PolarHBondContact O-N 2.94Å; Q427-A430 PolarHBondContact O-N 3.14Å; Q427-S431 WeakPolarHBondContact O-CB 3.44Å; Q427-S431 PolarHBondContact O-N 3.01Å; Q427-S431 PolarHBondContact O-OG 3.17Å
428	A	65.4	Low	72	Confident	9 Å²	9	93.3 Å²	93.3	7%	0.074	49%	0.488	C	S	.	.	H	α-helix	trans	-61	-47.5	176.8	0	0	0	0	0	111.2	L420 R424 K425 A430 S431 G432 N433	L420-A428 HydrophobicContact CD1-CB 4.15Å; R424-A428 WeakPolarHBondContact O-CB 3.37Å; R424-A428 PolarHBondContact O-N 2.82Å; K425-A428 PolarHBondContact O-N 3.14Å; A428-A430 PolarHBondContact O-N 3.1Å; A428-S431 CarbonylContact O-C 3.5Å; A428-S431 PolarHBondContact O-N 2.87Å; A428-S431 PolarHBondContact O-OG 3.24Å; A428-G432 PolarHBondContact O-N 2.66Å; A428-N433 CarbonylContact C-O 3.51Å; A428-N433 PolarHBondContact O-N 3.46Å
429	E	66.5	Low	72	Confident	108 Å²	108	95.2 Å²	95.2	51%	0.505	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-41.9	176.1	-71.6	175	158.5	0	0	112	K425 S431 G432	K425-E429 WeakPolarHBondContact CE-OE1 3.2Å; K425-E429 HydrophobicContact CG-CG 4.46Å; K425-E429 IonicContact NZ-OE1 3.56Å; K425-E429 WeakPolarHBondContact O-CG 3.5Å; K425-E429 PolarHBondContact O-N 3.11Å; E429-S431 VanDerWaalsContact C-N 3.29Å; E429-S431 PolarHBondContact O-N 3.38Å; E429-G432 PolarHBondContact O-N 2.98Å
430	A	65.9	Low	72.4	Confident	92 Å²	92	94.1 Å²	94.1	76%	0.76	49%	0.49	S	S	*	.	H	α-helix	trans	-67.3	-27.4	177.8	0	0	0	0	0	113.5	R426 Q427 A428	R426-A430 WeakPolarHBondContact O-CB 3.31Å; R426-A430 PolarHBondContact O-N 3.29Å; Q427-A430 PolarHBondContact O-N 3.14Å; A428-A430 PolarHBondContact O-N 3.1Å
431	S	62.6	Low	73	Confident	78 Å²	78	92.5 Å²	92.5	55%	0.545	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.3	177.7	47.3	0	0	0	0	113.7	Q427 A428 E429 N433	Q427-S431 WeakPolarHBondContact O-CB 3.44Å; Q427-S431 PolarHBondContact O-N 3.01Å; Q427-S431 PolarHBondContact O-OG 3.17Å; A428-S431 CarbonylContact O-C 3.5Å; A428-S431 PolarHBondContact O-N 2.87Å; A428-S431 PolarHBondContact O-OG 3.24Å; E429-S431 VanDerWaalsContact C-N 3.29Å; E429-S431 PolarHBondContact O-N 3.38Å; S431-N433 PolarHBondContact O-N 3.2Å
432	G	63.2	Low	73.5	Confident	69 Å²	69	88 Å²	88	71%	0.711	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	10.7	-178.8	0	0	0	0	0	114.4	A428 E429	A428-G432 PolarHBondContact O-N 2.66Å; E429-G432 PolarHBondContact O-N 2.98Å
433	N	63.7	Low	74	Confident	114 Å²	114	88.7 Å²	88.7	61%	0.61	47%	0.471	S	S	*	.			trans	-86.5	148.1	177.4	-83.7	-23.3	0	0	0	111.2	A428 S431 D435	A428-N433 CarbonylContact C-O 3.51Å; A428-N433 PolarHBondContact O-N 3.46Å; S431-N433 PolarHBondContact O-N 3.2Å; N433-D435 PolarHBondContact O-N 3.5Å
434	S	67.9	Low	74.7	Confident	81 Å²	81	87.5 Å²	87.5	57%	0.566	47%	0.466	S	S	*	.			trans	-52.4	132.4	174.8	161.3	0	0	0	0	111.8	V436	S434-V436 PolarHBondContact O-N 2.85Å; S434-V436 PolarHBondContact OG-N 3.35Å; S434-V436 PolarHBondContact OG-O 2.85Å
435	D	74.6	Confident	75.5	Confident	35 Å²	35	88.5 Å²	88.5	19%	0.187	47%	0.47	C	S	.	.	S	Bend	trans	-73.3	-11.3	172.4	67.5	-29.8	0	0	0	112.7	K419 L420 K425 N433	K419-D435 WeakPolarHBondContact CA-O 3.32Å; K419-D435 IonicContact NZ-OD2 3.63Å; L420-D435 PolarHBondContact N-O 3.37Å; K425-D435 HydrophobicContact CG-CB 4.36Å; N433-D435 PolarHBondContact O-N 3.5Å
436	V	79.5	Confident	76.1	Confident	61 Å²	61	85.3 Å²	85.3	37%	0.37	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.5	176.2	-175.4	0	0	0	0	110.1	K419 S434	K419-V436 HydrophobicContact CG-CG2 4.22Å; S434-V436 PolarHBondContact O-N 2.85Å; S434-V436 PolarHBondContact OG-N 3.35Å; S434-V436 PolarHBondContact OG-O 2.85Å
437	V	82.1	Confident	77.2	Confident	46 Å²	46	77.9 Å²	77.9	28%	0.279	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.8	173.2	175.5	0	0	0	0	108.9	S417 Y418 L420	S417-V437 WeakPolarHBondContact CA-O 3.48Å; Y418-V437 HydrophobicContact CE1-CB 4.49Å; Y418-V437 HydrophobicContact CE1-CG1 4.29Å; Y418-V437 HydrophobicContact CE2-CB 4.19Å; Y418-V437 HydrophobicContact CE2-CG1 4.49Å; Y418-V437 PolarHBondContact N-O 3.29Å; Y418-V437 VanDerWaalsContact N-O 3.08Å; Y418-V437 PolarHBondContact O-N 3.2Å; L420-V437 HydrophobicContact CD1-CG2 3.74Å; L420-V437 HydrophobicContact CD2-CG2 3.88Å; L420-V437 HydrophobicContact CG-CG2 3.65Å
438	K	86.4	Confident	78.4	Confident	111 Å²	111	77 Å²	77	48%	0.483	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	115	174.1	-170.8	165.9	177.1	168.9	0	109.6	F415 E461	F415-K438 HydrophobicContact CB-CG 4.14Å; F415-K438 HydrophobicContact CD1-CG 4.3Å; F415-K438 HydrophobicContact CG-CG 4.45Å; K438-E461 VanDerWaalsContact CE-OE1 3.25Å; K438-E461 WeakPolarHBondContact CE-OE1 3.21Å; K438-E461 VanDerWaalsContact CE-OE2 3.24Å; K438-E461 WeakPolarHBondContact CE-OE2 3.45Å; K438-E461 IonicContact NZ-OE1 3.69Å; K438-E461 PolarHBondContact NZ-OE1 3.38Å; K438-E461 IonicContact NZ-OE2 2.75Å; K438-E461 PolarHBondContact NZ-OE2 3.26Å
439	R	86.8	Confident	79.4	Confident	97 Å²	97	79.6 Å²	79.6	37%	0.366	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	131.9	-174.4	-149.4	175.3	-168.8	-178.6	-3.8	110.4	F415 V416 Y418	F415-R439 VanDerWaalsContact CA-O 3.3Å; F415-R439 WeakPolarHBondContact CA-O 3.5Å; V416-R439 PolarHBondContact N-O 3.13Å; V416-R439 PolarHBondContact O-N 2.85Å; Y418-R439 HydrophobicContact CE1-CB 4.15Å
440	F	90.2	Very high	80.4	Confident	102 Å²	102	74.9 Å²	74.9	45%	0.447	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	134.8	177.2	-175	-135.1	0	0	0	111.3	M414 F415 A442	M414-F440 HydrophobicContact CE-CE2 4.26Å; M414-F440 VanDerWaalsContact O-CD2 3.25Å; M414-F440 WeakPolarHBondContact O-CD2 3.31Å; M414-F440 HydrophobicContact SD-CE2 3.99Å; F415-F440 HydrophobicContact CD1-CB 3.91Å; F415-F440 AromaticContact CD1-CD2 3.73Å; F415-F440 HydrophobicContact CD1-CD2 3.73Å; F415-F440 HydrophobicContact CD1-CG 4.26Å; F415-F440 HydrophobicContact CE1-CB 3.74Å; F415-F440 AromaticContact CE1-CD2 3.3Å; F415-F440 HydrophobicContact CE1-CD2 3.3Å; F415-F440 HydrophobicContact CE1-CE2 4.17Å; F415-F440 AromaticContact CE1-CG 3.79Å; F415-F440 HydrophobicContact CE1-CG 3.79Å; F415-F440 HydrophobicContact CE2-CD2 4.43Å; F415-F440 HydrophobicContact CG-CD2 4.45Å; F415-F440 AromaticContact CZ-CD2 3.69Å; F415-F440 HydrophobicContact CZ-CD2 3.69Å; F415-F440 HydrophobicContact CZ-CE2 4.1Å; F415-F440 HydrophobicContact CZ-CG 4.48Å; F440-A442 HydrophobicContact CD1-CB 3.66Å; F440-A442 HydrophobicContact CE1-CB 3.4Å; F440-A442 HydrophobicContact CZ-CB 4.04Å; F440-A442 PolarHBondContact O-N 3.26Å
441	L	86.4	Confident	81.5	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.382	C	S	.	.			trans	-91.6	24.3	-170.9	-66.6	176.9	0	0	0	114.7	V403 P407 A413 M414 V416 R447 V450	V403-L441 HydrophobicContact CB-CD1 4.38Å; V403-L441 HydrophobicContact CG1-CD1 4.02Å; V403-L441 HydrophobicContact CG1-CD2 3.92Å; V403-L441 HydrophobicContact CG2-CD1 4.28Å; P407-L441 WeakPolarHBondContact CD-O 3.41Å; A413-L441 HydrophobicContact CB-CD1 3.78Å; A413-L441 WeakPolarHBondContact O-CD1 3.42Å; M414-L441 WeakPolarHBondContact O-CB 3.41Å; M414-L441 PolarHBondContact O-N 3.09Å; V416-L441 HydrophobicContact CG2-CD1 3.94Å; V416-L441 HydrophobicContact CG2-CD2 4.22Å; V416-L441 HydrophobicContact CG2-CG 4.33Å; L441-R447 HydrophobicContact CB-CG 4.16Å; L441-R447 HydrophobicContact CD2-CG 4.32Å; L441-R447 WeakPolarHBondContact O-CG 3.38Å; L441-R447 PolarHBondContact O-NE 3.3Å; L441-V450 HydrophobicContact CD2-CB 4.31Å; L441-V450 HydrophobicContact CD2-CG1 4.45Å; L441-V450 HydrophobicContact CD2-CG2 4.42Å
442	A	83.4	Confident	82.7	Confident	49 Å²	49	74.6 Å²	74.6	41%	0.405	39%	0.389	S	S	.	.			trans	-63.7	-44.6	-176.7	0	0	0	0	0	113.9	F440 R447	F440-A442 HydrophobicContact CD1-CB 3.66Å; F440-A442 HydrophobicContact CE1-CB 3.4Å; F440-A442 HydrophobicContact CZ-CB 4.04Å; F440-A442 PolarHBondContact O-N 3.26Å; A442-R447 PolarHBondContact O-NH2 3.11Å
443	S	86.1	Confident	83.9	Confident	69 Å²	69	78.9 Å²	78.9	48%	0.483	39%	0.385	S	S	.	.	S	Bend	trans	-86.2	138.8	-178.2	58.6	0	0	0	0	111.9	R445 A446 R447	S443-R445 VanDerWaalsContact C-N 3.33Å; S443-R445 PolarHBondContact O-N 2.77Å; S443-A446 WeakPolarHBondContact O-CB 3.44Å; S443-A446 PolarHBondContact O-N 2.83Å; S443-A446 VanDerWaalsContact O-N 3.09Å; S443-A446 WeakPolarHBondContact OG-CB 3.25Å; S443-R447 WeakPolarHBondContact O-CG 3.42Å; S443-R447 PolarHBondContact O-N 3.35Å
444	E	84.1	Confident	85.1	Confident	135 Å²	135	73.8 Å²	73.8	63%	0.631	36%	0.357	S	S	*	.	H	α-helix	trans	-57.7	-44.7	-178.6	-170.6	167.9	-151.2	0	0	112.3	A446 R447 E448	E444-A446 VanDerWaalsContact C-N 3.27Å; E444-A446 PolarHBondContact O-N 3.42Å; E444-R447 WeakPolarHBondContact O-CA 3.5Å; E444-R447 VanDerWaalsContact O-CB 3.32Å; E444-R447 WeakPolarHBondContact O-CB 3.33Å; E444-R447 PolarHBondContact O-N 2.85Å; E444-E448 PolarHBondContact O-N 3.42Å
445	R	85.7	Confident	86.2	Confident	199 Å²	199	74.1 Å²	74.1	75%	0.751	35%	0.35	S	S	*	.	H	α-helix	trans	-58.2	-37.4	175.6	-159.2	176.5	-171.1	171.2	4.2	113.1	S443 R447 D449	S443-R445 VanDerWaalsContact C-N 3.33Å; S443-R445 PolarHBondContact O-N 2.77Å; R445-R447 VanDerWaalsContact C-N 3.32Å; R445-D449 WeakPolarHBondContact O-CB 3.27Å; R445-D449 PolarHBondContact O-N 3.24Å; R445-D449 VanDerWaalsContact O-N 3.08Å
446	A	83.9	Confident	87	Confident	10 Å²	10	74.8 Å²	74.8	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-68.8	-33.5	176.4	0	0	0	0	0	111.9	S443 E444 V450	S443-A446 WeakPolarHBondContact O-CB 3.44Å; S443-A446 PolarHBondContact O-N 2.83Å; S443-A446 VanDerWaalsContact O-N 3.09Å; S443-A446 WeakPolarHBondContact OG-CB 3.25Å; E444-A446 VanDerWaalsContact C-N 3.27Å; E444-A446 PolarHBondContact O-N 3.42Å; A446-V450 WeakPolarHBondContact O-CB 3.48Å; A446-V450 WeakPolarHBondContact O-CG2 3.33Å; A446-V450 PolarHBondContact O-N 3.11Å
447	R	90.6	Very high	87.5	Confident	39 Å²	39	73.8 Å²	73.8	15%	0.147	36%	0.359	C	S	.	.	H	α-helix	trans	-66.2	-48.4	176.1	-60.1	175.3	-147.2	155.5	11.2	111.1	V403 L404 L441 A442 S443 E444 R445 V450 A451	V403-R447 WeakPolarHBondContact O-CB 3.45Å; V403-R447 WeakPolarHBondContact O-CG 3.21Å; L404-R447 VanDerWaalsContact O-CD 3.29Å; L404-R447 WeakPolarHBondContact O-CD 3.25Å; L441-R447 HydrophobicContact CB-CG 4.16Å; L441-R447 HydrophobicContact CD2-CG 4.32Å; L441-R447 WeakPolarHBondContact O-CG 3.38Å; L441-R447 PolarHBondContact O-NE 3.3Å; A442-R447 PolarHBondContact O-NH2 3.11Å; S443-R447 WeakPolarHBondContact O-CG 3.42Å; S443-R447 PolarHBondContact O-N 3.35Å; E444-R447 WeakPolarHBondContact O-CA 3.5Å; E444-R447 VanDerWaalsContact O-CB 3.32Å; E444-R447 WeakPolarHBondContact O-CB 3.33Å; E444-R447 PolarHBondContact O-N 2.85Å; R445-R447 VanDerWaalsContact C-N 3.32Å; R447-V450 PolarHBondContact O-N 3.24Å; R447-A451 WeakPolarHBondContact O-CB 3.4Å; R447-A451 PolarHBondContact O-N 3.15Å
448	E	91	Very high	88	Confident	113 Å²	113	72.2 Å²	72.2	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-47.2	178.7	-68.2	-177.3	157.9	0	0	112	L404 E444 A451 K452	L404-E448 HydrophobicContact CD2-CG 4.35Å; E444-E448 PolarHBondContact O-N 3.42Å; E448-A451 PolarHBondContact O-N 2.85Å; E448-K452 WeakPolarHBondContact O-CB 3.5Å; E448-K452 PolarHBondContact O-N 2.99Å
449	D	87.6	Confident	88.5	Confident	64 Å²	64	69.6 Å²	69.6	34%	0.342	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-52.4	177.9	-86.9	-12.8	0	0	0	110.9	R445 A451 K452 Y453	R445-D449 WeakPolarHBondContact O-CB 3.27Å; R445-D449 PolarHBondContact O-N 3.24Å; R445-D449 VanDerWaalsContact O-N 3.08Å; D449-A451 PolarHBondContact O-N 3.36Å; D449-K452 PolarHBondContact O-N 3.48Å; D449-Y453 WeakPolarHBondContact O-CD2 3.28Å; D449-Y453 PolarHBondContact O-N 2.88Å
450	V	87.5	Confident	88.9	Confident	9 Å²	9	65 Å²	65	6%	0.055	32%	0.323	C	S	.	.	H	α-helix	trans	-65.1	-41.1	-178.1	174.5	0	0	0	0	111.1	V403 V416 L441 A446 R447 K452 Y453 L454	V403-V450 HydrophobicContact CG1-CB 4.34Å; V403-V450 HydrophobicContact CG1-CG1 4.18Å; V416-V450 HydrophobicContact CB-CG1 3.77Å; V416-V450 HydrophobicContact CG1-CG1 3.79Å; V416-V450 HydrophobicContact CG2-CG1 3.69Å; L441-V450 HydrophobicContact CD2-CB 4.31Å; L441-V450 HydrophobicContact CD2-CG1 4.45Å; L441-V450 HydrophobicContact CD2-CG2 4.42Å; A446-V450 WeakPolarHBondContact O-CB 3.48Å; A446-V450 WeakPolarHBondContact O-CG2 3.33Å; A446-V450 PolarHBondContact O-N 3.11Å; R447-V450 PolarHBondContact O-N 3.24Å; V450-K452 VanDerWaalsContact C-N 3.29Å; V450-K452 PolarHBondContact O-N 3.22Å; V450-Y453 PolarHBondContact O-N 3.11Å; V450-L454 HydrophobicContact CG1-CD1 4.36Å; V450-L454 PolarHBondContact O-N 3.02Å
451	A	88.5	Confident	89.1	Confident	4 Å²	4	61.2 Å²	61.2	3%	0.033	31%	0.306	C	S	.	.	H	α-helix	trans	-60.6	-38.6	177.5	0	0	0	0	0	112.3	R400 V403 L404 R447 E448 D449	R400-A451 HydrophobicContact CG-CB 3.92Å; R400-A451 PolarHBondContact NE-O 2.75Å; V403-A451 HydrophobicContact CG1-CB 4.08Å; L404-A451 HydrophobicContact CD2-CB 3.74Å; L404-A451 HydrophobicContact CG-CB 3.89Å; R447-A451 WeakPolarHBondContact O-CB 3.4Å; R447-A451 PolarHBondContact O-N 3.15Å; E448-A451 PolarHBondContact O-N 2.85Å; D449-A451 PolarHBondContact O-N 3.36Å
452	K	88.4	Confident	89.6	Confident	159 Å²	159	61.5 Å²	61.5	69%	0.691	31%	0.308	S	S	*	.	H	α-helix	trans	-68.6	-37	179.6	-164.3	174.3	-175.1	176.9	0	112.6	E448 D449 V450	E448-K452 WeakPolarHBondContact O-CB 3.5Å; E448-K452 PolarHBondContact O-N 2.99Å; D449-K452 PolarHBondContact O-N 3.48Å; V450-K452 VanDerWaalsContact C-N 3.29Å; V450-K452 PolarHBondContact O-N 3.22Å
453	Y	87.7	Confident	90.3	Very high	160 Å²	160	59.2 Å²	59.2	63%	0.627	29%	0.288	S	S	*	.	H	α-helix	trans	-98.7	6	-178.6	-60.7	-67.8	0	0	0	114.6	D449 V450 Q455	D449-Y453 WeakPolarHBondContact O-CD2 3.28Å; D449-Y453 PolarHBondContact O-N 2.88Å; V450-Y453 PolarHBondContact O-N 3.11Å; Y453-Q455 PolarHBondContact O-N 3.14Å
454	L	90	Very high	90.8	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.031	27%	0.265	C	S	.	.			trans	-62.2	130.1	178.8	-158.4	79.8	0	0	0	110.8	V391 L399 R400 V416 V450 V460	V391-L454 HydrophobicContact CG1-CD2 4.32Å; V391-L454 HydrophobicContact CG1-CG 4.48Å; V391-L454 HydrophobicContact CG2-CD1 4.29Å; V391-L454 HydrophobicContact CG2-CD2 3.98Å; V391-L454 HydrophobicContact CG2-CG 4.07Å; L399-L454 HydrophobicContact CB-CD2 4.3Å; R400-L454 HydrophobicContact CB-CD2 4.47Å; V416-L454 HydrophobicContact CG1-CD1 3.95Å; V450-L454 HydrophobicContact CG1-CD1 4.36Å; V450-L454 PolarHBondContact O-N 3.02Å; L454-V460 HydrophobicContact CD1-CG2 3.89Å; L454-V460 HydrophobicContact CD2-CG2 4.35Å
455	Q	90.5	Very high	91.4	Very high	88 Å²	88	50.5 Å²	50.5	41%	0.411	24%	0.241	S	C	.	.			trans	-135.8	161.9	-179.2	-65.8	-175.7	13.2	0	0	112.4	V391 Y453 G457 D458	V391-Q455 WeakPolarHBondContact CB-O 3.47Å; V391-Q455 WeakPolarHBondContact CG1-O 3.38Å; Y453-Q455 PolarHBondContact O-N 3.14Å; Q455-G457 PolarHBondContact O-N 3.09Å; Q455-D458 PolarHBondContact N-OD2 3.06Å; Q455-D458 WeakPolarHBondContact O-CB 3.28Å; Q455-D458 PolarHBondContact O-N 3.38Å
456	S	91.8	Very high	91.8	Very high	50 Å²	50	45.2 Å²	45.2	35%	0.35	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	130.5	175.1	-58.2	0	0	0	0	111.1	V391 D393	V391-S456 WeakPolarHBondContact O-CA 3.27Å; D393-S456 PolarHBondContact OD1-OG 2.97Å
457	G	90.1	Very high	92.3	Very high	39 Å²	39	49.6 Å²	49.6	40%	0.402	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.4	-19.1	-174	0	0	0	0	0	115.1	V391 Q455	V391-G457 PolarHBondContact O-N 3.26Å; Q455-G457 PolarHBondContact O-N 3.09Å
458	D	92.6	Very high	92.6	Very high	14 Å²	14	48 Å²	48	8%	0.075	24%	0.244	C	C	.	.			trans	-68.6	161.4	172.2	-62.1	-26.7	0	0	0	110.8	R390 V391 Y418 Q455	R390-D458 WeakPolarHBondContact CA-O 3.28Å; V391-D458 HydrophobicContact CG2-CB 4.1Å; V391-D458 WeakPolarHBondContact CG2-O 3.47Å; V391-D458 PolarHBondContact N-O 3.2Å; Y418-D458 VanDerWaalsContact CB-OD1 3.31Å; Y418-D458 WeakPolarHBondContact CB-OD1 3.43Å; Q455-D458 PolarHBondContact N-OD2 3.06Å; Q455-D458 WeakPolarHBondContact O-CB 3.28Å; Q455-D458 PolarHBondContact O-N 3.38Å
459	I	95	Very high	92.9	Very high	56 Å²	56	43.1 Å²	43.1	29%	0.287	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.7	-179.8	-59.1	173.8	0	0	0	109.2	P388 V416 S417	P388-I459 HydrophobicContact CB-CG2 3.67Å; V416-I459 CarbonylContact C-O 3.46Å; V416-I459 WeakPolarHBondContact CA-O 3.46Å; S417-I459 PolarHBondContact N-O 3.32Å; S417-I459 PolarHBondContact O-N 3.17Å
460	V	95.7	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.9	176.6	178.9	0	0	0	0	108.8	E389 V391 L399 V403 A413 V416 L454 R462	E389-V460 PolarHBondContact N-O 3.25Å; E389-V460 PolarHBondContact O-N 3.42Å; V391-V460 HydrophobicContact CG2-CG2 3.79Å; L399-V460 HydrophobicContact CB-CG2 4.35Å; L399-V460 HydrophobicContact CD1-CB 4.43Å; L399-V460 HydrophobicContact CD1-CG2 4.38Å; L399-V460 HydrophobicContact CD2-CB 4.42Å; V403-V460 HydrophobicContact CG2-CG1 3.84Å; V403-V460 HydrophobicContact CG2-CG2 4.18Å; A413-V460 HydrophobicContact CB-CG1 3.76Å; V416-V460 HydrophobicContact CG1-CG2 4.33Å; V416-V460 HydrophobicContact CG2-CG1 4.39Å; V416-V460 HydrophobicContact CG2-CG2 4.15Å; L454-V460 HydrophobicContact CD1-CG2 3.89Å; L454-V460 HydrophobicContact CD2-CG2 4.35Å; V460-R462 VanDerWaalsContact C-N 3.32Å; V460-R462 PolarHBondContact O-N 3.42Å; V460-R462 VanDerWaalsContact O-N 3.08Å
461	E	95.8	Very high	93.9	Very high	22 Å²	22	41 Å²	41	10%	0.103	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	81.1	172.4	-70.5	178.8	-167.2	0	0	109.1	Y387 P388 M414 F415 K438	Y387-E461 WeakPolarHBondContact O-CA 3.46Å; P388-E461 HydrophobicContact CB-CG 4.21Å; M414-E461 PolarHBondContact N-O 2.92Å; F415-E461 HydrophobicContact CB-CB 4.15Å; F415-E461 HydrophobicContact CB-CG 4.48Å; F415-E461 WeakPolarHBondContact CD2-OE2 3.3Å; F415-E461 PolarHBondContact O-N 3Å; K438-E461 VanDerWaalsContact CE-OE1 3.25Å; K438-E461 WeakPolarHBondContact CE-OE1 3.21Å; K438-E461 VanDerWaalsContact CE-OE2 3.24Å; K438-E461 WeakPolarHBondContact CE-OE2 3.45Å; K438-E461 IonicContact NZ-OE1 3.69Å; K438-E461 PolarHBondContact NZ-OE1 3.38Å; K438-E461 IonicContact NZ-OE2 2.75Å; K438-E461 PolarHBondContact NZ-OE2 3.26Å
462	R	96.1	Very high	94.3	Very high	7 Å²	7	40.9 Å²	40.9	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	157.1	178.2	62.3	162.8	-179.4	80	-4.1	111.5	T386 Y387 E389 L402 A413 V460 D468	T386-R462 CarbonylContact C-O 3.6Å; T386-R462 WeakPolarHBondContact CA-O 3.28Å; T386-R462 WeakPolarHBondContact CB-O 3.33Å; Y387-R462 PolarHBondContact N-O 2.84Å; Y387-R462 PolarHBondContact O-N 3.24Å; Y387-R462 VanDerWaalsContact O-N 3.12Å; E389-R462 HydrophobicContact CB-CG 4.45Å; E389-R462 IonicContact OE2-CZ 2.88Å; E389-R462 VanDerWaalsContact OE2-CZ 3.29Å; E389-R462 IonicContact OE2-NE 3.13Å; E389-R462 PolarHBondContact OE2-NE 2.81Å; E389-R462 IonicContact OE2-NH2 2.67Å; E389-R462 PolarHBondContact OE2-NH2 2.99Å; L402-R462 HydrophobicContact CD1-CB 3.96Å; A413-R462 HydrophobicContact CB-CB 4.49Å; V460-R462 VanDerWaalsContact C-N 3.32Å; V460-R462 PolarHBondContact O-N 3.42Å; V460-R462 VanDerWaalsContact O-N 3.08Å; R462-D468 IonicContact CZ-OD1 3.86Å; R462-D468 IonicContact CZ-OD2 2.8Å; R462-D468 IonicContact NH1-OD1 2.65Å; R462-D468 IonicContact NH1-OD2 3.33Å; R462-D468 PolarHBondContact NH1-OD2 2.6Å; R462-D468 IonicContact NH2-OD1 3.62Å; R462-D468 PolarHBondContact NH2-OD1 3.3Å; R462-D468 IonicContact NH2-OD2 3.25Å
463	H	97.4	Very high	94.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	159.6	168	-61.8	158.4	0	0	0	111.1	A382 K383 P407 Y410 G412 L465	A382-H463 WeakPolarHBondContact O-CB 3.42Å; K383-H463 PolarHBondContact O-CD2 2.96Å; P407-H463 PolarHBondContact O-CE1 3.24Å; P407-H463 PolarHBondContact O-NE2 3.22Å; Y410-H463 HydrophobicContact CD2-CB 4.21Å; Y410-H463 HydrophobicContact CE2-CB 4.16Å; G412-H463 PolarHBondContact N-ND1 3.33Å; G412-H463 PolarHBondContact O-N 3.41Å; H463-L465 PolarHBondContact O-N 3.08Å
464	L	96.7	Very high	94.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-62.9	127.9	170.8	-179.2	154.4	0	0	0	110.1	I377 A382 L385 Y410 D468 V470 A488 V490 L519	I377-L464 HydrophobicContact CD1-CD1 3.78Å; I377-L464 HydrophobicContact CD1-CD2 3.97Å; A382-L464 HydrophobicContact CB-CB 4.19Å; A382-L464 HydrophobicContact CB-CD2 4.14Å; A382-L464 PolarHBondContact O-N 2.8Å; A382-L464 VanDerWaalsContact O-N 3.1Å; L385-L464 HydrophobicContact CB-CB 4.41Å; L385-L464 HydrophobicContact CB-CD1 4.33Å; L385-L464 HydrophobicContact CD1-CD1 4.23Å; L385-L464 PolarHBondContact O-N 3.43Å; L385-L464 VanDerWaalsContact O-N 3.07Å; Y410-L464 WeakPolarHBondContact CE2-O 3.49Å; Y410-L464 PolarHBondContact OH-O 3.26Å; L464-D468 HydrophobicContact CG-CB 4.36Å; L464-V470 HydrophobicContact CD1-CG1 3.78Å; L464-A488 HydrophobicContact CD2-CB 3.67Å; L464-A488 HydrophobicContact CG-CB 4.46Å; L464-V490 HydrophobicContact CD2-CG2 3.56Å; L464-L519 HydrophobicContact CD1-CD1 4.3Å; L464-L519 HydrophobicContact CD1-CD2 4.47Å
465	L	96.3	Very high	94.7	Very high	21 Å²	21	33.6 Å²	33.6	11%	0.11	18%	0.181	C	C	.	.			trans	-106	167.5	-178.4	-63.3	178.8	0	0	0	111.6	F398 L402 P411 H463 D468	F398-L465 HydrophobicContact CE1-CD1 3.81Å; F398-L465 HydrophobicContact CZ-CD1 3.59Å; L402-L465 HydrophobicContact CD1-CD1 4.4Å; P411-L465 HydrophobicContact CB-CD2 3.41Å; P411-L465 VanDerWaalsContact CB-CD2 3.41Å; P411-L465 HydrophobicContact CG-CD2 4.48Å; H463-L465 PolarHBondContact O-N 3.08Å; L465-D468 PolarHBondContact N-OD2 2.66Å; L465-D468 WeakPolarHBondContact O-CB 3.5Å; L465-D468 PolarHBondContact O-N 3.08Å
466	D	95.6	Very high	94.4	Very high	89 Å²	89	33.4 Å²	33.4	48%	0.476	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	146.3	165.2	-66.3	-21.3	0	0	0	109.8	D468 A488 V490	D466-D468 PolarHBondContact O-N 3.12Å; D466-A488 CarbonylContact C-O 3.58Å; D466-A488 WeakPolarHBondContact CA-O 3.33Å; D466-V490 PolarHBondContact OD1-N 2.97Å
467	D	94.6	Very high	94.1	Very high	102 Å²	102	33.6 Å²	33.6	55%	0.545	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	0.9	-175.2	-72.4	-46.1	0	0	0	117	I469 A488	D467-I469 PolarHBondContact O-N 2.86Å; D467-A488 PolarHBondContact N-O 2.84Å
468	D	96.6	Very high	93.8	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.032	18%	0.182	C	C	.	.			trans	-62.8	138.3	169.8	-84.5	-29.8	0	0	0	110.8	R462 L464 L465 D466 V470 A488 R526	R462-D468 IonicContact CZ-OD1 3.86Å; R462-D468 IonicContact CZ-OD2 2.8Å; R462-D468 IonicContact NH1-OD1 2.65Å; R462-D468 IonicContact NH1-OD2 3.33Å; R462-D468 PolarHBondContact NH1-OD2 2.6Å; R462-D468 IonicContact NH2-OD1 3.62Å; R462-D468 PolarHBondContact NH2-OD1 3.3Å; R462-D468 IonicContact NH2-OD2 3.25Å; L464-D468 HydrophobicContact CG-CB 4.36Å; L465-D468 PolarHBondContact N-OD2 2.66Å; L465-D468 WeakPolarHBondContact O-CB 3.5Å; L465-D468 PolarHBondContact O-N 3.08Å; D466-D468 PolarHBondContact O-N 3.12Å; D468-V470 PolarHBondContact O-N 2.81Å; D468-A488 PolarHBondContact O-N 3.3Å; D468-R526 IonicContact OD1-NH1 3.15Å
469	I	97.8	Very high	93.6	Very high	9 Å²	9	35 Å²	35	5%	0.046	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.7	178	-55.8	-62	0	0	0	109.1	D467 A485 R487 P520 R526 A529 K530	D467-I469 PolarHBondContact O-N 2.86Å; I469-A485 HydrophobicContact CG2-CB 3.91Å; I469-R487 HydrophobicContact CD1-CG 4.11Å; I469-P520 VanDerWaalsContact O-CD 3.29Å; I469-P520 WeakPolarHBondContact O-CD 3.38Å; I469-R526 HydrophobicContact CB-CG 3.88Å; I469-R526 HydrophobicContact CG1-CG 4.13Å; I469-A529 HydrophobicContact CG2-CB 3.91Å; I469-K530 HydrophobicContact CD1-CB 4.38Å; I469-K530 HydrophobicContact CD1-CG 4.21Å; I469-K530 HydrophobicContact CG1-CB 4.21Å; I469-K530 HydrophobicContact CG1-CG 4.44Å
470	V	97.5	Very high	93.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.8	177.2	-68.3	0	0	0	0	110.9	V375 I377 L464 D468 A485 F486 A488 I517 L519	V375-V470 HydrophobicContact CG1-CG2 3.63Å; I377-V470 HydrophobicContact CD1-CG1 4.05Å; I377-V470 HydrophobicContact CD1-CG2 4.15Å; L464-V470 HydrophobicContact CD1-CG1 3.78Å; D468-V470 PolarHBondContact O-N 2.81Å; V470-A485 CarbonylContact O-C 3.59Å; V470-A485 WeakPolarHBondContact O-CA 3.44Å; V470-F486 HydrophobicContact CG2-CB 4.41Å; V470-F486 WeakPolarHBondContact CG2-O 3.48Å; V470-F486 PolarHBondContact N-O 3.48Å; V470-F486 PolarHBondContact O-N 2.93Å; V470-A488 HydrophobicContact CG1-CB 4.32Å; V470-A488 HydrophobicContact CG2-CB 4.34Å; V470-I517 HydrophobicContact CB-CG2 4.02Å; V470-I517 HydrophobicContact CG1-CG2 4.16Å; V470-L519 HydrophobicContact CG1-CD1 4.05Å
471	L	97.7	Very high	93.1	Very high	30 Å²	30	36 Å²	36	16%	0.157	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.6	171.2	-70.3	140.3	0	0	0	109.4	I483 Q484 I517 H518 P520 M533	L471-I483 HydrophobicContact CB-CD1 4.49Å; L471-I483 HydrophobicContact CD2-CD1 4.09Å; L471-I483 HydrophobicContact CD2-CG1 4.12Å; L471-Q484 CarbonylContact C-O 3.58Å; L471-Q484 WeakPolarHBondContact CA-O 3.2Å; L471-I517 CarbonylContact O-C 3.56Å; L471-I517 VanDerWaalsContact O-CA 3.27Å; L471-I517 WeakPolarHBondContact O-CA 3.48Å; L471-H518 HydrophobicContact CB-CB 4.1Å; L471-H518 HydrophobicContact CD1-CB 4.34Å; L471-H518 PolarHBondContact N-O 3.06Å; L471-H518 PolarHBondContact O-N 3.46Å; L471-P520 HydrophobicContact CD1-CG 3.86Å; L471-M533 HydrophobicContact CD2-CE 3.41Å; L471-M533 VanDerWaalsContact CD2-CE 3.41Å; L471-M533 HydrophobicContact CD2-SD 3.62Å
472	F	97	Very high	93	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.2	176.8	-165.4	-134.4	0	0	0	109.8	I364 V375 I483 Q484 F486 F496 F498 F506 M515 N516 I517	I364-F472 HydrophobicContact CG2-CZ 3.87Å; V375-F472 HydrophobicContact CG2-CE1 4.49Å; V375-F472 HydrophobicContact CG2-CZ 4.45Å; F472-I483 WeakPolarHBondContact O-CA 3.27Å; F472-Q484 PolarHBondContact N-O 3.08Å; F472-Q484 PolarHBondContact O-N 2.82Å; F472-F486 HydrophobicContact CB-CD2 3.58Å; F472-F486 HydrophobicContact CB-CE2 3.86Å; F472-F486 HydrophobicContact CD1-CD2 4.22Å; F472-F486 AromaticContact CD1-CE2 3.89Å; F472-F486 HydrophobicContact CD1-CE2 3.89Å; F472-F486 HydrophobicContact CD1-CZ 4.5Å; F472-F486 HydrophobicContact CG-CD2 4.34Å; F472-F486 HydrophobicContact CG-CE2 4.37Å; F472-F496 HydrophobicContact CE2-CB 4.25Å; F472-F496 AromaticContact CE2-CD2 3.9Å; F472-F496 HydrophobicContact CE2-CD2 3.9Å; F472-F496 HydrophobicContact CE2-CG 4.25Å; F472-F496 HydrophobicContact CZ-CB 4.31Å; F472-F498 AromaticContact CE1-CD1 3.61Å; F472-F498 HydrophobicContact CE1-CD1 3.61Å; F472-F498 AromaticContact CE1-CE1 3.76Å; F472-F498 HydrophobicContact CE1-CE1 3.76Å; F472-F498 HydrophobicContact CE1-CG 4.18Å; F472-F498 HydrophobicContact CE1-CZ 4.44Å; F472-F498 AromaticContact CZ-CD1 3.94Å; F472-F498 HydrophobicContact CZ-CD1 3.94Å; F472-F498 HydrophobicContact CZ-CE1 4.04Å; F472-F506 HydrophobicContact CD1-CE2 4.1Å; F472-F506 HydrophobicContact CD1-CZ 4.06Å; F472-M515 HydrophobicContact CD1-CE 3.37Å; F472-M515 HydrophobicContact CD1-SD 4.38Å; F472-M515 HydrophobicContact CD2-CB 4.28Å; F472-M515 HydrophobicContact CD2-CE 4.16Å; F472-M515 HydrophobicContact CE1-CB 4.45Å; F472-M515 HydrophobicContact CE1-CE 3.12Å; F472-M515 HydrophobicContact CE1-SD 3.53Å; F472-M515 VanDerWaalsContact CE1-SD 3.53Å; F472-M515 HydrophobicContact CE2-CB 3.45Å; F472-M515 VanDerWaalsContact CE2-CB 3.45Å; F472-M515 HydrophobicContact CE2-CE 3.96Å; F472-M515 HydrophobicContact CE2-CG 4.43Å; F472-M515 HydrophobicContact CE2-SD 4.29Å; F472-M515 HydrophobicContact CG-CE 3.9Å; F472-M515 HydrophobicContact CZ-CB 3.55Å; F472-M515 HydrophobicContact CZ-CE 3.45Å; F472-M515 VanDerWaalsContact CZ-CE 3.45Å; F472-M515 HydrophobicContact CZ-CG 4.09Å; F472-M515 HydrophobicContact CZ-SD 3.48Å; F472-M515 WeakPolarHBondContact CZ-SD 3.48Å; F472-N516 WeakPolarHBondContact CA-O 3.38Å; F472-N516 WeakPolarHBondContact CD2-O 3.36Å; F472-I517 HydrophobicContact CD2-CD1 4.39Å; F472-I517 HydrophobicContact CD2-CG1 3.66Å; F472-I517 HydrophobicContact CE2-CG1 4.14Å
473	N	95.5	Very high	93	Very high	17 Å²	17	37.3 Å²	37.3	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.9	-171.7	179	27.1	0	0	0	111.4	S477 S482 I483 N516	N473-S477 PolarHBondContact OD1-OG 2.93Å; N473-S477 VanDerWaalsContact OD1-OG 3.07Å; N473-S482 PolarHBondContact OD1-O 2.91Å; N473-S482 VanDerWaalsContact OD1-O 3.07Å; N473-I483 HydrophobicContact CB-CB 4.2Å; N473-I483 HydrophobicContact CB-CD1 4.12Å; N473-I483 HydrophobicContact CB-CG1 3.99Å; N473-N516 PolarHBondContact N-O 3.39Å; N473-N516 PolarHBondContact O-N 3.04Å
474	R	92.3	Very high	92.9	Very high	34 Å²	34	37.3 Å²	37.3	13%	0.128	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.1	167.1	-162.3	-174.7	177.5	-126	0.9	111.2	P476 S477 S482 F506 N507 D513 M515	R474-P476 CarbonylContact O-C 3.49Å; R474-S477 PolarHBondContact O-OG 2.98Å; R474-S477 VanDerWaalsContact O-OG 3.13Å; R474-S482 PolarHBondContact N-O 2.6Å; R474-F506 HydrophobicContact CB-CB 4.13Å; R474-F506 HydrophobicContact CB-CD1 4.15Å; R474-F506 WeakPolarHBondContact CD-O 3.49Å; R474-F506 PolarHBondContact NH1-O 3.47Å; R474-F506 VanDerWaalsContact NH1-O 3.1Å; R474-N507 PolarHBondContact NH1-O 2.8Å; R474-N507 PolarHBondContact NH2-O 3.03Å; R474-D513 IonicContact CZ-OD1 2.86Å; R474-D513 IonicContact CZ-OD2 2.74Å; R474-D513 VanDerWaalsContact CZ-OD2 3.23Å; R474-D513 IonicContact NE-OD1 2.63Å; R474-D513 IonicContact NE-OD2 3.95Å; R474-D513 PolarHBondContact NE-OD2 3.27Å; R474-D513 VanDerWaalsContact NH2-CG 3.33Å; R474-D513 IonicContact NH2-OD1 3.31Å; R474-D513 PolarHBondContact NH2-OD1 3.15Å; R474-D513 IonicContact NH2-OD2 3.82Å; R474-D513 PolarHBondContact NH2-OD2 3.42Å; R474-M515 HydrophobicContact CB-CE 3.92Å; R474-M515 HydrophobicContact CB-CG 4.07Å; R474-M515 HydrophobicContact CB-SD 4.24Å; R474-M515 HydrophobicContact CG-CG 3.98Å; R474-M515 HydrophobicContact CG-SD 4.44Å
475	Q	86.3	Confident	92.9	Very high	122 Å²	122	37.3 Å²	37.3	57%	0.57	19%	0.194	S	C	*	.	S	Bend	trans	-97.8	129.8	169.4	-170	68.2	31.4	0	0	109.1
476	P	83.5	Confident	93	Very high	83 Å²	83	36.3 Å²	36.3	54%	0.539	19%	0.189	S	C	.	.	S	Bend	cis	-82.8	145.1	-1.2	33.4	-34.2	0	0	0	114.1	R474	R474-P476 CarbonylContact O-C 3.49Å
477	S	87.5	Confident	93.1	Very high	55 Å²	55	34.9 Å²	34.9	39%	0.385	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-90.1	123.2	176.3	-41.9	0	0	0	0	111.1	N473 R474	N473-S477 PolarHBondContact OD1-OG 2.93Å; N473-S477 VanDerWaalsContact OD1-OG 3.07Å; R474-S477 PolarHBondContact O-OG 2.98Å; R474-S477 VanDerWaalsContact O-OG 3.13Å
478	L	82.4	Confident	93.2	Very high	49 Å²	49	30 Å²	30	26%	0.257	15%	0.151	S	C	.	.			trans	-107.2	-23	-177.9	-64.5	179.2	0	0	0	113.4	S482 Q883 T1055	L478-S482 PolarHBondContact N-OG 3.1Å; L478-Q883 PolarHBondContact O-NE2 3.46Å; L478-T1055 HydrophobicContact CD1-CG2 4.35Å; L478-T1055 HydrophobicContact CD2-CG2 4.02Å
479	H	87.8	Confident	93.2	Very high	32 Å²	32	30.8 Å²	30.8	15%	0.148	16%	0.156	C	C	.	.	S	Bend	trans	-148.7	167.9	-179.9	53.2	86.7	0	0	0	109.5	V481 S482 P505 E1052	H479-V481 VanDerWaalsContact ND1-CB 3.34Å; H479-V481 WeakPolarHBondContact ND1-CB 3.48Å; H479-V481 PolarHBondContact ND1-N 2.96Å; H479-V481 PolarHBondContact O-N 3.23Å; H479-V481 VanDerWaalsContact O-N 3.1Å; H479-S482 PolarHBondContact N-OG 2.87Å; H479-S482 PolarHBondContact ND1-N 3.33Å; H479-S482 PolarHBondContact NE2-OG 3.23Å; H479-S482 WeakPolarHBondContact O-CB 3.35Å; H479-S482 PolarHBondContact O-N 3.39Å; H479-S482 PolarHBondContact O-OG 2.65Å; H479-S482 VanDerWaalsContact O-OG 3.13Å; H479-P505 PolarHBondContact CE1-O 3.42Å; H479-P505 PolarHBondContact NE2-O 3Å; H479-E1052 HydrophobicContact CB-CB 4.38Å; H479-E1052 HydrophobicContact CB-CG 4.44Å
480	R	89.8	Confident	93.2	Very high	77 Å²	77	31 Å²	31	29%	0.291	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-55.2	-35	-177.2	76.1	179.4	-156.5	-175.6	5.7	112.9	S482 I483 N538 P542 Q1048	R480-S482 PolarHBondContact O-N 3.35Å; R480-I483 WeakPolarHBondContact O-CG2 3.42Å; R480-I483 PolarHBondContact O-N 2.59Å; R480-N538 PolarHBondContact NH2-OD1 3.23Å; R480-N538 VanDerWaalsContact NH2-OD1 3.13Å; R480-P542 HydrophobicContact CG-CG 4.36Å; R480-Q1048 VanDerWaalsContact CB-OE1 3.3Å
481	V	92	Very high	93	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-73	-8.5	-176.6	-151	0	0	0	0	112.9	H479 I483 Q484 P505 N538 P542 L548	H479-V481 VanDerWaalsContact ND1-CB 3.34Å; H479-V481 WeakPolarHBondContact ND1-CB 3.48Å; H479-V481 PolarHBondContact ND1-N 2.96Å; H479-V481 PolarHBondContact O-N 3.23Å; H479-V481 VanDerWaalsContact O-N 3.1Å; V481-I483 PolarHBondContact O-N 2.98Å; V481-Q484 HydrophobicContact CG1-CG 4.13Å; V481-Q484 WeakPolarHBondContact O-CG 3.44Å; V481-P505 HydrophobicContact CB-CB 4.49Å; V481-P505 HydrophobicContact CG1-CB 3.88Å; V481-N538 HydrophobicContact CG1-CB 4.2Å; V481-P542 HydrophobicContact CG2-CG 4.47Å; V481-L548 HydrophobicContact CB-CD2 4.18Å; V481-L548 HydrophobicContact CG1-CD2 4.01Å; V481-L548 HydrophobicContact CG2-CD2 4.42Å
482	S	92.8	Very high	92.9	Very high	4 Å²	4	38.8 Å²	38.8	3%	0.028	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-70.5	-10.4	170.6	-49.5	0	0	0	0	113	N473 R474 L478 H479 R480 F506	N473-S482 PolarHBondContact OD1-O 2.91Å; N473-S482 VanDerWaalsContact OD1-O 3.07Å; R474-S482 PolarHBondContact N-O 2.6Å; L478-S482 PolarHBondContact N-OG 3.1Å; H479-S482 PolarHBondContact N-OG 2.87Å; H479-S482 PolarHBondContact ND1-N 3.33Å; H479-S482 PolarHBondContact NE2-OG 3.23Å; H479-S482 WeakPolarHBondContact O-CB 3.35Å; H479-S482 PolarHBondContact O-N 3.39Å; H479-S482 PolarHBondContact O-OG 2.65Å; H479-S482 VanDerWaalsContact O-OG 3.13Å; R480-S482 PolarHBondContact O-N 3.35Å; S482-F506 VanDerWaalsContact O-CD1 3.27Å; S482-F506 WeakPolarHBondContact O-CD1 3.38Å; S482-F506 WeakPolarHBondContact O-CE1 3.23Å
483	I	95.5	Very high	92.7	Very high	53 Å²	53	43.3 Å²	43.3	27%	0.272	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.5	167	-175.4	167.3	0	0	0	109	L471 F472 N473 R480 V481 M533	L471-I483 HydrophobicContact CB-CD1 4.49Å; L471-I483 HydrophobicContact CD2-CD1 4.09Å; L471-I483 HydrophobicContact CD2-CG1 4.12Å; F472-I483 WeakPolarHBondContact O-CA 3.27Å; N473-I483 HydrophobicContact CB-CB 4.2Å; N473-I483 HydrophobicContact CB-CD1 4.12Å; N473-I483 HydrophobicContact CB-CG1 3.99Å; R480-I483 WeakPolarHBondContact O-CG2 3.42Å; R480-I483 PolarHBondContact O-N 2.59Å; V481-I483 PolarHBondContact O-N 2.98Å; I483-M533 HydrophobicContact CB-CE 4.39Å; I483-M533 HydrophobicContact CD1-CE 4.28Å; I483-M533 HydrophobicContact CG1-CE 3.88Å; I483-M533 HydrophobicContact CG2-CE 3.85Å
484	Q	96.2	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	160.7	178.5	-59.7	-175.3	-31.4	0	0	109.9	L471 F472 V481 F486 F506 M533 S535	L471-Q484 CarbonylContact C-O 3.58Å; L471-Q484 WeakPolarHBondContact CA-O 3.2Å; F472-Q484 PolarHBondContact N-O 3.08Å; F472-Q484 PolarHBondContact O-N 2.82Å; V481-Q484 HydrophobicContact CG1-CG 4.13Å; V481-Q484 WeakPolarHBondContact O-CG 3.44Å; Q484-F486 HydrophobicContact CB-CD2 4.36Å; Q484-F486 HydrophobicContact CB-CE2 3.78Å; Q484-F506 HydrophobicContact CB-CZ 4.14Å; Q484-F506 HydrophobicContact CG-CE1 4.49Å; Q484-F506 HydrophobicContact CG-CZ 4.01Å; Q484-M533 WeakPolarHBondContact CA-O 3.45Å; Q484-S535 PolarHBondContact OE1-OG 2.97Å
485	A	97.6	Very high	92.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	144.5	168.1	0	0	0	0	0	110.8	I469 V470 A529 M533 L534 S535	I469-A485 HydrophobicContact CG2-CB 3.91Å; V470-A485 CarbonylContact O-C 3.59Å; V470-A485 WeakPolarHBondContact O-CA 3.44Å; A485-A529 HydrophobicContact CB-CB 4.1Å; A485-A529 WeakPolarHBondContact CB-O 3.37Å; A485-M533 HydrophobicContact CB-CB 4.01Å; A485-M533 PolarHBondContact N-O 3.23Å; A485-L534 CarbonylContact O-C 3.58Å; A485-L534 WeakPolarHBondContact O-CA 3.39Å; A485-S535 PolarHBondContact O-N 3.09Å
486	F	97.6	Very high	93.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157.1	174.7	-71.7	-99.1	0	0	0	109.3	I372 D373 V375 V470 F472 Q484 C502 F506	I372-F486 VanDerWaalsContact O-CE1 3.23Å; I372-F486 WeakPolarHBondContact O-CE1 3.05Å; D373-F486 WeakPolarHBondContact O-CA 3.33Å; V375-F486 HydrophobicContact CB-CB 3.87Å; V375-F486 HydrophobicContact CB-CD1 4.3Å; V375-F486 HydrophobicContact CB-CG 4.12Å; V375-F486 HydrophobicContact CG1-CB 3.54Å; V375-F486 HydrophobicContact CG1-CG 4.26Å; V470-F486 HydrophobicContact CG2-CB 4.41Å; V470-F486 WeakPolarHBondContact CG2-O 3.48Å; V470-F486 PolarHBondContact N-O 3.48Å; V470-F486 PolarHBondContact O-N 2.93Å; F472-F486 HydrophobicContact CB-CD2 3.58Å; F472-F486 HydrophobicContact CB-CE2 3.86Å; F472-F486 HydrophobicContact CD1-CD2 4.22Å; F472-F486 AromaticContact CD1-CE2 3.89Å; F472-F486 HydrophobicContact CD1-CE2 3.89Å; F472-F486 HydrophobicContact CD1-CZ 4.5Å; F472-F486 HydrophobicContact CG-CD2 4.34Å; F472-F486 HydrophobicContact CG-CE2 4.37Å; Q484-F486 HydrophobicContact CB-CD2 4.36Å; Q484-F486 HydrophobicContact CB-CE2 3.78Å; F486-C502 HydrophobicContact CZ-CB 4.49Å; F486-F506 HydrophobicContact CE2-CE2 4.05Å; F486-F506 AromaticContact CE2-CZ 3.83Å; F486-F506 HydrophobicContact CE2-CZ 3.83Å; F486-F506 AromaticContact CZ-CE2 3.97Å; F486-F506 HydrophobicContact CZ-CE2 3.97Å; F486-F506 HydrophobicContact CZ-CZ 4.2Å
487	R	97.2	Very high	94	Very high	58 Å²	58	45 Å²	45	22%	0.219	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.3	164.4	-61.5	178.4	-149.2	-108.8	4.5	108.7	D373 E374 V375 I469	D373-R487 PolarHBondContact O-N 3.1Å; D373-R487 IonicContact OD2-CZ 2.67Å; D373-R487 IonicContact OD2-NE 3.69Å; D373-R487 PolarHBondContact OD2-NE 3.46Å; D373-R487 IonicContact OD2-NH2 3.67Å; D373-R487 PolarHBondContact OD2-NH2 3.02Å; E374-R487 CarbonylContact C-O 3.54Å; E374-R487 VanDerWaalsContact CA-O 3.31Å; E374-R487 WeakPolarHBondContact CA-O 3.27Å; E374-R487 HydrophobicContact CG-CB 4.42Å; V375-R487 PolarHBondContact N-O 3.32Å; I469-R487 HydrophobicContact CD1-CG 4.11Å
488	A	97.2	Very high	94.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141.6	175.8	0	0	0	0	0	111.3	V375 I377 L464 D466 D467 D468 V470	V375-A488 CarbonylContact O-C 3.56Å; V375-A488 WeakPolarHBondContact O-CA 3.22Å; I377-A488 HydrophobicContact CD1-CB 3.51Å; I377-A488 HydrophobicContact CG1-CB 4.14Å; L464-A488 HydrophobicContact CD2-CB 3.67Å; L464-A488 HydrophobicContact CG-CB 4.46Å; D466-A488 CarbonylContact C-O 3.58Å; D466-A488 WeakPolarHBondContact CA-O 3.33Å; D467-A488 PolarHBondContact N-O 2.84Å; D468-A488 PolarHBondContact O-N 3.3Å; V470-A488 HydrophobicContact CG1-CB 4.32Å; V470-A488 HydrophobicContact CG2-CB 4.34Å
489	V	96.8	Very high	95	Very high	22 Å²	22	40.1 Å²	40.1	13%	0.133	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.7	168.1	177.5	0	0	0	0	107.9	M370 E374 V375 C376 I377 K491	M370-V489 HydrophobicContact CE-CB 3.74Å; M370-V489 HydrophobicContact CE-CG1 4.1Å; M370-V489 HydrophobicContact CE-CG2 3.67Å; E374-V489 HydrophobicContact CB-CG2 4.18Å; E374-V489 HydrophobicContact CG-CG2 4.2Å; V375-V489 PolarHBondContact O-N 3.19Å; C376-V489 CarbonylContact C-O 3.25Å; C376-V489 WeakPolarHBondContact CA-O 3.4Å; I377-V489 PolarHBondContact N-O 3.44Å; V489-K491 HydrophobicContact CG1-CG 4.5Å
490	V	96.9	Very high	95.3	Very high	13 Å²	13	39.7 Å²	39.7	8%	0.079	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	125.8	-172.3	-177.6	0	0	0	0	110.2	I377 V379 A382 Y410 L464 D466	I377-V490 WeakPolarHBondContact O-CA 3.48Å; V379-V490 HydrophobicContact CB-CG1 4.29Å; V379-V490 HydrophobicContact CG2-CG1 3.58Å; A382-V490 HydrophobicContact CB-CG1 3.8Å; A382-V490 HydrophobicContact CB-CG2 3.87Å; Y410-V490 HydrophobicContact CE1-CB 4.16Å; Y410-V490 HydrophobicContact CE1-CG1 3.9Å; Y410-V490 HydrophobicContact CE2-CG1 4.18Å; Y410-V490 WeakPolarHBondContact OH-CB 3.31Å; Y410-V490 WeakPolarHBondContact OH-CG2 3.3Å; L464-V490 HydrophobicContact CD2-CG2 3.56Å; D466-V490 PolarHBondContact OD1-N 2.97Å
491	K	94.7	Very high	95.5	Very high	90 Å²	90	36 Å²	36	39%	0.391	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	154.4	179.8	-68.3	-61.4	-179.1	-168.1	0	111.5	C376 I377 P378 V379 V489 F493	C376-K491 WeakPolarHBondContact SG-CG 3.23Å; I377-K491 PolarHBondContact O-N 3.43Å; P378-K491 WeakPolarHBondContact CA-O 3.47Å; V379-K491 WeakPolarHBondContact CG2-O 3.01Å; V379-K491 PolarHBondContact N-O 3.21Å; V489-K491 HydrophobicContact CG1-CG 4.5Å; K491-F493 HydrophobicContact CB-CD2 3.68Å; K491-F493 HydrophobicContact CB-CE2 4.09Å; K491-F493 HydrophobicContact CG-CD2 4.44Å; K491-F493 HydrophobicContact CG-CE2 4.47Å; K491-F493 PolarHBondContact O-N 3.4Å; K491-F493 VanDerWaalsContact O-N 3.09Å
492	P	94	Very high	95.6	Very high	105 Å²	105	36 Å²	36	68%	0.682	17%	0.169	S	C	*	.	S	Bend	trans	-70.6	-3.1	-176.2	29.1	-36.3	0	0	0	114.5
493	F	93.1	Very high	95.7	Very high	95 Å²	95	36 Å²	36	42%	0.417	17%	0.17	S	C	.	.	S	Bend	trans	-69.1	174.8	177.6	-51.9	-60.7	0	0	0	112.6	P378 K491	P378-F493 VanDerWaalsContact CA-O 3.32Å; P378-F493 WeakPolarHBondContact CA-O 3.38Å; P378-F493 WeakPolarHBondContact CB-O 3.48Å; K491-F493 HydrophobicContact CB-CD2 3.68Å; K491-F493 HydrophobicContact CB-CE2 4.09Å; K491-F493 HydrophobicContact CG-CD2 4.44Å; K491-F493 HydrophobicContact CG-CE2 4.47Å; K491-F493 PolarHBondContact O-N 3.4Å; K491-F493 VanDerWaalsContact O-N 3.09Å
494	R	95.2	Very high	95.5	Very high	196 Å²	196	36.6 Å²	36.6	74%	0.74	18%	0.175	S	C	*	.	S	Bend	trans	-114	5.2	-178	-65.5	-176.7	-179.7	162.2	0.6	114.7	T362	T362-R494 WeakPolarHBondContact CG2-O 3.26Å
495	T	96.2	Very high	95.3	Very high	33 Å²	33	36.6 Å²	36.6	20%	0.202	18%	0.175	C	C	.	.	S	Bend	trans	-118.5	152.2	-179	50.9	0	0	0	0	110.2	V363 S365 R497	V363-T495 WeakPolarHBondContact O-CA 3.36Å; V363-T495 WeakPolarHBondContact O-CB 3.49Å; S365-T495 VanDerWaalsContact OG-CB 3.26Å; S365-T495 WeakPolarHBondContact OG-CB 2.82Å; S365-T495 PolarHBondContact OG-OG1 2.93Å; T495-R497 PolarHBondContact OG1-NE 3.13Å; T495-R497 PolarHBondContact OG1-NH2 2.94Å
496	F	97.3	Very high	95	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134.1	165.1	-64.3	-37.5	0	0	0	108.8	A360 V363 I364 S365 C376 I377 P378 F472 M515 I517	A360-F496 HydrophobicContact CB-CZ 4.03Å; V363-F496 PolarHBondContact O-N 2.96Å; I364-F496 CarbonylContact C-O 3.57Å; I364-F496 WeakPolarHBondContact CA-O 3.5Å; I364-F496 HydrophobicContact CG2-CB 4.21Å; S365-F496 PolarHBondContact N-O 2.93Å; S365-F496 PolarHBondContact OG-O 3.21Å; C376-F496 WeakPolarHBondContact O-CA 3.38Å; I377-F496 HydrophobicContact CG2-CE1 4.35Å; P378-F496 HydrophobicContact CG-CD1 4.44Å; P378-F496 HydrophobicContact CG-CE1 4.48Å; F472-F496 HydrophobicContact CE2-CB 4.25Å; F472-F496 AromaticContact CE2-CD2 3.9Å; F472-F496 HydrophobicContact CE2-CD2 3.9Å; F472-F496 HydrophobicContact CE2-CG 4.25Å; F472-F496 HydrophobicContact CZ-CB 4.31Å; F496-M515 WeakPolarHBondContact CE2-O 3.48Å; F496-I517 HydrophobicContact CD1-CD1 3.59Å; F496-I517 HydrophobicContact CD1-CG1 4.48Å; F496-I517 HydrophobicContact CD2-CD1 4.28Å; F496-I517 HydrophobicContact CD2-CG1 4.34Å; F496-I517 HydrophobicContact CE1-CD1 3.29Å; F496-I517 HydrophobicContact CE1-CG1 4.07Å; F496-I517 HydrophobicContact CE2-CB 4.46Å; F496-I517 HydrophobicContact CE2-CD1 3.99Å; F496-I517 HydrophobicContact CE2-CG1 3.87Å; F496-I517 HydrophobicContact CG-CD1 4.11Å; F496-I517 HydrophobicContact CZ-CB 4.14Å; F496-I517 HydrophobicContact CZ-CD1 3.51Å; F496-I517 HydrophobicContact CZ-CG1 3.75Å
497	R	96.7	Very high	94.7	Very high	61 Å²	61	42.4 Å²	42.4	23%	0.23	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.7	-179.1	-73.4	165.3	-164.5	-98.7	-5.1	110.7	S365 D367 C376 T495	S365-R497 VanDerWaalsContact O-CA 3.26Å; S365-R497 WeakPolarHBondContact O-CA 3.49Å; S365-R497 WeakPolarHBondContact OG-CG 3.43Å; D367-R497 HydrophobicContact CB-CB 3.84Å; D367-R497 HydrophobicContact CB-CG 4.34Å; C376-R497 HydrophobicContact CB-CB 3.55Å; C376-R497 WeakPolarHBondContact CB-O 3.25Å; C376-R497 PolarHBondContact N-O 3.23Å; C376-R497 PolarHBondContact O-N 2.86Å; T495-R497 PolarHBondContact OG1-NE 3.13Å; T495-R497 PolarHBondContact OG1-NH2 2.94Å
498	F	95.9	Very high	94.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	166.6	177.2	65.7	-86.1	0	0	0	110.3	I364 D367 V375 F472 C502 F510 M515	I364-F498 HydrophobicContact CB-CE1 3.96Å; I364-F498 HydrophobicContact CD1-CE1 3.91Å; I364-F498 HydrophobicContact CD1-CZ 4.12Å; I364-F498 HydrophobicContact CG2-CE1 4Å; D367-F498 PolarHBondContact N-O 3.05Å; V375-F498 HydrophobicContact CG2-CB 4.36Å; F472-F498 AromaticContact CE1-CD1 3.61Å; F472-F498 HydrophobicContact CE1-CD1 3.61Å; F472-F498 AromaticContact CE1-CE1 3.76Å; F472-F498 HydrophobicContact CE1-CE1 3.76Å; F472-F498 HydrophobicContact CE1-CG 4.18Å; F472-F498 HydrophobicContact CE1-CZ 4.44Å; F472-F498 AromaticContact CZ-CD1 3.94Å; F472-F498 HydrophobicContact CZ-CD1 3.94Å; F472-F498 HydrophobicContact CZ-CE1 4.04Å; F498-C502 HydrophobicContact CD2-CB 4.01Å; F498-C502 HydrophobicContact CE2-CB 4.25Å; F498-F510 HydrophobicContact CD1-CE1 4.49Å; F498-F510 AromaticContact CE1-CE1 3.79Å; F498-F510 HydrophobicContact CE1-CE1 3.79Å; F498-F510 HydrophobicContact CE1-CZ 4.19Å; F498-F510 HydrophobicContact CE2-CZ 4.15Å; F498-F510 AromaticContact CZ-CE1 3.81Å; F498-F510 HydrophobicContact CZ-CE1 3.81Å; F498-F510 AromaticContact CZ-CZ 3.83Å; F498-F510 HydrophobicContact CZ-CZ 3.83Å; F498-M515 HydrophobicContact CE1-SD 4.18Å; F498-M515 HydrophobicContact CZ-SD 4.41Å
499	N	95.4	Very high	94	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	23%	0.225	C	C	.	.			trans	-65.7	129.8	-177.7	-167.8	-49.7	0	0	0	111.1	D367 M370 I372 C501 C502	D367-N499 WeakPolarHBondContact O-CA 3.5Å; M370-N499 PolarHBondContact O-ND2 2.96Å; I372-N499 HydrophobicContact CG2-CB 4.37Å; N499-C501 PolarHBondContact O-N 3.32Å; N499-C501 WeakPolarHBondContact OD1-CB 3.47Å; N499-C501 PolarHBondContact OD1-N 3.32Å; N499-C501 PolarHBondContact OD1-SG 3.12Å; N499-C502 PolarHBondContact O-N 3.25Å
500	P	94.1	Very high	93.8	Very high	22 Å²	22	46.4 Å²	46.4	14%	0.143	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-55.3	-24.4	177.9	-27.2	35.2	0	0	0	115.2	P366 C502 C503 I552	P366-P500 HydrophobicContact CB-CG 3.91Å; P500-C502 PolarHBondContact O-N 3.13Å; P500-C502 VanDerWaalsContact O-N 3.15Å; P500-C503 WeakPolarHBondContact O-CB 3.24Å; P500-C503 PolarHBondContact O-N 3.36Å; P500-C503 VanDerWaalsContact O-N 3.12Å; P500-C503 PolarHBondContact O-SG 2.87Å; P500-C503 VanDerWaalsContact O-SG 3.34Å; P500-I552 HydrophobicContact CB-CD1 4.25Å; P500-I552 HydrophobicContact CB-CG1 4.41Å; P500-I552 VanDerWaalsContact O-CD1 3.29Å; P500-I552 WeakPolarHBondContact O-CD1 3.14Å
501	C	94	Very high	93.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.007	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.1	-24.1	174.4	-64.5	0	0	0	0	113.1	I372 N499 I549 S550	I372-C501 HydrophobicContact CG2-CB 4.14Å; N499-C501 PolarHBondContact O-N 3.32Å; N499-C501 WeakPolarHBondContact OD1-CB 3.47Å; N499-C501 PolarHBondContact OD1-N 3.32Å; N499-C501 PolarHBondContact OD1-SG 3.12Å; C501-I549 HydrophobicContact CB-CG2 4.18Å; C501-S550 VanDerWaalsContact CA-O 3.31Å; C501-S550 WeakPolarHBondContact CA-O 3.27Å; C501-S550 PolarHBondContact O-N 3.41Å
502	C	94.3	Very high	93.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-91.9	5	-179.8	-57.8	0	0	0	0	113.4	I372 F486 F498 N499 P500 P505 F506	I372-C502 PolarHBondContact O-SG 2.98Å; F486-C502 HydrophobicContact CZ-CB 4.49Å; F498-C502 HydrophobicContact CD2-CB 4.01Å; F498-C502 HydrophobicContact CE2-CB 4.25Å; N499-C502 PolarHBondContact O-N 3.25Å; P500-C502 PolarHBondContact O-N 3.13Å; P500-C502 VanDerWaalsContact O-N 3.15Å; C502-P505 VanDerWaalsContact O-CD 3.3Å; C502-P505 WeakPolarHBondContact O-CD 3.44Å; C502-F506 VanDerWaalsContact O-CD2 3.24Å; C502-F506 WeakPolarHBondContact O-CD2 3.4Å
503	C	93.1	Very high	93.5	Very high	5 Å²	5	46 Å²	46	3%	0.034	24%	0.238	C	C	.	.	H	α-helix	trans	-68.7	-38.1	-179.5	-69.5	0	0	0	0	113.7	P500 F506 N507 A508 F510 I552	P500-C503 WeakPolarHBondContact O-CB 3.24Å; P500-C503 PolarHBondContact O-N 3.36Å; P500-C503 VanDerWaalsContact O-N 3.12Å; P500-C503 PolarHBondContact O-SG 2.87Å; P500-C503 VanDerWaalsContact O-SG 3.34Å; C503-F506 CarbonylContact O-C 3.5Å; C503-F506 PolarHBondContact O-N 2.91Å; C503-F506 VanDerWaalsContact O-N 3.12Å; C503-N507 WeakPolarHBondContact O-CA 3.43Å; C503-N507 PolarHBondContact O-N 3.43Å; C503-A508 PolarHBondContact O-N 3.24Å; C503-A508 VanDerWaalsContact O-N 3.15Å; C503-F510 WeakPolarHBondContact SG-CE2 3.44Å; C503-F510 WeakPolarHBondContact SG-CZ 3.4Å; C503-I552 HydrophobicContact CB-CD1 4.26Å
504	T	91.4	Very high	93.6	Very high	64 Å²	64	45.4 Å²	45.4	39%	0.393	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-45.1	-177.6	-54.3	0	0	0	0	113	F506 N507 L548	T504-F506 VanDerWaalsContact C-N 3.27Å; T504-F506 PolarHBondContact O-N 3.39Å; T504-N507 PolarHBondContact O-N 3.45Å; T504-L548 HydrophobicContact CG2-CD1 4.1Å; T504-L548 HydrophobicContact CG2-CG 4.35Å
505	P	91.8	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-55.1	-34.7	172.5	-21.5	21	0	0	0	116.2	H479 V481 C502 L548 I549	H479-P505 PolarHBondContact CE1-O 3.42Å; H479-P505 PolarHBondContact NE2-O 3Å; V481-P505 HydrophobicContact CB-CB 4.49Å; V481-P505 HydrophobicContact CG1-CB 3.88Å; C502-P505 VanDerWaalsContact O-CD 3.3Å; C502-P505 WeakPolarHBondContact O-CD 3.44Å; P505-L548 HydrophobicContact CB-CD2 3.72Å; P505-L548 HydrophobicContact CB-CG 4.48Å; P505-L548 HydrophobicContact CG-CD2 3.78Å; P505-L548 HydrophobicContact CG-CG 4.07Å; P505-I549 HydrophobicContact CG-CD1 4.45Å; P505-I549 HydrophobicContact CG-CG1 3.62Å
506	F	93	Very high	93.6	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.018	20%	0.198	C	C	.	.	H	α-helix	trans	-91.1	-10.3	177.8	-60.6	-66.2	0	0	0	112.1	F472 R474 S482 Q484 F486 C502 C503 T504 A508 M515	F472-F506 HydrophobicContact CD1-CE2 4.1Å; F472-F506 HydrophobicContact CD1-CZ 4.06Å; R474-F506 HydrophobicContact CB-CB 4.13Å; R474-F506 HydrophobicContact CB-CD1 4.15Å; R474-F506 WeakPolarHBondContact CD-O 3.49Å; R474-F506 PolarHBondContact NH1-O 3.47Å; R474-F506 VanDerWaalsContact NH1-O 3.1Å; S482-F506 VanDerWaalsContact O-CD1 3.27Å; S482-F506 WeakPolarHBondContact O-CD1 3.38Å; S482-F506 WeakPolarHBondContact O-CE1 3.23Å; Q484-F506 HydrophobicContact CB-CZ 4.14Å; Q484-F506 HydrophobicContact CG-CE1 4.49Å; Q484-F506 HydrophobicContact CG-CZ 4.01Å; F486-F506 HydrophobicContact CE2-CE2 4.05Å; F486-F506 AromaticContact CE2-CZ 3.83Å; F486-F506 HydrophobicContact CE2-CZ 3.83Å; F486-F506 AromaticContact CZ-CE2 3.97Å; F486-F506 HydrophobicContact CZ-CE2 3.97Å; F486-F506 HydrophobicContact CZ-CZ 4.2Å; C502-F506 VanDerWaalsContact O-CD2 3.24Å; C502-F506 WeakPolarHBondContact O-CD2 3.4Å; C503-F506 CarbonylContact O-C 3.5Å; C503-F506 PolarHBondContact O-N 2.91Å; C503-F506 VanDerWaalsContact O-N 3.12Å; T504-F506 VanDerWaalsContact C-N 3.27Å; T504-F506 PolarHBondContact O-N 3.39Å; F506-A508 HydrophobicContact CB-CB 4.1Å; F506-A508 PolarHBondContact O-N 3.4Å; F506-M515 HydrophobicContact CB-CE 4.12Å; F506-M515 HydrophobicContact CB-SD 4.39Å; F506-M515 HydrophobicContact CD1-CE 3.46Å; F506-M515 VanDerWaalsContact CD1-CE 3.46Å; F506-M515 HydrophobicContact CD2-CE 3.86Å; F506-M515 HydrophobicContact CE1-CE 3.79Å; F506-M515 HydrophobicContact CE2-CE 4.18Å; F506-M515 HydrophobicContact CG-CE 3.52Å; F506-M515 HydrophobicContact CG-SD 4.32Å; F506-M515 HydrophobicContact CZ-CE 4.15Å
507	N	89.5	Confident	93.6	Very high	118 Å²	118	35.8 Å²	35.8	63%	0.631	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	42.2	-167.3	-167.9	37.6	0	0	0	112	R474 C503 T504	R474-N507 PolarHBondContact NH1-O 2.8Å; R474-N507 PolarHBondContact NH2-O 3.03Å; C503-N507 WeakPolarHBondContact O-CA 3.43Å; C503-N507 PolarHBondContact O-N 3.43Å; T504-N507 PolarHBondContact O-N 3.45Å
508	A	91.6	Very high	93.6	Very high	11 Å²	11	35 Å²	35	9%	0.091	20%	0.198	C	C	.	.			trans	-96.7	146.2	-177.2	0	0	0	0	0	111.8	I364 C503 F506 D513	I364-A508 HydrophobicContact CD1-CB 3.74Å; C503-A508 PolarHBondContact O-N 3.24Å; C503-A508 VanDerWaalsContact O-N 3.15Å; F506-A508 HydrophobicContact CB-CB 4.1Å; F506-A508 PolarHBondContact O-N 3.4Å; A508-D513 WeakPolarHBondContact CA-OD2 3.48Å
509	D	88.6	Confident	93.7	Very high	97 Å²	97	35.5 Å²	35.5	52%	0.519	20%	0.2	S	C	.	.			trans	-131.9	6.2	-170.6	53.4	-1.1	0	0	0	115.4	D511	D509-D511 VanDerWaalsContact C-N 3.26Å; D509-D511 PolarHBondContact O-N 2.73Å
510	F	92.9	Very high	93.8	Very high	56 Å²	56	36 Å²	36	25%	0.246	20%	0.203	C	C	.	.	S	Bend	trans	56	29.9	174.1	-56.5	-65	0	0	0	115.5	I364 S365 P366 F498 C503	I364-F510 HydrophobicContact CB-CD1 4.26Å; I364-F510 HydrophobicContact CB-CE1 4.26Å; I364-F510 HydrophobicContact CD1-CD1 3.67Å; I364-F510 HydrophobicContact CD1-CE1 3.82Å; I364-F510 HydrophobicContact CG1-CD1 3.78Å; I364-F510 HydrophobicContact CG1-CE1 4.15Å; S365-F510 VanDerWaalsContact C-CE1 3.43Å; P366-F510 HydrophobicContact CB-CD2 4.14Å; P366-F510 HydrophobicContact CB-CE1 4.31Å; P366-F510 HydrophobicContact CB-CE2 3.73Å; P366-F510 HydrophobicContact CB-CZ 3.83Å; P366-F510 HydrophobicContact CG-CD2 4.34Å; P366-F510 HydrophobicContact CG-CE2 4.42Å; P366-F510 HydrophobicContact CG-CG 4.48Å; F498-F510 HydrophobicContact CD1-CE1 4.49Å; F498-F510 AromaticContact CE1-CE1 3.79Å; F498-F510 HydrophobicContact CE1-CE1 3.79Å; F498-F510 HydrophobicContact CE1-CZ 4.19Å; F498-F510 HydrophobicContact CE2-CZ 4.15Å; F498-F510 AromaticContact CZ-CE1 3.81Å; F498-F510 HydrophobicContact CZ-CE1 3.81Å; F498-F510 AromaticContact CZ-CZ 3.83Å; F498-F510 HydrophobicContact CZ-CZ 3.83Å; C503-F510 WeakPolarHBondContact SG-CE2 3.44Å; C503-F510 WeakPolarHBondContact SG-CZ 3.4Å
511	D	93.2	Very high	93.8	Very high	124 Å²	124	37.3 Å²	37.3	66%	0.663	21%	0.208	S	C	*	.	S	Bend	trans	-96.5	7.1	-179.7	71.8	-13.4	0	0	0	114.1	D509	D509-D511 VanDerWaalsContact C-N 3.26Å; D509-D511 PolarHBondContact O-N 2.73Å
512	G	92.3	Very high	93.9	Very high	49 Å²	49	41.2 Å²	41.2	51%	0.505	23%	0.231	S	C	.	.	S	Bend	trans	130.4	-1.5	-168.6	0	0	0	0	0	113.3
513	D	93.2	Very high	93.9	Very high	27 Å²	27	45.9 Å²	45.9	14%	0.144	25%	0.253	C	S	.	.			trans	-48.2	138.4	174.5	-108.1	-6.6	0	0	0	113.6	V363 I364 R474 A508	V363-D513 WeakPolarHBondContact CA-O 3.23Å; I364-D513 HydrophobicContact CD1-CB 3.78Å; I364-D513 HydrophobicContact CG1-CB 3.83Å; I364-D513 WeakPolarHBondContact CG1-O 3.45Å; I364-D513 PolarHBondContact N-O 3.3Å; R474-D513 IonicContact CZ-OD1 2.86Å; R474-D513 IonicContact CZ-OD2 2.74Å; R474-D513 VanDerWaalsContact CZ-OD2 3.23Å; R474-D513 IonicContact NE-OD1 2.63Å; R474-D513 IonicContact NE-OD2 3.95Å; R474-D513 PolarHBondContact NE-OD2 3.27Å; R474-D513 VanDerWaalsContact NH2-CG 3.33Å; R474-D513 IonicContact NH2-OD1 3.31Å; R474-D513 PolarHBondContact NH2-OD1 3.15Å; R474-D513 IonicContact NH2-OD2 3.82Å; R474-D513 PolarHBondContact NH2-OD2 3.42Å; A508-D513 WeakPolarHBondContact CA-OD2 3.48Å
514	E	95.6	Very high	93.9	Very high	82 Å²	82	49 Å²	49	38%	0.383	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136.8	175.1	-65.6	-179.4	154.9	0	0	110.4	R361 V363	R361-E514 HydrophobicContact CG-CB 4.3Å; R361-E514 IonicContact CZ-OE2 3.77Å; R361-E514 IonicContact NE-OE2 2.68Å; R361-E514 PolarHBondContact NE-OE2 2.86Å; R361-E514 IonicContact NH2-OE2 3.9Å; R361-E514 PolarHBondContact NH2-OE2 2.63Å; V363-E514 HydrophobicContact CG2-CG 4Å
515	M	96.9	Very high	94.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	160	177.6	-70.8	-175.3	63.7	0	0	111.6	R361 T362 I364 F472 R474 F496 F498 F506	R361-M515 WeakPolarHBondContact CA-O 3.34Å; T362-M515 PolarHBondContact N-O 3.39Å; T362-M515 PolarHBondContact O-N 2.86Å; T362-M515 VanDerWaalsContact O-N 3.11Å; I364-M515 HydrophobicContact CD1-SD 4.08Å; I364-M515 HydrophobicContact CG2-CB 3.68Å; I364-M515 HydrophobicContact CG2-CG 3.69Å; I364-M515 HydrophobicContact CG2-SD 3.82Å; F472-M515 HydrophobicContact CD1-CE 3.37Å; F472-M515 HydrophobicContact CD1-SD 4.38Å; F472-M515 HydrophobicContact CD2-CB 4.28Å; F472-M515 HydrophobicContact CD2-CE 4.16Å; F472-M515 HydrophobicContact CE1-CB 4.45Å; F472-M515 HydrophobicContact CE1-CE 3.12Å; F472-M515 HydrophobicContact CE1-SD 3.53Å; F472-M515 VanDerWaalsContact CE1-SD 3.53Å; F472-M515 HydrophobicContact CE2-CB 3.45Å; F472-M515 VanDerWaalsContact CE2-CB 3.45Å; F472-M515 HydrophobicContact CE2-CE 3.96Å; F472-M515 HydrophobicContact CE2-CG 4.43Å; F472-M515 HydrophobicContact CE2-SD 4.29Å; F472-M515 HydrophobicContact CG-CE 3.9Å; F472-M515 HydrophobicContact CZ-CB 3.55Å; F472-M515 HydrophobicContact CZ-CE 3.45Å; F472-M515 VanDerWaalsContact CZ-CE 3.45Å; F472-M515 HydrophobicContact CZ-CG 4.09Å; F472-M515 HydrophobicContact CZ-SD 3.48Å; F472-M515 WeakPolarHBondContact CZ-SD 3.48Å; R474-M515 HydrophobicContact CB-CE 3.92Å; R474-M515 HydrophobicContact CB-CG 4.07Å; R474-M515 HydrophobicContact CB-SD 4.24Å; R474-M515 HydrophobicContact CG-CG 3.98Å; R474-M515 HydrophobicContact CG-SD 4.44Å; F496-M515 WeakPolarHBondContact CE2-O 3.48Å; F498-M515 HydrophobicContact CE1-SD 4.18Å; F498-M515 HydrophobicContact CZ-SD 4.41Å; F506-M515 HydrophobicContact CB-CE 4.12Å; F506-M515 HydrophobicContact CB-SD 4.39Å; F506-M515 HydrophobicContact CD1-CE 3.46Å; F506-M515 VanDerWaalsContact CD1-CE 3.46Å; F506-M515 HydrophobicContact CD2-CE 3.86Å; F506-M515 HydrophobicContact CE1-CE 3.79Å; F506-M515 HydrophobicContact CE2-CE 4.18Å; F506-M515 HydrophobicContact CG-CE 3.52Å; F506-M515 HydrophobicContact CG-SD 4.32Å; F506-M515 HydrophobicContact CZ-CE 4.15Å
516	N	95.8	Very high	94.3	Very high	27 Å²	27	50.5 Å²	50.5	14%	0.144	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.2	-175.6	-55.4	-48	0	0	0	110.7	A360 R361 F472 N473	A360-N516 CarbonylContact O-C 3.24Å; A360-N516 WeakPolarHBondContact O-CA 3.5Å; R361-N516 WeakPolarHBondContact CB-OD1 3.24Å; R361-N516 VanDerWaalsContact CD-OD1 3.29Å; R361-N516 WeakPolarHBondContact CD-OD1 3.39Å; R361-N516 VanDerWaalsContact CG-OD1 3.28Å; R361-N516 WeakPolarHBondContact CG-OD1 3.27Å; F472-N516 WeakPolarHBondContact CA-O 3.38Å; F472-N516 WeakPolarHBondContact CD2-O 3.36Å; N473-N516 PolarHBondContact N-O 3.39Å; N473-N516 PolarHBondContact O-N 3.04Å
517	I	96.2	Very high	94.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.4	167.7	-72	-175	0	0	0	109.3	T359 A360 I377 L385 V470 L471 F472 F496	T359-I517 CarbonylContact C-O 3.54Å; T359-I517 WeakPolarHBondContact CA-O 3.14Å; T359-I517 WeakPolarHBondContact CB-O 3.3Å; A360-I517 PolarHBondContact N-O 3.3Å; A360-I517 PolarHBondContact O-N 2.87Å; I377-I517 HydrophobicContact CD1-CD1 3.66Å; I377-I517 HydrophobicContact CG1-CD1 3.72Å; L385-I517 HydrophobicContact CD1-CG2 4.24Å; V470-I517 HydrophobicContact CB-CG2 4.02Å; V470-I517 HydrophobicContact CG1-CG2 4.16Å; L471-I517 CarbonylContact O-C 3.56Å; L471-I517 VanDerWaalsContact O-CA 3.27Å; L471-I517 WeakPolarHBondContact O-CA 3.48Å; F472-I517 HydrophobicContact CD2-CD1 4.39Å; F472-I517 HydrophobicContact CD2-CG1 3.66Å; F472-I517 HydrophobicContact CE2-CG1 4.14Å; F496-I517 HydrophobicContact CD1-CD1 3.59Å; F496-I517 HydrophobicContact CD1-CG1 4.48Å; F496-I517 HydrophobicContact CD2-CD1 4.28Å; F496-I517 HydrophobicContact CD2-CG1 4.34Å; F496-I517 HydrophobicContact CE1-CD1 3.29Å; F496-I517 HydrophobicContact CE1-CG1 4.07Å; F496-I517 HydrophobicContact CE2-CB 4.46Å; F496-I517 HydrophobicContact CE2-CD1 3.99Å; F496-I517 HydrophobicContact CE2-CG1 3.87Å; F496-I517 HydrophobicContact CG-CD1 4.11Å; F496-I517 HydrophobicContact CZ-CB 4.14Å; F496-I517 HydrophobicContact CZ-CD1 3.51Å; F496-I517 HydrophobicContact CZ-CG1 3.75Å
518	H	97.1	Very high	94.7	Very high	46 Å²	46	51 Å²	51	21%	0.213	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.9	169.3	-46.7	65.4	0	0	0	108.9	T359 L471 P520	T359-H518 HydrophobicContact CG2-CB 4.23Å; T359-H518 WeakPolarHBondContact CG2-CD2 3.46Å; L471-H518 HydrophobicContact CB-CB 4.1Å; L471-H518 HydrophobicContact CD1-CB 4.34Å; L471-H518 PolarHBondContact N-O 3.06Å; L471-H518 PolarHBondContact O-N 3.46Å; H518-P520 WeakPolarHBondContact O-CD 3.37Å
519	L	97.3	Very high	94.9	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.052	29%	0.288	C	S	.	.			trans	-100.2	110.5	177.5	179	62.7	0	0	0	110	F358 L385 T386 L464 V470 Q521	F358-L519 HydrophobicContact CB-CB 4.49Å; F358-L519 PolarHBondContact O-N 2.7Å; F358-L519 VanDerWaalsContact O-N 3.11Å; L385-L519 HydrophobicContact CB-CD2 4.13Å; T386-L519 VanDerWaalsContact O-CD2 3.27Å; T386-L519 WeakPolarHBondContact O-CD2 3.47Å; L464-L519 HydrophobicContact CD1-CD1 4.3Å; L464-L519 HydrophobicContact CD1-CD2 4.47Å; V470-L519 HydrophobicContact CG1-CD1 4.05Å; L519-Q521 PolarHBondContact O-N 2.47Å; L519-Q521 PolarHBondContact O-NE2 3.41Å; L519-Q521 VanDerWaalsContact O-NE2 3.15Å
520	P	97.1	Very high	95.2	Very high	12 Å²	12	50.3 Å²	50.3	8%	0.078	28%	0.282	C	S	.	.			trans	-54.7	129.4	172.9	-22.6	32.8	0	0	0	111.3	Y387 I469 L471 H518 A525 R526	Y387-P520 WeakPolarHBondContact CD2-O 3.42Å; Y387-P520 WeakPolarHBondContact CE2-O 3.49Å; I469-P520 VanDerWaalsContact O-CD 3.29Å; I469-P520 WeakPolarHBondContact O-CD 3.38Å; L471-P520 HydrophobicContact CD1-CG 3.86Å; H518-P520 WeakPolarHBondContact O-CD 3.37Å; P520-A525 HydrophobicContact CB-CB 4.06Å; P520-R526 HydrophobicContact CB-CB 4.5Å
521	Q	95.8	Very high	95.3	Very high	51 Å²	51	53.2 Å²	53.2	24%	0.238	30%	0.297	C	S	.	.			trans	-95.5	-6.3	-173.8	-65.5	-64.8	-59.8	0	0	113.8	F358 T386 P388 L519	F358-Q521 HydrophobicContact CD2-CG 3.7Å; F358-Q521 HydrophobicContact CE2-CG 4.09Å; F358-Q521 HydrophobicContact CG-CG 4.13Å; T386-Q521 PolarHBondContact O-NE2 2.85Å; T386-Q521 VanDerWaalsContact O-NE2 3.1Å; P388-Q521 VanDerWaalsContact CD-OE1 3.25Å; P388-Q521 WeakPolarHBondContact CG-O 3.3Å; L519-Q521 PolarHBondContact O-N 2.47Å; L519-Q521 PolarHBondContact O-NE2 3.41Å; L519-Q521 VanDerWaalsContact O-NE2 3.15Å
522	T	95	Very high	95.4	Very high	82 Å²	82	52.1 Å²	52.1	50%	0.503	29%	0.29	S	S	.	.	S	Bend	trans	-126.2	150	-179.2	62.5	0	0	0	0	110.7	A524 A525 R526	T522-A524 VanDerWaalsContact C-N 3.31Å; T522-A524 PolarHBondContact O-N 3.16Å; T522-A525 PolarHBondContact O-N 3.11Å; T522-A525 VanDerWaalsContact OG1-CB 3.27Å; T522-A525 WeakPolarHBondContact OG1-CB 3.29Å; T522-A525 PolarHBondContact OG1-N 2.77Å; T522-R526 WeakPolarHBondContact O-CB 3.49Å; T522-R526 PolarHBondContact O-N 2.77Å
523	E	94	Very high	95.6	Very high	98 Å²	98	52.5 Å²	52.5	46%	0.458	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-36.8	178.1	-71.6	-67.4	-179.6	0	0	112.5	Y387 R526 A527	Y387-E523 WeakPolarHBondContact OH-CG 3.34Å; Y387-E523 PolarHBondContact OH-OE1 3.43Å; Y387-E523 PolarHBondContact OH-OE2 3.41Å; E523-R526 VanDerWaalsContact CD-NH2 3.3Å; E523-R526 PolarHBondContact O-N 2.83Å; E523-R526 IonicContact OE1-CZ 3.09Å; E523-R526 IonicContact OE1-NH2 2.67Å; E523-R526 PolarHBondContact OE1-NH2 2.7Å; E523-R526 IonicContact OE2-CZ 2.68Å; E523-R526 VanDerWaalsContact OE2-CZ 3.24Å; E523-R526 IonicContact OE2-NE 2.84Å; E523-R526 PolarHBondContact OE2-NE 2.99Å; E523-R526 IonicContact OE2-NH2 3.17Å; E523-R526 PolarHBondContact OE2-NH2 3.47Å; E523-A527 WeakPolarHBondContact O-CB 3.41Å; E523-A527 PolarHBondContact O-N 3.36Å
524	A	93.7	Very high	95.7	Very high	70 Å²	70	51.6 Å²	51.6	58%	0.579	28%	0.275	S	S	*	.	H	α-helix	trans	-60.3	-48.4	175.2	0	0	0	0	0	111.8	T522 R526 A527 E528	T522-A524 VanDerWaalsContact C-N 3.31Å; T522-A524 PolarHBondContact O-N 3.16Å; A524-R526 VanDerWaalsContact C-N 3.29Å; A524-R526 PolarHBondContact O-N 2.9Å; A524-A527 PolarHBondContact O-N 2.69Å; A524-E528 PolarHBondContact O-N 3.29Å
525	A	95	Very high	95.6	Very high	35 Å²	35	47.7 Å²	47.7	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-34.3	177.2	0	0	0	0	0	112	P520 T522 A529	P520-A525 HydrophobicContact CB-CB 4.06Å; T522-A525 PolarHBondContact O-N 3.11Å; T522-A525 VanDerWaalsContact OG1-CB 3.27Å; T522-A525 WeakPolarHBondContact OG1-CB 3.29Å; T522-A525 PolarHBondContact OG1-N 2.77Å; A525-A529 VanDerWaalsContact O-CB 3.27Å; A525-A529 WeakPolarHBondContact O-CB 3.42Å; A525-A529 PolarHBondContact O-N 2.84Å
526	R	95.7	Very high	95.4	Very high	61 Å²	61	48.1 Å²	48.1	23%	0.23	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-41.4	175.2	-159.9	170.8	70.2	159	-2.8	111.4	D468 I469 P520 T522 E523 A524 K530	D468-R526 IonicContact OD1-NH1 3.15Å; I469-R526 HydrophobicContact CB-CG 3.88Å; I469-R526 HydrophobicContact CG1-CG 4.13Å; P520-R526 HydrophobicContact CB-CB 4.5Å; T522-R526 WeakPolarHBondContact O-CB 3.49Å; T522-R526 PolarHBondContact O-N 2.77Å; E523-R526 VanDerWaalsContact CD-NH2 3.3Å; E523-R526 PolarHBondContact O-N 2.83Å; E523-R526 IonicContact OE1-CZ 3.09Å; E523-R526 IonicContact OE1-NH2 2.67Å; E523-R526 PolarHBondContact OE1-NH2 2.7Å; E523-R526 IonicContact OE2-CZ 2.68Å; E523-R526 VanDerWaalsContact OE2-CZ 3.24Å; E523-R526 IonicContact OE2-NE 2.84Å; E523-R526 PolarHBondContact OE2-NE 2.99Å; E523-R526 IonicContact OE2-NH2 3.17Å; E523-R526 PolarHBondContact OE2-NH2 3.47Å; A524-R526 VanDerWaalsContact C-N 3.29Å; A524-R526 PolarHBondContact O-N 2.9Å; R526-K530 VanDerWaalsContact O-CB 3.28Å; R526-K530 WeakPolarHBondContact O-CB 3.23Å; R526-K530 PolarHBondContact O-N 2.97Å
527	A	96.1	Very high	95.2	Very high	44 Å²	44	50.9 Å²	50.9	36%	0.364	27%	0.269	S	S	.	.	H	α-helix	trans	-65.5	-48	175.9	0	0	0	0	0	111.8	E523 A524 A529 K530 H531	E523-A527 WeakPolarHBondContact O-CB 3.41Å; E523-A527 PolarHBondContact O-N 3.36Å; A524-A527 PolarHBondContact O-N 2.69Å; A527-A529 PolarHBondContact O-N 3.43Å; A527-K530 PolarHBondContact O-N 3.18Å; A527-H531 PolarHBondContact O-CD2 3.27Å; A527-H531 PolarHBondContact O-N 2.84Å
528	E	95.5	Very high	95.1	Very high	89 Å²	89	51.3 Å²	51.3	42%	0.416	27%	0.271	S	S	.	.	H	α-helix	trans	-58.3	-47	175.8	-73.2	-172.7	158.9	0	0	111.5	A524 K530 H531 L532 T1354	A524-E528 PolarHBondContact O-N 3.29Å; E528-K530 VanDerWaalsContact C-N 3.34Å; E528-K530 PolarHBondContact O-N 3.28Å; E528-H531 PolarHBondContact O-N 3.23Å; E528-L532 VanDerWaalsContact O-CB 3.28Å; E528-L532 WeakPolarHBondContact O-CB 3.49Å; E528-L532 PolarHBondContact O-N 3.08Å; E528-T1354 HydrophobicContact CG-CG2 4.45Å; E528-T1354 WeakPolarHBondContact OE1-CB 3.22Å; E528-T1354 PolarHBondContact OE1-OG1 3.39Å
529	A	96.3	Very high	95	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.033	26%	0.262	C	S	.	.	I	π-helix	trans	-60.2	-42.8	177.1	0	0	0	0	0	112.1	I469 A485 A525 A527 M533 L534	I469-A529 HydrophobicContact CG2-CB 3.91Å; A485-A529 HydrophobicContact CB-CB 4.1Å; A485-A529 WeakPolarHBondContact CB-O 3.37Å; A525-A529 VanDerWaalsContact O-CB 3.27Å; A525-A529 WeakPolarHBondContact O-CB 3.42Å; A525-A529 PolarHBondContact O-N 2.84Å; A527-A529 PolarHBondContact O-N 3.43Å; A529-M533 CarbonylContact O-C 3.49Å; A529-M533 WeakPolarHBondContact O-CA 3.29Å; A529-M533 WeakPolarHBondContact O-CB 3.22Å; A529-M533 PolarHBondContact O-N 3.2Å; A529-L534 PolarHBondContact O-N 3.46Å
530	K	95.5	Very high	94.8	Very high	89 Å²	89	49.3 Å²	49.3	39%	0.387	26%	0.263	S	S	.	.	I	π-helix	trans	-66.8	-42.6	179.9	-175.2	179.2	178.4	-179.5	0	113	I469 R526 A527 E528 L534	I469-K530 HydrophobicContact CD1-CB 4.38Å; I469-K530 HydrophobicContact CD1-CG 4.21Å; I469-K530 HydrophobicContact CG1-CB 4.21Å; I469-K530 HydrophobicContact CG1-CG 4.44Å; R526-K530 VanDerWaalsContact O-CB 3.28Å; R526-K530 WeakPolarHBondContact O-CB 3.23Å; R526-K530 PolarHBondContact O-N 2.97Å; A527-K530 PolarHBondContact O-N 3.18Å; E528-K530 VanDerWaalsContact C-N 3.34Å; E528-K530 PolarHBondContact O-N 3.28Å; K530-L534 WeakPolarHBondContact O-CB 3.42Å
531	H	94.9	Very high	94.5	Very high	118 Å²	118	49.4 Å²	49.4	55%	0.546	26%	0.264	S	S	.	.	I	π-helix	trans	-88.1	-31.1	-172.7	-70.4	-68.4	0	0	0	113.4	A527 E528	A527-H531 PolarHBondContact O-CD2 3.27Å; A527-H531 PolarHBondContact O-N 2.84Å; E528-H531 PolarHBondContact O-N 3.23Å
532	L	94.8	Very high	94.3	Very high	101 Å²	101	47.3 Å²	47.3	53%	0.529	26%	0.255	S	S	.	.	I	π-helix	trans	-103.4	-42.6	-176.9	-55.3	176.4	0	0	0	112.9	E528 N538 T1354	E528-L532 VanDerWaalsContact O-CB 3.28Å; E528-L532 WeakPolarHBondContact O-CB 3.49Å; E528-L532 PolarHBondContact O-N 3.08Å; L532-N538 PolarHBondContact O-ND2 3.4Å; L532-T1354 HydrophobicContact CD1-CG2 4.28Å
533	M	95.8	Very high	94	Very high	57 Å²	57	44.6 Å²	44.6	28%	0.281	24%	0.236	S	C	.	.	I	π-helix	trans	-101.4	-12.3	-167.4	-59.1	-175.5	69.3	0	0	114.5	L471 I483 Q484 A485 A529 S535 N538	L471-M533 HydrophobicContact CD2-CE 3.41Å; L471-M533 VanDerWaalsContact CD2-CE 3.41Å; L471-M533 HydrophobicContact CD2-SD 3.62Å; I483-M533 HydrophobicContact CB-CE 4.39Å; I483-M533 HydrophobicContact CD1-CE 4.28Å; I483-M533 HydrophobicContact CG1-CE 3.88Å; I483-M533 HydrophobicContact CG2-CE 3.85Å; Q484-M533 WeakPolarHBondContact CA-O 3.45Å; A485-M533 HydrophobicContact CB-CB 4.01Å; A485-M533 PolarHBondContact N-O 3.23Å; A529-M533 CarbonylContact O-C 3.49Å; A529-M533 WeakPolarHBondContact O-CA 3.29Å; A529-M533 WeakPolarHBondContact O-CB 3.22Å; A529-M533 PolarHBondContact O-N 3.2Å; M533-S535 PolarHBondContact O-N 3.15Å; M533-N538 WeakPolarHBondContact CA-ND2 3.32Å; M533-N538 PolarHBondContact O-ND2 3.48Å
534	L	95.4	Very high	93.7	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.042	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-55	138.1	-178.7	-173.4	71.3	0	0	0	111.1	A485 A529 K530 L536 K537 N538	A485-L534 CarbonylContact O-C 3.58Å; A485-L534 WeakPolarHBondContact O-CA 3.39Å; A529-L534 PolarHBondContact O-N 3.46Å; K530-L534 WeakPolarHBondContact O-CB 3.42Å; L534-L536 HydrophobicContact CD2-CB 4.24Å; L534-L536 HydrophobicContact CD2-CD1 3.98Å; L534-L536 HydrophobicContact CD2-CG 4.27Å; L534-L536 HydrophobicContact CG-CB 4.4Å; L534-L536 PolarHBondContact O-N 2.79Å; L534-L536 VanDerWaalsContact O-N 3.14Å; L534-K537 HydrophobicContact CB-CG 4.22Å; L534-K537 WeakPolarHBondContact O-CA 3.27Å; L534-K537 PolarHBondContact O-N 3.37Å; L534-N538 PolarHBondContact O-N 2.88Å; L534-N538 PolarHBondContact O-ND2 3.03Å
535	S	93.8	Very high	93.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-53.4	-38.2	-176	-159.4	0	0	0	0	112.7	I372 Q484 A485 M533 K537 N538 I539 I549	I372-S535 WeakPolarHBondContact O-CB 3.45Å; I372-S535 PolarHBondContact O-OG 3.42Å; Q484-S535 PolarHBondContact OE1-OG 2.97Å; A485-S535 PolarHBondContact O-N 3.09Å; M533-S535 PolarHBondContact O-N 3.15Å; S535-K537 PolarHBondContact O-N 3.33Å; S535-K537 VanDerWaalsContact O-N 3.17Å; S535-N538 CarbonylContact O-C 3.35Å; S535-N538 PolarHBondContact O-N 3.22Å; S535-I539 PolarHBondContact O-N 3.2Å; S535-I549 WeakPolarHBondContact OG-CD1 3.16Å
536	L	92.5	Very high	93.3	Very high	8 Å²	8	37 Å²	37	4%	0.042	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-55.1	-33.5	173.5	-65.6	177.5	0	0	0	114.1	I372 D373 L534 I539 R684 A688	I372-L536 HydrophobicContact CD1-CD2 4.12Å; I372-L536 HydrophobicContact CG1-CD2 4.07Å; D373-L536 HydrophobicContact CB-CD1 4.04Å; D373-L536 HydrophobicContact CB-CD2 3.85Å; D373-L536 HydrophobicContact CB-CG 3.52Å; D373-L536 WeakPolarHBondContact OD2-CD1 3.16Å; L534-L536 HydrophobicContact CD2-CB 4.24Å; L534-L536 HydrophobicContact CD2-CD1 3.98Å; L534-L536 HydrophobicContact CD2-CG 4.27Å; L534-L536 HydrophobicContact CG-CB 4.4Å; L534-L536 PolarHBondContact O-N 2.79Å; L534-L536 VanDerWaalsContact O-N 3.14Å; L536-I539 WeakPolarHBondContact O-CD1 3.2Å; L536-R684 WeakPolarHBondContact O-CD 3.3Å; L536-R684 WeakPolarHBondContact O-CG 3.34Å; L536-A688 HydrophobicContact CD2-CB 3.35Å
537	K	92.1	Very high	93.2	Very high	85 Å²	85	34.3 Å²	34.3	37%	0.37	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-86.7	-13.3	-178.4	-46.5	-61	-104.1	170.2	0	111.6	L534 S535	L534-K537 HydrophobicContact CB-CG 4.22Å; L534-K537 WeakPolarHBondContact O-CA 3.27Å; L534-K537 PolarHBondContact O-N 3.37Å; S535-K537 PolarHBondContact O-N 3.33Å; S535-K537 VanDerWaalsContact O-N 3.17Å
538	N	94	Very high	93	Very high	9 Å²	9	33.7 Å²	33.7	5%	0.048	16%	0.163	C	C	.	.			trans	-120.2	38.9	-176.9	-67.6	-68.7	0	0	0	112.7	R480 V481 L532 M533 L534 S535 V540	R480-N538 PolarHBondContact NH2-OD1 3.23Å; R480-N538 VanDerWaalsContact NH2-OD1 3.13Å; V481-N538 HydrophobicContact CG1-CB 4.2Å; L532-N538 PolarHBondContact O-ND2 3.4Å; M533-N538 WeakPolarHBondContact CA-ND2 3.32Å; M533-N538 PolarHBondContact O-ND2 3.48Å; L534-N538 PolarHBondContact O-N 2.88Å; L534-N538 PolarHBondContact O-ND2 3.03Å; S535-N538 CarbonylContact O-C 3.35Å; S535-N538 PolarHBondContact O-N 3.22Å; N538-V540 VanDerWaalsContact C-N 3.33Å
539	I	94.4	Very high	92.9	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	14%	0.143	C	C	.	.	S	Bend	trans	-67.9	-34.7	174.9	-65.9	170.3	0	0	0	111.2	I372 S535 L536 L548 I549 L679	I372-I539 HydrophobicContact CD1-CD1 4.18Å; I372-I539 HydrophobicContact CD1-CG1 4.4Å; S535-I539 PolarHBondContact O-N 3.2Å; L536-I539 WeakPolarHBondContact O-CD1 3.2Å; I539-L548 PolarHBondContact O-N 3.23Å; I539-I549 HydrophobicContact CG1-CD1 4.31Å; I539-I549 HydrophobicContact CG2-CB 4.3Å; I539-I549 PolarHBondContact O-N 2.87Å; I539-I549 VanDerWaalsContact O-N 3.14Å; I539-L679 HydrophobicContact CB-CD2 4.42Å; I539-L679 HydrophobicContact CD1-CD1 4.25Å; I539-L679 HydrophobicContact CG2-CD2 4.19Å
540	V	93.2	Very high	92.8	Very high	10 Å²	10	29.4 Å²	29.4	6%	0.061	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-97.9	150.7	-177.8	-68.1	0	0	0	0	112.5	N538 E546 Y676 L679 L921	N538-V540 VanDerWaalsContact C-N 3.33Å; V540-E546 CarbonylContact C-O 3.33Å; V540-E546 VanDerWaalsContact CA-O 3.32Å; V540-E546 WeakPolarHBondContact CA-O 3.29Å; V540-Y676 HydrophobicContact CG1-CD2 4.24Å; V540-Y676 HydrophobicContact CG1-CE2 4.1Å; V540-L679 HydrophobicContact CG1-CD2 3.5Å; V540-L921 HydrophobicContact CG2-CD2 3.78Å
541	S	91.3	Very high	92.8	Very high	15 Å²	15	25.1 Å²	25.1	11%	0.105	12%	0.124	C	C	.	.			trans	-80	133.5	176.7	-177.4	0	0	0	0	111.6	K543 G545 E546	S541-K543 PolarHBondContact O-N 3.28Å; S541-K543 WeakPolarHBondContact OG-CB 3.45Å; S541-K543 PolarHBondContact OG-N 2.89Å; S541-G545 WeakPolarHBondContact O-CA 3.38Å; S541-G545 PolarHBondContact O-N 2.86Å; S541-E546 PolarHBondContact N-O 2.77Å
