A0A077Z968_TRITR Loading...

Rho-associated protein kinase let-502

Negatively regulates mel-11 to relieve the inhibition of mlc-4, allowing contraction of the circumferentially oriented microfilaments in epidermal cells and thereby regulating myosin II contractility during spermathecal contraction, cleavage furrow contraction in early embryos, and embryonic elongation and morphogenesis. Required for P-cell migration. May also play a role in oocyte cellularization.

AlphaFold DB , UniProt , Accession A0A077Z968, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,383 aa.

						>A0A077Z968_TRITR|A0A077Z968
MAELTQADLEDALVQLSGKLLNPRSSINVDCLLDALSALVGDCDFPALRRIKNIENFLLRYQTSVHEINGTRMRSSHFKLIKVIGRGAFGEVQLVRHKFTGKVYAMKLLNKFEMIKRADSAFFWEERDIMAYADPQWIVKLYYAFQDAKYLYMVMEYMPGGDLVNLMANYDVPEKWAKFYTAEVVLALDAIHSMGYIHRDVKPDNMLISALGHVKLADFGTCVRMGADGMVRCSTAVGTPDYISPEVLRSQGSEGVYGRECDWWSVGVFLYEMLVGETPFYANSLVATYSKIMNHQSSLTFPDDVLISTSAKDIICKFLSDRSVRLGRNGVSEIKSHPFFVNDEWDWDTIQNTRPPVVPDLSGDDDTRNFDNIEKETTPQESFQVPKAFAGNQLPFIGFTYSREFSPLGYMSLTRKNIQHSDAQISNLADQLQQGISLMEQNEEKHRNEAAKFAIMENRGEAMLRDYYDLERALASTRLELKEMQRKLEQEVEARQHVETLLQEARTAYAYLEEADNKNQSESSLDMERQISELNERLRLQSEGEEKLRDLLANFQATCSTQEEALHELRAKHDILMDQCTDAQQNLKMVQDQLEEERAISRQHIQAVQITKEKNESLQAELDLLTTRHQQLMEESRQLSDKKRALEKDFSMAELELKSARQKYEQELAAQQSELNAKRIIGEADRPESALIQGTHYMLLIALPQAKDERYQIIAELEQRLRDEEASRERLEEKLIEVEREKKVLSLDSDHFKEQVHQLVGDSESLRMKISELNSQVEQEMEKRNLVEGELSVASDALKAMKFKESNLQKEIAHLKQKCTQLEDSMAELRRFRSVSQSQLRDVEEQLETQQYFSSLYKSQSRELKDELVCKDQELNSVKIHLNRQSQMLRDQQEADRSARRIAEDSLSDVEKARAMLEIEMKQLINRHKQEITGKEATIDTLKEKEAMYLKNIEDLRKAQESLNVDLESANKELSRKTSMSTSTDEQIQQLKKLLEKEQQLKKSAIDKLTEVMQMKSTSAGKKGSRADDRFVARCSCESPASPRFQEKRKYDIMVTRFQKEISDLQASLYEEGQSKLRMMLELECKEEELELVQQKLHTLLSETCSVDSVSMAGDAVDFSNGDSLEHRLESSVWIPHKVSAKKKGWKKHYAVLFNRKIFIYANEADKQTSNASLILDVEKFYHVRHVTNADVRFAEEKEIPRIFQIIYAGEGESRLVGEVQPTESPNPWQDVMSHKGHDFIAISFHSPTSCDICSKQLWNVLKPPPALECKRCHVKIHKDHLEKHDKDVAPCRVNYDPMLARDLLVMVSSADDCKVWVSRLRRCLENCRKTSDAKTSRSSGSSSHKDSLRLPYKPYTANRSATAPCTKKGSSACPLPVTASHY
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	61.5	Low	230 Å²	230	90.4 Å²	90.4	100%	1.133	51%	0.507	S	S	*	.				0	161.6	0	-67.4	175.1	-76.2	0	0	107.5	E3	M1-E3 PolarHBondContact O-N 2.82Å
2	A	46	Very low	62.8	Low	101 Å²	101	86.8 Å²	86.8	84%	0.835	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-72.4	121.2	167.6	0	0	0	0	0	107.4
3	E	47.9	Very low	64	Low	77 Å²	77	87.9 Å²	87.9	36%	0.36	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-75	135	165.2	-69.7	174.5	179.4	0	0	107.5	M1 H446 R447	M1-E3 PolarHBondContact O-N 2.82Å; E3-H446 IonicContact OE1-ND1 3.16Å; E3-R447 HydrophobicContact CG-CG 4.06Å; E3-R447 WeakPolarHBondContact OE1-CG 3.38Å; E3-R447 VanDerWaalsContact OE2-CD 3.27Å; E3-R447 WeakPolarHBondContact OE2-CD 3.42Å; E3-R447 WeakPolarHBondContact OE2-CG 3.38Å; E3-R447 IonicContact OE2-CZ 3.72Å; E3-R447 IonicContact OE2-NE 3.32Å; E3-R447 IonicContact OE2-NH1 2.68Å; E3-R447 PolarHBondContact OE2-NH1 3.03Å
4	L	55.9	Low	64.9	Low	117 Å²	117	88.9 Å²	88.9	61%	0.613	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-72.1	134.2	172.4	-68.9	144.2	0	0	0	107.4	D8	L4-D8 HydrophobicContact CB-CB 4Å; L4-D8 HydrophobicContact CD2-CB 3.81Å
5	T	67	Low	65.8	Low	48 Å²	48	89.1 Å²	89.1	29%	0.294	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-64.3	164.6	172.4	61.5	0	0	0	0	110.6	A7 D8 L9	T5-A7 PolarHBondContact O-N 3.19Å; T5-D8 WeakPolarHBondContact CB-OD2 3.01Å; T5-D8 PolarHBondContact N-OD2 3.29Å; T5-D8 PolarHBondContact O-N 3.25Å; T5-D8 VanDerWaalsContact O-N 3.16Å; T5-D8 PolarHBondContact OG1-N 3.27Å; T5-D8 PolarHBondContact OG1-OD2 3.34Å; T5-L9 PolarHBondContact O-N 2.85Å
6	Q	69.1	Low	67	Low	20 Å²	20	88.4 Å²	88.4	9%	0.093	50%	0.497	C	S	.	.	H	α-helix	trans	-58.6	-36.5	171.2	-176	170.5	-30	0	0	110.8	L9 E10 I436 M439	Q6-L9 PolarHBondContact O-N 2.93Å; Q6-E10 HydrophobicContact CG-CG 4.34Å; Q6-E10 WeakPolarHBondContact CG-OE1 3.47Å; Q6-E10 PolarHBondContact NE2-OE1 3.5Å; Q6-E10 WeakPolarHBondContact O-CB 3.42Å; Q6-E10 WeakPolarHBondContact O-CG 3.4Å; Q6-E10 PolarHBondContact O-N 2.58Å; Q6-I436 HydrophobicContact CB-CG2 4.38Å; Q6-M439 HydrophobicContact CB-CE 3.77Å; Q6-M439 HydrophobicContact CG-CE 4.33Å
7	A	66	Low	67.7	Low	59 Å²	59	85.5 Å²	85.5	49%	0.488	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-40.3	175.1	0	0	0	0	0	113.1	T5 L9 E10 D11	T5-A7 PolarHBondContact O-N 3.19Å; A7-L9 VanDerWaalsContact C-N 3.32Å; A7-E10 PolarHBondContact O-N 3.35Å; A7-D11 WeakPolarHBondContact O-CB 3.48Å; A7-D11 PolarHBondContact O-N 3.26Å
8	D	70.2	Confident	68.3	Low	80 Å²	80	82.9 Å²	82.9	43%	0.428	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-38.4	173.1	-65.5	-57.4	0	0	0	111.5	L4 T5 A12	L4-D8 HydrophobicContact CB-CB 4Å; L4-D8 HydrophobicContact CD2-CB 3.81Å; T5-D8 WeakPolarHBondContact CB-OD2 3.01Å; T5-D8 PolarHBondContact N-OD2 3.29Å; T5-D8 PolarHBondContact O-N 3.25Å; T5-D8 VanDerWaalsContact O-N 3.16Å; T5-D8 PolarHBondContact OG1-N 3.27Å; T5-D8 PolarHBondContact OG1-OD2 3.34Å; D8-A12 WeakPolarHBondContact O-CB 3.46Å; D8-A12 PolarHBondContact O-N 2.97Å
9	L	71.5	Confident	69.2	Low	94 Å²	94	83.5 Å²	83.5	49%	0.492	48%	0.476	S	S	.	.	H	α-helix	trans	-69.3	-41.3	178	-172.5	67.6	0	0	0	111.4	T5 Q6 A7 A12 L13	T5-L9 PolarHBondContact O-N 2.85Å; Q6-L9 PolarHBondContact O-N 2.93Å; A7-L9 VanDerWaalsContact C-N 3.32Å; L9-A12 PolarHBondContact O-N 2.93Å; L9-L13 HydrophobicContact CG-CD1 4.24Å; L9-L13 WeakPolarHBondContact O-CB 3.37Å; L9-L13 WeakPolarHBondContact O-CG 3.15Å; L9-L13 PolarHBondContact O-N 3.13Å
10	E	70.1	Confident	70.1	Confident	81 Å²	81	82 Å²	82	38%	0.379	47%	0.466	S	S	.	.	H	α-helix	trans	-67.5	-44.9	176.2	-76.3	178.4	-165.4	0	0	112	Q6 A7 A12 L13 V14	Q6-E10 HydrophobicContact CG-CG 4.34Å; Q6-E10 WeakPolarHBondContact CG-OE1 3.47Å; Q6-E10 PolarHBondContact NE2-OE1 3.5Å; Q6-E10 WeakPolarHBondContact O-CB 3.42Å; Q6-E10 WeakPolarHBondContact O-CG 3.4Å; Q6-E10 PolarHBondContact O-N 2.58Å; A7-E10 PolarHBondContact O-N 3.35Å; E10-A12 VanDerWaalsContact C-N 3.35Å; E10-A12 PolarHBondContact O-N 3.41Å; E10-L13 PolarHBondContact O-N 2.85Å; E10-V14 WeakPolarHBondContact O-CB 3.34Å; E10-V14 WeakPolarHBondContact O-CG2 3.41Å; E10-V14 PolarHBondContact O-N 3.34Å
11	D	74.3	Confident	70.5	Confident	87 Å²	87	80 Å²	80	47%	0.465	45%	0.454	S	S	.	.	H	α-helix	trans	-63.7	-40.7	173	-175.5	57.7	0	0	0	111.2	A7 L13 V14 Q15	A7-D11 WeakPolarHBondContact O-CB 3.48Å; A7-D11 PolarHBondContact O-N 3.26Å; D11-L13 VanDerWaalsContact C-N 3.31Å; D11-L13 PolarHBondContact O-N 2.98Å; D11-V14 PolarHBondContact O-N 3.15Å; D11-Q15 VanDerWaalsContact O-CB 3.28Å; D11-Q15 WeakPolarHBondContact O-CB 3.39Å; D11-Q15 VanDerWaalsContact O-CG 3.28Å; D11-Q15 WeakPolarHBondContact O-CG 3.4Å; D11-Q15 PolarHBondContact O-N 3.41Å; D11-Q15 PolarHBondContact OD2-NE2 3.45Å
12	A	77.1	Confident	72.5	Confident	48 Å²	48	72.8 Å²	72.8	40%	0.397	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-38.7	173.3	0	0	0	0	0	112.5	D8 L9 E10 L16	D8-A12 WeakPolarHBondContact O-CB 3.46Å; D8-A12 PolarHBondContact O-N 2.97Å; L9-A12 PolarHBondContact O-N 2.93Å; E10-A12 VanDerWaalsContact C-N 3.35Å; E10-A12 PolarHBondContact O-N 3.41Å; A12-L16 WeakPolarHBondContact O-CB 3.42Å; A12-L16 PolarHBondContact O-N 2.92Å
13	L	77.9	Confident	74.1	Confident	101 Å²	101	71 Å²	71	53%	0.529	40%	0.4	S	S	.	.	H	α-helix	trans	-70.7	-38.2	175.6	-76.1	168.6	0	0	0	112.5	L9 E10 D11 L16 S17	L9-L13 HydrophobicContact CG-CD1 4.24Å; L9-L13 WeakPolarHBondContact O-CB 3.37Å; L9-L13 WeakPolarHBondContact O-CG 3.15Å; L9-L13 PolarHBondContact O-N 3.13Å; E10-L13 PolarHBondContact O-N 2.85Å; D11-L13 VanDerWaalsContact C-N 3.31Å; D11-L13 PolarHBondContact O-N 2.98Å; L13-L16 PolarHBondContact O-N 3.5Å; L13-S17 VanDerWaalsContact O-CB 3.28Å; L13-S17 WeakPolarHBondContact O-CB 3.5Å; L13-S17 PolarHBondContact O-N 3.23Å
14	V	76.3	Confident	75.8	Confident	102 Å²	102	74.9 Å²	74.9	62%	0.618	41%	0.411	S	S	*	.	H	α-helix	trans	-67.6	-47.1	174.4	169.1	0	0	0	0	110.6	E10 D11 L16 S17 G18	E10-V14 WeakPolarHBondContact O-CB 3.34Å; E10-V14 WeakPolarHBondContact O-CG2 3.41Å; E10-V14 PolarHBondContact O-N 3.34Å; D11-V14 PolarHBondContact O-N 3.15Å; V14-L16 VanDerWaalsContact C-N 3.32Å; V14-L16 PolarHBondContact O-N 3.16Å; V14-S17 PolarHBondContact O-N 3.04Å; V14-G18 PolarHBondContact O-N 3.12Å
15	Q	78.9	Confident	77.2	Confident	92 Å²	92	70.1 Å²	70.1	43%	0.43	39%	0.388	S	S	.	.	H	α-helix	trans	-59.1	-41.3	172.8	-74.8	-169.5	42.4	0	0	112	D11 K19	D11-Q15 VanDerWaalsContact O-CB 3.28Å; D11-Q15 WeakPolarHBondContact O-CB 3.39Å; D11-Q15 VanDerWaalsContact O-CG 3.28Å; D11-Q15 WeakPolarHBondContact O-CG 3.4Å; D11-Q15 PolarHBondContact O-N 3.41Å; D11-Q15 PolarHBondContact OD2-NE2 3.45Å; Q15-K19 WeakPolarHBondContact O-CD 3.46Å; Q15-K19 VanDerWaalsContact O-CG 3.24Å; Q15-K19 WeakPolarHBondContact O-CG 3.31Å; Q15-K19 PolarHBondContact O-N 2.88Å
16	L	84.4	Confident	78.1	Confident	77 Å²	77	73 Å²	73	40%	0.403	41%	0.41	S	S	.	.	H	α-helix	trans	-67.7	-47.3	177.1	-178.4	60	0	0	0	110.7	A12 L13 V14 G18 K19 L20 I27	A12-L16 WeakPolarHBondContact O-CB 3.42Å; A12-L16 PolarHBondContact O-N 2.92Å; L13-L16 PolarHBondContact O-N 3.5Å; V14-L16 VanDerWaalsContact C-N 3.32Å; V14-L16 PolarHBondContact O-N 3.16Å; L16-G18 VanDerWaalsContact C-N 3.29Å; L16-G18 PolarHBondContact O-N 3.33Å; L16-K19 CarbonylContact O-C 3.45Å; L16-K19 WeakPolarHBondContact O-CA 3.36Å; L16-K19 PolarHBondContact O-N 3.46Å; L16-L20 HydrophobicContact CD1-CD2 4.44Å; L16-L20 HydrophobicContact CD1-CG 4.29Å; L16-L20 HydrophobicContact CG-CD1 4.3Å; L16-L20 HydrophobicContact CG-CG 4.34Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 3.11Å; L16-I27 HydrophobicContact CD1-CD1 4.12Å
17	S	78.9	Confident	79.1	Confident	40 Å²	40	75.2 Å²	75.2	28%	0.28	42%	0.422	S	S	.	.	H	α-helix	trans	-56.4	-44	175.3	-170.1	0	0	0	0	111.3	L13 V14 K19 L20 L21	L13-S17 VanDerWaalsContact O-CB 3.28Å; L13-S17 WeakPolarHBondContact O-CB 3.5Å; L13-S17 PolarHBondContact O-N 3.23Å; V14-S17 PolarHBondContact O-N 3.04Å; S17-K19 VanDerWaalsContact C-N 3.34Å; S17-K19 PolarHBondContact O-N 3.31Å; S17-L20 PolarHBondContact O-N 3.31Å; S17-L21 VanDerWaalsContact O-CB 3.29Å; S17-L21 WeakPolarHBondContact O-CB 3.49Å; S17-L21 WeakPolarHBondContact O-CD1 3.37Å; S17-L21 VanDerWaalsContact O-CG 3.27Å; S17-L21 WeakPolarHBondContact O-CG 3.29Å; S17-L21 PolarHBondContact O-N 2.95Å
18	G	78.7	Confident	80.2	Confident	39 Å²	39	72.9 Å²	72.9	40%	0.402	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-38.5	172.8	0	0	0	0	0	113.6	V14 L16 N22	V14-G18 PolarHBondContact O-N 3.12Å; L16-G18 VanDerWaalsContact C-N 3.29Å; L16-G18 PolarHBondContact O-N 3.33Å; G18-N22 WeakPolarHBondContact O-CB 3.47Å; G18-N22 PolarHBondContact O-N 3.27Å
19	K	86.6	Confident	81.1	Confident	93 Å²	93	70.8 Å²	70.8	40%	0.404	39%	0.391	S	S	.	.	H	α-helix	trans	-74	-28.2	174.8	-70.1	162.3	-170.5	160.4	0	113.4	Q15 L16 S17 S25 I27	Q15-K19 WeakPolarHBondContact O-CD 3.46Å; Q15-K19 VanDerWaalsContact O-CG 3.24Å; Q15-K19 WeakPolarHBondContact O-CG 3.31Å; Q15-K19 PolarHBondContact O-N 2.88Å; L16-K19 CarbonylContact O-C 3.45Å; L16-K19 WeakPolarHBondContact O-CA 3.36Å; L16-K19 PolarHBondContact O-N 3.46Å; S17-K19 VanDerWaalsContact C-N 3.34Å; S17-K19 PolarHBondContact O-N 3.31Å; K19-S25 WeakPolarHBondContact O-CB 3.31Å; K19-S25 PolarHBondContact O-OG 2.99Å; K19-I27 HydrophobicContact CB-CD1 3.95Å; K19-I27 HydrophobicContact CB-CG1 4.11Å
20	L	86.3	Confident	82	Confident	53 Å²	53	66.8 Å²	66.8	28%	0.277	37%	0.37	S	S	.	.	H	α-helix	trans	-75.8	-34.6	173.6	-65.7	179.2	0	0	0	111.7	L16 S17 I27 N28 V29 L32	L16-L20 HydrophobicContact CD1-CD2 4.44Å; L16-L20 HydrophobicContact CD1-CG 4.29Å; L16-L20 HydrophobicContact CG-CD1 4.3Å; L16-L20 HydrophobicContact CG-CG 4.34Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 3.11Å; S17-L20 PolarHBondContact O-N 3.31Å; L20-I27 VanDerWaalsContact CD2-O 3.29Å; L20-I27 WeakPolarHBondContact CD2-O 3.43Å; L20-N28 WeakPolarHBondContact O-CA 3.4Å; L20-V29 HydrophobicContact CB-CG2 4.28Å; L20-V29 PolarHBondContact O-N 3.38Å; L20-L32 HydrophobicContact CD2-CD1 3.62Å
21	L	79	Confident	83	Confident	42 Å²	42	63.3 Å²	63.3	22%	0.22	35%	0.354	C	S	.	.	H	α-helix	trans	-83.9	-27.7	-178.5	-75.1	167.4	0	0	0	114.5	S17 P23 L408	S17-L21 VanDerWaalsContact O-CB 3.29Å; S17-L21 WeakPolarHBondContact O-CB 3.49Å; S17-L21 WeakPolarHBondContact O-CD1 3.37Å; S17-L21 VanDerWaalsContact O-CG 3.27Å; S17-L21 WeakPolarHBondContact O-CG 3.29Å; S17-L21 PolarHBondContact O-N 2.95Å; L21-P23 WeakPolarHBondContact O-CD 3.3Å; L21-L408 HydrophobicContact CD2-CB 3.48Å; L21-L408 VanDerWaalsContact CD2-CB 3.48Å; L21-L408 HydrophobicContact CD2-CD2 3.6Å; L21-L408 HydrophobicContact CD2-CG 4.15Å; L21-L408 HydrophobicContact CG-CD2 4.49Å
22	N	80.7	Confident	83.9	Confident	77 Å²	77	63.3 Å²	63.3	41%	0.412	35%	0.354	S	S	.	.			trans	-73.7	116.5	-178.5	176.3	5.1	0	0	0	110.6	G18 R24 S25 N28	G18-N22 WeakPolarHBondContact O-CB 3.47Å; G18-N22 PolarHBondContact O-N 3.27Å; N22-R24 PolarHBondContact O-N 2.91Å; N22-R24 WeakPolarHBondContact OD1-CB 3.23Å; N22-R24 PolarHBondContact OD1-N 3.15Å; N22-S25 WeakPolarHBondContact O-CB 3.25Å; N22-S25 PolarHBondContact O-N 3.36Å; N22-N28 WeakPolarHBondContact O-CB 3.31Å
23	P	79.7	Confident	84.7	Confident	63 Å²	63	62.9 Å²	62.9	41%	0.409	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.2	-177.8	30.1	-37.3	0	0	0	113.2	L21 S25 N28 Y132 Y401	L21-P23 WeakPolarHBondContact O-CD 3.3Å; P23-S25 VanDerWaalsContact C-N 3.25Å; P23-S25 PolarHBondContact O-N 3.06Å; P23-N28 PolarHBondContact O-ND2 3.44Å; P23-N28 VanDerWaalsContact O-ND2 3.15Å; P23-Y132 WeakPolarHBondContact CB-OH 3.35Å; P23-Y132 HydrophobicContact CG-CE1 4.36Å; P23-Y132 PolarHBondContact O-OH 3.16Å; P23-Y401 HydrophobicContact CB-CE2 4.36Å
24	R	83.5	Confident	85.4	Confident	159 Å²	159	58.3 Å²	58.3	60%	0.6	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	3	171.9	-65.3	-175.7	-178.3	176.1	4.9	113.8	N22 Y132	N22-R24 PolarHBondContact O-N 2.91Å; N22-R24 WeakPolarHBondContact OD1-CB 3.23Å; N22-R24 PolarHBondContact OD1-N 3.15Å; R24-Y132 HydrophobicContact CG-CD1 4.18Å; R24-Y132 HydrophobicContact CG-CD2 4.04Å; R24-Y132 HydrophobicContact CG-CE1 3.73Å; R24-Y132 HydrophobicContact CG-CE2 3.61Å; R24-Y132 HydrophobicContact CG-CG 4.34Å; R24-Y132 VanDerWaalsContact CG-CZ 3.44Å; R24-Y132 PolarHBondContact N-OH 3.46Å
25	S	85.5	Confident	86.3	Confident	18 Å²	18	55 Å²	55	13%	0.126	30%	0.304	C	S	.	.			trans	-85.9	133.9	177.1	-178.6	0	0	0	0	111.1	K19 N22 P23 I27 N28	K19-S25 WeakPolarHBondContact O-CB 3.31Å; K19-S25 PolarHBondContact O-OG 2.99Å; N22-S25 WeakPolarHBondContact O-CB 3.25Å; N22-S25 PolarHBondContact O-N 3.36Å; P23-S25 VanDerWaalsContact C-N 3.25Å; P23-S25 PolarHBondContact O-N 3.06Å; S25-I27 PolarHBondContact O-N 3.08Å; S25-I27 WeakPolarHBondContact OG-CG1 3.08Å; S25-I27 PolarHBondContact OG-N 3.34Å; S25-N28 WeakPolarHBondContact O-CB 3.21Å; S25-N28 PolarHBondContact O-N 3.4Å; S25-N28 PolarHBondContact O-ND2 3.08Å; S25-N28 VanDerWaalsContact O-ND2 3.13Å
26	S	85.8	Confident	87.1	Confident	108 Å²	108	52.9 Å²	52.9	76%	0.755	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-10	172.9	54	0	0	0	0	114	C31	S26-C31 WeakPolarHBondContact O-CB 3.27Å
27	I	89.3	Confident	87.5	Confident	66 Å²	66	50.2 Å²	50.2	34%	0.338	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	24.4	173.8	64.8	167	0	0	0	112.3	L16 K19 L20 S25	L16-I27 HydrophobicContact CD1-CD1 4.12Å; K19-I27 HydrophobicContact CB-CD1 3.95Å; K19-I27 HydrophobicContact CB-CG1 4.11Å; L20-I27 VanDerWaalsContact CD2-O 3.29Å; L20-I27 WeakPolarHBondContact CD2-O 3.43Å; S25-I27 PolarHBondContact O-N 3.08Å; S25-I27 WeakPolarHBondContact OG-CG1 3.08Å; S25-I27 PolarHBondContact OG-N 3.34Å
28	N	89.3	Confident	88.2	Confident	11 Å²	11	48.7 Å²	48.7	6%	0.059	27%	0.273	C	S	.	.	S	Bend	trans	-61.7	162.8	171.6	81.3	47.9	0	0	0	110.9	L20 N22 P23 S25 D30 C31 L32	L20-N28 WeakPolarHBondContact O-CA 3.4Å; N22-N28 WeakPolarHBondContact O-CB 3.31Å; P23-N28 PolarHBondContact O-ND2 3.44Å; P23-N28 VanDerWaalsContact O-ND2 3.15Å; S25-N28 WeakPolarHBondContact O-CB 3.21Å; S25-N28 PolarHBondContact O-N 3.4Å; S25-N28 PolarHBondContact O-ND2 3.08Å; S25-N28 VanDerWaalsContact O-ND2 3.13Å; N28-D30 VanDerWaalsContact C-N 3.3Å; N28-D30 PolarHBondContact O-N 3.48Å; N28-D30 WeakPolarHBondContact OD1-CA 3.11Å; N28-D30 WeakPolarHBondContact OD1-CB 3.43Å; N28-D30 PolarHBondContact OD1-N 3.01Å; N28-C31 PolarHBondContact ND2-SG 2.91Å; N28-C31 WeakPolarHBondContact O-CA 3.49Å; N28-C31 WeakPolarHBondContact O-CB 3.46Å; N28-C31 PolarHBondContact O-N 2.89Å; N28-C31 PolarHBondContact OD1-N 3.44Å; N28-C31 PolarHBondContact OD1-SG 3.36Å; N28-C31 VanDerWaalsContact OD1-SG 3.42Å; N28-L32 PolarHBondContact O-N 2.8Å
29	V	89.6	Confident	89	Confident	35 Å²	35	50.1 Å²	50.1	21%	0.212	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-36.9	-174.9	174.6	0	0	0	0	113	L20 C31 L32 L33 L408	L20-V29 HydrophobicContact CB-CG2 4.28Å; L20-V29 PolarHBondContact O-N 3.38Å; V29-C31 VanDerWaalsContact C-N 3.31Å; V29-C31 PolarHBondContact O-N 3.44Å; V29-L32 PolarHBondContact O-N 3.49Å; V29-L33 HydrophobicContact CG1-CD1 4.08Å; V29-L33 HydrophobicContact CG1-CG 4.38Å; V29-L33 VanDerWaalsContact O-CG 3.3Å; V29-L33 WeakPolarHBondContact O-CG 3.45Å; V29-L33 PolarHBondContact O-N 3.22Å; V29-L408 HydrophobicContact CB-CD1 4.02Å; V29-L408 HydrophobicContact CG1-CD1 4.18Å; V29-L408 HydrophobicContact CG2-CD1 3.67Å
30	D	89.7	Confident	89.3	Confident	11 Å²	11	46.1 Å²	46.1	6%	0.059	26%	0.255	C	S	.	.	H	α-helix	trans	-66	-32.5	175.1	-81.6	-68.3	0	0	0	112.4	N28 D34 R72 T400	N28-D30 VanDerWaalsContact C-N 3.3Å; N28-D30 PolarHBondContact O-N 3.48Å; N28-D30 WeakPolarHBondContact OD1-CA 3.11Å; N28-D30 WeakPolarHBondContact OD1-CB 3.43Å; N28-D30 PolarHBondContact OD1-N 3.01Å; D30-D34 WeakPolarHBondContact O-CB 3.48Å; D30-D34 VanDerWaalsContact O-CG 3.22Å; D30-D34 PolarHBondContact O-N 3.09Å; D30-R72 PolarHBondContact O-NH2 2.77Å; D30-R72 IonicContact OD1-CZ 3.79Å; D30-R72 IonicContact OD1-NE 3.6Å; D30-R72 PolarHBondContact OD1-NE 3.49Å; D30-R72 IonicContact OD1-NH2 2.74Å; D30-R72 PolarHBondContact OD1-NH2 3.35Å; D30-T400 HydrophobicContact CB-CG2 4.41Å
31	C	91.9	Very high	89.6	Confident	7 Å²	7	45.2 Å²	45.2	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-37.9	172.4	-54.9	0	0	0	0	113.5	S26 N28 V29 D34 A35 G398	S26-C31 WeakPolarHBondContact O-CB 3.27Å; N28-C31 PolarHBondContact ND2-SG 2.91Å; N28-C31 WeakPolarHBondContact O-CA 3.49Å; N28-C31 WeakPolarHBondContact O-CB 3.46Å; N28-C31 PolarHBondContact O-N 2.89Å; N28-C31 PolarHBondContact OD1-N 3.44Å; N28-C31 PolarHBondContact OD1-SG 3.36Å; N28-C31 VanDerWaalsContact OD1-SG 3.42Å; V29-C31 VanDerWaalsContact C-N 3.31Å; V29-C31 PolarHBondContact O-N 3.44Å; C31-D34 PolarHBondContact O-N 2.92Å; C31-A35 PolarHBondContact O-N 3.37Å; C31-G398 WeakPolarHBondContact SG-CA 3.34Å
32	L	92.9	Very high	90.3	Very high	87 Å²	87	43.3 Å²	43.3	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-70.4	-35.5	176.7	-62.3	178.2	0	0	0	111.9	L20 N28 V29 A35 L36	L20-L32 HydrophobicContact CD2-CD1 3.62Å; N28-L32 PolarHBondContact O-N 2.8Å; V29-L32 PolarHBondContact O-N 3.49Å; L32-A35 PolarHBondContact O-N 2.77Å; L32-L36 PolarHBondContact O-N 2.85Å; L32-L36 VanDerWaalsContact O-N 3.17Å
33	L	93.3	Very high	90.9	Very high	40 Å²	40	40 Å²	40	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-68.9	-40.1	172.1	-66.6	173.1	0	0	0	111.8	V29 A35 L36 S37 I68	V29-L33 HydrophobicContact CG1-CD1 4.08Å; V29-L33 HydrophobicContact CG1-CG 4.38Å; V29-L33 VanDerWaalsContact O-CG 3.3Å; V29-L33 WeakPolarHBondContact O-CG 3.45Å; V29-L33 PolarHBondContact O-N 3.22Å; L33-A35 VanDerWaalsContact C-N 3.32Å; L33-A35 PolarHBondContact O-N 2.97Å; L33-L36 PolarHBondContact O-N 2.73Å; L33-S37 WeakPolarHBondContact O-CB 3.25Å; L33-S37 PolarHBondContact O-N 3.49Å; L33-S37 PolarHBondContact O-OG 2.74Å; L33-I68 HydrophobicContact CB-CG2 4.39Å; L33-I68 HydrophobicContact CD2-CD1 3.96Å; L33-I68 HydrophobicContact CD2-CG1 4.34Å; L33-I68 HydrophobicContact CD2-CG2 3.98Å
34	D	94.2	Very high	91.5	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-58.8	-43.3	171.6	-78.1	4.9	0	0	0	111.5	D30 C31 L36 S37 A38 R72 Q146 G398 F399 T400	D30-D34 WeakPolarHBondContact O-CB 3.48Å; D30-D34 VanDerWaalsContact O-CG 3.22Å; D30-D34 PolarHBondContact O-N 3.09Å; C31-D34 PolarHBondContact O-N 2.92Å; D34-L36 PolarHBondContact O-N 2.77Å; D34-S37 PolarHBondContact O-N 2.68Å; D34-A38 WeakPolarHBondContact O-CB 3.17Å; D34-A38 PolarHBondContact O-N 2.87Å; D34-R72 IonicContact OD1-CZ 2.76Å; D34-R72 VanDerWaalsContact OD1-CZ 3.29Å; D34-R72 IonicContact OD1-NH1 3.28Å; D34-R72 PolarHBondContact OD1-NH1 3.09Å; D34-R72 IonicContact OD1-NH2 2.72Å; D34-R72 PolarHBondContact OD1-NH2 3.5Å; D34-Q146 VanDerWaalsContact CG-NE2 3.25Å; D34-Q146 PolarHBondContact OD2-NE2 3.47Å; D34-G398 WeakPolarHBondContact OD2-CA 2.99Å; D34-G398 PolarHBondContact OD2-N 3.47Å; D34-G398 VanDerWaalsContact OD2-N 3.14Å; D34-F399 PolarHBondContact OD2-N 3.21Å; D34-F399 VanDerWaalsContact OD2-N 3.1Å; D34-T400 VanDerWaalsContact CG-OG1 3.26Å; D34-T400 VanDerWaalsContact OD1-CB 3.3Å; D34-T400 WeakPolarHBondContact OD1-CB 3.4Å; D34-T400 PolarHBondContact OD1-OG1 2.98Å; D34-T400 WeakPolarHBondContact OD2-CB 3.37Å; D34-T400 PolarHBondContact OD2-N 3.07Å; D34-T400 PolarHBondContact OD2-OG1 3.48Å; D34-T400 VanDerWaalsContact OD2-OG1 3.04Å
35	A	94.7	Very high	91.9	Very high	33 Å²	33	33.9 Å²	33.9	27%	0.273	21%	0.205	S	C	.	.	H	α-helix	trans	-61.5	-43	178.4	0	0	0	0	0	112.6	C31 L32 L33 L39 I397	C31-A35 PolarHBondContact O-N 3.37Å; L32-A35 PolarHBondContact O-N 2.77Å; L33-A35 VanDerWaalsContact C-N 3.32Å; L33-A35 PolarHBondContact O-N 2.97Å; A35-L39 WeakPolarHBondContact O-CB 3.37Å; A35-L39 PolarHBondContact O-N 3.37Å; A35-I397 HydrophobicContact CB-CD1 4.32Å; A35-I397 HydrophobicContact CB-CG2 3.68Å
36	L	94.5	Very high	92.2	Very high	48 Å²	48	37.5 Å²	37.5	25%	0.251	23%	0.228	S	C	.	.	H	α-helix	trans	-68.4	-43	178.2	-174.9	64.6	0	0	0	111.9	L32 L33 D34 L39 V40 F57 V65 I68	L32-L36 PolarHBondContact O-N 2.85Å; L32-L36 VanDerWaalsContact O-N 3.17Å; L33-L36 PolarHBondContact O-N 2.73Å; D34-L36 PolarHBondContact O-N 2.77Å; L36-L39 PolarHBondContact O-N 3.47Å; L36-V40 PolarHBondContact O-N 3.47Å; L36-V40 VanDerWaalsContact O-N 3.1Å; L36-F57 HydrophobicContact CD1-CE2 4.45Å; L36-F57 HydrophobicContact CD1-CZ 4.25Å; L36-V65 HydrophobicContact CD1-CG2 4.48Å; L36-V65 HydrophobicContact CD2-CG2 3.94Å; L36-V65 HydrophobicContact CG-CG2 3.67Å; L36-I68 HydrophobicContact CD2-CD1 4.14Å
37	S	93.8	Very high	92.4	Very high	20 Å²	20	34 Å²	34	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-66.4	-39.6	176.4	-76	0	0	0	0	112.6	L33 D34 G41 N69	L33-S37 WeakPolarHBondContact O-CB 3.25Å; L33-S37 PolarHBondContact O-N 3.49Å; L33-S37 PolarHBondContact O-OG 2.74Å; D34-S37 PolarHBondContact O-N 2.68Å; S37-G41 PolarHBondContact O-N 2.67Å; S37-N69 PolarHBondContact OG-ND2 2.87Å; S37-N69 PolarHBondContact OG-OD1 3.46Å
38	A	94.2	Very high	92.4	Very high	8 Å²	8	31.1 Å²	31.1	7%	0.066	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-46.2	174.4	0	0	0	0	0	111.6	D34 V40 G41 D42 Q393 I397	D34-A38 WeakPolarHBondContact O-CB 3.17Å; D34-A38 PolarHBondContact O-N 2.87Å; A38-V40 PolarHBondContact O-N 2.8Å; A38-G41 PolarHBondContact O-N 2.78Å; A38-G41 VanDerWaalsContact O-N 3.15Å; A38-D42 PolarHBondContact O-N 3.49Å; A38-Q393 HydrophobicContact CB-CB 3.69Å; A38-I397 HydrophobicContact CB-CD1 3.84Å; A38-I397 HydrophobicContact CB-CG1 3.6Å
39	L	94.6	Very high	92.5	Very high	69 Å²	69	35.6 Å²	35.6	36%	0.361	21%	0.207	S	C	.	.	H	α-helix	trans	-63.1	-41.9	-180	-178.1	60.1	0	0	0	112.4	A35 L36 C43 F57 F389	A35-L39 WeakPolarHBondContact O-CB 3.37Å; A35-L39 PolarHBondContact O-N 3.37Å; L36-L39 PolarHBondContact O-N 3.47Å; L39-C43 WeakPolarHBondContact O-CB 3.46Å; L39-C43 PolarHBondContact O-N 3.39Å; L39-C43 VanDerWaalsContact O-N 3.12Å; L39-C43 PolarHBondContact O-SG 2.76Å; L39-F57 HydrophobicContact CB-CZ 4.37Å; L39-F57 HydrophobicContact CD2-CE1 4.15Å; L39-F57 HydrophobicContact CD2-CE2 4Å; L39-F57 HydrophobicContact CD2-CZ 3.56Å; L39-F57 HydrophobicContact CG-CE1 3.87Å; L39-F57 HydrophobicContact CG-CZ 3.73Å; L39-F389 HydrophobicContact CD1-CE2 4.4Å
40	V	93.8	Very high	92.5	Very high	9 Å²	9	44 Å²	44	6%	0.055	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-42.7	172	167.8	0	0	0	0	111.1	L36 A38 C43 D44 F57 L58 V65	L36-V40 PolarHBondContact O-N 3.47Å; L36-V40 VanDerWaalsContact O-N 3.1Å; A38-V40 PolarHBondContact O-N 2.8Å; V40-C43 PolarHBondContact O-N 3.01Å; V40-D44 WeakPolarHBondContact O-CB 3.19Å; V40-D44 PolarHBondContact O-N 2.98Å; V40-F57 HydrophobicContact CG2-CE1 3.6Å; V40-F57 HydrophobicContact CG2-CZ 3.83Å; V40-L58 HydrophobicContact CB-CD2 4.45Å; V40-L58 HydrophobicContact CG1-CD2 3.95Å; V40-L58 HydrophobicContact CG2-CD2 4.42Å; V40-V65 HydrophobicContact CB-CB 4.4Å; V40-V65 HydrophobicContact CB-CG1 4.07Å; V40-V65 HydrophobicContact CB-CG2 4.29Å; V40-V65 HydrophobicContact CG1-CB 4.35Å; V40-V65 HydrophobicContact CG1-CG1 4.04Å; V40-V65 HydrophobicContact CG2-CB 4.25Å; V40-V65 HydrophobicContact CG2-CG1 4.43Å; V40-V65 HydrophobicContact CG2-CG2 3.78Å
41	G	92.1	Very high	92.5	Very high	35 Å²	35	47.6 Å²	47.6	36%	0.361	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-40.5	179.4	0	0	0	0	0	114.5	S37 A38	S37-G41 PolarHBondContact O-N 2.67Å; A38-G41 PolarHBondContact O-N 2.78Å; A38-G41 VanDerWaalsContact O-N 3.15Å
42	D	93.8	Very high	92.5	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.011	28%	0.283	C	S	.	.	H	α-helix	trans	-79.5	-17.5	175.7	-82	-43.5	0	0	0	113.5	A38 F45 L48 F389 G391 N392 Q393	A38-D42 PolarHBondContact O-N 3.49Å; D42-F45 WeakPolarHBondContact O-CD2 3.29Å; D42-L48 WeakPolarHBondContact O-CD1 3.38Å; D42-F389 HydrophobicContact CB-CD2 4.25Å; D42-F389 HydrophobicContact CB-CE2 3.51Å; D42-F389 HydrophobicContact CB-CZ 3.96Å; D42-G391 VanDerWaalsContact OD2-CA 3.25Å; D42-G391 WeakPolarHBondContact OD2-CA 3.35Å; D42-N392 VanDerWaalsContact CG-N 3.32Å; D42-N392 PolarHBondContact OD1-N 3.37Å; D42-N392 PolarHBondContact OD2-N 3.01Å; D42-Q393 PolarHBondContact OD1-N 2.95Å; D42-Q393 WeakPolarHBondContact OD2-CA 3.46Å; D42-Q393 WeakPolarHBondContact OD2-CB 3.41Å; D42-Q393 PolarHBondContact OD2-N 2.96Å
43	C	93	Very high	92.6	Very high	6 Å²	6	56.8 Å²	56.8	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-89.7	-25.5	177	-77.2	0	0	0	0	114.2	L39 V40 F45 L48 I54 L58	L39-C43 WeakPolarHBondContact O-CB 3.46Å; L39-C43 PolarHBondContact O-N 3.39Å; L39-C43 VanDerWaalsContact O-N 3.12Å; L39-C43 PolarHBondContact O-SG 2.76Å; V40-C43 PolarHBondContact O-N 3.01Å; C43-F45 PolarHBondContact O-N 3.46Å; C43-L48 WeakPolarHBondContact O-CB 3.29Å; C43-I54 HydrophobicContact CB-CG2 3.7Å; C43-L58 HydrophobicContact CB-CD1 4.48Å; C43-L58 HydrophobicContact CB-CD2 4.11Å; C43-L58 HydrophobicContact CB-CG 4.44Å
44	D	92.5	Very high	92.6	Very high	48 Å²	48	56.2 Å²	56.2	26%	0.257	29%	0.292	S	S	.	.			trans	-80.5	64.9	-171.9	-164.5	2	0	0	0	114	V40 R49 L58 Q62	V40-D44 WeakPolarHBondContact O-CB 3.19Å; V40-D44 PolarHBondContact O-N 2.98Å; D44-R49 IonicContact OD1-CZ 2.76Å; D44-R49 IonicContact OD1-NE 3.3Å; D44-R49 PolarHBondContact OD1-NE 2.97Å; D44-R49 IonicContact OD1-NH2 3Å; D44-R49 PolarHBondContact OD1-NH2 2.89Å; D44-R49 IonicContact OD2-NH2 3.28Å; D44-R49 PolarHBondContact OD2-NH2 3.44Å; D44-L58 HydrophobicContact CB-CD2 4.28Å; D44-Q62 PolarHBondContact OD2-NE2 2.75Å
45	F	92.4	Very high	92.6	Very high	46 Å²	46	60.2 Å²	60.2	20%	0.202	31%	0.311	C	S	.	.	S	Bend	trans	-129	145.2	174.7	-62.6	-66.4	0	0	0	112.1	D42 C43 A47 L48 R49 V385 P386	D42-F45 WeakPolarHBondContact O-CD2 3.29Å; C43-F45 PolarHBondContact O-N 3.46Å; F45-A47 PolarHBondContact O-N 2.91Å; F45-L48 HydrophobicContact CD2-CD1 4.18Å; F45-L48 PolarHBondContact O-N 2.86Å; F45-R49 PolarHBondContact O-N 3.28Å; F45-V385 HydrophobicContact CD1-CG1 3.94Å; F45-P386 HydrophobicContact CD1-CG 4.45Å; F45-P386 HydrophobicContact CD2-CG 3.44Å; F45-P386 VanDerWaalsContact CD2-CG 3.44Å; F45-P386 HydrophobicContact CE2-CG 3.53Å; F45-P386 HydrophobicContact CG-CG 3.93Å; F45-P386 HydrophobicContact CZ-CG 4.09Å
46	P	90	Very high	92.6	Very high	94 Å²	94	63.1 Å²	63.1	61%	0.61	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.3	-175.9	-26.5	35.3	0	0	0	116.3	R50	P46-R50 PolarHBondContact O-NE 3.38Å
47	A	90	Very high	92.6	Very high	36 Å²	36	62.9 Å²	62.9	30%	0.298	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-43.5	171.3	0	0	0	0	0	111.6	F45 R50 K387	F45-A47 PolarHBondContact O-N 2.91Å; A47-R50 WeakPolarHBondContact O-CB 3.24Å; A47-R50 WeakPolarHBondContact O-CG 3.42Å; A47-R50 PolarHBondContact O-N 3.2Å; A47-K387 WeakPolarHBondContact CB-O 3.47Å
48	L	90.9	Very high	92.7	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.026	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-75.9	-35.1	-177.1	-66.3	-179.1	0	0	0	113.1	D42 C43 F45 R50 I51 I54 F389	D42-L48 WeakPolarHBondContact O-CD1 3.38Å; C43-L48 WeakPolarHBondContact O-CB 3.29Å; F45-L48 HydrophobicContact CD2-CD1 4.18Å; F45-L48 PolarHBondContact O-N 2.86Å; L48-R50 PolarHBondContact O-N 2.92Å; L48-I51 HydrophobicContact CD2-CD1 4.31Å; L48-I51 WeakPolarHBondContact O-CB 3.1Å; L48-I51 PolarHBondContact O-N 3.34Å; L48-I54 HydrophobicContact CB-CD1 4Å; L48-I54 HydrophobicContact CB-CG2 4.39Å; L48-I54 HydrophobicContact CD2-CD1 4.1Å; L48-F389 HydrophobicContact CD1-CB 4.37Å; L48-F389 HydrophobicContact CD1-CD2 4.35Å; L48-F389 HydrophobicContact CD2-CB 4.33Å
49	R	90.5	Very high	92.6	Very high	104 Å²	104	68 Å²	68	39%	0.392	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-55.2	-14.6	170.9	-76	-175.7	176.5	-113.8	-1.2	114.1	D44 F45 I51 L58	D44-R49 IonicContact OD1-CZ 2.76Å; D44-R49 IonicContact OD1-NE 3.3Å; D44-R49 PolarHBondContact OD1-NE 2.97Å; D44-R49 IonicContact OD1-NH2 3Å; D44-R49 PolarHBondContact OD1-NH2 2.89Å; D44-R49 IonicContact OD2-NH2 3.28Å; D44-R49 PolarHBondContact OD2-NH2 3.44Å; F45-R49 PolarHBondContact O-N 3.28Å; R49-I51 VanDerWaalsContact C-N 3.34Å; R49-L58 HydrophobicContact CG-CD1 3.8Å
50	R	88.8	Confident	92.6	Very high	212 Å²	212	72.8 Å²	72.8	80%	0.8	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-78.3	-16.2	174.6	-57	176.8	-178	-161.9	-5	113.5	P46 A47 L48	P46-R50 PolarHBondContact O-NE 3.38Å; A47-R50 WeakPolarHBondContact O-CB 3.24Å; A47-R50 WeakPolarHBondContact O-CG 3.42Å; A47-R50 PolarHBondContact O-N 3.2Å; L48-R50 PolarHBondContact O-N 2.92Å
51	I	91.6	Very high	92.6	Very high	87 Å²	87	76.5 Å²	76.5	45%	0.446	37%	0.369	S	S	.	.	S	Bend	trans	-86.9	111	177.8	-59.4	175	0	0	0	107.3	L48 R49 N53 I54 E55	L48-I51 HydrophobicContact CD2-CD1 4.31Å; L48-I51 WeakPolarHBondContact O-CB 3.1Å; L48-I51 PolarHBondContact O-N 3.34Å; R49-I51 VanDerWaalsContact C-N 3.34Å; I51-N53 HydrophobicContact CG2-CB 4.49Å; I51-N53 PolarHBondContact O-N 2.99Å; I51-I54 HydrophobicContact CB-CB 4.35Å; I51-I54 HydrophobicContact CB-CD1 4.1Å; I51-I54 HydrophobicContact CB-CG1 4.13Å; I51-I54 HydrophobicContact CD1-CD1 3.99Å; I51-I54 HydrophobicContact CG2-CD1 4.38Å; I51-I54 HydrophobicContact CG2-CG1 4.16Å; I51-I54 WeakPolarHBondContact O-CA 3.46Å; I51-I54 WeakPolarHBondContact O-CB 3.48Å; I51-I54 PolarHBondContact O-N 3.5Å; I51-E55 PolarHBondContact O-N 3.4Å
52	K	91.6	Very high	92.6	Very high	155 Å²	155	76.1 Å²	76.1	67%	0.674	36%	0.358	S	S	*	.	H	α-helix	trans	-49	-34.3	-174.6	-67.5	-173.5	175.2	-174.6	0	114.6	N56	K52-N56 VanDerWaalsContact O-CB 3.3Å; K52-N56 WeakPolarHBondContact O-CB 3.47Å; K52-N56 VanDerWaalsContact O-CG 3.25Å; K52-N56 PolarHBondContact O-N 2.9Å; K52-N56 PolarHBondContact O-ND2 3.35Å
53	N	94.7	Very high	92.6	Very high	132 Å²	132	81 Å²	81	71%	0.706	39%	0.388	S	S	*	.	H	α-helix	trans	-68.2	-38.6	178	-65.1	1.2	0	0	0	111.9	I51 F57	I51-N53 HydrophobicContact CG2-CB 4.49Å; I51-N53 PolarHBondContact O-N 2.99Å; N53-F57 VanDerWaalsContact O-CB 3.31Å; N53-F57 WeakPolarHBondContact O-CB 2.99Å; N53-F57 PolarHBondContact O-N 2.85Å; N53-F57 VanDerWaalsContact O-N 3.08Å
54	I	93.4	Very high	92.5	Very high	27 Å²	27	83.2 Å²	83.2	14%	0.138	40%	0.404	C	S	.	.	H	α-helix	trans	-73.6	-41.8	176	-58.7	-177.6	0	0	0	110.2	C43 L48 I51 F57 L58	C43-I54 HydrophobicContact CB-CG2 3.7Å; L48-I54 HydrophobicContact CB-CD1 4Å; L48-I54 HydrophobicContact CB-CG2 4.39Å; L48-I54 HydrophobicContact CD2-CD1 4.1Å; I51-I54 HydrophobicContact CB-CB 4.35Å; I51-I54 HydrophobicContact CB-CD1 4.1Å; I51-I54 HydrophobicContact CB-CG1 4.13Å; I51-I54 HydrophobicContact CD1-CD1 3.99Å; I51-I54 HydrophobicContact CG2-CD1 4.38Å; I51-I54 HydrophobicContact CG2-CG1 4.16Å; I51-I54 WeakPolarHBondContact O-CA 3.46Å; I51-I54 WeakPolarHBondContact O-CB 3.48Å; I51-I54 PolarHBondContact O-N 3.5Å; I54-F57 PolarHBondContact O-N 3.48Å; I54-L58 HydrophobicContact CG2-CD1 3.88Å; I54-L58 HydrophobicContact CG2-CG 4.23Å; I54-L58 WeakPolarHBondContact O-CB 3.41Å; I54-L58 WeakPolarHBondContact O-CG 3.2Å; I54-L58 PolarHBondContact O-N 2.9Å
55	E	93.6	Very high	92.5	Very high	89 Å²	89	81.1 Å²	81.1	42%	0.416	39%	0.392	S	S	.	.	H	α-helix	trans	-55.3	-52.7	173.7	-173	177	-148.2	0	0	111.5	I51 F57 L58 L59	I51-E55 PolarHBondContact O-N 3.4Å; E55-F57 VanDerWaalsContact C-N 3.31Å; E55-F57 PolarHBondContact O-N 3.18Å; E55-L58 PolarHBondContact O-N 3.48Å; E55-L59 HydrophobicContact CG-CD1 4.07Å; E55-L59 WeakPolarHBondContact O-CB 3.44Å; E55-L59 VanDerWaalsContact O-CG 3.26Å; E55-L59 WeakPolarHBondContact O-CG 3.45Å; E55-L59 PolarHBondContact O-N 2.88Å
56	N	94.6	Very high	92.4	Very high	94 Å²	94	85.7 Å²	85.7	50%	0.503	41%	0.414	S	S	.	.	H	α-helix	trans	-63.7	-32.4	177.2	-74.5	-38.9	0	0	0	113.5	K52 R60	K52-N56 VanDerWaalsContact O-CB 3.3Å; K52-N56 WeakPolarHBondContact O-CB 3.47Å; K52-N56 VanDerWaalsContact O-CG 3.25Å; K52-N56 PolarHBondContact O-N 2.9Å; K52-N56 PolarHBondContact O-ND2 3.35Å; N56-R60 WeakPolarHBondContact O-CB 3.49Å; N56-R60 PolarHBondContact O-N 3.4Å
57	F	95.5	Very high	92.5	Very high	43 Å²	43	87.5 Å²	87.5	19%	0.189	42%	0.415	C	S	.	.	H	α-helix	trans	-69.5	-49.5	175.3	169.6	-100.5	0	0	0	111.4	L36 L39 V40 N53 I54 E55 R60 Y61	L36-F57 HydrophobicContact CD1-CE2 4.45Å; L36-F57 HydrophobicContact CD1-CZ 4.25Å; L39-F57 HydrophobicContact CB-CZ 4.37Å; L39-F57 HydrophobicContact CD2-CE1 4.15Å; L39-F57 HydrophobicContact CD2-CE2 4Å; L39-F57 HydrophobicContact CD2-CZ 3.56Å; L39-F57 HydrophobicContact CG-CE1 3.87Å; L39-F57 HydrophobicContact CG-CZ 3.73Å; V40-F57 HydrophobicContact CG2-CE1 3.6Å; V40-F57 HydrophobicContact CG2-CZ 3.83Å; N53-F57 VanDerWaalsContact O-CB 3.31Å; N53-F57 WeakPolarHBondContact O-CB 2.99Å; N53-F57 PolarHBondContact O-N 2.85Å; N53-F57 VanDerWaalsContact O-N 3.08Å; I54-F57 PolarHBondContact O-N 3.48Å; E55-F57 VanDerWaalsContact C-N 3.31Å; E55-F57 PolarHBondContact O-N 3.18Å; F57-R60 PolarHBondContact O-N 3.49Å; F57-R60 VanDerWaalsContact O-N 3.12Å; F57-Y61 AromaticContact CD2-CD2 3.46Å; F57-Y61 HydrophobicContact CD2-CD2 3.46Å; F57-Y61 VanDerWaalsContact CD2-CD2 3.46Å; F57-Y61 AromaticContact CD2-CE2 3.88Å; F57-Y61 HydrophobicContact CD2-CE2 3.88Å; F57-Y61 AromaticContact CE2-CD2 3.45Å; F57-Y61 HydrophobicContact CE2-CD2 3.45Å; F57-Y61 VanDerWaalsContact CE2-CD2 3.45Å; F57-Y61 AromaticContact CE2-CE2 3.99Å; F57-Y61 HydrophobicContact CE2-CE2 3.99Å; F57-Y61 HydrophobicContact CE2-CG 4.21Å; F57-Y61 HydrophobicContact CG-CD2 4.32Å; F57-Y61 HydrophobicContact CZ-CD2 4.32Å; F57-Y61 WeakPolarHBondContact O-CD2 3.37Å; F57-Y61 PolarHBondContact O-N 2.83Å
58	L	94.4	Very high	92.5	Very high	3 Å²	3	87.5 Å²	87.5	2%	0.016	41%	0.409	C	S	.	.	H	α-helix	trans	-62.1	-44.8	177.5	-69.6	172.1	0	0	0	111.2	V40 C43 D44 R49 I54 E55 R60 Y61 Q62	V40-L58 HydrophobicContact CB-CD2 4.45Å; V40-L58 HydrophobicContact CG1-CD2 3.95Å; V40-L58 HydrophobicContact CG2-CD2 4.42Å; C43-L58 HydrophobicContact CB-CD1 4.48Å; C43-L58 HydrophobicContact CB-CD2 4.11Å; C43-L58 HydrophobicContact CB-CG 4.44Å; D44-L58 HydrophobicContact CB-CD2 4.28Å; R49-L58 HydrophobicContact CG-CD1 3.8Å; I54-L58 HydrophobicContact CG2-CD1 3.88Å; I54-L58 HydrophobicContact CG2-CG 4.23Å; I54-L58 WeakPolarHBondContact O-CB 3.41Å; I54-L58 WeakPolarHBondContact O-CG 3.2Å; I54-L58 PolarHBondContact O-N 2.9Å; E55-L58 PolarHBondContact O-N 3.48Å; L58-R60 PolarHBondContact O-N 2.78Å; L58-R60 VanDerWaalsContact O-N 3.13Å; L58-Y61 PolarHBondContact O-N 3.48Å; L58-Q62 WeakPolarHBondContact O-CB 3.21Å; L58-Q62 PolarHBondContact O-N 3.3Å
59	L	92.6	Very high	92.4	Very high	131 Å²	131	90 Å²	90	69%	0.686	42%	0.423	S	S	*	.	H	α-helix	trans	-57.3	-26.8	175.2	-76.1	169.7	0	0	0	113.6	E55	E55-L59 HydrophobicContact CG-CD1 4.07Å; E55-L59 WeakPolarHBondContact O-CB 3.44Å; E55-L59 VanDerWaalsContact O-CG 3.26Å; E55-L59 WeakPolarHBondContact O-CG 3.45Å; E55-L59 PolarHBondContact O-N 2.88Å
60	R	94.7	Very high	92.3	Very high	171 Å²	171	86.4 Å²	86.4	65%	0.645	42%	0.417	S	S	*	.	H	α-helix	trans	-89.4	-41	179.1	-171.9	178.1	-61.9	166.8	2.4	113.5	N56 F57 L58	N56-R60 WeakPolarHBondContact O-CB 3.49Å; N56-R60 PolarHBondContact O-N 3.4Å; F57-R60 PolarHBondContact O-N 3.49Å; F57-R60 VanDerWaalsContact O-N 3.12Å; L58-R60 PolarHBondContact O-N 2.78Å; L58-R60 VanDerWaalsContact O-N 3.13Å
61	Y	94.8	Very high	92.2	Very high	86 Å²	86	81.7 Å²	81.7	34%	0.337	41%	0.412	S	S	.	.	H	α-helix	trans	-113.8	-13.7	-167.7	-63.5	-72	0	0	0	115.2	F57 L58 T63 S64 V65	F57-Y61 AromaticContact CD2-CD2 3.46Å; F57-Y61 HydrophobicContact CD2-CD2 3.46Å; F57-Y61 VanDerWaalsContact CD2-CD2 3.46Å; F57-Y61 AromaticContact CD2-CE2 3.88Å; F57-Y61 HydrophobicContact CD2-CE2 3.88Å; F57-Y61 AromaticContact CE2-CD2 3.45Å; F57-Y61 HydrophobicContact CE2-CD2 3.45Å; F57-Y61 VanDerWaalsContact CE2-CD2 3.45Å; F57-Y61 AromaticContact CE2-CE2 3.99Å; F57-Y61 HydrophobicContact CE2-CE2 3.99Å; F57-Y61 HydrophobicContact CE2-CG 4.21Å; F57-Y61 HydrophobicContact CG-CD2 4.32Å; F57-Y61 HydrophobicContact CZ-CD2 4.32Å; F57-Y61 WeakPolarHBondContact O-CD2 3.37Å; F57-Y61 PolarHBondContact O-N 2.83Å; L58-Y61 PolarHBondContact O-N 3.48Å; Y61-T63 PolarHBondContact O-N 3.39Å; Y61-S64 PolarHBondContact O-N 2.86Å; Y61-V65 WeakPolarHBondContact O-CG2 3.34Å; Y61-V65 PolarHBondContact O-N 2.66Å
62	Q	91	Very high	92.1	Very high	27 Å²	27	79.3 Å²	79.3	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-59.2	-44	-176.1	177.1	159.6	31	0	0	112.3	D44 L58 V65 H66	D44-Q62 PolarHBondContact OD2-NE2 2.75Å; L58-Q62 WeakPolarHBondContact O-CB 3.21Å; L58-Q62 PolarHBondContact O-N 3.3Å; Q62-V65 PolarHBondContact O-N 3.29Å; Q62-H66 WeakPolarHBondContact CG-NE2 3.42Å; Q62-H66 PolarHBondContact NE2-NE2 2.68Å; Q62-H66 PolarHBondContact O-CD2 3.48Å; Q62-H66 PolarHBondContact O-N 2.9Å
63	T	93.3	Very high	92	Very high	106 Å²	106	73.7 Å²	73.7	65%	0.65	38%	0.375	S	S	*	.	H	α-helix	trans	-61.8	-48.3	177.6	-47.4	0	0	0	0	111.6	Y61 V65 H66 E67	Y61-T63 PolarHBondContact O-N 3.39Å; T63-V65 VanDerWaalsContact C-N 3.32Å; T63-V65 PolarHBondContact O-N 3.04Å; T63-H66 PolarHBondContact O-N 3.39Å; T63-E67 PolarHBondContact O-N 3.43Å
64	S	92.3	Very high	91.8	Very high	52 Å²	52	72.3 Å²	72.3	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-64	-35.9	178.8	-52.3	0	0	0	0	112.4	Y61 E67 I68	Y61-S64 PolarHBondContact O-N 2.86Å; S64-E67 PolarHBondContact O-N 2.76Å; S64-I68 WeakPolarHBondContact O-CB 3.28Å; S64-I68 WeakPolarHBondContact O-CD1 3.35Å; S64-I68 WeakPolarHBondContact O-CG1 3.24Å; S64-I68 PolarHBondContact O-N 2.89Å
65	V	91.6	Very high	91.8	Very high	3 Å²	3	73.1 Å²	73.1	2%	0.018	37%	0.367	C	S	.	.	H	α-helix	trans	-69.2	-36.4	174.3	166.3	0	0	0	0	112	L36 V40 Y61 Q62 T63 E67 I68 N69	L36-V65 HydrophobicContact CD1-CG2 4.48Å; L36-V65 HydrophobicContact CD2-CG2 3.94Å; L36-V65 HydrophobicContact CG-CG2 3.67Å; V40-V65 HydrophobicContact CB-CB 4.4Å; V40-V65 HydrophobicContact CB-CG1 4.07Å; V40-V65 HydrophobicContact CB-CG2 4.29Å; V40-V65 HydrophobicContact CG1-CB 4.35Å; V40-V65 HydrophobicContact CG1-CG1 4.04Å; V40-V65 HydrophobicContact CG2-CB 4.25Å; V40-V65 HydrophobicContact CG2-CG1 4.43Å; V40-V65 HydrophobicContact CG2-CG2 3.78Å; Y61-V65 WeakPolarHBondContact O-CG2 3.34Å; Y61-V65 PolarHBondContact O-N 2.66Å; Q62-V65 PolarHBondContact O-N 3.29Å; T63-V65 VanDerWaalsContact C-N 3.32Å; T63-V65 PolarHBondContact O-N 3.04Å; V65-E67 VanDerWaalsContact C-N 3.28Å; V65-E67 PolarHBondContact O-N 3.27Å; V65-I68 PolarHBondContact O-N 3.16Å; V65-N69 WeakPolarHBondContact CG1-ND2 3.42Å; V65-N69 VanDerWaalsContact O-CB 3.26Å; V65-N69 WeakPolarHBondContact O-CB 3.35Å; V65-N69 PolarHBondContact O-N 3.12Å; V65-N69 PolarHBondContact O-ND2 2.72Å
66	H	90.8	Very high	91.8	Very high	142 Å²	142	71.9 Å²	71.9	66%	0.657	37%	0.369	S	S	*	.	H	α-helix	trans	-65	-31.6	171.1	-74.1	-53.3	0	0	0	112.6	Q62 T63 G70	Q62-H66 WeakPolarHBondContact CG-NE2 3.42Å; Q62-H66 PolarHBondContact NE2-NE2 2.68Å; Q62-H66 PolarHBondContact O-CD2 3.48Å; Q62-H66 PolarHBondContact O-N 2.9Å; T63-H66 PolarHBondContact O-N 3.39Å; H66-G70 WeakPolarHBondContact O-CA 3.32Å; H66-G70 PolarHBondContact O-N 2.99Å
67	E	91.5	Very high	91.7	Very high	133 Å²	133	69.1 Å²	69.1	62%	0.621	35%	0.353	S	S	*	.	H	α-helix	trans	-75.1	-41.9	174.6	-173.7	174.6	-165.7	0	0	112.8	T63 S64 V65 G70 T71	T63-E67 PolarHBondContact O-N 3.43Å; S64-E67 PolarHBondContact O-N 2.76Å; V65-E67 VanDerWaalsContact C-N 3.28Å; V65-E67 PolarHBondContact O-N 3.27Å; E67-G70 CarbonylContact O-C 3.59Å; E67-G70 VanDerWaalsContact O-CA 3.26Å; E67-G70 WeakPolarHBondContact O-CA 3.22Å; E67-G70 PolarHBondContact O-N 3.35Å; E67-T71 PolarHBondContact O-N 3.47Å; E67-T71 PolarHBondContact O-OG1 3.34Å
68	I	90.6	Very high	91.7	Very high	35 Å²	35	67.6 Å²	67.6	18%	0.179	35%	0.346	C	S	.	.	H	α-helix	trans	-61.1	-49.8	172.6	-71.4	160.9	0	0	0	110.3	L33 L36 S64 V65 G70 T71 R72	L33-I68 HydrophobicContact CB-CG2 4.39Å; L33-I68 HydrophobicContact CD2-CD1 3.96Å; L33-I68 HydrophobicContact CD2-CG1 4.34Å; L33-I68 HydrophobicContact CD2-CG2 3.98Å; L36-I68 HydrophobicContact CD2-CD1 4.14Å; S64-I68 WeakPolarHBondContact O-CB 3.28Å; S64-I68 WeakPolarHBondContact O-CD1 3.35Å; S64-I68 WeakPolarHBondContact O-CG1 3.24Å; S64-I68 PolarHBondContact O-N 2.89Å; V65-I68 PolarHBondContact O-N 3.16Å; I68-G70 PolarHBondContact O-N 3.49Å; I68-T71 PolarHBondContact O-N 3.4Å; I68-T71 PolarHBondContact O-OG1 2.89Å; I68-T71 VanDerWaalsContact O-OG1 3.1Å; I68-R72 HydrophobicContact CG2-CG 4.48Å; I68-R72 WeakPolarHBondContact O-CG 3.12Å; I68-R72 PolarHBondContact O-N 2.93Å
69	N	89	Confident	91.8	Very high	59 Å²	59	73.8 Å²	73.8	32%	0.316	37%	0.373	S	S	.	.	H	α-helix	trans	-69.1	-14.8	173.1	-63.3	-27.4	0	0	0	112	S37 V65 R74	S37-N69 PolarHBondContact OG-ND2 2.87Å; S37-N69 PolarHBondContact OG-OD1 3.46Å; V65-N69 WeakPolarHBondContact CG1-ND2 3.42Å; V65-N69 VanDerWaalsContact O-CB 3.26Å; V65-N69 WeakPolarHBondContact O-CB 3.35Å; V65-N69 PolarHBondContact O-N 3.12Å; V65-N69 PolarHBondContact O-ND2 2.72Å; N69-R74 WeakPolarHBondContact O-CD 3.33Å; N69-R74 PolarHBondContact O-NE 3.42Å; N69-R74 PolarHBondContact O-NH1 2.9Å
70	G	88.1	Confident	91.9	Very high	27 Å²	27	71.8 Å²	71.8	28%	0.278	36%	0.362	S	S	.	.	H	α-helix	trans	-78	-29	171.8	0	0	0	0	0	114	H66 E67 I68 R74	H66-G70 WeakPolarHBondContact O-CA 3.32Å; H66-G70 PolarHBondContact O-N 2.99Å; E67-G70 CarbonylContact O-C 3.59Å; E67-G70 VanDerWaalsContact O-CA 3.26Å; E67-G70 WeakPolarHBondContact O-CA 3.22Å; E67-G70 PolarHBondContact O-N 3.35Å; I68-G70 PolarHBondContact O-N 3.49Å; G70-R74 PolarHBondContact O-NH2 3.11Å
71	T	86.6	Confident	91.9	Very high	113 Å²	113	66.6 Å²	66.6	69%	0.693	35%	0.347	S	S	*	.	H	α-helix	trans	-103.3	-25.9	-174.2	45.6	0	0	0	0	113.7	E67 I68	E67-T71 PolarHBondContact O-N 3.47Å; E67-T71 PolarHBondContact O-OG1 3.34Å; I68-T71 PolarHBondContact O-N 3.4Å; I68-T71 PolarHBondContact O-OG1 2.89Å; I68-T71 VanDerWaalsContact O-OG1 3.1Å
72	R	89.3	Confident	91.9	Very high	38 Å²	38	64.4 Å²	64.4	14%	0.143	34%	0.339	C	S	.	.	S	Bend	trans	-72.4	166.5	176.1	-67.8	174.9	95.4	-162	10	113	D30 D34 I68 H77 T400	D30-R72 PolarHBondContact O-NH2 2.77Å; D30-R72 IonicContact OD1-CZ 3.79Å; D30-R72 IonicContact OD1-NE 3.6Å; D30-R72 PolarHBondContact OD1-NE 3.49Å; D30-R72 IonicContact OD1-NH2 2.74Å; D30-R72 PolarHBondContact OD1-NH2 3.35Å; D34-R72 IonicContact OD1-CZ 2.76Å; D34-R72 VanDerWaalsContact OD1-CZ 3.29Å; D34-R72 IonicContact OD1-NH1 3.28Å; D34-R72 PolarHBondContact OD1-NH1 3.09Å; D34-R72 IonicContact OD1-NH2 2.72Å; D34-R72 PolarHBondContact OD1-NH2 3.5Å; I68-R72 HydrophobicContact CG2-CG 4.48Å; I68-R72 WeakPolarHBondContact O-CG 3.12Å; I68-R72 PolarHBondContact O-N 2.93Å; R72-H77 PolarHBondContact O-CE1 2.89Å; R72-T400 VanDerWaalsContact NH2-CG2 3.29Å
73	M	89.5	Confident	92	Very high	37 Å²	37	64.6 Å²	64.6	18%	0.182	34%	0.342	C	S	.	.			trans	-61.4	137.1	178.5	-169.6	62.6	77.8	0	0	111.4	H77 F78 Y143 F145 F405	M73-H77 HydrophobicContact SD-CB 4.17Å; M73-H77 PolarHBondContact SD-ND1 2.83Å; M73-H77 VanDerWaalsContact SD-ND1 3.45Å; M73-F78 HydrophobicContact CG-CE2 4.12Å; M73-F78 HydrophobicContact SD-CE2 3.76Å; M73-F78 HydrophobicContact SD-CZ 4.06Å; M73-Y143 HydrophobicContact CE-CD1 4.27Å; M73-Y143 HydrophobicContact CE-CD2 4.49Å; M73-Y143 HydrophobicContact CE-CE1 4.36Å; M73-Y143 HydrophobicContact CE-CG 4.36Å; M73-F145 HydrophobicContact CB-CB 4.28Å; M73-F145 HydrophobicContact CB-CD1 4.02Å; M73-F145 HydrophobicContact CB-CG 4.16Å; M73-F145 HydrophobicContact CG-CD1 3.5Å; M73-F145 VanDerWaalsContact CG-CD1 3.5Å; M73-F145 HydrophobicContact CG-CE1 3.68Å; M73-F145 HydrophobicContact CG-CG 4.08Å; M73-F145 HydrophobicContact CG-CZ 4.41Å; M73-F145 WeakPolarHBondContact O-CD2 3.07Å; M73-F405 HydrophobicContact CE-CD2 4.32Å
74	R	91	Very high	92	Very high	103 Å²	103	60.3 Å²	60.3	39%	0.389	32%	0.315	S	S	.	.			trans	-141.4	155.5	-177.9	-73.5	-177.9	-72.1	-174	3	111.7	N69 G70 S76 H77	N69-R74 WeakPolarHBondContact O-CD 3.33Å; N69-R74 PolarHBondContact O-NE 3.42Å; N69-R74 PolarHBondContact O-NH1 2.9Å; G70-R74 PolarHBondContact O-NH2 3.11Å; R74-S76 PolarHBondContact O-N 3.47Å; R74-S76 VanDerWaalsContact O-N 3.15Å; R74-H77 WeakPolarHBondContact O-CB 3.42Å; R74-H77 PolarHBondContact O-N 2.72Å
75	S	92.7	Very high	91.9	Very high	43 Å²	43	58.8 Å²	58.8	30%	0.301	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-57.1	-29	176.2	50.3	0	0	0	0	112.9	H77 F78 F145 Y152	S75-H77 PolarHBondContact O-N 2.7Å; S75-F78 PolarHBondContact O-N 3.02Å; S75-F78 VanDerWaalsContact O-N 3.08Å; S75-F145 VanDerWaalsContact N-CE2 3.27Å; S75-Y152 PolarHBondContact OG-OH 3.21Å
76	S	93	Very high	91.7	Very high	64 Å²	64	63.1 Å²	63.1	45%	0.448	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-62.6	-18.9	173.3	59.6	0	0	0	0	114.6	R74 F78 K98	R74-S76 PolarHBondContact O-N 3.47Å; R74-S76 VanDerWaalsContact O-N 3.15Å; S76-F78 PolarHBondContact O-N 3.44Å; S76-K98 PolarHBondContact O-NZ 2.72Å
77	H	93.1	Very high	91.2	Very high	36 Å²	36	58.7 Å²	58.7	17%	0.167	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-78.4	-8.8	175.4	-55.7	170.6	0	0	0	112.6	R72 M73 R74 S75 H97 K98 F99	R72-H77 PolarHBondContact O-CE1 2.89Å; M73-H77 HydrophobicContact SD-CB 4.17Å; M73-H77 PolarHBondContact SD-ND1 2.83Å; M73-H77 VanDerWaalsContact SD-ND1 3.45Å; R74-H77 WeakPolarHBondContact O-CB 3.42Å; R74-H77 PolarHBondContact O-N 2.72Å; S75-H77 PolarHBondContact O-N 2.7Å; H77-H97 PolarHBondContact O-CD2 3.07Å; H77-K98 VanDerWaalsContact O-CB 3.31Å; H77-K98 WeakPolarHBondContact O-CB 3.33Å; H77-K98 VanDerWaalsContact O-CG 3.3Å; H77-K98 WeakPolarHBondContact O-CG 3.23Å; H77-K98 PolarHBondContact O-N 2.74Å; H77-F99 HydrophobicContact CB-CE2 4.33Å