542	P	90.5	Very high	92.7	Very high	7 Å²	7	21.4 Å²	21.4	5%	0.045	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-11.5	173.8	29.5	-35.3	0	0	0	113.7	R480 V481 L921 L1045 H1283	R480-P542 HydrophobicContact CG-CG 4.36Å; V481-P542 HydrophobicContact CG2-CG 4.47Å; P542-L921 VanDerWaalsContact CA-CD2 3.46Å; P542-L921 HydrophobicContact CB-CD2 3.99Å; P542-L921 HydrophobicContact CB-CG 4.31Å; P542-L1045 HydrophobicContact CB-CD2 4.4Å; P542-H1283 PolarHBondContact O-NE2 3.16Å
543	K	89.5	Confident	92.5	Very high	25 Å²	25	20.8 Å²	20.8	11%	0.109	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-46.5	-179.2	-178.6	176.3	67.8	-173.3	0	112.5	S541 E1052 P1053 V1277 E1278 V1279 N1280	S541-K543 PolarHBondContact O-N 3.28Å; S541-K543 WeakPolarHBondContact OG-CB 3.45Å; S541-K543 PolarHBondContact OG-N 2.89Å; K543-E1052 IonicContact NZ-OE2 3.41Å; K543-E1052 PolarHBondContact NZ-OE2 3.35Å; K543-P1053 HydrophobicContact CD-CG 3.77Å; K543-V1277 HydrophobicContact CD-CG1 4.41Å; K543-E1278 VanDerWaalsContact CD-O 3.25Å; K543-E1278 WeakPolarHBondContact CD-O 3.36Å; K543-E1278 WeakPolarHBondContact CE-O 3.44Å; K543-E1278 WeakPolarHBondContact CG-O 3.16Å; K543-V1279 HydrophobicContact CD-CG2 3.96Å; K543-V1279 HydrophobicContact CG-CB 4.35Å; K543-V1279 HydrophobicContact CG-CG1 4.43Å; K543-V1279 HydrophobicContact CG-CG2 3.93Å; K543-N1280 VanDerWaalsContact O-CB 3.27Å; K543-N1280 WeakPolarHBondContact O-CB 3.44Å; K543-N1280 PolarHBondContact O-N 3.09Å
544	N	88.1	Confident	92.5	Very high	9 Å²	9	22.3 Å²	22.3	5%	0.048	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.6	0.5	-169.1	60.1	-4.4	0	0	0	114.1	E546 K671	N544-E546 VanDerWaalsContact C-N 3.32Å; N544-E546 WeakPolarHBondContact ND2-CG 3.18Å; N544-E546 PolarHBondContact ND2-OE2 3.23Å; N544-E546 WeakPolarHBondContact OD1-CB 3.46Å; N544-E546 PolarHBondContact OD1-N 2.84Å; N544-K671 VanDerWaalsContact O-CE 3.25Å; N544-K671 WeakPolarHBondContact O-CE 3.35Å
545	G	89.7	Confident	92.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	79	10.6	-179.1	0	0	0	0	0	114.3	S541 Y676 P920	S541-G545 WeakPolarHBondContact O-CA 3.38Å; S541-G545 PolarHBondContact O-N 2.86Å; G545-Y676 WeakPolarHBondContact O-CE2 3.31Å; G545-P920 WeakPolarHBondContact CA-O 3.4Å; G545-P920 PolarHBondContact N-O 2.89Å
546	E	90.9	Very high	92.5	Very high	35 Å²	35	22.6 Å²	22.6	16%	0.164	11%	0.113	C	C	.	.			trans	-79.3	150	178.7	-68.6	-173.3	137.8	0	0	112.8	V540 S541 N544 L548 G669 K671	V540-E546 CarbonylContact C-O 3.33Å; V540-E546 VanDerWaalsContact CA-O 3.32Å; V540-E546 WeakPolarHBondContact CA-O 3.29Å; S541-E546 PolarHBondContact N-O 2.77Å; N544-E546 VanDerWaalsContact C-N 3.32Å; N544-E546 WeakPolarHBondContact ND2-CG 3.18Å; N544-E546 PolarHBondContact ND2-OE2 3.23Å; N544-E546 WeakPolarHBondContact OD1-CB 3.46Å; N544-E546 PolarHBondContact OD1-N 2.84Å; E546-L548 PolarHBondContact O-N 2.89Å; E546-G669 VanDerWaalsContact CD-C 3.49Å; E546-G669 VanDerWaalsContact OE1-C 3.26Å; E546-G669 WeakPolarHBondContact OE2-CA 3.32Å; E546-K671 HydrophobicContact CG-CG 4.14Å
547	P	92.9	Very high	92.6	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.019	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-64.8	124.9	174.5	28.2	-34	0	0	0	110.4	G668 G669 S670 Y676	P547-G668 WeakPolarHBondContact O-CA 3.48Å; P547-G669 PolarHBondContact O-N 3.08Å; P547-G669 VanDerWaalsContact O-N 3.12Å; P547-S670 WeakPolarHBondContact CD-O 3.4Å; P547-S670 WeakPolarHBondContact CG-O 3.37Å; P547-Y676 HydrophobicContact CG-CD2 4.41Å
548	L	91.8	Very high	92.8	Very high	31 Å²	31	18.2 Å²	18.2	16%	0.162	9%	0.094	C	C	.	.			trans	-98.8	-47.7	176.6	-164.4	77.1	0	0	0	110.4	V481 T504 P505 I539 E546 S550	V481-L548 HydrophobicContact CB-CD2 4.18Å; V481-L548 HydrophobicContact CG1-CD2 4.01Å; V481-L548 HydrophobicContact CG2-CD2 4.42Å; T504-L548 HydrophobicContact CG2-CD1 4.1Å; T504-L548 HydrophobicContact CG2-CG 4.35Å; P505-L548 HydrophobicContact CB-CD2 3.72Å; P505-L548 HydrophobicContact CB-CG 4.48Å; P505-L548 HydrophobicContact CG-CD2 3.78Å; P505-L548 HydrophobicContact CG-CG 4.07Å; I539-L548 PolarHBondContact O-N 3.23Å; E546-L548 PolarHBondContact O-N 2.89Å; L548-S550 PolarHBondContact O-N 3.07Å; L548-S550 PolarHBondContact O-OG 3Å
549	I	94.4	Very high	92.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-76.5	114.5	171.7	-58.5	178.7	0	0	0	107.5	I372 C501 P505 S535 I539 M691	I372-I549 HydrophobicContact CB-CG2 4.42Å; I372-I549 HydrophobicContact CD1-CG2 4.28Å; I372-I549 HydrophobicContact CG2-CG2 4.34Å; C501-I549 HydrophobicContact CB-CG2 4.18Å; P505-I549 HydrophobicContact CG-CD1 4.45Å; P505-I549 HydrophobicContact CG-CG1 3.62Å; S535-I549 WeakPolarHBondContact OG-CD1 3.16Å; I539-I549 HydrophobicContact CG1-CD1 4.31Å; I539-I549 HydrophobicContact CG2-CB 4.3Å; I539-I549 PolarHBondContact O-N 2.87Å; I539-I549 VanDerWaalsContact O-N 3.14Å; I549-M691 HydrophobicContact CG2-SD 4.13Å; I549-M691 VanDerWaalsContact O-CE 3.23Å; I549-M691 WeakPolarHBondContact O-CE 3.19Å
550	S	93.9	Very high	92.8	Very high	3 Å²	3	17.8 Å²	17.8	2%	0.021	9%	0.091	C	C	.	.			trans	-161.3	158.4	-174.8	56.1	0	0	0	0	110.5	C501 L548 G668	C501-S550 VanDerWaalsContact CA-O 3.31Å; C501-S550 WeakPolarHBondContact CA-O 3.27Å; C501-S550 PolarHBondContact O-N 3.41Å; L548-S550 PolarHBondContact O-N 3.07Å; L548-S550 PolarHBondContact O-OG 3Å; S550-G668 WeakPolarHBondContact OG-CA 3.4Å; S550-G668 PolarHBondContact OG-N 3.08Å
551	P	94.1	Very high	92.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.			trans	-57.9	138.5	172.9	-26.7	36.7	0	0	0	112.5	L555 I556 L666 F675 L694	P551-L555 HydrophobicContact CB-CB 3.77Å; P551-L555 HydrophobicContact CB-CD1 3.93Å; P551-I556 WeakPolarHBondContact O-CD1 3.27Å; P551-L666 WeakPolarHBondContact CD-O 3.48Å; P551-F675 HydrophobicContact CG-CD2 4.18Å; P551-F675 HydrophobicContact CG-CE2 3.44Å; P551-F675 VanDerWaalsContact CG-CE2 3.44Å; P551-F675 HydrophobicContact CG-CZ 3.88Å; P551-L694 HydrophobicContact CB-CD2 3.86Å; P551-L694 HydrophobicContact CG-CD2 3.46Å; P551-L694 VanDerWaalsContact CG-CD2 3.46Å
552	I	92.5	Very high	93.1	Very high	40 Å²	40	16.7 Å²	16.7	21%	0.205	8%	0.084	C	C	.	.			trans	-123.4	156.8	-178.6	61	168	0	0	0	111.5	P500 C503 D554 L555	P500-I552 HydrophobicContact CB-CD1 4.25Å; P500-I552 HydrophobicContact CB-CG1 4.41Å; P500-I552 VanDerWaalsContact O-CD1 3.29Å; P500-I552 WeakPolarHBondContact O-CD1 3.14Å; C503-I552 HydrophobicContact CB-CD1 4.26Å; I552-D554 PolarHBondContact O-N 3.45Å; I552-D554 VanDerWaalsContact O-N 3.11Å; I552-L555 WeakPolarHBondContact O-CB 3.42Å; I552-L555 PolarHBondContact O-N 2.88Å
553	Q	92.3	Very high	93.4	Very high	87 Å²	87	16.3 Å²	16.3	41%	0.407	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.7	-110.5	167.4	-58.8	-177.9	11.8	0	0	113.7	L555 I556 T557 S796	Q553-L555 PolarHBondContact O-N 3.24Å; Q553-I556 WeakPolarHBondContact O-CA 3.39Å; Q553-I556 WeakPolarHBondContact O-CB 3.44Å; Q553-I556 PolarHBondContact O-N 3.19Å; Q553-T557 PolarHBondContact O-N 3.33Å; Q553-T557 PolarHBondContact O-OG1 2.97Å; Q553-S796 VanDerWaalsContact O-CB 3.31Å; Q553-S796 WeakPolarHBondContact O-CB 3.26Å
554	D	94.3	Very high	93.6	Very high	90 Å²	90	17.4 Å²	17.4	48%	0.481	9%	0.089	S	C	.	.	H	α-helix	trans	-57.1	-34.5	-174.9	-64	-19.3	0	0	0	113	I552 I556 T557 A558 L699 L702	I552-D554 PolarHBondContact O-N 3.45Å; I552-D554 VanDerWaalsContact O-N 3.11Å; D554-I556 VanDerWaalsContact C-N 3.32Å; D554-I556 PolarHBondContact O-N 3.4Å; D554-T557 PolarHBondContact O-N 2.98Å; D554-A558 WeakPolarHBondContact O-CB 3.43Å; D554-A558 PolarHBondContact O-N 3.09Å; D554-L699 HydrophobicContact CB-CD2 4.16Å; D554-L702 HydrophobicContact CB-CD2 4.07Å
555	L	94.8	Very high	93.7	Very high	9 Å²	9	23.1 Å²	23.1	5%	0.047	11%	0.113	C	C	.	.	H	α-helix	trans	-63.7	-40	175.8	-62.1	179.4	0	0	0	111.5	P551 I552 Q553 T559 A698 L699	P551-L555 HydrophobicContact CB-CB 3.77Å; P551-L555 HydrophobicContact CB-CD1 3.93Å; I552-L555 WeakPolarHBondContact O-CB 3.42Å; I552-L555 PolarHBondContact O-N 2.88Å; Q553-L555 PolarHBondContact O-N 3.24Å; L555-T559 WeakPolarHBondContact O-CB 3.44Å; L555-T559 PolarHBondContact O-N 3.37Å; L555-T559 VanDerWaalsContact O-N 3.12Å; L555-T559 PolarHBondContact O-OG1 3.31Å; L555-A698 HydrophobicContact CD2-CB 4.25Å; L555-L699 HydrophobicContact CD2-CD1 4.09Å; L555-L699 HydrophobicContact CD2-CD2 3.86Å; L555-L699 HydrophobicContact CD2-CG 3.65Å
556	I	95	Very high	93.8	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-69.5	-49.1	176.9	-59	174.4	0	0	0	109.5	P551 Q553 D554 A558 T559 H560 K663	P551-I556 WeakPolarHBondContact O-CD1 3.27Å; Q553-I556 WeakPolarHBondContact O-CA 3.39Å; Q553-I556 WeakPolarHBondContact O-CB 3.44Å; Q553-I556 PolarHBondContact O-N 3.19Å; D554-I556 VanDerWaalsContact C-N 3.32Å; D554-I556 PolarHBondContact O-N 3.4Å; I556-A558 PolarHBondContact O-N 3.02Å; I556-T559 PolarHBondContact O-N 2.62Å; I556-H560 VanDerWaalsContact O-CB 3.29Å; I556-H560 WeakPolarHBondContact O-CB 3.31Å; I556-H560 PolarHBondContact O-N 2.87Å; I556-K663 HydrophobicContact CD1-CB 4.16Å; I556-K663 HydrophobicContact CD1-CG 4.12Å; I556-K663 HydrophobicContact CG2-CB 4.32Å
557	T	95.2	Very high	94	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-47.6	-180	-52.5	0	0	0	0	111.2	Q553 D554 T559 H560 L561 F707 V790 S796	Q553-T557 PolarHBondContact O-N 3.33Å; Q553-T557 PolarHBondContact O-OG1 2.97Å; D554-T557 PolarHBondContact O-N 2.98Å; T557-T559 PolarHBondContact O-N 3.01Å; T557-H560 WeakPolarHBondContact O-CB 3.31Å; T557-H560 PolarHBondContact O-N 3.44Å; T557-L561 HydrophobicContact CG2-CD1 4.05Å; T557-L561 HydrophobicContact CG2-CG 4.5Å; T557-L561 WeakPolarHBondContact O-CB 3.33Å; T557-L561 VanDerWaalsContact O-CG 3.3Å; T557-L561 WeakPolarHBondContact O-CG 3.45Å; T557-L561 PolarHBondContact O-N 3.17Å; T557-F707 HydrophobicContact CG2-CD1 4.18Å; T557-F707 HydrophobicContact CG2-CE1 3.8Å; T557-F707 HydrophobicContact CG2-CE2 4.39Å; T557-F707 HydrophobicContact CG2-CZ 3.91Å; T557-V790 HydrophobicContact CG2-CG1 4.37Å; T557-S796 WeakPolarHBondContact OG1-CB 3.42Å; T557-S796 PolarHBondContact OG1-OG 3.14Å
558	A	95.4	Very high	94.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-43.6	179.7	0	0	0	0	0	112.2	D554 I556 L561 L562 A698 L702	D554-A558 WeakPolarHBondContact O-CB 3.43Å; D554-A558 PolarHBondContact O-N 3.09Å; I556-A558 PolarHBondContact O-N 3.02Å; A558-L561 PolarHBondContact O-N 3.05Å; A558-L562 VanDerWaalsContact O-CB 3.3Å; A558-L562 WeakPolarHBondContact O-CB 3.38Å; A558-L562 PolarHBondContact O-N 3.2Å; A558-A698 HydrophobicContact CB-CB 3.81Å; A558-A698 VanDerWaalsContact CB-O 3.29Å; A558-A698 WeakPolarHBondContact CB-O 3.16Å; A558-L702 HydrophobicContact CB-CB 3.81Å; A558-L702 HydrophobicContact CB-CD1 4.23Å; A558-L702 HydrophobicContact CB-CD2 4.16Å; A558-L702 HydrophobicContact CB-CG 4.29Å
559	T	95.1	Very high	94.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-70.5	-38.5	179.6	-50.2	0	0	0	0	111.5	L555 I556 T557 L562 T563 F611 V661 L666 L694	L555-T559 WeakPolarHBondContact O-CB 3.44Å; L555-T559 PolarHBondContact O-N 3.37Å; L555-T559 VanDerWaalsContact O-N 3.12Å; L555-T559 PolarHBondContact O-OG1 3.31Å; I556-T559 PolarHBondContact O-N 2.62Å; T557-T559 PolarHBondContact O-N 3.01Å; T559-L562 PolarHBondContact O-N 3.41Å; T559-T563 HydrophobicContact CG2-CG2 4.37Å; T559-T563 WeakPolarHBondContact O-CB 3.34Å; T559-T563 WeakPolarHBondContact O-CG2 3.48Å; T559-T563 PolarHBondContact O-N 2.69Å; T559-T563 PolarHBondContact O-OG1 3.1Å; T559-F611 HydrophobicContact CG2-CD2 3.68Å; T559-F611 HydrophobicContact CG2-CE2 3.5Å; T559-F611 VanDerWaalsContact CG2-CE2 3.5Å; T559-V661 HydrophobicContact CG2-CB 4.39Å; T559-V661 HydrophobicContact CG2-CG1 4.4Å; T559-L666 HydrophobicContact CG2-CD1 3.61Å; T559-L694 HydrophobicContact CG2-CD1 4.04Å; T559-L694 WeakPolarHBondContact OG1-CD1 3.49Å
560	H	94.6	Very high	94.4	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-58.4	-51.1	173.1	-178.3	73.1	0	0	0	110.6	I556 T557 L562 T563 L564 V661	I556-H560 VanDerWaalsContact O-CB 3.29Å; I556-H560 WeakPolarHBondContact O-CB 3.31Å; I556-H560 PolarHBondContact O-N 2.87Å; T557-H560 WeakPolarHBondContact O-CB 3.31Å; T557-H560 PolarHBondContact O-N 3.44Å; H560-L562 VanDerWaalsContact C-N 3.34Å; H560-L562 PolarHBondContact O-N 3.32Å; H560-T563 PolarHBondContact O-N 3.02Å; H560-T563 PolarHBondContact O-OG1 3Å; H560-L564 PolarHBondContact O-N 3.02Å; H560-V661 WeakPolarHBondContact CA-O 3.23Å; H560-V661 WeakPolarHBondContact CB-O 3.48Å; H560-V661 PolarHBondContact ND1-O 3.33Å
561	L	95.3	Very high	94.4	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-40.3	177.1	-73.1	173.8	0	0	0	112.5	T557 A558 T563 L564 V567 F701 L702 F707 V790	T557-L561 HydrophobicContact CG2-CD1 4.05Å; T557-L561 HydrophobicContact CG2-CG 4.5Å; T557-L561 WeakPolarHBondContact O-CB 3.33Å; T557-L561 VanDerWaalsContact O-CG 3.3Å; T557-L561 WeakPolarHBondContact O-CG 3.45Å; T557-L561 PolarHBondContact O-N 3.17Å; A558-L561 PolarHBondContact O-N 3.05Å; L561-T563 VanDerWaalsContact C-N 3.31Å; L561-T563 PolarHBondContact O-N 3.38Å; L561-L564 HydrophobicContact CD2-CD1 3.92Å; L561-V567 VanDerWaalsContact O-CG2 3.3Å; L561-V567 WeakPolarHBondContact O-CG2 3.34Å; L561-F701 HydrophobicContact CB-CE1 4.07Å; L561-L702 HydrophobicContact CD1-CD1 3.88Å; L561-F707 HydrophobicContact CD1-CD2 3.83Å; L561-F707 HydrophobicContact CD1-CE2 4.2Å; L561-F707 HydrophobicContact CD1-CG 4.37Å; L561-V790 HydrophobicContact CD2-CG1 3.78Å; L561-V790 HydrophobicContact CG-CG1 4.16Å
562	L	95.5	Very high	94.5	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-35.2	177.4	-179.8	63.7	0	0	0	111.9	A558 T559 H560 G607 I697 F701	A558-L562 VanDerWaalsContact O-CB 3.3Å; A558-L562 WeakPolarHBondContact O-CB 3.38Å; A558-L562 PolarHBondContact O-N 3.2Å; T559-L562 PolarHBondContact O-N 3.41Å; H560-L562 VanDerWaalsContact C-N 3.34Å; H560-L562 PolarHBondContact O-N 3.32Å; L562-G607 CarbonylContact O-C 3.55Å; L562-G607 VanDerWaalsContact O-CA 3.24Å; L562-G607 WeakPolarHBondContact O-CA 3.38Å; L562-I697 HydrophobicContact CD2-CG2 4.11Å; L562-F701 HydrophobicContact CB-CD1 3.95Å; L562-F701 HydrophobicContact CB-CE1 3.81Å; L562-F701 HydrophobicContact CB-CZ 4.29Å; L562-F701 HydrophobicContact CD1-CD1 4.29Å; L562-F701 HydrophobicContact CD1-CD2 3.9Å; L562-F701 HydrophobicContact CD1-CE1 4.26Å; L562-F701 HydrophobicContact CD1-CE2 3.87Å; L562-F701 HydrophobicContact CD1-CG 4.1Å; L562-F701 HydrophobicContact CD1-CZ 4.04Å
563	T	95.6	Very high	94.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-91.2	2	-174.5	55.7	0	0	0	0	114.2	T559 H560 L561 K608 F611 L656 V661	T559-T563 HydrophobicContact CG2-CG2 4.37Å; T559-T563 WeakPolarHBondContact O-CB 3.34Å; T559-T563 WeakPolarHBondContact O-CG2 3.48Å; T559-T563 PolarHBondContact O-N 2.69Å; T559-T563 PolarHBondContact O-OG1 3.1Å; H560-T563 PolarHBondContact O-N 3.02Å; H560-T563 PolarHBondContact O-OG1 3Å; L561-T563 VanDerWaalsContact C-N 3.31Å; L561-T563 PolarHBondContact O-N 3.38Å; T563-K608 WeakPolarHBondContact O-CE 3.37Å; T563-K608 PolarHBondContact O-NZ 2.96Å; T563-F611 HydrophobicContact CG2-CB 4.03Å; T563-F611 HydrophobicContact CG2-CD2 4.16Å; T563-F611 HydrophobicContact CG2-CG 4.07Å; T563-L656 HydrophobicContact CG2-CD2 3.62Å; T563-V661 HydrophobicContact CG2-CB 4.4Å; T563-V661 HydrophobicContact CG2-CG2 3.85Å; T563-V661 PolarHBondContact OG1-N 3.03Å; T563-V661 VanDerWaalsContact OG1-N 3.1Å
564	L	93.8	Very high	94.7	Very high	48 Å²	48	47.1 Å²	47.1	25%	0.251	23%	0.227	S	C	.	.	S	Bend	trans	-57.2	147.2	170.7	-69.9	174.9	0	0	0	111.5	H560 L561 D566 V567	H560-L564 PolarHBondContact O-N 3.02Å; L561-L564 HydrophobicContact CD2-CD1 3.92Å; L564-D566 PolarHBondContact O-N 2.87Å; L564-V567 HydrophobicContact CB-CG2 4.11Å; L564-V567 PolarHBondContact O-N 2.76Å
565	K	91.5	Very high	94.7	Very high	128 Å²	128	45.3 Å²	45.3	56%	0.557	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-29.4	-178.8	-172.1	174	-78.2	-178.9	0	113	V567	K565-V567 VanDerWaalsContact C-N 3.31Å; K565-V567 PolarHBondContact O-N 2.99Å
566	D	90.6	Very high	94.7	Very high	139 Å²	139	48.1 Å²	48.1	74%	0.743	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	3	-174.5	-55.2	-32.3	0	0	0	114	L564 F568	L564-D566 PolarHBondContact O-N 2.87Å; D566-F568 PolarHBondContact O-N 3.07Å
567	V	94.6	Very high	94.6	Very high	23 Å²	23	48.4 Å²	48.4	14%	0.139	24%	0.24	C	C	.	.			trans	-88.3	104.2	180	178.5	0	0	0	0	110.7	L561 L564 K565 L569 T606 G607 F701	L561-V567 VanDerWaalsContact O-CG2 3.3Å; L561-V567 WeakPolarHBondContact O-CG2 3.34Å; L564-V567 HydrophobicContact CB-CG2 4.11Å; L564-V567 PolarHBondContact O-N 2.76Å; K565-V567 VanDerWaalsContact C-N 3.31Å; K565-V567 PolarHBondContact O-N 2.99Å; V567-L569 HydrophobicContact CG1-CD2 4.29Å; V567-L569 HydrophobicContact CG1-CG 4.29Å; V567-T606 WeakPolarHBondContact O-CA 3.33Å; V567-G607 PolarHBondContact O-N 3.1Å; V567-G607 VanDerWaalsContact O-N 3.1Å; V567-F701 HydrophobicContact CG1-CZ 4.49Å
568	F	96.2	Very high	94.5	Very high	94 Å²	94	48.4 Å²	48.4	41%	0.412	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.3	172.3	-61.7	-79.2	0	0	0	110.8	D566 I598 L604 W605 T606	D566-F568 PolarHBondContact O-N 3.07Å; F568-I598 HydrophobicContact CD1-CD1 3.89Å; F568-I598 HydrophobicContact CE1-CD1 3.52Å; F568-I598 HydrophobicContact CE1-CG1 4.4Å; F568-I598 HydrophobicContact CZ-CD1 4.24Å; F568-L604 HydrophobicContact CB-CB 4.44Å; F568-L604 HydrophobicContact CB-CD1 4.22Å; F568-L604 HydrophobicContact CD1-CB 4.4Å; F568-W605 CarbonylContact C-O 3.56Å; F568-W605 WeakPolarHBondContact CA-O 3.23Å; F568-T606 HydrophobicContact CD1-CG2 4.16Å; F568-T606 HydrophobicContact CE1-CG2 3.92Å
569	L	96	Very high	94.3	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.063	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.5	-175.4	-59	169.6	0	0	0	109.2	V567 Q573 L577 W605 I610	V567-L569 HydrophobicContact CG1-CD2 4.29Å; V567-L569 HydrophobicContact CG1-CG 4.29Å; L569-Q573 HydrophobicContact CB-CB 4.29Å; L569-Q573 HydrophobicContact CD2-CB 4.22Å; L569-L577 HydrophobicContact CD1-CD1 3.71Å; L569-L577 HydrophobicContact CD2-CD1 4.43Å; L569-W605 PolarHBondContact N-O 2.86Å; L569-W605 PolarHBondContact O-N 3.26Å; L569-I610 HydrophobicContact CD1-CG1 3.6Å
570	N	95.5	Very high	94.1	Very high	63 Å²	63	53 Å²	53	34%	0.337	27%	0.269	S	S	.	.			trans	-73.9	171	168.7	71	8.5	0	0	0	110.4	D572 Q573 A574	N570-D572 VanDerWaalsContact C-N 3.29Å; N570-D572 PolarHBondContact O-N 3.34Å; N570-D572 PolarHBondContact OD1-N 2.92Å; N570-Q573 PolarHBondContact O-N 3.43Å; N570-Q573 VanDerWaalsContact OD1-CB 3.23Å; N570-Q573 WeakPolarHBondContact OD1-CB 3.45Å; N570-Q573 WeakPolarHBondContact OD1-CG 3.47Å; N570-Q573 PolarHBondContact OD1-N 3.26Å; N570-Q573 PolarHBondContact OD1-OE1 3.08Å; N570-A574 WeakPolarHBondContact O-CB 3.3Å; N570-A574 PolarHBondContact O-N 2.8Å
571	R	95.2	Very high	93.8	Very high	161 Å²	161	52.9 Å²	52.9	61%	0.608	27%	0.269	S	S	*	.	H	α-helix	trans	-56.3	-42.4	-178.9	-173.5	179.7	173.1	115	-1.2	112.4	A574 C575 W605	R571-A574 PolarHBondContact O-N 3.29Å; R571-C575 VanDerWaalsContact O-CB 3.31Å; R571-C575 WeakPolarHBondContact O-CB 3.21Å; R571-C575 PolarHBondContact O-N 3.19Å; R571-C575 PolarHBondContact O-SG 2.86Å; R571-W605 HydrophobicContact CB-CH2 4.17Å; R571-W605 HydrophobicContact CB-CZ3 3.76Å; R571-W605 HydrophobicContact CG-CH2 4.2Å; R571-W605 HydrophobicContact CG-CZ3 4.27Å
572	D	95.2	Very high	93.4	Very high	115 Å²	115	56.7 Å²	56.7	62%	0.615	29%	0.289	S	S	*	.	H	α-helix	trans	-66.9	-44	-176.1	-60.8	-21.6	0	0	0	111.8	N570 C575 T576	N570-D572 VanDerWaalsContact C-N 3.29Å; N570-D572 PolarHBondContact O-N 3.34Å; N570-D572 PolarHBondContact OD1-N 2.92Å; D572-C575 PolarHBondContact O-N 3.37Å; D572-T576 WeakPolarHBondContact O-CB 3.25Å; D572-T576 PolarHBondContact O-N 3.12Å; D572-T576 PolarHBondContact O-OG1 2.82Å
573	Q	95.1	Very high	93	Very high	97 Å²	97	57.4 Å²	57.4	45%	0.453	30%	0.295	S	S	.	.	H	α-helix	trans	-63.6	-45.5	174.7	-71.1	166.8	-21.3	0	0	111.2	L569 N570 T576 L577	L569-Q573 HydrophobicContact CB-CB 4.29Å; L569-Q573 HydrophobicContact CD2-CB 4.22Å; N570-Q573 PolarHBondContact O-N 3.43Å; N570-Q573 VanDerWaalsContact OD1-CB 3.23Å; N570-Q573 WeakPolarHBondContact OD1-CB 3.45Å; N570-Q573 WeakPolarHBondContact OD1-CG 3.47Å; N570-Q573 PolarHBondContact OD1-N 3.26Å; N570-Q573 PolarHBondContact OD1-OE1 3.08Å; Q573-T576 PolarHBondContact O-N 2.9Å; Q573-L577 WeakPolarHBondContact O-CG 3.41Å; Q573-L577 PolarHBondContact O-N 2.59Å
574	A	94.2	Very high	92.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.1	-47	177.2	0	0	0	0	0	111.5	N570 R571 T576 L577 A578 W605 I610	N570-A574 WeakPolarHBondContact O-CB 3.3Å; N570-A574 PolarHBondContact O-N 2.8Å; R571-A574 PolarHBondContact O-N 3.29Å; A574-T576 PolarHBondContact O-N 3.01Å; A574-L577 PolarHBondContact O-N 2.71Å; A574-A578 WeakPolarHBondContact O-CB 3.35Å; A574-A578 PolarHBondContact O-N 3.12Å; A574-W605 HydrophobicContact CB-CB 4.34Å; A574-W605 HydrophobicContact CB-CD2 4.36Å; A574-W605 HydrophobicContact CB-CG 4.28Å; A574-I610 HydrophobicContact CB-CD1 3.92Å
575	C	93.8	Very high	91.4	Very high	52 Å²	52	62.4 Å²	62.4	35%	0.351	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-39.9	176	-75.2	0	0	0	0	112.2	R571 D572 A578 A579	R571-C575 VanDerWaalsContact O-CB 3.31Å; R571-C575 WeakPolarHBondContact O-CB 3.21Å; R571-C575 PolarHBondContact O-N 3.19Å; R571-C575 PolarHBondContact O-SG 2.86Å; D572-C575 PolarHBondContact O-N 3.37Å; C575-A578 PolarHBondContact O-N 2.96Å; C575-A579 VanDerWaalsContact O-CB 3.29Å; C575-A579 WeakPolarHBondContact O-CB 3.26Å; C575-A579 PolarHBondContact O-N 3.21Å
576	T	94.6	Very high	90.7	Very high	68 Å²	68	56.6 Å²	56.6	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-42.3	179	-57.6	0	0	0	0	111.6	D572 Q573 A574 Q580 F700	D572-T576 WeakPolarHBondContact O-CB 3.25Å; D572-T576 PolarHBondContact O-N 3.12Å; D572-T576 PolarHBondContact O-OG1 2.82Å; Q573-T576 PolarHBondContact O-N 2.9Å; A574-T576 PolarHBondContact O-N 3.01Å; T576-Q580 PolarHBondContact O-NE2 3.42Å; T576-F700 HydrophobicContact CG2-CE1 3.72Å; T576-F700 HydrophobicContact CG2-CZ 3.68Å
577	L	94.2	Very high	90.1	Very high	9 Å²	9	56.4 Å²	56.4	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-45.4	174.1	-73	167.6	0	0	0	111.3	L569 Q573 A574 A579 Q580 I610 F700 F701	L569-L577 HydrophobicContact CD1-CD1 3.71Å; L569-L577 HydrophobicContact CD2-CD1 4.43Å; Q573-L577 WeakPolarHBondContact O-CG 3.41Å; Q573-L577 PolarHBondContact O-N 2.59Å; A574-L577 PolarHBondContact O-N 2.71Å; L577-A579 VanDerWaalsContact C-N 3.31Å; L577-A579 PolarHBondContact O-N 2.7Å; L577-Q580 WeakPolarHBondContact O-CB 3.26Å; L577-Q580 PolarHBondContact O-N 2.86Å; L577-I610 HydrophobicContact CB-CG2 4.22Å; L577-I610 HydrophobicContact CD1-CG2 4.44Å; L577-F700 HydrophobicContact CD2-CD1 3.8Å; L577-F700 HydrophobicContact CD2-CE1 4.42Å; L577-F701 HydrophobicContact CD1-CD2 4.35Å; L577-F701 HydrophobicContact CD2-CB 3.85Å; L577-F701 HydrophobicContact CD2-CD2 4.41Å
578	A	92	Very high	89.3	Confident	3 Å²	3	59.5 Å²	59.5	3%	0.025	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-36.9	178.7	0	0	0	0	0	112.4	A574 C575 Q580 L581 L591 L593 L613	A574-A578 WeakPolarHBondContact O-CB 3.35Å; A574-A578 PolarHBondContact O-N 3.12Å; C575-A578 PolarHBondContact O-N 2.96Å; A578-Q580 PolarHBondContact O-N 3.07Å; A578-L581 WeakPolarHBondContact O-CB 3.49Å; A578-L581 PolarHBondContact O-N 3.1Å; A578-L581 VanDerWaalsContact O-N 3.1Å; A578-L591 HydrophobicContact CB-CD2 3.64Å; A578-L593 HydrophobicContact CB-CD1 4.03Å; A578-L613 HydrophobicContact CB-CD1 4.01Å
579	A	91.4	Very high	88.5	Confident	47 Å²	47	61.7 Å²	61.7	39%	0.388	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-24.1	177.3	0	0	0	0	0	113	C575 L577 L581 L582	C575-A579 VanDerWaalsContact O-CB 3.29Å; C575-A579 WeakPolarHBondContact O-CB 3.26Å; C575-A579 PolarHBondContact O-N 3.21Å; L577-A579 VanDerWaalsContact C-N 3.31Å; L577-A579 PolarHBondContact O-N 2.7Å; A579-L581 PolarHBondContact O-N 2.84Å; A579-L581 VanDerWaalsContact O-N 3.13Å; A579-L582 WeakPolarHBondContact O-CB 3.44Å; A579-L582 PolarHBondContact O-N 3.36Å
580	Q	91.3	Very high	87.9	Confident	48 Å²	48	68.4 Å²	68.4	22%	0.224	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20	175.6	-59.6	-52.1	-42.5	0	0	112.9	T576 L577 A578 L582 R696 I697 F700	T576-Q580 PolarHBondContact O-NE2 3.42Å; L577-Q580 WeakPolarHBondContact O-CB 3.26Å; L577-Q580 PolarHBondContact O-N 2.86Å; A578-Q580 PolarHBondContact O-N 3.07Å; Q580-L582 VanDerWaalsContact C-N 3.34Å; Q580-R696 HydrophobicContact CB-CB 4.48Å; Q580-R696 VanDerWaalsContact O-CZ 3.27Å; Q580-R696 PolarHBondContact O-NE 2.83Å; Q580-R696 PolarHBondContact O-NH2 3.14Å; Q580-R696 VanDerWaalsContact O-NH2 3.15Å; Q580-I697 HydrophobicContact CB-CG1 4.41Å; Q580-F700 HydrophobicContact CG-CB 4.04Å; Q580-F700 HydrophobicContact CG-CD1 4.1Å; Q580-F700 HydrophobicContact CG-CD2 4.02Å; Q580-F700 HydrophobicContact CG-CG 3.78Å
581	L	88.3	Confident	87.3	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.3	176.4	-60.9	174	0	0	0	113.4	A578 A579 A583 H586 L591 L613 P617 R693 I697	A578-L581 WeakPolarHBondContact O-CB 3.49Å; A578-L581 PolarHBondContact O-N 3.1Å; A578-L581 VanDerWaalsContact O-N 3.1Å; A579-L581 PolarHBondContact O-N 2.84Å; A579-L581 VanDerWaalsContact O-N 3.13Å; L581-A583 VanDerWaalsContact C-N 3.25Å; L581-A583 PolarHBondContact O-N 2.84Å; L581-H586 VanDerWaalsContact O-CB 3.27Å; L581-H586 WeakPolarHBondContact O-CB 3.46Å; L581-L591 HydrophobicContact CB-CD1 4.4Å; L581-L591 HydrophobicContact CD1-CD1 4.02Å; L581-L613 HydrophobicContact CD1-CB 3.97Å; L581-P617 HydrophobicContact CD1-CB 4.34Å; L581-R693 HydrophobicContact CD2-CB 3.56Å; L581-R693 HydrophobicContact CD2-CG 3.68Å; L581-I697 HydrophobicContact CD1-CD1 3.86Å; L581-I697 HydrophobicContact CD2-CD1 3.6Å; L581-I697 HydrophobicContact CD2-CG1 3.95Å; L581-I697 HydrophobicContact CG-CD1 3.7Å; L581-I697 HydrophobicContact CG-CG1 4.2Å
582	L	87.4	Confident	86.7	Confident	82 Å²	82	62.7 Å²	62.7	43%	0.429	37%	0.37	S	S	.	.			trans	-79.3	68.4	-173.8	-62.3	175	0	0	0	111.9	A579 Q580 L591	A579-L582 WeakPolarHBondContact O-CB 3.44Å; A579-L582 PolarHBondContact O-N 3.36Å; Q580-L582 VanDerWaalsContact C-N 3.34Å; L582-L591 HydrophobicContact CD2-CB 4.37Å
583	A	85.9	Confident	86.4	Confident	16 Å²	16	59.4 Å²	59.4	13%	0.132	35%	0.353	C	S	.	.	S	Bend	trans	-152.3	167.4	175.3	0	0	0	0	0	111.8	L581 N585 H586 W692 R696	L581-A583 VanDerWaalsContact C-N 3.25Å; L581-A583 PolarHBondContact O-N 2.84Å; A583-N585 PolarHBondContact O-N 3.11Å; A583-H586 WeakPolarHBondContact O-CB 3.4Å; A583-H586 PolarHBondContact O-N 3.46Å; A583-W692 HydrophobicContact CB-CH2 3.79Å; A583-W692 HydrophobicContact CB-CZ2 4.3Å; A583-W692 WeakPolarHBondContact O-CH2 3.46Å; A583-R696 VanDerWaalsContact CB-CZ 3.43Å
584	G	80.7	Confident	86.2	Confident	52 Å²	52	56.5 Å²	56.5	54%	0.536	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	54.7	-126.7	-179.2	0	0	0	0	0	111.3	H586 L587	G584-H586 PolarHBondContact O-N 3.47Å; G584-H586 VanDerWaalsContact O-N 3.11Å; G584-L587 WeakPolarHBondContact O-CB 3.5Å; G584-L587 PolarHBondContact O-N 3.15Å; G584-L587 VanDerWaalsContact O-N 3.12Å
585	N	76.3	Confident	86.1	Confident	101 Å²	101	65.3 Å²	65.3	54%	0.54	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-67.9	-10	-177.8	-60.8	-8.9	0	0	0	114.3	R371 A583	R371-N585 PolarHBondContact NH1-ND2 3.46Å; A583-N585 PolarHBondContact O-N 3.11Å
586	H	76.7	Confident	86.2	Confident	5 Å²	5	64 Å²	64	2%	0.023	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-92	-6.4	177.1	-64	-77.3	0	0	0	113.1	L581 A583 G584 G588 R589 H618 W692 R693	L581-H586 VanDerWaalsContact O-CB 3.27Å; L581-H586 WeakPolarHBondContact O-CB 3.46Å; A583-H586 WeakPolarHBondContact O-CB 3.4Å; A583-H586 PolarHBondContact O-N 3.46Å; G584-H586 PolarHBondContact O-N 3.47Å; G584-H586 VanDerWaalsContact O-N 3.11Å; H586-G588 PolarHBondContact O-N 3.11Å; H586-R589 PolarHBondContact O-N 2.9Å; H586-R589 VanDerWaalsContact O-N 3.14Å; H586-H618 AromaticContact CE1-NE2 3.88Å; H586-H618 AromaticContact ND1-CD2 3.79Å; H586-H618 AromaticContact ND1-NE2 3.03Å; H586-H618 PolarHBondContact ND1-NE2 2.74Å; H586-W692 AromaticContact CD2-CZ3 3.88Å; H586-R693 PolarHBondContact CE1-NE 3.23Å; H586-R693 VanDerWaalsContact CE1-NE 3.26Å; H586-R693 PolarHBondContact CE1-NH2 2.99Å; H586-R693 VanDerWaalsContact CE1-NH2 3.33Å; H586-R693 PolarHBondContact NE2-NE 3.02Å; H586-R693 PolarHBondContact NE2-NH2 3.12Å
587	L	78.5	Confident	86.2	Confident	136 Å²	136	63.5 Å²	63.5	71%	0.712	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	121.1	176.8	-144.5	94	0	0	0	109.4	G584	G584-L587 WeakPolarHBondContact O-CB 3.5Å; G584-L587 PolarHBondContact O-N 3.15Å; G584-L587 VanDerWaalsContact O-N 3.12Å
588	G	76.7	Confident	86.2	Confident	87 Å²	87	65.6 Å²	65.6	90%	0.897	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	0.2	180	0	0	0	0	0	116.3	H586	H586-G588 PolarHBondContact O-N 3.11Å
589	R	80.6	Confident	86.3	Confident	141 Å²	141	72.1 Å²	72.1	53%	0.532	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-93.8	135.7	174.3	-66.7	-175.6	176.8	-177.9	-0.2	111.4	H586 L591 H618	H586-R589 PolarHBondContact O-N 2.9Å; H586-R589 VanDerWaalsContact O-N 3.14Å; R589-L591 PolarHBondContact O-N 3.11Å; R589-H618 WeakPolarHBondContact CB-CE1 3.21Å
590	L	81.7	Confident	86.3	Confident	152 Å²	152	80.6 Å²	80.6	80%	0.796	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-69.5	116.9	-177.4	-162.6	113	0	0	0	111.1	H618	L590-H618 PolarHBondContact O-ND1 3.44Å
591	L	84.4	Confident	86.4	Confident	43 Å²	43	83.1 Å²	83.1	23%	0.225	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-86	129.3	174.9	-164	90	0	0	0	109.8	A578 L581 L582 R589 P617	A578-L591 HydrophobicContact CB-CD2 3.64Å; L581-L591 HydrophobicContact CB-CD1 4.4Å; L581-L591 HydrophobicContact CD1-CD1 4.02Å; L582-L591 HydrophobicContact CD2-CB 4.37Å; R589-L591 PolarHBondContact O-N 3.11Å; L591-P617 HydrophobicContact CD1-CB 3.82Å
592	S	81.4	Confident	86.7	Confident	61 Å²	61	87.3 Å²	87.3	43%	0.427	49%	0.486	S	S	.	.			trans	-103.4	113.2	176.7	-174.9	0	0	0	0	110.2	L613	S592-L613 WeakPolarHBondContact O-CD2 3.42Å
593	L	88.5	Confident	87	Confident	47 Å²	47	85.5 Å²	85.5	25%	0.246	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-70.7	133.7	171.9	-158.6	78	0	0	0	109.3	A578 W605 L613	A578-L593 HydrophobicContact CB-CD1 4.03Å; L593-W605 HydrophobicContact CD2-CH2 4.47Å; L593-W605 HydrophobicContact CD2-CZ2 3.73Å; L593-L613 HydrophobicContact CD1-CD1 4.31Å
594	P	90.9	Very high	87.5	Confident	35 Å²	35	86.8 Å²	86.8	23%	0.227	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-63.5	163.3	176.8	24.9	-34	0	0	0	111.4	W605 Q609	P594-W605 PolarHBondContact O-NE1 2.9Å; P594-Q609 HydrophobicContact CG-CB 4.05Å
595	K	93	Very high	88.3	Confident	185 Å²	185	84.9 Å²	84.9	80%	0.804	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-65.3	141.5	171.3	-68.3	-178	-179	177.4	0	109.8	Q609	K595-Q609 PolarHBondContact O-NE2 3.21Å
596	P	95.2	Very high	89.3	Confident	26 Å²	26	81.4 Å²	81.4	17%	0.169	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-62	140.3	179.1	26.3	-33	0	0	0	110.4	L599 A603 L604 W605	P596-L599 HydrophobicContact CG-CD2 3.86Å; P596-L599 HydrophobicContact CG-CG 4.32Å; P596-A603 HydrophobicContact CB-CB 4.38Å; P596-A603 HydrophobicContact CG-CB 4.3Å; P596-L604 WeakPolarHBondContact CB-O 3.33Å; P596-W605 HydrophobicContact CB-CD2 3.86Å; P596-W605 HydrophobicContact CB-CE3 4.05Å; P596-W605 HydrophobicContact CB-CG 4.48Å; P596-W605 HydrophobicContact CB-CH2 3.93Å; P596-W605 HydrophobicContact CB-CZ2 3.75Å; P596-W605 HydrophobicContact CB-CZ3 4.06Å; P596-W605 HydrophobicContact CG-CH2 4.12Å; P596-W605 HydrophobicContact CG-CZ2 3.96Å
597	A	94.3	Very high	90.1	Very high	56 Å²	56	81.2 Å²	81.2	46%	0.463	45%	0.446	S	S	.	.	S	Bend	trans	-68.3	-38.2	178.6	0	0	0	0	0	112	L604 T606	A597-L604 PolarHBondContact N-O 3.16Å; A597-T606 HydrophobicContact CB-CG2 3.84Å
598	I	94.8	Very high	90.9	Very high	54 Å²	54	75.5 Å²	75.5	28%	0.277	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-108.2	121	173.3	-57.9	176.4	0	0	0	107	F568 W600 A603 L604	F568-I598 HydrophobicContact CD1-CD1 3.89Å; F568-I598 HydrophobicContact CE1-CD1 3.52Å; F568-I598 HydrophobicContact CE1-CG1 4.4Å; F568-I598 HydrophobicContact CZ-CD1 4.24Å; I598-W600 VanDerWaalsContact CG2-O 3.28Å; I598-W600 WeakPolarHBondContact CG2-O 3.37Å; I598-A603 CarbonylContact O-C 3.55Å; I598-A603 VanDerWaalsContact O-CA 3.24Å; I598-A603 WeakPolarHBondContact O-CA 3.2Å; I598-L604 HydrophobicContact CB-CB 4.23Å; I598-L604 HydrophobicContact CD1-CD1 4.44Å; I598-L604 PolarHBondContact N-O 3.28Å; I598-L604 VanDerWaalsContact N-O 3.14Å; I598-L604 PolarHBondContact O-N 3.49Å
599	L	94	Very high	91.8	Very high	139 Å²	139	73.7 Å²	73.7	73%	0.728	38%	0.383	S	S	*	.			trans	-94.1	-35.2	177.1	-75.6	148	0	0	0	111.8	P596	P596-L599 HydrophobicContact CG-CD2 3.86Å; P596-L599 HydrophobicContact CG-CG 4.32Å
600	W	92.6	Very high	92.4	Very high	226 Å²	226	67 Å²	67	86%	0.856	36%	0.358	S	S	*	.	S	Bend	trans	-136.4	136.7	-177.8	-171.7	88.4	0	0	0	109	I598	I598-W600 VanDerWaalsContact CG2-O 3.28Å; I598-W600 WeakPolarHBondContact CG2-O 3.37Å
601	P	92.9	Very high	93	Very high	101 Å²	101	59.8 Å²	59.8	66%	0.656	32%	0.32	S	S	*	.	S	Bend	cis	-78.2	-25	10.3	30.2	-35.4	0	0	0	114.9
602	V	93.2	Very high	93.4	Very high	88 Å²	88	58.3 Å²	58.3	53%	0.533	32%	0.316	S	S	.	.	S	Bend	trans	-130.4	142	178.5	-175.5	0	0	0	0	108.9	L604	V602-L604 HydrophobicContact CB-CG 4.41Å; V602-L604 HydrophobicContact CG1-CD2 4.34Å; V602-L604 HydrophobicContact CG1-CG 4.43Å; V602-L604 PolarHBondContact O-N 2.82Å; V602-L604 VanDerWaalsContact O-N 3.1Å
603	A	95.2	Very high	93.9	Very high	44 Å²	44	55.8 Å²	55.8	36%	0.364	30%	0.297	S	S	.	.			trans	-66.4	106.1	174.1	0	0	0	0	0	110.5	P596 I598 W605	P596-A603 HydrophobicContact CB-CB 4.38Å; P596-A603 HydrophobicContact CG-CB 4.3Å; I598-A603 CarbonylContact O-C 3.55Å; I598-A603 VanDerWaalsContact O-CA 3.24Å; I598-A603 WeakPolarHBondContact O-CA 3.2Å; A603-W605 HydrophobicContact CB-CH2 4.46Å; A603-W605 HydrophobicContact CB-CZ3 4.2Å
604	L	96.8	Very high	94	Very high	43 Å²	43	53.6 Å²	53.6	23%	0.225	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-125	138.6	-179.5	-61.9	171	0	0	0	111.1	F568 P596 A597 I598 V602	F568-L604 HydrophobicContact CB-CB 4.44Å; F568-L604 HydrophobicContact CB-CD1 4.22Å; F568-L604 HydrophobicContact CD1-CB 4.4Å; P596-L604 WeakPolarHBondContact CB-O 3.33Å; A597-L604 PolarHBondContact N-O 3.16Å; I598-L604 HydrophobicContact CB-CB 4.23Å; I598-L604 HydrophobicContact CD1-CD1 4.44Å; I598-L604 PolarHBondContact N-O 3.28Å; I598-L604 VanDerWaalsContact N-O 3.14Å; I598-L604 PolarHBondContact O-N 3.49Å; V602-L604 HydrophobicContact CB-CG 4.41Å; V602-L604 HydrophobicContact CG1-CD2 4.34Å; V602-L604 HydrophobicContact CG1-CG 4.43Å; V602-L604 PolarHBondContact O-N 2.82Å; V602-L604 VanDerWaalsContact O-N 3.1Å
605	W	96.7	Very high	94	Very high	12 Å²	12	52 Å²	52	5%	0.045	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.4	171.8	-74.8	-98.5	0	0	0	109.8	F568 L569 R571 A574 L593 P594 P596 A603	F568-W605 CarbonylContact C-O 3.56Å; F568-W605 WeakPolarHBondContact CA-O 3.23Å; L569-W605 PolarHBondContact N-O 2.86Å; L569-W605 PolarHBondContact O-N 3.26Å; R571-W605 HydrophobicContact CB-CH2 4.17Å; R571-W605 HydrophobicContact CB-CZ3 3.76Å; R571-W605 HydrophobicContact CG-CH2 4.2Å; R571-W605 HydrophobicContact CG-CZ3 4.27Å; A574-W605 HydrophobicContact CB-CB 4.34Å; A574-W605 HydrophobicContact CB-CD2 4.36Å; A574-W605 HydrophobicContact CB-CG 4.28Å; L593-W605 HydrophobicContact CD2-CH2 4.47Å; L593-W605 HydrophobicContact CD2-CZ2 3.73Å; P594-W605 PolarHBondContact O-NE1 2.9Å; P596-W605 HydrophobicContact CB-CD2 3.86Å; P596-W605 HydrophobicContact CB-CE3 4.05Å; P596-W605 HydrophobicContact CB-CG 4.48Å; P596-W605 HydrophobicContact CB-CH2 3.93Å; P596-W605 HydrophobicContact CB-CZ2 3.75Å; P596-W605 HydrophobicContact CB-CZ3 4.06Å; P596-W605 HydrophobicContact CG-CH2 4.12Å; P596-W605 HydrophobicContact CG-CZ2 3.96Å; A603-W605 HydrophobicContact CB-CH2 4.46Å; A603-W605 HydrophobicContact CB-CZ3 4.2Å
606	T	96.5	Very high	93.8	Very high	29 Å²	29	44.8 Å²	44.8	18%	0.178	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	153.1	171	63.9	0	0	0	0	110.4	V567 F568 A597 K608 Q609 I610	V567-T606 WeakPolarHBondContact O-CA 3.33Å; F568-T606 HydrophobicContact CD1-CG2 4.16Å; F568-T606 HydrophobicContact CE1-CG2 3.92Å; A597-T606 HydrophobicContact CB-CG2 3.84Å; T606-K608 PolarHBondContact O-N 2.94Å; T606-Q609 VanDerWaalsContact N-OE1 3.12Å; T606-Q609 WeakPolarHBondContact O-CB 3.4Å; T606-Q609 PolarHBondContact O-N 2.77Å; T606-Q609 WeakPolarHBondContact OG1-CG 3.42Å; T606-Q609 PolarHBondContact OG1-N 2.8Å; T606-I610 PolarHBondContact O-N 3.17Å
607	G	95.1	Very high	93.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-26.4	173.4	0	0	0	0	0	113.4	L562 V567 Q609 I610 F611	L562-G607 CarbonylContact O-C 3.55Å; L562-G607 VanDerWaalsContact O-CA 3.24Å; L562-G607 WeakPolarHBondContact O-CA 3.38Å; V567-G607 PolarHBondContact O-N 3.1Å; V567-G607 VanDerWaalsContact O-N 3.1Å; G607-Q609 PolarHBondContact O-N 3.22Å; G607-I610 PolarHBondContact O-N 3.48Å; G607-F611 PolarHBondContact O-N 3.49Å
608	K	95.3	Very high	92.6	Very high	17 Å²	17	41.2 Å²	41.2	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-37.1	170.9	-65.5	-177.4	165.7	72.8	0	112.8	T563 T606 F611 G612 D646 L656 G659	T563-K608 WeakPolarHBondContact O-CE 3.37Å; T563-K608 PolarHBondContact O-NZ 2.96Å; T606-K608 PolarHBondContact O-N 2.94Å; K608-F611 WeakPolarHBondContact O-CB 3.46Å; K608-F611 PolarHBondContact O-N 3.18Å; K608-G612 PolarHBondContact O-N 3.27Å; K608-D646 IonicContact NZ-OD2 2.7Å; K608-D646 PolarHBondContact NZ-OD2 3.07Å; K608-L656 HydrophobicContact CB-CB 4.37Å; K608-L656 HydrophobicContact CB-CD2 4.09Å; K608-L656 HydrophobicContact CB-CG 4.21Å; K608-L656 HydrophobicContact CD-CD2 4.42Å; K608-L656 HydrophobicContact CD-CG 4.3Å; K608-L656 HydrophobicContact CG-CD2 3.86Å; K608-L656 HydrophobicContact CG-CG 4.17Å; K608-G659 WeakPolarHBondContact CE-O 3.46Å
609	Q	94.5	Very high	91.6	Very high	48 Å²	48	43.6 Å²	43.6	22%	0.224	24%	0.239	C	C	.	.	H	α-helix	trans	-66.7	-39.5	174.5	-71.4	179.1	-47.6	0	0	112	P594 K595 T606 G607 F611 G612	P594-Q609 HydrophobicContact CG-CB 4.05Å; K595-Q609 PolarHBondContact O-NE2 3.21Å; T606-Q609 VanDerWaalsContact N-OE1 3.12Å; T606-Q609 WeakPolarHBondContact O-CB 3.4Å; T606-Q609 PolarHBondContact O-N 2.77Å; T606-Q609 WeakPolarHBondContact OG1-CG 3.42Å; T606-Q609 PolarHBondContact OG1-N 2.8Å; G607-Q609 PolarHBondContact O-N 3.22Å; Q609-F611 VanDerWaalsContact C-N 3.28Å; Q609-F611 PolarHBondContact O-N 2.86Å; Q609-G612 PolarHBondContact O-N 3.19Å; Q609-G612 VanDerWaalsContact O-N 3.17Å
610	I	94.5	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-36	175.1	-57.9	-55.3	0	0	0	111	L569 A574 L577 T606 G607 G612 L613 I697	L569-I610 HydrophobicContact CD1-CG1 3.6Å; A574-I610 HydrophobicContact CB-CD1 3.92Å; L577-I610 HydrophobicContact CB-CG2 4.22Å; L577-I610 HydrophobicContact CD1-CG2 4.44Å; T606-I610 PolarHBondContact O-N 3.17Å; G607-I610 PolarHBondContact O-N 3.48Å; I610-G612 VanDerWaalsContact C-N 3.27Å; I610-G612 PolarHBondContact O-N 3.44Å; I610-L613 HydrophobicContact CD1-CD1 4.35Å; I610-L613 WeakPolarHBondContact O-CB 3.32Å; I610-L613 PolarHBondContact O-N 3.16Å; I610-L613 VanDerWaalsContact O-N 3.16Å; I610-I697 HydrophobicContact CG2-CG2 4.34Å
611	F	94.1	Very high	89.9	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-36	173.7	-175.4	-96.1	0	0	0	112.7	T559 T563 G607 K608 Q609 L613 I614 L615 L656 V661 L666 I674 L694	T559-F611 HydrophobicContact CG2-CD2 3.68Å; T559-F611 HydrophobicContact CG2-CE2 3.5Å; T559-F611 VanDerWaalsContact CG2-CE2 3.5Å; T563-F611 HydrophobicContact CG2-CB 4.03Å; T563-F611 HydrophobicContact CG2-CD2 4.16Å; T563-F611 HydrophobicContact CG2-CG 4.07Å; G607-F611 PolarHBondContact O-N 3.49Å; K608-F611 WeakPolarHBondContact O-CB 3.46Å; K608-F611 PolarHBondContact O-N 3.18Å; Q609-F611 VanDerWaalsContact C-N 3.28Å; Q609-F611 PolarHBondContact O-N 2.86Å; F611-L613 PolarHBondContact O-N 2.93Å; F611-I614 HydrophobicContact CD2-CD1 3.83Å; F611-I614 HydrophobicContact CE2-CD1 4.26Å; F611-I614 VanDerWaalsContact O-CB 3.31Å; F611-I614 WeakPolarHBondContact O-CB 3.41Å; F611-I614 PolarHBondContact O-N 3.08Å; F611-L615 HydrophobicContact CE1-CD1 4.11Å; F611-L615 HydrophobicContact CE1-CG 4.36Å; F611-L656 HydrophobicContact CB-CD2 4.48Å; F611-L656 HydrophobicContact CD1-CB 4.09Å; F611-L656 HydrophobicContact CD1-CD2 3.92Å; F611-L656 HydrophobicContact CG-CD2 4.33Å; F611-V661 HydrophobicContact CZ-CG2 4.46Å; F611-L666 HydrophobicContact CE2-CD2 4.41Å; F611-L666 HydrophobicContact CZ-CD2 4.34Å; F611-I674 HydrophobicContact CE1-CD1 3.82Å; F611-I674 HydrophobicContact CZ-CD1 3.59Å; F611-L694 HydrophobicContact CE2-CD1 4.08Å
612	G	92.3	Very high	89.3	Confident	12 Å²	12	31.2 Å²	31.2	12%	0.124	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-33.3	175.1	0	0	0	0	0	113.7	K608 Q609 I610 I614 L615 S616 S654	K608-G612 PolarHBondContact O-N 3.27Å; Q609-G612 PolarHBondContact O-N 3.19Å; Q609-G612 VanDerWaalsContact O-N 3.17Å; I610-G612 VanDerWaalsContact C-N 3.27Å; I610-G612 PolarHBondContact O-N 3.44Å; G612-I614 PolarHBondContact O-N 3.36Å; G612-L615 PolarHBondContact O-N 3.39Å; G612-L615 VanDerWaalsContact O-N 3.17Å; G612-S616 PolarHBondContact O-N 3.24Å; G612-S654 WeakPolarHBondContact CA-O 3.4Å
613	L	90.9	Very high	89.1	Confident	8 Å²	8	27.9 Å²	27.9	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-24.1	176.8	-63.7	175.4	0	0	0	113.2	A578 L581 S592 L593 I610 F611 P617	A578-L613 HydrophobicContact CB-CD1 4.01Å; L581-L613 HydrophobicContact CD1-CB 3.97Å; S592-L613 WeakPolarHBondContact O-CD2 3.42Å; L593-L613 HydrophobicContact CD1-CD1 4.31Å; I610-L613 HydrophobicContact CD1-CD1 4.35Å; I610-L613 WeakPolarHBondContact O-CB 3.32Å; I610-L613 PolarHBondContact O-N 3.16Å; I610-L613 VanDerWaalsContact O-N 3.16Å; F611-L613 PolarHBondContact O-N 2.93Å; L613-P617 WeakPolarHBondContact O-CA 3.4Å; L613-P617 WeakPolarHBondContact O-CB 3.16Å; L613-P617 WeakPolarHBondContact O-CD 3.21Å
614	I	91.6	Very high	88.8	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-68.4	-42.2	175.7	-65	164.1	0	0	0	109.8	F611 G612 A690 R693 L694 I697	F611-I614 HydrophobicContact CD2-CD1 3.83Å; F611-I614 HydrophobicContact CE2-CD1 4.26Å; F611-I614 VanDerWaalsContact O-CB 3.31Å; F611-I614 WeakPolarHBondContact O-CB 3.41Å; F611-I614 PolarHBondContact O-N 3.08Å; G612-I614 PolarHBondContact O-N 3.36Å; I614-A690 WeakPolarHBondContact CG2-O 3.31Å; I614-R693 HydrophobicContact CG2-CB 4.11Å; I614-R693 WeakPolarHBondContact O-CD 3.35Å; I614-R693 PolarHBondContact O-NH1 2.97Å; I614-L694 HydrophobicContact CD1-CD1 3.54Å; I614-L694 HydrophobicContact CG2-CB 4.06Å; I614-L694 HydrophobicContact CG2-CD1 4.44Å; I614-I697 HydrophobicContact CD1-CB 4.38Å; I614-I697 HydrophobicContact CD1-CD1 4.34Å; I614-I697 HydrophobicContact CD1-CG2 4.32Å; I614-I697 HydrophobicContact CG1-CD1 3.81Å
615	L	91	Very high	88.6	Confident	2 Å²	2	28 Å²	28	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-74.5	-51.2	-179.3	-56.1	-178.2	0	0	0	111.3	F611 G612 I651 I674 L678	F611-L615 HydrophobicContact CE1-CD1 4.11Å; F611-L615 HydrophobicContact CE1-CG 4.36Å; G612-L615 PolarHBondContact O-N 3.39Å; G612-L615 VanDerWaalsContact O-N 3.17Å; L615-I651 HydrophobicContact CD1-CG2 4.22Å; L615-I674 HydrophobicContact CD2-CG2 3.65Å; L615-L678 HydrophobicContact CD2-CD1 4.14Å
616	S	88.1	Confident	88.4	Confident	33 Å²	33	27.9 Å²	27.9	23%	0.231	18%	0.177	C	C	.	.			trans	-134.3	87.6	-178.6	-168	0	0	0	0	111.3	G612 H618 T621	G612-S616 PolarHBondContact O-N 3.24Å; S616-H618 PolarHBondContact OG-O 3.35Å; S616-T621 PolarHBondContact OG-OG1 3.05Å; S616-T621 VanDerWaalsContact OG-OG1 3.08Å
617	P	83.5	Confident	88.1	Confident	2 Å²	2	27 Å²	27	1%	0.013	17%	0.171	C	C	.	.	S	Bend	trans	-75.9	-25.8	-179.2	26	-32.6	0	0	0	113.4	L581 L591 L613	L581-P617 HydrophobicContact CD1-CB 4.34Å; L591-P617 HydrophobicContact CD1-CB 3.82Å; L613-P617 WeakPolarHBondContact O-CA 3.4Å; L613-P617 WeakPolarHBondContact O-CB 3.16Å; L613-P617 WeakPolarHBondContact O-CD 3.21Å
618	H	80.7	Confident	87.9	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.019	19%	0.185	C	C	.	.	S	Bend	trans	-126	137	-178.6	-47.6	-73.3	0	0	0	109.8	H586 R589 L590 S616 S620 T621	H586-H618 AromaticContact CE1-NE2 3.88Å; H586-H618 AromaticContact ND1-CD2 3.79Å; H586-H618 AromaticContact ND1-NE2 3.03Å; H586-H618 PolarHBondContact ND1-NE2 2.74Å; R589-H618 WeakPolarHBondContact CB-CE1 3.21Å; L590-H618 PolarHBondContact O-ND1 3.44Å; S616-H618 PolarHBondContact OG-O 3.35Å; H618-S620 PolarHBondContact O-N 3.27Å; H618-S620 VanDerWaalsContact O-N 3.11Å; H618-T621 HydrophobicContact CB-CG2 4.08Å; H618-T621 WeakPolarHBondContact O-CG2 3.33Å; H618-T621 PolarHBondContact O-N 3.46Å; H618-T621 VanDerWaalsContact O-N 3.11Å; H618-T621 PolarHBondContact O-OG1 2.59Å
619	P	73.3	Confident	87.6	Confident	104 Å²	104	30.8 Å²	30.8	68%	0.675	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-57	-28.3	175.7	-23	32.1	0	0	0	113.2	T621	P619-T621 VanDerWaalsContact C-N 3.29Å; P619-T621 PolarHBondContact O-N 2.85Å
620	S	75.3	Confident	87.4	Confident	109 Å²	109	30.7 Å²	30.7	76%	0.762	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-76.7	-7.8	-178	64.9	0	0	0	0	114.6	H618 G622	H618-S620 PolarHBondContact O-N 3.27Å; H618-S620 VanDerWaalsContact O-N 3.11Å; S620-G622 VanDerWaalsContact C-N 3.27Å; S620-G622 PolarHBondContact O-N 3.34Å
621	T	75.5	Confident	87	Confident	44 Å²	44	31 Å²	31	27%	0.27	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-69.7	-26.1	-178.6	59.2	0	0	0	0	112.7	S616 H618 P619 I623	S616-T621 PolarHBondContact OG-OG1 3.05Å; S616-T621 VanDerWaalsContact OG-OG1 3.08Å; H618-T621 HydrophobicContact CB-CG2 4.08Å; H618-T621 WeakPolarHBondContact O-CG2 3.33Å; H618-T621 PolarHBondContact O-N 3.46Å; H618-T621 VanDerWaalsContact O-N 3.11Å; H618-T621 PolarHBondContact O-OG1 2.59Å; P619-T621 VanDerWaalsContact C-N 3.29Å; P619-T621 PolarHBondContact O-N 2.85Å; T621-I623 PolarHBondContact O-N 3.04Å
622	G	82.1	Confident	86.5	Confident	53 Å²	53	39.6 Å²	39.6	55%	0.546	23%	0.23	S	C	.	.			trans	69	5.8	-175.9	0	0	0	0	0	114.7	S620 K624	S620-G622 VanDerWaalsContact C-N 3.27Å; S620-G622 PolarHBondContact O-N 3.34Å; G622-K624 PolarHBondContact O-N 3.47Å
623	I	87.7	Confident	85.8	Confident	19 Å²	19	41 Å²	41	10%	0.097	24%	0.237	C	C	.	.			trans	-80.8	113.9	-177.2	-60.7	172.8	0	0	0	109.9	T621 V625 S654 L678 Y682 A686	T621-I623 PolarHBondContact O-N 3.04Å; I623-V625 HydrophobicContact CG2-CG2 3.97Å; I623-S654 PolarHBondContact O-OG 3.46Å; I623-L678 HydrophobicContact CG2-CD2 3.75Å; I623-Y682 HydrophobicContact CB-CD1 4.48Å; I623-Y682 HydrophobicContact CB-CE1 4.38Å; I623-Y682 HydrophobicContact CG1-CD1 4.05Å; I623-Y682 HydrophobicContact CG1-CE1 4.38Å; I623-Y682 HydrophobicContact CG1-CG 4.37Å; I623-Y682 HydrophobicContact CG2-CD1 4.41Å; I623-Y682 HydrophobicContact CG2-CD2 4.07Å; I623-Y682 HydrophobicContact CG2-CE1 4.36Å; I623-Y682 HydrophobicContact CG2-CE2 4.01Å; I623-Y682 HydrophobicContact CG2-CG 4.27Å; I623-A686 HydrophobicContact CD1-CB 4.13Å
624	K	90.1	Very high	85.3	Confident	90 Å²	90	42 Å²	42	39%	0.391	24%	0.243	S	C	.	.			trans	-119.9	90	175.8	-66.9	-179.2	-179.8	-176.3	0	110.3	G622 N653 S654 Y682 H938 S942	G622-K624 PolarHBondContact O-N 3.47Å; K624-N653 HydrophobicContact CG-CB 4.46Å; K624-S654 WeakPolarHBondContact CA-OG 3.21Å; K624-Y682 WeakPolarHBondContact CA-OH 3.04Å; K624-Y682 PolarHBondContact N-OH 2.88Å; K624-Y682 PolarHBondContact O-OH 3.46Å; K624-H938 PolarHBondContact O-CE1 3.27Å; K624-H938 VanDerWaalsContact O-CE1 3.3Å; K624-S942 PolarHBondContact NZ-O 3.02Å; K624-S942 VanDerWaalsContact NZ-O 3.11Å
625	V	91.2	Very high	85.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.253	C	S	.	.			trans	-79.2	134	176.4	-178.8	0	0	0	0	109.3	I623 I651 N653 S654 I674 T677 L678 Y682	I623-V625 HydrophobicContact CG2-CG2 3.97Å; V625-I651 HydrophobicContact CB-CG2 4.42Å; V625-I651 HydrophobicContact CG1-CG2 4.38Å; V625-I651 WeakPolarHBondContact O-CG2 3.27Å; V625-N653 PolarHBondContact O-N 3.46Å; V625-S654 PolarHBondContact N-OG 2.79Å; V625-S654 PolarHBondContact O-N 2.92Å; V625-I674 HydrophobicContact CG1-CG2 4.45Å; V625-T677 HydrophobicContact CG1-CG2 4.02Å; V625-L678 HydrophobicContact CG2-CD2 3.4Å; V625-L678 HydrophobicContact CG2-CG 3.97Å; V625-Y682 HydrophobicContact CG2-CE2 4.36Å
626	N	92	Very high	84.7	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.043	27%	0.267	C	S	.	.			trans	-126.4	129.6	174.1	-62.8	-53.4	0	0	0	109.5	I651 Q652 N653 H938 T941 S942	N626-I651 CarbonylContact C-O 3.53Å; N626-I651 VanDerWaalsContact CA-O 3.31Å; N626-I651 WeakPolarHBondContact CA-O 3.44Å; N626-Q652 WeakPolarHBondContact OD1-CA 3.14Å; N626-N653 PolarHBondContact OD1-N 2.9Å; N626-H938 HydrophobicContact CB-CB 4.42Å; N626-H938 PolarHBondContact ND2-ND1 2.96Å; N626-H938 VanDerWaalsContact ND2-ND1 3.2Å; N626-H938 PolarHBondContact ND2-O 3.28Å; N626-T941 WeakPolarHBondContact OD1-CG2 3Å; N626-S942 PolarHBondContact ND2-OG 3.46Å
627	L	90.5	Very high	84.5	Confident	11 Å²	11	49.9 Å²	49.9	6%	0.058	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	134	-177.4	-147.4	110.6	0	0	0	111.2	V629 I651 L665 T677	L627-V629 HydrophobicContact CD2-CB 4.01Å; L627-V629 HydrophobicContact CD2-CG2 3.45Å; L627-V629 VanDerWaalsContact CD2-CG2 3.45Å; L627-V629 HydrophobicContact CG-CG2 3.91Å; L627-I651 HydrophobicContact CB-CB 4.2Å; L627-I651 PolarHBondContact N-O 3.39Å; L627-I651 PolarHBondContact O-N 3.03Å; L627-L665 HydrophobicContact CD2-CD1 3.69Å; L627-L665 HydrophobicContact CD2-CG 4.15Å; L627-T677 HydrophobicContact CD1-CG2 4.17Å; L627-T677 VanDerWaalsContact CD1-OG1 3.25Å; L627-T677 WeakPolarHBondContact CD1-OG1 3.35Å
628	R	91.3	Very high	84.6	Confident	77 Å²	77	57.4 Å²	57.4	29%	0.291	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	101.9	172.6	-78.3	-174.5	75.3	91.5	0.6	110.1	E641 F648 V649 L650	R628-E641 IonicContact CZ-OE2 2.75Å; R628-E641 IonicContact NH1-OE2 3.56Å; R628-E641 PolarHBondContact NH1-OE2 2.91Å; R628-E641 IonicContact NH2-OE2 3.19Å; R628-E641 PolarHBondContact NH2-OE2 3.01Å; R628-F648 HydrophobicContact CB-CE1 4.38Å; R628-F648 HydrophobicContact CB-CZ 4.31Å; R628-V649 WeakPolarHBondContact CA-O 3.42Å; R628-L650 HydrophobicContact CG-CD1 3.51Å
629	V	89.5	Confident	84.6	Confident	20 Å²	20	59.7 Å²	59.7	12%	0.121	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	134.5	-172.6	-178	0	0	0	0	112	L627 V649 L665	L627-V629 HydrophobicContact CD2-CB 4.01Å; L627-V629 HydrophobicContact CD2-CG2 3.45Å; L627-V629 VanDerWaalsContact CD2-CG2 3.45Å; L627-V629 HydrophobicContact CG-CG2 3.91Å; V629-V649 PolarHBondContact N-O 2.9Å; V629-V649 PolarHBondContact O-N 2.79Å; V629-L665 HydrophobicContact CB-CD1 4.13Å; V629-L665 HydrophobicContact CG1-CD1 4.42Å
630	P	90.6	Very high	85.3	Confident	46 Å²	46	59.6 Å²	59.6	30%	0.299	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	135.8	169.6	29.8	-33.8	0	0	0	111.6	Y635 F648 K664	P630-Y635 HydrophobicContact CB-CD1 3.56Å; P630-Y635 HydrophobicContact CB-CD2 4.3Å; P630-Y635 HydrophobicContact CB-CE1 3.92Å; P630-Y635 HydrophobicContact CB-CG 3.77Å; P630-F648 HydrophobicContact CB-CD2 4.04Å; P630-F648 HydrophobicContact CB-CE2 4.39Å; P630-K664 PolarHBondContact O-NZ 3.02Å
631	T	86.3	Confident	85.8	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.043	32%	0.319	C	S	.	.			trans	-66.6	155.6	170.1	64.4	0	0	0	0	110.7	Y635 G647 V649 C660 D662	T631-Y635 VanDerWaalsContact O-CB 3.31Å; T631-Y635 WeakPolarHBondContact O-CB 3.39Å; T631-Y635 PolarHBondContact OG1-N 2.94Å; T631-G647 WeakPolarHBondContact CB-O 3.42Å; T631-G647 WeakPolarHBondContact CG2-O 3.46Å; T631-G647 PolarHBondContact N-O 3.33Å; T631-G647 VanDerWaalsContact OG1-C 3.29Å; T631-G647 VanDerWaalsContact OG1-CA 3.31Å; T631-G647 WeakPolarHBondContact OG1-CA 3.41Å; T631-G647 PolarHBondContact OG1-O 3.23Å; T631-V649 HydrophobicContact CG2-CG2 3.89Å; T631-C660 VanDerWaalsContact CG2-O 3.28Å; T631-C660 WeakPolarHBondContact CG2-O 3.38Å; T631-D662 WeakPolarHBondContact CA-OD2 3.31Å; T631-D662 VanDerWaalsContact CB-OD2 3.3Å; T631-D662 WeakPolarHBondContact CB-OD2 3.38Å
632	K	82	Confident	86.5	Confident	182 Å²	182	63.8 Å²	63.8	79%	0.791	34%	0.343	S	S	*	.	S	Bend	trans	-76.4	-39.3	-176.2	-174.2	173.4	-178.5	173	0	112.7	D662 K664	K632-D662 PolarHBondContact N-OD2 2.99Å; K632-K664 HydrophobicContact CB-CD 4.48Å
633	S	77.7	Confident	86.9	Confident	40 Å²	40	61.5 Å²	61.5	28%	0.28	32%	0.319	S	S	.	.	S	Bend	trans	-105	-29.4	-164.7	42.3	0	0	0	0	113.7	Q793	S633-Q793 WeakPolarHBondContact CB-O 3.38Å; S633-Q793 PolarHBondContact OG-O 3.31Å
634	M	81.8	Confident	87	Confident	30 Å²	30	65.7 Å²	65.7	15%	0.148	35%	0.348	C	S	.	.	S	Bend	trans	-101.7	-22.3	-174.7	-61.6	-167.7	81.3	0	0	113.6	S636 N645 C660	M634-S636 PolarHBondContact O-N 3.35Å; M634-N645 HydrophobicContact CB-CB 4.36Å; M634-N645 VanDerWaalsContact CE-O 3.28Å; M634-N645 WeakPolarHBondContact CE-O 3.15Å; M634-N645 WeakPolarHBondContact O-CB 3.45Å; M634-N645 PolarHBondContact O-ND2 2.91Å; M634-C660 HydrophobicContact SD-CB 4.17Å
635	Y	86.3	Confident	86.9	Confident	57 Å²	57	65.6 Å²	65.6	22%	0.224	35%	0.351	C	S	.	.			trans	-64.2	124.7	-178	-169.2	-126.9	0	0	0	111.9	P630 T631 S637 C643 G647 F648	P630-Y635 HydrophobicContact CB-CD1 3.56Å; P630-Y635 HydrophobicContact CB-CD2 4.3Å; P630-Y635 HydrophobicContact CB-CE1 3.92Å; P630-Y635 HydrophobicContact CB-CG 3.77Å; T631-Y635 VanDerWaalsContact O-CB 3.31Å; T631-Y635 WeakPolarHBondContact O-CB 3.39Å; T631-Y635 PolarHBondContact OG1-N 2.94Å; Y635-S637 VanDerWaalsContact CE1-CA 3.4Å; Y635-S637 PolarHBondContact O-N 3.15Å; Y635-C643 HydrophobicContact CD2-CB 4.17Å; Y635-C643 HydrophobicContact CE2-CB 4.27Å; Y635-G647 WeakPolarHBondContact CB-O 3.45Å; Y635-F648 HydrophobicContact CD2-CB 4.19Å; Y635-F648 HydrophobicContact CD2-CD2 4.36Å; Y635-F648 HydrophobicContact CE2-CB 4.19Å; Y635-F648 AromaticContact CE2-CD2 3.92Å; Y635-F648 HydrophobicContact CE2-CD2 3.92Å
636	S	83.7	Confident	86.8	Confident	45 Å²	45	66.2 Å²	66.2	32%	0.315	35%	0.354	S	S	.	.			trans	-85.1	10.3	-178.7	64.3	0	0	0	0	113.8	M634 K638 C643	M634-S636 PolarHBondContact O-N 3.35Å; S636-K638 PolarHBondContact O-N 3.36Å; S636-K638 VanDerWaalsContact O-N 3.11Å; S636-K638 PolarHBondContact OG-O 2.97Å; S636-C643 PolarHBondContact OG-SG 3.38Å
637	S	84.1	Confident	86.8	Confident	99 Å²	99	65.8 Å²	65.8	69%	0.692	35%	0.352	S	S	*	.	S	Bend	trans	61.8	6.8	-171.4	-56.4	0	0	0	0	115.1	Y635	Y635-S637 VanDerWaalsContact CE1-CA 3.4Å; Y635-S637 PolarHBondContact O-N 3.15Å
638	K	84.1	Confident	86.9	Confident	161 Å²	161	66 Å²	66	70%	0.7	35%	0.353	S	S	*	.	S	Bend	trans	-132.8	148.7	-178.5	-64	-175.8	-179	-178.2	0	111.4	S636 Q640	S636-K638 PolarHBondContact O-N 3.36Å; S636-K638 VanDerWaalsContact O-N 3.11Å; S636-K638 PolarHBondContact OG-O 2.97Å; K638-Q640 VanDerWaalsContact C-N 3.32Å; K638-Q640 PolarHBondContact O-N 3.39Å
639	G	81	Confident	87	Confident	51 Å²	51	62.3 Å²	62.3	53%	0.526	34%	0.339	S	S	.	.	S	Bend	trans	81.1	-4.5	169.3	0	0	0	0	0	116.5	E641 M642	G639-E641 PolarHBondContact O-N 3.09Å; G639-E641 VanDerWaalsContact O-N 3.1Å; G639-M642 WeakPolarHBondContact O-CA 3.45Å; G639-M642 PolarHBondContact O-N 3.12Å
640	Q	88.2	Confident	87.2	Confident	103 Å²	103	62 Å²	62	48%	0.481	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	43.7	-117.2	-174.5	-62.8	-173.1	2	0	0	110.9	K638 M642 C643 F648	K638-Q640 VanDerWaalsContact C-N 3.32Å; K638-Q640 PolarHBondContact O-N 3.39Å; Q640-M642 PolarHBondContact O-N 3.43Å; Q640-C643 WeakPolarHBondContact O-CB 3.45Å; Q640-C643 PolarHBondContact O-N 3.33Å; Q640-F648 HydrophobicContact CB-CD1 4.49Å; Q640-F648 HydrophobicContact CB-CD2 4.14Å; Q640-F648 HydrophobicContact CB-CE1 4.42Å; Q640-F648 HydrophobicContact CB-CE2 4.07Å; Q640-F648 HydrophobicContact CB-CG 4.35Å; Q640-F648 HydrophobicContact CB-CZ 4.22Å; Q640-F648 HydrophobicContact CG-CE2 4.28Å; Q640-F648 WeakPolarHBondContact O-CB 3.46Å; Q640-F648 WeakPolarHBondContact O-CG 3.21Å
641	E	86.6	Confident	87.3	Confident	81 Å²	81	59.9 Å²	59.9	38%	0.379	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-58.5	-24.2	178	60.9	-154.9	-161.9	0	0	114.8	R628 G639 C643 F648	R628-E641 IonicContact CZ-OE2 2.75Å; R628-E641 IonicContact NH1-OE2 3.56Å; R628-E641 PolarHBondContact NH1-OE2 2.91Å; R628-E641 IonicContact NH2-OE2 3.19Å; R628-E641 PolarHBondContact NH2-OE2 3.01Å; G639-E641 PolarHBondContact O-N 3.09Å; G639-E641 VanDerWaalsContact O-N 3.1Å; E641-C643 VanDerWaalsContact C-N 3.32Å; E641-F648 HydrophobicContact CB-CD1 4.15Å
642	M	90.2	Very high	87.6	Confident	159 Å²	159	63 Å²	63	78%	0.783	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-96.4	27	175.3	-60.4	-63.1	-88.7	0	0	112.5	G639 Q640	G639-M642 WeakPolarHBondContact O-CA 3.45Å; G639-M642 PolarHBondContact O-N 3.12Å; Q640-M642 PolarHBondContact O-N 3.43Å
643	C	90.5	Very high	88.1	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.034	32%	0.315	C	S	.	.			trans	-58.6	130.1	175.7	173.7	0	0	0	0	110.8	Y635 S636 Q640 E641 N645 D646	Y635-C643 HydrophobicContact CD2-CB 4.17Å; Y635-C643 HydrophobicContact CE2-CB 4.27Å; S636-C643 PolarHBondContact OG-SG 3.38Å; Q640-C643 WeakPolarHBondContact O-CB 3.45Å; Q640-C643 PolarHBondContact O-N 3.33Å; E641-C643 VanDerWaalsContact C-N 3.32Å; C643-N645 PolarHBondContact O-N 2.83Å; C643-N645 VanDerWaalsContact O-N 3.13Å; C643-D646 PolarHBondContact O-N 3.48Å
644	P	89.1	Confident	88.8	Confident	108 Å²	108	55.6 Å²	55.6	70%	0.701	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.6	179.7	-28.2	34.6	0	0	0	114.2	D646	P644-D646 VanDerWaalsContact C-N 3.32Å; P644-D646 PolarHBondContact O-N 3.08Å
645	N	87.1	Confident	89.3	Confident	87 Å²	87	60 Å²	60	47%	0.465	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	9.3	-179.5	-58.3	-19.9	0	0	0	113.7	M634 C643 G647	M634-N645 HydrophobicContact CB-CB 4.36Å; M634-N645 VanDerWaalsContact CE-O 3.28Å; M634-N645 WeakPolarHBondContact CE-O 3.15Å; M634-N645 WeakPolarHBondContact O-CB 3.45Å; M634-N645 PolarHBondContact O-ND2 2.91Å; C643-N645 PolarHBondContact O-N 2.83Å; C643-N645 VanDerWaalsContact O-N 3.13Å; N645-G647 PolarHBondContact O-N 2.89Å
646	D	90.8	Very high	89.7	Confident	13 Å²	13	57.8 Å²	57.8	7%	0.07	32%	0.315	C	S	.	.			trans	53.3	39.9	-173.4	-158.7	27.5	0	0	0	112.4	K608 C643 P644 G659 C660	K608-D646 IonicContact NZ-OD2 2.7Å; K608-D646 PolarHBondContact NZ-OD2 3.07Å; C643-D646 PolarHBondContact O-N 3.48Å; P644-D646 VanDerWaalsContact C-N 3.32Å; P644-D646 PolarHBondContact O-N 3.08Å; D646-G659 CarbonylContact O-C 3.59Å; D646-G659 VanDerWaalsContact O-CA 3.25Å; D646-G659 WeakPolarHBondContact O-CA 3.42Å; D646-G659 WeakPolarHBondContact OD1-CA 3.49Å; D646-G659 PolarHBondContact OD1-N 3.3Å; D646-C660 PolarHBondContact O-N 3.47Å; D646-C660 PolarHBondContact OD2-SG 3.23Å; D646-C660 VanDerWaalsContact OD2-SG 3.42Å
647	G	90.7	Very high	90.1	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.322	C	S	.	.			trans	-95.5	14.3	-171.2	0	0	0	0	0	115.3	T631 Y635 N645	T631-G647 WeakPolarHBondContact CB-O 3.42Å; T631-G647 WeakPolarHBondContact CG2-O 3.46Å; T631-G647 PolarHBondContact N-O 3.33Å; T631-G647 VanDerWaalsContact OG1-C 3.29Å; T631-G647 VanDerWaalsContact OG1-CA 3.31Å; T631-G647 WeakPolarHBondContact OG1-CA 3.41Å; T631-G647 PolarHBondContact OG1-O 3.23Å; Y635-G647 WeakPolarHBondContact CB-O 3.45Å; N645-G647 PolarHBondContact O-N 2.89Å
648	F	93.1	Very high	90.5	Very high	15 Å²	15	55.8 Å²	55.8	7%	0.066	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.6	180	-171.3	-85.1	0	0	0	109.8	R628 P630 Y635 Q640 E641 A658 G659	R628-F648 HydrophobicContact CB-CE1 4.38Å; R628-F648 HydrophobicContact CB-CZ 4.31Å; P630-F648 HydrophobicContact CB-CD2 4.04Å; P630-F648 HydrophobicContact CB-CE2 4.39Å; Y635-F648 HydrophobicContact CD2-CB 4.19Å; Y635-F648 HydrophobicContact CD2-CD2 4.36Å; Y635-F648 HydrophobicContact CE2-CB 4.19Å; Y635-F648 AromaticContact CE2-CD2 3.92Å; Y635-F648 HydrophobicContact CE2-CD2 3.92Å; Q640-F648 HydrophobicContact CB-CD1 4.49Å; Q640-F648 HydrophobicContact CB-CD2 4.14Å; Q640-F648 HydrophobicContact CB-CE1 4.42Å; Q640-F648 HydrophobicContact CB-CE2 4.07Å; Q640-F648 HydrophobicContact CB-CG 4.35Å; Q640-F648 HydrophobicContact CB-CZ 4.22Å; Q640-F648 HydrophobicContact CG-CE2 4.28Å; Q640-F648 WeakPolarHBondContact O-CB 3.46Å; Q640-F648 WeakPolarHBondContact O-CG 3.21Å; E641-F648 HydrophobicContact CB-CD1 4.15Å; F648-A658 CarbonylContact O-C 3.57Å; F648-G659 WeakPolarHBondContact O-CA 3.42Å; F648-G659 PolarHBondContact O-N 3.39Å
649	V	92.6	Very high	90.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	123.3	-175.4	176.4	0	0	0	0	110.3	R628 V629 T631 I651 L656 A658 L665	R628-V649 WeakPolarHBondContact CA-O 3.42Å; V629-V649 PolarHBondContact N-O 2.9Å; V629-V649 PolarHBondContact O-N 2.79Å; T631-V649 HydrophobicContact CG2-CG2 3.89Å; V649-I651 HydrophobicContact CG1-CD1 4.14Å; V649-I651 HydrophobicContact CG1-CG1 3.9Å; V649-L656 HydrophobicContact CG1-CD1 3.75Å; V649-A658 VanDerWaalsContact CA-O 3.32Å; V649-A658 WeakPolarHBondContact CA-O 3.33Å; V649-L665 HydrophobicContact CB-CD1 3.76Å; V649-L665 HydrophobicContact CB-CD2 4.32Å; V649-L665 HydrophobicContact CG1-CD1 3.92Å; V649-L665 HydrophobicContact CG1-CD2 3.72Å; V649-L665 HydrophobicContact CG1-CG 4.5Å; V649-L665 HydrophobicContact CG2-CD1 3.93Å; V649-L665 HydrophobicContact CG2-CD2 4.23Å
650	L	93.7	Very high	91.4	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.073	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	112.1	171.6	176.4	62.5	0	0	0	108.8	R628 Q652 L657 A658	R628-L650 HydrophobicContact CG-CD1 3.51Å; L650-Q652 HydrophobicContact CD1-CG 3.86Å; L650-Q652 HydrophobicContact CG-CG 4.29Å; L650-L657 HydrophobicContact CD2-CB 4.13Å; L650-L657 HydrophobicContact CD2-CD1 4.04Å; L650-L657 HydrophobicContact CG-CB 4.21Å; L650-L657 HydrophobicContact CG-CD1 4.27Å; L650-L657 PolarHBondContact O-N 3.04Å; L650-A658 HydrophobicContact CB-CB 4.15Å; L650-A658 PolarHBondContact N-O 3.32Å; L650-A658 PolarHBondContact O-N 2.71Å
651	I	94.1	Very high	91.6	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.5	170.2	-58.4	174.1	0	0	0	107.4	L615 V625 N626 L627 V649 E655 L656 L665 I674	L615-I651 HydrophobicContact CD1-CG2 4.22Å; V625-I651 HydrophobicContact CB-CG2 4.42Å; V625-I651 HydrophobicContact CG1-CG2 4.38Å; V625-I651 WeakPolarHBondContact O-CG2 3.27Å; N626-I651 CarbonylContact C-O 3.53Å; N626-I651 VanDerWaalsContact CA-O 3.31Å; N626-I651 WeakPolarHBondContact CA-O 3.44Å; L627-I651 HydrophobicContact CB-CB 4.2Å; L627-I651 PolarHBondContact N-O 3.39Å; L627-I651 PolarHBondContact O-N 3.03Å; V649-I651 HydrophobicContact CG1-CD1 4.14Å; V649-I651 HydrophobicContact CG1-CG1 3.9Å; I651-E655 VanDerWaalsContact CA-O 3.27Å; I651-E655 WeakPolarHBondContact CA-O 3.36Å; I651-L656 HydrophobicContact CD1-CD1 4.41Å; I651-L656 HydrophobicContact CG1-CD1 3.76Å; I651-L665 HydrophobicContact CD1-CD2 4.41Å; I651-I674 HydrophobicContact CD1-CD1 3.63Å; I651-I674 HydrophobicContact CD1-CG1 3.9Å
652	Q	92.2	Very high	91.8	Very high	71 Å²	71	37.3 Å²	37.3	33%	0.332	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.5	173.8	-71.2	-174.6	-31.2	0	0	109.3	N626 L650 S654 E655 L657 T941	N626-Q652 WeakPolarHBondContact OD1-CA 3.14Å; L650-Q652 HydrophobicContact CD1-CG 3.86Å; L650-Q652 HydrophobicContact CG-CG 4.29Å; Q652-S654 PolarHBondContact O-N 3.27Å; Q652-S654 VanDerWaalsContact O-N 3.16Å; Q652-E655 PolarHBondContact N-O 3.01Å; Q652-E655 WeakPolarHBondContact O-CB 3.21Å; Q652-E655 PolarHBondContact O-N 3.35Å; Q652-L657 HydrophobicContact CB-CD1 3.99Å; Q652-L657 HydrophobicContact CG-CD1 4.15Å; Q652-T941 HydrophobicContact CB-CG2 4.2Å; Q652-T941 HydrophobicContact CG-CG2 4.14Å
653	N	91.4	Very high	91.9	Very high	65 Å²	65	34.6 Å²	34.6	35%	0.348	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	42.6	179.9	-64.2	-38.7	0	0	0	113.4	K624 V625 N626 E655	K624-N653 HydrophobicContact CG-CB 4.46Å; V625-N653 PolarHBondContact O-N 3.46Å; N626-N653 PolarHBondContact OD1-N 2.9Å; N653-E655 PolarHBondContact O-N 3.19Å
654	S	92.7	Very high	91.8	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.021	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	12.1	-177	-56.7	0	0	0	0	115.8	G612 I623 K624 V625 Q652	G612-S654 WeakPolarHBondContact CA-O 3.4Å; I623-S654 PolarHBondContact O-OG 3.46Å; K624-S654 WeakPolarHBondContact CA-OG 3.21Å; V625-S654 PolarHBondContact N-OG 2.79Å; V625-S654 PolarHBondContact O-N 2.92Å; Q652-S654 PolarHBondContact O-N 3.27Å; Q652-S654 VanDerWaalsContact O-N 3.16Å
655	E	92.3	Very high	91.9	Very high	121 Å²	121	32.4 Å²	32.4	57%	0.565	16%	0.16	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.9	174	-60.3	-174.2	169.4	0	0	110.8	I651 Q652 N653 L657	I651-E655 VanDerWaalsContact CA-O 3.27Å; I651-E655 WeakPolarHBondContact CA-O 3.36Å; Q652-E655 PolarHBondContact N-O 3.01Å; Q652-E655 WeakPolarHBondContact O-CB 3.21Å; Q652-E655 PolarHBondContact O-N 3.35Å; N653-E655 PolarHBondContact O-N 3.19Å; E655-L657 HydrophobicContact CB-CD2 4.3Å; E655-L657 PolarHBondContact O-N 2.68Å
656	L	94.6	Very high	92.1	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.058	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	103	176.4	177.5	63.5	0	0	0	109.8	T563 K608 F611 V649 I651 A658 V661	T563-L656 HydrophobicContact CG2-CD2 3.62Å; K608-L656 HydrophobicContact CB-CB 4.37Å; K608-L656 HydrophobicContact CB-CD2 4.09Å; K608-L656 HydrophobicContact CB-CG 4.21Å; K608-L656 HydrophobicContact CD-CD2 4.42Å; K608-L656 HydrophobicContact CD-CG 4.3Å; K608-L656 HydrophobicContact CG-CD2 3.86Å; K608-L656 HydrophobicContact CG-CG 4.17Å; F611-L656 HydrophobicContact CB-CD2 4.48Å; F611-L656 HydrophobicContact CD1-CB 4.09Å; F611-L656 HydrophobicContact CD1-CD2 3.92Å; F611-L656 HydrophobicContact CG-CD2 4.33Å; V649-L656 HydrophobicContact CG1-CD1 3.75Å; I651-L656 HydrophobicContact CD1-CD1 4.41Å; I651-L656 HydrophobicContact CG1-CD1 3.76Å; L656-A658 WeakPolarHBondContact CD1-O 3.46Å; L656-V661 HydrophobicContact CD2-CG2 3.82Å
657	L	93.3	Very high	91.8	Very high	88 Å²	88	27.7 Å²	27.7	46%	0.461	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-43.4	-173.9	-60	-178.2	0	0	0	112.7	L650 Q652 E655	L650-L657 HydrophobicContact CD2-CB 4.13Å; L650-L657 HydrophobicContact CD2-CD1 4.04Å; L650-L657 HydrophobicContact CG-CB 4.21Å; L650-L657 HydrophobicContact CG-CD1 4.27Å; L650-L657 PolarHBondContact O-N 3.04Å; Q652-L657 HydrophobicContact CB-CD1 3.99Å; Q652-L657 HydrophobicContact CG-CD1 4.15Å; E655-L657 HydrophobicContact CB-CD2 4.3Å; E655-L657 PolarHBondContact O-N 2.68Å
658	A	93	Very high	91.4	Very high	15 Å²	15	29 Å²	29	12%	0.124	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	155.8	-179.6	0	0	0	0	0	110.7	F648 V649 L650 L656	F648-A658 CarbonylContact O-C 3.57Å; V649-A658 VanDerWaalsContact CA-O 3.32Å; V649-A658 WeakPolarHBondContact CA-O 3.33Å; L650-A658 HydrophobicContact CB-CB 4.15Å; L650-A658 PolarHBondContact N-O 3.32Å; L650-A658 PolarHBondContact O-N 2.71Å; L656-A658 WeakPolarHBondContact CD1-O 3.46Å
659	G	92	Very high	90.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.			trans	95.2	146.3	174.9	0	0	0	0	0	115	K608 D646 F648	K608-G659 WeakPolarHBondContact CE-O 3.46Å; D646-G659 CarbonylContact O-C 3.59Å; D646-G659 VanDerWaalsContact O-CA 3.25Å; D646-G659 WeakPolarHBondContact O-CA 3.42Å; D646-G659 WeakPolarHBondContact OD1-CA 3.49Å; D646-G659 PolarHBondContact OD1-N 3.3Å; F648-G659 WeakPolarHBondContact O-CA 3.42Å; F648-G659 PolarHBondContact O-N 3.39Å
660	C	91.6	Very high	90.5	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.014	18%	0.175	C	C	.	.			trans	-91.4	135.9	168.4	-63.7	0	0	0	0	110.3	T631 M634 D646	T631-C660 VanDerWaalsContact CG2-O 3.28Å; T631-C660 WeakPolarHBondContact CG2-O 3.38Å; M634-C660 HydrophobicContact SD-CB 4.17Å; D646-C660 PolarHBondContact O-N 3.47Å; D646-C660 PolarHBondContact OD2-SG 3.23Å; D646-C660 VanDerWaalsContact OD2-SG 3.42Å
661	V	91.7	Very high	90.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.177	C	C	.	.			trans	-79.1	133	-176	-176.5	0	0	0	0	110	T559 H560 T563 F611 L656 L665 L666	T559-V661 HydrophobicContact CG2-CB 4.39Å; T559-V661 HydrophobicContact CG2-CG1 4.4Å; H560-V661 WeakPolarHBondContact CA-O 3.23Å; H560-V661 WeakPolarHBondContact CB-O 3.48Å; H560-V661 PolarHBondContact ND1-O 3.33Å; T563-V661 HydrophobicContact CG2-CB 4.4Å; T563-V661 HydrophobicContact CG2-CG2 3.85Å; T563-V661 PolarHBondContact OG1-N 3.03Å; T563-V661 VanDerWaalsContact OG1-N 3.1Å; F611-V661 HydrophobicContact CZ-CG2 4.46Å; L656-V661 HydrophobicContact CD2-CG2 3.82Å; V661-L665 HydrophobicContact CG1-CB 4.16Å; V661-L665 HydrophobicContact CG1-CD2 3.89Å; V661-L665 HydrophobicContact CG2-CD2 4.26Å; V661-L666 HydrophobicContact CB-CD1 4.42Å; V661-L666 HydrophobicContact CG1-CD1 3.37Å; V661-L666 HydrophobicContact CG1-CD2 3.92Å; V661-L666 HydrophobicContact CG1-CG 3.32Å
662	D	91.2	Very high	89.8	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.027	19%	0.185	C	C	.	.			trans	-124.2	-178.6	-178.1	73.9	-2.1	0	0	0	112.3	T631 K632 K664 L665 L666	T631-D662 WeakPolarHBondContact CA-OD2 3.31Å; T631-D662 VanDerWaalsContact CB-OD2 3.3Å; T631-D662 WeakPolarHBondContact CB-OD2 3.38Å; K632-D662 PolarHBondContact N-OD2 2.99Å; D662-K664 PolarHBondContact O-N 2.81Å; D662-K664 WeakPolarHBondContact OD1-CB 3.47Å; D662-K664 PolarHBondContact OD1-N 2.81Å; D662-L665 PolarHBondContact O-N 3.25Å; D662-L665 VanDerWaalsContact O-N 3.14Å; D662-L665 PolarHBondContact OD1-N 2.79Å; D662-L665 VanDerWaalsContact OD1-N 3.14Å; D662-L666 PolarHBondContact O-N 3.28Å
663	K	91.3	Very high	89.6	Confident	103 Å²	103	30 Å²	30	45%	0.448	17%	0.17	S	C	.	.	H	α-helix	trans	-57.9	-32.5	175.9	174.6	170.6	172.4	179.6	0	113.1	I556 L665 G667 S794 G795	I556-K663 HydrophobicContact CD1-CB 4.16Å; I556-K663 HydrophobicContact CD1-CG 4.12Å; I556-K663 HydrophobicContact CG2-CB 4.32Å; K663-L665 PolarHBondContact O-N 3.41Å; K663-G667 WeakPolarHBondContact O-CA 3.46Å; K663-G667 PolarHBondContact O-N 3.39Å; K663-S794 WeakPolarHBondContact CB-O 3.38Å; K663-S794 PolarHBondContact N-O 3.46Å; K663-G795 WeakPolarHBondContact CD-O 3.48Å
664	K	89.4	Confident	89.7	Confident	66 Å²	66	26.9 Å²	26.9	29%	0.287	15%	0.153	S	C	.	.	H	α-helix	trans	-66.1	-31.5	-179.9	-178.2	-177.3	172.4	-168.7	0	111.1	P630 K632 D662 S672	P630-K664 PolarHBondContact O-NZ 3.02Å; K632-K664 HydrophobicContact CB-CD 4.48Å; D662-K664 PolarHBondContact O-N 2.81Å; D662-K664 WeakPolarHBondContact OD1-CB 3.47Å; D662-K664 PolarHBondContact OD1-N 2.81Å; K664-S672 WeakPolarHBondContact CE-OG 3.26Å
665	L	90.4	Very high	89.7	Confident	1 Å²	1	27 Å²	27	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-93.9	-26.5	-175.1	-144.8	109.8	0	0	0	113.8	L627 V629 V649 I651 V661 D662 K663 S673 I674	L627-L665 HydrophobicContact CD2-CD1 3.69Å; L627-L665 HydrophobicContact CD2-CG 4.15Å; V629-L665 HydrophobicContact CB-CD1 4.13Å; V629-L665 HydrophobicContact CG1-CD1 4.42Å; V649-L665 HydrophobicContact CB-CD1 3.76Å; V649-L665 HydrophobicContact CB-CD2 4.32Å; V649-L665 HydrophobicContact CG1-CD1 3.92Å; V649-L665 HydrophobicContact CG1-CD2 3.72Å; V649-L665 HydrophobicContact CG1-CG 4.5Å; V649-L665 HydrophobicContact CG2-CD1 3.93Å; V649-L665 HydrophobicContact CG2-CD2 4.23Å; I651-L665 HydrophobicContact CD1-CD2 4.41Å; V661-L665 HydrophobicContact CG1-CB 4.16Å; V661-L665 HydrophobicContact CG1-CD2 3.89Å; V661-L665 HydrophobicContact CG2-CD2 4.26Å; D662-L665 PolarHBondContact O-N 3.25Å; D662-L665 VanDerWaalsContact O-N 3.14Å; D662-L665 PolarHBondContact OD1-N 2.79Å; D662-L665 VanDerWaalsContact OD1-N 3.14Å; K663-L665 PolarHBondContact O-N 3.41Å; L665-S673 CarbonylContact O-C 3.47Å; L665-S673 VanDerWaalsContact O-CA 3.25Å; L665-S673 WeakPolarHBondContact O-CA 3.33Å; L665-S673 PolarHBondContact O-OG 2.84Å; L665-I674 HydrophobicContact CD2-CD1 3.34Å; L665-I674 HydrophobicContact CD2-CG1 3.5Å; L665-I674 VanDerWaalsContact CD2-CG1 3.5Å; L665-I674 HydrophobicContact CG-CD1 4.33Å; L665-I674 HydrophobicContact CG-CG1 4.01Å; L665-I674 PolarHBondContact O-N 3.09Å
666	L	91.2	Very high	89.7	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-106.8	-43.6	175.7	-67.4	168.1	0	0	0	113.6	P551 T559 F611 V661 D662 S673 I674 F675 L694	P551-L666 WeakPolarHBondContact CD-O 3.48Å; T559-L666 HydrophobicContact CG2-CD1 3.61Å; F611-L666 HydrophobicContact CE2-CD2 4.41Å; F611-L666 HydrophobicContact CZ-CD2 4.34Å; V661-L666 HydrophobicContact CB-CD1 4.42Å; V661-L666 HydrophobicContact CG1-CD1 3.37Å; V661-L666 HydrophobicContact CG1-CD2 3.92Å; V661-L666 HydrophobicContact CG1-CG 3.32Å; D662-L666 PolarHBondContact O-N 3.28Å; L666-S673 PolarHBondContact O-OG 2.85Å; L666-I674 HydrophobicContact CD2-CD1 4.33Å; L666-F675 HydrophobicContact CB-CE2 4.36Å; L666-F675 HydrophobicContact CD2-CE2 3.57Å; L666-F675 HydrophobicContact CD2-CZ 4.1Å; L666-F675 WeakPolarHBondContact O-CD2 3.42Å; L666-L694 HydrophobicContact CD2-CD2 4.24Å
667	G	86.4	Confident	89.5	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.01	12%	0.124	C	C	.	.	S	Bend	trans	-75.7	174.9	-169.3	0	0	0	0	0	113.7	K663	K663-G667 WeakPolarHBondContact O-CA 3.46Å; K663-G667 PolarHBondContact O-N 3.39Å
668	G	81.3	Confident	89.5	Confident	26 Å²	26	16.7 Å²	16.7	27%	0.268	10%	0.103	S	C	.	.	S	Bend	trans	-78.6	162.9	178.8	0	0	0	0	0	113	P547 S550	P547-G668 WeakPolarHBondContact O-CA 3.48Å; S550-G668 WeakPolarHBondContact OG-CA 3.4Å; S550-G668 PolarHBondContact OG-N 3.08Å
669	G	81.8	Confident	89.5	Confident	45 Å²	45	16.8 Å²	16.8	46%	0.464	10%	0.101	S	C	.	.	S	Bend	trans	78.8	27	179.8	0	0	0	0	0	114.2	E546 P547	E546-G669 VanDerWaalsContact CD-C 3.49Å; E546-G669 VanDerWaalsContact OE1-C 3.26Å; E546-G669 WeakPolarHBondContact OE2-CA 3.32Å; P547-G669 PolarHBondContact O-N 3.08Å; P547-G669 VanDerWaalsContact O-N 3.12Å