78	F	96	Very high	90.6	Very high	11 Å²	11	55.8 Å²	55.8	5%	0.048	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	151.9	-179.2	-62.9	-89.2	0	0	0	111.3	M73 S75 S76 V95 H97 K98 Y104 M106 F145 V154	M73-F78 HydrophobicContact CG-CE2 4.12Å; M73-F78 HydrophobicContact SD-CE2 3.76Å; M73-F78 HydrophobicContact SD-CZ 4.06Å; S75-F78 PolarHBondContact O-N 3.02Å; S75-F78 VanDerWaalsContact O-N 3.08Å; S76-F78 PolarHBondContact O-N 3.44Å; F78-V95 HydrophobicContact CB-CB 4.1Å; F78-V95 HydrophobicContact CB-CG1 4.44Å; F78-V95 HydrophobicContact CB-CG2 4.31Å; F78-V95 HydrophobicContact CD1-CB 4.24Å; F78-V95 HydrophobicContact CD1-CG2 3.62Å; F78-V95 HydrophobicContact CE1-CG2 4.36Å; F78-V95 HydrophobicContact CG-CG2 4.24Å; F78-H97 HydrophobicContact CD1-CB 3.95Å; F78-H97 HydrophobicContact CE1-CB 3.76Å; F78-H97 AromaticContact CE1-CD2 3.7Å; F78-H97 AromaticContact CE1-CG 3.99Å; F78-H97 AromaticContact CZ-CD2 3.77Å; F78-K98 WeakPolarHBondContact O-CE 3.17Å; F78-K98 PolarHBondContact O-NZ 3Å; F78-K98 VanDerWaalsContact O-NZ 3.17Å; F78-Y104 HydrophobicContact CE1-CD2 4.26Å; F78-M106 HydrophobicContact CD2-SD 4.35Å; F78-M106 HydrophobicContact CG-SD 4.37Å; F78-F145 HydrophobicContact CD2-CZ 4.31Å; F78-F145 AromaticContact CE2-CE1 3.82Å; F78-F145 HydrophobicContact CE2-CE1 3.82Å; F78-F145 AromaticContact CE2-CZ 4Å; F78-F145 HydrophobicContact CE2-CZ 4Å; F78-F145 HydrophobicContact CZ-CE1 4.46Å; F78-V154 HydrophobicContact CE1-CG1 3.92Å; F78-V154 HydrophobicContact CE1-CG2 4.19Å; F78-V154 HydrophobicContact CE2-CG2 4.27Å; F78-V154 HydrophobicContact CZ-CG1 4.15Å; F78-V154 HydrophobicContact CZ-CG2 3.8Å
79	K	96.5	Very high	90	Very high	132 Å²	132	56.2 Å²	56.2	57%	0.574	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	117.7	170.4	-179.6	-163.7	172.3	-166.7	0	107.9	V95 R96 K98	K79-V95 CarbonylContact O-C 3.55Å; K79-V95 VanDerWaalsContact O-CA 3.28Å; K79-V95 WeakPolarHBondContact O-CA 3.48Å; K79-R96 PolarHBondContact N-O 3.44Å; K79-R96 PolarHBondContact O-N 2.86Å; K79-K98 HydrophobicContact CB-CG 4.43Å
80	L	95.6	Very high	89.8	Confident	90 Å²	90	54.6 Å²	54.6	47%	0.471	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	136.4	170.9	178.9	61.1	0	0	0	110.9	Q93	L80-Q93 HydrophobicContact CD1-CB 3.66Å; L80-Q93 HydrophobicContact CD1-CG 3.73Å
81	I	94.6	Very high	89.9	Confident	61 Å²	61	55.3 Å²	55.3	31%	0.313	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-63.6	174.3	-47.6	-177.9	0	0	0	109.7	L94 R96 V103 D365	I81-L94 HydrophobicContact CB-CB 4.37Å; I81-L94 HydrophobicContact CB-CD2 4.22Å; I81-L94 HydrophobicContact CB-CG 4.27Å; I81-L94 WeakPolarHBondContact CB-O 3.43Å; I81-L94 HydrophobicContact CD1-CD2 4.15Å; I81-L94 HydrophobicContact CD1-CG 4.08Å; I81-L94 HydrophobicContact CG2-CD2 4.28Å; I81-L94 PolarHBondContact N-O 3.49Å; I81-R96 HydrophobicContact CD1-CB 4.08Å; I81-V103 HydrophobicContact CD1-CG1 4.47Å; I81-V103 HydrophobicContact CD1-CG2 4.35Å; I81-D365 HydrophobicContact CD1-CB 3.51Å; I81-D365 HydrophobicContact CG2-CB 4.34Å
82	K	93.7	Very high	90.3	Very high	40 Å²	40	51.5 Å²	51.5	17%	0.174	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.6	179.7	-163.2	-169.7	174.5	-178.1	0	109.2	I84 L94 T367 F370 D371 N372	K82-I84 HydrophobicContact CB-CG2 4.23Å; K82-I84 HydrophobicContact CD-CG2 4.22Å; K82-I84 HydrophobicContact CG-CG2 4.44Å; K82-L94 PolarHBondContact O-N 2.93Å; K82-T367 HydrophobicContact CB-CG2 4.35Å; K82-T367 HydrophobicContact CD-CG2 3.93Å; K82-T367 WeakPolarHBondContact CD-OG1 3.27Å; K82-F370 PolarHBondContact NZ-O 2.97Å; K82-D371 PolarHBondContact NZ-O 3.3Å; K82-N372 VanDerWaalsContact CE-OD1 3.24Å; K82-N372 WeakPolarHBondContact CE-OD1 3.25Å; K82-N372 PolarHBondContact NZ-OD1 2.76Å
83	V	93.3	Very high	90.6	Very high	31 Å²	31	50.9 Å²	50.9	19%	0.188	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.1	161	-176.7	0	0	0	0	107.2	E91 Q93 I373	V83-E91 HydrophobicContact CG1-CB 4.07Å; V83-E91 HydrophobicContact CG1-CG 4.46Å; V83-Q93 HydrophobicContact CG2-CG 4.43Å; V83-I373 HydrophobicContact CG1-CD1 4.36Å; V83-I373 HydrophobicContact CG1-CG2 4.37Å
84	I	93.4	Very high	91	Very high	17 Å²	17	49.1 Å²	49.1	9%	0.087	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-10.7	-172	59.6	168.5	0	0	0	113.7	K82 V92 L94 A105 Y157 T367 F370 I373	K82-I84 HydrophobicContact CB-CG2 4.23Å; K82-I84 HydrophobicContact CD-CG2 4.22Å; K82-I84 HydrophobicContact CG-CG2 4.44Å; I84-V92 HydrophobicContact CD1-CG1 4.11Å; I84-V92 HydrophobicContact CG1-CB 4.27Å; I84-V92 HydrophobicContact CG1-CG1 3.92Å; I84-V92 WeakPolarHBondContact CG1-O 3.23Å; I84-V92 PolarHBondContact N-O 3.03Å; I84-L94 HydrophobicContact CD1-CB 4.29Å; I84-L94 HydrophobicContact CG2-CB 3.92Å; I84-A105 HydrophobicContact CD1-CB 4.27Å; I84-Y157 HydrophobicContact CD1-CD2 4.05Å; I84-Y157 HydrophobicContact CD1-CE2 3.71Å; I84-T367 HydrophobicContact CG2-CG2 3.96Å; I84-F370 HydrophobicContact CB-CB 4.45Å; I84-F370 HydrophobicContact CB-CD1 3.82Å; I84-F370 HydrophobicContact CB-CE1 4.27Å; I84-F370 HydrophobicContact CB-CG 4.16Å; I84-F370 HydrophobicContact CD1-CE1 4.33Å; I84-F370 HydrophobicContact CG2-CB 4.39Å; I84-F370 HydrophobicContact CG2-CD1 4.47Å; I84-F370 HydrophobicContact CG2-CG 4.32Å; I84-F370 WeakPolarHBondContact O-CD1 3.44Å; I84-I373 VanDerWaalsContact C-CD1 3.44Å
85	G	89.7	Confident	91.3	Very high	19 Å²	19	44.3 Å²	44.3	20%	0.196	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	151.7	169.9	0	0	0	0	0	111	E91 V92 I373	G85-E91 CarbonylContact O-C 3.53Å; G85-E91 WeakPolarHBondContact O-CA 3.28Å; G85-E91 WeakPolarHBondContact O-CB 3.37Å; G85-V92 PolarHBondContact N-O 3.45Å; G85-V92 VanDerWaalsContact N-O 3.16Å; G85-V92 PolarHBondContact O-N 2.73Å; G85-I373 VanDerWaalsContact C-CD1 3.42Å; G85-I373 VanDerWaalsContact N-CD1 3.27Å
86	R	88.4	Confident	91.5	Very high	95 Å²	95	45 Å²	45	36%	0.358	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	132.5	164.8	-174.4	174.4	-66.2	129.6	8.3	108.8	E91 I373 E374 E376	R86-E91 HydrophobicContact CB-CB 4.33Å; R86-E91 HydrophobicContact CG-CB 4.32Å; R86-E91 IonicContact CZ-OE2 3.01Å; R86-E91 IonicContact NE-OE2 3.79Å; R86-E91 IonicContact NH2-OE2 3.87Å; R86-E91 PolarHBondContact NH2-OE2 3.46Å; R86-I373 HydrophobicContact CB-CG2 4.29Å; R86-E374 PolarHBondContact NH1-O 3.36Å; R86-E374 PolarHBondContact NH2-O 2.9Å; R86-E374 VanDerWaalsContact NH2-O 3.15Å; R86-E376 IonicContact NE-OE2 4Å
87	G	80.4	Confident	91.6	Very high	49 Å²	49	42.4 Å²	42.4	51%	0.505	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	179.9	-178.4	0	0	0	0	0	111.6	F89 G90	G87-F89 PolarHBondContact O-N 2.72Å; G87-G90 PolarHBondContact N-O 3.01Å; G87-G90 PolarHBondContact O-N 3.28Å
88	A	78	Confident	91.6	Very high	71 Å²	71	46.7 Å²	46.7	59%	0.587	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.9	-169	0	0	0	0	0	115.1	R117	A88-R117 PolarHBondContact O-NH1 2.89Å; A88-R117 PolarHBondContact O-NH2 3.48Å
89	F	77.5	Confident	91.3	Very high	45 Å²	45	53.8 Å²	53.8	20%	0.197	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	1.1	-176.1	-59.6	-82.3	0	0	0	114.4	G87 L109 N110 M114 F122	G87-F89 PolarHBondContact O-N 2.72Å; F89-L109 HydrophobicContact CB-CD2 4.11Å; F89-N110 WeakPolarHBondContact O-CB 3.47Å; F89-N110 PolarHBondContact O-N 2.72Å; F89-M114 HydrophobicContact CD1-CG 3.95Å; F89-F122 HydrophobicContact CD1-CE1 4.46Å; F89-F122 HydrophobicContact CD1-CZ 4.18Å; F89-F122 HydrophobicContact CD2-CE1 4.27Å; F89-F122 HydrophobicContact CD2-CE2 4.42Å; F89-F122 AromaticContact CD2-CZ 3.66Å; F89-F122 HydrophobicContact CD2-CZ 3.66Å; F89-F122 AromaticContact CE1-CE1 3.99Å; F89-F122 HydrophobicContact CE1-CE1 3.99Å; F89-F122 HydrophobicContact CE1-CZ 4.15Å; F89-F122 AromaticContact CE2-CE1 3.79Å; F89-F122 HydrophobicContact CE2-CE1 3.79Å; F89-F122 AromaticContact CE2-CZ 3.63Å; F89-F122 HydrophobicContact CE2-CZ 3.63Å; F89-F122 AromaticContact CG-CZ 3.94Å; F89-F122 HydrophobicContact CG-CZ 3.94Å; F89-F122 AromaticContact CZ-CE1 3.63Å; F89-F122 HydrophobicContact CZ-CE1 3.63Å; F89-F122 AromaticContact CZ-CZ 3.89Å; F89-F122 HydrophobicContact CZ-CZ 3.89Å
90	G	85.2	Confident	91	Very high	24 Å²	24	50.5 Å²	50.5	25%	0.247	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.6	-153.5	-176.4	0	0	0	0	0	113.4	G87 L108	G87-G90 PolarHBondContact N-O 3.01Å; G87-G90 PolarHBondContact O-N 3.28Å; G90-L108 WeakPolarHBondContact CA-O 3.01Å
91	E	91.4	Very high	90.8	Very high	42 Å²	42	48 Å²	48	20%	0.196	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	157.7	-173.2	57.6	171.2	-139.7	0	0	114	V83 G85 R86 Q93 L108	V83-E91 HydrophobicContact CG1-CB 4.07Å; V83-E91 HydrophobicContact CG1-CG 4.46Å; G85-E91 CarbonylContact O-C 3.53Å; G85-E91 WeakPolarHBondContact O-CA 3.28Å; G85-E91 WeakPolarHBondContact O-CB 3.37Å; R86-E91 HydrophobicContact CB-CB 4.33Å; R86-E91 HydrophobicContact CG-CB 4.32Å; R86-E91 IonicContact CZ-OE2 3.01Å; R86-E91 IonicContact NE-OE2 3.79Å; R86-E91 IonicContact NH2-OE2 3.87Å; R86-E91 PolarHBondContact NH2-OE2 3.46Å; E91-Q93 PolarHBondContact OE1-NE2 3.34Å; E91-L108 PolarHBondContact N-O 2.79Å; E91-L108 PolarHBondContact O-N 3.45Å
92	V	94.3	Very high	90.8	Very high	33 Å²	33	50.3 Å²	50.3	20%	0.2	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.8	176.2	-171.8	0	0	0	0	108.6	I84 G85 A105 M106 K107 M155	I84-V92 HydrophobicContact CD1-CG1 4.11Å; I84-V92 HydrophobicContact CG1-CB 4.27Å; I84-V92 HydrophobicContact CG1-CG1 3.92Å; I84-V92 WeakPolarHBondContact CG1-O 3.23Å; I84-V92 PolarHBondContact N-O 3.03Å; G85-V92 PolarHBondContact N-O 3.45Å; G85-V92 VanDerWaalsContact N-O 3.16Å; G85-V92 PolarHBondContact O-N 2.73Å; V92-A105 HydrophobicContact CG1-CB 4.22Å; V92-M106 CarbonylContact C-O 3.58Å; V92-M106 WeakPolarHBondContact CA-O 3.48Å; V92-K107 HydrophobicContact CG2-CB 4.12Å; V92-K107 HydrophobicContact CG2-CD 4.38Å; V92-K107 HydrophobicContact CG2-CG 4.11Å; V92-M155 HydrophobicContact CG1-CE 4.16Å
93	Q	95.7	Very high	90.9	Very high	26 Å²	26	49.3 Å²	49.3	12%	0.121	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.8	-175.9	-69.7	-178.4	-2.6	0	0	110.4	L80 V83 E91 V95 M106 L108	L80-Q93 HydrophobicContact CD1-CB 3.66Å; L80-Q93 HydrophobicContact CD1-CG 3.73Å; V83-Q93 HydrophobicContact CG2-CG 4.43Å; E91-Q93 PolarHBondContact OE1-NE2 3.34Å; Q93-V95 HydrophobicContact CB-CG1 3.93Å; Q93-V95 PolarHBondContact O-N 2.91Å; Q93-M106 PolarHBondContact N-O 2.76Å; Q93-M106 PolarHBondContact O-N 3.18Å; Q93-L108 HydrophobicContact CB-CD1 4.22Å; Q93-L108 HydrophobicContact CG-CD1 3.85Å
94	L	97.1	Very high	91	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.4	163.4	-172.4	67.8	0	0	0	108.6	I81 K82 I84 V103 Y157 D365 T367	I81-L94 HydrophobicContact CB-CB 4.37Å; I81-L94 HydrophobicContact CB-CD2 4.22Å; I81-L94 HydrophobicContact CB-CG 4.27Å; I81-L94 WeakPolarHBondContact CB-O 3.43Å; I81-L94 HydrophobicContact CD1-CD2 4.15Å; I81-L94 HydrophobicContact CD1-CG 4.08Å; I81-L94 HydrophobicContact CG2-CD2 4.28Å; I81-L94 PolarHBondContact N-O 3.49Å; K82-L94 PolarHBondContact O-N 2.93Å; I84-L94 HydrophobicContact CD1-CB 4.29Å; I84-L94 HydrophobicContact CG2-CB 3.92Å; L94-V103 HydrophobicContact CD1-CG1 3.34Å; L94-V103 HydrophobicContact CD2-CG1 4.41Å; L94-V103 HydrophobicContact CG-CG1 3.92Å; L94-Y157 HydrophobicContact CD1-CD1 3.54Å; L94-Y157 HydrophobicContact CD1-CD2 3.49Å; L94-Y157 VanDerWaalsContact CD1-CD2 3.49Å; L94-Y157 HydrophobicContact CD1-CE1 3.7Å; L94-Y157 HydrophobicContact CD1-CE2 3.71Å; L94-Y157 HydrophobicContact CD1-CG 3.44Å; L94-Y157 VanDerWaalsContact CD1-CG 3.44Å; L94-Y157 HydrophobicContact CD2-CE1 4.19Å; L94-D365 HydrophobicContact CD2-CB 3.97Å; L94-T367 HydrophobicContact CD2-CG2 3.36Å
95	V	97.6	Very high	91.2	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.8	-175.4	-61	0	0	0	0	112.7	F78 K79 Q93 V103 Y104 M106	F78-V95 HydrophobicContact CB-CB 4.1Å; F78-V95 HydrophobicContact CB-CG1 4.44Å; F78-V95 HydrophobicContact CB-CG2 4.31Å; F78-V95 HydrophobicContact CD1-CB 4.24Å; F78-V95 HydrophobicContact CD1-CG2 3.62Å; F78-V95 HydrophobicContact CE1-CG2 4.36Å; F78-V95 HydrophobicContact CG-CG2 4.24Å; K79-V95 CarbonylContact O-C 3.55Å; K79-V95 VanDerWaalsContact O-CA 3.28Å; K79-V95 WeakPolarHBondContact O-CA 3.48Å; Q93-V95 HydrophobicContact CB-CG1 3.93Å; Q93-V95 PolarHBondContact O-N 2.91Å; V95-V103 CarbonylContact O-C 3.56Å; V95-V103 WeakPolarHBondContact O-CA 3.4Å; V95-Y104 WeakPolarHBondContact CG2-O 3.3Å; V95-Y104 PolarHBondContact N-O 3.41Å; V95-Y104 PolarHBondContact O-N 2.69Å; V95-M106 HydrophobicContact CG1-CB 4.09Å; V95-M106 HydrophobicContact CG1-CE 3.93Å; V95-M106 HydrophobicContact CG1-SD 4.48Å; V95-M106 HydrophobicContact CG2-CB 3.77Å; V95-M106 HydrophobicContact CG2-SD 4.47Å
96	R	97.3	Very high	91.5	Very high	59 Å²	59	47 Å²	47	22%	0.223	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.8	168.4	-156.2	172.7	-78.1	-89.7	8.9	109.8	K79 I81 K98 G101 V103 D364 D365	K79-R96 PolarHBondContact N-O 3.44Å; K79-R96 PolarHBondContact O-N 2.86Å; I81-R96 HydrophobicContact CD1-CB 4.08Å; R96-K98 PolarHBondContact O-N 3.48Å; R96-G101 VanDerWaalsContact CD-O 3.29Å; R96-G101 WeakPolarHBondContact CD-O 3.37Å; R96-G101 WeakPolarHBondContact CG-O 3.34Å; R96-G101 PolarHBondContact NH1-O 3.49Å; R96-V103 HydrophobicContact CG-CG2 4.18Å; R96-D364 IonicContact CZ-OD1 2.71Å; R96-D364 IonicContact CZ-OD2 2.72Å; R96-D364 IonicContact NH1-OD1 2.76Å; R96-D364 PolarHBondContact NH1-OD1 3.44Å; R96-D364 IonicContact NH1-OD2 2.82Å; R96-D364 PolarHBondContact NH1-OD2 3.1Å; R96-D364 IonicContact NH2-OD1 2.64Å; R96-D364 PolarHBondContact NH2-OD1 2.91Å; R96-D364 IonicContact NH2-OD2 3.86Å; R96-D365 IonicContact CZ-OD2 2.68Å; R96-D365 IonicContact NE-OD2 3.62Å; R96-D365 IonicContact NH2-OD1 2.65Å; R96-D365 IonicContact NH2-OD2 2.62Å; R96-D365 PolarHBondContact NH2-OD2 3.1Å
97	H	94.8	Very high	91.9	Very high	9 Å²	9	43.4 Å²	43.4	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	121.7	176	-179	-122.9	0	0	0	110.1	H77 F78 F99 T100 G101 K102 Y104	H77-H97 PolarHBondContact O-CD2 3.07Å; F78-H97 HydrophobicContact CD1-CB 3.95Å; F78-H97 HydrophobicContact CE1-CB 3.76Å; F78-H97 AromaticContact CE1-CD2 3.7Å; F78-H97 AromaticContact CE1-CG 3.99Å; F78-H97 AromaticContact CZ-CD2 3.77Å; H97-F99 VanDerWaalsContact C-N 3.3Å; H97-F99 AromaticContact NE2-CD2 3.83Å; H97-F99 PolarHBondContact O-N 2.78Å; H97-T100 PolarHBondContact ND1-OG1 3.32Å; H97-T100 PolarHBondContact O-N 3.27Å; H97-G101 PolarHBondContact O-N 2.95Å; H97-K102 PolarHBondContact N-O 3.34Å; H97-Y104 HydrophobicContact CB-CD2 4.1Å; H97-Y104 HydrophobicContact CB-CE2 3.75Å
98	K	93.4	Very high	92.5	Very high	125 Å²	125	41.4 Å²	41.4	54%	0.543	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-31.9	-165.4	-71	171	179.6	162.5	0	114.1	S76 H77 F78 K79 R96	S76-K98 PolarHBondContact O-NZ 2.72Å; H77-K98 VanDerWaalsContact O-CB 3.31Å; H77-K98 WeakPolarHBondContact O-CB 3.33Å; H77-K98 VanDerWaalsContact O-CG 3.3Å; H77-K98 WeakPolarHBondContact O-CG 3.23Å; H77-K98 PolarHBondContact O-N 2.74Å; F78-K98 WeakPolarHBondContact O-CE 3.17Å; F78-K98 PolarHBondContact O-NZ 3Å; F78-K98 VanDerWaalsContact O-NZ 3.17Å; K79-K98 HydrophobicContact CB-CG 4.43Å; R96-K98 PolarHBondContact O-N 3.48Å
99	F	89.2	Confident	93.2	Very high	160 Å²	160	38.3 Å²	38.3	70%	0.702	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-32.4	-177	-60.9	-74.5	0	0	0	113.8	H77 H97	H77-F99 HydrophobicContact CB-CE2 4.33Å; H97-F99 VanDerWaalsContact C-N 3.3Å; H97-F99 AromaticContact NE2-CD2 3.83Å; H97-F99 PolarHBondContact O-N 2.78Å
100	T	90.5	Very high	93.8	Very high	64 Å²	64	36.9 Å²	36.9	39%	0.393	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-4.8	-175.2	60.2	0	0	0	0	113.9	H97 K102	H97-T100 PolarHBondContact ND1-OG1 3.32Å; H97-T100 PolarHBondContact O-N 3.27Å; T100-K102 PolarHBondContact O-N 2.8Å
101	G	91.8	Very high	94.1	Very high	38 Å²	38	35.8 Å²	35.8	39%	0.392	18%	0.178	S	C	.	.			trans	70.4	-25	-177.5	0	0	0	0	0	115.7	R96 H97	R96-G101 VanDerWaalsContact CD-O 3.29Å; R96-G101 WeakPolarHBondContact CD-O 3.37Å; R96-G101 WeakPolarHBondContact CG-O 3.34Å; R96-G101 PolarHBondContact NH1-O 3.49Å; H97-G101 PolarHBondContact O-N 2.95Å
102	K	93.7	Very high	94.1	Very high	109 Å²	109	35.3 Å²	35.3	47%	0.474	18%	0.176	S	C	.	.			trans	-55.5	143.4	179.1	-65	179	177.7	-179.3	0	113.8	H97 T100 Y104	H97-K102 PolarHBondContact N-O 3.34Å; T100-K102 PolarHBondContact O-N 2.8Å; K102-Y104 HydrophobicContact CB-CD2 4.48Å; K102-Y104 HydrophobicContact CB-CE2 3.68Å; K102-Y104 WeakPolarHBondContact CD-OH 3.47Å
103	V	96	Very high	93.7	Very high	19 Å²	19	35.2 Å²	35.2	12%	0.115	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	146.1	172.5	179.6	0	0	0	0	110.6	I81 L94 V95 R96 Y157 D364 D365	I81-V103 HydrophobicContact CD1-CG1 4.47Å; I81-V103 HydrophobicContact CD1-CG2 4.35Å; L94-V103 HydrophobicContact CD1-CG1 3.34Å; L94-V103 HydrophobicContact CD2-CG1 4.41Å; L94-V103 HydrophobicContact CG-CG1 3.92Å; V95-V103 CarbonylContact O-C 3.56Å; V95-V103 WeakPolarHBondContact O-CA 3.4Å; R96-V103 HydrophobicContact CG-CG2 4.18Å; V103-Y157 HydrophobicContact CG1-CD1 4.14Å; V103-Y157 HydrophobicContact CG1-CG 4.46Å; V103-D364 WeakPolarHBondContact CG1-O 3.41Å; V103-D364 HydrophobicContact CG2-CB 4.38Å; V103-D364 WeakPolarHBondContact CG2-OD2 3.36Å; V103-D365 HydrophobicContact CG2-CB 4.12Å
104	Y	96.4	Very high	93.2	Very high	6 Å²	6	34 Å²	34	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155.6	179.6	-60.9	-83.4	0	0	0	110.5	F78 V95 H97 K102 Y142 V154 M155	F78-Y104 HydrophobicContact CE1-CD2 4.26Å; V95-Y104 WeakPolarHBondContact CG2-O 3.3Å; V95-Y104 PolarHBondContact N-O 3.41Å; V95-Y104 PolarHBondContact O-N 2.69Å; H97-Y104 HydrophobicContact CB-CD2 4.1Å; H97-Y104 HydrophobicContact CB-CE2 3.75Å; K102-Y104 HydrophobicContact CB-CD2 4.48Å; K102-Y104 HydrophobicContact CB-CE2 3.68Å; K102-Y104 WeakPolarHBondContact CD-OH 3.47Å; Y104-Y142 HydrophobicContact CD1-CD2 4.05Å; Y104-Y142 HydrophobicContact CD1-CE2 4.43Å; Y104-Y142 HydrophobicContact CD1-CG 4.47Å; Y104-Y142 HydrophobicContact CE1-CD1 4.25Å; Y104-Y142 AromaticContact CE1-CD2 3.81Å; Y104-Y142 HydrophobicContact CE1-CD2 3.81Å; Y104-Y142 HydrophobicContact CE1-CE2 4.12Å; Y104-Y142 AromaticContact CE1-CG 3.9Å; Y104-Y142 HydrophobicContact CE1-CG 3.9Å; Y104-V154 HydrophobicContact CD1-CG1 3.85Å; Y104-V154 HydrophobicContact CD2-CG1 4.11Å; Y104-V154 HydrophobicContact CG-CG1 3.58Å; Y104-M155 WeakPolarHBondContact CA-O 3.49Å; Y104-M155 WeakPolarHBondContact CB-O 3.45Å
105	A	97	Very high	92.7	Very high	7 Å²	7	36.6 Å²	36.6	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.5	162.3	0	0	0	0	0	109.2	I84 V92 M155 Y157	I84-A105 HydrophobicContact CD1-CB 4.27Å; V92-A105 HydrophobicContact CG1-CB 4.22Å; A105-M155 HydrophobicContact CB-CE 3.82Å; A105-M155 PolarHBondContact N-O 3.08Å; A105-M155 VanDerWaalsContact N-O 3.07Å; A105-M155 WeakPolarHBondContact O-CB 3.33Å; A105-M155 PolarHBondContact O-N 2.85Å; A105-Y157 HydrophobicContact CB-CD2 4.39Å
106	M	96.8	Very high	92.1	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.2	179.7	-172.2	171.8	76.7	0	0	110	F78 V92 Q93 V95 L108 F145 Y152 M153 V154	F78-M106 HydrophobicContact CD2-SD 4.35Å; F78-M106 HydrophobicContact CG-SD 4.37Å; V92-M106 CarbonylContact C-O 3.58Å; V92-M106 WeakPolarHBondContact CA-O 3.48Å; Q93-M106 PolarHBondContact N-O 2.76Å; Q93-M106 PolarHBondContact O-N 3.18Å; V95-M106 HydrophobicContact CG1-CB 4.09Å; V95-M106 HydrophobicContact CG1-CE 3.93Å; V95-M106 HydrophobicContact CG1-SD 4.48Å; V95-M106 HydrophobicContact CG2-CB 3.77Å; V95-M106 HydrophobicContact CG2-SD 4.47Å; M106-L108 HydrophobicContact CE-CD1 3.82Å; M106-L108 HydrophobicContact CG-CD1 4.09Å; M106-L108 VanDerWaalsContact O-CD1 3.26Å; M106-L108 WeakPolarHBondContact O-CD1 3.13Å; M106-F145 HydrophobicContact SD-CZ 4.31Å; M106-Y152 HydrophobicContact CE-CD1 3.94Å; M106-Y152 HydrophobicContact CE-CE1 4.12Å; M106-Y152 HydrophobicContact CG-CD1 4.25Å; M106-Y152 HydrophobicContact SD-CD1 3.85Å; M106-M153 CarbonylContact C-O 3.59Å; M106-M153 VanDerWaalsContact CA-O 3.25Å; M106-M153 WeakPolarHBondContact CA-O 3.25Å; M106-V154 HydrophobicContact CG-CG2 4.07Å; M106-V154 HydrophobicContact SD-CG2 4.21Å
107	K	95.2	Very high	91.1	Very high	19 Å²	19	43.4 Å²	43.4	8%	0.083	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123	174.6	-178.9	165.3	170.1	179.2	0	109.1	V92 L109 E126 Y152 M153 M155 D218	V92-K107 HydrophobicContact CG2-CB 4.12Å; V92-K107 HydrophobicContact CG2-CD 4.38Å; V92-K107 HydrophobicContact CG2-CG 4.11Å; K107-L109 HydrophobicContact CG-CD2 4.28Å; K107-E126 WeakPolarHBondContact CE-OE1 3.26Å; K107-E126 IonicContact NZ-OE1 3.66Å; K107-E126 PolarHBondContact NZ-OE1 3.2Å; K107-E126 IonicContact NZ-OE2 3.6Å; K107-E126 PolarHBondContact NZ-OE2 2.71Å; K107-Y152 WeakPolarHBondContact O-CA 3.38Å; K107-M153 HydrophobicContact CB-CB 4.42Å; K107-M153 HydrophobicContact CB-CE 4.31Å; K107-M153 HydrophobicContact CD-CE 3.87Å; K107-M153 HydrophobicContact CG-CE 4.04Å; K107-M153 PolarHBondContact N-O 3.3Å; K107-M153 PolarHBondContact O-N 2.78Å; K107-M155 HydrophobicContact CB-CE 3.77Å; K107-M155 HydrophobicContact CB-SD 4.12Å; K107-D218 IonicContact NZ-OD1 2.73Å; K107-D218 PolarHBondContact NZ-OD1 3.41Å; K107-D218 IonicContact NZ-OD2 3.08Å; K107-D218 PolarHBondContact NZ-OD2 2.99Å
108	L	94.5	Very high	89.8	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.2	177.4	-70.5	72.7	0	0	0	108.7	G90 E91 Q93 M106 Y150 L151 Y152	G90-L108 WeakPolarHBondContact CA-O 3.01Å; E91-L108 PolarHBondContact N-O 2.79Å; E91-L108 PolarHBondContact O-N 3.45Å; Q93-L108 HydrophobicContact CB-CD1 4.22Å; Q93-L108 HydrophobicContact CG-CD1 3.85Å; M106-L108 HydrophobicContact CE-CD1 3.82Å; M106-L108 HydrophobicContact CG-CD1 4.09Å; M106-L108 VanDerWaalsContact O-CD1 3.26Å; M106-L108 WeakPolarHBondContact O-CD1 3.13Å; L108-Y150 HydrophobicContact CB-CD1 4.02Å; L108-Y150 HydrophobicContact CB-CE1 4.27Å; L108-Y150 HydrophobicContact CD2-CD1 4.32Å; L108-Y150 HydrophobicContact CD2-CE1 4.22Å; L108-L151 WeakPolarHBondContact CA-O 3.46Å; L108-Y152 HydrophobicContact CD1-CD1 4.38Å; L108-Y152 HydrophobicContact CD2-CD1 4.38Å; L108-Y152 HydrophobicContact CD2-CE1 3.79Å; L108-Y152 HydrophobicContact CG-CD1 3.79Å; L108-Y152 HydrophobicContact CG-CE1 3.72Å
109	L	91.9	Very high	88.5	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.4	172.6	-53.7	174.1	0	0	0	110	F89 K107 K111 M114 F122 F123 Y150 L151 M153	F89-L109 HydrophobicContact CB-CD2 4.11Å; K107-L109 HydrophobicContact CG-CD2 4.28Å; L109-K111 PolarHBondContact O-N 2.66Å; L109-M114 HydrophobicContact CB-CE 4.46Å; L109-M114 HydrophobicContact CB-SD 3.7Å; L109-M114 HydrophobicContact CD1-CE 4.29Å; L109-F122 HydrophobicContact CD1-CE2 4.41Å; L109-F123 HydrophobicContact CD1-CB 4.07Å; L109-Y150 VanDerWaalsContact O-CA 3.32Å; L109-Y150 WeakPolarHBondContact O-CA 2.99Å; L109-L151 HydrophobicContact CB-CB 4.17Å; L109-L151 HydrophobicContact CD1-CD1 4.34Å; L109-L151 PolarHBondContact N-O 3.45Å; L109-L151 PolarHBondContact O-N 2.77Å; L109-M153 HydrophobicContact CD1-CE 4Å
110	N	90.8	Very high	87	Confident	15 Å²	15	39.7 Å²	39.7	8%	0.08	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	108.9	-178.9	-178.8	-2.8	0	0	0	110.9	F89 F112 E113 M114 Y150 Q380	F89-N110 WeakPolarHBondContact O-CB 3.47Å; F89-N110 PolarHBondContact O-N 2.72Å; N110-F112 PolarHBondContact O-N 2.8Å; N110-F112 VanDerWaalsContact O-N 3.12Å; N110-F112 WeakPolarHBondContact OD1-CB 3.08Å; N110-F112 PolarHBondContact OD1-N 2.69Å; N110-F112 VanDerWaalsContact OD1-N 3.1Å; N110-E113 HydrophobicContact CB-CB 4.36Å; N110-E113 PolarHBondContact O-N 2.7Å; N110-E113 VanDerWaalsContact O-N 3.13Å; N110-M114 WeakPolarHBondContact O-CG 3.27Å; N110-M114 PolarHBondContact O-N 3.48Å; N110-M114 VanDerWaalsContact O-N 3.16Å; N110-Y150 HydrophobicContact CB-CE1 4.4Å; N110-Q380 PolarHBondContact ND2-NE2 2.66Å; N110-Q380 VanDerWaalsContact ND2-NE2 3.16Å
111	K	91.8	Very high	86	Confident	1 Å²	1	39.3 Å²	39.3	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-53.5	-35.1	-179.4	-70.5	-177.6	162.9	-175.3	0	113.4	L109 I115 D147 K149 L151 F383 F396	L109-K111 PolarHBondContact O-N 2.66Å; K111-I115 PolarHBondContact O-N 3.12Å; K111-I115 VanDerWaalsContact O-N 3.16Å; K111-D147 WeakPolarHBondContact CE-O 3.27Å; K111-D147 PolarHBondContact NZ-O 3.29Å; K111-K149 VanDerWaalsContact CB-O 3.31Å; K111-K149 WeakPolarHBondContact CB-O 3.36Å; K111-K149 WeakPolarHBondContact CG-O 3.43Å; K111-K149 PolarHBondContact N-O 3.09Å; K111-L151 VanDerWaalsContact CE-CD2 3.4Å; K111-L151 HydrophobicContact CG-CD2 4.33Å; K111-L151 HydrophobicContact CG-CG 4.3Å; K111-F383 HydrophobicContact CB-CE2 4Å; K111-F383 HydrophobicContact CB-CZ 4.11Å; K111-F396 HydrophobicContact CB-CD2 4.41Å; K111-F396 HydrophobicContact CB-CE1 4.38Å; K111-F396 HydrophobicContact CB-CE2 3.6Å; K111-F396 HydrophobicContact CB-CZ 3.59Å; K111-F396 HydrophobicContact CD-CD2 3.63Å; K111-F396 HydrophobicContact CD-CE2 3.68Å; K111-F396 HydrophobicContact CD-CG 4.15Å; K111-F396 HydrophobicContact CD-CZ 4.25Å; K111-F396 HydrophobicContact CG-CD1 4.32Å; K111-F396 HydrophobicContact CG-CD2 3.93Å; K111-F396 HydrophobicContact CG-CE1 4.01Å; K111-F396 HydrophobicContact CG-CE2 3.59Å; K111-F396 HydrophobicContact CG-CG 4.28Å; K111-F396 HydrophobicContact CG-CZ 3.63Å
112	F	89.7	Confident	85.5	Confident	32 Å²	32	39.1 Å²	39.1	14%	0.14	21%	0.209	C	C	.	.	H	α-helix	trans	-68.5	-46.1	-179.4	172.8	-91.3	0	0	0	111.8	N110 M114 I115 K116 E381 S382 F383	N110-F112 PolarHBondContact O-N 2.8Å; N110-F112 VanDerWaalsContact O-N 3.12Å; N110-F112 WeakPolarHBondContact OD1-CB 3.08Å; N110-F112 PolarHBondContact OD1-N 2.69Å; N110-F112 VanDerWaalsContact OD1-N 3.1Å; F112-M114 VanDerWaalsContact C-N 3.32Å; F112-M114 PolarHBondContact O-N 3Å; F112-I115 PolarHBondContact O-N 3.33Å; F112-K116 HydrophobicContact CD1-CD 4.25Å; F112-K116 HydrophobicContact CE1-CB 4.5Å; F112-K116 HydrophobicContact CE1-CD 3.44Å; F112-K116 VanDerWaalsContact CE1-CD 3.44Å; F112-K116 HydrophobicContact CZ-CD 3.87Å; F112-K116 WeakPolarHBondContact O-CB 3.49Å; F112-K116 PolarHBondContact O-N 2.89Å; F112-E381 HydrophobicContact CD1-CB 3.82Å; F112-E381 HydrophobicContact CE1-CB 3.36Å; F112-E381 HydrophobicContact CE1-CG 4.28Å; F112-E381 WeakPolarHBondContact CE1-OE2 3.47Å; F112-E381 HydrophobicContact CZ-CB 3.99Å; F112-E381 WeakPolarHBondContact CZ-OE2 3.33Å; F112-S382 VanDerWaalsContact CD2-C 3.44Å; F112-F383 HydrophobicContact CB-CD2 4.4Å; F112-F383 HydrophobicContact CB-CE1 4.31Å; F112-F383 HydrophobicContact CB-CE2 4.09Å; F112-F383 HydrophobicContact CB-CZ 4.05Å; F112-F383 AromaticContact CD2-CD1 3.76Å; F112-F383 HydrophobicContact CD2-CD1 3.76Å; F112-F383 HydrophobicContact CD2-CE1 4.05Å; F112-F383 HydrophobicContact CD2-CG 4.05Å
113	E	86.3	Confident	85	Confident	31 Å²	31	33.9 Å²	33.9	15%	0.145	19%	0.187	C	C	.	.	H	α-helix	trans	-66	-35.3	177.5	-77.6	-64.8	126.3	0	0	112	N110 K116 R117	N110-E113 HydrophobicContact CB-CB 4.36Å; N110-E113 PolarHBondContact O-N 2.7Å; N110-E113 VanDerWaalsContact O-N 3.13Å; E113-K116 PolarHBondContact O-N 3.2Å; E113-K116 WeakPolarHBondContact OE1-CD 3.49Å; E113-K116 WeakPolarHBondContact OE1-CE 3.14Å; E113-K116 IonicContact OE1-NZ 2.65Å; E113-K116 PolarHBondContact OE1-NZ 3.39Å; E113-R117 WeakPolarHBondContact O-CG 3.45Å; E113-R117 PolarHBondContact O-N 2.91Å; E113-R117 VanDerWaalsContact O-N 3.08Å; E113-R117 IonicContact OE2-CZ 3.7Å; E113-R117 VanDerWaalsContact OE2-CZ 3.29Å; E113-R117 IonicContact OE2-NE 3.13Å; E113-R117 PolarHBondContact OE2-NE 3.08Å; E113-R117 IonicContact OE2-NH2 3.4Å; E113-R117 PolarHBondContact OE2-NH2 3.33Å
114	M	86.3	Confident	84.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-41.8	176.1	-62.2	166.1	78.3	0	0	112.3	F89 L109 N110 F112 A118 F122 F123 L151 F396	F89-M114 HydrophobicContact CD1-CG 3.95Å; L109-M114 HydrophobicContact CB-CE 4.46Å; L109-M114 HydrophobicContact CB-SD 3.7Å; L109-M114 HydrophobicContact CD1-CE 4.29Å; N110-M114 WeakPolarHBondContact O-CG 3.27Å; N110-M114 PolarHBondContact O-N 3.48Å; N110-M114 VanDerWaalsContact O-N 3.16Å; F112-M114 VanDerWaalsContact C-N 3.32Å; F112-M114 PolarHBondContact O-N 3Å; M114-A118 PolarHBondContact O-N 2.97Å; M114-F122 HydrophobicContact CE-CZ 4.08Å; M114-F123 HydrophobicContact CE-CB 4.31Å; M114-F123 HydrophobicContact CE-CD1 3.21Å; M114-F123 HydrophobicContact CE-CE1 3.73Å; M114-F123 HydrophobicContact CE-CG 4.01Å; M114-L151 HydrophobicContact CE-CD1 3.82Å; M114-L151 HydrophobicContact SD-CD1 4.15Å; M114-F396 HydrophobicContact CE-CE1 4.14Å; M114-F396 HydrophobicContact SD-CE1 4.19Å
115	I	86.4	Confident	84.3	Confident	55 Å²	55	38.5 Å²	38.5	28%	0.282	20%	0.204	S	C	.	.	H	α-helix	trans	-72.6	-41.7	175.2	-70.5	-176.7	0	0	0	111.2	K111 F112 R117 A118 F383 N392 P395 F396	K111-I115 PolarHBondContact O-N 3.12Å; K111-I115 VanDerWaalsContact O-N 3.16Å; F112-I115 PolarHBondContact O-N 3.33Å; I115-R117 PolarHBondContact O-N 3.45Å; I115-A118 PolarHBondContact O-N 3.4Å; I115-A118 VanDerWaalsContact O-N 3.08Å; I115-F383 HydrophobicContact CB-CE1 4.27Å; I115-F383 HydrophobicContact CD1-CE1 3.92Å; I115-F383 HydrophobicContact CD1-CZ 3.92Å; I115-F383 HydrophobicContact CG2-CE1 4.46Å; I115-N392 VanDerWaalsContact CD1-O 3.29Å; I115-N392 WeakPolarHBondContact CD1-O 3.37Å; I115-P395 HydrophobicContact CD1-CG 4.12Å; I115-F396 HydrophobicContact CD1-CE2 3.9Å; I115-F396 HydrophobicContact CD1-CZ 4.12Å; I115-F396 HydrophobicContact CG1-CE2 4.4Å; I115-F396 HydrophobicContact CG1-CZ 4.1Å
116	K	84.5	Confident	84.1	Confident	103 Å²	103	38.2 Å²	38.2	45%	0.448	20%	0.202	S	C	.	.	H	α-helix	trans	-60.3	-28.1	179.4	175.3	172.1	159.9	-167.4	0	113.6	F112 E113 E381	F112-K116 HydrophobicContact CD1-CD 4.25Å; F112-K116 HydrophobicContact CE1-CB 4.5Å; F112-K116 HydrophobicContact CE1-CD 3.44Å; F112-K116 VanDerWaalsContact CE1-CD 3.44Å; F112-K116 HydrophobicContact CZ-CD 3.87Å; F112-K116 WeakPolarHBondContact O-CB 3.49Å; F112-K116 PolarHBondContact O-N 2.89Å; E113-K116 PolarHBondContact O-N 3.2Å; E113-K116 WeakPolarHBondContact OE1-CD 3.49Å; E113-K116 WeakPolarHBondContact OE1-CE 3.14Å; E113-K116 IonicContact OE1-NZ 2.65Å; E113-K116 PolarHBondContact OE1-NZ 3.39Å; K116-E381 IonicContact NZ-OE1 2.74Å; K116-E381 PolarHBondContact NZ-OE1 2.7Å; K116-E381 IonicContact NZ-OE2 3.65Å; K116-E381 PolarHBondContact NZ-OE2 2.91Å
117	R	77	Confident	83.8	Confident	100 Å²	100	38.8 Å²	38.8	38%	0.377	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	0.2	176.8	-60.8	-178.4	-157.7	168.3	6.6	114.4	A88 E113 I115 D119	A88-R117 PolarHBondContact O-NH1 2.89Å; A88-R117 PolarHBondContact O-NH2 3.48Å; E113-R117 WeakPolarHBondContact O-CG 3.45Å; E113-R117 PolarHBondContact O-N 2.91Å; E113-R117 VanDerWaalsContact O-N 3.08Å; E113-R117 IonicContact OE2-CZ 3.7Å; E113-R117 VanDerWaalsContact OE2-CZ 3.29Å; E113-R117 IonicContact OE2-NE 3.13Å; E113-R117 PolarHBondContact OE2-NE 3.08Å; E113-R117 IonicContact OE2-NH2 3.4Å; E113-R117 PolarHBondContact OE2-NH2 3.33Å; I115-R117 PolarHBondContact O-N 3.45Å; R117-D119 PolarHBondContact O-N 3.38Å
118	A	67.4	Low	83.6	Confident	79 Å²	79	39.7 Å²	39.7	65%	0.653	21%	0.209	S	C	*	.	S	Bend	trans	61.8	-10.3	-176.4	0	0	0	0	0	117.3	M114 I115 S120	M114-A118 PolarHBondContact O-N 2.97Å; I115-A118 PolarHBondContact O-N 3.4Å; I115-A118 VanDerWaalsContact O-N 3.08Å; A118-S120 PolarHBondContact O-N 3.5Å
119	D	65.5	Low	83.5	Confident	94 Å²	94	39.3 Å²	39.3	50%	0.503	21%	0.207	S	C	.	.			trans	-73.3	56.1	174	-66.2	-45.8	0	0	0	112.9	R117 A121 F122	R117-D119 PolarHBondContact O-N 3.38Å; D119-A121 VanDerWaalsContact C-N 3.34Å; D119-A121 PolarHBondContact O-N 3.01Å; D119-F122 HydrophobicContact CB-CD1 4.24Å; D119-F122 HydrophobicContact CB-CE1 4.27Å; D119-F122 WeakPolarHBondContact O-CD1 3.31Å; D119-F122 WeakPolarHBondContact O-CE1 3.46Å
120	S	58.3	Low	83.6	Confident	44 Å²	44	39.4 Å²	39.4	31%	0.308	21%	0.208	S	C	.	.			trans	-87.4	15.4	-169.3	62.5	0	0	0	0	115.8	A118 F123	A118-S120 PolarHBondContact O-N 3.5Å; S120-F123 WeakPolarHBondContact O-CE1 3.1Å
121	A	69	Low	83.6	Confident	56 Å²	56	38.8 Å²	38.8	46%	0.463	21%	0.205	S	C	.	.	S	Bend	trans	-113.6	-33.4	-172.5	0	0	0	0	0	115.8	D119 F123 W124	D119-A121 VanDerWaalsContact C-N 3.34Å; D119-A121 PolarHBondContact O-N 3.01Å; A121-F123 PolarHBondContact O-N 2.94Å; A121-W124 PolarHBondContact O-N 2.72Å; A121-W124 VanDerWaalsContact O-N 3.16Å
122	F	80.2	Confident	83.5	Confident	33 Å²	33	40.5 Å²	40.5	15%	0.145	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.2	-161.7	62.1	-100.4	0	0	0	116.8	F89 L109 M114 D119 W124 E126 G220	F89-F122 HydrophobicContact CD1-CE1 4.46Å; F89-F122 HydrophobicContact CD1-CZ 4.18Å; F89-F122 HydrophobicContact CD2-CE1 4.27Å; F89-F122 HydrophobicContact CD2-CE2 4.42Å; F89-F122 AromaticContact CD2-CZ 3.66Å; F89-F122 HydrophobicContact CD2-CZ 3.66Å; F89-F122 AromaticContact CE1-CE1 3.99Å; F89-F122 HydrophobicContact CE1-CE1 3.99Å; F89-F122 HydrophobicContact CE1-CZ 4.15Å; F89-F122 AromaticContact CE2-CE1 3.79Å; F89-F122 HydrophobicContact CE2-CE1 3.79Å; F89-F122 AromaticContact CE2-CZ 3.63Å; F89-F122 HydrophobicContact CE2-CZ 3.63Å; F89-F122 AromaticContact CG-CZ 3.94Å; F89-F122 HydrophobicContact CG-CZ 3.94Å; F89-F122 AromaticContact CZ-CE1 3.63Å; F89-F122 HydrophobicContact CZ-CE1 3.63Å; F89-F122 AromaticContact CZ-CZ 3.89Å; F89-F122 HydrophobicContact CZ-CZ 3.89Å; L109-F122 HydrophobicContact CD1-CE2 4.41Å; M114-F122 HydrophobicContact CE-CZ 4.08Å; D119-F122 HydrophobicContact CB-CD1 4.24Å; D119-F122 HydrophobicContact CB-CE1 4.27Å; D119-F122 WeakPolarHBondContact O-CD1 3.31Å; D119-F122 WeakPolarHBondContact O-CE1 3.46Å; F122-W124 VanDerWaalsContact C-N 3.26Å; F122-W124 PolarHBondContact O-N 3.3Å; F122-E126 PolarHBondContact O-N 2.81Å; F122-G220 VanDerWaalsContact CB-O 3.25Å; F122-G220 WeakPolarHBondContact CB-O 3.47Å
123	F	84.3	Confident	83.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-75	-14.6	-177.2	67	-96	0	0	0	113.1	L109 M114 S120 A121 R127 L151 F396 F399	L109-F123 HydrophobicContact CD1-CB 4.07Å; M114-F123 HydrophobicContact CE-CB 4.31Å; M114-F123 HydrophobicContact CE-CD1 3.21Å; M114-F123 HydrophobicContact CE-CE1 3.73Å; M114-F123 HydrophobicContact CE-CG 4.01Å; S120-F123 WeakPolarHBondContact O-CE1 3.1Å; A121-F123 PolarHBondContact O-N 2.94Å; F123-R127 VanDerWaalsContact O-CB 3.24Å; F123-R127 WeakPolarHBondContact O-CB 3.01Å; F123-R127 PolarHBondContact O-N 2.89Å; F123-L151 HydrophobicContact CB-CD1 4.42Å; F123-L151 HydrophobicContact CD1-CD1 4.05Å; F123-L151 HydrophobicContact CD2-CD1 3.88Å; F123-L151 HydrophobicContact CE1-CD1 4.2Å; F123-L151 HydrophobicContact CE2-CD1 4.08Å; F123-L151 HydrophobicContact CG-CD1 3.85Å; F123-L151 HydrophobicContact CZ-CD1 4.23Å; F123-F396 AromaticContact CE1-CD1 3.87Å; F123-F396 HydrophobicContact CE1-CD1 3.87Å; F123-F396 AromaticContact CE1-CE1 4Å; F123-F396 HydrophobicContact CE1-CE1 4Å; F123-F396 AromaticContact CZ-CD1 3.69Å; F123-F396 HydrophobicContact CZ-CD1 3.69Å; F123-F396 HydrophobicContact CZ-CE1 4.29Å; F123-F399 AromaticContact CD2-CD2 3.4Å; F123-F399 HydrophobicContact CD2-CD2 3.4Å; F123-F399 AromaticContact CD2-CE2 3.65Å; F123-F399 HydrophobicContact CD2-CE2 3.65Å; F123-F399 HydrophobicContact CD2-CG 4.47Å; F123-F399 HydrophobicContact CE2-CB 4.37Å; F123-F399 AromaticContact CE2-CD2 3.61Å; F123-F399 HydrophobicContact CE2-CD2 3.61Å; F123-F399 HydrophobicContact CE2-CE2 4.3Å; F123-F399 HydrophobicContact CE2-CG 4.34Å; F123-F399 HydrophobicContact CG-CE2 4.46Å
124	W	88.1	Confident	83.7	Confident	68 Å²	68	41.5 Å²	41.5	26%	0.258	22%	0.222	S	C	.	.	H	α-helix	trans	-68.7	-51.2	176.1	-68.3	116.6	0	0	0	111	A121 F122 R127 D128 P395 I397 G398 F399	A121-W124 PolarHBondContact O-N 2.72Å; A121-W124 VanDerWaalsContact O-N 3.16Å; F122-W124 VanDerWaalsContact C-N 3.26Å; F122-W124 PolarHBondContact O-N 3.3Å; W124-R127 PolarHBondContact O-N 3.5Å; W124-D128 WeakPolarHBondContact O-CB 3.47Å; W124-D128 PolarHBondContact O-N 2.97Å; W124-P395 WeakPolarHBondContact CZ2-O 3.49Å; W124-I397 VanDerWaalsContact CH2-O 3.27Å; W124-I397 WeakPolarHBondContact CH2-O 3.35Å; W124-G398 VanDerWaalsContact CH2-C 3.46Å; W124-G398 WeakPolarHBondContact CZ3-O 3.39Å; W124-F399 HydrophobicContact CH2-CB 4.22Å; W124-F399 VanDerWaalsContact CH2-N 3.33Å; W124-F399 HydrophobicContact CZ3-CB 4.38Å
125	E	89.6	Confident	84	Confident	54 Å²	54	44.3 Å²	44.3	25%	0.252	24%	0.24	S	C	.	.	H	α-helix	trans	-61	-43.7	174.3	-70.5	77.5	-171.3	0	0	111.2	D128 I129 Y196 C222	E125-D128 PolarHBondContact O-N 2.85Å; E125-I129 WeakPolarHBondContact O-CB 3.43Å; E125-I129 WeakPolarHBondContact O-CD1 3.36Å; E125-I129 VanDerWaalsContact O-CG1 3.25Å; E125-I129 WeakPolarHBondContact O-CG1 3.38Å; E125-I129 PolarHBondContact O-N 2.74Å; E125-Y196 HydrophobicContact CB-CE1 4.25Å; E125-Y196 HydrophobicContact CG-CD1 4.24Å; E125-Y196 HydrophobicContact CG-CE1 3.72Å; E125-C222 HydrophobicContact CB-CB 4.32Å
126	E	92.1	Very high	84.3	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-51.9	177.2	177.8	173.6	-159.1	0	0	112.1	K107 F122 D128 I129 M130 M153 F219	K107-E126 WeakPolarHBondContact CE-OE1 3.26Å; K107-E126 IonicContact NZ-OE1 3.66Å; K107-E126 PolarHBondContact NZ-OE1 3.2Å; K107-E126 IonicContact NZ-OE2 3.6Å; K107-E126 PolarHBondContact NZ-OE2 2.71Å; F122-E126 PolarHBondContact O-N 2.81Å; E126-D128 PolarHBondContact O-N 2.8Å; E126-I129 PolarHBondContact O-N 2.78Å; E126-M130 HydrophobicContact CG-SD 3.96Å; E126-M130 VanDerWaalsContact O-CG 3.29Å; E126-M130 WeakPolarHBondContact O-CG 3.12Å; E126-M130 PolarHBondContact O-N 3.35Å; E126-M153 HydrophobicContact CG-CE 4.16Å; E126-M153 HydrophobicContact CG-SD 4.36Å; E126-M153 WeakPolarHBondContact OE2-CE 3.29Å; E126-F219 HydrophobicContact CB-CB 4.02Å; E126-F219 HydrophobicContact CG-CB 4.07Å
127	R	91.8	Very high	84.8	Confident	17 Å²	17	42.1 Å²	42.1	6%	0.064	23%	0.229	C	C	.	.	H	α-helix	trans	-59.6	-45.9	178.2	-174	-154.3	67.7	176.8	-7.8	111.6	F123 W124 M130 A131 L141 A144 G398 F399	F123-R127 VanDerWaalsContact O-CB 3.24Å; F123-R127 WeakPolarHBondContact O-CB 3.01Å; F123-R127 PolarHBondContact O-N 2.89Å; W124-R127 PolarHBondContact O-N 3.5Å; R127-M130 PolarHBondContact O-N 3.45Å; R127-A131 WeakPolarHBondContact O-CB 3.12Å; R127-A131 PolarHBondContact O-N 3.01Å; R127-L141 HydrophobicContact CG-CD2 3.62Å; R127-A144 HydrophobicContact CG-CB 4.17Å; R127-G398 PolarHBondContact NH1-O 2.93Å; R127-F399 HydrophobicContact CB-CE2 4.32Å; R127-F399 WeakPolarHBondContact CD-O 3.16Å; R127-F399 HydrophobicContact CG-CE2 4.45Å; R127-F399 PolarHBondContact NH1-O 3.29Å
128	D	90.1	Very high	85.7	Confident	37 Å²	37	37.4 Å²	37.4	20%	0.198	21%	0.211	C	C	.	.	H	α-helix	trans	-70	-35.2	-175.7	-82.3	16.7	0	0	0	112.3	W124 E125 E126 Y132	W124-D128 WeakPolarHBondContact O-CB 3.47Å; W124-D128 PolarHBondContact O-N 2.97Å; E125-D128 PolarHBondContact O-N 2.85Å; E126-D128 PolarHBondContact O-N 2.8Å; D128-Y132 HydrophobicContact CB-CD2 4.12Å; D128-Y132 HydrophobicContact CB-CE2 4.42Å; D128-Y132 VanDerWaalsContact O-CB 3.25Å; D128-Y132 WeakPolarHBondContact O-CB 3.46Å; D128-Y132 WeakPolarHBondContact O-CD2 3.15Å; D128-Y132 PolarHBondContact O-N 2.76Å; D128-Y132 VanDerWaalsContact O-N 3.15Å
129	I	93.6	Very high	87.1	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-54.8	171	-70.8	165.6	0	0	0	109.4	E125 E126 A131 Y132 A133 I138 Y196 F219 C222	E125-I129 WeakPolarHBondContact O-CB 3.43Å; E125-I129 WeakPolarHBondContact O-CD1 3.36Å; E125-I129 VanDerWaalsContact O-CG1 3.25Å; E125-I129 WeakPolarHBondContact O-CG1 3.38Å; E125-I129 PolarHBondContact O-N 2.74Å; E126-I129 PolarHBondContact O-N 2.78Å; I129-A131 VanDerWaalsContact C-N 3.29Å; I129-A131 PolarHBondContact O-N 3.16Å; I129-Y132 PolarHBondContact O-N 3.29Å; I129-A133 HydrophobicContact CG2-CB 4.42Å; I129-A133 WeakPolarHBondContact O-CB 3.37Å; I129-A133 PolarHBondContact O-N 3.49Å; I129-I138 HydrophobicContact CG2-CG2 3.97Å; I129-Y196 HydrophobicContact CD1-CD1 4.23Å; I129-Y196 HydrophobicContact CD1-CD2 4.17Å; I129-Y196 HydrophobicContact CD1-CG 3.91Å; I129-Y196 HydrophobicContact CG1-CD2 3.98Å; I129-Y196 HydrophobicContact CG1-CE2 4.22Å; I129-Y196 HydrophobicContact CG1-CG 4.25Å; I129-F219 HydrophobicContact CB-CD2 4.33Å; I129-F219 HydrophobicContact CB-CG 4.34Å; I129-F219 HydrophobicContact CD1-CB 4.12Å; I129-F219 HydrophobicContact CD1-CG 4.34Å; I129-F219 HydrophobicContact CG2-CD1 4.1Å; I129-F219 HydrophobicContact CG2-CD2 3.78Å; I129-F219 HydrophobicContact CG2-CE1 4.23Å; I129-F219 HydrophobicContact CG2-CE2 3.92Å; I129-F219 HydrophobicContact CG2-CG 3.86Å; I129-F219 HydrophobicContact CG2-CZ 4.13Å; I129-C222 HydrophobicContact CD1-CB 3.66Å
130	M	93.6	Very high	88.5	Confident	7 Å²	7	31.3 Å²	31.3	3%	0.034	17%	0.166	C	C	.	.	H	α-helix	trans	-67.5	-24.9	-176.4	-59.2	-178.2	85.5	0	0	114.2	E126 R127 V139 L141 M155 F219	E126-M130 HydrophobicContact CG-SD 3.96Å; E126-M130 VanDerWaalsContact O-CG 3.29Å; E126-M130 WeakPolarHBondContact O-CG 3.12Å; E126-M130 PolarHBondContact O-N 3.35Å; R127-M130 PolarHBondContact O-N 3.45Å; M130-V139 WeakPolarHBondContact CB-O 3.4Å; M130-V139 HydrophobicContact CE-CB 3.79Å; M130-V139 HydrophobicContact CE-CG1 3.58Å; M130-V139 WeakPolarHBondContact CE-O 3.24Å; M130-L141 HydrophobicContact CB-CB 3.69Å; M130-L141 WeakPolarHBondContact O-CB 3.46Å; M130-L141 PolarHBondContact O-N 3.29Å; M130-M155 HydrophobicContact CE-CB 4.41Å; M130-M155 HydrophobicContact CE-CG 3.92Å; M130-M155 HydrophobicContact CE-SD 3.49Å; M130-M155 WeakPolarHBondContact CE-SD 3.33Å; M130-M155 HydrophobicContact SD-SD 4.19Å; M130-F219 HydrophobicContact CG-CD2 3.53Å; M130-F219 HydrophobicContact CG-CE2 3.65Å; M130-F219 HydrophobicContact SD-CD2 4.08Å; M130-F219 HydrophobicContact SD-CE2 4.34Å
131	A	91.3	Very high	90.2	Very high	2 Å²	2	29.2 Å²	29.2	2%	0.017	15%	0.151	C	C	.	.	H	α-helix	trans	-80.3	-30.5	176.7	0	0	0	0	0	113.8	R127 I129 L141 Y401	R127-A131 WeakPolarHBondContact O-CB 3.12Å; R127-A131 PolarHBondContact O-N 3.01Å; I129-A131 VanDerWaalsContact C-N 3.29Å; I129-A131 PolarHBondContact O-N 3.16Å; A131-L141 HydrophobicContact CB-CD2 4.17Å; A131-Y401 HydrophobicContact CB-CD1 4.36Å; A131-Y401 HydrophobicContact CB-CD2 4.5Å; A131-Y401 HydrophobicContact CB-CE1 3.91Å; A131-Y401 HydrophobicContact CB-CE2 4.04Å; A131-Y401 PolarHBondContact O-OH 3.22Å
132	Y	89.2	Confident	91.3	Very high	38 Å²	38	28.5 Å²	28.5	15%	0.149	14%	0.137	C	C	.	.	H	α-helix	trans	-129.7	-7.1	-162.2	-60.4	-54.8	0	0	0	116.3	P23 R24 D128 I129 Y401	P23-Y132 WeakPolarHBondContact CB-OH 3.35Å; P23-Y132 HydrophobicContact CG-CE1 4.36Å; P23-Y132 PolarHBondContact O-OH 3.16Å; R24-Y132 HydrophobicContact CG-CD1 4.18Å; R24-Y132 HydrophobicContact CG-CD2 4.04Å; R24-Y132 HydrophobicContact CG-CE1 3.73Å; R24-Y132 HydrophobicContact CG-CE2 3.61Å; R24-Y132 HydrophobicContact CG-CG 4.34Å; R24-Y132 VanDerWaalsContact CG-CZ 3.44Å; R24-Y132 PolarHBondContact N-OH 3.46Å; D128-Y132 HydrophobicContact CB-CD2 4.12Å; D128-Y132 HydrophobicContact CB-CE2 4.42Å; D128-Y132 VanDerWaalsContact O-CB 3.25Å; D128-Y132 WeakPolarHBondContact O-CB 3.46Å; D128-Y132 WeakPolarHBondContact O-CD2 3.15Å; D128-Y132 PolarHBondContact O-N 2.76Å; D128-Y132 VanDerWaalsContact O-N 3.15Å; I129-Y132 PolarHBondContact O-N 3.29Å; Y132-Y401 AromaticContact CE1-CE2 3.97Å; Y132-Y401 HydrophobicContact CE1-CE2 3.97Å; Y132-Y401 AromaticContact CZ-CE2 3.85Å; Y132-Y401 WeakPolarHBondContact OH-CE2 3.38Å
133	A	90.7	Very high	91.9	Very high	17 Å²	17	27.1 Å²	27.1	14%	0.14	13%	0.131	C	C	.	.	S	Bend	trans	-72.3	177.9	172.8	0	0	0	0	0	113	I129 P135 I138 M194	I129-A133 HydrophobicContact CG2-CB 4.42Å; I129-A133 WeakPolarHBondContact O-CB 3.37Å; I129-A133 PolarHBondContact O-N 3.49Å; A133-P135 WeakPolarHBondContact O-CD 3.3Å; A133-I138 HydrophobicContact CB-CB 3.79Å; A133-I138 HydrophobicContact CB-CG1 3.6Å; A133-I138 HydrophobicContact CB-CG2 3.89Å; A133-M194 WeakPolarHBondContact CA-SD 3.43Å; A133-M194 HydrophobicContact CB-CE 4.29Å; A133-M194 HydrophobicContact CB-SD 3.37Å; A133-M194 WeakPolarHBondContact CB-SD 3.37Å
134	D	89.5	Confident	92.3	Very high	67 Å²	67	27.1 Å²	27.1	36%	0.358	13%	0.131	S	C	.	.			trans	-69.7	116.2	169	-166.6	-30.4	0	0	0	110.3	Q136 W137 I138	D134-Q136 PolarHBondContact O-N 3.1Å; D134-Q136 VanDerWaalsContact O-N 3.16Å; D134-Q136 WeakPolarHBondContact OD1-CB 3.43Å; D134-Q136 WeakPolarHBondContact OD1-CG 3.3Å; D134-Q136 PolarHBondContact OD1-N 2.94Å; D134-W137 PolarHBondContact O-N 3.33Å; D134-I138 PolarHBondContact O-N 3.35Å; D134-I138 VanDerWaalsContact O-N 3.15Å
135	P	91.7	Very high	92.6	Very high	59 Å²	59	24.1 Å²	24.1	38%	0.383	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	1.7	180	34.3	-38.2	0	0	0	113.6	A133 K140 K215	A133-P135 WeakPolarHBondContact O-CD 3.3Å; P135-K140 HydrophobicContact CB-CB 4.11Å; P135-K140 HydrophobicContact CB-CD 4.15Å; P135-K140 HydrophobicContact CB-CG 4.32Å; P135-K215 WeakPolarHBondContact O-CE 3.46Å; P135-K215 PolarHBondContact O-NZ 3.19Å
136	Q	92.6	Very high	92.8	Very high	87 Å²	87	23.5 Å²	23.5	41%	0.407	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-43.5	166.1	-66.7	-178.1	20.5	0	0	111.2	D134 K215	D134-Q136 PolarHBondContact O-N 3.1Å; D134-Q136 VanDerWaalsContact O-N 3.16Å; D134-Q136 WeakPolarHBondContact OD1-CB 3.43Å; D134-Q136 WeakPolarHBondContact OD1-CG 3.3Å; D134-Q136 PolarHBondContact OD1-N 2.94Å; Q136-K215 VanDerWaalsContact O-CE 3.31Å; Q136-K215 WeakPolarHBondContact O-CE 3.28Å; Q136-K215 WeakPolarHBondContact O-CG 3.41Å
137	W	95.9	Very high	92.9	Very high	24 Å²	24	26.4 Å²	26.4	9%	0.091	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-18	-169.1	-50.9	109.2	0	0	0	114.6	D134 E183 L186 A187 K215 L216 I350 Q351	D134-W137 PolarHBondContact O-N 3.33Å; W137-E183 HydrophobicContact CZ3-CB 4.04Å; W137-E183 HydrophobicContact CZ3-CG 4.07Å; W137-L186 HydrophobicContact CD2-CB 4.02Å; W137-L186 HydrophobicContact CE3-CB 4.09Å; W137-L186 HydrophobicContact CH2-CB 4.15Å; W137-L186 HydrophobicContact CH2-CD1 3.44Å; W137-L186 VanDerWaalsContact CH2-CD1 3.44Å; W137-L186 HydrophobicContact CH2-CG 4.43Å; W137-L186 HydrophobicContact CZ2-CB 4.07Å; W137-L186 HydrophobicContact CZ2-CD1 3.66Å; W137-L186 HydrophobicContact CZ2-CG 4.43Å; W137-L186 HydrophobicContact CZ3-CB 4.16Å; W137-L186 HydrophobicContact CZ3-CD1 4.06Å; W137-A187 HydrophobicContact CB-CB 3.81Å; W137-K215 CarbonylContact O-C 3.54Å; W137-K215 WeakPolarHBondContact O-CA 3.39Å; W137-K215 WeakPolarHBondContact O-CB 3.35Å; W137-L216 PolarHBondContact O-N 3.47Å; W137-I350 HydrophobicContact CH2-CG2 4.05Å; W137-Q351 HydrophobicContact CH2-CB 3.89Å; W137-Q351 HydrophobicContact CH2-CG 4.18Å; W137-Q351 HydrophobicContact CZ2-CB 4.23Å; W137-Q351 HydrophobicContact CZ2-CG 4.45Å
138	I	96.6	Very high	92.8	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-118.1	134.7	-175.6	-58.3	-56.1	0	0	0	109.2	I129 A133 D134 K140 I191 L216 F219	I129-I138 HydrophobicContact CG2-CG2 3.97Å; A133-I138 HydrophobicContact CB-CB 3.79Å; A133-I138 HydrophobicContact CB-CG1 3.6Å; A133-I138 HydrophobicContact CB-CG2 3.89Å; D134-I138 PolarHBondContact O-N 3.35Å; D134-I138 VanDerWaalsContact O-N 3.15Å; I138-K140 PolarHBondContact O-N 2.78Å; I138-K140 VanDerWaalsContact O-N 3.1Å; I138-I191 HydrophobicContact CD1-CD1 3.76Å; I138-I191 HydrophobicContact CD1-CG1 3.69Å; I138-L216 HydrophobicContact CD1-CB 4.07Å; I138-F219 HydrophobicContact CD1-CE1 4.23Å; I138-F219 HydrophobicContact CD1-CZ 3.83Å; I138-F219 HydrophobicContact CG2-CE2 3.68Å; I138-F219 HydrophobicContact CG2-CZ 3.75Å
139	V	96.2	Very high	92.8	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.024	17%	0.169	C	C	.	.			trans	-60.4	115.1	176.1	171.8	0	0	0	0	109.6	M130 M155 E156 M158 L207 K215 L216 A217	M130-V139 WeakPolarHBondContact CB-O 3.4Å; M130-V139 HydrophobicContact CE-CB 3.79Å; M130-V139 HydrophobicContact CE-CG1 3.58Å; M130-V139 WeakPolarHBondContact CE-O 3.24Å; V139-M155 HydrophobicContact CG1-CB 4.05Å; V139-E156 HydrophobicContact CG1-CG 3.92Å; V139-M158 HydrophobicContact CG2-CE 4.25Å; V139-M158 HydrophobicContact CG2-CG 3.87Å; V139-M158 HydrophobicContact CG2-SD 4.07Å; V139-L207 HydrophobicContact CG2-CD1 4.4Å; V139-K215 HydrophobicContact CG2-CB 3.77Å; V139-K215 HydrophobicContact CG2-CD 4.43Å; V139-L216 WeakPolarHBondContact CG2-O 3.21Å; V139-L216 PolarHBondContact N-O 2.71Å; V139-L216 VanDerWaalsContact N-O 3.07Å; V139-A217 HydrophobicContact CB-CB 4.48Å; V139-A217 HydrophobicContact CG2-CB 4.1Å
140	K	94.1	Very high	92.8	Very high	41 Å²	41	34.5 Å²	34.5	18%	0.178	18%	0.178	C	C	.	.			trans	-73.9	126.4	-171.6	177.7	-174.2	166.9	-166	0	112.4	P135 I138 Y142 M155 E156	P135-K140 HydrophobicContact CB-CB 4.11Å; P135-K140 HydrophobicContact CB-CD 4.15Å; P135-K140 HydrophobicContact CB-CG 4.32Å; I138-K140 PolarHBondContact O-N 2.78Å; I138-K140 VanDerWaalsContact O-N 3.1Å; K140-Y142 HydrophobicContact CD-CE1 4.37Å; K140-Y142 HydrophobicContact CD-CE2 3.97Å; K140-Y142 HydrophobicContact CG-CE2 4.22Å; K140-Y142 PolarHBondContact NZ-OH 3.32Å; K140-M155 CarbonylContact O-C 3.58Å; K140-M155 VanDerWaalsContact O-CA 3.31Å; K140-M155 WeakPolarHBondContact O-CA 3.47Å; K140-E156 HydrophobicContact CB-CG 4.42Å; K140-E156 VanDerWaalsContact CB-OE1 3.27Å; K140-E156 WeakPolarHBondContact CB-OE1 3.22Å; K140-E156 PolarHBondContact N-OE1 2.75Å; K140-E156 PolarHBondContact O-N 2.92Å
141	L	94.3	Very high	92.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	130.7	165.6	-171.9	73.7	0	0	0	110.7	R127 M130 A131 Y143 A144 M153 M155 Y401	R127-L141 HydrophobicContact CG-CD2 3.62Å; M130-L141 HydrophobicContact CB-CB 3.69Å; M130-L141 WeakPolarHBondContact O-CB 3.46Å; M130-L141 PolarHBondContact O-N 3.29Å; A131-L141 HydrophobicContact CB-CD2 4.17Å; L141-Y143 WeakPolarHBondContact CD1-O 3.45Å; L141-A144 HydrophobicContact CD2-CB 4.15Å; L141-M153 HydrophobicContact CD1-CB 3.7Å; L141-M153 HydrophobicContact CD1-CG 4.19Å; L141-M155 HydrophobicContact CD1-CG 4.21Å; L141-Y401 HydrophobicContact CD2-CD1 3.9Å; L141-Y401 HydrophobicContact CD2-CE1 4.35Å; L141-Y401 HydrophobicContact CG-CD1 4.44Å
142	Y	91.9	Very high	93	Very high	41 Å²	41	34.6 Å²	34.6	16%	0.161	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-46	170.2	-73.3	-95	0	0	0	111.6	Y104 K140 V154 E156 R403 E404	Y104-Y142 HydrophobicContact CD1-CD2 4.05Å; Y104-Y142 HydrophobicContact CD1-CE2 4.43Å; Y104-Y142 HydrophobicContact CD1-CG 4.47Å; Y104-Y142 HydrophobicContact CE1-CD1 4.25Å; Y104-Y142 AromaticContact CE1-CD2 3.81Å; Y104-Y142 HydrophobicContact CE1-CD2 3.81Å; Y104-Y142 HydrophobicContact CE1-CE2 4.12Å; Y104-Y142 AromaticContact CE1-CG 3.9Å; Y104-Y142 HydrophobicContact CE1-CG 3.9Å; K140-Y142 HydrophobicContact CD-CE1 4.37Å; K140-Y142 HydrophobicContact CD-CE2 3.97Å; K140-Y142 HydrophobicContact CG-CE2 4.22Å; K140-Y142 PolarHBondContact NZ-OH 3.32Å; Y142-V154 PolarHBondContact N-O 2.56Å; Y142-E156 HydrophobicContact CE2-CB 4.08Å; Y142-R403 PolarHBondContact O-N 3.01Å; Y142-E404 WeakPolarHBondContact CD1-OE1 3.34Å
143	Y	92	Very high	93.3	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	134.5	-176.7	-44.5	-74.4	0	0	0	110.4	M73 L141 V154 Y401 E404 F405	M73-Y143 HydrophobicContact CE-CD1 4.27Å; M73-Y143 HydrophobicContact CE-CD2 4.49Å; M73-Y143 HydrophobicContact CE-CE1 4.36Å; M73-Y143 HydrophobicContact CE-CG 4.36Å; L141-Y143 WeakPolarHBondContact CD1-O 3.45Å; Y143-V154 HydrophobicContact CD2-CB 4.04Å; Y143-V154 HydrophobicContact CD2-CG1 4.01Å; Y143-V154 PolarHBondContact N-O 2.68Å; Y143-V154 PolarHBondContact O-N 3.02Å; Y143-Y401 CarbonylContact C-O 3.5Å; Y143-Y401 WeakPolarHBondContact CA-O 3.29Å; Y143-E404 HydrophobicContact CE1-CB 4.39Å; Y143-E404 PolarHBondContact OH-OE2 3.02Å; Y143-F405 AromaticContact CE1-CD2 3.6Å; Y143-F405 HydrophobicContact CE1-CD2 3.6Å; Y143-F405 AromaticContact CE1-CE2 4Å; Y143-F405 HydrophobicContact CE1-CE2 4Å; Y143-F405 AromaticContact CZ-CE2 3.94Å; Y143-F405 WeakPolarHBondContact OH-CE2 3.31Å
144	A	94.1	Very high	93.6	Very high	1 Å²	1	32 Å²	32	1%	0.008	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.9	156.3	0	0	0	0	0	108.7	R127 L141 Y152 F399 T400 Y401	R127-A144 HydrophobicContact CG-CB 4.17Å; L141-A144 HydrophobicContact CD2-CB 4.15Å; A144-Y152 CarbonylContact C-O 3.57Å; A144-Y152 VanDerWaalsContact CA-O 3.27Å; A144-Y152 WeakPolarHBondContact CA-O 3.34Å; A144-F399 HydrophobicContact CB-CD1 4.14Å; A144-F399 HydrophobicContact CB-CE1 3.68Å; A144-F399 HydrophobicContact CB-CE2 4.43Å; A144-F399 HydrophobicContact CB-CZ 3.87Å; A144-T400 CarbonylContact O-C 3.57Å; A144-T400 WeakPolarHBondContact O-CA 3.36Å; A144-T400 WeakPolarHBondContact O-CG2 3.3Å; A144-Y401 PolarHBondContact N-O 3.5Å; A144-Y401 PolarHBondContact O-N 2.92Å; A144-Y401 VanDerWaalsContact O-O 3.06Å
145	F	94.1	Very high	93.8	Very high	5 Å²	5	29.5 Å²	29.5	2%	0.022	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	172.4	173.9	65	-91.6	0	0	0	110.2	M73 S75 F78 M106 Y152 V154 F399 T400	M73-F145 HydrophobicContact CB-CB 4.28Å; M73-F145 HydrophobicContact CB-CD1 4.02Å; M73-F145 HydrophobicContact CB-CG 4.16Å; M73-F145 HydrophobicContact CG-CD1 3.5Å; M73-F145 VanDerWaalsContact CG-CD1 3.5Å; M73-F145 HydrophobicContact CG-CE1 3.68Å; M73-F145 HydrophobicContact CG-CG 4.08Å; M73-F145 HydrophobicContact CG-CZ 4.41Å; M73-F145 WeakPolarHBondContact O-CD2 3.07Å; S75-F145 VanDerWaalsContact N-CE2 3.27Å; F78-F145 HydrophobicContact CD2-CZ 4.31Å; F78-F145 AromaticContact CE2-CE1 3.82Å; F78-F145 HydrophobicContact CE2-CE1 3.82Å; F78-F145 AromaticContact CE2-CZ 4Å; F78-F145 HydrophobicContact CE2-CZ 4Å; F78-F145 HydrophobicContact CZ-CE1 4.46Å; M106-F145 HydrophobicContact SD-CZ 4.31Å; F145-Y152 AromaticContact CD2-CD2 3.58Å; F145-Y152 HydrophobicContact CD2-CD2 3.58Å; F145-Y152 HydrophobicContact CD2-CE2 4.38Å; F145-Y152 AromaticContact CD2-CG 3.98Å; F145-Y152 HydrophobicContact CD2-CG 3.98Å; F145-Y152 HydrophobicContact CE1-CG 4.42Å; F145-Y152 HydrophobicContact CE2-CD1 4.13Å; F145-Y152 AromaticContact CE2-CD2 3.23Å; F145-Y152 HydrophobicContact CE2-CD2 3.23Å; F145-Y152 AromaticContact CE2-CE2 3.86Å; F145-Y152 HydrophobicContact CE2-CE2 3.86Å; F145-Y152 AromaticContact CE2-CG 3.38Å; F145-Y152 HydrophobicContact CE2-CG 3.38Å; F145-Y152 HydrophobicContact CZ-CD1 4.14Å; F145-Y152 HydrophobicContact CZ-CD2 4.01Å; F145-Y152 AromaticContact CZ-CG 3.64Å; F145-Y152 HydrophobicContact CZ-CG 3.64Å; F145-Y152 PolarHBondContact N-O 2.74Å; F145-Y152 PolarHBondContact O-N 2.8Å; F145-V154 HydrophobicContact CD1-CG2 4.45Å; F145-V154 HydrophobicContact CE1-CG2 3.7Å; F145-F399 WeakPolarHBondContact O-CE1 3.29Å; F145-T400 HydrophobicContact CB-CG2 4.41Å
146	Q	94.2	Very high	94	Very high	40 Å²	40	28.4 Å²	28.4	19%	0.187	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	156.1	-173.8	53.9	176.3	-45.3	0	0	112.8	D34 Y150 L151 F396 F399	D34-Q146 VanDerWaalsContact CG-NE2 3.25Å; D34-Q146 PolarHBondContact OD2-NE2 3.47Å; Q146-Y150 WeakPolarHBondContact CA-O 3.11Å; Q146-L151 HydrophobicContact CB-CD2 3.87Å; Q146-F396 PolarHBondContact NE2-O 3.47Å; Q146-F399 HydrophobicContact CB-CD1 4.34Å
147	D	92.5	Very high	94.2	Very high	63 Å²	63	25.5 Å²	25.5	34%	0.337	13%	0.126	S	C	.	.			trans	-126.6	-166.5	164.9	75.8	17.9	0	0	0	110.8	K111 K149 Y150 Y152	K111-D147 WeakPolarHBondContact CE-O 3.27Å; K111-D147 PolarHBondContact NZ-O 3.29Å; D147-K149 PolarHBondContact O-N 2.96Å; D147-K149 WeakPolarHBondContact OD1-CA 3.49Å; D147-K149 PolarHBondContact OD1-N 2.91Å; D147-Y150 PolarHBondContact N-O 3.43Å; D147-Y150 PolarHBondContact OD1-N 2.76Å; D147-Y152 HydrophobicContact CB-CE2 4.39Å; D147-Y152 PolarHBondContact OD2-OH 3.26Å
148	A	89.8	Confident	94.2	Very high	68 Å²	68	24.6 Å²	24.6	56%	0.562	12%	0.122	S	C	*	.	S	Bend	trans	-67.2	-18.7	-178.5	0	0	0	0	0	114.6	Q393	A148-Q393 PolarHBondContact O-NE2 2.89Å
149	K	90.6	Very high	94.2	Very high	106 Å²	106	25 Å²	25	46%	0.461	13%	0.125	S	C	.	.	S	Bend	trans	-112.6	-36.4	-176.2	-66.6	-173.2	173.8	-166	0	113.3	K111 D147	K111-K149 VanDerWaalsContact CB-O 3.31Å; K111-K149 WeakPolarHBondContact CB-O 3.36Å; K111-K149 WeakPolarHBondContact CG-O 3.43Å; K111-K149 PolarHBondContact N-O 3.09Å; D147-K149 PolarHBondContact O-N 2.96Å; D147-K149 WeakPolarHBondContact OD1-CA 3.49Å; D147-K149 PolarHBondContact OD1-N 2.91Å
150	Y	93.3	Very high	94.1	Very high	49 Å²	49	25 Å²	25	19%	0.192	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	150	-166.7	-68.9	-77.7	0	0	0	113.4	L108 L109 N110 Q146 D147 Q380	L108-Y150 HydrophobicContact CB-CD1 4.02Å; L108-Y150 HydrophobicContact CB-CE1 4.27Å; L108-Y150 HydrophobicContact CD2-CD1 4.32Å; L108-Y150 HydrophobicContact CD2-CE1 4.22Å; L109-Y150 VanDerWaalsContact O-CA 3.32Å; L109-Y150 WeakPolarHBondContact O-CA 2.99Å; N110-Y150 HydrophobicContact CB-CE1 4.4Å; Q146-Y150 WeakPolarHBondContact CA-O 3.11Å; D147-Y150 PolarHBondContact N-O 3.43Å; D147-Y150 PolarHBondContact OD1-N 2.76Å; Y150-Q380 VanDerWaalsContact CZ-NE2 3.33Å; Y150-Q380 VanDerWaalsContact OH-CD 3.27Å; Y150-Q380 PolarHBondContact OH-NE2 3.34Å; Y150-Q380 PolarHBondContact OH-OE1 3.37Å
151	L	94.5	Very high	94.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	142.3	150.9	-52.1	-179.2	0	0	0	108.5	L108 L109 K111 M114 F123 Q146 F396 F399	L108-L151 WeakPolarHBondContact CA-O 3.46Å; L109-L151 HydrophobicContact CB-CB 4.17Å; L109-L151 HydrophobicContact CD1-CD1 4.34Å; L109-L151 PolarHBondContact N-O 3.45Å; L109-L151 PolarHBondContact O-N 2.77Å; K111-L151 VanDerWaalsContact CE-CD2 3.4Å; K111-L151 HydrophobicContact CG-CD2 4.33Å; K111-L151 HydrophobicContact CG-CG 4.3Å; M114-L151 HydrophobicContact CE-CD1 3.82Å; M114-L151 HydrophobicContact SD-CD1 4.15Å; F123-L151 HydrophobicContact CB-CD1 4.42Å; F123-L151 HydrophobicContact CD1-CD1 4.05Å; F123-L151 HydrophobicContact CD2-CD1 3.88Å; F123-L151 HydrophobicContact CE1-CD1 4.2Å; F123-L151 HydrophobicContact CE2-CD1 4.08Å; F123-L151 HydrophobicContact CG-CD1 3.85Å; F123-L151 HydrophobicContact CZ-CD1 4.23Å; Q146-L151 HydrophobicContact CB-CD2 3.87Å; L151-F396 HydrophobicContact CD1-CD1 3.88Å; L151-F396 HydrophobicContact CD1-CE1 4.21Å; L151-F396 HydrophobicContact CD2-CB 4.01Å; L151-F396 HydrophobicContact CD2-CD1 3.8Å; L151-F396 HydrophobicContact CD2-CG 4.04Å; L151-F396 HydrophobicContact CG-CD1 4.17Å; L151-F399 HydrophobicContact CB-CD1 4.17Å; L151-F399 HydrophobicContact CB-CE1 3.61Å; L151-F399 HydrophobicContact CB-CE2 4.46Å; L151-F399 HydrophobicContact CB-CZ 3.75Å; L151-F399 HydrophobicContact CD1-CD2 4.22Å; L151-F399 HydrophobicContact CD1-CE1 4.5Å; L151-F399 HydrophobicContact CD1-CE2 4.09Å; L151-F399 HydrophobicContact CD1-CG 4.45Å; L151-F399 HydrophobicContact CD1-CZ 4.21Å; L151-F399 HydrophobicContact CD2-CB 4.41Å; L151-F399 HydrophobicContact CD2-CD1 3.76Å; L151-F399 HydrophobicContact CD2-CE1 4.11Å; L151-F399 HydrophobicContact CD2-CG 3.99Å; L151-F399 HydrophobicContact CG-CD1 4.4Å; L151-F399 HydrophobicContact CG-CE1 4.28Å; L151-F399 HydrophobicContact CG-CZ 4.42Å
152	Y	95.7	Very high	94.2	Very high	12 Å²	12	24.9 Å²	24.9	5%	0.047	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.7	178.5	-62.9	-88	0	0	0	110	S75 M106 K107 L108 A144 F145 D147	S75-Y152 PolarHBondContact OG-OH 3.21Å; M106-Y152 HydrophobicContact CE-CD1 3.94Å; M106-Y152 HydrophobicContact CE-CE1 4.12Å; M106-Y152 HydrophobicContact CG-CD1 4.25Å; M106-Y152 HydrophobicContact SD-CD1 3.85Å; K107-Y152 WeakPolarHBondContact O-CA 3.38Å; L108-Y152 HydrophobicContact CD1-CD1 4.38Å; L108-Y152 HydrophobicContact CD2-CD1 4.38Å; L108-Y152 HydrophobicContact CD2-CE1 3.79Å; L108-Y152 HydrophobicContact CG-CD1 3.79Å; L108-Y152 HydrophobicContact CG-CE1 3.72Å; A144-Y152 CarbonylContact C-O 3.57Å; A144-Y152 VanDerWaalsContact CA-O 3.27Å; A144-Y152 WeakPolarHBondContact CA-O 3.34Å; F145-Y152 AromaticContact CD2-CD2 3.58Å; F145-Y152 HydrophobicContact CD2-CD2 3.58Å; F145-Y152 HydrophobicContact CD2-CE2 4.38Å; F145-Y152 AromaticContact CD2-CG 3.98Å; F145-Y152 HydrophobicContact CD2-CG 3.98Å; F145-Y152 HydrophobicContact CE1-CG 4.42Å; F145-Y152 HydrophobicContact CE2-CD1 4.13Å; F145-Y152 AromaticContact CE2-CD2 3.23Å; F145-Y152 HydrophobicContact CE2-CD2 3.23Å; F145-Y152 AromaticContact CE2-CE2 3.86Å; F145-Y152 HydrophobicContact CE2-CE2 3.86Å; F145-Y152 AromaticContact CE2-CG 3.38Å; F145-Y152 HydrophobicContact CE2-CG 3.38Å; F145-Y152 HydrophobicContact CZ-CD1 4.14Å; F145-Y152 HydrophobicContact CZ-CD2 4.01Å; F145-Y152 AromaticContact CZ-CG 3.64Å; F145-Y152 HydrophobicContact CZ-CG 3.64Å; F145-Y152 PolarHBondContact N-O 2.74Å; F145-Y152 PolarHBondContact O-N 2.8Å; D147-Y152 HydrophobicContact CB-CE2 4.39Å; D147-Y152 PolarHBondContact OD2-OH 3.26Å
153	M	95.5	Very high	94.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.4	172.2	-65.3	-173.3	-64.7	0	0	109.4	M106 K107 L109 E126 L141 M155 F399	M106-M153 CarbonylContact C-O 3.59Å; M106-M153 VanDerWaalsContact CA-O 3.25Å; M106-M153 WeakPolarHBondContact CA-O 3.25Å; K107-M153 HydrophobicContact CB-CB 4.42Å; K107-M153 HydrophobicContact CB-CE 4.31Å; K107-M153 HydrophobicContact CD-CE 3.87Å; K107-M153 HydrophobicContact CG-CE 4.04Å; K107-M153 PolarHBondContact N-O 3.3Å; K107-M153 PolarHBondContact O-N 2.78Å; L109-M153 HydrophobicContact CD1-CE 4Å; E126-M153 HydrophobicContact CG-CE 4.16Å; E126-M153 HydrophobicContact CG-SD 4.36Å; E126-M153 WeakPolarHBondContact OE2-CE 3.29Å; L141-M153 HydrophobicContact CD1-CB 3.7Å; L141-M153 HydrophobicContact CD1-CG 4.19Å; M153-M155 HydrophobicContact CB-CG 4.33Å; M153-M155 HydrophobicContact CB-SD 4.41Å; M153-F399 HydrophobicContact CG-CE1 4.44Å; M153-F399 HydrophobicContact CG-CE2 4.38Å; M153-F399 HydrophobicContact CG-CZ 3.58Å; M153-F399 HydrophobicContact SD-CE2 4.28Å; M153-F399 HydrophobicContact SD-CZ 4.04Å
154	V	95.6	Very high	94.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	113	-179.8	-175.9	0	0	0	0	108.7	F78 Y104 M106 Y142 Y143 F145	F78-V154 HydrophobicContact CE1-CG1 3.92Å; F78-V154 HydrophobicContact CE1-CG2 4.19Å; F78-V154 HydrophobicContact CE2-CG2 4.27Å; F78-V154 HydrophobicContact CZ-CG1 4.15Å; F78-V154 HydrophobicContact CZ-CG2 3.8Å; Y104-V154 HydrophobicContact CD1-CG1 3.85Å; Y104-V154 HydrophobicContact CD2-CG1 4.11Å; Y104-V154 HydrophobicContact CG-CG1 3.58Å; M106-V154 HydrophobicContact CG-CG2 4.07Å; M106-V154 HydrophobicContact SD-CG2 4.21Å; Y142-V154 PolarHBondContact N-O 2.56Å; Y143-V154 HydrophobicContact CD2-CB 4.04Å; Y143-V154 HydrophobicContact CD2-CG1 4.01Å; Y143-V154 PolarHBondContact N-O 2.68Å; Y143-V154 PolarHBondContact O-N 3.02Å; F145-V154 HydrophobicContact CD1-CG2 4.45Å; F145-V154 HydrophobicContact CE1-CG2 3.7Å
155	M	95.5	Very high	94.4	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.074	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	162.1	-164.4	-48.6	170.3	-55	0	0	109.3	V92 Y104 A105 K107 M130 V139 K140 L141 M153	V92-M155 HydrophobicContact CG1-CE 4.16Å; Y104-M155 WeakPolarHBondContact CA-O 3.49Å; Y104-M155 WeakPolarHBondContact CB-O 3.45Å; A105-M155 HydrophobicContact CB-CE 3.82Å; A105-M155 PolarHBondContact N-O 3.08Å; A105-M155 VanDerWaalsContact N-O 3.07Å; A105-M155 WeakPolarHBondContact O-CB 3.33Å; A105-M155 PolarHBondContact O-N 2.85Å; K107-M155 HydrophobicContact CB-CE 3.77Å; K107-M155 HydrophobicContact CB-SD 4.12Å; M130-M155 HydrophobicContact CE-CB 4.41Å; M130-M155 HydrophobicContact CE-CG 3.92Å; M130-M155 HydrophobicContact CE-SD 3.49Å; M130-M155 WeakPolarHBondContact CE-SD 3.33Å; M130-M155 HydrophobicContact SD-SD 4.19Å; V139-M155 HydrophobicContact CG1-CB 4.05Å; K140-M155 CarbonylContact O-C 3.58Å; K140-M155 VanDerWaalsContact O-CA 3.31Å; K140-M155 WeakPolarHBondContact O-CA 3.47Å; L141-M155 HydrophobicContact CD1-CG 4.21Å; M153-M155 HydrophobicContact CB-CG 4.33Å; M153-M155 HydrophobicContact CB-SD 4.41Å
156	E	95.1	Very high	94.4	Very high	35 Å²	35	27.7 Å²	27.7	16%	0.164	15%	0.147	C	C	.	.			trans	-57.6	145.6	166.1	64.7	-171.3	128.8	0	0	111.2	V139 K140 Y142 M158 K215	V139-E156 HydrophobicContact CG1-CG 3.92Å; K140-E156 HydrophobicContact CB-CG 4.42Å; K140-E156 VanDerWaalsContact CB-OE1 3.27Å; K140-E156 WeakPolarHBondContact CB-OE1 3.22Å; K140-E156 PolarHBondContact N-OE1 2.75Å; K140-E156 PolarHBondContact O-N 2.92Å; Y142-E156 HydrophobicContact CE2-CB 4.08Å; E156-M158 HydrophobicContact CG-SD 4.06Å; E156-K215 IonicContact OE1-NZ 2.61Å; E156-K215 PolarHBondContact OE1-NZ 2.8Å; E156-K215 IonicContact OE2-NZ 2.7Å; E156-K215 PolarHBondContact OE2-NZ 3.44Å
157	Y	96.7	Very high	94.3	Very high	27 Å²	27	27.7 Å²	27.7	11%	0.106	15%	0.148	C	C	.	.			trans	-83.5	136.6	172.5	-178.9	-137.9	0	0	0	110	I84 L94 V103 A105 P159 D366 T367 F370	I84-Y157 HydrophobicContact CD1-CD2 4.05Å; I84-Y157 HydrophobicContact CD1-CE2 3.71Å; L94-Y157 HydrophobicContact CD1-CD1 3.54Å; L94-Y157 HydrophobicContact CD1-CD2 3.49Å; L94-Y157 VanDerWaalsContact CD1-CD2 3.49Å; L94-Y157 HydrophobicContact CD1-CE1 3.7Å; L94-Y157 HydrophobicContact CD1-CE2 3.71Å; L94-Y157 HydrophobicContact CD1-CG 3.44Å; L94-Y157 VanDerWaalsContact CD1-CG 3.44Å; L94-Y157 HydrophobicContact CD2-CE1 4.19Å; V103-Y157 HydrophobicContact CG1-CD1 4.14Å; V103-Y157 HydrophobicContact CG1-CG 4.46Å; A105-Y157 HydrophobicContact CB-CD2 4.39Å; Y157-P159 HydrophobicContact CD1-CB 4.1Å; Y157-P159 HydrophobicContact CE1-CB 3.66Å; Y157-P159 WeakPolarHBondContact O-CD 3.38Å; Y157-D366 WeakPolarHBondContact CE1-O 3.2Å; Y157-D366 PolarHBondContact OH-O 3.25Å; Y157-T367 WeakPolarHBondContact OH-CG2 3.39Å; Y157-F370 HydrophobicContact CE2-CD2 4.34Å; Y157-F370 AromaticContact CE2-CE2 3.58Å; Y157-F370 HydrophobicContact CE2-CE2 3.58Å; Y157-F370 AromaticContact CE2-CZ 3.81Å; Y157-F370 HydrophobicContact CE2-CZ 3.81Å; Y157-F370 AromaticContact CZ-CE2 3.72Å; Y157-F370 VanDerWaalsContact OH-CD2 3.22Å; Y157-F370 WeakPolarHBondContact OH-CD2 3.23Å; Y157-F370 WeakPolarHBondContact OH-CE2 3.49Å
158	M	97	Very high	94.3	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.02	16%	0.164	C	C	.	.			trans	-111.8	80.3	-178	-62.3	-63.5	-72.1	0	0	109	V139 E156 G160 G161 L207 I208 K215 F370	V139-M158 HydrophobicContact CG2-CE 4.25Å; V139-M158 HydrophobicContact CG2-CG 3.87Å; V139-M158 HydrophobicContact CG2-SD 4.07Å; E156-M158 HydrophobicContact CG-SD 4.06Å; M158-G160 PolarHBondContact O-N 3.5Å; M158-G160 VanDerWaalsContact O-N 3.14Å; M158-G161 PolarHBondContact O-N 3.44Å; M158-L207 HydrophobicContact CB-CB 3.79Å; M158-L207 HydrophobicContact CB-CD1 4.15Å; M158-L207 HydrophobicContact CE-CB 3.93Å; M158-L207 WeakPolarHBondContact CE-O 3.5Å; M158-L207 HydrophobicContact CG-CB 3.88Å; M158-L207 HydrophobicContact CG-CD1 4.05Å; M158-I208 CarbonylContact C-O 3.55Å; M158-K215 HydrophobicContact CE-CB 3.73Å; M158-K215 HydrophobicContact CE-CD 3.96Å; M158-K215 HydrophobicContact CE-CG 3.77Å; M158-K215 HydrophobicContact SD-CD 4.15Å; M158-F370 VanDerWaalsContact O-CE2 3.29Å; M158-F370 WeakPolarHBondContact O-CE2 3.32Å; M158-F370 WeakPolarHBondContact O-CZ 3.4Å
159	P	95.6	Very high	94.4	Very high	11 Å²	11	30.3 Å²	30.3	7%	0.071	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-8.8	-166.4	28.4	-37.7	0	0	0	115	Y157 G161 A210 L361 N369	Y157-P159 HydrophobicContact CD1-CB 4.1Å; Y157-P159 HydrophobicContact CE1-CB 3.66Å; Y157-P159 WeakPolarHBondContact O-CD 3.38Å; P159-G161 VanDerWaalsContact C-N 3.26Å; P159-G161 PolarHBondContact O-N 3.28Å; P159-A210 HydrophobicContact CG-CB 3.66Å; P159-L361 HydrophobicContact CB-CD1 3.69Å; P159-L361 HydrophobicContact CB-CD2 3.94Å; P159-L361 HydrophobicContact CB-CG 4.49Å; P159-L361 HydrophobicContact CG-CD1 3.52Å; P159-N369 PolarHBondContact O-ND2 3.02Å
160	G	94.5	Very high	94.4	Very high	4 Å²	4	30.7 Å²	30.7	4%	0.041	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-7.7	176.2	0	0	0	0	0	114.6	M158 I208 N369	M158-G160 PolarHBondContact O-N 3.5Å; M158-G160 VanDerWaalsContact O-N 3.14Å; G160-I208 WeakPolarHBondContact CA-O 3.23Å; G160-I208 PolarHBondContact N-O 3.04Å; G160-N369 WeakPolarHBondContact O-CB 3.26Å
161	G	94.6	Very high	94.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.			trans	83.5	-149.7	-173.2	0	0	0	0	0	111.7	M158 P159 L207 I208 N369	M158-G161 PolarHBondContact O-N 3.44Å; P159-G161 VanDerWaalsContact C-N 3.26Å; P159-G161 PolarHBondContact O-N 3.28Å; G161-L207 CarbonylContact O-C 3.35Å; G161-L207 WeakPolarHBondContact O-CA 3.35Å; G161-I208 PolarHBondContact O-N 2.75Å; G161-N369 WeakPolarHBondContact CA-O 3.37Å
162	D	95.3	Very high	94.3	Very high	39 Å²	39	37.2 Å²	37.2	21%	0.209	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-112.7	175.6	174.7	56.5	57.5	0	0	0	111.6	V164 N165 L166 M206 L207	D162-V164 VanDerWaalsContact C-N 3.34Å; D162-V164 WeakPolarHBondContact OD1-CA 3.29Å; D162-V164 VanDerWaalsContact OD1-CB 3.24Å; D162-V164 WeakPolarHBondContact OD1-CB 3.4Å; D162-V164 PolarHBondContact OD1-N 2.9Å; D162-N165 PolarHBondContact OD1-N 3.36Å; D162-L166 PolarHBondContact O-N 2.96Å; D162-M206 WeakPolarHBondContact CA-O 3.33Å; D162-L207 HydrophobicContact CB-CD2 3.74Å
163	L	95.6	Very high	94.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-77.1	-14.5	176.6	-76.1	-179.8	0	0	0	113.9	L166 M167 Y180 P203 M206 I208 V214 F269	L163-L166 HydrophobicContact CD2-CB 4.01Å; L163-L166 HydrophobicContact CD2-CD1 3.96Å; L163-L166 HydrophobicContact CD2-CD2 4.37Å; L163-L166 HydrophobicContact CD2-CG 4.33Å; L163-L166 PolarHBondContact O-N 3.44Å; L163-M167 WeakPolarHBondContact O-CG 3.32Å; L163-M167 PolarHBondContact O-N 3.16Å; L163-Y180 HydrophobicContact CD2-CD1 4.37Å; L163-Y180 HydrophobicContact CD2-CD2 4.37Å; L163-Y180 HydrophobicContact CD2-CG 4.28Å; L163-P203 HydrophobicContact CB-CB 3.85Å; L163-P203 PolarHBondContact N-O 3.07Å; L163-M206 HydrophobicContact CB-CB 4.26Å; L163-M206 HydrophobicContact CD1-CB 3.68Å; L163-M206 HydrophobicContact CD1-CG 4.33Å; L163-M206 HydrophobicContact CD1-SD 3.82Å; L163-M206 HydrophobicContact CG-CB 4Å; L163-M206 PolarHBondContact N-O 3.16Å; L163-M206 VanDerWaalsContact N-O 3.11Å; L163-I208 HydrophobicContact CD2-CD1 3.97Å; L163-I208 HydrophobicContact CD2-CG1 4.23Å; L163-V214 HydrophobicContact CD1-CG2 4.06Å; L163-V214 HydrophobicContact CD2-CG2 4.38Å; L163-V214 HydrophobicContact CG-CG2 4.35Å; L163-F269 HydrophobicContact CD1-CE2 3.75Å; L163-F269 HydrophobicContact CD1-CZ 3.53Å
164	V	94.1	Very high	94.2	Very high	59 Å²	59	41.7 Å²	41.7	36%	0.358	23%	0.228	S	C	.	.	H	α-helix	trans	-64.7	-49.6	170.5	-172.2	0	0	0	0	108.7	D162 L166 M167 A168 P203 D204	D162-V164 VanDerWaalsContact C-N 3.34Å; D162-V164 WeakPolarHBondContact OD1-CA 3.29Å; D162-V164 VanDerWaalsContact OD1-CB 3.24Å; D162-V164 WeakPolarHBondContact OD1-CB 3.4Å; D162-V164 PolarHBondContact OD1-N 2.9Å; V164-L166 VanDerWaalsContact C-N 3.27Å; V164-L166 PolarHBondContact O-N 3.28Å; V164-M167 PolarHBondContact O-N 3.31Å; V164-A168 WeakPolarHBondContact O-CB 3.36Å; V164-A168 PolarHBondContact O-N 3.29Å; V164-P203 HydrophobicContact CG2-CB 3.8Å; V164-D204 HydrophobicContact CG2-CB 4.29Å
165	N	92.5	Very high	94.1	Very high	43 Å²	43	47.1 Å²	47.1	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-32	175.7	179.8	61.2	0	0	0	112.3	D162 N169	D162-N165 PolarHBondContact OD1-N 3.36Å; N165-N169 PolarHBondContact O-N 3.31Å; N165-N169 PolarHBondContact O-ND2 2.81Å; N165-N169 PolarHBondContact OD1-ND2 3.44Å
166	L	93.9	Very high	94.2	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-50.5	172.4	-172	147.1	0	0	0	111.6	D162 L163 V164 A168 N169 Y170 V172 Y180 I208 V357	D162-L166 PolarHBondContact O-N 2.96Å; L163-L166 HydrophobicContact CD2-CB 4.01Å; L163-L166 HydrophobicContact CD2-CD1 3.96Å; L163-L166 HydrophobicContact CD2-CD2 4.37Å; L163-L166 HydrophobicContact CD2-CG 4.33Å; L163-L166 PolarHBondContact O-N 3.44Å; V164-L166 VanDerWaalsContact C-N 3.27Å; V164-L166 PolarHBondContact O-N 3.28Å; L166-A168 VanDerWaalsContact C-N 3.29Å; L166-A168 PolarHBondContact O-N 3.03Å; L166-N169 PolarHBondContact O-N 2.88Å; L166-Y170 HydrophobicContact CG-CD2 4.27Å; L166-Y170 WeakPolarHBondContact O-CD2 3.18Å; L166-Y170 PolarHBondContact O-N 2.94Å; L166-Y170 VanDerWaalsContact O-N 3.08Å; L166-V172 HydrophobicContact CD2-CG2 3.78Å; L166-Y180 HydrophobicContact CD1-CE2 3.86Å; L166-Y180 HydrophobicContact CD2-CE2 4.28Å; L166-I208 HydrophobicContact CB-CD1 4.02Å; L166-I208 HydrophobicContact CD1-CD1 3.75Å; L166-V357 HydrophobicContact CD1-CB 4.08Å; L166-V357 HydrophobicContact CD1-CG2 3.9Å
167	M	93.4	Very high	94.2	Very high	41 Å²	41	47.6 Å²	47.6	20%	0.202	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-31.9	179.8	-66.2	-175.3	-55.6	0	0	112.6	L163 V164 N169 V172 P203 E272 M273	L163-M167 WeakPolarHBondContact O-CG 3.32Å; L163-M167 PolarHBondContact O-N 3.16Å; V164-M167 PolarHBondContact O-N 3.31Å; M167-N169 VanDerWaalsContact C-N 3.29Å; M167-N169 PolarHBondContact O-N 2.83Å; M167-V172 HydrophobicContact CG-CG2 4.1Å; M167-P203 HydrophobicContact CE-CB 3.75Å; M167-P203 HydrophobicContact CE-CG 3.56Å; M167-E272 HydrophobicContact CE-CG 4.11Å; M167-E272 HydrophobicContact SD-CG 4.2Å; M167-M273 HydrophobicContact CG-CG 4.23Å; M167-M273 HydrophobicContact SD-CB 4.27Å; M167-M273 HydrophobicContact SD-CG 3.5Å; M167-M273 WeakPolarHBondContact SD-CG 3.47Å
168	A	92.4	Very high	94.2	Very high	81 Å²	81	47.8 Å²	47.8	67%	0.669	25%	0.253	S	S	*	.	H	α-helix	trans	-70.6	-20.8	176.1	0	0	0	0	0	114.1	V164 L166	V164-A168 WeakPolarHBondContact O-CB 3.36Å; V164-A168 PolarHBondContact O-N 3.29Å; L166-A168 VanDerWaalsContact C-N 3.29Å; L166-A168 PolarHBondContact O-N 3.03Å
169	N	91.2	Very high	94.3	Very high	105 Å²	105	47.9 Å²	47.9	56%	0.561	25%	0.253	S	S	*	.	H	α-helix	trans	-107.1	-12.7	-178.6	-76	-75.1	0	0	0	114.3	N165 L166 M167	N165-N169 PolarHBondContact O-N 3.31Å; N165-N169 PolarHBondContact O-ND2 2.81Å; N165-N169 PolarHBondContact OD1-ND2 3.44Å; L166-N169 PolarHBondContact O-N 2.88Å; M167-N169 VanDerWaalsContact C-N 3.29Å; M167-N169 PolarHBondContact O-N 2.83Å
170	Y	91.7	Very high	94.4	Very high	114 Å²	114	47.4 Å²	47.4	45%	0.447	25%	0.25	S	C	.	.	S	Bend	trans	-142.7	129.2	-174.9	-61.9	-85.6	0	0	0	112.3	L166 V172 W176 V357	L166-Y170 HydrophobicContact CG-CD2 4.27Å; L166-Y170 WeakPolarHBondContact O-CD2 3.18Å; L166-Y170 PolarHBondContact O-N 2.94Å; L166-Y170 VanDerWaalsContact O-N 3.08Å; Y170-V172 WeakPolarHBondContact O-CG2 3.34Å; Y170-V172 PolarHBondContact O-N 2.94Å; Y170-V172 VanDerWaalsContact O-N 3.07Å; Y170-W176 HydrophobicContact CD1-CH2 4.01Å; Y170-W176 HydrophobicContact CD1-CZ3 4.03Å; Y170-W176 HydrophobicContact CE1-CH2 4.42Å; Y170-W176 HydrophobicContact CG-CH2 4.39Å; Y170-W176 AromaticContact CG-CZ3 3.94Å; Y170-W176 HydrophobicContact CG-CZ3 3.94Å; Y170-V357 HydrophobicContact CE2-CG1 4.44Å; Y170-V357 HydrophobicContact CE2-CG2 4.35Å
171	D	90.6	Very high	94.5	Very high	169 Å²	169	47.2 Å²	47.2	90%	0.904	25%	0.248	S	C	*	.			trans	-62.4	106.9	161.4	-61.8	-47.5	0	0	0	108.6	P173	D171-P173 WeakPolarHBondContact O-CD 3.46Å
172	V	93.1	Very high	94.7	Very high	17 Å²	17	47.2 Å²	47.2	10%	0.103	25%	0.248	C	C	.	.			trans	-81.3	111.1	-170.2	-176.1	0	0	0	0	110.9	L166 M167 Y170 W176 A177 M273	L166-V172 HydrophobicContact CD2-CG2 3.78Å; M167-V172 HydrophobicContact CG-CG2 4.1Å; Y170-V172 WeakPolarHBondContact O-CG2 3.34Å; Y170-V172 PolarHBondContact O-N 2.94Å; Y170-V172 VanDerWaalsContact O-N 3.07Å; V172-W176 HydrophobicContact CG1-CB 3.68Å; V172-A177 HydrophobicContact CG1-CB 4.27Å; V172-M273 HydrophobicContact CG1-CB 4.43Å; V172-M273 HydrophobicContact CG1-SD 4.35Å
173	P	94.1	Very high	94.8	Very high	58 Å²	58	45.3 Å²	45.3	38%	0.377	24%	0.238	S	C	.	.			trans	-72.4	155.6	178	31.9	-36.9	0	0	0	111.2	D171 K175 W176 A177	D171-P173 WeakPolarHBondContact O-CD 3.46Å; P173-K175 PolarHBondContact O-N 3.06Å; P173-W176 HydrophobicContact CG-CB 4.05Å; P173-W176 HydrophobicContact CG-CD2 3.89Å; P173-W176 HydrophobicContact CG-CG 3.55Å; P173-W176 WeakPolarHBondContact O-CB 3.48Å; P173-W176 PolarHBondContact O-N 3.45Å; P173-A177 PolarHBondContact O-N 3.11Å; P173-A177 VanDerWaalsContact O-N 3.1Å
174	E	95	Very high	94.9	Very high	47 Å²	47	45.3 Å²	45.3	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-52.9	-30.7	-178.7	-167.8	178.2	132.7	0	0	113.5	K178 L274 S308 A311 F339	E174-K178 VanDerWaalsContact O-CB 3.27Å; E174-K178 WeakPolarHBondContact O-CB 3.06Å; E174-K178 PolarHBondContact O-N 3.29Å; E174-L274 HydrophobicContact CB-CD2 4.1Å; E174-L274 HydrophobicContact CG-CD2 4.3Å; E174-S308 VanDerWaalsContact CD-OG 3.23Å; E174-S308 VanDerWaalsContact OE1-CB 3.29Å; E174-S308 WeakPolarHBondContact OE1-CB 3.44Å; E174-S308 PolarHBondContact OE1-OG 3.26Å; E174-S308 WeakPolarHBondContact OE2-CB 3.44Å; E174-S308 PolarHBondContact OE2-N 3.02Å; E174-S308 PolarHBondContact OE2-OG 3.24Å; E174-S308 VanDerWaalsContact OE2-OG 3.11Å; E174-A311 HydrophobicContact CG-CB 4.37Å; E174-F339 HydrophobicContact CG-CE2 3.77Å
175	K	95	Very high	95.1	Very high	115 Å²	115	42.5 Å²	42.5	50%	0.5	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-44.2	172.8	-174.9	-178	179.3	-177.8	0	113.4	P173 F179 E344	P173-K175 PolarHBondContact O-N 3.06Å; K175-F179 PolarHBondContact O-N 3.25Å; K175-E344 WeakPolarHBondContact CE-OE1 3.49Å; K175-E344 WeakPolarHBondContact CE-OE2 3.31Å; K175-E344 IonicContact NZ-OE1 3.58Å; K175-E344 PolarHBondContact NZ-OE1 3.32Å; K175-E344 IonicContact NZ-OE2 3.85Å; K175-E344 PolarHBondContact NZ-OE2 3.48Å
176	W	96.1	Very high	95.3	Very high	59 Å²	59	41.1 Å²	41.1	22%	0.223	21%	0.213	C	C	.	.	H	α-helix	trans	-74.6	-43.6	179.4	-68.9	17.7	0	0	0	110.5	Y170 V172 P173 K178 F179 Y180 P356 V357	Y170-W176 HydrophobicContact CD1-CH2 4.01Å; Y170-W176 HydrophobicContact CD1-CZ3 4.03Å; Y170-W176 HydrophobicContact CE1-CH2 4.42Å; Y170-W176 HydrophobicContact CG-CH2 4.39Å; Y170-W176 AromaticContact CG-CZ3 3.94Å; Y170-W176 HydrophobicContact CG-CZ3 3.94Å; V172-W176 HydrophobicContact CG1-CB 3.68Å; P173-W176 HydrophobicContact CG-CB 4.05Å; P173-W176 HydrophobicContact CG-CD2 3.89Å; P173-W176 HydrophobicContact CG-CG 3.55Å; P173-W176 WeakPolarHBondContact O-CB 3.48Å; P173-W176 PolarHBondContact O-N 3.45Å; W176-K178 VanDerWaalsContact C-N 3.28Å; W176-K178 PolarHBondContact O-N 3.46Å; W176-F179 WeakPolarHBondContact O-CB 3.26Å; W176-F179 PolarHBondContact O-N 2.63Å; W176-F179 VanDerWaalsContact O-N 3.1Å; W176-Y180 HydrophobicContact CB-CE2 4.42Å; W176-Y180 WeakPolarHBondContact O-CD2 3.27Å; W176-Y180 PolarHBondContact O-N 3.09Å; W176-P356 HydrophobicContact CB-CB 4.13Å; W176-P356 HydrophobicContact CB-CG 4.21Å; W176-P356 HydrophobicContact CD2-CB 3.56Å; W176-P356 HydrophobicContact CE3-CB 4.17Å; W176-P356 HydrophobicContact CG-CB 3.52Å; W176-P356 HydrophobicContact CG-CG 4.05Å; W176-P356 HydrophobicContact CZ2-CB 4.41Å; W176-V357 HydrophobicContact CE3-CG2 4.05Å; W176-V357 HydrophobicContact CH2-CG2 3.53Å; W176-V357 HydrophobicContact CZ2-CG2 4.37Å; W176-V357 HydrophobicContact CZ3-CG2 3.34Å
177	A	96.3	Very high	95.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.1	-43.3	175.3	0	0	0	0	0	111.7	V172 P173 F179 Y180 T181 L270 M273 L274	V172-A177 HydrophobicContact CG1-CB 4.27Å; P173-A177 PolarHBondContact O-N 3.11Å; P173-A177 VanDerWaalsContact O-N 3.1Å; A177-F179 VanDerWaalsContact C-N 3.35Å; A177-F179 PolarHBondContact O-N 2.91Å; A177-Y180 PolarHBondContact O-N 2.81Å; A177-T181 VanDerWaalsContact O-CB 3.3Å; A177-T181 WeakPolarHBondContact O-CB 3.35Å; A177-T181 PolarHBondContact O-N 2.83Å; A177-T181 PolarHBondContact O-OG1 2.92Å; A177-T181 VanDerWaalsContact O-OG1 3.04Å; A177-L270 HydrophobicContact CB-CD1 3.91Å; A177-M273 HydrophobicContact CB-CB 4.15Å; A177-M273 HydrophobicContact CB-CE 3.84Å; A177-M273 HydrophobicContact CB-SD 4.09Å; A177-L274 HydrophobicContact CB-CD2 3.65Å; A177-L274 HydrophobicContact CB-CG 4.21Å
178	K	96.7	Very high	95.6	Very high	32 Å²	32	38.9 Å²	38.9	14%	0.139	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-42.9	175.1	-165.8	-165.5	-56.5	-131.1	0	113	E174 W176 A182 F339 F340 V341 N342 W345	E174-K178 VanDerWaalsContact O-CB 3.27Å; E174-K178 WeakPolarHBondContact O-CB 3.06Å; E174-K178 PolarHBondContact O-N 3.29Å; W176-K178 VanDerWaalsContact C-N 3.28Å; W176-K178 PolarHBondContact O-N 3.46Å; K178-A182 WeakPolarHBondContact O-CB 3.37Å; K178-A182 PolarHBondContact O-N 2.79Å; K178-A182 VanDerWaalsContact O-N 3.15Å; K178-F339 HydrophobicContact CB-CE1 4.1Å; K178-F339 HydrophobicContact CB-CE2 4.42Å; K178-F339 HydrophobicContact CB-CZ 3.81Å; K178-F339 VanDerWaalsContact CD-O 3.25Å; K178-F339 WeakPolarHBondContact CD-O 3.43Å; K178-F339 WeakPolarHBondContact CE-O 3.43Å; K178-F339 HydrophobicContact CG-CD1 4.36Å; K178-F339 HydrophobicContact CG-CE1 3.99Å; K178-F339 HydrophobicContact CG-CZ 4.1Å; K178-F339 PolarHBondContact NZ-O 3.05Å; K178-F340 HydrophobicContact CG-CD1 4.06Å; K178-V341 PolarHBondContact NZ-O 2.87Å; K178-N342 HydrophobicContact CD-CB 3.96Å; K178-W345 HydrophobicContact CD-CZ2 4.12Å; K178-W345 HydrophobicContact CG-CH2 4.37Å; K178-W345 HydrophobicContact CG-CZ2 3.94Å
179	F	97.6	Very high	95.8	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-55	177.1	-179.9	-83.9	0	0	0	111	K175 W176 A177 T181 A182 E183 H213 W345 I350 P355 P356	K175-F179 PolarHBondContact O-N 3.25Å; W176-F179 WeakPolarHBondContact O-CB 3.26Å; W176-F179 PolarHBondContact O-N 2.63Å; W176-F179 VanDerWaalsContact O-N 3.1Å; A177-F179 VanDerWaalsContact C-N 3.35Å; A177-F179 PolarHBondContact O-N 2.91Å; F179-T181 PolarHBondContact O-N 2.83Å; F179-A182 WeakPolarHBondContact O-CB 3.26Å; F179-A182 PolarHBondContact O-N 3.2Å; F179-E183 HydrophobicContact CD1-CG 4.37Å; F179-E183 HydrophobicContact CE1-CG 4Å; F179-E183 WeakPolarHBondContact CE1-OE2 3.21Å; F179-E183 HydrophobicContact CZ-CG 4.33Å; F179-E183 WeakPolarHBondContact CZ-OE1 3.36Å; F179-E183 PolarHBondContact O-N 3.33Å; F179-H213 AromaticContact CZ-ND1 3.91Å; F179-W345 AromaticContact CD2-CD1 3.85Å; F179-W345 AromaticContact CD2-NE1 3.72Å; F179-I350 HydrophobicContact CD2-CD1 3.9Å; F179-I350 HydrophobicContact CD2-CG1 3.9Å; F179-I350 HydrophobicContact CE2-CD1 4Å; F179-I350 HydrophobicContact CE2-CG1 3.54Å; F179-I350 HydrophobicContact CG-CD1 4.36Å; F179-I350 HydrophobicContact CZ-CG1 4.13Å; F179-P355 HydrophobicContact CE1-CB 3.98Å; F179-P355 HydrophobicContact CE1-CG 4.41Å; F179-P355 HydrophobicContact CZ-CB 3.92Å; F179-P355 HydrophobicContact CZ-CG 3.99Å; F179-P356 HydrophobicContact CB-CG 4.03Å; F179-P356 HydrophobicContact CD1-CG 3.81Å; F179-P356 HydrophobicContact CE1-CG 4.46Å; F179-P356 HydrophobicContact CG-CG 3.91Å
180	Y	97.7	Very high	96	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-35.5	-176.3	-66.2	-53.3	0	0	0	112.8	L163 L166 W176 A177 A182 E183 V184 V214 P356 V357	L163-Y180 HydrophobicContact CD2-CD1 4.37Å; L163-Y180 HydrophobicContact CD2-CD2 4.37Å; L163-Y180 HydrophobicContact CD2-CG 4.28Å; L166-Y180 HydrophobicContact CD1-CE2 3.86Å; L166-Y180 HydrophobicContact CD2-CE2 4.28Å; W176-Y180 HydrophobicContact CB-CE2 4.42Å; W176-Y180 WeakPolarHBondContact O-CD2 3.27Å; W176-Y180 PolarHBondContact O-N 3.09Å; A177-Y180 PolarHBondContact O-N 2.81Å; Y180-A182 VanDerWaalsContact C-N 3.33Å; Y180-A182 PolarHBondContact O-N 2.75Å; Y180-E183 PolarHBondContact O-N 2.8Å; Y180-V184 WeakPolarHBondContact O-CB 3.38Å; Y180-V184 VanDerWaalsContact O-CG2 3.27Å; Y180-V184 WeakPolarHBondContact O-CG2 3.19Å; Y180-V184 PolarHBondContact O-N 2.76Å; Y180-V214 HydrophobicContact CD1-CG2 3.52Å; Y180-V214 HydrophobicContact CE1-CG2 3.99Å; Y180-V214 HydrophobicContact CG-CG2 4.47Å; Y180-P356 HydrophobicContact CE1-CG 4.49Å; Y180-P356 HydrophobicContact CE2-CB 4.08Å; Y180-P356 HydrophobicContact CE2-CG 3.88Å; Y180-V357 PolarHBondContact OH-N 3.48Å
181	T	97.9	Very high	96.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-37.3	169.6	-61.5	0	0	0	0	112.2	A177 F179 V184 V185 V266 L270 M273 F340	A177-T181 VanDerWaalsContact O-CB 3.3Å; A177-T181 WeakPolarHBondContact O-CB 3.35Å; A177-T181 PolarHBondContact O-N 2.83Å; A177-T181 PolarHBondContact O-OG1 2.92Å; A177-T181 VanDerWaalsContact O-OG1 3.04Å; F179-T181 PolarHBondContact O-N 2.83Å; T181-V184 PolarHBondContact O-N 2.94Å; T181-V185 HydrophobicContact CG2-CG2 4.32Å; T181-V185 WeakPolarHBondContact O-CB 3.32Å; T181-V185 VanDerWaalsContact O-CG2 3.23Å; T181-V185 WeakPolarHBondContact O-CG2 3.23Å; T181-V185 PolarHBondContact O-N 3.37Å; T181-V266 HydrophobicContact CG2-CG1 3.76Å; T181-L270 HydrophobicContact CG2-CD2 4.37Å; T181-M273 VanDerWaalsContact OG1-CE 3.27Å; T181-M273 WeakPolarHBondContact OG1-CE 3.5Å; T181-F340 HydrophobicContact CG2-CE1 3.83Å; T181-F340 HydrophobicContact CG2-CZ 3.79Å
182	A	97.8	Very high	96.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67	-43.3	177.9	0	0	0	0	0	112.4	K178 F179 Y180 V185 L186 F340 W345 W347 I350	K178-A182 WeakPolarHBondContact O-CB 3.37Å; K178-A182 PolarHBondContact O-N 2.79Å; K178-A182 VanDerWaalsContact O-N 3.15Å; F179-A182 WeakPolarHBondContact O-CB 3.26Å; F179-A182 PolarHBondContact O-N 3.2Å; Y180-A182 VanDerWaalsContact C-N 3.33Å; Y180-A182 PolarHBondContact O-N 2.75Å; A182-V185 PolarHBondContact O-N 3.23Å; A182-L186 WeakPolarHBondContact O-CG 3.35Å; A182-L186 PolarHBondContact O-N 3.29Å; A182-F340 HydrophobicContact CB-CD1 4.21Å; A182-F340 HydrophobicContact CB-CE1 4.23Å; A182-W345 HydrophobicContact CB-CH2 3.38Å; A182-W345 HydrophobicContact CB-CZ2 4Å; A182-W345 HydrophobicContact CB-CZ3 3.78Å; A182-W347 HydrophobicContact CB-CE3 4.37Å; A182-W347 HydrophobicContact CB-CH2 3.79Å; A182-W347 HydrophobicContact CB-CZ3 3.62Å; A182-I350 HydrophobicContact CB-CD1 3.75Å
183	E	97.6	Very high	96.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.4	-42.9	173.9	-63.5	-162.7	136.9	0	0	112	W137 F179 Y180 V185 L186 A187 H213 V214 I350	W137-E183 HydrophobicContact CZ3-CB 4.04Å; W137-E183 HydrophobicContact CZ3-CG 4.07Å; F179-E183 HydrophobicContact CD1-CG 4.37Å; F179-E183 HydrophobicContact CE1-CG 4Å; F179-E183 WeakPolarHBondContact CE1-OE2 3.21Å; F179-E183 HydrophobicContact CZ-CG 4.33Å; F179-E183 WeakPolarHBondContact CZ-OE1 3.36Å; F179-E183 PolarHBondContact O-N 3.33Å; Y180-E183 PolarHBondContact O-N 2.8Å; E183-V185 VanDerWaalsContact C-N 3.33Å; E183-V185 PolarHBondContact O-N 2.64Å; E183-L186 PolarHBondContact O-N 3.01Å; E183-A187 WeakPolarHBondContact O-CB 3.42Å; E183-A187 PolarHBondContact O-N 3.06Å; E183-H213 IonicContact OE1-CE1 3.73Å; E183-H213 IonicContact OE1-CG 3.96Å; E183-H213 IonicContact OE1-ND1 2.85Å; E183-H213 PolarHBondContact OE1-ND1 3.39Å; E183-H213 WeakPolarHBondContact OE2-CA 3.06Å; E183-V214 HydrophobicContact CB-CB 4.31Å; E183-V214 PolarHBondContact OE2-N 3.28Å; E183-I350 HydrophobicContact CG-CD1 3.81Å; E183-I350 HydrophobicContact CG-CG1 4.36Å
184	V	97.8	Very high	96.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-38.3	175.2	168.5	0	0	0	0	111.9	Y180 T181 A187 L188 M206 V214 V266 F269	Y180-V184 WeakPolarHBondContact O-CB 3.38Å; Y180-V184 VanDerWaalsContact O-CG2 3.27Å; Y180-V184 WeakPolarHBondContact O-CG2 3.19Å; Y180-V184 PolarHBondContact O-N 2.76Å; T181-V184 PolarHBondContact O-N 2.94Å; V184-A187 PolarHBondContact O-N 3.41Å; V184-L188 HydrophobicContact CG1-CD1 4.08Å; V184-L188 HydrophobicContact CG1-CG 4.5Å; V184-L188 WeakPolarHBondContact O-CG 3.08Å; V184-L188 PolarHBondContact O-N 3.4Å; V184-M206 HydrophobicContact CG1-CE 3.77Å; V184-M206 HydrophobicContact CG2-CE 3.97Å; V184-M206 HydrophobicContact CG2-CG 4.04Å; V184-M206 HydrophobicContact CG2-SD 3.62Å; V184-V214 HydrophobicContact CG2-CG1 4.17Å; V184-V266 HydrophobicContact CG1-CG2 4.01Å; V184-F269 HydrophobicContact CB-CE1 4.27Å; V184-F269 HydrophobicContact CG1-CE1 4.49Å; V184-F269 HydrophobicContact CG2-CE1 3.86Å; V184-F269 HydrophobicContact CG2-CZ 4.37Å
185	V	98	Very high	96.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.3	-39.9	175.4	164.6	0	0	0	0	111.6	T181 A182 E183 D189 W263 V266 V331 I334 W347	T181-V185 HydrophobicContact CG2-CG2 4.32Å; T181-V185 WeakPolarHBondContact O-CB 3.32Å; T181-V185 VanDerWaalsContact O-CG2 3.23Å; T181-V185 WeakPolarHBondContact O-CG2 3.23Å; T181-V185 PolarHBondContact O-N 3.37Å; A182-V185 PolarHBondContact O-N 3.23Å; E183-V185 VanDerWaalsContact C-N 3.33Å; E183-V185 PolarHBondContact O-N 2.64Å; V185-D189 WeakPolarHBondContact O-CB 3.36Å; V185-D189 PolarHBondContact O-N 3.27Å; V185-W263 HydrophobicContact CB-CZ3 4.41Å; V185-W263 HydrophobicContact CG1-CH2 4.42Å; V185-W263 HydrophobicContact CG1-CZ3 4.33Å; V185-W263 HydrophobicContact CG2-CZ3 4.14Å; V185-V266 HydrophobicContact CG2-CG1 4.23Å; V185-V331 HydrophobicContact CG1-CG2 3.55Å; V185-I334 HydrophobicContact CG1-CG2 3.95Å; V185-I334 HydrophobicContact CG2-CG2 3.95Å; V185-W347 HydrophobicContact CB-CZ3 4.28Å; V185-W347 HydrophobicContact CG1-CH2 4.27Å; V185-W347 HydrophobicContact CG1-CZ3 4.05Å
186	L	97	Very high	96.1	Very high	14 Å²	14	17.1 Å²	17.1	7%	0.073	10%	0.097	C	C	.	.	H	α-helix	trans	-67.7	-40	174.6	-68	171	0	0	0	112.1	W137 A182 E183 D189 A190 W347 I350	W137-L186 HydrophobicContact CD2-CB 4.02Å; W137-L186 HydrophobicContact CE3-CB 4.09Å; W137-L186 HydrophobicContact CH2-CB 4.15Å; W137-L186 HydrophobicContact CH2-CD1 3.44Å; W137-L186 VanDerWaalsContact CH2-CD1 3.44Å; W137-L186 HydrophobicContact CH2-CG 4.43Å; W137-L186 HydrophobicContact CZ2-CB 4.07Å; W137-L186 HydrophobicContact CZ2-CD1 3.66Å; W137-L186 HydrophobicContact CZ2-CG 4.43Å; W137-L186 HydrophobicContact CZ3-CB 4.16Å; W137-L186 HydrophobicContact CZ3-CD1 4.06Å; A182-L186 WeakPolarHBondContact O-CG 3.35Å; A182-L186 PolarHBondContact O-N 3.29Å; E183-L186 PolarHBondContact O-N 3.01Å; L186-D189 PolarHBondContact O-N 2.67Å; L186-A190 PolarHBondContact O-N 3.04Å; L186-W347 HydrophobicContact CD1-CE3 4.19Å; L186-W347 HydrophobicContact CD2-CE3 4.03Å; L186-W347 HydrophobicContact CG-CE3 4.02Å; L186-W347 HydrophobicContact CG-CZ3 4.3Å; L186-I350 HydrophobicContact CD1-CG2 3.66Å
187	A	97.1	Very high	95.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.6	-39.6	177.7	0	0	0	0	0	113.1	W137 E183 V184 A190 I191 L216	W137-A187 HydrophobicContact CB-CB 3.81Å; E183-A187 WeakPolarHBondContact O-CB 3.42Å; E183-A187 PolarHBondContact O-N 3.06Å; V184-A187 PolarHBondContact O-N 3.41Å; A187-A190 PolarHBondContact O-N 2.91Å; A187-I191 WeakPolarHBondContact O-CG1 3.34Å; A187-I191 PolarHBondContact O-N 3.05Å; A187-L216 HydrophobicContact CB-CD1 3.51Å; A187-L216 HydrophobicContact CB-CG 3.7Å
188	L	97.4	Very high	95.8	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-69	-39.7	173.5	-69	172.2	0	0	0	112.1	V184 A190 I191 H192 H198 V201 L216 D262 W263 V266	V184-L188 HydrophobicContact CG1-CD1 4.08Å; V184-L188 HydrophobicContact CG1-CG 4.5Å; V184-L188 WeakPolarHBondContact O-CG 3.08Å; V184-L188 PolarHBondContact O-N 3.4Å; L188-A190 VanDerWaalsContact C-N 3.26Å; L188-A190 PolarHBondContact O-N 3.12Å; L188-I191 HydrophobicContact CD2-CD1 4.49Å; L188-I191 PolarHBondContact O-N 3.23Å; L188-I191 VanDerWaalsContact O-N 3.13Å; L188-H192 WeakPolarHBondContact O-CB 3.48Å; L188-H192 PolarHBondContact O-CD2 3.03Å; L188-H192 VanDerWaalsContact O-CD2 3.27Å; L188-H192 PolarHBondContact O-N 2.9Å; L188-H198 HydrophobicContact CD2-CB 4.1Å; L188-V201 HydrophobicContact CD1-CG1 4.22Å; L188-V201 HydrophobicContact CD1-CG2 4.34Å; L188-V201 HydrophobicContact CD2-CG1 4.48Å; L188-V201 HydrophobicContact CD2-CG2 3.6Å; L188-L216 HydrophobicContact CD2-CD1 3.8Å; L188-L216 HydrophobicContact CG-CD1 4.09Å; L188-D262 HydrophobicContact CD1-CB 4.28Å; L188-D262 HydrophobicContact CD2-CB 4.3Å; L188-W263 HydrophobicContact CB-CH2 3.77Å; L188-W263 HydrophobicContact CB-CZ3 3.69Å; L188-W263 HydrophobicContact CD1-CE3 4Å; L188-W263 HydrophobicContact CD1-CZ3 3.68Å; L188-W263 HydrophobicContact CG-CZ3 4.35Å; L188-V266 HydrophobicContact CD1-CG2 3.38Å
189	D	95.7	Very high	95.6	Very high	36 Å²	36	13.7 Å²	13.7	19%	0.193	8%	0.084	C	C	.	.	H	α-helix	trans	-61.9	-34.1	176.2	-167.2	43.5	0	0	0	112.1	V185 L186 S193 V331	V185-D189 WeakPolarHBondContact O-CB 3.36Å; V185-D189 PolarHBondContact O-N 3.27Å; L186-D189 PolarHBondContact O-N 2.67Å; D189-S193 WeakPolarHBondContact O-CB 3.49Å; D189-S193 PolarHBondContact O-N 2.64Å; D189-S193 PolarHBondContact O-OG 3.06Å; D189-V331 HydrophobicContact CB-CB 4.43Å; D189-V331 HydrophobicContact CB-CG2 4.13Å
190	A	94.9	Very high	95.4	Very high	20 Å²	20	14.1 Å²	14.1	17%	0.165	9%	0.086	C	C	.	.	H	α-helix	trans	-62.9	-45.6	171.6	0	0	0	0	0	112.5	L186 A187 L188 S193 M194	L186-A190 PolarHBondContact O-N 3.04Å; A187-A190 PolarHBondContact O-N 2.91Å; L188-A190 VanDerWaalsContact C-N 3.26Å; L188-A190 PolarHBondContact O-N 3.12Å; A190-S193 PolarHBondContact O-N 2.81Å; A190-M194 WeakPolarHBondContact O-CG 3.49Å; A190-M194 PolarHBondContact O-N 3.01Å
191	I	95.1	Very high	95.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.5	-44.2	177.1	-63.3	168.2	0	0	0	110.8	I138 A187 L188 S193 M194 G195 Y196 L216 F219	I138-I191 HydrophobicContact CD1-CD1 3.76Å; I138-I191 HydrophobicContact CD1-CG1 3.69Å; A187-I191 WeakPolarHBondContact O-CG1 3.34Å; A187-I191 PolarHBondContact O-N 3.05Å; L188-I191 HydrophobicContact CD2-CD1 4.49Å; L188-I191 PolarHBondContact O-N 3.23Å; L188-I191 VanDerWaalsContact O-N 3.13Å; I191-S193 VanDerWaalsContact C-N 3.29Å; I191-S193 PolarHBondContact O-N 2.92Å; I191-M194 WeakPolarHBondContact O-CB 3.46Å; I191-M194 PolarHBondContact O-N 3.38Å; I191-G195 PolarHBondContact O-N 3.08Å; I191-Y196 PolarHBondContact O-N 2.95Å; I191-L216 HydrophobicContact CD1-CD1 3.69Å; I191-F219 HydrophobicContact CD1-CD1 4.14Å; I191-F219 HydrophobicContact CD1-CE1 3.55Å; I191-F219 HydrophobicContact CD1-CZ 4.43Å; I191-F219 HydrophobicContact CG1-CE1 4.49Å
192	H	94.8	Very high	95.2	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-64.8	-33.6	178	-66.4	-178	0	0	0	112.1	L188 G195 Y196 M225 R259 D262 W263	L188-H192 WeakPolarHBondContact O-CB 3.48Å; L188-H192 PolarHBondContact O-CD2 3.03Å; L188-H192 VanDerWaalsContact O-CD2 3.27Å; L188-H192 PolarHBondContact O-N 2.9Å; H192-G195 PolarHBondContact O-N 3.32Å; H192-Y196 WeakPolarHBondContact CA-O 3.17Å; H192-Y196 PolarHBondContact CD2-O 3.46Å; H192-M225 HydrophobicContact CB-CE 4.45Å; H192-M225 WeakPolarHBondContact O-CE 3.5Å; H192-R259 PolarHBondContact O-NH2 3.36Å; H192-D262 IonicContact CD2-OD2 3.94Å; H192-D262 IonicContact CE1-OD2 3.57Å; H192-D262 IonicContact NE2-OD2 2.99Å; H192-D262 PolarHBondContact NE2-OD2 2.93Å; H192-W263 AromaticContact CE1-CE2 3.79Å; H192-W263 AromaticContact CE1-CZ2 3.58Å; H192-W263 AromaticContact ND1-CZ2 3.49Å; H192-W263 WeakPolarHBondContact ND1-CZ2 3.47Å
193	S	93.3	Very high	95.1	Very high	91 Å²	91	15.5 Å²	15.5	64%	0.636	9%	0.092	S	C	*	.	H	α-helix	trans	-73.2	-29.5	175	-66.4	0	0	0	0	113.1	D189 A190 I191 G195	D189-S193 WeakPolarHBondContact O-CB 3.49Å; D189-S193 PolarHBondContact O-N 2.64Å; D189-S193 PolarHBondContact O-OG 3.06Å; A190-S193 PolarHBondContact O-N 2.81Å; I191-S193 VanDerWaalsContact C-N 3.29Å; I191-S193 PolarHBondContact O-N 2.92Å; S193-G195 PolarHBondContact O-N 3.28Å
194	M	91.7	Very high	94.9	Very high	57 Å²	57	19.1 Å²	19.1	28%	0.281	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.7	167.7	-70.9	-179.4	70.9	0	0	113.5	A133 A190 I191 Y196	A133-M194 WeakPolarHBondContact CA-SD 3.43Å; A133-M194 HydrophobicContact CB-CE 4.29Å; A133-M194 HydrophobicContact CB-SD 3.37Å; A133-M194 WeakPolarHBondContact CB-SD 3.37Å; A190-M194 WeakPolarHBondContact O-CG 3.49Å; A190-M194 PolarHBondContact O-N 3.01Å; I191-M194 WeakPolarHBondContact O-CB 3.46Å; I191-M194 PolarHBondContact O-N 3.38Å; M194-Y196 HydrophobicContact CB-CD2 3.82Å; M194-Y196 HydrophobicContact CB-CE2 4.22Å
195	G	93	Very high	94.8	Very high	21 Å²	21	19.5 Å²	19.5	22%	0.216	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.1	22	-179.6	0	0	0	0	0	114.6	I191 H192 S193 R224 M225	I191-G195 PolarHBondContact O-N 3.08Å; H192-G195 PolarHBondContact O-N 3.32Å; S193-G195 PolarHBondContact O-N 3.28Å; G195-R224 CarbonylContact O-C 3.57Å; G195-R224 WeakPolarHBondContact O-CA 3.48Å; G195-M225 PolarHBondContact O-N 3.46Å