670	S	85.6	Confident	89.4	Confident	23 Å²	23	18.6 Å²	18.6	16%	0.161	11%	0.108	C	C	.	.			trans	-150.9	129.3	169	-168.3	0	0	0	0	111.9	P547 S672 S673	P547-S670 WeakPolarHBondContact CD-O 3.4Å; P547-S670 WeakPolarHBondContact CG-O 3.37Å; S670-S672 PolarHBondContact O-N 3.47Å; S670-S672 PolarHBondContact OG-N 3.31Å; S670-S672 PolarHBondContact OG-OG 3.19Å; S670-S673 WeakPolarHBondContact O-CB 3.21Å; S670-S673 PolarHBondContact O-N 2.92Å
671	K	86.6	Confident	89.3	Confident	29 Å²	29	20.4 Å²	20.4	13%	0.126	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-14	174	-58.7	179.5	-173.3	159.9	0	113	N544 E546 S673 Y676 M923 E924 T925 D926	N544-K671 VanDerWaalsContact O-CE 3.25Å; N544-K671 WeakPolarHBondContact O-CE 3.35Å; E546-K671 HydrophobicContact CG-CG 4.14Å; K671-S673 PolarHBondContact O-N 3.22Å; K671-Y676 HydrophobicContact CB-CD1 4.28Å; K671-Y676 HydrophobicContact CB-CE1 4.1Å; K671-Y676 WeakPolarHBondContact O-CD1 3.33Å; K671-M923 WeakPolarHBondContact CE-O 3.49Å; K671-E924 WeakPolarHBondContact CD-O 3.39Å; K671-T925 VanDerWaalsContact NZ-C 3.33Å; K671-T925 PolarHBondContact NZ-O 3.34Å; K671-D926 IonicContact NZ-OD1 2.86Å; K671-D926 PolarHBondContact NZ-OD1 3Å
672	S	85.4	Confident	89.2	Confident	25 Å²	25	23.9 Å²	23.9	18%	0.175	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	5.3	174.2	58	0	0	0	0	114.5	K664 S670	K664-S672 WeakPolarHBondContact CE-OG 3.26Å; S670-S672 PolarHBondContact O-N 3.47Å; S670-S672 PolarHBondContact OG-N 3.31Å; S670-S672 PolarHBondContact OG-OG 3.19Å
673	S	89.6	Confident	89.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.142	C	C	.	.			trans	-63.3	142.5	177.8	176.1	0	0	0	0	112	L665 L666 S670 K671 F675 Y676 T677	L665-S673 CarbonylContact O-C 3.47Å; L665-S673 VanDerWaalsContact O-CA 3.25Å; L665-S673 WeakPolarHBondContact O-CA 3.33Å; L665-S673 PolarHBondContact O-OG 2.84Å; L666-S673 PolarHBondContact O-OG 2.85Å; S670-S673 WeakPolarHBondContact O-CB 3.21Å; S670-S673 PolarHBondContact O-N 2.92Å; K671-S673 PolarHBondContact O-N 3.22Å; S673-F675 PolarHBondContact O-N 3.2Å; S673-F675 PolarHBondContact OG-N 2.79Å; S673-Y676 WeakPolarHBondContact O-CB 3.49Å; S673-Y676 PolarHBondContact O-N 3.19Å; S673-T677 PolarHBondContact O-N 2.86Å; S673-T677 VanDerWaalsContact O-N 3.08Å; S673-T677 PolarHBondContact O-OG1 3.15Å
674	I	92.4	Very high	89.2	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-42	172.7	-62	170.6	0	0	0	109.9	F611 L615 V625 I651 L665 L666 Y676 T677 L678	F611-I674 HydrophobicContact CE1-CD1 3.82Å; F611-I674 HydrophobicContact CZ-CD1 3.59Å; L615-I674 HydrophobicContact CD2-CG2 3.65Å; V625-I674 HydrophobicContact CG1-CG2 4.45Å; I651-I674 HydrophobicContact CD1-CD1 3.63Å; I651-I674 HydrophobicContact CD1-CG1 3.9Å; L665-I674 HydrophobicContact CD2-CD1 3.34Å; L665-I674 HydrophobicContact CD2-CG1 3.5Å; L665-I674 VanDerWaalsContact CD2-CG1 3.5Å; L665-I674 HydrophobicContact CG-CD1 4.33Å; L665-I674 HydrophobicContact CG-CG1 4.01Å; L665-I674 PolarHBondContact O-N 3.09Å; L666-I674 HydrophobicContact CD2-CD1 4.33Å; I674-Y676 VanDerWaalsContact C-N 3.3Å; I674-Y676 PolarHBondContact O-N 3.01Å; I674-T677 WeakPolarHBondContact O-CB 3.24Å; I674-T677 PolarHBondContact O-N 2.73Å; I674-L678 HydrophobicContact CG2-CD1 4.2Å; I674-L678 PolarHBondContact O-N 3.31Å
675	F	92.8	Very high	89.3	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-68.1	-32.4	-179	-63.1	-66.5	0	0	0	112.5	P551 L666 S673 L678 L679 C687 A690 M691 L694	P551-F675 HydrophobicContact CG-CD2 4.18Å; P551-F675 HydrophobicContact CG-CE2 3.44Å; P551-F675 VanDerWaalsContact CG-CE2 3.44Å; P551-F675 HydrophobicContact CG-CZ 3.88Å; L666-F675 HydrophobicContact CB-CE2 4.36Å; L666-F675 HydrophobicContact CD2-CE2 3.57Å; L666-F675 HydrophobicContact CD2-CZ 4.1Å; L666-F675 WeakPolarHBondContact O-CD2 3.42Å; S673-F675 PolarHBondContact O-N 3.2Å; S673-F675 PolarHBondContact OG-N 2.79Å; F675-L678 HydrophobicContact CD1-CD1 4.34Å; F675-L679 VanDerWaalsContact O-CB 3.23Å; F675-L679 WeakPolarHBondContact O-CB 3.46Å; F675-L679 PolarHBondContact O-N 2.99Å; F675-C687 PolarHBondContact O-SG 3.04Å; F675-A690 HydrophobicContact CD1-CB 4.3Å; F675-A690 HydrophobicContact CE1-CB 3.92Å; F675-M691 HydrophobicContact CB-CE 3.52Å; F675-M691 HydrophobicContact CD1-CE 3.92Å; F675-M691 HydrophobicContact CD1-CG 3.46Å; F675-M691 VanDerWaalsContact CD1-CG 3.46Å; F675-M691 HydrophobicContact CD2-CE 4.2Å; F675-M691 HydrophobicContact CD2-CG 4.44Å; F675-M691 HydrophobicContact CE1-CB 4.25Å; F675-M691 HydrophobicContact CE1-CG 3.48Å; F675-M691 VanDerWaalsContact CE1-CG 3.48Å; F675-M691 HydrophobicContact CE2-CG 4.47Å; F675-M691 HydrophobicContact CG-CE 3.6Å; F675-M691 HydrophobicContact CG-CG 3.97Å; F675-M691 HydrophobicContact CZ-CG 4.02Å; F675-L694 HydrophobicContact CE2-CD2 4.24Å; F675-L694 HydrophobicContact CZ-CB 4.49Å; F675-L694 HydrophobicContact CZ-CD2 3.84Å
676	Y	92.4	Very high	89.4	Confident	3 Å²	3	28.1 Å²	28.1	1%	0.012	16%	0.159	C	C	.	.	H	α-helix	trans	-66.3	-40.9	172.6	-174.6	-96.5	0	0	0	111.3	V540 G545 P547 K671 S673 I674 L679 R680 M923 E924	V540-Y676 HydrophobicContact CG1-CD2 4.24Å; V540-Y676 HydrophobicContact CG1-CE2 4.1Å; G545-Y676 WeakPolarHBondContact O-CE2 3.31Å; P547-Y676 HydrophobicContact CG-CD2 4.41Å; K671-Y676 HydrophobicContact CB-CD1 4.28Å; K671-Y676 HydrophobicContact CB-CE1 4.1Å; K671-Y676 WeakPolarHBondContact O-CD1 3.33Å; S673-Y676 WeakPolarHBondContact O-CB 3.49Å; S673-Y676 PolarHBondContact O-N 3.19Å; I674-Y676 VanDerWaalsContact C-N 3.3Å; I674-Y676 PolarHBondContact O-N 3.01Å; Y676-L679 WeakPolarHBondContact O-CB 3.31Å; Y676-L679 PolarHBondContact O-N 2.87Å; Y676-R680 HydrophobicContact CD1-CG 4.25Å; Y676-R680 HydrophobicContact CE1-CG 3.84Å; Y676-R680 WeakPolarHBondContact O-CG 3.49Å; Y676-R680 PolarHBondContact O-N 3.1Å; Y676-R680 PolarHBondContact OH-NE 2.84Å; Y676-R680 PolarHBondContact OH-NH2 3.38Å; Y676-M923 PolarHBondContact OH-O 3.33Å; Y676-E924 HydrophobicContact CE1-CG 4.23Å; Y676-E924 WeakPolarHBondContact OH-CA 3.4Å
677	T	91	Very high	89.4	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-63.7	-46.7	174.9	-64.1	0	0	0	0	111.5	V625 L627 S673 I674 L679 R680 D681 K934	V625-T677 HydrophobicContact CG1-CG2 4.02Å; L627-T677 HydrophobicContact CD1-CG2 4.17Å; L627-T677 VanDerWaalsContact CD1-OG1 3.25Å; L627-T677 WeakPolarHBondContact CD1-OG1 3.35Å; S673-T677 PolarHBondContact O-N 2.86Å; S673-T677 VanDerWaalsContact O-N 3.08Å; S673-T677 PolarHBondContact O-OG1 3.15Å; I674-T677 WeakPolarHBondContact O-CB 3.24Å; I674-T677 PolarHBondContact O-N 2.73Å; T677-L679 VanDerWaalsContact C-N 3.3Å; T677-L679 PolarHBondContact O-N 3.42Å; T677-R680 PolarHBondContact O-N 3.23Å; T677-D681 VanDerWaalsContact CG2-OD2 3.22Å; T677-D681 WeakPolarHBondContact CG2-OD2 3.24Å; T677-D681 WeakPolarHBondContact O-CB 3.44Å; T677-D681 PolarHBondContact O-N 3.03Å; T677-K934 PolarHBondContact OG1-NZ 3.08Å
678	L	92.6	Very high	89.7	Confident	1 Å²	1	28 Å²	28	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-58	-42.4	173.6	-77.5	169.9	0	0	0	112.4	L615 I623 V625 I674 F675 Y682 G683 C687 A690	L615-L678 HydrophobicContact CD2-CD1 4.14Å; I623-L678 HydrophobicContact CG2-CD2 3.75Å; V625-L678 HydrophobicContact CG2-CD2 3.4Å; V625-L678 HydrophobicContact CG2-CG 3.97Å; I674-L678 HydrophobicContact CG2-CD1 4.2Å; I674-L678 PolarHBondContact O-N 3.31Å; F675-L678 HydrophobicContact CD1-CD1 4.34Å; L678-Y682 HydrophobicContact CD2-CD2 4.03Å; L678-Y682 CarbonylContact O-C 3.5Å; L678-Y682 WeakPolarHBondContact O-CA 3.3Å; L678-Y682 PolarHBondContact O-N 3.21Å; L678-G683 PolarHBondContact O-N 3.21Å; L678-G683 VanDerWaalsContact O-N 3.1Å; L678-C687 HydrophobicContact CB-CB 4.34Å; L678-A690 HydrophobicContact CD1-CB 3.59Å
679	L	92.8	Very high	90.2	Very high	16 Å²	16	28 Å²	28	8%	0.084	15%	0.152	C	C	.	.	H	α-helix	trans	-60.1	-45.8	178.4	172	65.9	0	0	0	111.9	I539 V540 F675 Y676 T677 G683 R684 C687	I539-L679 HydrophobicContact CB-CD2 4.42Å; I539-L679 HydrophobicContact CD1-CD1 4.25Å; I539-L679 HydrophobicContact CG2-CD2 4.19Å; V540-L679 HydrophobicContact CG1-CD2 3.5Å; F675-L679 VanDerWaalsContact O-CB 3.23Å; F675-L679 WeakPolarHBondContact O-CB 3.46Å; F675-L679 PolarHBondContact O-N 2.99Å; Y676-L679 WeakPolarHBondContact O-CB 3.31Å; Y676-L679 PolarHBondContact O-N 2.87Å; T677-L679 VanDerWaalsContact C-N 3.3Å; T677-L679 PolarHBondContact O-N 3.42Å; L679-G683 VanDerWaalsContact O-CA 3.23Å; L679-G683 WeakPolarHBondContact O-CA 3.46Å; L679-G683 PolarHBondContact O-N 3.45Å; L679-R684 HydrophobicContact CD1-CB 4.16Å; L679-R684 HydrophobicContact CD1-CG 3.37Å; L679-C687 HydrophobicContact CB-CB 4.21Å
680	R	90.5	Very high	90.7	Very high	39 Å²	39	26 Å²	26	15%	0.147	13%	0.13	C	C	.	.	H	α-helix	trans	-75.1	-42.6	-176.9	-68.9	-64	-177.8	-145.4	-8.5	113	Y676 T677 L921 E922 E924	Y676-R680 HydrophobicContact CD1-CG 4.25Å; Y676-R680 HydrophobicContact CE1-CG 3.84Å; Y676-R680 WeakPolarHBondContact O-CG 3.49Å; Y676-R680 PolarHBondContact O-N 3.1Å; Y676-R680 PolarHBondContact OH-NE 2.84Å; Y676-R680 PolarHBondContact OH-NH2 3.38Å; T677-R680 PolarHBondContact O-N 3.23Å; R680-L921 PolarHBondContact NH2-O 3.37Å; R680-E922 IonicContact CZ-OE2 3.01Å; R680-E922 IonicContact NH1-OE1 2.66Å; R680-E922 PolarHBondContact NH1-OE1 3.47Å; R680-E922 IonicContact NH1-OE2 3.76Å; R680-E922 PolarHBondContact NH1-OE2 2.93Å; R680-E924 HydrophobicContact CG-CG 4.44Å
681	D	88.6	Confident	91	Very high	39 Å²	39	24.9 Å²	24.9	21%	0.209	12%	0.123	C	C	.	.	H	α-helix	trans	-90.5	-33.4	-169.1	-56.3	-21.8	0	0	0	112	T677 K934 K1030	T677-D681 VanDerWaalsContact CG2-OD2 3.22Å; T677-D681 WeakPolarHBondContact CG2-OD2 3.24Å; T677-D681 WeakPolarHBondContact O-CB 3.44Å; T677-D681 PolarHBondContact O-N 3.03Å; D681-K934 IonicContact OD2-NZ 3.71Å; D681-K1030 IonicContact OD1-NZ 3.59Å; D681-K1030 PolarHBondContact OD1-NZ 2.81Å
682	Y	90	Very high	91.3	Very high	74 Å²	74	24.3 Å²	24.3	29%	0.29	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-9.4	-174.9	-61.4	-81.1	0	0	0	114.1	I623 K624 V625 L678	I623-Y682 HydrophobicContact CB-CD1 4.48Å; I623-Y682 HydrophobicContact CB-CE1 4.38Å; I623-Y682 HydrophobicContact CG1-CD1 4.05Å; I623-Y682 HydrophobicContact CG1-CE1 4.38Å; I623-Y682 HydrophobicContact CG1-CG 4.37Å; I623-Y682 HydrophobicContact CG2-CD1 4.41Å; I623-Y682 HydrophobicContact CG2-CD2 4.07Å; I623-Y682 HydrophobicContact CG2-CE1 4.36Å; I623-Y682 HydrophobicContact CG2-CE2 4.01Å; I623-Y682 HydrophobicContact CG2-CG 4.27Å; K624-Y682 WeakPolarHBondContact CA-OH 3.04Å; K624-Y682 PolarHBondContact N-OH 2.88Å; K624-Y682 PolarHBondContact O-OH 3.46Å; V625-Y682 HydrophobicContact CG2-CE2 4.36Å; L678-Y682 HydrophobicContact CD2-CD2 4.03Å; L678-Y682 CarbonylContact O-C 3.5Å; L678-Y682 WeakPolarHBondContact O-CA 3.3Å; L678-Y682 PolarHBondContact O-N 3.21Å
683	G	90.8	Very high	91.6	Very high	26 Å²	26	23.5 Å²	23.5	27%	0.268	11%	0.113	S	C	.	.			trans	95.5	178.9	175.8	0	0	0	0	0	115.4	L678 L679 C687	L678-G683 PolarHBondContact O-N 3.21Å; L678-G683 VanDerWaalsContact O-N 3.1Å; L679-G683 VanDerWaalsContact O-CA 3.23Å; L679-G683 WeakPolarHBondContact O-CA 3.46Å; L679-G683 PolarHBondContact O-N 3.45Å; G683-C687 PolarHBondContact O-N 3.43Å
684	R	92.3	Very high	91.8	Very high	90 Å²	90	23.5 Å²	23.5	34%	0.34	11%	0.113	S	C	.	.	H	α-helix	trans	-70.3	-36.9	-167	-65.4	165.4	-170.3	177.4	11.6	113.4	L536 L679 A688	L536-R684 WeakPolarHBondContact O-CD 3.3Å; L536-R684 WeakPolarHBondContact O-CG 3.34Å; L679-R684 HydrophobicContact CD1-CB 4.16Å; L679-R684 HydrophobicContact CD1-CG 3.37Å; R684-A688 WeakPolarHBondContact O-CB 3.49Å; R684-A688 PolarHBondContact O-N 3.07Å
685	E	91.7	Very high	91.8	Very high	130 Å²	130	23.6 Å²	23.6	61%	0.607	11%	0.114	S	C	*	.	H	α-helix	trans	-69.6	-43	-179.9	-68	-164.4	169.3	0	0	112.3	C687 A688 D689	E685-C687 VanDerWaalsContact C-N 3.28Å; E685-C687 PolarHBondContact O-N 3.38Å; E685-A688 PolarHBondContact O-N 3.22Å; E685-D689 WeakPolarHBondContact O-CB 3.48Å; E685-D689 PolarHBondContact O-N 3.2Å
686	A	90.9	Very high	91.8	Very high	17 Å²	17	25.9 Å²	25.9	14%	0.14	12%	0.123	C	C	.	.	H	α-helix	trans	-60.4	-40.6	176.6	0	0	0	0	0	111.6	I623 A690	I623-A686 HydrophobicContact CD1-CB 4.13Å; A686-A690 WeakPolarHBondContact O-CB 3.49Å; A686-A690 PolarHBondContact O-N 2.87Å
687	C	93.1	Very high	91.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.3	-48.5	174.5	-175	0	0	0	0	112.1	F675 L678 L679 G683 E685 A690 M691	F675-C687 PolarHBondContact O-SG 3.04Å; L678-C687 HydrophobicContact CB-CB 4.34Å; L679-C687 HydrophobicContact CB-CB 4.21Å; G683-C687 PolarHBondContact O-N 3.43Å; E685-C687 VanDerWaalsContact C-N 3.28Å; E685-C687 PolarHBondContact O-N 3.38Å; C687-A690 PolarHBondContact O-N 3.04Å; C687-M691 PolarHBondContact O-N 3.22Å
688	A	91.9	Very high	92	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.6	-44.9	179	0	0	0	0	0	112.8	I372 L536 R684 E685 A690 M691 W692	I372-A688 HydrophobicContact CD1-CB 3.57Å; I372-A688 HydrophobicContact CG1-CB 3.68Å; L536-A688 HydrophobicContact CD2-CB 3.35Å; R684-A688 WeakPolarHBondContact O-CB 3.49Å; R684-A688 PolarHBondContact O-N 3.07Å; E685-A688 PolarHBondContact O-N 3.22Å; A688-A690 VanDerWaalsContact C-N 3.35Å; A688-A690 PolarHBondContact O-N 3.34Å; A688-M691 PolarHBondContact O-N 3.35Å; A688-W692 WeakPolarHBondContact O-CB 3.4Å; A688-W692 PolarHBondContact O-N 2.92Å
689	D	90.8	Very high	92.1	Very high	26 Å²	26	28.1 Å²	28.1	14%	0.139	14%	0.135	C	C	.	.	H	α-helix	trans	-61.6	-44	176.9	-77.6	7.6	0	0	0	111.1	R371 E685 M691 W692 R693	R371-D689 IonicContact CZ-OD1 3.31Å; R371-D689 IonicContact NH1-OD1 2.65Å; R371-D689 PolarHBondContact NH1-OD1 3.43Å; R371-D689 IonicContact NH2-OD1 2.73Å; R371-D689 PolarHBondContact NH2-OD1 3.4Å; E685-D689 WeakPolarHBondContact O-CB 3.48Å; E685-D689 PolarHBondContact O-N 3.2Å; D689-M691 PolarHBondContact O-N 3.27Å; D689-W692 PolarHBondContact O-N 3.11Å; D689-R693 WeakPolarHBondContact O-CB 3.23Å; D689-R693 VanDerWaalsContact O-CG 3.23Å; D689-R693 WeakPolarHBondContact O-CG 3.41Å; D689-R693 PolarHBondContact O-N 2.72Å; D689-R693 IonicContact OD2-NH2 2.79Å
690	A	92.3	Very high	92.2	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-41.1	178.5	0	0	0	0	0	112	I614 F675 L678 A686 C687 A688 R693 L694	I614-A690 WeakPolarHBondContact CG2-O 3.31Å; F675-A690 HydrophobicContact CD1-CB 4.3Å; F675-A690 HydrophobicContact CE1-CB 3.92Å; L678-A690 HydrophobicContact CD1-CB 3.59Å; A686-A690 WeakPolarHBondContact O-CB 3.49Å; A686-A690 PolarHBondContact O-N 2.87Å; C687-A690 PolarHBondContact O-N 3.04Å; A688-A690 VanDerWaalsContact C-N 3.35Å; A688-A690 PolarHBondContact O-N 3.34Å; A690-R693 PolarHBondContact O-N 3.1Å; A690-L694 WeakPolarHBondContact O-CB 3.23Å; A690-L694 PolarHBondContact O-N 3.11Å
691	M	93	Very high	92.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-63.8	-41.3	174.8	-71.1	-173.2	-168.9	0	0	112.1	I372 I549 F675 C687 A688 D689 L694 G695	I372-M691 HydrophobicContact CD1-SD 4.25Å; I372-M691 HydrophobicContact CG2-CB 4.31Å; I372-M691 HydrophobicContact CG2-SD 4.25Å; I549-M691 HydrophobicContact CG2-SD 4.13Å; I549-M691 VanDerWaalsContact O-CE 3.23Å; I549-M691 WeakPolarHBondContact O-CE 3.19Å; F675-M691 HydrophobicContact CB-CE 3.52Å; F675-M691 HydrophobicContact CD1-CE 3.92Å; F675-M691 HydrophobicContact CD1-CG 3.46Å; F675-M691 VanDerWaalsContact CD1-CG 3.46Å; F675-M691 HydrophobicContact CD2-CE 4.2Å; F675-M691 HydrophobicContact CD2-CG 4.44Å; F675-M691 HydrophobicContact CE1-CB 4.25Å; F675-M691 HydrophobicContact CE1-CG 3.48Å; F675-M691 VanDerWaalsContact CE1-CG 3.48Å; F675-M691 HydrophobicContact CE2-CG 4.47Å; F675-M691 HydrophobicContact CG-CE 3.6Å; F675-M691 HydrophobicContact CG-CG 3.97Å; F675-M691 HydrophobicContact CZ-CG 4.02Å; C687-M691 PolarHBondContact O-N 3.22Å; A688-M691 PolarHBondContact O-N 3.35Å; D689-M691 PolarHBondContact O-N 3.27Å; M691-L694 PolarHBondContact O-N 3.42Å; M691-G695 PolarHBondContact O-N 2.87Å
692	W	93	Very high	92.7	Very high	16 Å²	16	28 Å²	28	6%	0.061	13%	0.133	C	C	.	.	H	α-helix	trans	-64.3	-44.2	177.7	-179.4	79.8	0	0	0	111.9	N369 R371 A583 H586 A688 D689 L694 G695 R696	N369-W692 PolarHBondContact O-NE1 3.48Å; R371-W692 HydrophobicContact CG-CG 4.24Å; A583-W692 HydrophobicContact CB-CH2 3.79Å; A583-W692 HydrophobicContact CB-CZ2 4.3Å; A583-W692 WeakPolarHBondContact O-CH2 3.46Å; H586-W692 AromaticContact CD2-CZ3 3.88Å; A688-W692 WeakPolarHBondContact O-CB 3.4Å; A688-W692 PolarHBondContact O-N 2.92Å; D689-W692 PolarHBondContact O-N 3.11Å; W692-L694 PolarHBondContact O-N 2.87Å; W692-G695 PolarHBondContact O-N 2.83Å; W692-R696 PolarHBondContact O-N 2.9Å
693	R	91.9	Very high	93	Very high	8 Å²	8	28.1 Å²	28.1	3%	0.03	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-44	174.3	-69.8	175	-153	148.3	6	112	L581 H586 I614 D689 A690 G695 R696 I697	L581-R693 HydrophobicContact CD2-CB 3.56Å; L581-R693 HydrophobicContact CD2-CG 3.68Å; H586-R693 PolarHBondContact CE1-NE 3.23Å; H586-R693 VanDerWaalsContact CE1-NE 3.26Å; H586-R693 PolarHBondContact CE1-NH2 2.99Å; H586-R693 VanDerWaalsContact CE1-NH2 3.33Å; H586-R693 PolarHBondContact NE2-NE 3.02Å; H586-R693 PolarHBondContact NE2-NH2 3.12Å; I614-R693 HydrophobicContact CG2-CB 4.11Å; I614-R693 WeakPolarHBondContact O-CD 3.35Å; I614-R693 PolarHBondContact O-NH1 2.97Å; D689-R693 WeakPolarHBondContact O-CB 3.23Å; D689-R693 VanDerWaalsContact O-CG 3.23Å; D689-R693 WeakPolarHBondContact O-CG 3.41Å; D689-R693 PolarHBondContact O-N 2.72Å; D689-R693 IonicContact OD2-NH2 2.79Å; A690-R693 PolarHBondContact O-N 3.1Å; R693-G695 VanDerWaalsContact C-N 3.33Å; R693-G695 PolarHBondContact O-N 3.47Å; R693-R696 PolarHBondContact O-N 2.86Å; R693-I697 PolarHBondContact O-N 3.44Å; R693-I697 VanDerWaalsContact O-N 3.16Å
694	L	93.8	Very high	93.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-57.6	-48.5	176	-175.8	74.6	0	0	0	110.6	P551 T559 F611 I614 L666 F675 A690 M691 W692 R696 I697 A698	P551-L694 HydrophobicContact CB-CD2 3.86Å; P551-L694 HydrophobicContact CG-CD2 3.46Å; P551-L694 VanDerWaalsContact CG-CD2 3.46Å; T559-L694 HydrophobicContact CG2-CD1 4.04Å; T559-L694 WeakPolarHBondContact OG1-CD1 3.49Å; F611-L694 HydrophobicContact CE2-CD1 4.08Å; I614-L694 HydrophobicContact CD1-CD1 3.54Å; I614-L694 HydrophobicContact CG2-CB 4.06Å; I614-L694 HydrophobicContact CG2-CD1 4.44Å; L666-L694 HydrophobicContact CD2-CD2 4.24Å; F675-L694 HydrophobicContact CE2-CD2 4.24Å; F675-L694 HydrophobicContact CZ-CB 4.49Å; F675-L694 HydrophobicContact CZ-CD2 3.84Å; A690-L694 WeakPolarHBondContact O-CB 3.23Å; A690-L694 PolarHBondContact O-N 3.11Å; M691-L694 PolarHBondContact O-N 3.42Å; W692-L694 PolarHBondContact O-N 2.87Å; L694-R696 PolarHBondContact O-N 2.76Å; L694-I697 PolarHBondContact O-N 2.94Å; L694-A698 HydrophobicContact CD1-CB 4.45Å; L694-A698 HydrophobicContact CG-CB 4.39Å; L694-A698 WeakPolarHBondContact O-CB 3.36Å; L694-A698 PolarHBondContact O-N 3.3Å
695	G	92.2	Very high	93.2	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-51.4	-44.8	-179.9	0	0	0	0	0	112.8	M691 W692 R693 L699	M691-G695 PolarHBondContact O-N 2.87Å; W692-G695 PolarHBondContact O-N 2.83Å; R693-G695 VanDerWaalsContact C-N 3.33Å; R693-G695 PolarHBondContact O-N 3.47Å; G695-L699 WeakPolarHBondContact O-CB 3.49Å; G695-L699 WeakPolarHBondContact O-CD1 3.46Å; G695-L699 VanDerWaalsContact O-CG 3.23Å; G695-L699 WeakPolarHBondContact O-CG 3.35Å; G695-L699 PolarHBondContact O-N 2.82Å
696	R	92.6	Very high	93.3	Very high	52 Å²	52	30.3 Å²	30.3	20%	0.196	16%	0.162	C	C	.	.	H	α-helix	trans	-71.9	-48.3	-177.8	-64.9	179.1	63.3	121.8	3.7	113	Q580 A583 W692 R693 L694 F700	Q580-R696 HydrophobicContact CB-CB 4.48Å; Q580-R696 VanDerWaalsContact O-CZ 3.27Å; Q580-R696 PolarHBondContact O-NE 2.83Å; Q580-R696 PolarHBondContact O-NH2 3.14Å; Q580-R696 VanDerWaalsContact O-NH2 3.15Å; A583-R696 VanDerWaalsContact CB-CZ 3.43Å; W692-R696 PolarHBondContact O-N 2.9Å; R693-R696 PolarHBondContact O-N 2.86Å; L694-R696 PolarHBondContact O-N 2.76Å; R696-F700 VanDerWaalsContact O-CB 3.23Å; R696-F700 WeakPolarHBondContact O-CB 3.48Å; R696-F700 PolarHBondContact O-N 2.86Å
697	I	93.5	Very high	93.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-49.2	-179.8	-72.8	-175.8	0	0	0	111	L562 Q580 L581 I610 I614 R693 L694 L699 F700 F701	L562-I697 HydrophobicContact CD2-CG2 4.11Å; Q580-I697 HydrophobicContact CB-CG1 4.41Å; L581-I697 HydrophobicContact CD1-CD1 3.86Å; L581-I697 HydrophobicContact CD2-CD1 3.6Å; L581-I697 HydrophobicContact CD2-CG1 3.95Å; L581-I697 HydrophobicContact CG-CD1 3.7Å; L581-I697 HydrophobicContact CG-CG1 4.2Å; I610-I697 HydrophobicContact CG2-CG2 4.34Å; I614-I697 HydrophobicContact CD1-CB 4.38Å; I614-I697 HydrophobicContact CD1-CD1 4.34Å; I614-I697 HydrophobicContact CD1-CG2 4.32Å; I614-I697 HydrophobicContact CG1-CD1 3.81Å; R693-I697 PolarHBondContact O-N 3.44Å; R693-I697 VanDerWaalsContact O-N 3.16Å; L694-I697 PolarHBondContact O-N 2.94Å; I697-L699 PolarHBondContact O-N 2.82Å; I697-F700 PolarHBondContact O-N 3.45Å; I697-F701 WeakPolarHBondContact O-CB 3.45Å; I697-F701 PolarHBondContact O-N 3.37Å
698	A	93.8	Very high	93.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-46.9	-171.7	0	0	0	0	0	111.3	L555 A558 L694 F701 L702	L555-A698 HydrophobicContact CD2-CB 4.25Å; A558-A698 HydrophobicContact CB-CB 3.81Å; A558-A698 VanDerWaalsContact CB-O 3.29Å; A558-A698 WeakPolarHBondContact CB-O 3.16Å; L694-A698 HydrophobicContact CD1-CB 4.45Å; L694-A698 HydrophobicContact CG-CB 4.39Å; L694-A698 WeakPolarHBondContact O-CB 3.36Å; L694-A698 PolarHBondContact O-N 3.3Å; A698-F701 PolarHBondContact O-N 3.37Å; A698-L702 WeakPolarHBondContact O-CB 3.33Å; A698-L702 PolarHBondContact O-N 2.99Å
699	L	93.7	Very high	93.6	Very high	53 Å²	53	41.8 Å²	41.8	28%	0.277	23%	0.225	S	C	.	.	H	α-helix	trans	-67.9	-39.8	179.1	-65.5	175.4	0	0	0	112.2	P368 D554 L555 G695 I697 L702 A703	P368-L699 HydrophobicContact CB-CD1 3.42Å; P368-L699 VanDerWaalsContact CB-CD1 3.42Å; P368-L699 HydrophobicContact CG-CD1 3.45Å; P368-L699 VanDerWaalsContact CG-CD1 3.45Å; D554-L699 HydrophobicContact CB-CD2 4.16Å; L555-L699 HydrophobicContact CD2-CD1 4.09Å; L555-L699 HydrophobicContact CD2-CD2 3.86Å; L555-L699 HydrophobicContact CD2-CG 3.65Å; G695-L699 WeakPolarHBondContact O-CB 3.49Å; G695-L699 WeakPolarHBondContact O-CD1 3.46Å; G695-L699 VanDerWaalsContact O-CG 3.23Å; G695-L699 WeakPolarHBondContact O-CG 3.35Å; G695-L699 PolarHBondContact O-N 2.82Å; I697-L699 PolarHBondContact O-N 2.82Å; L699-L702 PolarHBondContact O-N 2.99Å; L699-A703 WeakPolarHBondContact O-CB 3.49Å; L699-A703 PolarHBondContact O-N 3.47Å
700	F	94.9	Very high	93.7	Very high	50 Å²	50	42.5 Å²	42.5	22%	0.219	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-45.1	175.9	-174.4	-85.8	0	0	0	111.2	T576 L577 Q580 R696 I697 A703 H704	T576-F700 HydrophobicContact CG2-CE1 3.72Å; T576-F700 HydrophobicContact CG2-CZ 3.68Å; L577-F700 HydrophobicContact CD2-CD1 3.8Å; L577-F700 HydrophobicContact CD2-CE1 4.42Å; Q580-F700 HydrophobicContact CG-CB 4.04Å; Q580-F700 HydrophobicContact CG-CD1 4.1Å; Q580-F700 HydrophobicContact CG-CD2 4.02Å; Q580-F700 HydrophobicContact CG-CG 3.78Å; R696-F700 VanDerWaalsContact O-CB 3.23Å; R696-F700 WeakPolarHBondContact O-CB 3.48Å; R696-F700 PolarHBondContact O-N 2.86Å; I697-F700 PolarHBondContact O-N 3.45Å; F700-A703 PolarHBondContact O-N 3.17Å; F700-H704 AromaticContact CD1-CE1 3.99Å; F700-H704 AromaticContact CD1-ND1 3.74Å; F700-H704 AromaticContact CD2-CE1 3.73Å; F700-H704 AromaticContact CE1-CE1 3.55Å; F700-H704 AromaticContact CE1-ND1 3.59Å; F700-H704 AromaticContact CE2-CE1 3.25Å; F700-H704 WeakPolarHBondContact CE2-CE1 3.31Å; F700-H704 AromaticContact CE2-ND1 3.97Å; F700-H704 AromaticContact CE2-NE2 4Å; F700-H704 AromaticContact CZ-CE1 3.16Å; F700-H704 WeakPolarHBondContact CZ-CE1 3.39Å; F700-H704 AromaticContact CZ-ND1 3.71Å; F700-H704 AromaticContact CZ-NE2 3.61Å; F700-H704 PolarHBondContact O-N 2.84Å; F700-H704 PolarHBondContact O-ND1 3.1Å
701	F	95.5	Very high	93.7	Very high	18 Å²	18	48.4 Å²	48.4	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-48.2	176	173.6	-105.9	0	0	0	111.9	L561 L562 V567 L577 I697 A698 A703 H704 R705	L561-F701 HydrophobicContact CB-CE1 4.07Å; L562-F701 HydrophobicContact CB-CD1 3.95Å; L562-F701 HydrophobicContact CB-CE1 3.81Å; L562-F701 HydrophobicContact CB-CZ 4.29Å; L562-F701 HydrophobicContact CD1-CD1 4.29Å; L562-F701 HydrophobicContact CD1-CD2 3.9Å; L562-F701 HydrophobicContact CD1-CE1 4.26Å; L562-F701 HydrophobicContact CD1-CE2 3.87Å; L562-F701 HydrophobicContact CD1-CG 4.1Å; L562-F701 HydrophobicContact CD1-CZ 4.04Å; V567-F701 HydrophobicContact CG1-CZ 4.49Å; L577-F701 HydrophobicContact CD1-CD2 4.35Å; L577-F701 HydrophobicContact CD2-CB 3.85Å; L577-F701 HydrophobicContact CD2-CD2 4.41Å; I697-F701 WeakPolarHBondContact O-CB 3.45Å; I697-F701 PolarHBondContact O-N 3.37Å; A698-F701 PolarHBondContact O-N 3.37Å; F701-A703 VanDerWaalsContact C-N 3.33Å; F701-A703 PolarHBondContact O-N 3.24Å; F701-H704 PolarHBondContact O-N 3.47Å; F701-R705 HydrophobicContact CZ-CB 4.46Å; F701-R705 WeakPolarHBondContact O-CB 3.41Å; F701-R705 PolarHBondContact O-N 3.24Å
702	L	95.5	Very high	93.7	Very high	22 Å²	22	51.4 Å²	51.4	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-41.7	-178.2	-168.2	66.7	0	0	0	111.9	D554 A558 L561 A698 L699 H704 R705 G706 F707	D554-L702 HydrophobicContact CB-CD2 4.07Å; A558-L702 HydrophobicContact CB-CB 3.81Å; A558-L702 HydrophobicContact CB-CD1 4.23Å; A558-L702 HydrophobicContact CB-CD2 4.16Å; A558-L702 HydrophobicContact CB-CG 4.29Å; L561-L702 HydrophobicContact CD1-CD1 3.88Å; A698-L702 WeakPolarHBondContact O-CB 3.33Å; A698-L702 PolarHBondContact O-N 2.99Å; L699-L702 PolarHBondContact O-N 2.99Å; L702-H704 VanDerWaalsContact C-N 3.33Å; L702-H704 PolarHBondContact O-N 3.44Å; L702-R705 PolarHBondContact O-N 3.13Å; L702-G706 PolarHBondContact O-N 3.21Å; L702-F707 HydrophobicContact CD1-CB 3.68Å; L702-F707 HydrophobicContact CD1-CG 4.29Å; L702-F707 HydrophobicContact CG-CB 4.38Å
703	A	95.2	Very high	93.6	Very high	78 Å²	78	52.5 Å²	52.5	65%	0.645	31%	0.306	S	S	*	.	H	α-helix	trans	-61.6	-38.6	178.5	0	0	0	0	0	112.6	L699 F700 F701	L699-A703 WeakPolarHBondContact O-CB 3.49Å; L699-A703 PolarHBondContact O-N 3.47Å; F700-A703 PolarHBondContact O-N 3.17Å; F701-A703 VanDerWaalsContact C-N 3.33Å; F701-A703 PolarHBondContact O-N 3.24Å
704	H	94.2	Very high	93.5	Very high	136 Å²	136	53.1 Å²	53.1	63%	0.63	31%	0.311	S	S	*	.	H	α-helix	trans	-84.1	-32.5	-179.5	-69.7	77	0	0	0	113.3	F700 F701 L702	F700-H704 AromaticContact CD1-CE1 3.99Å; F700-H704 AromaticContact CD1-ND1 3.74Å; F700-H704 AromaticContact CD2-CE1 3.73Å; F700-H704 AromaticContact CE1-CE1 3.55Å; F700-H704 AromaticContact CE1-ND1 3.59Å; F700-H704 AromaticContact CE2-CE1 3.25Å; F700-H704 WeakPolarHBondContact CE2-CE1 3.31Å; F700-H704 AromaticContact CE2-ND1 3.97Å; F700-H704 AromaticContact CE2-NE2 4Å; F700-H704 AromaticContact CZ-CE1 3.16Å; F700-H704 WeakPolarHBondContact CZ-CE1 3.39Å; F700-H704 AromaticContact CZ-ND1 3.71Å; F700-H704 AromaticContact CZ-NE2 3.61Å; F700-H704 PolarHBondContact O-N 2.84Å; F700-H704 PolarHBondContact O-ND1 3.1Å; F701-H704 PolarHBondContact O-N 3.47Å; L702-H704 VanDerWaalsContact C-N 3.33Å; L702-H704 PolarHBondContact O-N 3.44Å
705	R	93.1	Very high	93.4	Very high	116 Å²	116	58.5 Å²	58.5	44%	0.438	34%	0.337	S	S	.	.	H	α-helix	trans	-68.6	-39.1	174.7	-177.3	-175.1	175.8	-79.7	3.9	111.4	F701 L702	F701-R705 HydrophobicContact CZ-CB 4.46Å; F701-R705 WeakPolarHBondContact O-CB 3.41Å; F701-R705 PolarHBondContact O-N 3.24Å; L702-R705 PolarHBondContact O-N 3.13Å
706	G	94	Very high	93.3	Very high	39 Å²	39	59.5 Å²	59.5	40%	0.402	34%	0.343	S	S	.	.			trans	79.5	136.6	-167.3	0	0	0	0	0	112	L702	L702-G706 PolarHBondContact O-N 3.21Å
707	F	95.1	Very high	93.2	Very high	60 Å²	60	59.2 Å²	59.2	26%	0.263	35%	0.349	S	S	.	.			trans	-149.4	117.9	171.9	-171.5	-108.7	0	0	0	108	T557 L561 L702 S787 V790 M791	T557-F707 HydrophobicContact CG2-CD1 4.18Å; T557-F707 HydrophobicContact CG2-CE1 3.8Å; T557-F707 HydrophobicContact CG2-CE2 4.39Å; T557-F707 HydrophobicContact CG2-CZ 3.91Å; L561-F707 HydrophobicContact CD1-CD2 3.83Å; L561-F707 HydrophobicContact CD1-CE2 4.2Å; L561-F707 HydrophobicContact CD1-CG 4.37Å; L702-F707 HydrophobicContact CD1-CB 3.68Å; L702-F707 HydrophobicContact CD1-CG 4.29Å; L702-F707 HydrophobicContact CG-CB 4.38Å; F707-S787 VanDerWaalsContact CZ-CB 3.47Å; F707-V790 HydrophobicContact CE2-CB 4.23Å; F707-V790 HydrophobicContact CE2-CG1 4.12Å; F707-V790 HydrophobicContact CZ-CB 4.29Å; F707-V790 HydrophobicContact CZ-CG1 4.26Å; F707-M791 HydrophobicContact CE1-CG 3.79Å; F707-M791 HydrophobicContact CE1-SD 3.9Å; F707-M791 HydrophobicContact CZ-CG 3.81Å; F707-M791 HydrophobicContact CZ-SD 4.31Å
708	S	94.5	Very high	93.1	Very high	94 Å²	94	63.7 Å²	63.7	66%	0.657	38%	0.38	S	S	*	.			trans	-143.3	141.9	-171.8	-175.4	0	0	0	0	109.8	S787	S708-S787 PolarHBondContact O-OG 3.29Å
709	I	93.7	Very high	92.9	Very high	105 Å²	105	68.9 Å²	68.9	54%	0.538	41%	0.408	S	S	.	.			trans	-99.8	140	170.7	-174.8	169.1	0	0	0	109.7	E713 P788	I709-E713 VanDerWaalsContact CA-OE2 3.31Å; I709-E713 WeakPolarHBondContact CA-OE2 3.3Å; I709-E713 WeakPolarHBondContact CG1-OE2 3.48Å; I709-P788 HydrophobicContact CD1-CG 3.74Å; I709-P788 HydrophobicContact CG1-CG 4.23Å
710	G	93	Very high	92.8	Very high	40 Å²	40	66.5 Å²	66.5	41%	0.412	40%	0.396	S	S	.	.			trans	-140	168.6	177.4	0	0	0	0	0	112	G712 E713	G710-G712 PolarHBondContact O-N 3.1Å; G710-E713 PolarHBondContact O-N 2.87Å; G710-E713 VanDerWaalsContact O-N 3.15Å
711	L	92.6	Very high	92.6	Very high	126 Å²	126	67.3 Å²	67.3	66%	0.66	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-60.1	-34.4	-179.4	-174.2	64.3	0	0	0	112.5	E713 V714 M715 Y850	L711-E713 PolarHBondContact O-N 2.73Å; L711-V714 HydrophobicContact CD1-CG2 4.05Å; L711-V714 WeakPolarHBondContact O-CG2 3.46Å; L711-V714 PolarHBondContact O-N 2.88Å; L711-V714 VanDerWaalsContact O-N 3.16Å; L711-M715 PolarHBondContact O-N 2.82Å; L711-Y850 HydrophobicContact CD1-CD2 3.99Å; L711-Y850 HydrophobicContact CD1-CE2 3.86Å; L711-Y850 HydrophobicContact CG-CE2 4.12Å
712	G	91.4	Very high	92.4	Very high	64 Å²	64	69.4 Å²	69.4	66%	0.66	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-62.8	-23.5	178.7	0	0	0	0	0	114.3	G710 V714	G710-G712 PolarHBondContact O-N 3.1Å; G712-V714 VanDerWaalsContact C-N 3.32Å
713	E	90.8	Very high	92.1	Very high	39 Å²	39	70.6 Å²	70.6	18%	0.182	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-78.5	-18	178.3	-63.6	-172.4	139.3	0	0	113.4	I709 G710 L711 N786 S787 P788	I709-E713 VanDerWaalsContact CA-OE2 3.31Å; I709-E713 WeakPolarHBondContact CA-OE2 3.3Å; I709-E713 WeakPolarHBondContact CG1-OE2 3.48Å; G710-E713 PolarHBondContact O-N 2.87Å; G710-E713 VanDerWaalsContact O-N 3.15Å; L711-E713 PolarHBondContact O-N 2.73Å; E713-N786 PolarHBondContact O-ND2 3.21Å; E713-S787 VanDerWaalsContact OE1-CB 3.27Å; E713-S787 WeakPolarHBondContact OE1-CB 3.36Å; E713-S787 PolarHBondContact OE1-N 2.91Å; E713-S787 PolarHBondContact OE1-OG 3.36Å; E713-S787 VanDerWaalsContact OE2-CB 3.23Å; E713-S787 WeakPolarHBondContact OE2-CB 3.29Å; E713-S787 PolarHBondContact OE2-OG 2.81Å; E713-P788 HydrophobicContact CB-CG 4.41Å; E713-P788 WeakPolarHBondContact OE2-CD 3.29Å
714	V	91.2	Very high	91.9	Very high	20 Å²	20	68 Å²	68	12%	0.121	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-107.5	5.7	177.2	-65	0	0	0	0	112.8	L711 G712 P788 M806 I807 Y850	L711-V714 HydrophobicContact CD1-CG2 4.05Å; L711-V714 WeakPolarHBondContact O-CG2 3.46Å; L711-V714 PolarHBondContact O-N 2.88Å; L711-V714 VanDerWaalsContact O-N 3.16Å; G712-V714 VanDerWaalsContact C-N 3.32Å; V714-P788 HydrophobicContact CG1-CG 4.44Å; V714-M806 HydrophobicContact CG1-CB 4.5Å; V714-I807 HydrophobicContact CB-CG1 4.13Å; V714-I807 HydrophobicContact CG1-CG1 4.41Å; V714-Y850 HydrophobicContact CG2-CD2 4.19Å
715	M	91.4	Very high	91.7	Very high	115 Å²	115	65.1 Å²	65.1	57%	0.567	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-75.5	122.2	177.2	-177.2	171.9	-178	0	0	110.2	L711 Y850	L711-M715 PolarHBondContact O-N 2.82Å; M715-Y850 HydrophobicContact CB-CE2 4.03Å; M715-Y850 HydrophobicContact CG-CE1 4.44Å; M715-Y850 HydrophobicContact CG-CE2 4.3Å; M715-Y850 WeakPolarHBondContact CG-OH 3.48Å
716	P	90.7	Very high	91.7	Very high	23 Å²	23	62 Å²	62	15%	0.149	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-71.6	143	175.3	30.8	-33.8	0	0	0	110.5	L720 V721 I807 Y850	P716-L720 HydrophobicContact CB-CD2 4.01Å; P716-V721 HydrophobicContact CB-CG2 3.96Å; P716-V721 HydrophobicContact CG-CG2 3.97Å; P716-I807 HydrophobicContact CB-CG2 3.93Å; P716-Y850 VanDerWaalsContact CD-CE1 3.46Å; P716-Y850 HydrophobicContact CG-CD1 3.89Å; P716-Y850 HydrophobicContact CG-CE1 4.13Å
717	S	90.5	Very high	91.6	Very high	46 Å²	46	61.1 Å²	61.1	32%	0.322	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-69.9	159.6	170.6	76.3	0	0	0	0	110.7	D719 L720 V721 Q781	S717-D719 PolarHBondContact O-N 2.65Å; S717-D719 PolarHBondContact OG-N 3.48Å; S717-L720 PolarHBondContact O-N 3.04Å; S717-L720 WeakPolarHBondContact OG-CB 3.5Å; S717-L720 PolarHBondContact OG-N 2.67Å; S717-V721 WeakPolarHBondContact O-CG2 3.28Å; S717-V721 PolarHBondContact O-N 3.06Å; S717-V721 VanDerWaalsContact O-N 3.07Å; S717-Q781 PolarHBondContact OG-OE1 3.02Å
718	S	90.1	Very high	91.4	Very high	93 Å²	93	59.3 Å²	59.3	65%	0.65	38%	0.38	S	S	*	.	H	α-helix	trans	-54.5	-38.8	171.8	49.3	0	0	0	0	112.2	V721 A722	S718-V721 PolarHBondContact O-N 3.31Å; S718-A722 WeakPolarHBondContact O-CB 3.5Å; S718-A722 PolarHBondContact O-N 3.11Å
719	D	90.7	Very high	91.4	Very high	109 Å²	109	58.3 Å²	58.3	58%	0.583	37%	0.373	S	S	*	.	H	α-helix	trans	-69.8	-38.8	-177.7	-61.5	-8.8	0	0	0	111.4	S717 S723	S717-D719 PolarHBondContact O-N 2.65Å; S717-D719 PolarHBondContact OG-N 3.48Å; D719-S723 VanDerWaalsContact O-CB 3.22Å; D719-S723 WeakPolarHBondContact O-CB 3.49Å; D719-S723 PolarHBondContact O-N 3.01Å
720	L	90.2	Very high	91.4	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.021	37%	0.374	C	S	.	.	H	α-helix	trans	-64.8	-42.9	174.2	-175.6	58.4	0	0	0	110.9	P716 S717 S723 K724 A777 C778 I807	P716-L720 HydrophobicContact CB-CD2 4.01Å; S717-L720 PolarHBondContact O-N 3.04Å; S717-L720 WeakPolarHBondContact OG-CB 3.5Å; S717-L720 PolarHBondContact OG-N 2.67Å; L720-S723 PolarHBondContact O-N 2.86Å; L720-K724 WeakPolarHBondContact O-CB 3.49Å; L720-K724 PolarHBondContact O-N 2.84Å; L720-A777 HydrophobicContact CD1-CB 3.98Å; L720-C778 HydrophobicContact CD1-CB 4.11Å; L720-C778 HydrophobicContact CD2-CB 3.91Å; L720-I807 HydrophobicContact CD2-CG2 3.69Å
721	V	90.8	Very high	91.4	Very high	66 Å²	66	58.9 Å²	58.9	40%	0.4	36%	0.357	S	S	.	.	H	α-helix	trans	-62.1	-47.3	177.9	175.4	0	0	0	0	110.3	P716 S717 S718 K724 T725	P716-V721 HydrophobicContact CB-CG2 3.96Å; P716-V721 HydrophobicContact CG-CG2 3.97Å; S717-V721 WeakPolarHBondContact O-CG2 3.28Å; S717-V721 PolarHBondContact O-N 3.06Å; S717-V721 VanDerWaalsContact O-N 3.07Å; S718-V721 PolarHBondContact O-N 3.31Å; V721-K724 PolarHBondContact O-N 3.29Å; V721-T725 PolarHBondContact O-N 3.29Å; V721-T725 PolarHBondContact O-OG1 3.46Å
722	A	91	Very high	91.5	Very high	63 Å²	63	54.4 Å²	54.4	52%	0.521	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-46.3	177.3	0	0	0	0	0	112	S718 T725 A726	S718-A722 WeakPolarHBondContact O-CB 3.5Å; S718-A722 PolarHBondContact O-N 3.11Å; A722-T725 PolarHBondContact O-N 3.28Å; A722-A726 PolarHBondContact O-N 3.08Å
723	S	89.5	Confident	91.6	Very high	46 Å²	46	54.2 Å²	54.2	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-63	-43	178	-179	0	0	0	0	112	D719 L720 A726 L727	D719-S723 VanDerWaalsContact O-CB 3.22Å; D719-S723 WeakPolarHBondContact O-CB 3.49Å; D719-S723 PolarHBondContact O-N 3.01Å; L720-S723 PolarHBondContact O-N 2.86Å; S723-A726 PolarHBondContact O-N 3.08Å; S723-L727 WeakPolarHBondContact O-CB 3.14Å; S723-L727 VanDerWaalsContact O-CG 3.27Å; S723-L727 WeakPolarHBondContact O-CG 3.17Å; S723-L727 PolarHBondContact O-N 3.24Å
724	K	91	Very high	91.8	Very high	24 Å²	24	54.6 Å²	54.6	10%	0.104	33%	0.33	C	S	.	.	H	α-helix	trans	-58.9	-51.4	175.6	171.9	-166.4	169.9	172	0	111.1	L720 V721 A726 L727 I728 A808 G846	L720-K724 WeakPolarHBondContact O-CB 3.49Å; L720-K724 PolarHBondContact O-N 2.84Å; V721-K724 PolarHBondContact O-N 3.29Å; K724-A726 VanDerWaalsContact C-N 3.3Å; K724-A726 PolarHBondContact O-N 3.37Å; K724-L727 PolarHBondContact O-N 3.04Å; K724-L727 VanDerWaalsContact O-N 3.15Å; K724-I728 HydrophobicContact CD-CD1 4.42Å; K724-I728 HydrophobicContact CG-CD1 3.81Å; K724-I728 HydrophobicContact CG-CG1 4.45Å; K724-I728 WeakPolarHBondContact O-CG1 3.27Å; K724-I728 PolarHBondContact O-N 3.36Å; K724-A808 VanDerWaalsContact CD-O 3.25Å; K724-A808 WeakPolarHBondContact CD-O 3.05Å; K724-A808 WeakPolarHBondContact CE-O 3.4Å; K724-A808 PolarHBondContact NZ-O 3.19Å; K724-G846 WeakPolarHBondContact CE-O 3.48Å; K724-G846 PolarHBondContact NZ-O 2.94Å
725	T	90.4	Very high	91.9	Very high	76 Å²	76	53.6 Å²	53.6	47%	0.466	32%	0.324	S	S	.	.	H	α-helix	trans	-59.6	-44.4	-178.7	-56.5	0	0	0	0	110.6	V721 A722 L727 I728 S729	V721-T725 PolarHBondContact O-N 3.29Å; V721-T725 PolarHBondContact O-OG1 3.46Å; A722-T725 PolarHBondContact O-N 3.28Å; T725-L727 PolarHBondContact O-N 2.5Å; T725-I728 PolarHBondContact O-N 3.48Å; T725-S729 WeakPolarHBondContact O-CB 3.23Å; T725-S729 PolarHBondContact O-N 3.43Å; T725-S729 PolarHBondContact O-OG 3.23Å; T725-S729 VanDerWaalsContact O-OG 3.07Å
726	A	92.9	Very high	92.1	Very high	51 Å²	51	51.2 Å²	51.2	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-62.1	-39.2	176	0	0	0	0	0	113.3	A722 S723 K724 R730	A722-A726 PolarHBondContact O-N 3.08Å; S723-A726 PolarHBondContact O-N 3.08Å; K724-A726 VanDerWaalsContact C-N 3.3Å; K724-A726 PolarHBondContact O-N 3.37Å; A726-R730 WeakPolarHBondContact O-CB 3.38Å; A726-R730 PolarHBondContact O-N 3.49Å; A726-R730 VanDerWaalsContact O-N 3.1Å
727	L	92.3	Very high	92.2	Very high	19 Å²	19	53.9 Å²	53.9	10%	0.099	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-46.2	176.8	-74.6	173.3	0	0	0	112.1	S723 K724 T725 R730 G731 E773 A774	S723-L727 WeakPolarHBondContact O-CB 3.14Å; S723-L727 VanDerWaalsContact O-CG 3.27Å; S723-L727 WeakPolarHBondContact O-CG 3.17Å; S723-L727 PolarHBondContact O-N 3.24Å; K724-L727 PolarHBondContact O-N 3.04Å; K724-L727 VanDerWaalsContact O-N 3.15Å; T725-L727 PolarHBondContact O-N 2.5Å; L727-R730 PolarHBondContact O-N 3.28Å; L727-G731 PolarHBondContact O-N 3.09Å; L727-E773 HydrophobicContact CD1-CB 4.16Å; L727-E773 VanDerWaalsContact CD2-OE2 3.27Å; L727-E773 WeakPolarHBondContact CD2-OE2 3.21Å; L727-A774 HydrophobicContact CD1-CB 4.48Å
728	I	91.9	Very high	92.4	Very high	22 Å²	22	54.1 Å²	54.1	11%	0.113	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-48.5	179	-67.3	173.8	0	0	0	110.1	K724 T725 R730 G731 F732 I770	K724-I728 HydrophobicContact CD-CD1 4.42Å; K724-I728 HydrophobicContact CG-CD1 3.81Å; K724-I728 HydrophobicContact CG-CG1 4.45Å; K724-I728 WeakPolarHBondContact O-CG1 3.27Å; K724-I728 PolarHBondContact O-N 3.36Å; T725-I728 PolarHBondContact O-N 3.48Å; I728-R730 VanDerWaalsContact C-N 3.31Å; I728-R730 PolarHBondContact O-N 3.3Å; I728-G731 PolarHBondContact O-N 3.41Å; I728-F732 HydrophobicContact CG2-CD1 4.14Å; I728-F732 HydrophobicContact CG2-CD2 4.11Å; I728-F732 HydrophobicContact CG2-CE1 3.88Å; I728-F732 HydrophobicContact CG2-CE2 3.84Å; I728-F732 HydrophobicContact CG2-CG 4.26Å; I728-F732 HydrophobicContact CG2-CZ 3.72Å; I728-F732 WeakPolarHBondContact O-CB 3.44Å; I728-F732 WeakPolarHBondContact O-CG 3.33Å; I728-F732 PolarHBondContact O-N 3.02Å; I728-I770 HydrophobicContact CG1-CG2 4.02Å
729	S	92.9	Very high	92.6	Very high	73 Å²	73	50.4 Å²	50.4	51%	0.51	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-40.4	178.9	-61.2	0	0	0	0	112.3	T725 A733	T725-S729 WeakPolarHBondContact O-CB 3.23Å; T725-S729 PolarHBondContact O-N 3.43Å; T725-S729 PolarHBondContact O-OG 3.23Å; T725-S729 VanDerWaalsContact O-OG 3.07Å; S729-A733 WeakPolarHBondContact O-CB 3.39Å; S729-A733 PolarHBondContact O-N 2.89Å
730	R	94.3	Very high	92.7	Very high	152 Å²	152	48.8 Å²	48.8	57%	0.574	29%	0.285	S	S	*	.	H	α-helix	trans	-65.6	-46.4	176.3	-170.9	-171.6	-54.8	139.3	5	112	A726 L727 I728 F732 A733 T734	A726-R730 WeakPolarHBondContact O-CB 3.38Å; A726-R730 PolarHBondContact O-N 3.49Å; A726-R730 VanDerWaalsContact O-N 3.1Å; L727-R730 PolarHBondContact O-N 3.28Å; I728-R730 VanDerWaalsContact C-N 3.31Å; I728-R730 PolarHBondContact O-N 3.3Å; R730-F732 VanDerWaalsContact C-N 3.35Å; R730-A733 PolarHBondContact O-N 3.13Å; R730-T734 PolarHBondContact O-N 3.42Å; R730-T734 VanDerWaalsContact O-N 3.09Å; R730-T734 PolarHBondContact O-OG1 2.97Å; R730-T734 VanDerWaalsContact O-OG1 3.04Å
731	G	92.5	Very high	92.8	Very high	6 Å²	6	51.1 Å²	51.1	6%	0.062	30%	0.296	C	S	.	.	H	α-helix	trans	-66.1	-36.9	179.9	0	0	0	0	0	112.7	L727 I728 T734 C735	L727-G731 PolarHBondContact O-N 3.09Å; I728-G731 PolarHBondContact O-N 3.41Å; G731-T734 PolarHBondContact O-N 2.87Å; G731-C735 PolarHBondContact O-N 2.99Å; G731-C735 PolarHBondContact O-SG 2.65Å
732	F	94.5	Very high	92.8	Very high	32 Å²	32	50.7 Å²	50.7	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-44.6	173.3	-77	10.8	0	0	0	111.5	I728 R730 T734 C735 D736 L767 P839 E840 F844	I728-F732 HydrophobicContact CG2-CD1 4.14Å; I728-F732 HydrophobicContact CG2-CD2 4.11Å; I728-F732 HydrophobicContact CG2-CE1 3.88Å; I728-F732 HydrophobicContact CG2-CE2 3.84Å; I728-F732 HydrophobicContact CG2-CG 4.26Å; I728-F732 HydrophobicContact CG2-CZ 3.72Å; I728-F732 WeakPolarHBondContact O-CB 3.44Å; I728-F732 WeakPolarHBondContact O-CG 3.33Å; I728-F732 PolarHBondContact O-N 3.02Å; R730-F732 VanDerWaalsContact C-N 3.35Å; F732-T734 PolarHBondContact O-N 3.05Å; F732-C735 CarbonylContact O-C 3.55Å; F732-C735 WeakPolarHBondContact O-CA 3.42Å; F732-C735 WeakPolarHBondContact O-CB 3.23Å; F732-C735 PolarHBondContact O-N 3.32Å; F732-D736 VanDerWaalsContact O-CG 3.3Å; F732-D736 PolarHBondContact O-N 3.03Å; F732-L767 HydrophobicContact CE1-CD2 4.27Å; F732-P839 HydrophobicContact CD1-CB 4.03Å; F732-P839 HydrophobicContact CD1-CG 3.83Å; F732-P839 HydrophobicContact CE1-CB 3.57Å; F732-P839 HydrophobicContact CE1-CG 3.92Å; F732-P839 HydrophobicContact CG-CG 4.44Å; F732-P839 HydrophobicContact CZ-CB 4.02Å; F732-E840 HydrophobicContact CE2-CG 3.7Å; F732-E840 HydrophobicContact CZ-CG 3.9Å; F732-F844 AromaticContact CE1-CD1 3.57Å; F732-F844 HydrophobicContact CE1-CD1 3.57Å; F732-F844 AromaticContact CE1-CE1 3.67Å; F732-F844 HydrophobicContact CE1-CE1 3.67Å; F732-F844 HydrophobicContact CE1-CG 4.3Å; F732-F844 HydrophobicContact CE1-CZ 4.48Å; F732-F844 AromaticContact CZ-CD1 3.58Å; F732-F844 HydrophobicContact CZ-CD1 3.58Å; F732-F844 AromaticContact CZ-CE1 3.86Å; F732-F844 HydrophobicContact CZ-CE1 3.86Å
733	A	94.9	Very high	92.7	Very high	60 Å²	60	54.1 Å²	54.1	50%	0.496	29%	0.292	S	S	.	.	H	α-helix	trans	-59	-36.2	175.3	0	0	0	0	0	112.7	S729 R730 D737	S729-A733 WeakPolarHBondContact O-CB 3.39Å; S729-A733 PolarHBondContact O-N 2.89Å; R730-A733 PolarHBondContact O-N 3.13Å; A733-D737 PolarHBondContact O-N 2.96Å
734	T	94.6	Very high	92.8	Very high	46 Å²	46	58.9 Å²	58.9	28%	0.282	31%	0.311	S	S	.	.	H	α-helix	trans	-69.9	-39.4	174.6	-51.3	0	0	0	0	111.7	R730 G731 F732 D737 Y738 E766	R730-T734 PolarHBondContact O-N 3.42Å; R730-T734 VanDerWaalsContact O-N 3.09Å; R730-T734 PolarHBondContact O-OG1 2.97Å; R730-T734 VanDerWaalsContact O-OG1 3.04Å; G731-T734 PolarHBondContact O-N 2.87Å; F732-T734 PolarHBondContact O-N 3.05Å; T734-D737 PolarHBondContact O-N 3.42Å; T734-Y738 HydrophobicContact CG2-CE2 3.93Å; T734-Y738 WeakPolarHBondContact O-CD2 3.35Å; T734-Y738 PolarHBondContact O-N 3.3Å; T734-Y738 VanDerWaalsContact O-N 3.12Å; T734-E766 HydrophobicContact CG2-CG 4.37Å
735	C	93.9	Very high	92.6	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.1	-41.2	174.5	-67.2	0	0	0	0	111.8	G731 F732 D737 Y738 I739 I763 P839	G731-C735 PolarHBondContact O-N 2.99Å; G731-C735 PolarHBondContact O-SG 2.65Å; F732-C735 CarbonylContact O-C 3.55Å; F732-C735 WeakPolarHBondContact O-CA 3.42Å; F732-C735 WeakPolarHBondContact O-CB 3.23Å; F732-C735 PolarHBondContact O-N 3.32Å; C735-D737 VanDerWaalsContact C-N 3.32Å; C735-Y738 PolarHBondContact O-N 2.66Å; C735-I739 VanDerWaalsContact O-CG1 3.28Å; C735-I739 WeakPolarHBondContact O-CG1 3.34Å; C735-I739 PolarHBondContact O-N 3.15Å; C735-I763 HydrophobicContact CB-CG1 4.46Å; C735-P839 HydrophobicContact CB-CG 3.89Å
736	D	94	Very high	92.6	Very high	65 Å²	65	64 Å²	64	35%	0.348	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-37	176.9	-67.6	-27.6	0	0	0	111.2	F732 I739 N740	F732-D736 VanDerWaalsContact O-CG 3.3Å; F732-D736 PolarHBondContact O-N 3.03Å; D736-I739 PolarHBondContact O-N 3.11Å; D736-N740 WeakPolarHBondContact O-CB 3.17Å; D736-N740 PolarHBondContact O-N 3.12Å; D736-N740 PolarHBondContact O-ND2 2.95Å
737	D	94.4	Very high	92.4	Very high	79 Å²	79	62 Å²	62	42%	0.422	32%	0.323	S	S	.	.	H	α-helix	trans	-61.1	-45.4	171.8	-173.2	50.4	0	0	0	111.9	A733 T734 C735 I739 N740 Q741	A733-D737 PolarHBondContact O-N 2.96Å; T734-D737 PolarHBondContact O-N 3.42Å; C735-D737 VanDerWaalsContact C-N 3.32Å; D737-I739 VanDerWaalsContact C-N 3.31Å; D737-I739 PolarHBondContact O-N 3.32Å; D737-N740 PolarHBondContact O-N 3.08Å; D737-Q741 VanDerWaalsContact O-CG 3.32Å; D737-Q741 WeakPolarHBondContact O-CG 3.43Å; D737-Q741 PolarHBondContact O-N 2.83Å; D737-Q741 PolarHBondContact OD2-NE2 3.08Å
738	Y	94	Very high	92	Very high	51 Å²	51	67 Å²	67	20%	0.2	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-38.2	173.8	-64.6	-38.9	0	0	0	112.9	T734 C735 Q741 Y742 L747 L759 N762 E766	T734-Y738 HydrophobicContact CG2-CE2 3.93Å; T734-Y738 WeakPolarHBondContact O-CD2 3.35Å; T734-Y738 PolarHBondContact O-N 3.3Å; T734-Y738 VanDerWaalsContact O-N 3.12Å; C735-Y738 PolarHBondContact O-N 2.66Å; Y738-Q741 PolarHBondContact O-N 3.49Å; Y738-Y742 WeakPolarHBondContact O-CB 3.32Å; Y738-Y742 PolarHBondContact O-N 3.09Å; Y738-L747 HydrophobicContact CD1-CD1 4.42Å; Y738-L759 WeakPolarHBondContact O-CD1 3.44Å; Y738-N762 HydrophobicContact CD2-CB 4.04Å; Y738-N762 HydrophobicContact CE2-CB 3.99Å; Y738-E766 HydrophobicContact CE2-CG 3.89Å
739	I	93.1	Very high	91.3	Very high	14 Å²	14	68.6 Å²	68.6	7%	0.072	37%	0.366	C	S	.	.	H	α-helix	trans	-65	-41.8	175.8	-67.6	164.9	0	0	0	110.3	C735 D736 D737 Y742 Q743 L759 I763 R837 T838	C735-I739 VanDerWaalsContact O-CG1 3.28Å; C735-I739 WeakPolarHBondContact O-CG1 3.34Å; C735-I739 PolarHBondContact O-N 3.15Å; D736-I739 PolarHBondContact O-N 3.11Å; D737-I739 VanDerWaalsContact C-N 3.31Å; D737-I739 PolarHBondContact O-N 3.32Å; I739-Y742 WeakPolarHBondContact O-CB 3.26Å; I739-Y742 PolarHBondContact O-N 2.98Å; I739-Q743 WeakPolarHBondContact O-CG 3.22Å; I739-Q743 PolarHBondContact O-N 2.67Å; I739-L759 HydrophobicContact CG1-CD1 4.32Å; I739-I763 HydrophobicContact CD1-CD1 4.35Å; I739-I763 HydrophobicContact CG1-CD1 4.08Å; I739-R837 HydrophobicContact CD1-CB 4.35Å; I739-R837 HydrophobicContact CG1-CB 4.45Å; I739-T838 HydrophobicContact CD1-CG2 4.41Å
740	N	93.2	Very high	90.4	Very high	75 Å²	75	67.9 Å²	67.9	40%	0.401	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-43.8	176.6	-70	-29	0	0	0	111.5	D736 D737 Y742 Q743 M744	D736-N740 WeakPolarHBondContact O-CB 3.17Å; D736-N740 PolarHBondContact O-N 3.12Å; D736-N740 PolarHBondContact O-ND2 2.95Å; D737-N740 PolarHBondContact O-N 3.08Å; N740-Y742 VanDerWaalsContact C-N 3.29Å; N740-Y742 PolarHBondContact O-N 3.18Å; N740-Q743 PolarHBondContact O-N 2.94Å; N740-M744 WeakPolarHBondContact O-CB 3.42Å; N740-M744 WeakPolarHBondContact O-CG 3.46Å; N740-M744 PolarHBondContact O-N 3.32Å
741	Q	92.3	Very high	89.2	Confident	54 Å²	54	65.2 Å²	65.2	25%	0.252	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-38.5	174.6	-69.9	175.2	27.6	0	0	111.9	D737 Y738 M744 N745 T746 L747	D737-Q741 VanDerWaalsContact O-CG 3.32Å; D737-Q741 WeakPolarHBondContact O-CG 3.43Å; D737-Q741 PolarHBondContact O-N 2.83Å; D737-Q741 PolarHBondContact OD2-NE2 3.08Å; Y738-Q741 PolarHBondContact O-N 3.49Å; Q741-M744 PolarHBondContact O-N 3.37Å; Q741-N745 PolarHBondContact O-N 3.45Å; Q741-N745 VanDerWaalsContact O-N 3.12Å; Q741-T746 WeakPolarHBondContact CA-OG1 3.07Å; Q741-T746 PolarHBondContact O-N 2.9Å; Q741-T746 PolarHBondContact O-OG1 3.48Å; Q741-L747 HydrophobicContact CB-CB 4.15Å; Q741-L747 HydrophobicContact CB-CD1 4.3Å; Q741-L747 PolarHBondContact O-N 3.2Å
742	Y	91	Very high	88	Confident	57 Å²	57	67 Å²	67	22%	0.224	38%	0.378	C	S	.	.	H	α-helix	trans	-65.4	-45	173.8	173	-99.6	0	0	0	111.7	Y738 I739 N740 M744 N745 M755 E756 L759	Y738-Y742 WeakPolarHBondContact O-CB 3.32Å; Y738-Y742 PolarHBondContact O-N 3.09Å; I739-Y742 WeakPolarHBondContact O-CB 3.26Å; I739-Y742 PolarHBondContact O-N 2.98Å; N740-Y742 VanDerWaalsContact C-N 3.29Å; N740-Y742 PolarHBondContact O-N 3.18Å; Y742-M744 VanDerWaalsContact C-N 3.31Å; Y742-M744 PolarHBondContact O-N 3.38Å; Y742-N745 PolarHBondContact O-N 3.45Å; Y742-M755 HydrophobicContact CD2-CB 4.3Å; Y742-M755 HydrophobicContact CD2-CG 4.25Å; Y742-M755 HydrophobicContact CD2-SD 4.35Å; Y742-M755 HydrophobicContact CE2-CB 4.21Å; Y742-E756 HydrophobicContact CE2-CB 4.23Å; Y742-L759 HydrophobicContact CD1-CD2 3.88Å; Y742-L759 HydrophobicContact CD2-CB 4.45Å; Y742-L759 HydrophobicContact CD2-CD2 4.15Å; Y742-L759 HydrophobicContact CE1-CD2 4.43Å; Y742-L759 HydrophobicContact CG-CD2 3.71Å
743	Q	89.7	Confident	86.8	Confident	135 Å²	135	66.2 Å²	66.2	63%	0.631	38%	0.376	S	S	*	.	H	α-helix	trans	-63.2	-36	176.8	-72.2	176.4	2.7	0	0	112.6	I739 N740 N745	I739-Q743 WeakPolarHBondContact O-CG 3.22Å; I739-Q743 PolarHBondContact O-N 2.67Å; N740-Q743 PolarHBondContact O-N 2.94Å; Q743-N745 VanDerWaalsContact C-N 3.25Å; Q743-N745 PolarHBondContact O-N 3.41Å
744	M	91.1	Very high	86.2	Confident	145 Å²	145	65.9 Å²	65.9	71%	0.714	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-0.7	174.5	-66.2	-167.7	-176.3	0	0	113.7	N740 Q741 Y742 T746	N740-M744 WeakPolarHBondContact O-CB 3.42Å; N740-M744 WeakPolarHBondContact O-CG 3.46Å; N740-M744 PolarHBondContact O-N 3.32Å; Q741-M744 PolarHBondContact O-N 3.37Å; Y742-M744 VanDerWaalsContact C-N 3.31Å; Y742-M744 PolarHBondContact O-N 3.38Å; M744-T746 HydrophobicContact CB-CG2 4.13Å; M744-T746 PolarHBondContact O-N 3.16Å
745	N	87.3	Confident	85.6	Confident	119 Å²	119	66.3 Å²	66.3	64%	0.636	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	27.7	-173.3	-60.8	-61.1	0	0	0	114.3	Q741 Y742 Q743 M755	Q741-N745 PolarHBondContact O-N 3.45Å; Q741-N745 VanDerWaalsContact O-N 3.12Å; Y742-N745 PolarHBondContact O-N 3.45Å; Q743-N745 VanDerWaalsContact C-N 3.25Å; Q743-N745 PolarHBondContact O-N 3.41Å; N745-M755 HydrophobicContact CB-CE 4.29Å; N745-M755 HydrophobicContact CB-SD 4.39Å
746	T	89.9	Confident	85.3	Confident	89 Å²	89	70.3 Å²	70.3	55%	0.546	39%	0.388	S	S	.	.			trans	-98	-7.2	178.2	55.1	0	0	0	0	113.2	Q741 M744 V748	Q741-T746 WeakPolarHBondContact CA-OG1 3.07Å; Q741-T746 PolarHBondContact O-N 2.9Å; Q741-T746 PolarHBondContact O-OG1 3.48Å; M744-T746 HydrophobicContact CB-CG2 4.13Å; M744-T746 PolarHBondContact O-N 3.16Å; T746-V748 PolarHBondContact O-N 3.42Å
747	L	88.1	Confident	84.7	Confident	10 Å²	10	70.5 Å²	70.5	5%	0.052	39%	0.389	C	S	.	.			trans	-64.7	122.5	179.8	-173.8	69.1	0	0	0	111.4	Y738 Q741 C749 M755 T758 L759	Y738-L747 HydrophobicContact CD1-CD1 4.42Å; Q741-L747 HydrophobicContact CB-CB 4.15Å; Q741-L747 HydrophobicContact CB-CD1 4.3Å; Q741-L747 PolarHBondContact O-N 3.2Å; L747-C749 PolarHBondContact O-N 2.9Å; L747-M755 HydrophobicContact CB-CG 4.19Å; L747-M755 HydrophobicContact CB-SD 4.47Å; L747-T758 HydrophobicContact CD2-CG2 4.32Å; L747-L759 HydrophobicContact CD2-CB 3.88Å; L747-L759 HydrophobicContact CD2-CD1 4.35Å
748	V	84.2	Confident	84.3	Confident	122 Å²	122	66.7 Å²	66.7	74%	0.739	37%	0.369	S	S	*	.			trans	-72.3	114.4	177.9	-178.7	0	0	0	0	109.5	T746 T758	T746-V748 PolarHBondContact O-N 3.42Å; V748-T758 WeakPolarHBondContact O-CG2 3.41Å
749	C	78.1	Confident	84	Confident	57 Å²	57	64.3 Å²	64.3	39%	0.385	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.2	134.9	178.2	-61	0	0	0	0	111.9	L747 M755	L747-C749 PolarHBondContact O-N 2.9Å; C749-M755 VanDerWaalsContact SG-CA 3.57Å
750	N	74.5	Confident	83.8	Confident	57 Å²	57	65.5 Å²	65.5	31%	0.305	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-63.7	151.6	167.8	-74.9	-23.3	0	0	0	110.4	G752 C753 T758	N750-G752 PolarHBondContact O-N 3.26Å; N750-C753 HydrophobicContact CB-CB 3.99Å; N750-C753 WeakPolarHBondContact O-CB 3.18Å; N750-C753 PolarHBondContact O-N 3.47Å; N750-T758 HydrophobicContact CB-CG2 4.2Å; N750-T758 PolarHBondContact N-OG1 3.44Å
751	P	67.8	Low	83.3	Confident	96 Å²	96	63.7 Å²	63.7	62%	0.623	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	118.4	-177.7	-26.1	33.7	0	0	0	112.5	C753	P751-C753 PolarHBondContact O-N 3.17Å
752	G	66.5	Low	83.1	Confident	45 Å²	45	62.4 Å²	62.4	46%	0.464	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-6.2	-179.5	0	0	0	0	0	115.5	N750 R1210	N750-G752 PolarHBondContact O-N 3.26Å; G752-R1210 VanDerWaalsContact O-CZ 3.27Å; G752-R1210 PolarHBondContact O-NH2 2.9Å
753	C	70.2	Confident	83.1	Confident	14 Å²	14	59.7 Å²	59.7	10%	0.095	34%	0.342	C	S	.	.			trans	-84.5	149.1	178.3	-58.1	0	0	0	0	110.3	N750 P751 D757 T758 S1069	N750-C753 HydrophobicContact CB-CB 3.99Å; N750-C753 WeakPolarHBondContact O-CB 3.18Å; N750-C753 PolarHBondContact O-N 3.47Å; P751-C753 PolarHBondContact O-N 3.17Å; C753-D757 HydrophobicContact CB-CB 4.1Å; C753-T758 WeakPolarHBondContact CB-OG1 3.35Å; C753-S1069 VanDerWaalsContact SG-CB 3.56Å
754	S	82	Confident	83	Confident	53 Å²	53	55.2 Å²	55.2	37%	0.371	33%	0.325	S	S	.	.			trans	-68.2	164.3	162.7	70.7	0	0	0	0	109.9	E756 D757 T758	S754-E756 PolarHBondContact O-N 3.38Å; S754-D757 WeakPolarHBondContact CB-OD2 3.44Å; S754-D757 PolarHBondContact N-OD2 2.7Å; S754-D757 PolarHBondContact O-N 3.17Å; S754-D757 PolarHBondContact OG-N 3.39Å; S754-D757 PolarHBondContact OG-OD2 3.34Å; S754-T758 WeakPolarHBondContact O-CB 3.39Å; S754-T758 PolarHBondContact O-N 3.43Å; S754-T758 PolarHBondContact O-OG1 3.3Å
755	M	83.3	Confident	82.7	Confident	55 Å²	55	54.3 Å²	54.3	27%	0.271	32%	0.32	S	S	.	.	H	α-helix	trans	-59.4	-33.4	175.1	-141.5	-171.2	-66.8	0	0	110.6	Y742 N745 L747 C749 L759	Y742-M755 HydrophobicContact CD2-CB 4.3Å; Y742-M755 HydrophobicContact CD2-CG 4.25Å; Y742-M755 HydrophobicContact CD2-SD 4.35Å; Y742-M755 HydrophobicContact CE2-CB 4.21Å; N745-M755 HydrophobicContact CB-CE 4.29Å; N745-M755 HydrophobicContact CB-SD 4.39Å; L747-M755 HydrophobicContact CB-CG 4.19Å; L747-M755 HydrophobicContact CB-SD 4.47Å; C749-M755 VanDerWaalsContact SG-CA 3.57Å; M755-L759 PolarHBondContact O-N 3.46Å; M755-L759 VanDerWaalsContact O-N 3.1Å
756	E	86.1	Confident	82.9	Confident	85 Å²	85	50.4 Å²	50.4	40%	0.397	30%	0.297	S	S	.	.	H	α-helix	trans	-70	-48.2	175.9	-177.8	170.4	-172.3	0	0	113.1	Y742 S754 T758 L759 E760 R837	Y742-E756 HydrophobicContact CE2-CB 4.23Å; S754-E756 PolarHBondContact O-N 3.38Å; E756-T758 PolarHBondContact O-N 3.12Å; E756-L759 WeakPolarHBondContact O-CB 3.42Å; E756-L759 PolarHBondContact O-N 2.93Å; E756-L759 VanDerWaalsContact O-N 3.15Å; E756-E760 PolarHBondContact O-N 3.44Å; E756-R837 VanDerWaalsContact CD-NH1 3.34Å; E756-R837 VanDerWaalsContact CG-NH1 3.25Å; E756-R837 IonicContact OE1-CZ 3.73Å; E756-R837 IonicContact OE1-NH1 3.72Å; E756-R837 PolarHBondContact OE1-NH1 2.88Å; E756-R837 IonicContact OE1-NH2 3.1Å; E756-R837 PolarHBondContact OE1-NH2 2.9Å; E756-R837 IonicContact OE2-NH2 3.9Å
757	D	81.9	Confident	83	Confident	68 Å²	68	46.2 Å²	46.2	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-35.6	178	-60.8	-48.8	0	0	0	111.1	C753 S754 E760 S761	C753-D757 HydrophobicContact CB-CB 4.1Å; S754-D757 WeakPolarHBondContact CB-OD2 3.44Å; S754-D757 PolarHBondContact N-OD2 2.7Å; S754-D757 PolarHBondContact O-N 3.17Å; S754-D757 PolarHBondContact OG-N 3.39Å; S754-D757 PolarHBondContact OG-OD2 3.34Å; D757-E760 PolarHBondContact O-N 2.88Å; D757-S761 WeakPolarHBondContact O-CB 3.47Å; D757-S761 PolarHBondContact O-N 2.98Å
758	T	85.4	Confident	82.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-45.5	175.8	-55.4	0	0	0	0	111	L747 V748 N750 C753 S754 E756 S761 N762	L747-T758 HydrophobicContact CD2-CG2 4.32Å; V748-T758 WeakPolarHBondContact O-CG2 3.41Å; N750-T758 HydrophobicContact CB-CG2 4.2Å; N750-T758 PolarHBondContact N-OG1 3.44Å; C753-T758 WeakPolarHBondContact CB-OG1 3.35Å; S754-T758 WeakPolarHBondContact O-CB 3.39Å; S754-T758 PolarHBondContact O-N 3.43Å; S754-T758 PolarHBondContact O-OG1 3.3Å; E756-T758 PolarHBondContact O-N 3.12Å; T758-S761 PolarHBondContact O-N 2.95Å; T758-N762 WeakPolarHBondContact O-CB 3.34Å; T758-N762 VanDerWaalsContact O-CG 3.25Å; T758-N762 PolarHBondContact O-N 3.08Å; T758-N762 PolarHBondContact O-OD1 2.96Å
759	L	89.3	Confident	83.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-49.9	175.6	178.6	66.2	0	0	0	111.3	Y738 I739 Y742 L747 M755 E756 S761 N762 I763	Y738-L759 WeakPolarHBondContact O-CD1 3.44Å; I739-L759 HydrophobicContact CG1-CD1 4.32Å; Y742-L759 HydrophobicContact CD1-CD2 3.88Å; Y742-L759 HydrophobicContact CD2-CB 4.45Å; Y742-L759 HydrophobicContact CD2-CD2 4.15Å; Y742-L759 HydrophobicContact CE1-CD2 4.43Å; Y742-L759 HydrophobicContact CG-CD2 3.71Å; L747-L759 HydrophobicContact CD2-CB 3.88Å; L747-L759 HydrophobicContact CD2-CD1 4.35Å; M755-L759 PolarHBondContact O-N 3.46Å; M755-L759 VanDerWaalsContact O-N 3.1Å; E756-L759 WeakPolarHBondContact O-CB 3.42Å; E756-L759 PolarHBondContact O-N 2.93Å; E756-L759 VanDerWaalsContact O-N 3.15Å; L759-S761 VanDerWaalsContact C-N 3.31Å; L759-S761 PolarHBondContact O-N 3.43Å; L759-N762 PolarHBondContact O-N 3.27Å; L759-I763 HydrophobicContact CD1-CD1 3.73Å; L759-I763 HydrophobicContact CD1-CG1 4.15Å; L759-I763 HydrophobicContact CD2-CD1 4.47Å; L759-I763 HydrophobicContact CG-CD1 3.79Å; L759-I763 HydrophobicContact CG-CG1 4.49Å; L759-I763 WeakPolarHBondContact O-CB 3.49Å; L759-I763 VanDerWaalsContact O-CG1 3.32Å; L759-I763 WeakPolarHBondContact O-CG1 3.48Å; L759-I763 PolarHBondContact O-N 3.45Å
760	E	87.2	Confident	83.8	Confident	40 Å²	40	44.5 Å²	44.5	19%	0.187	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-38.1	-179.5	-71.5	-65.1	146.4	0	0	112.3	E756 D757 S764 R819 R837	E756-E760 PolarHBondContact O-N 3.44Å; D757-E760 PolarHBondContact O-N 2.88Å; E760-S764 VanDerWaalsContact O-CB 3.26Å; E760-S764 WeakPolarHBondContact O-CB 3.31Å; E760-S764 PolarHBondContact O-N 3.23Å; E760-S764 PolarHBondContact O-OG 3.43Å; E760-R819 IonicContact OE1-CZ 3.55Å; E760-R819 IonicContact OE1-NE 3.55Å; E760-R819 IonicContact OE1-NH2 3.49Å; E760-R819 PolarHBondContact OE1-NH2 3.07Å; E760-R819 IonicContact OE2-CZ 2.86Å; E760-R819 IonicContact OE2-NE 2.79Å; E760-R819 PolarHBondContact OE2-NE 3.45Å; E760-R819 IonicContact OE2-NH2 3.58Å; E760-R819 PolarHBondContact OE2-NH2 3.36Å; E760-R837 IonicContact OE1-NH1 2.84Å
761	S	83.1	Confident	84.4	Confident	36 Å²	36	44.8 Å²	44.8	25%	0.252	25%	0.25	S	S	.	.	H	α-helix	trans	-64.1	-50.1	175.1	-174.8	0	0	0	0	111.8	D757 T758 L759 S764 Q765 A1068	D757-S761 WeakPolarHBondContact O-CB 3.47Å; D757-S761 PolarHBondContact O-N 2.98Å; T758-S761 PolarHBondContact O-N 2.95Å; L759-S761 VanDerWaalsContact C-N 3.31Å; L759-S761 PolarHBondContact O-N 3.43Å; S761-S764 PolarHBondContact O-N 3.01Å; S761-Q765 WeakPolarHBondContact O-CB 3.32Å; S761-Q765 PolarHBondContact O-N 3.48Å; S761-A1068 WeakPolarHBondContact OG-CB 3.14Å
762	N	88.5	Confident	85.3	Confident	28 Å²	28	44.5 Å²	44.5	15%	0.15	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-44.6	-178.1	-69.1	-1.2	0	0	0	111	Y738 T758 L759 Q765 E766	Y738-N762 HydrophobicContact CD2-CB 4.04Å; Y738-N762 HydrophobicContact CE2-CB 3.99Å; T758-N762 WeakPolarHBondContact O-CB 3.34Å; T758-N762 VanDerWaalsContact O-CG 3.25Å; T758-N762 PolarHBondContact O-N 3.08Å; T758-N762 PolarHBondContact O-OD1 2.96Å; L759-N762 PolarHBondContact O-N 3.27Å; N762-Q765 PolarHBondContact O-N 2.77Å; N762-E766 PolarHBondContact O-N 2.91Å
763	I	91	Very high	86.5	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-48.8	175.6	-68.5	173.5	0	0	0	110.4	C735 I739 L759 Q765 E766 L767	C735-I763 HydrophobicContact CB-CG1 4.46Å; I739-I763 HydrophobicContact CD1-CD1 4.35Å; I739-I763 HydrophobicContact CG1-CD1 4.08Å; L759-I763 HydrophobicContact CD1-CD1 3.73Å; L759-I763 HydrophobicContact CD1-CG1 4.15Å; L759-I763 HydrophobicContact CD2-CD1 4.47Å; L759-I763 HydrophobicContact CG-CD1 3.79Å; L759-I763 HydrophobicContact CG-CG1 4.49Å; L759-I763 WeakPolarHBondContact O-CB 3.49Å; L759-I763 VanDerWaalsContact O-CG1 3.32Å; L759-I763 WeakPolarHBondContact O-CG1 3.48Å; L759-I763 PolarHBondContact O-N 3.45Å; I763-Q765 VanDerWaalsContact C-N 3.26Å; I763-Q765 PolarHBondContact O-N 3.09Å; I763-E766 PolarHBondContact O-N 3.28Å; I763-L767 HydrophobicContact CG2-CD1 3.64Å; I763-L767 HydrophobicContact CG2-CG 4.04Å; I763-L767 VanDerWaalsContact O-CG 3.25Å; I763-L767 WeakPolarHBondContact O-CG 3.48Å; I763-L767 PolarHBondContact O-N 3.49Å
764	S	86.7	Confident	87.3	Confident	40 Å²	40	45.5 Å²	45.5	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-35.3	-178.1	-60.7	0	0	0	0	112.6	E760 S761 S768	E760-S764 VanDerWaalsContact O-CB 3.26Å; E760-S764 WeakPolarHBondContact O-CB 3.31Å; E760-S764 PolarHBondContact O-N 3.23Å; E760-S764 PolarHBondContact O-OG 3.43Å; S761-S764 PolarHBondContact O-N 3.01Å; S764-S768 WeakPolarHBondContact O-CB 3.17Å; S764-S768 PolarHBondContact O-N 3.47Å; S764-S768 VanDerWaalsContact O-N 3.07Å; S764-S768 PolarHBondContact O-OG 2.78Å
765	Q	86.3	Confident	87.6	Confident	127 Å²	127	43.7 Å²	43.7	59%	0.593	22%	0.224	S	C	*	.	H	α-helix	trans	-66.5	-48.2	175.4	-175.2	174.4	-0.5	0	0	111.7	S761 N762 I763 S768 K769	S761-Q765 WeakPolarHBondContact O-CB 3.32Å; S761-Q765 PolarHBondContact O-N 3.48Å; N762-Q765 PolarHBondContact O-N 2.77Å; I763-Q765 VanDerWaalsContact C-N 3.26Å; I763-Q765 PolarHBondContact O-N 3.09Å; Q765-S768 PolarHBondContact O-N 3.25Å; Q765-K769 PolarHBondContact O-N 3.25Å
766	E	91.9	Very high	87.9	Confident	37 Å²	37	43.5 Å²	43.5	17%	0.173	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-43	177.1	-73.4	-54	139.2	0	0	112	T734 Y738 N762 I763 S768 K769 I770	T734-E766 HydrophobicContact CG2-CG 4.37Å; Y738-E766 HydrophobicContact CE2-CG 3.89Å; N762-E766 PolarHBondContact O-N 2.91Å; I763-E766 PolarHBondContact O-N 3.28Å; E766-S768 VanDerWaalsContact C-N 3.3Å; E766-S768 PolarHBondContact O-N 3.36Å; E766-K769 WeakPolarHBondContact O-CB 3.49Å; E766-K769 PolarHBondContact O-N 3.03Å; E766-K769 VanDerWaalsContact O-N 3.14Å; E766-I770 WeakPolarHBondContact O-CG1 3.25Å; E766-I770 PolarHBondContact O-N 3.43Å
767	L	90.9	Very high	88.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-33.7	178.1	-64.1	180	0	0	0	112.9	F732 I763 I770 R771 P839 F844	F732-L767 HydrophobicContact CE1-CD2 4.27Å; I763-L767 HydrophobicContact CG2-CD1 3.64Å; I763-L767 HydrophobicContact CG2-CG 4.04Å; I763-L767 VanDerWaalsContact O-CG 3.25Å; I763-L767 WeakPolarHBondContact O-CG 3.48Å; I763-L767 PolarHBondContact O-N 3.49Å; L767-I770 HydrophobicContact CD2-CD1 3.88Å; L767-R771 PolarHBondContact O-N 3.27Å; L767-P839 HydrophobicContact CD1-CB 4.06Å; L767-P839 HydrophobicContact CD1-CG 4.49Å; L767-P839 HydrophobicContact CD2-CB 3.85Å; L767-P839 HydrophobicContact CD2-CG 3.99Å; L767-F844 HydrophobicContact CB-CD2 3.94Å; L767-F844 HydrophobicContact CB-CE2 3.97Å; L767-F844 HydrophobicContact CD1-CB 4.32Å; L767-F844 HydrophobicContact CD1-CD2 3.94Å; L767-F844 HydrophobicContact CD1-CG 4.41Å; L767-F844 HydrophobicContact CD2-CD2 3.72Å; L767-F844 HydrophobicContact CD2-CE2 3.87Å; L767-F844 HydrophobicContact CD2-CG 4.14Å; L767-F844 HydrophobicContact CD2-CZ 4.41Å; L767-F844 HydrophobicContact CG-CD2 4.06Å; L767-F844 HydrophobicContact CG-CE2 4.37Å
768	S	86.8	Confident	88.5	Confident	46 Å²	46	36.5 Å²	36.5	32%	0.322	20%	0.198	S	C	.	.	H	α-helix	trans	-67.2	-41	173.7	-61.2	0	0	0	0	111.3	S764 Q765 E766 R771 D772	S764-S768 WeakPolarHBondContact O-CB 3.17Å; S764-S768 PolarHBondContact O-N 3.47Å; S764-S768 VanDerWaalsContact O-N 3.07Å; S764-S768 PolarHBondContact O-OG 2.78Å; Q765-S768 PolarHBondContact O-N 3.25Å; E766-S768 VanDerWaalsContact C-N 3.3Å; E766-S768 PolarHBondContact O-N 3.36Å; S768-R771 WeakPolarHBondContact O-CB 3.38Å; S768-R771 PolarHBondContact O-N 3.49Å; S768-D772 VanDerWaalsContact O-CG 3.3Å; S768-D772 PolarHBondContact O-N 3.24Å; S768-D772 VanDerWaalsContact O-N 3.11Å
769	K	89.6	Confident	88.6	Confident	100 Å²	100	41.3 Å²	41.3	44%	0.435	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-42.8	176.6	-177.2	-178.1	172.1	-169.8	0	112.3	Q765 E766 R771 D772 E773	Q765-K769 PolarHBondContact O-N 3.25Å; E766-K769 WeakPolarHBondContact O-CB 3.49Å; E766-K769 PolarHBondContact O-N 3.03Å; E766-K769 VanDerWaalsContact O-N 3.14Å; K769-R771 VanDerWaalsContact C-N 3.3Å; K769-R771 PolarHBondContact O-N 3.22Å; K769-D772 PolarHBondContact O-N 3.29Å; K769-E773 WeakPolarHBondContact CE-OE1 3.05Å; K769-E773 HydrophobicContact CG-CG 4.41Å; K769-E773 WeakPolarHBondContact CG-OE1 3.27Å; K769-E773 WeakPolarHBondContact O-CG 3.38Å; K769-E773 PolarHBondContact O-N 3.11Å
770	I	90.1	Very high	88.5	Confident	8 Å²	8	51 Å²	51	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-55.1	-47.2	175.8	-65.1	167	0	0	0	110.8	I728 E766 L767 A774 F844	I728-I770 HydrophobicContact CG1-CG2 4.02Å; E766-I770 WeakPolarHBondContact O-CG1 3.25Å; E766-I770 PolarHBondContact O-N 3.43Å; L767-I770 HydrophobicContact CD2-CD1 3.88Å; I770-A774 VanDerWaalsContact O-CB 3.26Å; I770-A774 WeakPolarHBondContact O-CB 3.26Å; I770-A774 PolarHBondContact O-N 2.71Å; I770-F844 HydrophobicContact CG2-CZ 4.19Å
771	R	87.6	Confident	88.5	Confident	63 Å²	63	53.1 Å²	53.1	24%	0.238	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-46.3	178.8	-178.6	-160.5	66.5	-156.3	-7	111.3	L767 S768 K769 A774 G775	L767-R771 PolarHBondContact O-N 3.27Å; S768-R771 WeakPolarHBondContact O-CB 3.38Å; S768-R771 PolarHBondContact O-N 3.49Å; K769-R771 VanDerWaalsContact C-N 3.3Å; K769-R771 PolarHBondContact O-N 3.22Å; R771-A774 PolarHBondContact O-N 2.82Å; R771-G775 PolarHBondContact O-N 2.95Å
772	D	86.8	Confident	88.9	Confident	89 Å²	89	52.8 Å²	52.8	48%	0.476	26%	0.26	S	S	.	.	H	α-helix	trans	-69.1	-39.2	-175.4	-63.7	-14.6	0	0	0	111.6	S768 K769 G775 A776	S768-D772 VanDerWaalsContact O-CG 3.3Å; S768-D772 PolarHBondContact O-N 3.24Å; S768-D772 VanDerWaalsContact O-N 3.11Å; K769-D772 PolarHBondContact O-N 3.29Å; D772-G775 PolarHBondContact O-N 3.46Å; D772-A776 WeakPolarHBondContact O-CB 3.25Å; D772-A776 PolarHBondContact O-N 3.03Å
773	E	91.1	Very high	88.9	Confident	78 Å²	78	57.4 Å²	57.4	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-43.8	173.7	-72.4	-177.3	-167.5	0	0	112.1	L727 K769 G775 A776 A777	L727-E773 HydrophobicContact CD1-CB 4.16Å; L727-E773 VanDerWaalsContact CD2-OE2 3.27Å; L727-E773 WeakPolarHBondContact CD2-OE2 3.21Å; K769-E773 WeakPolarHBondContact CE-OE1 3.05Å; K769-E773 HydrophobicContact CG-CG 4.41Å; K769-E773 WeakPolarHBondContact CG-OE1 3.27Å; K769-E773 WeakPolarHBondContact O-CG 3.38Å; K769-E773 PolarHBondContact O-N 3.11Å; E773-G775 VanDerWaalsContact C-N 3.32Å; E773-G775 PolarHBondContact O-N 2.99Å; E773-A776 PolarHBondContact O-N 3.27Å; E773-A777 PolarHBondContact O-N 3.12Å
774	A	88.9	Confident	88.8	Confident	2 Å²	2	61.9 Å²	61.9	2%	0.017	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-40.1	175.7	0	0	0	0	0	111.6	L727 I770 R771 A777 C778 A808	L727-A774 HydrophobicContact CD1-CB 4.48Å; I770-A774 VanDerWaalsContact O-CB 3.26Å; I770-A774 WeakPolarHBondContact O-CB 3.26Å; I770-A774 PolarHBondContact O-N 2.71Å; R771-A774 PolarHBondContact O-N 2.82Å; A774-A777 PolarHBondContact O-N 2.95Å; A774-C778 WeakPolarHBondContact O-CB 3.49Å; A774-C778 PolarHBondContact O-N 3.11Å; A774-A808 HydrophobicContact CB-CB 4.27Å
775	G	87.7	Confident	88.9	Confident	15 Å²	15	63.5 Å²	63.5	16%	0.155	32%	0.321	C	S	.	.	H	α-helix	trans	-65	-40.2	174.6	0	0	0	0	0	113.2	R771 D772 E773 C778 K779 S804	R771-G775 PolarHBondContact O-N 2.95Å; D772-G775 PolarHBondContact O-N 3.46Å; E773-G775 VanDerWaalsContact C-N 3.32Å; E773-G775 PolarHBondContact O-N 2.99Å; G775-C778 WeakPolarHBondContact O-CB 3.33Å; G775-C778 PolarHBondContact O-N 2.85Å; G775-K779 PolarHBondContact O-N 2.79Å; G775-S804 WeakPolarHBondContact CA-OG 3.34Å
776	A	89.7	Confident	89.3	Confident	51 Å²	51	58 Å²	58	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-68.2	-35.7	175.7	0	0	0	0	0	112.7	D772 E773 R780	D772-A776 WeakPolarHBondContact O-CB 3.25Å; D772-A776 PolarHBondContact O-N 3.03Å; E773-A776 PolarHBondContact O-N 3.27Å; A776-R780 PolarHBondContact O-N 3.2Å; A776-R780 PolarHBondContact O-NE 2.91Å
777	A	90.2	Very high	89.4	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-46.3	171.4	0	0	0	0	0	111.2	L720 E773 A774 K779 R780	L720-A777 HydrophobicContact CD1-CB 3.98Å; E773-A777 PolarHBondContact O-N 3.12Å; A774-A777 PolarHBondContact O-N 2.95Å; A777-K779 PolarHBondContact O-N 3.31Å; A777-R780 PolarHBondContact O-N 2.94Å
778	C	90.4	Very high	89.5	Confident	3 Å²	3	57 Å²	57	2%	0.02	29%	0.293	C	S	.	.	H	α-helix	trans	-55.8	-51	175.7	178.9	0	0	0	0	111.6	L720 A774 G775 R780 Q781 L782 A808	L720-C778 HydrophobicContact CD1-CB 4.11Å; L720-C778 HydrophobicContact CD2-CB 3.91Å; A774-C778 WeakPolarHBondContact O-CB 3.49Å; A774-C778 PolarHBondContact O-N 3.11Å; G775-C778 WeakPolarHBondContact O-CB 3.33Å; G775-C778 PolarHBondContact O-N 2.85Å; C778-R780 VanDerWaalsContact C-N 3.25Å; C778-R780 PolarHBondContact O-N 3.2Å; C778-R780 VanDerWaalsContact O-N 3.16Å; C778-Q781 PolarHBondContact O-N 2.85Å; C778-L782 WeakPolarHBondContact O-CG 3.47Å; C778-L782 PolarHBondContact O-N 2.87Å; C778-A808 HydrophobicContact CB-CB 4.14Å
779	K	87.4	Confident	89.8	Confident	100 Å²	100	55.1 Å²	55.1	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-55.8	-36.7	-178.7	-176.2	176.8	177.5	178.2	0	113.6	G775 A777 Q781 F800	G775-K779 PolarHBondContact O-N 2.79Å; A777-K779 PolarHBondContact O-N 3.31Å; K779-Q781 VanDerWaalsContact C-N 3.27Å; K779-Q781 PolarHBondContact O-N 2.67Å; K779-F800 HydrophobicContact CD-CD1 4.11Å; K779-F800 HydrophobicContact CD-CE1 4.02Å; K779-F800 HydrophobicContact CG-CE1 4.48Å
780	R	87.7	Confident	90	Very high	204 Å²	204	50.8 Å²	50.8	77%	0.77	26%	0.261	S	S	*	.	H	α-helix	trans	-71	-22.5	-178.9	-75.1	-176.9	-72.7	160.3	-3.3	113.5	A776 A777 C778	A776-R780 PolarHBondContact O-N 3.2Å; A776-R780 PolarHBondContact O-NE 2.91Å; A777-R780 PolarHBondContact O-N 2.94Å; C778-R780 VanDerWaalsContact C-N 3.25Å; C778-R780 PolarHBondContact O-N 3.2Å; C778-R780 VanDerWaalsContact O-N 3.16Å
781	Q	87.3	Confident	90.2	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	27%	0.27	S	S	.	.	H	α-helix	trans	-100.2	-14.6	-174.6	-62.8	-176.1	10.3	0	0	113.4	S717 C778 K779	S717-Q781 PolarHBondContact OG-OE1 3.02Å; C778-Q781 PolarHBondContact O-N 2.85Å; K779-Q781 VanDerWaalsContact C-N 3.27Å; K779-Q781 PolarHBondContact O-N 2.67Å
782	L	89.8	Confident	90.4	Very high	29 Å²	29	50 Å²	50	15%	0.152	26%	0.262	C	S	.	.	S	Bend	trans	-72.7	131.9	177.4	-64.8	171.8	0	0	0	110.7	C778 L789 I803 I807	C778-L782 WeakPolarHBondContact O-CG 3.47Å; C778-L782 PolarHBondContact O-N 2.87Å; L782-L789 HydrophobicContact CB-CD2 4.08Å; L782-I803 HydrophobicContact CD1-CG2 3.66Å; L782-I807 HydrophobicContact CD1-CD1 4.18Å; L782-I807 HydrophobicContact CD2-CD1 3.66Å
783	H	90.1	Very high	90.6	Very high	126 Å²	126	47.6 Å²	47.6	58%	0.583	25%	0.248	S	C	*	.			trans	-63.7	141.5	174.4	-171.8	-98.1	0	0	0	110.7	S785 N786	H783-S785 PolarHBondContact CE1-OG 2.75Å; H783-S785 WeakPolarHBondContact ND1-CB 3.46Å; H783-S785 PolarHBondContact ND1-N 3.11Å; H783-S785 VanDerWaalsContact ND1-N 3.16Å; H783-S785 PolarHBondContact ND1-OG 3.43Å; H783-S785 PolarHBondContact O-N 3.38Å; H783-S785 VanDerWaalsContact O-N 3.08Å; H783-N786 WeakPolarHBondContact O-CB 3.4Å; H783-N786 PolarHBondContact O-N 3.37Å
784	P	87.7	Confident	90.7	Very high	93 Å²	93	44 Å²	44	60%	0.604	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-25.7	-179.4	-27.8	35.7	0	0	0	115.1	N786	P784-N786 VanDerWaalsContact C-N 3.3Å; P784-N786 PolarHBondContact O-N 3.11Å
785	S	89.8	Confident	90.7	Very high	74 Å²	74	45 Å²	45	52%	0.517	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-3.3	177.8	77.2	0	0	0	0	114.6	H783 S787	H783-S785 PolarHBondContact CE1-OG 2.75Å; H783-S785 WeakPolarHBondContact ND1-CB 3.46Å; H783-S785 PolarHBondContact ND1-N 3.11Å; H783-S785 VanDerWaalsContact ND1-N 3.16Å; H783-S785 PolarHBondContact ND1-OG 3.43Å; H783-S785 PolarHBondContact O-N 3.38Å; H783-S785 VanDerWaalsContact O-N 3.08Å; S785-S787 PolarHBondContact O-N 3.28Å
786	N	93.1	Very high	90.9	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.07	24%	0.238	C	C	.	.			trans	-61.2	124.2	-178.4	-179.8	-53.7	0	0	0	110.2	E713 H783 P784 P788 L789 V790	E713-N786 PolarHBondContact O-ND2 3.21Å; H783-N786 WeakPolarHBondContact O-CB 3.4Å; H783-N786 PolarHBondContact O-N 3.37Å; P784-N786 VanDerWaalsContact C-N 3.3Å; P784-N786 PolarHBondContact O-N 3.11Å; N786-P788 WeakPolarHBondContact OD1-CD 3.44Å; N786-P788 WeakPolarHBondContact OD1-CG 3.37Å; N786-L789 HydrophobicContact CB-CB 3.97Å; N786-L789 WeakPolarHBondContact O-CA 3.2Å; N786-L789 WeakPolarHBondContact O-CB 3.17Å; N786-L789 PolarHBondContact O-N 3.32Å; N786-L789 PolarHBondContact OD1-N 3.07Å; N786-V790 WeakPolarHBondContact O-CG2 3.42Å; N786-V790 PolarHBondContact O-N 3.22Å
787	S	94.5	Very high	91	Very high	7 Å²	7	48.2 Å²	48.2	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-48.4	-170.8	-53.6	0	0	0	0	113.6	F707 S708 E713 S785 L789 V790 M791	F707-S787 VanDerWaalsContact CZ-CB 3.47Å; S708-S787 PolarHBondContact O-OG 3.29Å; E713-S787 VanDerWaalsContact OE1-CB 3.27Å; E713-S787 WeakPolarHBondContact OE1-CB 3.36Å; E713-S787 PolarHBondContact OE1-N 2.91Å; E713-S787 PolarHBondContact OE1-OG 3.36Å; E713-S787 VanDerWaalsContact OE2-CB 3.23Å; E713-S787 WeakPolarHBondContact OE2-CB 3.29Å; E713-S787 PolarHBondContact OE2-OG 2.81Å; S785-S787 PolarHBondContact O-N 3.28Å; S787-L789 PolarHBondContact O-N 3.07Å; S787-V790 PolarHBondContact O-N 3.37Å; S787-M791 WeakPolarHBondContact O-CG 3.19Å; S787-M791 PolarHBondContact O-N 3.06Å