196	Y	93.6	Very high	94.8	Very high	21 Å²	21	19.5 Å²	19.5	8%	0.082	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	158.6	179.3	-64.2	-84.7	0	0	0	112.4	E125 I129 I191 H192 M194 V223 R224 M225	E125-Y196 HydrophobicContact CB-CE1 4.25Å; E125-Y196 HydrophobicContact CG-CD1 4.24Å; E125-Y196 HydrophobicContact CG-CE1 3.72Å; I129-Y196 HydrophobicContact CD1-CD1 4.23Å; I129-Y196 HydrophobicContact CD1-CD2 4.17Å; I129-Y196 HydrophobicContact CD1-CG 3.91Å; I129-Y196 HydrophobicContact CG1-CD2 3.98Å; I129-Y196 HydrophobicContact CG1-CE2 4.22Å; I129-Y196 HydrophobicContact CG1-CG 4.25Å; I191-Y196 PolarHBondContact O-N 2.95Å; H192-Y196 WeakPolarHBondContact CA-O 3.17Å; H192-Y196 PolarHBondContact CD2-O 3.46Å; M194-Y196 HydrophobicContact CB-CD2 3.82Å; M194-Y196 HydrophobicContact CB-CE2 4.22Å; Y196-V223 WeakPolarHBondContact CA-O 3.29Å; Y196-R224 HydrophobicContact CD1-CB 3.9Å; Y196-R224 HydrophobicContact CD1-CG 4.32Å; Y196-R224 HydrophobicContact CE1-CB 3.63Å; Y196-R224 HydrophobicContact CE1-CG 3.93Å; Y196-M225 WeakPolarHBondContact O-CE 3.49Å
197	I	93.7	Very high	94.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.8	170.4	-56.2	178.6	0	0	0	107.4	R199 C222 V223 M225 V231 G258 R259 C261 D262	I197-R199 HydrophobicContact CB-CG 4.39Å; I197-R199 HydrophobicContact CG2-CG 3.78Å; I197-C222 VanDerWaalsContact O-CA 3.24Å; I197-C222 WeakPolarHBondContact O-CA 3.26Å; I197-V223 PolarHBondContact N-O 3.37Å; I197-V223 PolarHBondContact O-N 2.91Å; I197-V223 VanDerWaalsContact O-N 3.08Å; I197-M225 HydrophobicContact CD1-CG 3.75Å; I197-M225 HydrophobicContact CD1-SD 4.18Å; I197-M225 HydrophobicContact CG1-CE 4.31Å; I197-M225 HydrophobicContact CG1-CG 3.59Å; I197-M225 HydrophobicContact CG1-SD 3.93Å; I197-V231 HydrophobicContact CD1-CB 4.22Å; I197-V231 HydrophobicContact CD1-CG2 3.65Å; I197-V231 HydrophobicContact CG1-CG2 4.32Å; I197-G258 VanDerWaalsContact CD1-C 3.44Å; I197-R259 HydrophobicContact CG1-CB 4.38Å; I197-C261 WeakPolarHBondContact CG2-SG 3.49Å; I197-D262 WeakPolarHBondContact CG2-OD1 3.27Å; I197-D262 WeakPolarHBondContact CG2-OD2 3.24Å
198	H	93.6	Very high	94.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.12	C	C	.	.			trans	-81.8	-42.3	-171.6	-165.6	-36.3	0	0	0	113.9	L188 D200 V201 F219 T221 D262	L188-H198 HydrophobicContact CD2-CB 4.1Å; H198-D200 PolarHBondContact CE1-O 3.45Å; H198-D200 PolarHBondContact O-N 3.48Å; H198-V201 HydrophobicContact CB-CG2 3.67Å; H198-F219 AromaticContact CD2-CD1 4Å; H198-F219 AromaticContact CD2-CE1 3.94Å; H198-F219 AromaticContact NE2-CD1 3.72Å; H198-F219 AromaticContact NE2-CE1 3.68Å; H198-T221 CarbonylContact O-C 3.57Å; H198-T221 PolarHBondContact O-OG1 2.91Å; H198-D262 PolarHBondContact N-OD1 3.41Å; H198-D262 PolarHBondContact N-OD2 3.43Å
199	R	92.3	Very high	94.6	Very high	19 Å²	19	21.5 Å²	21.5	7%	0.072	13%	0.125	C	C	.	.	S	Bend	trans	65.1	-24.1	176.9	-47.6	-171.4	-62	159.9	2.7	117.7	I197 T221 V223 C233 V237 Y257 D262	I197-R199 HydrophobicContact CB-CG 4.39Å; I197-R199 HydrophobicContact CG2-CG 3.78Å; R199-T221 VanDerWaalsContact CZ-O 3.23Å; R199-T221 PolarHBondContact NE-O 2.8Å; R199-T221 PolarHBondContact NH2-O 2.61Å; R199-V223 VanDerWaalsContact CZ-CG2 3.45Å; R199-C233 PolarHBondContact NH1-SG 2.94Å; R199-V237 VanDerWaalsContact NH2-CG2 3.26Å; R199-Y257 WeakPolarHBondContact CD-OH 3.5Å; R199-Y257 HydrophobicContact CG-CE2 4.33Å; R199-Y257 PolarHBondContact NH1-OH 3.29Å; R199-D262 PolarHBondContact N-OD1 2.88Å
200	D	94	Very high	94.5	Very high	16 Å²	16	22.1 Å²	22.1	9%	0.086	14%	0.136	C	C	.	.			trans	-121.6	57	173.3	-167.7	41.1	0	0	0	111.7	H198 K202 N205 T221 G238 T239	H198-D200 PolarHBondContact CE1-O 3.45Å; H198-D200 PolarHBondContact O-N 3.48Å; D200-K202 IonicContact OD1-NZ 3.01Å; D200-K202 IonicContact OD2-NZ 2.63Å; D200-K202 PolarHBondContact OD2-NZ 3.48Å; D200-N205 PolarHBondContact O-ND2 3.18Å; D200-N205 PolarHBondContact OD2-ND2 2.72Å; D200-T221 HydrophobicContact CB-CG2 3.87Å; D200-T221 WeakPolarHBondContact CB-OG1 3.5Å; D200-G238 WeakPolarHBondContact OD1-CA 3.48Å; D200-T239 VanDerWaalsContact OD1-CB 3.29Å; D200-T239 WeakPolarHBondContact OD1-CB 3.35Å; D200-T239 PolarHBondContact OD1-N 3.34Å; D200-T239 PolarHBondContact OD1-OG1 3.26Å
201	V	96.5	Very high	94.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.156	C	C	.	.			trans	-81.1	120	176.2	-179	0	0	0	0	109.1	L188 H198 M206 Y242 D262 S265	L188-V201 HydrophobicContact CD1-CG1 4.22Å; L188-V201 HydrophobicContact CD1-CG2 4.34Å; L188-V201 HydrophobicContact CD2-CG1 4.48Å; L188-V201 HydrophobicContact CD2-CG2 3.6Å; H198-V201 HydrophobicContact CB-CG2 3.67Å; V201-M206 HydrophobicContact CG1-CE 3.48Å; V201-M206 VanDerWaalsContact CG1-CE 3.48Å; V201-Y242 WeakPolarHBondContact O-CB 3.47Å; V201-D262 HydrophobicContact CG2-CB 4.04Å; V201-S265 WeakPolarHBondContact O-CB 3.32Å
202	K	95.2	Very high	94.5	Very high	28 Å²	28	26.6 Å²	26.6	12%	0.122	16%	0.156	C	C	.	.			trans	-161.6	164.3	-176	66.8	-169.9	-168.7	-150.3	0	111.2	D200 D204 N205 M206 T239 Y242	D200-K202 IonicContact OD1-NZ 3.01Å; D200-K202 IonicContact OD2-NZ 2.63Å; D200-K202 PolarHBondContact OD2-NZ 3.48Å; K202-D204 VanDerWaalsContact C-N 3.3Å; K202-D204 HydrophobicContact CD-CB 4.34Å; K202-D204 VanDerWaalsContact CD-OD2 3.25Å; K202-D204 WeakPolarHBondContact CD-OD2 3.24Å; K202-D204 WeakPolarHBondContact CE-OD2 3.25Å; K202-D204 HydrophobicContact CG-CB 4.17Å; K202-D204 WeakPolarHBondContact CG-OD2 3.42Å; K202-D204 PolarHBondContact O-N 3.07Å; K202-N205 HydrophobicContact CG-CB 4.13Å; K202-N205 PolarHBondContact O-N 2.82Å; K202-N205 VanDerWaalsContact O-N 3.08Å; K202-M206 WeakPolarHBondContact O-CG 3.33Å; K202-T239 HydrophobicContact CD-CG2 4.26Å; K202-T239 WeakPolarHBondContact CD-OG1 3.4Å; K202-T239 PolarHBondContact NZ-OG1 2.93Å; K202-Y242 HydrophobicContact CB-CD1 4.16Å; K202-Y242 HydrophobicContact CB-CD2 3.83Å; K202-Y242 HydrophobicContact CB-CE1 4.32Å; K202-Y242 HydrophobicContact CB-CE2 3.96Å; K202-Y242 HydrophobicContact CB-CG 3.93Å
203	P	95.7	Very high	94.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-63.2	-29.9	-175.4	-15.9	27.6	0	0	0	114.1	L163 V164 M167 N205 M206 Y242 F269 E272	L163-P203 HydrophobicContact CB-CB 3.85Å; L163-P203 PolarHBondContact N-O 3.07Å; V164-P203 HydrophobicContact CG2-CB 3.8Å; M167-P203 HydrophobicContact CE-CB 3.75Å; M167-P203 HydrophobicContact CE-CG 3.56Å; P203-N205 PolarHBondContact O-N 3.24Å; P203-M206 WeakPolarHBondContact O-CB 3.46Å; P203-M206 PolarHBondContact O-N 2.78Å; P203-M206 VanDerWaalsContact O-N 3.08Å; P203-Y242 VanDerWaalsContact CD-CZ 3.44Å; P203-Y242 VanDerWaalsContact CD-OH 3.25Å; P203-Y242 WeakPolarHBondContact CD-OH 3.23Å; P203-Y242 HydrophobicContact CG-CE1 4.21Å; P203-F269 HydrophobicContact CG-CD2 4.1Å; P203-E272 WeakPolarHBondContact CG-OE2 3.46Å
204	D	93.3	Very high	94.8	Very high	76 Å²	76	23 Å²	23	41%	0.406	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-60.1	-33.2	175.5	-32.9	-132.8	0	0	0	111.7	V164 K202 M206	V164-D204 HydrophobicContact CG2-CB 4.29Å; K202-D204 VanDerWaalsContact C-N 3.3Å; K202-D204 HydrophobicContact CD-CB 4.34Å; K202-D204 VanDerWaalsContact CD-OD2 3.25Å; K202-D204 WeakPolarHBondContact CD-OD2 3.24Å; K202-D204 WeakPolarHBondContact CE-OD2 3.25Å; K202-D204 HydrophobicContact CG-CB 4.17Å; K202-D204 WeakPolarHBondContact CG-OD2 3.42Å; K202-D204 PolarHBondContact O-N 3.07Å; D204-M206 VanDerWaalsContact C-N 3.3Å
205	N	95	Very high	95	Very high	9 Å²	9	21.4 Å²	21.4	5%	0.048	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-89.6	4.4	-178.1	-68.2	-9.3	0	0	0	111.9	D200 K202 P203 L216 A217	D200-N205 PolarHBondContact O-ND2 3.18Å; D200-N205 PolarHBondContact OD2-ND2 2.72Å; K202-N205 HydrophobicContact CG-CB 4.13Å; K202-N205 PolarHBondContact O-N 2.82Å; K202-N205 VanDerWaalsContact O-N 3.08Å; P203-N205 PolarHBondContact O-N 3.24Å; N205-L216 CarbonylContact O-C 3.6Å; N205-L216 WeakPolarHBondContact O-CA 3.41Å; N205-A217 WeakPolarHBondContact CB-O 3.31Å; N205-A217 PolarHBondContact O-N 2.88Å
206	M	97.2	Very high	95.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	88	-178.9	-64	167.9	-171	0	0	109.6	D162 L163 V184 V201 K202 P203 D204 V214 L216 F269	D162-M206 WeakPolarHBondContact CA-O 3.33Å; L163-M206 HydrophobicContact CB-CB 4.26Å; L163-M206 HydrophobicContact CD1-CB 3.68Å; L163-M206 HydrophobicContact CD1-CG 4.33Å; L163-M206 HydrophobicContact CD1-SD 3.82Å; L163-M206 HydrophobicContact CG-CB 4Å; L163-M206 PolarHBondContact N-O 3.16Å; L163-M206 VanDerWaalsContact N-O 3.11Å; V184-M206 HydrophobicContact CG1-CE 3.77Å; V184-M206 HydrophobicContact CG2-CE 3.97Å; V184-M206 HydrophobicContact CG2-CG 4.04Å; V184-M206 HydrophobicContact CG2-SD 3.62Å; V201-M206 HydrophobicContact CG1-CE 3.48Å; V201-M206 VanDerWaalsContact CG1-CE 3.48Å; K202-M206 WeakPolarHBondContact O-CG 3.33Å; P203-M206 WeakPolarHBondContact O-CB 3.46Å; P203-M206 PolarHBondContact O-N 2.78Å; P203-M206 VanDerWaalsContact O-N 3.08Å; D204-M206 VanDerWaalsContact C-N 3.3Å; M206-V214 HydrophobicContact CB-CG1 3.92Å; M206-V214 HydrophobicContact CG-CG1 4.48Å; M206-L216 HydrophobicContact CG-CD2 3.7Å; M206-F269 HydrophobicContact CE-CD1 4.01Å; M206-F269 HydrophobicContact CE-CE1 4.29Å; M206-F269 HydrophobicContact CE-CG 4.15Å; M206-F269 HydrophobicContact SD-CD1 4.14Å; M206-F269 HydrophobicContact SD-CD2 4.14Å; M206-F269 HydrophobicContact SD-CE1 3.91Å; M206-F269 HydrophobicContact SD-CE2 3.91Å; M206-F269 HydrophobicContact SD-CG 4.24Å; M206-F269 HydrophobicContact SD-CZ 3.78Å
207	L	96.9	Very high	95.2	Very high	34 Å²	34	19.9 Å²	19.9	18%	0.178	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	142.4	-173.3	-56.7	-171.5	0	0	0	112.5	V139 M158 G161 D162 V214 K215 A217	V139-L207 HydrophobicContact CG2-CD1 4.4Å; M158-L207 HydrophobicContact CB-CB 3.79Å; M158-L207 HydrophobicContact CB-CD1 4.15Å; M158-L207 HydrophobicContact CE-CB 3.93Å; M158-L207 WeakPolarHBondContact CE-O 3.5Å; M158-L207 HydrophobicContact CG-CB 3.88Å; M158-L207 HydrophobicContact CG-CD1 4.05Å; G161-L207 CarbonylContact O-C 3.35Å; G161-L207 WeakPolarHBondContact O-CA 3.35Å; D162-L207 HydrophobicContact CB-CD2 3.74Å; L207-V214 CarbonylContact O-C 3.56Å; L207-V214 WeakPolarHBondContact O-CA 3.39Å; L207-K215 PolarHBondContact N-O 3.32Å; L207-K215 PolarHBondContact O-N 2.73Å; L207-A217 HydrophobicContact CD1-CB 3.66Å; L207-A217 HydrophobicContact CG-CB 3.87Å
208	I	96.6	Very high	95.1	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.026	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124	-175.1	-52.8	172.5	0	0	0	110.3	M158 G160 G161 L163 L166 P359	M158-I208 CarbonylContact C-O 3.55Å; G160-I208 WeakPolarHBondContact CA-O 3.23Å; G160-I208 PolarHBondContact N-O 3.04Å; G161-I208 PolarHBondContact O-N 2.75Å; L163-I208 HydrophobicContact CD2-CD1 3.97Å; L163-I208 HydrophobicContact CD2-CG1 4.23Å; L166-I208 HydrophobicContact CB-CD1 4.02Å; L166-I208 HydrophobicContact CD1-CD1 3.75Å; I208-P359 HydrophobicContact CG2-CG 4.26Å
209	S	95	Very high	95	Very high	16 Å²	16	23.1 Å²	23.1	11%	0.112	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-73.2	167.5	178.8	64.7	0	0	0	0	112.5	L211 G212 H213	S209-L211 PolarHBondContact O-N 3.25Å; S209-G212 PolarHBondContact O-N 2.82Å; S209-H213 WeakPolarHBondContact CB-O 3.37Å; S209-H213 PolarHBondContact N-O 3.28Å; S209-H213 PolarHBondContact OG-N 3.06Å; S209-H213 VanDerWaalsContact OG-N 3.17Å; S209-H213 PolarHBondContact OG-O 2.84Å
210	A	94.2	Very high	94.7	Very high	50 Å²	50	23 Å²	23	41%	0.413	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-17.1	174.9	0	0	0	0	0	114.5	P159 L361	P159-A210 HydrophobicContact CG-CB 3.66Å; A210-L361 HydrophobicContact CB-CD1 4.09Å
211	L	94.2	Very high	94.4	Very high	113 Å²	113	23.4 Å²	23.4	59%	0.592	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-9.3	177.5	-64.1	178.1	0	0	0	113.3	S209 P355	S209-L211 PolarHBondContact O-N 3.25Å; L211-P355 WeakPolarHBondContact O-CD 3.36Å; L211-P355 WeakPolarHBondContact O-CG 3.44Å
212	G	94.5	Very high	94.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	98.6	-6.4	-178.1	0	0	0	0	0	116	S209 P355 V357	S209-G212 PolarHBondContact O-N 2.82Å; G212-P355 WeakPolarHBondContact O-CB 3.25Å; G212-V357 WeakPolarHBondContact CA-O 3.25Å
213	H	97.1	Very high	93.9	Very high	16 Å²	16	24.1 Å²	24.1	7%	0.074	14%	0.143	C	C	.	.			trans	-79.2	145.6	175.9	-61.2	-84.9	0	0	0	111.9	F179 E183 S209 Q351 T353 P355	F179-H213 AromaticContact CZ-ND1 3.91Å; E183-H213 IonicContact OE1-CE1 3.73Å; E183-H213 IonicContact OE1-CG 3.96Å; E183-H213 IonicContact OE1-ND1 2.85Å; E183-H213 PolarHBondContact OE1-ND1 3.39Å; E183-H213 WeakPolarHBondContact OE2-CA 3.06Å; S209-H213 WeakPolarHBondContact CB-O 3.37Å; S209-H213 PolarHBondContact N-O 3.28Å; S209-H213 PolarHBondContact OG-N 3.06Å; S209-H213 VanDerWaalsContact OG-N 3.17Å; S209-H213 PolarHBondContact OG-O 2.84Å; H213-Q351 PolarHBondContact CE1-O 3.43Å; H213-Q351 PolarHBondContact NE2-O 3.08Å; H213-T353 PolarHBondContact CE1-O 3.46Å; H213-T353 VanDerWaalsContact CE1-O 3.22Å; H213-P355 VanDerWaalsContact CE1-CG 3.47Å; H213-P355 WeakPolarHBondContact CE1-CG 3.21Å; H213-P355 WeakPolarHBondContact NE2-CG 3.4Å
214	V	96.9	Very high	93.6	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	142.9	179.4	173.6	0	0	0	0	112.1	L163 Y180 E183 V184 M206 L207	L163-V214 HydrophobicContact CD1-CG2 4.06Å; L163-V214 HydrophobicContact CD2-CG2 4.38Å; L163-V214 HydrophobicContact CG-CG2 4.35Å; Y180-V214 HydrophobicContact CD1-CG2 3.52Å; Y180-V214 HydrophobicContact CE1-CG2 3.99Å; Y180-V214 HydrophobicContact CG-CG2 4.47Å; E183-V214 HydrophobicContact CB-CB 4.31Å; E183-V214 PolarHBondContact OE2-N 3.28Å; V184-V214 HydrophobicContact CG2-CG1 4.17Å; M206-V214 HydrophobicContact CB-CG1 3.92Å; M206-V214 HydrophobicContact CG-CG1 4.48Å; L207-V214 CarbonylContact O-C 3.56Å; L207-V214 WeakPolarHBondContact O-CA 3.39Å
215	K	97.5	Very high	93.5	Very high	24 Å²	24	29.4 Å²	29.4	10%	0.104	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	146.4	161.8	-57.2	-172.3	-174.4	-171.3	0	111.1	P135 Q136 W137 V139 E156 M158 L207	P135-K215 WeakPolarHBondContact O-CE 3.46Å; P135-K215 PolarHBondContact O-NZ 3.19Å; Q136-K215 VanDerWaalsContact O-CE 3.31Å; Q136-K215 WeakPolarHBondContact O-CE 3.28Å; Q136-K215 WeakPolarHBondContact O-CG 3.41Å; W137-K215 CarbonylContact O-C 3.54Å; W137-K215 WeakPolarHBondContact O-CA 3.39Å; W137-K215 WeakPolarHBondContact O-CB 3.35Å; V139-K215 HydrophobicContact CG2-CB 3.77Å; V139-K215 HydrophobicContact CG2-CD 4.43Å; E156-K215 IonicContact OE1-NZ 2.61Å; E156-K215 PolarHBondContact OE1-NZ 2.8Å; E156-K215 IonicContact OE2-NZ 2.7Å; E156-K215 PolarHBondContact OE2-NZ 3.44Å; M158-K215 HydrophobicContact CE-CB 3.73Å; M158-K215 HydrophobicContact CE-CD 3.96Å; M158-K215 HydrophobicContact CE-CG 3.77Å; M158-K215 HydrophobicContact SD-CD 4.15Å; L207-K215 PolarHBondContact N-O 3.32Å; L207-K215 PolarHBondContact O-N 2.73Å
216	L	97.2	Very high	93.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	148.6	173.7	-65.9	174.1	0	0	0	112.1	W137 I138 V139 A187 L188 I191 N205 M206 F219	W137-L216 PolarHBondContact O-N 3.47Å; I138-L216 HydrophobicContact CD1-CB 4.07Å; V139-L216 WeakPolarHBondContact CG2-O 3.21Å; V139-L216 PolarHBondContact N-O 2.71Å; V139-L216 VanDerWaalsContact N-O 3.07Å; A187-L216 HydrophobicContact CB-CD1 3.51Å; A187-L216 HydrophobicContact CB-CG 3.7Å; L188-L216 HydrophobicContact CD2-CD1 3.8Å; L188-L216 HydrophobicContact CG-CD1 4.09Å; I191-L216 HydrophobicContact CD1-CD1 3.69Å; N205-L216 CarbonylContact O-C 3.6Å; N205-L216 WeakPolarHBondContact O-CA 3.41Å; M206-L216 HydrophobicContact CG-CD2 3.7Å; L216-F219 VanDerWaalsContact C-CZ 3.41Å; L216-F219 HydrophobicContact CB-CE1 3.78Å; L216-F219 HydrophobicContact CB-CZ 3.73Å; L216-F219 VanDerWaalsContact O-CZ 3.24Å; L216-F219 WeakPolarHBondContact O-CZ 3.37Å
217	A	93.6	Very high	92.6	Very high	11 Å²	11	36.4 Å²	36.4	9%	0.091	22%	0.221	C	C	.	.			trans	-141.9	176.3	177.4	0	0	0	0	0	111.5	V139 N205 L207	V139-A217 HydrophobicContact CB-CB 4.48Å; V139-A217 HydrophobicContact CG2-CB 4.1Å; N205-A217 WeakPolarHBondContact CB-O 3.31Å; N205-A217 PolarHBondContact O-N 2.88Å; L207-A217 HydrophobicContact CD1-CB 3.66Å; L207-A217 HydrophobicContact CG-CB 3.87Å
218	D	90.3	Very high	92.2	Very high	67 Å²	67	38.6 Å²	38.6	36%	0.358	23%	0.233	S	C	.	.			trans	49.8	69.9	-178.1	-147.7	-26.3	0	0	0	115.7	K107 G220	K107-D218 IonicContact NZ-OD1 2.73Å; K107-D218 PolarHBondContact NZ-OD1 3.41Å; K107-D218 IonicContact NZ-OD2 3.08Å; K107-D218 PolarHBondContact NZ-OD2 2.99Å; D218-G220 PolarHBondContact O-N 2.75Å; D218-G220 PolarHBondContact OD1-N 2.9Å
219	F	91.8	Very high	91.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.244	C	C	.	.			trans	-82.7	15	179.5	-55.4	-66.2	0	0	0	113.4	E126 I129 M130 I138 I191 H198 L216 T221 C222	E126-F219 HydrophobicContact CB-CB 4.02Å; E126-F219 HydrophobicContact CG-CB 4.07Å; I129-F219 HydrophobicContact CB-CD2 4.33Å; I129-F219 HydrophobicContact CB-CG 4.34Å; I129-F219 HydrophobicContact CD1-CB 4.12Å; I129-F219 HydrophobicContact CD1-CG 4.34Å; I129-F219 HydrophobicContact CG2-CD1 4.1Å; I129-F219 HydrophobicContact CG2-CD2 3.78Å; I129-F219 HydrophobicContact CG2-CE1 4.23Å; I129-F219 HydrophobicContact CG2-CE2 3.92Å; I129-F219 HydrophobicContact CG2-CG 3.86Å; I129-F219 HydrophobicContact CG2-CZ 4.13Å; M130-F219 HydrophobicContact CG-CD2 3.53Å; M130-F219 HydrophobicContact CG-CE2 3.65Å; M130-F219 HydrophobicContact SD-CD2 4.08Å; M130-F219 HydrophobicContact SD-CE2 4.34Å; I138-F219 HydrophobicContact CD1-CE1 4.23Å; I138-F219 HydrophobicContact CD1-CZ 3.83Å; I138-F219 HydrophobicContact CG2-CE2 3.68Å; I138-F219 HydrophobicContact CG2-CZ 3.75Å; I191-F219 HydrophobicContact CD1-CD1 4.14Å; I191-F219 HydrophobicContact CD1-CE1 3.55Å; I191-F219 HydrophobicContact CD1-CZ 4.43Å; I191-F219 HydrophobicContact CG1-CE1 4.49Å; H198-F219 AromaticContact CD2-CD1 4Å; H198-F219 AromaticContact CD2-CE1 3.94Å; H198-F219 AromaticContact NE2-CD1 3.72Å; H198-F219 AromaticContact NE2-CE1 3.68Å; L216-F219 VanDerWaalsContact C-CZ 3.41Å; L216-F219 HydrophobicContact CB-CE1 3.78Å; L216-F219 HydrophobicContact CB-CZ 3.73Å; L216-F219 VanDerWaalsContact O-CZ 3.24Å; L216-F219 WeakPolarHBondContact O-CZ 3.37Å; F219-T221 PolarHBondContact O-N 3.5Å; F219-C222 HydrophobicContact CB-CB 4.35Å; F219-C222 VanDerWaalsContact O-CB 3.25Å; F219-C222 WeakPolarHBondContact O-CB 3.32Å; F219-C222 PolarHBondContact O-N 2.82Å
220	G	86	Confident	91.6	Very high	17 Å²	17	41.5 Å²	41.5	18%	0.175	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	1.5	-179.6	0	0	0	0	0	115.5	F122 D218	F122-G220 VanDerWaalsContact CB-O 3.25Å; F122-G220 WeakPolarHBondContact CB-O 3.47Å; D218-G220 PolarHBondContact O-N 2.75Å; D218-G220 PolarHBondContact OD1-N 2.9Å
221	T	87.5	Confident	91.2	Very high	24 Å²	24	39.3 Å²	39.3	15%	0.147	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-3.8	170.6	49.7	0	0	0	0	113.3	H198 R199 D200 F219 V237	H198-T221 CarbonylContact O-C 3.57Å; H198-T221 PolarHBondContact O-OG1 2.91Å; R199-T221 VanDerWaalsContact CZ-O 3.23Å; R199-T221 PolarHBondContact NE-O 2.8Å; R199-T221 PolarHBondContact NH2-O 2.61Å; D200-T221 HydrophobicContact CB-CG2 3.87Å; D200-T221 WeakPolarHBondContact CB-OG1 3.5Å; F219-T221 PolarHBondContact O-N 3.5Å; T221-V237 HydrophobicContact CG2-CB 4.34Å; T221-V237 HydrophobicContact CG2-CG2 4.11Å
222	C	91.6	Very high	90.7	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.027	23%	0.233	C	C	.	.			trans	-64.3	142.8	-177.7	-74.9	0	0	0	0	112.7	E125 I129 I197 F219	E125-C222 HydrophobicContact CB-CB 4.32Å; I129-C222 HydrophobicContact CD1-CB 3.66Å; I197-C222 VanDerWaalsContact O-CA 3.24Å; I197-C222 WeakPolarHBondContact O-CA 3.26Å; F219-C222 HydrophobicContact CB-CB 4.35Å; F219-C222 VanDerWaalsContact O-CB 3.25Å; F219-C222 WeakPolarHBondContact O-CB 3.32Å; F219-C222 PolarHBondContact O-N 2.82Å
223	V	89.2	Confident	89.8	Confident	40 Å²	40	42.4 Å²	42.4	24%	0.242	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.5	171.8	173.8	0	0	0	0	110.7	Y196 I197 R199 V231	Y196-V223 WeakPolarHBondContact CA-O 3.29Å; I197-V223 PolarHBondContact N-O 3.37Å; I197-V223 PolarHBondContact O-N 2.91Å; I197-V223 VanDerWaalsContact O-N 3.08Å; R199-V223 VanDerWaalsContact CZ-CG2 3.45Å; V223-V231 HydrophobicContact CB-CG1 4.21Å; V223-V231 HydrophobicContact CB-CG2 4.29Å; V223-V231 HydrophobicContact CG1-CB 4.4Å; V223-V231 HydrophobicContact CG1-CG1 3.64Å; V223-V231 HydrophobicContact CG1-CG2 3.81Å
224	R	90.2	Very high	88.6	Confident	165 Å²	165	45 Å²	45	62%	0.623	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	129.4	178	-163.4	173.7	-179.3	168.5	1.8	111.8	G195 Y196	G195-R224 CarbonylContact O-C 3.57Å; G195-R224 WeakPolarHBondContact O-CA 3.48Å; Y196-R224 HydrophobicContact CD1-CB 3.9Å; Y196-R224 HydrophobicContact CD1-CG 4.32Å; Y196-R224 HydrophobicContact CE1-CB 3.63Å; Y196-R224 HydrophobicContact CE1-CG 3.93Å
225	M	90.8	Very high	87.5	Confident	21 Å²	21	48.8 Å²	48.8	10%	0.103	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-64.8	145.3	173.5	-70.2	-176.2	-92.5	0	0	111.7	H192 G195 Y196 I197 G229 V231 R259	H192-M225 HydrophobicContact CB-CE 4.45Å; H192-M225 WeakPolarHBondContact O-CE 3.5Å; G195-M225 PolarHBondContact O-N 3.46Å; Y196-M225 WeakPolarHBondContact O-CE 3.49Å; I197-M225 HydrophobicContact CD1-CG 3.75Å; I197-M225 HydrophobicContact CD1-SD 4.18Å; I197-M225 HydrophobicContact CG1-CE 4.31Å; I197-M225 HydrophobicContact CG1-CG 3.59Å; I197-M225 HydrophobicContact CG1-SD 3.93Å; M225-G229 VanDerWaalsContact SD-O 3.38Å; M225-V231 HydrophobicContact CG-CG2 4.39Å; M225-R259 HydrophobicContact SD-CB 4.35Å
226	G	89	Confident	86.4	Confident	34 Å²	34	49 Å²	49	35%	0.351	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-68.5	173.8	164.8	0	0	0	0	0	112.4	D228 G229 M230	G226-D228 PolarHBondContact O-N 2.78Å; G226-G229 PolarHBondContact O-N 2.84Å; G226-M230 PolarHBondContact N-O 2.86Å
227	A	84.9	Confident	85.4	Confident	123 Å²	123	51 Å²	51	100%	1.017	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-10	176.2	0	0	0	0	0	113.9
228	D	88.1	Confident	84.5	Confident	79 Å²	79	51.6 Å²	51.6	42%	0.422	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	3.9	172.5	54.5	-4.3	0	0	0	113.6	G226 M230 R232	G226-D228 PolarHBondContact O-N 2.78Å; D228-M230 PolarHBondContact O-N 3.11Å; D228-M230 PolarHBondContact OD1-N 2.85Å; D228-R232 IonicContact OD1-NH1 2.73Å; D228-R232 PolarHBondContact OD1-NH1 2.89Å; D228-R232 IonicContact OD2-CZ 3.1Å; D228-R232 IonicContact OD2-NH1 2.7Å; D228-R232 PolarHBondContact OD2-NH1 3.42Å; D228-R232 IonicContact OD2-NH2 2.69Å; D228-R232 PolarHBondContact OD2-NH2 3.1Å
229	G	87.9	Confident	84.3	Confident	26 Å²	26	50 Å²	50	27%	0.268	30%	0.302	S	S	.	.	S	Bend	trans	72.4	13.3	-177.1	0	0	0	0	0	114.2	M225 G226	M225-G229 VanDerWaalsContact SD-O 3.38Å; G226-G229 PolarHBondContact O-N 2.84Å
230	M	90.1	Very high	84.1	Confident	57 Å²	57	51.5 Å²	51.5	28%	0.281	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	150.7	-174.4	-65.5	-80.9	161	0	0	111.3	G226 D228 V256 R322	G226-M230 PolarHBondContact N-O 2.86Å; D228-M230 PolarHBondContact O-N 3.11Å; D228-M230 PolarHBondContact OD1-N 2.85Å; M230-V256 HydrophobicContact CB-CG1 3.82Å; M230-V256 HydrophobicContact CG-CG1 4.25Å; M230-V256 HydrophobicContact SD-CG1 4.32Å; M230-R322 PolarHBondContact SD-NH2 3.46Å
231	V	87.4	Confident	84.5	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.024	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.2	170.3	167.5	0	0	0	0	109.2	I197 V223 M225 C233 V256 Y257	I197-V231 HydrophobicContact CD1-CB 4.22Å; I197-V231 HydrophobicContact CD1-CG2 3.65Å; I197-V231 HydrophobicContact CG1-CG2 4.32Å; V223-V231 HydrophobicContact CB-CG1 4.21Å; V223-V231 HydrophobicContact CB-CG2 4.29Å; V223-V231 HydrophobicContact CG1-CB 4.4Å; V223-V231 HydrophobicContact CG1-CG1 3.64Å; V223-V231 HydrophobicContact CG1-CG2 3.81Å; M225-V231 HydrophobicContact CG-CG2 4.39Å; V231-C233 HydrophobicContact CG1-CB 3.89Å; V231-V256 WeakPolarHBondContact O-CA 3.23Å; V231-Y257 HydrophobicContact CB-CE2 4.28Å; V231-Y257 HydrophobicContact CG1-CE2 4.19Å; V231-Y257 PolarHBondContact N-O 2.8Å; V231-Y257 PolarHBondContact O-N 3.44Å; V231-Y257 VanDerWaalsContact O-N 3.14Å
232	R	83.5	Confident	85	Confident	156 Å²	156	51.9 Å²	51.9	59%	0.589	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	108.3	175.4	-63.6	174.4	173.6	70.7	3.3	107.2	D228 V256	D228-R232 IonicContact OD1-NH1 2.73Å; D228-R232 PolarHBondContact OD1-NH1 2.89Å; D228-R232 IonicContact OD2-CZ 3.1Å; D228-R232 IonicContact OD2-NH1 2.7Å; D228-R232 PolarHBondContact OD2-NH1 3.42Å; D228-R232 IonicContact OD2-NH2 2.69Å; D228-R232 PolarHBondContact OD2-NH2 3.1Å; R232-V256 HydrophobicContact CG-CG1 4.16Å; R232-V256 HydrophobicContact CG-CG2 4.06Å
233	C	74.5	Confident	85.1	Confident	22 Å²	22	51.9 Å²	51.9	15%	0.149	31%	0.307	C	S	.	.			trans	-150.5	133.8	-170.8	-170.6	0	0	0	0	110.1	R199 V231 T235 G255	R199-C233 PolarHBondContact NH1-SG 2.94Å; V231-C233 HydrophobicContact CG1-CB 3.89Å; C233-T235 PolarHBondContact SG-OG1 2.77Å; C233-T235 VanDerWaalsContact SG-OG1 3.37Å; C233-G255 PolarHBondContact N-O 3.44Å
234	S	72.3	Confident	85.3	Confident	70 Å²	70	50.1 Å²	50.1	49%	0.49	30%	0.296	S	S	.	.	S	Bend	trans	-99.2	-11.9	-177.4	52.2	0	0	0	0	114	G252 S253	S234-G252 PolarHBondContact O-N 3.32Å; S234-S253 WeakPolarHBondContact CA-O 3.44Å; S234-S253 WeakPolarHBondContact CB-O 3.47Å
235	T	74.2	Confident	85.5	Confident	80 Å²	80	42.2 Å²	42.2	49%	0.491	27%	0.266	S	S	.	.	S	Bend	trans	-92.6	114.3	172.5	38.2	0	0	0	0	110.2	C233 V237	C233-T235 PolarHBondContact SG-OG1 2.77Å; C233-T235 VanDerWaalsContact SG-OG1 3.37Å; T235-V237 PolarHBondContact O-N 2.93Å
236	A	74.6	Confident	85.5	Confident	28 Å²	28	41.8 Å²	41.8	23%	0.231	26%	0.264	C	S	.	.			trans	-71.7	123.1	164.4	0	0	0	0	0	108.7	V247 Q251	A236-V247 HydrophobicContact CB-CG1 4.4Å; A236-Q251 HydrophobicContact CB-CB 3.82Å; A236-Q251 HydrophobicContact CB-CG 4.04Å
237	V	76	Confident	85.6	Confident	44 Å²	44	40.2 Å²	40.2	27%	0.267	25%	0.248	S	C	.	.			trans	-134.5	154.8	174.3	-58.5	0	0	0	0	108.6	R199 T221 T235 I243	R199-V237 VanDerWaalsContact NH2-CG2 3.26Å; T221-V237 HydrophobicContact CG2-CB 4.34Å; T221-V237 HydrophobicContact CG2-CG2 4.11Å; T235-V237 PolarHBondContact O-N 2.93Å; V237-I243 WeakPolarHBondContact O-CD1 3.31Å
238	G	74.8	Confident	85.8	Confident	22 Å²	22	35.2 Å²	35.2	23%	0.227	20%	0.204	C	C	.	.	S	Bend	trans	126.2	156.4	-172.7	0	0	0	0	0	111.2	D200	D200-G238 WeakPolarHBondContact OD1-CA 3.48Å
239	T	85.4	Confident	85.8	Confident	35 Å²	35	36.8 Å²	36.8	22%	0.215	20%	0.204	C	C	.	.			trans	-73.6	133	-176.8	-58.5	0	0	0	0	109.9	D200 K202 D241 Y242 I243	D200-T239 VanDerWaalsContact OD1-CB 3.29Å; D200-T239 WeakPolarHBondContact OD1-CB 3.35Å; D200-T239 PolarHBondContact OD1-N 3.34Å; D200-T239 PolarHBondContact OD1-OG1 3.26Å; K202-T239 HydrophobicContact CD-CG2 4.26Å; K202-T239 WeakPolarHBondContact CD-OG1 3.4Å; K202-T239 PolarHBondContact NZ-OG1 2.93Å; T239-D241 PolarHBondContact O-N 3.28Å; T239-Y242 HydrophobicContact CG2-CD2 3.92Å; T239-Y242 HydrophobicContact CG2-CE2 4.23Å; T239-Y242 PolarHBondContact O-N 2.71Å; T239-I243 PolarHBondContact O-N 3.07Å; T239-I243 VanDerWaalsContact O-N 3.12Å
240	P	89	Confident	85.4	Confident	31 Å²	31	35.5 Å²	35.5	20%	0.201	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.1	-163.7	-32.6	37.8	0	0	0	117.7	I243 L285 T288 Y289 I292	P240-I243 WeakPolarHBondContact O-CG2 3.26Å; P240-L285 HydrophobicContact CB-CD2 3.8Å; P240-L285 HydrophobicContact CG-CD2 3.66Å; P240-T288 WeakPolarHBondContact O-CG2 3.28Å; P240-Y289 HydrophobicContact CB-CE1 3.77Å; P240-Y289 HydrophobicContact CG-CE1 4.49Å; P240-I292 WeakPolarHBondContact O-CD1 3.48Å
241	D	94	Very high	84.7	Confident	31 Å²	31	39 Å²	39	17%	0.166	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-24.5	-177.7	-63.7	-101.8	0	0	0	113.4	T239 V268 T278	T239-D241 PolarHBondContact O-N 3.28Å; D241-V268 WeakPolarHBondContact O-CG1 3.28Å; D241-T278 HydrophobicContact CB-CG2 3.97Å; D241-T278 PolarHBondContact OD1-OG1 2.73Å; D241-T278 VanDerWaalsContact OD1-OG1 3.1Å
242	Y	96.4	Very high	83.5	Confident	18 Å²	18	42.3 Å²	42.3	7%	0.071	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-12.7	-177.1	-54.2	-92.4	0	0	0	113.4	V201 K202 P203 T239 S265 V268 E272	V201-Y242 WeakPolarHBondContact O-CB 3.47Å; K202-Y242 HydrophobicContact CB-CD1 4.16Å; K202-Y242 HydrophobicContact CB-CD2 3.83Å; K202-Y242 HydrophobicContact CB-CE1 4.32Å; K202-Y242 HydrophobicContact CB-CE2 3.96Å; K202-Y242 HydrophobicContact CB-CG 3.93Å; P203-Y242 VanDerWaalsContact CD-CZ 3.44Å; P203-Y242 VanDerWaalsContact CD-OH 3.25Å; P203-Y242 WeakPolarHBondContact CD-OH 3.23Å; P203-Y242 HydrophobicContact CG-CE1 4.21Å; T239-Y242 HydrophobicContact CG2-CD2 3.92Å; T239-Y242 HydrophobicContact CG2-CE2 4.23Å; T239-Y242 PolarHBondContact O-N 2.71Å; Y242-S265 WeakPolarHBondContact O-CB 3.18Å; Y242-S265 PolarHBondContact O-OG 2.8Å; Y242-V268 HydrophobicContact CD1-CB 3.94Å; Y242-V268 HydrophobicContact CD1-CG1 3.44Å; Y242-V268 VanDerWaalsContact CD1-CG1 3.44Å; Y242-V268 HydrophobicContact CE1-CG1 3.78Å; Y242-V268 HydrophobicContact CG-CG1 4.11Å; Y242-E272 WeakPolarHBondContact CE1-OE2 3.41Å; Y242-E272 PolarHBondContact OH-OE1 3.14Å; Y242-E272 PolarHBondContact OH-OE2 2.9Å
243	I	94	Very high	82.7	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.021	23%	0.234	C	C	.	.			trans	-67	137.9	-177.3	-164.4	167	0	0	0	112.2	V237 T239 P240 V247 L248 W264 Y289 I292	V237-I243 WeakPolarHBondContact O-CD1 3.31Å; T239-I243 PolarHBondContact O-N 3.07Å; T239-I243 VanDerWaalsContact O-N 3.12Å; P240-I243 WeakPolarHBondContact O-CG2 3.26Å; I243-V247 HydrophobicContact CD1-CB 4.44Å; I243-V247 HydrophobicContact CD1-CG1 3.91Å; I243-V247 HydrophobicContact CG1-CB 4.03Å; I243-V247 HydrophobicContact CG1-CG1 3.97Å; I243-L248 HydrophobicContact CD1-CD2 3.92Å; I243-L248 HydrophobicContact CD1-CG 4.32Å; I243-L248 HydrophobicContact CG1-CD2 4.41Å; I243-L248 HydrophobicContact CG1-CG 4.31Å; I243-L248 HydrophobicContact CG2-CD1 3.98Å; I243-L248 HydrophobicContact CG2-CD2 3.89Å; I243-L248 HydrophobicContact CG2-CG 3.87Å; I243-W264 PolarHBondContact O-NE1 2.88Å; I243-W264 VanDerWaalsContact O-NE1 3.16Å; I243-Y289 HydrophobicContact CG2-CE1 4.24Å; I243-I292 HydrophobicContact CG2-CD1 4.09Å
244	S	94.5	Very high	82.3	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.014	27%	0.268	C	S	.	.			trans	-79.4	153	-178.1	70	0	0	0	0	113.4	E246 V247 L248 C261	S244-E246 PolarHBondContact O-N 2.88Å; S244-V247 PolarHBondContact O-N 3.11Å; S244-V247 VanDerWaalsContact O-N 3.13Å; S244-V247 VanDerWaalsContact OG-CG2 3.31Å; S244-V247 WeakPolarHBondContact OG-CG2 3.28Å; S244-L248 PolarHBondContact O-N 2.68Å; S244-L248 VanDerWaalsContact O-N 3.12Å; S244-C261 VanDerWaalsContact OG-CB 3.29Å; S244-C261 WeakPolarHBondContact OG-CB 3.34Å
245	P	93.6	Very high	82.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.9	-35.4	179.2	-23.9	32.2	0	0	0	113.4	R249 W264 I292 M293	P245-R249 WeakPolarHBondContact O-CB 3.3Å; P245-R249 WeakPolarHBondContact O-CD 3.31Å; P245-R249 WeakPolarHBondContact O-CG 3.45Å; P245-R249 PolarHBondContact O-N 3.48Å; P245-W264 HydrophobicContact CG-CD2 4.48Å; P245-W264 HydrophobicContact CG-CE3 4.21Å; P245-W264 HydrophobicContact CG-CH2 3.58Å; P245-W264 HydrophobicContact CG-CZ2 3.89Å; P245-W264 HydrophobicContact CG-CZ3 3.75Å; P245-I292 HydrophobicContact CB-CG2 4.36Å; P245-I292 HydrophobicContact CG-CG2 3.81Å; P245-M293 HydrophobicContact CB-SD 4.39Å
246	E	91.8	Very high	82.9	Confident	11 Å²	11	41.9 Å²	41.9	5%	0.051	25%	0.245	C	C	.	.	H	α-helix	trans	-74.2	-28.8	179	63.5	-91.9	-148.4	0	0	114.7	S244 S250 C261 R322 R325	S244-E246 PolarHBondContact O-N 2.88Å; E246-S250 PolarHBondContact O-N 3.36Å; E246-S250 VanDerWaalsContact O-N 3.13Å; E246-C261 HydrophobicContact CG-CB 4.42Å; E246-R322 WeakPolarHBondContact OE1-CB 3.39Å; E246-R325 IonicContact OE1-CZ 2.73Å; E246-R325 IonicContact OE1-NH1 3.49Å; E246-R325 PolarHBondContact OE1-NH1 3.37Å; E246-R325 IonicContact OE1-NH2 2.81Å; E246-R325 PolarHBondContact OE1-NH2 3.01Å; E246-R325 IonicContact OE2-CZ 2.67Å; E246-R325 IonicContact OE2-NH1 3.94Å; E246-R325 IonicContact OE2-NH2 3.73Å; E246-R325 PolarHBondContact OE2-NH2 3.37Å
247	V	90.9	Very high	83.7	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-72.9	-41	172.5	178.6	0	0	0	0	109.2	A236 I243 S244 R249 S250 Y257 C261	A236-V247 HydrophobicContact CB-CG1 4.4Å; I243-V247 HydrophobicContact CD1-CB 4.44Å; I243-V247 HydrophobicContact CD1-CG1 3.91Å; I243-V247 HydrophobicContact CG1-CB 4.03Å; I243-V247 HydrophobicContact CG1-CG1 3.97Å; S244-V247 PolarHBondContact O-N 3.11Å; S244-V247 VanDerWaalsContact O-N 3.13Å; S244-V247 VanDerWaalsContact OG-CG2 3.31Å; S244-V247 WeakPolarHBondContact OG-CG2 3.28Å; V247-R249 PolarHBondContact O-N 3.33Å; V247-S250 WeakPolarHBondContact O-CB 3.42Å; V247-S250 PolarHBondContact O-N 3.22Å; V247-S250 VanDerWaalsContact O-N 3.1Å; V247-S250 PolarHBondContact O-OG 3.33Å; V247-Y257 HydrophobicContact CG2-CD1 4.17Å; V247-Y257 HydrophobicContact CG2-CD2 4.03Å; V247-Y257 HydrophobicContact CG2-CE1 4.03Å; V247-Y257 HydrophobicContact CG2-CE2 3.89Å; V247-Y257 HydrophobicContact CG2-CG 4.17Å; V247-C261 HydrophobicContact CG2-CB 4.01Å
248	L	89.4	Confident	84.5	Confident	18 Å²	18	38.5 Å²	38.5	9%	0.094	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-45.2	170.2	-70.4	175.9	0	0	0	112.1	I243 S244 S250 Q251 Y289 I292	I243-L248 HydrophobicContact CD1-CD2 3.92Å; I243-L248 HydrophobicContact CD1-CG 4.32Å; I243-L248 HydrophobicContact CG1-CD2 4.41Å; I243-L248 HydrophobicContact CG1-CG 4.31Å; I243-L248 HydrophobicContact CG2-CD1 3.98Å; I243-L248 HydrophobicContact CG2-CD2 3.89Å; I243-L248 HydrophobicContact CG2-CG 3.87Å; S244-L248 PolarHBondContact O-N 2.68Å; S244-L248 VanDerWaalsContact O-N 3.12Å; L248-S250 PolarHBondContact O-N 3.34Å; L248-Q251 WeakPolarHBondContact O-CB 3.4Å; L248-Q251 PolarHBondContact O-N 2.87Å; L248-Q251 VanDerWaalsContact O-N 3.15Å; L248-Y289 HydrophobicContact CD1-CD1 3.84Å; L248-Y289 HydrophobicContact CD1-CG 4.2Å; L248-Y289 HydrophobicContact CD2-CD1 3.72Å; L248-Y289 HydrophobicContact CD2-CD2 4.38Å; L248-Y289 HydrophobicContact CD2-CE1 3.7Å; L248-Y289 HydrophobicContact CD2-CE2 4.37Å; L248-Y289 HydrophobicContact CD2-CG 4.07Å; L248-Y289 HydrophobicContact CG-CD1 4.46Å; L248-I292 HydrophobicContact CD1-CB 4.18Å; L248-I292 HydrophobicContact CD1-CD1 4.42Å; L248-I292 HydrophobicContact CD1-CG2 3.72Å
249	R	87.2	Confident	85.4	Confident	111 Å²	111	40.8 Å²	40.8	42%	0.419	22%	0.223	S	C	.	.	H	α-helix	trans	-61.3	-21.2	175.4	-70.7	161.7	-168.5	174.8	0.9	113.5	P245 V247 M293 D321	P245-R249 WeakPolarHBondContact O-CB 3.3Å; P245-R249 WeakPolarHBondContact O-CD 3.31Å; P245-R249 WeakPolarHBondContact O-CG 3.45Å; P245-R249 PolarHBondContact O-N 3.48Å; V247-R249 PolarHBondContact O-N 3.33Å; R249-M293 HydrophobicContact CG-CE 3.8Å; R249-M293 HydrophobicContact CG-SD 3.85Å; R249-D321 IonicContact CZ-OD2 3.66Å; R249-D321 IonicContact NH1-OD2 3.84Å; R249-D321 PolarHBondContact NH1-OD2 2.86Å; R249-D321 IonicContact NH2-OD2 2.77Å
250	S	80.3	Confident	85.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-77.2	-17.2	177.2	76.3	0	0	0	0	114.2	E246 V247 L248 G252 S253	E246-S250 PolarHBondContact O-N 3.36Å; E246-S250 VanDerWaalsContact O-N 3.13Å; V247-S250 WeakPolarHBondContact O-CB 3.42Å; V247-S250 PolarHBondContact O-N 3.22Å; V247-S250 VanDerWaalsContact O-N 3.1Å; V247-S250 PolarHBondContact O-OG 3.33Å; L248-S250 PolarHBondContact O-N 3.34Å; S250-G252 PolarHBondContact O-N 3.05Å; S250-G252 VanDerWaalsContact O-N 3.09Å; S250-S253 PolarHBondContact O-N 3.02Å; S250-S253 VanDerWaalsContact O-N 3.08Å
251	Q	74.1	Confident	86.2	Confident	129 Å²	129	38.2 Å²	38.2	60%	0.603	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	115.8	-174.9	-165.1	176	4	0	0	111.6	A236 L248 S253	A236-Q251 HydrophobicContact CB-CB 3.82Å; A236-Q251 HydrophobicContact CB-CG 4.04Å; L248-Q251 WeakPolarHBondContact O-CB 3.4Å; L248-Q251 PolarHBondContact O-N 2.87Å; L248-Q251 VanDerWaalsContact O-N 3.15Å; Q251-S253 VanDerWaalsContact C-N 3.34Å; Q251-S253 PolarHBondContact O-N 2.92Å
252	G	64	Low	86.3	Confident	74 Å²	74	36.7 Å²	36.7	76%	0.763	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	13.2	178.3	0	0	0	0	0	115.6	S234 S250	S234-G252 PolarHBondContact O-N 3.32Å; S250-G252 PolarHBondContact O-N 3.05Å; S250-G252 VanDerWaalsContact O-N 3.09Å
253	S	65.1	Low	86.4	Confident	61 Å²	61	35.9 Å²	35.9	43%	0.427	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137	171	171.8	68	0	0	0	0	111.4	S234 S250 Q251 G255	S234-S253 WeakPolarHBondContact CA-O 3.44Å; S234-S253 WeakPolarHBondContact CB-O 3.47Å; S250-S253 PolarHBondContact O-N 3.02Å; S250-S253 VanDerWaalsContact O-N 3.08Å; Q251-S253 VanDerWaalsContact C-N 3.34Å; Q251-S253 PolarHBondContact O-N 2.92Å; S253-G255 PolarHBondContact O-N 3.23Å
254	E	67.4	Low	86.6	Confident	187 Å²	187	35.7 Å²	35.7	87%	0.874	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	64.8	170.8	-68.9	-164.1	160.4	0	0	110.9
255	G	70.7	Confident	86.8	Confident	12 Å²	12	35.7 Å²	35.7	12%	0.124	19%	0.194	C	C	.	.			trans	-66.1	140.1	175.2	0	0	0	0	0	111.9	C233 S253	C233-G255 PolarHBondContact N-O 3.44Å; S253-G255 PolarHBondContact O-N 3.23Å
256	V	87.2	Confident	87	Confident	59 Å²	59	35.7 Å²	35.7	36%	0.358	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.1	-178.3	-168.6	0	0	0	0	109.6	M230 V231 R232 R322	M230-V256 HydrophobicContact CB-CG1 3.82Å; M230-V256 HydrophobicContact CG-CG1 4.25Å; M230-V256 HydrophobicContact SD-CG1 4.32Å; V231-V256 WeakPolarHBondContact O-CA 3.23Å; R232-V256 HydrophobicContact CG-CG1 4.16Å; R232-V256 HydrophobicContact CG-CG2 4.06Å; V256-R322 PolarHBondContact O-NH1 2.83Å
257	Y	91.4	Very high	87.3	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	153.9	179.8	51.2	-96.2	0	0	0	111.8	R199 V231 V247	R199-Y257 WeakPolarHBondContact CD-OH 3.5Å; R199-Y257 HydrophobicContact CG-CE2 4.33Å; R199-Y257 PolarHBondContact NH1-OH 3.29Å; V231-Y257 HydrophobicContact CB-CE2 4.28Å; V231-Y257 HydrophobicContact CG1-CE2 4.19Å; V231-Y257 PolarHBondContact N-O 2.8Å; V231-Y257 PolarHBondContact O-N 3.44Å; V231-Y257 VanDerWaalsContact O-N 3.14Å; V247-Y257 HydrophobicContact CG2-CD1 4.17Å; V247-Y257 HydrophobicContact CG2-CD2 4.03Å; V247-Y257 HydrophobicContact CG2-CE1 4.03Å; V247-Y257 HydrophobicContact CG2-CE2 3.89Å; V247-Y257 HydrophobicContact CG2-CG 4.17Å
258	G	92.8	Very high	87.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-172.7	178.6	0	0	0	0	0	111.7	I197 E260 C261	I197-G258 VanDerWaalsContact CD1-C 3.44Å; G258-E260 WeakPolarHBondContact CA-OE2 3.34Å; G258-E260 PolarHBondContact N-OE1 2.71Å; G258-E260 PolarHBondContact O-N 3.23Å; G258-C261 PolarHBondContact O-N 3.42Å; G258-C261 PolarHBondContact O-SG 3.16Å
259	R	95	Very high	88	Confident	70 Å²	70	34.2 Å²	34.2	26%	0.264	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-19.4	-177.9	71.3	179.2	63.6	-163.3	-5.6	114.7	H192 I197 M225 C261 D262	H192-R259 PolarHBondContact O-NH2 3.36Å; I197-R259 HydrophobicContact CG1-CB 4.38Å; M225-R259 HydrophobicContact SD-CB 4.35Å; R259-C261 PolarHBondContact O-N 2.87Å; R259-C261 VanDerWaalsContact O-N 3.16Å; R259-D262 PolarHBondContact O-N 3.41Å; R259-D262 VanDerWaalsContact O-N 3.14Å
260	E	95	Very high	88.5	Confident	10 Å²	10	29 Å²	29	5%	0.047	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-14.3	-179.7	70.4	-76.7	179.4	0	0	114.4	G258 D262 W263 W264 R322 R325	G258-E260 WeakPolarHBondContact CA-OE2 3.34Å; G258-E260 PolarHBondContact N-OE1 2.71Å; G258-E260 PolarHBondContact O-N 3.23Å; E260-D262 VanDerWaalsContact C-N 3.31Å; E260-W263 PolarHBondContact O-N 2.83Å; E260-W264 PolarHBondContact O-N 3.48Å; E260-R322 HydrophobicContact CG-CB 3.79Å; E260-R322 IonicContact OE1-CZ 2.62Å; E260-R322 IonicContact OE1-NE 3.85Å; E260-R322 PolarHBondContact OE1-NE 2.96Å; E260-R322 IonicContact OE1-NH2 2.82Å; E260-R322 PolarHBondContact OE1-NH2 2.97Å; E260-R325 WeakPolarHBondContact O-CD 3.27Å; E260-R325 PolarHBondContact O-NH1 3.38Å
261	C	94.9	Very high	89.3	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-67	-29.3	171.7	63.9	0	0	0	0	113.2	I197 S244 E246 V247 G258 R259 W264	I197-C261 WeakPolarHBondContact CG2-SG 3.49Å; S244-C261 VanDerWaalsContact OG-CB 3.29Å; S244-C261 WeakPolarHBondContact OG-CB 3.34Å; E246-C261 HydrophobicContact CG-CB 4.42Å; V247-C261 HydrophobicContact CG2-CB 4.01Å; G258-C261 PolarHBondContact O-N 3.42Å; G258-C261 PolarHBondContact O-SG 3.16Å; R259-C261 PolarHBondContact O-N 2.87Å; R259-C261 VanDerWaalsContact O-N 3.16Å; C261-W264 WeakPolarHBondContact O-CB 3.25Å; C261-W264 PolarHBondContact O-N 2.89Å
262	D	97.3	Very high	90.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-73	-34.1	177.2	-64.7	-18.2	0	0	0	111	L188 H192 I197 H198 R199 V201 R259 E260 W264 S265 V266	L188-D262 HydrophobicContact CD1-CB 4.28Å; L188-D262 HydrophobicContact CD2-CB 4.3Å; H192-D262 IonicContact CD2-OD2 3.94Å; H192-D262 IonicContact CE1-OD2 3.57Å; H192-D262 IonicContact NE2-OD2 2.99Å; H192-D262 PolarHBondContact NE2-OD2 2.93Å; I197-D262 WeakPolarHBondContact CG2-OD1 3.27Å; I197-D262 WeakPolarHBondContact CG2-OD2 3.24Å; H198-D262 PolarHBondContact N-OD1 3.41Å; H198-D262 PolarHBondContact N-OD2 3.43Å; R199-D262 PolarHBondContact N-OD1 2.88Å; V201-D262 HydrophobicContact CG2-CB 4.04Å; R259-D262 PolarHBondContact O-N 3.41Å; R259-D262 VanDerWaalsContact O-N 3.14Å; E260-D262 VanDerWaalsContact C-N 3.31Å; D262-W264 VanDerWaalsContact C-N 3.26Å; D262-W264 PolarHBondContact O-N 3.23Å; D262-S265 WeakPolarHBondContact O-CB 3.3Å; D262-S265 PolarHBondContact O-N 3.1Å; D262-S265 VanDerWaalsContact O-N 3.14Å; D262-V266 PolarHBondContact O-N 3.48Å; D262-V266 VanDerWaalsContact O-N 3.12Å
263	W	98.1	Very high	91.9	Very high	1 Å²	1	21.8 Å²	21.8	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-67.1	-24.9	176.5	-55.5	139.9	0	0	0	113.4	V185 L188 H192 E260 V266 G267 F318 G327 V331 I334	V185-W263 HydrophobicContact CB-CZ3 4.41Å; V185-W263 HydrophobicContact CG1-CH2 4.42Å; V185-W263 HydrophobicContact CG1-CZ3 4.33Å; V185-W263 HydrophobicContact CG2-CZ3 4.14Å; L188-W263 HydrophobicContact CB-CH2 3.77Å; L188-W263 HydrophobicContact CB-CZ3 3.69Å; L188-W263 HydrophobicContact CD1-CE3 4Å; L188-W263 HydrophobicContact CD1-CZ3 3.68Å; L188-W263 HydrophobicContact CG-CZ3 4.35Å; H192-W263 AromaticContact CE1-CE2 3.79Å; H192-W263 AromaticContact CE1-CZ2 3.58Å; H192-W263 AromaticContact ND1-CZ2 3.49Å; H192-W263 WeakPolarHBondContact ND1-CZ2 3.47Å; E260-W263 PolarHBondContact O-N 2.83Å; W263-V266 HydrophobicContact CE3-CG2 4.08Å; W263-G267 PolarHBondContact O-N 2.77Å; W263-F318 HydrophobicContact CB-CD1 3.91Å; W263-F318 HydrophobicContact CB-CE1 3.97Å; W263-F318 WeakPolarHBondContact O-CB 3.29Å; W263-F318 WeakPolarHBondContact O-CD1 3.36Å; W263-F318 WeakPolarHBondContact O-CG 3.35Å; W263-G327 VanDerWaalsContact CD1-CA 3.46Å; W263-G327 PolarHBondContact NE1-O 3.03Å; W263-G327 VanDerWaalsContact NE1-O 3.13Å; W263-V331 HydrophobicContact CH2-CG2 4.17Å; W263-V331 HydrophobicContact CZ2-CG2 4.37Å; W263-I334 HydrophobicContact CD2-CD1 3.49Å; W263-I334 VanDerWaalsContact CD2-CD1 3.49Å; W263-I334 HydrophobicContact CE3-CD1 3.65Å; W263-I334 HydrophobicContact CG-CD1 4Å; W263-I334 HydrophobicContact CH2-CD1 4.08Å; W263-I334 HydrophobicContact CZ2-CD1 3.92Å; W263-I334 HydrophobicContact CZ3-CD1 3.94Å
264	W	97.9	Very high	93.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.5	-50	168.7	169.6	-85.9	0	0	0	110.8	I243 P245 E260 C261 D262 V266 G267 V268 F280 I292 H295 L319	I243-W264 PolarHBondContact O-NE1 2.88Å; I243-W264 VanDerWaalsContact O-NE1 3.16Å; P245-W264 HydrophobicContact CG-CD2 4.48Å; P245-W264 HydrophobicContact CG-CE3 4.21Å; P245-W264 HydrophobicContact CG-CH2 3.58Å; P245-W264 HydrophobicContact CG-CZ2 3.89Å; P245-W264 HydrophobicContact CG-CZ3 3.75Å; E260-W264 PolarHBondContact O-N 3.48Å; C261-W264 WeakPolarHBondContact O-CB 3.25Å; C261-W264 PolarHBondContact O-N 2.89Å; D262-W264 VanDerWaalsContact C-N 3.26Å; D262-W264 PolarHBondContact O-N 3.23Å; W264-V266 VanDerWaalsContact C-N 3.28Å; W264-V266 PolarHBondContact O-N 3.49Å; W264-G267 CarbonylContact O-C 3.47Å; W264-G267 VanDerWaalsContact O-CA 3.31Å; W264-G267 WeakPolarHBondContact O-CA 3.42Å; W264-G267 PolarHBondContact O-N 3.4Å; W264-V268 PolarHBondContact O-N 2.78Å; W264-F280 AromaticContact CH2-CE2 3.85Å; W264-F280 HydrophobicContact CH2-CE2 3.85Å; W264-F280 AromaticContact CH2-CZ 3.86Å; W264-F280 HydrophobicContact CH2-CZ 3.86Å; W264-F280 HydrophobicContact CZ2-CD2 4.05Å; W264-F280 AromaticContact CZ2-CE2 3.3Å; W264-F280 HydrophobicContact CZ2-CE2 3.3Å; W264-F280 AromaticContact CZ2-CZ 3.81Å; W264-F280 HydrophobicContact CZ2-CZ 3.81Å; W264-I292 HydrophobicContact CZ2-CG2 3.91Å; W264-H295 HydrophobicContact CH2-CB 3.65Å; W264-H295 AromaticContact CH2-CG 3.67Å; W264-H295 AromaticContact CH2-ND1 3.88Å; W264-H295 HydrophobicContact CZ3-CB 4.41Å; W264-L319 HydrophobicContact CD2-CD2 3.85Å; W264-L319 HydrophobicContact CE3-CD2 4.04Å; W264-L319 HydrophobicContact CG-CD2 4.34Å; W264-L319 HydrophobicContact CH2-CD2 4.37Å; W264-L319 HydrophobicContact CZ2-CD2 4.19Å; W264-L319 VanDerWaalsContact CZ3-C 3.44Å; W264-L319 HydrophobicContact CZ3-CB 4.25Å; W264-L319 HydrophobicContact CZ3-CD2 4.32Å; W264-L319 WeakPolarHBondContact O-CD2 3.28Å
265	S	97.7	Very high	94.6	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-64.4	-32.4	-178.4	-50.1	0	0	0	0	112.3	V201 Y242 D262 G267 V268 F269	V201-S265 WeakPolarHBondContact O-CB 3.32Å; Y242-S265 WeakPolarHBondContact O-CB 3.18Å; Y242-S265 PolarHBondContact O-OG 2.8Å; D262-S265 WeakPolarHBondContact O-CB 3.3Å; D262-S265 PolarHBondContact O-N 3.1Å; D262-S265 VanDerWaalsContact O-N 3.14Å; S265-G267 VanDerWaalsContact C-N 3.3Å; S265-G267 PolarHBondContact O-N 2.76Å; S265-V268 WeakPolarHBondContact O-CB 3.28Å; S265-V268 PolarHBondContact O-N 3.26Å; S265-F269 WeakPolarHBondContact O-CB 3.43Å; S265-F269 PolarHBondContact O-N 3.47Å
266	V	98.2	Very high	95.7	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.3	-37.7	168.1	177.2	0	0	0	0	111.9	T181 V184 V185 L188 D262 W263 W264 L270 F318	T181-V266 HydrophobicContact CG2-CG1 3.76Å; V184-V266 HydrophobicContact CG1-CG2 4.01Å; V185-V266 HydrophobicContact CG2-CG1 4.23Å; L188-V266 HydrophobicContact CD1-CG2 3.38Å; D262-V266 PolarHBondContact O-N 3.48Å; D262-V266 VanDerWaalsContact O-N 3.12Å; W263-V266 HydrophobicContact CE3-CG2 4.08Å; W264-V266 VanDerWaalsContact C-N 3.28Å; W264-V266 PolarHBondContact O-N 3.49Å; V266-L270 WeakPolarHBondContact O-CB 3.47Å; V266-L270 PolarHBondContact O-N 2.8Å; V266-F318 HydrophobicContact CG1-CE2 3.96Å; V266-F318 HydrophobicContact CG1-CZ 4.11Å
267	G	97.8	Very high	95.9	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.8	-35.7	172.5	0	0	0	0	0	113.9	W263 W264 S265 Y271	W263-G267 PolarHBondContact O-N 2.77Å; W264-G267 CarbonylContact O-C 3.47Å; W264-G267 VanDerWaalsContact O-CA 3.31Å; W264-G267 WeakPolarHBondContact O-CA 3.42Å; W264-G267 PolarHBondContact O-N 3.4Å; S265-G267 VanDerWaalsContact C-N 3.3Å; S265-G267 PolarHBondContact O-N 2.76Å; G267-Y271 WeakPolarHBondContact O-CB 3.49Å; G267-Y271 PolarHBondContact O-N 3.01Å; G267-Y271 VanDerWaalsContact O-N 3.08Å
268	V	98	Very high	96.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.4	-50.9	173.9	179.3	0	0	0	0	110	D241 Y242 W264 S265 L270 Y271 E272 P279 F280 L319	D241-V268 WeakPolarHBondContact O-CG1 3.28Å; Y242-V268 HydrophobicContact CD1-CB 3.94Å; Y242-V268 HydrophobicContact CD1-CG1 3.44Å; Y242-V268 VanDerWaalsContact CD1-CG1 3.44Å; Y242-V268 HydrophobicContact CE1-CG1 3.78Å; Y242-V268 HydrophobicContact CG-CG1 4.11Å; W264-V268 PolarHBondContact O-N 2.78Å; S265-V268 WeakPolarHBondContact O-CB 3.28Å; S265-V268 PolarHBondContact O-N 3.26Å; V268-L270 PolarHBondContact O-N 2.99Å; V268-Y271 PolarHBondContact O-N 2.91Å; V268-E272 WeakPolarHBondContact O-CB 3.49Å; V268-E272 PolarHBondContact O-N 2.85Å; V268-P279 HydrophobicContact CB-CG 4.44Å; V268-P279 HydrophobicContact CG1-CG 4.15Å; V268-P279 HydrophobicContact CG2-CG 4.36Å; V268-F280 HydrophobicContact CG2-CE2 4.49Å; V268-L319 HydrophobicContact CG2-CD2 3.73Å