788	P	94.2	Very high	90.9	Very high	8 Å²	8	50.2 Å²	50.2	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-49.5	-43.9	168.9	-26.6	24.1	0	0	0	113.8	I709 E713 V714 N786 M791 A792 I803	I709-P788 HydrophobicContact CD1-CG 3.74Å; I709-P788 HydrophobicContact CG1-CG 4.23Å; E713-P788 HydrophobicContact CB-CG 4.41Å; E713-P788 WeakPolarHBondContact OE2-CD 3.29Å; V714-P788 HydrophobicContact CG1-CG 4.44Å; N786-P788 WeakPolarHBondContact OD1-CD 3.44Å; N786-P788 WeakPolarHBondContact OD1-CG 3.37Å; P788-M791 PolarHBondContact O-N 3.19Å; P788-A792 WeakPolarHBondContact O-CB 3.41Å; P788-A792 PolarHBondContact O-N 3.43Å; P788-I803 HydrophobicContact CB-CD1 4.15Å; P788-I803 HydrophobicContact CB-CG1 4.06Å; P788-I803 WeakPolarHBondContact O-CD1 3.43Å
789	L	92.9	Very high	90.8	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.037	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-45.4	179.8	-178.8	62.8	0	0	0	111.4	L782 N786 S787 M791 A792 Q793 F800	L782-L789 HydrophobicContact CB-CD2 4.08Å; N786-L789 HydrophobicContact CB-CB 3.97Å; N786-L789 WeakPolarHBondContact O-CA 3.2Å; N786-L789 WeakPolarHBondContact O-CB 3.17Å; N786-L789 PolarHBondContact O-N 3.32Å; N786-L789 PolarHBondContact OD1-N 3.07Å; S787-L789 PolarHBondContact O-N 3.07Å; L789-M791 VanDerWaalsContact C-N 3.35Å; L789-M791 PolarHBondContact O-N 3.43Å; L789-A792 PolarHBondContact O-N 3.13Å; L789-Q793 HydrophobicContact CD1-CG 4.19Å; L789-Q793 HydrophobicContact CG-CG 4.36Å; L789-Q793 WeakPolarHBondContact O-CB 3.23Å; L789-Q793 VanDerWaalsContact O-CG 3.29Å; L789-Q793 WeakPolarHBondContact O-CG 3.48Å; L789-Q793 PolarHBondContact O-N 3.41Å; L789-F800 HydrophobicContact CD1-CD1 4.34Å; L789-F800 HydrophobicContact CD1-CE1 3.62Å
790	V	93.3	Very high	90.8	Very high	8 Å²	8	50.8 Å²	50.8	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-41.9	176.4	172.5	0	0	0	0	111.3	T557 L561 F707 N786 S787 Q793 S794	T557-V790 HydrophobicContact CG2-CG1 4.37Å; L561-V790 HydrophobicContact CD2-CG1 3.78Å; L561-V790 HydrophobicContact CG-CG1 4.16Å; F707-V790 HydrophobicContact CE2-CB 4.23Å; F707-V790 HydrophobicContact CE2-CG1 4.12Å; F707-V790 HydrophobicContact CZ-CB 4.29Å; F707-V790 HydrophobicContact CZ-CG1 4.26Å; N786-V790 WeakPolarHBondContact O-CG2 3.42Å; N786-V790 PolarHBondContact O-N 3.22Å; S787-V790 PolarHBondContact O-N 3.37Å; V790-Q793 PolarHBondContact O-N 3.34Å; V790-S794 VanDerWaalsContact O-CB 3.29Å; V790-S794 WeakPolarHBondContact O-CB 3.38Å; V790-S794 PolarHBondContact O-N 3Å; V790-S794 PolarHBondContact O-OG 3.13Å
791	M	94.3	Very high	90.8	Very high	46 Å²	46	44.7 Å²	44.7	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-40.7	177.2	-67.9	172	64.3	0	0	112	F707 S787 P788 L789 S794 G795 S796 K797	F707-M791 HydrophobicContact CE1-CG 3.79Å; F707-M791 HydrophobicContact CE1-SD 3.9Å; F707-M791 HydrophobicContact CZ-CG 3.81Å; F707-M791 HydrophobicContact CZ-SD 4.31Å; S787-M791 WeakPolarHBondContact O-CG 3.19Å; S787-M791 PolarHBondContact O-N 3.06Å; P788-M791 PolarHBondContact O-N 3.19Å; L789-M791 VanDerWaalsContact C-N 3.35Å; L789-M791 PolarHBondContact O-N 3.43Å; M791-S794 PolarHBondContact O-OG 3.11Å; M791-S794 VanDerWaalsContact O-OG 3.12Å; M791-G795 WeakPolarHBondContact O-CA 3.18Å; M791-G795 PolarHBondContact O-N 3.3Å; M791-S796 PolarHBondContact O-N 2.98Å; M791-S796 VanDerWaalsContact O-N 3.13Å; M791-S796 PolarHBondContact O-OG 3.27Å; M791-K797 CarbonylContact C-O 3.59Å; M791-K797 WeakPolarHBondContact CB-O 3.19Å; M791-K797 HydrophobicContact CE-CB 3.78Å; M791-K797 HydrophobicContact CE-CG 4.46Å
792	A	92.1	Very high	90.9	Very high	10 Å²	10	44.1 Å²	44.1	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-70.9	-37	176.1	0	0	0	0	0	112.8	P788 L789 G795 F800 I803	P788-A792 WeakPolarHBondContact O-CB 3.41Å; P788-A792 PolarHBondContact O-N 3.43Å; L789-A792 PolarHBondContact O-N 3.13Å; A792-G795 PolarHBondContact O-N 2.7Å; A792-F800 HydrophobicContact CB-CD1 4.49Å; A792-F800 HydrophobicContact CB-CE1 4.48Å; A792-I803 HydrophobicContact CB-CD1 3.6Å
793	Q	90.9	Very high	91	Very high	38 Å²	38	43.1 Å²	43.1	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-48.4	176.9	-77.2	177.5	-11.5	0	0	111.7	S633 L789 V790 G795 F800	S633-Q793 WeakPolarHBondContact CB-O 3.38Å; S633-Q793 PolarHBondContact OG-O 3.31Å; L789-Q793 HydrophobicContact CD1-CG 4.19Å; L789-Q793 HydrophobicContact CG-CG 4.36Å; L789-Q793 WeakPolarHBondContact O-CB 3.23Å; L789-Q793 VanDerWaalsContact O-CG 3.29Å; L789-Q793 WeakPolarHBondContact O-CG 3.48Å; L789-Q793 PolarHBondContact O-N 3.41Å; V790-Q793 PolarHBondContact O-N 3.34Å; Q793-G795 PolarHBondContact O-N 2.87Å; Q793-F800 HydrophobicContact CG-CE1 4.39Å; Q793-F800 HydrophobicContact CG-CZ 3.92Å
794	S	91.9	Very high	91.1	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-24.5	173.8	62.8	0	0	0	0	112.3	K663 V790 M791 S796	K663-S794 WeakPolarHBondContact CB-O 3.38Å; K663-S794 PolarHBondContact N-O 3.46Å; V790-S794 VanDerWaalsContact O-CB 3.29Å; V790-S794 WeakPolarHBondContact O-CB 3.38Å; V790-S794 PolarHBondContact O-N 3Å; V790-S794 PolarHBondContact O-OG 3.13Å; M791-S794 PolarHBondContact O-OG 3.11Å; M791-S794 VanDerWaalsContact O-OG 3.12Å; S794-S796 VanDerWaalsContact C-N 3.29Å; S794-S796 PolarHBondContact OG-N 2.95Å; S794-S796 PolarHBondContact OG-OG 3.37Å
795	G	90.7	Very high	91.2	Very high	23 Å²	23	35.4 Å²	35.4	24%	0.237	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	13.2	-177.2	0	0	0	0	0	113.4	K663 M791 A792 Q793	K663-G795 WeakPolarHBondContact CD-O 3.48Å; M791-G795 WeakPolarHBondContact O-CA 3.18Å; M791-G795 PolarHBondContact O-N 3.3Å; A792-G795 PolarHBondContact O-N 2.7Å; Q793-G795 PolarHBondContact O-N 2.87Å
796	S	92.1	Very high	91.4	Very high	12 Å²	12	34.7 Å²	34.7	8%	0.084	20%	0.195	C	C	.	.	S	Bend	trans	-65.2	-47.1	-176.7	62.8	0	0	0	0	112.6	Q553 T557 M791 S794	Q553-S796 VanDerWaalsContact O-CB 3.31Å; Q553-S796 WeakPolarHBondContact O-CB 3.26Å; T557-S796 WeakPolarHBondContact OG1-CB 3.42Å; T557-S796 PolarHBondContact OG1-OG 3.14Å; M791-S796 PolarHBondContact O-N 2.98Å; M791-S796 VanDerWaalsContact O-N 3.13Å; M791-S796 PolarHBondContact O-OG 3.27Å; S794-S796 VanDerWaalsContact C-N 3.29Å; S794-S796 PolarHBondContact OG-N 2.95Å; S794-S796 PolarHBondContact OG-OG 3.37Å
797	K	91.4	Very high	91.4	Very high	122 Å²	122	34.2 Å²	34.2	53%	0.53	19%	0.193	S	C	.	.	S	Bend	trans	-158.7	143.3	175.5	-167.5	170.1	-173.8	173.4	0	110.7	M791	M791-K797 CarbonylContact C-O 3.59Å; M791-K797 WeakPolarHBondContact CB-O 3.19Å; M791-K797 HydrophobicContact CE-CB 3.78Å; M791-K797 HydrophobicContact CE-CG 4.46Å
798	G	87.1	Confident	91.2	Very high	46 Å²	46	33.9 Å²	33.9	47%	0.474	19%	0.19	S	C	.	.			trans	81	176.2	-177.8	0	0	0	0	0	113.2
799	S	88.2	Confident	91.1	Very high	45 Å²	45	33.5 Å²	33.5	32%	0.315	19%	0.188	S	C	.	.			trans	-141.7	166.9	179	79.1	0	0	0	0	109.9	L801 N802 I803	S799-L801 PolarHBondContact O-N 3.03Å; S799-L801 WeakPolarHBondContact OG-CB 3.49Å; S799-L801 PolarHBondContact OG-N 3.31Å; S799-N802 WeakPolarHBondContact O-CB 3.27Å; S799-N802 PolarHBondContact O-N 3.14Å; S799-N802 PolarHBondContact OG-N 2.82Å; S799-N802 PolarHBondContact OG-OD1 3.1Å; S799-I803 PolarHBondContact O-N 2.9Å
800	F	87.8	Confident	91	Very high	70 Å²	70	33.3 Å²	33.3	31%	0.307	19%	0.187	S	C	.	.	H	α-helix	trans	-57.8	-30.1	172.9	-68.2	-74.4	0	0	0	112.7	K779 L789 A792 Q793 I803 S804	K779-F800 HydrophobicContact CD-CD1 4.11Å; K779-F800 HydrophobicContact CD-CE1 4.02Å; K779-F800 HydrophobicContact CG-CE1 4.48Å; L789-F800 HydrophobicContact CD1-CD1 4.34Å; L789-F800 HydrophobicContact CD1-CE1 3.62Å; A792-F800 HydrophobicContact CB-CD1 4.49Å; A792-F800 HydrophobicContact CB-CE1 4.48Å; Q793-F800 HydrophobicContact CG-CE1 4.39Å; Q793-F800 HydrophobicContact CG-CZ 3.92Å; F800-I803 PolarHBondContact O-N 2.75Å; F800-S804 WeakPolarHBondContact O-CB 3.23Å; F800-S804 PolarHBondContact O-N 3.29Å
801	L	86.7	Confident	90.9	Very high	76 Å²	76	33 Å²	33	40%	0.398	19%	0.185	S	C	.	.	H	α-helix	trans	-63.4	-44.6	175.2	-178.2	63.5	0	0	0	110.8	S799 I803 S804 Q805	S799-L801 PolarHBondContact O-N 3.03Å; S799-L801 WeakPolarHBondContact OG-CB 3.49Å; S799-L801 PolarHBondContact OG-N 3.31Å; L801-I803 VanDerWaalsContact C-N 3.32Å; L801-I803 PolarHBondContact O-N 2.82Å; L801-S804 WeakPolarHBondContact O-CB 3.48Å; L801-S804 PolarHBondContact O-N 2.93Å; L801-Q805 HydrophobicContact CD1-CG 4.49Å; L801-Q805 VanDerWaalsContact O-CG 3.3Å; L801-Q805 WeakPolarHBondContact O-CG 3.26Å; L801-Q805 PolarHBondContact O-N 3.46Å
802	N	90.7	Very high	90.8	Very high	73 Å²	73	32.2 Å²	32.2	39%	0.39	18%	0.18	S	C	.	.	H	α-helix	trans	-61.9	-42.1	178.9	-60	48.9	0	0	0	111.1	S799 Q805 M806	S799-N802 WeakPolarHBondContact O-CB 3.27Å; S799-N802 PolarHBondContact O-N 3.14Å; S799-N802 PolarHBondContact OG-N 2.82Å; S799-N802 PolarHBondContact OG-OD1 3.1Å; N802-Q805 PolarHBondContact O-N 3.2Å; N802-M806 WeakPolarHBondContact O-CG 3.34Å; N802-M806 PolarHBondContact O-N 2.71Å
803	I	91.8	Very high	90.7	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.041	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-45.9	176.2	-58.6	172.7	0	0	0	110.2	L782 P788 A792 S799 F800 L801 Q805 M806 I807	L782-I803 HydrophobicContact CD1-CG2 3.66Å; P788-I803 HydrophobicContact CB-CD1 4.15Å; P788-I803 HydrophobicContact CB-CG1 4.06Å; P788-I803 WeakPolarHBondContact O-CD1 3.43Å; A792-I803 HydrophobicContact CB-CD1 3.6Å; S799-I803 PolarHBondContact O-N 2.9Å; F800-I803 PolarHBondContact O-N 2.75Å; L801-I803 VanDerWaalsContact C-N 3.32Å; L801-I803 PolarHBondContact O-N 2.82Å; I803-Q805 VanDerWaalsContact C-N 3.28Å; I803-Q805 PolarHBondContact O-N 3Å; I803-M806 HydrophobicContact CG1-CE 4.39Å; I803-M806 PolarHBondContact O-N 3.05Å; I803-I807 HydrophobicContact CG2-CD1 3.69Å; I803-I807 HydrophobicContact CG2-CG1 4.33Å; I803-I807 WeakPolarHBondContact O-CG1 3.44Å; I803-I807 PolarHBondContact O-N 2.8Å
804	S	91.1	Very high	90.3	Very high	6 Å²	6	32.2 Å²	32.2	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-40	176.3	-174.6	0	0	0	0	112.2	G775 F800 L801 A808 C809	G775-S804 WeakPolarHBondContact CA-OG 3.34Å; F800-S804 WeakPolarHBondContact O-CB 3.23Å; F800-S804 PolarHBondContact O-N 3.29Å; L801-S804 WeakPolarHBondContact O-CB 3.48Å; L801-S804 PolarHBondContact O-N 2.93Å; S804-A808 CarbonylContact O-C 3.37Å; S804-A808 WeakPolarHBondContact O-CA 3.46Å; S804-A808 WeakPolarHBondContact O-CB 3.5Å; S804-A808 PolarHBondContact O-N 2.94Å; S804-C809 PolarHBondContact O-N 3.28Å
805	Q	91.1	Very high	89.8	Confident	50 Å²	50	34 Å²	34	23%	0.234	19%	0.19	C	C	.	.	H	α-helix	trans	-70	-37	179	-68.9	178.3	-34.9	0	0	113	L801 N802 I803 C809 V810 S848 F849	L801-Q805 HydrophobicContact CD1-CG 4.49Å; L801-Q805 VanDerWaalsContact O-CG 3.3Å; L801-Q805 WeakPolarHBondContact O-CG 3.26Å; L801-Q805 PolarHBondContact O-N 3.46Å; N802-Q805 PolarHBondContact O-N 3.2Å; I803-Q805 VanDerWaalsContact C-N 3.28Å; I803-Q805 PolarHBondContact O-N 3Å; Q805-C809 WeakPolarHBondContact CA-O 3.38Å; Q805-V810 PolarHBondContact NE2-O 3.33Å; Q805-S848 WeakPolarHBondContact O-CB 3.32Å; Q805-F849 HydrophobicContact CB-CD2 4.41Å; Q805-F849 HydrophobicContact CB-CE2 4.06Å; Q805-F849 PolarHBondContact O-N 3Å
806	M	92.8	Very high	89	Confident	60 Å²	60	35.4 Å²	35.4	30%	0.296	21%	0.205	S	C	.	.	H	α-helix	trans	-69.7	-40.8	177.3	-69.2	-177.6	-61.1	0	0	112.4	V714 N802 I803 S848 F849 Y850	V714-M806 HydrophobicContact CG1-CB 4.5Å; N802-M806 WeakPolarHBondContact O-CG 3.34Å; N802-M806 PolarHBondContact O-N 2.71Å; I803-M806 HydrophobicContact CG1-CE 4.39Å; I803-M806 PolarHBondContact O-N 3.05Å; M806-S848 WeakPolarHBondContact O-CB 3.39Å; M806-S848 PolarHBondContact O-OG 2.85Å; M806-F849 HydrophobicContact CG-CD2 4.1Å; M806-Y850 WeakPolarHBondContact O-CB 3.48Å; M806-Y850 PolarHBondContact O-N 3.02Å; M806-Y850 VanDerWaalsContact O-N 3.13Å
807	I	93.1	Very high	88.1	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-99.6	-51.5	-170	-53	-177	0	0	0	112	V714 P716 L720 L782 I803 S848	V714-I807 HydrophobicContact CB-CG1 4.13Å; V714-I807 HydrophobicContact CG1-CG1 4.41Å; P716-I807 HydrophobicContact CB-CG2 3.93Å; L720-I807 HydrophobicContact CD2-CG2 3.69Å; L782-I807 HydrophobicContact CD1-CD1 4.18Å; L782-I807 HydrophobicContact CD2-CD1 3.66Å; I803-I807 HydrophobicContact CG2-CD1 3.69Å; I803-I807 HydrophobicContact CG2-CG1 4.33Å; I803-I807 WeakPolarHBondContact O-CG1 3.44Å; I803-I807 PolarHBondContact O-N 2.8Å; I807-S848 WeakPolarHBondContact O-CB 3.23Å; I807-S848 PolarHBondContact O-OG 3.24Å
808	A	91.1	Very high	87.6	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-75.6	-170	0	0	0	0	0	113.1	K724 A774 C778 S804	K724-A808 VanDerWaalsContact CD-O 3.25Å; K724-A808 WeakPolarHBondContact CD-O 3.05Å; K724-A808 WeakPolarHBondContact CE-O 3.4Å; K724-A808 PolarHBondContact NZ-O 3.19Å; A774-A808 HydrophobicContact CB-CB 4.27Å; C778-A808 HydrophobicContact CB-CB 4.14Å; S804-A808 CarbonylContact O-C 3.37Å; S804-A808 WeakPolarHBondContact O-CA 3.46Å; S804-A808 WeakPolarHBondContact O-CB 3.5Å; S804-A808 PolarHBondContact O-N 2.94Å
809	C	91.5	Very high	87.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.			trans	-156.6	147	178	66	0	0	0	0	111.4	S804 Q805 G846	S804-C809 PolarHBondContact O-N 3.28Å; Q805-C809 WeakPolarHBondContact CA-O 3.38Å; C809-G846 WeakPolarHBondContact CB-O 3.37Å
810	V	92	Very high	87.8	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	18%	0.177	C	C	.	.			trans	-72.3	-42.1	179.4	179.3	0	0	0	0	111.5	Q805 V845 N847 F849 L853	Q805-V810 PolarHBondContact NE2-O 3.33Å; V810-V845 HydrophobicContact CB-CB 4.05Å; V810-V845 HydrophobicContact CB-CG1 3.78Å; V810-V845 HydrophobicContact CG1-CB 4.48Å; V810-V845 HydrophobicContact CG1-CG1 4.47Å; V810-V845 HydrophobicContact CG2-CG1 4.1Å; V810-N847 WeakPolarHBondContact CG2-O 3.39Å; V810-N847 PolarHBondContact N-O 3.03Å; V810-N847 VanDerWaalsContact N-O 3.11Å; V810-F849 HydrophobicContact CG1-CZ 4.47Å; V810-F849 HydrophobicContact CG2-CD1 4.42Å; V810-F849 HydrophobicContact CG2-CD2 4.36Å; V810-F849 HydrophobicContact CG2-CE1 4.16Å; V810-F849 HydrophobicContact CG2-CE2 4.1Å; V810-F849 HydrophobicContact CG2-CZ 4Å; V810-L853 HydrophobicContact CG2-CD2 4.26Å
811	G	91.2	Very high	87.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94	-167.9	178.7	0	0	0	0	0	114.4	Q813 V845	G811-Q813 PolarHBondContact O-N 2.86Å; G811-Q813 PolarHBondContact O-NE2 3.15Å; G811-V845 PolarHBondContact N-O 3.37Å; G811-V845 PolarHBondContact O-N 3.28Å; G811-V845 VanDerWaalsContact O-N 3.11Å
812	Q	90.9	Very high	88.1	Confident	30 Å²	30	32.1 Å²	32.1	14%	0.14	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.2	-176.4	-179.5	61.5	49.2	0	0	112.4	V814 K842 G843 F844	Q812-V814 HydrophobicContact CG-CG2 4.19Å; Q812-K842 PolarHBondContact NE2-O 3.3Å; Q812-G843 PolarHBondContact NE2-O 3.45Å; Q812-F844 HydrophobicContact CB-CD2 4.16Å
813	Q	90.2	Very high	87.9	Confident	13 Å²	13	33.8 Å²	33.8	6%	0.061	20%	0.195	C	C	.	.			trans	-83.5	126.8	169.6	-53	-51.4	-72.8	0	0	109.7	G811 G843 V845 F860 H861	G811-Q813 PolarHBondContact O-N 2.86Å; G811-Q813 PolarHBondContact O-NE2 3.15Å; Q813-G843 WeakPolarHBondContact CB-O 3.34Å; Q813-G843 WeakPolarHBondContact CG-O 3.14Å; Q813-G843 PolarHBondContact N-O 2.87Å; Q813-V845 HydrophobicContact CG-CG2 3.79Å; Q813-F860 HydrophobicContact CG-CB 4.29Å; Q813-H861 PolarHBondContact OE1-ND1 3.29Å
814	V	84.2	Confident	87.6	Confident	36 Å²	36	36.6 Å²	36.6	22%	0.218	21%	0.21	C	C	.	.			trans	-114	134.8	-176	-178.7	0	0	0	0	108.4	Q812 G817 K818 S864 F1062	Q812-V814 HydrophobicContact CG-CG2 4.19Å; V814-G817 VanDerWaalsContact CG1-C 3.49Å; V814-K818 WeakPolarHBondContact CA-O 3.32Å; V814-K818 WeakPolarHBondContact CG1-O 3.48Å; V814-S864 PolarHBondContact O-OG 3.26Å; V814-S864 VanDerWaalsContact O-OG 3.1Å; V814-F1062 HydrophobicContact CG2-CZ 4.47Å
815	I	81.4	Confident	87.5	Confident	37 Å²	37	43.1 Å²	43.1	19%	0.19	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-125.2	121.7	176.9	-58	175.8	0	0	0	108.6	G817 K818 V820 M863 E867	I815-G817 PolarHBondContact O-N 3.22Å; I815-G817 VanDerWaalsContact O-N 3.15Å; I815-K818 PolarHBondContact N-O 2.92Å; I815-K818 PolarHBondContact O-N 3.31Å; I815-K818 VanDerWaalsContact O-O 3.14Å; I815-V820 HydrophobicContact CD1-CG1 4.44Å; I815-V820 HydrophobicContact CD1-CG2 4.13Å; I815-M863 HydrophobicContact CD1-CB 3.78Å; I815-M863 HydrophobicContact CD1-CE 3.81Å; I815-M863 HydrophobicContact CD1-SD 4.44Å; I815-E867 WeakPolarHBondContact CA-OE2 3.45Å; I815-E867 WeakPolarHBondContact CG2-OE2 3.43Å
816	G	72.2	Confident	87.3	Confident	53 Å²	53	42.6 Å²	42.6	55%	0.546	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	28.8	-177.9	0	0	0	0	0	114.6	K818 E867	G816-K818 VanDerWaalsContact C-N 3.32Å; G816-K818 PolarHBondContact O-N 2.84Å; G816-E867 WeakPolarHBondContact CA-OE1 3.37Å; G816-E867 PolarHBondContact N-OE1 2.91Å; G816-E867 PolarHBondContact N-OE2 3.4Å
817	G	73.2	Confident	87.2	Confident	20 Å²	20	42.5 Å²	42.5	21%	0.206	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	6.1	-177.2	0	0	0	0	0	115.3	V814 I815	V814-G817 VanDerWaalsContact CG1-C 3.49Å; I815-G817 PolarHBondContact O-N 3.22Å; I815-G817 VanDerWaalsContact O-N 3.15Å
818	K	81.2	Confident	87.1	Confident	126 Å²	126	42.8 Å²	42.8	55%	0.548	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-123.8	167.6	176.9	-62.5	-172.7	178.1	-167.7	0	111.3	V814 I815 G816	V814-K818 WeakPolarHBondContact CA-O 3.32Å; V814-K818 WeakPolarHBondContact CG1-O 3.48Å; I815-K818 PolarHBondContact N-O 2.92Å; I815-K818 PolarHBondContact O-N 3.31Å; I815-K818 VanDerWaalsContact O-O 3.14Å; G816-K818 VanDerWaalsContact C-N 3.32Å; G816-K818 PolarHBondContact O-N 2.84Å
819	R	88.2	Confident	87.2	Confident	14 Å²	14	44 Å²	44	5%	0.053	26%	0.257	C	S	.	.	S	Bend	trans	-64.2	166.1	166.8	-61.8	-161.2	-52.3	164.2	2.2	110.8	E760 R837 K842	E760-R819 IonicContact OE1-CZ 3.55Å; E760-R819 IonicContact OE1-NE 3.55Å; E760-R819 IonicContact OE1-NH2 3.49Å; E760-R819 PolarHBondContact OE1-NH2 3.07Å; E760-R819 IonicContact OE2-CZ 2.86Å; E760-R819 IonicContact OE2-NE 2.79Å; E760-R819 PolarHBondContact OE2-NE 3.45Å; E760-R819 IonicContact OE2-NH2 3.58Å; E760-R819 PolarHBondContact OE2-NH2 3.36Å; R819-R837 PolarHBondContact NH1-O 3.41Å; R819-R837 PolarHBondContact NH2-O 3.09Å; R819-K842 HydrophobicContact CB-CB 4.29Å
820	V	91.1	Very high	87.2	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-56.6	125.6	-174.3	-178.8	0	0	0	0	110.7	I815 K842 F860 M863	I815-V820 HydrophobicContact CD1-CG1 4.44Å; I815-V820 HydrophobicContact CD1-CG2 4.13Å; V820-K842 PolarHBondContact N-O 3.35Å; V820-K842 WeakPolarHBondContact O-CD 3.04Å; V820-F860 HydrophobicContact CB-CD1 4.38Å; V820-F860 HydrophobicContact CB-CE1 4.36Å; V820-F860 HydrophobicContact CG1-CD1 3.96Å; V820-F860 HydrophobicContact CG1-CE1 3.81Å; V820-F860 HydrophobicContact CG2-CD1 3.88Å; V820-F860 HydrophobicContact CG2-CE1 4.33Å; V820-F860 HydrophobicContact CG2-CG 4.36Å; V820-M863 HydrophobicContact CG1-CE 4.16Å; V820-M863 HydrophobicContact CG1-SD 4.37Å
821	P	89.9	Confident	87.2	Confident	68 Å²	68	54.9 Å²	54.9	44%	0.442	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-71.8	159.5	-177.9	29.8	-35.6	0	0	0	112	V823	P821-V823 HydrophobicContact CG-CG2 4.47Å
822	D	90.3	Very high	87.3	Confident	72 Å²	72	56.4 Å²	56.4	39%	0.385	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-80.8	118.5	171.4	-67.1	-37.6	0	0	0	110.3	R827 S828 K842	D822-R827 WeakPolarHBondContact CA-O 3.38Å; D822-R827 WeakPolarHBondContact OD1-CA 3.46Å; D822-S828 PolarHBondContact OD1-N 3.33Å; D822-K842 IonicContact OD1-NZ 3.31Å; D822-K842 PolarHBondContact OD1-NZ 3.22Å; D822-K842 IonicContact OD2-NZ 3.35Å; D822-K842 PolarHBondContact OD2-NZ 2.89Å
823	V	86.6	Confident	87.3	Confident	107 Å²	107	58.9 Å²	58.9	65%	0.648	34%	0.338	S	S	*	.			trans	-108.4	-24.2	-175.3	-167.6	0	0	0	0	111.5	P821 R827	P821-V823 HydrophobicContact CG-CG2 4.47Å; V823-R827 PolarHBondContact N-O 2.62Å
824	I	86.7	Confident	87.3	Confident	67 Å²	67	62.8 Å²	62.8	34%	0.344	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-124.7	107.1	-172.5	-54.3	173.5	0	0	0	108.8	G826 R827 V830	I824-G826 VanDerWaalsContact C-N 3.26Å; I824-G826 PolarHBondContact O-N 3.02Å; I824-G826 VanDerWaalsContact O-N 3.08Å; I824-R827 PolarHBondContact N-O 2.68Å; I824-R827 WeakPolarHBondContact O-CG 3.39Å; I824-R827 PolarHBondContact O-N 2.95Å; I824-V830 HydrophobicContact CD1-CG1 4.11Å; I824-V830 HydrophobicContact CG2-CG1 4.25Å
825	N	87.7	Confident	87.5	Confident	144 Å²	144	63.5 Å²	63.5	77%	0.77	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.3	43.3	173.6	-61.8	-7.7	0	0	0	114.9
826	G	87	Confident	87.9	Confident	39 Å²	39	62.8 Å²	62.8	40%	0.402	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	20.4	-179.9	0	0	0	0	0	115.4	I824 G835	I824-G826 VanDerWaalsContact C-N 3.26Å; I824-G826 PolarHBondContact O-N 3.02Å; I824-G826 VanDerWaalsContact O-N 3.08Å; G826-G835 WeakPolarHBondContact O-CA 3.33Å; G826-G835 PolarHBondContact O-N 3.01Å
827	R	90.9	Very high	88.7	Confident	58 Å²	58	62.7 Å²	62.7	22%	0.219	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-136	158.7	170.7	49.7	179.2	179.6	-179.2	0.3	111.2	D822 V823 I824 L829 V830 F832	D822-R827 WeakPolarHBondContact CA-O 3.38Å; D822-R827 WeakPolarHBondContact OD1-CA 3.46Å; V823-R827 PolarHBondContact N-O 2.62Å; I824-R827 PolarHBondContact N-O 2.68Å; I824-R827 WeakPolarHBondContact O-CG 3.39Å; I824-R827 PolarHBondContact O-N 2.95Å; R827-L829 WeakPolarHBondContact CD-O 3.26Å; R827-V830 PolarHBondContact NH1-O 3.02Å; R827-F832 WeakPolarHBondContact CD-O 3.46Å; R827-F832 PolarHBondContact NH1-O 3.46Å
828	S	91.9	Very high	89.7	Confident	9 Å²	9	63.8 Å²	63.8	6%	0.063	36%	0.364	C	S	.	.	S	Bend	trans	-72.2	-50.7	177.4	56.4	0	0	0	0	112	D822 A841	D822-S828 PolarHBondContact OD1-N 3.33Å; S828-A841 WeakPolarHBondContact CB-O 3.35Å; S828-A841 PolarHBondContact OG-O 2.98Å
829	L	92.9	Very high	90.3	Very high	25 Å²	25	57.9 Å²	57.9	13%	0.131	34%	0.338	C	S	.	.	S	Bend	trans	-132.9	155.3	177.2	-64.7	176.7	0	0	0	110.6	R827 H831 F832 F859 F860	R827-L829 WeakPolarHBondContact CD-O 3.26Å; L829-H831 PolarHBondContact O-N 3.38Å; L829-H831 VanDerWaalsContact O-N 3.13Å; L829-F832 HydrophobicContact CB-CD2 3.98Å; L829-F832 HydrophobicContact CB-CE2 4.24Å; L829-F832 HydrophobicContact CD1-CE2 4.23Å; L829-F832 PolarHBondContact O-N 2.84Å; L829-F859 HydrophobicContact CD1-CD1 4.4Å; L829-F859 HydrophobicContact CD2-CD1 3.93Å; L829-F859 HydrophobicContact CD2-CE1 3.94Å; L829-F860 HydrophobicContact CD1-CE1 3.79Å; L829-F860 HydrophobicContact CD1-CE2 4.2Å; L829-F860 HydrophobicContact CD1-CZ 3.6Å; L829-F860 HydrophobicContact CG-CE1 3.91Å; L829-F860 HydrophobicContact CG-CZ 3.93Å
830	V	91.6	Very high	90.5	Very high	79 Å²	79	62.5 Å²	62.5	48%	0.479	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.5	179	-67.9	0	0	0	0	114.4	I824 R827 F832	I824-V830 HydrophobicContact CD1-CG1 4.11Å; I824-V830 HydrophobicContact CG2-CG1 4.25Å; R827-V830 PolarHBondContact NH1-O 3.02Å; V830-F832 VanDerWaalsContact C-N 3.27Å; V830-F832 PolarHBondContact O-N 3.25Å
831	H	92	Very high	90.5	Very high	153 Å²	153	62.4 Å²	62.4	71%	0.708	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-15.3	178.6	-55.7	-65.8	0	0	0	113.6	L829	L829-H831 PolarHBondContact O-N 3.38Å; L829-H831 VanDerWaalsContact O-N 3.13Å
832	F	93.3	Very high	90.7	Very high	31 Å²	31	59.8 Å²	59.8	14%	0.136	34%	0.341	C	S	.	.	S	Bend	trans	-105.9	151.2	-179.7	-59.5	-67.1	0	0	0	111.3	R827 L829 V830 A841 F860	R827-F832 WeakPolarHBondContact CD-O 3.46Å; R827-F832 PolarHBondContact NH1-O 3.46Å; L829-F832 HydrophobicContact CB-CD2 3.98Å; L829-F832 HydrophobicContact CB-CE2 4.24Å; L829-F832 HydrophobicContact CD1-CE2 4.23Å; L829-F832 PolarHBondContact O-N 2.84Å; V830-F832 VanDerWaalsContact C-N 3.27Å; V830-F832 PolarHBondContact O-N 3.25Å; F832-A841 HydrophobicContact CB-CB 3.99Å; F832-A841 HydrophobicContact CD1-CB 3.71Å; F832-A841 HydrophobicContact CD2-CB 4.05Å; F832-A841 HydrophobicContact CE1-CB 4.17Å; F832-A841 HydrophobicContact CE2-CB 4.49Å; F832-A841 HydrophobicContact CG-CB 3.64Å; F832-F860 AromaticContact CE2-CE2 3.91Å; F832-F860 HydrophobicContact CE2-CE2 3.91Å; F832-F860 AromaticContact CE2-CZ 3.82Å; F832-F860 HydrophobicContact CE2-CZ 3.82Å; F832-F860 HydrophobicContact CZ-CE2 4.34Å
833	P	91.4	Very high	90.7	Very high	82 Å²	82	56.3 Å²	56.3	53%	0.532	32%	0.323	S	S	.	.			trans	-65.3	148.6	175.9	20.8	-25.3	0	0	0	111.3	G835 S836	P833-G835 PolarHBondContact O-N 3.49Å; P833-S836 WeakPolarHBondContact O-CB 3.44Å; P833-S836 PolarHBondContact O-N 3.34Å
834	P	89.8	Confident	91.1	Very high	95 Å²	95	51.4 Å²	51.4	62%	0.617	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	135.8	176.4	-20.6	31.8	0	0	0	111.6	S836	P834-S836 VanDerWaalsContact C-N 3.25Å; P834-S836 PolarHBondContact O-N 2.95Å
835	G	87.2	Confident	91.5	Very high	52 Å²	52	48.2 Å²	48.2	54%	0.536	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	6.9	179.2	0	0	0	0	0	115.3	G826 P833 R837	G826-G835 WeakPolarHBondContact O-CA 3.33Å; G826-G835 PolarHBondContact O-N 3.01Å; P833-G835 PolarHBondContact O-N 3.49Å; G835-R837 PolarHBondContact O-N 2.91Å
836	S	90.7	Very high	91.6	Very high	21 Å²	21	41.9 Å²	41.9	15%	0.147	25%	0.246	C	C	.	.			trans	-63.2	127.4	178.7	-171.9	0	0	0	0	112.1	P833 P834 T838 K842	P833-S836 WeakPolarHBondContact O-CB 3.44Å; P833-S836 PolarHBondContact O-N 3.34Å; P834-S836 VanDerWaalsContact C-N 3.25Å; P834-S836 PolarHBondContact O-N 2.95Å; S836-T838 PolarHBondContact OG-OG1 2.94Å; S836-K842 WeakPolarHBondContact O-CE 3.27Å
837	R	89.9	Confident	91.9	Very high	51 Å²	51	42.7 Å²	42.7	19%	0.192	24%	0.241	C	C	.	.			trans	-108.8	6.1	175.9	-62.7	-170.8	-176.4	-107.3	3.1	113.7	I739 E756 E760 R819 G835	I739-R837 HydrophobicContact CD1-CB 4.35Å; I739-R837 HydrophobicContact CG1-CB 4.45Å; E756-R837 VanDerWaalsContact CD-NH1 3.34Å; E756-R837 VanDerWaalsContact CG-NH1 3.25Å; E756-R837 IonicContact OE1-CZ 3.73Å; E756-R837 IonicContact OE1-NH1 3.72Å; E756-R837 PolarHBondContact OE1-NH1 2.88Å; E756-R837 IonicContact OE1-NH2 3.1Å; E756-R837 PolarHBondContact OE1-NH2 2.9Å; E756-R837 IonicContact OE2-NH2 3.9Å; E760-R837 IonicContact OE1-NH1 2.84Å; R819-R837 PolarHBondContact NH1-O 3.41Å; R819-R837 PolarHBondContact NH2-O 3.09Å; G835-R837 PolarHBondContact O-N 2.91Å
838	T	92.9	Very high	92.1	Very high	43 Å²	43	40 Å²	40	26%	0.264	23%	0.231	S	C	.	.	S	Bend	trans	-58.6	153.1	-179.5	61.3	0	0	0	0	111.4	I739 S836 E840 A841 K842	I739-T838 HydrophobicContact CD1-CG2 4.41Å; S836-T838 PolarHBondContact OG-OG1 2.94Å; T838-E840 VanDerWaalsContact C-N 3.33Å; T838-E840 PolarHBondContact O-N 3.46Å; T838-A841 PolarHBondContact O-N 3.01Å; T838-A841 WeakPolarHBondContact OG1-CB 3.46Å; T838-K842 PolarHBondContact O-N 3.46Å
839	P	93.5	Very high	92.2	Very high	2 Å²	2	44 Å²	44	1%	0.013	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-46.2	-179.1	-29.6	37.2	0	0	0	113.7	F732 C735 L767 K842 G843 F844	F732-P839 HydrophobicContact CD1-CB 4.03Å; F732-P839 HydrophobicContact CD1-CG 3.83Å; F732-P839 HydrophobicContact CE1-CB 3.57Å; F732-P839 HydrophobicContact CE1-CG 3.92Å; F732-P839 HydrophobicContact CG-CG 4.44Å; F732-P839 HydrophobicContact CZ-CB 4.02Å; C735-P839 HydrophobicContact CB-CG 3.89Å; L767-P839 HydrophobicContact CD1-CB 4.06Å; L767-P839 HydrophobicContact CD1-CG 4.49Å; L767-P839 HydrophobicContact CD2-CB 3.85Å; L767-P839 HydrophobicContact CD2-CG 3.99Å; P839-K842 CarbonylContact O-C 3.58Å; P839-K842 PolarHBondContact O-N 3.42Å; P839-G843 PolarHBondContact O-N 3.21Å; P839-F844 HydrophobicContact CB-CB 3.83Å; P839-F844 HydrophobicContact CB-CG 4.29Å; P839-F844 VanDerWaalsContact O-CB 3.26Å; P839-F844 WeakPolarHBondContact O-CB 3.48Å; P839-F844 PolarHBondContact O-N 3.27Å
840	E	92.7	Very high	92.2	Very high	112 Å²	112	46.9 Å²	46.9	52%	0.523	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-65.1	-41.5	-177.4	-59.1	179	142.3	0	0	112.5	F732 T838 K842 F860	F732-E840 HydrophobicContact CE2-CG 3.7Å; F732-E840 HydrophobicContact CZ-CG 3.9Å; T838-E840 VanDerWaalsContact C-N 3.33Å; T838-E840 PolarHBondContact O-N 3.46Å; E840-K842 PolarHBondContact O-N 3.25Å; E840-F860 WeakPolarHBondContact O-CE2 3.33Å
841	A	92.6	Very high	92.3	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-66.3	-18.8	178.7	0	0	0	0	0	112.6	S828 F832 T838	S828-A841 WeakPolarHBondContact CB-O 3.35Å; S828-A841 PolarHBondContact OG-O 2.98Å; F832-A841 HydrophobicContact CB-CB 3.99Å; F832-A841 HydrophobicContact CD1-CB 3.71Å; F832-A841 HydrophobicContact CD2-CB 4.05Å; F832-A841 HydrophobicContact CE1-CB 4.17Å; F832-A841 HydrophobicContact CE2-CB 4.49Å; F832-A841 HydrophobicContact CG-CB 3.64Å; T838-A841 PolarHBondContact O-N 3.01Å; T838-A841 WeakPolarHBondContact OG1-CB 3.46Å
842	K	92.8	Very high	92.4	Very high	12 Å²	12	40.6 Å²	40.6	5%	0.052	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-117.8	22.5	-171.5	-67.3	-72.4	-167.2	176.4	0	113.2	Q812 R819 V820 D822 S836 T838 P839 E840	Q812-K842 PolarHBondContact NE2-O 3.3Å; R819-K842 HydrophobicContact CB-CB 4.29Å; V820-K842 PolarHBondContact N-O 3.35Å; V820-K842 WeakPolarHBondContact O-CD 3.04Å; D822-K842 IonicContact OD1-NZ 3.31Å; D822-K842 PolarHBondContact OD1-NZ 3.22Å; D822-K842 IonicContact OD2-NZ 3.35Å; D822-K842 PolarHBondContact OD2-NZ 2.89Å; S836-K842 WeakPolarHBondContact O-CE 3.27Å; T838-K842 PolarHBondContact O-N 3.46Å; P839-K842 CarbonylContact O-C 3.58Å; P839-K842 PolarHBondContact O-N 3.42Å; E840-K842 PolarHBondContact O-N 3.25Å
843	G	91.1	Very high	92.5	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	17.8	168	0	0	0	0	0	115.9	Q812 Q813 P839	Q812-G843 PolarHBondContact NE2-O 3.45Å; Q813-G843 WeakPolarHBondContact CB-O 3.34Å; Q813-G843 WeakPolarHBondContact CG-O 3.14Å; Q813-G843 PolarHBondContact N-O 2.87Å; P839-G843 PolarHBondContact O-N 3.21Å
844	F	94.7	Very high	92.7	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.013	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.7	167.3	-172	-99	0	0	0	110.6	F732 L767 I770 Q812 P839	F732-F844 AromaticContact CE1-CD1 3.57Å; F732-F844 HydrophobicContact CE1-CD1 3.57Å; F732-F844 AromaticContact CE1-CE1 3.67Å; F732-F844 HydrophobicContact CE1-CE1 3.67Å; F732-F844 HydrophobicContact CE1-CG 4.3Å; F732-F844 HydrophobicContact CE1-CZ 4.48Å; F732-F844 AromaticContact CZ-CD1 3.58Å; F732-F844 HydrophobicContact CZ-CD1 3.58Å; F732-F844 AromaticContact CZ-CE1 3.86Å; F732-F844 HydrophobicContact CZ-CE1 3.86Å; L767-F844 HydrophobicContact CB-CD2 3.94Å; L767-F844 HydrophobicContact CB-CE2 3.97Å; L767-F844 HydrophobicContact CD1-CB 4.32Å; L767-F844 HydrophobicContact CD1-CD2 3.94Å; L767-F844 HydrophobicContact CD1-CG 4.41Å; L767-F844 HydrophobicContact CD2-CD2 3.72Å; L767-F844 HydrophobicContact CD2-CE2 3.87Å; L767-F844 HydrophobicContact CD2-CG 4.14Å; L767-F844 HydrophobicContact CD2-CZ 4.41Å; L767-F844 HydrophobicContact CG-CD2 4.06Å; L767-F844 HydrophobicContact CG-CE2 4.37Å; I770-F844 HydrophobicContact CG2-CZ 4.19Å; Q812-F844 HydrophobicContact CB-CD2 4.16Å; P839-F844 HydrophobicContact CB-CB 3.83Å; P839-F844 HydrophobicContact CB-CG 4.29Å; P839-F844 VanDerWaalsContact O-CB 3.26Å; P839-F844 WeakPolarHBondContact O-CB 3.48Å; P839-F844 PolarHBondContact O-N 3.27Å
845	V	94.1	Very high	93	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	102.4	178.3	179.9	0	0	0	0	108.9	V810 G811 Q813 L853 E857	V810-V845 HydrophobicContact CB-CB 4.05Å; V810-V845 HydrophobicContact CB-CG1 3.78Å; V810-V845 HydrophobicContact CG1-CB 4.48Å; V810-V845 HydrophobicContact CG1-CG1 4.47Å; V810-V845 HydrophobicContact CG2-CG1 4.1Å; G811-V845 PolarHBondContact N-O 3.37Å; G811-V845 PolarHBondContact O-N 3.28Å; G811-V845 VanDerWaalsContact O-N 3.11Å; Q813-V845 HydrophobicContact CG-CG2 3.79Å; V845-L853 HydrophobicContact CG1-CD2 3.54Å; V845-E857 HydrophobicContact CB-CB 4.46Å; V845-E857 HydrophobicContact CB-CG 4.32Å; V845-E857 HydrophobicContact CG1-CB 3.99Å; V845-E857 HydrophobicContact CG1-CG 4.05Å; V845-E857 HydrophobicContact CG2-CB 3.96Å; V845-E857 HydrophobicContact CG2-CG 4.11Å
846	G	91	Very high	93.4	Very high	12 Å²	12	39.1 Å²	39.1	12%	0.124	22%	0.223	C	C	.	.			trans	-78.2	-28.2	-179.4	0	0	0	0	0	112.2	K724 C809 E857	K724-G846 WeakPolarHBondContact CE-O 3.48Å; K724-G846 PolarHBondContact NZ-O 2.94Å; C809-G846 WeakPolarHBondContact CB-O 3.37Å; G846-E857 PolarHBondContact N-OE1 3.05Å
847	N	93.6	Very high	93.6	Very high	56 Å²	56	39 Å²	39	30%	0.299	22%	0.22	S	C	.	.	S	Bend	trans	-73.2	158.4	176.8	-73.7	-45.4	0	0	0	113.1	V810 S851 G852 L853 E857	V810-N847 WeakPolarHBondContact CG2-O 3.39Å; V810-N847 PolarHBondContact N-O 3.03Å; V810-N847 VanDerWaalsContact N-O 3.11Å; N847-S851 WeakPolarHBondContact CB-OG 3.24Å; N847-S851 PolarHBondContact OD1-OG 3.45Å; N847-G852 VanDerWaalsContact CB-O 3.28Å; N847-G852 WeakPolarHBondContact CB-O 2.91Å; N847-L853 HydrophobicContact CB-CD2 4.09Å; N847-E857 PolarHBondContact N-OE1 2.67Å; N847-E857 PolarHBondContact ND2-OE1 3.37Å; N847-E857 PolarHBondContact ND2-OE2 3.08Å
848	S	93.6	Very high	93.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.014	24%	0.238	C	C	.	.			trans	-101.7	169.3	170.5	64.3	0	0	0	0	110.3	Q805 M806 I807 Y850 S851 G852	Q805-S848 WeakPolarHBondContact O-CB 3.32Å; M806-S848 WeakPolarHBondContact O-CB 3.39Å; M806-S848 PolarHBondContact O-OG 2.85Å; I807-S848 WeakPolarHBondContact O-CB 3.23Å; I807-S848 PolarHBondContact O-OG 3.24Å; S848-Y850 PolarHBondContact O-N 2.88Å; S848-S851 PolarHBondContact N-OG 2.85Å; S848-S851 PolarHBondContact O-N 3.38Å; S848-S851 PolarHBondContact O-OG 3.44Å; S848-S851 PolarHBondContact OG-N 3.39Å; S848-S851 PolarHBondContact OG-OG 3.13Å; S848-G852 PolarHBondContact O-N 3.09Å
849	F	94.5	Very high	94	Very high	91 Å²	91	45.8 Å²	45.8	40%	0.399	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.3	173.7	-64.1	-60	0	0	0	112.4	Q805 M806 V810 L853 H861	Q805-F849 HydrophobicContact CB-CD2 4.41Å; Q805-F849 HydrophobicContact CB-CE2 4.06Å; Q805-F849 PolarHBondContact O-N 3Å; M806-F849 HydrophobicContact CG-CD2 4.1Å; V810-F849 HydrophobicContact CG1-CZ 4.47Å; V810-F849 HydrophobicContact CG2-CD1 4.42Å; V810-F849 HydrophobicContact CG2-CD2 4.36Å; V810-F849 HydrophobicContact CG2-CE1 4.16Å; V810-F849 HydrophobicContact CG2-CE2 4.1Å; V810-F849 HydrophobicContact CG2-CZ 4Å; F849-L853 HydrophobicContact CE1-CD1 4.31Å; F849-H861 AromaticContact CE1-NE2 3.75Å; F849-H861 AromaticContact CZ-CE1 3.96Å; F849-H861 AromaticContact CZ-NE2 3.72Å
850	Y	94.1	Very high	94	Very high	86 Å²	86	45.8 Å²	45.8	34%	0.337	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-45.8	174.4	179.6	-89.4	0	0	0	112.5	L711 V714 M715 P716 M806 S848 G852	L711-Y850 HydrophobicContact CD1-CD2 3.99Å; L711-Y850 HydrophobicContact CD1-CE2 3.86Å; L711-Y850 HydrophobicContact CG-CE2 4.12Å; V714-Y850 HydrophobicContact CG2-CD2 4.19Å; M715-Y850 HydrophobicContact CB-CE2 4.03Å; M715-Y850 HydrophobicContact CG-CE1 4.44Å; M715-Y850 HydrophobicContact CG-CE2 4.3Å; M715-Y850 WeakPolarHBondContact CG-OH 3.48Å; P716-Y850 VanDerWaalsContact CD-CE1 3.46Å; P716-Y850 HydrophobicContact CG-CD1 3.89Å; P716-Y850 HydrophobicContact CG-CE1 4.13Å; M806-Y850 WeakPolarHBondContact O-CB 3.48Å; M806-Y850 PolarHBondContact O-N 3.02Å; M806-Y850 VanDerWaalsContact O-N 3.13Å; S848-Y850 PolarHBondContact O-N 2.88Å; Y850-G852 PolarHBondContact O-N 3.27Å
851	S	92.3	Very high	94	Very high	64 Å²	64	43.1 Å²	43.1	45%	0.448	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.7	-178.8	64.1	0	0	0	0	113.4	N847 S848	N847-S851 WeakPolarHBondContact CB-OG 3.24Å; N847-S851 PolarHBondContact OD1-OG 3.45Å; S848-S851 PolarHBondContact N-OG 2.85Å; S848-S851 PolarHBondContact O-N 3.38Å; S848-S851 PolarHBondContact O-OG 3.44Å; S848-S851 PolarHBondContact OG-N 3.39Å; S848-S851 PolarHBondContact OG-OG 3.13Å
852	G	94.7	Very high	94.1	Very high	36 Å²	36	45.2 Å²	45.2	37%	0.371	25%	0.252	S	S	.	.			trans	84.9	144.4	-172.9	0	0	0	0	0	112.1	N847 S848 Y850	N847-G852 VanDerWaalsContact CB-O 3.28Å; N847-G852 WeakPolarHBondContact CB-O 2.91Å; S848-G852 PolarHBondContact O-N 3.09Å; Y850-G852 PolarHBondContact O-N 3.27Å
853	L	95.6	Very high	94	Very high	41 Å²	41	47.3 Å²	47.3	22%	0.215	26%	0.263	C	S	.	.			trans	-90.7	137.7	179.5	-56.2	-175.1	0	0	0	110.4	V810 V845 N847 F849 E857 F858 H861	V810-L853 HydrophobicContact CG2-CD2 4.26Å; V845-L853 HydrophobicContact CG1-CD2 3.54Å; N847-L853 HydrophobicContact CB-CD2 4.09Å; F849-L853 HydrophobicContact CE1-CD1 4.31Å; L853-E857 HydrophobicContact CB-CB 4.22Å; L853-F858 HydrophobicContact CB-CB 4.14Å; L853-H861 HydrophobicContact CD1-CB 4.2Å
854	S	95.7	Very high	93.7	Very high	41 Å²	41	48.8 Å²	48.8	29%	0.287	27%	0.273	S	S	.	.			trans	-65.9	161	168.6	64.3	0	0	0	0	111.1	S856 E857 F858	S854-S856 VanDerWaalsContact C-N 3.31Å; S854-S856 PolarHBondContact O-N 3.13Å; S854-S856 PolarHBondContact OG-OG 3.39Å; S854-E857 WeakPolarHBondContact CB-OE2 3.5Å; S854-E857 PolarHBondContact N-OE2 2.95Å; S854-E857 PolarHBondContact O-N 2.91Å; S854-E857 WeakPolarHBondContact OG-CB 3.3Å; S854-E857 VanDerWaalsContact OG-CD 3.27Å; S854-E857 WeakPolarHBondContact OG-CG 3.23Å; S854-E857 PolarHBondContact OG-OE2 3.48Å; S854-F858 WeakPolarHBondContact O-CB 3.4Å; S854-F858 PolarHBondContact O-N 2.81Å
855	P	96.2	Very high	93.3	Very high	115 Å²	115	50.7 Å²	50.7	75%	0.747	29%	0.293	S	S	*	.	H	α-helix	trans	-56.5	-38.8	-177.6	-28.8	36.4	0	0	0	114.6	F859	P855-F859 WeakPolarHBondContact O-CB 3.16Å; P855-F859 PolarHBondContact O-N 3.3Å
856	S	94.8	Very high	93	Very high	33 Å²	33	59.4 Å²	59.4	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-68.3	-46.1	176.2	46.8	0	0	0	0	111.8	S854 F859 F860	S854-S856 VanDerWaalsContact C-N 3.31Å; S854-S856 PolarHBondContact O-N 3.13Å; S854-S856 PolarHBondContact OG-OG 3.39Å; S856-F859 PolarHBondContact O-N 3.04Å; S856-F860 WeakPolarHBondContact O-CD2 3.41Å; S856-F860 WeakPolarHBondContact O-CG 3.49Å; S856-F860 PolarHBondContact O-N 3.18Å
857	E	94.8	Very high	92.6	Very high	19 Å²	19	61 Å²	61	9%	0.089	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-44.6	175.8	-72.6	173.7	131.6	0	0	112.1	V845 G846 N847 L853 S854 F859 F860 H861	V845-E857 HydrophobicContact CB-CB 4.46Å; V845-E857 HydrophobicContact CB-CG 4.32Å; V845-E857 HydrophobicContact CG1-CB 3.99Å; V845-E857 HydrophobicContact CG1-CG 4.05Å; V845-E857 HydrophobicContact CG2-CB 3.96Å; V845-E857 HydrophobicContact CG2-CG 4.11Å; G846-E857 PolarHBondContact N-OE1 3.05Å; N847-E857 PolarHBondContact N-OE1 2.67Å; N847-E857 PolarHBondContact ND2-OE1 3.37Å; N847-E857 PolarHBondContact ND2-OE2 3.08Å; L853-E857 HydrophobicContact CB-CB 4.22Å; S854-E857 WeakPolarHBondContact CB-OE2 3.5Å; S854-E857 PolarHBondContact N-OE2 2.95Å; S854-E857 PolarHBondContact O-N 2.91Å; S854-E857 WeakPolarHBondContact OG-CB 3.3Å; S854-E857 VanDerWaalsContact OG-CD 3.27Å; S854-E857 WeakPolarHBondContact OG-CG 3.23Å; S854-E857 PolarHBondContact OG-OE2 3.48Å; E857-F859 VanDerWaalsContact C-N 3.31Å; E857-F859 PolarHBondContact O-N 2.85Å; E857-F860 PolarHBondContact O-N 3.37Å; E857-H861 WeakPolarHBondContact O-CB 3.31Å; E857-H861 PolarHBondContact O-N 3.35Å
858	F	96	Very high	91.8	Very high	128 Å²	128	59.6 Å²	59.6	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-59.6	-44.1	176.3	177.2	-100.6	0	0	0	111	L853 S854 H861 A862	L853-F858 HydrophobicContact CB-CB 4.14Å; S854-F858 WeakPolarHBondContact O-CB 3.4Å; S854-F858 PolarHBondContact O-N 2.81Å; F858-H861 PolarHBondContact O-N 2.91Å; F858-A862 WeakPolarHBondContact O-CB 3.44Å; F858-A862 PolarHBondContact O-N 3.2Å
859	F	94.9	Very high	91.3	Very high	107 Å²	107	65.7 Å²	65.7	47%	0.469	36%	0.361	S	S	.	.	H	α-helix	trans	-62.8	-47.1	177.8	-167.5	-95.1	0	0	0	111.6	L829 P855 S856 E857 H861 A862 M863	L829-F859 HydrophobicContact CD1-CD1 4.4Å; L829-F859 HydrophobicContact CD2-CD1 3.93Å; L829-F859 HydrophobicContact CD2-CE1 3.94Å; P855-F859 WeakPolarHBondContact O-CB 3.16Å; P855-F859 PolarHBondContact O-N 3.3Å; S856-F859 PolarHBondContact O-N 3.04Å; E857-F859 VanDerWaalsContact C-N 3.31Å; E857-F859 PolarHBondContact O-N 2.85Å; F859-H861 VanDerWaalsContact C-N 3.33Å; F859-H861 PolarHBondContact O-N 2.68Å; F859-A862 PolarHBondContact O-N 3.22Å; F859-M863 HydrophobicContact CD1-CG 4.09Å; F859-M863 HydrophobicContact CD1-SD 3.7Å; F859-M863 HydrophobicContact CE1-CG 3.93Å; F859-M863 HydrophobicContact CE1-SD 3.53Å; F859-M863 VanDerWaalsContact CE1-SD 3.53Å; F859-M863 WeakPolarHBondContact O-CG 3.25Å; F859-M863 PolarHBondContact O-N 3.32Å
860	F	93.8	Very high	90.8	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.009	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-39.2	176.4	-65.3	-43.3	0	0	0	112.6	Q813 V820 L829 F832 E840 S856 E857 M863 S864	Q813-F860 HydrophobicContact CG-CB 4.29Å; V820-F860 HydrophobicContact CB-CD1 4.38Å; V820-F860 HydrophobicContact CB-CE1 4.36Å; V820-F860 HydrophobicContact CG1-CD1 3.96Å; V820-F860 HydrophobicContact CG1-CE1 3.81Å; V820-F860 HydrophobicContact CG2-CD1 3.88Å; V820-F860 HydrophobicContact CG2-CE1 4.33Å; V820-F860 HydrophobicContact CG2-CG 4.36Å; L829-F860 HydrophobicContact CD1-CE1 3.79Å; L829-F860 HydrophobicContact CD1-CE2 4.2Å; L829-F860 HydrophobicContact CD1-CZ 3.6Å; L829-F860 HydrophobicContact CG-CE1 3.91Å; L829-F860 HydrophobicContact CG-CZ 3.93Å; F832-F860 AromaticContact CE2-CE2 3.91Å; F832-F860 HydrophobicContact CE2-CE2 3.91Å; F832-F860 AromaticContact CE2-CZ 3.82Å; F832-F860 HydrophobicContact CE2-CZ 3.82Å; F832-F860 HydrophobicContact CZ-CE2 4.34Å; E840-F860 WeakPolarHBondContact O-CE2 3.33Å; S856-F860 WeakPolarHBondContact O-CD2 3.41Å; S856-F860 WeakPolarHBondContact O-CG 3.49Å; S856-F860 PolarHBondContact O-N 3.18Å; E857-F860 PolarHBondContact O-N 3.37Å; F860-M863 HydrophobicContact CD1-SD 4.03Å; F860-M863 PolarHBondContact O-N 3.39Å; F860-S864 PolarHBondContact O-N 2.8Å
861	H	93.4	Very high	89.9	Confident	57 Å²	57	62.5 Å²	62.5	26%	0.264	36%	0.356	S	S	.	.	H	α-helix	trans	-63.9	-43.7	174.8	-173.9	56.4	0	0	0	111.7	Q813 F849 L853 E857 F858 F859 M863 S864 G865	Q813-H861 PolarHBondContact OE1-ND1 3.29Å; F849-H861 AromaticContact CE1-NE2 3.75Å; F849-H861 AromaticContact CZ-CE1 3.96Å; F849-H861 AromaticContact CZ-NE2 3.72Å; L853-H861 HydrophobicContact CD1-CB 4.2Å; E857-H861 WeakPolarHBondContact O-CB 3.31Å; E857-H861 PolarHBondContact O-N 3.35Å; F858-H861 PolarHBondContact O-N 2.91Å; F859-H861 VanDerWaalsContact C-N 3.33Å; F859-H861 PolarHBondContact O-N 2.68Å; H861-M863 VanDerWaalsContact C-N 3.31Å; H861-M863 PolarHBondContact O-N 2.82Å; H861-S864 PolarHBondContact O-N 2.94Å; H861-G865 PolarHBondContact O-N 3.08Å
862	A	93.8	Very high	89	Confident	44 Å²	44	62.2 Å²	62.2	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-35.1	176.1	0	0	0	0	0	112.6	F858 F859 R866	F858-A862 WeakPolarHBondContact O-CB 3.44Å; F858-A862 PolarHBondContact O-N 3.2Å; F859-A862 PolarHBondContact O-N 3.22Å; A862-R866 WeakPolarHBondContact O-CB 3.41Å; A862-R866 PolarHBondContact O-N 3.33Å
863	M	90.7	Very high	88.3	Confident	57 Å²	57	64.1 Å²	64.1	28%	0.281	36%	0.364	S	S	.	.	H	α-helix	trans	-61.2	-50.9	174.6	-70.3	174.6	78.1	0	0	111.5	I815 V820 F859 F860 H861 R866 E867	I815-M863 HydrophobicContact CD1-CB 3.78Å; I815-M863 HydrophobicContact CD1-CE 3.81Å; I815-M863 HydrophobicContact CD1-SD 4.44Å; V820-M863 HydrophobicContact CG1-CE 4.16Å; V820-M863 HydrophobicContact CG1-SD 4.37Å; F859-M863 HydrophobicContact CD1-CG 4.09Å; F859-M863 HydrophobicContact CD1-SD 3.7Å; F859-M863 HydrophobicContact CE1-CG 3.93Å; F859-M863 HydrophobicContact CE1-SD 3.53Å; F859-M863 VanDerWaalsContact CE1-SD 3.53Å; F859-M863 WeakPolarHBondContact O-CG 3.25Å; F859-M863 PolarHBondContact O-N 3.32Å; F860-M863 HydrophobicContact CD1-SD 4.03Å; F860-M863 PolarHBondContact O-N 3.39Å; H861-M863 VanDerWaalsContact C-N 3.31Å; H861-M863 PolarHBondContact O-N 2.82Å; M863-R866 PolarHBondContact O-N 3.07Å; M863-E867 PolarHBondContact O-N 2.91Å
864	S	85.3	Confident	87.5	Confident	31 Å²	31	66.8 Å²	66.8	22%	0.217	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-41.1	179.1	-171.7	0	0	0	0	111.7	V814 F860 H861 R866 E867 G868	V814-S864 PolarHBondContact O-OG 3.26Å; V814-S864 VanDerWaalsContact O-OG 3.1Å; F860-S864 PolarHBondContact O-N 2.8Å; H861-S864 PolarHBondContact O-N 2.94Å; S864-R866 VanDerWaalsContact C-N 3.34Å; S864-R866 PolarHBondContact O-N 3.27Å; S864-E867 WeakPolarHBondContact O-CB 3.46Å; S864-E867 PolarHBondContact O-N 2.98Å; S864-G868 PolarHBondContact O-N 2.83Å
865	G	85.8	Confident	86.5	Confident	42 Å²	42	67 Å²	67	43%	0.433	38%	0.378	S	S	.	.	H	α-helix	trans	-61.3	-39.5	174.9	0	0	0	0	0	113.4	H861 G868 L869	H861-G865 PolarHBondContact O-N 3.08Å; G865-G868 PolarHBondContact O-N 3.41Å; G865-L869 PolarHBondContact O-N 3.37Å
866	R	89.1	Confident	85.5	Confident	183 Å²	183	65.3 Å²	65.3	69%	0.691	37%	0.365	S	S	*	.	H	α-helix	trans	-66.6	-36.9	177.7	-176.7	172.9	-74.1	-174.9	-2.3	112.3	A862 M863 S864 G868 L869 T870	A862-R866 WeakPolarHBondContact O-CB 3.41Å; A862-R866 PolarHBondContact O-N 3.33Å; M863-R866 PolarHBondContact O-N 3.07Å; S864-R866 VanDerWaalsContact C-N 3.34Å; S864-R866 PolarHBondContact O-N 3.27Å; R866-G868 VanDerWaalsContact C-N 3.34Å; R866-G868 PolarHBondContact O-N 3.16Å; R866-L869 PolarHBondContact O-N 3.26Å; R866-T870 HydrophobicContact CG-CG2 4.28Å; R866-T870 WeakPolarHBondContact O-CG2 3.42Å; R866-T870 PolarHBondContact O-N 3.43Å; R866-T870 PolarHBondContact O-OG1 3.19Å; R866-T870 VanDerWaalsContact O-OG1 3.08Å
867	E	82.5	Confident	84.8	Confident	46 Å²	46	67 Å²	67	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-56.6	-48.6	175.7	-174.8	179.6	-175.9	0	0	111	I815 G816 M863 S864 L869 T870 D871	I815-E867 WeakPolarHBondContact CA-OE2 3.45Å; I815-E867 WeakPolarHBondContact CG2-OE2 3.43Å; G816-E867 WeakPolarHBondContact CA-OE1 3.37Å; G816-E867 PolarHBondContact N-OE1 2.91Å; G816-E867 PolarHBondContact N-OE2 3.4Å; M863-E867 PolarHBondContact O-N 2.91Å; S864-E867 WeakPolarHBondContact O-CB 3.46Å; S864-E867 PolarHBondContact O-N 2.98Å; E867-L869 VanDerWaalsContact C-N 3.33Å; E867-L869 PolarHBondContact O-N 3.3Å; E867-T870 WeakPolarHBondContact CA-OG1 3.37Å; E867-T870 PolarHBondContact O-N 3.16Å; E867-T870 PolarHBondContact O-OG1 2.77Å; E867-D871 WeakPolarHBondContact O-CB 3.31Å; E867-D871 PolarHBondContact O-N 3.43Å
868	G	76.4	Confident	84.1	Confident	27 Å²	27	69.9 Å²	69.9	28%	0.278	40%	0.398	S	S	.	.	H	α-helix	trans	-59.2	-39.8	177.9	0	0	0	0	0	113.7	S864 G865 R866 T872	S864-G868 PolarHBondContact O-N 2.83Å; G865-G868 PolarHBondContact O-N 3.41Å; R866-G868 VanDerWaalsContact C-N 3.34Å; R866-G868 PolarHBondContact O-N 3.16Å; G868-T872 PolarHBondContact O-N 3.38Å; G868-T872 VanDerWaalsContact O-N 3.14Å; G868-T872 PolarHBondContact O-OG1 2.98Å
869	L	83.1	Confident	83.4	Confident	130 Å²	130	63.9 Å²	63.9	68%	0.681	37%	0.371	S	S	*	.	H	α-helix	trans	-66.7	-44.7	175.2	-68.5	172.8	0	0	0	111.9	G865 R866 E867 T872 A873	G865-L869 PolarHBondContact O-N 3.37Å; R866-L869 PolarHBondContact O-N 3.26Å; E867-L869 VanDerWaalsContact C-N 3.33Å; E867-L869 PolarHBondContact O-N 3.3Å; L869-T872 PolarHBondContact O-N 3.35Å; L869-A873 PolarHBondContact O-N 3.09Å
870	T	83.8	Confident	82.9	Confident	68 Å²	68	60.4 Å²	60.4	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-39.2	178.7	50.3	0	0	0	0	112.2	R866 E867 T872 A873 V874	R866-T870 HydrophobicContact CG-CG2 4.28Å; R866-T870 WeakPolarHBondContact O-CG2 3.42Å; R866-T870 PolarHBondContact O-N 3.43Å; R866-T870 PolarHBondContact O-OG1 3.19Å; R866-T870 VanDerWaalsContact O-OG1 3.08Å; E867-T870 WeakPolarHBondContact CA-OG1 3.37Å; E867-T870 PolarHBondContact O-N 3.16Å; E867-T870 PolarHBondContact O-OG1 2.77Å; T870-T872 VanDerWaalsContact C-N 3.33Å; T870-T872 PolarHBondContact O-N 2.99Å; T870-A873 PolarHBondContact O-N 3.26Å; T870-V874 WeakPolarHBondContact O-CG2 3.43Å; T870-V874 PolarHBondContact O-N 3.14Å
871	D	75.9	Confident	82.5	Confident	41 Å²	41	64.6 Å²	64.6	22%	0.219	38%	0.382	C	S	.	.	H	α-helix	trans	-63.4	-41.6	177.4	-96.9	-6.7	0	0	0	111.4	E867 K875	E867-D871 WeakPolarHBondContact O-CB 3.31Å; E867-D871 PolarHBondContact O-N 3.43Å; D871-K875 HydrophobicContact CB-CD 4.31Å; D871-K875 VanDerWaalsContact CG-CE 3.41Å; D871-K875 WeakPolarHBondContact O-CB 3.21Å; D871-K875 VanDerWaalsContact O-CG 3.26Å; D871-K875 WeakPolarHBondContact O-CG 3.45Å; D871-K875 PolarHBondContact O-N 3.1Å; D871-K875 VanDerWaalsContact OD1-CE 3.27Å; D871-K875 WeakPolarHBondContact OD1-CE 3.19Å; D871-K875 IonicContact OD1-NZ 2.69Å; D871-K875 PolarHBondContact OD1-NZ 2.88Å; D871-K875 WeakPolarHBondContact OD2-CE 3.26Å; D871-K875 IonicContact OD2-NZ 3.01Å; D871-K875 PolarHBondContact OD2-NZ 2.8Å
872	T	73.2	Confident	82.2	Confident	59 Å²	59	62.2 Å²	62.2	36%	0.362	37%	0.372	S	S	.	.	H	α-helix	trans	-61.3	-48.2	174.6	-53.9	0	0	0	0	110.3	G868 L869 T870 T876	G868-T872 PolarHBondContact O-N 3.38Å; G868-T872 VanDerWaalsContact O-N 3.14Å; G868-T872 PolarHBondContact O-OG1 2.98Å; L869-T872 PolarHBondContact O-N 3.35Å; T870-T872 VanDerWaalsContact C-N 3.33Å; T870-T872 PolarHBondContact O-N 2.99Å; T872-T876 WeakPolarHBondContact O-CB 2.93Å; T872-T876 PolarHBondContact O-N 2.74Å; T872-T876 PolarHBondContact O-OG1 3.23Å
873	A	79.6	Confident	82	Confident	75 Å²	75	61.3 Å²	61.3	62%	0.62	36%	0.36	S	S	*	.	H	α-helix	trans	-64	-44.5	-178.4	0	0	0	0	0	113.3	L869 T870	L869-A873 PolarHBondContact O-N 3.09Å; T870-A873 PolarHBondContact O-N 3.26Å
874	V	78.1	Confident	81.8	Confident	98 Å²	98	60.9 Å²	60.9	59%	0.594	36%	0.355	S	S	*	.	H	α-helix	trans	-77.8	-45.8	-175.4	176.6	0	0	0	0	111.6	T870 T876 A877	T870-V874 WeakPolarHBondContact O-CG2 3.43Å; T870-V874 PolarHBondContact O-N 3.14Å; V874-T876 VanDerWaalsContact C-N 3.29Å; V874-T876 PolarHBondContact O-N 3.22Å; V874-A877 PolarHBondContact O-N 2.8Å
875	K	74.5	Confident	82	Confident	46 Å²	46	60 Å²	60	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-73.3	-19.1	-173.3	-63	174.4	-173.4	166.1	0	113.2	D871 A877 D878 T879 T1058	D871-K875 HydrophobicContact CB-CD 4.31Å; D871-K875 VanDerWaalsContact CG-CE 3.41Å; D871-K875 WeakPolarHBondContact O-CB 3.21Å; D871-K875 VanDerWaalsContact O-CG 3.26Å; D871-K875 WeakPolarHBondContact O-CG 3.45Å; D871-K875 PolarHBondContact O-N 3.1Å; D871-K875 VanDerWaalsContact OD1-CE 3.27Å; D871-K875 WeakPolarHBondContact OD1-CE 3.19Å; D871-K875 IonicContact OD1-NZ 2.69Å; D871-K875 PolarHBondContact OD1-NZ 2.88Å; D871-K875 WeakPolarHBondContact OD2-CE 3.26Å; D871-K875 IonicContact OD2-NZ 3.01Å; D871-K875 PolarHBondContact OD2-NZ 2.8Å; K875-A877 VanDerWaalsContact C-N 3.3Å; K875-A877 PolarHBondContact O-N 3.17Å; K875-D878 PolarHBondContact O-N 3.07Å; K875-T879 WeakPolarHBondContact O-CG2 3.3Å; K875-T879 PolarHBondContact O-N 3.04Å; K875-T879 PolarHBondContact O-OG1 3.22Å; K875-T1058 HydrophobicContact CB-CG2 3.4Å; K875-T1058 VanDerWaalsContact CB-CG2 3.4Å; K875-T1058 HydrophobicContact CD-CG2 3.75Å; K875-T1058 HydrophobicContact CG-CG2 4.21Å; K875-T1058 PolarHBondContact NZ-O 3.37Å
876	T	75.7	Confident	82.3	Confident	78 Å²	78	58 Å²	58	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-36.4	176.8	-56.2	0	0	0	0	112.1	T872 V874 T879 G880	T872-T876 WeakPolarHBondContact O-CB 2.93Å; T872-T876 PolarHBondContact O-N 2.74Å; T872-T876 PolarHBondContact O-OG1 3.23Å; V874-T876 VanDerWaalsContact C-N 3.29Å; V874-T876 PolarHBondContact O-N 3.22Å; T876-T879 WeakPolarHBondContact CA-OG1 3.11Å; T876-T879 PolarHBondContact O-OG1 2.75Å; T876-T879 VanDerWaalsContact O-OG1 3.12Å; T876-G880 PolarHBondContact O-N 3.03Å; T876-G880 VanDerWaalsContact O-N 3.09Å
877	A	79.7	Confident	82.4	Confident	69 Å²	69	51 Å²	51	57%	0.57	30%	0.304	S	S	*	.	H	α-helix	trans	-66.9	-43.2	177.4	0	0	0	0	0	112	V874 K875 Y881	V874-A877 PolarHBondContact O-N 2.8Å; K875-A877 VanDerWaalsContact C-N 3.3Å; K875-A877 PolarHBondContact O-N 3.17Å; A877-Y881 WeakPolarHBondContact O-CB 3.45Å; A877-Y881 PolarHBondContact O-N 3.33Å; A877-Y881 VanDerWaalsContact O-N 3.07Å
878	D	80	Confident	82.7	Confident	80 Å²	80	49.9 Å²	49.9	43%	0.428	30%	0.298	S	S	.	.	H	α-helix	trans	-67.2	-44.7	-179.1	-82	-4.9	0	0	0	112	K875 Y881 M882	K875-D878 PolarHBondContact O-N 3.07Å; D878-Y881 PolarHBondContact O-N 3.26Å; D878-M882 WeakPolarHBondContact O-CB 3.49Å; D878-M882 PolarHBondContact O-N 2.97Å
879	T	82.3	Confident	83.4	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-42.4	179.1	49.4	0	0	0	0	111.8	K875 T876 Y881 M882 Q883 A1054 T1058 V1076	K875-T879 WeakPolarHBondContact O-CG2 3.3Å; K875-T879 PolarHBondContact O-N 3.04Å; K875-T879 PolarHBondContact O-OG1 3.22Å; T876-T879 WeakPolarHBondContact CA-OG1 3.11Å; T876-T879 PolarHBondContact O-OG1 2.75Å; T876-T879 VanDerWaalsContact O-OG1 3.12Å; T879-Y881 PolarHBondContact O-N 3.45Å; T879-M882 WeakPolarHBondContact O-CB 3.47Å; T879-M882 PolarHBondContact O-N 3.13Å; T879-Q883 WeakPolarHBondContact O-CB 3.41Å; T879-Q883 PolarHBondContact O-N 2.84Å; T879-A1054 HydrophobicContact CG2-CB 4.24Å; T879-A1054 VanDerWaalsContact CG2-O 3.31Å; T879-A1054 WeakPolarHBondContact CG2-O 3.08Å; T879-T1058 HydrophobicContact CG2-CG2 4.31Å; T879-V1076 HydrophobicContact CG2-CB 4.48Å; T879-V1076 HydrophobicContact CG2-CG1 3.77Å; T879-V1076 HydrophobicContact CG2-CG2 3.85Å
880	G	84.1	Confident	83.9	Confident	35 Å²	35	42.7 Å²	42.7	36%	0.361	25%	0.254	S	S	.	.	H	α-helix	trans	-63.6	-38	174.8	0	0	0	0	0	113.2	T876 R884	T876-G880 PolarHBondContact O-N 3.03Å; T876-G880 VanDerWaalsContact O-N 3.09Å; G880-R884 PolarHBondContact O-N 3.11Å
881	Y	85.9	Confident	84.3	Confident	90 Å²	90	40.4 Å²	40.4	35%	0.353	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-40.6	173	175.7	-111.1	0	0	0	112.1	A877 D878 T879 R884 R885 E1319	A877-Y881 WeakPolarHBondContact O-CB 3.45Å; A877-Y881 PolarHBondContact O-N 3.33Å; A877-Y881 VanDerWaalsContact O-N 3.07Å; D878-Y881 PolarHBondContact O-N 3.26Å; T879-Y881 PolarHBondContact O-N 3.45Å; Y881-R884 PolarHBondContact O-N 2.72Å; Y881-R885 HydrophobicContact CE1-CG 4.37Å; Y881-R885 HydrophobicContact CE2-CG 4.36Å; Y881-R885 WeakPolarHBondContact O-CG 3.17Å; Y881-R885 PolarHBondContact O-N 3.47Å; Y881-R885 VanDerWaalsContact O-N 3.08Å; Y881-E1319 WeakPolarHBondContact CE2-OE1 3.4Å; Y881-E1319 PolarHBondContact OH-OE1 2.96Å
882	M	87.1	Confident	85.1	Confident	7 Å²	7	38.7 Å²	38.7	3%	0.034	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-45.4	174.4	-175.1	176.1	76.3	0	0	111.8	D878 T879 R884 R885 L886 A1054 M1079	D878-M882 WeakPolarHBondContact O-CB 3.49Å; D878-M882 PolarHBondContact O-N 2.97Å; T879-M882 WeakPolarHBondContact O-CB 3.47Å; T879-M882 PolarHBondContact O-N 3.13Å; M882-R884 VanDerWaalsContact C-N 3.34Å; M882-R884 PolarHBondContact O-N 2.76Å; M882-R885 WeakPolarHBondContact O-CB 3.24Å; M882-R885 PolarHBondContact O-N 3.03Å; M882-R885 VanDerWaalsContact O-N 3.08Å; M882-L886 HydrophobicContact CG-CD1 4.37Å; M882-L886 WeakPolarHBondContact O-CG 3.17Å; M882-L886 PolarHBondContact O-N 3.49Å; M882-A1054 HydrophobicContact CE-CB 3.33Å; M882-M1079 HydrophobicContact CE-CG 4.19Å; M882-M1079 HydrophobicContact CE-SD 3.53Å; M882-M1079 VanDerWaalsContact CE-SD 3.53Å; M882-M1079 HydrophobicContact SD-CG 4.26Å; M882-M1079 HydrophobicContact SD-SD 4.36Å
883	Q	88.8	Confident	86.1	Confident	24 Å²	24	36.1 Å²	36.1	11%	0.112	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-44.9	176.3	-176.9	179	6	0	0	111.5	L478 T879 R885 L886 V887	L478-Q883 PolarHBondContact O-NE2 3.46Å; T879-Q883 WeakPolarHBondContact O-CB 3.41Å; T879-Q883 PolarHBondContact O-N 2.84Å; Q883-R885 PolarHBondContact O-N 3.03Å; Q883-L886 PolarHBondContact O-N 3.39Å; Q883-V887 HydrophobicContact CG-CG2 4.31Å; Q883-V887 WeakPolarHBondContact O-CG2 3.39Å; Q883-V887 PolarHBondContact O-N 3.25Å
884	R	87.3	Confident	86.8	Confident	48 Å²	48	33.2 Å²	33.2	18%	0.181	19%	0.189	C	C	.	.	H	α-helix	trans	-56.1	-40.5	174.7	176.9	180	175.1	-102.9	3.1	111.7	G880 Y881 M882 K888 S1317 F1318	G880-R884 PolarHBondContact O-N 3.11Å; Y881-R884 PolarHBondContact O-N 2.72Å; M882-R884 VanDerWaalsContact C-N 3.34Å; M882-R884 PolarHBondContact O-N 2.76Å; R884-K888 WeakPolarHBondContact O-CB 3.49Å; R884-K888 VanDerWaalsContact O-CG 3.31Å; R884-K888 WeakPolarHBondContact O-CG 3.34Å; R884-K888 PolarHBondContact O-N 3.34Å; R884-K888 VanDerWaalsContact O-N 3.08Å; R884-S1317 PolarHBondContact NH2-O 3.25Å; R884-F1318 PolarHBondContact NH1-O 3.2Å; R884-F1318 PolarHBondContact NH2-O 3.01Å
885	R	89.9	Confident	87.6	Confident	14 Å²	14	28.6 Å²	28.6	5%	0.053	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-49.9	177.9	-71.6	175	53.6	-157.4	-13.8	111.5	Y881 M882 Q883 K888 F889 N1084 Y1300 F1318	Y881-R885 HydrophobicContact CE1-CG 4.37Å; Y881-R885 HydrophobicContact CE2-CG 4.36Å; Y881-R885 WeakPolarHBondContact O-CG 3.17Å; Y881-R885 PolarHBondContact O-N 3.47Å; Y881-R885 VanDerWaalsContact O-N 3.08Å; M882-R885 WeakPolarHBondContact O-CB 3.24Å; M882-R885 PolarHBondContact O-N 3.03Å; M882-R885 VanDerWaalsContact O-N 3.08Å; Q883-R885 PolarHBondContact O-N 3.03Å; R885-K888 PolarHBondContact O-N 3.06Å; R885-F889 VanDerWaalsContact O-CD2 3.26Å; R885-F889 WeakPolarHBondContact O-CD2 3.32Å; R885-F889 PolarHBondContact O-N 2.9Å; R885-N1084 PolarHBondContact NH1-OD1 3.31Å; R885-N1084 PolarHBondContact NH2-OD1 2.86Å; R885-Y1300 PolarHBondContact NE-O 3.18Å; R885-Y1300 PolarHBondContact NH2-O 3.06Å; R885-F1318 HydrophobicContact CB-CE2 4.46Å; R885-F1318 HydrophobicContact CG-CE2 3.67Å; R885-F1318 HydrophobicContact CG-CZ 3.63Å
886	L	91.7	Very high	88.6	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-50.7	179.2	-68.8	174.4	0	0	0	111.3	M882 Q883 K888 F889 L890 V1050 V1083 L1287 Y1300	M882-L886 HydrophobicContact CG-CD1 4.37Å; M882-L886 WeakPolarHBondContact O-CG 3.17Å; M882-L886 PolarHBondContact O-N 3.49Å; Q883-L886 PolarHBondContact O-N 3.39Å; L886-K888 PolarHBondContact O-N 2.96Å; L886-F889 PolarHBondContact O-N 2.89Å; L886-L890 WeakPolarHBondContact O-CB 3.4Å; L886-L890 VanDerWaalsContact O-CG 3.26Å; L886-L890 WeakPolarHBondContact O-CG 3.24Å; L886-L890 PolarHBondContact O-N 2.71Å; L886-L890 VanDerWaalsContact O-N 3.08Å; L886-V1050 HydrophobicContact CD1-CB 4.45Å; L886-V1050 HydrophobicContact CD1-CG1 3.97Å; L886-V1083 HydrophobicContact CD2-CG1 3.88Å; L886-V1083 HydrophobicContact CD2-CG2 4.43Å; L886-L1287 HydrophobicContact CD2-CD1 3.85Å; L886-Y1300 HydrophobicContact CD2-CD1 4.01Å; L886-Y1300 HydrophobicContact CD2-CD2 3.95Å; L886-Y1300 HydrophobicContact CD2-CE1 4.24Å; L886-Y1300 HydrophobicContact CD2-CE2 4.14Å; L886-Y1300 HydrophobicContact CD2-CG 3.89Å
887	V	90.8	Very high	89.4	Confident	35 Å²	35	31.2 Å²	31.2	21%	0.212	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-43.5	-179.7	174.9	0	0	0	0	111.3	Q883 F889 L890 E891 Q1048	Q883-V887 HydrophobicContact CG-CG2 4.31Å; Q883-V887 WeakPolarHBondContact O-CG2 3.39Å; Q883-V887 PolarHBondContact O-N 3.25Å; V887-F889 VanDerWaalsContact C-N 3.27Å; V887-F889 PolarHBondContact O-N 3.46Å; V887-L890 PolarHBondContact O-N 3Å; V887-E891 VanDerWaalsContact O-CB 3.26Å; V887-E891 WeakPolarHBondContact O-CB 3.49Å; V887-E891 WeakPolarHBondContact O-CG 3.41Å; V887-E891 PolarHBondContact O-N 3.08Å; V887-Q1048 HydrophobicContact CG2-CG 4.42Å
888	K	89.7	Confident	90.1	Very high	22 Å²	22	31.8 Å²	31.8	10%	0.096	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-28.3	-179.8	-80.7	-75.4	160.2	-139.4	0	114.3	R884 R885 L886 E891 M1305 F1318 T1341	R884-K888 WeakPolarHBondContact O-CB 3.49Å; R884-K888 VanDerWaalsContact O-CG 3.31Å; R884-K888 WeakPolarHBondContact O-CG 3.34Å; R884-K888 PolarHBondContact O-N 3.34Å; R884-K888 VanDerWaalsContact O-N 3.08Å; R885-K888 PolarHBondContact O-N 3.06Å; L886-K888 PolarHBondContact O-N 2.96Å; K888-E891 IonicContact NZ-OE1 2.66Å; K888-E891 PolarHBondContact NZ-OE1 3.15Å; K888-E891 IonicContact NZ-OE2 3.09Å; K888-E891 PolarHBondContact NZ-OE2 3.05Å; K888-M1305 HydrophobicContact CB-SD 4.42Å; K888-F1318 HydrophobicContact CB-CD2 4.3Å; K888-F1318 HydrophobicContact CG-CD2 4.26Å; K888-T1341 PolarHBondContact NZ-OG1 3.09Å
889	F	90.4	Very high	90.7	Very high	7 Å²	7	32 Å²	32	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-79.2	-38.5	174.1	-88.2	-111.9	0	0	0	112.3	R885 L886 V887 Y1300 Q1301 M1305 A1308 K1309	R885-F889 VanDerWaalsContact O-CD2 3.26Å; R885-F889 WeakPolarHBondContact O-CD2 3.32Å; R885-F889 PolarHBondContact O-N 2.9Å; L886-F889 PolarHBondContact O-N 2.89Å; V887-F889 VanDerWaalsContact C-N 3.27Å; V887-F889 PolarHBondContact O-N 3.46Å; F889-Y1300 HydrophobicContact CB-CD1 3.56Å; F889-Y1300 HydrophobicContact CB-CE1 3.58Å; F889-Y1300 AromaticContact CD1-CD1 3.63Å; F889-Y1300 HydrophobicContact CD1-CD1 3.63Å; F889-Y1300 AromaticContact CD1-CE1 3.95Å; F889-Y1300 HydrophobicContact CD1-CE1 3.95Å; F889-Y1300 AromaticContact CD2-CD1 3.84Å; F889-Y1300 HydrophobicContact CD2-CD1 3.84Å; F889-Y1300 HydrophobicContact CE1-CD1 4.14Å; F889-Y1300 VanDerWaalsContact CE2-C 3.5Å; F889-Y1300 HydrophobicContact CE2-CD1 4.3Å; F889-Y1300 WeakPolarHBondContact CE2-O 3.49Å; F889-Y1300 AromaticContact CG-CD1 3.43Å; F889-Y1300 HydrophobicContact CG-CD1 3.43Å; F889-Y1300 VanDerWaalsContact CG-CD1 3.43Å; F889-Y1300 AromaticContact CG-CE1 3.88Å; F889-Y1300 HydrophobicContact CG-CE1 3.88Å; F889-Y1300 VanDerWaalsContact CZ-CA 3.44Å; F889-Y1300 HydrophobicContact CZ-CD1 4.4Å; F889-Q1301 WeakPolarHBondContact CZ-O 3.48Å; F889-M1305 HydrophobicContact CD1-CG 4.26Å; F889-M1305 HydrophobicContact CD2-CB 4.3Å; F889-M1305 HydrophobicContact CD2-CG 3.7Å; F889-M1305 HydrophobicContact CD2-SD 3.64Å; F889-M1305 VanDerWaalsContact CE1-CA 3.49Å; F889-M1305 HydrophobicContact CE1-CB 3.89Å; F889-M1305 HydrophobicContact CE1-CG 3.93Å; F889-M1305 HydrophobicContact CE2-CB 3.44Å; F889-M1305 VanDerWaalsContact CE2-CB 3.44Å; F889-M1305 HydrophobicContact CE2-CG 3.35Å; F889-M1305 HydrophobicContact CE2-SD 3.51Å; F889-M1305 VanDerWaalsContact CE2-SD 3.51Å; F889-M1305 HydrophobicContact CG-CG 4.19Å; F889-M1305 HydrophobicContact CZ-CB 3.22Å; F889-M1305 HydrophobicContact CZ-CG 3.5Å; F889-M1305 VanDerWaalsContact CZ-CG 3.5Å; F889-M1305 HydrophobicContact CZ-SD 4.28Å; F889-A1308 HydrophobicContact CD1-CB 4.45Å; F889-A1308 HydrophobicContact CE1-CB 4.32Å; F889-K1309 WeakPolarHBondContact O-CE 3.23Å; F889-K1309 PolarHBondContact O-NZ 2.89Å
890	L	93.4	Very high	91.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-94.8	-14	-167.8	-61	170.8	0	0	0	113.7	L886 V887 D892 L893 G1043 C1046 V1290 Y1300	L886-L890 WeakPolarHBondContact O-CB 3.4Å; L886-L890 VanDerWaalsContact O-CG 3.26Å; L886-L890 WeakPolarHBondContact O-CG 3.24Å; L886-L890 PolarHBondContact O-N 2.71Å; L886-L890 VanDerWaalsContact O-N 3.08Å; V887-L890 PolarHBondContact O-N 3Å; L890-D892 PolarHBondContact O-N 2.96Å; L890-D892 VanDerWaalsContact O-N 3.08Å; L890-L893 HydrophobicContact CB-CD1 4.31Å; L890-L893 HydrophobicContact CD2-CD1 3.57Å; L890-L893 WeakPolarHBondContact O-CB 3.43Å; L890-L893 WeakPolarHBondContact O-CG 3.34Å; L890-L893 PolarHBondContact O-N 3.27Å; L890-G1043 WeakPolarHBondContact CB-O 3.09Å; L890-G1043 CarbonylContact O-C 3.51Å; L890-G1043 VanDerWaalsContact O-CA 3.24Å; L890-G1043 WeakPolarHBondContact O-CA 3.36Å; L890-C1046 HydrophobicContact CD1-CB 4.37Å; L890-V1290 HydrophobicContact CD2-CB 4.04Å; L890-V1290 HydrophobicContact CD2-CG1 3.95Å; L890-V1290 HydrophobicContact CD2-CG2 3.7Å; L890-Y1300 HydrophobicContact CD2-CE1 4.3Å; L890-Y1300 HydrophobicContact CG-CE1 4.3Å
891	E	93	Very high	91.9	Very high	19 Å²	19	30.9 Å²	30.9	9%	0.089	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.7	-171.8	56.8	-179.9	-140.3	0	0	115.3	V887 K888 L893 V1340 T1341	V887-E891 VanDerWaalsContact O-CB 3.26Å; V887-E891 WeakPolarHBondContact O-CB 3.49Å; V887-E891 WeakPolarHBondContact O-CG 3.41Å; V887-E891 PolarHBondContact O-N 3.08Å; K888-E891 IonicContact NZ-OE1 2.66Å; K888-E891 PolarHBondContact NZ-OE1 3.15Å; K888-E891 IonicContact NZ-OE2 3.09Å; K888-E891 PolarHBondContact NZ-OE2 3.05Å; E891-L893 VanDerWaalsContact C-N 3.34Å; E891-V1340 HydrophobicContact CG-CB 4.44Å; E891-T1341 WeakPolarHBondContact OE1-CB 3.46Å; E891-T1341 PolarHBondContact OE1-N 3.04Å; E891-T1341 PolarHBondContact OE1-OG1 3.34Å
892	D	91.6	Very high	92.3	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.032	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.3	-179.8	-58.6	-36.9	0	0	0	113.9	L890 A894 K1309 G1339 V1340	L890-D892 PolarHBondContact O-N 2.96Å; L890-D892 VanDerWaalsContact O-N 3.08Å; D892-A894 PolarHBondContact O-N 3.36Å; D892-K1309 WeakPolarHBondContact OD2-CE 3.35Å; D892-K1309 IonicContact OD2-NZ 3.2Å; D892-K1309 PolarHBondContact OD2-NZ 3.32Å; D892-G1339 VanDerWaalsContact OD1-CA 3.3Å; D892-G1339 WeakPolarHBondContact OD1-CA 3.42Å; D892-V1340 PolarHBondContact OD1-N 3.35Å
893	L	94.6	Very high	92.4	Very high	4 Å²	4	31 Å²	31	2%	0.021	15%	0.15	C	C	.	.			trans	-83	120	-174	-57.2	173.2	0	0	0	111	L890 E891 V901 R902 D903 I909 A1041 V1042 G1043 L1286 V1290	L890-L893 HydrophobicContact CB-CD1 4.31Å; L890-L893 HydrophobicContact CD2-CD1 3.57Å; L890-L893 WeakPolarHBondContact O-CB 3.43Å; L890-L893 WeakPolarHBondContact O-CG 3.34Å; L890-L893 PolarHBondContact O-N 3.27Å; E891-L893 VanDerWaalsContact C-N 3.34Å; L893-V901 HydrophobicContact CB-CG1 4.35Å; L893-R902 WeakPolarHBondContact CA-O 3.42Å; L893-D903 HydrophobicContact CD2-CB 3.88Å; L893-I909 HydrophobicContact CD2-CD1 4.37Å; L893-I909 HydrophobicContact CD2-CG1 3.58Å; L893-A1041 CarbonylContact O-C 3.5Å; L893-V1042 HydrophobicContact CB-CG2 4.46Å; L893-V1042 PolarHBondContact O-N 3.06Å; L893-G1043 PolarHBondContact O-N 3.12Å; L893-L1286 HydrophobicContact CD1-CD1 4.33Å; L893-L1286 HydrophobicContact CD1-CG 4.48Å; L893-V1290 HydrophobicContact CD1-CG2 3.38Å
894	A	94.8	Very high	92.2	Very high	14 Å²	14	31.3 Å²	31.3	12%	0.116	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.6	177.1	0	0	0	0	0	111.1	D892 R902 T1040 V1352	D892-A894 PolarHBondContact O-N 3.36Å; A894-R902 PolarHBondContact N-O 2.89Å; A894-R902 PolarHBondContact O-N 3.04Å; A894-R902 VanDerWaalsContact O-N 3.14Å; A894-T1040 WeakPolarHBondContact CA-O 3.23Å; A894-V1352 HydrophobicContact CB-CG1 4.02Å; A894-V1352 HydrophobicContact CB-CG2 4.32Å
895	V	95.3	Very high	91.9	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.5	169.2	-176.3	0	0	0	0	108.3	V901 I1036 G1039 T1040 V1042	V895-V901 HydrophobicContact CG2-CG2 4.35Å; V895-I1036 HydrophobicContact CG1-CG2 4.17Å; V895-I1036 HydrophobicContact CG2-CD1 4.13Å; V895-I1036 HydrophobicContact CG2-CG1 4.29Å; V895-I1036 HydrophobicContact CG2-CG2 4.06Å; V895-G1039 WeakPolarHBondContact O-CA 3.23Å; V895-G1039 PolarHBondContact O-N 3.39Å; V895-T1040 PolarHBondContact N-O 2.83Å; V895-V1042 HydrophobicContact CG2-CG1 3.59Å; V895-V1042 HydrophobicContact CG2-CG2 4.13Å
896	A	94	Very high	91.7	Very high	29 Å²	29	34 Å²	34	24%	0.24	18%	0.175	C	C	.	.			trans	-86.5	166.2	173.4	0	0	0	0	0	111.1	D898 D899 T900	A896-D898 WeakPolarHBondContact CB-OD1 3.48Å; A896-D898 PolarHBondContact O-N 3.04Å; A896-D898 VanDerWaalsContact O-N 3.14Å; A896-D899 PolarHBondContact O-N 3.31Å; A896-D899 VanDerWaalsContact O-N 3.11Å; A896-T900 PolarHBondContact N-O 2.9Å
897	Y	94.1	Very high	91.6	Very high	150 Å²	150	36.6 Å²	36.6	59%	0.588	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-11.5	179.3	-79.1	-84.1	0	0	0	114.4	D899 P1038	Y897-D899 VanDerWaalsContact C-N 3.34Å; Y897-P1038 HydrophobicContact CD1-CB 3.62Å; Y897-P1038 HydrophobicContact CD1-CG 3.87Å; Y897-P1038 HydrophobicContact CD2-CB 4.32Å; Y897-P1038 HydrophobicContact CE1-CB 3.79Å; Y897-P1038 HydrophobicContact CE1-CG 4.19Å; Y897-P1038 HydrophobicContact CE2-CB 4.45Å; Y897-P1038 HydrophobicContact CG-CB 3.91Å; Y897-P1038 HydrophobicContact CG-CG 4.47Å
898	D	93.8	Very high	91.8	Very high	81 Å²	81	38.4 Å²	38.4	43%	0.433	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	20	174.1	68.9	-14.8	0	0	0	112.8	A896 T900 R902	A896-D898 WeakPolarHBondContact CB-OD1 3.48Å; A896-D898 PolarHBondContact O-N 3.04Å; A896-D898 VanDerWaalsContact O-N 3.14Å; D898-T900 PolarHBondContact O-N 3.15Å; D898-T900 VanDerWaalsContact O-N 3.09Å; D898-T900 WeakPolarHBondContact OD1-CB 3.46Å; D898-T900 PolarHBondContact OD1-N 2.88Å; D898-T900 PolarHBondContact OD1-OG1 3.1Å; D898-T900 PolarHBondContact OD2-OG1 3.38Å; D898-R902 IonicContact OD2-CZ 3.63Å; D898-R902 IonicContact OD2-NE 3.89Å; D898-R902 IonicContact OD2-NH2 2.77Å; D898-R902 PolarHBondContact OD2-NH2 2.79Å
899	D	91.4	Very high	92	Very high	83 Å²	83	38.1 Å²	38.1	44%	0.444	20%	0.195	S	C	.	.	S	Bend	trans	63.8	3.1	-178	-62.1	-35.1	0	0	0	116.3	A896 Y897 R912	A896-D899 PolarHBondContact O-N 3.31Å; A896-D899 VanDerWaalsContact O-N 3.11Å; Y897-D899 VanDerWaalsContact C-N 3.34Å; D899-R912 WeakPolarHBondContact O-CA 3.45Å
900	T	95.9	Very high	92.3	Very high	13 Å²	13	38.3 Å²	38.3	8%	0.08	20%	0.196	C	C	.	.			trans	-81.5	148.1	177	67.1	0	0	0	0	111.7	A896 D898 R902	A896-T900 PolarHBondContact N-O 2.9Å; D898-T900 PolarHBondContact O-N 3.15Å; D898-T900 VanDerWaalsContact O-N 3.09Å; D898-T900 WeakPolarHBondContact OD1-CB 3.46Å; D898-T900 PolarHBondContact OD1-N 2.88Å; D898-T900 PolarHBondContact OD1-OG1 3.1Å; D898-T900 PolarHBondContact OD2-OG1 3.38Å; T900-R902 WeakPolarHBondContact OG1-CG 3.26Å; T900-R902 PolarHBondContact OG1-NE 3.18Å
901	V	96.7	Very high	92.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.5	169.7	-176.6	0	0	0	0	108.3	L893 V895 I909 Q910 Y913 V1042 L1286	L893-V901 HydrophobicContact CB-CG1 4.35Å; V895-V901 HydrophobicContact CG2-CG2 4.35Å; V901-I909 HydrophobicContact CG1-CB 4.46Å; V901-I909 PolarHBondContact O-N 3.35Å; V901-Q910 HydrophobicContact CB-CB 4.05Å; V901-Q910 HydrophobicContact CG2-CB 4.09Å; V901-Q910 PolarHBondContact N-O 3.36Å; V901-Q910 PolarHBondContact O-N 3.3Å; V901-Y913 HydrophobicContact CG2-CD2 4.03Å; V901-Y913 HydrophobicContact CG2-CG 4.37Å; V901-V1042 HydrophobicContact CG1-CG2 3.83Å; V901-V1042 HydrophobicContact CG2-CG2 4.44Å; V901-L1286 HydrophobicContact CG1-CD1 4.07Å
902	R	93.7	Very high	92.5	Very high	85 Å²	85	49.4 Å²	49.4	32%	0.321	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	156.8	-176.9	-56.2	-170.9	-173.5	-158.2	4.9	111.7	L893 A894 D898 T900 D907 I908	L893-R902 WeakPolarHBondContact CA-O 3.42Å; A894-R902 PolarHBondContact N-O 2.89Å; A894-R902 PolarHBondContact O-N 3.04Å; A894-R902 VanDerWaalsContact O-N 3.14Å; D898-R902 IonicContact OD2-CZ 3.63Å; D898-R902 IonicContact OD2-NE 3.89Å; D898-R902 IonicContact OD2-NH2 2.77Å; D898-R902 PolarHBondContact OD2-NH2 2.79Å; T900-R902 WeakPolarHBondContact OG1-CG 3.26Å; T900-R902 PolarHBondContact OG1-NE 3.18Å; R902-D907 VanDerWaalsContact CA-O 3.3Å; R902-D907 WeakPolarHBondContact CA-O 3.26Å; R902-I908 HydrophobicContact CG-CG1 4.36Å
903	D	90	Very high	92.6	Very high	16 Å²	16	49.2 Å²	49.2	9%	0.086	24%	0.241	C	C	.	.			trans	-88.8	-178	167.7	79.2	-1	0	0	0	112.3	L893 R905 G906 D907	L893-D903 HydrophobicContact CD2-CB 3.88Å; D903-R905 PolarHBondContact O-N 3.29Å; D903-R905 VanDerWaalsContact O-N 3.09Å; D903-R905 WeakPolarHBondContact OD1-CA 3.45Å; D903-R905 PolarHBondContact OD1-N 3.38Å; D903-G906 PolarHBondContact O-N 3.12Å; D903-G906 PolarHBondContact OD1-N 3.39Å; D903-D907 PolarHBondContact N-O 3.43Å; D903-D907 VanDerWaalsContact N-O 3.11Å; D903-D907 WeakPolarHBondContact OD1-CB 3.41Å; D903-D907 PolarHBondContact OD1-N 3.21Å
904	S	84.5	Confident	92.5	Very high	30 Å²	30	49.2 Å²	49.2	21%	0.21	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.9	-179	53.7	0	0	0	0	115.2	T1338	S904-T1338 WeakPolarHBondContact O-CB 3.34Å; S904-T1338 PolarHBondContact O-OG1 3.4Å
905	R	81.2	Confident	92.2	Very high	87 Å²	87	52.7 Å²	52.7	33%	0.328	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-9.6	173.5	-58.2	-170.8	-149.9	166.9	17.5	113.2	D135 D903 A1308 N1310	D135-R905 IonicContact OD1-NH1 2.78Å; D135-R905 IonicContact OD2-CZ 2.69Å; D135-R905 IonicContact OD2-NH1 3.07Å; D135-R905 PolarHBondContact OD2-NH1 3.49Å; D903-R905 PolarHBondContact O-N 3.29Å; D903-R905 VanDerWaalsContact O-N 3.09Å; D903-R905 WeakPolarHBondContact OD1-CA 3.45Å; D903-R905 PolarHBondContact OD1-N 3.38Å; R905-A1308 PolarHBondContact NH2-O 3.46Å; R905-N1310 PolarHBondContact NE-ND2 2.98Å; R905-N1310 PolarHBondContact NH1-ND2 2.92Å; R905-N1310 PolarHBondContact NH1-OD1 3.29Å; R905-N1310 PolarHBondContact NH2-ND2 3.4Å; R905-N1310 PolarHBondContact NH2-OD1 3.35Å
906	G	85.8	Confident	92	Very high	32 Å²	32	53 Å²	53	33%	0.33	27%	0.267	S	S	.	.			trans	86.1	12	-170.8	0	0	0	0	0	113.7	D903 I908	D903-G906 PolarHBondContact O-N 3.12Å; D903-G906 PolarHBondContact OD1-N 3.39Å; G906-I908 PolarHBondContact O-N 2.79Å
907	D	89.5	Confident	91.9	Very high	54 Å²	54	51.9 Å²	51.9	29%	0.289	26%	0.258	S	S	.	.			trans	-66	130.8	170	-73.3	-21.4	0	0	0	108.6	R902 D903 I909 K1294	R902-D907 VanDerWaalsContact CA-O 3.3Å; R902-D907 WeakPolarHBondContact CA-O 3.26Å; D903-D907 PolarHBondContact N-O 3.43Å; D903-D907 VanDerWaalsContact N-O 3.11Å; D903-D907 WeakPolarHBondContact OD1-CB 3.41Å; D903-D907 PolarHBondContact OD1-N 3.21Å; D907-I909 PolarHBondContact O-N 3.08Å; D907-K1294 IonicContact OD2-NZ 3.81Å; D907-K1294 PolarHBondContact OD2-NZ 3.18Å
908	I	94.6	Very high	91.9	Very high	72 Å²	72	44.9 Å²	44.9	37%	0.369	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.8	179.1	-60.5	175	0	0	0	109	R902 G906 F911	R902-I908 HydrophobicContact CG-CG1 4.36Å; G906-I908 PolarHBondContact O-N 2.79Å; I908-F911 HydrophobicContact CD1-CE1 4.39Å; I908-F911 HydrophobicContact CG2-CD1 4.31Å; I908-F911 HydrophobicContact CG2-CE1 4.4Å
909	I	94.7	Very high	91.9	Very high	17 Å²	17	42.2 Å²	42.2	9%	0.087	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-45.5	173.1	-53.7	-54.7	0	0	0	110.4	L893 V901 D907 L1286 D1289 V1290 N1293	L893-I909 HydrophobicContact CD2-CD1 4.37Å; L893-I909 HydrophobicContact CD2-CG1 3.58Å; V901-I909 HydrophobicContact CG1-CB 4.46Å; V901-I909 PolarHBondContact O-N 3.35Å; D907-I909 PolarHBondContact O-N 3.08Å; I909-L1286 HydrophobicContact CG2-CD1 4.09Å; I909-D1289 HydrophobicContact CG2-CB 3.91Å; I909-V1290 HydrophobicContact CG2-CG2 3.65Å; I909-N1293 HydrophobicContact CD1-CB 4.21Å; I909-N1293 WeakPolarHBondContact CD1-ND2 3.48Å