269	F	97.6	Very high	96.3	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.6	-43.5	177.1	162.2	-124.6	0	0	0	113.2	L163 V184 P203 M206 S265 E272 M273	L163-F269 HydrophobicContact CD1-CE2 3.75Å; L163-F269 HydrophobicContact CD1-CZ 3.53Å; V184-F269 HydrophobicContact CB-CE1 4.27Å; V184-F269 HydrophobicContact CG1-CE1 4.49Å; V184-F269 HydrophobicContact CG2-CE1 3.86Å; V184-F269 HydrophobicContact CG2-CZ 4.37Å; P203-F269 HydrophobicContact CG-CD2 4.1Å; M206-F269 HydrophobicContact CE-CD1 4.01Å; M206-F269 HydrophobicContact CE-CE1 4.29Å; M206-F269 HydrophobicContact CE-CG 4.15Å; M206-F269 HydrophobicContact SD-CD1 4.14Å; M206-F269 HydrophobicContact SD-CD2 4.14Å; M206-F269 HydrophobicContact SD-CE1 3.91Å; M206-F269 HydrophobicContact SD-CE2 3.91Å; M206-F269 HydrophobicContact SD-CG 4.24Å; M206-F269 HydrophobicContact SD-CZ 3.78Å; S265-F269 WeakPolarHBondContact O-CB 3.43Å; S265-F269 PolarHBondContact O-N 3.47Å; F269-E272 PolarHBondContact O-N 3.44Å; F269-M273 HydrophobicContact CD1-CE 4.05Å; F269-M273 HydrophobicContact CD2-CE 4.1Å; F269-M273 HydrophobicContact CD2-CG 4.06Å; F269-M273 HydrophobicContact CD2-SD 4.33Å; F269-M273 HydrophobicContact CE1-CE 3.54Å; F269-M273 HydrophobicContact CE1-SD 4.34Å; F269-M273 HydrophobicContact CE2-CE 3.6Å; F269-M273 HydrophobicContact CE2-CG 3.65Å; F269-M273 HydrophobicContact CE2-SD 3.47Å; F269-M273 WeakPolarHBondContact CE2-SD 3.38Å; F269-M273 HydrophobicContact CG-CE 4.31Å; F269-M273 HydrophobicContact CZ-CE 3.29Å; F269-M273 HydrophobicContact CZ-CG 4.27Å; F269-M273 HydrophobicContact CZ-SD 3.48Å; F269-M273 WeakPolarHBondContact CZ-SD 3.18Å; F269-M273 PolarHBondContact O-N 3Å
270	L	97.9	Very high	96.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-70.8	-31.7	177.3	177.5	58.3	0	0	0	112.7	A177 T181 V266 V268 M273 L274 I314 I315 F339	A177-L270 HydrophobicContact CB-CD1 3.91Å; T181-L270 HydrophobicContact CG2-CD2 4.37Å; V266-L270 WeakPolarHBondContact O-CB 3.47Å; V266-L270 PolarHBondContact O-N 2.8Å; V268-L270 PolarHBondContact O-N 2.99Å; L270-M273 HydrophobicContact CD1-CE 4.1Å; L270-L274 HydrophobicContact CD1-CD1 3.82Å; L270-L274 HydrophobicContact CD1-CG 4.2Å; L270-L274 HydrophobicContact CG-CD1 4.32Å; L270-L274 VanDerWaalsContact O-CG 3.28Å; L270-L274 WeakPolarHBondContact O-CG 3.31Å; L270-I314 HydrophobicContact CD2-CG2 3.5Å; L270-I315 HydrophobicContact CB-CG1 4.37Å; L270-I315 HydrophobicContact CD2-CG1 4.05Å; L270-I315 HydrophobicContact CG-CD1 4.17Å; L270-I315 HydrophobicContact CG-CG1 3.93Å; L270-F339 HydrophobicContact CD1-CE1 4.1Å; L270-F339 HydrophobicContact CD1-CZ 3.68Å; L270-F339 HydrophobicContact CD2-CD1 4.29Å; L270-F339 HydrophobicContact CD2-CE1 3.75Å; L270-F339 HydrophobicContact CD2-CZ 3.98Å; L270-F339 HydrophobicContact CG-CZ 4.48Å
271	Y	97.6	Very high	96.3	Very high	14 Å²	14	20.6 Å²	20.6	6%	0.055	11%	0.114	C	C	.	.	H	α-helix	trans	-64.9	-48.9	169.7	178.8	-74.7	0	0	0	110.3	G267 V268 L274 V275 E277 P279 L299 T300 F301 I315	G267-Y271 WeakPolarHBondContact O-CB 3.49Å; G267-Y271 PolarHBondContact O-N 3.01Å; G267-Y271 VanDerWaalsContact O-N 3.08Å; V268-Y271 PolarHBondContact O-N 2.91Å; Y271-L274 CarbonylContact O-C 3.57Å; Y271-L274 PolarHBondContact O-N 3.37Å; Y271-V275 HydrophobicContact CD1-CB 3.95Å; Y271-V275 HydrophobicContact CD1-CG1 4.44Å; Y271-V275 HydrophobicContact CD1-CG2 3.96Å; Y271-V275 HydrophobicContact CD2-CG2 4.31Å; Y271-V275 HydrophobicContact CE1-CB 3.62Å; Y271-V275 HydrophobicContact CE1-CG1 3.63Å; Y271-V275 HydrophobicContact CE1-CG2 3.72Å; Y271-V275 HydrophobicContact CE2-CG2 4.08Å; Y271-V275 HydrophobicContact CG-CG2 4.26Å; Y271-V275 WeakPolarHBondContact O-CB 3.37Å; Y271-V275 WeakPolarHBondContact O-CG2 3.09Å; Y271-V275 PolarHBondContact O-N 3.31Å; Y271-E277 VanDerWaalsContact CD1-O 3.25Å; Y271-E277 WeakPolarHBondContact CD1-O 3.11Å; Y271-E277 VanDerWaalsContact CE1-O 3.24Å; Y271-E277 WeakPolarHBondContact CE1-O 3.44Å; Y271-P279 HydrophobicContact CD1-CB 3.73Å; Y271-P279 VanDerWaalsContact CD1-CD 3.41Å; Y271-P279 HydrophobicContact CD1-CG 3.98Å; Y271-P279 HydrophobicContact CD2-CB 3.86Å; Y271-P279 HydrophobicContact CD2-CG 4.49Å; Y271-P279 HydrophobicContact CE1-CB 3.85Å; Y271-P279 HydrophobicContact CE2-CB 3.97Å; Y271-P279 HydrophobicContact CG-CB 3.74Å; Y271-P279 HydrophobicContact CG-CG 3.96Å; Y271-L299 HydrophobicContact CD2-CD1 4.17Å; Y271-L299 HydrophobicContact CE2-CD1 4.09Å; Y271-T300 PolarHBondContact OH-O 3.5Å; Y271-F301 AromaticContact CD2-CD1 3.96Å; Y271-F301 HydrophobicContact CD2-CD1 3.96Å; Y271-F301 AromaticContact CD2-CE1 3.71Å; Y271-F301 HydrophobicContact CD2-CE1 3.71Å; Y271-F301 AromaticContact CE2-CD1 3.73Å; Y271-F301 HydrophobicContact CE2-CD1 3.73Å; Y271-F301 AromaticContact CE2-CE1 3.92Å; Y271-F301 HydrophobicContact CE2-CE1 3.92Å; Y271-F301 HydrophobicContact CE2-CG 4.41Å; Y271-I315 HydrophobicContact CD2-CG2 4.18Å
272	E	96.6	Very high	96.2	Very high	29 Å²	29	21.4 Å²	21.4	14%	0.136	12%	0.121	C	C	.	.	H	α-helix	trans	-59.5	-48	-177.6	-177.8	179.1	-141	0	0	112.5	M167 P203 Y242 V268 F269 L274 V275 G276 T278	M167-E272 HydrophobicContact CE-CG 4.11Å; M167-E272 HydrophobicContact SD-CG 4.2Å; P203-E272 WeakPolarHBondContact CG-OE2 3.46Å; Y242-E272 WeakPolarHBondContact CE1-OE2 3.41Å; Y242-E272 PolarHBondContact OH-OE1 3.14Å; Y242-E272 PolarHBondContact OH-OE2 2.9Å; V268-E272 WeakPolarHBondContact O-CB 3.49Å; V268-E272 PolarHBondContact O-N 2.85Å; F269-E272 PolarHBondContact O-N 3.44Å; E272-L274 PolarHBondContact O-N 3.49Å; E272-L274 VanDerWaalsContact O-N 3.14Å; E272-V275 PolarHBondContact O-N 2.89Å; E272-G276 WeakPolarHBondContact O-CA 3.49Å; E272-G276 PolarHBondContact O-N 2.75Å; E272-T278 HydrophobicContact CG-CG2 4.49Å; E272-T278 WeakPolarHBondContact OE1-CG2 3.4Å
273	M	95.7	Very high	95.8	Very high	9 Å²	9	28.8 Å²	28.8	4%	0.044	16%	0.16	C	C	.	.	H	α-helix	trans	-55.7	-30.8	173.9	-81.8	-167.1	-64.9	0	0	113.5	M167 V172 A177 T181 F269 L270	M167-M273 HydrophobicContact CG-CG 4.23Å; M167-M273 HydrophobicContact SD-CB 4.27Å; M167-M273 HydrophobicContact SD-CG 3.5Å; M167-M273 WeakPolarHBondContact SD-CG 3.47Å; V172-M273 HydrophobicContact CG1-CB 4.43Å; V172-M273 HydrophobicContact CG1-SD 4.35Å; A177-M273 HydrophobicContact CB-CB 4.15Å; A177-M273 HydrophobicContact CB-CE 3.84Å; A177-M273 HydrophobicContact CB-SD 4.09Å; T181-M273 VanDerWaalsContact OG1-CE 3.27Å; T181-M273 WeakPolarHBondContact OG1-CE 3.5Å; F269-M273 HydrophobicContact CD1-CE 4.05Å; F269-M273 HydrophobicContact CD2-CE 4.1Å; F269-M273 HydrophobicContact CD2-CG 4.06Å; F269-M273 HydrophobicContact CD2-SD 4.33Å; F269-M273 HydrophobicContact CE1-CE 3.54Å; F269-M273 HydrophobicContact CE1-SD 4.34Å; F269-M273 HydrophobicContact CE2-CE 3.6Å; F269-M273 HydrophobicContact CE2-CG 3.65Å; F269-M273 HydrophobicContact CE2-SD 3.47Å; F269-M273 WeakPolarHBondContact CE2-SD 3.38Å; F269-M273 HydrophobicContact CG-CE 4.31Å; F269-M273 HydrophobicContact CZ-CE 3.29Å; F269-M273 HydrophobicContact CZ-CG 4.27Å; F269-M273 HydrophobicContact CZ-SD 3.48Å; F269-M273 WeakPolarHBondContact CZ-SD 3.18Å; F269-M273 PolarHBondContact O-N 3Å; L270-M273 HydrophobicContact CD1-CE 4.1Å
274	L	95.5	Very high	95.5	Very high	21 Å²	21	31.8 Å²	31.8	11%	0.11	18%	0.181	C	C	.	.	H	α-helix	trans	-96.5	-17.5	-175.3	-63.9	178.9	0	0	0	113.7	E174 A177 L270 Y271 E272 V305 I307 A311 I315	E174-L274 HydrophobicContact CB-CD2 4.1Å; E174-L274 HydrophobicContact CG-CD2 4.3Å; A177-L274 HydrophobicContact CB-CD2 3.65Å; A177-L274 HydrophobicContact CB-CG 4.21Å; L270-L274 HydrophobicContact CD1-CD1 3.82Å; L270-L274 HydrophobicContact CD1-CG 4.2Å; L270-L274 HydrophobicContact CG-CD1 4.32Å; L270-L274 VanDerWaalsContact O-CG 3.28Å; L270-L274 WeakPolarHBondContact O-CG 3.31Å; Y271-L274 CarbonylContact O-C 3.57Å; Y271-L274 PolarHBondContact O-N 3.37Å; E272-L274 PolarHBondContact O-N 3.49Å; E272-L274 VanDerWaalsContact O-N 3.14Å; L274-V305 WeakPolarHBondContact O-CG1 3.44Å; L274-I307 HydrophobicContact CB-CD1 4.18Å; L274-I307 HydrophobicContact CB-CG1 4.29Å; L274-I307 HydrophobicContact CD1-CG2 4.08Å; L274-A311 HydrophobicContact CD1-CB 3.93Å; L274-I315 HydrophobicContact CD1-CD1 4.21Å
275	V	94.3	Very high	95.1	Very high	29 Å²	29	36.6 Å²	36.6	18%	0.176	21%	0.207	C	C	.	.	H	α-helix	trans	-118	-25.1	-173.5	177.2	0	0	0	0	113.1	Y271 E272 P302 I307	Y271-V275 HydrophobicContact CD1-CB 3.95Å; Y271-V275 HydrophobicContact CD1-CG1 4.44Å; Y271-V275 HydrophobicContact CD1-CG2 3.96Å; Y271-V275 HydrophobicContact CD2-CG2 4.31Å; Y271-V275 HydrophobicContact CE1-CB 3.62Å; Y271-V275 HydrophobicContact CE1-CG1 3.63Å; Y271-V275 HydrophobicContact CE1-CG2 3.72Å; Y271-V275 HydrophobicContact CE2-CG2 4.08Å; Y271-V275 HydrophobicContact CG-CG2 4.26Å; Y271-V275 WeakPolarHBondContact O-CB 3.37Å; Y271-V275 WeakPolarHBondContact O-CG2 3.09Å; Y271-V275 PolarHBondContact O-N 3.31Å; E272-V275 PolarHBondContact O-N 2.89Å; V275-P302 HydrophobicContact CG1-CG 3.96Å; V275-I307 HydrophobicContact CG2-CD1 3.62Å
276	G	92.3	Very high	94.7	Very high	65 Å²	65	42 Å²	42	67%	0.67	24%	0.239	S	C	*	.	S	Bend	trans	87.1	-6.8	-176.5	0	0	0	0	0	115.4	E272	E272-G276 WeakPolarHBondContact O-CA 3.49Å; E272-G276 PolarHBondContact O-N 2.75Å
277	E	93	Very high	94.5	Very high	126 Å²	126	43.8 Å²	43.8	59%	0.589	25%	0.254	S	S	*	.	S	Bend	trans	-136.3	158.1	174.7	-67	-168.7	161.2	0	0	110.9	Y271	Y271-E277 VanDerWaalsContact CD1-O 3.25Å; Y271-E277 WeakPolarHBondContact CD1-O 3.11Å; Y271-E277 VanDerWaalsContact CE1-O 3.24Å; Y271-E277 WeakPolarHBondContact CE1-O 3.44Å
278	T	95.5	Very high	94.2	Very high	16 Å²	16	44 Å²	44	10%	0.098	26%	0.255	C	S	.	.			trans	-72.4	142.7	175.2	76.2	0	0	0	0	111.2	D241 E272 F280 Y281	D241-T278 HydrophobicContact CB-CG2 3.97Å; D241-T278 PolarHBondContact OD1-OG1 2.73Å; D241-T278 VanDerWaalsContact OD1-OG1 3.1Å; E272-T278 HydrophobicContact CG-CG2 4.49Å; E272-T278 WeakPolarHBondContact OE1-CG2 3.4Å; T278-F280 PolarHBondContact O-N 2.79Å; T278-Y281 PolarHBondContact O-N 2.89Å; T278-Y281 WeakPolarHBondContact OG1-CB 3.26Å; T278-Y281 PolarHBondContact OG1-N 3.42Å
279	P	96.3	Very high	94	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.039	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.3	-175.2	21.9	-32	0	0	0	114.4	V268 Y271 L299 L319	V268-P279 HydrophobicContact CB-CG 4.44Å; V268-P279 HydrophobicContact CG1-CG 4.15Å; V268-P279 HydrophobicContact CG2-CG 4.36Å; Y271-P279 HydrophobicContact CD1-CB 3.73Å; Y271-P279 VanDerWaalsContact CD1-CD 3.41Å; Y271-P279 HydrophobicContact CD1-CG 3.98Å; Y271-P279 HydrophobicContact CD2-CB 3.86Å; Y271-P279 HydrophobicContact CD2-CG 4.49Å; Y271-P279 HydrophobicContact CE1-CB 3.85Å; Y271-P279 HydrophobicContact CE2-CB 3.97Å; Y271-P279 HydrophobicContact CG-CB 3.74Å; Y271-P279 HydrophobicContact CG-CG 3.96Å; P279-L299 HydrophobicContact CB-CD1 3.71Å; P279-L319 HydrophobicContact CB-CD1 4.15Å; P279-L319 HydrophobicContact CG-CD1 3.87Å
280	F	96.6	Very high	93.8	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	11.5	-176.3	-52.5	-62	0	0	0	113.8	W264 V268 T278 K291 I292 H295 L299 L319	W264-F280 AromaticContact CH2-CE2 3.85Å; W264-F280 HydrophobicContact CH2-CE2 3.85Å; W264-F280 AromaticContact CH2-CZ 3.86Å; W264-F280 HydrophobicContact CH2-CZ 3.86Å; W264-F280 HydrophobicContact CZ2-CD2 4.05Å; W264-F280 AromaticContact CZ2-CE2 3.3Å; W264-F280 HydrophobicContact CZ2-CE2 3.3Å; W264-F280 AromaticContact CZ2-CZ 3.81Å; W264-F280 HydrophobicContact CZ2-CZ 3.81Å; V268-F280 HydrophobicContact CG2-CE2 4.49Å; T278-F280 PolarHBondContact O-N 2.79Å; F280-K291 HydrophobicContact CB-CB 3.95Å; F280-K291 HydrophobicContact CD1-CB 4.16Å; F280-K291 HydrophobicContact CG-CB 4.49Å; F280-K291 WeakPolarHBondContact O-CD 3.4Å; F280-I292 HydrophobicContact CB-CD1 4.42Å; F280-I292 HydrophobicContact CB-CG1 3.64Å; F280-I292 HydrophobicContact CD2-CG1 3.69Å; F280-I292 HydrophobicContact CG-CG1 3.69Å; F280-H295 HydrophobicContact CE1-CB 3.8Å; F280-H295 HydrophobicContact CZ-CB 3.8Å; F280-L299 HydrophobicContact CE1-CB 4.16Å; F280-L299 HydrophobicContact CZ-CB 4.47Å; F280-L299 HydrophobicContact CZ-CD1 4.44Å; F280-L319 HydrophobicContact CE2-CD1 4.15Å; F280-L319 HydrophobicContact CE2-CD2 4.16Å; F280-L319 HydrophobicContact CZ-CD1 4.15Å
281	Y	92.9	Very high	93.6	Very high	113 Å²	113	54.3 Å²	54.3	44%	0.443	31%	0.306	S	S	.	.			trans	-49.9	138.5	-178.4	179.1	-109.2	0	0	0	113.3	T278 K291	T278-Y281 PolarHBondContact O-N 2.89Å; T278-Y281 WeakPolarHBondContact OG1-CB 3.26Å; T278-Y281 PolarHBondContact OG1-N 3.42Å; Y281-K291 WeakPolarHBondContact O-CE 3.48Å; Y281-K291 PolarHBondContact O-NZ 3.32Å
282	A	92.9	Very high	93.5	Very high	19 Å²	19	53.6 Å²	53.6	16%	0.157	30%	0.304	C	S	.	.			trans	-157.5	154.6	169.9	0	0	0	0	0	112.1	S284 A287 K291	A282-S284 PolarHBondContact O-N 2.92Å; A282-A287 HydrophobicContact CB-CB 3.56Å; A282-K291 HydrophobicContact CB-CD 4.48Å
283	N	88.9	Confident	93.3	Very high	154 Å²	154	56 Å²	56	82%	0.824	32%	0.316	S	S	*	.	S	Bend	trans	-63.2	4.1	-178.4	-52.7	11.4	0	0	0	115.3
284	S	92	Very high	93.3	Very high	65 Å²	65	59.7 Å²	59.7	46%	0.455	34%	0.336	S	S	.	.	S	Bend	trans	-155.9	143	174	69.5	0	0	0	0	111.3	A282 V286 A287 T288	A282-S284 PolarHBondContact O-N 2.92Å; S284-V286 PolarHBondContact O-N 3.44Å; S284-V286 VanDerWaalsContact O-N 3.15Å; S284-A287 WeakPolarHBondContact O-CA 3.34Å; S284-A287 WeakPolarHBondContact O-CB 3.42Å; S284-A287 PolarHBondContact O-N 3.41Å; S284-A287 WeakPolarHBondContact OG-CB 3.43Å; S284-T288 PolarHBondContact O-N 3.32Å; S284-T288 PolarHBondContact O-OG1 3.45Å
285	L	89.5	Confident	93.2	Very high	101 Å²	101	59 Å²	59	53%	0.529	33%	0.332	S	S	.	.	H	α-helix	trans	-52.3	-40.1	-178.2	-58.6	178.1	0	0	0	113.3	P240 A287 T288 Y289	P240-L285 HydrophobicContact CB-CD2 3.8Å; P240-L285 HydrophobicContact CG-CD2 3.66Å; L285-A287 VanDerWaalsContact C-N 3.31Å; L285-A287 PolarHBondContact O-N 2.95Å; L285-T288 PolarHBondContact O-N 2.84Å; L285-Y289 WeakPolarHBondContact O-CD2 3.27Å; L285-Y289 VanDerWaalsContact O-CG 3.23Å; L285-Y289 PolarHBondContact O-N 2.97Å
286	V	90.5	Very high	93.1	Very high	115 Å²	115	65.7 Å²	65.7	70%	0.697	36%	0.361	S	S	*	.	H	α-helix	trans	-66.7	-33.4	178.8	-176.8	0	0	0	0	111.5	S284 S290	S284-V286 PolarHBondContact O-N 3.44Å; S284-V286 VanDerWaalsContact O-N 3.15Å; V286-S290 VanDerWaalsContact O-CB 3.27Å; V286-S290 WeakPolarHBondContact O-CB 3.48Å; V286-S290 PolarHBondContact O-N 2.95Å
287	A	92.2	Very high	93	Very high	38 Å²	38	67.1 Å²	67.1	31%	0.314	36%	0.361	S	S	.	.	H	α-helix	trans	-74	-38.8	174.4	0	0	0	0	0	112	A282 S284 L285 S290 K291	A282-A287 HydrophobicContact CB-CB 3.56Å; S284-A287 WeakPolarHBondContact O-CA 3.34Å; S284-A287 WeakPolarHBondContact O-CB 3.42Å; S284-A287 PolarHBondContact O-N 3.41Å; S284-A287 WeakPolarHBondContact OG-CB 3.43Å; L285-A287 VanDerWaalsContact C-N 3.31Å; L285-A287 PolarHBondContact O-N 2.95Å; A287-S290 WeakPolarHBondContact O-CB 3.23Å; A287-S290 PolarHBondContact O-N 2.77Å; A287-K291 PolarHBondContact O-N 2.83Å
288	T	93.3	Very high	93.1	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-60	-50	172.5	-50.5	0	0	0	0	110.7	P240 S284 L285 S290 K291 I292	P240-T288 WeakPolarHBondContact O-CG2 3.28Å; S284-T288 PolarHBondContact O-N 3.32Å; S284-T288 PolarHBondContact O-OG1 3.45Å; L285-T288 PolarHBondContact O-N 2.84Å; T288-S290 VanDerWaalsContact C-N 3.31Å; T288-S290 PolarHBondContact O-N 3.33Å; T288-K291 WeakPolarHBondContact O-CB 3.28Å; T288-K291 PolarHBondContact O-N 3.34Å; T288-K291 VanDerWaalsContact O-N 3.13Å; T288-I292 HydrophobicContact CG2-CD1 4.07Å; T288-I292 WeakPolarHBondContact O-CG1 3.48Å; T288-I292 PolarHBondContact O-N 3.37Å
289	Y	92.7	Very high	93.1	Very high	70 Å²	70	63.1 Å²	63.1	28%	0.275	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-37.8	175.1	-63	-18.6	0	0	0	112.7	P240 I243 L248 L285 I292 M293	P240-Y289 HydrophobicContact CB-CE1 3.77Å; P240-Y289 HydrophobicContact CG-CE1 4.49Å; I243-Y289 HydrophobicContact CG2-CE1 4.24Å; L248-Y289 HydrophobicContact CD1-CD1 3.84Å; L248-Y289 HydrophobicContact CD1-CG 4.2Å; L248-Y289 HydrophobicContact CD2-CD1 3.72Å; L248-Y289 HydrophobicContact CD2-CD2 4.38Å; L248-Y289 HydrophobicContact CD2-CE1 3.7Å; L248-Y289 HydrophobicContact CD2-CE2 4.37Å; L248-Y289 HydrophobicContact CD2-CG 4.07Å; L248-Y289 HydrophobicContact CG-CD1 4.46Å; L285-Y289 WeakPolarHBondContact O-CD2 3.27Å; L285-Y289 VanDerWaalsContact O-CG 3.23Å; L285-Y289 PolarHBondContact O-N 2.97Å; Y289-I292 PolarHBondContact O-N 3.42Å; Y289-M293 WeakPolarHBondContact O-CB 3.3Å; Y289-M293 VanDerWaalsContact O-CG 3.31Å; Y289-M293 WeakPolarHBondContact O-CG 3.46Å; Y289-M293 PolarHBondContact O-N 3.29Å
290	S	93.2	Very high	92.9	Very high	64 Å²	64	67.4 Å²	67.4	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-41.2	174.1	-172.2	0	0	0	0	112	V286 A287 T288 N294	V286-S290 VanDerWaalsContact O-CB 3.27Å; V286-S290 WeakPolarHBondContact O-CB 3.48Å; V286-S290 PolarHBondContact O-N 2.95Å; A287-S290 WeakPolarHBondContact O-CB 3.23Å; A287-S290 PolarHBondContact O-N 2.77Å; T288-S290 VanDerWaalsContact C-N 3.31Å; T288-S290 PolarHBondContact O-N 3.33Å; S290-N294 WeakPolarHBondContact O-CB 3.45Å; S290-N294 PolarHBondContact O-N 3.44Å; S290-N294 VanDerWaalsContact O-N 3.16Å; S290-N294 PolarHBondContact O-ND2 2.95Å
291	K	95.2	Very high	92.8	Very high	83 Å²	83	69.5 Å²	69.5	36%	0.361	38%	0.38	S	S	.	.	H	α-helix	trans	-61.9	-49.1	172.9	-83	-175.6	163.9	-166.1	0	111.4	F280 Y281 A282 A287 T288 M293 N294 H295 S298	F280-K291 HydrophobicContact CB-CB 3.95Å; F280-K291 HydrophobicContact CD1-CB 4.16Å; F280-K291 HydrophobicContact CG-CB 4.49Å; F280-K291 WeakPolarHBondContact O-CD 3.4Å; Y281-K291 WeakPolarHBondContact O-CE 3.48Å; Y281-K291 PolarHBondContact O-NZ 3.32Å; A282-K291 HydrophobicContact CB-CD 4.48Å; A287-K291 PolarHBondContact O-N 2.83Å; T288-K291 WeakPolarHBondContact O-CB 3.28Å; T288-K291 PolarHBondContact O-N 3.34Å; T288-K291 VanDerWaalsContact O-N 3.13Å; K291-M293 PolarHBondContact O-N 3.47Å; K291-N294 CarbonylContact O-C 3.59Å; K291-N294 VanDerWaalsContact O-C 3.32Å; K291-N294 PolarHBondContact O-N 3.47Å; K291-N294 VanDerWaalsContact O-N 3.16Å; K291-H295 PolarHBondContact O-N 3.21Å; K291-H295 VanDerWaalsContact O-N 3.08Å; K291-S298 PolarHBondContact O-OG 2.81Å
292	I	95.4	Very high	92.8	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-59.7	-45.7	179	-69.8	167.3	0	0	0	111.6	P240 I243 P245 L248 W264 F280 T288 Y289 N294 H295	P240-I292 WeakPolarHBondContact O-CD1 3.48Å; I243-I292 HydrophobicContact CG2-CD1 4.09Å; P245-I292 HydrophobicContact CB-CG2 4.36Å; P245-I292 HydrophobicContact CG-CG2 3.81Å; L248-I292 HydrophobicContact CD1-CB 4.18Å; L248-I292 HydrophobicContact CD1-CD1 4.42Å; L248-I292 HydrophobicContact CD1-CG2 3.72Å; W264-I292 HydrophobicContact CZ2-CG2 3.91Å; F280-I292 HydrophobicContact CB-CD1 4.42Å; F280-I292 HydrophobicContact CB-CG1 3.64Å; F280-I292 HydrophobicContact CD2-CG1 3.69Å; F280-I292 HydrophobicContact CG-CG1 3.69Å; T288-I292 HydrophobicContact CG2-CD1 4.07Å; T288-I292 WeakPolarHBondContact O-CG1 3.48Å; T288-I292 PolarHBondContact O-N 3.37Å; Y289-I292 PolarHBondContact O-N 3.42Å; I292-N294 PolarHBondContact O-N 3.41Å; I292-H295 WeakPolarHBondContact O-CB 3.32Å; I292-H295 PolarHBondContact O-N 3.09Å; I292-H295 PolarHBondContact O-ND1 2.94Å
293	M	92.4	Very high	92.6	Very high	80 Å²	80	73 Å²	73	39%	0.394	41%	0.407	S	S	.	.	H	α-helix	trans	-64.5	-27.7	178.7	-76.8	-70.2	-77	0	0	113	P245 R249 Y289 K291	P245-M293 HydrophobicContact CB-SD 4.39Å; R249-M293 HydrophobicContact CG-CE 3.8Å; R249-M293 HydrophobicContact CG-SD 3.85Å; Y289-M293 WeakPolarHBondContact O-CB 3.3Å; Y289-M293 VanDerWaalsContact O-CG 3.31Å; Y289-M293 WeakPolarHBondContact O-CG 3.46Å; Y289-M293 PolarHBondContact O-N 3.29Å; K291-M293 PolarHBondContact O-N 3.47Å
294	N	93.9	Very high	92.6	Very high	85 Å²	85	72.3 Å²	72.3	46%	0.455	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	22.9	178.7	-63.8	-66.7	0	0	0	113.6	S290 K291 I292 Q296 S297 S298	S290-N294 WeakPolarHBondContact O-CB 3.45Å; S290-N294 PolarHBondContact O-N 3.44Å; S290-N294 VanDerWaalsContact O-N 3.16Å; S290-N294 PolarHBondContact O-ND2 2.95Å; K291-N294 CarbonylContact O-C 3.59Å; K291-N294 VanDerWaalsContact O-C 3.32Å; K291-N294 PolarHBondContact O-N 3.47Å; K291-N294 VanDerWaalsContact O-N 3.16Å; I292-N294 PolarHBondContact O-N 3.41Å; N294-Q296 PolarHBondContact O-N 3.39Å; N294-S297 PolarHBondContact O-N 3.36Å; N294-S297 PolarHBondContact O-OG 3.16Å; N294-S298 PolarHBondContact O-N 2.62Å; N294-S298 PolarHBondContact O-OG 2.95Å
295	H	94.5	Very high	92.3	Very high	6 Å²	6	71 Å²	71	3%	0.028	39%	0.392	C	S	.	.	H	α-helix	trans	-45.1	-36	-172.7	58.3	-89.3	0	0	0	116	W264 F280 K291 I292 S297 S298 L299 L319	W264-H295 HydrophobicContact CH2-CB 3.65Å; W264-H295 AromaticContact CH2-CG 3.67Å; W264-H295 AromaticContact CH2-ND1 3.88Å; W264-H295 HydrophobicContact CZ3-CB 4.41Å; F280-H295 HydrophobicContact CE1-CB 3.8Å; F280-H295 HydrophobicContact CZ-CB 3.8Å; K291-H295 PolarHBondContact O-N 3.21Å; K291-H295 VanDerWaalsContact O-N 3.08Å; I292-H295 WeakPolarHBondContact O-CB 3.32Å; I292-H295 PolarHBondContact O-N 3.09Å; I292-H295 PolarHBondContact O-ND1 2.94Å; H295-S297 PolarHBondContact O-N 3.43Å; H295-S298 WeakPolarHBondContact CA-OG 3.48Å; H295-S298 PolarHBondContact N-OG 3.47Å; H295-S298 PolarHBondContact O-N 2.99Å; H295-L299 WeakPolarHBondContact O-CB 3.49Å; H295-L299 PolarHBondContact O-N 3.48Å; H295-L299 VanDerWaalsContact O-N 3.1Å; H295-L319 PolarHBondContact CD2-O 2.98Å
296	Q	91	Very high	92.2	Very high	170 Å²	170	74.6 Å²	74.6	79%	0.794	41%	0.41	S	S	*	.	H	α-helix	trans	-58.7	-14.5	176.2	-58.6	-179.6	-3.2	0	0	114.3	N294	N294-Q296 PolarHBondContact O-N 3.39Å
297	S	91.4	Very high	92.3	Very high	95 Å²	95	70 Å²	70	66%	0.664	38%	0.382	S	S	*	.	H	α-helix	trans	-129.1	-13.6	-178.2	64.6	0	0	0	0	114.3	N294 H295	N294-S297 PolarHBondContact O-N 3.36Å; N294-S297 PolarHBondContact O-OG 3.16Å; H295-S297 PolarHBondContact O-N 3.43Å
298	S	94.2	Very high	92.4	Very high	23 Å²	23	70 Å²	70	16%	0.161	38%	0.38	C	S	.	.	H	α-helix	trans	-105.6	-17.6	-177.7	59.5	0	0	0	0	113.7	K291 N294 H295 T300	K291-S298 PolarHBondContact O-OG 2.81Å; N294-S298 PolarHBondContact O-N 2.62Å; N294-S298 PolarHBondContact O-OG 2.95Å; H295-S298 WeakPolarHBondContact CA-OG 3.48Å; H295-S298 PolarHBondContact N-OG 3.47Å; H295-S298 PolarHBondContact O-N 2.99Å; S298-T300 PolarHBondContact O-N 2.88Å
299	L	95.5	Very high	92.5	Very high	35 Å²	35	75.8 Å²	75.8	18%	0.183	42%	0.415	C	S	.	.			trans	-74.6	112.5	173.5	179.8	63.2	0	0	0	110	Y271 P279 F280 H295 L319	Y271-L299 HydrophobicContact CD2-CD1 4.17Å; Y271-L299 HydrophobicContact CE2-CD1 4.09Å; P279-L299 HydrophobicContact CB-CD1 3.71Å; F280-L299 HydrophobicContact CE1-CB 4.16Å; F280-L299 HydrophobicContact CZ-CB 4.47Å; F280-L299 HydrophobicContact CZ-CD1 4.44Å; H295-L299 WeakPolarHBondContact O-CB 3.49Å; H295-L299 PolarHBondContact O-N 3.48Å; H295-L299 VanDerWaalsContact O-N 3.1Å; L299-L319 HydrophobicContact CD1-CD1 3.75Å; L299-L319 HydrophobicContact CD2-CB 3.88Å; L299-L319 HydrophobicContact CD2-CD1 4.08Å
300	T	93.8	Very high	92.7	Very high	97 Å²	97	74.4 Å²	74.4	60%	0.595	42%	0.416	S	S	*	.			trans	-134.9	135.6	177.6	54.2	0	0	0	0	109.5	Y271 S298	Y271-T300 PolarHBondContact OH-O 3.5Å; S298-T300 PolarHBondContact O-N 2.88Å
301	F	94.6	Very high	92.9	Very high	43 Å²	43	71.4 Å²	71.4	19%	0.189	39%	0.394	C	S	.	.			trans	-94.1	136.1	171.9	-60.2	-90.4	0	0	0	109.6	Y271 I307 K312 I315	Y271-F301 AromaticContact CD2-CD1 3.96Å; Y271-F301 HydrophobicContact CD2-CD1 3.96Å; Y271-F301 AromaticContact CD2-CE1 3.71Å; Y271-F301 HydrophobicContact CD2-CE1 3.71Å; Y271-F301 AromaticContact CE2-CD1 3.73Å; Y271-F301 HydrophobicContact CE2-CD1 3.73Å; Y271-F301 AromaticContact CE2-CE1 3.92Å; Y271-F301 HydrophobicContact CE2-CE1 3.92Å; Y271-F301 HydrophobicContact CE2-CG 4.41Å; F301-I307 HydrophobicContact CD1-CD1 3.99Å; F301-K312 HydrophobicContact CB-CD 4.27Å; F301-K312 HydrophobicContact CD1-CD 4.22Å; F301-K312 HydrophobicContact CD1-CG 4.11Å; F301-K312 HydrophobicContact CD2-CD 4.08Å; F301-K312 HydrophobicContact CD2-CG 4.44Å; F301-K312 HydrophobicContact CE1-CB 4.37Å; F301-K312 HydrophobicContact CE1-CG 4.07Å; F301-K312 HydrophobicContact CE2-CB 4.26Å; F301-K312 HydrophobicContact CE2-CD 4.49Å; F301-K312 HydrophobicContact CE2-CG 4.42Å; F301-K312 HydrophobicContact CG-CD 3.93Å; F301-K312 HydrophobicContact CG-CG 4.29Å; F301-K312 HydrophobicContact CZ-CB 4.08Å; F301-K312 HydrophobicContact CZ-CG 4.23Å; F301-I315 HydrophobicContact CE1-CB 4.29Å; F301-I315 HydrophobicContact CE1-CD1 3.98Å; F301-I315 HydrophobicContact CE1-CG2 3.99Å; F301-I315 HydrophobicContact CZ-CB 4.11Å; F301-I315 HydrophobicContact CZ-CG2 3.83Å
302	P	92.5	Very high	92.9	Very high	42 Å²	42	70.3 Å²	70.3	27%	0.273	39%	0.39	S	S	.	.			trans	-61.8	150	170.9	-21	33.2	0	0	0	112.3	V275 D304 V305	V275-P302 HydrophobicContact CG1-CG 3.96Å; P302-D304 WeakPolarHBondContact CB-OD1 3.47Å; P302-V305 HydrophobicContact CB-CG2 4Å; P302-V305 HydrophobicContact CG-CG2 4.34Å
303	D	88.4	Confident	93	Very high	165 Å²	165	73.2 Å²	73.2	88%	0.882	41%	0.405	S	S	*	.	S	Bend	trans	-84.5	-18.3	-178.8	-76.4	-40.6	0	0	0	113.1
304	D	88.5	Confident	93.3	Very high	139 Å²	139	69.4 Å²	69.4	74%	0.743	39%	0.387	S	S	*	.	S	Bend	trans	-84.4	-13.5	178.6	54.3	-37.6	0	0	0	113.7	P302	P302-D304 WeakPolarHBondContact CB-OD1 3.47Å
305	V	86.2	Confident	93.5	Very high	38 Å²	38	65.3 Å²	65.3	23%	0.23	37%	0.365	C	S	.	.	S	Bend	trans	-98.3	119.9	-178.6	-173.2	0	0	0	0	111.5	L274 P302 I307	L274-V305 WeakPolarHBondContact O-CG1 3.44Å; P302-V305 HydrophobicContact CB-CG2 4Å; P302-V305 HydrophobicContact CG-CG2 4.34Å; V305-I307 HydrophobicContact CB-CG1 4.44Å; V305-I307 HydrophobicContact CG1-CD1 3.99Å; V305-I307 HydrophobicContact CG1-CG1 3.74Å; V305-I307 PolarHBondContact O-N 3.38Å
306	L	87.1	Confident	93.6	Very high	175 Å²	175	67.8 Å²	67.8	92%	0.916	38%	0.382	S	S	*	.			trans	-80	77	-175	-66.1	177.6	0	0	0	113.2
307	I	91.9	Very high	93.9	Very high	20 Å²	20	63.4 Å²	63.4	10%	0.103	36%	0.36	C	S	.	.			trans	-100.3	132	178.2	-52.4	175.3	0	0	0	110.6	L274 V275 F301 V305 A311 K312	L274-I307 HydrophobicContact CB-CD1 4.18Å; L274-I307 HydrophobicContact CB-CG1 4.29Å; L274-I307 HydrophobicContact CD1-CG2 4.08Å; V275-I307 HydrophobicContact CG2-CD1 3.62Å; F301-I307 HydrophobicContact CD1-CD1 3.99Å; V305-I307 HydrophobicContact CB-CG1 4.44Å; V305-I307 HydrophobicContact CG1-CD1 3.99Å; V305-I307 HydrophobicContact CG1-CG1 3.74Å; V305-I307 PolarHBondContact O-N 3.38Å; I307-A311 HydrophobicContact CG2-CB 3.48Å; I307-A311 VanDerWaalsContact CG2-CB 3.48Å; I307-K312 HydrophobicContact CB-CG 4.07Å; I307-K312 HydrophobicContact CG2-CG 3.64Å
308	S	95	Very high	94.2	Very high	38 Å²	38	58.9 Å²	58.9	27%	0.266	33%	0.329	S	S	.	.			trans	-65.2	158	179.1	84.1	0	0	0	0	113.4	E174 S310 A311 K312	E174-S308 VanDerWaalsContact CD-OG 3.23Å; E174-S308 VanDerWaalsContact OE1-CB 3.29Å; E174-S308 WeakPolarHBondContact OE1-CB 3.44Å; E174-S308 PolarHBondContact OE1-OG 3.26Å; E174-S308 WeakPolarHBondContact OE2-CB 3.44Å; E174-S308 PolarHBondContact OE2-N 3.02Å; E174-S308 PolarHBondContact OE2-OG 3.24Å; E174-S308 VanDerWaalsContact OE2-OG 3.11Å; S308-S310 PolarHBondContact O-N 3.08Å; S308-S310 PolarHBondContact OG-N 3.44Å; S308-A311 PolarHBondContact O-N 2.91Å; S308-A311 VanDerWaalsContact O-N 3.14Å; S308-A311 PolarHBondContact OG-N 3.19Å; S308-A311 VanDerWaalsContact OG-N 3.12Å; S308-K312 PolarHBondContact O-N 2.96Å
309	T	95.1	Very high	94.4	Very high	124 Å²	124	58 Å²	58	76%	0.761	32%	0.322	S	S	*	.	H	α-helix	trans	-57.9	-37.4	174.2	-45.1	0	0	0	0	111.8	D313	T309-D313 WeakPolarHBondContact O-CB 3.27Å; T309-D313 PolarHBondContact O-N 3.28Å
310	S	96.8	Very high	94.4	Very high	41 Å²	41	57.3 Å²	57.3	29%	0.287	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-35.5	177.5	-58.5	0	0	0	0	112.7	S308 I314	S308-S310 PolarHBondContact O-N 3.08Å; S308-S310 PolarHBondContact OG-N 3.44Å; S310-I314 PolarHBondContact O-N 2.67Å
311	A	96.8	Very high	94.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-73.1	-45.2	175.9	0	0	0	0	0	112	E174 L274 I307 S308 D313 I314 I315 F339	E174-A311 HydrophobicContact CG-CB 4.37Å; L274-A311 HydrophobicContact CD1-CB 3.93Å; I307-A311 HydrophobicContact CG2-CB 3.48Å; I307-A311 VanDerWaalsContact CG2-CB 3.48Å; S308-A311 PolarHBondContact O-N 2.91Å; S308-A311 VanDerWaalsContact O-N 3.14Å; S308-A311 PolarHBondContact OG-N 3.19Å; S308-A311 VanDerWaalsContact OG-N 3.12Å; A311-D313 VanDerWaalsContact C-N 3.3Å; A311-D313 PolarHBondContact O-N 2.88Å; A311-I314 WeakPolarHBondContact O-CG2 3.25Å; A311-I314 PolarHBondContact O-N 2.79Å; A311-I315 WeakPolarHBondContact O-CB 3.41Å; A311-I315 WeakPolarHBondContact O-CD1 3.3Å; A311-I315 VanDerWaalsContact O-CG1 3.27Å; A311-I315 WeakPolarHBondContact O-CG1 3.37Å; A311-I315 PolarHBondContact O-N 3.19Å; A311-I315 VanDerWaalsContact O-N 3.09Å; A311-F339 HydrophobicContact CB-CD2 3.88Å; A311-F339 HydrophobicContact CB-CE2 3.82Å
312	K	96.3	Very high	94.4	Very high	60 Å²	60	55.1 Å²	55.1	26%	0.261	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-41	173.1	-63	-163.3	-178.8	-169.4	0	111.4	F301 I307 S308 C316	F301-K312 HydrophobicContact CB-CD 4.27Å; F301-K312 HydrophobicContact CD1-CD 4.22Å; F301-K312 HydrophobicContact CD1-CG 4.11Å; F301-K312 HydrophobicContact CD2-CD 4.08Å; F301-K312 HydrophobicContact CD2-CG 4.44Å; F301-K312 HydrophobicContact CE1-CB 4.37Å; F301-K312 HydrophobicContact CE1-CG 4.07Å; F301-K312 HydrophobicContact CE2-CB 4.26Å; F301-K312 HydrophobicContact CE2-CD 4.49Å; F301-K312 HydrophobicContact CE2-CG 4.42Å; F301-K312 HydrophobicContact CG-CD 3.93Å; F301-K312 HydrophobicContact CG-CG 4.29Å; F301-K312 HydrophobicContact CZ-CB 4.08Å; F301-K312 HydrophobicContact CZ-CG 4.23Å; I307-K312 HydrophobicContact CB-CG 4.07Å; I307-K312 HydrophobicContact CG2-CG 3.64Å; S308-K312 PolarHBondContact O-N 2.96Å; K312-C316 WeakPolarHBondContact O-CB 3.32Å; K312-C316 PolarHBondContact O-N 2.84Å; K312-C316 PolarHBondContact O-SG 2.9Å; K312-C316 VanDerWaalsContact O-SG 3.33Å
313	D	97.4	Very high	94.4	Very high	61 Å²	61	56.1 Å²	56.1	33%	0.326	31%	0.31	S	S	.	.	H	α-helix	trans	-63.4	-47.1	177.7	176.3	47	0	0	0	113.2	T309 A311 C316 K317 H337	T309-D313 WeakPolarHBondContact O-CB 3.27Å; T309-D313 PolarHBondContact O-N 3.28Å; A311-D313 VanDerWaalsContact C-N 3.3Å; A311-D313 PolarHBondContact O-N 2.88Å; D313-C316 PolarHBondContact O-N 2.67Å; D313-K317 WeakPolarHBondContact O-CB 3.32Å; D313-K317 WeakPolarHBondContact O-CD 3.48Å; D313-K317 VanDerWaalsContact O-CG 3.31Å; D313-K317 WeakPolarHBondContact O-CG 3.33Å; D313-K317 PolarHBondContact O-N 3.34Å; D313-K317 WeakPolarHBondContact OD1-CE 3.13Å; D313-K317 IonicContact OD1-NZ 3.62Å; D313-K317 PolarHBondContact OD1-NZ 2.9Å; D313-K317 IonicContact OD2-NZ 2.66Å; D313-K317 PolarHBondContact OD2-NZ 2.81Å; D313-H337 IonicContact OD2-CE1 3.31Å; D313-H337 PolarHBondContact OD2-CE1 2.76Å; D313-H337 IonicContact OD2-NE2 2.73Å; D313-H337 PolarHBondContact OD2-NE2 3.3Å
314	I	98	Very high	94.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.8	-39.4	177.9	-159.3	177.8	0	0	0	112.2	L270 S310 A311 K317 F318 L326 H337 F339 F340	L270-I314 HydrophobicContact CD2-CG2 3.5Å; S310-I314 PolarHBondContact O-N 2.67Å; A311-I314 WeakPolarHBondContact O-CG2 3.25Å; A311-I314 PolarHBondContact O-N 2.79Å; I314-K317 PolarHBondContact O-N 3.44Å; I314-F318 HydrophobicContact CD1-CE2 3.72Å; I314-F318 HydrophobicContact CD1-CZ 4.2Å; I314-F318 HydrophobicContact CG1-CD2 4.01Å; I314-F318 HydrophobicContact CG1-CE2 3.69Å; I314-F318 HydrophobicContact CG1-CZ 4.34Å; I314-F318 WeakPolarHBondContact O-CD2 3.4Å; I314-F318 PolarHBondContact O-N 2.86Å; I314-L326 HydrophobicContact CD1-CD2 4.31Å; I314-L326 HydrophobicContact CG1-CD2 3.88Å; I314-H337 WeakPolarHBondContact CB-ND1 3.45Å; I314-H337 HydrophobicContact CD1-CB 3.94Å; I314-H337 HydrophobicContact CG1-CB 4.49Å; I314-F339 HydrophobicContact CB-CB 4.23Å; I314-F339 HydrophobicContact CD1-CB 4.16Å; I314-F339 HydrophobicContact CD1-CD1 3.96Å; I314-F339 HydrophobicContact CD1-CG 4.4Å; I314-F339 HydrophobicContact CG2-CB 4.03Å; I314-F339 HydrophobicContact CG2-CD1 4.01Å; I314-F339 HydrophobicContact CG2-CD2 4.36Å; I314-F339 HydrophobicContact CG2-CG 3.87Å; I314-F340 HydrophobicContact CD1-CD2 4.2Å; I314-F340 HydrophobicContact CD1-CE2 3.38Å; I314-F340 HydrophobicContact CD1-CZ 3.78Å
315	I	98	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-48	176.5	-69.1	165.2	0	0	0	110.1	L270 Y271 L274 F301 A311 K317 F318 L319	L270-I315 HydrophobicContact CB-CG1 4.37Å; L270-I315 HydrophobicContact CD2-CG1 4.05Å; L270-I315 HydrophobicContact CG-CD1 4.17Å; L270-I315 HydrophobicContact CG-CG1 3.93Å; Y271-I315 HydrophobicContact CD2-CG2 4.18Å; L274-I315 HydrophobicContact CD1-CD1 4.21Å; F301-I315 HydrophobicContact CE1-CB 4.29Å; F301-I315 HydrophobicContact CE1-CD1 3.98Å; F301-I315 HydrophobicContact CE1-CG2 3.99Å; F301-I315 HydrophobicContact CZ-CB 4.11Å; F301-I315 HydrophobicContact CZ-CG2 3.83Å; A311-I315 WeakPolarHBondContact O-CB 3.41Å; A311-I315 WeakPolarHBondContact O-CD1 3.3Å; A311-I315 VanDerWaalsContact O-CG1 3.27Å; A311-I315 WeakPolarHBondContact O-CG1 3.37Å; A311-I315 PolarHBondContact O-N 3.19Å; A311-I315 VanDerWaalsContact O-N 3.09Å; I315-K317 VanDerWaalsContact C-N 3.25Å; I315-K317 PolarHBondContact O-N 3.37Å; I315-F318 PolarHBondContact O-N 3.31Å; I315-L319 HydrophobicContact CG2-CD1 3.65Å; I315-L319 HydrophobicContact CG2-CG 4.16Å; I315-L319 WeakPolarHBondContact O-CB 3.37Å; I315-L319 WeakPolarHBondContact O-CG 3.42Å; I315-L319 PolarHBondContact O-N 3.13Å
316	C	97.1	Very high	95.6	Very high	57 Å²	57	46.2 Å²	46.2	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-61	-32.3	176.5	-73.3	0	0	0	0	113.4	K312 D313	K312-C316 WeakPolarHBondContact O-CB 3.32Å; K312-C316 PolarHBondContact O-N 2.84Å; K312-C316 PolarHBondContact O-SG 2.9Å; K312-C316 VanDerWaalsContact O-SG 3.33Å; D313-C316 PolarHBondContact O-N 2.67Å
317	K	97.3	Very high	96	Very high	78 Å²	78	37.9 Å²	37.9	34%	0.339	22%	0.216	S	C	.	.	H	α-helix	trans	-74.5	-30.5	176.9	-75.6	165	170.2	159.8	0	113.4	D313 I314 I315 S320 R325 L326 H337	D313-K317 WeakPolarHBondContact O-CB 3.32Å; D313-K317 WeakPolarHBondContact O-CD 3.48Å; D313-K317 VanDerWaalsContact O-CG 3.31Å; D313-K317 WeakPolarHBondContact O-CG 3.33Å; D313-K317 PolarHBondContact O-N 3.34Å; D313-K317 WeakPolarHBondContact OD1-CE 3.13Å; D313-K317 IonicContact OD1-NZ 3.62Å; D313-K317 PolarHBondContact OD1-NZ 2.9Å; D313-K317 IonicContact OD2-NZ 2.66Å; D313-K317 PolarHBondContact OD2-NZ 2.81Å; I314-K317 PolarHBondContact O-N 3.44Å; I315-K317 VanDerWaalsContact C-N 3.25Å; I315-K317 PolarHBondContact O-N 3.37Å; K317-S320 PolarHBondContact O-OG 3.22Å; K317-R325 WeakPolarHBondContact O-CG 3.43Å; K317-L326 HydrophobicContact CB-CB 4.08Å; K317-L326 HydrophobicContact CB-CD2 4.45Å; K317-L326 PolarHBondContact O-N 3.03Å; K317-L326 VanDerWaalsContact O-N 3.15Å; K317-H337 VanDerWaalsContact CD-NE2 3.32Å; K317-H337 WeakPolarHBondContact CD-NE2 3.36Å; K317-H337 PolarHBondContact NZ-NE2 3.45Å
318	F	98.1	Very high	96	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-77.9	-42.6	169.6	-73.7	-47.6	0	0	0	112.5	W263 V266 I314 I315 S320 R325 L326 I334	W263-F318 HydrophobicContact CB-CD1 3.91Å; W263-F318 HydrophobicContact CB-CE1 3.97Å; W263-F318 WeakPolarHBondContact O-CB 3.29Å; W263-F318 WeakPolarHBondContact O-CD1 3.36Å; W263-F318 WeakPolarHBondContact O-CG 3.35Å; V266-F318 HydrophobicContact CG1-CE2 3.96Å; V266-F318 HydrophobicContact CG1-CZ 4.11Å; I314-F318 HydrophobicContact CD1-CE2 3.72Å; I314-F318 HydrophobicContact CD1-CZ 4.2Å; I314-F318 HydrophobicContact CG1-CD2 4.01Å; I314-F318 HydrophobicContact CG1-CE2 3.69Å; I314-F318 HydrophobicContact CG1-CZ 4.34Å; I314-F318 WeakPolarHBondContact O-CD2 3.4Å; I314-F318 PolarHBondContact O-N 2.86Å; I315-F318 PolarHBondContact O-N 3.31Å; F318-S320 PolarHBondContact O-N 2.9Å; F318-R325 WeakPolarHBondContact O-CD 3.2Å; F318-R325 VanDerWaalsContact O-CG 3.24Å; F318-R325 WeakPolarHBondContact O-CG 3.3Å; F318-R325 PolarHBondContact O-NE 2.88Å; F318-R325 VanDerWaalsContact O-NE 3.11Å; F318-L326 HydrophobicContact CD1-CB 4.05Å; F318-L326 HydrophobicContact CE1-CB 4.13Å; F318-L326 HydrophobicContact CE1-CD2 4.09Å; F318-L326 HydrophobicContact CE1-CG 4.41Å; F318-L326 HydrophobicContact CZ-CD2 4.22Å; F318-I334 HydrophobicContact CE1-CD1 3.84Å; F318-I334 HydrophobicContact CE1-CG1 3.92Å; F318-I334 HydrophobicContact CE1-CG2 4.49Å; F318-I334 HydrophobicContact CZ-CD1 4.2Å; F318-I334 HydrophobicContact CZ-CG1 4.15Å; F318-I334 HydrophobicContact CZ-CG2 3.87Å
319	L	97.8	Very high	95.9	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.026	26%	0.256	C	S	.	.	S	Bend	trans	-84.6	42.1	-178.1	-59.2	-174.3	0	0	0	113.1	W264 V268 P279 F280 H295 L299 I315	W264-L319 HydrophobicContact CD2-CD2 3.85Å; W264-L319 HydrophobicContact CE3-CD2 4.04Å; W264-L319 HydrophobicContact CG-CD2 4.34Å; W264-L319 HydrophobicContact CH2-CD2 4.37Å; W264-L319 HydrophobicContact CZ2-CD2 4.19Å; W264-L319 VanDerWaalsContact CZ3-C 3.44Å; W264-L319 HydrophobicContact CZ3-CB 4.25Å; W264-L319 HydrophobicContact CZ3-CD2 4.32Å; W264-L319 WeakPolarHBondContact O-CD2 3.28Å; V268-L319 HydrophobicContact CG2-CD2 3.73Å; P279-L319 HydrophobicContact CB-CD1 4.15Å; P279-L319 HydrophobicContact CG-CD1 3.87Å; F280-L319 HydrophobicContact CE2-CD1 4.15Å; F280-L319 HydrophobicContact CE2-CD2 4.16Å; F280-L319 HydrophobicContact CZ-CD1 4.15Å; H295-L319 PolarHBondContact CD2-O 2.98Å; L299-L319 HydrophobicContact CD1-CD1 3.75Å; L299-L319 HydrophobicContact CD2-CB 3.88Å; L299-L319 HydrophobicContact CD2-CD1 4.08Å; I315-L319 HydrophobicContact CG2-CD1 3.65Å; I315-L319 HydrophobicContact CG2-CG 4.16Å; I315-L319 WeakPolarHBondContact O-CB 3.37Å; I315-L319 WeakPolarHBondContact O-CG 3.42Å; I315-L319 PolarHBondContact O-N 3.13Å
320	S	96.2	Very high	95.7	Very high	20 Å²	20	43 Å²	43	14%	0.14	23%	0.231	C	C	.	.	S	Bend	trans	-115.8	171.5	177.6	66.2	0	0	0	0	111.9	K317 F318 R325	K317-S320 PolarHBondContact O-OG 3.22Å; F318-S320 PolarHBondContact O-N 2.9Å; S320-R325 PolarHBondContact O-NE 3.48Å; S320-R325 PolarHBondContact O-NH2 2.71Å; S320-R325 WeakPolarHBondContact OG-CA 3.22Å
321	D	94.6	Very high	95.6	Very high	34 Å²	34	41.7 Å²	41.7	18%	0.182	22%	0.221	C	C	.	.			trans	-63.6	138.9	172.3	-176.1	-85.8	0	0	0	110.7	R249 S323 V324 R325	R249-D321 IonicContact CZ-OD2 3.66Å; R249-D321 IonicContact NH1-OD2 3.84Å; R249-D321 PolarHBondContact NH1-OD2 2.86Å; R249-D321 IonicContact NH2-OD2 2.77Å; D321-S323 PolarHBondContact O-N 3.45Å; D321-S323 WeakPolarHBondContact OD1-CB 3.49Å; D321-S323 PolarHBondContact OD1-N 2.79Å; D321-S323 PolarHBondContact OD1-OG 3.49Å; D321-V324 WeakPolarHBondContact O-CG2 3.27Å; D321-V324 PolarHBondContact O-N 2.98Å; D321-R325 PolarHBondContact O-N 2.84Å
322	R	93.4	Very high	95.6	Very high	60 Å²	60	46.1 Å²	46.1	23%	0.226	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-22.5	-176.5	66	176.3	-69.7	-141.3	2.8	115.5	M230 E246 V256 E260 V324 R328	M230-R322 PolarHBondContact SD-NH2 3.46Å; E246-R322 WeakPolarHBondContact OE1-CB 3.39Å; V256-R322 PolarHBondContact O-NH1 2.83Å; E260-R322 HydrophobicContact CG-CB 3.79Å; E260-R322 IonicContact OE1-CZ 2.62Å; E260-R322 IonicContact OE1-NE 3.85Å; E260-R322 PolarHBondContact OE1-NE 2.96Å; E260-R322 IonicContact OE1-NH2 2.82Å; E260-R322 PolarHBondContact OE1-NH2 2.97Å; R322-V324 VanDerWaalsContact C-N 3.28Å; R322-V324 PolarHBondContact O-N 3.08Å; R322-R328 WeakPolarHBondContact O-CD 3.23Å
323	S	92.3	Very high	95.6	Very high	63 Å²	63	45.4 Å²	45.4	44%	0.441	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-27.3	176	53.8	0	0	0	0	113.8	D321 R328	D321-S323 PolarHBondContact O-N 3.45Å; D321-S323 WeakPolarHBondContact OD1-CB 3.49Å; D321-S323 PolarHBondContact OD1-N 2.79Å; D321-S323 PolarHBondContact OD1-OG 3.49Å; S323-R328 WeakPolarHBondContact O-CD 3.45Å; S323-R328 PolarHBondContact O-NH1 2.95Å
324	V	95.2	Very high	95.6	Very high	111 Å²	111	42.5 Å²	42.5	67%	0.673	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.3	1.8	-176.9	-63.2	0	0	0	0	114	D321 R322	D321-V324 WeakPolarHBondContact O-CG2 3.27Å; D321-V324 PolarHBondContact O-N 2.98Å; R322-V324 VanDerWaalsContact C-N 3.28Å; R322-V324 PolarHBondContact O-N 3.08Å
325	R	97.4	Very high	95.5	Very high	2 Å²	2	45 Å²	45	1%	0.008	25%	0.245	C	C	.	.			trans	-65.2	140.3	-175.4	-165.1	179.7	-60.1	142.9	3.9	113.5	E246 E260 K317 F318 S320 D321 R328	E246-R325 IonicContact OE1-CZ 2.73Å; E246-R325 IonicContact OE1-NH1 3.49Å; E246-R325 PolarHBondContact OE1-NH1 3.37Å; E246-R325 IonicContact OE1-NH2 2.81Å; E246-R325 PolarHBondContact OE1-NH2 3.01Å; E246-R325 IonicContact OE2-CZ 2.67Å; E246-R325 IonicContact OE2-NH1 3.94Å; E246-R325 IonicContact OE2-NH2 3.73Å; E246-R325 PolarHBondContact OE2-NH2 3.37Å; E260-R325 WeakPolarHBondContact O-CD 3.27Å; E260-R325 PolarHBondContact O-NH1 3.38Å; K317-R325 WeakPolarHBondContact O-CG 3.43Å; F318-R325 WeakPolarHBondContact O-CD 3.2Å; F318-R325 VanDerWaalsContact O-CG 3.24Å; F318-R325 WeakPolarHBondContact O-CG 3.3Å; F318-R325 PolarHBondContact O-NE 2.88Å; F318-R325 VanDerWaalsContact O-NE 3.11Å; S320-R325 PolarHBondContact O-NE 3.48Å; S320-R325 PolarHBondContact O-NH2 2.71Å; S320-R325 WeakPolarHBondContact OG-CA 3.22Å; D321-R325 PolarHBondContact O-N 2.84Å; R325-R328 WeakPolarHBondContact O-CB 3.35Å; R325-R328 PolarHBondContact O-N 3.34Å
326	L	96.6	Very high	95.5	Very high	22 Å²	22	49.3 Å²	49.3	12%	0.115	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	134.8	174.2	-162.7	72.6	0	0	0	111.3	I314 K317 F318 E333 I334	I314-L326 HydrophobicContact CD1-CD2 4.31Å; I314-L326 HydrophobicContact CG1-CD2 3.88Å; K317-L326 HydrophobicContact CB-CB 4.08Å; K317-L326 HydrophobicContact CB-CD2 4.45Å; K317-L326 PolarHBondContact O-N 3.03Å; K317-L326 VanDerWaalsContact O-N 3.15Å; F318-L326 HydrophobicContact CD1-CB 4.05Å; F318-L326 HydrophobicContact CE1-CB 4.13Å; F318-L326 HydrophobicContact CE1-CD2 4.09Å; F318-L326 HydrophobicContact CE1-CG 4.41Å; F318-L326 HydrophobicContact CZ-CD2 4.22Å; L326-E333 HydrophobicContact CD1-CB 4.15Å; L326-E333 HydrophobicContact CD1-CG 3.79Å; L326-E333 HydrophobicContact CG-CG 4.23Å; L326-I334 HydrophobicContact CD2-CG1 4.13Å; L326-I334 HydrophobicContact CG-CG1 3.91Å
327	G	95.1	Very high	95.5	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	-4.6	-175.9	0	0	0	0	0	114.3	W263 N329 G330 E333	W263-G327 VanDerWaalsContact CD1-CA 3.46Å; W263-G327 PolarHBondContact NE1-O 3.03Å; W263-G327 VanDerWaalsContact NE1-O 3.13Å; G327-N329 VanDerWaalsContact C-N 3.28Å; G327-N329 PolarHBondContact O-N 3.37Å; G327-G330 PolarHBondContact O-N 3.03Å; G327-E333 VanDerWaalsContact C-OE1 3.25Å; G327-E333 WeakPolarHBondContact CA-OE1 3.45Å; G327-E333 PolarHBondContact N-OE1 2.81Å
328	R	92.3	Very high	95.5	Very high	139 Å²	139	46.8 Å²	46.8	53%	0.525	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-35.9	172.9	-177.3	-170.1	174.4	-142.9	-18.2	112.1	R322 S323 R325 G330 E333	R322-R328 WeakPolarHBondContact O-CD 3.23Å; S323-R328 WeakPolarHBondContact O-CD 3.45Å; S323-R328 PolarHBondContact O-NH1 2.95Å; R325-R328 WeakPolarHBondContact O-CB 3.35Å; R325-R328 PolarHBondContact O-N 3.34Å; R328-G330 VanDerWaalsContact C-N 3.3Å; R328-E333 PolarHBondContact N-OE1 2.9Å
329	N	91.1	Very high	95.5	Very high	126 Å²	126	46.9 Å²	46.9	67%	0.674	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	8.2	-179.3	-51.5	-62.6	0	0	0	112.8	G327 E333	G327-N329 VanDerWaalsContact C-N 3.28Å; G327-N329 PolarHBondContact O-N 3.37Å; N329-E333 PolarHBondContact N-OE1 3.32Å; N329-E333 PolarHBondContact ND2-OE1 2.7Å; N329-E333 PolarHBondContact ND2-OE2 3.02Å
330	G	91.7	Very high	95.4	Very high	23 Å²	23	46.9 Å²	46.9	24%	0.237	27%	0.266	C	S	.	.			trans	107.4	163.1	-175.5	0	0	0	0	0	112.8	G327 R328 S332 E333	G327-G330 PolarHBondContact O-N 3.03Å; R328-G330 VanDerWaalsContact C-N 3.3Å; G330-S332 PolarHBondContact O-N 3.13Å; G330-E333 PolarHBondContact O-N 3.05Å
331	V	95.4	Very high	95.4	Very high	15 Å²	15	51.1 Å²	51.1	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-23.7	-170.7	80	0	0	0	0	114.1	V185 D189 W263 E333 I334 K335	V185-V331 HydrophobicContact CG1-CG2 3.55Å; D189-V331 HydrophobicContact CB-CB 4.43Å; D189-V331 HydrophobicContact CB-CG2 4.13Å; W263-V331 HydrophobicContact CH2-CG2 4.17Å; W263-V331 HydrophobicContact CZ2-CG2 4.37Å; V331-E333 VanDerWaalsContact C-N 3.26Å; V331-E333 PolarHBondContact O-N 3.43Å; V331-I334 WeakPolarHBondContact O-CA 3.36Å; V331-I334 WeakPolarHBondContact O-CB 3.42Å; V331-I334 PolarHBondContact O-N 3.41Å; V331-K335 HydrophobicContact CG1-CD 4.28Å; V331-K335 HydrophobicContact CG2-CG 4.26Å; V331-K335 PolarHBondContact O-N 3.19Å
332	S	95.9	Very high	95.4	Very high	92 Å²	92	51.4 Å²	51.4	64%	0.643	29%	0.292	S	S	*	.	H	α-helix	trans	-58.3	-33.9	-175.3	-51.3	0	0	0	0	113.7	G330 K335 S336	G330-S332 PolarHBondContact O-N 3.13Å; S332-K335 PolarHBondContact O-N 2.97Å; S332-S336 WeakPolarHBondContact O-CB 3.47Å; S332-S336 PolarHBondContact O-N 3.32Å; S332-S336 PolarHBondContact O-OG 3.4Å
333	E	96.3	Very high	95.4	Very high	46 Å²	46	56.6 Å²	56.6	22%	0.215	32%	0.324	C	S	.	.	H	α-helix	trans	-71.5	-32.8	177	69.6	-166.9	167	0	0	112	L326 G327 R328 N329 G330 V331 S336	L326-E333 HydrophobicContact CD1-CB 4.15Å; L326-E333 HydrophobicContact CD1-CG 3.79Å; L326-E333 HydrophobicContact CG-CG 4.23Å; G327-E333 VanDerWaalsContact C-OE1 3.25Å; G327-E333 WeakPolarHBondContact CA-OE1 3.45Å; G327-E333 PolarHBondContact N-OE1 2.81Å; R328-E333 PolarHBondContact N-OE1 2.9Å; N329-E333 PolarHBondContact N-OE1 3.32Å; N329-E333 PolarHBondContact ND2-OE1 2.7Å; N329-E333 PolarHBondContact ND2-OE2 3.02Å; G330-E333 PolarHBondContact O-N 3.05Å; V331-E333 VanDerWaalsContact C-N 3.26Å; V331-E333 PolarHBondContact O-N 3.43Å; E333-S336 PolarHBondContact O-OG 2.85Å
334	I	97.6	Very high	95.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-50.9	168.6	-57.1	170.2	0	0	0	109.8	V185 W263 F318 L326 V331 S336 H337 F340	V185-I334 HydrophobicContact CG1-CG2 3.95Å; V185-I334 HydrophobicContact CG2-CG2 3.95Å; W263-I334 HydrophobicContact CD2-CD1 3.49Å; W263-I334 VanDerWaalsContact CD2-CD1 3.49Å; W263-I334 HydrophobicContact CE3-CD1 3.65Å; W263-I334 HydrophobicContact CG-CD1 4Å; W263-I334 HydrophobicContact CH2-CD1 4.08Å; W263-I334 HydrophobicContact CZ2-CD1 3.92Å; W263-I334 HydrophobicContact CZ3-CD1 3.94Å; F318-I334 HydrophobicContact CE1-CD1 3.84Å; F318-I334 HydrophobicContact CE1-CG1 3.92Å; F318-I334 HydrophobicContact CE1-CG2 4.49Å; F318-I334 HydrophobicContact CZ-CD1 4.2Å; F318-I334 HydrophobicContact CZ-CG1 4.15Å; F318-I334 HydrophobicContact CZ-CG2 3.87Å; L326-I334 HydrophobicContact CD2-CG1 4.13Å; L326-I334 HydrophobicContact CG-CG1 3.91Å; V331-I334 WeakPolarHBondContact O-CA 3.36Å; V331-I334 WeakPolarHBondContact O-CB 3.42Å; V331-I334 PolarHBondContact O-N 3.41Å; I334-S336 PolarHBondContact O-N 3.06Å; I334-S336 VanDerWaalsContact O-N 3.14Å; I334-H337 VanDerWaalsContact O-CB 3.3Å; I334-H337 WeakPolarHBondContact O-CB 3.36Å; I334-H337 PolarHBondContact O-N 3.46Å; I334-F340 HydrophobicContact CG2-CE2 3.62Å; I334-F340 HydrophobicContact CG2-CZ 4.1Å; I334-F340 VanDerWaalsContact O-CD2 3.31Å; I334-F340 WeakPolarHBondContact O-CD2 3.25Å; I334-F340 WeakPolarHBondContact O-CE2 3.35Å
335	K	97.1	Very high	95.4	Very high	53 Å²	53	54.8 Å²	54.8	23%	0.23	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-27.5	-178.3	-69	-166.8	173.8	-176.5	0	113.4	V331 S332 W347	V331-K335 HydrophobicContact CG1-CD 4.28Å; V331-K335 HydrophobicContact CG2-CG 4.26Å; V331-K335 PolarHBondContact O-N 3.19Å; S332-K335 PolarHBondContact O-N 2.97Å; K335-W347 HydrophobicContact CB-CD2 4.14Å; K335-W347 HydrophobicContact CB-CG 4.39Å; K335-W347 HydrophobicContact CB-CZ2 4.04Å; K335-W347 HydrophobicContact CD-CB 4.25Å; K335-W347 HydrophobicContact CD-CD2 3.8Å; K335-W347 HydrophobicContact CD-CE3 4.08Å; K335-W347 HydrophobicContact CD-CG 3.86Å; K335-W347 HydrophobicContact CG-CD2 3.68Å; K335-W347 HydrophobicContact CG-CE3 3.96Å; K335-W347 HydrophobicContact CG-CG 4.15Å; K335-W347 HydrophobicContact CG-CH2 4.2Å; K335-W347 HydrophobicContact CG-CZ2 3.95Å; K335-W347 HydrophobicContact CG-CZ3 4.19Å; K335-W347 PolarHBondContact O-NE1 2.84Å
336	S	96.2	Very high	95.2	Very high	89 Å²	89	58.2 Å²	58.2	62%	0.622	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.8	176.7	74.2	0	0	0	0	115.4	S332 E333 I334	S332-S336 WeakPolarHBondContact O-CB 3.47Å; S332-S336 PolarHBondContact O-N 3.32Å; S332-S336 PolarHBondContact O-OG 3.4Å; E333-S336 PolarHBondContact O-OG 2.85Å; I334-S336 PolarHBondContact O-N 3.06Å; I334-S336 VanDerWaalsContact O-N 3.14Å
337	H	97.8	Very high	95.1	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.037	32%	0.321	C	S	.	.			trans	-70.6	134.7	-169.4	-154.5	-92.9	0	0	0	112.7	D313 I314 K317 I334 F339 F340	D313-H337 IonicContact OD2-CE1 3.31Å; D313-H337 PolarHBondContact OD2-CE1 2.76Å; D313-H337 IonicContact OD2-NE2 2.73Å; D313-H337 PolarHBondContact OD2-NE2 3.3Å; I314-H337 WeakPolarHBondContact CB-ND1 3.45Å; I314-H337 HydrophobicContact CD1-CB 3.94Å; I314-H337 HydrophobicContact CG1-CB 4.49Å; K317-H337 VanDerWaalsContact CD-NE2 3.32Å; K317-H337 WeakPolarHBondContact CD-NE2 3.36Å; K317-H337 PolarHBondContact NZ-NE2 3.45Å; I334-H337 VanDerWaalsContact O-CB 3.3Å; I334-H337 WeakPolarHBondContact O-CB 3.36Å; I334-H337 PolarHBondContact O-N 3.46Å; H337-F339 PolarHBondContact O-N 2.68Å; H337-F340 HydrophobicContact CB-CD2 4Å; H337-F340 HydrophobicContact CB-CE2 4.3Å; H337-F340 PolarHBondContact O-N 3.48Å
338	P	97.1	Very high	95	Very high	75 Å²	75	66 Å²	66	49%	0.487	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-20.3	179.6	-29.9	36.4	0	0	0	115.7
339	F	97.4	Very high	95.1	Very high	1 Å²	1	62.1 Å²	62.1	0%	0.004	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-41.7	172.4	174.8	-111.4	0	0	0	112.6	E174 K178 L270 A311 I314 H337 V341	E174-F339 HydrophobicContact CG-CE2 3.77Å; K178-F339 HydrophobicContact CB-CE1 4.1Å; K178-F339 HydrophobicContact CB-CE2 4.42Å; K178-F339 HydrophobicContact CB-CZ 3.81Å; K178-F339 VanDerWaalsContact CD-O 3.25Å; K178-F339 WeakPolarHBondContact CD-O 3.43Å; K178-F339 WeakPolarHBondContact CE-O 3.43Å; K178-F339 HydrophobicContact CG-CD1 4.36Å; K178-F339 HydrophobicContact CG-CE1 3.99Å; K178-F339 HydrophobicContact CG-CZ 4.1Å; K178-F339 PolarHBondContact NZ-O 3.05Å; L270-F339 HydrophobicContact CD1-CE1 4.1Å; L270-F339 HydrophobicContact CD1-CZ 3.68Å; L270-F339 HydrophobicContact CD2-CD1 4.29Å; L270-F339 HydrophobicContact CD2-CE1 3.75Å; L270-F339 HydrophobicContact CD2-CZ 3.98Å; L270-F339 HydrophobicContact CG-CZ 4.48Å; A311-F339 HydrophobicContact CB-CD2 3.88Å; A311-F339 HydrophobicContact CB-CE2 3.82Å; I314-F339 HydrophobicContact CB-CB 4.23Å; I314-F339 HydrophobicContact CD1-CB 4.16Å; I314-F339 HydrophobicContact CD1-CD1 3.96Å; I314-F339 HydrophobicContact CD1-CG 4.4Å; I314-F339 HydrophobicContact CG2-CB 4.03Å; I314-F339 HydrophobicContact CG2-CD1 4.01Å; I314-F339 HydrophobicContact CG2-CD2 4.36Å; I314-F339 HydrophobicContact CG2-CG 3.87Å; H337-F339 PolarHBondContact O-N 2.68Å; F339-V341 VanDerWaalsContact C-N 3.33Å; F339-V341 PolarHBondContact O-N 3.33Å
340	F	97.5	Very high	95.3	Very high	6 Å²	6	56.2 Å²	56.2	3%	0.026	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-8.2	-175.2	-61.6	-70	0	0	0	114.3	K178 T181 A182 I314 I334 H337 N342 W345 W347	K178-F340 HydrophobicContact CG-CD1 4.06Å; T181-F340 HydrophobicContact CG2-CE1 3.83Å; T181-F340 HydrophobicContact CG2-CZ 3.79Å; A182-F340 HydrophobicContact CB-CD1 4.21Å; A182-F340 HydrophobicContact CB-CE1 4.23Å; I314-F340 HydrophobicContact CD1-CD2 4.2Å; I314-F340 HydrophobicContact CD1-CE2 3.38Å; I314-F340 HydrophobicContact CD1-CZ 3.78Å; I334-F340 HydrophobicContact CG2-CE2 3.62Å; I334-F340 HydrophobicContact CG2-CZ 4.1Å; I334-F340 VanDerWaalsContact O-CD2 3.31Å; I334-F340 WeakPolarHBondContact O-CD2 3.25Å; I334-F340 WeakPolarHBondContact O-CE2 3.35Å; H337-F340 HydrophobicContact CB-CD2 4Å; H337-F340 HydrophobicContact CB-CE2 4.3Å; H337-F340 PolarHBondContact O-N 3.48Å; F340-N342 PolarHBondContact O-N 3.16Å; F340-N342 PolarHBondContact O-ND2 3.29Å; F340-W345 HydrophobicContact CB-CH2 4.3Å; F340-W345 HydrophobicContact CD1-CH2 4.13Å; F340-W347 HydrophobicContact CB-CH2 4.47Å; F340-W347 HydrophobicContact CB-CZ2 3.69Å; F340-W347 AromaticContact CD1-CH2 3.87Å; F340-W347 HydrophobicContact CD1-CH2 3.87Å; F340-W347 AromaticContact CD1-CZ2 3.93Å; F340-W347 HydrophobicContact CD1-CZ2 3.93Å; F340-W347 AromaticContact CD2-CH2 3.99Å; F340-W347 HydrophobicContact CD2-CH2 3.99Å; F340-W347 AromaticContact CD2-CZ2 3.62Å; F340-W347 HydrophobicContact CD2-CZ2 3.62Å; F340-W347 AromaticContact CE1-CH2 3.99Å; F340-W347 HydrophobicContact CE1-CH2 3.99Å; F340-W347 HydrophobicContact CE1-CZ2 4.45Å; F340-W347 HydrophobicContact CE2-CH2 4.1Å; F340-W347 HydrophobicContact CE2-CZ2 4.17Å; F340-W347 AromaticContact CG-CH2 3.86Å; F340-W347 HydrophobicContact CG-CH2 3.86Å; F340-W347 AromaticContact CG-CZ2 3.47Å; F340-W347 HydrophobicContact CG-CZ2 3.47Å; F340-W347 VanDerWaalsContact CG-CZ2 3.47Å; F340-W347 HydrophobicContact CZ-CH2 4.1Å
341	V	95.3	Very high	95.3	Very high	108 Å²	108	57.8 Å²	57.8	66%	0.655	32%	0.319	S	S	*	.			trans	-59.1	123.5	173.9	179.7	0	0	0	0	109.2	K178 F339	K178-V341 PolarHBondContact NZ-O 2.87Å; F339-V341 VanDerWaalsContact C-N 3.33Å; F339-V341 PolarHBondContact O-N 3.33Å
342	N	94.2	Very high	95	Very high	41 Å²	41	63.4 Å²	63.4	22%	0.219	35%	0.348	C	S	.	.			trans	-158	173.4	-175.6	82	94.5	0	0	0	110.5	K178 F340 E344 W345	K178-N342 HydrophobicContact CD-CB 3.96Å; F340-N342 PolarHBondContact O-N 3.16Å; F340-N342 PolarHBondContact O-ND2 3.29Å; N342-E344 PolarHBondContact OD1-N 3.16Å; N342-W345 PolarHBondContact ND2-O 3.29Å; N342-W345 PolarHBondContact OD1-N 3.46Å; N342-W345 PolarHBondContact OD1-O 3.33Å
343	D	93.3	Very high	94.9	Very high	169 Å²	169	60.5 Å²	60.5	90%	0.904	33%	0.327	S	S	*	.	S	Bend	trans	-108.6	-1.3	-168.1	-53.3	58.1	0	0	0	113
344	E	91.9	Very high	94.7	Very high	115 Å²	115	67.4 Å²	67.4	54%	0.537	35%	0.351	S	S	.	.	S	Bend	trans	-118.6	-30.7	-164.6	-62.1	-171.9	145.9	0	0	114.3	K175 N342	K175-E344 WeakPolarHBondContact CE-OE1 3.49Å; K175-E344 WeakPolarHBondContact CE-OE2 3.31Å; K175-E344 IonicContact NZ-OE1 3.58Å; K175-E344 PolarHBondContact NZ-OE1 3.32Å; K175-E344 IonicContact NZ-OE2 3.85Å; K175-E344 PolarHBondContact NZ-OE2 3.48Å; N342-E344 PolarHBondContact OD1-N 3.16Å
345	W	95.7	Very high	94.6	Very high	20 Å²	20	67.6 Å²	67.6	8%	0.076	35%	0.352	C	S	.	.			trans	-148.2	153.4	-178.8	54.3	-97.6	0	0	0	112.4	K178 F179 A182 F340 N342 I350 T353	K178-W345 HydrophobicContact CD-CZ2 4.12Å; K178-W345 HydrophobicContact CG-CH2 4.37Å; K178-W345 HydrophobicContact CG-CZ2 3.94Å; F179-W345 AromaticContact CD2-CD1 3.85Å; F179-W345 AromaticContact CD2-NE1 3.72Å; A182-W345 HydrophobicContact CB-CH2 3.38Å; A182-W345 HydrophobicContact CB-CZ2 4Å; A182-W345 HydrophobicContact CB-CZ3 3.78Å; F340-W345 HydrophobicContact CB-CH2 4.3Å; F340-W345 HydrophobicContact CD1-CH2 4.13Å; N342-W345 PolarHBondContact ND2-O 3.29Å; N342-W345 PolarHBondContact OD1-N 3.46Å; N342-W345 PolarHBondContact OD1-O 3.33Å; W345-I350 HydrophobicContact CB-CB 4.03Å; W345-I350 HydrophobicContact CB-CG1 4.17Å; W345-I350 HydrophobicContact CD2-CB 4.24Å; W345-I350 HydrophobicContact CD2-CD1 3.76Å; W345-I350 HydrophobicContact CD2-CG1 3.94Å; W345-I350 HydrophobicContact CE3-CB 4.11Å; W345-I350 HydrophobicContact CE3-CD1 3.82Å; W345-I350 HydrophobicContact CE3-CG1 4.18Å; W345-I350 HydrophobicContact CG-CB 4.23Å; W345-I350 HydrophobicContact CG-CD1 4.26Å; W345-I350 HydrophobicContact CG-CG1 3.94Å; W345-I350 HydrophobicContact CH2-CD1 4.41Å; W345-I350 HydrophobicContact CZ2-CD1 4.33Å; W345-I350 HydrophobicContact CZ3-CD1 4.17Å; W345-T353 HydrophobicContact CB-CG2 3.77Å
346	D	93.8	Very high	94.4	Very high	74 Å²	74	66.3 Å²	66.3	40%	0.396	35%	0.349	S	S	.	.			trans	-114.5	175.7	164.3	68.3	68	0	0	0	110.9	D348 T349 I350	D346-D348 PolarHBondContact O-N 2.96Å; D346-D348 WeakPolarHBondContact OD1-CA 3.43Å; D346-D348 PolarHBondContact OD1-N 3.26Å; D346-T349 PolarHBondContact N-OG1 3.01Å; D346-T349 PolarHBondContact O-N 2.78Å; D346-T349 PolarHBondContact OD1-N 2.85Å; D346-T349 PolarHBondContact OD1-OG1 2.71Å; D346-T349 WeakPolarHBondContact OD2-CB 3.14Å; D346-T349 WeakPolarHBondContact OD2-CG2 3.29Å; D346-T349 PolarHBondContact OD2-OG1 3.07Å; D346-I350 WeakPolarHBondContact O-CB 3.24Å; D346-I350 PolarHBondContact O-N 3.34Å
347	W	95.4	Very high	94.3	Very high	43 Å²	43	63.2 Å²	63.2	16%	0.163	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.1	-174.2	-68.6	103.8	0	0	0	115.3	A182 V185 L186 K335 F340	A182-W347 HydrophobicContact CB-CE3 4.37Å; A182-W347 HydrophobicContact CB-CH2 3.79Å; A182-W347 HydrophobicContact CB-CZ3 3.62Å; V185-W347 HydrophobicContact CB-CZ3 4.28Å; V185-W347 HydrophobicContact CG1-CH2 4.27Å; V185-W347 HydrophobicContact CG1-CZ3 4.05Å; L186-W347 HydrophobicContact CD1-CE3 4.19Å; L186-W347 HydrophobicContact CD2-CE3 4.03Å; L186-W347 HydrophobicContact CG-CE3 4.02Å; L186-W347 HydrophobicContact CG-CZ3 4.3Å; K335-W347 HydrophobicContact CB-CD2 4.14Å; K335-W347 HydrophobicContact CB-CG 4.39Å; K335-W347 HydrophobicContact CB-CZ2 4.04Å; K335-W347 HydrophobicContact CD-CB 4.25Å; K335-W347 HydrophobicContact CD-CD2 3.8Å; K335-W347 HydrophobicContact CD-CE3 4.08Å; K335-W347 HydrophobicContact CD-CG 3.86Å; K335-W347 HydrophobicContact CG-CD2 3.68Å; K335-W347 HydrophobicContact CG-CE3 3.96Å; K335-W347 HydrophobicContact CG-CG 4.15Å; K335-W347 HydrophobicContact CG-CH2 4.2Å; K335-W347 HydrophobicContact CG-CZ2 3.95Å; K335-W347 HydrophobicContact CG-CZ3 4.19Å; K335-W347 PolarHBondContact O-NE1 2.84Å; F340-W347 HydrophobicContact CB-CH2 4.47Å; F340-W347 HydrophobicContact CB-CZ2 3.69Å; F340-W347 AromaticContact CD1-CH2 3.87Å; F340-W347 HydrophobicContact CD1-CH2 3.87Å; F340-W347 AromaticContact CD1-CZ2 3.93Å; F340-W347 HydrophobicContact CD1-CZ2 3.93Å; F340-W347 AromaticContact CD2-CH2 3.99Å; F340-W347 HydrophobicContact CD2-CH2 3.99Å; F340-W347 AromaticContact CD2-CZ2 3.62Å; F340-W347 HydrophobicContact CD2-CZ2 3.62Å; F340-W347 AromaticContact CE1-CH2 3.99Å; F340-W347 HydrophobicContact CE1-CH2 3.99Å; F340-W347 HydrophobicContact CE1-CZ2 4.45Å; F340-W347 HydrophobicContact CE2-CH2 4.1Å; F340-W347 HydrophobicContact CE2-CZ2 4.17Å; F340-W347 AromaticContact CG-CH2 3.86Å; F340-W347 HydrophobicContact CG-CH2 3.86Å; F340-W347 AromaticContact CG-CZ2 3.47Å; F340-W347 HydrophobicContact CG-CZ2 3.47Å; F340-W347 VanDerWaalsContact CG-CZ2 3.47Å; F340-W347 HydrophobicContact CZ-CH2 4.1Å
348	D	92.6	Very high	94.2	Very high	144 Å²	144	65.8 Å²	65.8	77%	0.77	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-24.9	178.7	-57.5	-32.8	0	0	0	111	D346	D346-D348 PolarHBondContact O-N 2.96Å; D346-D348 WeakPolarHBondContact OD1-CA 3.43Å; D346-D348 PolarHBondContact OD1-N 3.26Å
349	T	92.9	Very high	93.9	Very high	57 Å²	57	63.1 Å²	63.1	35%	0.35	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-20.3	179.3	59.7	0	0	0	0	115.6	D346 Q351 N352 T353	D346-T349 PolarHBondContact N-OG1 3.01Å; D346-T349 PolarHBondContact O-N 2.78Å; D346-T349 PolarHBondContact OD1-N 2.85Å; D346-T349 PolarHBondContact OD1-OG1 2.71Å; D346-T349 WeakPolarHBondContact OD2-CB 3.14Å; D346-T349 WeakPolarHBondContact OD2-CG2 3.29Å; D346-T349 PolarHBondContact OD2-OG1 3.07Å; T349-Q351 VanDerWaalsContact C-N 3.26Å; T349-Q351 PolarHBondContact O-N 3.45Å; T349-N352 WeakPolarHBondContact O-CA 3.36Å; T349-N352 WeakPolarHBondContact O-CB 3.33Å; T349-N352 PolarHBondContact O-N 2.91Å; T349-T353 PolarHBondContact O-N 2.84Å
350	I	95.6	Very high	93.6	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-46.9	-42.2	-172.2	-171.4	174.2	0	0	0	114.5	W137 F179 A182 E183 L186 W345 D346 N352 T353	W137-I350 HydrophobicContact CH2-CG2 4.05Å; F179-I350 HydrophobicContact CD2-CD1 3.9Å; F179-I350 HydrophobicContact CD2-CG1 3.9Å; F179-I350 HydrophobicContact CE2-CD1 4Å; F179-I350 HydrophobicContact CE2-CG1 3.54Å; F179-I350 HydrophobicContact CG-CD1 4.36Å; F179-I350 HydrophobicContact CZ-CG1 4.13Å; A182-I350 HydrophobicContact CB-CD1 3.75Å; E183-I350 HydrophobicContact CG-CD1 3.81Å; E183-I350 HydrophobicContact CG-CG1 4.36Å; L186-I350 HydrophobicContact CD1-CG2 3.66Å; W345-I350 HydrophobicContact CB-CB 4.03Å; W345-I350 HydrophobicContact CB-CG1 4.17Å; W345-I350 HydrophobicContact CD2-CB 4.24Å; W345-I350 HydrophobicContact CD2-CD1 3.76Å; W345-I350 HydrophobicContact CD2-CG1 3.94Å; W345-I350 HydrophobicContact CE3-CB 4.11Å; W345-I350 HydrophobicContact CE3-CD1 3.82Å; W345-I350 HydrophobicContact CE3-CG1 4.18Å; W345-I350 HydrophobicContact CG-CB 4.23Å; W345-I350 HydrophobicContact CG-CD1 4.26Å; W345-I350 HydrophobicContact CG-CG1 3.94Å; W345-I350 HydrophobicContact CH2-CD1 4.41Å; W345-I350 HydrophobicContact CZ2-CD1 4.33Å; W345-I350 HydrophobicContact CZ3-CD1 4.17Å; D346-I350 WeakPolarHBondContact O-CB 3.24Å; D346-I350 PolarHBondContact O-N 3.34Å; I350-N352 PolarHBondContact O-N 2.61Å; I350-N352 VanDerWaalsContact O-N 3.14Å; I350-T353 PolarHBondContact O-N 3.17Å; I350-T353 PolarHBondContact O-OG1 2.88Å
351	Q	91.5	Very high	93.4	Very high	56 Å²	56	70.8 Å²	70.8	26%	0.262	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-65	-15.8	179.5	-160.7	-83.6	-37	0	0	114.1	W137 H213 T349	W137-Q351 HydrophobicContact CH2-CB 3.89Å; W137-Q351 HydrophobicContact CH2-CG 4.18Å; W137-Q351 HydrophobicContact CZ2-CB 4.23Å; W137-Q351 HydrophobicContact CZ2-CG 4.45Å; H213-Q351 PolarHBondContact CE1-O 3.43Å; H213-Q351 PolarHBondContact NE2-O 3.08Å; T349-Q351 VanDerWaalsContact C-N 3.26Å; T349-Q351 PolarHBondContact O-N 3.45Å
352	N	90.7	Very high	93.3	Very high	134 Å²	134	70.5 Å²	70.5	72%	0.717	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-101.9	-3.7	175.5	-61.4	-89.7	0	0	0	112.7	T349 I350	T349-N352 WeakPolarHBondContact O-CA 3.36Å; T349-N352 WeakPolarHBondContact O-CB 3.33Å; T349-N352 PolarHBondContact O-N 2.91Å; I350-N352 PolarHBondContact O-N 2.61Å; I350-N352 VanDerWaalsContact O-N 3.14Å
353	T	93.1	Very high	93.2	Very high	30 Å²	30	70.1 Å²	70.1	18%	0.184	38%	0.375	C	S	.	.	S	Bend	trans	-92.3	152.8	178.8	70.1	0	0	0	0	111.1	H213 W345 T349 I350 P355	H213-T353 PolarHBondContact CE1-O 3.46Å; H213-T353 VanDerWaalsContact CE1-O 3.22Å; W345-T353 HydrophobicContact CB-CG2 3.77Å; T349-T353 PolarHBondContact O-N 2.84Å; I350-T353 PolarHBondContact O-N 3.17Å; I350-T353 PolarHBondContact O-OG1 2.88Å; T353-P355 VanDerWaalsContact O-CD 3.23Å; T353-P355 WeakPolarHBondContact O-CD 3.38Å
354	R	92.7	Very high	93.1	Very high	192 Å²	192	66.3 Å²	66.3	73%	0.725	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-69.3	119.6	-176.5	-175.5	-167.8	176.5	-75.7	4.1	110.4	V358	R354-V358 HydrophobicContact CG-CG2 4.38Å
355	P	94.1	Very high	93.1	Very high	4 Å²	4	63.6 Å²	63.6	3%	0.026	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-62.7	162.8	179.5	-28.3	39.8	0	0	0	113.9	F179 L211 G212 H213 T353	F179-P355 HydrophobicContact CE1-CB 3.98Å; F179-P355 HydrophobicContact CE1-CG 4.41Å; F179-P355 HydrophobicContact CZ-CB 3.92Å; F179-P355 HydrophobicContact CZ-CG 3.99Å; L211-P355 WeakPolarHBondContact O-CD 3.36Å; L211-P355 WeakPolarHBondContact O-CG 3.44Å; G212-P355 WeakPolarHBondContact O-CB 3.25Å; H213-P355 VanDerWaalsContact CE1-CG 3.47Å; H213-P355 WeakPolarHBondContact CE1-CG 3.21Å; H213-P355 WeakPolarHBondContact NE2-CG 3.4Å; T353-P355 VanDerWaalsContact O-CD 3.23Å; T353-P355 WeakPolarHBondContact O-CD 3.38Å
356	P	94.5	Very high	93	Very high	26 Å²	26	63.4 Å²	63.4	17%	0.169	34%	0.344	C	S	.	.	S	Bend	trans	-56.4	-56.3	176.4	-25	33.9	0	0	0	112.8	W176 F179 Y180	W176-P356 HydrophobicContact CB-CB 4.13Å; W176-P356 HydrophobicContact CB-CG 4.21Å; W176-P356 HydrophobicContact CD2-CB 3.56Å; W176-P356 HydrophobicContact CE3-CB 4.17Å; W176-P356 HydrophobicContact CG-CB 3.52Å; W176-P356 HydrophobicContact CG-CG 4.05Å; W176-P356 HydrophobicContact CZ2-CB 4.41Å; F179-P356 HydrophobicContact CB-CG 4.03Å; F179-P356 HydrophobicContact CD1-CG 3.81Å; F179-P356 HydrophobicContact CE1-CG 4.46Å; F179-P356 HydrophobicContact CG-CG 3.91Å; Y180-P356 HydrophobicContact CE1-CG 4.49Å; Y180-P356 HydrophobicContact CE2-CB 4.08Å; Y180-P356 HydrophobicContact CE2-CG 3.88Å
357	V	93.8	Very high	93	Very high	24 Å²	24	61.2 Å²	61.2	15%	0.145	33%	0.334	C	S	.	.			trans	-109.2	123	175	-176.8	0	0	0	0	109	L166 Y170 W176 Y180 G212	L166-V357 HydrophobicContact CD1-CB 4.08Å; L166-V357 HydrophobicContact CD1-CG2 3.9Å; Y170-V357 HydrophobicContact CE2-CG1 4.44Å; Y170-V357 HydrophobicContact CE2-CG2 4.35Å; W176-V357 HydrophobicContact CE3-CG2 4.05Å; W176-V357 HydrophobicContact CH2-CG2 3.53Å; W176-V357 HydrophobicContact CZ2-CG2 4.37Å; W176-V357 HydrophobicContact CZ3-CG2 3.34Å; Y180-V357 PolarHBondContact OH-N 3.48Å; G212-V357 WeakPolarHBondContact CA-O 3.25Å
358	V	94.2	Very high	92.8	Very high	61 Å²	61	65 Å²	65	37%	0.37	35%	0.348	S	S	.	.			trans	-108.9	119.2	169.1	-177.1	0	0	0	0	106.8	R354 D360	R354-V358 HydrophobicContact CG-CG2 4.38Å; V358-D360 PolarHBondContact O-N 3.14Å
359	P	92.3	Very high	92.8	Very high	20 Å²	20	59.9 Å²	59.9	13%	0.13	32%	0.321	C	S	.	.			trans	-61.4	129.7	-177.5	-25	34.6	0	0	0	112.8	I208 L361	I208-P359 HydrophobicContact CG2-CG 4.26Å; P359-L361 HydrophobicContact CB-CD1 4.38Å; P359-L361 HydrophobicContact CB-CD2 3.93Å; P359-L361 HydrophobicContact CB-CG 4.01Å
360	D	91.1	Very high	92.7	Very high	117 Å²	117	58.5 Å²	58.5	63%	0.626	31%	0.31	S	S	*	.			trans	-78.2	119.2	165.2	176.3	62.7	0	0	0	109.2	V358 R368	V358-D360 PolarHBondContact O-N 3.14Å; D360-R368 PolarHBondContact O-NE 3.44Å; D360-R368 PolarHBondContact O-NH1 3.48Å; D360-R368 PolarHBondContact O-NH2 3.16Å; D360-R368 IonicContact OD2-CZ 3.92Å; D360-R368 IonicContact OD2-NH1 2.66Å; D360-R368 PolarHBondContact OD2-NH1 3.2Å; D360-R368 IonicContact OD2-NH2 3.02Å
361	L	92.6	Very high	92.2	Very high	50 Å²	50	65 Å²	65	26%	0.262	35%	0.345	S	S	.	.			trans	-127.9	131.3	-171.7	-58.4	174.9	0	0	0	110.3	P159 A210 P359 D366	P159-L361 HydrophobicContact CB-CD1 3.69Å; P159-L361 HydrophobicContact CB-CD2 3.94Å; P159-L361 HydrophobicContact CB-CG 4.49Å; P159-L361 HydrophobicContact CG-CD1 3.52Å; A210-L361 HydrophobicContact CB-CD1 4.09Å; P359-L361 HydrophobicContact CB-CD1 4.38Å; P359-L361 HydrophobicContact CB-CD2 3.93Å; P359-L361 HydrophobicContact CB-CG 4.01Å; L361-D366 HydrophobicContact CB-CB 4.49Å; L361-D366 HydrophobicContact CD2-CB 4.31Å
362	S	92.5	Very high	91.9	Very high	102 Å²	102	68.8 Å²	68.8	71%	0.713	37%	0.366	S	S	*	.	S	Bend	trans	-85.6	-11.4	-179.3	60.4	0	0	0	0	114	D366	S362-D366 WeakPolarHBondContact CB-OD2 3.37Å; S362-D366 PolarHBondContact N-OD2 3.2Å; S362-D366 PolarHBondContact OG-OD2 3.31Å
363	G	91.8	Very high	91.6	Very high	34 Å²	34	65 Å²	65	35%	0.351	35%	0.346	S	S	.	.	S	Bend	trans	-178	178.9	-177.5	0	0	0	0	0	112.2	D365 D366	G363-D365 VanDerWaalsContact C-N 3.28Å; G363-D365 PolarHBondContact O-N 3.49Å; G363-D366 PolarHBondContact O-N 3.29Å
364	D	92.7	Very high	90.9	Very high	88 Å²	88	71.5 Å²	71.5	47%	0.471	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8	179.9	68	-31.8	0	0	0	113.9	R96 V103	R96-D364 IonicContact CZ-OD1 2.71Å; R96-D364 IonicContact CZ-OD2 2.72Å; R96-D364 IonicContact NH1-OD1 2.76Å; R96-D364 PolarHBondContact NH1-OD1 3.44Å; R96-D364 IonicContact NH1-OD2 2.82Å; R96-D364 PolarHBondContact NH1-OD2 3.1Å; R96-D364 IonicContact NH2-OD1 2.64Å; R96-D364 PolarHBondContact NH2-OD1 2.91Å; R96-D364 IonicContact NH2-OD2 3.86Å; V103-D364 WeakPolarHBondContact CG1-O 3.41Å; V103-D364 HydrophobicContact CG2-CB 4.38Å; V103-D364 WeakPolarHBondContact CG2-OD2 3.36Å
365	D	92.1	Very high	89.8	Confident	59 Å²	59	71.5 Å²	71.5	32%	0.316	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	21.4	170.6	56.8	7.7	0	0	0	114.4	I81 L94 R96 V103 G363 T367	I81-D365 HydrophobicContact CD1-CB 3.51Å; I81-D365 HydrophobicContact CG2-CB 4.34Å; L94-D365 HydrophobicContact CD2-CB 3.97Å; R96-D365 IonicContact CZ-OD2 2.68Å; R96-D365 IonicContact NE-OD2 3.62Å; R96-D365 IonicContact NH2-OD1 2.65Å; R96-D365 IonicContact NH2-OD2 2.62Å; R96-D365 PolarHBondContact NH2-OD2 3.1Å; V103-D365 HydrophobicContact CG2-CB 4.12Å; G363-D365 VanDerWaalsContact C-N 3.28Å; G363-D365 PolarHBondContact O-N 3.49Å; D365-T367 PolarHBondContact O-N 2.97Å
366	D	93.7	Very high	88.5	Confident	15 Å²	15	77.2 Å²	77.2	8%	0.08	41%	0.406	C	S	.	.			trans	-63.5	129.1	170.2	-165	-34.3	0	0	0	110.6	Y157 L361 S362 G363 R368	Y157-D366 WeakPolarHBondContact CE1-O 3.2Å; Y157-D366 PolarHBondContact OH-O 3.25Å; L361-D366 HydrophobicContact CB-CB 4.49Å; L361-D366 HydrophobicContact CD2-CB 4.31Å; S362-D366 WeakPolarHBondContact CB-OD2 3.37Å; S362-D366 PolarHBondContact N-OD2 3.2Å; S362-D366 PolarHBondContact OG-OD2 3.31Å; G363-D366 PolarHBondContact O-N 3.29Å; D366-R368 WeakPolarHBondContact OD1-CB 3.4Å; D366-R368 WeakPolarHBondContact OD1-CG 3.43Å; D366-R368 PolarHBondContact OD1-N 3.46Å; D366-R368 IonicContact OD1-NE 3.23Å; D366-R368 PolarHBondContact OD1-NE 3Å; D366-R368 IonicContact OD2-CZ 2.62Å; D366-R368 VanDerWaalsContact OD2-CZ 3.28Å; D366-R368 IonicContact OD2-NE 3.33Å; D366-R368 PolarHBondContact OD2-NE 3.43Å; D366-R368 IonicContact OD2-NH2 2.62Å; D366-R368 PolarHBondContact OD2-NH2 3.04Å
367	T	92.9	Very high	86.8	Confident	29 Å²	29	82.4 Å²	82.4	18%	0.178	44%	0.437	C	S	.	.			trans	-125	22.7	-176.1	47.4	0	0	0	0	112.6	K82 I84 L94 Y157 D365 N369 F370	K82-T367 HydrophobicContact CB-CG2 4.35Å; K82-T367 HydrophobicContact CD-CG2 3.93Å; K82-T367 WeakPolarHBondContact CD-OG1 3.27Å; I84-T367 HydrophobicContact CG2-CG2 3.96Å; L94-T367 HydrophobicContact CD2-CG2 3.36Å; Y157-T367 WeakPolarHBondContact OH-CG2 3.39Å; D365-T367 PolarHBondContact O-N 2.97Å; T367-N369 PolarHBondContact O-N 3.31Å; T367-F370 PolarHBondContact O-N 2.89Å; T367-F370 VanDerWaalsContact O-N 3.14Å
368	R	91.5	Very high	85.2	Confident	123 Å²	123	85.6 Å²	85.6	46%	0.464	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.4	-178.4	72.3	178.2	73	172.3	9.8	113.9	D360 D366 F370	D360-R368 PolarHBondContact O-NE 3.44Å; D360-R368 PolarHBondContact O-NH1 3.48Å; D360-R368 PolarHBondContact O-NH2 3.16Å; D360-R368 IonicContact OD2-CZ 3.92Å; D360-R368 IonicContact OD2-NH1 2.66Å; D360-R368 PolarHBondContact OD2-NH1 3.2Å; D360-R368 IonicContact OD2-NH2 3.02Å; D366-R368 WeakPolarHBondContact OD1-CB 3.4Å; D366-R368 WeakPolarHBondContact OD1-CG 3.43Å; D366-R368 PolarHBondContact OD1-N 3.46Å; D366-R368 IonicContact OD1-NE 3.23Å; D366-R368 PolarHBondContact OD1-NE 3Å; D366-R368 IonicContact OD2-CZ 2.62Å; D366-R368 VanDerWaalsContact OD2-CZ 3.28Å; D366-R368 IonicContact OD2-NE 3.33Å; D366-R368 PolarHBondContact OD2-NE 3.43Å; D366-R368 IonicContact OD2-NH2 2.62Å; D366-R368 PolarHBondContact OD2-NH2 3.04Å; R368-F370 VanDerWaalsContact C-N 3.27Å; R368-F370 PolarHBondContact O-N 3.46Å
369	N	91.9	Very high	83.9	Confident	36 Å²	36	88.3 Å²	88.3	19%	0.193	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	19.3	179.8	-51.6	-50.8	0	0	0	112.9	P159 G160 G161 T367	P159-N369 PolarHBondContact O-ND2 3.02Å; G160-N369 WeakPolarHBondContact O-CB 3.26Å; G161-N369 WeakPolarHBondContact CA-O 3.37Å; T367-N369 PolarHBondContact O-N 3.31Å
370	F	90.4	Very high	82.8	Confident	27 Å²	27	91.3 Å²	91.3	12%	0.118	49%	0.488	C	S	.	.	S	Bend	trans	-134.8	126.5	180	-73.6	-89.4	0	0	0	110.6	K82 I84 Y157 M158 T367 R368	K82-F370 PolarHBondContact NZ-O 2.97Å; I84-F370 HydrophobicContact CB-CB 4.45Å; I84-F370 HydrophobicContact CB-CD1 3.82Å; I84-F370 HydrophobicContact CB-CE1 4.27Å; I84-F370 HydrophobicContact CB-CG 4.16Å; I84-F370 HydrophobicContact CD1-CE1 4.33Å; I84-F370 HydrophobicContact CG2-CB 4.39Å; I84-F370 HydrophobicContact CG2-CD1 4.47Å; I84-F370 HydrophobicContact CG2-CG 4.32Å; I84-F370 WeakPolarHBondContact O-CD1 3.44Å; Y157-F370 HydrophobicContact CE2-CD2 4.34Å; Y157-F370 AromaticContact CE2-CE2 3.58Å; Y157-F370 HydrophobicContact CE2-CE2 3.58Å; Y157-F370 AromaticContact CE2-CZ 3.81Å; Y157-F370 HydrophobicContact CE2-CZ 3.81Å; Y157-F370 AromaticContact CZ-CE2 3.72Å; Y157-F370 VanDerWaalsContact OH-CD2 3.22Å; Y157-F370 WeakPolarHBondContact OH-CD2 3.23Å; Y157-F370 WeakPolarHBondContact OH-CE2 3.49Å; M158-F370 VanDerWaalsContact O-CE2 3.29Å; M158-F370 WeakPolarHBondContact O-CE2 3.32Å; M158-F370 WeakPolarHBondContact O-CZ 3.4Å; T367-F370 PolarHBondContact O-N 2.89Å; T367-F370 VanDerWaalsContact O-N 3.14Å; R368-F370 VanDerWaalsContact C-N 3.27Å; R368-F370 PolarHBondContact O-N 3.46Å
371	D	86.9	Confident	82.2	Confident	138 Å²	138	90.9 Å²	90.9	74%	0.738	48%	0.482	S	S	*	.			trans	-57.2	161.4	179.4	-89.8	-37.9	0	0	0	114.5	K82 I373	K82-D371 PolarHBondContact NZ-O 3.3Å; D371-I373 PolarHBondContact O-N 3.44Å
372	N	85	Confident	81.7	Confident	135 Å²	135	91.8 Å²	91.8	72%	0.722	49%	0.492	S	S	*	.			trans	-90.7	88	-179.6	-70	-41.6	0	0	0	110.9	K82 E374	K82-N372 VanDerWaalsContact CE-OD1 3.24Å; K82-N372 WeakPolarHBondContact CE-OD1 3.25Å; K82-N372 PolarHBondContact NZ-OD1 2.76Å; N372-E374 PolarHBondContact O-N 3.02Å
373	I	84.7	Confident	81.4	Confident	55 Å²	55	89.2 Å²	89.2	28%	0.282	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-67.1	125.4	-178.7	-61.4	175.5	0	0	0	111	V83 I84 G85 R86 D371	V83-I373 HydrophobicContact CG1-CD1 4.36Å; V83-I373 HydrophobicContact CG1-CG2 4.37Å; I84-I373 VanDerWaalsContact C-CD1 3.44Å; G85-I373 VanDerWaalsContact C-CD1 3.42Å; G85-I373 VanDerWaalsContact N-CD1 3.27Å; R86-I373 HydrophobicContact CB-CG2 4.29Å; D371-I373 PolarHBondContact O-N 3.44Å
374	E	77.2	Confident	81.1	Confident	167 Å²	167	95.9 Å²	95.9	78%	0.78	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-63.2	148.2	177.7	-62.5	-164	154.7	0	0	112.2	R86 N372 E376	R86-E374 PolarHBondContact NH1-O 3.36Å; R86-E374 PolarHBondContact NH2-O 2.9Å; R86-E374 VanDerWaalsContact NH2-O 3.15Å; N372-E374 PolarHBondContact O-N 3.02Å; E374-E376 PolarHBondContact O-N 2.81Å
375	K	70.8	Confident	80.8	Confident	192 Å²	192	96.8 Å²	96.8	84%	0.835	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-76.1	120.8	174.9	-70.2	-178.1	179.7	176.9	0	109.4	T377	K375-T377 PolarHBondContact O-N 3.39Å
376	E	66.2	Low	80.5	Confident	123 Å²	123	94.9 Å²	94.9	58%	0.575	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-63.4	127.1	175.8	-169.3	168.9	-178.6	0	0	110.3	R86 E374 T378	R86-E376 IonicContact NE-OE2 4Å; E374-E376 PolarHBondContact O-N 2.81Å; E376-T378 WeakPolarHBondContact CG-OG1 3.48Å; E376-T378 PolarHBondContact OE1-OG1 2.79Å
377	T	58.1	Low	80.2	Confident	136 Å²	136	103.6 Å²	103.6	83%	0.834	53%	0.527	S	S	*	.			trans	-95.1	-9.8	-178	51.8	0	0	0	0	112.8	K375	K375-T377 PolarHBondContact O-N 3.39Å
378	T	61.6	Low	80	Confident	91 Å²	91	105.3 Å²	105.3	56%	0.558	54%	0.544	S	S	*	.	S	Bend	trans	-67.4	131.3	178.6	-27.6	0	0	0	0	111.2	E376 Q380	E376-T378 WeakPolarHBondContact CG-OG1 3.48Å; E376-T378 PolarHBondContact OE1-OG1 2.79Å; T378-Q380 PolarHBondContact O-N 3.25Å
379	P	66.2	Low	80.1	Confident	117 Å²	117	103.8 Å²	103.8	76%	0.76	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-63.1	124.4	169.8	-21.9	33.8	0	0	0	111.2	E381	P379-E381 PolarHBondContact O-N 3.19Å
380	Q	69.4	Low	79.9	Confident	84 Å²	84	104.5 Å²	104.5	39%	0.393	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-64.3	122.2	-179.6	-170.4	-172.5	15.4	0	0	111.6	N110 Y150 T378	N110-Q380 PolarHBondContact ND2-NE2 2.66Å; N110-Q380 VanDerWaalsContact ND2-NE2 3.16Å; Y150-Q380 VanDerWaalsContact CZ-NE2 3.33Å; Y150-Q380 VanDerWaalsContact OH-CD 3.27Å; Y150-Q380 PolarHBondContact OH-NE2 3.34Å; Y150-Q380 PolarHBondContact OH-OE1 3.37Å; T378-Q380 PolarHBondContact O-N 3.25Å
381	E	77.4	Confident	80	Confident	107 Å²	107	103.7 Å²	103.7	50%	0.5	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-63.7	153.8	171.6	-69.9	-176.4	-135.3	0	0	112.3	F112 K116 P379	F112-E381 HydrophobicContact CD1-CB 3.82Å; F112-E381 HydrophobicContact CE1-CB 3.36Å; F112-E381 HydrophobicContact CE1-CG 4.28Å; F112-E381 WeakPolarHBondContact CE1-OE2 3.47Å; F112-E381 HydrophobicContact CZ-CB 3.99Å; F112-E381 WeakPolarHBondContact CZ-OE2 3.33Å; K116-E381 IonicContact NZ-OE1 2.74Å; K116-E381 PolarHBondContact NZ-OE1 2.7Å; K116-E381 IonicContact NZ-OE2 3.65Å; K116-E381 PolarHBondContact NZ-OE2 2.91Å; P379-E381 PolarHBondContact O-N 3.19Å
382	S	82	Confident	80.2	Confident	69 Å²	69	98.4 Å²	98.4	48%	0.483	52%	0.523	S	S	.	.			trans	-152.3	161.5	-179.2	57	0	0	0	0	111.9	F112 Q384	F112-S382 VanDerWaalsContact CD2-C 3.44Å; S382-Q384 PolarHBondContact O-N 3.41Å
383	F	87	Confident	80.6	Confident	49 Å²	49	93 Å²	93	22%	0.215	49%	0.493	C	S	.	.			trans	-55.6	127.6	-179.1	-62.2	-74.2	0	0	0	111.9	K111 F112 I115 N392	K111-F383 HydrophobicContact CB-CE2 4Å; K111-F383 HydrophobicContact CB-CZ 4.11Å; F112-F383 HydrophobicContact CB-CD2 4.4Å; F112-F383 HydrophobicContact CB-CE1 4.31Å; F112-F383 HydrophobicContact CB-CE2 4.09Å; F112-F383 HydrophobicContact CB-CZ 4.05Å; F112-F383 AromaticContact CD2-CD1 3.76Å; F112-F383 HydrophobicContact CD2-CD1 3.76Å; F112-F383 HydrophobicContact CD2-CE1 4.05Å; F112-F383 HydrophobicContact CD2-CG 4.05Å; I115-F383 HydrophobicContact CB-CE1 4.27Å; I115-F383 HydrophobicContact CD1-CE1 3.92Å; I115-F383 HydrophobicContact CD1-CZ 3.92Å; I115-F383 HydrophobicContact CG2-CE1 4.46Å; F383-N392 HydrophobicContact CD1-CB 3.98Å; F383-N392 HydrophobicContact CE1-CB 3.89Å; F383-N392 HydrophobicContact CE2-CB 4.46Å; F383-N392 HydrophobicContact CG-CB 4.32Å; F383-N392 HydrophobicContact CZ-CB 4.14Å
384	Q	84.9	Confident	81	Confident	174 Å²	174	94 Å²	94	81%	0.813	50%	0.499	S	S	*	.			trans	-65.3	143.2	172	-61.5	-174.9	7.6	0	0	110.2	S382 P386	S382-Q384 PolarHBondContact O-N 3.41Å; Q384-P386 VanDerWaalsContact O-CD 3.28Å; Q384-P386 WeakPolarHBondContact O-CD 3.29Å; Q384-P386 VanDerWaalsContact O-N 3.12Å
385	V	87	Confident	81.7	Confident	106 Å²	106	88.2 Å²	88.2	64%	0.642	48%	0.476	S	S	*	.			trans	-60.5	114	178.3	178.4	0	0	0	0	109.5	F45	F45-V385 HydrophobicContact CD1-CG1 3.94Å
386	P	86.4	Confident	82.7	Confident	19 Å²	19	79 Å²	79	12%	0.123	44%	0.436	C	S	.	.			trans	-81.5	143.3	-167.7	34.8	-37.6	0	0	0	111.7	F45 Q384 A388 A390	F45-P386 HydrophobicContact CD1-CG 4.45Å; F45-P386 HydrophobicContact CD2-CG 3.44Å; F45-P386 VanDerWaalsContact CD2-CG 3.44Å; F45-P386 HydrophobicContact CE2-CG 3.53Å; F45-P386 HydrophobicContact CG-CG 3.93Å; F45-P386 HydrophobicContact CZ-CG 4.09Å; Q384-P386 VanDerWaalsContact O-CD 3.28Å; Q384-P386 WeakPolarHBondContact O-CD 3.29Å; Q384-P386 VanDerWaalsContact O-N 3.12Å; P386-A388 WeakPolarHBondContact CB-O 3.46Å; P386-A390 HydrophobicContact CB-CB 3.86Å; P386-A390 HydrophobicContact CG-CB 4.33Å
387	K	86.8	Confident	84	Confident	198 Å²	198	75.8 Å²	75.8	86%	0.861	42%	0.422	S	S	*	.	S	Bend	trans	-85.4	-17.3	179.9	-63.5	177.5	-176.2	171.7	0	113.3	A47	A47-K387 WeakPolarHBondContact CB-O 3.47Å
388	A	89.4	Confident	85.6	Confident	65 Å²	65	69.5 Å²	69.5	54%	0.537	38%	0.384	S	S	.	.	S	Bend	trans	-137.2	-179.1	175.2	0	0	0	0	0	108.4	P386 A390	P386-A388 WeakPolarHBondContact CB-O 3.46Å; A388-A390 PolarHBondContact O-N 3.34Å
389	F	92.1	Very high	87.1	Confident	91 Å²	91	65.2 Å²	65.2	40%	0.399	36%	0.358	S	S	.	.			trans	-74.2	115.3	-179.4	-179.8	-90.4	0	0	0	109.8	L39 D42 L48 L394	L39-F389 HydrophobicContact CD1-CE2 4.4Å; D42-F389 HydrophobicContact CB-CD2 4.25Å; D42-F389 HydrophobicContact CB-CE2 3.51Å; D42-F389 HydrophobicContact CB-CZ 3.96Å; L48-F389 HydrophobicContact CD1-CB 4.37Å; L48-F389 HydrophobicContact CD1-CD2 4.35Å; L48-F389 HydrophobicContact CD2-CB 4.33Å; F389-L394 HydrophobicContact CE1-CD1 3.95Å; F389-L394 HydrophobicContact CZ-CD1 4.11Å; F389-L394 HydrophobicContact CZ-CD2 4.45Å; F389-L394 HydrophobicContact CZ-CG 4.45Å
390	A	88.7	Confident	88.3	Confident	52 Å²	52	60.1 Å²	60.1	43%	0.43	32%	0.324	S	S	.	.			trans	-94.6	-25.9	-176.4	0	0	0	0	0	113.7	P386 A388 N392	P386-A390 HydrophobicContact CB-CB 3.86Å; P386-A390 HydrophobicContact CG-CB 4.33Å; A388-A390 PolarHBondContact O-N 3.34Å; A390-N392 VanDerWaalsContact C-N 3.35Å; A390-N392 PolarHBondContact O-N 3.42Å
391	G	91.7	Very high	89.3	Confident	9 Å²	9	56.8 Å²	56.8	9%	0.093	31%	0.308	C	S	.	.			trans	66.4	31.2	-179.6	0	0	0	0	0	114.4	D42 Q393 L394 P395	D42-G391 VanDerWaalsContact OD2-CA 3.25Å; D42-G391 WeakPolarHBondContact OD2-CA 3.35Å; G391-Q393 PolarHBondContact O-N 3.29Å; G391-L394 WeakPolarHBondContact O-CB 3.14Å; G391-L394 WeakPolarHBondContact O-CG 3.46Å; G391-L394 PolarHBondContact O-N 3.05Å; G391-L394 VanDerWaalsContact O-N 3.15Å; G391-P395 WeakPolarHBondContact O-CD 3.24Å
392	N	91.6	Very high	89.4	Confident	27 Å²	27	52.6 Å²	52.6	14%	0.144	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-23.2	-174.7	-68.6	-42.4	0	0	0	113.1	D42 I115 F383 A390 F396	D42-N392 VanDerWaalsContact CG-N 3.32Å; D42-N392 PolarHBondContact OD1-N 3.37Å; D42-N392 PolarHBondContact OD2-N 3.01Å; I115-N392 VanDerWaalsContact CD1-O 3.29Å; I115-N392 WeakPolarHBondContact CD1-O 3.37Å; F383-N392 HydrophobicContact CD1-CB 3.98Å; F383-N392 HydrophobicContact CE1-CB 3.89Å; F383-N392 HydrophobicContact CE2-CB 4.46Å; F383-N392 HydrophobicContact CG-CB 4.32Å; F383-N392 HydrophobicContact CZ-CB 4.14Å; A390-N392 VanDerWaalsContact C-N 3.35Å; A390-N392 PolarHBondContact O-N 3.42Å; N392-F396 VanDerWaalsContact O-CE2 3.29Å; N392-F396 WeakPolarHBondContact O-CE2 3.24Å
393	Q	92.9	Very high	88.6	Confident	22 Å²	22	55.9 Å²	55.9	10%	0.103	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-15.8	177.7	-55.5	-60.6	-30.6	0	0	112.6	A38 D42 A148 G391 F396	A38-Q393 HydrophobicContact CB-CB 3.69Å; D42-Q393 PolarHBondContact OD1-N 2.95Å; D42-Q393 WeakPolarHBondContact OD2-CA 3.46Å; D42-Q393 WeakPolarHBondContact OD2-CB 3.41Å; D42-Q393 PolarHBondContact OD2-N 2.96Å; A148-Q393 PolarHBondContact O-NE2 2.89Å; G391-Q393 PolarHBondContact O-N 3.29Å; Q393-F396 PolarHBondContact O-N 3.31Å
394	L	92.6	Very high	87.3	Confident	75 Å²	75	57.7 Å²	57.7	39%	0.393	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-58.5	-40.7	-176.3	-58.3	-176.9	0	0	0	115.1	F389 G391 F396 I397	F389-L394 HydrophobicContact CE1-CD1 3.95Å; F389-L394 HydrophobicContact CZ-CD1 4.11Å; F389-L394 HydrophobicContact CZ-CD2 4.45Å; F389-L394 HydrophobicContact CZ-CG 4.45Å; G391-L394 WeakPolarHBondContact O-CB 3.14Å; G391-L394 WeakPolarHBondContact O-CG 3.46Å; G391-L394 PolarHBondContact O-N 3.05Å; G391-L394 VanDerWaalsContact O-N 3.15Å; L394-F396 PolarHBondContact O-N 2.8Å; L394-I397 HydrophobicContact CB-CD1 4.38Å; L394-I397 HydrophobicContact CD2-CD1 3.61Å; L394-I397 WeakPolarHBondContact O-CG1 3.35Å; L394-I397 PolarHBondContact O-N 2.73Å
395	P	91.7	Very high	85.8	Confident	46 Å²	46	55 Å²	55	30%	0.299	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-61.9	-18	-179.7	-25	36.2	0	0	0	114.2	I115 W124 G391	I115-P395 HydrophobicContact CD1-CG 4.12Å; W124-P395 WeakPolarHBondContact CZ2-O 3.49Å; G391-P395 WeakPolarHBondContact O-CD 3.24Å
396	F	93.3	Very high	83.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-101.8	2	-174.5	-48.4	-66	0	0	0	113.2	K111 M114 I115 F123 Q146 L151 N392 Q393 L394 G398 F399	K111-F396 HydrophobicContact CB-CD2 4.41Å; K111-F396 HydrophobicContact CB-CE1 4.38Å; K111-F396 HydrophobicContact CB-CE2 3.6Å; K111-F396 HydrophobicContact CB-CZ 3.59Å; K111-F396 HydrophobicContact CD-CD2 3.63Å; K111-F396 HydrophobicContact CD-CE2 3.68Å; K111-F396 HydrophobicContact CD-CG 4.15Å; K111-F396 HydrophobicContact CD-CZ 4.25Å; K111-F396 HydrophobicContact CG-CD1 4.32Å; K111-F396 HydrophobicContact CG-CD2 3.93Å; K111-F396 HydrophobicContact CG-CE1 4.01Å; K111-F396 HydrophobicContact CG-CE2 3.59Å; K111-F396 HydrophobicContact CG-CG 4.28Å; K111-F396 HydrophobicContact CG-CZ 3.63Å; M114-F396 HydrophobicContact CE-CE1 4.14Å; M114-F396 HydrophobicContact SD-CE1 4.19Å; I115-F396 HydrophobicContact CD1-CE2 3.9Å; I115-F396 HydrophobicContact CD1-CZ 4.12Å; I115-F396 HydrophobicContact CG1-CE2 4.4Å; I115-F396 HydrophobicContact CG1-CZ 4.1Å; F123-F396 AromaticContact CE1-CD1 3.87Å; F123-F396 HydrophobicContact CE1-CD1 3.87Å; F123-F396 AromaticContact CE1-CE1 4Å; F123-F396 HydrophobicContact CE1-CE1 4Å; F123-F396 AromaticContact CZ-CD1 3.69Å; F123-F396 HydrophobicContact CZ-CD1 3.69Å; F123-F396 HydrophobicContact CZ-CE1 4.29Å; Q146-F396 PolarHBondContact NE2-O 3.47Å; L151-F396 HydrophobicContact CD1-CD1 3.88Å; L151-F396 HydrophobicContact CD1-CE1 4.21Å; L151-F396 HydrophobicContact CD2-CB 4.01Å; L151-F396 HydrophobicContact CD2-CD1 3.8Å; L151-F396 HydrophobicContact CD2-CG 4.04Å; L151-F396 HydrophobicContact CG-CD1 4.17Å; N392-F396 VanDerWaalsContact O-CE2 3.29Å; N392-F396 WeakPolarHBondContact O-CE2 3.24Å; Q393-F396 PolarHBondContact O-N 3.31Å; L394-F396 PolarHBondContact O-N 2.8Å; F396-G398 PolarHBondContact O-N 3.44Å; F396-F399 WeakPolarHBondContact O-CB 3.43Å; F396-F399 PolarHBondContact O-N 3.05Å
397	I	93.4	Very high	82	Confident	55 Å²	55	54.8 Å²	54.8	28%	0.282	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	117.6	-178.7	-70.7	173.2	0	0	0	110.3	A35 A38 W124 L394	A35-I397 HydrophobicContact CB-CD1 4.32Å; A35-I397 HydrophobicContact CB-CG2 3.68Å; A38-I397 HydrophobicContact CB-CD1 3.84Å; A38-I397 HydrophobicContact CB-CG1 3.6Å; W124-I397 VanDerWaalsContact CH2-O 3.27Å; W124-I397 WeakPolarHBondContact CH2-O 3.35Å; L394-I397 HydrophobicContact CB-CD1 4.38Å; L394-I397 HydrophobicContact CD2-CD1 3.61Å; L394-I397 WeakPolarHBondContact O-CG1 3.35Å; L394-I397 PolarHBondContact O-N 2.73Å
398	G	90.8	Very high	80.1	Confident	4 Å²	4	47.8 Å²	47.8	4%	0.041	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	4	178.9	0	0	0	0	0	115.1	C31 D34 W124 R127 F396 T400	C31-G398 WeakPolarHBondContact SG-CA 3.34Å; D34-G398 WeakPolarHBondContact OD2-CA 2.99Å; D34-G398 PolarHBondContact OD2-N 3.47Å; D34-G398 VanDerWaalsContact OD2-N 3.14Å; W124-G398 VanDerWaalsContact CH2-C 3.46Å; W124-G398 WeakPolarHBondContact CZ3-O 3.39Å; R127-G398 PolarHBondContact NH1-O 2.93Å; F396-G398 PolarHBondContact O-N 3.44Å; G398-T400 VanDerWaalsContact C-N 3.33Å
399	F	93	Very high	77.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.			trans	-63.6	-37.7	177.7	179.4	-107.2	0	0	0	112.4	D34 F123 W124 R127 A144 F145 Q146 L151 M153 F396 Y401	D34-F399 PolarHBondContact OD2-N 3.21Å; D34-F399 VanDerWaalsContact OD2-N 3.1Å; F123-F399 AromaticContact CD2-CD2 3.4Å; F123-F399 HydrophobicContact CD2-CD2 3.4Å; F123-F399 AromaticContact CD2-CE2 3.65Å; F123-F399 HydrophobicContact CD2-CE2 3.65Å; F123-F399 HydrophobicContact CD2-CG 4.47Å; F123-F399 HydrophobicContact CE2-CB 4.37Å; F123-F399 AromaticContact CE2-CD2 3.61Å; F123-F399 HydrophobicContact CE2-CD2 3.61Å; F123-F399 HydrophobicContact CE2-CE2 4.3Å; F123-F399 HydrophobicContact CE2-CG 4.34Å; F123-F399 HydrophobicContact CG-CE2 4.46Å; W124-F399 HydrophobicContact CH2-CB 4.22Å; W124-F399 VanDerWaalsContact CH2-N 3.33Å; W124-F399 HydrophobicContact CZ3-CB 4.38Å; R127-F399 HydrophobicContact CB-CE2 4.32Å; R127-F399 WeakPolarHBondContact CD-O 3.16Å; R127-F399 HydrophobicContact CG-CE2 4.45Å; R127-F399 PolarHBondContact NH1-O 3.29Å; A144-F399 HydrophobicContact CB-CD1 4.14Å; A144-F399 HydrophobicContact CB-CE1 3.68Å; A144-F399 HydrophobicContact CB-CE2 4.43Å; A144-F399 HydrophobicContact CB-CZ 3.87Å; F145-F399 WeakPolarHBondContact O-CE1 3.29Å; Q146-F399 HydrophobicContact CB-CD1 4.34Å; L151-F399 HydrophobicContact CB-CD1 4.17Å; L151-F399 HydrophobicContact CB-CE1 3.61Å; L151-F399 HydrophobicContact CB-CE2 4.46Å; L151-F399 HydrophobicContact CB-CZ 3.75Å; L151-F399 HydrophobicContact CD1-CD2 4.22Å; L151-F399 HydrophobicContact CD1-CE1 4.5Å; L151-F399 HydrophobicContact CD1-CE2 4.09Å; L151-F399 HydrophobicContact CD1-CG 4.45Å; L151-F399 HydrophobicContact CD1-CZ 4.21Å; L151-F399 HydrophobicContact CD2-CB 4.41Å; L151-F399 HydrophobicContact CD2-CD1 3.76Å; L151-F399 HydrophobicContact CD2-CE1 4.11Å; L151-F399 HydrophobicContact CD2-CG 3.99Å; L151-F399 HydrophobicContact CG-CD1 4.4Å; L151-F399 HydrophobicContact CG-CE1 4.28Å; L151-F399 HydrophobicContact CG-CZ 4.42Å; M153-F399 HydrophobicContact CG-CE1 4.44Å; M153-F399 HydrophobicContact CG-CE2 4.38Å; M153-F399 HydrophobicContact CG-CZ 3.58Å; M153-F399 HydrophobicContact SD-CE2 4.28Å; M153-F399 HydrophobicContact SD-CZ 4.04Å; F396-F399 WeakPolarHBondContact O-CB 3.43Å; F396-F399 PolarHBondContact O-N 3.05Å; F399-Y401 PolarHBondContact O-N 3.38Å
400	T	92.1	Very high	75.5	Confident	10 Å²	10	50.9 Å²	50.9	6%	0.061	27%	0.265	C	S	.	.			trans	-60.3	132	-173.8	-55.7	0	0	0	0	111.7	D30 D34 R72 A144 F145 G398	D30-T400 HydrophobicContact CB-CG2 4.41Å; D34-T400 VanDerWaalsContact CG-OG1 3.26Å; D34-T400 VanDerWaalsContact OD1-CB 3.3Å; D34-T400 WeakPolarHBondContact OD1-CB 3.4Å; D34-T400 PolarHBondContact OD1-OG1 2.98Å; D34-T400 WeakPolarHBondContact OD2-CB 3.37Å; D34-T400 PolarHBondContact OD2-N 3.07Å; D34-T400 PolarHBondContact OD2-OG1 3.48Å; D34-T400 VanDerWaalsContact OD2-OG1 3.04Å; R72-T400 VanDerWaalsContact NH2-CG2 3.29Å; A144-T400 CarbonylContact O-C 3.57Å; A144-T400 WeakPolarHBondContact O-CA 3.36Å; A144-T400 WeakPolarHBondContact O-CG2 3.3Å; F145-T400 HydrophobicContact CB-CG2 4.41Å; G398-T400 VanDerWaalsContact C-N 3.33Å
401	Y	89.6	Confident	73.3	Confident	15 Å²	15	52.9 Å²	52.9	6%	0.059	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	134.5	-178.9	167	-93.4	0	0	0	109.3	P23 A131 Y132 L141 Y143 A144 F399 R403	P23-Y401 HydrophobicContact CB-CE2 4.36Å; A131-Y401 HydrophobicContact CB-CD1 4.36Å; A131-Y401 HydrophobicContact CB-CD2 4.5Å; A131-Y401 HydrophobicContact CB-CE1 3.91Å; A131-Y401 HydrophobicContact CB-CE2 4.04Å; A131-Y401 PolarHBondContact O-OH 3.22Å; Y132-Y401 AromaticContact CE1-CE2 3.97Å; Y132-Y401 HydrophobicContact CE1-CE2 3.97Å; Y132-Y401 AromaticContact CZ-CE2 3.85Å; Y132-Y401 WeakPolarHBondContact OH-CE2 3.38Å; L141-Y401 HydrophobicContact CD2-CD1 3.9Å; L141-Y401 HydrophobicContact CD2-CE1 4.35Å; L141-Y401 HydrophobicContact CG-CD1 4.44Å; Y143-Y401 CarbonylContact C-O 3.5Å; Y143-Y401 WeakPolarHBondContact CA-O 3.29Å; A144-Y401 PolarHBondContact N-O 3.5Å; A144-Y401 PolarHBondContact O-N 2.92Å; A144-Y401 VanDerWaalsContact O-O 3.06Å; F399-Y401 PolarHBondContact O-N 3.38Å; Y401-R403 HydrophobicContact CE1-CB 4.01Å
402	S	79.4	Confident	70.7	Confident	19 Å²	19	54.9 Å²	54.9	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	111.7	176.3	-174.7	0	0	0	0	110.3	F405 S406	S402-F405 WeakPolarHBondContact OG-CA 3.39Å; S402-F405 WeakPolarHBondContact OG-CB 3.44Å; S402-F405 PolarHBondContact OG-N 2.79Å; S402-F405 VanDerWaalsContact OG-N 3.1Å; S402-S406 WeakPolarHBondContact O-CB 3.47Å; S402-S406 PolarHBondContact O-N 2.91Å
403	R	66.8	Low	68.1	Low	138 Å²	138	60.4 Å²	60.4	52%	0.521	31%	0.308	S	S	.	.	S	Bend	trans	-74.5	-37.2	-178.7	-169.5	170.8	177	154	-3.8	112.8	Y142 Y401	Y142-R403 PolarHBondContact O-N 3.01Å; Y401-R403 HydrophobicContact CE1-CB 4.01Å
404	E	58.9	Low	65.6	Low	87 Å²	87	62.4 Å²	62.4	41%	0.407	32%	0.322	S	S	.	.	S	Bend	trans	-100.7	-21.9	-173.5	-68	171.5	-154.9	0	0	112.6	Y142 Y143	Y142-E404 WeakPolarHBondContact CD1-OE1 3.34Å; Y143-E404 HydrophobicContact CE1-CB 4.39Å; Y143-E404 PolarHBondContact OH-OE2 3.02Å
405	F	53.1	Low	62.9	Low	118 Å²	118	65.2 Å²	65.2	52%	0.518	33%	0.327	S	S	.	.			trans	-129.6	31.8	-179	-51.3	-68.7	0	0	0	113.9	M73 Y143 S402	M73-F405 HydrophobicContact CE-CD2 4.32Å; Y143-F405 AromaticContact CE1-CD2 3.6Å; Y143-F405 HydrophobicContact CE1-CD2 3.6Å; Y143-F405 AromaticContact CE1-CE2 4Å; Y143-F405 HydrophobicContact CE1-CE2 4Å; Y143-F405 AromaticContact CZ-CE2 3.94Å; Y143-F405 WeakPolarHBondContact OH-CE2 3.31Å; S402-F405 WeakPolarHBondContact OG-CA 3.39Å; S402-F405 WeakPolarHBondContact OG-CB 3.44Å; S402-F405 PolarHBondContact OG-N 2.79Å; S402-F405 VanDerWaalsContact OG-N 3.1Å
406	S	47.8	Very low	59.9	Low	39 Å²	39	71 Å²	71	27%	0.273	35%	0.348	S	S	.	.			trans	-61.5	134.5	164.8	-179.6	0	0	0	0	108.7	S402 L408 G409	S402-S406 WeakPolarHBondContact O-CB 3.47Å; S402-S406 PolarHBondContact O-N 2.91Å; S406-L408 PolarHBondContact O-N 2.95Å; S406-G409 PolarHBondContact O-N 2.82Å
407	P	45.8	Very low	57	Low	80 Å²	80	78 Å²	78	52%	0.519	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.9	-176.4	-26.9	35.4	0	0	0	115.3
408	L	46.7	Very low	54.4	Low	51 Å²	51	78.4 Å²	78.4	27%	0.267	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	9.6	174	-62	94.3	0	0	0	113.7	L21 V29 S406 Y410 M411 S412	L21-L408 HydrophobicContact CD2-CB 3.48Å; L21-L408 VanDerWaalsContact CD2-CB 3.48Å; L21-L408 HydrophobicContact CD2-CD2 3.6Å; L21-L408 HydrophobicContact CD2-CG 4.15Å; L21-L408 HydrophobicContact CG-CD2 4.49Å; V29-L408 HydrophobicContact CB-CD1 4.02Å; V29-L408 HydrophobicContact CG1-CD1 4.18Å; V29-L408 HydrophobicContact CG2-CD1 3.67Å; S406-L408 PolarHBondContact O-N 2.95Å; L408-Y410 VanDerWaalsContact C-N 3.32Å; L408-Y410 PolarHBondContact O-N 2.78Å; L408-M411 HydrophobicContact CB-CB 4.23Å; L408-M411 CarbonylContact O-C 3.55Å; L408-M411 WeakPolarHBondContact O-CA 3.34Å; L408-M411 PolarHBondContact O-N 2.96Å; L408-S412 VanDerWaalsContact O-CB 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.31Å; L408-S412 PolarHBondContact O-N 3.07Å
409	G	43.5	Very low	51.9	Low	25 Å²	25	83.2 Å²	83.2	26%	0.258	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-45.3	169.8	0	0	0	0	0	111.4	S406 M411 S412 L413	S406-G409 PolarHBondContact O-N 2.82Å; G409-M411 PolarHBondContact O-N 2.67Å; G409-S412 PolarHBondContact O-N 2.9Å; G409-L413 WeakPolarHBondContact O-CG 3.34Å; G409-L413 PolarHBondContact O-N 2.79Å
410	Y	42.6	Very low	49.4	Very low	196 Å²	196	87.4 Å²	87.4	77%	0.769	43%	0.428	S	S	*	.	H	α-helix	trans	-61.4	-27.1	171.3	-102.7	-96.5	0	0	0	113.8	L408 T414	L408-Y410 VanDerWaalsContact C-N 3.32Å; L408-Y410 PolarHBondContact O-N 2.78Å; Y410-T414 PolarHBondContact O-OG1 3.07Å
411	M	41.4	Very low	46.9	Very low	94 Å²	94	87.6 Å²	87.6	46%	0.463	43%	0.43	S	S	.	.	H	α-helix	trans	-91	-3.1	175.4	-62.7	-126.5	77.6	0	0	113.7	L408 G409 R415	L408-M411 HydrophobicContact CB-CB 4.23Å; L408-M411 CarbonylContact O-C 3.55Å; L408-M411 WeakPolarHBondContact O-CA 3.34Å; L408-M411 PolarHBondContact O-N 2.96Å; G409-M411 PolarHBondContact O-N 2.67Å; M411-R415 WeakPolarHBondContact O-CD 3.37Å; M411-R415 VanDerWaalsContact O-CG 3.23Å; M411-R415 WeakPolarHBondContact O-CG 3.25Å
412	S	37.3	Very low	44.4	Very low	52 Å²	52	87.2 Å²	87.2	36%	0.364	43%	0.429	S	S	.	.	H	α-helix	trans	-105.7	-33.5	179.8	-168.2	0	0	0	0	110.7	L408 G409 T414 R415	L408-S412 VanDerWaalsContact O-CB 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.31Å; L408-S412 PolarHBondContact O-N 3.07Å; G409-S412 PolarHBondContact O-N 2.9Å; S412-T414 VanDerWaalsContact C-N 3.29Å; S412-T414 PolarHBondContact O-N 2.93Å; S412-R415 PolarHBondContact O-N 3.32Å
413	L	37.3	Very low	42.7	Very low	143 Å²	143	89.2 Å²	89.2	75%	0.749	45%	0.447	S	S	*	.	H	α-helix	trans	-63.4	-31.6	168.3	-71.6	167.1	0	0	0	112.6	G409	G409-L413 WeakPolarHBondContact O-CG 3.34Å; G409-L413 PolarHBondContact O-N 2.79Å
414	T	39.9	Very low	41.6	Very low	64 Å²	64	90.5 Å²	90.5	39%	0.393	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.2	173.8	51.8	0	0	0	0	114.3	Y410 S412	Y410-T414 PolarHBondContact O-OG1 3.07Å; S412-T414 VanDerWaalsContact C-N 3.29Å; S412-T414 PolarHBondContact O-N 2.93Å
415	R	36.1	Very low	41.1	Very low	133 Å²	133	88.9 Å²	88.9	50%	0.502	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	15.3	-175.2	-76.3	-178.3	-179.6	-160.1	-0.3	114.8	M411 S412	M411-R415 WeakPolarHBondContact O-CD 3.37Å; M411-R415 VanDerWaalsContact O-CG 3.23Å; M411-R415 WeakPolarHBondContact O-CG 3.25Å; S412-R415 PolarHBondContact O-N 3.32Å
416	K	30.4	Very low	40.6	Very low	169 Å²	169	84.8 Å²	84.8	74%	0.735	44%	0.438	S	S	*	.	S	Bend	trans	-137.7	76.8	179.7	-70.5	-172.8	178.1	-177	0	112.6