910	Q	96.1	Very high	91.9	Very high	11 Å²	11	38.3 Å²	38.3	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	139.1	175	-66.5	178.3	-26.6	0	0	109	V901 R912 G914 L1286 D1289	V901-Q910 HydrophobicContact CB-CB 4.05Å; V901-Q910 HydrophobicContact CG2-CB 4.09Å; V901-Q910 PolarHBondContact N-O 3.36Å; V901-Q910 PolarHBondContact O-N 3.3Å; Q910-R912 VanDerWaalsContact C-N 3.31Å; Q910-G914 VanDerWaalsContact OE1-N 3.11Å; Q910-L1286 HydrophobicContact CG-CD1 4.37Å; Q910-D1289 HydrophobicContact CG-CB 4.1Å; Q910-D1289 PolarHBondContact NE2-OD2 3.3Å
911	F	95.5	Very high	91.7	Very high	169 Å²	169	38.4 Å²	38.4	74%	0.741	20%	0.196	S	C	*	.	S	Bend	trans	-70.3	-30.6	172.9	-69.2	-78.8	0	0	0	112.7	I908	I908-F911 HydrophobicContact CD1-CE1 4.39Å; I908-F911 HydrophobicContact CG2-CD1 4.31Å; I908-F911 HydrophobicContact CG2-CE1 4.4Å
912	R	94	Very high	91.4	Very high	82 Å²	82	40.5 Å²	40.5	31%	0.309	21%	0.206	S	C	.	.	S	Bend	trans	-146.1	131.4	174	-166.8	173.9	-178.3	-174.3	-4.8	107.7	D899 Q910 G914 S915 D916 D973	D899-R912 WeakPolarHBondContact O-CA 3.45Å; Q910-R912 VanDerWaalsContact C-N 3.31Å; R912-G914 PolarHBondContact O-N 2.64Å; R912-S915 PolarHBondContact O-N 3.3Å; R912-D916 PolarHBondContact NE-O 3.15Å; R912-D916 VanDerWaalsContact NE-O 3.09Å; R912-D916 PolarHBondContact NH2-O 3.12Å; R912-D973 IonicContact CZ-OD2 2.78Å; R912-D973 IonicContact NH1-OD2 3.69Å; R912-D973 PolarHBondContact NH1-OD2 3.32Å; R912-D973 IonicContact NH2-OD2 3.71Å; R912-D973 PolarHBondContact NH2-OD2 3.49Å
913	Y	94.9	Very high	91.2	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.008	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-55.8	123.5	-176.5	174.6	-113.3	0	0	0	111.4	V901 S915 D916 G917 L918 P920 I1036 V1042 R1282 L1286	V901-Y913 HydrophobicContact CG2-CD2 4.03Å; V901-Y913 HydrophobicContact CG2-CG 4.37Å; Y913-S915 PolarHBondContact O-N 2.66Å; Y913-S915 VanDerWaalsContact O-N 3.08Å; Y913-D916 PolarHBondContact O-N 3.2Å; Y913-G917 WeakPolarHBondContact O-CA 3.41Å; Y913-G917 PolarHBondContact O-N 3.33Å; Y913-L918 WeakPolarHBondContact CE1-O 3.41Å; Y913-P920 HydrophobicContact CE1-CG 4.46Å; Y913-I1036 HydrophobicContact CD1-CB 4.37Å; Y913-I1036 HydrophobicContact CD1-CD1 3.47Å; Y913-I1036 VanDerWaalsContact CD1-CD1 3.47Å; Y913-I1036 HydrophobicContact CD1-CG2 4.16Å; Y913-I1036 HydrophobicContact CE1-CD1 3.47Å; Y913-I1036 VanDerWaalsContact CE1-CD1 3.47Å; Y913-I1036 HydrophobicContact CG-CD1 4.15Å; Y913-V1042 HydrophobicContact CD2-CB 4.22Å; Y913-V1042 HydrophobicContact CD2-CG1 4Å; Y913-V1042 HydrophobicContact CD2-CG2 4.42Å; Y913-V1042 HydrophobicContact CE1-CG1 4.41Å; Y913-V1042 HydrophobicContact CE2-CB 3.87Å; Y913-V1042 HydrophobicContact CE2-CG1 3.82Å; Y913-V1042 HydrophobicContact CE2-CG2 4.48Å; Y913-V1042 HydrophobicContact CG-CG1 4.38Å; Y913-R1282 HydrophobicContact CE1-CB 4.21Å; Y913-L1286 HydrophobicContact CE2-CD2 4.18Å
914	G	91.1	Very high	91.2	Very high	4 Å²	4	36.3 Å²	36.3	4%	0.041	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	60.5	20.5	179.5	0	0	0	0	0	115.2	Q910 R912 D916	Q910-G914 VanDerWaalsContact OE1-N 3.11Å; R912-G914 PolarHBondContact O-N 2.64Å; G914-D916 PolarHBondContact O-N 3.08Å
915	S	89.6	Confident	91.3	Very high	87 Å²	87	36.5 Å²	36.5	61%	0.608	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	67.9	-6.7	-173.1	-56.3	0	0	0	0	116.4	R912 Y913 M1285	R912-S915 PolarHBondContact O-N 3.3Å; Y913-S915 PolarHBondContact O-N 2.66Å; Y913-S915 VanDerWaalsContact O-N 3.08Å; S915-M1285 WeakPolarHBondContact OG-CE 3.44Å
916	D	91.1	Very high	91.1	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.048	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.8	-5.1	-178.1	58.7	18.6	0	0	0	115.7	R912 Y913 G914 L918 R975 R1282	R912-D916 PolarHBondContact NE-O 3.15Å; R912-D916 VanDerWaalsContact NE-O 3.09Å; R912-D916 PolarHBondContact NH2-O 3.12Å; Y913-D916 PolarHBondContact O-N 3.2Å; G914-D916 PolarHBondContact O-N 3.08Å; D916-L918 HydrophobicContact CB-CD1 4.24Å; D916-L918 HydrophobicContact CB-CG 4.29Å; D916-L918 PolarHBondContact O-N 2.85Å; D916-L918 PolarHBondContact OD1-N 3.41Å; D916-R975 IonicContact OD2-NH1 3.93Å; D916-R975 PolarHBondContact OD2-NH1 3.32Å; D916-R1282 IonicContact OD1-CZ 3.47Å; D916-R1282 IonicContact OD1-NE 3.93Å; D916-R1282 PolarHBondContact OD1-NE 2.98Å; D916-R1282 IonicContact OD1-NH2 2.73Å; D916-R1282 PolarHBondContact OD1-NH2 3.02Å; D916-R1282 IonicContact OD2-CZ 3.24Å; D916-R1282 IonicContact OD2-NE 2.63Å; D916-R1282 IonicContact OD2-NH2 3.06Å; D916-R1282 PolarHBondContact OD2-NH2 3.33Å
917	G	91.7	Very high	90.6	Very high	5 Å²	5	41.2 Å²	41.2	5%	0.052	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	21.3	174.9	0	0	0	0	0	113.3	Y913 L1035 I1036	Y913-G917 WeakPolarHBondContact O-CA 3.41Å; Y913-G917 PolarHBondContact O-N 3.33Å; G917-L1035 WeakPolarHBondContact O-CA 3.33Å; G917-I1036 WeakPolarHBondContact O-CG2 3.34Å; G917-I1036 PolarHBondContact O-N 3.08Å
918	L	93.2	Very high	90.4	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-101.1	145.2	-177.7	-59.6	170.7	0	0	0	112	Y913 D916 P920 M923 P929 Y1031 A1034 L1035 R1282	Y913-L918 WeakPolarHBondContact CE1-O 3.41Å; D916-L918 HydrophobicContact CB-CD1 4.24Å; D916-L918 HydrophobicContact CB-CG 4.29Å; D916-L918 PolarHBondContact O-N 2.85Å; D916-L918 PolarHBondContact OD1-N 3.41Å; L918-P920 WeakPolarHBondContact O-CD 3.33Å; L918-M923 HydrophobicContact CB-CE 3.18Å; L918-M923 HydrophobicContact CD1-CE 3.87Å; L918-M923 HydrophobicContact CG-CE 4.13Å; L918-P929 HydrophobicContact CD1-CG 4.03Å; L918-P929 HydrophobicContact CD2-CG 4.37Å; L918-Y1031 HydrophobicContact CD1-CE2 4.39Å; L918-Y1031 HydrophobicContact CD2-CD2 4.48Å; L918-Y1031 HydrophobicContact CD2-CE2 3.96Å; L918-A1034 CarbonylContact C-O 3.5Å; L918-A1034 WeakPolarHBondContact CA-O 3.17Å; L918-A1034 HydrophobicContact CD2-CB 4.35Å; L918-L1035 HydrophobicContact CD2-CD2 3.99Å; L918-R1282 VanDerWaalsContact O-CD 3.25Å; L918-R1282 WeakPolarHBondContact O-CD 3.24Å; L918-R1282 PolarHBondContact O-NE 3.43Å
919	D	93.8	Very high	90.1	Very high	24 Å²	24	36.6 Å²	36.6	13%	0.128	19%	0.192	C	C	.	.			trans	-83.7	123	178.8	-170.3	-12.8	0	0	0	111.5	L921 E922 A1034 I1036	D919-L921 PolarHBondContact O-N 2.78Å; D919-L921 VanDerWaalsContact O-N 3.09Å; D919-L921 WeakPolarHBondContact OD1-CB 3Å; D919-L921 PolarHBondContact OD1-N 3.11Å; D919-E922 PolarHBondContact O-N 3.49Å; D919-A1034 PolarHBondContact N-O 3.4Å; D919-I1036 HydrophobicContact CB-CB 4.3Å; D919-I1036 HydrophobicContact CB-CG1 4.37Å
920	P	92.2	Very high	89.9	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.006	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-50.2	-28.5	169.6	-29.7	35.8	0	0	0	115	G545 Y913 L918 E922 N1280 R1282	G545-P920 WeakPolarHBondContact CA-O 3.4Å; G545-P920 PolarHBondContact N-O 2.89Å; Y913-P920 HydrophobicContact CE1-CG 4.46Å; L918-P920 WeakPolarHBondContact O-CD 3.33Å; P920-E922 VanDerWaalsContact C-N 3.3Å; P920-E922 PolarHBondContact O-N 3.44Å; P920-N1280 HydrophobicContact CB-CB 3.9Å; P920-N1280 HydrophobicContact CG-CB 4.18Å; P920-R1282 HydrophobicContact CG-CB 4.28Å
921	L	91.1	Very high	89.6	Confident	16 Å²	16	38 Å²	38	8%	0.084	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-66.9	-28.9	178.6	-77.1	161.6	0	0	0	113.1	V540 P542 R680 D919	V540-L921 HydrophobicContact CG2-CD2 3.78Å; P542-L921 VanDerWaalsContact CA-CD2 3.46Å; P542-L921 HydrophobicContact CB-CD2 3.99Å; P542-L921 HydrophobicContact CB-CG 4.31Å; R680-L921 PolarHBondContact NH2-O 3.37Å; D919-L921 PolarHBondContact O-N 2.78Å; D919-L921 VanDerWaalsContact O-N 3.09Å; D919-L921 WeakPolarHBondContact OD1-CB 3Å; D919-L921 PolarHBondContact OD1-N 3.11Å
922	E	91	Very high	89.4	Confident	44 Å²	44	31 Å²	31	21%	0.206	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-100	5.5	-173.6	-65.4	-62.6	128.5	0	0	113.1	R680 D919 P920 E924 A1034	R680-E922 IonicContact CZ-OE2 3.01Å; R680-E922 IonicContact NH1-OE1 2.66Å; R680-E922 PolarHBondContact NH1-OE1 3.47Å; R680-E922 IonicContact NH1-OE2 3.76Å; R680-E922 PolarHBondContact NH1-OE2 2.93Å; D919-E922 PolarHBondContact O-N 3.49Å; P920-E922 VanDerWaalsContact C-N 3.3Å; P920-E922 PolarHBondContact O-N 3.44Å; E922-E924 PolarHBondContact O-N 2.76Å; E922-A1034 HydrophobicContact CB-CB 3.72Å
923	M	90.5	Very high	89.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.175	C	C	.	.			trans	-75.5	116.8	-177.3	-66.2	-71.4	159.1	0	0	113.6	K671 Y676 L918 P929 R1282	K671-M923 WeakPolarHBondContact CE-O 3.49Å; Y676-M923 PolarHBondContact OH-O 3.33Å; L918-M923 HydrophobicContact CB-CE 3.18Å; L918-M923 HydrophobicContact CD1-CE 3.87Å; L918-M923 HydrophobicContact CG-CE 4.13Å; M923-P929 HydrophobicContact SD-CB 4.23Å; M923-R1282 VanDerWaalsContact CE-NH2 3.28Å
924	E	89.4	Confident	89	Confident	13 Å²	13	32 Å²	32	6%	0.061	18%	0.182	C	C	.	.	S	Bend	trans	-83.2	-27.2	172.1	-68.2	-173.5	171.7	0	0	114.2	K671 Y676 R680 E922 P929 N931 K1030	K671-E924 WeakPolarHBondContact CD-O 3.39Å; Y676-E924 HydrophobicContact CE1-CG 4.23Å; Y676-E924 WeakPolarHBondContact OH-CA 3.4Å; R680-E924 HydrophobicContact CG-CG 4.44Å; E922-E924 PolarHBondContact O-N 2.76Å; E924-P929 VanDerWaalsContact CB-O 3.24Å; E924-P929 WeakPolarHBondContact CB-O 3.3Å; E924-P929 VanDerWaalsContact CG-O 3.26Å; E924-P929 WeakPolarHBondContact CG-O 3.37Å; E924-P929 PolarHBondContact N-O 2.82Å; E924-P929 VanDerWaalsContact N-O 3.13Å; E924-N931 HydrophobicContact CB-CB 4.39Å; E924-N931 PolarHBondContact OE2-N 3.04Å; E924-K1030 IonicContact OE1-NZ 2.81Å; E924-K1030 PolarHBondContact OE1-NZ 2.86Å
925	T	85.4	Confident	89	Confident	34 Å²	34	31.8 Å²	31.8	21%	0.209	18%	0.18	C	C	.	.	S	Bend	trans	-120	-179.5	171.7	72	0	0	0	0	109.7	K671 F928 N931	K671-T925 VanDerWaalsContact NZ-C 3.33Å; K671-T925 PolarHBondContact NZ-O 3.34Å; T925-F928 PolarHBondContact N-O 3.09Å; T925-F928 VanDerWaalsContact N-O 3.15Å; T925-F928 WeakPolarHBondContact OG1-CA 3.43Å; T925-F928 PolarHBondContact OG1-N 2.78Å; T925-F928 PolarHBondContact OG1-O 3.1Å; T925-N931 HydrophobicContact CG2-CB 3.84Å
926	D	77.1	Confident	89.1	Confident	110 Å²	110	28.1 Å²	28.1	59%	0.588	15%	0.154	S	C	*	.	S	Bend	trans	-80	-25.4	-177.5	-56.6	-30.5	0	0	0	112.1	K671	K671-D926 IonicContact NZ-OD1 2.86Å; K671-D926 PolarHBondContact NZ-OD1 3Å
927	T	76.4	Confident	88.9	Confident	108 Å²	108	30.6 Å²	30.6	66%	0.663	17%	0.165	S	C	*	.	S	Bend	trans	-109.6	-30.6	-176.6	55.6	0	0	0	0	113.4
928	F	86	Confident	88.9	Confident	25 Å²	25	30.8 Å²	30.8	11%	0.11	16%	0.164	C	C	.	.			trans	-131.7	145.6	-171.3	-150.7	-101.7	0	0	0	112.7	T925 V930 F932 L976 A979 Y1031	T925-F928 PolarHBondContact N-O 3.09Å; T925-F928 VanDerWaalsContact N-O 3.15Å; T925-F928 WeakPolarHBondContact OG1-CA 3.43Å; T925-F928 PolarHBondContact OG1-N 2.78Å; T925-F928 PolarHBondContact OG1-O 3.1Å; F928-V930 VanDerWaalsContact C-N 3.29Å; F928-V930 HydrophobicContact CD1-CB 4.48Å; F928-V930 PolarHBondContact O-N 3.08Å; F928-F932 AromaticContact CD1-CE2 3.84Å; F928-F932 HydrophobicContact CD1-CE2 3.84Å; F928-F932 AromaticContact CD1-CZ 3.73Å; F928-F932 HydrophobicContact CD1-CZ 3.73Å; F928-F932 HydrophobicContact CE1-CE1 4.14Å; F928-F932 AromaticContact CE1-CE2 3.87Å; F928-F932 HydrophobicContact CE1-CE2 3.87Å; F928-F932 AromaticContact CE1-CZ 3.32Å; F928-F932 HydrophobicContact CE1-CZ 3.32Å; F928-F932 HydrophobicContact CZ-CZ 4.11Å; F928-L976 HydrophobicContact CE1-CD1 3.74Å; F928-L976 HydrophobicContact CZ-CB 4.46Å; F928-L976 HydrophobicContact CZ-CD1 3.58Å; F928-A979 HydrophobicContact CE2-CB 4.23Å; F928-A979 HydrophobicContact CZ-CB 4.17Å; F928-Y1031 HydrophobicContact CZ-CD2 4.23Å; F928-Y1031 HydrophobicContact CZ-CE2 4.17Å
929	P	87.3	Confident	88.8	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.019	16%	0.163	C	C	.	.	S	Bend	trans	-68.8	-24.3	-174.9	24.8	-35.1	0	0	0	114	L918 M923 E924 Y1031 A1034	L918-P929 HydrophobicContact CD1-CG 4.03Å; L918-P929 HydrophobicContact CD2-CG 4.37Å; M923-P929 HydrophobicContact SD-CB 4.23Å; E924-P929 VanDerWaalsContact CB-O 3.24Å; E924-P929 WeakPolarHBondContact CB-O 3.3Å; E924-P929 VanDerWaalsContact CG-O 3.26Å; E924-P929 WeakPolarHBondContact CG-O 3.37Å; E924-P929 PolarHBondContact N-O 2.82Å; E924-P929 VanDerWaalsContact N-O 3.13Å; P929-Y1031 HydrophobicContact CG-CD2 3.64Å; P929-Y1031 HydrophobicContact CG-CE2 4.08Å; P929-A1034 HydrophobicContact CB-CB 3.52Å; P929-A1034 HydrophobicContact CG-CB 4.33Å
930	V	90.3	Very high	88.6	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	17%	0.17	C	C	.	.	S	Bend	trans	-119.7	133.6	-176.8	-173.6	0	0	0	0	111	F928 F932 V1027 K1030	F928-V930 VanDerWaalsContact C-N 3.29Å; F928-V930 HydrophobicContact CD1-CB 4.48Å; F928-V930 PolarHBondContact O-N 3.08Å; V930-F932 HydrophobicContact CB-CE1 4.34Å; V930-F932 HydrophobicContact CG1-CD1 4.26Å; V930-F932 HydrophobicContact CG1-CE1 4.47Å; V930-F932 PolarHBondContact O-N 2.93Å; V930-V1027 HydrophobicContact CG1-CG2 4.25Å; V930-K1030 HydrophobicContact CG1-CD 4.33Å; V930-K1030 HydrophobicContact CG2-CB 3.66Å; V930-K1030 HydrophobicContact CG2-CD 4.49Å
931	N	90.7	Very high	88.3	Confident	55 Å²	55	34.8 Å²	34.8	29%	0.294	18%	0.182	S	C	.	.			trans	-86.8	93.1	168.9	-174.3	-26.9	0	0	0	110.4	E924 T925 V933 K934 E935	E924-N931 HydrophobicContact CB-CB 4.39Å; E924-N931 PolarHBondContact OE2-N 3.04Å; T925-N931 HydrophobicContact CG2-CB 3.84Å; N931-V933 VanDerWaalsContact C-N 3.28Å; N931-V933 PolarHBondContact O-N 3.38Å; N931-V933 PolarHBondContact OD1-N 2.99Å; N931-K934 HydrophobicContact CB-CB 4.01Å; N931-K934 PolarHBondContact O-N 3.08Å; N931-K934 PolarHBondContact OD1-N 3.35Å; N931-K934 VanDerWaalsContact OD1-N 3.1Å; N931-E935 PolarHBondContact O-N 3.19Å
932	F	91.8	Very high	88.2	Confident	23 Å²	23	34.5 Å²	34.5	10%	0.101	18%	0.181	C	C	.	.	H	α-helix	trans	-57.5	-36.8	-176.6	-59.8	-57.5	0	0	0	114.1	F928 V930 M936 L976 A979 I980 F983 F1023 V1027	F928-F932 AromaticContact CD1-CE2 3.84Å; F928-F932 HydrophobicContact CD1-CE2 3.84Å; F928-F932 AromaticContact CD1-CZ 3.73Å; F928-F932 HydrophobicContact CD1-CZ 3.73Å; F928-F932 HydrophobicContact CE1-CE1 4.14Å; F928-F932 AromaticContact CE1-CE2 3.87Å; F928-F932 HydrophobicContact CE1-CE2 3.87Å; F928-F932 AromaticContact CE1-CZ 3.32Å; F928-F932 HydrophobicContact CE1-CZ 3.32Å; F928-F932 HydrophobicContact CZ-CZ 4.11Å; V930-F932 HydrophobicContact CB-CE1 4.34Å; V930-F932 HydrophobicContact CG1-CD1 4.26Å; V930-F932 HydrophobicContact CG1-CE1 4.47Å; V930-F932 PolarHBondContact O-N 2.93Å; F932-M936 VanDerWaalsContact O-CB 3.26Å; F932-M936 WeakPolarHBondContact O-CB 3.43Å; F932-M936 PolarHBondContact O-N 3.31Å; F932-L976 HydrophobicContact CE1-CD1 4.37Å; F932-L976 HydrophobicContact CZ-CD1 4.11Å; F932-A979 HydrophobicContact CE2-CB 4.11Å; F932-A979 HydrophobicContact CZ-CB 4.26Å; F932-I980 HydrophobicContact CE1-CG1 4.01Å; F932-I980 HydrophobicContact CZ-CG1 4.13Å; F932-F983 HydrophobicContact CB-CD1 3.67Å; F932-F983 HydrophobicContact CB-CD2 3.86Å; F932-F983 HydrophobicContact CB-CE1 3.66Å; F932-F983 HydrophobicContact CB-CE2 3.86Å; F932-F983 HydrophobicContact CB-CG 3.76Å; F932-F983 HydrophobicContact CB-CZ 3.75Å; F932-F983 HydrophobicContact CD2-CB 4.16Å; F932-F983 HydrophobicContact CD2-CG 4.19Å; F932-F983 HydrophobicContact CG-CD1 4.2Å; F932-F983 HydrophobicContact CG-CG 4.17Å; F932-F1023 HydrophobicContact CB-CZ 4.31Å; F932-F1023 AromaticContact CD1-CZ 3.97Å; F932-F1023 HydrophobicContact CD1-CZ 3.97Å; F932-V1027 HydrophobicContact CD1-CG1 4.41Å; F932-V1027 HydrophobicContact CD1-CG2 4.05Å; F932-V1027 HydrophobicContact CE1-CG1 3.7Å; F932-V1027 HydrophobicContact CE1-CG2 4.17Å
933	V	90.4	Very high	88.1	Confident	70 Å²	70	37 Å²	37	42%	0.424	19%	0.19	S	C	.	.	H	α-helix	trans	-64.1	-50.7	179	177.8	0	0	0	0	110	N931 M936 E937 F983	N931-V933 VanDerWaalsContact C-N 3.28Å; N931-V933 PolarHBondContact O-N 3.38Å; N931-V933 PolarHBondContact OD1-N 2.99Å; V933-M936 PolarHBondContact O-N 3.23Å; V933-E937 WeakPolarHBondContact O-CG 3.42Å; V933-E937 PolarHBondContact O-N 3.31Å; V933-E937 VanDerWaalsContact O-N 3.09Å; V933-F983 HydrophobicContact CG2-CE2 3.69Å; V933-F983 HydrophobicContact CG2-CZ 4.27Å
934	K	89.3	Confident	87.7	Confident	34 Å²	34	42.7 Å²	42.7	15%	0.148	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-46.4	178.9	-179	-166.1	160	-164	0	111.1	T677 D681 N931 M936 E937 H938	T677-K934 PolarHBondContact OG1-NZ 3.08Å; D681-K934 IonicContact OD2-NZ 3.71Å; N931-K934 HydrophobicContact CB-CB 4.01Å; N931-K934 PolarHBondContact O-N 3.08Å; N931-K934 PolarHBondContact OD1-N 3.35Å; N931-K934 VanDerWaalsContact OD1-N 3.1Å; K934-M936 PolarHBondContact O-N 3.15Å; K934-E937 PolarHBondContact O-N 3.06Å; K934-H938 WeakPolarHBondContact O-CB 3.11Å; K934-H938 PolarHBondContact O-N 2.8Å
935	E	91.2	Very high	87.5	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-42	-177.2	-165	65.1	-154	0	0	111.4	N931 H938 I939 F1023 H1026 K1030	N931-E935 PolarHBondContact O-N 3.19Å; E935-H938 PolarHBondContact O-N 3.1Å; E935-I939 HydrophobicContact CG-CD1 4.13Å; E935-I939 WeakPolarHBondContact O-CG1 3.43Å; E935-I939 PolarHBondContact O-N 2.94Å; E935-F1023 HydrophobicContact CB-CD2 4.33Å; E935-F1023 HydrophobicContact CB-CE2 4.09Å; E935-F1023 HydrophobicContact CG-CD2 4.12Å; E935-F1023 HydrophobicContact CG-CE2 4.28Å; E935-H1026 IonicContact OE1-CG 3.29Å; E935-H1026 IonicContact OE1-ND1 2.66Å; E935-H1026 PolarHBondContact OE1-ND1 3.14Å; E935-K1030 WeakPolarHBondContact OE2-CE 3.42Å; E935-K1030 IonicContact OE2-NZ 2.6Å; E935-K1030 PolarHBondContact OE2-NZ 2.86Å
936	M	90.9	Very high	87.3	Confident	10 Å²	10	45.5 Å²	45.5	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-46.3	176.6	-174.8	64.3	74.8	0	0	111.7	F932 V933 K934 H938 I939 R940 F983 L1015 F1023	F932-M936 VanDerWaalsContact O-CB 3.26Å; F932-M936 WeakPolarHBondContact O-CB 3.43Å; F932-M936 PolarHBondContact O-N 3.31Å; V933-M936 PolarHBondContact O-N 3.23Å; K934-M936 PolarHBondContact O-N 3.15Å; M936-H938 VanDerWaalsContact C-N 3.34Å; M936-H938 PolarHBondContact O-N 2.92Å; M936-I939 PolarHBondContact O-N 3.37Å; M936-R940 WeakPolarHBondContact O-CB 3.36Å; M936-R940 VanDerWaalsContact O-CG 3.31Å; M936-R940 WeakPolarHBondContact O-CG 3.36Å; M936-R940 PolarHBondContact O-N 3.24Å; M936-F983 HydrophobicContact CE-CE1 4.26Å; M936-L1015 HydrophobicContact CE-CD2 4.26Å; M936-L1015 HydrophobicContact SD-CD1 3.59Å; M936-L1015 VanDerWaalsContact SD-CD1 3.59Å; M936-L1015 HydrophobicContact SD-CD2 4.25Å; M936-F1023 HydrophobicContact CB-CD2 4.28Å; M936-F1023 HydrophobicContact CB-CE2 4.07Å; M936-F1023 HydrophobicContact CE-CD1 3.74Å; M936-F1023 HydrophobicContact CE-CD2 3.86Å; M936-F1023 HydrophobicContact CE-CE1 3.79Å; M936-F1023 HydrophobicContact CE-CE2 3.91Å; M936-F1023 HydrophobicContact CE-CG 3.77Å; M936-F1023 HydrophobicContact CE-CZ 3.87Å; M936-F1023 HydrophobicContact SD-CD2 4.27Å; M936-F1023 HydrophobicContact SD-CG 4.37Å
937	E	88.4	Confident	87.7	Confident	60 Å²	60	49 Å²	49	28%	0.28	25%	0.253	S	S	.	.	H	α-helix	trans	-63.1	-40.8	176.4	-74.1	-175.4	175.9	0	0	112.1	V933 K934 I939 T941	V933-E937 WeakPolarHBondContact O-CG 3.42Å; V933-E937 PolarHBondContact O-N 3.31Å; V933-E937 VanDerWaalsContact O-N 3.09Å; K934-E937 PolarHBondContact O-N 3.06Å; E937-I939 VanDerWaalsContact C-N 3.34Å; E937-I939 PolarHBondContact O-N 3.25Å; E937-T941 WeakPolarHBondContact O-CB 3.36Å; E937-T941 PolarHBondContact O-N 3.1Å; E937-T941 VanDerWaalsContact O-N 3.11Å; E937-T941 PolarHBondContact O-OG1 2.86Å
938	H	90.3	Very high	88.1	Confident	10 Å²	10	47 Å²	47	5%	0.046	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-44.9	177	172.8	76	0	0	0	111.7	K624 N626 K934 E935 M936 T941 S942	K624-H938 PolarHBondContact O-CE1 3.27Å; K624-H938 VanDerWaalsContact O-CE1 3.3Å; N626-H938 HydrophobicContact CB-CB 4.42Å; N626-H938 PolarHBondContact ND2-ND1 2.96Å; N626-H938 VanDerWaalsContact ND2-ND1 3.2Å; N626-H938 PolarHBondContact ND2-O 3.28Å; K934-H938 WeakPolarHBondContact O-CB 3.11Å; K934-H938 PolarHBondContact O-N 2.8Å; E935-H938 PolarHBondContact O-N 3.1Å; M936-H938 VanDerWaalsContact C-N 3.34Å; M936-H938 PolarHBondContact O-N 2.92Å; H938-T941 PolarHBondContact O-N 3.38Å; H938-S942 PolarHBondContact CE1-OG 3.01Å; H938-S942 VanDerWaalsContact CE1-OG 3.29Å; H938-S942 VanDerWaalsContact O-CB 3.26Å; H938-S942 WeakPolarHBondContact O-CB 3.26Å; H938-S942 PolarHBondContact O-N 3.03Å; H938-S942 PolarHBondContact O-OG 3.01Å
939	I	91.3	Very high	88	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-71.4	-43.5	-178.1	-69.4	170.5	0	0	0	111.3	E935 M936 E937 T941 S942 Y943 Q1019 I1022 F1023 H1026	E935-I939 HydrophobicContact CG-CD1 4.13Å; E935-I939 WeakPolarHBondContact O-CG1 3.43Å; E935-I939 PolarHBondContact O-N 2.94Å; M936-I939 PolarHBondContact O-N 3.37Å; E937-I939 VanDerWaalsContact C-N 3.34Å; E937-I939 PolarHBondContact O-N 3.25Å; I939-T941 PolarHBondContact O-N 3.33Å; I939-S942 PolarHBondContact O-N 3.2Å; I939-Y943 HydrophobicContact CB-CD2 4.48Å; I939-Y943 HydrophobicContact CG2-CD2 4.05Å; I939-Y943 PolarHBondContact O-N 2.73Å; I939-Y943 VanDerWaalsContact O-N 3.1Å; I939-Q1019 HydrophobicContact CG2-CB 4.03Å; I939-Q1019 HydrophobicContact CG2-CG 4.22Å; I939-I1022 HydrophobicContact CD1-CG2 4.1Å; I939-I1022 HydrophobicContact CG1-CG2 4.34Å; I939-I1022 HydrophobicContact CG2-CB 4.35Å; I939-I1022 HydrophobicContact CG2-CG2 4.26Å; I939-F1023 HydrophobicContact CD1-CB 3.64Å; I939-F1023 HydrophobicContact CD1-CD2 4.08Å; I939-F1023 HydrophobicContact CD1-CG 4.37Å; I939-H1026 HydrophobicContact CD1-CB 4.43Å
940	R	88.9	Confident	87.8	Confident	70 Å²	70	51.6 Å²	51.6	26%	0.264	27%	0.269	S	S	.	.	H	α-helix	trans	-57.4	-36	176.4	-74.3	177.3	67.6	-166.2	-9	112.3	M936 E1013 R1014 L1015	M936-R940 WeakPolarHBondContact O-CB 3.36Å; M936-R940 VanDerWaalsContact O-CG 3.31Å; M936-R940 WeakPolarHBondContact O-CG 3.36Å; M936-R940 PolarHBondContact O-N 3.24Å; R940-E1013 IonicContact CZ-OE2 3.97Å; R940-E1013 IonicContact NH1-OE2 2.84Å; R940-E1013 PolarHBondContact NH1-OE2 3.49Å; R940-E1013 IonicContact NH2-OE2 3.28Å; R940-R1014 PolarHBondContact NE-O 3.19Å; R940-L1015 HydrophobicContact CG-CD1 4.29Å
941	T	87.6	Confident	87.6	Confident	42 Å²	42	51.8 Å²	51.8	26%	0.258	27%	0.27	S	S	.	.	H	α-helix	trans	-84.5	-38.8	-178.3	-47.3	0	0	0	0	112.7	N626 Q652 E937 H938 I939	N626-T941 WeakPolarHBondContact OD1-CG2 3Å; Q652-T941 HydrophobicContact CB-CG2 4.2Å; Q652-T941 HydrophobicContact CG-CG2 4.14Å; E937-T941 WeakPolarHBondContact O-CB 3.36Å; E937-T941 PolarHBondContact O-N 3.1Å; E937-T941 VanDerWaalsContact O-N 3.11Å; E937-T941 PolarHBondContact O-OG1 2.86Å; H938-T941 PolarHBondContact O-N 3.38Å; I939-T941 PolarHBondContact O-N 3.33Å
942	S	88.3	Confident	87.3	Confident	10 Å²	10	50.4 Å²	50.4	7%	0.07	26%	0.264	C	S	.	.	H	α-helix	trans	-76.8	-34.3	-174.2	-58.2	0	0	0	0	113.5	K624 N626 H938 I939	K624-S942 PolarHBondContact NZ-O 3.02Å; K624-S942 VanDerWaalsContact NZ-O 3.11Å; N626-S942 PolarHBondContact ND2-OG 3.46Å; H938-S942 PolarHBondContact CE1-OG 3.01Å; H938-S942 VanDerWaalsContact CE1-OG 3.29Å; H938-S942 VanDerWaalsContact O-CB 3.26Å; H938-S942 WeakPolarHBondContact O-CB 3.26Å; H938-S942 PolarHBondContact O-N 3.03Å; H938-S942 PolarHBondContact O-OG 3.01Å; I939-S942 PolarHBondContact O-N 3.2Å
943	Y	88.4	Confident	87	Confident	97 Å²	97	49.3 Å²	49.3	38%	0.38	26%	0.26	S	S	.	.			trans	-113.9	82.7	-174.6	-61	-82	0	0	0	110.4	I939 C945 Q1019 I1022	I939-Y943 HydrophobicContact CB-CD2 4.48Å; I939-Y943 HydrophobicContact CG2-CD2 4.05Å; I939-Y943 PolarHBondContact O-N 2.73Å; I939-Y943 VanDerWaalsContact O-N 3.1Å; Y943-C945 PolarHBondContact O-N 3.08Å; Y943-Q1019 PolarHBondContact O-NE2 2.94Å; Y943-I1022 HydrophobicContact CD1-CD1 4.04Å; Y943-I1022 HydrophobicContact CD2-CD1 4.28Å; Y943-I1022 HydrophobicContact CD2-CG2 4.41Å; Y943-I1022 HydrophobicContact CE1-CD1 4.27Å; Y943-I1022 HydrophobicContact CE2-CG2 3.98Å; Y943-I1022 HydrophobicContact CG-CD1 4.04Å
944	D	81.9	Confident	86.8	Confident	120 Å²	120	51.3 Å²	51.3	64%	0.642	26%	0.264	S	S	*	.			trans	-72.5	119.1	172	-164.1	1.9	0	0	0	109.4	P946 R1014	D944-P946 WeakPolarHBondContact O-CD 3.38Å; D944-R1014 IonicContact OD1-NH1 2.77Å
945	C	85.7	Confident	86.8	Confident	22 Å²	22	53.9 Å²	53.9	15%	0.149	28%	0.277	C	S	.	.			trans	-113.3	60.5	-177.6	-63.3	0	0	0	0	109.8	Y943 H947 E948 R1014 T1016	Y943-C945 PolarHBondContact O-N 3.08Å; C945-H947 PolarHBondContact O-N 3.42Å; C945-E948 HydrophobicContact CB-CB 4.44Å; C945-E948 PolarHBondContact O-N 2.82Å; C945-R1014 PolarHBondContact O-NH2 2.91Å; C945-T1016 HydrophobicContact CB-CG2 4.23Å
946	P	82	Confident	86.7	Confident	83 Å²	83	53.9 Å²	53.9	54%	0.539	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.4	-164.6	24.1	-35.7	0	0	0	114.5	D944	D944-P946 WeakPolarHBondContact O-CD 3.38Å
947	H	84.9	Confident	86.6	Confident	185 Å²	185	56.1 Å²	56.1	86%	0.856	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-11.7	-178.8	-52.5	-60.3	0	0	0	114.6	C945	C945-H947 PolarHBondContact O-N 3.42Å
948	E	85.2	Confident	86.7	Confident	64 Å²	64	58.6 Å²	58.6	30%	0.299	30%	0.302	S	S	.	.	S	Bend	trans	-95.2	138.1	179.1	-75.4	-171.8	-166	0	0	112.1	C945 R1014 T1016 R1017 T1018	C945-E948 HydrophobicContact CB-CB 4.44Å; C945-E948 PolarHBondContact O-N 2.82Å; E948-R1014 PolarHBondContact O-NE 3.49Å; E948-R1014 PolarHBondContact O-NH2 2.99Å; E948-T1016 HydrophobicContact CB-CG2 3.79Å; E948-T1016 VanDerWaalsContact OE2-CB 3.31Å; E948-T1016 WeakPolarHBondContact OE2-CB 3.29Å; E948-R1017 PolarHBondContact OE2-N 3.02Å; E948-T1018 WeakPolarHBondContact OE1-CB 3.35Å; E948-T1018 PolarHBondContact OE1-OG1 2.84Å; E948-T1018 PolarHBondContact OE2-N 2.69Å; E948-T1018 PolarHBondContact OE2-OG1 2.85Å
949	V	83	Confident	86.7	Confident	107 Å²	107	59.3 Å²	59.3	65%	0.648	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-75.6	145.8	173.3	-170.3	0	0	0	0	109.6
950	G	83	Confident	86.6	Confident	18 Å²	18	59.5 Å²	59.5	19%	0.186	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-66.6	139.9	172.5	0	0	0	0	0	111.7	N1010 L1015	G950-N1010 PolarHBondContact N-OD1 2.79Å; G950-L1015 WeakPolarHBondContact CA-O 3.43Å
951	M	85.9	Confident	86.5	Confident	7 Å²	7	60.7 Å²	60.7	3%	0.034	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-74.1	149.2	177.3	-65.9	176.4	-67.6	0	0	111.6	E955 L956 L1015 T1016 R1017 L1020	M951-E955 WeakPolarHBondContact CA-OE2 3.38Å; M951-E955 HydrophobicContact CB-CB 4.19Å; M951-L956 HydrophobicContact CE-CD1 3.87Å; M951-L1015 HydrophobicContact CE-CD2 4.31Å; M951-L1015 HydrophobicContact CE-CG 4.02Å; M951-L1015 PolarHBondContact N-O 3.39Å; M951-T1016 WeakPolarHBondContact CE-O 3.26Å; M951-R1017 HydrophobicContact CG-CG 3.91Å; M951-R1017 HydrophobicContact SD-CB 4.31Å; M951-R1017 HydrophobicContact SD-CG 3.44Å; M951-R1017 WeakPolarHBondContact SD-CG 3.35Å; M951-L1020 HydrophobicContact CE-CB 3.9Å; M951-L1020 HydrophobicContact CE-CD2 3.95Å; M951-L1020 HydrophobicContact SD-CD2 4.36Å
952	S	85.2	Confident	86.5	Confident	25 Å²	25	62.3 Å²	62.3	18%	0.175	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-72.7	166.8	165.9	88.2	0	0	0	0	111.6	E954 E955 L956	S952-E954 VanDerWaalsContact C-N 3.3Å; S952-E954 WeakPolarHBondContact CB-OE2 3.36Å; S952-E954 PolarHBondContact O-N 3.28Å; S952-E954 PolarHBondContact OG-N 3.22Å; S952-E954 PolarHBondContact OG-OE2 2.81Å; S952-E955 PolarHBondContact N-OE2 2.8Å; S952-E955 PolarHBondContact O-N 2.81Å; S952-E955 PolarHBondContact OG-N 2.89Å; S952-L956 VanDerWaalsContact O-CB 3.31Å; S952-L956 WeakPolarHBondContact O-CB 3.37Å; S952-L956 PolarHBondContact O-N 2.81Å
953	A	85.6	Confident	86.4	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-38.7	175.8	0	0	0	0	0	112	L956 E957 C989 R993	A953-L956 PolarHBondContact O-N 2.86Å; A953-E957 PolarHBondContact O-N 3.39Å; A953-E957 VanDerWaalsContact O-N 3.12Å; A953-C989 HydrophobicContact CB-CB 4.14Å; A953-R993 HydrophobicContact CB-CG 3.69Å
954	E	86.8	Confident	86.3	Confident	112 Å²	112	60 Å²	60	52%	0.523	32%	0.322	S	S	.	.	H	α-helix	trans	-69	-42.7	177.5	-54	74.6	-151.1	0	0	111.5	S952 L956 E957 L958	S952-E954 VanDerWaalsContact C-N 3.3Å; S952-E954 WeakPolarHBondContact CB-OE2 3.36Å; S952-E954 PolarHBondContact O-N 3.28Å; S952-E954 PolarHBondContact OG-N 3.22Å; S952-E954 PolarHBondContact OG-OE2 2.81Å; E954-L956 VanDerWaalsContact C-N 3.29Å; E954-L956 PolarHBondContact O-N 2.82Å; E954-E957 PolarHBondContact O-N 2.86Å; E954-L958 WeakPolarHBondContact O-CB 3.46Å; E954-L958 PolarHBondContact O-N 3.25Å
955	E	88.4	Confident	86.4	Confident	89 Å²	89	61.2 Å²	61.2	42%	0.416	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-38.3	176.1	-71.4	-175.5	159.7	0	0	111.8	M951 S952 A959	M951-E955 WeakPolarHBondContact CA-OE2 3.38Å; M951-E955 HydrophobicContact CB-CB 4.19Å; S952-E955 PolarHBondContact N-OE2 2.8Å; S952-E955 PolarHBondContact O-N 2.81Å; S952-E955 PolarHBondContact OG-N 2.89Å; E955-A959 WeakPolarHBondContact O-CB 3.37Å; E955-A959 PolarHBondContact O-N 2.66Å
956	L	89.6	Confident	86.4	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-49	177.9	176.8	60.2	0	0	0	111.4	M951 S952 A953 E954 A959 V960 I984 V988 I992 L1015 L1020	M951-L956 HydrophobicContact CE-CD1 3.87Å; S952-L956 VanDerWaalsContact O-CB 3.31Å; S952-L956 WeakPolarHBondContact O-CB 3.37Å; S952-L956 PolarHBondContact O-N 2.81Å; A953-L956 PolarHBondContact O-N 2.86Å; E954-L956 VanDerWaalsContact C-N 3.29Å; E954-L956 PolarHBondContact O-N 2.82Å; L956-A959 PolarHBondContact O-N 2.84Å; L956-V960 HydrophobicContact CD1-CG2 4.41Å; L956-V960 VanDerWaalsContact O-CG2 3.23Å; L956-V960 WeakPolarHBondContact O-CG2 3.44Å; L956-V960 PolarHBondContact O-N 3.39Å; L956-V960 VanDerWaalsContact O-N 3.08Å; L956-I984 HydrophobicContact CD2-CG2 3.79Å; L956-I984 HydrophobicContact CG-CG2 3.84Å; L956-V988 HydrophobicContact CD2-CB 4.49Å; L956-V988 HydrophobicContact CD2-CG1 3.81Å; L956-I992 HydrophobicContact CD2-CD1 3.94Å; L956-L1015 HydrophobicContact CD1-CD2 3.71Å; L956-L1015 HydrophobicContact CD2-CD2 3.98Å; L956-L1020 HydrophobicContact CD1-CD1 3.77Å; L956-L1020 HydrophobicContact CD1-CD2 3.69Å; L956-L1020 HydrophobicContact CD1-CG 4.27Å
957	E	89	Confident	86.5	Confident	56 Å²	56	66.1 Å²	66.1	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-60.1	-47.5	177.6	-74	176.3	173	0	0	110.9	A953 E954 A959 V960 E961 H985 C989 R993	A953-E957 PolarHBondContact O-N 3.39Å; A953-E957 VanDerWaalsContact O-N 3.12Å; E954-E957 PolarHBondContact O-N 2.86Å; E957-A959 PolarHBondContact O-N 3.5Å; E957-V960 PolarHBondContact O-N 2.87Å; E957-E961 WeakPolarHBondContact O-CG 3.38Å; E957-E961 PolarHBondContact O-N 3.35Å; E957-E961 VanDerWaalsContact O-N 3.15Å; E957-H985 IonicContact OE1-CE1 3.1Å; E957-H985 IonicContact OE1-CG 3.79Å; E957-H985 IonicContact OE1-ND1 2.87Å; E957-H985 PolarHBondContact OE1-ND1 3.24Å; E957-C989 PolarHBondContact OE1-SG 3.06Å; E957-R993 IonicContact OE1-NH2 2.66Å
958	L	89.6	Confident	86.2	Confident	112 Å²	112	60.2 Å²	60.2	59%	0.586	33%	0.327	S	S	*	.	H	α-helix	trans	-60.3	-44.2	177.2	-174.2	70.7	0	0	0	111.9	E954 V960 E961 V962	E954-L958 WeakPolarHBondContact O-CB 3.46Å; E954-L958 PolarHBondContact O-N 3.25Å; L958-V960 VanDerWaalsContact C-N 3.31Å; L958-V960 PolarHBondContact O-N 3.25Å; L958-E961 PolarHBondContact O-N 3Å; L958-V962 WeakPolarHBondContact O-CG2 3.29Å; L958-V962 PolarHBondContact O-N 2.98Å
959	A	89.9	Confident	86.1	Confident	26 Å²	26	58.1 Å²	58.1	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-40.8	179.9	0	0	0	0	0	111.8	E955 L956 E957 V962 V963 L1020	E955-A959 WeakPolarHBondContact O-CB 3.37Å; E955-A959 PolarHBondContact O-N 2.66Å; L956-A959 PolarHBondContact O-N 2.84Å; E957-A959 PolarHBondContact O-N 3.5Å; A959-V962 PolarHBondContact O-N 3.25Å; A959-V963 VanDerWaalsContact O-CG2 3.27Å; A959-V963 WeakPolarHBondContact O-CG2 3.38Å; A959-V963 PolarHBondContact O-N 3.47Å; A959-L1020 HydrophobicContact CB-CD2 3.86Å
960	V	89.5	Confident	85.9	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.024	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-42.6	177.5	172.8	0	0	0	0	111	L956 E957 L958 V963 F964 I980 I984 L1020	L956-V960 HydrophobicContact CD1-CG2 4.41Å; L956-V960 VanDerWaalsContact O-CG2 3.23Å; L956-V960 WeakPolarHBondContact O-CG2 3.44Å; L956-V960 PolarHBondContact O-N 3.39Å; L956-V960 VanDerWaalsContact O-N 3.08Å; E957-V960 PolarHBondContact O-N 2.87Å; L958-V960 VanDerWaalsContact C-N 3.31Å; L958-V960 PolarHBondContact O-N 3.25Å; V960-V963 PolarHBondContact O-N 3.02Å; V960-F964 HydrophobicContact CG1-CD2 4.08Å; V960-F964 HydrophobicContact CG1-CE2 3.41Å; V960-F964 VanDerWaalsContact CG1-CE2 3.41Å; V960-F964 HydrophobicContact CG1-CZ 3.73Å; V960-F964 WeakPolarHBondContact O-CD2 3.46Å; V960-F964 WeakPolarHBondContact O-CG 3.37Å; V960-F964 PolarHBondContact O-N 3.43Å; V960-I980 HydrophobicContact CG1-CG2 4.45Å; V960-I984 HydrophobicContact CB-CD1 4.37Å; V960-I984 HydrophobicContact CG1-CD1 4.2Å; V960-I984 HydrophobicContact CG2-CD1 3.31Å; V960-L1020 HydrophobicContact CG2-CD1 4.26Å; V960-L1020 HydrophobicContact CG2-CD2 4.26Å
961	E	87.8	Confident	85.7	Confident	94 Å²	94	68.5 Å²	68.5	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-41.2	177.8	-64.4	-153.3	137.1	0	0	112.5	E957 L958 F964 K981	E957-E961 WeakPolarHBondContact O-CG 3.38Å; E957-E961 PolarHBondContact O-N 3.35Å; E957-E961 VanDerWaalsContact O-N 3.15Å; L958-E961 PolarHBondContact O-N 3Å; E961-F964 PolarHBondContact O-N 2.93Å; E961-K981 IonicContact OE1-NZ 2.86Å; E961-K981 PolarHBondContact OE1-NZ 2.84Å
962	V	87.9	Confident	85.5	Confident	77 Å²	77	69.4 Å²	69.4	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-42.2	175.8	172.9	0	0	0	0	111	L958 A959 F964 Q965	L958-V962 WeakPolarHBondContact O-CG2 3.29Å; L958-V962 PolarHBondContact O-N 2.98Å; A959-V962 PolarHBondContact O-N 3.25Å; V962-F964 VanDerWaalsContact C-N 3.3Å; V962-F964 PolarHBondContact O-N 3.27Å; V962-Q965 WeakPolarHBondContact O-CB 3.26Å; V962-Q965 PolarHBondContact O-N 2.76Å; V962-Q965 VanDerWaalsContact O-N 3.09Å
963	V	86.3	Confident	85.3	Confident	28 Å²	28	70 Å²	70	17%	0.17	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-37.1	180	171.2	0	0	0	0	111.9	A959 V960 Q965 L966 F969 L1024	A959-V963 VanDerWaalsContact O-CG2 3.27Å; A959-V963 WeakPolarHBondContact O-CG2 3.38Å; A959-V963 PolarHBondContact O-N 3.47Å; V960-V963 PolarHBondContact O-N 3.02Å; V963-Q965 PolarHBondContact O-N 3.3Å; V963-L966 HydrophobicContact CG1-CD1 4.41Å; V963-L966 HydrophobicContact CG2-CD1 4.48Å; V963-L966 WeakPolarHBondContact O-CB 3.16Å; V963-L966 PolarHBondContact O-N 3.48Å; V963-L966 VanDerWaalsContact O-N 3.13Å; V963-F969 HydrophobicContact CG1-CD2 3.68Å; V963-F969 HydrophobicContact CG1-CE2 3.74Å; V963-F969 HydrophobicContact CG1-CG 4.11Å; V963-F969 HydrophobicContact CG1-CZ 4.19Å; V963-L1024 HydrophobicContact CB-CD1 3.95Å; V963-L1024 HydrophobicContact CG1-CD1 3.65Å; V963-L1024 HydrophobicContact CG2-CD1 4.09Å
964	F	85.3	Confident	85.3	Confident	29 Å²	29	74.1 Å²	74.1	13%	0.127	38%	0.381	C	S	.	.	H	α-helix	trans	-67.9	-16.6	176.9	-65.6	-32.7	0	0	0	114.3	V960 E961 V962 F969 C977 I980 K981	V960-F964 HydrophobicContact CG1-CD2 4.08Å; V960-F964 HydrophobicContact CG1-CE2 3.41Å; V960-F964 VanDerWaalsContact CG1-CE2 3.41Å; V960-F964 HydrophobicContact CG1-CZ 3.73Å; V960-F964 WeakPolarHBondContact O-CD2 3.46Å; V960-F964 WeakPolarHBondContact O-CG 3.37Å; V960-F964 PolarHBondContact O-N 3.43Å; E961-F964 PolarHBondContact O-N 2.93Å; V962-F964 VanDerWaalsContact C-N 3.3Å; V962-F964 PolarHBondContact O-N 3.27Å; F964-F969 HydrophobicContact CD1-CB 4.45Å; F964-C977 HydrophobicContact CE2-CB 4.38Å; F964-C977 HydrophobicContact CZ-CB 4.41Å; F964-I980 HydrophobicContact CE1-CD1 4.26Å; F964-I980 HydrophobicContact CZ-CB 4.05Å; F964-I980 HydrophobicContact CZ-CD1 4.18Å; F964-I980 HydrophobicContact CZ-CG2 3.87Å; F964-K981 HydrophobicContact CE2-CD 4.43Å; F964-K981 HydrophobicContact CE2-CG 3.83Å
965	Q	84.6	Confident	85.2	Confident	146 Å²	146	75 Å²	75	68%	0.682	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.3	174.3	-63.3	-180	6.3	0	0	113.1	V962 V963	V962-Q965 WeakPolarHBondContact O-CB 3.26Å; V962-Q965 PolarHBondContact O-N 2.76Å; V962-Q965 VanDerWaalsContact O-N 3.09Å; V963-Q965 PolarHBondContact O-N 3.3Å
966	L	86.1	Confident	85.1	Confident	92 Å²	92	70.7 Å²	70.7	48%	0.482	36%	0.36	S	S	.	.	S	Bend	trans	-71.2	143.8	177.7	-60.5	173.7	0	0	0	110.8	V963 A968 F969 R970	V963-L966 HydrophobicContact CG1-CD1 4.41Å; V963-L966 HydrophobicContact CG2-CD1 4.48Å; V963-L966 WeakPolarHBondContact O-CB 3.16Å; V963-L966 PolarHBondContact O-N 3.48Å; V963-L966 VanDerWaalsContact O-N 3.13Å; L966-A968 PolarHBondContact O-N 3.05Å; L966-A968 VanDerWaalsContact O-N 3.1Å; L966-F969 PolarHBondContact O-N 3.03Å; L966-R970 PolarHBondContact O-N 2.98Å
967	D	82.5	Confident	85.1	Confident	117 Å²	117	71.8 Å²	71.8	63%	0.626	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.3	-178.3	-70.4	-36.5	0	0	0	113	F969 R970	D967-F969 PolarHBondContact O-N 3.13Å; D967-R970 PolarHBondContact O-N 3.15Å; D967-R970 IonicContact OD1-CZ 2.95Å; D967-R970 IonicContact OD1-NH1 2.98Å; D967-R970 PolarHBondContact OD1-NH1 3.27Å
968	A	80.3	Confident	85.1	Confident	61 Å²	61	72.5 Å²	72.5	50%	0.504	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.2	176.7	0	0	0	0	0	113.8	L966 K1028	L966-A968 PolarHBondContact O-N 3.05Å; L966-A968 VanDerWaalsContact O-N 3.1Å; A968-K1028 WeakPolarHBondContact O-CE 3.24Å; A968-K1028 PolarHBondContact O-NZ 2.96Å
969	F	82.5	Confident	85.1	Confident	20 Å²	20	68.1 Å²	68.1	9%	0.088	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-2.9	-178.8	-65.5	-90.4	0	0	0	113.3	V963 F964 L966 D967 H971 L972 L1024 K1028	V963-F969 HydrophobicContact CG1-CD2 3.68Å; V963-F969 HydrophobicContact CG1-CE2 3.74Å; V963-F969 HydrophobicContact CG1-CG 4.11Å; V963-F969 HydrophobicContact CG1-CZ 4.19Å; F964-F969 HydrophobicContact CD1-CB 4.45Å; L966-F969 PolarHBondContact O-N 3.03Å; D967-F969 PolarHBondContact O-N 3.13Å; F969-H971 VanDerWaalsContact C-N 3.26Å; F969-H971 PolarHBondContact O-N 2.73Å; F969-L972 HydrophobicContact CB-CD1 4.39Å; F969-L972 HydrophobicContact CD1-CD1 3.87Å; F969-L972 HydrophobicContact CD1-CD2 4.38Å; F969-L972 WeakPolarHBondContact O-CB 3.4Å; F969-L972 PolarHBondContact O-N 3.25Å; F969-L1024 HydrophobicContact CE1-CB 4.22Å; F969-L1024 HydrophobicContact CZ-CB 4.26Å; F969-K1028 HydrophobicContact CD1-CD 4.1Å; F969-K1028 HydrophobicContact CE1-CB 3.95Å; F969-K1028 HydrophobicContact CE1-CD 3.86Å; F969-K1028 HydrophobicContact CE1-CG 4.47Å; F969-K1028 HydrophobicContact CZ-CD 4.41Å
970	R	78	Confident	85.2	Confident	165 Å²	165	67 Å²	67	62%	0.623	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.2	-174.1	-163.2	177.6	-146	159.8	1.5	114.1	L966 D967	L966-R970 PolarHBondContact O-N 2.98Å; D967-R970 PolarHBondContact O-N 3.15Å; D967-R970 IonicContact OD1-CZ 2.95Å; D967-R970 IonicContact OD1-NH1 2.98Å; D967-R970 PolarHBondContact OD1-NH1 3.27Å
971	H	80	Confident	85.2	Confident	178 Å²	178	70.9 Å²	70.9	82%	0.824	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	12.4	-179.1	-60.4	-65.6	0	0	0	113.7	F969	F969-H971 VanDerWaalsContact C-N 3.26Å; F969-H971 PolarHBondContact O-N 2.73Å
972	L	80.1	Confident	85.4	Confident	26 Å²	26	72.3 Å²	72.3	14%	0.136	37%	0.372	C	S	.	.	S	Bend	trans	-62.4	148.8	174.6	-115.1	78.5	0	0	0	111.3	F969 S974 L976 K1028	F969-L972 HydrophobicContact CB-CD1 4.39Å; F969-L972 HydrophobicContact CD1-CD1 3.87Å; F969-L972 HydrophobicContact CD1-CD2 4.38Å; F969-L972 WeakPolarHBondContact O-CB 3.4Å; F969-L972 PolarHBondContact O-N 3.25Å; L972-S974 PolarHBondContact O-N 3.05Å; L972-L976 HydrophobicContact CD2-CB 4.44Å; L972-L976 HydrophobicContact CD2-CD2 3.32Å; L972-L976 HydrophobicContact CD2-CG 3.83Å; L972-L976 HydrophobicContact CG-CD2 3.9Å; L972-K1028 HydrophobicContact CD1-CB 4.4Å; L972-K1028 HydrophobicContact CD1-CD 3.82Å; L972-K1028 HydrophobicContact CD1-CG 3.86Å
973	D	82.3	Confident	85.6	Confident	36 Å²	36	69.7 Å²	69.7	19%	0.193	35%	0.354	C	S	.	.			trans	-59.7	130.7	172.1	-164.8	-36.1	0	0	0	109.9	R912 R975 L976 C977 Y1031	R912-D973 IonicContact CZ-OD2 2.78Å; R912-D973 IonicContact NH1-OD2 3.69Å; R912-D973 PolarHBondContact NH1-OD2 3.32Å; R912-D973 IonicContact NH2-OD2 3.71Å; R912-D973 PolarHBondContact NH2-OD2 3.49Å; D973-R975 PolarHBondContact O-N 3.23Å; D973-R975 VanDerWaalsContact O-N 3.14Å; D973-R975 PolarHBondContact OD1-N 3.29Å; D973-R975 VanDerWaalsContact OD1-N 3.09Å; D973-L976 WeakPolarHBondContact O-CB 3.47Å; D973-L976 PolarHBondContact O-N 2.71Å; D973-C977 PolarHBondContact O-N 3.1Å; D973-C977 VanDerWaalsContact O-N 3.17Å; D973-Y1031 HydrophobicContact CB-CE1 3.95Å; D973-Y1031 WeakPolarHBondContact CB-OH 3.43Å; D973-Y1031 PolarHBondContact OD2-OH 2.84Å
974	S	85.2	Confident	85.9	Confident	88 Å²	88	68.5 Å²	68.5	62%	0.615	35%	0.347	S	S	*	.	H	α-helix	trans	-57.6	-30.7	-178.6	63.3	0	0	0	0	112.1	L972 C977 S978	L972-S974 PolarHBondContact O-N 3.05Å; S974-C977 PolarHBondContact O-N 3.28Å; S974-S978 WeakPolarHBondContact O-CB 3.31Å; S974-S978 PolarHBondContact O-N 3.24Å; S974-S978 PolarHBondContact O-OG 3.33Å
975	R	84.6	Confident	86.2	Confident	129 Å²	129	71.6 Å²	71.6	49%	0.487	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-39.2	176	-166.7	176.3	-176.9	-166	-1.9	112	D916 D973 A979	D916-R975 IonicContact OD2-NH1 3.93Å; D916-R975 PolarHBondContact OD2-NH1 3.32Å; D973-R975 PolarHBondContact O-N 3.23Å; D973-R975 VanDerWaalsContact O-N 3.14Å; D973-R975 PolarHBondContact OD1-N 3.29Å; D973-R975 VanDerWaalsContact OD1-N 3.09Å; R975-A979 WeakPolarHBondContact O-CB 3.46Å; R975-A979 PolarHBondContact O-N 3.5Å
976	L	86.6	Confident	86.6	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-68.2	-46.1	176.3	174.4	62.1	0	0	0	110.8	F928 F932 L972 D973 S978 A979 I980 V1027 Y1031	F928-L976 HydrophobicContact CE1-CD1 3.74Å; F928-L976 HydrophobicContact CZ-CB 4.46Å; F928-L976 HydrophobicContact CZ-CD1 3.58Å; F932-L976 HydrophobicContact CE1-CD1 4.37Å; F932-L976 HydrophobicContact CZ-CD1 4.11Å; L972-L976 HydrophobicContact CD2-CB 4.44Å; L972-L976 HydrophobicContact CD2-CD2 3.32Å; L972-L976 HydrophobicContact CD2-CG 3.83Å; L972-L976 HydrophobicContact CG-CD2 3.9Å; D973-L976 WeakPolarHBondContact O-CB 3.47Å; D973-L976 PolarHBondContact O-N 2.71Å; L976-S978 VanDerWaalsContact C-N 3.27Å; L976-S978 PolarHBondContact O-N 3.02Å; L976-A979 PolarHBondContact O-N 3.02Å; L976-I980 HydrophobicContact CD1-CD1 3.82Å; L976-I980 HydrophobicContact CD1-CG1 3.99Å; L976-I980 HydrophobicContact CG-CD1 3.83Å; L976-I980 HydrophobicContact CG-CG1 4.4Å; L976-I980 WeakPolarHBondContact O-CG1 3.27Å; L976-I980 PolarHBondContact O-N 3.02Å; L976-V1027 HydrophobicContact CD1-CG1 3.94Å; L976-Y1031 HydrophobicContact CB-CD2 4.33Å; L976-Y1031 HydrophobicContact CB-CE2 4.16Å; L976-Y1031 HydrophobicContact CD1-CD2 4.12Å; L976-Y1031 HydrophobicContact CD2-CD1 3.8Å; L976-Y1031 HydrophobicContact CD2-CD2 3.91Å; L976-Y1031 HydrophobicContact CD2-CE1 4.38Å; L976-Y1031 HydrophobicContact CD2-CE2 4.48Å; L976-Y1031 HydrophobicContact CD2-CG 3.54Å; L976-Y1031 HydrophobicContact CG-CD2 4.35Å; L976-Y1031 HydrophobicContact CG-CG 4.46Å
977	C	88.7	Confident	86.7	Confident	24 Å²	24	67.1 Å²	67.1	16%	0.162	35%	0.347	C	S	.	.	H	α-helix	trans	-56.5	-44.2	176.3	-68.5	0	0	0	0	111.5	F964 D973 S974 I980 K981	F964-C977 HydrophobicContact CE2-CB 4.38Å; F964-C977 HydrophobicContact CZ-CB 4.41Å; D973-C977 PolarHBondContact O-N 3.1Å; D973-C977 VanDerWaalsContact O-N 3.17Å; S974-C977 PolarHBondContact O-N 3.28Å; C977-I980 PolarHBondContact O-N 3.46Å; C977-K981 WeakPolarHBondContact O-CG 3.47Å; C977-K981 PolarHBondContact O-N 3.12Å
978	S	89.7	Confident	87	Confident	70 Å²	70	62.4 Å²	62.4	49%	0.49	32%	0.322	S	S	.	.	H	α-helix	trans	-63.8	-45.3	178.4	-55.2	0	0	0	0	111.6	S974 L976 I980 K981 E982	S974-S978 WeakPolarHBondContact O-CB 3.31Å; S974-S978 PolarHBondContact O-N 3.24Å; S974-S978 PolarHBondContact O-OG 3.33Å; L976-S978 VanDerWaalsContact C-N 3.27Å; L976-S978 PolarHBondContact O-N 3.02Å; S978-I980 PolarHBondContact O-N 3Å; S978-K981 PolarHBondContact O-N 3.34Å; S978-E982 VanDerWaalsContact O-CB 3.32Å; S978-E982 WeakPolarHBondContact O-CB 3.41Å; S978-E982 PolarHBondContact O-N 3.47Å
979	A	90.1	Very high	87.4	Confident	20 Å²	20	59.5 Å²	59.5	17%	0.165	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-38.5	177.9	0	0	0	0	0	112.9	F928 F932 R975 L976 F983	F928-A979 HydrophobicContact CE2-CB 4.23Å; F928-A979 HydrophobicContact CZ-CB 4.17Å; F932-A979 HydrophobicContact CE2-CB 4.11Å; F932-A979 HydrophobicContact CZ-CB 4.26Å; R975-A979 WeakPolarHBondContact O-CB 3.46Å; R975-A979 PolarHBondContact O-N 3.5Å; L976-A979 PolarHBondContact O-N 3.02Å; A979-F983 VanDerWaalsContact O-CB 3.3Å; A979-F983 WeakPolarHBondContact O-CB 3.25Å; A979-F983 PolarHBondContact O-N 2.94Å
980	I	90.6	Very high	87.8	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-66.1	-47.1	175.4	-66.7	166.8	0	0	0	110.4	F932 V960 F964 L976 C977 S978 E982 F983 I984 L1024 V1027	F932-I980 HydrophobicContact CE1-CG1 4.01Å; F932-I980 HydrophobicContact CZ-CG1 4.13Å; V960-I980 HydrophobicContact CG1-CG2 4.45Å; F964-I980 HydrophobicContact CE1-CD1 4.26Å; F964-I980 HydrophobicContact CZ-CB 4.05Å; F964-I980 HydrophobicContact CZ-CD1 4.18Å; F964-I980 HydrophobicContact CZ-CG2 3.87Å; L976-I980 HydrophobicContact CD1-CD1 3.82Å; L976-I980 HydrophobicContact CD1-CG1 3.99Å; L976-I980 HydrophobicContact CG-CD1 3.83Å; L976-I980 HydrophobicContact CG-CG1 4.4Å; L976-I980 WeakPolarHBondContact O-CG1 3.27Å; L976-I980 PolarHBondContact O-N 3.02Å; C977-I980 PolarHBondContact O-N 3.46Å; S978-I980 PolarHBondContact O-N 3Å; I980-E982 VanDerWaalsContact C-N 3.32Å; I980-E982 PolarHBondContact O-N 3.39Å; I980-F983 PolarHBondContact O-N 3.31Å; I980-I984 HydrophobicContact CG2-CD1 3.78Å; I980-I984 HydrophobicContact CG2-CG1 4.42Å; I980-I984 WeakPolarHBondContact O-CB 3.31Å; I980-I984 WeakPolarHBondContact O-CG1 3.21Å; I980-I984 PolarHBondContact O-N 2.96Å; I980-L1024 HydrophobicContact CD1-CD2 4.39Å; I980-L1024 HydrophobicContact CG2-CD2 3.85Å; I980-V1027 HydrophobicContact CD1-CG1 3.85Å; I980-V1027 HydrophobicContact CG1-CG1 4.26Å
981	K	90.9	Very high	88.3	Confident	86 Å²	86	58.9 Å²	58.9	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-58.6	-46.9	177.1	-73.4	-167.5	177.2	-158.3	0	110.9	E961 F964 C977 S978 I984 H985	E961-K981 IonicContact OE1-NZ 2.86Å; E961-K981 PolarHBondContact OE1-NZ 2.84Å; F964-K981 HydrophobicContact CE2-CD 4.43Å; F964-K981 HydrophobicContact CE2-CG 3.83Å; C977-K981 WeakPolarHBondContact O-CG 3.47Å; C977-K981 PolarHBondContact O-N 3.12Å; S978-K981 PolarHBondContact O-N 3.34Å; K981-I984 PolarHBondContact O-N 3.01Å; K981-H985 VanDerWaalsContact O-CB 3.23Å; K981-H985 WeakPolarHBondContact O-CB 3.45Å; K981-H985 PolarHBondContact O-N 3.17Å
982	E	92.1	Very high	88.6	Confident	123 Å²	123	50.9 Å²	50.9	58%	0.575	27%	0.266	S	S	*	.	H	α-helix	trans	-62.2	-44.3	179	-168.4	-179.8	178.4	0	0	111.6	S978 I980 N986	S978-E982 VanDerWaalsContact O-CB 3.32Å; S978-E982 WeakPolarHBondContact O-CB 3.41Å; S978-E982 PolarHBondContact O-N 3.47Å; I980-E982 VanDerWaalsContact C-N 3.32Å; I980-E982 PolarHBondContact O-N 3.39Å; E982-N986 WeakPolarHBondContact CG-ND2 3.47Å; E982-N986 WeakPolarHBondContact O-CB 3.34Å; E982-N986 PolarHBondContact O-N 3.35Å
983	F	91.9	Very high	88.9	Confident	23 Å²	23	53.6 Å²	53.6	10%	0.101	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-47.3	176.3	172.8	-110.3	0	0	0	112	F932 V933 M936 A979 I980 S987 V988 F1023	F932-F983 HydrophobicContact CB-CD1 3.67Å; F932-F983 HydrophobicContact CB-CD2 3.86Å; F932-F983 HydrophobicContact CB-CE1 3.66Å; F932-F983 HydrophobicContact CB-CE2 3.86Å; F932-F983 HydrophobicContact CB-CG 3.76Å; F932-F983 HydrophobicContact CB-CZ 3.75Å; F932-F983 HydrophobicContact CD2-CB 4.16Å; F932-F983 HydrophobicContact CD2-CG 4.19Å; F932-F983 HydrophobicContact CG-CD1 4.2Å; F932-F983 HydrophobicContact CG-CG 4.17Å; V933-F983 HydrophobicContact CG2-CE2 3.69Å; V933-F983 HydrophobicContact CG2-CZ 4.27Å; M936-F983 HydrophobicContact CE-CE1 4.26Å; A979-F983 VanDerWaalsContact O-CB 3.3Å; A979-F983 WeakPolarHBondContact O-CB 3.25Å; A979-F983 PolarHBondContact O-N 2.94Å; I980-F983 PolarHBondContact O-N 3.31Å; F983-S987 WeakPolarHBondContact O-CA 3.48Å; F983-S987 WeakPolarHBondContact O-CB 3.31Å; F983-S987 PolarHBondContact O-N 3.39Å; F983-V988 HydrophobicContact CD1-CG2 4.2Å; F983-V988 HydrophobicContact CE1-CG2 3.66Å; F983-V988 HydrophobicContact CE2-CG2 4.49Å; F983-V988 HydrophobicContact CZ-CG2 3.83Å; F983-V988 PolarHBondContact O-N 2.99Å; F983-F1023 HydrophobicContact CD1-CZ 4.28Å; F983-F1023 HydrophobicContact CE1-CZ 4.06Å
984	I	91.9	Very high	89.1	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.015	30%	0.296	C	S	.	.	I	π-helix	trans	-64.9	-49.1	-179.1	-69.3	177.7	0	0	0	110.2	L956 V960 I980 K981 V988 C989 L1020	L956-I984 HydrophobicContact CD2-CG2 3.79Å; L956-I984 HydrophobicContact CG-CG2 3.84Å; V960-I984 HydrophobicContact CB-CD1 4.37Å; V960-I984 HydrophobicContact CG1-CD1 4.2Å; V960-I984 HydrophobicContact CG2-CD1 3.31Å; I980-I984 HydrophobicContact CG2-CD1 3.78Å; I980-I984 HydrophobicContact CG2-CG1 4.42Å; I980-I984 WeakPolarHBondContact O-CB 3.31Å; I980-I984 WeakPolarHBondContact O-CG1 3.21Å; I980-I984 PolarHBondContact O-N 2.96Å; K981-I984 PolarHBondContact O-N 3.01Å; I984-V988 PolarHBondContact O-N 3.36Å; I984-V988 VanDerWaalsContact O-N 3.13Å; I984-C989 PolarHBondContact O-N 2.92Å; I984-C989 PolarHBondContact O-SG 2.84Å; I984-C989 VanDerWaalsContact O-SG 3.39Å; I984-L1020 HydrophobicContact CD1-CD1 4.45Å
985	H	92	Very high	89	Confident	93 Å²	93	57.1 Å²	57.1	43%	0.431	28%	0.275	S	S	.	.	I	π-helix	trans	-66.8	-43.4	-177.8	-172.1	70.3	0	0	0	113.2	E957 K981 P990	E957-H985 IonicContact OE1-CE1 3.1Å; E957-H985 IonicContact OE1-CG 3.79Å; E957-H985 IonicContact OE1-ND1 2.87Å; E957-H985 PolarHBondContact OE1-ND1 3.24Å; K981-H985 VanDerWaalsContact O-CB 3.23Å; K981-H985 WeakPolarHBondContact O-CB 3.45Å; K981-H985 PolarHBondContact O-N 3.17Å; H985-P990 WeakPolarHBondContact O-CD 3.39Å; H985-P990 WeakPolarHBondContact O-CG 3.18Å
986	N	91.8	Very high	88.8	Confident	91 Å²	91	53.3 Å²	53.3	49%	0.487	26%	0.263	S	S	.	.	I	π-helix	trans	-88.8	-28.5	-173.8	-65.8	-18	0	0	0	113.5	E982 P990	E982-N986 WeakPolarHBondContact CG-ND2 3.47Å; E982-N986 WeakPolarHBondContact O-CB 3.34Å; E982-N986 PolarHBondContact O-N 3.35Å; N986-P990 WeakPolarHBondContact O-CG 3.49Å
987	S	88.3	Confident	88.6	Confident	53 Å²	53	58.6 Å²	58.6	37%	0.371	29%	0.288	S	S	.	.	I	π-helix	trans	-111.8	-40.5	-172.3	-51.8	0	0	0	0	113.6	F983 R991	F983-S987 WeakPolarHBondContact O-CA 3.48Å; F983-S987 WeakPolarHBondContact O-CB 3.31Å; F983-S987 PolarHBondContact O-N 3.39Å; S987-R991 WeakPolarHBondContact O-CD 3.47Å; S987-R991 WeakPolarHBondContact O-CG 3.36Å
988	V	89.4	Confident	88.3	Confident	18 Å²	18	62.5 Å²	62.5	11%	0.109	30%	0.299	C	S	.	.	I	π-helix	trans	-92.2	-54.6	-171.9	-175.8	0	0	0	0	111.4	L956 F983 I984 P990 R991 I992 L1015	L956-V988 HydrophobicContact CD2-CB 4.49Å; L956-V988 HydrophobicContact CD2-CG1 3.81Å; F983-V988 HydrophobicContact CD1-CG2 4.2Å; F983-V988 HydrophobicContact CE1-CG2 3.66Å; F983-V988 HydrophobicContact CE2-CG2 4.49Å; F983-V988 HydrophobicContact CZ-CG2 3.83Å; F983-V988 PolarHBondContact O-N 2.99Å; I984-V988 PolarHBondContact O-N 3.36Å; I984-V988 VanDerWaalsContact O-N 3.13Å; V988-P990 VanDerWaalsContact C-CD 3.49Å; V988-R991 PolarHBondContact O-N 2.88Å; V988-R991 VanDerWaalsContact O-N 3.13Å; V988-I992 HydrophobicContact CG1-CD1 3.82Å; V988-I992 HydrophobicContact CG1-CG1 4.43Å; V988-I992 PolarHBondContact O-N 3.16Å; V988-I992 VanDerWaalsContact O-N 3.09Å; V988-L1015 HydrophobicContact CG1-CD2 4.37Å
989	C	89.2	Confident	87.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-53.8	-44	-179.8	-69	0	0	0	0	113.3	A953 E957 I984 R991 I992 R993	A953-C989 HydrophobicContact CB-CB 4.14Å; E957-C989 PolarHBondContact OE1-SG 3.06Å; I984-C989 PolarHBondContact O-N 2.92Å; I984-C989 PolarHBondContact O-SG 2.84Å; I984-C989 VanDerWaalsContact O-SG 3.39Å; C989-R991 VanDerWaalsContact C-N 3.31Å; C989-R991 PolarHBondContact O-N 2.84Å; C989-I992 PolarHBondContact O-N 3.35Å; C989-R993 WeakPolarHBondContact O-CG 3.19Å; C989-R993 PolarHBondContact O-N 3.48Å
990	P	91	Very high	87.1	Confident	57 Å²	57	63.2 Å²	63.2	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-33	-179	-23.2	37.4	0	0	0	112.6	H985 N986 V988 K994	H985-P990 WeakPolarHBondContact O-CD 3.39Å; H985-P990 WeakPolarHBondContact O-CG 3.18Å; N986-P990 WeakPolarHBondContact O-CG 3.49Å; V988-P990 VanDerWaalsContact C-CD 3.49Å; P990-K994 VanDerWaalsContact O-CB 3.24Å; P990-K994 WeakPolarHBondContact O-CB 3.26Å; P990-K994 PolarHBondContact O-N 2.77Å
991	R	87.5	Confident	86.4	Confident	116 Å²	116	70.2 Å²	70.2	44%	0.438	33%	0.331	S	S	.	.	H	α-helix	trans	-68.1	-43.5	175.4	-69.8	171.9	67.8	172.8	-0.4	111	S987 V988 C989 W995 E1013	S987-R991 WeakPolarHBondContact O-CD 3.47Å; S987-R991 WeakPolarHBondContact O-CG 3.36Å; V988-R991 PolarHBondContact O-N 2.88Å; V988-R991 VanDerWaalsContact O-N 3.13Å; C989-R991 VanDerWaalsContact C-N 3.31Å; C989-R991 PolarHBondContact O-N 2.84Å; R991-W995 WeakPolarHBondContact O-CB 3.46Å; R991-W995 PolarHBondContact O-N 2.58Å; R991-E1013 HydrophobicContact CB-CG 4.34Å; R991-E1013 IonicContact CZ-OE1 3.42Å; R991-E1013 IonicContact CZ-OE2 3.03Å; R991-E1013 IonicContact NE-OE1 3.02Å; R991-E1013 PolarHBondContact NE-OE1 3.06Å; R991-E1013 IonicContact NE-OE2 3.85Å; R991-E1013 IonicContact NH2-OE1 2.72Å; R991-E1013 PolarHBondContact NH2-OE1 2.86Å; R991-E1013 IonicContact NH2-OE2 2.78Å; R991-E1013 PolarHBondContact NH2-OE2 3.35Å
992	I	86.3	Confident	85.6	Confident	9 Å²	9	71.4 Å²	71.4	5%	0.046	34%	0.338	C	S	.	.	H	α-helix	trans	-63.3	-49.4	176.7	-65.1	175.2	0	0	0	110.3	L956 V988 C989 K994 W995 Q996 E1013	L956-I992 HydrophobicContact CD2-CD1 3.94Å; V988-I992 HydrophobicContact CG1-CD1 3.82Å; V988-I992 HydrophobicContact CG1-CG1 4.43Å; V988-I992 PolarHBondContact O-N 3.16Å; V988-I992 VanDerWaalsContact O-N 3.09Å; C989-I992 PolarHBondContact O-N 3.35Å; I992-K994 PolarHBondContact O-N 3.26Å; I992-W995 PolarHBondContact O-N 2.89Å; I992-Q996 HydrophobicContact CG2-CG 4.28Å; I992-Q996 WeakPolarHBondContact O-CB 3.44Å; I992-Q996 WeakPolarHBondContact O-CG 3.31Å; I992-Q996 PolarHBondContact O-N 3.33Å; I992-E1013 HydrophobicContact CG1-CB 4.41Å
993	R	87.2	Confident	84.2	Confident	83 Å²	83	66.6 Å²	66.6	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-50.6	178.2	-74	-175.4	-174	137.1	8.9	111.7	A953 E957 C989 W995 Q996 E997	A953-R993 HydrophobicContact CB-CG 3.69Å; E957-R993 IonicContact OE1-NH2 2.66Å; C989-R993 WeakPolarHBondContact O-CG 3.19Å; C989-R993 PolarHBondContact O-N 3.48Å; R993-W995 VanDerWaalsContact C-N 3.27Å; R993-W995 PolarHBondContact O-N 2.84Å; R993-Q996 WeakPolarHBondContact O-CB 3.17Å; R993-Q996 PolarHBondContact O-N 2.96Å; R993-Q996 VanDerWaalsContact O-N 3.1Å; R993-E997 WeakPolarHBondContact O-CB 3.27Å; R993-E997 WeakPolarHBondContact O-CG 3.23Å; R993-E997 PolarHBondContact O-N 3.4Å
994	K	86.3	Confident	82.4	Confident	152 Å²	152	73.7 Å²	73.7	66%	0.661	36%	0.358	S	S	*	.	H	α-helix	trans	-60.3	-37.2	179.1	-172.8	174	-177.2	176.8	0	112.5	P990 I992 W998	P990-K994 VanDerWaalsContact O-CB 3.24Å; P990-K994 WeakPolarHBondContact O-CB 3.26Å; P990-K994 PolarHBondContact O-N 2.77Å; I992-K994 PolarHBondContact O-N 3.26Å; K994-W998 WeakPolarHBondContact O-CB 3.12Å; K994-W998 PolarHBondContact O-N 2.88Å
995	W	83.2	Confident	80.7	Confident	46 Å²	46	77.6 Å²	77.6	17%	0.174	40%	0.399	C	S	.	.	H	α-helix	trans	-70.3	-40.2	175.3	-178.3	-108.5	0	0	0	112.3	R991 I992 R993 W998 C999 L1008 N1012 E1013	R991-W995 WeakPolarHBondContact O-CB 3.46Å; R991-W995 PolarHBondContact O-N 2.58Å; I992-W995 PolarHBondContact O-N 2.89Å; R993-W995 VanDerWaalsContact C-N 3.27Å; R993-W995 PolarHBondContact O-N 2.84Å; W995-W998 HydrophobicContact CE3-CE3 4.1Å; W995-W998 HydrophobicContact CH2-CD2 4.39Å; W995-W998 AromaticContact CH2-CE3 3.47Å; W995-W998 HydrophobicContact CH2-CE3 3.47Å; W995-W998 VanDerWaalsContact CH2-CE3 3.47Å; W995-W998 HydrophobicContact CH2-CH2 4.25Å; W995-W998 AromaticContact CH2-CZ3 3.39Å; W995-W998 HydrophobicContact CH2-CZ3 3.39Å; W995-W998 AromaticContact CZ2-CE3 4Å; W995-W998 HydrophobicContact CZ2-CE3 4Å; W995-W998 AromaticContact CZ2-CZ3 3.97Å; W995-W998 HydrophobicContact CZ2-CZ3 3.97Å; W995-W998 HydrophobicContact CZ3-CD2 4.05Å; W995-W998 AromaticContact CZ3-CE3 3.53Å; W995-W998 HydrophobicContact CZ3-CE3 3.53Å; W995-W998 AromaticContact CZ3-CZ3 3.88Å; W995-W998 HydrophobicContact CZ3-CZ3 3.88Å; W995-W998 PolarHBondContact O-N 2.92Å; W995-C999 PolarHBondContact NE1-SG 3.39Å; W995-C999 WeakPolarHBondContact O-CB 3.47Å; W995-C999 PolarHBondContact O-N 2.9Å; W995-C999 PolarHBondContact O-SG 3.38Å; W995-L1008 PolarHBondContact NE1-O 3.21Å; W995-N1012 HydrophobicContact CD2-CB 3.56Å; W995-N1012 HydrophobicContact CE3-CB 3.98Å; W995-N1012 HydrophobicContact CG-CB 4.2Å; W995-N1012 HydrophobicContact CH2-CB 3.71Å; W995-N1012 WeakPolarHBondContact CH2-ND2 3.47Å; W995-N1012 HydrophobicContact CZ2-CB 3.26Å; W995-N1012 HydrophobicContact CZ3-CB 4.04Å; W995-N1012 VanDerWaalsContact CZ3-ND2 3.31Å; W995-N1012 WeakPolarHBondContact CZ3-ND2 3.42Å; W995-N1012 PolarHBondContact NE1-O 3.36Å; W995-E1013 HydrophobicContact CB-CB 4.31Å; W995-E1013 HydrophobicContact CB-CG 4.35Å; W995-E1013 HydrophobicContact CG-CB 4.49Å
996	Q	79.8	Confident	79.2	Confident	49 Å²	49	76.2 Å²	76.2	23%	0.229	40%	0.4	C	S	.	.	H	α-helix	trans	-63.6	-45.8	175.6	-74.1	176.1	-31.5	0	0	111.4	I992 R993 W998 C999 T1000	I992-Q996 HydrophobicContact CG2-CG 4.28Å; I992-Q996 WeakPolarHBondContact O-CB 3.44Å; I992-Q996 WeakPolarHBondContact O-CG 3.31Å; I992-Q996 PolarHBondContact O-N 3.33Å; R993-Q996 WeakPolarHBondContact O-CB 3.17Å; R993-Q996 PolarHBondContact O-N 2.96Å; R993-Q996 VanDerWaalsContact O-N 3.1Å; Q996-W998 PolarHBondContact O-N 2.94Å; Q996-C999 WeakPolarHBondContact O-CB 3.44Å; Q996-C999 PolarHBondContact O-N 3.4Å; Q996-T1000 WeakPolarHBondContact O-CG2 3.37Å; Q996-T1000 PolarHBondContact O-N 3.02Å; Q996-T1000 PolarHBondContact O-OG1 2.89Å
997	E	82.5	Confident	77.9	Confident	111 Å²	111	77.6 Å²	77.6	52%	0.519	41%	0.408	S	S	.	.	H	α-helix	trans	-55.9	-50.3	173	-73.4	167	-172.7	0	0	110.8	R993 C999 T1000 E1001	R993-E997 WeakPolarHBondContact O-CB 3.27Å; R993-E997 WeakPolarHBondContact O-CG 3.23Å; R993-E997 PolarHBondContact O-N 3.4Å; E997-C999 VanDerWaalsContact C-N 3.31Å; E997-C999 PolarHBondContact O-N 3.01Å; E997-T1000 VanDerWaalsContact CA-OG1 3.31Å; E997-T1000 WeakPolarHBondContact CA-OG1 3.35Å; E997-T1000 PolarHBondContact O-N 3.44Å; E997-T1000 VanDerWaalsContact O-N 3.11Å; E997-T1000 PolarHBondContact O-OG1 3.35Å; E997-E1001 WeakPolarHBondContact O-CG 3.43Å; E997-E1001 PolarHBondContact O-N 2.78Å
998	W	82.8	Confident	76.9	Confident	106 Å²	106	77.5 Å²	77.5	40%	0.402	40%	0.402	S	S	.	.	H	α-helix	trans	-59	-42.6	177	-173.9	84.4	0	0	0	112.2	K994 W995 Q996 E1001 H1002	K994-W998 WeakPolarHBondContact O-CB 3.12Å; K994-W998 PolarHBondContact O-N 2.88Å; W995-W998 HydrophobicContact CE3-CE3 4.1Å; W995-W998 HydrophobicContact CH2-CD2 4.39Å; W995-W998 AromaticContact CH2-CE3 3.47Å; W995-W998 HydrophobicContact CH2-CE3 3.47Å; W995-W998 VanDerWaalsContact CH2-CE3 3.47Å; W995-W998 HydrophobicContact CH2-CH2 4.25Å; W995-W998 AromaticContact CH2-CZ3 3.39Å; W995-W998 HydrophobicContact CH2-CZ3 3.39Å; W995-W998 AromaticContact CZ2-CE3 4Å; W995-W998 HydrophobicContact CZ2-CE3 4Å; W995-W998 AromaticContact CZ2-CZ3 3.97Å; W995-W998 HydrophobicContact CZ2-CZ3 3.97Å; W995-W998 HydrophobicContact CZ3-CD2 4.05Å; W995-W998 AromaticContact CZ3-CE3 3.53Å; W995-W998 HydrophobicContact CZ3-CE3 3.53Å; W995-W998 AromaticContact CZ3-CZ3 3.88Å; W995-W998 HydrophobicContact CZ3-CZ3 3.88Å; W995-W998 PolarHBondContact O-N 2.92Å; Q996-W998 PolarHBondContact O-N 2.94Å; W998-E1001 PolarHBondContact O-N 3.1Å; W998-H1002 AromaticContact CD1-CE1 3.69Å; W998-H1002 AromaticContact CD1-ND1 3.62Å; W998-H1002 HydrophobicContact CD2-CB 4.46Å; W998-H1002 AromaticContact CE2-CG 3.83Å; W998-H1002 AromaticContact CE2-ND1 3.81Å; W998-H1002 AromaticContact CG-ND1 3.95Å; W998-H1002 HydrophobicContact CH2-CB 4.23Å; W998-H1002 HydrophobicContact CZ2-CB 4.12Å; W998-H1002 HydrophobicContact CZ3-CB 4.44Å; W998-H1002 AromaticContact NE1-CE1 3.55Å; W998-H1002 AromaticContact NE1-CG 3.9Å; W998-H1002 AromaticContact NE1-ND1 3.53Å; W998-H1002 AromaticContact NE1-NE2 3.86Å; W998-H1002 WeakPolarHBondContact O-CB 3.4Å; W998-H1002 PolarHBondContact O-N 3.06Å; W998-H1002 PolarHBondContact O-ND1 3.07Å
999	C	77.6	Confident	75.7	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.007	42%	0.416	C	S	.	.	H	α-helix	trans	-64	-42.2	175.2	-71	0	0	0	0	111.9	W995 Q996 E997 E1001 H1002 A1003 I1009	W995-C999 PolarHBondContact NE1-SG 3.39Å; W995-C999 WeakPolarHBondContact O-CB 3.47Å; W995-C999 PolarHBondContact O-N 2.9Å; W995-C999 PolarHBondContact O-SG 3.38Å; Q996-C999 WeakPolarHBondContact O-CB 3.44Å; Q996-C999 PolarHBondContact O-N 3.4Å; E997-C999 VanDerWaalsContact C-N 3.31Å; E997-C999 PolarHBondContact O-N 3.01Å; C999-E1001 PolarHBondContact O-N 2.97Å; C999-H1002 PolarHBondContact O-N 2.9Å; C999-A1003 WeakPolarHBondContact O-CA 3.31Å; C999-A1003 WeakPolarHBondContact O-CB 3.45Å; C999-A1003 PolarHBondContact O-N 2.81Å; C999-I1009 HydrophobicContact CB-CD1 4.49Å; C999-I1009 HydrophobicContact CB-CG1 3.61Å
1000	T	77.5	Confident	74.7	Confident	104 Å²	104	81.9 Å²	81.9	64%	0.638	42%	0.424	S	S	*	.	H	α-helix	trans	-64.1	-31.9	178.2	49.9	0	0	0	0	112.4	Q996 E997	Q996-T1000 WeakPolarHBondContact O-CG2 3.37Å; Q996-T1000 PolarHBondContact O-N 3.02Å; Q996-T1000 PolarHBondContact O-OG1 2.89Å; E997-T1000 VanDerWaalsContact CA-OG1 3.31Å; E997-T1000 WeakPolarHBondContact CA-OG1 3.35Å; E997-T1000 PolarHBondContact O-N 3.44Å; E997-T1000 VanDerWaalsContact O-N 3.11Å; E997-T1000 PolarHBondContact O-OG1 3.35Å
1001	E	76.2	Confident	73.7	Confident	150 Å²	150	86.2 Å²	86.2	70%	0.701	44%	0.44	S	S	*	.	H	α-helix	trans	-78	-33.2	176.8	-71.8	178.1	171.4	0	0	113.3	E997 W998 C999	E997-E1001 WeakPolarHBondContact O-CG 3.43Å; E997-E1001 PolarHBondContact O-N 2.78Å; W998-E1001 PolarHBondContact O-N 3.1Å; C999-E1001 PolarHBondContact O-N 2.97Å
1002	H	73.9	Confident	72.9	Confident	112 Å²	112	84.8 Å²	84.8	52%	0.519	44%	0.441	S	S	.	.	H	α-helix	trans	-114.7	-13.9	-167.4	-62.6	77.2	0	0	0	114.9	W998 C999	W998-H1002 AromaticContact CD1-CE1 3.69Å; W998-H1002 AromaticContact CD1-ND1 3.62Å; W998-H1002 HydrophobicContact CD2-CB 4.46Å; W998-H1002 AromaticContact CE2-CG 3.83Å; W998-H1002 AromaticContact CE2-ND1 3.81Å; W998-H1002 AromaticContact CG-ND1 3.95Å; W998-H1002 HydrophobicContact CH2-CB 4.23Å; W998-H1002 HydrophobicContact CZ2-CB 4.12Å; W998-H1002 HydrophobicContact CZ3-CB 4.44Å; W998-H1002 AromaticContact NE1-CE1 3.55Å; W998-H1002 AromaticContact NE1-CG 3.9Å; W998-H1002 AromaticContact NE1-ND1 3.53Å; W998-H1002 AromaticContact NE1-NE2 3.86Å; W998-H1002 WeakPolarHBondContact O-CB 3.4Å; W998-H1002 PolarHBondContact O-N 3.06Å; W998-H1002 PolarHBondContact O-ND1 3.07Å; C999-H1002 PolarHBondContact O-N 2.9Å
1003	A	62.5	Low	72.6	Confident	21 Å²	21	86.4 Å²	86.4	17%	0.174	45%	0.448	C	S	.	.			trans	-110.2	87	-173.7	0	0	0	0	0	112.2	C999 G1005 L1008	C999-A1003 WeakPolarHBondContact O-CA 3.31Å; C999-A1003 WeakPolarHBondContact O-CB 3.45Å; C999-A1003 PolarHBondContact O-N 2.81Å; A1003-G1005 VanDerWaalsContact C-N 3.31Å; A1003-G1005 PolarHBondContact O-N 3.42Å; A1003-L1008 HydrophobicContact CB-CB 4.45Å; A1003-L1008 HydrophobicContact CB-CD1 4.07Å
1004	N	54.1	Low	72.5	Confident	173 Å²	173	84.4 Å²	84.4	93%	0.925	44%	0.441	S	S	*	.	S	Bend	trans	-75.1	82.5	164.4	-81.1	-19.2	0	0	0	110.2
1005	G	55.7	Low	72.5	Confident	85 Å²	85	77.3 Å²	77.3	88%	0.876	41%	0.41	S	S	*	.	S	Bend	trans	93.8	7.6	163.8	0	0	0	0	0	117.8	A1003	A1003-G1005 VanDerWaalsContact C-N 3.31Å; A1003-G1005 PolarHBondContact O-N 3.42Å
1006	S	59.8	Low	72.9	Confident	64 Å²	64	75.1 Å²	75.1	45%	0.448	40%	0.402	S	S	.	.			trans	-101.8	139.8	170.5	55.9	0	0	0	0	111.1	L1008	S1006-L1008 PolarHBondContact O-N 3.3Å; S1006-L1008 WeakPolarHBondContact OG-CD1 3.17Å
1007	N	64.8	Low	73.4	Confident	120 Å²	120	80.7 Å²	80.7	64%	0.642	42%	0.421	S	S	*	.			trans	-75.1	40.2	-176	-140.7	-6.7	0	0	0	112.5	I1009 N1010	N1007-I1009 PolarHBondContact O-N 3.49Å; N1007-N1010 PolarHBondContact O-N 3.3Å; N1007-N1010 PolarHBondContact OD1-ND2 2.66Å; N1007-N1010 VanDerWaalsContact OD1-ND2 3.08Å
1008	L	67.2	Low	73.8	Confident	50 Å²	50	77.1 Å²	77.1	26%	0.262	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-64.8	-22.2	-178.2	-82.6	164.1	0	0	0	113.1	W995 A1003 S1006 N1010 Q1011	W995-L1008 PolarHBondContact NE1-O 3.21Å; A1003-L1008 HydrophobicContact CB-CB 4.45Å; A1003-L1008 HydrophobicContact CB-CD1 4.07Å; S1006-L1008 PolarHBondContact O-N 3.3Å; S1006-L1008 WeakPolarHBondContact OG-CD1 3.17Å; L1008-N1010 PolarHBondContact O-N 3Å; L1008-N1010 VanDerWaalsContact O-N 3.1Å; L1008-Q1011 PolarHBondContact O-N 3.32Å
1009	I	65.5	Low	74.2	Confident	75 Å²	75	72.3 Å²	72.3	39%	0.385	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-54	-30.1	172.9	-63.5	171.3	0	0	0	110.7	C999 N1007	C999-I1009 HydrophobicContact CB-CD1 4.49Å; C999-I1009 HydrophobicContact CB-CG1 3.61Å; N1007-I1009 PolarHBondContact O-N 3.49Å
1010	N	67.7	Low	74.9	Confident	35 Å²	35	72.5 Å²	72.5	19%	0.187	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-93.1	7.4	-178.8	-72.8	-53.9	0	0	0	115.1	G950 N1007 L1008 R1014	G950-N1010 PolarHBondContact N-OD1 2.79Å; N1007-N1010 PolarHBondContact O-N 3.3Å; N1007-N1010 PolarHBondContact OD1-ND2 2.66Å; N1007-N1010 VanDerWaalsContact OD1-ND2 3.08Å; L1008-N1010 PolarHBondContact O-N 3Å; L1008-N1010 VanDerWaalsContact O-N 3.1Å; N1010-R1014 WeakPolarHBondContact O-CD 3.48Å
1011	Q	70.3	Confident	75.5	Confident	149 Å²	149	75.4 Å²	75.4	70%	0.696	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-45.2	-178.2	-65.9	-166.5	-5.1	0	0	113.2	L1008	L1008-Q1011 PolarHBondContact O-N 3.32Å
1012	N	70.9	Confident	76.3	Confident	86 Å²	86	69.7 Å²	69.7	46%	0.46	36%	0.363	S	S	.	.	S	Bend	trans	-108.1	145.8	-176.8	-112.8	-2.3	0	0	0	110.8	W995 R1014	W995-N1012 HydrophobicContact CD2-CB 3.56Å; W995-N1012 HydrophobicContact CE3-CB 3.98Å; W995-N1012 HydrophobicContact CG-CB 4.2Å; W995-N1012 HydrophobicContact CH2-CB 3.71Å; W995-N1012 WeakPolarHBondContact CH2-ND2 3.47Å; W995-N1012 HydrophobicContact CZ2-CB 3.26Å; W995-N1012 HydrophobicContact CZ3-CB 4.04Å; W995-N1012 VanDerWaalsContact CZ3-ND2 3.31Å; W995-N1012 WeakPolarHBondContact CZ3-ND2 3.42Å; W995-N1012 PolarHBondContact NE1-O 3.36Å; N1012-R1014 PolarHBondContact O-N 3.19Å
1013	E	78.7	Confident	77.2	Confident	43 Å²	43	64.3 Å²	64.3	20%	0.201	34%	0.338	C	S	.	.	S	Bend	trans	50	21	-175.4	-56.7	-64.7	-172.5	0	0	116.2	R940 R991 I992 W995 L1015	R940-E1013 IonicContact CZ-OE2 3.97Å; R940-E1013 IonicContact NH1-OE2 2.84Å; R940-E1013 PolarHBondContact NH1-OE2 3.49Å; R940-E1013 IonicContact NH2-OE2 3.28Å; R991-E1013 HydrophobicContact CB-CG 4.34Å; R991-E1013 IonicContact CZ-OE1 3.42Å; R991-E1013 IonicContact CZ-OE2 3.03Å; R991-E1013 IonicContact NE-OE1 3.02Å; R991-E1013 PolarHBondContact NE-OE1 3.06Å; R991-E1013 IonicContact NE-OE2 3.85Å; R991-E1013 IonicContact NH2-OE1 2.72Å; R991-E1013 PolarHBondContact NH2-OE1 2.86Å; R991-E1013 IonicContact NH2-OE2 2.78Å; R991-E1013 PolarHBondContact NH2-OE2 3.35Å; I992-E1013 HydrophobicContact CG1-CB 4.41Å; W995-E1013 HydrophobicContact CB-CB 4.31Å; W995-E1013 HydrophobicContact CB-CG 4.35Å; W995-E1013 HydrophobicContact CG-CB 4.49Å; E1013-L1015 PolarHBondContact O-N 3.34Å
1014	R	84.9	Confident	78.6	Confident	40 Å²	40	63.5 Å²	63.5	15%	0.151	33%	0.33	C	S	.	.			trans	-66.2	129	178.1	175	168.7	170.3	-117	12.1	112.1	R940 D944 C945 E948 N1010 N1012 T1016	R940-R1014 PolarHBondContact NE-O 3.19Å; D944-R1014 IonicContact OD1-NH1 2.77Å; C945-R1014 PolarHBondContact O-NH2 2.91Å; E948-R1014 PolarHBondContact O-NE 3.49Å; E948-R1014 PolarHBondContact O-NH2 2.99Å; N1010-R1014 WeakPolarHBondContact O-CD 3.48Å; N1012-R1014 PolarHBondContact O-N 3.19Å; R1014-T1016 HydrophobicContact CG-CG2 4.32Å
1015	L	88.1	Confident	80.4	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.021	30%	0.301	C	S	.	.			trans	-132.7	123.3	171.3	-175.4	64	0	0	0	109.8	M936 R940 G950 M951 L956 V988 E1013 Q1019	M936-L1015 HydrophobicContact CE-CD2 4.26Å; M936-L1015 HydrophobicContact SD-CD1 3.59Å; M936-L1015 VanDerWaalsContact SD-CD1 3.59Å; M936-L1015 HydrophobicContact SD-CD2 4.25Å; R940-L1015 HydrophobicContact CG-CD1 4.29Å; G950-L1015 WeakPolarHBondContact CA-O 3.43Å; M951-L1015 HydrophobicContact CE-CD2 4.31Å; M951-L1015 HydrophobicContact CE-CG 4.02Å; M951-L1015 PolarHBondContact N-O 3.39Å; L956-L1015 HydrophobicContact CD1-CD2 3.71Å; L956-L1015 HydrophobicContact CD2-CD2 3.98Å; V988-L1015 HydrophobicContact CG1-CD2 4.37Å; E1013-L1015 PolarHBondContact O-N 3.34Å; L1015-Q1019 HydrophobicContact CD1-CB 3.98Å
1016	T	90.5	Very high	82.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.27	C	S	.	.			trans	-99.4	161.8	-177.5	61.7	0	0	0	0	111.9	C945 E948 M951 R1014 T1018 Q1019 L1020	C945-T1016 HydrophobicContact CB-CG2 4.23Å; E948-T1016 HydrophobicContact CB-CG2 3.79Å; E948-T1016 VanDerWaalsContact OE2-CB 3.31Å; E948-T1016 WeakPolarHBondContact OE2-CB 3.29Å; M951-T1016 WeakPolarHBondContact CE-O 3.26Å; R1014-T1016 HydrophobicContact CG-CG2 4.32Å; T1016-T1018 VanDerWaalsContact C-N 3.3Å; T1016-T1018 PolarHBondContact O-N 3.11Å; T1016-Q1019 PolarHBondContact O-N 3.11Å; T1016-Q1019 WeakPolarHBondContact OG1-CB 3.27Å; T1016-Q1019 WeakPolarHBondContact OG1-CG 3.45Å; T1016-Q1019 PolarHBondContact OG1-N 2.85Å; T1016-Q1019 PolarHBondContact OG1-OE1 3.29Å; T1016-L1020 PolarHBondContact O-N 3.34Å
1017	R	89.8	Confident	83.7	Confident	166 Å²	166	52.8 Å²	52.8	63%	0.626	25%	0.249	S	C	*	.	H	α-helix	trans	-61.3	-41.2	179.8	-73.8	-179.6	-175	177.3	2.5	111	E948 M951 L1020 R1021	E948-R1017 PolarHBondContact OE2-N 3.02Å; M951-R1017 HydrophobicContact CG-CG 3.91Å; M951-R1017 HydrophobicContact SD-CB 4.31Å; M951-R1017 HydrophobicContact SD-CG 3.44Å; M951-R1017 WeakPolarHBondContact SD-CG 3.35Å; R1017-L1020 PolarHBondContact O-N 2.99Å; R1017-R1021 PolarHBondContact O-N 2.79Å
1018	T	91.3	Very high	84.9	Confident	36 Å²	36	49.2 Å²	49.2	22%	0.221	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-43.9	177.5	-71.1	0	0	0	0	112	E948 T1016 L1020 R1021 I1022	E948-T1018 WeakPolarHBondContact OE1-CB 3.35Å; E948-T1018 PolarHBondContact OE1-OG1 2.84Å; E948-T1018 PolarHBondContact OE2-N 2.69Å; E948-T1018 PolarHBondContact OE2-OG1 2.85Å; T1016-T1018 VanDerWaalsContact C-N 3.3Å; T1016-T1018 PolarHBondContact O-N 3.11Å; T1018-L1020 PolarHBondContact O-N 2.83Å; T1018-R1021 PolarHBondContact O-N 2.83Å; T1018-I1022 HydrophobicContact CG2-CD1 3.93Å; T1018-I1022 WeakPolarHBondContact O-CG1 3.43Å; T1018-I1022 PolarHBondContact O-N 3.42Å
1019	Q	92.2	Very high	86.1	Confident	5 Å²	5	51.1 Å²	51.1	2%	0.023	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-42.3	176.3	-74.2	166.9	-21.1	0	0	112.1	I939 Y943 L1015 T1016 R1021 I1022 F1023	I939-Q1019 HydrophobicContact CG2-CB 4.03Å; I939-Q1019 HydrophobicContact CG2-CG 4.22Å; Y943-Q1019 PolarHBondContact O-NE2 2.94Å; L1015-Q1019 HydrophobicContact CD1-CB 3.98Å; T1016-Q1019 PolarHBondContact O-N 3.11Å; T1016-Q1019 WeakPolarHBondContact OG1-CB 3.27Å; T1016-Q1019 WeakPolarHBondContact OG1-CG 3.45Å; T1016-Q1019 PolarHBondContact OG1-N 2.85Å; T1016-Q1019 PolarHBondContact OG1-OE1 3.29Å; Q1019-R1021 PolarHBondContact O-N 3.22Å; Q1019-I1022 PolarHBondContact O-N 3.15Å; Q1019-F1023 WeakPolarHBondContact O-CB 3.4Å; Q1019-F1023 PolarHBondContact O-N 3.33Å
1020	L	91.4	Very high	87.3	Confident	5 Å²	5	49 Å²	49	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-44.2	176.1	178.7	68	0	0	0	111.8	M951 L956 A959 V960 I984 T1016 R1017 T1018 I1022 F1023 L1024	M951-L1020 HydrophobicContact CE-CB 3.9Å; M951-L1020 HydrophobicContact CE-CD2 3.95Å; M951-L1020 HydrophobicContact SD-CD2 4.36Å; L956-L1020 HydrophobicContact CD1-CD1 3.77Å; L956-L1020 HydrophobicContact CD1-CD2 3.69Å; L956-L1020 HydrophobicContact CD1-CG 4.27Å; A959-L1020 HydrophobicContact CB-CD2 3.86Å; V960-L1020 HydrophobicContact CG2-CD1 4.26Å; V960-L1020 HydrophobicContact CG2-CD2 4.26Å; I984-L1020 HydrophobicContact CD1-CD1 4.45Å; T1016-L1020 PolarHBondContact O-N 3.34Å; R1017-L1020 PolarHBondContact O-N 2.99Å; T1018-L1020 PolarHBondContact O-N 2.83Å; L1020-I1022 VanDerWaalsContact C-N 3.34Å; L1020-I1022 PolarHBondContact O-N 3.14Å; L1020-F1023 HydrophobicContact CD1-CD1 4.46Å; L1020-F1023 WeakPolarHBondContact O-CB 3.47Å; L1020-F1023 PolarHBondContact O-N 3.37Å; L1020-L1024 HydrophobicContact CD1-CD1 4.26Å; L1020-L1024 HydrophobicContact CD1-CG 4.28Å; L1020-L1024 HydrophobicContact CG-CD1 4.11Å; L1020-L1024 HydrophobicContact CG-CG 4.48Å; L1020-L1024 WeakPolarHBondContact O-CG 3.39Å; L1020-L1024 PolarHBondContact O-N 3.16Å
1021	R	91.1	Very high	88.5	Confident	164 Å²	164	47.9 Å²	47.9	62%	0.619	22%	0.216	S	C	*	.	H	α-helix	trans	-60.3	-45.2	177.6	-176.5	-179.6	66.4	174.7	-1.2	111.5	R1017 T1018 Q1019 F1023 L1024 T1025	R1017-R1021 PolarHBondContact O-N 2.79Å; T1018-R1021 PolarHBondContact O-N 2.83Å; Q1019-R1021 PolarHBondContact O-N 3.22Å; R1021-F1023 VanDerWaalsContact C-N 3.32Å; R1021-L1024 PolarHBondContact O-N 3.34Å; R1021-T1025 WeakPolarHBondContact O-CB 3.12Å; R1021-T1025 PolarHBondContact O-N 3.37Å; R1021-T1025 PolarHBondContact O-OG1 3.33Å