417	N	30.6	Very low	40.8	Very low	147 Å²	147	87.6 Å²	87.6	79%	0.786	45%	0.45	S	S	*	.	S	Bend	trans	164	72.4	151.5	-86.7	-8.2	0	0	0	107.8
418	I	39.2	Very low	41.1	Very low	62 Å²	62	86.6 Å²	86.6	32%	0.318	44%	0.44	S	S	.	.			trans	-132.7	124.8	178.2	-54.8	174	0	0	0	110.1	E616	I418-E616 HydrophobicContact CD1-CG 3.48Å; I418-E616 VanDerWaalsContact CD1-CG 3.48Å; I418-E616 WeakPolarHBondContact CD1-OE1 3.34Å; I418-E616 HydrophobicContact CG1-CG 4.38Å
419	Q	38.5	Very low	41.4	Very low	105 Å²	105	86.2 Å²	86.2	49%	0.491	44%	0.444	S	S	.	.			trans	-113.8	140.8	163.2	-77.4	-169.5	-89.6	0	0	107.1
420	H	40.7	Very low	42.3	Very low	88 Å²	88	89.3 Å²	89.3	41%	0.407	46%	0.455	S	S	.	.			trans	-73.1	-176.7	-170.7	-45.9	-23.2	0	0	0	112.5	D422 R784	H420-D422 WeakPolarHBondContact CB-OD2 3.35Å; H420-D422 IonicContact CD2-OD2 2.65Å; H420-D422 PolarHBondContact CD2-OD2 3.11Å; H420-D422 IonicContact CG-OD2 3.55Å; H420-R784 PolarHBondContact CD2-NH1 3.28Å; H420-R784 PolarHBondContact CE1-NH1 3.08Å; H420-R784 PolarHBondContact ND1-NH1 3.29Å; H420-R784 PolarHBondContact NE2-NH1 3.43Å; H420-R784 VanDerWaalsContact NE2-NH1 3.12Å; H420-R784 WeakPolarHBondContact O-CB 3.21Å
421	S	39.9	Very low	43.3	Very low	14 Å²	14	84 Å²	84	10%	0.098	44%	0.437	C	S	.	.			trans	-153.6	114.6	166.1	58.6	0	0	0	0	108.5	I425 E780	S421-I425 WeakPolarHBondContact O-CD1 3.19Å; S421-E780 WeakPolarHBondContact CB-O 3.14Å; S421-E780 WeakPolarHBondContact CB-OE2 3.31Å; S421-E780 PolarHBondContact OG-OE2 3.08Å
422	D	37.8	Very low	44.2	Very low	7 Å²	7	81.4 Å²	81.4	4%	0.037	43%	0.425	C	S	.	.			trans	-125.5	-5.3	-134.5	-118.7	-48.3	0	0	0	115.8	H420 Q424 I425 S426 K783 V787	H420-D422 WeakPolarHBondContact CB-OD2 3.35Å; H420-D422 IonicContact CD2-OD2 2.65Å; H420-D422 PolarHBondContact CD2-OD2 3.11Å; H420-D422 IonicContact CG-OD2 3.55Å; D422-Q424 VanDerWaalsContact C-N 3.28Å; D422-Q424 PolarHBondContact O-N 3.01Å; D422-I425 PolarHBondContact O-N 2.84Å; D422-I425 VanDerWaalsContact O-N 3.16Å; D422-I425 WeakPolarHBondContact OD1-CB 3.2Å; D422-I425 WeakPolarHBondContact OD1-CG2 3.38Å; D422-S426 WeakPolarHBondContact O-CB 3.5Å; D422-S426 PolarHBondContact O-N 3.27Å; D422-K783 WeakPolarHBondContact CB-O 2.87Å; D422-K783 PolarHBondContact N-O 3.1Å; D422-V787 HydrophobicContact CB-CB 3.54Å; D422-V787 HydrophobicContact CB-CG1 4.31Å; D422-V787 HydrophobicContact CB-CG2 3.53Å; D422-V787 VanDerWaalsContact CG-CB 3.4Å
423	A	42.1	Very low	45.6	Very low	62 Å²	62	85 Å²	85	51%	0.512	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.7	-176.7	0	0	0	0	0	115
424	Q	45.3	Very low	47.3	Very low	165 Å²	165	84.2 Å²	84.2	77%	0.771	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-23.6	172.3	-72.5	-179.1	-46.6	0	0	112.6	D422 L428	D422-Q424 VanDerWaalsContact C-N 3.28Å; D422-Q424 PolarHBondContact O-N 3.01Å; Q424-L428 PolarHBondContact O-N 3.13Å
425	I	48	Very low	48.7	Very low	53 Å²	53	81.8 Å²	81.8	27%	0.272	42%	0.416	S	S	.	.	H	α-helix	trans	-71.6	-40.6	175.8	-61.4	179	0	0	0	109.6	S421 D422 N427 L428 A429	S421-I425 WeakPolarHBondContact O-CD1 3.19Å; D422-I425 PolarHBondContact O-N 2.84Å; D422-I425 VanDerWaalsContact O-N 3.16Å; D422-I425 WeakPolarHBondContact OD1-CB 3.2Å; D422-I425 WeakPolarHBondContact OD1-CG2 3.38Å; I425-N427 VanDerWaalsContact C-N 3.35Å; I425-N427 PolarHBondContact O-N 2.92Å; I425-L428 CarbonylContact O-C 3.59Å; I425-L428 WeakPolarHBondContact O-CA 3.39Å; I425-L428 PolarHBondContact O-N 3.39Å; I425-A429 VanDerWaalsContact O-CB 3.27Å; I425-A429 WeakPolarHBondContact O-CB 3.41Å; I425-A429 PolarHBondContact O-N 3.29Å
426	S	42.7	Very low	50.3	Low	31 Å²	31	77 Å²	77	22%	0.217	40%	0.4	C	S	.	.	H	α-helix	trans	-43.7	-54.3	172.3	170.7	0	0	0	0	112.9	D422 L428 A429 D430	D422-S426 WeakPolarHBondContact O-CB 3.5Å; D422-S426 PolarHBondContact O-N 3.27Å; S426-L428 PolarHBondContact O-N 3.25Å; S426-A429 PolarHBondContact O-N 2.8Å; S426-D430 PolarHBondContact O-N 2.88Å
427	N	50.7	Low	52.3	Low	98 Å²	98	71.5 Å²	71.5	52%	0.524	38%	0.383	S	S	.	.	H	α-helix	trans	-69.1	-32.4	-178.3	-158.2	-39	0	0	0	112.9	I425 Q431	I425-N427 VanDerWaalsContact C-N 3.35Å; I425-N427 PolarHBondContact O-N 2.92Å; N427-Q431 VanDerWaalsContact O-CG 3.22Å; N427-Q431 WeakPolarHBondContact O-CG 3.46Å; N427-Q431 PolarHBondContact O-N 3.49Å; N427-Q431 PolarHBondContact O-NE2 3.14Å; N427-Q431 PolarHBondContact OD1-NE2 3.04Å
428	L	52	Low	54.5	Low	60 Å²	60	68 Å²	68	31%	0.314	36%	0.364	S	S	.	.	H	α-helix	trans	-75.1	-29.4	172.8	-81.1	163.4	0	0	0	112.8	Q424 I425 S426 L432 H604	Q424-L428 PolarHBondContact O-N 3.13Å; I425-L428 CarbonylContact O-C 3.59Å; I425-L428 WeakPolarHBondContact O-CA 3.39Å; I425-L428 PolarHBondContact O-N 3.39Å; S426-L428 PolarHBondContact O-N 3.25Å; L428-L432 WeakPolarHBondContact O-CB 3.31Å; L428-L432 PolarHBondContact O-N 3.14Å; L428-H604 WeakPolarHBondContact CD2-ND1 3.4Å
429	A	53.9	Low	56.1	Low	42 Å²	42	65.5 Å²	65.5	35%	0.347	35%	0.351	S	S	.	.	H	α-helix	trans	-76.3	-40	177.4	0	0	0	0	0	111.2	I425 S426 Q431 L432 Q433	I425-A429 VanDerWaalsContact O-CB 3.27Å; I425-A429 WeakPolarHBondContact O-CB 3.41Å; I425-A429 PolarHBondContact O-N 3.29Å; S426-A429 PolarHBondContact O-N 2.8Å; A429-Q431 VanDerWaalsContact C-N 3.31Å; A429-Q431 PolarHBondContact O-N 3.08Å; A429-L432 PolarHBondContact O-N 2.96Å; A429-Q433 VanDerWaalsContact O-CB 3.22Å; A429-Q433 WeakPolarHBondContact O-CB 3.47Å; A429-Q433 PolarHBondContact O-N 3.2Å
430	D	61.8	Low	57.9	Low	91 Å²	91	63.5 Å²	63.5	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-57.2	-44.5	168.9	-95.8	-12	0	0	0	111.3	S426 Q433 Q434	S426-D430 PolarHBondContact O-N 2.88Å; D430-Q433 PolarHBondContact O-N 3.38Å; D430-Q434 WeakPolarHBondContact O-CB 3.48Å; D430-Q434 VanDerWaalsContact O-CG 3.26Å; D430-Q434 WeakPolarHBondContact O-CG 3.37Å; D430-Q434 PolarHBondContact O-N 3.48Å; D430-Q434 PolarHBondContact O-NE2 2.66Å
431	Q	64	Low	59.7	Low	85 Å²	85	64 Å²	64	40%	0.397	34%	0.344	S	S	.	.	H	α-helix	trans	-65.3	-45.4	176.2	-71.2	168.5	36.2	0	0	111.6	N427 A429 Q433 Q434 G435 H604	N427-Q431 VanDerWaalsContact O-CG 3.22Å; N427-Q431 WeakPolarHBondContact O-CG 3.46Å; N427-Q431 PolarHBondContact O-N 3.49Å; N427-Q431 PolarHBondContact O-NE2 3.14Å; N427-Q431 PolarHBondContact OD1-NE2 3.04Å; A429-Q431 VanDerWaalsContact C-N 3.31Å; A429-Q431 PolarHBondContact O-N 3.08Å; Q431-Q433 PolarHBondContact O-N 2.8Å; Q431-Q434 PolarHBondContact O-N 3.32Å; Q431-G435 PolarHBondContact O-N 2.73Å; Q431-H604 PolarHBondContact OE1-CE1 3.46Å
432	L	60.8	Low	61.6	Low	39 Å²	39	63.7 Å²	63.7	20%	0.204	34%	0.341	C	S	.	.	H	α-helix	trans	-61.4	-43.8	176.1	-171.1	77.2	0	0	0	111.5	L428 A429 G435 I436 H604 I605	L428-L432 WeakPolarHBondContact O-CB 3.31Å; L428-L432 PolarHBondContact O-N 3.14Å; A429-L432 PolarHBondContact O-N 2.96Å; L432-G435 PolarHBondContact O-N 3.24Å; L432-I436 HydrophobicContact CD2-CD1 4.33Å; L432-I436 HydrophobicContact CG-CD1 3.98Å; L432-I436 VanDerWaalsContact O-CG1 3.26Å; L432-I436 WeakPolarHBondContact O-CG1 3.4Å; L432-I436 PolarHBondContact O-N 3.14Å; L432-H604 HydrophobicContact CD1-CB 3.71Å; L432-I605 HydrophobicContact CD1-CG1 4.26Å
433	Q	66.1	Low	63.5	Low	127 Å²	127	63.9 Å²	63.9	59%	0.593	34%	0.342	S	S	*	.	H	α-helix	trans	-71	-34.2	-178.2	-174	169.9	-23.7	0	0	112.3	A429 D430 Q431 S437	A429-Q433 VanDerWaalsContact O-CB 3.22Å; A429-Q433 WeakPolarHBondContact O-CB 3.47Å; A429-Q433 PolarHBondContact O-N 3.2Å; D430-Q433 PolarHBondContact O-N 3.38Å; Q431-Q433 PolarHBondContact O-N 2.8Å; Q433-S437 PolarHBondContact O-N 3.43Å; Q433-S437 VanDerWaalsContact O-N 3.08Å
434	Q	72.4	Confident	65.4	Low	126 Å²	126	66 Å²	66	59%	0.589	34%	0.342	S	S	*	.	H	α-helix	trans	-64	-46.2	168.4	-74.3	173.3	50.1	0	0	111.1	D430 Q431 S437 L438	D430-Q434 WeakPolarHBondContact O-CB 3.48Å; D430-Q434 VanDerWaalsContact O-CG 3.26Å; D430-Q434 WeakPolarHBondContact O-CG 3.37Å; D430-Q434 PolarHBondContact O-N 3.48Å; D430-Q434 PolarHBondContact O-NE2 2.66Å; Q431-Q434 PolarHBondContact O-N 3.32Å; Q434-S437 PolarHBondContact O-N 2.98Å; Q434-L438 PolarHBondContact O-N 3.44Å
435	G	69.3	Low	67.3	Low	13 Å²	13	62.4 Å²	62.4	13%	0.134	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-43.9	175.8	0	0	0	0	0	113.2	Q431 L432 S437 L438 M439	Q431-G435 PolarHBondContact O-N 2.73Å; L432-G435 PolarHBondContact O-N 3.24Å; G435-S437 PolarHBondContact O-N 3.31Å; G435-L438 PolarHBondContact O-N 3.3Å; G435-M439 WeakPolarHBondContact O-CB 3.47Å; G435-M439 PolarHBondContact O-N 3.5Å
436	I	69.5	Low	69	Low	33 Å²	33	62 Å²	62	17%	0.169	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-47.1	174.3	-69.6	164.2	0	0	0	110.5	Q6 L432 L438 M439 E440	Q6-I436 HydrophobicContact CB-CG2 4.38Å; L432-I436 HydrophobicContact CD2-CD1 4.33Å; L432-I436 HydrophobicContact CG-CD1 3.98Å; L432-I436 VanDerWaalsContact O-CG1 3.26Å; L432-I436 WeakPolarHBondContact O-CG1 3.4Å; L432-I436 PolarHBondContact O-N 3.14Å; I436-L438 PolarHBondContact O-N 2.95Å; I436-M439 PolarHBondContact O-N 3.11Å; I436-E440 HydrophobicContact CG2-CG 4.43Å; I436-E440 WeakPolarHBondContact O-CG 3.44Å; I436-E440 PolarHBondContact O-N 3.34Å
437	S	74	Confident	70.9	Confident	53 Å²	53	64 Å²	64	37%	0.371	32%	0.323	S	S	.	.	H	α-helix	trans	-68.1	-32.9	-179.1	-167.1	0	0	0	0	113.4	Q433 Q434 G435 Q441	Q433-S437 PolarHBondContact O-N 3.43Å; Q433-S437 VanDerWaalsContact O-N 3.08Å; Q434-S437 PolarHBondContact O-N 2.98Å; G435-S437 PolarHBondContact O-N 3.31Å; S437-Q441 VanDerWaalsContact O-CG 3.26Å; S437-Q441 WeakPolarHBondContact O-CG 3.41Å; S437-Q441 PolarHBondContact O-N 3.37Å; S437-Q441 PolarHBondContact O-NE2 3.21Å; S437-Q441 VanDerWaalsContact O-NE2 3.08Å
438	L	76.1	Confident	72.5	Confident	75 Å²	75	63.2 Å²	63.2	39%	0.393	32%	0.318	S	S	.	.	H	α-helix	trans	-66.7	-43.3	170.1	-89.4	154.1	0	0	0	111.5	Q434 G435 I436 Q441 N442	Q434-L438 PolarHBondContact O-N 3.44Å; G435-L438 PolarHBondContact O-N 3.3Å; I436-L438 PolarHBondContact O-N 2.95Å; L438-Q441 PolarHBondContact O-N 3.05Å; L438-N442 WeakPolarHBondContact O-CB 3.42Å; L438-N442 VanDerWaalsContact O-CG 3.28Å; L438-N442 PolarHBondContact O-N 2.88Å; L438-N442 PolarHBondContact O-ND2 3.23Å
439	M	73.6	Confident	74	Confident	9 Å²	9	62 Å²	62	4%	0.044	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-47.8	177.7	-161.3	-172.4	76.5	0	0	111.5	Q6 G435 I436 Q441 N442 E443 L594 E597 R598	Q6-M439 HydrophobicContact CB-CE 3.77Å; Q6-M439 HydrophobicContact CG-CE 4.33Å; G435-M439 WeakPolarHBondContact O-CB 3.47Å; G435-M439 PolarHBondContact O-N 3.5Å; I436-M439 PolarHBondContact O-N 3.11Å; M439-Q441 VanDerWaalsContact C-N 3.31Å; M439-Q441 PolarHBondContact O-N 3.09Å; M439-N442 CarbonylContact O-C 3.54Å; M439-N442 PolarHBondContact O-N 2.9Å; M439-N442 VanDerWaalsContact O-N 3.08Å; M439-E443 WeakPolarHBondContact O-CG 3.23Å; M439-E443 PolarHBondContact O-N 3.34Å; M439-L594 HydrophobicContact CG-CD1 3.47Å; M439-L594 VanDerWaalsContact CG-CD1 3.47Å; M439-L594 HydrophobicContact SD-CD1 4.4Å; M439-E597 HydrophobicContact CB-CB 4.41Å; M439-E597 HydrophobicContact CG-CB 4.42Å; M439-R598 HydrophobicContact CG-CG 4.18Å; M439-R598 HydrophobicContact SD-CB 4.48Å; M439-R598 HydrophobicContact SD-CG 3.33Å; M439-R598 WeakPolarHBondContact SD-CG 3.39Å
440	E	75.2	Confident	75.4	Confident	62 Å²	62	61.5 Å²	61.5	29%	0.29	31%	0.307	S	S	.	.	H	α-helix	trans	-59.1	-39.4	176.8	-73.3	-179.7	158.7	0	0	112.6	I436 E444	I436-E440 HydrophobicContact CG2-CG 4.43Å; I436-E440 WeakPolarHBondContact O-CG 3.44Å; I436-E440 PolarHBondContact O-N 3.34Å; E440-E444 PolarHBondContact O-N 3.4Å
441	Q	78.8	Confident	76.5	Confident	99 Å²	99	59.6 Å²	59.6	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-67.9	-36	174.6	-74.5	173.2	60.6	0	0	112.6	S437 L438 M439 E444 K445	S437-Q441 VanDerWaalsContact O-CG 3.26Å; S437-Q441 WeakPolarHBondContact O-CG 3.41Å; S437-Q441 PolarHBondContact O-N 3.37Å; S437-Q441 PolarHBondContact O-NE2 3.21Å; S437-Q441 VanDerWaalsContact O-NE2 3.08Å; L438-Q441 PolarHBondContact O-N 3.05Å; M439-Q441 VanDerWaalsContact C-N 3.31Å; M439-Q441 PolarHBondContact O-N 3.09Å; Q441-E444 PolarHBondContact O-N 3.32Å; Q441-K445 VanDerWaalsContact O-CG 3.29Å; Q441-K445 WeakPolarHBondContact O-CG 3.36Å; Q441-K445 PolarHBondContact O-N 2.8Å; Q441-K445 VanDerWaalsContact O-N 3.08Å
442	N	79.2	Confident	77.5	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.037	31%	0.306	C	S	.	.	H	α-helix	trans	-74.9	-35.2	177	-70.2	-15.7	0	0	0	111.6	L438 M439 K445 H446 V590	L438-N442 WeakPolarHBondContact O-CB 3.42Å; L438-N442 VanDerWaalsContact O-CG 3.28Å; L438-N442 PolarHBondContact O-N 2.88Å; L438-N442 PolarHBondContact O-ND2 3.23Å; M439-N442 CarbonylContact O-C 3.54Å; M439-N442 PolarHBondContact O-N 2.9Å; M439-N442 VanDerWaalsContact O-N 3.08Å; N442-K445 PolarHBondContact O-N 3.1Å; N442-K445 PolarHBondContact OD1-NZ 3.18Å; N442-H446 WeakPolarHBondContact O-CB 3.4Å; N442-H446 PolarHBondContact O-N 3.4Å; N442-V590 VanDerWaalsContact O-CG1 3.23Å; N442-V590 WeakPolarHBondContact O-CG1 3.47Å
443	E	77.2	Confident	78.8	Confident	11 Å²	11	60.2 Å²	60.2	5%	0.051	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-42	167.9	-70.5	-177	165.7	0	0	111.2	M439 K445 H446 R447 L594 R598	M439-E443 WeakPolarHBondContact O-CG 3.23Å; M439-E443 PolarHBondContact O-N 3.34Å; E443-K445 PolarHBondContact O-N 3.42Å; E443-H446 WeakPolarHBondContact O-CB 3.43Å; E443-H446 PolarHBondContact O-N 2.88Å; E443-H446 VanDerWaalsContact O-N 3.14Å; E443-R447 WeakPolarHBondContact O-CG 3.37Å; E443-R447 PolarHBondContact O-N 3.03Å; E443-L594 HydrophobicContact CG-CD1 3.51Å; E443-L594 HydrophobicContact CG-CD2 3.78Å; E443-L594 HydrophobicContact CG-CG 4.31Å; E443-R598 IonicContact OE1-CZ 2.69Å; E443-R598 IonicContact OE1-NE 3.02Å; E443-R598 IonicContact OE1-NH2 2.83Å; E443-R598 PolarHBondContact OE1-NH2 2.86Å
444	E	83.4	Confident	79.6	Confident	108 Å²	108	56 Å²	56	51%	0.505	29%	0.291	S	S	.	.	H	α-helix	trans	-63.8	-39.5	175.1	-159.2	179.8	167.2	0	0	113.2	E440 Q441 H446 R447 N448	E440-E444 PolarHBondContact O-N 3.4Å; Q441-E444 PolarHBondContact O-N 3.32Å; E444-H446 VanDerWaalsContact C-N 3.34Å; E444-R447 VanDerWaalsContact CB-NH2 3.33Å; E444-R447 PolarHBondContact O-N 2.79Å; E444-N448 WeakPolarHBondContact O-CB 3.42Å; E444-N448 PolarHBondContact O-N 3.21Å; E444-N448 VanDerWaalsContact O-N 3.12Å; E444-N448 PolarHBondContact O-ND2 2.83Å
445	K	84.2	Confident	80.3	Confident	88 Å²	88	54.7 Å²	54.7	38%	0.383	29%	0.286	S	S	.	.	H	α-helix	trans	-60.8	-44.3	171.1	-67.2	163.9	-154.8	163.5	0	110.8	Q441 N442 E443 N448 E449 V590	Q441-K445 VanDerWaalsContact O-CG 3.29Å; Q441-K445 WeakPolarHBondContact O-CG 3.36Å; Q441-K445 PolarHBondContact O-N 2.8Å; Q441-K445 VanDerWaalsContact O-N 3.08Å; N442-K445 PolarHBondContact O-N 3.1Å; N442-K445 PolarHBondContact OD1-NZ 3.18Å; E443-K445 PolarHBondContact O-N 3.42Å; K445-N448 PolarHBondContact O-N 3.25Å; K445-E449 PolarHBondContact O-N 3.47Å; K445-V590 HydrophobicContact CB-CG1 3.69Å; K445-V590 HydrophobicContact CB-CG2 4.23Å
446	H	84.8	Confident	81	Confident	44 Å²	44	55.7 Å²	55.7	20%	0.204	29%	0.288	C	S	.	.	H	α-helix	trans	-60.5	-47.2	179	178.7	-96.9	0	0	0	111.6	E3 N442 E443 E444 N448 E449 A450 L587 V590	E3-H446 IonicContact OE1-ND1 3.16Å; N442-H446 WeakPolarHBondContact O-CB 3.4Å; N442-H446 PolarHBondContact O-N 3.4Å; E443-H446 WeakPolarHBondContact O-CB 3.43Å; E443-H446 PolarHBondContact O-N 2.88Å; E443-H446 VanDerWaalsContact O-N 3.14Å; E444-H446 VanDerWaalsContact C-N 3.34Å; H446-N448 VanDerWaalsContact C-N 3.28Å; H446-N448 PolarHBondContact O-N 3.3Å; H446-E449 PolarHBondContact O-N 3.13Å; H446-A450 WeakPolarHBondContact O-CB 3.42Å; H446-A450 PolarHBondContact O-N 2.74Å; H446-L587 VanDerWaalsContact CD2-CD1 3.48Å; H446-L587 WeakPolarHBondContact CD2-CD1 3.35Å; H446-V590 HydrophobicContact CB-CG1 3.92Å
447	R	81.4	Confident	81.7	Confident	75 Å²	75	58.6 Å²	58.6	28%	0.283	30%	0.301	S	S	.	.	H	α-helix	trans	-52.7	-46.5	172.7	-70.1	-174.8	-71.6	-95.7	12.7	112.1	E3 E443 E444 A451	E3-R447 HydrophobicContact CG-CG 4.06Å; E3-R447 WeakPolarHBondContact OE1-CG 3.38Å; E3-R447 VanDerWaalsContact OE2-CD 3.27Å; E3-R447 WeakPolarHBondContact OE2-CD 3.42Å; E3-R447 WeakPolarHBondContact OE2-CG 3.38Å; E3-R447 IonicContact OE2-CZ 3.72Å; E3-R447 IonicContact OE2-NE 3.32Å; E3-R447 IonicContact OE2-NH1 2.68Å; E3-R447 PolarHBondContact OE2-NH1 3.03Å; E443-R447 WeakPolarHBondContact O-CG 3.37Å; E443-R447 PolarHBondContact O-N 3.03Å; E444-R447 VanDerWaalsContact CB-NH2 3.33Å; E444-R447 PolarHBondContact O-N 2.79Å; R447-A451 VanDerWaalsContact O-CB 3.3Å; R447-A451 WeakPolarHBondContact O-CB 3.43Å; R447-A451 PolarHBondContact O-N 3.1Å
448	N	84.2	Confident	82.2	Confident	80 Å²	80	60.7 Å²	60.7	43%	0.428	31%	0.308	S	S	.	.	H	α-helix	trans	-72.9	-41.6	-174.8	-74.9	-44.2	0	0	0	112.7	E444 K445 H446 K452	E444-N448 WeakPolarHBondContact O-CB 3.42Å; E444-N448 PolarHBondContact O-N 3.21Å; E444-N448 VanDerWaalsContact O-N 3.12Å; E444-N448 PolarHBondContact O-ND2 2.83Å; K445-N448 PolarHBondContact O-N 3.25Å; H446-N448 VanDerWaalsContact C-N 3.28Å; H446-N448 PolarHBondContact O-N 3.3Å; N448-K452 VanDerWaalsContact O-CG 3.3Å; N448-K452 WeakPolarHBondContact O-CG 3.44Å; N448-K452 PolarHBondContact O-N 3.06Å
449	E	85	Confident	82.7	Confident	36 Å²	36	64.6 Å²	64.6	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-69.7	-38.9	173.9	-61.2	-42.8	128.6	0	0	112.4	K445 H446 A451 K452 F453 N586 L587	K445-E449 PolarHBondContact O-N 3.47Å; H446-E449 PolarHBondContact O-N 3.13Å; E449-A451 VanDerWaalsContact C-N 3.33Å; E449-A451 PolarHBondContact O-N 3.16Å; E449-K452 VanDerWaalsContact CD-NZ 3.25Å; E449-K452 PolarHBondContact O-N 3.11Å; E449-K452 IonicContact OE1-NZ 2.68Å; E449-K452 PolarHBondContact OE1-NZ 2.74Å; E449-K452 WeakPolarHBondContact OE2-CD 3.23Å; E449-K452 IonicContact OE2-NZ 3.15Å; E449-K452 PolarHBondContact OE2-NZ 2.72Å; E449-K452 VanDerWaalsContact OE2-NZ 3.08Å; E449-F453 WeakPolarHBondContact O-CB 3.44Å; E449-F453 PolarHBondContact O-N 2.76Å; E449-N586 HydrophobicContact CG-CB 4.44Å; E449-L587 HydrophobicContact CB-CB 4.23Å; E449-L587 HydrophobicContact CB-CD1 4.25Å
450	A	83.5	Confident	83.3	Confident	31 Å²	31	64.3 Å²	64.3	26%	0.256	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-41.2	175.7	0	0	0	0	0	111.8	H446 A454 L587	H446-A450 WeakPolarHBondContact O-CB 3.42Å; H446-A450 PolarHBondContact O-N 2.74Å; A450-A454 WeakPolarHBondContact O-CB 3.25Å; A450-A454 PolarHBondContact O-N 3.28Å; A450-L587 HydrophobicContact CB-CD1 3.86Å; A450-L587 HydrophobicContact CB-CD2 4.32Å
451	A	84.7	Confident	83.7	Confident	50 Å²	50	66 Å²	66	41%	0.413	33%	0.325	S	S	.	.	H	α-helix	trans	-65.6	-41	175.2	0	0	0	0	0	112.5	R447 E449 I455	R447-A451 VanDerWaalsContact O-CB 3.3Å; R447-A451 WeakPolarHBondContact O-CB 3.43Å; R447-A451 PolarHBondContact O-N 3.1Å; E449-A451 VanDerWaalsContact C-N 3.33Å; E449-A451 PolarHBondContact O-N 3.16Å; A451-I455 WeakPolarHBondContact O-CD1 3.27Å; A451-I455 VanDerWaalsContact O-CG1 3.23Å; A451-I455 WeakPolarHBondContact O-CG1 3.36Å; A451-I455 PolarHBondContact O-N 3.14Å; A451-I455 VanDerWaalsContact O-N 3.14Å
452	K	84.4	Confident	84.1	Confident	105 Å²	105	63 Å²	63	46%	0.457	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-51	174	-74.3	163.4	174.2	178.5	0	111.5	N448 E449 A454 I455 M456	N448-K452 VanDerWaalsContact O-CG 3.3Å; N448-K452 WeakPolarHBondContact O-CG 3.44Å; N448-K452 PolarHBondContact O-N 3.06Å; E449-K452 VanDerWaalsContact CD-NZ 3.25Å; E449-K452 PolarHBondContact O-N 3.11Å; E449-K452 IonicContact OE1-NZ 2.68Å; E449-K452 PolarHBondContact OE1-NZ 2.74Å; E449-K452 WeakPolarHBondContact OE2-CD 3.23Å; E449-K452 IonicContact OE2-NZ 3.15Å; E449-K452 PolarHBondContact OE2-NZ 2.72Å; E449-K452 VanDerWaalsContact OE2-NZ 3.08Å; K452-A454 PolarHBondContact O-N 2.91Å; K452-I455 PolarHBondContact O-N 3.19Å; K452-M456 HydrophobicContact CB-CE 4.3Å; K452-M456 PolarHBondContact O-N 3Å; K452-M456 VanDerWaalsContact O-N 3.08Å
453	F	87.6	Confident	84.5	Confident	33 Å²	33	64.7 Å²	64.7	15%	0.145	33%	0.325	C	S	.	.	H	α-helix	trans	-55.3	-52.8	179.7	175.8	-95.8	0	0	0	110.9	E449 I455 M456 E457 C580 A583 Q584	E449-F453 WeakPolarHBondContact O-CB 3.44Å; E449-F453 PolarHBondContact O-N 2.76Å; F453-I455 VanDerWaalsContact C-N 3.29Å; F453-I455 PolarHBondContact O-N 3.07Å; F453-M456 PolarHBondContact O-N 2.82Å; F453-E457 HydrophobicContact CE1-CB 4.39Å; F453-E457 WeakPolarHBondContact O-CB 3.3Å; F453-E457 PolarHBondContact O-N 2.9Å; F453-C580 WeakPolarHBondContact CD2-O 3.41Å; F453-C580 HydrophobicContact CE2-CB 4.45Å; F453-A583 HydrophobicContact CB-CB 4.21Å; F453-A583 HydrophobicContact CD2-CB 4.19Å; F453-Q584 HydrophobicContact CD2-CB 4.04Å; F453-Q584 HydrophobicContact CE2-CB 3.79Å; F453-Q584 HydrophobicContact CE2-CG 4.17Å
454	A	83.8	Confident	85	Confident	39 Å²	39	67.2 Å²	67.2	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-35.4	179.6	0	0	0	0	0	113.3	A450 K452 N458	A450-A454 WeakPolarHBondContact O-CB 3.25Å; A450-A454 PolarHBondContact O-N 3.28Å; K452-A454 PolarHBondContact O-N 2.91Å; A454-N458 WeakPolarHBondContact O-CB 3.49Å; A454-N458 PolarHBondContact O-N 2.92Å; A454-N458 PolarHBondContact O-ND2 3.13Å
455	I	85.7	Confident	85.2	Confident	97 Å²	97	68 Å²	68	50%	0.497	34%	0.337	S	S	.	.	H	α-helix	trans	-68	-35.5	175.6	-72	166.7	0	0	0	111.6	A451 K452 F453 R459	A451-I455 WeakPolarHBondContact O-CD1 3.27Å; A451-I455 VanDerWaalsContact O-CG1 3.23Å; A451-I455 WeakPolarHBondContact O-CG1 3.36Å; A451-I455 PolarHBondContact O-N 3.14Å; A451-I455 VanDerWaalsContact O-N 3.14Å; K452-I455 PolarHBondContact O-N 3.19Å; F453-I455 VanDerWaalsContact C-N 3.29Å; F453-I455 PolarHBondContact O-N 3.07Å; I455-R459 WeakPolarHBondContact O-CD 3.2Å; I455-R459 VanDerWaalsContact O-CG 3.25Å; I455-R459 WeakPolarHBondContact O-CG 3.1Å; I455-R459 PolarHBondContact O-N 2.81Å
456	M	84.4	Confident	85.4	Confident	34 Å²	34	68.2 Å²	68.2	17%	0.167	34%	0.343	C	S	.	.	H	α-helix	trans	-79	-41.1	179.8	-66.5	-174.4	-67.1	0	0	111.9	K452 F453 N458 R459 G460 L576 Q579 C580 A583	K452-M456 HydrophobicContact CB-CE 4.3Å; K452-M456 PolarHBondContact O-N 3Å; K452-M456 VanDerWaalsContact O-N 3.08Å; F453-M456 PolarHBondContact O-N 2.82Å; M456-N458 PolarHBondContact O-N 3.15Å; M456-R459 WeakPolarHBondContact O-CB 3.28Å; M456-R459 PolarHBondContact O-N 3.08Å; M456-R459 VanDerWaalsContact O-N 3.1Å; M456-G460 PolarHBondContact O-N 3.31Å; M456-L576 HydrophobicContact CB-CD1 4.05Å; M456-L576 HydrophobicContact CG-CD1 4.24Å; M456-Q579 HydrophobicContact SD-CB 4.07Å; M456-C580 VanDerWaalsContact C-SG 3.5Å; M456-C580 VanDerWaalsContact CB-SG 3.59Å; M456-A583 HydrophobicContact CE-CB 3.41Å; M456-A583 VanDerWaalsContact CE-CB 3.41Å
457	E	84.9	Confident	85.7	Confident	94 Å²	94	68.3 Å²	68.3	44%	0.439	34%	0.341	S	S	.	.	H	α-helix	trans	-56.6	-49.8	174	-175.5	176.1	-126.8	0	0	111.8	F453 R459 G460 E461	F453-E457 HydrophobicContact CE1-CB 4.39Å; F453-E457 WeakPolarHBondContact O-CB 3.3Å; F453-E457 PolarHBondContact O-N 2.9Å; E457-R459 PolarHBondContact O-N 3.28Å; E457-G460 PolarHBondContact O-N 3.03Å; E457-G460 VanDerWaalsContact O-N 3.1Å; E457-E461 PolarHBondContact O-N 2.9Å
458	N	84	Confident	86	Confident	98 Å²	98	70 Å²	70	52%	0.524	35%	0.349	S	S	.	.	H	α-helix	trans	-61.6	-30.4	176.5	-84.7	-92.6	0	0	0	113.3	A454 M456 A462	A454-N458 WeakPolarHBondContact O-CB 3.49Å; A454-N458 PolarHBondContact O-N 2.92Å; A454-N458 PolarHBondContact O-ND2 3.13Å; M456-N458 PolarHBondContact O-N 3.15Å; N458-A462 PolarHBondContact O-N 2.7Å
459	R	86.9	Confident	86.2	Confident	156 Å²	156	70.5 Å²	70.5	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-75.7	-37.6	174.5	-74.5	170.2	174.4	-170.5	-0.7	111.7	I455 M456 E457 A462 M463 L576	I455-R459 WeakPolarHBondContact O-CD 3.2Å; I455-R459 VanDerWaalsContact O-CG 3.25Å; I455-R459 WeakPolarHBondContact O-CG 3.1Å; I455-R459 PolarHBondContact O-N 2.81Å; M456-R459 WeakPolarHBondContact O-CB 3.28Å; M456-R459 PolarHBondContact O-N 3.08Å; M456-R459 VanDerWaalsContact O-N 3.1Å; E457-R459 PolarHBondContact O-N 3.28Å; R459-A462 PolarHBondContact O-N 2.69Å; R459-M463 WeakPolarHBondContact O-CB 3.38Å; R459-M463 PolarHBondContact O-N 2.98Å; R459-L576 HydrophobicContact CB-CD2 3.64Å
460	G	85.5	Confident	86.5	Confident	3 Å²	3	70.8 Å²	70.8	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-59.8	-50.6	174.7	0	0	0	0	0	111.3	M456 E457 A462 M463 L464	M456-G460 PolarHBondContact O-N 3.31Å; E457-G460 PolarHBondContact O-N 3.03Å; E457-G460 VanDerWaalsContact O-N 3.1Å; G460-A462 VanDerWaalsContact C-N 3.31Å; G460-A462 PolarHBondContact O-N 2.86Å; G460-M463 PolarHBondContact O-N 3.15Å; G460-L464 WeakPolarHBondContact O-CB 3.27Å; G460-L464 PolarHBondContact O-N 3.05Å
461	E	84.6	Confident	86.8	Confident	98 Å²	98	73.2 Å²	73.2	46%	0.458	36%	0.36	S	S	.	.	H	α-helix	trans	-58.5	-40.5	175	-69.1	-163	164.2	0	0	113.3	E457 L464 R465	E457-E461 PolarHBondContact O-N 2.9Å; E461-L464 PolarHBondContact O-N 3.15Å; E461-R465 VanDerWaalsContact CB-NH2 3.27Å; E461-R465 WeakPolarHBondContact O-CG 3.08Å; E461-R465 PolarHBondContact O-N 3.03Å; E461-R465 PolarHBondContact O-NE 3.26Å; E461-R465 IonicContact OE2-CZ 2.68Å; E461-R465 IonicContact OE2-NH1 2.63Å; E461-R465 PolarHBondContact OE2-NH1 3.09Å; E461-R465 IonicContact OE2-NH2 3.95Å; E461-R465 PolarHBondContact OE2-NH2 3.26Å; E461-R465 VanDerWaalsContact OE2-NH2 3.13Å
462	A	87.1	Confident	87	Confident	37 Å²	37	77.6 Å²	77.6	31%	0.306	37%	0.365	S	S	.	.	H	α-helix	trans	-63	-46.3	179.2	0	0	0	0	0	110.8	N458 R459 G460 L464 R465 D466	N458-A462 PolarHBondContact O-N 2.7Å; R459-A462 PolarHBondContact O-N 2.69Å; G460-A462 VanDerWaalsContact C-N 3.31Å; G460-A462 PolarHBondContact O-N 2.86Å; A462-L464 VanDerWaalsContact C-N 3.31Å; A462-L464 PolarHBondContact O-N 3.01Å; A462-R465 WeakPolarHBondContact O-CB 3.35Å; A462-R465 PolarHBondContact O-N 2.94Å; A462-D466 PolarHBondContact O-N 3.43Å
463	M	87.4	Confident	87.3	Confident	42 Å²	42	74.5 Å²	74.5	21%	0.207	36%	0.36	C	S	.	.	H	α-helix	trans	-65.1	-34.5	178.4	-155.9	171.2	-62.8	0	0	112.8	R459 G460 Y467 L569 K572 H573 L576	R459-M463 WeakPolarHBondContact O-CB 3.38Å; R459-M463 PolarHBondContact O-N 2.98Å; G460-M463 PolarHBondContact O-N 3.15Å; M463-Y467 WeakPolarHBondContact O-CB 3.31Å; M463-Y467 PolarHBondContact O-N 3.48Å; M463-L569 HydrophobicContact CG-CD1 3.43Å; M463-L569 VanDerWaalsContact CG-CD1 3.43Å; M463-L569 HydrophobicContact CG-CG 4.02Å; M463-L569 HydrophobicContact SD-CD1 4.18Å; M463-K572 HydrophobicContact CE-CB 4.19Å; M463-K572 HydrophobicContact SD-CB 3.45Å; M463-K572 WeakPolarHBondContact SD-CB 3.38Å; M463-H573 HydrophobicContact CG-CB 4.27Å; M463-H573 VanDerWaalsContact SD-CA 3.59Å; M463-H573 HydrophobicContact SD-CB 4Å; M463-H573 PolarHBondContact SD-N 3.12Å; M463-L576 HydrophobicContact CE-CD2 4.12Å
464	L	87.9	Confident	87.4	Confident	63 Å²	63	73.1 Å²	73.1	33%	0.33	35%	0.354	S	S	.	.	H	α-helix	trans	-69.8	-34.8	174.8	-172.5	64.8	0	0	0	112.4	G460 E461 A462 Y468	G460-L464 WeakPolarHBondContact O-CB 3.27Å; G460-L464 PolarHBondContact O-N 3.05Å; E461-L464 PolarHBondContact O-N 3.15Å; A462-L464 VanDerWaalsContact C-N 3.31Å; A462-L464 PolarHBondContact O-N 3.01Å; L464-Y468 HydrophobicContact CD1-CD2 4.36Å; L464-Y468 HydrophobicContact CD1-CE2 3.76Å; L464-Y468 HydrophobicContact CD2-CE2 4.23Å; L464-Y468 HydrophobicContact CG-CD2 4.13Å; L464-Y468 HydrophobicContact CG-CE2 3.69Å; L464-Y468 WeakPolarHBondContact O-CD2 3.26Å; L464-Y468 PolarHBondContact O-N 3.45Å
465	R	86.5	Confident	87.7	Confident	124 Å²	124	74.2 Å²	74.2	47%	0.468	36%	0.363	S	S	.	.	H	α-helix	trans	-63.7	-50.3	171.3	-74.9	178	-78	-103.8	1.2	110.9	E461 A462 Y467 Y468 D469	E461-R465 VanDerWaalsContact CB-NH2 3.27Å; E461-R465 WeakPolarHBondContact O-CG 3.08Å; E461-R465 PolarHBondContact O-N 3.03Å; E461-R465 PolarHBondContact O-NE 3.26Å; E461-R465 IonicContact OE2-CZ 2.68Å; E461-R465 IonicContact OE2-NH1 2.63Å; E461-R465 PolarHBondContact OE2-NH1 3.09Å; E461-R465 IonicContact OE2-NH2 3.95Å; E461-R465 PolarHBondContact OE2-NH2 3.26Å; E461-R465 VanDerWaalsContact OE2-NH2 3.13Å; A462-R465 WeakPolarHBondContact O-CB 3.35Å; A462-R465 PolarHBondContact O-N 2.94Å; R465-Y467 VanDerWaalsContact C-N 3.28Å; R465-Y467 PolarHBondContact O-N 3.36Å; R465-Y468 PolarHBondContact O-N 3.05Å; R465-Y468 VanDerWaalsContact O-N 3.13Å; R465-D469 PolarHBondContact O-N 3.18Å
466	D	88.7	Confident	87.8	Confident	94 Å²	94	72.4 Å²	72.4	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-57.9	-39.2	177.7	-64.8	-16.7	0	0	0	111.8	A462 D469 L470 L569	A462-D466 PolarHBondContact O-N 3.43Å; D466-D469 PolarHBondContact O-N 2.77Å; D466-L470 WeakPolarHBondContact O-CB 3.37Å; D466-L470 PolarHBondContact O-N 3.02Å; D466-L569 HydrophobicContact CB-CD2 3.83Å
467	Y	91.3	Very high	88	Confident	45 Å²	45	71.4 Å²	71.4	18%	0.176	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-50.4	174.3	175.3	-82.6	0	0	0	111.7	M463 R465 D469 L470 E471 L566 R570	M463-Y467 WeakPolarHBondContact O-CB 3.31Å; M463-Y467 PolarHBondContact O-N 3.48Å; R465-Y467 VanDerWaalsContact C-N 3.28Å; R465-Y467 PolarHBondContact O-N 3.36Å; Y467-D469 VanDerWaalsContact C-N 3.33Å; Y467-D469 PolarHBondContact O-N 3.32Å; Y467-L470 PolarHBondContact O-N 3.32Å; Y467-E471 HydrophobicContact CE1-CB 4.35Å; Y467-E471 WeakPolarHBondContact CE1-OE1 3.46Å; Y467-E471 WeakPolarHBondContact O-CB 3.34Å; Y467-E471 PolarHBondContact O-N 2.92Å; Y467-E471 PolarHBondContact OH-OE1 2.86Å; Y467-L566 HydrophobicContact CD2-CD2 3.73Å; Y467-L566 HydrophobicContact CE2-CB 4.45Å; Y467-L566 HydrophobicContact CE2-CD2 3.72Å; Y467-L566 HydrophobicContact CG-CD2 4.23Å; Y467-L566 WeakPolarHBondContact O-CD2 3.46Å; Y467-R570 HydrophobicContact CD2-CB 4.21Å; Y467-R570 HydrophobicContact CE2-CB 4.06Å
468	Y	88	Confident	88.3	Confident	111 Å²	111	72.5 Å²	72.5	44%	0.435	36%	0.355	S	S	.	.	H	α-helix	trans	-68.7	-28.6	-178.6	-73.8	-53.5	0	0	0	113.5	L464 R465 R472	L464-Y468 HydrophobicContact CD1-CD2 4.36Å; L464-Y468 HydrophobicContact CD1-CE2 3.76Å; L464-Y468 HydrophobicContact CD2-CE2 4.23Å; L464-Y468 HydrophobicContact CG-CD2 4.13Å; L464-Y468 HydrophobicContact CG-CE2 3.69Å; L464-Y468 WeakPolarHBondContact O-CD2 3.26Å; L464-Y468 PolarHBondContact O-N 3.45Å; R465-Y468 PolarHBondContact O-N 3.05Å; R465-Y468 VanDerWaalsContact O-N 3.13Å; Y468-R472 WeakPolarHBondContact O-CG 3.44Å; Y468-R472 PolarHBondContact O-N 3.02Å; Y468-R472 VanDerWaalsContact O-N 3.16Å; Y468-R472 PolarHBondContact O-NE 3.44Å; Y468-R472 PolarHBondContact O-NH1 2.89Å
469	D	89.2	Confident	88.5	Confident	91 Å²	91	73.6 Å²	73.6	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-71.6	-40.9	173	-81.5	-43.1	0	0	0	112.2	R465 D466 Y467 R472 A473	R465-D469 PolarHBondContact O-N 3.18Å; D466-D469 PolarHBondContact O-N 2.77Å; Y467-D469 VanDerWaalsContact C-N 3.33Å; Y467-D469 PolarHBondContact O-N 3.32Å; D469-R472 VanDerWaalsContact CG-NH2 3.27Å; D469-R472 WeakPolarHBondContact O-CB 3.44Å; D469-R472 PolarHBondContact O-N 3.32Å; D469-R472 IonicContact OD1-CZ 2.7Å; D469-R472 IonicContact OD1-NE 3.26Å; D469-R472 PolarHBondContact OD1-NE 2.93Å; D469-R472 VanDerWaalsContact OD1-NE 3.16Å; D469-R472 IonicContact OD1-NH2 2.69Å; D469-R472 PolarHBondContact OD1-NH2 3.23Å; D469-R472 IonicContact OD2-NH2 3.85Å; D469-A473 PolarHBondContact O-N 2.88Å
470	L	89.8	Confident	88.6	Confident	42 Å²	42	69.6 Å²	69.6	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-68.9	-34.9	175.2	-174	63.1	0	0	0	112.3	D466 Y467 R472 A473 L474 Q562 A565 L566	D466-L470 WeakPolarHBondContact O-CB 3.37Å; D466-L470 PolarHBondContact O-N 3.02Å; Y467-L470 PolarHBondContact O-N 3.32Å; L470-R472 VanDerWaalsContact C-N 3.35Å; L470-A473 PolarHBondContact O-N 2.87Å; L470-L474 WeakPolarHBondContact O-CB 3.17Å; L470-L474 PolarHBondContact O-N 3.48Å; L470-Q562 HydrophobicContact CD1-CB 4.39Å; L470-Q562 HydrophobicContact CD1-CG 4.21Å; L470-A565 HydrophobicContact CD2-CB 3.68Å; L470-L566 HydrophobicContact CB-CD2 3.82Å; L470-L566 HydrophobicContact CB-CG 4.35Å; L470-L566 HydrophobicContact CD2-CB 4.46Å; L470-L566 HydrophobicContact CD2-CD2 3.87Å; L470-L566 HydrophobicContact CD2-CG 3.73Å; L470-L566 HydrophobicContact CG-CD2 3.84Å; L470-L566 HydrophobicContact CG-CG 3.8Å
471	E	90.6	Very high	88.9	Confident	81 Å²	81	70.5 Å²	70.5	38%	0.379	35%	0.352	S	S	.	.	H	α-helix	trans	-65.6	-37.6	175.1	-171	173.9	-116.6	0	0	111.5	Y467 A475 L566	Y467-E471 HydrophobicContact CE1-CB 4.35Å; Y467-E471 WeakPolarHBondContact CE1-OE1 3.46Å; Y467-E471 WeakPolarHBondContact O-CB 3.34Å; Y467-E471 PolarHBondContact O-N 2.92Å; Y467-E471 PolarHBondContact OH-OE1 2.86Å; E471-A475 WeakPolarHBondContact O-CB 3.44Å; E471-A475 PolarHBondContact O-N 2.68Å; E471-A475 VanDerWaalsContact O-N 3.08Å; E471-L566 HydrophobicContact CB-CD1 4.41Å; E471-L566 HydrophobicContact CB-CD2 4.13Å
472	R	89.5	Confident	89.2	Confident	142 Å²	142	72.7 Å²	72.7	54%	0.536	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-45.1	170	-78.8	-177.6	-77.7	-84.4	8.6	112.4	Y468 D469 L470 A475 S476	Y468-R472 WeakPolarHBondContact O-CG 3.44Å; Y468-R472 PolarHBondContact O-N 3.02Å; Y468-R472 VanDerWaalsContact O-N 3.16Å; Y468-R472 PolarHBondContact O-NE 3.44Å; Y468-R472 PolarHBondContact O-NH1 2.89Å; D469-R472 VanDerWaalsContact CG-NH2 3.27Å; D469-R472 WeakPolarHBondContact O-CB 3.44Å; D469-R472 PolarHBondContact O-N 3.32Å; D469-R472 IonicContact OD1-CZ 2.7Å; D469-R472 IonicContact OD1-NE 3.26Å; D469-R472 PolarHBondContact OD1-NE 2.93Å; D469-R472 VanDerWaalsContact OD1-NE 3.16Å; D469-R472 IonicContact OD1-NH2 2.69Å; D469-R472 PolarHBondContact OD1-NH2 3.23Å; D469-R472 IonicContact OD2-NH2 3.85Å; L470-R472 VanDerWaalsContact C-N 3.35Å; R472-A475 PolarHBondContact O-N 3.45Å; R472-S476 PolarHBondContact O-N 3.28Å
473	A	89	Confident	89.3	Confident	41 Å²	41	75.5 Å²	75.5	34%	0.339	37%	0.367	S	S	.	.	H	α-helix	trans	-60.6	-48.7	178.9	0	0	0	0	0	111.4	D469 L470 A475 S476 T477	D469-A473 PolarHBondContact O-N 2.88Å; L470-A473 PolarHBondContact O-N 2.87Å; A473-A475 VanDerWaalsContact C-N 3.29Å; A473-A475 PolarHBondContact O-N 3.48Å; A473-S476 WeakPolarHBondContact O-CB 3.36Å; A473-S476 PolarHBondContact O-N 3.09Å; A473-T477 PolarHBondContact O-N 3.06Å; A473-T477 PolarHBondContact O-OG1 3.05Å
474	L	91.3	Very high	89.3	Confident	4 Å²	4	75 Å²	75	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-36.2	176.5	176.8	63.1	0	0	0	112.9	L470 S476 T477 R478 C559 Q562 E563 L566	L470-L474 WeakPolarHBondContact O-CB 3.17Å; L470-L474 PolarHBondContact O-N 3.48Å; L474-S476 VanDerWaalsContact C-N 3.3Å; L474-S476 PolarHBondContact O-N 3.31Å; L474-T477 PolarHBondContact O-N 3.15Å; L474-R478 HydrophobicContact CD1-CG 3.86Å; L474-R478 HydrophobicContact CG-CG 4.25Å; L474-R478 VanDerWaalsContact O-CB 3.28Å; L474-R478 WeakPolarHBondContact O-CB 3.49Å; L474-R478 VanDerWaalsContact O-CG 3.26Å; L474-R478 WeakPolarHBondContact O-CG 3.41Å; L474-R478 PolarHBondContact O-N 3.33Å; L474-C559 HydrophobicContact CD1-CB 4.19Å; L474-Q562 VanDerWaalsContact CA-OE1 3.31Å; L474-Q562 HydrophobicContact CB-CB 4.28Å; L474-Q562 HydrophobicContact CD1-CB 4Å; L474-E563 HydrophobicContact CD1-CG 3.84Å; L474-E563 HydrophobicContact CD2-CG 3.44Å; L474-E563 VanDerWaalsContact CD2-CG 3.44Å; L474-E563 HydrophobicContact CG-CG 4.29Å; L474-L566 HydrophobicContact CB-CD1 4.36Å; L474-L566 HydrophobicContact CD2-CD1 3.47Å; L474-L566 VanDerWaalsContact CD2-CD1 3.47Å
475	A	89	Confident	89.4	Confident	62 Å²	62	75.6 Å²	75.6	51%	0.512	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-35.7	174.7	0	0	0	0	0	112.7	E471 R472 A473 L479	E471-A475 WeakPolarHBondContact O-CB 3.44Å; E471-A475 PolarHBondContact O-N 2.68Å; E471-A475 VanDerWaalsContact O-N 3.08Å; R472-A475 PolarHBondContact O-N 3.45Å; A473-A475 VanDerWaalsContact C-N 3.29Å; A473-A475 PolarHBondContact O-N 3.48Å; A475-L479 PolarHBondContact O-N 2.98Å
476	S	88	Confident	89.6	Confident	58 Å²	58	75.2 Å²	75.2	41%	0.406	36%	0.364	S	S	.	.	H	α-helix	trans	-69	-52.4	172.6	-162.7	0	0	0	0	111.3	R472 A473 L474 R478 L479 E480	R472-S476 PolarHBondContact O-N 3.28Å; A473-S476 WeakPolarHBondContact O-CB 3.36Å; A473-S476 PolarHBondContact O-N 3.09Å; L474-S476 VanDerWaalsContact C-N 3.3Å; L474-S476 PolarHBondContact O-N 3.31Å; S476-R478 VanDerWaalsContact C-N 3.26Å; S476-R478 PolarHBondContact O-N 3.33Å; S476-L479 WeakPolarHBondContact O-CA 3.39Å; S476-L479 VanDerWaalsContact O-CB 3.31Å; S476-L479 WeakPolarHBondContact O-CB 3.11Å; S476-L479 PolarHBondContact O-N 2.99Å; S476-E480 PolarHBondContact O-N 3.08Å; S476-E480 PolarHBondContact OG-OE1 2.63Å
477	T	88.5	Confident	89.7	Confident	14 Å²	14	73.8 Å²	73.8	9%	0.086	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-34.9	-177.3	-48.9	0	0	0	0	112	A473 L474 L481 F555 T558 Q562	A473-T477 PolarHBondContact O-N 3.06Å; A473-T477 PolarHBondContact O-OG1 3.05Å; L474-T477 PolarHBondContact O-N 3.15Å; T477-L481 VanDerWaalsContact O-CB 3.29Å; T477-L481 WeakPolarHBondContact O-CB 2.99Å; T477-L481 PolarHBondContact O-N 3.01Å; T477-F555 HydrophobicContact CG2-CD1 4.03Å; T477-T558 HydrophobicContact CG2-CG2 3.85Å; T477-Q562 PolarHBondContact OG1-NE2 2.96Å; T477-Q562 PolarHBondContact OG1-OE1 3.2Å
478	R	91.4	Very high	89.8	Confident	116 Å²	116	72.9 Å²	72.9	44%	0.438	35%	0.352	S	S	.	.	H	α-helix	trans	-68.4	-27.4	171.5	-75.4	171.9	168	175.7	-9.5	114.2	L474 S476 K482 E563	L474-R478 HydrophobicContact CD1-CG 3.86Å; L474-R478 HydrophobicContact CG-CG 4.25Å; L474-R478 VanDerWaalsContact O-CB 3.28Å; L474-R478 WeakPolarHBondContact O-CB 3.49Å; L474-R478 VanDerWaalsContact O-CG 3.26Å; L474-R478 WeakPolarHBondContact O-CG 3.41Å; L474-R478 PolarHBondContact O-N 3.33Å; S476-R478 VanDerWaalsContact C-N 3.26Å; S476-R478 PolarHBondContact O-N 3.33Å; R478-K482 WeakPolarHBondContact O-CG 3.28Å; R478-K482 PolarHBondContact O-N 2.85Å; R478-E563 IonicContact CZ-OE1 3.48Å; R478-E563 IonicContact NE-OE1 3.45Å; R478-E563 PolarHBondContact NE-OE1 3.49Å; R478-E563 IonicContact NH2-OE1 2.65Å; R478-E563 PolarHBondContact NH2-OE1 3.43Å; R478-E563 IonicContact NH2-OE2 2.8Å
479	L	89	Confident	89.9	Confident	122 Å²	122	73.1 Å²	73.1	64%	0.639	36%	0.357	S	S	*	.	H	α-helix	trans	-75	-46.9	173.9	-172.9	72.6	0	0	0	110.3	A475 S476 L481 K482 E483	A475-L479 PolarHBondContact O-N 2.98Å; S476-L479 WeakPolarHBondContact O-CA 3.39Å; S476-L479 VanDerWaalsContact O-CB 3.31Å; S476-L479 WeakPolarHBondContact O-CB 3.11Å; S476-L479 PolarHBondContact O-N 2.99Å; L479-L481 PolarHBondContact O-N 3Å; L479-K482 PolarHBondContact O-N 3.25Å; L479-E483 PolarHBondContact O-N 3.49Å; L479-E483 VanDerWaalsContact O-N 3.07Å
480	E	88.9	Confident	90	Very high	71 Å²	71	73.6 Å²	73.6	33%	0.332	36%	0.356	S	S	.	.	H	α-helix	trans	-59.6	-44.9	176.6	-68.4	161.2	-123.3	0	0	111.1	S476 K482 E483 M484 F555	S476-E480 PolarHBondContact O-N 3.08Å; S476-E480 PolarHBondContact OG-OE1 2.63Å; E480-K482 VanDerWaalsContact C-N 3.32Å; E480-K482 PolarHBondContact O-N 3.19Å; E480-E483 PolarHBondContact O-N 2.94Å; E480-M484 WeakPolarHBondContact O-CG 3.31Å; E480-M484 PolarHBondContact O-N 3.48Å; E480-F555 HydrophobicContact CB-CD1 4.35Å; E480-F555 HydrophobicContact CB-CE1 3.96Å; E480-F555 HydrophobicContact CB-CZ 4.4Å; E480-F555 WeakPolarHBondContact OE2-CE1 3.4Å
481	L	90.5	Very high	89.9	Confident	23 Å²	23	74 Å²	74	12%	0.12	36%	0.357	C	S	.	.	H	α-helix	trans	-53.9	-45.6	173.7	175.8	59.7	0	0	0	112.2	T477 L479 E483 M484 Q485 L552 F555 Q556	T477-L481 VanDerWaalsContact O-CB 3.29Å; T477-L481 WeakPolarHBondContact O-CB 2.99Å; T477-L481 PolarHBondContact O-N 3.01Å; L479-L481 PolarHBondContact O-N 3Å; L481-E483 VanDerWaalsContact C-N 3.34Å; L481-E483 PolarHBondContact O-N 3.33Å; L481-M484 PolarHBondContact O-N 2.77Å; L481-Q485 WeakPolarHBondContact O-CG 3.22Å; L481-Q485 PolarHBondContact O-N 3.25Å; L481-L552 HydrophobicContact CD1-CD1 4.13Å; L481-L552 HydrophobicContact CD1-CG 4.21Å; L481-F555 HydrophobicContact CB-CB 4.29Å; L481-F555 HydrophobicContact CD1-CB 3.93Å; L481-Q556 HydrophobicContact CD1-CG 3.68Å; L481-Q556 HydrophobicContact CD2-CG 4.17Å
482	K	90.9	Very high	90	Very high	143 Å²	143	71.8 Å²	71.8	62%	0.622	35%	0.349	S	S	*	.	H	α-helix	trans	-66	-34.6	177.3	-75.1	176.3	177.5	180	0	112.8	R478 L479 E480 R486	R478-K482 WeakPolarHBondContact O-CG 3.28Å; R478-K482 PolarHBondContact O-N 2.85Å; L479-K482 PolarHBondContact O-N 3.25Å; E480-K482 VanDerWaalsContact C-N 3.32Å; E480-K482 PolarHBondContact O-N 3.19Å; K482-R486 PolarHBondContact O-N 3.08Å; K482-R486 VanDerWaalsContact O-N 3.11Å
483	E	89	Confident	90	Very high	96 Å²	96	71.4 Å²	71.4	45%	0.449	35%	0.353	S	S	.	.	H	α-helix	trans	-69.3	-36.5	174.7	-157.8	-171.4	127.1	0	0	111.7	L479 E480 L481 R486 K487	L479-E483 PolarHBondContact O-N 3.49Å; L479-E483 VanDerWaalsContact O-N 3.07Å; E480-E483 PolarHBondContact O-N 2.94Å; L481-E483 VanDerWaalsContact C-N 3.34Å; L481-E483 PolarHBondContact O-N 3.33Å; E483-R486 PolarHBondContact O-N 2.76Å; E483-K487 WeakPolarHBondContact O-CG 3.39Å; E483-K487 PolarHBondContact O-N 3.28Å; E483-K487 WeakPolarHBondContact OE1-CE 3.42Å; E483-K487 IonicContact OE1-NZ 3.47Å; E483-K487 PolarHBondContact OE1-NZ 3.21Å
484	M	88.3	Confident	90	Very high	33 Å²	33	71.2 Å²	71.2	16%	0.163	35%	0.351	C	S	.	.	H	α-helix	trans	-71.4	-35.7	174.6	-58.3	-48.9	159.7	0	0	112.5	E480 L481 K487 L488 L552 F555	E480-M484 WeakPolarHBondContact O-CG 3.31Å; E480-M484 PolarHBondContact O-N 3.48Å; L481-M484 PolarHBondContact O-N 2.77Å; M484-K487 PolarHBondContact O-N 2.81Å; M484-K487 HydrophobicContact SD-CD 3.79Å; M484-L488 WeakPolarHBondContact O-CB 3.25Å; M484-L488 PolarHBondContact O-N 3.26Å; M484-L552 HydrophobicContact CB-CD1 3.98Å; M484-F555 HydrophobicContact CE-CE2 4.18Å; M484-F555 HydrophobicContact CE-CZ 4.46Å; M484-F555 HydrophobicContact CG-CD2 3.88Å; M484-F555 HydrophobicContact CG-CE2 3.8Å
485	Q	91.1	Very high	90	Very high	75 Å²	75	73 Å²	73	35%	0.35	36%	0.358	S	S	.	.	H	α-helix	trans	-55	-52.2	169	-74.4	178.2	-46.1	0	0	110.5	L481 K487 L488 E489 L552	L481-Q485 WeakPolarHBondContact O-CG 3.22Å; L481-Q485 PolarHBondContact O-N 3.25Å; Q485-K487 VanDerWaalsContact C-N 3.3Å; Q485-K487 PolarHBondContact O-N 3.07Å; Q485-L488 PolarHBondContact O-N 2.88Å; Q485-L488 VanDerWaalsContact O-N 3.16Å; Q485-E489 WeakPolarHBondContact O-CG 3.16Å; Q485-E489 PolarHBondContact O-N 3.47Å; Q485-L552 HydrophobicContact CB-CD1 4.38Å; Q485-L552 HydrophobicContact CG-CD1 3.73Å
486	R	90.7	Very high	90.1	Very high	115 Å²	115	74.9 Å²	74.9	43%	0.434	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-32.9	179.7	-162.9	-173.1	64.1	67.5	5.4	113.4	K482 E483 Q490	K482-R486 PolarHBondContact O-N 3.08Å; K482-R486 VanDerWaalsContact O-N 3.11Å; E483-R486 PolarHBondContact O-N 2.76Å; R486-Q490 VanDerWaalsContact NH1-CD 3.25Å; R486-Q490 VanDerWaalsContact O-CG 3.32Å; R486-Q490 WeakPolarHBondContact O-CG 3.14Å; R486-Q490 PolarHBondContact O-N 3.03Å
487	K	90.4	Very high	90.3	Very high	65 Å²	65	77.7 Å²	77.7	28%	0.283	36%	0.362	S	S	.	.	H	α-helix	trans	-70.7	-42.3	174.4	-73.7	166.3	-173.4	163.4	0	111.8	E483 M484 Q485 Q490 E491 L548	E483-K487 WeakPolarHBondContact O-CG 3.39Å; E483-K487 PolarHBondContact O-N 3.28Å; E483-K487 WeakPolarHBondContact OE1-CE 3.42Å; E483-K487 IonicContact OE1-NZ 3.47Å; E483-K487 PolarHBondContact OE1-NZ 3.21Å; M484-K487 PolarHBondContact O-N 2.81Å; M484-K487 HydrophobicContact SD-CD 3.79Å; Q485-K487 VanDerWaalsContact C-N 3.3Å; Q485-K487 PolarHBondContact O-N 3.07Å; K487-Q490 PolarHBondContact O-N 2.92Å; K487-E491 PolarHBondContact O-N 2.83Å; K487-L548 HydrophobicContact CB-CD1 4.39Å; K487-L548 HydrophobicContact CB-CD2 4.13Å
488	L	92.3	Very high	90.3	Very high	26 Å²	26	77.8 Å²	77.8	14%	0.136	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-42.8	176.1	178.4	62.2	0	0	0	111.4	M484 Q485 Q490 E491 V492 E545 L548 R549 L552	M484-L488 WeakPolarHBondContact O-CB 3.25Å; M484-L488 PolarHBondContact O-N 3.26Å; Q485-L488 PolarHBondContact O-N 2.88Å; Q485-L488 VanDerWaalsContact O-N 3.16Å; L488-Q490 VanDerWaalsContact C-N 3.33Å; L488-Q490 PolarHBondContact O-N 3.18Å; L488-E491 PolarHBondContact O-N 3.14Å; L488-V492 HydrophobicContact CD1-CG2 4.24Å; L488-V492 HydrophobicContact CG-CG2 4.46Å; L488-V492 WeakPolarHBondContact O-CB 3.28Å; L488-V492 VanDerWaalsContact O-CG2 3.24Å; L488-V492 WeakPolarHBondContact O-CG2 3.2Å; L488-V492 PolarHBondContact O-N 3.05Å; L488-E545 HydrophobicContact CD1-CG 3.57Å; L488-L548 HydrophobicContact CB-CB 4.32Å; L488-L548 HydrophobicContact CD1-CB 3.93Å; L488-R549 HydrophobicContact CD1-CG 3.7Å; L488-R549 HydrophobicContact CD2-CG 3.98Å; L488-L552 HydrophobicContact CD2-CD2 3.97Å
489	E	91.2	Very high	90.3	Very high	115 Å²	115	75.9 Å²	75.9	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-55.5	-46.9	173.4	-71.8	166.8	168.3	0	0	111.6	Q485 E491 V492 E493	Q485-E489 WeakPolarHBondContact O-CG 3.16Å; Q485-E489 PolarHBondContact O-N 3.47Å; E489-E491 PolarHBondContact O-N 3.27Å; E489-V492 PolarHBondContact O-N 2.85Å; E489-E493 WeakPolarHBondContact O-CG 3.3Å; E489-E493 PolarHBondContact O-N 2.99Å
490	Q	90.3	Very high	90.4	Very high	101 Å²	101	73.6 Å²	73.6	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-37.7	178.9	-71.4	-175.4	-47.9	0	0	113.3	R486 K487 L488 A494	R486-Q490 VanDerWaalsContact NH1-CD 3.25Å; R486-Q490 VanDerWaalsContact O-CG 3.32Å; R486-Q490 WeakPolarHBondContact O-CG 3.14Å; R486-Q490 PolarHBondContact O-N 3.03Å; K487-Q490 PolarHBondContact O-N 2.92Å; L488-Q490 VanDerWaalsContact C-N 3.33Å; L488-Q490 PolarHBondContact O-N 3.18Å; Q490-A494 VanDerWaalsContact O-CB 3.31Å; Q490-A494 WeakPolarHBondContact O-CB 3.49Å; Q490-A494 PolarHBondContact O-N 3.29Å
491	E	88.7	Confident	90.5	Very high	52 Å²	52	73.1 Å²	73.1	24%	0.243	35%	0.349	C	S	.	.	H	α-helix	trans	-72.3	-33.4	176.6	-152.4	73.4	-159.6	0	0	111.8	K487 L488 E489 A494 R495 Q541 E545 L548	K487-E491 PolarHBondContact O-N 2.83Å; L488-E491 PolarHBondContact O-N 3.14Å; E489-E491 PolarHBondContact O-N 3.27Å; E491-A494 PolarHBondContact O-N 2.88Å; E491-R495 WeakPolarHBondContact O-CB 3.44Å; E491-R495 PolarHBondContact O-N 2.81Å; E491-Q541 PolarHBondContact OE1-NE2 2.64Å; E491-E545 HydrophobicContact CG-CB 4.42Å; E491-L548 HydrophobicContact CB-CD1 3.75Å; E491-L548 HydrophobicContact CG-CD1 4.05Å
492	V	91.1	Very high	90.5	Very high	34 Å²	34	72.2 Å²	72.2	21%	0.206	35%	0.345	C	S	.	.	H	α-helix	trans	-65.5	-46.4	172.7	169	0	0	0	0	111.1	L488 E489 A494 R495 Q496 E545	L488-V492 HydrophobicContact CD1-CG2 4.24Å; L488-V492 HydrophobicContact CG-CG2 4.46Å; L488-V492 WeakPolarHBondContact O-CB 3.28Å; L488-V492 VanDerWaalsContact O-CG2 3.24Å; L488-V492 WeakPolarHBondContact O-CG2 3.2Å; L488-V492 PolarHBondContact O-N 3.05Å; E489-V492 PolarHBondContact O-N 2.85Å; V492-A494 VanDerWaalsContact C-N 3.33Å; V492-A494 PolarHBondContact O-N 3.15Å; V492-R495 PolarHBondContact O-N 2.89Å; V492-Q496 WeakPolarHBondContact O-CG 3.39Å; V492-Q496 PolarHBondContact O-N 3.44Å; V492-E545 VanDerWaalsContact CG2-CD 3.45Å; V492-E545 HydrophobicContact CG2-CG 3.77Å
493	E	90.8	Very high	90.4	Very high	134 Å²	134	70.4 Å²	70.4	63%	0.626	34%	0.339	S	S	*	.	H	α-helix	trans	-59.7	-44.2	174.7	-74.5	-179.6	166.2	0	0	111.3	E489 Q496 H497	E489-E493 WeakPolarHBondContact O-CG 3.3Å; E489-E493 PolarHBondContact O-N 2.99Å; E493-Q496 PolarHBondContact O-N 3.16Å; E493-H497 PolarHBondContact O-N 2.89Å
494	A	89.2	Confident	90.4	Very high	36 Å²	36	71.1 Å²	71.1	30%	0.298	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-39.5	179.1	0	0	0	0	0	112.5	Q490 E491 V492 H497 V498	Q490-A494 VanDerWaalsContact O-CB 3.31Å; Q490-A494 WeakPolarHBondContact O-CB 3.49Å; Q490-A494 PolarHBondContact O-N 3.29Å; E491-A494 PolarHBondContact O-N 2.88Å; V492-A494 VanDerWaalsContact C-N 3.33Å; V492-A494 PolarHBondContact O-N 3.15Å; A494-H497 PolarHBondContact O-N 3.43Å; A494-V498 WeakPolarHBondContact O-CG2 3.3Å; A494-V498 PolarHBondContact O-N 3.4Å; A494-V498 VanDerWaalsContact O-N 3.07Å