1022	I	91.9	Very high	89.5	Confident	30 Å²	30	45.6 Å²	45.6	15%	0.154	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-43.6	177.2	-64.7	167.3	0	0	0	109.8	I939 Y943 T1018 Q1019 L1020 T1025 H1026	I939-I1022 HydrophobicContact CD1-CG2 4.1Å; I939-I1022 HydrophobicContact CG1-CG2 4.34Å; I939-I1022 HydrophobicContact CG2-CB 4.35Å; I939-I1022 HydrophobicContact CG2-CG2 4.26Å; Y943-I1022 HydrophobicContact CD1-CD1 4.04Å; Y943-I1022 HydrophobicContact CD2-CD1 4.28Å; Y943-I1022 HydrophobicContact CD2-CG2 4.41Å; Y943-I1022 HydrophobicContact CE1-CD1 4.27Å; Y943-I1022 HydrophobicContact CE2-CG2 3.98Å; Y943-I1022 HydrophobicContact CG-CD1 4.04Å; T1018-I1022 HydrophobicContact CG2-CD1 3.93Å; T1018-I1022 WeakPolarHBondContact O-CG1 3.43Å; T1018-I1022 PolarHBondContact O-N 3.42Å; Q1019-I1022 PolarHBondContact O-N 3.15Å; L1020-I1022 VanDerWaalsContact C-N 3.34Å; L1020-I1022 PolarHBondContact O-N 3.14Å; I1022-T1025 PolarHBondContact O-N 3.49Å; I1022-H1026 WeakPolarHBondContact O-CB 3.46Å; I1022-H1026 PolarHBondContact O-N 3.16Å
1023	F	93.5	Very high	90.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-51.1	177.1	171.7	-98.2	0	0	0	112.5	F932 E935 M936 I939 F983 Q1019 L1020 R1021 T1025 H1026 V1027	F932-F1023 HydrophobicContact CB-CZ 4.31Å; F932-F1023 AromaticContact CD1-CZ 3.97Å; F932-F1023 HydrophobicContact CD1-CZ 3.97Å; E935-F1023 HydrophobicContact CB-CD2 4.33Å; E935-F1023 HydrophobicContact CB-CE2 4.09Å; E935-F1023 HydrophobicContact CG-CD2 4.12Å; E935-F1023 HydrophobicContact CG-CE2 4.28Å; M936-F1023 HydrophobicContact CB-CD2 4.28Å; M936-F1023 HydrophobicContact CB-CE2 4.07Å; M936-F1023 HydrophobicContact CE-CD1 3.74Å; M936-F1023 HydrophobicContact CE-CD2 3.86Å; M936-F1023 HydrophobicContact CE-CE1 3.79Å; M936-F1023 HydrophobicContact CE-CE2 3.91Å; M936-F1023 HydrophobicContact CE-CG 3.77Å; M936-F1023 HydrophobicContact CE-CZ 3.87Å; M936-F1023 HydrophobicContact SD-CD2 4.27Å; M936-F1023 HydrophobicContact SD-CG 4.37Å; I939-F1023 HydrophobicContact CD1-CB 3.64Å; I939-F1023 HydrophobicContact CD1-CD2 4.08Å; I939-F1023 HydrophobicContact CD1-CG 4.37Å; F983-F1023 HydrophobicContact CD1-CZ 4.28Å; F983-F1023 HydrophobicContact CE1-CZ 4.06Å; Q1019-F1023 WeakPolarHBondContact O-CB 3.4Å; Q1019-F1023 PolarHBondContact O-N 3.33Å; L1020-F1023 HydrophobicContact CD1-CD1 4.46Å; L1020-F1023 WeakPolarHBondContact O-CB 3.47Å; L1020-F1023 PolarHBondContact O-N 3.37Å; R1021-F1023 VanDerWaalsContact C-N 3.32Å; F1023-T1025 VanDerWaalsContact C-N 3.28Å; F1023-T1025 PolarHBondContact O-N 3.02Å; F1023-H1026 PolarHBondContact O-N 2.9Å; F1023-V1027 HydrophobicContact CD1-CG2 4.4Å; F1023-V1027 HydrophobicContact CD2-CG2 4.08Å; F1023-V1027 HydrophobicContact CE1-CG2 4.08Å; F1023-V1027 HydrophobicContact CE2-CG2 3.75Å; F1023-V1027 HydrophobicContact CG-CG2 4.41Å; F1023-V1027 HydrophobicContact CZ-CG2 3.75Å; F1023-V1027 WeakPolarHBondContact O-CB 3.35Å; F1023-V1027 WeakPolarHBondContact O-CG2 3.37Å; F1023-V1027 PolarHBondContact O-N 3.38Å
1024	L	92.2	Very high	91.1	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-36.7	179.5	-65.8	174.4	0	0	0	111.9	V963 F969 I980 L1020 R1021 K1028	V963-L1024 HydrophobicContact CB-CD1 3.95Å; V963-L1024 HydrophobicContact CG1-CD1 3.65Å; V963-L1024 HydrophobicContact CG2-CD1 4.09Å; F969-L1024 HydrophobicContact CE1-CB 4.22Å; F969-L1024 HydrophobicContact CZ-CB 4.26Å; I980-L1024 HydrophobicContact CD1-CD2 4.39Å; I980-L1024 HydrophobicContact CG2-CD2 3.85Å; L1020-L1024 HydrophobicContact CD1-CD1 4.26Å; L1020-L1024 HydrophobicContact CD1-CG 4.28Å; L1020-L1024 HydrophobicContact CG-CD1 4.11Å; L1020-L1024 HydrophobicContact CG-CG 4.48Å; L1020-L1024 WeakPolarHBondContact O-CG 3.39Å; L1020-L1024 PolarHBondContact O-N 3.16Å; R1021-L1024 PolarHBondContact O-N 3.34Å; L1024-K1028 WeakPolarHBondContact O-CB 3.25Å; L1024-K1028 PolarHBondContact O-N 3.4Å
1025	T	91.6	Very high	91.5	Very high	51 Å²	51	47.5 Å²	47.5	31%	0.313	21%	0.213	S	C	.	.	H	α-helix	trans	-67	-48.8	176.9	-51.5	0	0	0	0	111.3	R1021 I1022 F1023 V1027 K1028 E1029	R1021-T1025 WeakPolarHBondContact O-CB 3.12Å; R1021-T1025 PolarHBondContact O-N 3.37Å; R1021-T1025 PolarHBondContact O-OG1 3.33Å; I1022-T1025 PolarHBondContact O-N 3.49Å; F1023-T1025 VanDerWaalsContact C-N 3.28Å; F1023-T1025 PolarHBondContact O-N 3.02Å; T1025-V1027 PolarHBondContact O-N 2.94Å; T1025-K1028 PolarHBondContact O-N 2.9Å; T1025-E1029 WeakPolarHBondContact O-CG 3.35Å; T1025-E1029 PolarHBondContact O-N 3.46Å
1026	H	91.5	Very high	91.8	Very high	47 Å²	47	47.7 Å²	47.7	22%	0.218	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-45.5	176.6	-85.3	-148.9	0	0	0	112.3	E935 I939 I1022 F1023 K1028 E1029 K1030	E935-H1026 IonicContact OE1-CG 3.29Å; E935-H1026 IonicContact OE1-ND1 2.66Å; E935-H1026 PolarHBondContact OE1-ND1 3.14Å; I939-H1026 HydrophobicContact CD1-CB 4.43Å; I1022-H1026 WeakPolarHBondContact O-CB 3.46Å; I1022-H1026 PolarHBondContact O-N 3.16Å; F1023-H1026 PolarHBondContact O-N 2.9Å; H1026-K1028 VanDerWaalsContact C-N 3.33Å; H1026-K1028 PolarHBondContact O-N 3.13Å; H1026-E1029 PolarHBondContact O-N 3.24Å; H1026-K1030 WeakPolarHBondContact O-CB 3.17Å; H1026-K1030 WeakPolarHBondContact O-CG 3.43Å; H1026-K1030 PolarHBondContact O-N 3.06Å
1027	V	92.4	Very high	92	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-45.1	177.7	165.7	0	0	0	0	110.8	V930 F932 L976 I980 F1023 T1025 Y1031	V930-V1027 HydrophobicContact CG1-CG2 4.25Å; F932-V1027 HydrophobicContact CD1-CG1 4.41Å; F932-V1027 HydrophobicContact CD1-CG2 4.05Å; F932-V1027 HydrophobicContact CE1-CG1 3.7Å; F932-V1027 HydrophobicContact CE1-CG2 4.17Å; L976-V1027 HydrophobicContact CD1-CG1 3.94Å; I980-V1027 HydrophobicContact CD1-CG1 3.85Å; I980-V1027 HydrophobicContact CG1-CG1 4.26Å; F1023-V1027 HydrophobicContact CD1-CG2 4.4Å; F1023-V1027 HydrophobicContact CD2-CG2 4.08Å; F1023-V1027 HydrophobicContact CE1-CG2 4.08Å; F1023-V1027 HydrophobicContact CE2-CG2 3.75Å; F1023-V1027 HydrophobicContact CG-CG2 4.41Å; F1023-V1027 HydrophobicContact CZ-CG2 3.75Å; F1023-V1027 WeakPolarHBondContact O-CB 3.35Å; F1023-V1027 WeakPolarHBondContact O-CG2 3.37Å; F1023-V1027 PolarHBondContact O-N 3.38Å; T1025-V1027 PolarHBondContact O-N 2.94Å; V1027-Y1031 WeakPolarHBondContact O-CB 3.29Å; V1027-Y1031 PolarHBondContact O-N 3.2Å
1028	K	91.2	Very high	92.2	Very high	45 Å²	45	49 Å²	49	20%	0.196	23%	0.232	C	C	.	.	H	α-helix	trans	-59.1	-52.8	175.6	171.4	-178.3	175.8	-167.9	0	111.1	A968 F969 L972 L1024 T1025 H1026 K1030 Y1031 E1032	A968-K1028 WeakPolarHBondContact O-CE 3.24Å; A968-K1028 PolarHBondContact O-NZ 2.96Å; F969-K1028 HydrophobicContact CD1-CD 4.1Å; F969-K1028 HydrophobicContact CE1-CB 3.95Å; F969-K1028 HydrophobicContact CE1-CD 3.86Å; F969-K1028 HydrophobicContact CE1-CG 4.47Å; F969-K1028 HydrophobicContact CZ-CD 4.41Å; L972-K1028 HydrophobicContact CD1-CB 4.4Å; L972-K1028 HydrophobicContact CD1-CD 3.82Å; L972-K1028 HydrophobicContact CD1-CG 3.86Å; L1024-K1028 WeakPolarHBondContact O-CB 3.25Å; L1024-K1028 PolarHBondContact O-N 3.4Å; T1025-K1028 PolarHBondContact O-N 2.9Å; H1026-K1028 VanDerWaalsContact C-N 3.33Å; H1026-K1028 PolarHBondContact O-N 3.13Å; K1028-K1030 VanDerWaalsContact C-N 3.33Å; K1028-K1030 PolarHBondContact O-N 3.21Å; K1028-Y1031 PolarHBondContact O-N 3.47Å; K1028-Y1031 VanDerWaalsContact O-N 3.15Å; K1028-E1032 VanDerWaalsContact CE-CD 3.47Å; K1028-E1032 WeakPolarHBondContact CE-OE1 3.44Å; K1028-E1032 HydrophobicContact CG-CG 4.44Å; K1028-E1032 IonicContact NZ-OE1 3.88Å; K1028-E1032 WeakPolarHBondContact O-CG 3.43Å; K1028-E1032 PolarHBondContact O-N 3.4Å
1029	E	91.4	Very high	92.3	Very high	90 Å²	90	47.5 Å²	47.5	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-60.9	-41	-178.2	-73.1	-179.4	-168.8	0	0	112.5	T1025 H1026 K1033	T1025-E1029 WeakPolarHBondContact O-CG 3.35Å; T1025-E1029 PolarHBondContact O-N 3.46Å; H1026-E1029 PolarHBondContact O-N 3.24Å; E1029-K1033 WeakPolarHBondContact O-CB 3.4Å; E1029-K1033 VanDerWaalsContact O-CG 3.26Å; E1029-K1033 WeakPolarHBondContact O-CG 3.29Å; E1029-K1033 PolarHBondContact O-N 3.13Å; E1029-K1033 VanDerWaalsContact O-N 3.09Å
1030	K	91.9	Very high	92.4	Very high	31 Å²	31	48.6 Å²	48.6	14%	0.135	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-38.9	175.9	-75.1	-172	172.3	-167.8	0	111.7	D681 E924 V930 E935 H1026 K1028 A1034	D681-K1030 IonicContact OD1-NZ 3.59Å; D681-K1030 PolarHBondContact OD1-NZ 2.81Å; E924-K1030 IonicContact OE1-NZ 2.81Å; E924-K1030 PolarHBondContact OE1-NZ 2.86Å; V930-K1030 HydrophobicContact CG1-CD 4.33Å; V930-K1030 HydrophobicContact CG2-CB 3.66Å; V930-K1030 HydrophobicContact CG2-CD 4.49Å; E935-K1030 WeakPolarHBondContact OE2-CE 3.42Å; E935-K1030 IonicContact OE2-NZ 2.6Å; E935-K1030 PolarHBondContact OE2-NZ 2.86Å; H1026-K1030 WeakPolarHBondContact O-CB 3.17Å; H1026-K1030 WeakPolarHBondContact O-CG 3.43Å; H1026-K1030 PolarHBondContact O-N 3.06Å; K1028-K1030 VanDerWaalsContact C-N 3.33Å; K1028-K1030 PolarHBondContact O-N 3.21Å; K1030-A1034 WeakPolarHBondContact O-CB 3.47Å; K1030-A1034 PolarHBondContact O-N 3.36Å; K1030-A1034 VanDerWaalsContact O-N 3.12Å
1031	Y	92.3	Very high	92.6	Very high	11 Å²	11	49.8 Å²	49.8	4%	0.043	24%	0.24	C	C	.	.	H	α-helix	trans	-67.2	-45.9	177.5	-176	-91.8	0	0	0	112.3	L918 F928 P929 D973 L976 V1027 K1028 K1033 A1034 L1035	L918-Y1031 HydrophobicContact CD1-CE2 4.39Å; L918-Y1031 HydrophobicContact CD2-CD2 4.48Å; L918-Y1031 HydrophobicContact CD2-CE2 3.96Å; F928-Y1031 HydrophobicContact CZ-CD2 4.23Å; F928-Y1031 HydrophobicContact CZ-CE2 4.17Å; P929-Y1031 HydrophobicContact CG-CD2 3.64Å; P929-Y1031 HydrophobicContact CG-CE2 4.08Å; D973-Y1031 HydrophobicContact CB-CE1 3.95Å; D973-Y1031 WeakPolarHBondContact CB-OH 3.43Å; D973-Y1031 PolarHBondContact OD2-OH 2.84Å; L976-Y1031 HydrophobicContact CB-CD2 4.33Å; L976-Y1031 HydrophobicContact CB-CE2 4.16Å; L976-Y1031 HydrophobicContact CD1-CD2 4.12Å; L976-Y1031 HydrophobicContact CD2-CD1 3.8Å; L976-Y1031 HydrophobicContact CD2-CD2 3.91Å; L976-Y1031 HydrophobicContact CD2-CE1 4.38Å; L976-Y1031 HydrophobicContact CD2-CE2 4.48Å; L976-Y1031 HydrophobicContact CD2-CG 3.54Å; L976-Y1031 HydrophobicContact CG-CD2 4.35Å; L976-Y1031 HydrophobicContact CG-CG 4.46Å; V1027-Y1031 WeakPolarHBondContact O-CB 3.29Å; V1027-Y1031 PolarHBondContact O-N 3.2Å; K1028-Y1031 PolarHBondContact O-N 3.47Å; K1028-Y1031 VanDerWaalsContact O-N 3.15Å; Y1031-K1033 VanDerWaalsContact C-N 3.31Å; Y1031-K1033 PolarHBondContact O-N 2.83Å; Y1031-A1034 WeakPolarHBondContact O-CB 3.29Å; Y1031-A1034 PolarHBondContact O-N 3.2Å; Y1031-L1035 HydrophobicContact CE1-CD2 4.35Å; Y1031-L1035 PolarHBondContact O-N 3.49Å
1032	E	91	Very high	92.8	Very high	101 Å²	101	42 Å²	42	47%	0.472	21%	0.211	S	C	.	.	H	α-helix	trans	-61.8	-39.7	177.5	-72.4	176.7	164.7	0	0	111.7	K1028 A1034 L1035	K1028-E1032 VanDerWaalsContact CE-CD 3.47Å; K1028-E1032 WeakPolarHBondContact CE-OE1 3.44Å; K1028-E1032 HydrophobicContact CG-CG 4.44Å; K1028-E1032 IonicContact NZ-OE1 3.88Å; K1028-E1032 WeakPolarHBondContact O-CG 3.43Å; K1028-E1032 PolarHBondContact O-N 3.4Å; E1032-A1034 PolarHBondContact O-N 2.9Å; E1032-L1035 WeakPolarHBondContact O-CB 3.36Å; E1032-L1035 PolarHBondContact O-N 3.2Å
1033	K	90.7	Very high	92.9	Very high	141 Å²	141	40.5 Å²	40.5	61%	0.613	20%	0.204	S	C	*	.	H	α-helix	trans	-65.7	-24.9	172.9	-74.4	170.9	-175.8	163.3	0	113.6	E1029 Y1031 L1035	E1029-K1033 WeakPolarHBondContact O-CB 3.4Å; E1029-K1033 VanDerWaalsContact O-CG 3.26Å; E1029-K1033 WeakPolarHBondContact O-CG 3.29Å; E1029-K1033 PolarHBondContact O-N 3.13Å; E1029-K1033 VanDerWaalsContact O-N 3.09Å; Y1031-K1033 VanDerWaalsContact C-N 3.31Å; Y1031-K1033 PolarHBondContact O-N 2.83Å; K1033-L1035 VanDerWaalsContact C-N 3.35Å
1034	A	93.4	Very high	92.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.008	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-5.9	-179.7	0	0	0	0	0	113.6	L918 D919 E922 P929 K1030 Y1031 E1032	L918-A1034 CarbonylContact C-O 3.5Å; L918-A1034 WeakPolarHBondContact CA-O 3.17Å; L918-A1034 HydrophobicContact CD2-CB 4.35Å; D919-A1034 PolarHBondContact N-O 3.4Å; E922-A1034 HydrophobicContact CB-CB 3.72Å; P929-A1034 HydrophobicContact CB-CB 3.52Å; P929-A1034 HydrophobicContact CG-CB 4.33Å; K1030-A1034 WeakPolarHBondContact O-CB 3.47Å; K1030-A1034 PolarHBondContact O-N 3.36Å; K1030-A1034 VanDerWaalsContact O-N 3.12Å; Y1031-A1034 WeakPolarHBondContact O-CB 3.29Å; Y1031-A1034 PolarHBondContact O-N 3.2Å; E1032-A1034 PolarHBondContact O-N 2.9Å
1035	L	93	Very high	93	Very high	67 Å²	67	42.2 Å²	42.2	35%	0.351	22%	0.216	S	C	.	.	B	Isolated β-bridge	trans	-65.8	139.7	169.9	-67.2	169.4	0	0	0	109.6	G917 L918 Y1031 E1032 K1033 E1037	G917-L1035 WeakPolarHBondContact O-CA 3.33Å; L918-L1035 HydrophobicContact CD2-CD2 3.99Å; Y1031-L1035 HydrophobicContact CE1-CD2 4.35Å; Y1031-L1035 PolarHBondContact O-N 3.49Å; E1032-L1035 WeakPolarHBondContact O-CB 3.36Å; E1032-L1035 PolarHBondContact O-N 3.2Å; K1033-L1035 VanDerWaalsContact C-N 3.35Å; L1035-E1037 PolarHBondContact O-N 2.84Å
1036	I	94.6	Very high	93.1	Very high	8 Å²	8	39.8 Å²	39.8	4%	0.041	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-70.5	132	-179.8	-164.9	156.8	0	0	0	110.7	V895 Y913 G917 D919 T1040 V1042	V895-I1036 HydrophobicContact CG1-CG2 4.17Å; V895-I1036 HydrophobicContact CG2-CD1 4.13Å; V895-I1036 HydrophobicContact CG2-CG1 4.29Å; V895-I1036 HydrophobicContact CG2-CG2 4.06Å; Y913-I1036 HydrophobicContact CD1-CB 4.37Å; Y913-I1036 HydrophobicContact CD1-CD1 3.47Å; Y913-I1036 VanDerWaalsContact CD1-CD1 3.47Å; Y913-I1036 HydrophobicContact CD1-CG2 4.16Å; Y913-I1036 HydrophobicContact CE1-CD1 3.47Å; Y913-I1036 VanDerWaalsContact CE1-CD1 3.47Å; Y913-I1036 HydrophobicContact CG-CD1 4.15Å; G917-I1036 WeakPolarHBondContact O-CG2 3.34Å; G917-I1036 PolarHBondContact O-N 3.08Å; D919-I1036 HydrophobicContact CB-CB 4.3Å; D919-I1036 HydrophobicContact CB-CG1 4.37Å; I1036-T1040 HydrophobicContact CD1-CG2 4.17Å; I1036-T1040 HydrophobicContact CG1-CG2 4.27Å; I1036-V1042 HydrophobicContact CD1-CG1 3.34Å; I1036-V1042 HydrophobicContact CG1-CG1 4.5Å
1037	E	94.1	Very high	93.1	Very high	143 Å²	143	37.6 Å²	37.6	67%	0.668	19%	0.191	S	C	*	.	P	Polyproline II helix	trans	-69.7	133.4	-179.5	-65.4	179	175.3	0	0	110.8	L1035 T1040	L1035-E1037 PolarHBondContact O-N 2.84Å; E1037-T1040 VanDerWaalsContact O-CB 3.23Å; E1037-T1040 WeakPolarHBondContact O-CB 3.44Å; E1037-T1040 PolarHBondContact O-N 2.86Å; E1037-T1040 PolarHBondContact O-OG1 3.48Å
1038	P	94.5	Very high	93.1	Very high	51 Å²	51	39.6 Å²	39.6	33%	0.331	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	142.5	170.1	-26.5	35.3	0	0	0	112	Y897 T1040	Y897-P1038 HydrophobicContact CD1-CB 3.62Å; Y897-P1038 HydrophobicContact CD1-CG 3.87Å; Y897-P1038 HydrophobicContact CD2-CB 4.32Å; Y897-P1038 HydrophobicContact CE1-CB 3.79Å; Y897-P1038 HydrophobicContact CE1-CG 4.19Å; Y897-P1038 HydrophobicContact CE2-CB 4.45Å; Y897-P1038 HydrophobicContact CG-CB 3.91Å; Y897-P1038 HydrophobicContact CG-CG 4.47Å; P1038-T1040 VanDerWaalsContact C-N 3.28Å; P1038-T1040 PolarHBondContact O-N 2.88Å
1039	G	92.9	Very high	93.2	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.031	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	-6.9	-175	0	0	0	0	0	114.9	V895 A1041 G1353	V895-G1039 WeakPolarHBondContact O-CA 3.23Å; V895-G1039 PolarHBondContact O-N 3.39Å; G1039-A1041 PolarHBondContact O-N 3.25Å; G1039-G1353 VanDerWaalsContact O-CA 3.24Å; G1039-G1353 WeakPolarHBondContact O-CA 3.48Å; G1039-G1353 PolarHBondContact O-N 2.87Å
1040	T	94.7	Very high	93.1	Very high	28 Å²	28	33.4 Å²	33.4	17%	0.172	17%	0.172	C	C	.	.			trans	-57.9	126.7	174.9	-62.8	0	0	0	0	111.1	A894 V895 I1036 E1037 P1038 V1042 L1045	A894-T1040 WeakPolarHBondContact CA-O 3.23Å; V895-T1040 PolarHBondContact N-O 2.83Å; I1036-T1040 HydrophobicContact CD1-CG2 4.17Å; I1036-T1040 HydrophobicContact CG1-CG2 4.27Å; E1037-T1040 VanDerWaalsContact O-CB 3.23Å; E1037-T1040 WeakPolarHBondContact O-CB 3.44Å; E1037-T1040 PolarHBondContact O-N 2.86Å; E1037-T1040 PolarHBondContact O-OG1 3.48Å; P1038-T1040 VanDerWaalsContact C-N 3.28Å; P1038-T1040 PolarHBondContact O-N 2.88Å; T1040-V1042 HydrophobicContact CG2-CG1 4.06Å; T1040-V1042 PolarHBondContact O-N 2.85Å; T1040-L1045 HydrophobicContact CG2-CD1 3.8Å
1041	A	95	Very high	92.8	Very high	30 Å²	30	31.9 Å²	31.9	25%	0.248	17%	0.166	C	C	.	.			trans	-75	64.3	179	0	0	0	0	0	112.3	L893 G1039 G1043 A1044 L1045 V1352	L893-A1041 CarbonylContact O-C 3.5Å; G1039-A1041 PolarHBondContact O-N 3.25Å; A1041-G1043 PolarHBondContact O-N 3.23Å; A1041-A1044 HydrophobicContact CB-CB 4.31Å; A1041-A1044 PolarHBondContact O-N 3.4Å; A1041-A1044 VanDerWaalsContact O-N 3.17Å; A1041-L1045 PolarHBondContact O-N 3.03Å; A1041-V1352 HydrophobicContact CB-CG1 3.56Å
1042	V	95.4	Very high	92.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.1	-32.9	-173.4	-73.4	0	0	0	0	113.7	L893 V895 V901 Y913 I1036 T1040 L1045 C1046 L1286	L893-V1042 HydrophobicContact CB-CG2 4.46Å; L893-V1042 PolarHBondContact O-N 3.06Å; V895-V1042 HydrophobicContact CG2-CG1 3.59Å; V895-V1042 HydrophobicContact CG2-CG2 4.13Å; V901-V1042 HydrophobicContact CG1-CG2 3.83Å; V901-V1042 HydrophobicContact CG2-CG2 4.44Å; Y913-V1042 HydrophobicContact CD2-CB 4.22Å; Y913-V1042 HydrophobicContact CD2-CG1 4Å; Y913-V1042 HydrophobicContact CD2-CG2 4.42Å; Y913-V1042 HydrophobicContact CE1-CG1 4.41Å; Y913-V1042 HydrophobicContact CE2-CB 3.87Å; Y913-V1042 HydrophobicContact CE2-CG1 3.82Å; Y913-V1042 HydrophobicContact CE2-CG2 4.48Å; Y913-V1042 HydrophobicContact CG-CG1 4.38Å; I1036-V1042 HydrophobicContact CD1-CG1 3.34Å; I1036-V1042 HydrophobicContact CG1-CG1 4.5Å; T1040-V1042 HydrophobicContact CG2-CG1 4.06Å; T1040-V1042 PolarHBondContact O-N 2.85Å; V1042-L1045 PolarHBondContact O-N 2.99Å; V1042-C1046 VanDerWaalsContact O-CB 3.3Å; V1042-C1046 WeakPolarHBondContact O-CB 3.33Å; V1042-C1046 PolarHBondContact O-N 2.82Å; V1042-L1286 HydrophobicContact CB-CD2 4.03Å; V1042-L1286 HydrophobicContact CG2-CD2 3.99Å
1043	G	94.2	Very high	91.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-71.4	-39	179.1	0	0	0	0	0	113.4	L890 L893 A1041 L1045 C1046 G1047	L890-G1043 WeakPolarHBondContact CB-O 3.09Å; L890-G1043 CarbonylContact O-C 3.51Å; L890-G1043 VanDerWaalsContact O-CA 3.24Å; L890-G1043 WeakPolarHBondContact O-CA 3.36Å; L893-G1043 PolarHBondContact O-N 3.12Å; A1041-G1043 PolarHBondContact O-N 3.23Å; G1043-L1045 VanDerWaalsContact C-N 3.32Å; G1043-L1045 PolarHBondContact O-N 2.93Å; G1043-C1046 PolarHBondContact O-N 3.36Å; G1043-G1047 PolarHBondContact O-N 2.92Å
1044	A	93.2	Very high	91.3	Very high	23 Å²	23	21 Å²	21	19%	0.19	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-40.2	173.9	0	0	0	0	0	111.3	A1041 G1047 Q1048	A1041-A1044 HydrophobicContact CB-CB 4.31Å; A1041-A1044 PolarHBondContact O-N 3.4Å; A1041-A1044 VanDerWaalsContact O-N 3.17Å; A1044-G1047 PolarHBondContact O-N 2.81Å; A1044-Q1048 VanDerWaalsContact O-CG 3.31Å; A1044-Q1048 WeakPolarHBondContact O-CG 3.42Å; A1044-Q1048 PolarHBondContact O-N 2.98Å; A1044-Q1048 VanDerWaalsContact O-N 3.16Å
1045	L	93.9	Very high	90.3	Very high	16 Å²	16	22 Å²	22	8%	0.084	12%	0.123	C	C	.	.	H	α-helix	trans	-62.8	-48.2	174.9	-62.3	176.6	0	0	0	111.3	P542 T1040 A1041 V1042 G1043 G1047 Q1048 S1049	P542-L1045 HydrophobicContact CB-CD2 4.4Å; T1040-L1045 HydrophobicContact CG2-CD1 3.8Å; A1041-L1045 PolarHBondContact O-N 3.03Å; V1042-L1045 PolarHBondContact O-N 2.99Å; G1043-L1045 VanDerWaalsContact C-N 3.32Å; G1043-L1045 PolarHBondContact O-N 2.93Å; L1045-G1047 PolarHBondContact O-N 3.06Å; L1045-Q1048 PolarHBondContact O-N 3.41Å; L1045-S1049 VanDerWaalsContact O-CB 3.31Å; L1045-S1049 WeakPolarHBondContact O-CB 3.41Å; L1045-S1049 PolarHBondContact O-N 3.26Å; L1045-S1049 PolarHBondContact O-OG 2.74Å
1046	C	94.3	Very high	89.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.3	-49.2	176.4	173	0	0	0	0	112	L890 V1042 G1043 Q1048 S1049 V1050 H1283 L1286	L890-C1046 HydrophobicContact CD1-CB 4.37Å; V1042-C1046 VanDerWaalsContact O-CB 3.3Å; V1042-C1046 WeakPolarHBondContact O-CB 3.33Å; V1042-C1046 PolarHBondContact O-N 2.82Å; G1043-C1046 PolarHBondContact O-N 3.36Å; C1046-Q1048 VanDerWaalsContact C-N 3.25Å; C1046-Q1048 PolarHBondContact O-N 2.92Å; C1046-S1049 PolarHBondContact O-N 3.31Å; C1046-V1050 WeakPolarHBondContact O-CG2 3.46Å; C1046-V1050 PolarHBondContact O-N 3.49Å; C1046-H1283 HydrophobicContact CB-CB 4.36Å; C1046-H1283 PolarHBondContact SG-O 3.21Å; C1046-L1286 HydrophobicContact CB-CD2 3.96Å
1047	G	91.8	Very high	88	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-34.7	-178.7	0	0	0	0	0	112.9	G1043 A1044 L1045 G1051	G1043-G1047 PolarHBondContact O-N 2.92Å; A1044-G1047 PolarHBondContact O-N 2.81Å; L1045-G1047 PolarHBondContact O-N 3.06Å; G1047-G1051 PolarHBondContact O-N 3.17Å; G1047-G1051 VanDerWaalsContact O-N 3.11Å
1048	Q	92.3	Very high	86.4	Confident	42 Å²	42	17 Å²	17	20%	0.196	10%	0.099	C	C	.	.	H	α-helix	trans	-78.4	-44.1	175.8	-67.8	175.6	7.3	0	0	112.6	R480 V887 A1044 L1045 C1046 V1050 G1051 E1052	R480-Q1048 VanDerWaalsContact CB-OE1 3.3Å; V887-Q1048 HydrophobicContact CG2-CG 4.42Å; A1044-Q1048 VanDerWaalsContact O-CG 3.31Å; A1044-Q1048 WeakPolarHBondContact O-CG 3.42Å; A1044-Q1048 PolarHBondContact O-N 2.98Å; A1044-Q1048 VanDerWaalsContact O-N 3.16Å; L1045-Q1048 PolarHBondContact O-N 3.41Å; C1046-Q1048 VanDerWaalsContact C-N 3.25Å; C1046-Q1048 PolarHBondContact O-N 2.92Å; Q1048-V1050 PolarHBondContact O-N 3.16Å; Q1048-G1051 PolarHBondContact O-N 3.35Å; Q1048-G1051 VanDerWaalsContact O-N 3.15Å; Q1048-E1052 WeakPolarHBondContact O-CB 3.32Å; Q1048-E1052 PolarHBondContact O-N 3.16Å
1049	S	91.8	Very high	84.5	Confident	4 Å²	4	20 Å²	20	3%	0.028	11%	0.112	C	C	.	.	H	α-helix	trans	-64	-25.8	179.9	-66.9	0	0	0	0	113.3	L1045 C1046 P1053	L1045-S1049 VanDerWaalsContact O-CB 3.31Å; L1045-S1049 WeakPolarHBondContact O-CB 3.41Å; L1045-S1049 PolarHBondContact O-N 3.26Å; L1045-S1049 PolarHBondContact O-OG 2.74Å; C1046-S1049 PolarHBondContact O-N 3.31Å; S1049-P1053 WeakPolarHBondContact O-CD 3.4Å; S1049-P1053 WeakPolarHBondContact O-CG 3.47Å
1050	V	89.7	Confident	82.4	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-89.1	-35.9	172	173.3	0	0	0	0	111.5	L886 C1046 Q1048 M1079 M1272 L1287	L886-V1050 HydrophobicContact CD1-CB 4.45Å; L886-V1050 HydrophobicContact CD1-CG1 3.97Å; C1046-V1050 WeakPolarHBondContact O-CG2 3.46Å; C1046-V1050 PolarHBondContact O-N 3.49Å; Q1048-V1050 PolarHBondContact O-N 3.16Å; V1050-M1079 HydrophobicContact CG1-SD 4.46Å; V1050-M1272 HydrophobicContact CB-CE 4.18Å; V1050-M1272 HydrophobicContact CG1-CE 3.69Å; V1050-M1272 HydrophobicContact CG2-CE 4.14Å; V1050-L1287 HydrophobicContact CB-CD1 4.39Å; V1050-L1287 HydrophobicContact CG1-CD1 4.05Å; V1050-L1287 HydrophobicContact CG2-CD1 4.13Å
1051	G	85.9	Confident	80.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-72.2	-39.6	-177.9	0	0	0	0	0	114.6	G1047 Q1048 A1054	G1047-G1051 PolarHBondContact O-N 3.17Å; G1047-G1051 VanDerWaalsContact O-N 3.11Å; Q1048-G1051 PolarHBondContact O-N 3.35Å; Q1048-G1051 VanDerWaalsContact O-N 3.15Å; G1051-A1054 WeakPolarHBondContact O-CB 3.42Å; G1051-A1054 PolarHBondContact O-N 3.37Å
1052	E	82.6	Confident	77.8	Confident	23 Å²	23	33.4 Å²	33.4	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-61.1	-51.7	179.5	176	-90.8	171.9	0	0	112.2	H479 K543 Q1048 A1054 T1055 Q1056	H479-E1052 HydrophobicContact CB-CB 4.38Å; H479-E1052 HydrophobicContact CB-CG 4.44Å; K543-E1052 IonicContact NZ-OE2 3.41Å; K543-E1052 PolarHBondContact NZ-OE2 3.35Å; Q1048-E1052 WeakPolarHBondContact O-CB 3.32Å; Q1048-E1052 PolarHBondContact O-N 3.16Å; E1052-A1054 PolarHBondContact O-N 3.5Å; E1052-T1055 PolarHBondContact O-N 2.85Å; E1052-T1055 VanDerWaalsContact O-N 3.08Å; E1052-T1055 PolarHBondContact O-OG1 3.24Å; E1052-Q1056 PolarHBondContact OE1-NE2 3.31Å
1053	P	80.8	Confident	75.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-53	-40.1	174.1	-35.2	43	0	0	0	113.8	K543 S1049 T1055 Q1056 M1057 V1277 V1279	K543-P1053 HydrophobicContact CD-CG 3.77Å; S1049-P1053 WeakPolarHBondContact O-CD 3.4Å; S1049-P1053 WeakPolarHBondContact O-CG 3.47Å; P1053-T1055 PolarHBondContact O-N 3.45Å; P1053-T1055 VanDerWaalsContact O-N 3.15Å; P1053-Q1056 WeakPolarHBondContact O-CA 3.29Å; P1053-Q1056 WeakPolarHBondContact O-CB 3.44Å; P1053-Q1056 PolarHBondContact O-N 3.27Å; P1053-M1057 VanDerWaalsContact O-CG 3.26Å; P1053-M1057 WeakPolarHBondContact O-CG 3.33Å; P1053-M1057 PolarHBondContact O-N 3.17Å; P1053-V1277 HydrophobicContact CB-CB 4.31Å; P1053-V1277 HydrophobicContact CB-CG1 3.53Å; P1053-V1277 HydrophobicContact CG-CG1 3.68Å; P1053-V1279 HydrophobicContact CG-CG2 3.85Å
1054	A	78.5	Confident	72.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-32.1	-177.6	0	0	0	0	0	112.3	T879 M882 G1051 E1052 V1076 M1079	T879-A1054 HydrophobicContact CG2-CB 4.24Å; T879-A1054 VanDerWaalsContact CG2-O 3.31Å; T879-A1054 WeakPolarHBondContact CG2-O 3.08Å; M882-A1054 HydrophobicContact CE-CB 3.33Å; G1051-A1054 WeakPolarHBondContact O-CB 3.42Å; G1051-A1054 PolarHBondContact O-N 3.37Å; E1052-A1054 PolarHBondContact O-N 3.5Å; A1054-V1076 WeakPolarHBondContact O-CG2 3.48Å; A1054-M1079 HydrophobicContact CB-SD 3.79Å
1055	T	72.1	Confident	70.1	Confident	22 Å²	22	44.7 Å²	44.7	14%	0.135	23%	0.226	C	C	.	.	H	α-helix	trans	-69.2	-35.4	174.5	66.5	0	0	0	0	112.5	L478 E1052 P1053 T1058	L478-T1055 HydrophobicContact CD1-CG2 4.35Å; L478-T1055 HydrophobicContact CD2-CG2 4.02Å; E1052-T1055 PolarHBondContact O-N 2.85Å; E1052-T1055 VanDerWaalsContact O-N 3.08Å; E1052-T1055 PolarHBondContact O-OG1 3.24Å; P1053-T1055 PolarHBondContact O-N 3.45Å; P1053-T1055 VanDerWaalsContact O-N 3.15Å; T1055-T1058 VanDerWaalsContact O-CG2 3.31Å; T1055-T1058 WeakPolarHBondContact O-CG2 3.46Å; T1055-T1058 PolarHBondContact O-OG1 2.63Å
1056	Q	70.5	Confident	67.6	Low	102 Å²	102	47 Å²	47	48%	0.477	25%	0.253	S	S	.	.	H	α-helix	trans	-78.9	-28.8	-179.8	-65.7	177.7	-1	0	0	113.3	E1052 P1053 T1058	E1052-Q1056 PolarHBondContact OE1-NE2 3.31Å; P1053-Q1056 WeakPolarHBondContact O-CA 3.29Å; P1053-Q1056 WeakPolarHBondContact O-CB 3.44Å; P1053-Q1056 PolarHBondContact O-N 3.27Å; Q1056-T1058 PolarHBondContact O-N 3.26Å; Q1056-T1058 VanDerWaalsContact O-N 3.1Å
1057	M	70.2	Confident	65.2	Low	7 Å²	7	47.9 Å²	47.9	3%	0.034	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-67.5	-7.5	179.8	-69.9	175.1	82.4	0	0	114	P1053 L1059 V1076 M1079 V1271 H1275 V1277	P1053-M1057 VanDerWaalsContact O-CG 3.26Å; P1053-M1057 WeakPolarHBondContact O-CG 3.33Å; P1053-M1057 PolarHBondContact O-N 3.17Å; M1057-L1059 PolarHBondContact O-N 3Å; M1057-V1076 HydrophobicContact CB-CG2 4.41Å; M1057-M1079 HydrophobicContact CE-CE 4.43Å; M1057-M1079 HydrophobicContact SD-CE 3.67Å; M1057-V1271 HydrophobicContact CE-CG1 3.7Å; M1057-V1271 WeakPolarHBondContact CE-O 3.06Å; M1057-H1275 HydrophobicContact CE-CB 3.7Å; M1057-H1275 WeakPolarHBondContact CE-ND1 3.37Å; M1057-H1275 HydrophobicContact CG-CB 3.86Å; M1057-V1277 HydrophobicContact CG-CG2 4.22Å
1058	T	59.7	Low	63	Low	6 Å²	6	49.7 Å²	49.7	4%	0.037	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-63.9	-14.4	-174.4	53.1	0	0	0	0	114.2	K875 T879 T1055 Q1056 V1076	K875-T1058 HydrophobicContact CB-CG2 3.4Å; K875-T1058 VanDerWaalsContact CB-CG2 3.4Å; K875-T1058 HydrophobicContact CD-CG2 3.75Å; K875-T1058 HydrophobicContact CG-CG2 4.21Å; K875-T1058 PolarHBondContact NZ-O 3.37Å; T879-T1058 HydrophobicContact CG2-CG2 4.31Å; T1055-T1058 VanDerWaalsContact O-CG2 3.31Å; T1055-T1058 WeakPolarHBondContact O-CG2 3.46Å; T1055-T1058 PolarHBondContact O-OG1 2.63Å; Q1056-T1058 PolarHBondContact O-N 3.26Å; Q1056-T1058 VanDerWaalsContact O-N 3.1Å; T1058-V1076 HydrophobicContact CG2-CG2 4.17Å
1059	L	54.2	Low	61.1	Low	114 Å²	114	48.6 Å²	48.6	60%	0.597	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-106	-2.4	-166	-74	164.3	0	0	0	116.9	M1057	M1057-L1059 PolarHBondContact O-N 3Å
1060	K	49.5	Very low	59.5	Low	118 Å²	118	49.7 Å²	49.7	51%	0.513	28%	0.275	S	S	.	.			trans	-128.1	117.5	-174.7	-63.8	-177.7	-173.6	170.7	0	112.3	H1275	K1060-H1275 PolarHBondContact NZ-O 2.74Å; K1060-H1275 PolarHBondContact O-NE2 3.31Å
1061	T	49.4	Very low	58.1	Low	78 Å²	78	54.2 Å²	54.2	48%	0.479	30%	0.299	S	S	.	.			trans	-104.2	15.2	174.8	40.4	0	0	0	0	113.5	H1063	T1061-H1063 PolarHBondContact O-N 3.12Å
1062	F	44.3	Very low	57.2	Low	145 Å²	145	57.1 Å²	57.1	64%	0.636	32%	0.315	S	S	*	.			trans	-93	56.8	-166.1	-86	-75	0	0	0	115.7	V814	V814-F1062 HydrophobicContact CG2-CZ 4.47Å
1063	H	44.7	Very low	56.6	Low	101 Å²	101	57.2 Å²	57.2	47%	0.468	32%	0.316	S	S	.	.			trans	-144.4	89.5	166.8	-67	-70.5	0	0	0	112.6	T1061 A1065 G1274	T1061-H1063 PolarHBondContact O-N 3.12Å; H1063-A1065 PolarHBondContact O-N 3.45Å; H1063-G1274 PolarHBondContact CD2-O 2.91Å; H1063-G1274 PolarHBondContact NE2-O 3.29Å
1064	F	39.9	Very low	56.1	Low	98 Å²	98	60 Å²	60	43%	0.43	33%	0.33	S	S	.	.			trans	-81.2	98.8	154.4	-72.9	-89.6	0	0	0	107.1	G1066 N1071	F1064-G1066 VanDerWaalsContact C-N 3.34Å; F1064-G1066 PolarHBondContact O-N 3.06Å; F1064-N1071 WeakPolarHBondContact CE1-OD1 3.43Å
1065	A	35.3	Very low	56.1	Low	62 Å²	62	60.2 Å²	60.2	51%	0.512	33%	0.331	S	S	.	.			trans	-66.8	92.7	176.5	0	0	0	0	0	109.7	H1063 V1067 I1072	H1063-A1065 PolarHBondContact O-N 3.45Å; A1065-V1067 PolarHBondContact O-N 2.94Å; A1065-I1072 HydrophobicContact CB-CD1 4.48Å
1066	G	41.5	Very low	56.5	Low	64 Å²	64	59.7 Å²	59.7	66%	0.66	33%	0.329	S	S	*	.	S	Bend	trans	64.5	-8.7	161.2	0	0	0	0	0	118.1	F1064	F1064-G1066 VanDerWaalsContact C-N 3.34Å; F1064-G1066 PolarHBondContact O-N 3.06Å
1067	V	45.4	Very low	57.2	Low	19 Å²	19	57.4 Å²	57.4	12%	0.115	32%	0.323	C	S	.	.			trans	-135.4	109.4	-179.3	-169.1	0	0	0	0	108.5	A1065 S1069 M1070 V1212 Q1214	A1065-V1067 PolarHBondContact O-N 2.94Å; V1067-S1069 WeakPolarHBondContact CG1-OG 3.38Å; V1067-S1069 PolarHBondContact O-N 3.19Å; V1067-M1070 PolarHBondContact O-N 3.14Å; V1067-V1212 HydrophobicContact CG1-CG1 4.14Å; V1067-Q1214 HydrophobicContact CG2-CB 4.41Å; V1067-Q1214 HydrophobicContact CG2-CG 4.23Å
1068	A	45.3	Very low	58	Low	37 Å²	37	57.3 Å²	57.3	31%	0.306	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-6.8	-179	0	0	0	0	0	114.9	S761	S761-A1068 WeakPolarHBondContact OG-CB 3.14Å
1069	S	51.8	Low	59.3	Low	20 Å²	20	57 Å²	57	14%	0.14	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-3.9	-172.1	65.3	0	0	0	0	116.5	C753 V1067 R1210	C753-S1069 VanDerWaalsContact SG-CB 3.56Å; V1067-S1069 WeakPolarHBondContact CG1-OG 3.38Å; V1067-S1069 PolarHBondContact O-N 3.19Å; S1069-R1210 PolarHBondContact O-NH1 3.5Å; S1069-R1210 PolarHBondContact OG-NH2 3.11Å
1070	M	57.6	Low	60.9	Low	26 Å²	26	56.3 Å²	56.3	13%	0.128	31%	0.309	C	S	.	.			trans	-116.7	102.8	179.4	-76.2	-167.1	156.1	0	0	111.5	V1067 I1072 L1093 V1212 F1223 E1225	V1067-M1070 PolarHBondContact O-N 3.14Å; M1070-I1072 PolarHBondContact O-N 3.29Å; M1070-L1093 HydrophobicContact SD-CD1 4.02Å; M1070-V1212 HydrophobicContact CE-CB 4.44Å; M1070-V1212 HydrophobicContact CE-CG2 3.68Å; M1070-V1212 HydrophobicContact SD-CG2 4.32Å; M1070-F1223 HydrophobicContact SD-CB 4.4Å; M1070-E1225 HydrophobicContact CE-CB 3.9Å
1071	N	61.8	Low	62.9	Low	96 Å²	96	51.5 Å²	51.5	51%	0.513	29%	0.289	S	S	.	.			trans	-76.7	83.9	175.2	-68.1	-13.4	0	0	0	110.1	F1064 T1073 T1091	F1064-N1071 WeakPolarHBondContact CE1-OD1 3.43Å; N1071-T1073 PolarHBondContact O-N 3.4Å; N1071-T1091 WeakPolarHBondContact O-CG2 3.39Å
1072	I	65.5	Low	65	Low	62 Å²	62	47.8 Å²	47.8	32%	0.318	27%	0.266	S	S	.	.			trans	-66.9	132.9	175.4	-58.9	171.6	0	0	0	109	A1065 M1070 Q1074 L1093	A1065-I1072 HydrophobicContact CB-CD1 4.48Å; M1070-I1072 PolarHBondContact O-N 3.29Å; I1072-Q1074 HydrophobicContact CB-CG 4.45Å; I1072-Q1074 HydrophobicContact CG2-CG 4.14Å; I1072-Q1074 PolarHBondContact O-N 3.47Å; I1072-L1093 HydrophobicContact CD1-CD2 4.36Å
1073	T	70.3	Confident	67.2	Low	24 Å²	24	40.9 Å²	40.9	15%	0.147	24%	0.235	C	C	.	.			trans	-64.3	120.7	169.1	50.5	0	0	0	0	109.3	N1071 R1078 E1081 K1090 T1091	N1071-T1073 PolarHBondContact O-N 3.4Å; T1073-R1078 VanDerWaalsContact O-CB 3.23Å; T1073-R1078 WeakPolarHBondContact O-CB 3.28Å; T1073-R1078 WeakPolarHBondContact O-CD 3.48Å; T1073-R1078 WeakPolarHBondContact O-CG 3.29Å; T1073-E1081 PolarHBondContact OG1-OE2 2.92Å; T1073-K1090 HydrophobicContact CG2-CB 3.85Å; T1073-K1090 HydrophobicContact CG2-CD 4Å; T1073-T1091 HydrophobicContact CG2-CG2 4.4Å; T1073-T1091 PolarHBondContact N-OG1 2.89Å; T1073-T1091 PolarHBondContact OG1-OG1 2.94Å
1074	Q	71.2	Confident	69.5	Low	59 Å²	59	37.2 Å²	37.2	28%	0.276	22%	0.219	S	C	.	.			trans	-128.4	172.3	177.8	-66.9	-162.8	-3.1	0	0	111.7	I1072 P1077	I1072-Q1074 HydrophobicContact CB-CG 4.45Å; I1072-Q1074 HydrophobicContact CG2-CG 4.14Å; I1072-Q1074 PolarHBondContact O-N 3.47Å; Q1074-P1077 WeakPolarHBondContact O-CD 3.35Å
1075	G	78.5	Confident	72	Confident	4 Å²	4	33.2 Å²	33.2	4%	0.041	20%	0.204	C	C	.	.	S	Bend	trans	71.8	-147	178.6	0	0	0	0	0	113	R1078 M1079 H1275	G1075-R1078 PolarHBondContact O-N 3.37Å; G1075-R1078 VanDerWaalsContact O-N 3.15Å; G1075-M1079 PolarHBondContact O-N 3.14Å; G1075-H1275 VanDerWaalsContact CA-CE1 3.42Å; G1075-H1275 WeakPolarHBondContact CA-CE1 3.34Å; G1075-H1275 WeakPolarHBondContact CA-NE2 3.35Å; G1075-H1275 PolarHBondContact N-CE1 2.74Å; G1075-H1275 VanDerWaalsContact N-CE1 3.35Å
1076	V	81	Confident	74.6	Confident	12 Å²	12	31.6 Å²	31.6	7%	0.073	19%	0.191	C	C	.	.	H	α-helix	trans	-56.7	-42.5	-176.9	-177.5	0	0	0	0	113.3	T879 A1054 M1057 T1058 R1078 M1079 R1080	T879-V1076 HydrophobicContact CG2-CB 4.48Å; T879-V1076 HydrophobicContact CG2-CG1 3.77Å; T879-V1076 HydrophobicContact CG2-CG2 3.85Å; A1054-V1076 WeakPolarHBondContact O-CG2 3.48Å; M1057-V1076 HydrophobicContact CB-CG2 4.41Å; T1058-V1076 HydrophobicContact CG2-CG2 4.17Å; V1076-R1078 VanDerWaalsContact C-N 3.31Å; V1076-R1078 PolarHBondContact O-N 3Å; V1076-M1079 PolarHBondContact O-N 3.47Å; V1076-R1080 WeakPolarHBondContact O-CB 3.49Å; V1076-R1080 PolarHBondContact O-N 3.18Å
1077	P	83.7	Confident	76.8	Confident	54 Å²	54	32 Å²	32	35%	0.351	19%	0.188	S	C	.	.	H	α-helix	trans	-57.2	-41.5	176	-27.6	35.6	0	0	0	113.7	Q1074 R1080 E1081	Q1074-P1077 WeakPolarHBondContact O-CD 3.35Å; P1077-R1080 WeakPolarHBondContact O-CB 3.38Å; P1077-R1080 PolarHBondContact O-N 2.93Å; P1077-E1081 WeakPolarHBondContact O-CG 2.87Å; P1077-E1081 PolarHBondContact O-N 3.14Å
1078	R	87.6	Confident	78.9	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.015	23%	0.225	C	C	.	.	H	α-helix	trans	-72	-44.7	179.1	-176.2	60	-174.4	158.6	2.2	111.7	T1073 G1075 V1076 R1080 E1081 I1082 N1246 E1267 V1271	T1073-R1078 VanDerWaalsContact O-CB 3.23Å; T1073-R1078 WeakPolarHBondContact O-CB 3.28Å; T1073-R1078 WeakPolarHBondContact O-CD 3.48Å; T1073-R1078 WeakPolarHBondContact O-CG 3.29Å; G1075-R1078 PolarHBondContact O-N 3.37Å; G1075-R1078 VanDerWaalsContact O-N 3.15Å; V1076-R1078 VanDerWaalsContact C-N 3.31Å; V1076-R1078 PolarHBondContact O-N 3Å; R1078-R1080 PolarHBondContact O-N 2.73Å; R1078-E1081 IonicContact NH1-OE2 3.11Å; R1078-E1081 PolarHBondContact NH1-OE2 2.91Å; R1078-E1081 WeakPolarHBondContact O-CB 3.31Å; R1078-E1081 PolarHBondContact O-N 2.88Å; R1078-I1082 HydrophobicContact CG-CD1 4.05Å; R1078-I1082 WeakPolarHBondContact O-CG1 3.44Å; R1078-I1082 PolarHBondContact O-N 2.68Å; R1078-N1246 PolarHBondContact NH2-O 3.03Å; R1078-E1267 IonicContact CZ-OE2 3.4Å; R1078-E1267 IonicContact NE-OE2 3.16Å; R1078-E1267 PolarHBondContact NE-OE2 2.82Å; R1078-E1267 IonicContact NH2-OE2 3.73Å; R1078-E1267 PolarHBondContact NH2-OE2 2.94Å; R1078-V1271 HydrophobicContact CB-CG2 4.1Å; R1078-V1271 HydrophobicContact CG-CG2 3.52Å
1079	M	87.6	Confident	81.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.1	-41.5	173.3	-169.9	177.9	-69.4	0	0	111	M882 V1050 A1054 M1057 G1075 V1076 I1082 V1083 L1268 V1271 M1272	M882-M1079 HydrophobicContact CE-CG 4.19Å; M882-M1079 HydrophobicContact CE-SD 3.53Å; M882-M1079 VanDerWaalsContact CE-SD 3.53Å; M882-M1079 HydrophobicContact SD-CG 4.26Å; M882-M1079 HydrophobicContact SD-SD 4.36Å; V1050-M1079 HydrophobicContact CG1-SD 4.46Å; A1054-M1079 HydrophobicContact CB-SD 3.79Å; M1057-M1079 HydrophobicContact CE-CE 4.43Å; M1057-M1079 HydrophobicContact SD-CE 3.67Å; G1075-M1079 PolarHBondContact O-N 3.14Å; V1076-M1079 PolarHBondContact O-N 3.47Å; M1079-I1082 PolarHBondContact O-N 2.84Å; M1079-V1083 HydrophobicContact CG-CG2 4.3Å; M1079-V1083 VanDerWaalsContact O-CB 3.3Å; M1079-V1083 WeakPolarHBondContact O-CB 3.4Å; M1079-V1083 VanDerWaalsContact O-CG2 3.24Å; M1079-V1083 WeakPolarHBondContact O-CG2 3.46Å; M1079-V1083 PolarHBondContact O-N 3.45Å; M1079-L1268 HydrophobicContact CG-CD2 4.06Å; M1079-V1271 HydrophobicContact CB-CG1 4.41Å; M1079-V1271 HydrophobicContact CE-CG1 4.24Å; M1079-M1272 HydrophobicContact CE-CE 3.74Å; M1079-M1272 HydrophobicContact CE-CG 4.06Å
1080	R	87.8	Confident	82.6	Confident	99 Å²	99	47.5 Å²	47.5	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-41	174.8	-176	-176.6	69.8	-178.1	0.9	112.7	V1076 P1077 R1078 I1082 N1084	V1076-R1080 WeakPolarHBondContact O-CB 3.49Å; V1076-R1080 PolarHBondContact O-N 3.18Å; P1077-R1080 WeakPolarHBondContact O-CB 3.38Å; P1077-R1080 PolarHBondContact O-N 2.93Å; R1078-R1080 PolarHBondContact O-N 2.73Å; R1080-I1082 VanDerWaalsContact C-N 3.34Å; R1080-N1084 WeakPolarHBondContact CG-ND2 3.38Å; R1080-N1084 WeakPolarHBondContact O-CB 3.31Å; R1080-N1084 PolarHBondContact O-N 3.22Å; R1080-N1084 PolarHBondContact O-ND2 2.76Å
1081	E	91.1	Very high	84	Confident	17 Å²	17	47.4 Å²	47.4	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-44.1	176	-75	175.1	176.8	0	0	111.5	T1073 P1077 R1078 A1085 A1086 I1089 K1090	T1073-E1081 PolarHBondContact OG1-OE2 2.92Å; P1077-E1081 WeakPolarHBondContact O-CG 2.87Å; P1077-E1081 PolarHBondContact O-N 3.14Å; R1078-E1081 IonicContact NH1-OE2 3.11Å; R1078-E1081 PolarHBondContact NH1-OE2 2.91Å; R1078-E1081 WeakPolarHBondContact O-CB 3.31Å; R1078-E1081 PolarHBondContact O-N 2.88Å; E1081-A1085 PolarHBondContact O-N 3.03Å; E1081-A1086 PolarHBondContact O-N 3.18Å; E1081-A1086 VanDerWaalsContact O-N 3.17Å; E1081-I1089 HydrophobicContact CB-CG2 4.27Å; E1081-K1090 PolarHBondContact OE1-N 3.02Å
1082	I	93.3	Very high	85.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-56.1	178.7	-63.3	160.6	0	0	0	110.8	R1078 M1079 R1080 N1084 A1085 I1248 V1264 E1267 L1268 V1271	R1078-I1082 HydrophobicContact CG-CD1 4.05Å; R1078-I1082 WeakPolarHBondContact O-CG1 3.44Å; R1078-I1082 PolarHBondContact O-N 2.68Å; M1079-I1082 PolarHBondContact O-N 2.84Å; R1080-I1082 VanDerWaalsContact C-N 3.34Å; I1082-N1084 PolarHBondContact O-N 3.43Å; I1082-A1085 PolarHBondContact O-N 2.76Å; I1082-I1248 HydrophobicContact CB-CD1 4.2Å; I1082-I1248 HydrophobicContact CG1-CD1 4.28Å; I1082-I1248 HydrophobicContact CG2-CD1 3.81Å; I1082-V1264 HydrophobicContact CG2-CG1 4.13Å; I1082-E1267 HydrophobicContact CD1-CB 3.72Å; I1082-E1267 HydrophobicContact CG1-CB 4.38Å; I1082-L1268 HydrophobicContact CB-CD2 4.26Å; I1082-L1268 HydrophobicContact CD1-CD2 4.09Å; I1082-L1268 HydrophobicContact CD1-CG 4.39Å; I1082-L1268 HydrophobicContact CG2-CD1 4.17Å; I1082-L1268 HydrophobicContact CG2-CD2 3.87Å; I1082-L1268 HydrophobicContact CG2-CG 3.8Å; I1082-V1271 HydrophobicContact CD1-CG2 4.31Å
1083	V	91.4	Very high	86.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-30.6	-179.4	168.1	0	0	0	0	111.7	L886 M1079 A1085 Y1300	L886-V1083 HydrophobicContact CD2-CG1 3.88Å; L886-V1083 HydrophobicContact CD2-CG2 4.43Å; M1079-V1083 HydrophobicContact CG-CG2 4.3Å; M1079-V1083 VanDerWaalsContact O-CB 3.3Å; M1079-V1083 WeakPolarHBondContact O-CB 3.4Å; M1079-V1083 VanDerWaalsContact O-CG2 3.24Å; M1079-V1083 WeakPolarHBondContact O-CG2 3.46Å; M1079-V1083 PolarHBondContact O-N 3.45Å; V1083-A1085 VanDerWaalsContact C-N 3.35Å; V1083-Y1300 HydrophobicContact CB-CD2 4.44Å; V1083-Y1300 HydrophobicContact CG1-CD2 3.72Å; V1083-Y1300 HydrophobicContact CG1-CG 3.99Å; V1083-Y1300 WeakPolarHBondContact O-CD2 3.26Å; V1083-Y1300 PolarHBondContact O-N 3.45Å
1084	N	91.5	Very high	87.6	Confident	24 Å²	24	41.2 Å²	41.2	13%	0.128	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-13.1	175.8	-75.3	-15.1	0	0	0	114.4	R885 R1080 I1082 A1086 Q1301	R885-N1084 PolarHBondContact NH1-OD1 3.31Å; R885-N1084 PolarHBondContact NH2-OD1 2.86Å; R1080-N1084 WeakPolarHBondContact CG-ND2 3.38Å; R1080-N1084 WeakPolarHBondContact O-CB 3.31Å; R1080-N1084 PolarHBondContact O-N 3.22Å; R1080-N1084 PolarHBondContact O-ND2 2.76Å; I1082-N1084 PolarHBondContact O-N 3.43Å; N1084-A1086 VanDerWaalsContact C-N 3.32Å; N1084-A1086 PolarHBondContact O-N 2.94Å; N1084-Q1301 HydrophobicContact CB-CG 4.2Å; N1084-Q1301 VanDerWaalsContact CB-NE2 3.33Å; N1084-Q1301 PolarHBondContact ND2-NE2 3.16Å
1085	A	92.3	Very high	88.5	Confident	14 Å²	14	40.2 Å²	40.2	12%	0.116	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	55	-165.7	0	0	0	0	0	111.4	E1081 I1082 V1083 A1087 L1249 M1291 V1297	E1081-A1085 PolarHBondContact O-N 3.03Å; I1082-A1085 PolarHBondContact O-N 2.76Å; V1083-A1085 VanDerWaalsContact C-N 3.35Å; A1085-A1087 PolarHBondContact O-N 3.42Å; A1085-L1249 VanDerWaalsContact O-CD1 3.23Å; A1085-L1249 WeakPolarHBondContact O-CD1 3.49Å; A1085-M1291 HydrophobicContact CB-CE 4.17Å; A1085-V1297 HydrophobicContact CB-CG1 3.8Å
1086	A	91.2	Very high	89.2	Confident	28 Å²	28	40 Å²	40	23%	0.231	21%	0.205	C	C	.	.			trans	-69.5	124.7	-174.9	0	0	0	0	0	112	E1081 N1084 R1088 I1089	E1081-A1086 PolarHBondContact O-N 3.18Å; E1081-A1086 VanDerWaalsContact O-N 3.17Å; N1084-A1086 VanDerWaalsContact C-N 3.32Å; N1084-A1086 PolarHBondContact O-N 2.94Å; A1086-R1088 VanDerWaalsContact C-N 3.26Å; A1086-R1088 PolarHBondContact O-N 2.87Å; A1086-I1089 HydrophobicContact CB-CG2 4.39Å
1087	A	87.6	Confident	89.6	Confident	73 Å²	73	41.2 Å²	41.2	60%	0.603	21%	0.212	S	C	*	.	S	Bend	trans	-65.6	-25.7	179.3	0	0	0	0	0	114.4	A1085 L1249	A1085-A1087 PolarHBondContact O-N 3.42Å; A1087-L1249 HydrophobicContact CB-CD1 3.8Å
1088	R	89.3	Confident	90	Very high	234 Å²	234	38.9 Å²	38.9	88%	0.883	20%	0.197	S	C	*	.	S	Bend	trans	-125.9	105.5	174.6	-67.3	-175.7	-176.6	-176.6	0.2	108.6	A1086	A1086-R1088 VanDerWaalsContact C-N 3.26Å; A1086-R1088 PolarHBondContact O-N 2.87Å
1089	I	90.4	Very high	90.2	Very high	21 Å²	21	42.9 Å²	42.9	11%	0.108	22%	0.222	C	C	.	.			trans	-89.7	155.3	173.8	59	174.2	0	0	0	110.3	E1081 A1086 P1092 N1246 N1247	E1081-I1089 HydrophobicContact CB-CG2 4.27Å; A1086-I1089 HydrophobicContact CB-CG2 4.39Å; I1089-P1092 HydrophobicContact CD1-CB 3.9Å; I1089-P1092 HydrophobicContact CG1-CB 3.83Å; I1089-N1246 WeakPolarHBondContact CD1-OD1 3.34Å; I1089-N1247 HydrophobicContact CD1-CB 3.89Å
1090	K	85.2	Confident	90.3	Very high	146 Å²	146	46.3 Å²	46.3	64%	0.635	24%	0.24	S	C	*	.	S	Bend	trans	-68.1	-40.9	-176.7	-73.2	-177.7	175.2	-172.4	0	112.9	T1073 E1081	T1073-K1090 HydrophobicContact CG2-CB 3.85Å; T1073-K1090 HydrophobicContact CG2-CD 4Å; E1081-K1090 PolarHBondContact OE1-N 3.02Å
1091	T	86	Confident	90.3	Very high	24 Å²	24	43.1 Å²	43.1	15%	0.147	23%	0.232	C	C	.	.	S	Bend	trans	-128.1	77.3	-177.4	54.7	0	0	0	0	110.7	N1071 T1073 L1093 N1246	N1071-T1091 WeakPolarHBondContact O-CG2 3.39Å; T1073-T1091 HydrophobicContact CG2-CG2 4.4Å; T1073-T1091 PolarHBondContact N-OG1 2.89Å; T1073-T1091 PolarHBondContact OG1-OG1 2.94Å; T1091-L1093 PolarHBondContact O-N 2.86Å; T1091-N1246 PolarHBondContact O-ND2 3.43Å; T1091-N1246 VanDerWaalsContact O-ND2 3.08Å
1092	P	90	Very high	90.2	Very high	22 Å²	22	48.5 Å²	48.5	14%	0.143	26%	0.255	C	S	.	.			trans	-70	123.7	174.4	30.1	-32.2	0	0	0	109.8	I1089 E1225 G1226 A1227 N1246	I1089-P1092 HydrophobicContact CD1-CB 3.9Å; I1089-P1092 HydrophobicContact CG1-CB 3.83Å; P1092-E1225 CarbonylContact O-C 3.27Å; P1092-E1225 VanDerWaalsContact O-CA 3.26Å; P1092-E1225 WeakPolarHBondContact O-CA 3.28Å; P1092-G1226 PolarHBondContact O-N 2.87Å; P1092-A1227 HydrophobicContact CB-CB 4.24Å; P1092-N1246 WeakPolarHBondContact CA-OD1 3.34Å
1093	L	89.9	Confident	90.1	Very high	31 Å²	31	49.6 Å²	49.6	16%	0.162	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.2	-174.4	-168.8	74.4	0	0	0	109.5	M1070 I1072 T1091 F1223 V1224 S1245 N1246	M1070-L1093 HydrophobicContact SD-CD1 4.02Å; I1072-L1093 HydrophobicContact CD1-CD2 4.36Å; T1091-L1093 PolarHBondContact O-N 2.86Å; L1093-F1223 HydrophobicContact CD1-CB 4.07Å; L1093-F1223 HydrophobicContact CD1-CD1 4.17Å; L1093-F1223 HydrophobicContact CD2-CD1 3.89Å; L1093-F1223 HydrophobicContact CD2-CE1 4.32Å; L1093-F1223 HydrophobicContact CG-CD1 4.14Å; L1093-V1224 CarbonylContact C-O 3.53Å; L1093-V1224 WeakPolarHBondContact CA-O 3.38Å; L1093-S1245 WeakPolarHBondContact O-CA 3.47Å; L1093-N1246 PolarHBondContact N-OD1 3.29Å; L1093-N1246 PolarHBondContact O-N 3.48Å; L1093-N1246 PolarHBondContact O-OD1 3.1Å
1094	I	92.9	Very high	89.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.1	170.5	-56.4	163.6	0	0	0	107.5	V1096 V1224 G1226 L1229 V1232 T1243 R1244	I1094-V1096 HydrophobicContact CG2-CG2 3.92Å; I1094-V1224 HydrophobicContact CB-CB 4.17Å; I1094-V1224 PolarHBondContact N-O 3.38Å; I1094-V1224 PolarHBondContact O-N 2.68Å; I1094-G1226 WeakPolarHBondContact CD1-O 3.31Å; I1094-L1229 HydrophobicContact CD1-CB 4.43Å; I1094-L1229 HydrophobicContact CG2-CD1 4Å; I1094-V1232 HydrophobicContact CD1-CG2 4.05Å; I1094-V1232 HydrophobicContact CG2-CG1 4.19Å; I1094-T1243 HydrophobicContact CG2-CG2 3.78Å; I1094-R1244 CarbonylContact C-O 3.51Å; I1094-R1244 VanDerWaalsContact CA-O 3.26Å; I1094-R1244 WeakPolarHBondContact CA-O 3.36Å; I1094-R1244 WeakPolarHBondContact CG2-O 3.37Å
1095	C	91.4	Very high	89.7	Confident	37 Å²	37	54.1 Å²	54.1	25%	0.25	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.1	174	-175.4	0	0	0	0	108.7	I1221 F1223 T1243 R1244	C1095-I1221 VanDerWaalsContact SG-CG2 3.58Å; C1095-F1223 HydrophobicContact CB-CD1 4.29Å; C1095-F1223 HydrophobicContact CB-CE1 4.05Å; C1095-T1243 WeakPolarHBondContact O-CA 3.49Å; C1095-R1244 PolarHBondContact N-O 3.13Å; C1095-R1244 PolarHBondContact O-N 2.95Å
1096	V	91.9	Very high	89.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.5	-173	175.7	0	0	0	0	109.2	I1094 I1222 V1224 V1232 V1238 T1243	I1094-V1096 HydrophobicContact CG2-CG2 3.92Å; V1096-I1222 HydrophobicContact CB-CB 4.02Å; V1096-I1222 WeakPolarHBondContact CB-O 3.35Å; V1096-I1222 HydrophobicContact CG1-CB 4.44Å; V1096-I1222 PolarHBondContact N-O 2.89Å; V1096-I1222 PolarHBondContact O-N 2.72Å; V1096-V1224 HydrophobicContact CG2-CG2 3.86Å; V1096-V1232 HydrophobicContact CG2-CG1 3.46Å; V1096-V1232 VanDerWaalsContact CG2-CG1 3.46Å; V1096-V1238 HydrophobicContact CG1-CB 4.23Å; V1096-V1238 HydrophobicContact CG1-CG1 3.72Å; V1096-V1238 HydrophobicContact CG1-CG2 3.62Å; V1096-T1243 HydrophobicContact CG2-CG2 4.18Å
1097	T	90	Very high	89.4	Confident	38 Å²	38	53.5 Å²	53.5	23%	0.233	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-97.1	132	173.3	-55.5	0	0	0	0	109.3	V1239 R1242	T1097-V1239 HydrophobicContact CG2-CB 4.47Å; T1097-V1239 PolarHBondContact O-N 3.38Å; T1097-R1242 HydrophobicContact CG2-CB 4.08Å; T1097-R1242 PolarHBondContact OG1-O 3.41Å
1098	L	91.8	Very high	89.4	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.026	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-86.3	153.9	179	-63.3	174.8	0	0	0	111.6	D1100 L1106 A1107 V1110 H1220 I1222 G1237	L1098-D1100 VanDerWaalsContact C-N 3.3Å; L1098-L1106 HydrophobicContact CB-CD2 4.34Å; L1098-A1107 HydrophobicContact CD1-CB 3.51Å; L1098-V1110 HydrophobicContact CD2-CB 3.93Å; L1098-V1110 HydrophobicContact CD2-CG1 4.01Å; L1098-V1110 HydrophobicContact CD2-CG2 3.74Å; L1098-H1220 HydrophobicContact CD1-CB 4.22Å; L1098-I1222 HydrophobicContact CD1-CD1 4.25Å; L1098-I1222 HydrophobicContact CD1-CG1 4.37Å; L1098-I1222 HydrophobicContact CD2-CD1 3.78Å; L1098-I1222 HydrophobicContact CD2-CG1 4.42Å; L1098-I1222 HydrophobicContact CG-CD1 4.32Å; L1098-I1222 HydrophobicContact CG-CG1 4.48Å; L1098-G1237 WeakPolarHBondContact CA-O 3.43Å
1099	T	91.4	Very high	89.3	Confident	87 Å²	87	52.8 Å²	52.8	53%	0.534	28%	0.277	S	S	.	.	S	Bend	trans	-64.8	-36.6	174	51.9	0	0	0	0	112	L1106 G1237 V1239	T1099-L1106 WeakPolarHBondContact OG1-CD2 3.33Å; T1099-G1237 PolarHBondContact N-O 3.41Å; T1099-V1239 HydrophobicContact CG2-CG2 3.81Å
1100	D	90.7	Very high	89.3	Confident	72 Å²	72	51.8 Å²	51.8	39%	0.385	27%	0.272	S	S	.	.	S	Bend	trans	-119.6	101.5	167.6	179.4	2.2	0	0	0	108.7	L1098 F1102 S1103 L1106	L1098-D1100 VanDerWaalsContact C-N 3.3Å; D1100-F1102 PolarHBondContact O-N 3.31Å; D1100-F1102 PolarHBondContact OD1-N 3.33Å; D1100-S1103 PolarHBondContact O-N 3.49Å; D1100-S1103 VanDerWaalsContact OD2-CB 3.24Å; D1100-S1103 WeakPolarHBondContact OD2-CB 3.16Å; D1100-L1106 HydrophobicContact CB-CD2 3.97Å
1101	P	86.6	Confident	89.5	Confident	33 Å²	33	47.5 Å²	47.5	21%	0.214	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.1	-178	27.6	-33	0	0	0	112.7	E1219 H1220	P1101-E1219 HydrophobicContact CB-CB 4.06Å; P1101-E1219 HydrophobicContact CB-CG 4.07Å; P1101-E1219 HydrophobicContact CG-CG 4.42Å; P1101-H1220 WeakPolarHBondContact O-CB 3.49Å; P1101-H1220 PolarHBondContact O-CD2 3.36Å; P1101-H1220 PolarHBondContact O-N 2.91Å
1102	F	90.4	Very high	89.5	Confident	129 Å²	129	49 Å²	49	57%	0.566	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-11.1	-177.7	-59.3	-76	0	0	0	113	D1100 A1104 G1218 E1219	D1100-F1102 PolarHBondContact O-N 3.31Å; D1100-F1102 PolarHBondContact OD1-N 3.33Å; F1102-A1104 PolarHBondContact O-N 3.05Å; F1102-G1218 WeakPolarHBondContact CD1-O 3.18Å; F1102-E1219 HydrophobicContact CD1-CG 4.32Å; F1102-E1219 HydrophobicContact CE1-CG 3.6Å; F1102-E1219 HydrophobicContact CE2-CG 4.49Å; F1102-E1219 HydrophobicContact CZ-CG 3.69Å
1103	S	90.1	Very high	89.4	Confident	24 Å²	24	49.9 Å²	49.9	17%	0.168	27%	0.266	C	S	.	.			trans	-84.8	103.2	-178.1	178.7	0	0	0	0	113.1	D1100 S1105 L1106 A1107	D1100-S1103 PolarHBondContact O-N 3.49Å; D1100-S1103 VanDerWaalsContact OD2-CB 3.24Å; D1100-S1103 WeakPolarHBondContact OD2-CB 3.16Å; S1103-S1105 PolarHBondContact O-N 3.18Å; S1103-S1105 PolarHBondContact OG-OG 2.91Å; S1103-L1106 PolarHBondContact O-N 3.29Å; S1103-L1106 WeakPolarHBondContact OG-CB 3.25Å; S1103-L1106 PolarHBondContact OG-N 3.03Å; S1103-A1107 PolarHBondContact O-N 3.27Å
1104	A	85.7	Confident	89.5	Confident	36 Å²	36	48.4 Å²	48.4	30%	0.298	26%	0.259	S	S	.	.	H	α-helix	trans	-62.3	-29.9	173.1	0	0	0	0	0	113.2	F1102 R1108	F1102-A1104 PolarHBondContact O-N 3.05Å; A1104-R1108 WeakPolarHBondContact O-CG 3.45Å; A1104-R1108 PolarHBondContact O-N 3.19Å
1105	S	88.1	Confident	89.3	Confident	82 Å²	82	51.1 Å²	51.1	57%	0.573	27%	0.271	S	S	*	.	H	α-helix	trans	-70.2	-44.4	178	57.1	0	0	0	0	111.1	S1103 R1108 Q1109	S1103-S1105 PolarHBondContact O-N 3.18Å; S1103-S1105 PolarHBondContact OG-OG 2.91Å; S1105-R1108 PolarHBondContact O-N 3.06Å; S1105-Q1109 PolarHBondContact O-N 3.14Å
1106	L	89.7	Confident	89.2	Confident	29 Å²	29	50.4 Å²	50.4	15%	0.152	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-45.6	174.4	-178.1	65.5	0	0	0	110.9	L1098 T1099 D1100 S1103 R1108 Q1109 V1110	L1098-L1106 HydrophobicContact CB-CD2 4.34Å; T1099-L1106 WeakPolarHBondContact OG1-CD2 3.33Å; D1100-L1106 HydrophobicContact CB-CD2 3.97Å; S1103-L1106 PolarHBondContact O-N 3.29Å; S1103-L1106 WeakPolarHBondContact OG-CB 3.25Å; S1103-L1106 PolarHBondContact OG-N 3.03Å; L1106-R1108 VanDerWaalsContact C-N 3.27Å; L1106-R1108 PolarHBondContact O-N 3.33Å; L1106-Q1109 PolarHBondContact O-N 3.11Å; L1106-Q1109 VanDerWaalsContact O-N 3.08Å; L1106-V1110 HydrophobicContact CD1-CG2 4.22Å; L1106-V1110 HydrophobicContact CG-CG2 4.38Å; L1106-V1110 WeakPolarHBondContact O-CG2 3.43Å; L1106-V1110 PolarHBondContact O-N 2.94Å
1107	A	88	Confident	89	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-56.2	-41.6	178.1	0	0	0	0	0	112.3	L1098 S1103 K1111 I1213 H1220 I1222	L1098-A1107 HydrophobicContact CD1-CB 3.51Å; S1103-A1107 PolarHBondContact O-N 3.27Å; A1107-K1111 VanDerWaalsContact O-CB 3.28Å; A1107-K1111 WeakPolarHBondContact O-CB 3.34Å; A1107-K1111 PolarHBondContact O-N 3.18Å; A1107-I1213 HydrophobicContact CB-CD1 4.11Å; A1107-I1213 HydrophobicContact CB-CG2 4.22Å; A1107-H1220 HydrophobicContact CB-CB 4.05Å; A1107-I1222 HydrophobicContact CB-CD1 4.43Å; A1107-I1222 WeakPolarHBondContact O-CD1 3.34Å
1108	R	87.1	Confident	88.9	Confident	165 Å²	165	54.7 Å²	54.7	62%	0.623	28%	0.279	S	S	*	.	H	α-helix	trans	-68.8	-40	175.9	-71.3	175.7	-170.8	139.5	2.3	112.5	A1104 S1105 L1106 K1111 L1112 I1213	A1104-R1108 WeakPolarHBondContact O-CG 3.45Å; A1104-R1108 PolarHBondContact O-N 3.19Å; S1105-R1108 PolarHBondContact O-N 3.06Å; L1106-R1108 VanDerWaalsContact C-N 3.27Å; L1106-R1108 PolarHBondContact O-N 3.33Å; R1108-K1111 PolarHBondContact O-N 3.46Å; R1108-L1112 WeakPolarHBondContact O-CB 3.43Å; R1108-L1112 VanDerWaalsContact O-CG 3.29Å; R1108-L1112 WeakPolarHBondContact O-CG 3.36Å; R1108-L1112 PolarHBondContact O-N 3Å; R1108-I1213 HydrophobicContact CG-CD1 4.22Å
1109	Q	87.9	Confident	88.7	Confident	127 Å²	127	54.6 Å²	54.6	59%	0.593	28%	0.278	S	S	*	.	H	α-helix	trans	-64.6	-44.4	178.2	-176.1	178.6	-9.7	0	0	111.9	S1105 L1106 L1112 S1113	S1105-Q1109 PolarHBondContact O-N 3.14Å; L1106-Q1109 PolarHBondContact O-N 3.11Å; L1106-Q1109 VanDerWaalsContact O-N 3.08Å; Q1109-L1112 PolarHBondContact O-N 3.25Å; Q1109-S1113 PolarHBondContact O-N 3.11Å; Q1109-S1113 VanDerWaalsContact O-N 3.14Å; Q1109-S1113 PolarHBondContact O-OG 2.84Å
1110	V	90.2	Very high	88.5	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-45	175.3	173.2	0	0	0	0	110.2	L1098 L1106 L1112 S1113 I1114 I1222 I1235 V1238	L1098-V1110 HydrophobicContact CD2-CB 3.93Å; L1098-V1110 HydrophobicContact CD2-CG1 4.01Å; L1098-V1110 HydrophobicContact CD2-CG2 3.74Å; L1106-V1110 HydrophobicContact CD1-CG2 4.22Å; L1106-V1110 HydrophobicContact CG-CG2 4.38Å; L1106-V1110 WeakPolarHBondContact O-CG2 3.43Å; L1106-V1110 PolarHBondContact O-N 2.94Å; V1110-L1112 PolarHBondContact O-N 3.29Å; V1110-S1113 WeakPolarHBondContact O-CB 3.35Å; V1110-S1113 PolarHBondContact O-N 2.86Å; V1110-I1114 HydrophobicContact CG1-CD1 3.7Å; V1110-I1114 HydrophobicContact CG1-CG1 4.5Å; V1110-I1114 WeakPolarHBondContact O-CG1 3.06Å; V1110-I1114 PolarHBondContact O-N 3.07Å; V1110-I1114 VanDerWaalsContact O-N 3.13Å; V1110-I1222 HydrophobicContact CB-CD1 3.94Å; V1110-I1222 HydrophobicContact CG1-CD1 3.79Å; V1110-I1235 HydrophobicContact CG1-CG2 4.37Å; V1110-V1238 HydrophobicContact CG1-CG2 3.63Å
1111	K	89.4	Confident	88.3	Confident	56 Å²	56	51.5 Å²	51.5	24%	0.243	26%	0.264	C	S	.	.	H	α-helix	trans	-53.2	-50.7	173.8	171.2	174.9	174.8	173.1	0	112.2	A1107 R1108 S1113 I1114 E1115 V1211 I1213	A1107-K1111 VanDerWaalsContact O-CB 3.28Å; A1107-K1111 WeakPolarHBondContact O-CB 3.34Å; A1107-K1111 PolarHBondContact O-N 3.18Å; R1108-K1111 PolarHBondContact O-N 3.46Å; K1111-S1113 PolarHBondContact O-N 3.27Å; K1111-I1114 PolarHBondContact O-N 2.99Å; K1111-I1114 VanDerWaalsContact O-N 3.13Å; K1111-E1115 WeakPolarHBondContact CE-OE2 3.29Å; K1111-E1115 IonicContact NZ-OE2 2.87Å; K1111-E1115 WeakPolarHBondContact O-CB 3.42Å; K1111-E1115 PolarHBondContact O-N 3.22Å; K1111-V1211 HydrophobicContact CB-CG1 4.18Å; K1111-V1211 HydrophobicContact CD-CG1 4.46Å; K1111-V1211 WeakPolarHBondContact CE-O 3.21Å; K1111-V1211 HydrophobicContact CG-CB 4.12Å; K1111-V1211 HydrophobicContact CG-CG1 3.84Å; K1111-V1211 PolarHBondContact NZ-O 3.42Å; K1111-I1213 HydrophobicContact CB-CD1 4.1Å; K1111-I1213 HydrophobicContact CB-CG1 4.41Å; K1111-I1213 HydrophobicContact CD-CD1 3.84Å; K1111-I1213 HydrophobicContact CD-CG1 4.05Å
1112	L	86.7	Confident	88.3	Confident	55 Å²	55	50 Å²	50	29%	0.288	25%	0.254	S	S	.	.	H	α-helix	trans	-63.7	-23.6	180	-73.6	172	0	0	0	113.4	R1108 Q1109 V1110 R1149	R1108-L1112 WeakPolarHBondContact O-CB 3.43Å; R1108-L1112 VanDerWaalsContact O-CG 3.29Å; R1108-L1112 WeakPolarHBondContact O-CG 3.36Å; R1108-L1112 PolarHBondContact O-N 3Å; Q1109-L1112 PolarHBondContact O-N 3.25Å; V1110-L1112 PolarHBondContact O-N 3.29Å; L1112-R1149 HydrophobicContact CD2-CG 4.12Å
1113	S	88.4	Confident	88.2	Confident	40 Å²	40	44.7 Å²	44.7	28%	0.28	23%	0.233	S	C	.	.	H	α-helix	trans	-82.6	-25	177.8	-56	0	0	0	0	112.4	Q1109 V1110 K1111 G1204	Q1109-S1113 PolarHBondContact O-N 3.11Å; Q1109-S1113 VanDerWaalsContact O-N 3.14Å; Q1109-S1113 PolarHBondContact O-OG 2.84Å; V1110-S1113 WeakPolarHBondContact O-CB 3.35Å; V1110-S1113 PolarHBondContact O-N 2.86Å; K1111-S1113 PolarHBondContact O-N 3.27Å; S1113-G1204 WeakPolarHBondContact O-CA 3.48Å
1114	I	91	Very high	88.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-92.2	-46.5	179.6	-62	165.7	0	0	0	111.2	V1110 K1111 I1205 V1208 V1211 V1224 V1232 I1235	V1110-I1114 HydrophobicContact CG1-CD1 3.7Å; V1110-I1114 HydrophobicContact CG1-CG1 4.5Å; V1110-I1114 WeakPolarHBondContact O-CG1 3.06Å; V1110-I1114 PolarHBondContact O-N 3.07Å; V1110-I1114 VanDerWaalsContact O-N 3.13Å; K1111-I1114 PolarHBondContact O-N 2.99Å; K1111-I1114 VanDerWaalsContact O-N 3.13Å; I1114-I1205 HydrophobicContact CG2-CD1 4.37Å; I1114-I1205 PolarHBondContact O-N 2.84Å; I1114-V1208 HydrophobicContact CG2-CG1 4.26Å; I1114-V1208 HydrophobicContact CG2-CG2 4.2Å; I1114-V1211 HydrophobicContact CB-CG2 4.08Å; I1114-V1211 HydrophobicContact CG2-CG2 3.66Å; I1114-V1224 HydrophobicContact CD1-CG2 3.92Å; I1114-V1224 HydrophobicContact CG2-CB 4.44Å; I1114-V1224 HydrophobicContact CG2-CG1 3.67Å; I1114-V1224 HydrophobicContact CG2-CG2 3.87Å; I1114-V1232 HydrophobicContact CD1-CG1 4.16Å; I1114-V1232 HydrophobicContact CG2-CG2 4.32Å; I1114-I1235 HydrophobicContact CB-CD1 4.31Å; I1114-I1235 HydrophobicContact CD1-CD1 4.25Å; I1114-I1235 HydrophobicContact CG1-CD1 3.27Å
1115	E	88.8	Confident	88.2	Confident	57 Å²	57	49.4 Å²	49.4	27%	0.266	26%	0.255	S	S	.	.	S	Bend	trans	-65.6	123.5	-171.9	-172.7	170.8	-157.8	0	0	111.4	K1111 T1117 V1211	K1111-E1115 WeakPolarHBondContact CE-OE2 3.29Å; K1111-E1115 IonicContact NZ-OE2 2.87Å; K1111-E1115 WeakPolarHBondContact O-CB 3.42Å; K1111-E1115 PolarHBondContact O-N 3.22Å; E1115-T1117 PolarHBondContact O-N 3.14Å; E1115-V1211 HydrophobicContact CB-CB 4.33Å; E1115-V1211 HydrophobicContact CB-CG2 3.91Å
1116	P	88.5	Confident	88.2	Confident	22 Å²	22	47.6 Å²	47.6	14%	0.143	24%	0.239	C	C	.	.			trans	-69.7	120.1	-177.8	29.4	-35.4	0	0	0	110.7	I1201 V1208	P1116-I1201 HydrophobicContact CB-CD1 4.08Å; P1116-I1201 HydrophobicContact CB-CG1 4.38Å; P1116-I1201 HydrophobicContact CB-CG2 3.95Å; P1116-V1208 VanDerWaalsContact CG-O 3.26Å; P1116-V1208 WeakPolarHBondContact CG-O 3.34Å
1117	T	88.4	Confident	88.1	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	110.7	171.8	-65.3	0	0	0	0	109.1	E1115 D1121 I1122 R1149 I1151 V1202 K1203	E1115-T1117 PolarHBondContact O-N 3.14Å; T1117-D1121 HydrophobicContact CG2-CB 4.44Å; T1117-I1122 HydrophobicContact CG2-CG2 3.71Å; T1117-R1149 WeakPolarHBondContact OG1-CD 3.42Å; T1117-R1149 PolarHBondContact OG1-NH1 3.33Å; T1117-I1151 HydrophobicContact CG2-CD1 3.6Å; T1117-V1202 PolarHBondContact O-N 2.81Å; T1117-K1203 PolarHBondContact N-O 2.85Å
1118	R	88.8	Confident	88.1	Confident	125 Å²	125	53.8 Å²	53.8	47%	0.472	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	155.4	173	-63.5	-172.7	-170	-168.8	9.8	110	A1120 D1121 D1199 V1200	R1118-A1120 HydrophobicContact CB-CB 4.41Å; R1118-A1120 PolarHBondContact O-N 2.8Å; R1118-D1121 PolarHBondContact N-OD2 2.85Å; R1118-D1121 VanDerWaalsContact N-OD2 3.11Å; R1118-D1121 WeakPolarHBondContact O-CB 3.35Å; R1118-D1121 PolarHBondContact O-N 2.86Å; R1118-D1199 IonicContact CZ-OD1 2.62Å; R1118-D1199 IonicContact NH1-OD1 2.64Å; R1118-D1199 PolarHBondContact NH1-OD1 2.99Å; R1118-V1200 CarbonylContact C-O 3.58Å; R1118-V1200 WeakPolarHBondContact CA-O 3.29Å
1119	L	87.5	Confident	88	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-37.8	173.9	-172.1	62.4	0	0	0	111.2	D1121 I1122 S1123 I1139 L1141 V1156 I1160 V1197 E1198 V1200 V1202	L1119-D1121 PolarHBondContact O-N 2.83Å; L1119-I1122 HydrophobicContact CD1-CD1 4.17Å; L1119-I1122 HydrophobicContact CD1-CG1 4.15Å; L1119-I1122 CarbonylContact O-C 3.53Å; L1119-I1122 VanDerWaalsContact O-CG1 3.31Å; L1119-I1122 WeakPolarHBondContact O-CG1 3.41Å; L1119-I1122 PolarHBondContact O-N 3.06Å; L1119-I1122 VanDerWaalsContact O-N 3.07Å; L1119-S1123 WeakPolarHBondContact O-CB 3.24Å; L1119-S1123 PolarHBondContact O-N 3.43Å; L1119-S1123 PolarHBondContact O-OG 2.92Å; L1119-I1139 HydrophobicContact CD2-CD1 3.65Å; L1119-I1139 HydrophobicContact CD2-CG2 4.5Å; L1119-L1141 HydrophobicContact CD1-CD2 4.03Å; L1119-V1156 HydrophobicContact CD1-CG1 3.45Å; L1119-V1156 VanDerWaalsContact CD1-CG1 3.45Å; L1119-I1160 HydrophobicContact CD1-CD1 4.42Å; L1119-I1160 HydrophobicContact CD2-CD1 3.79Å; L1119-I1160 HydrophobicContact CD2-CG1 4.33Å; L1119-V1197 HydrophobicContact CD2-CG1 3.49Å; L1119-V1197 VanDerWaalsContact CD2-CG1 3.49Å; L1119-V1197 WeakPolarHBondContact CD2-O 3.47Å; L1119-E1198 PolarHBondContact N-O 2.93Å; L1119-V1200 PolarHBondContact N-O 2.82Å; L1119-V1202 HydrophobicContact CB-CG2 4.22Å; L1119-V1202 HydrophobicContact CD1-CG2 4.03Å
1120	A	86.9	Confident	87.9	Confident	40 Å²	40	46.5 Å²	46.5	33%	0.331	25%	0.252	S	S	.	.	H	α-helix	trans	-52.6	-35.7	173.7	0	0	0	0	0	113.6	R1118 I1122 S1123 E1198	R1118-A1120 HydrophobicContact CB-CB 4.41Å; R1118-A1120 PolarHBondContact O-N 2.8Å; A1120-I1122 VanDerWaalsContact C-N 3.26Å; A1120-I1122 PolarHBondContact O-N 3.12Å; A1120-S1123 WeakPolarHBondContact CA-OG 3.3Å; A1120-S1123 PolarHBondContact O-OG 2.76Å; A1120-E1198 HydrophobicContact CB-CB 4.2Å; A1120-E1198 PolarHBondContact N-O 3.41Å; A1120-E1198 VanDerWaalsContact N-O 3.14Å
1121	D	85.5	Confident	87.5	Confident	55 Å²	55	49.1 Å²	49.1	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-69.2	-28.5	-177.7	-60.5	-24	0	0	0	112.3	T1117 R1118 L1119 R1145 R1149	T1117-D1121 HydrophobicContact CG2-CB 4.44Å; R1118-D1121 PolarHBondContact N-OD2 2.85Å; R1118-D1121 VanDerWaalsContact N-OD2 3.11Å; R1118-D1121 WeakPolarHBondContact O-CB 3.35Å; R1118-D1121 PolarHBondContact O-N 2.86Å; L1119-D1121 PolarHBondContact O-N 2.83Å; D1121-R1145 WeakPolarHBondContact O-CD 3.44Å; D1121-R1145 PolarHBondContact O-NH1 3.05Å; D1121-R1149 IonicContact OD2-CZ 3.57Å; D1121-R1149 IonicContact OD2-NH1 3.54Å; D1121-R1149 PolarHBondContact OD2-NH1 3.41Å; D1121-R1149 IonicContact OD2-NH2 2.72Å
1122	I	87.8	Confident	86.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-111.7	-1.8	-173.9	63	169.2	0	0	0	113.3	T1117 L1119 A1120 L1141 D1142 R1145 M1146 I1151 V1156 V1202	T1117-I1122 HydrophobicContact CG2-CG2 3.71Å; L1119-I1122 HydrophobicContact CD1-CD1 4.17Å; L1119-I1122 HydrophobicContact CD1-CG1 4.15Å; L1119-I1122 CarbonylContact O-C 3.53Å; L1119-I1122 VanDerWaalsContact O-CG1 3.31Å; L1119-I1122 WeakPolarHBondContact O-CG1 3.41Å; L1119-I1122 PolarHBondContact O-N 3.06Å; L1119-I1122 VanDerWaalsContact O-N 3.07Å; A1120-I1122 VanDerWaalsContact C-N 3.26Å; A1120-I1122 PolarHBondContact O-N 3.12Å; I1122-L1141 CarbonylContact O-C 2.97Å; I1122-L1141 WeakPolarHBondContact O-CA 3.3Å; I1122-D1142 PolarHBondContact O-N 3.47Å; I1122-R1145 HydrophobicContact CG2-CB 4.46Å; I1122-M1146 HydrophobicContact CB-CG 4.22Å; I1122-M1146 HydrophobicContact CD1-CG 4.42Å; I1122-I1151 HydrophobicContact CD1-CG2 4.39Å; I1122-V1156 HydrophobicContact CD1-CG1 4.44Å; I1122-V1156 HydrophobicContact CD1-CG2 3.94Å; I1122-V1202 HydrophobicContact CD1-CB 4.4Å; I1122-V1202 HydrophobicContact CD1-CG1 4.21Å; I1122-V1202 HydrophobicContact CD1-CG2 4.07Å
1123	S	87.8	Confident	86.6	Confident	19 Å²	19	58.1 Å²	58.1	13%	0.133	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	137.4	174.9	58.5	0	0	0	0	112	L1119 A1120 K1140	L1119-S1123 WeakPolarHBondContact O-CB 3.24Å; L1119-S1123 PolarHBondContact O-N 3.43Å; L1119-S1123 PolarHBondContact O-OG 2.92Å; A1120-S1123 WeakPolarHBondContact CA-OG 3.3Å; A1120-S1123 PolarHBondContact O-OG 2.76Å; S1123-K1140 CarbonylContact C-O 3.56Å; S1123-K1140 WeakPolarHBondContact CA-O 3.29Å
1124	L	88.4	Confident	86.1	Confident	100 Å²	100	61.6 Å²	61.6	52%	0.524	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-43.8	170.1	-81.9	160.5	0	0	0	111.9	K1140 D1142	L1124-K1140 HydrophobicContact CB-CB 4.41Å; L1124-K1140 HydrophobicContact CB-CD 4.46Å; L1124-K1140 HydrophobicContact CB-CG 4.35Å; L1124-K1140 HydrophobicContact CD1-CD 4.32Å; L1124-K1140 HydrophobicContact CD1-CG 4.25Å; L1124-K1140 PolarHBondContact N-O 2.9Å; L1124-D1142 HydrophobicContact CD1-CB 4.22Å; L1124-D1142 HydrophobicContact CD2-CB 4.44Å; L1124-D1142 HydrophobicContact CG-CB 3.9Å
1125	S	87.9	Confident	85.8	Confident	58 Å²	58	63.4 Å²	63.4	41%	0.406	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	145.4	-176.4	61.5	0	0	0	0	110.7	K1140	S1125-K1140 PolarHBondContact O-N 2.69Å; S1125-K1140 WeakPolarHBondContact OG-CB 3.42Å
1126	L	88.2	Confident	85.7	Confident	45 Å²	45	62.8 Å²	62.8	24%	0.236	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.4	172.6	-174.1	151.9	0	0	0	108.2	V1137 I1139 V1194 V1197 E1198	L1126-V1137 HydrophobicContact CD1-CG1 3.96Å; L1126-V1137 HydrophobicContact CD2-CG1 3.58Å; L1126-V1137 HydrophobicContact CG-CG1 3.56Å; L1126-I1139 HydrophobicContact CD1-CG1 4.33Å; L1126-I1139 HydrophobicContact CG-CG1 4.36Å; L1126-V1194 HydrophobicContact CD2-CG1 3.88Å; L1126-V1194 HydrophobicContact CD2-CG2 4.24Å; L1126-V1197 HydrophobicContact CD1-CG1 4.48Å; L1126-E1198 HydrophobicContact CD1-CG 4.09Å
1127	S	87.6	Confident	85.6	Confident	52 Å²	52	61.8 Å²	61.8	36%	0.364	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132	-179.9	55.1	0	0	0	0	110.9	A1138	S1127-A1138 PolarHBondContact N-O 2.97Å; S1127-A1138 PolarHBondContact O-N 2.88Å; S1127-A1138 PolarHBondContact OG-O 3.4Å
1128	Q	87.4	Confident	85.7	Confident	107 Å²	107	61.9 Å²	61.9	50%	0.5	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.1	173.2	-60.4	176.1	42.1	0	0	108.4	V1194	Q1128-V1194 HydrophobicContact CG-CG2 3.74Å
1129	C	85.3	Confident	85.7	Confident	29 Å²	29	56 Å²	56	20%	0.196	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	112.3	-178	-62.1	0	0	0	0	108.9	Y1136	C1129-Y1136 HydrophobicContact CB-CD1 4.21Å; C1129-Y1136 HydrophobicContact CB-CD2 3.84Å; C1129-Y1136 HydrophobicContact CB-CE1 3.83Å; C1129-Y1136 HydrophobicContact CB-CE2 3.42Å; C1129-Y1136 VanDerWaalsContact CB-CE2 3.42Å; C1129-Y1136 HydrophobicContact CB-CG 4.22Å; C1129-Y1136 VanDerWaalsContact CB-CZ 3.42Å; C1129-Y1136 PolarHBondContact N-O 3.44Å; C1129-Y1136 PolarHBondContact O-N 2.95Å
1130	L	84.6	Confident	85.9	Confident	109 Å²	109	59.7 Å²	59.7	57%	0.571	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	97.7	173	-65	132.4	0	0	0	107.1	V1135 L1187 L1190	L1130-V1135 HydrophobicContact CD2-CG1 3.99Å; L1130-V1135 HydrophobicContact CD2-CG2 4.02Å; L1130-L1187 HydrophobicContact CD2-CD2 3.88Å; L1130-L1190 HydrophobicContact CD2-CD2 4.49Å
1131	T	81.9	Confident	86	Confident	56 Å²	56	57.9 Å²	57.9	34%	0.344	31%	0.309	S	S	.	.			trans	-99.5	160.6	170.2	70.2	0	0	0	0	109.6	E1133 Y1134 Y1136	T1131-E1133 PolarHBondContact O-N 3.5Å; T1131-E1133 VanDerWaalsContact O-N 3.12Å; T1131-Y1134 PolarHBondContact N-O 2.84Å; T1131-Y1134 PolarHBondContact O-N 3.28Å; T1131-Y1134 PolarHBondContact OG1-N 3.31Å; T1131-Y1134 PolarHBondContact OG1-O 3.38Å; T1131-Y1136 HydrophobicContact CG2-CE1 4.16Å
1132	P	78	Confident	86.2	Confident	144 Å²	144	56.6 Å²	56.6	94%	0.935	30%	0.303	S	S	*	.	S	Bend	trans	-56.5	-27.9	176.4	-24.8	34.2	0	0	0	113.3
1133	E	79	Confident	86.1	Confident	156 Å²	156	62.4 Å²	62.4	73%	0.729	33%	0.328	S	S	*	.	S	Bend	trans	-95.8	-32.7	-176.5	-61.9	-178.1	176.2	0	0	113.5	T1131	T1131-E1133 PolarHBondContact O-N 3.5Å; T1131-E1133 VanDerWaalsContact O-N 3.12Å
1134	Y	79.4	Confident	86	Confident	113 Å²	113	69.2 Å²	69.2	44%	0.443	36%	0.355	S	S	.	.			trans	-146.7	142.8	-174.2	-59	-77.2	0	0	0	112.5	T1131 Y1183	T1131-Y1134 PolarHBondContact N-O 2.84Å; T1131-Y1134 PolarHBondContact O-N 3.28Å; T1131-Y1134 PolarHBondContact OG1-N 3.31Å; T1131-Y1134 PolarHBondContact OG1-O 3.38Å; Y1134-Y1183 HydrophobicContact CD1-CD1 4.45Å; Y1134-Y1183 HydrophobicContact CD1-CE1 4.23Å; Y1134-Y1183 HydrophobicContact CG-CE1 4.16Å
1135	V	83.6	Confident	85.8	Confident	38 Å²	38	70.3 Å²	70.3	23%	0.23	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.6	165	-177.2	0	0	0	0	107.7	L1130 P1184 L1187 L1190	L1130-V1135 HydrophobicContact CD2-CG1 3.99Å; L1130-V1135 HydrophobicContact CD2-CG2 4.02Å; V1135-P1184 HydrophobicContact CG1-CG 4.29Å; V1135-P1184 WeakPolarHBondContact O-CD 3.31Å; V1135-L1187 HydrophobicContact CG2-CD1 4.49Å; V1135-L1187 HydrophobicContact CG2-CG 4.42Å; V1135-L1190 HydrophobicContact CG1-CD1 4.07Å; V1135-L1190 HydrophobicContact CG1-CD2 3.8Å; V1135-L1190 HydrophobicContact CG1-CG 4.39Å
1136	Y	87.3	Confident	85.7	Confident	45 Å²	45	67.9 Å²	67.9	18%	0.176	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	158.3	178.7	61.6	-87.2	0	0	0	112.5	C1129 T1131 A1138 F1181 V1182 Y1183	C1129-Y1136 HydrophobicContact CB-CD1 4.21Å; C1129-Y1136 HydrophobicContact CB-CD2 3.84Å; C1129-Y1136 HydrophobicContact CB-CE1 3.83Å; C1129-Y1136 HydrophobicContact CB-CE2 3.42Å; C1129-Y1136 VanDerWaalsContact CB-CE2 3.42Å; C1129-Y1136 HydrophobicContact CB-CG 4.22Å; C1129-Y1136 VanDerWaalsContact CB-CZ 3.42Å; C1129-Y1136 PolarHBondContact N-O 3.44Å; C1129-Y1136 PolarHBondContact O-N 2.95Å; T1131-Y1136 HydrophobicContact CG2-CE1 4.16Å; Y1136-A1138 HydrophobicContact CD2-CB 4.22Å; Y1136-A1138 HydrophobicContact CE2-CB 4.01Å; Y1136-F1181 HydrophobicContact CD2-CB 4.19Å; Y1136-F1181 AromaticContact CD2-CD1 3.64Å; Y1136-F1181 HydrophobicContact CD2-CD1 3.64Å; Y1136-F1181 HydrophobicContact CD2-CG 4.36Å; Y1136-F1181 AromaticContact CE2-CD1 3.47Å; Y1136-F1181 HydrophobicContact CE2-CD1 3.47Å; Y1136-F1181 VanDerWaalsContact CE2-CD1 3.47Å; Y1136-F1181 AromaticContact CE2-CE1 3.94Å; Y1136-F1181 HydrophobicContact CE2-CE1 3.94Å; Y1136-F1181 HydrophobicContact CE2-CG 4.47Å; Y1136-V1182 CarbonylContact C-O 3.14Å; Y1136-V1182 WeakPolarHBondContact CA-O 3.36Å; Y1136-Y1183 AromaticContact CD1-CE1 3.88Å; Y1136-Y1183 HydrophobicContact CD1-CE1 3.88Å; Y1136-Y1183 HydrophobicContact CG-CD1 4.41Å; Y1136-Y1183 AromaticContact CG-CE1 3.96Å; Y1136-Y1183 HydrophobicContact CG-CE1 3.96Å
1137	V	87.2	Confident	85.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.5	170.6	-177.7	0	0	0	0	108	L1126 I1139 F1181 V1182 L1190 V1193 V1194	L1126-V1137 HydrophobicContact CD1-CG1 3.96Å; L1126-V1137 HydrophobicContact CD2-CG1 3.58Å; L1126-V1137 HydrophobicContact CG-CG1 3.56Å; V1137-I1139 HydrophobicContact CG1-CG1 4.09Å; V1137-F1181 WeakPolarHBondContact O-CA 3.1Å; V1137-V1182 HydrophobicContact CB-CB 4.32Å; V1137-V1182 PolarHBondContact N-O 2.65Å; V1137-V1182 PolarHBondContact O-N 2.84Å; V1137-L1190 HydrophobicContact CG2-CD1 3.48Å; V1137-L1190 VanDerWaalsContact CG2-CD1 3.48Å; V1137-V1193 HydrophobicContact CG2-CG1 4.27Å; V1137-V1194 HydrophobicContact CG2-CG2 3.8Å
1138	A	89.1	Confident	85.1	Confident	6 Å²	6	78.2 Å²	78.2	5%	0.05	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125.3	173.2	0	0	0	0	0	110.2	S1127 Y1136 I1180 F1181	S1127-A1138 PolarHBondContact N-O 2.97Å; S1127-A1138 PolarHBondContact O-N 2.88Å; S1127-A1138 PolarHBondContact OG-O 3.4Å; Y1136-A1138 HydrophobicContact CD2-CB 4.22Å; Y1136-A1138 HydrophobicContact CE2-CB 4.01Å; A1138-I1180 CarbonylContact C-O 3.43Å; A1138-I1180 WeakPolarHBondContact CA-O 3.38Å; A1138-F1181 HydrophobicContact CB-CD1 3.76Å; A1138-F1181 HydrophobicContact CB-CE1 3.84Å
1139	I	89.9	Confident	84.8	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.005	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117.3	-177.8	-51	174.4	0	0	0	107.2	L1119 L1126 V1137 L1141 I1160 Y1179 I1180 V1182 V1197	L1119-I1139 HydrophobicContact CD2-CD1 3.65Å; L1119-I1139 HydrophobicContact CD2-CG2 4.5Å; L1126-I1139 HydrophobicContact CD1-CG1 4.33Å; L1126-I1139 HydrophobicContact CG-CG1 4.36Å; V1137-I1139 HydrophobicContact CG1-CG1 4.09Å; I1139-L1141 HydrophobicContact CG2-CD2 4.11Å; I1139-I1160 HydrophobicContact CD1-CD1 4.49Å; I1139-Y1179 WeakPolarHBondContact O-CA 3.5Å; I1139-I1180 HydrophobicContact CB-CB 4.4Å; I1139-I1180 PolarHBondContact N-O 3.18Å; I1139-I1180 PolarHBondContact O-N 3.08Å; I1139-V1182 HydrophobicContact CD1-CG2 4.02Å; I1139-V1197 HydrophobicContact CD1-CG1 3.45Å; I1139-V1197 VanDerWaalsContact CD1-CG1 3.45Å
1140	K	91.2	Very high	84.6	Confident	80 Å²	80	77 Å²	77	35%	0.348	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.6	175	-171	176.6	-176.6	174.3	0	109	S1123 L1124 S1125 Y1179	S1123-K1140 CarbonylContact C-O 3.56Å; S1123-K1140 WeakPolarHBondContact CA-O 3.29Å; L1124-K1140 HydrophobicContact CB-CB 4.41Å; L1124-K1140 HydrophobicContact CB-CD 4.46Å; L1124-K1140 HydrophobicContact CB-CG 4.35Å; L1124-K1140 HydrophobicContact CD1-CD 4.32Å; L1124-K1140 HydrophobicContact CD1-CG 4.25Å; L1124-K1140 PolarHBondContact N-O 2.9Å; S1125-K1140 PolarHBondContact O-N 2.69Å; S1125-K1140 WeakPolarHBondContact OG-CB 3.42Å; K1140-Y1179 HydrophobicContact CB-CD1 4.01Å; K1140-Y1179 HydrophobicContact CB-CE1 3.63Å; K1140-Y1179 HydrophobicContact CD-CE1 3.94Å; K1140-Y1179 WeakPolarHBondContact CE-OH 3.1Å; K1140-Y1179 HydrophobicContact CG-CD1 4.26Å; K1140-Y1179 HydrophobicContact CG-CE1 3.65Å
1141	L	89.4	Confident	84.6	Confident	3 Å²	3	72 Å²	72	2%	0.016	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	147.1	-178.6	-54.9	175.9	0	0	0	111.9	L1119 I1122 I1139 K1143 M1146 T1153 V1156 D1178 I1180	L1119-L1141 HydrophobicContact CD1-CD2 4.03Å; I1122-L1141 CarbonylContact O-C 2.97Å; I1122-L1141 WeakPolarHBondContact O-CA 3.3Å; I1139-L1141 HydrophobicContact CG2-CD2 4.11Å; L1141-K1143 PolarHBondContact O-N 3.25Å; L1141-M1146 HydrophobicContact CB-SD 3.49Å; L1141-M1146 WeakPolarHBondContact CB-SD 3.4Å; L1141-M1146 HydrophobicContact CD1-CE 4.01Å; L1141-M1146 HydrophobicContact CD1-SD 3.61Å; L1141-M1146 HydrophobicContact CG-SD 4.13Å; L1141-T1153 HydrophobicContact CD1-CG2 3.92Å; L1141-V1156 HydrophobicContact CD1-CG2 4.29Å; L1141-D1178 PolarHBondContact N-O 3.42Å; L1141-I1180 HydrophobicContact CD1-CD1 3.8Å; L1141-I1180 HydrophobicContact CD1-CG1 4.05Å; L1141-I1180 HydrophobicContact CD2-CD1 4.34Å; L1141-I1180 HydrophobicContact CG-CD1 4.43Å
1142	D	89.6	Confident	84.8	Confident	28 Å²	28	72.8 Å²	72.8	15%	0.15	35%	0.349	C	S	.	.			trans	-87	101.2	172.7	-170.2	-21.4	0	0	0	110.3	I1122 L1124 K1144 R1145 M1146	I1122-D1142 PolarHBondContact O-N 3.47Å; L1124-D1142 HydrophobicContact CD1-CB 4.22Å; L1124-D1142 HydrophobicContact CD2-CB 4.44Å; L1124-D1142 HydrophobicContact CG-CB 3.9Å; D1142-K1144 VanDerWaalsContact C-N 3.25Å; D1142-K1144 PolarHBondContact O-N 3.47Å; D1142-K1144 WeakPolarHBondContact OD1-CB 3.31Å; D1142-K1144 PolarHBondContact OD1-N 3.38Å; D1142-R1145 HydrophobicContact CB-CB 4.05Å; D1142-R1145 HydrophobicContact CB-CG 4.04Å; D1142-R1145 PolarHBondContact O-N 2.98Å; D1142-R1145 VanDerWaalsContact O-N 3.13Å; D1142-R1145 PolarHBondContact OD1-N 3.38Å; D1142-R1145 WeakPolarHBondContact OD2-CD 3.19Å; D1142-R1145 VanDerWaalsContact OD2-CG 3.31Å; D1142-R1145 WeakPolarHBondContact OD2-CG 3.42Å; D1142-R1145 IonicContact OD2-NE 3.66Å; D1142-R1145 PolarHBondContact OD2-NE 2.78Å; D1142-R1145 VanDerWaalsContact OD2-NE 3.11Å; D1142-M1146 WeakPolarHBondContact O-CG 3.43Å; D1142-M1146 PolarHBondContact O-N 3.37Å
1143	K	84.4	Confident	85.2	Confident	122 Å²	122	66.9 Å²	66.9	53%	0.53	31%	0.311	S	S	.	.	H	α-helix	trans	-54.6	-38.9	179	-170.1	175	-180	179.7	0	113	L1141 R1145 M1146 D1147	L1141-K1143 PolarHBondContact O-N 3.25Å; K1143-R1145 PolarHBondContact O-N 2.95Å; K1143-M1146 PolarHBondContact O-N 3.03Å; K1143-D1147 WeakPolarHBondContact O-CB 3.44Å; K1143-D1147 PolarHBondContact O-N 3.23Å
1144	K	86.2	Confident	85.6	Confident	162 Å²	162	62 Å²	62	70%	0.704	29%	0.292	S	S	*	.	H	α-helix	trans	-66.7	-38.8	-179.2	-68.1	-178.2	179.5	178.3	0	111.7	D1142 R1148	D1142-K1144 VanDerWaalsContact C-N 3.25Å; D1142-K1144 PolarHBondContact O-N 3.47Å; D1142-K1144 WeakPolarHBondContact OD1-CB 3.31Å; D1142-K1144 PolarHBondContact OD1-N 3.38Å; K1144-R1148 WeakPolarHBondContact O-CG 3.38Å; K1144-R1148 PolarHBondContact O-N 3.1Å
1145	R	84.8	Confident	85.9	Confident	122 Å²	122	61.2 Å²	61.2	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-72.3	-37.8	177	-66.3	-179	-168.2	-167.5	-2.8	111.5	D1121 I1122 D1142 K1143 R1149	D1121-R1145 WeakPolarHBondContact O-CD 3.44Å; D1121-R1145 PolarHBondContact O-NH1 3.05Å; I1122-R1145 HydrophobicContact CG2-CB 4.46Å; D1142-R1145 HydrophobicContact CB-CB 4.05Å; D1142-R1145 HydrophobicContact CB-CG 4.04Å; D1142-R1145 PolarHBondContact O-N 2.98Å; D1142-R1145 VanDerWaalsContact O-N 3.13Å; D1142-R1145 PolarHBondContact OD1-N 3.38Å; D1142-R1145 WeakPolarHBondContact OD2-CD 3.19Å; D1142-R1145 VanDerWaalsContact OD2-CG 3.31Å; D1142-R1145 WeakPolarHBondContact OD2-CG 3.42Å; D1142-R1145 IonicContact OD2-NE 3.66Å; D1142-R1145 PolarHBondContact OD2-NE 2.78Å; D1142-R1145 VanDerWaalsContact OD2-NE 3.11Å; K1143-R1145 PolarHBondContact O-N 2.95Å; R1145-R1149 WeakPolarHBondContact O-CG 3.29Å; R1145-R1149 PolarHBondContact O-N 2.96Å
1146	M	85.3	Confident	86.1	Confident	7 Å²	7	59.4 Å²	59.4	3%	0.034	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-47.4	175.3	-73.6	179.9	65.7	0	0	112.2	I1122 L1141 D1142 K1143 R1148 R1149 G1150 I1151 V1156	I1122-M1146 HydrophobicContact CB-CG 4.22Å; I1122-M1146 HydrophobicContact CD1-CG 4.42Å; L1141-M1146 HydrophobicContact CB-SD 3.49Å; L1141-M1146 WeakPolarHBondContact CB-SD 3.4Å; L1141-M1146 HydrophobicContact CD1-CE 4.01Å; L1141-M1146 HydrophobicContact CD1-SD 3.61Å; L1141-M1146 HydrophobicContact CG-SD 4.13Å; D1142-M1146 WeakPolarHBondContact O-CG 3.43Å; D1142-M1146 PolarHBondContact O-N 3.37Å; K1143-M1146 PolarHBondContact O-N 3.03Å; M1146-R1148 PolarHBondContact O-N 3.48Å; M1146-R1149 CarbonylContact O-C 3.56Å; M1146-R1149 PolarHBondContact O-N 3.48Å; M1146-R1149 VanDerWaalsContact O-N 3.11Å; M1146-G1150 PolarHBondContact O-N 2.86Å; M1146-I1151 HydrophobicContact CE-CG2 4.29Å; M1146-I1151 VanDerWaalsContact CE-O 3.31Å; M1146-I1151 WeakPolarHBondContact CE-O 3.04Å; M1146-I1151 PolarHBondContact O-N 3.35Å; M1146-V1156 HydrophobicContact CE-CG2 4.17Å
1147	D	83.2	Confident	86	Confident	107 Å²	107	57.6 Å²	57.6	57%	0.572	28%	0.276	S	S	*	.	H	α-helix	trans	-60.8	-44.1	-179.8	-70.3	-20.1	0	0	0	111.2	K1143 R1149 G1150	K1143-D1147 WeakPolarHBondContact O-CB 3.44Å; K1143-D1147 PolarHBondContact O-N 3.23Å; D1147-R1149 PolarHBondContact O-N 3.18Å; D1147-G1150 PolarHBondContact O-N 2.8Å; D1147-G1150 VanDerWaalsContact O-N 3.14Å
1148	R	81.2	Confident	86	Confident	207 Å²	207	61.6 Å²	61.6	78%	0.781	30%	0.3	S	S	*	.	H	α-helix	trans	-61.7	-28.7	176.6	-73.7	177.1	-178.3	-175.2	0.3	113.8	K1144 M1146	K1144-R1148 WeakPolarHBondContact O-CG 3.38Å; K1144-R1148 PolarHBondContact O-N 3.1Å; M1146-R1148 PolarHBondContact O-N 3.48Å
1149	R	79.5	Confident	85.8	Confident	68 Å²	68	62 Å²	62	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-98.2	-2.7	179.7	-63	-172.8	-179	-160.7	6.7	112.6	L1112 T1117 D1121 R1145 M1146 D1147 I1151 K1203	L1112-R1149 HydrophobicContact CD2-CG 4.12Å; T1117-R1149 WeakPolarHBondContact OG1-CD 3.42Å; T1117-R1149 PolarHBondContact OG1-NH1 3.33Å; D1121-R1149 IonicContact OD2-CZ 3.57Å; D1121-R1149 IonicContact OD2-NH1 3.54Å; D1121-R1149 PolarHBondContact OD2-NH1 3.41Å; D1121-R1149 IonicContact OD2-NH2 2.72Å; R1145-R1149 WeakPolarHBondContact O-CG 3.29Å; R1145-R1149 PolarHBondContact O-N 2.96Å; M1146-R1149 CarbonylContact O-C 3.56Å; M1146-R1149 PolarHBondContact O-N 3.48Å; M1146-R1149 VanDerWaalsContact O-N 3.11Å; D1147-R1149 PolarHBondContact O-N 3.18Å; R1149-I1151 HydrophobicContact CB-CD1 3.82Å; R1149-I1151 HydrophobicContact CB-CG1 4.03Å; R1149-K1203 PolarHBondContact O-NZ 3.38Å
1150	G	81.2	Confident	85.6	Confident	43 Å²	43	61.9 Å²	61.9	44%	0.443	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	49.4	-176.4	0	0	0	0	0	112.3	M1146 D1147 K1203	M1146-G1150 PolarHBondContact O-N 2.86Å; D1147-G1150 PolarHBondContact O-N 2.8Å; D1147-G1150 VanDerWaalsContact O-N 3.14Å; G1150-K1203 PolarHBondContact O-NZ 3.36Å
1151	I	85.3	Confident	85.2	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	31%	0.306	C	S	.	.			trans	-114.1	134.7	179.5	-62.2	173.1	0	0	0	108.7	T1117 I1122 M1146 R1149 V1156 V1202 K1203	T1117-I1151 HydrophobicContact CG2-CD1 3.6Å; I1122-I1151 HydrophobicContact CD1-CG2 4.39Å; M1146-I1151 HydrophobicContact CE-CG2 4.29Å; M1146-I1151 VanDerWaalsContact CE-O 3.31Å; M1146-I1151 WeakPolarHBondContact CE-O 3.04Å; M1146-I1151 PolarHBondContact O-N 3.35Å; R1149-I1151 HydrophobicContact CB-CD1 3.82Å; R1149-I1151 HydrophobicContact CB-CG1 4.03Å; I1151-V1156 HydrophobicContact CG2-CG2 3.55Å; I1151-V1202 HydrophobicContact CD1-CG1 4.31Å; I1151-V1202 HydrophobicContact CG2-CG1 3.7Å; I1151-K1203 HydrophobicContact CD1-CB 3.95Å; I1151-K1203 HydrophobicContact CD1-CD 4.25Å; I1151-K1203 HydrophobicContact CG1-CB 4.12Å; I1151-K1203 HydrophobicContact CG1-CD 3.65Å
1152	T	87.2	Confident	84.9	Confident	72 Å²	72	67 Å²	67	44%	0.442	34%	0.335	S	S	.	.			trans	-108.1	151.4	176.9	65	0	0	0	0	112	P1154 Q1155 V1156	T1152-P1154 VanDerWaalsContact C-CD 3.43Å; T1152-P1154 VanDerWaalsContact C-N 3.34Å; T1152-Q1155 WeakPolarHBondContact O-CB 3.34Å; T1152-Q1155 PolarHBondContact O-N 3.43Å; T1152-Q1155 VanDerWaalsContact OG1-CG 3.3Å; T1152-Q1155 WeakPolarHBondContact OG1-CG 3.14Å; T1152-Q1155 PolarHBondContact OG1-OE1 2.91Å; T1152-V1156 WeakPolarHBondContact O-CG2 3.25Å; T1152-V1156 PolarHBondContact O-N 3.3Å
1153	T	85.5	Confident	84.3	Confident	21 Å²	21	68.1 Å²	68.1	13%	0.129	34%	0.343	C	S	.	.	H	α-helix	trans	-53.6	-41.5	180	-44.8	0	0	0	0	113.6	L1141 Q1155 V1156 A1157 Y1175 K1177 I1180	L1141-T1153 HydrophobicContact CD1-CG2 3.92Å; T1153-Q1155 VanDerWaalsContact C-N 3.33Å; T1153-Q1155 PolarHBondContact O-N 3.45Å; T1153-V1156 PolarHBondContact O-N 2.75Å; T1153-A1157 PolarHBondContact O-N 2.86Å; T1153-Y1175 HydrophobicContact CG2-CD2 4.16Å; T1153-Y1175 HydrophobicContact CG2-CG 4.35Å; T1153-K1177 WeakPolarHBondContact CB-O 3.42Å; T1153-K1177 VanDerWaalsContact CG2-O 3.28Å; T1153-K1177 WeakPolarHBondContact CG2-O 3.17Å; T1153-K1177 PolarHBondContact OG1-O 3.26Å; T1153-I1180 HydrophobicContact CG2-CG1 4.14Å
1154	P	87.6	Confident	83.6	Confident	54 Å²	54	71.9 Å²	71.9	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-34.5	176	-22.4	33.9	0	0	0	113.8	T1152 A1157 T1158 Y1175	T1152-P1154 VanDerWaalsContact C-CD 3.43Å; T1152-P1154 VanDerWaalsContact C-N 3.34Å; P1154-A1157 PolarHBondContact O-N 3.46Å; P1154-T1158 WeakPolarHBondContact O-CB 3.28Å; P1154-T1158 PolarHBondContact O-N 3.32Å; P1154-T1158 PolarHBondContact O-OG1 2.97Å; P1154-Y1175 HydrophobicContact CB-CE1 4.45Å; P1154-Y1175 HydrophobicContact CB-CE2 4.3Å; P1154-Y1175 HydrophobicContact CG-CE2 3.84Å
1155	Q	85.6	Confident	82.8	Confident	96 Å²	96	64.7 Å²	64.7	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-43	175.9	-72.6	170.6	-16.2	0	0	110.7	T1152 T1153 T1158 A1159	T1152-Q1155 WeakPolarHBondContact O-CB 3.34Å; T1152-Q1155 PolarHBondContact O-N 3.43Å; T1152-Q1155 VanDerWaalsContact OG1-CG 3.3Å; T1152-Q1155 WeakPolarHBondContact OG1-CG 3.14Å; T1152-Q1155 PolarHBondContact OG1-OE1 2.91Å; T1153-Q1155 VanDerWaalsContact C-N 3.33Å; T1153-Q1155 PolarHBondContact O-N 3.45Å; Q1155-T1158 PolarHBondContact O-N 2.8Å; Q1155-A1159 WeakPolarHBondContact O-CB 3.3Å; Q1155-A1159 PolarHBondContact O-N 2.78Å
1156	V	86.7	Confident	81.8	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-45.9	178.2	-173.1	0	0	0	0	110.8	L1119 I1122 L1141 M1146 I1151 T1152 T1153 T1158 A1159 I1160 I1180 V1202	L1119-V1156 HydrophobicContact CD1-CG1 3.45Å; L1119-V1156 VanDerWaalsContact CD1-CG1 3.45Å; I1122-V1156 HydrophobicContact CD1-CG1 4.44Å; I1122-V1156 HydrophobicContact CD1-CG2 3.94Å; L1141-V1156 HydrophobicContact CD1-CG2 4.29Å; M1146-V1156 HydrophobicContact CE-CG2 4.17Å; I1151-V1156 HydrophobicContact CG2-CG2 3.55Å; T1152-V1156 WeakPolarHBondContact O-CG2 3.25Å; T1152-V1156 PolarHBondContact O-N 3.3Å; T1153-V1156 PolarHBondContact O-N 2.75Å; V1156-T1158 VanDerWaalsContact C-N 3.29Å; V1156-T1158 PolarHBondContact O-N 3.4Å; V1156-A1159 PolarHBondContact O-N 2.79Å; V1156-I1160 HydrophobicContact CG1-CD1 4.05Å; V1156-I1160 WeakPolarHBondContact O-CG1 3.43Å; V1156-I1160 PolarHBondContact O-N 3.1Å; V1156-I1180 HydrophobicContact CB-CD1 3.51Å; V1156-I1180 HydrophobicContact CG1-CD1 3.17Å; V1156-V1202 HydrophobicContact CB-CG1 4.15Å; V1156-V1202 HydrophobicContact CG1-CG1 4.29Å; V1156-V1202 HydrophobicContact CG1-CG2 4.03Å; V1156-V1202 HydrophobicContact CG2-CG1 3.69Å
1157	A	86	Confident	80.6	Confident	6 Å²	6	77 Å²	77	5%	0.05	39%	0.385	C	S	.	.	H	α-helix	trans	-60.5	-40.9	177.4	0	0	0	0	0	111.9	T1153 P1154 I1160 Q1161 V1173 Y1175	T1153-A1157 PolarHBondContact O-N 2.86Å; P1154-A1157 PolarHBondContact O-N 3.46Å; A1157-I1160 PolarHBondContact O-N 3.23Å; A1157-Q1161 WeakPolarHBondContact O-CB 3.35Å; A1157-Q1161 PolarHBondContact O-N 2.94Å; A1157-V1173 HydrophobicContact CB-CG1 4.09Å; A1157-Y1175 HydrophobicContact CB-CD1 3.51Å; A1157-Y1175 HydrophobicContact CB-CE1 4.25Å; A1157-Y1175 HydrophobicContact CB-CG 4.11Å
1158	T	86.5	Confident	79.7	Confident	84 Å²	84	73.5 Å²	73.5	52%	0.515	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-42	177.2	-54.1	0	0	0	0	111.6	P1154 Q1155 V1156 I1160 Q1161 T1162	P1154-T1158 WeakPolarHBondContact O-CB 3.28Å; P1154-T1158 PolarHBondContact O-N 3.32Å; P1154-T1158 PolarHBondContact O-OG1 2.97Å; Q1155-T1158 PolarHBondContact O-N 2.8Å; V1156-T1158 VanDerWaalsContact C-N 3.29Å; V1156-T1158 PolarHBondContact O-N 3.4Å; T1158-I1160 VanDerWaalsContact C-N 3.35Å; T1158-I1160 PolarHBondContact O-N 3.26Å; T1158-Q1161 PolarHBondContact O-N 3.29Å; T1158-T1162 HydrophobicContact CG2-CG2 4.33Å; T1158-T1162 WeakPolarHBondContact O-CB 3.4Å; T1158-T1162 WeakPolarHBondContact O-CG2 3.36Å; T1158-T1162 PolarHBondContact O-N 3.47Å; T1158-T1162 PolarHBondContact O-OG1 3.13Å
1159	A	85.7	Confident	78.9	Confident	14 Å²	14	71.7 Å²	71.7	12%	0.116	37%	0.366	C	S	.	.	H	α-helix	trans	-60.9	-42.8	176.5	0	0	0	0	0	111.5	Q1155 V1156 T1162 T1163	Q1155-A1159 WeakPolarHBondContact O-CB 3.3Å; Q1155-A1159 PolarHBondContact O-N 2.78Å; V1156-A1159 PolarHBondContact O-N 2.79Å; A1159-T1162 PolarHBondContact O-OG1 3.12Å; A1159-T1163 WeakPolarHBondContact O-CB 3.47Å; A1159-T1163 PolarHBondContact O-N 2.81Å; A1159-T1163 VanDerWaalsContact O-N 3.1Å; A1159-T1163 PolarHBondContact O-OG1 3.24Å
1160	I	85.2	Confident	78.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-44.3	177.2	-62.6	164.1	0	0	0	110.9	L1119 I1139 V1156 A1157 T1158 T1162 T1163 L1170 V1173 I1180 V1182 V1200	L1119-I1160 HydrophobicContact CD1-CD1 4.42Å; L1119-I1160 HydrophobicContact CD2-CD1 3.79Å; L1119-I1160 HydrophobicContact CD2-CG1 4.33Å; I1139-I1160 HydrophobicContact CD1-CD1 4.49Å; V1156-I1160 HydrophobicContact CG1-CD1 4.05Å; V1156-I1160 WeakPolarHBondContact O-CG1 3.43Å; V1156-I1160 PolarHBondContact O-N 3.1Å; A1157-I1160 PolarHBondContact O-N 3.23Å; T1158-I1160 VanDerWaalsContact C-N 3.35Å; T1158-I1160 PolarHBondContact O-N 3.26Å; I1160-T1162 VanDerWaalsContact C-N 3.31Å; I1160-T1162 PolarHBondContact O-N 3.47Å; I1160-T1163 PolarHBondContact O-N 2.82Å; I1160-L1170 HydrophobicContact CG2-CD1 4.03Å; I1160-V1173 HydrophobicContact CB-CG2 4.45Å; I1160-V1173 HydrophobicContact CG2-CG2 3.87Å; I1160-I1180 HydrophobicContact CD1-CD1 4.08Å; I1160-I1180 HydrophobicContact CD1-CG2 3.96Å; I1160-V1182 HydrophobicContact CD1-CG2 4.42Å; I1160-V1182 HydrophobicContact CG2-CG1 4.41Å; I1160-V1182 HydrophobicContact CG2-CG2 3.97Å; I1160-V1200 HydrophobicContact CG1-CG1 4.21Å
1161	Q	83.6	Confident	78.4	Confident	89 Å²	89	70.9 Å²	70.9	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-34.4	-179.4	-173.6	66.1	42.2	0	0	112.8	A1157 T1158 V1173	A1157-Q1161 WeakPolarHBondContact O-CB 3.35Å; A1157-Q1161 PolarHBondContact O-N 2.94Å; T1158-Q1161 PolarHBondContact O-N 3.29Å; Q1161-V1173 HydrophobicContact CB-CB 4.44Å; Q1161-V1173 HydrophobicContact CB-CG2 4.34Å; Q1161-V1173 VanDerWaalsContact OE1-CG2 3.28Å
1162	T	82	Confident	78.4	Confident	100 Å²	100	75.8 Å²	75.8	61%	0.613	38%	0.38	S	S	*	.	H	α-helix	trans	-85.1	-23.8	-178.1	51.7	0	0	0	0	113.3	T1158 A1159 I1160 K1164	T1158-T1162 HydrophobicContact CG2-CG2 4.33Å; T1158-T1162 WeakPolarHBondContact O-CB 3.4Å; T1158-T1162 WeakPolarHBondContact O-CG2 3.36Å; T1158-T1162 PolarHBondContact O-N 3.47Å; T1158-T1162 PolarHBondContact O-OG1 3.13Å; A1159-T1162 PolarHBondContact O-OG1 3.12Å; I1160-T1162 VanDerWaalsContact C-N 3.31Å; I1160-T1162 PolarHBondContact O-N 3.47Å; T1162-K1164 PolarHBondContact O-N 2.92Å
1163	T	77.6	Confident	78.2	Confident	53 Å²	53	73.3 Å²	73.3	33%	0.325	37%	0.365	S	S	.	.	S	Bend	trans	-75.4	121.7	-177.1	-60.9	0	0	0	0	111.6	A1159 I1160 L1165 V1200	A1159-T1163 WeakPolarHBondContact O-CB 3.47Å; A1159-T1163 PolarHBondContact O-N 2.81Å; A1159-T1163 VanDerWaalsContact O-N 3.1Å; A1159-T1163 PolarHBondContact O-OG1 3.24Å; I1160-T1163 PolarHBondContact O-N 2.82Å; T1163-L1165 HydrophobicContact CG2-CD2 4.47Å; T1163-L1165 PolarHBondContact O-N 2.88Å; T1163-L1165 VanDerWaalsContact O-N 3.16Å; T1163-V1200 HydrophobicContact CG2-CG1 4.43Å; T1163-V1200 HydrophobicContact CG2-CG2 4.3Å
1164	K	70.2	Confident	78.3	Confident	200 Å²	200	74.5 Å²	74.5	87%	0.87	37%	0.372	S	S	*	.			trans	-76.6	99.8	174.9	-72.1	-174.7	179.8	177.3	0	111.2	T1162 K1166	T1162-K1164 PolarHBondContact O-N 2.92Å; K1164-K1166 PolarHBondContact O-N 2.93Å
1165	L	70.1	Confident	78.2	Confident	11 Å²	11	77.8 Å²	77.8	6%	0.058	38%	0.378	C	S	.	.			trans	-74.5	84	174.9	-62.1	173.3	0	0	0	111.4	T1163 K1167 T1168 L1170 L1196 V1197 V1200	T1163-L1165 HydrophobicContact CG2-CD2 4.47Å; T1163-L1165 PolarHBondContact O-N 2.88Å; T1163-L1165 VanDerWaalsContact O-N 3.16Å; L1165-K1167 VanDerWaalsContact C-N 3.3Å; L1165-K1167 PolarHBondContact O-N 2.6Å; L1165-T1168 WeakPolarHBondContact O-CB 2.95Å; L1165-T1168 PolarHBondContact O-N 3.28Å; L1165-T1168 PolarHBondContact O-OG1 3.41Å; L1165-L1170 HydrophobicContact CD1-CD1 4.05Å; L1165-L1170 HydrophobicContact CD1-CD2 4.21Å; L1165-L1170 HydrophobicContact CD1-CG 4.31Å; L1165-L1196 HydrophobicContact CB-CD1 4.41Å; L1165-L1196 HydrophobicContact CD2-CB 3.91Å; L1165-V1197 HydrophobicContact CD1-CG2 3.86Å; L1165-V1200 HydrophobicContact CD2-CG2 3.82Å
1166	K	62.2	Low	78.1	Confident	174 Å²	174	76.4 Å²	76.4	76%	0.757	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	34	49.9	169.9	-70.1	-175.1	179.9	172	0	116.4	K1164 L1196	K1164-K1166 PolarHBondContact O-N 2.93Å; K1166-L1196 HydrophobicContact CB-CD1 4.22Å
1167	K	60.1	Low	78	Confident	213 Å²	213	84.8 Å²	84.8	93%	0.926	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-0	177.5	-51	175.9	178.6	178.4	0	116.8	L1165	L1165-K1167 VanDerWaalsContact C-N 3.3Å; L1165-K1167 PolarHBondContact O-N 2.6Å
1168	T	64.4	Low	77.9	Confident	34 Å²	34	87.5 Å²	87.5	21%	0.209	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-84.6	122.3	171	-39.2	0	0	0	0	108.9	L1165 A1189 V1193	L1165-T1168 WeakPolarHBondContact O-CB 2.95Å; L1165-T1168 PolarHBondContact O-N 3.28Å; L1165-T1168 PolarHBondContact O-OG1 3.41Å; T1168-A1189 HydrophobicContact CG2-CB 3.37Å; T1168-V1193 HydrophobicContact CG2-CG2 4.27Å
1169	K	64.3	Low	78	Confident	170 Å²	170	87.9 Å²	87.9	74%	0.739	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-80.5	137.4	171.5	-72.5	-176.5	179.1	-179.7	0	108.4	V1185	K1169-V1185 HydrophobicContact CB-CG2 4Å; K1169-V1185 WeakPolarHBondContact O-CG2 3.42Å
1170	L	72.1	Confident	78.1	Confident	26 Å²	26	87.2 Å²	87.2	14%	0.136	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	141.5	167.3	-65	174	0	0	0	108.1	I1160 L1165 V1173 V1182 V1193	I1160-L1170 HydrophobicContact CG2-CD1 4.03Å; L1165-L1170 HydrophobicContact CD1-CD1 4.05Å; L1165-L1170 HydrophobicContact CD1-CD2 4.21Å; L1165-L1170 HydrophobicContact CD1-CG 4.31Å; L1170-V1173 HydrophobicContact CD1-CG2 4.24Å; L1170-V1182 HydrophobicContact CD1-CG1 4.15Å; L1170-V1182 HydrophobicContact CD2-CG1 3.62Å; L1170-V1182 HydrophobicContact CG-CG1 4.48Å; L1170-V1193 HydrophobicContact CD2-CG1 4.2Å; L1170-V1193 HydrophobicContact CD2-CG2 3.78Å
1171	S	78.3	Confident	78.3	Confident	68 Å²	68	89.2 Å²	89.2	48%	0.476	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-52.4	179.1	59.7	0	0	0	0	110.6	Y1183 P1184	S1171-Y1183 PolarHBondContact N-O 3.34Å; S1171-Y1183 WeakPolarHBondContact OG-CB 3.36Å; S1171-Y1183 PolarHBondContact OG-O 3.2Å; S1171-P1184 PolarHBondContact OG-O 3.32Å
1172	R	84.7	Confident	78.5	Confident	106 Å²	106	85 Å²	85	40%	0.4	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	158.7	173.2	62.8	-179.1	-177.8	159.3	-3.5	110.7	Y1183	R1172-Y1183 HydrophobicContact CG-CD2 3.55Å; R1172-Y1183 HydrophobicContact CG-CE2 4.22Å; R1172-Y1183 HydrophobicContact CG-CG 3.86Å; R1172-Y1183 WeakPolarHBondContact O-CB 3.33Å; R1172-Y1183 WeakPolarHBondContact O-CD2 3.31Å; R1172-Y1183 PolarHBondContact O-N 3.35Å
1173	V	84.2	Confident	78.7	Confident	21 Å²	21	81.5 Å²	81.5	13%	0.127	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.6	168	179.1	0	0	0	0	107.5	A1157 I1160 Q1161 L1170 I1180 F1181 V1182	A1157-V1173 HydrophobicContact CB-CG1 4.09Å; I1160-V1173 HydrophobicContact CB-CG2 4.45Å; I1160-V1173 HydrophobicContact CG2-CG2 3.87Å; Q1161-V1173 HydrophobicContact CB-CB 4.44Å; Q1161-V1173 HydrophobicContact CB-CG2 4.34Å; Q1161-V1173 VanDerWaalsContact OE1-CG2 3.28Å; L1170-V1173 HydrophobicContact CD1-CG2 4.24Å; V1173-I1180 HydrophobicContact CG1-CG2 3.65Å; V1173-F1181 WeakPolarHBondContact CA-O 3.31Å; V1173-V1182 HydrophobicContact CG1-CG2 4.39Å; V1173-V1182 HydrophobicContact CG2-CG1 4.3Å; V1173-V1182 HydrophobicContact CG2-CG2 4.4Å
1174	T	87.5	Confident	79	Confident	45 Å²	45	79.5 Å²	79.5	28%	0.276	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	161.9	173.6	66	0	0	0	0	109.7	F1181 Y1183	T1174-F1181 PolarHBondContact N-O 3.2Å; T1174-F1181 PolarHBondContact O-N 3.29Å; T1174-Y1183 HydrophobicContact CG2-CE2 4.14Å; T1174-Y1183 WeakPolarHBondContact OG1-CE2 3.42Å
1175	Y	85.8	Confident	79.4	Confident	124 Å²	124	74.4 Å²	74.4	49%	0.486	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	150.5	179.7	63.4	-89.4	0	0	0	111	T1153 P1154 A1157 Y1179	T1153-Y1175 HydrophobicContact CG2-CD2 4.16Å; T1153-Y1175 HydrophobicContact CG2-CG 4.35Å; P1154-Y1175 HydrophobicContact CB-CE1 4.45Å; P1154-Y1175 HydrophobicContact CB-CE2 4.3Å; P1154-Y1175 HydrophobicContact CG-CE2 3.84Å; A1157-Y1175 HydrophobicContact CB-CD1 3.51Å; A1157-Y1175 HydrophobicContact CB-CE1 4.25Å; A1157-Y1175 HydrophobicContact CB-CG 4.11Å; Y1175-Y1179 CarbonylContact C-O 3.59Å; Y1175-Y1179 VanDerWaalsContact CA-O 3.29Å; Y1175-Y1179 WeakPolarHBondContact CA-O 3.19Å
1176	S	83.8	Confident	79.8	Confident	67 Å²	67	77.7 Å²	77.7	47%	0.469	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	116.5	175	-179.1	0	0	0	0	109.9	D1178 Y1179	S1176-D1178 PolarHBondContact O-N 3.42Å; S1176-Y1179 PolarHBondContact N-O 2.79Å; S1176-Y1179 PolarHBondContact O-N 3.46Å
1177	K	83.5	Confident	80.4	Confident	176 Å²	176	74.8 Å²	74.8	77%	0.765	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	-95.9	-176.6	-66.1	-177.9	177.7	179.4	0	113	T1153	T1153-K1177 WeakPolarHBondContact CB-O 3.42Å; T1153-K1177 VanDerWaalsContact CG2-O 3.28Å; T1153-K1177 WeakPolarHBondContact CG2-O 3.17Å; T1153-K1177 PolarHBondContact OG1-O 3.26Å
1178	D	84.4	Confident	81.2	Confident	63 Å²	63	71 Å²	71	34%	0.337	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	7.8	-175.9	-53.5	-35.2	0	0	0	112.8	L1141 S1176	L1141-D1178 PolarHBondContact N-O 3.42Å; S1176-D1178 PolarHBondContact O-N 3.42Å
1179	Y	88.1	Confident	81.8	Confident	91 Å²	91	69.7 Å²	69.7	36%	0.357	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.7	179.7	-68.8	-87.5	0	0	0	112.2	I1139 K1140 Y1175 S1176 F1181	I1139-Y1179 WeakPolarHBondContact O-CA 3.5Å; K1140-Y1179 HydrophobicContact CB-CD1 4.01Å; K1140-Y1179 HydrophobicContact CB-CE1 3.63Å; K1140-Y1179 HydrophobicContact CD-CE1 3.94Å; K1140-Y1179 WeakPolarHBondContact CE-OH 3.1Å; K1140-Y1179 HydrophobicContact CG-CD1 4.26Å; K1140-Y1179 HydrophobicContact CG-CE1 3.65Å; Y1175-Y1179 CarbonylContact C-O 3.59Å; Y1175-Y1179 VanDerWaalsContact CA-O 3.29Å; Y1175-Y1179 WeakPolarHBondContact CA-O 3.19Å; S1176-Y1179 PolarHBondContact N-O 2.79Å; S1176-Y1179 PolarHBondContact O-N 3.46Å; Y1179-F1181 HydrophobicContact CG-CZ 4.4Å
1180	I	88.6	Confident	82.4	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135	168.2	-63.1	178.9	0	0	0	108.8	A1138 I1139 L1141 T1153 V1156 I1160 V1173 V1182	A1138-I1180 CarbonylContact C-O 3.43Å; A1138-I1180 WeakPolarHBondContact CA-O 3.38Å; I1139-I1180 HydrophobicContact CB-CB 4.4Å; I1139-I1180 PolarHBondContact N-O 3.18Å; I1139-I1180 PolarHBondContact O-N 3.08Å; L1141-I1180 HydrophobicContact CD1-CD1 3.8Å; L1141-I1180 HydrophobicContact CD1-CG1 4.05Å; L1141-I1180 HydrophobicContact CD2-CD1 4.34Å; L1141-I1180 HydrophobicContact CG-CD1 4.43Å; T1153-I1180 HydrophobicContact CG2-CG1 4.14Å; V1156-I1180 HydrophobicContact CB-CD1 3.51Å; V1156-I1180 HydrophobicContact CG1-CD1 3.17Å; I1160-I1180 HydrophobicContact CD1-CD1 4.08Å; I1160-I1180 HydrophobicContact CD1-CG2 3.96Å; V1173-I1180 HydrophobicContact CG1-CG2 3.65Å; I1180-V1182 HydrophobicContact CG2-CG2 4Å
1181	F	89.2	Confident	82.8	Confident	43 Å²	43	66.6 Å²	66.6	19%	0.189	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113.9	177.5	-51.8	-77.4	0	0	0	109.1	Y1136 V1137 A1138 V1173 T1174 Y1179 Y1183	Y1136-F1181 HydrophobicContact CD2-CB 4.19Å; Y1136-F1181 AromaticContact CD2-CD1 3.64Å; Y1136-F1181 HydrophobicContact CD2-CD1 3.64Å; Y1136-F1181 HydrophobicContact CD2-CG 4.36Å; Y1136-F1181 AromaticContact CE2-CD1 3.47Å; Y1136-F1181 HydrophobicContact CE2-CD1 3.47Å; Y1136-F1181 VanDerWaalsContact CE2-CD1 3.47Å; Y1136-F1181 AromaticContact CE2-CE1 3.94Å; Y1136-F1181 HydrophobicContact CE2-CE1 3.94Å; Y1136-F1181 HydrophobicContact CE2-CG 4.47Å; V1137-F1181 WeakPolarHBondContact O-CA 3.1Å; A1138-F1181 HydrophobicContact CB-CD1 3.76Å; A1138-F1181 HydrophobicContact CB-CE1 3.84Å; V1173-F1181 WeakPolarHBondContact CA-O 3.31Å; T1174-F1181 PolarHBondContact N-O 3.2Å; T1174-F1181 PolarHBondContact O-N 3.29Å; Y1179-F1181 HydrophobicContact CG-CZ 4.4Å; F1181-Y1183 HydrophobicContact CB-CE2 3.71Å
1182	V	87.4	Confident	82.8	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117	-179.9	-177.5	0	0	0	0	108.6	Y1136 V1137 I1139 I1160 L1170 V1173 I1180 P1184 V1193	Y1136-V1182 CarbonylContact C-O 3.14Å; Y1136-V1182 WeakPolarHBondContact CA-O 3.36Å; V1137-V1182 HydrophobicContact CB-CB 4.32Å; V1137-V1182 PolarHBondContact N-O 2.65Å; V1137-V1182 PolarHBondContact O-N 2.84Å; I1139-V1182 HydrophobicContact CD1-CG2 4.02Å; I1160-V1182 HydrophobicContact CD1-CG2 4.42Å; I1160-V1182 HydrophobicContact CG2-CG1 4.41Å; I1160-V1182 HydrophobicContact CG2-CG2 3.97Å; L1170-V1182 HydrophobicContact CD1-CG1 4.15Å; L1170-V1182 HydrophobicContact CD2-CG1 3.62Å; L1170-V1182 HydrophobicContact CG-CG1 4.48Å; V1173-V1182 HydrophobicContact CG1-CG2 4.39Å; V1173-V1182 HydrophobicContact CG2-CG1 4.3Å; V1173-V1182 HydrophobicContact CG2-CG2 4.4Å; I1180-V1182 HydrophobicContact CG2-CG2 4Å; V1182-P1184 WeakPolarHBondContact O-CD 3.46Å; V1182-V1193 HydrophobicContact CG1-CG1 3.92Å
1183	Y	87.1	Confident	82.6	Confident	27 Å²	27	61 Å²	61	11%	0.106	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	112.9	-178.4	-61.7	-99.8	0	0	0	109.5	Y1134 Y1136 S1171 R1172 T1174 F1181	Y1134-Y1183 HydrophobicContact CD1-CD1 4.45Å; Y1134-Y1183 HydrophobicContact CD1-CE1 4.23Å; Y1134-Y1183 HydrophobicContact CG-CE1 4.16Å; Y1136-Y1183 AromaticContact CD1-CE1 3.88Å; Y1136-Y1183 HydrophobicContact CD1-CE1 3.88Å; Y1136-Y1183 HydrophobicContact CG-CD1 4.41Å; Y1136-Y1183 AromaticContact CG-CE1 3.96Å; Y1136-Y1183 HydrophobicContact CG-CE1 3.96Å; S1171-Y1183 PolarHBondContact N-O 3.34Å; S1171-Y1183 WeakPolarHBondContact OG-CB 3.36Å; S1171-Y1183 PolarHBondContact OG-O 3.2Å; R1172-Y1183 HydrophobicContact CG-CD2 3.55Å; R1172-Y1183 HydrophobicContact CG-CE2 4.22Å; R1172-Y1183 HydrophobicContact CG-CG 3.86Å; R1172-Y1183 WeakPolarHBondContact O-CB 3.33Å; R1172-Y1183 WeakPolarHBondContact O-CD2 3.31Å; R1172-Y1183 PolarHBondContact O-N 3.35Å; T1174-Y1183 HydrophobicContact CG2-CE2 4.14Å; T1174-Y1183 WeakPolarHBondContact OG1-CE2 3.42Å; F1181-Y1183 HydrophobicContact CB-CE2 3.71Å
1184	P	82.6	Confident	82.6	Confident	11 Å²	11	61.3 Å²	61.3	7%	0.071	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	164.9	170	29.7	-35	0	0	0	111.1	V1135 S1171 V1182 A1189 L1190 V1193	V1135-P1184 HydrophobicContact CG1-CG 4.29Å; V1135-P1184 WeakPolarHBondContact O-CD 3.31Å; S1171-P1184 PolarHBondContact OG-O 3.32Å; V1182-P1184 WeakPolarHBondContact O-CD 3.46Å; P1184-A1189 HydrophobicContact CB-CB 3.96Å; P1184-L1190 HydrophobicContact CG-CB 4.21Å; P1184-L1190 HydrophobicContact CG-CD1 3.97Å; P1184-V1193 HydrophobicContact CB-CG2 4.35Å
1185	V	80.1	Confident	82.3	Confident	93 Å²	93	65.6 Å²	65.6	56%	0.564	33%	0.326	S	S	*	.	S	Bend	trans	-76.4	-36	175.3	168.6	0	0	0	0	111.4	K1169	K1169-V1185 HydrophobicContact CB-CG2 4Å; K1169-V1185 WeakPolarHBondContact O-CG2 3.42Å
1186	D	76.7	Confident	82.1	Confident	80 Å²	80	61.4 Å²	61.4	43%	0.428	31%	0.312	S	S	.	.	S	Bend	trans	-146.3	171	178	65.4	-3.9	0	0	0	111.6	N1188 A1189 L1190	D1186-N1188 VanDerWaalsContact C-N 3.27Å; D1186-N1188 PolarHBondContact O-N 2.89Å; D1186-A1189 WeakPolarHBondContact O-CB 3.44Å; D1186-A1189 PolarHBondContact O-N 3.1Å; D1186-A1189 WeakPolarHBondContact OD1-CB 3.47Å; D1186-A1189 PolarHBondContact OD1-N 3.35Å; D1186-L1190 PolarHBondContact O-N 2.85Å
1187	L	76.6	Confident	82.1	Confident	113 Å²	113	58.2 Å²	58.2	59%	0.592	29%	0.289	S	S	*	.	H	α-helix	trans	-62.6	-33	179	-105.9	140.1	0	0	0	112.6	L1130 V1135 A1189 L1190	L1130-L1187 HydrophobicContact CD2-CD2 3.88Å; V1135-L1187 HydrophobicContact CG2-CD1 4.49Å; V1135-L1187 HydrophobicContact CG2-CG 4.42Å; L1187-A1189 VanDerWaalsContact C-N 3.33Å; L1187-A1189 PolarHBondContact O-N 3.15Å; L1187-L1190 VanDerWaalsContact O-CB 3.25Å; L1187-L1190 WeakPolarHBondContact O-CB 3.44Å; L1187-L1190 PolarHBondContact O-N 2.81Å
1188	N	75.8	Confident	82.1	Confident	134 Å²	134	54 Å²	54	72%	0.717	27%	0.272	S	S	*	.	H	α-helix	trans	-69.2	-33	178	-65.2	-26.4	0	0	0	112	D1186 L1190	D1186-N1188 VanDerWaalsContact C-N 3.27Å; D1186-N1188 PolarHBondContact O-N 2.89Å; N1188-L1190 VanDerWaalsContact C-N 3.3Å
1189	A	76.2	Confident	82	Confident	6 Å²	6	55.2 Å²	55.2	5%	0.05	28%	0.279	C	S	.	.	H	α-helix	trans	-69.1	-26.1	173	0	0	0	0	0	112.9	T1168 P1184 D1186 L1187 E1191 T1192 V1193	T1168-A1189 HydrophobicContact CG2-CB 3.37Å; P1184-A1189 HydrophobicContact CB-CB 3.96Å; D1186-A1189 WeakPolarHBondContact O-CB 3.44Å; D1186-A1189 PolarHBondContact O-N 3.1Å; D1186-A1189 WeakPolarHBondContact OD1-CB 3.47Å; D1186-A1189 PolarHBondContact OD1-N 3.35Å; L1187-A1189 VanDerWaalsContact C-N 3.33Å; L1187-A1189 PolarHBondContact O-N 3.15Å; A1189-E1191 PolarHBondContact O-N 3.49Å; A1189-T1192 PolarHBondContact O-N 2.63Å; A1189-T1192 VanDerWaalsContact O-N 3.16Å; A1189-V1193 WeakPolarHBondContact O-CB 3.33Å; A1189-V1193 VanDerWaalsContact O-CG2 3.24Å; A1189-V1193 WeakPolarHBondContact O-CG2 3.24Å; A1189-V1193 PolarHBondContact O-N 2.9Å
1190	L	78.7	Confident	82	Confident	9 Å²	9	51.1 Å²	51.1	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-54.8	-49.9	-176.1	-178.7	67.1	0	0	0	111.9	L1130 V1135 V1137 P1184 D1186 L1187 N1188 T1192 V1193 V1194	L1130-L1190 HydrophobicContact CD2-CD2 4.49Å; V1135-L1190 HydrophobicContact CG1-CD1 4.07Å; V1135-L1190 HydrophobicContact CG1-CD2 3.8Å; V1135-L1190 HydrophobicContact CG1-CG 4.39Å; V1137-L1190 HydrophobicContact CG2-CD1 3.48Å; V1137-L1190 VanDerWaalsContact CG2-CD1 3.48Å; P1184-L1190 HydrophobicContact CG-CB 4.21Å; P1184-L1190 HydrophobicContact CG-CD1 3.97Å; D1186-L1190 PolarHBondContact O-N 2.85Å; L1187-L1190 VanDerWaalsContact O-CB 3.25Å; L1187-L1190 WeakPolarHBondContact O-CB 3.44Å; L1187-L1190 PolarHBondContact O-N 2.81Å; N1188-L1190 VanDerWaalsContact C-N 3.3Å; L1190-T1192 VanDerWaalsContact C-N 3.3Å; L1190-T1192 PolarHBondContact O-N 3.27Å; L1190-V1193 PolarHBondContact O-N 3.07Å; L1190-V1194 HydrophobicContact CD1-CG2 4.43Å; L1190-V1194 VanDerWaalsContact O-CG2 3.29Å; L1190-V1194 WeakPolarHBondContact O-CG2 3.11Å; L1190-V1194 PolarHBondContact O-N 2.92Å
1191	E	79.1	Confident	81.9	Confident	122 Å²	122	53.6 Å²	53.6	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-63.9	-37.8	-178.2	-161	-167.2	152.7	0	0	111.9	A1189 K1195	A1189-E1191 PolarHBondContact O-N 3.49Å; E1191-K1195 WeakPolarHBondContact O-CG 3.23Å; E1191-K1195 PolarHBondContact O-N 3.37Å; E1191-K1195 VanDerWaalsContact O-N 3.16Å; E1191-K1195 IonicContact OE1-NZ 3.02Å; E1191-K1195 PolarHBondContact OE1-NZ 2.77Å
1192	T	79.4	Confident	81.8	Confident	57 Å²	57	52.5 Å²	52.5	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-68.8	-39.8	176.9	-58.1	0	0	0	0	111.3	A1189 L1190 K1195 L1196	A1189-T1192 PolarHBondContact O-N 2.63Å; A1189-T1192 VanDerWaalsContact O-N 3.16Å; L1190-T1192 VanDerWaalsContact C-N 3.3Å; L1190-T1192 PolarHBondContact O-N 3.27Å; T1192-K1195 PolarHBondContact O-N 3.33Å; T1192-L1196 HydrophobicContact CG2-CD1 3.68Å; T1192-L1196 HydrophobicContact CG2-CG 4.43Å; T1192-L1196 WeakPolarHBondContact O-CB 3.42Å; T1192-L1196 VanDerWaalsContact O-CG 3.27Å; T1192-L1196 WeakPolarHBondContact O-CG 3.3Å; T1192-L1196 PolarHBondContact O-N 2.92Å; T1192-L1196 VanDerWaalsContact O-N 3.14Å
1193	V	81	Confident	81.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.9	-47.8	177.1	169.3	0	0	0	0	109.9	V1137 T1168 L1170 V1182 P1184 A1189 L1190 K1195 L1196 V1197	V1137-V1193 HydrophobicContact CG2-CG1 4.27Å; T1168-V1193 HydrophobicContact CG2-CG2 4.27Å; L1170-V1193 HydrophobicContact CD2-CG1 4.2Å; L1170-V1193 HydrophobicContact CD2-CG2 3.78Å; V1182-V1193 HydrophobicContact CG1-CG1 3.92Å; P1184-V1193 HydrophobicContact CB-CG2 4.35Å; A1189-V1193 WeakPolarHBondContact O-CB 3.33Å; A1189-V1193 VanDerWaalsContact O-CG2 3.24Å; A1189-V1193 WeakPolarHBondContact O-CG2 3.24Å; A1189-V1193 PolarHBondContact O-N 2.9Å; L1190-V1193 PolarHBondContact O-N 3.07Å; V1193-K1195 VanDerWaalsContact C-N 3.32Å; V1193-K1195 PolarHBondContact O-N 2.79Å; V1193-L1196 PolarHBondContact O-N 3.32Å; V1193-L1196 VanDerWaalsContact O-N 3.15Å; V1193-V1197 HydrophobicContact CB-CG2 4.47Å; V1193-V1197 HydrophobicContact CG1-CG2 3.47Å; V1193-V1197 VanDerWaalsContact CG1-CG2 3.47Å; V1193-V1197 WeakPolarHBondContact O-CB 3.36Å; V1193-V1197 WeakPolarHBondContact O-CG2 3.44Å; V1193-V1197 PolarHBondContact O-N 3.34Å
1194	V	82.5	Confident	81.7	Confident	26 Å²	26	55.3 Å²	55.3	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-56.1	-45.6	177.4	171.6	0	0	0	0	111.5	L1126 Q1128 V1137 L1190 L1196	L1126-V1194 HydrophobicContact CD2-CG1 3.88Å; L1126-V1194 HydrophobicContact CD2-CG2 4.24Å; Q1128-V1194 HydrophobicContact CG-CG2 3.74Å; V1137-V1194 HydrophobicContact CG2-CG2 3.8Å; L1190-V1194 HydrophobicContact CD1-CG2 4.43Å; L1190-V1194 VanDerWaalsContact O-CG2 3.29Å; L1190-V1194 WeakPolarHBondContact O-CG2 3.11Å; L1190-V1194 PolarHBondContact O-N 2.92Å; V1194-L1196 VanDerWaalsContact C-N 3.34Å; V1194-L1196 PolarHBondContact O-N 2.9Å
1195	K	81.6	Confident	82.1	Confident	135 Å²	135	55.3 Å²	55.3	59%	0.587	29%	0.291	S	S	*	.	H	α-helix	trans	-67.1	-29.5	179.5	-76.1	172.2	173.8	164.3	0	114.2	E1191 T1192 V1193	E1191-K1195 WeakPolarHBondContact O-CG 3.23Å; E1191-K1195 PolarHBondContact O-N 3.37Å; E1191-K1195 VanDerWaalsContact O-N 3.16Å; E1191-K1195 IonicContact OE1-NZ 3.02Å; E1191-K1195 PolarHBondContact OE1-NZ 2.77Å; T1192-K1195 PolarHBondContact O-N 3.33Å; V1193-K1195 VanDerWaalsContact C-N 3.32Å; V1193-K1195 PolarHBondContact O-N 2.79Å
1196	L	82.4	Confident	82.3	Confident	36 Å²	36	53.8 Å²	53.8	19%	0.188	28%	0.283	C	S	.	.	H	α-helix	trans	-105.2	-20.5	-171.5	-64.4	176.8	0	0	0	114.1	L1165 K1166 T1192 V1193 V1194 E1198 D1199	L1165-L1196 HydrophobicContact CB-CD1 4.41Å; L1165-L1196 HydrophobicContact CD2-CB 3.91Å; K1166-L1196 HydrophobicContact CB-CD1 4.22Å; T1192-L1196 HydrophobicContact CG2-CD1 3.68Å; T1192-L1196 HydrophobicContact CG2-CG 4.43Å; T1192-L1196 WeakPolarHBondContact O-CB 3.42Å; T1192-L1196 VanDerWaalsContact O-CG 3.27Å; T1192-L1196 WeakPolarHBondContact O-CG 3.3Å; T1192-L1196 PolarHBondContact O-N 2.92Å; T1192-L1196 VanDerWaalsContact O-N 3.14Å; V1193-L1196 PolarHBondContact O-N 3.32Å; V1193-L1196 VanDerWaalsContact O-N 3.15Å; V1194-L1196 VanDerWaalsContact C-N 3.34Å; V1194-L1196 PolarHBondContact O-N 2.9Å; L1196-E1198 VanDerWaalsContact C-N 3.34Å; L1196-E1198 PolarHBondContact O-N 2.97Å; L1196-D1199 PolarHBondContact O-N 3.45Å
1197	V	83.1	Confident	82.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-33.1	-175.7	158.6	0	0	0	0	112.1	L1119 L1126 I1139 L1165 V1193 D1199 V1200	L1119-V1197 HydrophobicContact CD2-CG1 3.49Å; L1119-V1197 VanDerWaalsContact CD2-CG1 3.49Å; L1119-V1197 WeakPolarHBondContact CD2-O 3.47Å; L1126-V1197 HydrophobicContact CD1-CG1 4.48Å; I1139-V1197 HydrophobicContact CD1-CG1 3.45Å; I1139-V1197 VanDerWaalsContact CD1-CG1 3.45Å; L1165-V1197 HydrophobicContact CD1-CG2 3.86Å; V1193-V1197 HydrophobicContact CB-CG2 4.47Å; V1193-V1197 HydrophobicContact CG1-CG2 3.47Å; V1193-V1197 VanDerWaalsContact CG1-CG2 3.47Å; V1193-V1197 WeakPolarHBondContact O-CB 3.36Å; V1193-V1197 WeakPolarHBondContact O-CG2 3.44Å; V1193-V1197 PolarHBondContact O-N 3.34Å; V1197-D1199 VanDerWaalsContact C-N 3.25Å; V1197-D1199 PolarHBondContact O-N 3.46Å; V1197-V1200 WeakPolarHBondContact O-CB 3.28Å; V1197-V1200 WeakPolarHBondContact O-CG2 3.35Å; V1197-V1200 PolarHBondContact O-N 3.22Å
1198	E	83.1	Confident	83.1	Confident	88 Å²	88	47.7 Å²	47.7	41%	0.411	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-31.4	177.4	-71.2	-171.1	155.9	0	0	113.1	L1119 A1120 L1126 L1196 V1200	L1119-E1198 PolarHBondContact N-O 2.93Å; A1120-E1198 HydrophobicContact CB-CB 4.2Å; A1120-E1198 PolarHBondContact N-O 3.41Å; A1120-E1198 VanDerWaalsContact N-O 3.14Å; L1126-E1198 HydrophobicContact CD1-CG 4.09Å; L1196-E1198 VanDerWaalsContact C-N 3.34Å; L1196-E1198 PolarHBondContact O-N 2.97Å; E1198-V1200 VanDerWaalsContact C-N 3.3Å; E1198-V1200 PolarHBondContact O-N 3.46Å
1199	D	83.6	Confident	83.5	Confident	89 Å²	89	44.9 Å²	44.9	48%	0.476	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-2	179.6	-82.5	-28.4	0	0	0	113.9	R1118 L1196 V1197 I1201	R1118-D1199 IonicContact CZ-OD1 2.62Å; R1118-D1199 IonicContact NH1-OD1 2.64Å; R1118-D1199 PolarHBondContact NH1-OD1 2.99Å; L1196-D1199 PolarHBondContact O-N 3.45Å; V1197-D1199 VanDerWaalsContact C-N 3.25Å; V1197-D1199 PolarHBondContact O-N 3.46Å; D1199-I1201 PolarHBondContact O-N 3.13Å
1200	V	87	Confident	83.8	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.03	27%	0.265	C	S	.	.			trans	-64.9	127.2	177.5	175.3	0	0	0	0	109.8	R1118 L1119 I1160 T1163 L1165 V1197 E1198	R1118-V1200 CarbonylContact C-O 3.58Å; R1118-V1200 WeakPolarHBondContact CA-O 3.29Å; L1119-V1200 PolarHBondContact N-O 2.82Å; I1160-V1200 HydrophobicContact CG1-CG1 4.21Å; T1163-V1200 HydrophobicContact CG2-CG1 4.43Å; T1163-V1200 HydrophobicContact CG2-CG2 4.3Å; L1165-V1200 HydrophobicContact CD2-CG2 3.82Å; V1197-V1200 WeakPolarHBondContact O-CB 3.28Å; V1197-V1200 WeakPolarHBondContact O-CG2 3.35Å; V1197-V1200 PolarHBondContact O-N 3.22Å; E1198-V1200 VanDerWaalsContact C-N 3.3Å; E1198-V1200 PolarHBondContact O-N 3.46Å
1201	I	87.2	Confident	84.2	Confident	52 Å²	52	47.2 Å²	47.2	27%	0.267	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	119.7	176.6	-59.7	174.1	0	0	0	108.4	P1116 D1199 P1206	P1116-I1201 HydrophobicContact CB-CD1 4.08Å; P1116-I1201 HydrophobicContact CB-CG1 4.38Å; P1116-I1201 HydrophobicContact CB-CG2 3.95Å; D1199-I1201 PolarHBondContact O-N 3.13Å; I1201-P1206 HydrophobicContact CD1-CB 3.91Å; I1201-P1206 HydrophobicContact CD1-CG 4.31Å
1202	V	86.5	Confident	84.4	Confident	20 Å²	20	41.6 Å²	41.6	12%	0.121	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	-38.8	-175.3	175.5	0	0	0	0	111.9	T1117 L1119 I1122 I1151 V1156	T1117-V1202 PolarHBondContact O-N 2.81Å; L1119-V1202 HydrophobicContact CB-CG2 4.22Å; L1119-V1202 HydrophobicContact CD1-CG2 4.03Å; I1122-V1202 HydrophobicContact CD1-CB 4.4Å; I1122-V1202 HydrophobicContact CD1-CG1 4.21Å; I1122-V1202 HydrophobicContact CD1-CG2 4.07Å; I1151-V1202 HydrophobicContact CD1-CG1 4.31Å; I1151-V1202 HydrophobicContact CG2-CG1 3.7Å; V1156-V1202 HydrophobicContact CB-CG1 4.15Å; V1156-V1202 HydrophobicContact CG1-CG1 4.29Å; V1156-V1202 HydrophobicContact CG1-CG2 4.03Å; V1156-V1202 HydrophobicContact CG2-CG1 3.69Å
1203	K	85.9	Confident	84.7	Confident	63 Å²	63	40.7 Å²	40.7	27%	0.274	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	151.9	-179.3	-172.1	173.2	178	-177	0	108.6	T1117 R1149 G1150 I1151	T1117-K1203 PolarHBondContact N-O 2.85Å; R1149-K1203 PolarHBondContact O-NZ 3.38Å; G1150-K1203 PolarHBondContact O-NZ 3.36Å; I1151-K1203 HydrophobicContact CD1-CB 3.95Å; I1151-K1203 HydrophobicContact CD1-CD 4.25Å; I1151-K1203 HydrophobicContact CG1-CB 4.12Å; I1151-K1203 HydrophobicContact CG1-CD 3.65Å
1204	G	87.5	Confident	84.7	Confident	22 Å²	22	42.9 Å²	42.9	23%	0.227	24%	0.24	C	C	.	.	S	Bend	trans	99	178.1	-174.9	0	0	0	0	0	112.9	S1113 P1206	S1113-G1204 WeakPolarHBondContact O-CA 3.48Å; G1204-P1206 WeakPolarHBondContact O-CD 3.44Å
1205	I	89.3	Confident	84.6	Confident	11 Å²	11	47.8 Å²	47.8	6%	0.056	26%	0.261	C	S	.	.			trans	-92	121.1	-174.1	-73.1	170	0	0	0	110.9	I1114 G1207 V1208 R1228 E1231 V1232 I1235	I1114-I1205 HydrophobicContact CG2-CD1 4.37Å; I1114-I1205 PolarHBondContact O-N 2.84Å; I1205-G1207 PolarHBondContact O-N 3.31Å; I1205-V1208 HydrophobicContact CB-CG2 4.02Å; I1205-V1208 HydrophobicContact CG2-CG2 3.76Å; I1205-V1208 PolarHBondContact O-N 3.33Å; I1205-R1228 HydrophobicContact CG2-CB 3.55Å; I1205-R1228 HydrophobicContact CG2-CG 3.56Å; I1205-E1231 HydrophobicContact CD1-CB 3.64Å; I1205-E1231 HydrophobicContact CG1-CB 4.02Å; I1205-E1231 HydrophobicContact CG2-CB 4.36Å; I1205-E1231 VanDerWaalsContact CG2-OE2 3.23Å; I1205-E1231 WeakPolarHBondContact CG2-OE2 3.27Å; I1205-V1232 HydrophobicContact CD1-CB 4.47Å; I1205-V1232 HydrophobicContact CD1-CG2 3.68Å; I1205-I1235 HydrophobicContact CD1-CD1 3.74Å
1206	P	84.8	Confident	84.3	Confident	61 Å²	61	45.3 Å²	45.3	40%	0.396	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	118.8	175.4	-22	34.2	0	0	0	112.9	I1201 G1204 R1228	I1201-P1206 HydrophobicContact CD1-CB 3.91Å; I1201-P1206 HydrophobicContact CD1-CG 4.31Å; G1204-P1206 WeakPolarHBondContact O-CD 3.44Å; P1206-R1228 PolarHBondContact O-NE 2.97Å; P1206-R1228 PolarHBondContact O-NH2 2.93Å
1207	G	83	Confident	84.1	Confident	58 Å²	58	53.4 Å²	53.4	60%	0.598	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.1	-4.9	177.8	0	0	0	0	0	114.8	I1205	I1205-G1207 PolarHBondContact O-N 3.31Å
1208	V	88.4	Confident	83.8	Confident	8 Å²	8	54.6 Å²	54.6	5%	0.048	30%	0.301	C	S	.	.			trans	-73.9	135	161.8	168.8	0	0	0	0	108.3	I1114 P1116 I1205 V1211 V1224 E1225	I1114-V1208 HydrophobicContact CG2-CG1 4.26Å; I1114-V1208 HydrophobicContact CG2-CG2 4.2Å; P1116-V1208 VanDerWaalsContact CG-O 3.26Å; P1116-V1208 WeakPolarHBondContact CG-O 3.34Å; I1205-V1208 HydrophobicContact CB-CG2 4.02Å; I1205-V1208 HydrophobicContact CG2-CG2 3.76Å; I1205-V1208 PolarHBondContact O-N 3.33Å; V1208-V1211 HydrophobicContact CG1-CG2 3.88Å; V1208-V1224 HydrophobicContact CB-CG1 4.37Å; V1208-V1224 HydrophobicContact CG1-CG1 3.67Å; V1208-V1224 HydrophobicContact CG2-CG1 3.72Å; V1208-E1225 CarbonylContact C-O 3.54Å; V1208-E1225 WeakPolarHBondContact CA-O 3.48Å
1209	S	84.3	Confident	83.9	Confident	75 Å²	75	54.7 Å²	54.7	52%	0.524	30%	0.301	S	S	.	.			trans	-88.3	-45.6	174.5	50.5	0	0	0	0	111.2	E1225	S1209-E1225 PolarHBondContact N-O 3.42Å; S1209-E1225 VanDerWaalsContact OG-CB 3.29Å; S1209-E1225 WeakPolarHBondContact OG-CB 3.37Å; S1209-E1225 WeakPolarHBondContact OG-CG 3.45Å; S1209-E1225 PolarHBondContact OG-O 3.31Å; S1209-E1225 VanDerWaalsContact OG-O 3.11Å; S1209-E1225 PolarHBondContact OG-OE2 2.85Å
1210	R	81.2	Confident	84.1	Confident	62 Å²	62	51.6 Å²	51.6	23%	0.234	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	149.7	-168.4	-170.6	169.5	167.9	-136.7	-21.6	112.3	G752 S1069 V1212 E1225	G752-R1210 VanDerWaalsContact O-CZ 3.27Å; G752-R1210 PolarHBondContact O-NH2 2.9Å; S1069-R1210 PolarHBondContact O-NH1 3.5Å; S1069-R1210 PolarHBondContact OG-NH2 3.11Å; R1210-V1212 HydrophobicContact CG-CG2 4.33Å; R1210-E1225 HydrophobicContact CB-CB 4.42Å; R1210-E1225 PolarHBondContact O-N 3.41Å
1211	V	87	Confident	84.1	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	126	176	-174	0	0	0	0	110.6	K1111 I1114 E1115 V1208 I1222 F1223 V1224	K1111-V1211 HydrophobicContact CB-CG1 4.18Å; K1111-V1211 HydrophobicContact CD-CG1 4.46Å; K1111-V1211 WeakPolarHBondContact CE-O 3.21Å; K1111-V1211 HydrophobicContact CG-CB 4.12Å; K1111-V1211 HydrophobicContact CG-CG1 3.84Å; K1111-V1211 PolarHBondContact NZ-O 3.42Å; I1114-V1211 HydrophobicContact CB-CG2 4.08Å; I1114-V1211 HydrophobicContact CG2-CG2 3.66Å; E1115-V1211 HydrophobicContact CB-CB 4.33Å; E1115-V1211 HydrophobicContact CB-CG2 3.91Å; V1208-V1211 HydrophobicContact CG1-CG2 3.88Å; V1211-I1222 HydrophobicContact CG1-CG2 3.4Å; V1211-F1223 WeakPolarHBondContact CA-O 3.46Å; V1211-V1224 HydrophobicContact CG1-CG2 4.11Å; V1211-V1224 HydrophobicContact CG2-CG1 4.24Å; V1211-V1224 HydrophobicContact CG2-CG2 4.26Å
1212	V	84.5	Confident	84.2	Confident	4 Å²	4	51 Å²	51	2%	0.024	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.5	-177.9	-177	0	0	0	0	109.8	V1067 M1070 R1210 I1222 F1223	V1067-V1212 HydrophobicContact CG1-CG1 4.14Å; M1070-V1212 HydrophobicContact CE-CB 4.44Å; M1070-V1212 HydrophobicContact CE-CG2 3.68Å; M1070-V1212 HydrophobicContact SD-CG2 4.32Å; R1210-V1212 HydrophobicContact CG-CG2 4.33Å; V1212-I1222 WeakPolarHBondContact O-CA 3.49Å; V1212-F1223 PolarHBondContact N-O 3.14Å; V1212-F1223 PolarHBondContact O-N 2.91Å
1213	I	86	Confident	84.3	Confident	38 Å²	38	51.9 Å²	51.9	20%	0.195	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.4	172.9	-56.6	170.8	0	0	0	106.6	A1107 R1108 K1111 H1220 I1222	A1107-I1213 HydrophobicContact CB-CD1 4.11Å; A1107-I1213 HydrophobicContact CB-CG2 4.22Å; R1108-I1213 HydrophobicContact CG-CD1 4.22Å; K1111-I1213 HydrophobicContact CB-CD1 4.1Å; K1111-I1213 HydrophobicContact CB-CG1 4.41Å; K1111-I1213 HydrophobicContact CD-CD1 3.84Å; K1111-I1213 HydrophobicContact CD-CG1 4.05Å; I1213-H1220 HydrophobicContact CG2-CB 4.27Å; I1213-I1222 HydrophobicContact CG1-CG1 4.25Å
1214	Q	80.1	Confident	84.5	Confident	46 Å²	46	48.9 Å²	48.9	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	142.9	172.3	-174.8	174.7	-7.2	0	0	109.2	V1067 H1220 I1221 F1223	V1067-Q1214 HydrophobicContact CG2-CB 4.41Å; V1067-Q1214 HydrophobicContact CG2-CG 4.23Å; Q1214-H1220 WeakPolarHBondContact O-CA 3.43Å; Q1214-I1221 PolarHBondContact N-O 3.28Å; Q1214-I1221 PolarHBondContact O-N 2.79Å; Q1214-F1223 HydrophobicContact CB-CD2 4.14Å; Q1214-F1223 HydrophobicContact CB-CE2 3.94Å
1215	Q	80.3	Confident	84.6	Confident	129 Å²	129	50.4 Å²	50.4	60%	0.603	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	115.9	170.7	-166.8	172.7	6.9	0	0	108.5	E1219	Q1215-E1219 CarbonylContact C-O 3.6Å; Q1215-E1219 VanDerWaalsContact CA-O 3.29Å; Q1215-E1219 WeakPolarHBondContact CA-O 3.42Å
1216	D	74.7	Confident	84.5	Confident	83 Å²	83	50 Å²	50	44%	0.444	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	117.5	173.9	-171.2	17.7	0	0	0	109.1	G1218 E1219	D1216-G1218 PolarHBondContact O-N 2.97Å; D1216-E1219 PolarHBondContact N-O 3.43Å; D1216-E1219 PolarHBondContact O-N 3.1Å
1217	K	77.9	Confident	84.5	Confident	205 Å²	205	49.1 Å²	49.1	89%	0.891	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	30.5	-178.7	-61.4	176.2	-173.7	173.4	0	115.6
1218	G	78.2	Confident	84.9	Confident	26 Å²	26	51.3 Å²	51.3	27%	0.268	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	101	-17.4	-179.7	0	0	0	0	0	114.7	F1102 D1216	F1102-G1218 WeakPolarHBondContact CD1-O 3.18Å; D1216-G1218 PolarHBondContact O-N 2.97Å
1219	E	85.3	Confident	85.1	Confident	90 Å²	90	51 Å²	51	42%	0.421	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	138	175.8	-65.2	-177.1	-179.9	0	0	111.3	P1101 F1102 Q1215 D1216	P1101-E1219 HydrophobicContact CB-CB 4.06Å; P1101-E1219 HydrophobicContact CB-CG 4.07Å; P1101-E1219 HydrophobicContact CG-CG 4.42Å; F1102-E1219 HydrophobicContact CD1-CG 4.32Å; F1102-E1219 HydrophobicContact CE1-CG 3.6Å; F1102-E1219 HydrophobicContact CE2-CG 4.49Å; F1102-E1219 HydrophobicContact CZ-CG 3.69Å; Q1215-E1219 CarbonylContact C-O 3.6Å; Q1215-E1219 VanDerWaalsContact CA-O 3.29Å; Q1215-E1219 WeakPolarHBondContact CA-O 3.42Å; D1216-E1219 PolarHBondContact N-O 3.43Å; D1216-E1219 PolarHBondContact O-N 3.1Å
1220	H	86.7	Confident	85.6	Confident	24 Å²	24	54.6 Å²	54.6	11%	0.111	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114.6	175.9	-64.7	-58.5	0	0	0	110.5	L1098 P1101 A1107 I1213 Q1214	L1098-H1220 HydrophobicContact CD1-CB 4.22Å; P1101-H1220 WeakPolarHBondContact O-CB 3.49Å; P1101-H1220 PolarHBondContact O-CD2 3.36Å; P1101-H1220 PolarHBondContact O-N 2.91Å; A1107-H1220 HydrophobicContact CB-CB 4.05Å; I1213-H1220 HydrophobicContact CG2-CB 4.27Å; Q1214-H1220 WeakPolarHBondContact O-CA 3.43Å
1221	I	86.6	Confident	86.1	Confident	44 Å²	44	55.2 Å²	55.2	23%	0.226	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.4	174.5	-57.9	173.6	0	0	0	108.1	C1095 Q1214 F1223	C1095-I1221 VanDerWaalsContact SG-CG2 3.58Å; Q1214-I1221 PolarHBondContact N-O 3.28Å; Q1214-I1221 PolarHBondContact O-N 2.79Å; I1221-F1223 HydrophobicContact CB-CE2 4.38Å; I1221-F1223 HydrophobicContact CG2-CD2 4.5Å; I1221-F1223 HydrophobicContact CG2-CE2 3.91Å; I1221-F1223 HydrophobicContact CG2-CZ 3.94Å
1222	I	89.3	Confident	86.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	127	179	-57.3	-175.6	0	0	0	109.6	V1096 L1098 A1107 V1110 V1211 V1212 I1213 V1224	V1096-I1222 HydrophobicContact CB-CB 4.02Å; V1096-I1222 WeakPolarHBondContact CB-O 3.35Å; V1096-I1222 HydrophobicContact CG1-CB 4.44Å; V1096-I1222 PolarHBondContact N-O 2.89Å; V1096-I1222 PolarHBondContact O-N 2.72Å; L1098-I1222 HydrophobicContact CD1-CD1 4.25Å; L1098-I1222 HydrophobicContact CD1-CG1 4.37Å; L1098-I1222 HydrophobicContact CD2-CD1 3.78Å; L1098-I1222 HydrophobicContact CD2-CG1 4.42Å; L1098-I1222 HydrophobicContact CG-CD1 4.32Å; L1098-I1222 HydrophobicContact CG-CG1 4.48Å; A1107-I1222 HydrophobicContact CB-CD1 4.43Å; A1107-I1222 WeakPolarHBondContact O-CD1 3.34Å; V1110-I1222 HydrophobicContact CB-CD1 3.94Å; V1110-I1222 HydrophobicContact CG1-CD1 3.79Å; V1211-I1222 HydrophobicContact CG1-CG2 3.4Å; V1212-I1222 WeakPolarHBondContact O-CA 3.49Å; I1213-I1222 HydrophobicContact CG1-CG1 4.25Å; I1222-V1224 HydrophobicContact CG2-CG2 4.07Å
1223	F	89.2	Confident	86.8	Confident	39 Å²	39	56.7 Å²	56.7	17%	0.171	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	172.4	-68.9	-76	0	0	0	109.8	M1070 L1093 C1095 V1211 V1212 Q1214 I1221	M1070-F1223 HydrophobicContact SD-CB 4.4Å; L1093-F1223 HydrophobicContact CD1-CB 4.07Å; L1093-F1223 HydrophobicContact CD1-CD1 4.17Å; L1093-F1223 HydrophobicContact CD2-CD1 3.89Å; L1093-F1223 HydrophobicContact CD2-CE1 4.32Å; L1093-F1223 HydrophobicContact CG-CD1 4.14Å; C1095-F1223 HydrophobicContact CB-CD1 4.29Å; C1095-F1223 HydrophobicContact CB-CE1 4.05Å; V1211-F1223 WeakPolarHBondContact CA-O 3.46Å; V1212-F1223 PolarHBondContact N-O 3.14Å; V1212-F1223 PolarHBondContact O-N 2.91Å; Q1214-F1223 HydrophobicContact CB-CD2 4.14Å; Q1214-F1223 HydrophobicContact CB-CE2 3.94Å; I1221-F1223 HydrophobicContact CB-CE2 4.38Å; I1221-F1223 HydrophobicContact CG2-CD2 4.5Å; I1221-F1223 HydrophobicContact CG2-CE2 3.91Å; I1221-F1223 HydrophobicContact CG2-CZ 3.94Å
1224	V	90	Very high	87.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.3	179.6	179.4	0	0	0	0	108.2	L1093 I1094 V1096 I1114 V1208 V1211 I1222 V1232	L1093-V1224 CarbonylContact C-O 3.53Å; L1093-V1224 WeakPolarHBondContact CA-O 3.38Å; I1094-V1224 HydrophobicContact CB-CB 4.17Å; I1094-V1224 PolarHBondContact N-O 3.38Å; I1094-V1224 PolarHBondContact O-N 2.68Å; V1096-V1224 HydrophobicContact CG2-CG2 3.86Å; I1114-V1224 HydrophobicContact CD1-CG2 3.92Å; I1114-V1224 HydrophobicContact CG2-CB 4.44Å; I1114-V1224 HydrophobicContact CG2-CG1 3.67Å; I1114-V1224 HydrophobicContact CG2-CG2 3.87Å; V1208-V1224 HydrophobicContact CB-CG1 4.37Å; V1208-V1224 HydrophobicContact CG1-CG1 3.67Å; V1208-V1224 HydrophobicContact CG2-CG1 3.72Å; V1211-V1224 HydrophobicContact CG1-CG2 4.11Å; V1211-V1224 HydrophobicContact CG2-CG1 4.24Å; V1211-V1224 HydrophobicContact CG2-CG2 4.26Å; I1222-V1224 HydrophobicContact CG2-CG2 4.07Å; V1224-V1232 HydrophobicContact CG1-CG2 4.5Å
1225	E	88.9	Confident	87.7	Confident	53 Å²	53	58.6 Å²	58.6	25%	0.248	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	109.2	172.7	-170	-172.2	-166.9	0	0	109.2	M1070 P1092 V1208 S1209 R1210	M1070-E1225 HydrophobicContact CE-CB 3.9Å; P1092-E1225 CarbonylContact O-C 3.27Å; P1092-E1225 VanDerWaalsContact O-CA 3.26Å; P1092-E1225 WeakPolarHBondContact O-CA 3.28Å; V1208-E1225 CarbonylContact C-O 3.54Å; V1208-E1225 WeakPolarHBondContact CA-O 3.48Å; S1209-E1225 PolarHBondContact N-O 3.42Å; S1209-E1225 VanDerWaalsContact OG-CB 3.29Å; S1209-E1225 WeakPolarHBondContact OG-CB 3.37Å; S1209-E1225 WeakPolarHBondContact OG-CG 3.45Å; S1209-E1225 PolarHBondContact OG-O 3.31Å; S1209-E1225 VanDerWaalsContact OG-O 3.11Å; S1209-E1225 PolarHBondContact OG-OE2 2.85Å; R1210-E1225 HydrophobicContact CB-CB 4.42Å; R1210-E1225 PolarHBondContact O-N 3.41Å
1226	G	87.5	Confident	88.1	Confident	3 Å²	3	57.9 Å²	57.9	3%	0.031	30%	0.295	C	S	.	.	S	Bend	trans	159.4	162.8	-175.2	0	0	0	0	0	112.9	P1092 I1094	P1092-G1226 PolarHBondContact O-N 2.87Å; I1094-G1226 WeakPolarHBondContact CD1-O 3.31Å
1227	A	85.2	Confident	88.8	Confident	42 Å²	42	54.7 Å²	54.7	35%	0.347	28%	0.282	S	S	.	.	S	Bend	trans	-114	70.1	178.5	0	0	0	0	0	110.3	P1092 E1250	P1092-A1227 HydrophobicContact CB-CB 4.24Å; A1227-E1250 WeakPolarHBondContact CA-OE1 3.4Å; A1227-E1250 WeakPolarHBondContact CA-OE2 3.38Å
1228	R	91.4	Very high	89.5	Confident	104 Å²	104	45.6 Å²	45.6	39%	0.392	24%	0.244	S	C	.	.			trans	-139.1	44.7	178.2	-65.3	-65.5	-159	178.3	7.4	113.7	I1205 P1206 R1230 E1231 V1232 E1250	I1205-R1228 HydrophobicContact CG2-CB 3.55Å; I1205-R1228 HydrophobicContact CG2-CG 3.56Å; P1206-R1228 PolarHBondContact O-NE 2.97Å; P1206-R1228 PolarHBondContact O-NH2 2.93Å; R1228-R1230 VanDerWaalsContact C-N 3.33Å; R1228-R1230 PolarHBondContact O-N 3.38Å; R1228-E1231 HydrophobicContact CB-CB 4.43Å; R1228-E1231 WeakPolarHBondContact CD-OE1 3.45Å; R1228-E1231 IonicContact CZ-OE1 2.76Å; R1228-E1231 IonicContact NE-OE1 3.45Å; R1228-E1231 IonicContact NH1-OE1 2.68Å; R1228-E1231 PolarHBondContact O-N 3.29Å; R1228-V1232 WeakPolarHBondContact O-CG2 3.49Å; R1228-V1232 PolarHBondContact O-N 3.23Å; R1228-V1232 VanDerWaalsContact O-N 3.08Å; R1228-E1250 WeakPolarHBondContact CA-OE1 3.3Å; R1228-E1250 PolarHBondContact N-OE1 3.31Å
1229	L	93.1	Very high	90.2	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-49.1	-48.2	-176.1	-178	60.1	0	0	0	113.1	I1094 E1231 V1232 M1233 T1243 E1250 V1251 V1254 L1255	I1094-L1229 HydrophobicContact CD1-CB 4.43Å; I1094-L1229 HydrophobicContact CG2-CD1 4Å; L1229-E1231 VanDerWaalsContact C-N 3.3Å; L1229-E1231 PolarHBondContact O-N 3.42Å; L1229-V1232 PolarHBondContact O-N 2.82Å; L1229-M1233 HydrophobicContact CD1-CG 3.99Å; L1229-M1233 HydrophobicContact CD1-SD 3.91Å; L1229-M1233 HydrophobicContact CD2-SD 4.42Å; L1229-M1233 HydrophobicContact CG-CG 4.34Å; L1229-M1233 HydrophobicContact CG-SD 3.8Å; L1229-M1233 VanDerWaalsContact O-CG 3.27Å; L1229-M1233 WeakPolarHBondContact O-CG 3.23Å; L1229-M1233 PolarHBondContact O-N 2.73Å; L1229-T1243 HydrophobicContact CD1-CG2 4.08Å; L1229-E1250 HydrophobicContact CB-CG 3.87Å; L1229-E1250 WeakPolarHBondContact CB-OE1 3.28Å; L1229-E1250 PolarHBondContact N-OE1 3.47Å; L1229-V1251 HydrophobicContact CD2-CG2 3.92Å; L1229-V1254 HydrophobicContact CD2-CB 4.44Å; L1229-L1255 HydrophobicContact CD2-CD1 4.48Å
1230	R	94	Very high	90.5	Very high	151 Å²	151	43.1 Å²	43.1	57%	0.57	23%	0.233	S	C	*	.	H	α-helix	trans	-57.7	-43.3	179.9	-174.8	-179.4	-64.7	175.8	0.7	112.4	R1228 C1234 Q1253 V1254	R1228-R1230 VanDerWaalsContact C-N 3.33Å; R1228-R1230 PolarHBondContact O-N 3.38Å; R1230-C1234 PolarHBondContact O-N 3.41Å; R1230-C1234 PolarHBondContact O-SG 2.98Å; R1230-Q1253 PolarHBondContact NH2-O 3.32Å; R1230-V1254 HydrophobicContact CB-CG1 4.11Å; R1230-V1254 HydrophobicContact CB-CG2 3.92Å
1231	E	93	Very high	90.7	Very high	76 Å²	76	50 Å²	50	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-72.1	-39.1	-177.7	-64	172.6	-145.4	0	0	110.5	I1205 R1228 L1229 C1234	I1205-E1231 HydrophobicContact CD1-CB 3.64Å; I1205-E1231 HydrophobicContact CG1-CB 4.02Å; I1205-E1231 HydrophobicContact CG2-CB 4.36Å; I1205-E1231 VanDerWaalsContact CG2-OE2 3.23Å; I1205-E1231 WeakPolarHBondContact CG2-OE2 3.27Å; R1228-E1231 HydrophobicContact CB-CB 4.43Å; R1228-E1231 WeakPolarHBondContact CD-OE1 3.45Å; R1228-E1231 IonicContact CZ-OE1 2.76Å; R1228-E1231 IonicContact NE-OE1 3.45Å; R1228-E1231 IonicContact NH1-OE1 2.68Å; R1228-E1231 PolarHBondContact O-N 3.29Å; L1229-E1231 VanDerWaalsContact C-N 3.3Å; L1229-E1231 PolarHBondContact O-N 3.42Å; E1231-C1234 PolarHBondContact O-N 3.44Å
1232	V	93.1	Very high	90.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.1	-41.2	177.5	175.5	0	0	0	0	111.9	I1094 V1096 I1114 I1205 V1224 R1228 L1229 C1234 I1235	I1094-V1232 HydrophobicContact CD1-CG2 4.05Å; I1094-V1232 HydrophobicContact CG2-CG1 4.19Å; V1096-V1232 HydrophobicContact CG2-CG1 3.46Å; V1096-V1232 VanDerWaalsContact CG2-CG1 3.46Å; I1114-V1232 HydrophobicContact CD1-CG1 4.16Å; I1114-V1232 HydrophobicContact CG2-CG2 4.32Å; I1205-V1232 HydrophobicContact CD1-CB 4.47Å; I1205-V1232 HydrophobicContact CD1-CG2 3.68Å; V1224-V1232 HydrophobicContact CG1-CG2 4.5Å; R1228-V1232 WeakPolarHBondContact O-CG2 3.49Å; R1228-V1232 PolarHBondContact O-N 3.23Å; R1228-V1232 VanDerWaalsContact O-N 3.08Å; L1229-V1232 PolarHBondContact O-N 2.82Å; V1232-C1234 PolarHBondContact O-N 3.07Å; V1232-I1235 PolarHBondContact O-N 3.23Å
1233	M	93.1	Very high	91	Very high	37 Å²	37	56.5 Å²	56.5	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-24.4	179.2	-71.5	176.2	70.7	0	0	113.4	L1229 I1235 A1240 T1243 V1254 L1255	L1229-M1233 HydrophobicContact CD1-CG 3.99Å; L1229-M1233 HydrophobicContact CD1-SD 3.91Å; L1229-M1233 HydrophobicContact CD2-SD 4.42Å; L1229-M1233 HydrophobicContact CG-CG 4.34Å; L1229-M1233 HydrophobicContact CG-SD 3.8Å; L1229-M1233 VanDerWaalsContact O-CG 3.27Å; L1229-M1233 WeakPolarHBondContact O-CG 3.23Å; L1229-M1233 PolarHBondContact O-N 2.73Å; M1233-I1235 VanDerWaalsContact C-N 3.31Å; M1233-A1240 HydrophobicContact CB-CB 4.36Å; M1233-A1240 HydrophobicContact CE-CB 3.78Å; M1233-A1240 WeakPolarHBondContact CE-O 3.45Å; M1233-T1243 HydrophobicContact CG-CG2 4.21Å; M1233-V1254 HydrophobicContact SD-CG1 4.38Å; M1233-L1255 HydrophobicContact CE-CD2 4.08Å; M1233-L1255 HydrophobicContact SD-CD2 4.36Å
1234	C	92.2	Very high	91.2	Very high	103 Å²	103	62.6 Å²	62.6	70%	0.696	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-2.1	179.9	-67.2	0	0	0	0	113.6	R1230 E1231 V1232	R1230-C1234 PolarHBondContact O-N 3.41Å; R1230-C1234 PolarHBondContact O-SG 2.98Å; E1231-C1234 PolarHBondContact O-N 3.44Å; V1232-C1234 PolarHBondContact O-N 3.07Å
1235	I	91.2	Very high	91.4	Very high	20 Å²	20	63 Å²	63	10%	0.103	31%	0.312	C	S	.	.	S	Bend	trans	-78.9	130.5	-176.1	-71.2	172.4	0	0	0	110.7	V1110 I1114 I1205 V1232 M1233 G1237 V1238	V1110-I1235 HydrophobicContact CG1-CG2 4.37Å; I1114-I1235 HydrophobicContact CB-CD1 4.31Å; I1114-I1235 HydrophobicContact CD1-CD1 4.25Å; I1114-I1235 HydrophobicContact CG1-CD1 3.27Å; I1205-I1235 HydrophobicContact CD1-CD1 3.74Å; V1232-I1235 PolarHBondContact O-N 3.23Å; M1233-I1235 VanDerWaalsContact C-N 3.31Å; I1235-G1237 PolarHBondContact O-N 3.25Å; I1235-V1238 HydrophobicContact CB-CG2 4.09Å; I1235-V1238 HydrophobicContact CG2-CG2 4.2Å; I1235-V1238 WeakPolarHBondContact O-CB 3.31Å; I1235-V1238 PolarHBondContact O-N 3.21Å; I1235-V1238 VanDerWaalsContact O-N 3.16Å
1236	P	89.8	Confident	91.6	Very high	114 Å²	114	60.9 Å²	60.9	74%	0.74	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	132.4	175.2	-24.4	33.8	0	0	0	112.1
1237	G	88.9	Confident	91.9	Very high	16 Å²	16	61.1 Å²	61.1	17%	0.165	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	94	-4.1	-177	0	0	0	0	0	114.7	L1098 T1099 I1235	L1098-G1237 WeakPolarHBondContact CA-O 3.43Å; T1099-G1237 PolarHBondContact N-O 3.41Å; I1235-G1237 PolarHBondContact O-N 3.25Å
1238	V	92.7	Very high	92.3	Very high	15 Å²	15	59.5 Å²	59.5	9%	0.091	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-94.7	133.7	171.6	175.8	0	0	0	0	110.3	V1096 V1110 I1235 A1240 T1243	V1096-V1238 HydrophobicContact CG1-CB 4.23Å; V1096-V1238 HydrophobicContact CG1-CG1 3.72Å; V1096-V1238 HydrophobicContact CG1-CG2 3.62Å; V1110-V1238 HydrophobicContact CG1-CG2 3.63Å; I1235-V1238 HydrophobicContact CB-CG2 4.09Å; I1235-V1238 HydrophobicContact CG2-CG2 4.2Å; I1235-V1238 WeakPolarHBondContact O-CB 3.31Å; I1235-V1238 PolarHBondContact O-N 3.21Å; I1235-V1238 VanDerWaalsContact O-N 3.16Å; V1238-A1240 PolarHBondContact O-N 2.95Å; V1238-T1243 VanDerWaalsContact CG1-OG1 3.26Å; V1238-T1243 WeakPolarHBondContact CG1-OG1 3.04Å
1239	V	93.2	Very high	92.4	Very high	31 Å²	31	56 Å²	56	19%	0.188	28%	0.278	C	S	.	.			trans	-85.3	102.8	170.4	-178.5	0	0	0	0	108.4	T1097 T1099 E1241 R1242 T1243	T1097-V1239 HydrophobicContact CG2-CB 4.47Å; T1097-V1239 PolarHBondContact O-N 3.38Å; T1099-V1239 HydrophobicContact CG2-CG2 3.81Å; V1239-E1241 VanDerWaalsContact C-N 3.32Å; V1239-E1241 WeakPolarHBondContact CG1-OE2 3.34Å; V1239-E1241 PolarHBondContact O-N 2.95Å; V1239-R1242 HydrophobicContact CB-CB 4.49Å; V1239-R1242 HydrophobicContact CG1-CB 4.05Å; V1239-R1242 HydrophobicContact CG1-CG 4.02Å; V1239-R1242 PolarHBondContact O-N 3.34Å; V1239-T1243 PolarHBondContact O-N 2.93Å; V1239-T1243 PolarHBondContact O-OG1 3.31Å
1240	A	90.7	Very high	92.4	Very high	33 Å²	33	56.9 Å²	56.9	27%	0.273	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-60.4	-40.5	-175.6	0	0	0	0	0	112	M1233 V1238 R1242 T1243	M1233-A1240 HydrophobicContact CB-CB 4.36Å; M1233-A1240 HydrophobicContact CE-CB 3.78Å; M1233-A1240 WeakPolarHBondContact CE-O 3.45Å; V1238-A1240 PolarHBondContact O-N 2.95Å; A1240-R1242 PolarHBondContact O-N 3.24Å; A1240-T1243 PolarHBondContact O-N 3.35Å
1241	E	91	Very high	92.5	Very high	168 Å²	168	49.8 Å²	49.8	79%	0.785	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-67.1	-21.9	-176	-55.7	85.5	172.7	0	0	113.6	V1239	V1239-E1241 VanDerWaalsContact C-N 3.32Å; V1239-E1241 WeakPolarHBondContact CG1-OE2 3.34Å; V1239-E1241 PolarHBondContact O-N 2.95Å
1242	R	90.7	Very high	92.6	Very high	172 Å²	172	48.1 Å²	48.1	65%	0.649	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-108.1	-4.6	-179.1	-65	-172.9	179	-171.3	1.1	113.4	T1097 V1239 A1240	T1097-R1242 HydrophobicContact CG2-CB 4.08Å; T1097-R1242 PolarHBondContact OG1-O 3.41Å; V1239-R1242 HydrophobicContact CB-CB 4.49Å; V1239-R1242 HydrophobicContact CG1-CB 4.05Å; V1239-R1242 HydrophobicContact CG1-CG 4.02Å; V1239-R1242 PolarHBondContact O-N 3.34Å; A1240-R1242 PolarHBondContact O-N 3.24Å
1243	T	92.5	Very high	92.7	Very high	9 Å²	9	54.9 Å²	54.9	6%	0.055	28%	0.279	C	S	.	.			trans	-78.4	130.8	178.5	-64.8	0	0	0	0	110.3	I1094 C1095 V1096 L1229 M1233 V1238 V1239 A1240	I1094-T1243 HydrophobicContact CG2-CG2 3.78Å; C1095-T1243 WeakPolarHBondContact O-CA 3.49Å; V1096-T1243 HydrophobicContact CG2-CG2 4.18Å; L1229-T1243 HydrophobicContact CD1-CG2 4.08Å; M1233-T1243 HydrophobicContact CG-CG2 4.21Å; V1238-T1243 VanDerWaalsContact CG1-OG1 3.26Å; V1238-T1243 WeakPolarHBondContact CG1-OG1 3.04Å; V1239-T1243 PolarHBondContact O-N 2.93Å; V1239-T1243 PolarHBondContact O-OG1 3.31Å; A1240-T1243 PolarHBondContact O-N 3.35Å
1244	R	93.5	Very high	92.8	Very high	167 Å²	167	55.1 Å²	55.1	63%	0.63	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.3	-173.2	-57.9	-176.3	-177	-148.7	1	111.2	I1094 C1095	I1094-R1244 CarbonylContact C-O 3.51Å; I1094-R1244 VanDerWaalsContact CA-O 3.26Å; I1094-R1244 WeakPolarHBondContact CA-O 3.36Å; I1094-R1244 WeakPolarHBondContact CG2-O 3.37Å; C1095-R1244 PolarHBondContact N-O 3.13Å; C1095-R1244 PolarHBondContact O-N 2.95Å
1245	S	93	Very high	92.9	Very high	7 Å²	7	54.5 Å²	54.5	5%	0.049	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.9	171.3	177.7	0	0	0	0	110.1	L1093 N1247 E1250	L1093-S1245 WeakPolarHBondContact O-CA 3.47Å; S1245-N1247 VanDerWaalsContact C-N 3.33Å; S1245-N1247 PolarHBondContact OG-N 3.37Å; S1245-E1250 PolarHBondContact OG-OE2 3.04Å
1246	N	92.9	Very high	93.1	Very high	9 Å²	9	55 Å²	55	5%	0.048	28%	0.281	C	S	.	.	S	Bend	trans	-88.1	0.4	174.7	77.2	-11.7	0	0	0	113.1	R1078 I1089 T1091 P1092 L1093 E1267	R1078-N1246 PolarHBondContact NH2-O 3.03Å; I1089-N1246 WeakPolarHBondContact CD1-OD1 3.34Å; T1091-N1246 PolarHBondContact O-ND2 3.43Å; T1091-N1246 VanDerWaalsContact O-ND2 3.08Å; P1092-N1246 WeakPolarHBondContact CA-OD1 3.34Å; L1093-N1246 PolarHBondContact N-OD1 3.29Å; L1093-N1246 PolarHBondContact O-N 3.48Å; L1093-N1246 PolarHBondContact O-OD1 3.1Å; N1246-E1267 WeakPolarHBondContact CB-OE1 3.47Å
1247	N	93.7	Very high	93.4	Very high	8 Å²	8	51.7 Å²	51.7	4%	0.043	26%	0.259	C	S	.	.			trans	-94.6	104.8	177.6	-173.1	-10.7	0	0	0	111.3	I1089 S1245 L1249 E1250 V1251	I1089-N1247 HydrophobicContact CD1-CB 3.89Å; S1245-N1247 VanDerWaalsContact C-N 3.33Å; S1245-N1247 PolarHBondContact OG-N 3.37Å; N1247-L1249 PolarHBondContact O-N 3.35Å; N1247-L1249 PolarHBondContact OD1-N 3.11Å; N1247-E1250 HydrophobicContact CB-CB 3.93Å; N1247-E1250 PolarHBondContact O-N 2.86Å; N1247-V1251 WeakPolarHBondContact O-CG2 3.35Å; N1247-V1251 PolarHBondContact O-N 2.99Å
1248	I	94.9	Very high	93.7	Very high	9 Å²	9	56.5 Å²	56.5	5%	0.046	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-46.6	-171.8	-60	152.9	0	0	0	112.5	I1082 E1250 V1251 E1252 A1260 V1263 V1264 V1297	I1082-I1248 HydrophobicContact CB-CD1 4.2Å; I1082-I1248 HydrophobicContact CG1-CD1 4.28Å; I1082-I1248 HydrophobicContact CG2-CD1 3.81Å; I1248-E1250 VanDerWaalsContact C-N 3.29Å; I1248-E1250 PolarHBondContact O-N 3.02Å; I1248-V1251 PolarHBondContact O-N 2.62Å; I1248-E1252 PolarHBondContact O-N 3.27Å; I1248-A1260 HydrophobicContact CG2-CB 4.08Å; I1248-V1263 HydrophobicContact CG1-CG1 4.08Å; I1248-V1264 HydrophobicContact CD1-CG2 3.79Å; I1248-V1264 HydrophobicContact CG1-CG2 3.95Å; I1248-V1264 HydrophobicContact CG2-CG2 3.77Å; I1248-V1297 HydrophobicContact CG2-CG1 3.95Å; I1248-V1297 HydrophobicContact CG2-CG2 4.15Å
1249	L	93.3	Very high	93.9	Very high	30 Å²	30	57.3 Å²	57.3	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-71.8	-26.9	-177.1	-69.9	177.6	0	0	0	112.4	A1085 A1087 N1247 E1252 Q1253 V1297	A1085-L1249 VanDerWaalsContact O-CD1 3.23Å; A1085-L1249 WeakPolarHBondContact O-CD1 3.49Å; A1087-L1249 HydrophobicContact CB-CD1 3.8Å; N1247-L1249 PolarHBondContact O-N 3.35Å; N1247-L1249 PolarHBondContact OD1-N 3.11Å; L1249-E1252 WeakPolarHBondContact CD2-OE2 3.32Å; L1249-Q1253 WeakPolarHBondContact O-CG 3.1Å; L1249-Q1253 PolarHBondContact O-N 2.9Å; L1249-V1297 HydrophobicContact CD2-CB 3.96Å; L1249-V1297 HydrophobicContact CD2-CG1 4.34Å
1250	E	93.6	Very high	94	Very high	19 Å²	19	55.8 Å²	55.8	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-70.5	-43.9	171.2	175.4	173.8	-142	0	0	111.2	A1227 R1228 L1229 S1245 N1247 I1248 E1252 Q1253 V1254	A1227-E1250 WeakPolarHBondContact CA-OE1 3.4Å; A1227-E1250 WeakPolarHBondContact CA-OE2 3.38Å; R1228-E1250 WeakPolarHBondContact CA-OE1 3.3Å; R1228-E1250 PolarHBondContact N-OE1 3.31Å; L1229-E1250 HydrophobicContact CB-CG 3.87Å; L1229-E1250 WeakPolarHBondContact CB-OE1 3.28Å; L1229-E1250 PolarHBondContact N-OE1 3.47Å; S1245-E1250 PolarHBondContact OG-OE2 3.04Å; N1247-E1250 HydrophobicContact CB-CB 3.93Å; N1247-E1250 PolarHBondContact O-N 2.86Å; I1248-E1250 VanDerWaalsContact C-N 3.29Å; I1248-E1250 PolarHBondContact O-N 3.02Å; E1250-E1252 VanDerWaalsContact C-N 3.32Å; E1250-E1252 PolarHBondContact O-N 2.81Å; E1250-Q1253 PolarHBondContact O-N 2.71Å; E1250-V1254 WeakPolarHBondContact O-CG2 3.44Å; E1250-V1254 PolarHBondContact O-N 2.89Å
1251	V	95.3	Very high	94.3	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-42.9	176.3	172.3	0	0	0	0	110.7	L1229 N1247 I1248 Q1253 V1254 L1255 G1256 A1259 A1260 V1263	L1229-V1251 HydrophobicContact CD2-CG2 3.92Å; N1247-V1251 WeakPolarHBondContact O-CG2 3.35Å; N1247-V1251 PolarHBondContact O-N 2.99Å; I1248-V1251 PolarHBondContact O-N 2.62Å; V1251-Q1253 VanDerWaalsContact C-N 3.32Å; V1251-Q1253 PolarHBondContact O-N 3.44Å; V1251-V1254 PolarHBondContact O-N 3.23Å; V1251-L1255 HydrophobicContact CG1-CB 4.36Å; V1251-L1255 HydrophobicContact CG1-CD1 4.33Å; V1251-L1255 WeakPolarHBondContact O-CA 3.36Å; V1251-L1255 PolarHBondContact O-N 3.03Å; V1251-G1256 PolarHBondContact O-N 3.3Å; V1251-A1259 HydrophobicContact CG1-CB 3.78Å; V1251-A1260 HydrophobicContact CG1-CB 4.41Å; V1251-V1263 HydrophobicContact CG1-CG2 4.07Å; V1251-V1263 HydrophobicContact CG2-CG2 4.22Å
1252	E	95.5	Very high	94.5	Very high	40 Å²	40	54.4 Å²	54.4	19%	0.187	26%	0.257	C	S	.	.	H	α-helix	trans	-55.4	-46.3	173.9	-178.3	-169.3	-159.8	0	0	111.8	I1248 L1249 E1250 V1254 G1256 A1260 E1296 V1297	I1248-E1252 PolarHBondContact O-N 3.27Å; L1249-E1252 WeakPolarHBondContact CD2-OE2 3.32Å; E1250-E1252 VanDerWaalsContact C-N 3.32Å; E1250-E1252 PolarHBondContact O-N 2.81Å; E1252-V1254 VanDerWaalsContact C-N 3.33Å; E1252-V1254 PolarHBondContact O-N 3.04Å; E1252-G1256 WeakPolarHBondContact O-CA 3.41Å; E1252-G1256 PolarHBondContact O-N 3.11Å; E1252-A1260 HydrophobicContact CB-CB 3.87Å; E1252-E1296 VanDerWaalsContact OE1-CA 3.23Å; E1252-E1296 WeakPolarHBondContact OE1-CA 3.26Å; E1252-V1297 HydrophobicContact CB-CG2 4.16Å; E1252-V1297 HydrophobicContact CG-CG2 4.06Å; E1252-V1297 PolarHBondContact OE1-N 3.16Å
1253	Q	94.4	Very high	94.7	Very high	142 Å²	142	47.3 Å²	47.3	66%	0.664	23%	0.233	S	C	*	.	H	α-helix	trans	-70.7	-25.1	-178.2	-72.9	171.6	16.4	0	0	114.1	R1230 L1249 E1250 V1251	R1230-Q1253 PolarHBondContact NH2-O 3.32Å; L1249-Q1253 WeakPolarHBondContact O-CG 3.1Å; L1249-Q1253 PolarHBondContact O-N 2.9Å; E1250-Q1253 PolarHBondContact O-N 2.71Å; V1251-Q1253 VanDerWaalsContact C-N 3.32Å; V1251-Q1253 PolarHBondContact O-N 3.44Å
1254	V	94.8	Very high	94.9	Very high	42 Å²	42	46.9 Å²	46.9	26%	0.255	23%	0.23	S	C	.	.	H	α-helix	trans	-100.7	-44.8	-175.7	-179.9	0	0	0	0	112	L1229 R1230 M1233 E1250 V1251 E1252	L1229-V1254 HydrophobicContact CD2-CB 4.44Å; R1230-V1254 HydrophobicContact CB-CG1 4.11Å; R1230-V1254 HydrophobicContact CB-CG2 3.92Å; M1233-V1254 HydrophobicContact SD-CG1 4.38Å; E1250-V1254 WeakPolarHBondContact O-CG2 3.44Å; E1250-V1254 PolarHBondContact O-N 2.89Å; V1251-V1254 PolarHBondContact O-N 3.23Å; E1252-V1254 VanDerWaalsContact C-N 3.33Å; E1252-V1254 PolarHBondContact O-N 3.04Å
1255	L	95.4	Very high	95	Very high	91 Å²	91	39.1 Å²	39.1	48%	0.476	20%	0.201	S	C	.	.	H	α-helix	trans	-113.7	-10.7	-171.8	-58	-179.1	0	0	0	113.6	L1229 M1233 V1251 A1259	L1229-L1255 HydrophobicContact CD2-CD1 4.48Å; M1233-L1255 HydrophobicContact CE-CD2 4.08Å; M1233-L1255 HydrophobicContact SD-CD2 4.36Å; V1251-L1255 HydrophobicContact CG1-CB 4.36Å; V1251-L1255 HydrophobicContact CG1-CD1 4.33Å; V1251-L1255 WeakPolarHBondContact O-CA 3.36Å; V1251-L1255 PolarHBondContact O-N 3.03Å; L1255-A1259 HydrophobicContact CB-CB 3.56Å; L1255-A1259 HydrophobicContact CD1-CB 4.35Å
1256	G	95.6	Very high	95	Very high	29 Å²	29	40.9 Å²	40.9	30%	0.299	21%	0.21	S	C	.	.			trans	95.5	175.7	179.5	0	0	0	0	0	114.4	V1251 E1252 E1258 A1259 A1260	V1251-G1256 PolarHBondContact O-N 3.3Å; E1252-G1256 WeakPolarHBondContact O-CA 3.41Å; E1252-G1256 PolarHBondContact O-N 3.11Å; G1256-E1258 PolarHBondContact O-N 3.18Å; G1256-A1259 PolarHBondContact O-N 2.94Å; G1256-A1260 PolarHBondContact O-N 3.27Å
1257	V	95.7	Very high	95	Very high	45 Å²	45	42.6 Å²	42.6	27%	0.273	22%	0.218	S	C	.	.	H	α-helix	trans	-67.7	-34.4	-169.1	70.2	0	0	0	0	113.7	A1260 R1261 T1292	V1257-A1260 WeakPolarHBondContact O-CB 3.44Å; V1257-A1260 PolarHBondContact O-N 3.49Å; V1257-R1261 PolarHBondContact O-N 3.06Å; V1257-T1292 HydrophobicContact CG2-CG2 3.82Å
1258	E	95.8	Very high	94.8	Very high	117 Å²	117	42.2 Å²	42.2	55%	0.547	22%	0.216	S	C	.	.	H	α-helix	trans	-72.3	-34.6	-178.8	-166.8	57.5	-155.4	0	0	112.2	G1256 A1260 R1261 R1262	G1256-E1258 PolarHBondContact O-N 3.18Å; E1258-A1260 VanDerWaalsContact C-N 3.34Å; E1258-R1261 WeakPolarHBondContact O-CB 3.49Å; E1258-R1261 PolarHBondContact O-N 3.4Å; E1258-R1261 WeakPolarHBondContact OE1-CD 3.34Å; E1258-R1261 IonicContact OE1-CZ 3.63Å; E1258-R1261 IonicContact OE1-NE 2.98Å; E1258-R1261 IonicContact OE1-NH1 3.57Å; E1258-R1261 PolarHBondContact OE1-NH1 3.35Å; E1258-R1261 VanDerWaalsContact OE1-NH1 3.1Å; E1258-R1261 WeakPolarHBondContact OE2-CD 3.46Å; E1258-R1262 PolarHBondContact O-N 2.95Å; E1258-R1262 VanDerWaalsContact O-N 3.09Å
1259	A	95.7	Very high	94.6	Very high	32 Å²	32	43.2 Å²	43.2	26%	0.264	22%	0.221	S	C	.	.	H	α-helix	trans	-64.6	-41.7	170	0	0	0	0	0	110.8	V1251 L1255 G1256 R1261 R1262 V1263	V1251-A1259 HydrophobicContact CG1-CB 3.78Å; L1255-A1259 HydrophobicContact CB-CB 3.56Å; L1255-A1259 HydrophobicContact CD1-CB 4.35Å; G1256-A1259 PolarHBondContact O-N 2.94Å; A1259-R1261 VanDerWaalsContact C-N 3.33Å; A1259-R1261 PolarHBondContact O-N 3.28Å; A1259-R1262 PolarHBondContact O-N 3.4Å; A1259-V1263 WeakPolarHBondContact O-CG2 3.48Å; A1259-V1263 PolarHBondContact O-N 3.24Å; A1259-V1263 VanDerWaalsContact O-N 3.08Å
1260	A	96.2	Very high	94.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-40.4	176	0	0	0	0	0	111.9	I1248 V1251 E1252 G1256 V1257 E1258 R1262 V1263 V1264 V1297	I1248-A1260 HydrophobicContact CG2-CB 4.08Å; V1251-A1260 HydrophobicContact CG1-CB 4.41Å; E1252-A1260 HydrophobicContact CB-CB 3.87Å; G1256-A1260 PolarHBondContact O-N 3.27Å; V1257-A1260 WeakPolarHBondContact O-CB 3.44Å; V1257-A1260 PolarHBondContact O-N 3.49Å; E1258-A1260 VanDerWaalsContact C-N 3.34Å; A1260-R1262 PolarHBondContact O-N 3.41Å; A1260-V1263 PolarHBondContact O-N 3.35Å; A1260-V1264 WeakPolarHBondContact O-CG2 3.26Å; A1260-V1264 PolarHBondContact O-N 3.43Å; A1260-V1297 HydrophobicContact CB-CG2 3.84Å
1261	R	96.4	Very high	94	Very high	32 Å²	32	44 Å²	44	12%	0.121	23%	0.234	C	C	.	.	H	α-helix	trans	-56.8	-48.4	173.5	-175.7	-171.5	168.4	-101.9	-1.9	111.6	V1257 E1258 A1259 V1263 V1264 I1265 A1288 D1289 T1292	V1257-R1261 PolarHBondContact O-N 3.06Å; E1258-R1261 WeakPolarHBondContact O-CB 3.49Å; E1258-R1261 PolarHBondContact O-N 3.4Å; E1258-R1261 WeakPolarHBondContact OE1-CD 3.34Å; E1258-R1261 IonicContact OE1-CZ 3.63Å; E1258-R1261 IonicContact OE1-NE 2.98Å; E1258-R1261 IonicContact OE1-NH1 3.57Å; E1258-R1261 PolarHBondContact OE1-NH1 3.35Å; E1258-R1261 VanDerWaalsContact OE1-NH1 3.1Å; E1258-R1261 WeakPolarHBondContact OE2-CD 3.46Å; A1259-R1261 VanDerWaalsContact C-N 3.33Å; A1259-R1261 PolarHBondContact O-N 3.28Å; R1261-V1263 VanDerWaalsContact C-N 3.33Å; R1261-V1263 PolarHBondContact O-N 2.87Å; R1261-V1264 WeakPolarHBondContact O-CB 3.38Å; R1261-V1264 PolarHBondContact O-N 2.91Å; R1261-I1265 HydrophobicContact CG-CD1 4.44Å; R1261-I1265 WeakPolarHBondContact O-CG1 3.25Å; R1261-I1265 PolarHBondContact O-N 2.98Å; R1261-A1288 HydrophobicContact CG-CB 3.96Å; R1261-D1289 IonicContact CZ-OD1 3.66Å; R1261-D1289 IonicContact CZ-OD2 3.23Å; R1261-D1289 IonicContact NE-OD1 3.31Å; R1261-D1289 PolarHBondContact NE-OD1 3.16Å; R1261-D1289 IonicContact NE-OD2 2.84Å; R1261-D1289 VanDerWaalsContact NH2-CG 3.3Å; R1261-D1289 IonicContact NH2-OD1 3.11Å; R1261-D1289 PolarHBondContact NH2-OD1 3.08Å; R1261-D1289 IonicContact NH2-OD2 2.78Å; R1261-D1289 PolarHBondContact NH2-OD2 3.19Å; R1261-T1292 HydrophobicContact CB-CG2 4Å; R1261-T1292 HydrophobicContact CG-CG2 4.47Å
1262	R	95.7	Very high	93.5	Very high	139 Å²	139	44 Å²	44	53%	0.525	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-41.7	178.4	-179.4	62.3	-165	-168.3	6.6	112.1	E1258 A1259 A1260 V1264 I1265 D1266	E1258-R1262 PolarHBondContact O-N 2.95Å; E1258-R1262 VanDerWaalsContact O-N 3.09Å; A1259-R1262 PolarHBondContact O-N 3.4Å; A1260-R1262 PolarHBondContact O-N 3.41Å; R1262-V1264 VanDerWaalsContact C-N 3.33Å; R1262-V1264 PolarHBondContact O-N 3.02Å; R1262-I1265 PolarHBondContact O-N 3.33Å; R1262-I1265 VanDerWaalsContact O-N 3.16Å; R1262-D1266 IonicContact CZ-OD1 2.8Å; R1262-D1266 IonicContact CZ-OD2 3.64Å; R1262-D1266 VanDerWaalsContact NE-CG 3.28Å; R1262-D1266 IonicContact NE-OD1 2.98Å; R1262-D1266 PolarHBondContact NE-OD1 2.94Å; R1262-D1266 IonicContact NE-OD2 3.45Å; R1262-D1266 PolarHBondContact NE-OD2 2.87Å; R1262-D1266 IonicContact NH2-OD1 3.22Å; R1262-D1266 PolarHBondContact NH2-OD1 3.47Å; R1262-D1266 IonicContact NH2-OD2 3.51Å; R1262-D1266 PolarHBondContact O-N 3.25Å
1263	V	95.4	Very high	92.9	Very high	23 Å²	23	48.4 Å²	48.4	14%	0.139	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-39.8	177.2	172	0	0	0	0	111.5	I1248 V1251 A1259 A1260 R1261 I1265 D1266 E1267	I1248-V1263 HydrophobicContact CG1-CG1 4.08Å; V1251-V1263 HydrophobicContact CG1-CG2 4.07Å; V1251-V1263 HydrophobicContact CG2-CG2 4.22Å; A1259-V1263 WeakPolarHBondContact O-CG2 3.48Å; A1259-V1263 PolarHBondContact O-N 3.24Å; A1259-V1263 VanDerWaalsContact O-N 3.08Å; A1260-V1263 PolarHBondContact O-N 3.35Å; R1261-V1263 VanDerWaalsContact C-N 3.33Å; R1261-V1263 PolarHBondContact O-N 2.87Å; V1263-I1265 VanDerWaalsContact C-N 3.31Å; V1263-I1265 PolarHBondContact O-N 3.42Å; V1263-D1266 PolarHBondContact O-N 3.11Å; V1263-E1267 HydrophobicContact CG1-CG 3.98Å; V1263-E1267 VanDerWaalsContact O-CB 3.23Å; V1263-E1267 WeakPolarHBondContact O-CB 3.45Å; V1263-E1267 WeakPolarHBondContact O-CG 3.32Å; V1263-E1267 PolarHBondContact O-N 3.42Å
1264	V	95.9	Very high	91.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-44	174.1	172.5	0	0	0	0	111.2	I1082 I1248 A1260 R1261 R1262 L1268 A1288 M1291	I1082-V1264 HydrophobicContact CG2-CG1 4.13Å; I1248-V1264 HydrophobicContact CD1-CG2 3.79Å; I1248-V1264 HydrophobicContact CG1-CG2 3.95Å; I1248-V1264 HydrophobicContact CG2-CG2 3.77Å; A1260-V1264 WeakPolarHBondContact O-CG2 3.26Å; A1260-V1264 PolarHBondContact O-N 3.43Å; R1261-V1264 WeakPolarHBondContact O-CB 3.38Å; R1261-V1264 PolarHBondContact O-N 2.91Å; R1262-V1264 VanDerWaalsContact C-N 3.33Å; R1262-V1264 PolarHBondContact O-N 3.02Å; V1264-L1268 HydrophobicContact CG1-CD1 3.8Å; V1264-L1268 WeakPolarHBondContact O-CB 3.48Å; V1264-L1268 VanDerWaalsContact O-CG 3.29Å; V1264-L1268 WeakPolarHBondContact O-CG 3.43Å; V1264-L1268 PolarHBondContact O-N 3.18Å; V1264-L1268 VanDerWaalsContact O-N 3.08Å; V1264-A1288 HydrophobicContact CB-CB 4.14Å; V1264-A1288 HydrophobicContact CG1-CB 3.82Å; V1264-M1291 HydrophobicContact CG1-SD 4.05Å; V1264-M1291 HydrophobicContact CG2-CE 4.43Å
1265	I	95.3	Very high	90.9	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-52.5	-179.8	-63	165.7	0	0	0	110.8	R1261 R1262 V1263 E1267 L1268 L1269 V1284 M1285 A1288	R1261-I1265 HydrophobicContact CG-CD1 4.44Å; R1261-I1265 WeakPolarHBondContact O-CG1 3.25Å; R1261-I1265 PolarHBondContact O-N 2.98Å; R1262-I1265 PolarHBondContact O-N 3.33Å; R1262-I1265 VanDerWaalsContact O-N 3.16Å; V1263-I1265 VanDerWaalsContact C-N 3.31Å; V1263-I1265 PolarHBondContact O-N 3.42Å; I1265-E1267 PolarHBondContact O-N 3.04Å; I1265-L1268 PolarHBondContact O-N 3.11Å; I1265-L1269 HydrophobicContact CG2-CD1 3.88Å; I1265-L1269 WeakPolarHBondContact O-CG 3.41Å; I1265-L1269 PolarHBondContact O-N 2.88Å; I1265-V1284 HydrophobicContact CB-CG1 4.38Å; I1265-V1284 HydrophobicContact CG1-CG1 4.48Å; I1265-V1284 HydrophobicContact CG2-CG1 4.19Å; I1265-M1285 HydrophobicContact CD1-CG 4.03Å; I1265-A1288 HydrophobicContact CD1-CB 4.1Å; I1265-A1288 HydrophobicContact CG1-CB 3.56Å
1266	D	93.7	Very high	89.9	Confident	43 Å²	43	39.8 Å²	39.8	23%	0.23	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-42.6	-176.8	-72.5	-22	0	0	0	111.6	R1262 V1263 A1270	R1262-D1266 IonicContact CZ-OD1 2.8Å; R1262-D1266 IonicContact CZ-OD2 3.64Å; R1262-D1266 VanDerWaalsContact NE-CG 3.28Å; R1262-D1266 IonicContact NE-OD1 2.98Å; R1262-D1266 PolarHBondContact NE-OD1 2.94Å; R1262-D1266 IonicContact NE-OD2 3.45Å; R1262-D1266 PolarHBondContact NE-OD2 2.87Å; R1262-D1266 IonicContact NH2-OD1 3.22Å; R1262-D1266 PolarHBondContact NH2-OD1 3.47Å; R1262-D1266 IonicContact NH2-OD2 3.51Å; R1262-D1266 PolarHBondContact O-N 3.25Å; V1263-D1266 PolarHBondContact O-N 3.11Å; D1266-A1270 VanDerWaalsContact O-CB 3.24Å; D1266-A1270 WeakPolarHBondContact O-CB 3.48Å; D1266-A1270 PolarHBondContact O-N 3.46Å
1267	E	92.1	Very high	89.1	Confident	45 Å²	45	39 Å²	39	21%	0.21	22%	0.221	C	C	.	.	H	α-helix	trans	-69.2	-38.7	179.8	-72	-74.4	139.2	0	0	112.6	R1078 I1082 N1246 V1263 I1265 V1271	R1078-E1267 IonicContact CZ-OE2 3.4Å; R1078-E1267 IonicContact NE-OE2 3.16Å; R1078-E1267 PolarHBondContact NE-OE2 2.82Å; R1078-E1267 IonicContact NH2-OE2 3.73Å; R1078-E1267 PolarHBondContact NH2-OE2 2.94Å; I1082-E1267 HydrophobicContact CD1-CB 3.72Å; I1082-E1267 HydrophobicContact CG1-CB 4.38Å; N1246-E1267 WeakPolarHBondContact CB-OE1 3.47Å; V1263-E1267 HydrophobicContact CG1-CG 3.98Å; V1263-E1267 VanDerWaalsContact O-CB 3.23Å; V1263-E1267 WeakPolarHBondContact O-CB 3.45Å; V1263-E1267 WeakPolarHBondContact O-CG 3.32Å; V1263-E1267 PolarHBondContact O-N 3.42Å; I1265-E1267 PolarHBondContact O-N 3.04Å; E1267-V1271 WeakPolarHBondContact O-CB 3.37Å; E1267-V1271 WeakPolarHBondContact O-CG2 3.11Å; E1267-V1271 PolarHBondContact O-N 3.38Å
1268	L	91	Very high	88.5	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-67.6	-43.8	177.1	-77.1	172	0	0	0	111.8	M1079 I1082 V1264 I1265 V1271 M1272 V1284 L1287	M1079-L1268 HydrophobicContact CG-CD2 4.06Å; I1082-L1268 HydrophobicContact CB-CD2 4.26Å; I1082-L1268 HydrophobicContact CD1-CD2 4.09Å; I1082-L1268 HydrophobicContact CD1-CG 4.39Å; I1082-L1268 HydrophobicContact CG2-CD1 4.17Å; I1082-L1268 HydrophobicContact CG2-CD2 3.87Å; I1082-L1268 HydrophobicContact CG2-CG 3.8Å; V1264-L1268 HydrophobicContact CG1-CD1 3.8Å; V1264-L1268 WeakPolarHBondContact O-CB 3.48Å; V1264-L1268 VanDerWaalsContact O-CG 3.29Å; V1264-L1268 WeakPolarHBondContact O-CG 3.43Å; V1264-L1268 PolarHBondContact O-N 3.18Å; V1264-L1268 VanDerWaalsContact O-N 3.08Å; I1265-L1268 PolarHBondContact O-N 3.11Å; L1268-V1271 PolarHBondContact O-N 2.98Å; L1268-M1272 VanDerWaalsContact O-CG 3.3Å; L1268-M1272 WeakPolarHBondContact O-CG 3.46Å; L1268-M1272 PolarHBondContact O-N 3.14Å; L1268-M1272 VanDerWaalsContact O-N 3.08Å; L1268-V1284 HydrophobicContact CB-CG1 3.7Å; L1268-V1284 HydrophobicContact CD1-CG1 3.91Å; L1268-V1284 HydrophobicContact CG-CG1 4.46Å; L1268-L1287 HydrophobicContact CD1-CD2 3.69Å
1269	L	90.3	Very high	88.1	Confident	30 Å²	30	37.3 Å²	37.3	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-47.7	175.7	-71.3	172.7	0	0	0	111	I1265 V1271 M1272 E1273 V1281 V1284	I1265-L1269 HydrophobicContact CG2-CD1 3.88Å; I1265-L1269 WeakPolarHBondContact O-CG 3.41Å; I1265-L1269 PolarHBondContact O-N 2.88Å; L1269-V1271 VanDerWaalsContact C-N 3.28Å; L1269-V1271 PolarHBondContact O-N 3.03Å; L1269-M1272 PolarHBondContact O-N 2.81Å; L1269-M1272 VanDerWaalsContact O-N 3.08Å; L1269-E1273 WeakPolarHBondContact O-CB 3.4Å; L1269-E1273 WeakPolarHBondContact O-CG 3.35Å; L1269-E1273 PolarHBondContact O-N 3.35Å; L1269-V1281 HydrophobicContact CD1-CG2 4.2Å; L1269-V1284 HydrophobicContact CD2-CB 4.48Å; L1269-V1284 HydrophobicContact CD2-CG2 3.92Å; L1269-V1284 HydrophobicContact CG-CG1 4.42Å; L1269-V1284 HydrophobicContact CG-CG2 4.43Å
1270	A	87.8	Confident	87.9	Confident	56 Å²	56	36.3 Å²	36.3	46%	0.463	20%	0.201	S	C	.	.	H	α-helix	trans	-58.5	-39.4	178.1	0	0	0	0	0	112.5	D1266 G1274	D1266-A1270 VanDerWaalsContact O-CB 3.24Å; D1266-A1270 WeakPolarHBondContact O-CB 3.48Å; D1266-A1270 PolarHBondContact O-N 3.46Å; A1270-G1274 PolarHBondContact O-N 2.84Å
1271	V	85.9	Confident	87.7	Confident	9 Å²	9	39 Å²	39	6%	0.055	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-41.8	176.4	165.7	0	0	0	0	111.5	M1057 R1078 M1079 I1082 E1267 L1268 L1269 H1275	M1057-V1271 HydrophobicContact CE-CG1 3.7Å; M1057-V1271 WeakPolarHBondContact CE-O 3.06Å; R1078-V1271 HydrophobicContact CB-CG2 4.1Å; R1078-V1271 HydrophobicContact CG-CG2 3.52Å; M1079-V1271 HydrophobicContact CB-CG1 4.41Å; M1079-V1271 HydrophobicContact CE-CG1 4.24Å; I1082-V1271 HydrophobicContact CD1-CG2 4.31Å; E1267-V1271 WeakPolarHBondContact O-CB 3.37Å; E1267-V1271 WeakPolarHBondContact O-CG2 3.11Å; E1267-V1271 PolarHBondContact O-N 3.38Å; L1268-V1271 PolarHBondContact O-N 2.98Å; L1269-V1271 VanDerWaalsContact C-N 3.28Å; L1269-V1271 PolarHBondContact O-N 3.03Å; V1271-H1275 PolarHBondContact O-ND1 3.05Å
1272	M	84.4	Confident	87.6	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-72.5	-48.5	-179.6	-70.2	177.8	173.1	0	0	112.6	V1050 M1079 L1268 L1269 G1274 H1275 G1276 V1277 V1279	V1050-M1272 HydrophobicContact CB-CE 4.18Å; V1050-M1272 HydrophobicContact CG1-CE 3.69Å; V1050-M1272 HydrophobicContact CG2-CE 4.14Å; M1079-M1272 HydrophobicContact CE-CE 3.74Å; M1079-M1272 HydrophobicContact CE-CG 4.06Å; L1268-M1272 VanDerWaalsContact O-CG 3.3Å; L1268-M1272 WeakPolarHBondContact O-CG 3.46Å; L1268-M1272 PolarHBondContact O-N 3.14Å; L1268-M1272 VanDerWaalsContact O-N 3.08Å; L1269-M1272 PolarHBondContact O-N 2.81Å; L1269-M1272 VanDerWaalsContact O-N 3.08Å; M1272-G1274 VanDerWaalsContact C-N 3.26Å; M1272-G1274 PolarHBondContact O-N 3.31Å; M1272-H1275 PolarHBondContact O-N 3.23Å; M1272-G1276 PolarHBondContact O-N 2.98Å; M1272-V1277 CarbonylContact C-O 3.58Å; M1272-V1277 VanDerWaalsContact C-O 3.32Å; M1272-V1277 WeakPolarHBondContact CB-O 3.48Å; M1272-V1277 PolarHBondContact O-N 2.72Å; M1272-V1279 HydrophobicContact CE-CG2 4.1Å; M1272-V1279 HydrophobicContact SD-CB 3.68Å; M1272-V1279 HydrophobicContact SD-CG1 4.33Å; M1272-V1279 HydrophobicContact SD-CG2 3.38Å; M1272-V1279 WeakPolarHBondContact SD-CG2 3.48Å
1273	E	82.9	Confident	87.6	Confident	133 Å²	133	31.3 Å²	31.3	62%	0.621	19%	0.188	S	C	*	.	H	α-helix	trans	-59.5	-39.8	175.5	-72.5	176.4	-171	0	0	111.1	L1269 H1275 G1276	L1269-E1273 WeakPolarHBondContact O-CB 3.4Å; L1269-E1273 WeakPolarHBondContact O-CG 3.35Å; L1269-E1273 PolarHBondContact O-N 3.35Å; E1273-H1275 PolarHBondContact O-N 3.07Å; E1273-G1276 PolarHBondContact O-N 2.86Å
1274	G	73.5	Confident	87.5	Confident	19 Å²	19	30.2 Å²	30.2	20%	0.196	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-13.2	173.8	0	0	0	0	0	114.3	H1063 A1270 M1272	H1063-G1274 PolarHBondContact CD2-O 2.91Å; H1063-G1274 PolarHBondContact NE2-O 3.29Å; A1270-G1274 PolarHBondContact O-N 2.84Å; M1272-G1274 VanDerWaalsContact C-N 3.26Å; M1272-G1274 PolarHBondContact O-N 3.31Å
1275	H	74.3	Confident	87.5	Confident	12 Å²	12	31.4 Å²	31.4	6%	0.056	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	5	173.6	-65.8	64.1	0	0	0	112.8	M1057 K1060 G1075 V1271 M1272 E1273 V1277	M1057-H1275 HydrophobicContact CE-CB 3.7Å; M1057-H1275 WeakPolarHBondContact CE-ND1 3.37Å; M1057-H1275 HydrophobicContact CG-CB 3.86Å; K1060-H1275 PolarHBondContact NZ-O 2.74Å; K1060-H1275 PolarHBondContact O-NE2 3.31Å; G1075-H1275 VanDerWaalsContact CA-CE1 3.42Å; G1075-H1275 WeakPolarHBondContact CA-CE1 3.34Å; G1075-H1275 WeakPolarHBondContact CA-NE2 3.35Å; G1075-H1275 PolarHBondContact N-CE1 2.74Å; G1075-H1275 VanDerWaalsContact N-CE1 3.35Å; V1271-H1275 PolarHBondContact O-ND1 3.05Å; M1272-H1275 PolarHBondContact O-N 3.23Å; E1273-H1275 PolarHBondContact O-N 3.07Å; H1275-V1277 VanDerWaalsContact C-N 3.32Å; H1275-V1277 HydrophobicContact CB-CG2 4.5Å
1276	G	75.1	Confident	87.5	Confident	64 Å²	64	31.2 Å²	31.2	66%	0.66	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	29.2	-174.5	0	0	0	0	0	112.9	M1272 E1273	M1272-G1276 PolarHBondContact O-N 2.98Å; E1273-G1276 PolarHBondContact O-N 2.86Å
1277	V	78.7	Confident	87.5	Confident	13 Å²	13	29.1 Å²	29.1	8%	0.079	18%	0.176	C	C	.	.			trans	-106.9	117.8	173.7	-171.4	0	0	0	0	109.5	K543 P1053 M1057 M1272 H1275	K543-V1277 HydrophobicContact CD-CG1 4.41Å; P1053-V1277 HydrophobicContact CB-CB 4.31Å; P1053-V1277 HydrophobicContact CB-CG1 3.53Å; P1053-V1277 HydrophobicContact CG-CG1 3.68Å; M1057-V1277 HydrophobicContact CG-CG2 4.22Å; M1272-V1277 CarbonylContact C-O 3.58Å; M1272-V1277 VanDerWaalsContact C-O 3.32Å; M1272-V1277 WeakPolarHBondContact CB-O 3.48Å; M1272-V1277 PolarHBondContact O-N 2.72Å; H1275-V1277 VanDerWaalsContact C-N 3.32Å; H1275-V1277 HydrophobicContact CB-CG2 4.5Å
1278	E	81.5	Confident	87.7	Confident	109 Å²	109	27 Å²	27	51%	0.509	17%	0.165	S	C	.	.			trans	-91.1	127.3	177.4	-66.9	175.7	-170.6	0	0	110.3	K543	K543-E1278 VanDerWaalsContact CD-O 3.25Å; K543-E1278 WeakPolarHBondContact CD-O 3.36Å; K543-E1278 WeakPolarHBondContact CE-O 3.44Å; K543-E1278 WeakPolarHBondContact CG-O 3.16Å
1279	V	88.2	Confident	87.9	Confident	16 Å²	16	28 Å²	28	10%	0.097	17%	0.171	C	C	.	.			trans	-125.5	135.8	172.8	178.7	0	0	0	0	107.7	K543 P1053 M1272 V1281 H1283 V1284	K543-V1279 HydrophobicContact CD-CG2 3.96Å; K543-V1279 HydrophobicContact CG-CB 4.35Å; K543-V1279 HydrophobicContact CG-CG1 4.43Å; K543-V1279 HydrophobicContact CG-CG2 3.93Å; P1053-V1279 HydrophobicContact CG-CG2 3.85Å; M1272-V1279 HydrophobicContact CE-CG2 4.1Å; M1272-V1279 HydrophobicContact SD-CB 3.68Å; M1272-V1279 HydrophobicContact SD-CG1 4.33Å; M1272-V1279 HydrophobicContact SD-CG2 3.38Å; M1272-V1279 WeakPolarHBondContact SD-CG2 3.48Å; V1279-V1281 PolarHBondContact O-N 3.05Å; V1279-H1283 HydrophobicContact CG1-CB 4.14Å; V1279-V1284 HydrophobicContact CG1-CG2 4.29Å
1280	N	91.3	Very high	88	Confident	11 Å²	11	27.3 Å²	27.3	6%	0.059	17%	0.168	C	C	.	.			trans	-60.8	133.8	176.9	-165.8	-73.2	0	0	0	110.7	K543 P920 R1282 H1283	K543-N1280 VanDerWaalsContact O-CB 3.27Å; K543-N1280 WeakPolarHBondContact O-CB 3.44Å; K543-N1280 PolarHBondContact O-N 3.09Å; P920-N1280 HydrophobicContact CB-CB 3.9Å; P920-N1280 HydrophobicContact CG-CB 4.18Å; N1280-R1282 PolarHBondContact ND2-NH1 2.95Å; N1280-R1282 PolarHBondContact O-N 2.99Å; N1280-R1282 VanDerWaalsContact O-N 3.08Å; N1280-R1282 WeakPolarHBondContact OD1-CB 3.44Å; N1280-R1282 WeakPolarHBondContact OD1-CG 3.44Å; N1280-R1282 PolarHBondContact OD1-N 2.64Å; N1280-R1282 VanDerWaalsContact OD1-N 3.09Å; N1280-R1282 PolarHBondContact OD1-NH1 2.96Å; N1280-R1282 VanDerWaalsContact OD1-NH1 3.08Å; N1280-H1283 PolarHBondContact O-N 3.4Å; N1280-H1283 VanDerWaalsContact O-N 3.12Å
1281	V	93	Very high	88.3	Confident	57 Å²	57	24.7 Å²	24.7	35%	0.345	15%	0.146	S	C	.	.	H	α-helix	trans	-54.2	-31.3	-177.9	65	0	0	0	0	113.3	L1269 V1279 H1283 V1284 M1285	L1269-V1281 HydrophobicContact CD1-CG2 4.2Å; V1279-V1281 PolarHBondContact O-N 3.05Å; V1281-H1283 VanDerWaalsContact C-N 3.3Å; V1281-H1283 PolarHBondContact O-N 3.36Å; V1281-V1284 PolarHBondContact O-N 3.48Å; V1281-V1284 VanDerWaalsContact O-N 3.11Å; V1281-M1285 HydrophobicContact CG2-CG 4.04Å; V1281-M1285 HydrophobicContact CG2-SD 3.95Å; V1281-M1285 VanDerWaalsContact O-CG 3.31Å; V1281-M1285 WeakPolarHBondContact O-CG 3.4Å; V1281-M1285 PolarHBondContact O-N 3.36Å
1282	R	94	Very high	88.6	Confident	7 Å²	7	24.8 Å²	24.8	3%	0.026	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-34.4	-178.7	-63.1	179.4	-176.3	74	-2.2	113.1	Y913 D916 L918 P920 M923 N1280 L1286	Y913-R1282 HydrophobicContact CE1-CB 4.21Å; D916-R1282 IonicContact OD1-CZ 3.47Å; D916-R1282 IonicContact OD1-NE 3.93Å; D916-R1282 PolarHBondContact OD1-NE 2.98Å; D916-R1282 IonicContact OD1-NH2 2.73Å; D916-R1282 PolarHBondContact OD1-NH2 3.02Å; D916-R1282 IonicContact OD2-CZ 3.24Å; D916-R1282 IonicContact OD2-NE 2.63Å; D916-R1282 IonicContact OD2-NH2 3.06Å; D916-R1282 PolarHBondContact OD2-NH2 3.33Å; L918-R1282 VanDerWaalsContact O-CD 3.25Å; L918-R1282 WeakPolarHBondContact O-CD 3.24Å; L918-R1282 PolarHBondContact O-NE 3.43Å; P920-R1282 HydrophobicContact CG-CB 4.28Å; M923-R1282 VanDerWaalsContact CE-NH2 3.28Å; N1280-R1282 PolarHBondContact ND2-NH1 2.95Å; N1280-R1282 PolarHBondContact O-N 2.99Å; N1280-R1282 VanDerWaalsContact O-N 3.08Å; N1280-R1282 WeakPolarHBondContact OD1-CB 3.44Å; N1280-R1282 WeakPolarHBondContact OD1-CG 3.44Å; N1280-R1282 PolarHBondContact OD1-N 2.64Å; N1280-R1282 VanDerWaalsContact OD1-N 3.09Å; N1280-R1282 PolarHBondContact OD1-NH1 2.96Å; N1280-R1282 VanDerWaalsContact OD1-NH1 3.08Å; R1282-L1286 WeakPolarHBondContact O-CB 3.43Å; R1282-L1286 PolarHBondContact O-N 3.31Å
1283	H	94.4	Very high	89	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-66.4	-46.2	174.1	-65.9	-50.6	0	0	0	110.6	P542 C1046 V1279 N1280 V1281 M1285 L1286 L1287	P542-H1283 PolarHBondContact O-NE2 3.16Å; C1046-H1283 HydrophobicContact CB-CB 4.36Å; C1046-H1283 PolarHBondContact SG-O 3.21Å; V1279-H1283 HydrophobicContact CG1-CB 4.14Å; N1280-H1283 PolarHBondContact O-N 3.4Å; N1280-H1283 VanDerWaalsContact O-N 3.12Å; V1281-H1283 VanDerWaalsContact C-N 3.3Å; V1281-H1283 PolarHBondContact O-N 3.36Å; H1283-M1285 PolarHBondContact O-N 2.96Å; H1283-L1286 PolarHBondContact O-N 2.98Å; H1283-L1287 PolarHBondContact O-N 3.15Å
1284	V	94.2	Very high	89.1	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.4	-39	179.6	-175	0	0	0	0	111.4	I1265 L1268 L1269 V1279 V1281 L1287 A1288	I1265-V1284 HydrophobicContact CB-CG1 4.38Å; I1265-V1284 HydrophobicContact CG1-CG1 4.48Å; I1265-V1284 HydrophobicContact CG2-CG1 4.19Å; L1268-V1284 HydrophobicContact CB-CG1 3.7Å; L1268-V1284 HydrophobicContact CD1-CG1 3.91Å; L1268-V1284 HydrophobicContact CG-CG1 4.46Å; L1269-V1284 HydrophobicContact CD2-CB 4.48Å; L1269-V1284 HydrophobicContact CD2-CG2 3.92Å; L1269-V1284 HydrophobicContact CG-CG1 4.42Å; L1269-V1284 HydrophobicContact CG-CG2 4.43Å; V1279-V1284 HydrophobicContact CG1-CG2 4.29Å; V1281-V1284 PolarHBondContact O-N 3.48Å; V1281-V1284 VanDerWaalsContact O-N 3.11Å; V1284-L1287 PolarHBondContact O-N 3.1Å; V1284-A1288 PolarHBondContact O-N 3.37Å
1285	M	95.8	Very high	89.8	Confident	26 Å²	26	27 Å²	27	13%	0.128	17%	0.167	C	C	.	.	H	α-helix	trans	-58.6	-50.9	173.2	-72.6	171.6	69.1	0	0	111.1	S915 I1265 V1281 H1283 L1287 A1288 D1289	S915-M1285 WeakPolarHBondContact OG-CE 3.44Å; I1265-M1285 HydrophobicContact CD1-CG 4.03Å; V1281-M1285 HydrophobicContact CG2-CG 4.04Å; V1281-M1285 HydrophobicContact CG2-SD 3.95Å; V1281-M1285 VanDerWaalsContact O-CG 3.31Å; V1281-M1285 WeakPolarHBondContact O-CG 3.4Å; V1281-M1285 PolarHBondContact O-N 3.36Å; H1283-M1285 PolarHBondContact O-N 2.96Å; M1285-L1287 VanDerWaalsContact C-N 3.27Å; M1285-L1287 PolarHBondContact O-N 3.25Å; M1285-A1288 PolarHBondContact O-N 2.76Å; M1285-A1288 VanDerWaalsContact O-N 3.09Å; M1285-D1289 PolarHBondContact O-N 3.15Å
1286	L	95.8	Very high	90.6	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-41.1	178.8	-177.3	62.6	0	0	0	111.7	L893 V901 I909 Q910 Y913 V1042 C1046 R1282 H1283 A1288 D1289 V1290	L893-L1286 HydrophobicContact CD1-CD1 4.33Å; L893-L1286 HydrophobicContact CD1-CG 4.48Å; V901-L1286 HydrophobicContact CG1-CD1 4.07Å; I909-L1286 HydrophobicContact CG2-CD1 4.09Å; Q910-L1286 HydrophobicContact CG-CD1 4.37Å; Y913-L1286 HydrophobicContact CE2-CD2 4.18Å; V1042-L1286 HydrophobicContact CB-CD2 4.03Å; V1042-L1286 HydrophobicContact CG2-CD2 3.99Å; C1046-L1286 HydrophobicContact CB-CD2 3.96Å; R1282-L1286 WeakPolarHBondContact O-CB 3.43Å; R1282-L1286 PolarHBondContact O-N 3.31Å; H1283-L1286 PolarHBondContact O-N 2.98Å; L1286-A1288 VanDerWaalsContact C-N 3.35Å; L1286-A1288 PolarHBondContact O-N 2.75Å; L1286-D1289 PolarHBondContact O-N 2.72Å; L1286-V1290 HydrophobicContact CD1-CG2 4.38Å; L1286-V1290 VanDerWaalsContact O-CG2 3.23Å; L1286-V1290 WeakPolarHBondContact O-CG2 3.45Å; L1286-V1290 PolarHBondContact O-N 3.4Å
1287	L	94.3	Very high	91.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-41.2	177.2	-169.7	149.7	0	0	0	112	L886 V1050 L1268 H1283 V1284 M1285 M1291 Y1300	L886-L1287 HydrophobicContact CD2-CD1 3.85Å; V1050-L1287 HydrophobicContact CB-CD1 4.39Å; V1050-L1287 HydrophobicContact CG1-CD1 4.05Å; V1050-L1287 HydrophobicContact CG2-CD1 4.13Å; L1268-L1287 HydrophobicContact CD1-CD2 3.69Å; H1283-L1287 PolarHBondContact O-N 3.15Å; V1284-L1287 PolarHBondContact O-N 3.1Å; M1285-L1287 VanDerWaalsContact C-N 3.27Å; M1285-L1287 PolarHBondContact O-N 3.25Å; L1287-M1291 HydrophobicContact CD2-SD 3.84Å; L1287-M1291 WeakPolarHBondContact O-CG 3.43Å; L1287-M1291 PolarHBondContact O-N 3.32Å; L1287-Y1300 HydrophobicContact CD1-CE2 4.49Å; L1287-Y1300 HydrophobicContact CD2-CE2 3.63Å; L1287-Y1300 HydrophobicContact CG-CE2 3.76Å; L1287-Y1300 PolarHBondContact O-OH 3.27Å
1288	A	95.1	Very high	92	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.4	-38.9	177.1	0	0	0	0	0	112.5	R1261 V1264 I1265 V1284 M1285 L1286 M1291 T1292	R1261-A1288 HydrophobicContact CG-CB 3.96Å; V1264-A1288 HydrophobicContact CB-CB 4.14Å; V1264-A1288 HydrophobicContact CG1-CB 3.82Å; I1265-A1288 HydrophobicContact CD1-CB 4.1Å; I1265-A1288 HydrophobicContact CG1-CB 3.56Å; V1284-A1288 PolarHBondContact O-N 3.37Å; M1285-A1288 PolarHBondContact O-N 2.76Å; M1285-A1288 VanDerWaalsContact O-N 3.09Å; L1286-A1288 VanDerWaalsContact C-N 3.35Å; L1286-A1288 PolarHBondContact O-N 2.75Å; A1288-M1291 WeakPolarHBondContact O-CB 3.42Å; A1288-M1291 PolarHBondContact O-N 2.98Å; A1288-T1292 PolarHBondContact O-N 2.81Å; A1288-T1292 PolarHBondContact O-OG1 3.3Å
1289	D	95.3	Very high	92.4	Very high	22 Å²	22	22.7 Å²	22.7	12%	0.118	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-45.4	175.8	-76.9	-51	0	0	0	111.5	I909 Q910 R1261 M1285 L1286 M1291 T1292 N1293	I909-D1289 HydrophobicContact CG2-CB 3.91Å; Q910-D1289 HydrophobicContact CG-CB 4.1Å; Q910-D1289 PolarHBondContact NE2-OD2 3.3Å; R1261-D1289 IonicContact CZ-OD1 3.66Å; R1261-D1289 IonicContact CZ-OD2 3.23Å; R1261-D1289 IonicContact NE-OD1 3.31Å; R1261-D1289 PolarHBondContact NE-OD1 3.16Å; R1261-D1289 IonicContact NE-OD2 2.84Å; R1261-D1289 VanDerWaalsContact NH2-CG 3.3Å; R1261-D1289 IonicContact NH2-OD1 3.11Å; R1261-D1289 PolarHBondContact NH2-OD1 3.08Å; R1261-D1289 IonicContact NH2-OD2 2.78Å; R1261-D1289 PolarHBondContact NH2-OD2 3.19Å; M1285-D1289 PolarHBondContact O-N 3.15Å; L1286-D1289 PolarHBondContact O-N 2.72Å; D1289-M1291 PolarHBondContact O-N 3.23Å; D1289-T1292 PolarHBondContact O-N 3.13Å; D1289-T1292 PolarHBondContact O-OG1 3.27Å; D1289-N1293 WeakPolarHBondContact O-CB 3.38Å; D1289-N1293 PolarHBondContact O-N 2.81Å
1290	V	93.2	Very high	92.6	Very high	15 Å²	15	22 Å²	22	9%	0.091	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-32.3	176.4	174.2	0	0	0	0	111.9	L890 L893 I909 L1286 T1292 N1293 Y1300	L890-V1290 HydrophobicContact CD2-CB 4.04Å; L890-V1290 HydrophobicContact CD2-CG1 3.95Å; L890-V1290 HydrophobicContact CD2-CG2 3.7Å; L893-V1290 HydrophobicContact CD1-CG2 3.38Å; I909-V1290 HydrophobicContact CG2-CG2 3.65Å; L1286-V1290 HydrophobicContact CD1-CG2 4.38Å; L1286-V1290 VanDerWaalsContact O-CG2 3.23Å; L1286-V1290 WeakPolarHBondContact O-CG2 3.45Å; L1286-V1290 PolarHBondContact O-N 3.4Å; V1290-T1292 VanDerWaalsContact C-N 3.26Å; V1290-T1292 PolarHBondContact O-N 3.34Å; V1290-N1293 PolarHBondContact O-OD1 3.01Å; V1290-Y1300 HydrophobicContact CG1-CE1 4.33Å
1291	M	92.6	Very high	92.5	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-70.9	-20.6	174.8	-73	179.5	68.1	0	0	113.1	A1085 V1264 L1287 A1288 D1289 V1297 C1298 Y1300	A1085-M1291 HydrophobicContact CB-CE 4.17Å; V1264-M1291 HydrophobicContact CG1-SD 4.05Å; V1264-M1291 HydrophobicContact CG2-CE 4.43Å; L1287-M1291 HydrophobicContact CD2-SD 3.84Å; L1287-M1291 WeakPolarHBondContact O-CG 3.43Å; L1287-M1291 PolarHBondContact O-N 3.32Å; A1288-M1291 WeakPolarHBondContact O-CB 3.42Å; A1288-M1291 PolarHBondContact O-N 2.98Å; D1289-M1291 PolarHBondContact O-N 3.23Å; M1291-V1297 HydrophobicContact CE-CG1 3.99Å; M1291-V1297 CarbonylContact O-C 3.48Å; M1291-V1297 WeakPolarHBondContact O-CA 3.14Å; M1291-C1298 PolarHBondContact O-N 3.11Å; M1291-Y1300 HydrophobicContact CG-CD2 3.95Å; M1291-Y1300 HydrophobicContact CG-CE2 3.25Å; M1291-Y1300 HydrophobicContact SD-CD2 3.97Å; M1291-Y1300 HydrophobicContact SD-CE2 3.5Å; M1291-Y1300 WeakPolarHBondContact SD-CE2 3.34Å
1292	T	94	Very high	92.2	Very high	11 Å²	11	27.1 Å²	27.1	7%	0.067	14%	0.144	C	C	.	.	H	α-helix	trans	-122.3	-8.4	-167	51.6	0	0	0	0	114.8	V1257 R1261 A1288 D1289 V1290 K1294 G1295 V1297	V1257-T1292 HydrophobicContact CG2-CG2 3.82Å; R1261-T1292 HydrophobicContact CB-CG2 4Å; R1261-T1292 HydrophobicContact CG-CG2 4.47Å; A1288-T1292 PolarHBondContact O-N 2.81Å; A1288-T1292 PolarHBondContact O-OG1 3.3Å; D1289-T1292 PolarHBondContact O-N 3.13Å; D1289-T1292 PolarHBondContact O-OG1 3.27Å; V1290-T1292 VanDerWaalsContact C-N 3.26Å; V1290-T1292 PolarHBondContact O-N 3.34Å; T1292-K1294 VanDerWaalsContact C-N 3.25Å; T1292-K1294 PolarHBondContact O-N 3.06Å; T1292-K1294 VanDerWaalsContact O-N 3.1Å; T1292-G1295 PolarHBondContact O-N 3.43Å; T1292-G1295 VanDerWaalsContact O-N 3.07Å; T1292-V1297 HydrophobicContact CG2-CG2 4.19Å
1293	N	90.9	Very high	91.8	Very high	57 Å²	57	30.7 Å²	30.7	31%	0.305	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26	-175.2	72.2	-25.8	0	0	0	115.7	I909 D1289 V1290 G1295	I909-N1293 HydrophobicContact CD1-CB 4.21Å; I909-N1293 WeakPolarHBondContact CD1-ND2 3.48Å; D1289-N1293 WeakPolarHBondContact O-CB 3.38Å; D1289-N1293 PolarHBondContact O-N 2.81Å; V1290-N1293 PolarHBondContact O-OD1 3.01Å; N1293-G1295 VanDerWaalsContact C-N 3.32Å
1294	K	86.1	Confident	91.4	Very high	91 Å²	91	30.9 Å²	30.9	40%	0.396	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	5	-179.9	-65.3	-61.2	178.6	-175.6	0	113.8	D907 T1292 E1296	D907-K1294 IonicContact OD2-NZ 3.81Å; D907-K1294 PolarHBondContact OD2-NZ 3.18Å; T1292-K1294 VanDerWaalsContact C-N 3.25Å; T1292-K1294 PolarHBondContact O-N 3.06Å; T1292-K1294 VanDerWaalsContact O-N 3.1Å; K1294-E1296 VanDerWaalsContact C-N 3.28Å; K1294-E1296 PolarHBondContact O-N 3.35Å
1295	G	88.2	Confident	91	Very high	54 Å²	54	30.9 Å²	30.9	56%	0.557	17%	0.169	S	C	*	.	S	Bend	trans	80.5	4.6	-178.6	0	0	0	0	0	114.7	T1292 N1293	T1292-G1295 PolarHBondContact O-N 3.43Å; T1292-G1295 VanDerWaalsContact O-N 3.07Å; N1293-G1295 VanDerWaalsContact C-N 3.32Å
1296	E	90.7	Very high	90.4	Very high	75 Å²	75	30.8 Å²	30.8	35%	0.35	17%	0.172	S	C	.	.	S	Bend	trans	-136	153.5	167.8	64.2	172.4	173.9	0	0	109.5	E1252 K1294 C1298 K1307	E1252-E1296 VanDerWaalsContact OE1-CA 3.23Å; E1252-E1296 WeakPolarHBondContact OE1-CA 3.26Å; K1294-E1296 VanDerWaalsContact C-N 3.28Å; K1294-E1296 PolarHBondContact O-N 3.35Å; E1296-C1298 PolarHBondContact O-N 2.82Å; E1296-K1307 WeakPolarHBondContact OE1-CD 3.27Å; E1296-K1307 WeakPolarHBondContact OE1-CE 3.5Å; E1296-K1307 IonicContact OE1-NZ 2.79Å; E1296-K1307 PolarHBondContact OE1-NZ 3.43Å; E1296-K1307 IonicContact OE2-NZ 3.79Å; E1296-K1307 PolarHBondContact OE2-NZ 2.92Å
1297	V	92.5	Very high	89.8	Confident	14 Å²	14	35 Å²	35	9%	0.085	19%	0.19	C	C	.	.			trans	-74.9	107.8	177.7	-178.3	0	0	0	0	110.6	A1085 I1248 L1249 E1252 A1260 M1291 T1292	A1085-V1297 HydrophobicContact CB-CG1 3.8Å; I1248-V1297 HydrophobicContact CG2-CG1 3.95Å; I1248-V1297 HydrophobicContact CG2-CG2 4.15Å; L1249-V1297 HydrophobicContact CD2-CB 3.96Å; L1249-V1297 HydrophobicContact CD2-CG1 4.34Å; E1252-V1297 HydrophobicContact CB-CG2 4.16Å; E1252-V1297 HydrophobicContact CG-CG2 4.06Å; E1252-V1297 PolarHBondContact OE1-N 3.16Å; A1260-V1297 HydrophobicContact CB-CG2 3.84Å; M1291-V1297 HydrophobicContact CE-CG1 3.99Å; M1291-V1297 CarbonylContact O-C 3.48Å; M1291-V1297 WeakPolarHBondContact O-CA 3.14Å; T1292-V1297 HydrophobicContact CG2-CG2 4.19Å
1298	C	90.5	Very high	89.1	Confident	10 Å²	10	35.9 Å²	35.9	7%	0.068	20%	0.197	C	C	.	.			trans	-97.6	105.7	176.8	-71.7	0	0	0	0	111.3	M1291 E1296	M1291-C1298 PolarHBondContact O-N 3.11Å; E1296-C1298 PolarHBondContact O-N 2.82Å
1299	G	91.2	Very high	88.5	Confident	8 Å²	8	36.5 Å²	36.5	8%	0.082	20%	0.2	C	C	.	.			trans	-65.8	151.6	172	0	0	0	0	0	113	Q1301 G1304	G1299-Q1301 PolarHBondContact O-N 3.3Å; G1299-G1304 WeakPolarHBondContact O-CA 3.4Å
1300	Y	90.9	Very high	87.7	Confident	1 Å²	1	36.2 Å²	36.2	0%	0.004	20%	0.199	C	C	.	.	S	Bend	trans	-70.7	24.9	-178.2	-72.4	-84.4	0	0	0	114.6	R885 L886 F889 L890 V1083 L1287 V1290 M1291	R885-Y1300 PolarHBondContact NE-O 3.18Å; R885-Y1300 PolarHBondContact NH2-O 3.06Å; L886-Y1300 HydrophobicContact CD2-CD1 4.01Å; L886-Y1300 HydrophobicContact CD2-CD2 3.95Å; L886-Y1300 HydrophobicContact CD2-CE1 4.24Å; L886-Y1300 HydrophobicContact CD2-CE2 4.14Å; L886-Y1300 HydrophobicContact CD2-CG 3.89Å; F889-Y1300 HydrophobicContact CB-CD1 3.56Å; F889-Y1300 HydrophobicContact CB-CE1 3.58Å; F889-Y1300 AromaticContact CD1-CD1 3.63Å; F889-Y1300 HydrophobicContact CD1-CD1 3.63Å; F889-Y1300 AromaticContact CD1-CE1 3.95Å; F889-Y1300 HydrophobicContact CD1-CE1 3.95Å; F889-Y1300 AromaticContact CD2-CD1 3.84Å; F889-Y1300 HydrophobicContact CD2-CD1 3.84Å; F889-Y1300 HydrophobicContact CE1-CD1 4.14Å; F889-Y1300 VanDerWaalsContact CE2-C 3.5Å; F889-Y1300 HydrophobicContact CE2-CD1 4.3Å; F889-Y1300 WeakPolarHBondContact CE2-O 3.49Å; F889-Y1300 AromaticContact CG-CD1 3.43Å; F889-Y1300 HydrophobicContact CG-CD1 3.43Å; F889-Y1300 VanDerWaalsContact CG-CD1 3.43Å; F889-Y1300 AromaticContact CG-CE1 3.88Å; F889-Y1300 HydrophobicContact CG-CE1 3.88Å; F889-Y1300 VanDerWaalsContact CZ-CA 3.44Å; F889-Y1300 HydrophobicContact CZ-CD1 4.4Å; L890-Y1300 HydrophobicContact CD2-CE1 4.3Å; L890-Y1300 HydrophobicContact CG-CE1 4.3Å; V1083-Y1300 HydrophobicContact CB-CD2 4.44Å; V1083-Y1300 HydrophobicContact CG1-CD2 3.72Å; V1083-Y1300 HydrophobicContact CG1-CG 3.99Å; V1083-Y1300 WeakPolarHBondContact O-CD2 3.26Å; V1083-Y1300 PolarHBondContact O-N 3.45Å; L1287-Y1300 HydrophobicContact CD1-CE2 4.49Å; L1287-Y1300 HydrophobicContact CD2-CE2 3.63Å; L1287-Y1300 HydrophobicContact CG-CE2 3.76Å; L1287-Y1300 PolarHBondContact O-OH 3.27Å; V1290-Y1300 HydrophobicContact CG1-CE1 4.33Å; M1291-Y1300 HydrophobicContact CG-CD2 3.95Å; M1291-Y1300 HydrophobicContact CG-CE2 3.25Å; M1291-Y1300 HydrophobicContact SD-CD2 3.97Å; M1291-Y1300 HydrophobicContact SD-CE2 3.5Å; M1291-Y1300 WeakPolarHBondContact SD-CE2 3.34Å
1301	Q	89.9	Confident	87.5	Confident	70 Å²	70	36.2 Å²	36.2	33%	0.327	20%	0.199	S	C	.	.	S	Bend	trans	-88.6	167.8	179.4	-66.6	-175	-9.7	0	0	110.5	F889 N1084 G1299 T1303 G1304 M1305	F889-Q1301 WeakPolarHBondContact CZ-O 3.48Å; N1084-Q1301 HydrophobicContact CB-CG 4.2Å; N1084-Q1301 VanDerWaalsContact CB-NE2 3.33Å; N1084-Q1301 PolarHBondContact ND2-NE2 3.16Å; G1299-Q1301 PolarHBondContact O-N 3.3Å; Q1301-T1303 PolarHBondContact O-N 3.42Å; Q1301-G1304 PolarHBondContact O-N 3.43Å; Q1301-M1305 PolarHBondContact O-N 2.97Å
1302	R	86.6	Confident	87.4	Confident	105 Å²	105	36.2 Å²	36.2	40%	0.396	20%	0.2	S	C	.	.	H	α-helix	trans	-49.4	-35.5	175.4	72.5	-176.2	-177.6	-158.9	-6.4	114	M1305 A1306 F1318 E1319 R1320	R1302-M1305 PolarHBondContact O-N 3.46Å; R1302-A1306 WeakPolarHBondContact O-CB 3.43Å; R1302-A1306 PolarHBondContact O-N 3.41Å; R1302-F1318 HydrophobicContact CB-CE1 3.96Å; R1302-E1319 WeakPolarHBondContact CD-OE2 3.28Å; R1302-R1320 VanDerWaalsContact NH1-NE 3.16Å
1303	T	86.1	Confident	87.4	Confident	83 Å²	83	36.5 Å²	36.5	51%	0.509	20%	0.2	S	C	.	.	H	α-helix	trans	-71.3	-39.9	-179.7	42.9	0	0	0	0	111.9	Q1301	Q1301-T1303 PolarHBondContact O-N 3.42Å
1304	G	85.7	Confident	87.4	Confident	5 Å²	5	33.8 Å²	33.8	5%	0.052	19%	0.186	C	C	.	.	H	α-helix	trans	-70.5	-35.7	172	0	0	0	0	0	111.8	G1299 Q1301 A1306 K1307 A1308	G1299-G1304 WeakPolarHBondContact O-CA 3.4Å; Q1301-G1304 PolarHBondContact O-N 3.43Å; G1304-A1306 VanDerWaalsContact C-N 3.33Å; G1304-A1306 PolarHBondContact O-N 2.95Å; G1304-K1307 WeakPolarHBondContact O-CA 3.15Å; G1304-K1307 WeakPolarHBondContact O-CB 2.9Å; G1304-K1307 PolarHBondContact O-N 3.06Å; G1304-A1308 PolarHBondContact O-N 3.28Å
1305	M	84.7	Confident	87.6	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-41.6	179.5	-147.6	170.6	88.6	0	0	111.5	K888 F889 Q1301 R1302 K1307 A1308 K1309 L1315 F1318	K888-M1305 HydrophobicContact CB-SD 4.42Å; F889-M1305 HydrophobicContact CD1-CG 4.26Å; F889-M1305 HydrophobicContact CD2-CB 4.3Å; F889-M1305 HydrophobicContact CD2-CG 3.7Å; F889-M1305 HydrophobicContact CD2-SD 3.64Å; F889-M1305 VanDerWaalsContact CE1-CA 3.49Å; F889-M1305 HydrophobicContact CE1-CB 3.89Å; F889-M1305 HydrophobicContact CE1-CG 3.93Å; F889-M1305 HydrophobicContact CE2-CB 3.44Å; F889-M1305 VanDerWaalsContact CE2-CB 3.44Å; F889-M1305 HydrophobicContact CE2-CG 3.35Å; F889-M1305 HydrophobicContact CE2-SD 3.51Å; F889-M1305 VanDerWaalsContact CE2-SD 3.51Å; F889-M1305 HydrophobicContact CG-CG 4.19Å; F889-M1305 HydrophobicContact CZ-CB 3.22Å; F889-M1305 HydrophobicContact CZ-CG 3.5Å; F889-M1305 VanDerWaalsContact CZ-CG 3.5Å; F889-M1305 HydrophobicContact CZ-SD 4.28Å; Q1301-M1305 PolarHBondContact O-N 2.97Å; R1302-M1305 PolarHBondContact O-N 3.46Å; M1305-K1307 PolarHBondContact O-N 3.03Å; M1305-A1308 PolarHBondContact O-N 3.36Å; M1305-K1309 HydrophobicContact CG-CG 4.32Å; M1305-K1309 PolarHBondContact O-N 2.96Å; M1305-L1315 HydrophobicContact CB-CD2 4.4Å; M1305-L1315 HydrophobicContact CE-CD2 3.87Å; M1305-L1315 HydrophobicContact CG-CD2 4.37Å; M1305-F1318 HydrophobicContact CE-CB 3.24Å; M1305-F1318 HydrophobicContact CE-CD1 3.47Å; M1305-F1318 VanDerWaalsContact CE-CD1 3.47Å; M1305-F1318 HydrophobicContact CE-CD2 4.35Å; M1305-F1318 HydrophobicContact CE-CE1 4.46Å; M1305-F1318 HydrophobicContact CE-CG 3.43Å; M1305-F1318 VanDerWaalsContact CE-CG 3.43Å; M1305-F1318 HydrophobicContact SD-CB 4.17Å; M1305-F1318 HydrophobicContact SD-CD1 3.69Å; M1305-F1318 HydrophobicContact SD-CD2 4.2Å; M1305-F1318 HydrophobicContact SD-CE1 4.16Å; M1305-F1318 HydrophobicContact SD-CG 3.73Å
1306	A	83.7	Confident	87.8	Confident	24 Å²	24	27 Å²	27	20%	0.198	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-13.3	175.1	0	0	0	0	0	113.9	V137 R1302 G1304 L1315	V137-A1306 WeakPolarHBondContact CG2-O 3.22Å; R1302-A1306 WeakPolarHBondContact O-CB 3.43Å; R1302-A1306 PolarHBondContact O-N 3.41Å; G1304-A1306 VanDerWaalsContact C-N 3.33Å; G1304-A1306 PolarHBondContact O-N 2.95Å; A1306-L1315 HydrophobicContact CB-CD2 4.37Å
1307	K	83.1	Confident	87.8	Confident	88 Å²	88	23.5 Å²	23.5	38%	0.383	13%	0.125	S	C	.	.	H	α-helix	trans	-95.4	-36.1	171.2	-67.8	-179.8	171.9	-165.5	0	112.3	E1296 G1304 M1305	E1296-K1307 WeakPolarHBondContact OE1-CD 3.27Å; E1296-K1307 WeakPolarHBondContact OE1-CE 3.5Å; E1296-K1307 IonicContact OE1-NZ 2.79Å; E1296-K1307 PolarHBondContact OE1-NZ 3.43Å; E1296-K1307 IonicContact OE2-NZ 3.79Å; E1296-K1307 PolarHBondContact OE2-NZ 2.92Å; G1304-K1307 WeakPolarHBondContact O-CA 3.15Å; G1304-K1307 WeakPolarHBondContact O-CB 2.9Å; G1304-K1307 PolarHBondContact O-N 3.06Å; M1305-K1307 PolarHBondContact O-N 3.03Å
1308	A	80.1	Confident	87.6	Confident	18 Å²	18	23.3 Å²	23.3	15%	0.149	12%	0.123	C	C	.	.	H	α-helix	trans	-80.3	-41.6	-176.6	0	0	0	0	0	112.8	F889 R905 G1304 M1305	F889-A1308 HydrophobicContact CD1-CB 4.45Å; F889-A1308 HydrophobicContact CE1-CB 4.32Å; R905-A1308 PolarHBondContact NH2-O 3.46Å; G1304-A1308 PolarHBondContact O-N 3.28Å; M1305-A1308 PolarHBondContact O-N 3.36Å
1309	K	81.8	Confident	87.5	Confident	14 Å²	14	25 Å²	25	6%	0.061	13%	0.13	C	C	.	.			trans	-110.5	147.3	-177.4	-59.3	-68.7	-176.2	-179.8	0	110.3	F889 D892 M1305 L1315	F889-K1309 WeakPolarHBondContact O-CE 3.23Å; F889-K1309 PolarHBondContact O-NZ 2.89Å; D892-K1309 WeakPolarHBondContact OD2-CE 3.35Å; D892-K1309 IonicContact OD2-NZ 3.2Å; D892-K1309 PolarHBondContact OD2-NZ 3.32Å; M1305-K1309 HydrophobicContact CG-CG 4.32Å; M1305-K1309 PolarHBondContact O-N 2.96Å; K1309-L1315 HydrophobicContact CB-CD2 4.42Å
1310	N	80.2	Confident	87.3	Confident	16 Å²	16	30.9 Å²	30.9	9%	0.086	15%	0.15	C	C	.	.			trans	-130.9	13.1	164.7	30.7	-98.2	0	0	0	117.6	D135 Y136 R905 V1312	D135-N1310 PolarHBondContact OD1-ND2 3.43Å; D135-N1310 PolarHBondContact OD1-OD1 3.3Å; D135-N1310 VanDerWaalsContact OD1-OD1 3.14Å; D135-N1310 PolarHBondContact OD2-OD1 3.42Å; Y136-N1310 HydrophobicContact CD1-CB 3.89Å; Y136-N1310 HydrophobicContact CG-CB 4.25Å; R905-N1310 PolarHBondContact NE-ND2 2.98Å; R905-N1310 PolarHBondContact NH1-ND2 2.92Å; R905-N1310 PolarHBondContact NH1-OD1 3.29Å; R905-N1310 PolarHBondContact NH2-ND2 3.4Å; R905-N1310 PolarHBondContact NH2-OD1 3.35Å; N1310-V1312 PolarHBondContact O-N 3.19Å
1311	S	88.5	Confident	87.3	Confident	15 Å²	15	31.3 Å²	31.3	11%	0.105	15%	0.153	C	C	.	.			trans	-59.5	122.1	157.1	154.5	0	0	0	0	109.7	C1314 L1315 D1335 E1342	S1311-C1314 WeakPolarHBondContact OG-CB 3.21Å; S1311-C1314 PolarHBondContact OG-N 3.37Å; S1311-L1315 VanDerWaalsContact O-CG 3.25Å; S1311-L1315 WeakPolarHBondContact O-CG 3.03Å; S1311-L1315 PolarHBondContact O-N 2.99Å; S1311-L1315 VanDerWaalsContact O-N 3.09Å; S1311-D1335 WeakPolarHBondContact CA-OD1 3.42Å; S1311-E1342 VanDerWaalsContact CB-OE1 3.31Å; S1311-E1342 WeakPolarHBondContact CB-OE1 3.44Å; S1311-E1342 PolarHBondContact OG-OE1 3.04Å; S1311-E1342 PolarHBondContact OG-OE2 2.96Å
1312	V	91	Very high	87.4	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-71.1	-42.2	-176.9	177.5	0	0	0	0	109.1	F19 N1310 C1314 L1315 A1316 L1325 A1328 Q1333 D1335	F19-V1312 HydrophobicContact CD2-CB 4.41Å; F19-V1312 HydrophobicContact CD2-CG1 4.42Å; F19-V1312 HydrophobicContact CD2-CG2 4.35Å; F19-V1312 HydrophobicContact CE1-CG1 4.46Å; F19-V1312 HydrophobicContact CE2-CB 3.74Å; F19-V1312 HydrophobicContact CE2-CG1 3.88Å; F19-V1312 HydrophobicContact CE2-CG2 4.12Å; F19-V1312 HydrophobicContact CZ-CB 4.14Å; F19-V1312 HydrophobicContact CZ-CG1 3.9Å; N1310-V1312 PolarHBondContact O-N 3.19Å; V1312-C1314 VanDerWaalsContact C-N 3.34Å; V1312-C1314 PolarHBondContact O-N 3.05Å; V1312-L1315 PolarHBondContact O-N 3.18Å; V1312-A1316 WeakPolarHBondContact O-CB 3.48Å; V1312-A1316 PolarHBondContact O-N 3.37Å; V1312-L1325 HydrophobicContact CG1-CD2 4.3Å; V1312-A1328 HydrophobicContact CB-CB 4.24Å; V1312-A1328 HydrophobicContact CG1-CB 3.51Å; V1312-A1328 HydrophobicContact CG2-CB 3.69Å; V1312-Q1333 HydrophobicContact CG2-CB 4.46Å; V1312-Q1333 HydrophobicContact CG2-CG 3.98Å; V1312-D1335 WeakPolarHBondContact CA-OD2 3.43Å; V1312-D1335 WeakPolarHBondContact CB-OD2 3.41Å; V1312-D1335 HydrophobicContact CG2-CB 4.41Å; V1312-D1335 PolarHBondContact N-OD1 3.33Å; V1312-D1335 PolarHBondContact N-OD2 3.48Å
1313	L	92.3	Very high	87.6	Confident	16 Å²	16	27 Å²	27	8%	0.084	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-40.4	176.6	-66.7	-179.5	0	0	0	111.7	I17 F19 F347 A1316 S1317 D1335 L1337 E1342 I1345	I17-L1313 HydrophobicContact CD1-CD1 4.04Å; F19-L1313 HydrophobicContact CZ-CD2 4.14Å; F19-L1313 HydrophobicContact CZ-CG 4.44Å; F347-L1313 HydrophobicContact CE1-CD2 4.08Å; F347-L1313 HydrophobicContact CZ-CD2 4.42Å; L1313-A1316 PolarHBondContact O-N 2.57Å; L1313-S1317 VanDerWaalsContact O-CB 3.28Å; L1313-S1317 WeakPolarHBondContact O-CB 3.38Å; L1313-S1317 PolarHBondContact O-N 3.33Å; L1313-S1317 PolarHBondContact O-OG 3.17Å; L1313-D1335 PolarHBondContact N-OD2 2.94Å; L1313-L1337 HydrophobicContact CD1-CD2 4.25Å; L1313-E1342 HydrophobicContact CB-CB 4.25Å; L1313-E1342 HydrophobicContact CD1-CB 4.12Å; L1313-I1345 HydrophobicContact CB-CD1 4.4Å
1314	C	90.8	Very high	87.9	Confident	1 Å²	1	24 Å²	24	1%	0.007	12%	0.121	C	C	.	.	H	α-helix	trans	-59.6	-51.5	174	178.8	0	0	0	0	111.1	S1311 V1312 A1316 S1317 F1318 T1341	S1311-C1314 WeakPolarHBondContact OG-CB 3.21Å; S1311-C1314 PolarHBondContact OG-N 3.37Å; V1312-C1314 VanDerWaalsContact C-N 3.34Å; V1312-C1314 PolarHBondContact O-N 3.05Å; C1314-A1316 PolarHBondContact O-N 2.93Å; C1314-S1317 PolarHBondContact O-N 3.05Å; C1314-S1317 PolarHBondContact O-OG 3.35Å; C1314-F1318 PolarHBondContact O-N 3.47Å; C1314-T1341 HydrophobicContact CB-CG2 4.34Å
1315	L	91.3	Very high	88.3	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-60.4	-45.4	178.1	-67.7	171.3	0	0	0	112	Y136 M1305 A1306 K1309 S1311 V1312 S1317 F1318 E1319 H1324	Y136-L1315 HydrophobicContact CE1-CD1 4.23Å; M1305-L1315 HydrophobicContact CB-CD2 4.4Å; M1305-L1315 HydrophobicContact CE-CD2 3.87Å; M1305-L1315 HydrophobicContact CG-CD2 4.37Å; A1306-L1315 HydrophobicContact CB-CD2 4.37Å; K1309-L1315 HydrophobicContact CB-CD2 4.42Å; S1311-L1315 VanDerWaalsContact O-CG 3.25Å; S1311-L1315 WeakPolarHBondContact O-CG 3.03Å; S1311-L1315 PolarHBondContact O-N 2.99Å; S1311-L1315 VanDerWaalsContact O-N 3.09Å; V1312-L1315 PolarHBondContact O-N 3.18Å; L1315-S1317 VanDerWaalsContact C-N 3.33Å; L1315-S1317 PolarHBondContact O-N 3.36Å; L1315-F1318 PolarHBondContact O-N 2.84Å; L1315-E1319 PolarHBondContact O-N 3.08Å; L1315-H1324 HydrophobicContact CB-CB 4.43Å
1316	A	91.6	Very high	88.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.2	-32.2	-178.1	0	0	0	0	0	112.9	F347 V1312 L1313 C1314 F1318 T1321 H1324 L1325	F347-A1316 HydrophobicContact CE1-CB 4.37Å; F347-A1316 HydrophobicContact CZ-CB 4.15Å; V1312-A1316 WeakPolarHBondContact O-CB 3.48Å; V1312-A1316 PolarHBondContact O-N 3.37Å; L1313-A1316 PolarHBondContact O-N 2.57Å; C1314-A1316 PolarHBondContact O-N 2.93Å; A1316-F1318 PolarHBondContact O-N 2.99Å; A1316-T1321 HydrophobicContact CB-CG2 4.13Å; A1316-T1321 WeakPolarHBondContact O-CA 3.47Å; A1316-T1321 WeakPolarHBondContact O-CB 3.43Å; A1316-T1321 WeakPolarHBondContact O-CG2 3.43Å; A1316-T1321 PolarHBondContact O-OG1 3.29Å; A1316-H1324 HydrophobicContact CB-CB 4.29Å; A1316-L1325 HydrophobicContact CB-CD2 4.23Å; A1316-L1325 HydrophobicContact CB-CG 4.2Å
1317	S	91.2	Very high	89	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.014	14%	0.135	C	C	.	.	H	α-helix	trans	-71.7	-19	176.6	80.8	0	0	0	0	113.6	R884 L1313 C1314 L1315	R884-S1317 PolarHBondContact NH2-O 3.25Å; L1313-S1317 VanDerWaalsContact O-CB 3.28Å; L1313-S1317 WeakPolarHBondContact O-CB 3.38Å; L1313-S1317 PolarHBondContact O-N 3.33Å; L1313-S1317 PolarHBondContact O-OG 3.17Å; C1314-S1317 PolarHBondContact O-N 3.05Å; C1314-S1317 PolarHBondContact O-OG 3.35Å; L1315-S1317 VanDerWaalsContact C-N 3.33Å; L1315-S1317 PolarHBondContact O-N 3.36Å
1318	F	88.4	Confident	89.4	Confident	10 Å²	10	23.9 Å²	23.9	4%	0.044	12%	0.117	C	C	.	.	H	α-helix	trans	-88.2	-67.8	-175.8	177.2	-109.7	0	0	0	112.8	R884 R885 K888 R1302 M1305 C1314 L1315 A1316	R884-F1318 PolarHBondContact NH1-O 3.2Å; R884-F1318 PolarHBondContact NH2-O 3.01Å; R885-F1318 HydrophobicContact CB-CE2 4.46Å; R885-F1318 HydrophobicContact CG-CE2 3.67Å; R885-F1318 HydrophobicContact CG-CZ 3.63Å; K888-F1318 HydrophobicContact CB-CD2 4.3Å; K888-F1318 HydrophobicContact CG-CD2 4.26Å; R1302-F1318 HydrophobicContact CB-CE1 3.96Å; M1305-F1318 HydrophobicContact CE-CB 3.24Å; M1305-F1318 HydrophobicContact CE-CD1 3.47Å; M1305-F1318 VanDerWaalsContact CE-CD1 3.47Å; M1305-F1318 HydrophobicContact CE-CD2 4.35Å; M1305-F1318 HydrophobicContact CE-CE1 4.46Å; M1305-F1318 HydrophobicContact CE-CG 3.43Å; M1305-F1318 VanDerWaalsContact CE-CG 3.43Å; M1305-F1318 HydrophobicContact SD-CB 4.17Å; M1305-F1318 HydrophobicContact SD-CD1 3.69Å; M1305-F1318 HydrophobicContact SD-CD2 4.2Å; M1305-F1318 HydrophobicContact SD-CE1 4.16Å; M1305-F1318 HydrophobicContact SD-CG 3.73Å; C1314-F1318 PolarHBondContact O-N 3.47Å; L1315-F1318 PolarHBondContact O-N 2.84Å; A1316-F1318 PolarHBondContact O-N 2.99Å
1319	E	87.6	Confident	89.9	Confident	46 Å²	46	23.5 Å²	23.5	22%	0.215	11%	0.113	C	C	.	.	S	Bend	trans	-152.1	160.4	179	-72.6	-167.2	173.1	0	0	110.9	Y881 R1302 L1315 T1321 H1324	Y881-E1319 WeakPolarHBondContact CE2-OE1 3.4Å; Y881-E1319 PolarHBondContact OH-OE1 2.96Å; R1302-E1319 WeakPolarHBondContact CD-OE2 3.28Å; L1315-E1319 PolarHBondContact O-N 3.08Å; E1319-T1321 PolarHBondContact O-N 3.45Å; E1319-H1324 PolarHBondContact O-CD2 3.12Å; E1319-H1324 VanDerWaalsContact O-CD2 3.27Å
1320	R	88.4	Confident	90.4	Very high	130 Å²	130	22.9 Å²	22.9	49%	0.491	11%	0.111	S	C	.	.			trans	49.7	45.9	178.2	-64.5	-177	167.4	-141.8	2.1	113.2	R1302 G1322 D1323 H1324	R1302-R1320 VanDerWaalsContact NH1-NE 3.16Å; R1320-G1322 VanDerWaalsContact C-N 3.26Å; R1320-G1322 PolarHBondContact O-N 3.4Å; R1320-G1322 VanDerWaalsContact O-N 3.15Å; R1320-D1323 HydrophobicContact CB-CB 4.18Å; R1320-D1323 WeakPolarHBondContact CD-OD2 3.43Å; R1320-D1323 IonicContact CZ-OD2 3.67Å; R1320-D1323 IonicContact NH1-OD2 3.71Å; R1320-D1323 PolarHBondContact NH1-OD2 2.87Å; R1320-D1323 PolarHBondContact O-N 3.26Å; R1320-D1323 VanDerWaalsContact O-N 3.09Å; R1320-H1324 PolarHBondContact O-CD2 3.45Å; R1320-H1324 PolarHBondContact O-N 3.23Å
1321	T	91.3	Very high	90.7	Very high	11 Å²	11	22.1 Å²	22.1	7%	0.067	11%	0.107	C	C	.	.	H	α-helix	trans	-44.9	-48.6	-178.8	-50.6	0	0	0	0	113	L340 F347 A1316 E1319 L1325	L340-T1321 HydrophobicContact CB-CG2 4.22Å; F347-T1321 HydrophobicContact CD2-CG2 3.42Å; F347-T1321 VanDerWaalsContact CD2-CG2 3.42Å; F347-T1321 HydrophobicContact CE2-CG2 3.29Å; F347-T1321 HydrophobicContact CG-CG2 4.45Å; F347-T1321 HydrophobicContact CZ-CG2 4.23Å; A1316-T1321 HydrophobicContact CB-CG2 4.13Å; A1316-T1321 WeakPolarHBondContact O-CA 3.47Å; A1316-T1321 WeakPolarHBondContact O-CB 3.43Å; A1316-T1321 WeakPolarHBondContact O-CG2 3.43Å; A1316-T1321 PolarHBondContact O-OG1 3.29Å; E1319-T1321 PolarHBondContact O-N 3.45Å; T1321-L1325 HydrophobicContact CG2-CD1 4.06Å; T1321-L1325 VanDerWaalsContact O-CG 3.31Å; T1321-L1325 WeakPolarHBondContact O-CG 3.28Å; T1321-L1325 PolarHBondContact O-N 3.41Å
1322	G	90.2	Very high	90.7	Very high	5 Å²	5	21.7 Å²	21.7	5%	0.052	10%	0.103	C	C	.	.	H	α-helix	trans	-62.2	-49.5	179.6	0	0	0	0	0	113.8	R1320 H1324 L1325 F1326	R1320-G1322 VanDerWaalsContact C-N 3.26Å; R1320-G1322 PolarHBondContact O-N 3.4Å; R1320-G1322 VanDerWaalsContact O-N 3.15Å; G1322-H1324 VanDerWaalsContact C-N 3.27Å; G1322-H1324 PolarHBondContact O-N 3.04Å; G1322-L1325 PolarHBondContact O-N 3.49Å; G1322-F1326 WeakPolarHBondContact O-CD2 3.19Å; G1322-F1326 WeakPolarHBondContact O-CG 3.47Å; G1322-F1326 PolarHBondContact O-N 3.25Å
1323	D	91.2	Very high	90.5	Very high	79 Å²	79	22.4 Å²	22.4	42%	0.422	11%	0.107	S	C	.	.	H	α-helix	trans	-56.1	-44.1	-178.4	-63.5	-5.8	0	0	0	111	R1320 E1327	R1320-D1323 HydrophobicContact CB-CB 4.18Å; R1320-D1323 WeakPolarHBondContact CD-OD2 3.43Å; R1320-D1323 IonicContact CZ-OD2 3.67Å; R1320-D1323 IonicContact NH1-OD2 3.71Å; R1320-D1323 PolarHBondContact NH1-OD2 2.87Å; R1320-D1323 PolarHBondContact O-N 3.26Å; R1320-D1323 VanDerWaalsContact O-N 3.09Å; D1323-E1327 WeakPolarHBondContact O-CB 3.36Å; D1323-E1327 PolarHBondContact O-N 3.33Å
1324	H	92.3	Very high	90.3	Very high	21 Å²	21	24.2 Å²	24.2	10%	0.097	12%	0.116	C	C	.	.	H	α-helix	trans	-67.9	-41.4	-179.4	-71.2	-57.5	0	0	0	113.2	L1315 A1316 E1319 R1320 G1322 A1328	L1315-H1324 HydrophobicContact CB-CB 4.43Å; A1316-H1324 HydrophobicContact CB-CB 4.29Å; E1319-H1324 PolarHBondContact O-CD2 3.12Å; E1319-H1324 VanDerWaalsContact O-CD2 3.27Å; R1320-H1324 PolarHBondContact O-CD2 3.45Å; R1320-H1324 PolarHBondContact O-N 3.23Å; G1322-H1324 VanDerWaalsContact C-N 3.27Å; G1322-H1324 PolarHBondContact O-N 3.04Å; H1324-A1328 VanDerWaalsContact O-CB 3.25Å; H1324-A1328 WeakPolarHBondContact O-CB 3.14Å; H1324-A1328 PolarHBondContact O-N 3.33Å
1325	L	93.5	Very high	90.2	Very high	34 Å²	34	24.4 Å²	24.4	18%	0.178	12%	0.117	C	C	.	.	H	α-helix	trans	-67.8	-44.4	178.4	-67.9	173.7	0	0	0	111.7	F19 L340 F347 V1312 A1316 T1321 G1322 A1328 A1329	F19-L1325 HydrophobicContact CE1-CD2 3.83Å; F19-L1325 HydrophobicContact CZ-CD2 4.35Å; L340-L1325 HydrophobicContact CD1-CD1 4.16Å; F347-L1325 HydrophobicContact CE2-CD1 4.19Å; F347-L1325 HydrophobicContact CZ-CD1 4.34Å; V1312-L1325 HydrophobicContact CG1-CD2 4.3Å; A1316-L1325 HydrophobicContact CB-CD2 4.23Å; A1316-L1325 HydrophobicContact CB-CG 4.2Å; T1321-L1325 HydrophobicContact CG2-CD1 4.06Å; T1321-L1325 VanDerWaalsContact O-CG 3.31Å; T1321-L1325 WeakPolarHBondContact O-CG 3.28Å; T1321-L1325 PolarHBondContact O-N 3.41Å; G1322-L1325 PolarHBondContact O-N 3.49Å; L1325-A1328 PolarHBondContact O-N 3.33Å; L1325-A1329 WeakPolarHBondContact O-CB 3.27Å; L1325-A1329 PolarHBondContact O-N 2.98Å
1326	F	93.4	Very high	90	Very high	36 Å²	36	28.9 Å²	28.9	16%	0.158	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-45	176.4	-65.9	-48.9	0	0	0	111.1	H94 Y97 I317 L337 G1322 A1328 A1329 Y1330	H94-F1326 AromaticContact CE1-CE1 3.5Å; H94-F1326 VanDerWaalsContact CE1-CE1 3.5Å; H94-F1326 WeakPolarHBondContact CE1-CE1 3.11Å; H94-F1326 AromaticContact CE1-CZ 3.94Å; Y97-F1326 HydrophobicContact CD1-CB 4.28Å; Y97-F1326 HydrophobicContact CE1-CB 3.77Å; Y97-F1326 HydrophobicContact CE1-CD1 4.07Å; Y97-F1326 HydrophobicContact CE1-CG 4.31Å; Y97-F1326 WeakPolarHBondContact CE1-O 3.4Å; Y97-F1326 HydrophobicContact CE2-CD1 4.19Å; Y97-F1326 AromaticContact CZ-CD1 3.7Å; I317-F1326 HydrophobicContact CG2-CE2 4.48Å; I317-F1326 HydrophobicContact CG2-CZ 3.73Å; L337-F1326 HydrophobicContact CD1-CE2 3.85Å; L337-F1326 HydrophobicContact CD1-CZ 4.39Å; G1322-F1326 WeakPolarHBondContact O-CD2 3.19Å; G1322-F1326 WeakPolarHBondContact O-CG 3.47Å; G1322-F1326 PolarHBondContact O-N 3.25Å; F1326-A1328 VanDerWaalsContact C-N 3.34Å; F1326-A1328 PolarHBondContact O-N 3.35Å; F1326-A1329 PolarHBondContact O-N 3.44Å; F1326-Y1330 WeakPolarHBondContact O-CB 3.21Å; F1326-Y1330 PolarHBondContact O-N 2.74Å
1327	E	91	Very high	89.8	Confident	45 Å²	45	29.4 Å²	29.4	21%	0.21	14%	0.141	C	C	.	.	H	α-helix	trans	-66.2	-35.9	-179.8	-167.5	169.6	-155.2	0	0	112.4	Y136 K140 D1323 Y1330 H1331	Y136-E1327 WeakPolarHBondContact OH-CB 3.27Å; Y136-E1327 WeakPolarHBondContact OH-CG 3.46Å; K140-E1327 WeakPolarHBondContact CD-OE1 3.16Å; K140-E1327 WeakPolarHBondContact CE-OE1 3.41Å; K140-E1327 VanDerWaalsContact CE-OE2 3.3Å; K140-E1327 WeakPolarHBondContact CE-OE2 2.92Å; K140-E1327 VanDerWaalsContact NZ-CD 3.26Å; K140-E1327 IonicContact NZ-OE1 3.53Å; K140-E1327 IonicContact NZ-OE2 3.32Å; K140-E1327 PolarHBondContact NZ-OE2 2.91Å; D1323-E1327 WeakPolarHBondContact O-CB 3.36Å; D1323-E1327 PolarHBondContact O-N 3.33Å; E1327-Y1330 PolarHBondContact O-N 2.92Å; E1327-H1331 PolarHBondContact O-CD2 2.78Å; E1327-H1331 VanDerWaalsContact O-CD2 3.27Å; E1327-H1331 PolarHBondContact O-N 2.78Å; E1327-H1331 VanDerWaalsContact O-N 3.17Å
1328	A	91.1	Very high	89.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-44.7	173.8	0	0	0	0	0	112.3	F19 Y136 V1312 H1324 L1325 F1326 Y1330 H1331 C1332 Q1333	F19-A1328 HydrophobicContact CB-CB 4.16Å; F19-A1328 HydrophobicContact CD2-CB 4.12Å; F19-A1328 HydrophobicContact CG-CB 4.01Å; Y136-A1328 PolarHBondContact OH-N 3.16Å; V1312-A1328 HydrophobicContact CB-CB 4.24Å; V1312-A1328 HydrophobicContact CG1-CB 3.51Å; V1312-A1328 HydrophobicContact CG2-CB 3.69Å; H1324-A1328 VanDerWaalsContact O-CB 3.25Å; H1324-A1328 WeakPolarHBondContact O-CB 3.14Å; H1324-A1328 PolarHBondContact O-N 3.33Å; L1325-A1328 PolarHBondContact O-N 3.33Å; F1326-A1328 VanDerWaalsContact C-N 3.34Å; F1326-A1328 PolarHBondContact O-N 3.35Å; A1328-Y1330 VanDerWaalsContact C-N 3.33Å; A1328-Y1330 PolarHBondContact O-N 3.19Å; A1328-H1331 PolarHBondContact O-N 3.15Å; A1328-C1332 PolarHBondContact O-N 3.5Å; A1328-C1332 VanDerWaalsContact O-N 3.12Å; A1328-Q1333 HydrophobicContact CB-CB 4.12Å; A1328-Q1333 PolarHBondContact O-N 3.46Å
1329	A	91.1	Very high	89.7	Confident	9 Å²	9	30.9 Å²	30.9	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-39.4	175.6	0	0	0	0	0	112.1	L21 Y97 L1325 F1326 H1331 C1332	L21-A1329 HydrophobicContact CD2-CB 4.35Å; Y97-A1329 WeakPolarHBondContact OH-CB 3.25Å; L1325-A1329 WeakPolarHBondContact O-CB 3.27Å; L1325-A1329 PolarHBondContact O-N 2.98Å; F1326-A1329 PolarHBondContact O-N 3.44Å; A1329-H1331 VanDerWaalsContact C-N 3.34Å; A1329-H1331 PolarHBondContact O-N 3.45Å; A1329-C1332 PolarHBondContact O-N 2.78Å
1330	Y	91.4	Very high	90	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-59.2	-43.5	175.6	174.1	-79.9	0	0	0	112.1	H100 I104 R143 L235 M237 L250 F1326 E1327 A1328 C1332	H100-Y1330 HydrophobicContact CB-CD2 3.79Å; H100-Y1330 HydrophobicContact CB-CE2 3.83Å; H100-Y1330 AromaticContact CG-CD2 3.81Å; I104-Y1330 HydrophobicContact CD1-CE2 3.86Å; R143-Y1330 VanDerWaalsContact NH1-CD1 3.29Å; R143-Y1330 PolarHBondContact NH2-OH 3.45Å; L235-Y1330 WeakPolarHBondContact O-CE1 3.5Å; L235-Y1330 PolarHBondContact O-OH 3.24Å; M237-Y1330 HydrophobicContact CE-CD1 4.48Å; M237-Y1330 HydrophobicContact CE-CD2 3.52Å; M237-Y1330 HydrophobicContact CE-CE1 4.38Å; M237-Y1330 HydrophobicContact CE-CE2 3.45Å; M237-Y1330 VanDerWaalsContact CE-CE2 3.45Å; M237-Y1330 HydrophobicContact CE-CG 4.04Å; M237-Y1330 HydrophobicContact CG-CE1 4.16Å; M237-Y1330 HydrophobicContact SD-CE2 4.24Å; L250-Y1330 HydrophobicContact CD1-CD2 4.37Å; L250-Y1330 HydrophobicContact CD1-CE2 4.19Å; L250-Y1330 HydrophobicContact CD2-CD2 4.15Å; F1326-Y1330 WeakPolarHBondContact O-CB 3.21Å; F1326-Y1330 PolarHBondContact O-N 2.74Å; E1327-Y1330 PolarHBondContact O-N 2.92Å; A1328-Y1330 VanDerWaalsContact C-N 3.33Å; A1328-Y1330 PolarHBondContact O-N 3.19Å; Y1330-C1332 VanDerWaalsContact C-N 3.29Å
1331	H	87.7	Confident	90.2	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	0.2	-177.7	-75.8	-58.5	0	0	0	114.2	R143 L236 E1327 A1328 A1329 Q1333	R143-H1331 PolarHBondContact NH1-NE2 3.13Å; L236-H1331 PolarHBondContact O-ND1 3.17Å; E1327-H1331 PolarHBondContact O-CD2 2.78Å; E1327-H1331 VanDerWaalsContact O-CD2 3.27Å; E1327-H1331 PolarHBondContact O-N 2.78Å; E1327-H1331 VanDerWaalsContact O-N 3.17Å; A1328-H1331 PolarHBondContact O-N 3.15Å; A1329-H1331 VanDerWaalsContact C-N 3.34Å; A1329-H1331 PolarHBondContact O-N 3.45Å; H1331-Q1333 VanDerWaalsContact C-N 3.25Å; H1331-Q1333 PolarHBondContact O-N 2.91Å
1332	C	88.1	Confident	90.3	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.034	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	51	-167.3	-164.6	0	0	0	0	112.3	K18 F19 P238 T245 A1328 A1329 Y1330 D1334	K18-C1332 VanDerWaalsContact CE-SG 3.55Å; F19-C1332 CarbonylContact O-C 3.46Å; F19-C1332 WeakPolarHBondContact O-CA 3.24Å; F19-C1332 PolarHBondContact O-SG 2.99Å; P238-C1332 HydrophobicContact CG-CB 3.73Å; T245-C1332 HydrophobicContact CG2-CB 3.62Å; A1328-C1332 PolarHBondContact O-N 3.5Å; A1328-C1332 VanDerWaalsContact O-N 3.12Å; A1329-C1332 PolarHBondContact O-N 2.78Å; Y1330-C1332 VanDerWaalsContact C-N 3.29Å; C1332-D1334 PolarHBondContact O-N 3.4Å
1333	Q	87	Confident	90.4	Very high	17 Å²	17	23.2 Å²	23.2	8%	0.079	12%	0.121	C	C	.	.			trans	-68.4	128.9	-172.5	-174	58.5	32.2	0	0	110.5	F19 Y136 V1312 A1328 H1331	F19-Q1333 PolarHBondContact N-O 3.39Å; Y136-Q1333 HydrophobicContact CD2-CG 4.06Å; Y136-Q1333 HydrophobicContact CG-CG 4.38Å; V1312-Q1333 HydrophobicContact CG2-CB 4.46Å; V1312-Q1333 HydrophobicContact CG2-CG 3.98Å; A1328-Q1333 HydrophobicContact CB-CB 4.12Å; A1328-Q1333 PolarHBondContact O-N 3.46Å; H1331-Q1333 VanDerWaalsContact C-N 3.25Å; H1331-Q1333 PolarHBondContact O-N 2.91Å
1334	D	87.5	Confident	90.5	Very high	53 Å²	53	23.2 Å²	23.2	28%	0.283	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118.4	166.5	-171.6	20.7	0	0	0	108.5	N16 K18 C1332 Q1336	N16-D1334 WeakPolarHBondContact CB-OD1 3.46Å; N16-D1334 PolarHBondContact ND2-OD1 3.23Å; N16-D1334 PolarHBondContact ND2-OD2 3.02Å; K18-D1334 HydrophobicContact CG-CB 4.45Å; C1332-D1334 PolarHBondContact O-N 3.4Å; D1334-Q1336 PolarHBondContact OD2-NE2 3.15Å; D1334-Q1336 VanDerWaalsContact OD2-NE2 3.1Å
1335	D	88.3	Confident	90.5	Very high	5 Å²	5	23.3 Å²	23.3	3%	0.027	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	108.3	-177.9	-165.1	5.9	0	0	0	109.3	N16 I17 F19 S1311 V1312 L1313	N16-D1335 CarbonylContact C-O 3.57Å; N16-D1335 VanDerWaalsContact CA-O 3.31Å; N16-D1335 WeakPolarHBondContact CA-O 3.26Å; I17-D1335 PolarHBondContact N-O 2.96Å; I17-D1335 WeakPolarHBondContact O-CB 3.19Å; I17-D1335 PolarHBondContact O-N 3.48Å; F19-D1335 HydrophobicContact CD2-CB 4.39Å; F19-D1335 HydrophobicContact CE2-CB 3.87Å; S1311-D1335 WeakPolarHBondContact CA-OD1 3.42Å; V1312-D1335 WeakPolarHBondContact CA-OD2 3.43Å; V1312-D1335 WeakPolarHBondContact CB-OD2 3.41Å; V1312-D1335 HydrophobicContact CG2-CB 4.41Å; V1312-D1335 PolarHBondContact N-OD1 3.33Å; V1312-D1335 PolarHBondContact N-OD2 3.48Å; L1313-D1335 PolarHBondContact N-OD2 2.94Å
1336	Q	87.5	Confident	90.4	Very high	97 Å²	97	25 Å²	25	45%	0.453	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	123.9	-179.4	-66.5	-70.7	-34	0	0	109.2	D1334 T1338	D1334-Q1336 PolarHBondContact OD2-NE2 3.15Å; D1334-Q1336 VanDerWaalsContact OD2-NE2 3.1Å; Q1336-T1338 HydrophobicContact CB-CG2 4.46Å; Q1336-T1338 PolarHBondContact O-N 3.24Å
1337	L	88.1	Confident	90.3	Very high	10 Å²	10	26.3 Å²	26.3	5%	0.052	15%	0.153	C	C	.	.			trans	-85.3	57.3	-168.2	-56.6	168.8	0	0	0	112.6	V14 E15 I17 L1313 E1342 N1343 L1346	V14-L1337 HydrophobicContact CB-CD1 4.02Å; V14-L1337 HydrophobicContact CG1-CD1 3.6Å; V14-L1337 VanDerWaalsContact O-CD1 3.3Å; V14-L1337 WeakPolarHBondContact O-CD1 3.48Å; E15-L1337 WeakPolarHBondContact O-CB 3.13Å; E15-L1337 WeakPolarHBondContact O-CG 3.2Å; E15-L1337 PolarHBondContact O-N 3.1Å; E15-L1337 VanDerWaalsContact O-N 3.07Å; I17-L1337 HydrophobicContact CD1-CD1 4.37Å; I17-L1337 HydrophobicContact CD1-CD2 4.08Å; I17-L1337 HydrophobicContact CG1-CD1 4.16Å; I17-L1337 HydrophobicContact CG1-CD2 4.25Å; L1313-L1337 HydrophobicContact CD1-CD2 4.25Å; L1337-E1342 HydrophobicContact CB-CG 4.4Å; L1337-E1342 HydrophobicContact CD2-CB 3.81Å; L1337-E1342 HydrophobicContact CD2-CG 4.23Å; L1337-N1343 PolarHBondContact O-ND2 3.04Å; L1337-N1343 PolarHBondContact O-OD1 2.96Å; L1337-L1346 HydrophobicContact CD1-CD1 3.21Å; L1337-L1346 HydrophobicContact CD2-CD1 3.59Å; L1337-L1346 HydrophobicContact CG-CD1 3.98Å
1338	T	87.6	Confident	90.2	Very high	43 Å²	43	25.4 Å²	25.4	26%	0.264	15%	0.15	S	C	.	.			trans	-96.3	-24	-173.6	59.9	0	0	0	0	114.1	S904 Q1336	S904-T1338 WeakPolarHBondContact O-CB 3.34Å; S904-T1338 PolarHBondContact O-OG1 3.4Å; Q1336-T1338 HydrophobicContact CB-CG2 4.46Å; Q1336-T1338 PolarHBondContact O-N 3.24Å
1339	G	90.2	Very high	90.1	Very high	1 Å²	1	30 Å²	30	1%	0.01	18%	0.18	C	C	.	.	S	Bend	trans	-81	175.8	-179.1	0	0	0	0	0	114.5	D892 E1342 N1343	D892-G1339 VanDerWaalsContact OD1-CA 3.3Å; D892-G1339 WeakPolarHBondContact OD1-CA 3.42Å; G1339-E1342 WeakPolarHBondContact CA-OE1 3.49Å; G1339-E1342 PolarHBondContact N-OE1 2.85Å; G1339-N1343 WeakPolarHBondContact O-CB 3.32Å; G1339-N1343 PolarHBondContact O-ND2 2.82Å
1340	V	93.2	Very high	90	Very high	22 Å²	22	31.7 Å²	31.7	13%	0.133	19%	0.189	C	C	.	.	H	α-helix	trans	-75.7	-45.4	-174.9	174.7	0	0	0	0	111.4	E891 D892 N1343 I1344 T1350 V1352	E891-V1340 HydrophobicContact CG-CB 4.44Å; D892-V1340 PolarHBondContact OD1-N 3.35Å; V1340-N1343 PolarHBondContact O-N 3.19Å; V1340-I1344 HydrophobicContact CG1-CD1 3.6Å; V1340-I1344 HydrophobicContact CG1-CG1 4.35Å; V1340-I1344 VanDerWaalsContact O-CG1 3.28Å; V1340-I1344 WeakPolarHBondContact O-CG1 3.34Å; V1340-I1344 PolarHBondContact O-N 3.25Å; V1340-T1350 HydrophobicContact CG1-CG2 4.14Å; V1340-V1352 HydrophobicContact CG2-CB 4.45Å; V1340-V1352 HydrophobicContact CG2-CG2 3.91Å
1341	T	93.2	Very high	89.7	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-53.9	-176.9	-80.3	0	0	0	0	113.1	L352 K888 E891 C1314 N1343 I1344 I1345	L352-T1341 HydrophobicContact CD2-CG2 4.19Å; K888-T1341 PolarHBondContact NZ-OG1 3.09Å; E891-T1341 WeakPolarHBondContact OE1-CB 3.46Å; E891-T1341 PolarHBondContact OE1-N 3.04Å; E891-T1341 PolarHBondContact OE1-OG1 3.34Å; C1314-T1341 HydrophobicContact CB-CG2 4.34Å; T1341-N1343 VanDerWaalsContact C-N 3.34Å; T1341-N1343 PolarHBondContact O-N 3.12Å; T1341-I1344 PolarHBondContact O-N 2.8Å; T1341-I1345 HydrophobicContact CG2-CD1 3.61Å; T1341-I1345 HydrophobicContact CG2-CG1 4.41Å; T1341-I1345 VanDerWaalsContact O-CG1 3.28Å; T1341-I1345 WeakPolarHBondContact O-CG1 3.45Å; T1341-I1345 PolarHBondContact O-N 2.87Å
1342	E	92.4	Very high	89.8	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-40.9	-178.6	45.5	-93	-150.1	0	0	112.5	S1311 L1313 L1337 G1339 I1345 L1346	S1311-E1342 VanDerWaalsContact CB-OE1 3.31Å; S1311-E1342 WeakPolarHBondContact CB-OE1 3.44Å; S1311-E1342 PolarHBondContact OG-OE1 3.04Å; S1311-E1342 PolarHBondContact OG-OE2 2.96Å; L1313-E1342 HydrophobicContact CB-CB 4.25Å; L1313-E1342 HydrophobicContact CD1-CB 4.12Å; L1337-E1342 HydrophobicContact CB-CG 4.4Å; L1337-E1342 HydrophobicContact CD2-CB 3.81Å; L1337-E1342 HydrophobicContact CD2-CG 4.23Å; G1339-E1342 WeakPolarHBondContact CA-OE1 3.49Å; G1339-E1342 PolarHBondContact N-OE1 2.85Å; E1342-I1345 PolarHBondContact O-N 3.2Å; E1342-L1346 WeakPolarHBondContact O-CG 3.41Å; E1342-L1346 PolarHBondContact O-N 2.83Å
1343	N	92.9	Very high	90	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-40.3	177.3	-78.2	-44.6	0	0	0	111.7	L1337 G1339 V1340 T1341 I1345 L1346 G1347 N1348 T1350	L1337-N1343 PolarHBondContact O-ND2 3.04Å; L1337-N1343 PolarHBondContact O-OD1 2.96Å; G1339-N1343 WeakPolarHBondContact O-CB 3.32Å; G1339-N1343 PolarHBondContact O-ND2 2.82Å; V1340-N1343 PolarHBondContact O-N 3.19Å; T1341-N1343 VanDerWaalsContact C-N 3.34Å; T1341-N1343 PolarHBondContact O-N 3.12Å; N1343-I1345 PolarHBondContact O-N 3.35Å; N1343-L1346 PolarHBondContact O-N 3.26Å; N1343-G1347 CarbonylContact O-C 3.55Å; N1343-G1347 WeakPolarHBondContact O-CA 3.49Å; N1343-G1347 PolarHBondContact O-N 3.33Å; N1343-N1348 HydrophobicContact CB-CB 4.02Å; N1343-N1348 PolarHBondContact O-N 3.18Å; N1343-N1348 WeakPolarHBondContact OD1-CB 3.48Å; N1343-N1348 PolarHBondContact OD1-ND2 2.89Å; N1343-T1350 HydrophobicContact CB-CG2 4.1Å
1344	I	93	Very high	90.2	Very high	78 Å²	78	44.9 Å²	44.9	40%	0.4	26%	0.257	S	S	.	.	H	α-helix	trans	-62.8	-41.7	173.1	-68.9	170.6	0	0	0	111.5	L352 V1340 T1341 L1346 G1347 T1350	L352-I1344 HydrophobicContact CD2-CG2 4.31Å; V1340-I1344 HydrophobicContact CG1-CD1 3.6Å; V1340-I1344 HydrophobicContact CG1-CG1 4.35Å; V1340-I1344 VanDerWaalsContact O-CG1 3.28Å; V1340-I1344 WeakPolarHBondContact O-CG1 3.34Å; V1340-I1344 PolarHBondContact O-N 3.25Å; T1341-I1344 PolarHBondContact O-N 2.8Å; I1344-L1346 VanDerWaalsContact C-N 3.34Å; I1344-L1346 PolarHBondContact O-N 3.39Å; I1344-G1347 PolarHBondContact O-N 3.24Å; I1344-T1350 HydrophobicContact CG1-CG2 4.2Å
1345	I	92.8	Very high	90.3	Very high	24 Å²	24	43.9 Å²	43.9	12%	0.123	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-41.7	179.9	-73.2	168.5	0	0	0	111.1	F347 L351 L352 L1313 T1341 E1342 N1343	F347-I1345 HydrophobicContact CD1-CD1 4.18Å; F347-I1345 HydrophobicContact CE1-CD1 4.44Å; L351-I1345 HydrophobicContact CB-CG1 4.19Å; L351-I1345 HydrophobicContact CB-CG2 4.4Å; L351-I1345 HydrophobicContact CD1-CG2 4Å; L351-I1345 HydrophobicContact CD2-CG2 4.4Å; L351-I1345 HydrophobicContact CG-CG2 4.49Å; L352-I1345 HydrophobicContact CD2-CD1 4.49Å; L352-I1345 HydrophobicContact CD2-CG1 4.12Å; L352-I1345 HydrophobicContact CG-CG1 4.39Å; L1313-I1345 HydrophobicContact CB-CD1 4.4Å; T1341-I1345 HydrophobicContact CG2-CD1 3.61Å; T1341-I1345 HydrophobicContact CG2-CG1 4.41Å; T1341-I1345 VanDerWaalsContact O-CG1 3.28Å; T1341-I1345 WeakPolarHBondContact O-CG1 3.45Å; T1341-I1345 PolarHBondContact O-N 2.87Å; E1342-I1345 PolarHBondContact O-N 3.2Å; N1343-I1345 PolarHBondContact O-N 3.35Å
1346	L	91.3	Very high	90.3	Very high	69 Å²	69	46 Å²	46	36%	0.361	27%	0.272	S	S	.	.	H	α-helix	trans	-86.5	-16.1	-177.7	-65.4	169.9	0	0	0	113.7	I17 L1337 E1342 N1343 I1344	I17-L1346 HydrophobicContact CD1-CD1 3.74Å; I17-L1346 HydrophobicContact CD1-CD2 3.98Å; I17-L1346 HydrophobicContact CD1-CG 4.43Å; L1337-L1346 HydrophobicContact CD1-CD1 3.21Å; L1337-L1346 HydrophobicContact CD2-CD1 3.59Å; L1337-L1346 HydrophobicContact CG-CD1 3.98Å; E1342-L1346 WeakPolarHBondContact O-CG 3.41Å; E1342-L1346 PolarHBondContact O-N 2.83Å; N1343-L1346 PolarHBondContact O-N 3.26Å; I1344-L1346 VanDerWaalsContact C-N 3.34Å; I1344-L1346 PolarHBondContact O-N 3.39Å
1347	G	90.1	Very high	90.5	Very high	63 Å²	63	45.7 Å²	45.7	65%	0.649	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	20.8	-175.9	0	0	0	0	0	114	N1343 I1344	N1343-G1347 CarbonylContact O-C 3.55Å; N1343-G1347 WeakPolarHBondContact O-CA 3.49Å; N1343-G1347 PolarHBondContact O-N 3.33Å; I1344-G1347 PolarHBondContact O-N 3.24Å
1348	N	89.9	Confident	90.5	Very high	27 Å²	27	52.4 Å²	52.4	14%	0.144	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-80.5	150.6	171.9	-72.3	-10.9	0	0	0	110.7	V14 N1343	V14-N1348 PolarHBondContact O-ND2 3.05Å; N1343-N1348 HydrophobicContact CB-CB 4.02Å; N1343-N1348 PolarHBondContact O-N 3.18Å; N1343-N1348 WeakPolarHBondContact OD1-CB 3.48Å; N1343-N1348 PolarHBondContact OD1-ND2 2.89Å
1349	P	88.4	Confident	90.6	Very high	97 Å²	97	57.7 Å²	57.7	63%	0.63	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-64.3	139	169.2	28.4	-33.2	0	0	0	110.6
1350	T	90	Very high	90.4	Very high	43 Å²	43	65.4 Å²	65.4	26%	0.264	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-81.8	140.8	-180	53.4	0	0	0	0	111	V1340 N1343 I1344 V1352 G1355	V1340-T1350 HydrophobicContact CG1-CG2 4.14Å; N1343-T1350 HydrophobicContact CB-CG2 4.1Å; I1344-T1350 HydrophobicContact CG1-CG2 4.2Å; T1350-V1352 PolarHBondContact O-N 3.2Å; T1350-G1355 WeakPolarHBondContact O-CA 3.49Å
1351	R	85.6	Confident	90	Very high	177 Å²	177	68.1 Å²	68.1	67%	0.668	39%	0.392	S	S	*	.	S	Bend	trans	-78.1	21.9	177.4	-63.1	-168.1	178.8	-167.9	0.3	114.9	T1356	R1351-T1356 VanDerWaalsContact O-CG2 3.23Å; R1351-T1356 WeakPolarHBondContact O-CG2 3.47Å
1352	V	90.1	Very high	89.4	Confident	25 Å²	25	74.5 Å²	74.5	15%	0.152	43%	0.426	C	S	.	.	S	Bend	trans	-120.4	146.8	-179.6	178	0	0	0	0	108.4	A894 A1041 V1340 T1350 T1354	A894-V1352 HydrophobicContact CB-CG1 4.02Å; A894-V1352 HydrophobicContact CB-CG2 4.32Å; A1041-V1352 HydrophobicContact CB-CG1 3.56Å; V1340-V1352 HydrophobicContact CG2-CB 4.45Å; V1340-V1352 HydrophobicContact CG2-CG2 3.91Å; T1350-V1352 PolarHBondContact O-N 3.2Å; V1352-T1354 PolarHBondContact O-N 2.98Å
1353	G	90.8	Very high	88.5	Confident	31 Å²	31	84.2 Å²	84.2	32%	0.32	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	68.1	-124.9	-176.5	0	0	0	0	0	111.7	G1039 G1355 T1356	G1039-G1353 VanDerWaalsContact O-CA 3.24Å; G1039-G1353 WeakPolarHBondContact O-CA 3.48Å; G1039-G1353 PolarHBondContact O-N 2.87Å; G1353-G1355 PolarHBondContact O-N 2.56Å; G1353-T1356 WeakPolarHBondContact O-CG2 3.42Å; G1353-T1356 PolarHBondContact O-N 3.22Å; G1353-T1356 PolarHBondContact O-OG1 3.26Å
1354	T	92	Very high	87.1	Confident	69 Å²	69	92.7 Å²	92.7	42%	0.423	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-66	-17.6	-176.3	52.3	0	0	0	0	114	E528 L532 V1352	E528-T1354 HydrophobicContact CG-CG2 4.45Å; E528-T1354 WeakPolarHBondContact OE1-CB 3.22Å; E528-T1354 PolarHBondContact OE1-OG1 3.39Å; L532-T1354 HydrophobicContact CD1-CG2 4.28Å; V1352-T1354 PolarHBondContact O-N 2.98Å
1355	G	88.9	Confident	85.6	Confident	32 Å²	32	95.9 Å²	95.9	33%	0.33	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-90.2	12.2	176.4	0	0	0	0	0	115.2	T1350 G1353	T1350-G1355 WeakPolarHBondContact O-CA 3.49Å; G1353-G1355 PolarHBondContact O-N 2.56Å
1356	T	89	Confident	84.2	Confident	48 Å²	48	102.5 Å²	102.5	29%	0.294	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-81.3	-15.9	177.8	48.9	0	0	0	0	114.1	R1351 G1353	R1351-T1356 VanDerWaalsContact O-CG2 3.23Å; R1351-T1356 WeakPolarHBondContact O-CG2 3.47Å; G1353-T1356 WeakPolarHBondContact O-CG2 3.42Å; G1353-T1356 PolarHBondContact O-N 3.22Å; G1353-T1356 PolarHBondContact O-OG1 3.26Å
1357	F	90.9	Very high	82.9	Confident	92 Å²	92	104.5 Å²	104.5	40%	0.404	55%	0.546	S	S	.	.	S	Bend	trans	-135.1	156.2	-179.8	61.3	-90.5	0	0	0	110.5	L1359	F1357-L1359 HydrophobicContact CD2-CD2 4.19Å; F1357-L1359 HydrophobicContact CD2-CG 4.5Å; F1357-L1359 HydrophobicContact CE2-CD2 3.79Å; F1357-L1359 HydrophobicContact CE2-CG 4.15Å
1358	D	89	Confident	81.6	Confident	151 Å²	151	107.8 Å²	107.8	81%	0.807	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-101.1	148.2	174	-66.5	-46.2	0	0	0	110.7
1359	L	88.5	Confident	80.3	Confident	154 Å²	154	114.2 Å²	114.2	81%	0.806	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-99.7	121.4	174.5	-68.2	175.6	0	0	0	110	F1357	F1357-L1359 HydrophobicContact CD2-CD2 4.19Å; F1357-L1359 HydrophobicContact CD2-CG 4.5Å; F1357-L1359 HydrophobicContact CE2-CD2 3.79Å; F1357-L1359 HydrophobicContact CE2-CG 4.15Å
1360	L	87	Confident	79	Confident	163 Å²	163	115.8 Å²	115.8	85%	0.853	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-99.6	149.9	174.5	-60.6	174.9	0	0	0	110.3
1361	S	84.6	Confident	77.6	Confident	78 Å²	78	121.3 Å²	121.3	55%	0.545	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-100.1	130.8	175.8	-178.8	0	0	0	0	110.8	R1363 W1364	S1361-R1363 PolarHBondContact O-N 3.07Å; S1361-W1364 VanDerWaalsContact O-CB 3.24Å; S1361-W1364 WeakPolarHBondContact O-CB 3.35Å; S1361-W1364 PolarHBondContact O-N 2.88Å
1362	D	80.8	Confident	76.4	Confident	135 Å²	135	121 Å²	121	72%	0.722	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-22.3	176.6	-55.2	-12.5	0	0	0	113.9	W1364 E1365	D1362-W1364 PolarHBondContact O-N 2.94Å; D1362-E1365 PolarHBondContact O-N 3.4Å
1363	R	72.5	Confident	75.1	Confident	206 Å²	206	128.9 Å²	128.9	78%	0.777	65%	0.648	S	S	*	*	H	α-helix	trans	-63.9	-24.4	175.5	-72.3	-172.1	178.4	-170.8	0.1	112.9	S1361 K1366	S1361-R1363 PolarHBondContact O-N 3.07Å; R1363-K1366 PolarHBondContact O-N 3.34Å
1364	W	63.1	Low	73.7	Confident	185 Å²	185	132.8 Å²	132.8	70%	0.701	67%	0.668	S	S	*	*	H	α-helix	trans	-64.3	-41.5	-179.9	-173	-94.2	0	0	0	111.8	S1361 D1362 K1366 N1367	S1361-W1364 VanDerWaalsContact O-CB 3.24Å; S1361-W1364 WeakPolarHBondContact O-CB 3.35Å; S1361-W1364 PolarHBondContact O-N 2.88Å; D1362-W1364 PolarHBondContact O-N 2.94Å; W1364-K1366 VanDerWaalsContact C-N 3.3Å; W1364-K1366 PolarHBondContact O-N 2.8Å; W1364-N1367 PolarHBondContact O-N 3.43Å
1365	E	62.8	Low	72.3	Confident	145 Å²	145	133.6 Å²	133.6	68%	0.678	67%	0.673	S	S	*	*	H	α-helix	trans	-62.3	-36.2	-180	-70.2	-173.3	155.6	0	0	112.6	D1362 N1367 L1368	D1362-E1365 PolarHBondContact O-N 3.4Å; E1365-N1367 VanDerWaalsContact C-N 3.28Å; E1365-N1367 PolarHBondContact O-N 2.97Å; E1365-L1368 PolarHBondContact O-N 2.95Å
1366	K	63.6	Low	71.3	Confident	163 Å²	163	140.2 Å²	140.2	71%	0.709	70%	0.7	S	S	*	*	H	α-helix	trans	-65.3	-28.6	178.5	-76	-173	176.4	-178	0	113.8	R1363 W1364	R1363-K1366 PolarHBondContact O-N 3.34Å; W1364-K1366 VanDerWaalsContact C-N 3.3Å; W1364-K1366 PolarHBondContact O-N 2.8Å
1367	N	62.7	Low	69.7	Low	111 Å²	111	145.6 Å²	145.6	59%	0.594	73%	0.726	S	S	*	*	H	α-helix	trans	-81.3	-23.5	-179.2	-75.8	-21.2	0	0	0	112.9	W1364 E1365 Q1369 L1370	W1364-N1367 PolarHBondContact O-N 3.43Å; E1365-N1367 VanDerWaalsContact C-N 3.28Å; E1365-N1367 PolarHBondContact O-N 2.97Å; N1367-Q1369 PolarHBondContact O-N 2.98Å; N1367-L1370 PolarHBondContact O-N 3.42Å
1368	L	63.6	Low	68	Low	131 Å²	131	147.9 Å²	147.9	69%	0.686	74%	0.742	S	S	*	*	H	α-helix	trans	-69	-21.3	175.6	-89	149.4	0	0	0	112.9	E1365	E1365-L1368 PolarHBondContact O-N 2.95Å
1369	Q	61.9	Low	65.7	Low	163 Å²	163	152.4 Å²	152.4	76%	0.762	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	6.5	179.8	-70.5	-172.3	-15.7	0	0	114.6	N1367 D1371	N1367-Q1369 PolarHBondContact O-N 2.98Å; Q1369-D1371 PolarHBondContact O-N 3.43Å
1370	L	61	Low	64.5	Low	130 Å²	130	152.3 Å²	152.3	68%	0.681	75%	0.752	S	S	*	*			trans	-72.2	96.9	174.6	-78	162.2	0	0	0	109.5	N1367 M1372	N1367-L1370 PolarHBondContact O-N 3.42Å; L1370-M1372 PolarHBondContact O-N 3.06Å; L1370-M1372 VanDerWaalsContact O-N 3.1Å
1371	D	60.7	Low	63.3	Low	159 Å²	159	151.7 Å²	151.7	85%	0.85	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-49.3	117.2	170.3	-83.4	-30.4	0	0	0	109.5	Q1369 K1373	Q1369-D1371 PolarHBondContact O-N 3.43Å; D1371-K1373 PolarHBondContact O-N 3.4Å
1372	M	61.1	Low	62.1	Low	170 Å²	170	155.8 Å²	155.8	84%	0.837	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-57.5	116.9	171.4	-83.1	-163.5	62.2	0	0	108	L1370 P1374	L1370-M1372 PolarHBondContact O-N 3.06Å; L1370-M1372 VanDerWaalsContact O-N 3.1Å; M1372-P1374 WeakPolarHBondContact O-CD 3.47Å; M1372-P1374 VanDerWaalsContact O-N 3.11Å
1373	K	62.7	Low	61	Low	190 Å²	190	157.1 Å²	157.1	83%	0.826	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-51.5	123	170.9	-80.9	-175	174.8	-178.8	0	107.9	D1371 T1375	D1371-K1373 PolarHBondContact O-N 3.4Å; K1373-T1375 PolarHBondContact O-N 3.07Å
1374	P	62.2	Low	60.3	Low	113 Å²	113	154 Å²	154	73%	0.734	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-57.8	128.4	178.1	21.2	-30.1	0	0	0	108.4	M1372 L1376	M1372-P1374 WeakPolarHBondContact O-CD 3.47Å; M1372-P1374 VanDerWaalsContact O-N 3.11Å; P1374-L1376 PolarHBondContact O-N 3.1Å
1375	T	62.8	Low	60.1	Low	87 Å²	87	151.9 Å²	151.9	53%	0.534	76%	0.763	S	S	.	*	P	Polyproline II helix	trans	-65.6	129.1	175.8	32.1	0	0	0	0	108.9	K1373 L1377 N1378	K1373-T1375 PolarHBondContact O-N 3.07Å; T1375-L1377 PolarHBondContact O-N 3.05Å; T1375-N1378 PolarHBondContact O-N 2.96Å; T1375-N1378 VanDerWaalsContact O-N 3.13Å
1376	L	66.5	Low	60	Low	170 Å²	170	152.4 Å²	152.4	89%	0.89	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-0.1	176.9	-93.3	152.6	0	0	0	115	P1374	P1374-L1376 PolarHBondContact O-N 3.1Å
1377	L	56.5	Low	59.7	Low	162 Å²	162	151.6 Å²	151.6	85%	0.848	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	0	178.4	-97.4	142.9	0	0	0	113.9	T1375	T1375-L1377 PolarHBondContact O-N 3.05Å
1378	N	54.3	Low	59.4	Low	139 Å²	139	155 Å²	155	74%	0.743	79%	0.789	S	S	*	*			trans	-108.4	18.9	177.6	-82.7	-9.7	0	0	0	113.8	T1375	T1375-N1378 PolarHBondContact O-N 2.96Å; T1375-N1378 VanDerWaalsContact O-N 3.13Å
1379	F	39.9	Very low	59	Low	246 Å²	246	157.2 Å²	157.2	100%	1.079	80%	0.799	S	S	*	*			trans	-117.3	0	172.2	-92.5	-78.4	0	0	0	111.7

Retrieved 1,379 of 1,379 residues in 1623 ms (Link to these results)

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