495	R	91.5	Very high	90.4	Very high	43 Å²	43	70 Å²	70	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-48.5	170.3	-174.2	178.8	52.2	69.8	11.4	111.7	E491 V492 H497 V498 E499 L538 Q541 E545	E491-R495 WeakPolarHBondContact O-CB 3.44Å; E491-R495 PolarHBondContact O-N 2.81Å; V492-R495 PolarHBondContact O-N 2.89Å; R495-H497 VanDerWaalsContact C-N 3.25Å; R495-H497 PolarHBondContact O-N 3.22Å; R495-V498 PolarHBondContact O-N 2.79Å; R495-V498 VanDerWaalsContact O-N 3.1Å; R495-E499 HydrophobicContact CG-CG 4.36Å; R495-E499 IonicContact CZ-OE1 3.95Å; R495-E499 IonicContact NH1-OE1 2.79Å; R495-E499 PolarHBondContact NH1-OE1 3.32Å; R495-E499 IonicContact NH1-OE2 3.54Å; R495-E499 PolarHBondContact NH1-OE2 2.7Å; R495-E499 WeakPolarHBondContact O-CG 3.49Å; R495-E499 PolarHBondContact O-N 3.07Å; R495-L538 HydrophobicContact CG-CD1 3.54Å; R495-Q541 HydrophobicContact CB-CB 4.19Å; R495-Q541 HydrophobicContact CG-CB 4.39Å; R495-E545 IonicContact CZ-OE2 2.67Å; R495-E545 VanDerWaalsContact CZ-OE2 3.26Å; R495-E545 IonicContact NE-OE2 2.65Å; R495-E545 PolarHBondContact NE-OE2 3.44Å; R495-E545 IonicContact NH2-OE2 3.14Å; R495-E545 PolarHBondContact NH2-OE2 2.99Å
496	Q	91.1	Very high	90.3	Very high	101 Å²	101	71.6 Å²	71.6	47%	0.472	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-36.3	179	-73.1	177.4	23.3	0	0	112.1	V492 E493 E499 T500	V492-Q496 WeakPolarHBondContact O-CG 3.39Å; V492-Q496 PolarHBondContact O-N 3.44Å; E493-Q496 PolarHBondContact O-N 3.16Å; Q496-E499 PolarHBondContact O-N 2.93Å; Q496-T500 WeakPolarHBondContact O-CB 3.38Å; Q496-T500 PolarHBondContact O-N 2.98Å; Q496-T500 PolarHBondContact O-OG1 3.14Å
497	H	90.7	Very high	90.1	Very high	116 Å²	116	69.1 Å²	69.1	54%	0.537	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-44.2	173.8	-175.6	48.5	0	0	0	112	E493 A494 R495 T500 L501	E493-H497 PolarHBondContact O-N 2.89Å; A494-H497 PolarHBondContact O-N 3.43Å; R495-H497 VanDerWaalsContact C-N 3.25Å; R495-H497 PolarHBondContact O-N 3.22Å; H497-T500 PolarHBondContact O-N 2.82Å; H497-L501 WeakPolarHBondContact O-CG 3.41Å; H497-L501 PolarHBondContact O-N 3.33Å
498	V	89.9	Confident	89.9	Confident	17 Å²	17	68 Å²	68	10%	0.103	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-37.7	175.2	176.2	0	0	0	0	112	A494 R495 T500 L501 L502 L534 R537 L538 Q541	A494-V498 WeakPolarHBondContact O-CG2 3.3Å; A494-V498 PolarHBondContact O-N 3.4Å; A494-V498 VanDerWaalsContact O-N 3.07Å; R495-V498 PolarHBondContact O-N 2.79Å; R495-V498 VanDerWaalsContact O-N 3.1Å; V498-T500 VanDerWaalsContact C-N 3.34Å; V498-L501 PolarHBondContact O-N 3.38Å; V498-L502 WeakPolarHBondContact O-CB 3.23Å; V498-L502 PolarHBondContact O-N 3.28Å; V498-L534 HydrophobicContact CG1-CD2 4.43Å; V498-R537 HydrophobicContact CG1-CB 4.07Å; V498-L538 HydrophobicContact CG1-CB 3.96Å; V498-Q541 HydrophobicContact CG2-CG 4.42Å
499	E	90.5	Very high	89.5	Confident	75 Å²	75	69 Å²	69	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-38.9	173.6	-73.2	176.9	169.3	0	0	112.2	R495 Q496 L502 Q503 L538	R495-E499 HydrophobicContact CG-CG 4.36Å; R495-E499 IonicContact CZ-OE1 3.95Å; R495-E499 IonicContact NH1-OE1 2.79Å; R495-E499 PolarHBondContact NH1-OE1 3.32Å; R495-E499 IonicContact NH1-OE2 3.54Å; R495-E499 PolarHBondContact NH1-OE2 2.7Å; R495-E499 WeakPolarHBondContact O-CG 3.49Å; R495-E499 PolarHBondContact O-N 3.07Å; Q496-E499 PolarHBondContact O-N 2.93Å; E499-L502 PolarHBondContact O-N 2.86Å; E499-Q503 WeakPolarHBondContact O-CB 3.22Å; E499-Q503 PolarHBondContact O-N 2.94Å; E499-L538 HydrophobicContact CG-CD1 3.54Å; E499-L538 HydrophobicContact CG-CD2 4.03Å; E499-L538 HydrophobicContact CG-CG 4.46Å
500	T	90.8	Very high	89.2	Confident	74 Å²	74	65.7 Å²	65.7	45%	0.454	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-51.2	175.8	-55.4	0	0	0	0	110.6	Q496 H497 V498 L502 Q503 E504	Q496-T500 WeakPolarHBondContact O-CB 3.38Å; Q496-T500 PolarHBondContact O-N 2.98Å; Q496-T500 PolarHBondContact O-OG1 3.14Å; H497-T500 PolarHBondContact O-N 2.82Å; V498-T500 VanDerWaalsContact C-N 3.34Å; T500-L502 VanDerWaalsContact C-N 3.29Å; T500-L502 PolarHBondContact O-N 3.33Å; T500-Q503 PolarHBondContact O-N 3.14Å; T500-Q503 VanDerWaalsContact O-N 3.12Å; T500-E504 WeakPolarHBondContact O-CG 3.42Å; T500-E504 PolarHBondContact O-N 3.41Å
501	L	90.8	Very high	88.8	Confident	61 Å²	61	69 Å²	69	32%	0.319	35%	0.345	S	S	.	.	H	α-helix	trans	-59.4	-38.4	176.3	-69.3	171.4	0	0	0	112.4	H497 V498 E504 A505 L534	H497-L501 WeakPolarHBondContact O-CG 3.41Å; H497-L501 PolarHBondContact O-N 3.33Å; V498-L501 PolarHBondContact O-N 3.38Å; L501-E504 PolarHBondContact O-N 3.36Å; L501-A505 VanDerWaalsContact O-CB 3.29Å; L501-A505 WeakPolarHBondContact O-CB 3.46Å; L501-A505 PolarHBondContact O-N 3.48Å; L501-L534 HydrophobicContact CB-CD1 4.38Å; L501-L534 HydrophobicContact CB-CD2 4.03Å
502	L	91	Very high	88.1	Confident	4 Å²	4	69.2 Å²	69.2	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-67.3	-37.2	176.5	178.9	61.1	0	0	0	112	V498 E499 T500 R506 I531 L534 N535 L538	V498-L502 WeakPolarHBondContact O-CB 3.23Å; V498-L502 PolarHBondContact O-N 3.28Å; E499-L502 PolarHBondContact O-N 2.86Å; T500-L502 VanDerWaalsContact C-N 3.29Å; T500-L502 PolarHBondContact O-N 3.33Å; L502-R506 WeakPolarHBondContact O-CB 3.48Å; L502-R506 WeakPolarHBondContact O-CD 3.43Å; L502-R506 WeakPolarHBondContact O-CG 3.35Å; L502-R506 PolarHBondContact O-N 2.87Å; L502-I531 HydrophobicContact CD1-CG2 4.19Å; L502-L534 HydrophobicContact CB-CB 4.26Å; L502-L534 HydrophobicContact CD1-CB 3.85Å; L502-N535 WeakPolarHBondContact CD2-OD1 3.35Å; L502-L538 HydrophobicContact CD2-CD2 3.5Å
503	Q	89.8	Confident	87.3	Confident	106 Å²	106	73.4 Å²	73.4	50%	0.495	36%	0.364	S	S	.	.	H	α-helix	trans	-71.2	-41.1	175.2	-175	59.4	22.8	0	0	111.6	E499 T500 R506 T507	E499-Q503 WeakPolarHBondContact O-CB 3.22Å; E499-Q503 PolarHBondContact O-N 2.94Å; T500-Q503 PolarHBondContact O-N 3.14Å; T500-Q503 VanDerWaalsContact O-N 3.12Å; Q503-R506 PolarHBondContact O-N 3.05Å; Q503-T507 WeakPolarHBondContact O-CG2 3.48Å; Q503-T507 PolarHBondContact O-N 3.25Å; Q503-T507 PolarHBondContact O-OG1 2.88Å
504	E	89.1	Confident	86.5	Confident	110 Å²	110	74 Å²	74	51%	0.514	37%	0.367	S	S	.	.	H	α-helix	trans	-58.3	-50.5	172.3	-72.4	174.7	170.1	0	0	110.9	T500 L501 R506 T507 A508	T500-E504 WeakPolarHBondContact O-CG 3.42Å; T500-E504 PolarHBondContact O-N 3.41Å; L501-E504 PolarHBondContact O-N 3.36Å; E504-R506 VanDerWaalsContact C-N 3.34Å; E504-R506 PolarHBondContact O-N 2.99Å; E504-T507 PolarHBondContact O-N 3.47Å; E504-T507 PolarHBondContact O-OG1 3.27Å; E504-A508 WeakPolarHBondContact O-CB 3.27Å; E504-A508 PolarHBondContact O-N 3.03Å
505	A	87.2	Confident	85.5	Confident	9 Å²	9	76 Å²	76	7%	0.074	38%	0.384	C	S	.	.	H	α-helix	trans	-59.2	-41.5	176.9	0	0	0	0	0	112.6	L501 A508 Y509 M527 I531 L534	L501-A505 VanDerWaalsContact O-CB 3.29Å; L501-A505 WeakPolarHBondContact O-CB 3.46Å; L501-A505 PolarHBondContact O-N 3.48Å; A505-A508 PolarHBondContact O-N 3.2Å; A505-Y509 WeakPolarHBondContact O-CB 3.5Å; A505-Y509 PolarHBondContact O-N 2.9Å; A505-M527 HydrophobicContact CB-CE 4.25Å; A505-M527 VanDerWaalsContact O-CE 3.25Å; A505-M527 WeakPolarHBondContact O-CE 3.42Å; A505-I531 HydrophobicContact CB-CG1 3.89Å; A505-L534 HydrophobicContact CB-CD1 3.86Å
506	R	89.3	Confident	84	Confident	110 Å²	110	76.6 Å²	76.6	42%	0.415	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-41	175.4	-75.7	168.4	-178.5	-178.3	2.3	112.8	L502 Q503 E504 Y509 A510 I531 N535	L502-R506 WeakPolarHBondContact O-CB 3.48Å; L502-R506 WeakPolarHBondContact O-CD 3.43Å; L502-R506 WeakPolarHBondContact O-CG 3.35Å; L502-R506 PolarHBondContact O-N 2.87Å; Q503-R506 PolarHBondContact O-N 3.05Å; E504-R506 VanDerWaalsContact C-N 3.34Å; E504-R506 PolarHBondContact O-N 2.99Å; R506-Y509 PolarHBondContact O-N 2.7Å; R506-A510 PolarHBondContact O-N 2.9Å; R506-I531 HydrophobicContact CG-CD1 4.19Å; R506-I531 HydrophobicContact CG-CG1 4.45Å; R506-N535 PolarHBondContact NH2-OD1 3.3Å
507	T	87.3	Confident	82.3	Confident	62 Å²	62	77.9 Å²	77.9	38%	0.38	40%	0.4	S	S	.	.	H	α-helix	trans	-68.5	-39.7	176.1	56.6	0	0	0	0	112.2	Q503 E504 A510 Y511	Q503-T507 WeakPolarHBondContact O-CG2 3.48Å; Q503-T507 PolarHBondContact O-N 3.25Å; Q503-T507 PolarHBondContact O-OG1 2.88Å; E504-T507 PolarHBondContact O-N 3.47Å; E504-T507 PolarHBondContact O-OG1 3.27Å; T507-A510 PolarHBondContact O-N 3.02Å; T507-Y511 WeakPolarHBondContact O-CD2 3.38Å; T507-Y511 PolarHBondContact O-N 3.24Å
508	A	84.8	Confident	80.6	Confident	41 Å²	41	81.4 Å²	81.4	34%	0.339	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-40.5	174.5	0	0	0	0	0	112.1	E504 A505 Y511 L512 M527	E504-A508 WeakPolarHBondContact O-CB 3.27Å; E504-A508 PolarHBondContact O-N 3.03Å; A505-A508 PolarHBondContact O-N 3.2Å; A508-Y511 PolarHBondContact O-N 2.61Å; A508-L512 WeakPolarHBondContact O-CG 3.23Å; A508-L512 PolarHBondContact O-N 3Å; A508-L512 VanDerWaalsContact O-N 3.08Å; A508-M527 HydrophobicContact CB-CE 3.66Å
509	Y	85.1	Confident	79	Confident	49 Å²	49	86.9 Å²	86.9	19%	0.192	44%	0.443	C	S	.	.	H	α-helix	trans	-61.5	-46.5	172.7	177.7	-89.2	0	0	0	111.8	A505 R506 Y511 L512 E513 M527 E528 I531	A505-Y509 WeakPolarHBondContact O-CB 3.5Å; A505-Y509 PolarHBondContact O-N 2.9Å; R506-Y509 PolarHBondContact O-N 2.7Å; Y509-Y511 PolarHBondContact O-N 3.35Å; Y509-L512 WeakPolarHBondContact O-CB 3.48Å; Y509-L512 PolarHBondContact O-N 2.79Å; Y509-L512 VanDerWaalsContact O-N 3.08Å; Y509-E513 HydrophobicContact CE1-CB 4.4Å; Y509-E513 PolarHBondContact O-N 2.93Å; Y509-M527 HydrophobicContact CD2-CB 4.01Å; Y509-E528 HydrophobicContact CD2-CG 4.38Å; Y509-E528 HydrophobicContact CE2-CG 3.66Å; Y509-I531 HydrophobicContact CD2-CD1 4.39Å; Y509-I531 HydrophobicContact CG-CD1 3.98Å
510	A	83.9	Confident	77.4	Confident	44 Å²	44	91.6 Å²	91.6	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-61.1	-40.2	177.5	0	0	0	0	0	112.8	R506 T507 L512 E513 E514	R506-A510 PolarHBondContact O-N 2.9Å; T507-A510 PolarHBondContact O-N 3.02Å; A510-L512 VanDerWaalsContact C-N 3.31Å; A510-L512 PolarHBondContact O-N 2.86Å; A510-E513 PolarHBondContact O-N 2.79Å; A510-E514 PolarHBondContact O-N 2.83Å
511	Y	81.8	Confident	76	Confident	172 Å²	172	89.9 Å²	89.9	68%	0.675	46%	0.456	S	S	*	.	H	α-helix	trans	-64.7	-32.8	173.6	-81.1	-59.7	0	0	0	113.2	T507 A508 Y509 A515	T507-Y511 WeakPolarHBondContact O-CD2 3.38Å; T507-Y511 PolarHBondContact O-N 3.24Å; A508-Y511 PolarHBondContact O-N 2.61Å; Y509-Y511 PolarHBondContact O-N 3.35Å; Y511-A515 VanDerWaalsContact O-CB 3.31Å; Y511-A515 WeakPolarHBondContact O-CB 3.37Å; Y511-A515 PolarHBondContact O-N 3.03Å
512	L	75.4	Confident	74.9	Confident	55 Å²	55	95.4 Å²	95.4	29%	0.288	48%	0.48	S	S	.	.	H	α-helix	trans	-72.7	-38.8	173.4	-70.8	166.9	0	0	0	111.6	A508 Y509 A510 A515 D516 M527	A508-L512 WeakPolarHBondContact O-CG 3.23Å; A508-L512 PolarHBondContact O-N 3Å; A508-L512 VanDerWaalsContact O-N 3.08Å; Y509-L512 WeakPolarHBondContact O-CB 3.48Å; Y509-L512 PolarHBondContact O-N 2.79Å; Y509-L512 VanDerWaalsContact O-N 3.08Å; A510-L512 VanDerWaalsContact C-N 3.31Å; A510-L512 PolarHBondContact O-N 2.86Å; L512-A515 PolarHBondContact O-N 3.39Å; L512-D516 WeakPolarHBondContact O-CB 3.44Å; L512-D516 PolarHBondContact O-N 2.68Å; L512-M527 HydrophobicContact CD1-CG 3.83Å
513	E	73.6	Confident	73.9	Confident	122 Å²	122	98.4 Å²	98.4	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-65.4	-39.1	176.9	-173.2	172.9	-153	0	0	112.4	Y509 A510	Y509-E513 HydrophobicContact CE1-CB 4.4Å; Y509-E513 PolarHBondContact O-N 2.93Å; A510-E513 PolarHBondContact O-N 2.79Å
514	E	72.9	Confident	73	Confident	148 Å²	148	94.4 Å²	94.4	69%	0.692	49%	0.485	S	S	*	.	H	α-helix	trans	-65.9	-37.5	171.8	-73.1	-170.9	166	0	0	112.4	A510 N517	A510-E514 PolarHBondContact O-N 2.83Å; E514-N517 PolarHBondContact O-ND2 2.9Å
515	A	68.5	Low	72.6	Confident	78 Å²	78	93.6 Å²	93.6	65%	0.645	48%	0.484	S	S	*	.	H	α-helix	trans	-78.3	-42.7	-176.3	0	0	0	0	0	113.9	Y511 L512 N517	Y511-A515 VanDerWaalsContact O-CB 3.31Å; Y511-A515 WeakPolarHBondContact O-CB 3.37Å; Y511-A515 PolarHBondContact O-N 3.03Å; L512-A515 PolarHBondContact O-N 3.39Å; A515-N517 PolarHBondContact O-N 3.16Å
516	D	60.7	Low	72.4	Confident	54 Å²	54	96.2 Å²	96.2	29%	0.289	50%	0.496	S	S	.	.			trans	-85.5	57.2	-169.7	-156.6	1.3	0	0	0	112.7	L512 K518 N519 S521	L512-D516 WeakPolarHBondContact O-CB 3.44Å; L512-D516 PolarHBondContact O-N 2.68Å; D516-K518 PolarHBondContact O-N 3.41Å; D516-N519 VanDerWaalsContact CG-O 3.24Å; D516-S521 WeakPolarHBondContact OD2-CB 3.46Å; D516-S521 PolarHBondContact OD2-N 2.95Å; D516-S521 PolarHBondContact OD2-OG 2.97Å
517	N	56	Low	72	Confident	128 Å²	128	92 Å²	92	68%	0.684	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	90.1	-178.7	-114.1	-86.7	0	0	0	111.6	E514 A515	E514-N517 PolarHBondContact O-ND2 2.9Å; A515-N517 PolarHBondContact O-N 3.16Å
518	K	55.4	Low	71.9	Confident	191 Å²	191	93.5 Å²	93.5	83%	0.83	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.8	16.5	164.3	-54.4	169.1	-177.6	172.6	0	118.9	D516	D516-K518 PolarHBondContact O-N 3.41Å
519	N	55.9	Low	72	Confident	132 Å²	132	97.7 Å²	97.7	71%	0.706	49%	0.492	S	S	*	.	S	Bend	trans	-131.5	150.9	159.9	-73.9	-62.9	0	0	0	110.2	D516 S521	D516-N519 VanDerWaalsContact CG-O 3.24Å; N519-S521 PolarHBondContact O-N 3.4Å
520	Q	55.8	Low	72.1	Confident	174 Å²	174	99 Å²	99	81%	0.813	50%	0.499	S	S	*	.			trans	-85	95	167	-71.2	-179.5	-58.8	0	0	108
521	S	61.7	Low	72.4	Confident	38 Å²	38	98 Å²	98	27%	0.266	49%	0.488	S	S	.	.			trans	-69	147.3	170.5	59.8	0	0	0	0	111.9	D516 N519 S523 S524	D516-S521 WeakPolarHBondContact OD2-CB 3.46Å; D516-S521 PolarHBondContact OD2-N 2.95Å; D516-S521 PolarHBondContact OD2-OG 2.97Å; N519-S521 PolarHBondContact O-N 3.4Å; S521-S523 PolarHBondContact O-N 3.22Å; S521-S523 VanDerWaalsContact O-N 3.15Å; S521-S524 WeakPolarHBondContact O-CB 3.5Å; S521-S524 PolarHBondContact O-N 2.93Å
522	E	67.1	Low	72.7	Confident	176 Å²	176	93.6 Å²	93.6	82%	0.822	48%	0.482	S	S	*	.	H	α-helix	trans	-57.7	-26.8	175.1	-162.9	167.3	-146.1	0	0	112	S524 D526	E522-S524 PolarHBondContact O-N 2.96Å; E522-D526 PolarHBondContact O-N 2.89Å
523	S	70.3	Confident	73.4	Confident	68 Å²	68	94.4 Å²	94.4	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-69.4	-25.3	174.7	-167.9	0	0	0	0	114.2	S521 M527	S521-S523 PolarHBondContact O-N 3.22Å; S521-S523 VanDerWaalsContact O-N 3.15Å; S523-M527 VanDerWaalsContact O-CG 3.3Å; S523-M527 WeakPolarHBondContact O-CG 3.38Å; S523-M527 PolarHBondContact O-N 2.99Å
524	S	72.3	Confident	74.2	Confident	22 Å²	22	89.5 Å²	89.5	15%	0.154	46%	0.462	C	S	.	.	H	α-helix	trans	-74.4	-44.8	176.5	-174.7	0	0	0	0	110.7	S521 E522 D526 M527 E528	S521-S524 WeakPolarHBondContact O-CB 3.5Å; S521-S524 PolarHBondContact O-N 2.93Å; E522-S524 PolarHBondContact O-N 2.96Å; S524-D526 PolarHBondContact O-N 3.36Å; S524-M527 WeakPolarHBondContact O-CB 3.33Å; S524-M527 PolarHBondContact O-N 2.81Å; S524-M527 VanDerWaalsContact O-N 3.13Å; S524-E528 PolarHBondContact O-N 3.42Å
525	L	79.4	Confident	75.1	Confident	93 Å²	93	85.5 Å²	85.5	49%	0.487	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-36.5	179.4	-69.2	169.1	0	0	0	113.4	R529	L525-R529 PolarHBondContact O-N 3.01Å; L525-R529 VanDerWaalsContact O-N 3.09Å
526	D	83	Confident	76.1	Confident	63 Å²	63	85.8 Å²	85.8	34%	0.337	43%	0.433	S	S	.	.	H	α-helix	trans	-69.5	-35.6	174.6	-165	69.9	0	0	0	111.7	E522 S524 R529 Q530	E522-D526 PolarHBondContact O-N 2.89Å; S524-D526 PolarHBondContact O-N 3.36Å; D526-R529 PolarHBondContact O-N 3.23Å; D526-R529 IonicContact OD1-CZ 3.56Å; D526-R529 IonicContact OD1-NH1 2.68Å; D526-R529 PolarHBondContact OD1-NH1 3.39Å; D526-R529 IonicContact OD1-NH2 3.01Å; D526-Q530 WeakPolarHBondContact O-CG 3.48Å; D526-Q530 PolarHBondContact O-N 2.93Å; D526-Q530 PolarHBondContact OD2-NE2 2.92Å
527	M	81.7	Confident	77.5	Confident	23 Å²	23	89.6 Å²	89.6	11%	0.113	44%	0.443	C	S	.	.	H	α-helix	trans	-67.5	-39.5	174.2	-71.7	-64.3	-60.3	0	0	112.7	A505 A508 Y509 L512 S523 S524 R529 Q530 I531	A505-M527 HydrophobicContact CB-CE 4.25Å; A505-M527 VanDerWaalsContact O-CE 3.25Å; A505-M527 WeakPolarHBondContact O-CE 3.42Å; A508-M527 HydrophobicContact CB-CE 3.66Å; Y509-M527 HydrophobicContact CD2-CB 4.01Å; L512-M527 HydrophobicContact CD1-CG 3.83Å; S523-M527 VanDerWaalsContact O-CG 3.3Å; S523-M527 WeakPolarHBondContact O-CG 3.38Å; S523-M527 PolarHBondContact O-N 2.99Å; S524-M527 WeakPolarHBondContact O-CB 3.33Å; S524-M527 PolarHBondContact O-N 2.81Å; S524-M527 VanDerWaalsContact O-N 3.13Å; M527-R529 VanDerWaalsContact C-N 3.29Å; M527-R529 PolarHBondContact O-N 3.21Å; M527-Q530 PolarHBondContact O-N 2.83Å; M527-I531 WeakPolarHBondContact O-CB 3.22Å; M527-I531 WeakPolarHBondContact O-CG1 3.39Å; M527-I531 PolarHBondContact O-N 3.25Å
528	E	84.3	Confident	79.2	Confident	92 Å²	92	85 Å²	85	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-57.1	-44.1	169	-70.8	-174	170.5	0	0	111.1	Y509 S524 I531 S532	Y509-E528 HydrophobicContact CD2-CG 4.38Å; Y509-E528 HydrophobicContact CE2-CG 3.66Å; S524-E528 PolarHBondContact O-N 3.42Å; E528-I531 PolarHBondContact O-N 3.47Å; E528-S532 PolarHBondContact O-N 3.42Å
529	R	86.6	Confident	80.9	Confident	130 Å²	130	81.4 Å²	81.4	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-65.7	-43.5	178.7	-150.7	-168.6	80	-110.3	-13.2	111.8	L525 D526 M527 I531 S532 E533	L525-R529 PolarHBondContact O-N 3.01Å; L525-R529 VanDerWaalsContact O-N 3.09Å; D526-R529 PolarHBondContact O-N 3.23Å; D526-R529 IonicContact OD1-CZ 3.56Å; D526-R529 IonicContact OD1-NH1 2.68Å; D526-R529 PolarHBondContact OD1-NH1 3.39Å; D526-R529 IonicContact OD1-NH2 3.01Å; M527-R529 VanDerWaalsContact C-N 3.29Å; M527-R529 PolarHBondContact O-N 3.21Å; R529-I531 PolarHBondContact O-N 2.62Å; R529-S532 WeakPolarHBondContact O-CB 3.22Å; R529-S532 PolarHBondContact O-N 3.13Å; R529-E533 IonicContact CZ-OE1 3.25Å; R529-E533 VanDerWaalsContact CZ-OE1 3.25Å; R529-E533 IonicContact NE-OE1 2.8Å; R529-E533 PolarHBondContact NE-OE1 3.42Å; R529-E533 IonicContact NH2-OE1 3.43Å; R529-E533 PolarHBondContact NH2-OE1 3.49Å; R529-E533 WeakPolarHBondContact O-CG 3.47Å; R529-E533 PolarHBondContact O-N 3.29Å
530	Q	88.3	Confident	82.5	Confident	75 Å²	75	79.4 Å²	79.4	35%	0.35	39%	0.388	S	S	.	.	H	α-helix	trans	-60.9	-42.5	175.1	-71.8	-178.5	41.5	0	0	111.8	D526 M527 S532 E533 L534	D526-Q530 WeakPolarHBondContact O-CG 3.48Å; D526-Q530 PolarHBondContact O-N 2.93Å; D526-Q530 PolarHBondContact OD2-NE2 2.92Å; M527-Q530 PolarHBondContact O-N 2.83Å; Q530-S532 VanDerWaalsContact C-N 3.34Å; Q530-S532 PolarHBondContact O-N 3.01Å; Q530-E533 PolarHBondContact O-N 2.88Å; Q530-L534 WeakPolarHBondContact O-CB 3.47Å; Q530-L534 VanDerWaalsContact O-CG 3.29Å; Q530-L534 WeakPolarHBondContact O-CG 3.26Å; Q530-L534 PolarHBondContact O-N 3.4Å
531	I	89.4	Confident	84.1	Confident	25 Å²	25	73 Å²	73	13%	0.128	36%	0.359	C	S	.	.	H	α-helix	trans	-61.9	-41.9	174	-72.4	168.5	0	0	0	110.7	L502 A505 R506 Y509 M527 E528 R529 L534 N535	L502-I531 HydrophobicContact CD1-CG2 4.19Å; A505-I531 HydrophobicContact CB-CG1 3.89Å; R506-I531 HydrophobicContact CG-CD1 4.19Å; R506-I531 HydrophobicContact CG-CG1 4.45Å; Y509-I531 HydrophobicContact CD2-CD1 4.39Å; Y509-I531 HydrophobicContact CG-CD1 3.98Å; M527-I531 WeakPolarHBondContact O-CB 3.22Å; M527-I531 WeakPolarHBondContact O-CG1 3.39Å; M527-I531 PolarHBondContact O-N 3.25Å; E528-I531 PolarHBondContact O-N 3.47Å; R529-I531 PolarHBondContact O-N 2.62Å; I531-L534 PolarHBondContact O-N 3.4Å; I531-N535 WeakPolarHBondContact CG2-ND2 3.43Å; I531-N535 WeakPolarHBondContact O-CB 3.43Å; I531-N535 VanDerWaalsContact O-CG 3.24Å; I531-N535 PolarHBondContact O-N 2.97Å; I531-N535 PolarHBondContact O-ND2 3.19Å
532	S	88.8	Confident	85.4	Confident	78 Å²	78	73.4 Å²	73.4	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-64	-44.1	175.7	-167.2	0	0	0	0	112.6	E528 R529 Q530 L534 N535 E536	E528-S532 PolarHBondContact O-N 3.42Å; R529-S532 WeakPolarHBondContact O-CB 3.22Å; R529-S532 PolarHBondContact O-N 3.13Å; Q530-S532 VanDerWaalsContact C-N 3.34Å; Q530-S532 PolarHBondContact O-N 3.01Å; S532-L534 VanDerWaalsContact C-N 3.34Å; S532-L534 PolarHBondContact O-N 3.37Å; S532-N535 PolarHBondContact O-N 2.65Å; S532-E536 PolarHBondContact O-N 2.84Å; S532-E536 VanDerWaalsContact O-N 3.16Å
533	E	89.5	Confident	86.5	Confident	73 Å²	73	68.1 Å²	68.1	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-39.3	175.7	-73.1	-179.1	-141	0	0	111.8	R529 Q530 R537	R529-E533 IonicContact CZ-OE1 3.25Å; R529-E533 VanDerWaalsContact CZ-OE1 3.25Å; R529-E533 IonicContact NE-OE1 2.8Å; R529-E533 PolarHBondContact NE-OE1 3.42Å; R529-E533 IonicContact NH2-OE1 3.43Å; R529-E533 PolarHBondContact NH2-OE1 3.49Å; R529-E533 WeakPolarHBondContact O-CG 3.47Å; R529-E533 PolarHBondContact O-N 3.29Å; Q530-E533 PolarHBondContact O-N 2.88Å; E533-R537 WeakPolarHBondContact O-CG 3.23Å; E533-R537 PolarHBondContact O-N 2.75Å; E533-R537 VanDerWaalsContact O-N 3.09Å; E533-R537 IonicContact OE2-NH2 2.69Å
534	L	91.1	Very high	87.4	Confident	18 Å²	18	65.7 Å²	65.7	9%	0.094	32%	0.323	C	S	.	.	H	α-helix	trans	-72	-38.2	177.3	-72.9	167.3	0	0	0	112.7	V498 L501 L502 A505 Q530 I531 S532 E536 R537 L538	V498-L534 HydrophobicContact CG1-CD2 4.43Å; L501-L534 HydrophobicContact CB-CD1 4.38Å; L501-L534 HydrophobicContact CB-CD2 4.03Å; L502-L534 HydrophobicContact CB-CB 4.26Å; L502-L534 HydrophobicContact CD1-CB 3.85Å; A505-L534 HydrophobicContact CB-CD1 3.86Å; Q530-L534 WeakPolarHBondContact O-CB 3.47Å; Q530-L534 VanDerWaalsContact O-CG 3.29Å; Q530-L534 WeakPolarHBondContact O-CG 3.26Å; Q530-L534 PolarHBondContact O-N 3.4Å; I531-L534 PolarHBondContact O-N 3.4Å; S532-L534 VanDerWaalsContact C-N 3.34Å; S532-L534 PolarHBondContact O-N 3.37Å; L534-E536 PolarHBondContact O-N 2.69Å; L534-R537 PolarHBondContact O-N 2.81Å; L534-L538 WeakPolarHBondContact O-CB 3.38Å; L534-L538 PolarHBondContact O-N 3.42Å
535	N	91	Very high	88.2	Confident	64 Å²	64	65.3 Å²	65.3	34%	0.342	32%	0.318	S	S	.	.	H	α-helix	trans	-61.1	-41.7	173.5	-73.6	-47	0	0	0	111.6	L502 R506 I531 S532 L538 R539	L502-N535 WeakPolarHBondContact CD2-OD1 3.35Å; R506-N535 PolarHBondContact NH2-OD1 3.3Å; I531-N535 WeakPolarHBondContact CG2-ND2 3.43Å; I531-N535 WeakPolarHBondContact O-CB 3.43Å; I531-N535 VanDerWaalsContact O-CG 3.24Å; I531-N535 PolarHBondContact O-N 2.97Å; I531-N535 PolarHBondContact O-ND2 3.19Å; S532-N535 PolarHBondContact O-N 2.65Å; N535-L538 WeakPolarHBondContact O-CB 3.17Å; N535-L538 PolarHBondContact O-N 2.94Å; N535-R539 PolarHBondContact O-N 3.21Å
536	E	90.2	Very high	88.8	Confident	84 Å²	84	65.9 Å²	65.9	39%	0.393	32%	0.318	S	S	.	.	H	α-helix	trans	-71.2	-37.6	178.2	179.4	59.5	-169.5	0	0	112.2	S532 L534 L538 R539 L540	S532-E536 PolarHBondContact O-N 2.84Å; S532-E536 VanDerWaalsContact O-N 3.16Å; L534-E536 PolarHBondContact O-N 2.69Å; E536-L538 VanDerWaalsContact C-N 3.32Å; E536-L538 PolarHBondContact O-N 3.41Å; E536-R539 WeakPolarHBondContact O-CB 3.48Å; E536-R539 PolarHBondContact O-N 3.07Å; E536-R539 IonicContact OE1-CZ 3.83Å; E536-R539 IonicContact OE1-NE 3.2Å; E536-R539 PolarHBondContact OE1-NE 3.06Å; E536-R539 IonicContact OE1-NH2 2.98Å; E536-R539 PolarHBondContact OE1-NH2 2.97Å; E536-R539 IonicContact OE2-CZ 3.59Å; E536-R539 IonicContact OE2-NE 2.79Å; E536-R539 PolarHBondContact OE2-NE 3.17Å; E536-R539 IonicContact OE2-NH2 3.2Å; E536-L540 HydrophobicContact CG-CD1 4.44Å; E536-L540 WeakPolarHBondContact O-CG 3.34Å; E536-L540 PolarHBondContact O-N 3.48Å
537	R	90.4	Very high	89.1	Confident	135 Å²	135	68.1 Å²	68.1	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-43.4	169.7	-71.7	177.4	-160.8	-177.3	10.7	111.4	V498 E533 L534 R539 L540 Q541	V498-R537 HydrophobicContact CG1-CB 4.07Å; E533-R537 WeakPolarHBondContact O-CG 3.23Å; E533-R537 PolarHBondContact O-N 2.75Å; E533-R537 VanDerWaalsContact O-N 3.09Å; E533-R537 IonicContact OE2-NH2 2.69Å; L534-R537 PolarHBondContact O-N 2.81Å; R537-R539 VanDerWaalsContact C-N 3.31Å; R537-R539 PolarHBondContact O-N 2.86Å; R537-L540 PolarHBondContact O-N 3.17Å; R537-Q541 WeakPolarHBondContact O-CB 3.36Å; R537-Q541 VanDerWaalsContact O-CG 3.23Å; R537-Q541 WeakPolarHBondContact O-CG 3.47Å; R537-Q541 PolarHBondContact O-N 3.46Å
538	L	91.2	Very high	89.6	Confident	30 Å²	30	68.3 Å²	68.3	16%	0.157	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-39.7	176.7	179.1	54.4	0	0	0	111.8	R495 V498 E499 L502 L534 N535 E536 Q541 S542	R495-L538 HydrophobicContact CG-CD1 3.54Å; V498-L538 HydrophobicContact CG1-CB 3.96Å; E499-L538 HydrophobicContact CG-CD1 3.54Å; E499-L538 HydrophobicContact CG-CD2 4.03Å; E499-L538 HydrophobicContact CG-CG 4.46Å; L502-L538 HydrophobicContact CD2-CD2 3.5Å; L534-L538 WeakPolarHBondContact O-CB 3.38Å; L534-L538 PolarHBondContact O-N 3.42Å; N535-L538 WeakPolarHBondContact O-CB 3.17Å; N535-L538 PolarHBondContact O-N 2.94Å; E536-L538 VanDerWaalsContact C-N 3.32Å; E536-L538 PolarHBondContact O-N 3.41Å; L538-Q541 PolarHBondContact O-N 3.37Å; L538-S542 WeakPolarHBondContact O-CB 3.46Å; L538-S542 PolarHBondContact O-N 3.33Å; L538-S542 PolarHBondContact O-OG 3.35Å
539	R	91.3	Very high	89.9	Confident	116 Å²	116	69.1 Å²	69.1	44%	0.438	33%	0.326	S	S	.	.	H	α-helix	trans	-60.9	-49.4	175	-163.9	-176.1	71.6	70.7	10.9	111.5	N535 E536 R537 S542 E543	N535-R539 PolarHBondContact O-N 3.21Å; E536-R539 WeakPolarHBondContact O-CB 3.48Å; E536-R539 PolarHBondContact O-N 3.07Å; E536-R539 IonicContact OE1-CZ 3.83Å; E536-R539 IonicContact OE1-NE 3.2Å; E536-R539 PolarHBondContact OE1-NE 3.06Å; E536-R539 IonicContact OE1-NH2 2.98Å; E536-R539 PolarHBondContact OE1-NH2 2.97Å; E536-R539 IonicContact OE2-CZ 3.59Å; E536-R539 IonicContact OE2-NE 2.79Å; E536-R539 PolarHBondContact OE2-NE 3.17Å; E536-R539 IonicContact OE2-NH2 3.2Å; R537-R539 VanDerWaalsContact C-N 3.31Å; R537-R539 PolarHBondContact O-N 2.86Å; R539-S542 PolarHBondContact O-N 2.89Å; R539-E543 IonicContact CZ-OE1 3.9Å; R539-E543 IonicContact NH1-OE1 2.74Å; R539-E543 PolarHBondContact NH1-OE1 2.85Å; R539-E543 IonicContact NH2-OE1 2.94Å; R539-E543 PolarHBondContact O-N 2.77Å
540	L	89.7	Confident	90.2	Very high	90 Å²	90	67.7 Å²	67.7	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-37.7	179.3	-67.7	171.1	0	0	0	112.9	E536 R537 G544	E536-L540 HydrophobicContact CG-CD1 4.44Å; E536-L540 WeakPolarHBondContact O-CG 3.34Å; E536-L540 PolarHBondContact O-N 3.48Å; R537-L540 PolarHBondContact O-N 3.17Å; L540-G544 PolarHBondContact O-N 3.24Å
541	Q	88.1	Confident	90.2	Very high	41 Å²	41	68.1 Å²	68.1	19%	0.192	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-42.4	173.9	-71.2	-73.3	-90.4	0	0	112.2	E491 R495 V498 R537 L538 E543 G544 E545	E491-Q541 PolarHBondContact OE1-NE2 2.64Å; R495-Q541 HydrophobicContact CB-CB 4.19Å; R495-Q541 HydrophobicContact CG-CB 4.39Å; V498-Q541 HydrophobicContact CG2-CG 4.42Å; R537-Q541 WeakPolarHBondContact O-CB 3.36Å; R537-Q541 VanDerWaalsContact O-CG 3.23Å; R537-Q541 WeakPolarHBondContact O-CG 3.47Å; R537-Q541 PolarHBondContact O-N 3.46Å; L538-Q541 PolarHBondContact O-N 3.37Å; Q541-E543 VanDerWaalsContact C-N 3.34Å; Q541-E543 PolarHBondContact O-N 3.39Å; Q541-G544 PolarHBondContact O-N 3.44Å; Q541-G544 VanDerWaalsContact O-N 3.08Å; Q541-E545 PolarHBondContact O-N 3.03Å
542	S	89.3	Confident	90.3	Very high	45 Å²	45	68 Å²	68	32%	0.315	33%	0.332	S	S	.	.	H	α-helix	trans	-62.9	-41.6	176.6	-56.2	0	0	0	0	111.8	L538 R539 G544 E545 E546	L538-S542 WeakPolarHBondContact O-CB 3.46Å; L538-S542 PolarHBondContact O-N 3.33Å; L538-S542 PolarHBondContact O-OG 3.35Å; R539-S542 PolarHBondContact O-N 2.89Å; S542-G544 VanDerWaalsContact C-N 3.29Å; S542-G544 PolarHBondContact O-N 3.25Å; S542-E545 PolarHBondContact O-N 3.38Å; S542-E546 WeakPolarHBondContact O-CB 3.44Å; S542-E546 PolarHBondContact O-N 2.84Å
543	E	90.2	Very high	90.5	Very high	65 Å²	65	66.8 Å²	66.8	30%	0.304	33%	0.327	S	S	.	.	H	α-helix	trans	-63.7	-29.5	171.7	-92.8	-162.6	-125.7	0	0	113.8	R539 Q541 K547	R539-E543 IonicContact CZ-OE1 3.9Å; R539-E543 IonicContact NH1-OE1 2.74Å; R539-E543 PolarHBondContact NH1-OE1 2.85Å; R539-E543 IonicContact NH2-OE1 2.94Å; R539-E543 PolarHBondContact O-N 2.77Å; Q541-E543 VanDerWaalsContact C-N 3.34Å; Q541-E543 PolarHBondContact O-N 3.39Å; E543-K547 WeakPolarHBondContact O-CD 3.44Å; E543-K547 VanDerWaalsContact O-CE 3.28Å; E543-K547 WeakPolarHBondContact O-CE 3.41Å; E543-K547 VanDerWaalsContact O-CG 3.27Å; E543-K547 WeakPolarHBondContact O-CG 3.36Å; E543-K547 PolarHBondContact O-NZ 3.41Å; E543-K547 IonicContact OE2-NZ 2.67Å; E543-K547 PolarHBondContact OE2-NZ 3.37Å
544	G	89	Confident	90.5	Very high	18 Å²	18	68.3 Å²	68.3	19%	0.186	34%	0.337	C	S	.	.	H	α-helix	trans	-73	-48.3	174.5	0	0	0	0	0	111.5	L540 Q541 S542 E546 K547 L548	L540-G544 PolarHBondContact O-N 3.24Å; Q541-G544 PolarHBondContact O-N 3.44Å; Q541-G544 VanDerWaalsContact O-N 3.08Å; S542-G544 VanDerWaalsContact C-N 3.29Å; S542-G544 PolarHBondContact O-N 3.25Å; G544-E546 PolarHBondContact O-N 3.32Å; G544-K547 PolarHBondContact O-N 3.47Å; G544-L548 WeakPolarHBondContact O-CG 3.18Å; G544-L548 PolarHBondContact O-N 3.17Å; G544-L548 VanDerWaalsContact O-N 3.1Å
545	E	90.3	Very high	90.4	Very high	13 Å²	13	69.5 Å²	69.5	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-45.3	177.6	-161.2	-163.5	126.6	0	0	111.2	L488 E491 V492 R495 Q541 S542 K547 L548 R549	L488-E545 HydrophobicContact CD1-CG 3.57Å; E491-E545 HydrophobicContact CG-CB 4.42Å; V492-E545 VanDerWaalsContact CG2-CD 3.45Å; V492-E545 HydrophobicContact CG2-CG 3.77Å; R495-E545 IonicContact CZ-OE2 2.67Å; R495-E545 VanDerWaalsContact CZ-OE2 3.26Å; R495-E545 IonicContact NE-OE2 2.65Å; R495-E545 PolarHBondContact NE-OE2 3.44Å; R495-E545 IonicContact NH2-OE2 3.14Å; R495-E545 PolarHBondContact NH2-OE2 2.99Å; Q541-E545 PolarHBondContact O-N 3.03Å; S542-E545 PolarHBondContact O-N 3.38Å; E545-K547 PolarHBondContact O-N 3.38Å; E545-L548 PolarHBondContact O-N 2.92Å; E545-R549 WeakPolarHBondContact O-CG 3.41Å; E545-R549 PolarHBondContact O-N 2.84Å; E545-R549 IonicContact OE1-CZ 2.76Å; E545-R549 IonicContact OE1-NE 3.64Å; E545-R549 PolarHBondContact OE1-NE 3.17Å; E545-R549 IonicContact OE1-NH2 3.62Å; E545-R549 PolarHBondContact OE1-NH2 3.32Å; E545-R549 IonicContact OE2-NH2 2.83Å
546	E	90.8	Very high	90.4	Very high	105 Å²	105	71 Å²	71	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-58.8	-48.2	179	-173.5	169.2	-136	0	0	112.5	S542 G544 L548 R549 D550	S542-E546 WeakPolarHBondContact O-CB 3.44Å; S542-E546 PolarHBondContact O-N 2.84Å; G544-E546 PolarHBondContact O-N 3.32Å; E546-L548 VanDerWaalsContact C-N 3.28Å; E546-L548 PolarHBondContact O-N 3.03Å; E546-R549 PolarHBondContact O-N 3.4Å; E546-R549 VanDerWaalsContact O-N 3.12Å; E546-D550 PolarHBondContact O-N 3.06Å
547	K	90.9	Very high	90.5	Very high	111 Å²	111	69.7 Å²	69.7	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-63.5	-33.2	177.6	-67.7	162.4	-163	144.1	0	112.3	E543 G544 E545 L551	E543-K547 WeakPolarHBondContact O-CD 3.44Å; E543-K547 VanDerWaalsContact O-CE 3.28Å; E543-K547 WeakPolarHBondContact O-CE 3.41Å; E543-K547 VanDerWaalsContact O-CG 3.27Å; E543-K547 WeakPolarHBondContact O-CG 3.36Å; E543-K547 PolarHBondContact O-NZ 3.41Å; E543-K547 IonicContact OE2-NZ 2.67Å; E543-K547 PolarHBondContact OE2-NZ 3.37Å; G544-K547 PolarHBondContact O-N 3.47Å; E545-K547 PolarHBondContact O-N 3.38Å; K547-L551 WeakPolarHBondContact O-CG 3.37Å; K547-L551 PolarHBondContact O-N 3.45Å; K547-L551 VanDerWaalsContact O-N 3.16Å
548	L	90.4	Very high	90.5	Very high	27 Å²	27	66 Å²	66	14%	0.141	34%	0.343	C	S	.	.	H	α-helix	trans	-72.4	-36.7	174	-73.5	170.1	0	0	0	112.3	K487 L488 E491 G544 E545 E546 L551 L552	K487-L548 HydrophobicContact CB-CD1 4.39Å; K487-L548 HydrophobicContact CB-CD2 4.13Å; L488-L548 HydrophobicContact CB-CB 4.32Å; L488-L548 HydrophobicContact CD1-CB 3.93Å; E491-L548 HydrophobicContact CB-CD1 3.75Å; E491-L548 HydrophobicContact CG-CD1 4.05Å; G544-L548 WeakPolarHBondContact O-CG 3.18Å; G544-L548 PolarHBondContact O-N 3.17Å; G544-L548 VanDerWaalsContact O-N 3.1Å; E545-L548 PolarHBondContact O-N 2.92Å; E546-L548 VanDerWaalsContact C-N 3.28Å; E546-L548 PolarHBondContact O-N 3.03Å; L548-L551 PolarHBondContact O-N 2.91Å; L548-L552 WeakPolarHBondContact O-CB 3.43Å; L548-L552 PolarHBondContact O-N 3.49Å
549	R	92.1	Very high	90.5	Very high	108 Å²	108	65 Å²	65	41%	0.408	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-43.2	172.9	-69.3	-169.2	-125.6	107.9	-6.6	112	L488 E545 E546 L552 A553	L488-R549 HydrophobicContact CD1-CG 3.7Å; L488-R549 HydrophobicContact CD2-CG 3.98Å; E545-R549 WeakPolarHBondContact O-CG 3.41Å; E545-R549 PolarHBondContact O-N 2.84Å; E545-R549 IonicContact OE1-CZ 2.76Å; E545-R549 IonicContact OE1-NE 3.64Å; E545-R549 PolarHBondContact OE1-NE 3.17Å; E545-R549 IonicContact OE1-NH2 3.62Å; E545-R549 PolarHBondContact OE1-NH2 3.32Å; E545-R549 IonicContact OE2-NH2 2.83Å; E546-R549 PolarHBondContact O-N 3.4Å; E546-R549 VanDerWaalsContact O-N 3.12Å; R549-L552 VanDerWaalsContact O-CB 3.3Å; R549-L552 WeakPolarHBondContact O-CB 3.44Å; R549-L552 PolarHBondContact O-N 3.25Å; R549-A553 PolarHBondContact O-N 2.72Å
550	D	91.3	Very high	90.5	Very high	101 Å²	101	62 Å²	62	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-63.4	-44.5	177	-77.2	-9.6	0	0	0	111.9	E546 L552 A553 N554	E546-D550 PolarHBondContact O-N 3.06Å; D550-L552 VanDerWaalsContact C-N 3.31Å; D550-L552 PolarHBondContact O-N 3.03Å; D550-A553 PolarHBondContact O-N 3.43Å; D550-N554 PolarHBondContact O-N 2.91Å; D550-N554 VanDerWaalsContact O-N 3.16Å; D550-N554 PolarHBondContact O-ND2 3.07Å
551	L	89.9	Confident	90.6	Very high	84 Å²	84	61.7 Å²	61.7	44%	0.44	34%	0.337	S	S	.	.	H	α-helix	trans	-60.4	-42	173.4	-74.9	168.5	0	0	0	111.4	K547 L548 A553 N554 F555	K547-L551 WeakPolarHBondContact O-CG 3.37Å; K547-L551 PolarHBondContact O-N 3.45Å; K547-L551 VanDerWaalsContact O-N 3.16Å; L548-L551 PolarHBondContact O-N 2.91Å; L551-A553 PolarHBondContact O-N 2.93Å; L551-N554 PolarHBondContact O-N 2.83Å; L551-F555 VanDerWaalsContact O-CD2 3.22Å; L551-F555 WeakPolarHBondContact O-CD2 3.48Å; L551-F555 PolarHBondContact O-N 2.93Å
552	L	91.5	Very high	90.7	Very high	22 Å²	22	61.2 Å²	61.2	12%	0.115	34%	0.335	C	S	.	.	H	α-helix	trans	-57.2	-47.8	176.9	-155.2	86.2	0	0	0	112	L481 M484 Q485 L488 L548 R549 D550 N554 F555 Q556	L481-L552 HydrophobicContact CD1-CD1 4.13Å; L481-L552 HydrophobicContact CD1-CG 4.21Å; M484-L552 HydrophobicContact CB-CD1 3.98Å; Q485-L552 HydrophobicContact CB-CD1 4.38Å; Q485-L552 HydrophobicContact CG-CD1 3.73Å; L488-L552 HydrophobicContact CD2-CD2 3.97Å; L548-L552 WeakPolarHBondContact O-CB 3.43Å; L548-L552 PolarHBondContact O-N 3.49Å; R549-L552 VanDerWaalsContact O-CB 3.3Å; R549-L552 WeakPolarHBondContact O-CB 3.44Å; R549-L552 PolarHBondContact O-N 3.25Å; D550-L552 VanDerWaalsContact C-N 3.31Å; D550-L552 PolarHBondContact O-N 3.03Å; L552-N554 VanDerWaalsContact C-N 3.33Å; L552-N554 PolarHBondContact O-N 2.98Å; L552-F555 PolarHBondContact O-N 2.72Å; L552-Q556 WeakPolarHBondContact O-CG 3.44Å; L552-Q556 PolarHBondContact O-N 2.81Å
553	A	91.5	Very high	90.8	Very high	53 Å²	53	62.9 Å²	62.9	44%	0.438	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-40.1	180	0	0	0	0	0	112	R549 D550 L551 Q556 A557	R549-A553 PolarHBondContact O-N 2.72Å; D550-A553 PolarHBondContact O-N 3.43Å; L551-A553 PolarHBondContact O-N 2.93Å; A553-Q556 PolarHBondContact O-N 3.09Å; A553-A557 WeakPolarHBondContact O-CB 3.4Å; A553-A557 PolarHBondContact O-N 3.29Å
554	N	90.1	Very high	90.9	Very high	105 Å²	105	65.1 Å²	65.1	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-64.9	-42.9	175.7	-74.6	-68.2	0	0	0	112.3	D550 L551 L552 A557 T558	D550-N554 PolarHBondContact O-N 2.91Å; D550-N554 VanDerWaalsContact O-N 3.16Å; D550-N554 PolarHBondContact O-ND2 3.07Å; L551-N554 PolarHBondContact O-N 2.83Å; L552-N554 VanDerWaalsContact C-N 3.33Å; L552-N554 PolarHBondContact O-N 2.98Å; N554-A557 PolarHBondContact O-N 3.4Å; N554-T558 WeakPolarHBondContact O-CB 3.26Å; N554-T558 PolarHBondContact O-N 3.03Å; N554-T558 PolarHBondContact O-OG1 3.36Å
555	F	89.2	Confident	91	Very high	43 Å²	43	66.3 Å²	66.3	19%	0.189	36%	0.355	C	S	.	.	H	α-helix	trans	-65.6	-38.2	174.1	-79.4	-68.3	0	0	0	112.3	T477 E480 L481 M484 L551 L552 T558 C559	T477-F555 HydrophobicContact CG2-CD1 4.03Å; E480-F555 HydrophobicContact CB-CD1 4.35Å; E480-F555 HydrophobicContact CB-CE1 3.96Å; E480-F555 HydrophobicContact CB-CZ 4.4Å; E480-F555 WeakPolarHBondContact OE2-CE1 3.4Å; L481-F555 HydrophobicContact CB-CB 4.29Å; L481-F555 HydrophobicContact CD1-CB 3.93Å; M484-F555 HydrophobicContact CE-CE2 4.18Å; M484-F555 HydrophobicContact CE-CZ 4.46Å; M484-F555 HydrophobicContact CG-CD2 3.88Å; M484-F555 HydrophobicContact CG-CE2 3.8Å; L551-F555 VanDerWaalsContact O-CD2 3.22Å; L551-F555 WeakPolarHBondContact O-CD2 3.48Å; L551-F555 PolarHBondContact O-N 2.93Å; L552-F555 PolarHBondContact O-N 2.72Å; F555-T558 PolarHBondContact O-N 3.37Å; F555-C559 PolarHBondContact O-N 3.07Å; F555-C559 PolarHBondContact O-SG 3.43Å; F555-C559 VanDerWaalsContact O-SG 3.41Å
556	Q	91.6	Very high	91	Very high	95 Å²	95	66.5 Å²	66.5	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-63.5	-45.5	175.4	-74.2	176.2	-20.8	0	0	112.4	L481 L552 A553 T558 C559 S560	L481-Q556 HydrophobicContact CD1-CG 3.68Å; L481-Q556 HydrophobicContact CD2-CG 4.17Å; L552-Q556 WeakPolarHBondContact O-CG 3.44Å; L552-Q556 PolarHBondContact O-N 2.81Å; A553-Q556 PolarHBondContact O-N 3.09Å; Q556-T558 VanDerWaalsContact C-N 3.32Å; Q556-T558 PolarHBondContact O-N 3.14Å; Q556-C559 PolarHBondContact O-N 2.96Å; Q556-S560 PolarHBondContact O-N 3.37Å
557	A	92	Very high	91	Very high	56 Å²	56	68.3 Å²	68.3	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-38.7	175.6	0	0	0	0	0	112.2	A553 N554 S560 T561	A553-A557 WeakPolarHBondContact O-CB 3.4Å; A553-A557 PolarHBondContact O-N 3.29Å; N554-A557 PolarHBondContact O-N 3.4Å; A557-S560 PolarHBondContact O-N 2.94Å; A557-T561 WeakPolarHBondContact O-CG2 3.28Å; A557-T561 PolarHBondContact O-N 3.27Å; A557-T561 PolarHBondContact O-OG1 3.36Å
558	T	90	Very high	91.1	Very high	59 Å²	59	68.4 Å²	68.4	36%	0.362	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-44	175.8	-52.8	0	0	0	0	111.3	T477 N554 F555 Q556 T561 Q562	T477-T558 HydrophobicContact CG2-CG2 3.85Å; N554-T558 WeakPolarHBondContact O-CB 3.26Å; N554-T558 PolarHBondContact O-N 3.03Å; N554-T558 PolarHBondContact O-OG1 3.36Å; F555-T558 PolarHBondContact O-N 3.37Å; Q556-T558 VanDerWaalsContact C-N 3.32Å; Q556-T558 PolarHBondContact O-N 3.14Å; T558-T561 PolarHBondContact O-OG1 2.94Å; T558-T561 VanDerWaalsContact O-OG1 3.08Å; T558-Q562 WeakPolarHBondContact O-CB 3.17Å; T558-Q562 VanDerWaalsContact O-CG 3.28Å; T558-Q562 WeakPolarHBondContact O-CG 3.45Å; T558-Q562 PolarHBondContact O-N 3.48Å; T558-Q562 VanDerWaalsContact O-N 3.11Å
559	C	91	Very high	91	Very high	7 Å²	7	68.6 Å²	68.6	5%	0.047	37%	0.368	C	S	.	.	H	α-helix	trans	-60.4	-46.2	173.3	-71.9	0	0	0	0	112.4	L474 F555 Q556 T561 Q562 E563	L474-C559 HydrophobicContact CD1-CB 4.19Å; F555-C559 PolarHBondContact O-N 3.07Å; F555-C559 PolarHBondContact O-SG 3.43Å; F555-C559 VanDerWaalsContact O-SG 3.41Å; Q556-C559 PolarHBondContact O-N 2.96Å; C559-T561 PolarHBondContact O-N 2.83Å; C559-Q562 PolarHBondContact O-N 3.44Å; C559-E563 WeakPolarHBondContact O-CB 3.33Å; C559-E563 VanDerWaalsContact O-CG 3.28Å; C559-E563 WeakPolarHBondContact O-CG 3.34Å; C559-E563 PolarHBondContact O-N 2.84Å
560	S	91.2	Very high	90.9	Very high	55 Å²	55	70.4 Å²	70.4	39%	0.385	38%	0.375	S	S	.	.	H	α-helix	trans	-59.2	-49.1	-180	-161.6	0	0	0	0	111.8	Q556 A557 Q562 E563 E564	Q556-S560 PolarHBondContact O-N 3.37Å; A557-S560 PolarHBondContact O-N 2.94Å; S560-Q562 VanDerWaalsContact C-N 3.33Å; S560-Q562 PolarHBondContact O-N 3.15Å; S560-E563 PolarHBondContact O-N 3.09Å; S560-E563 VanDerWaalsContact O-N 3.14Å; S560-E564 WeakPolarHBondContact O-CB 3.35Å; S560-E564 VanDerWaalsContact O-CG 3.31Å; S560-E564 WeakPolarHBondContact O-CG 3.49Å; S560-E564 PolarHBondContact O-N 3.03Å; S560-E564 PolarHBondContact OG-OE1 2.91Å
561	T	91.7	Very high	91	Very high	83 Å²	83	67.6 Å²	67.6	51%	0.509	37%	0.366	S	S	.	.	H	α-helix	trans	-65.4	-33.3	-179.5	51.8	0	0	0	0	113.1	A557 T558 C559 A565	A557-T561 WeakPolarHBondContact O-CG2 3.28Å; A557-T561 PolarHBondContact O-N 3.27Å; A557-T561 PolarHBondContact O-OG1 3.36Å; T558-T561 PolarHBondContact O-OG1 2.94Å; T558-T561 VanDerWaalsContact O-OG1 3.08Å; C559-T561 PolarHBondContact O-N 2.83Å; T561-A565 VanDerWaalsContact O-CB 3.28Å; T561-A565 WeakPolarHBondContact O-CB 3.32Å; T561-A565 PolarHBondContact O-N 2.87Å
562	Q	90.2	Very high	91	Very high	31 Å²	31	68.1 Å²	68.1	15%	0.145	37%	0.365	C	S	.	.	H	α-helix	trans	-71.3	-37.3	172.1	-72	171.5	-10.8	0	0	112.5	L470 L474 T477 T558 C559 S560 A565 L566	L470-Q562 HydrophobicContact CD1-CB 4.39Å; L470-Q562 HydrophobicContact CD1-CG 4.21Å; L474-Q562 VanDerWaalsContact CA-OE1 3.31Å; L474-Q562 HydrophobicContact CB-CB 4.28Å; L474-Q562 HydrophobicContact CD1-CB 4Å; T477-Q562 PolarHBondContact OG1-NE2 2.96Å; T477-Q562 PolarHBondContact OG1-OE1 3.2Å; T558-Q562 WeakPolarHBondContact O-CB 3.17Å; T558-Q562 VanDerWaalsContact O-CG 3.28Å; T558-Q562 WeakPolarHBondContact O-CG 3.45Å; T558-Q562 PolarHBondContact O-N 3.48Å; T558-Q562 VanDerWaalsContact O-N 3.11Å; C559-Q562 PolarHBondContact O-N 3.44Å; S560-Q562 VanDerWaalsContact C-N 3.33Å; S560-Q562 PolarHBondContact O-N 3.15Å; Q562-A565 PolarHBondContact O-N 2.99Å; Q562-L566 WeakPolarHBondContact O-CG 3.46Å; Q562-L566 PolarHBondContact O-N 2.92Å
563	E	91.8	Very high	91	Very high	79 Å²	79	68.6 Å²	68.6	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-66.8	-42.8	176	-75.7	174	-162.5	0	0	111.9	L474 R478 C559 S560 L566 H567	L474-E563 HydrophobicContact CD1-CG 3.84Å; L474-E563 HydrophobicContact CD2-CG 3.44Å; L474-E563 VanDerWaalsContact CD2-CG 3.44Å; L474-E563 HydrophobicContact CG-CG 4.29Å; R478-E563 IonicContact CZ-OE1 3.48Å; R478-E563 IonicContact NE-OE1 3.45Å; R478-E563 PolarHBondContact NE-OE1 3.49Å; R478-E563 IonicContact NH2-OE1 2.65Å; R478-E563 PolarHBondContact NH2-OE1 3.43Å; R478-E563 IonicContact NH2-OE2 2.8Å; C559-E563 WeakPolarHBondContact O-CB 3.33Å; C559-E563 VanDerWaalsContact O-CG 3.28Å; C559-E563 WeakPolarHBondContact O-CG 3.34Å; C559-E563 PolarHBondContact O-N 2.84Å; S560-E563 PolarHBondContact O-N 3.09Å; S560-E563 VanDerWaalsContact O-N 3.14Å; E563-L566 PolarHBondContact O-N 3.44Å; E563-H567 PolarHBondContact O-N 3.08Å; E563-H567 VanDerWaalsContact O-N 3.09Å
564	E	92.7	Very high	90.9	Very high	113 Å²	113	69.3 Å²	69.3	53%	0.528	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-45.7	172.9	-71.2	160	-135.2	0	0	111.4	S560 L566 H567 E568	S560-E564 WeakPolarHBondContact O-CB 3.35Å; S560-E564 VanDerWaalsContact O-CG 3.31Å; S560-E564 WeakPolarHBondContact O-CG 3.49Å; S560-E564 PolarHBondContact O-N 3.03Å; S560-E564 PolarHBondContact OG-OE1 2.91Å; E564-L566 PolarHBondContact O-N 3.25Å; E564-H567 PolarHBondContact O-N 3.31Å; E564-E568 PolarHBondContact O-N 3.47Å
565	A	91.4	Very high	90.9	Very high	42 Å²	42	69.1 Å²	69.1	35%	0.347	36%	0.36	S	S	.	.	H	α-helix	trans	-65.1	-36.2	178.1	0	0	0	0	0	113.1	L470 T561 Q562 L569	L470-A565 HydrophobicContact CD2-CB 3.68Å; T561-A565 VanDerWaalsContact O-CB 3.28Å; T561-A565 WeakPolarHBondContact O-CB 3.32Å; T561-A565 PolarHBondContact O-N 2.87Å; Q562-A565 PolarHBondContact O-N 2.99Å; A565-L569 VanDerWaalsContact O-CB 3.23Å; A565-L569 WeakPolarHBondContact O-CB 3.32Å; A565-L569 PolarHBondContact O-N 3.26Å
566	L	90	Very high	90.9	Very high	17 Å²	17	67.8 Å²	67.8	9%	0.089	36%	0.355	C	S	.	.	H	α-helix	trans	-63.7	-42.5	171.4	-80.4	171	0	0	0	112.3	Y467 L470 E471 L474 Q562 E563 E564 L569 R570	Y467-L566 HydrophobicContact CD2-CD2 3.73Å; Y467-L566 HydrophobicContact CE2-CB 4.45Å; Y467-L566 HydrophobicContact CE2-CD2 3.72Å; Y467-L566 HydrophobicContact CG-CD2 4.23Å; Y467-L566 WeakPolarHBondContact O-CD2 3.46Å; L470-L566 HydrophobicContact CB-CD2 3.82Å; L470-L566 HydrophobicContact CB-CG 4.35Å; L470-L566 HydrophobicContact CD2-CB 4.46Å; L470-L566 HydrophobicContact CD2-CD2 3.87Å; L470-L566 HydrophobicContact CD2-CG 3.73Å; L470-L566 HydrophobicContact CG-CD2 3.84Å; L470-L566 HydrophobicContact CG-CG 3.8Å; E471-L566 HydrophobicContact CB-CD1 4.41Å; E471-L566 HydrophobicContact CB-CD2 4.13Å; L474-L566 HydrophobicContact CB-CD1 4.36Å; L474-L566 HydrophobicContact CD2-CD1 3.47Å; L474-L566 VanDerWaalsContact CD2-CD1 3.47Å; Q562-L566 WeakPolarHBondContact O-CG 3.46Å; Q562-L566 PolarHBondContact O-N 2.92Å; E563-L566 PolarHBondContact O-N 3.44Å; E564-L566 PolarHBondContact O-N 3.25Å; L566-L569 PolarHBondContact O-N 2.85Å; L566-R570 WeakPolarHBondContact O-CB 3.37Å; L566-R570 PolarHBondContact O-N 2.98Å
567	H	91.3	Very high	90.6	Very high	144 Å²	144	67 Å²	67	67%	0.667	35%	0.353	S	S	*	.	H	α-helix	trans	-63.3	-45.5	177.7	-174	-71.3	0	0	0	111.3	E563 E564 A571	E563-H567 PolarHBondContact O-N 3.08Å; E563-H567 VanDerWaalsContact O-N 3.09Å; E564-H567 PolarHBondContact O-N 3.31Å; H567-A571 WeakPolarHBondContact O-CB 3.47Å; H567-A571 PolarHBondContact O-N 2.81Å
568	E	91.3	Very high	90.5	Very high	113 Å²	113	69.4 Å²	69.4	53%	0.528	36%	0.357	S	S	.	.	H	α-helix	trans	-59.3	-45.6	173.7	-86.7	-158.3	-160.6	0	0	112.7	E564 A571 K572	E564-E568 PolarHBondContact O-N 3.47Å; E568-A571 PolarHBondContact O-N 2.83Å; E568-K572 WeakPolarHBondContact O-CD 3.39Å; E568-K572 VanDerWaalsContact O-CG 3.23Å; E568-K572 WeakPolarHBondContact O-CG 3.23Å; E568-K572 PolarHBondContact O-N 3.2Å; E568-K572 WeakPolarHBondContact OE2-CE 3.35Å; E568-K572 IonicContact OE2-NZ 2.66Å; E568-K572 PolarHBondContact OE2-NZ 3.45Å
569	L	89.8	Confident	90.4	Very high	31 Å²	31	71 Å²	71	16%	0.162	36%	0.361	C	S	.	.	H	α-helix	trans	-69.3	-38.5	-174.8	-167.5	60.5	0	0	0	111.6	M463 D466 A565 L566 K572 H573	M463-L569 HydrophobicContact CG-CD1 3.43Å; M463-L569 VanDerWaalsContact CG-CD1 3.43Å; M463-L569 HydrophobicContact CG-CG 4.02Å; M463-L569 HydrophobicContact SD-CD1 4.18Å; D466-L569 HydrophobicContact CB-CD2 3.83Å; A565-L569 VanDerWaalsContact O-CB 3.23Å; A565-L569 WeakPolarHBondContact O-CB 3.32Å; A565-L569 PolarHBondContact O-N 3.26Å; L566-L569 PolarHBondContact O-N 2.85Å; L569-K572 PolarHBondContact O-N 2.82Å; L569-H573 WeakPolarHBondContact O-CB 3.49Å; L569-H573 PolarHBondContact O-N 2.84Å
570	R	90.5	Very high	90.2	Very high	146 Å²	146	71 Å²	71	55%	0.551	36%	0.361	S	S	*	.	H	α-helix	trans	-63.6	-46.3	171.3	-177.5	175.2	174.6	174.2	1.3	112.2	Y467 L566 K572 H573 D574	Y467-R570 HydrophobicContact CD2-CB 4.21Å; Y467-R570 HydrophobicContact CE2-CB 4.06Å; L566-R570 WeakPolarHBondContact O-CB 3.37Å; L566-R570 PolarHBondContact O-N 2.98Å; R570-K572 VanDerWaalsContact C-N 3.26Å; R570-K572 PolarHBondContact O-N 3.27Å; R570-H573 WeakPolarHBondContact O-CB 3.49Å; R570-H573 PolarHBondContact O-N 2.83Å; R570-H573 VanDerWaalsContact O-N 3.1Å; R570-D574 IonicContact NE-OD2 2.71Å; R570-D574 VanDerWaalsContact O-CG 3.28Å; R570-D574 PolarHBondContact O-N 2.87Å
571	A	92.1	Very high	90.1	Very high	41 Å²	41	71.3 Å²	71.3	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-60.4	-36.9	177.9	0	0	0	0	0	112.3	H567 E568 I575	H567-A571 WeakPolarHBondContact O-CB 3.47Å; H567-A571 PolarHBondContact O-N 2.81Å; E568-A571 PolarHBondContact O-N 2.83Å; A571-I575 WeakPolarHBondContact O-CD1 3.44Å; A571-I575 VanDerWaalsContact O-CG1 3.27Å; A571-I575 WeakPolarHBondContact O-CG1 3.31Å; A571-I575 PolarHBondContact O-N 3.06Å
572	K	90.8	Very high	89.9	Confident	96 Å²	96	71.8 Å²	71.8	42%	0.417	36%	0.36	S	S	.	.	H	α-helix	trans	-69.6	-37.1	174.3	-67.4	160.4	-166.2	168.1	0	112.3	M463 E568 L569 R570 L576	M463-K572 HydrophobicContact CE-CB 4.19Å; M463-K572 HydrophobicContact SD-CB 3.45Å; M463-K572 WeakPolarHBondContact SD-CB 3.38Å; E568-K572 WeakPolarHBondContact O-CD 3.39Å; E568-K572 VanDerWaalsContact O-CG 3.23Å; E568-K572 WeakPolarHBondContact O-CG 3.23Å; E568-K572 PolarHBondContact O-N 3.2Å; E568-K572 WeakPolarHBondContact OE2-CE 3.35Å; E568-K572 IonicContact OE2-NZ 2.66Å; E568-K572 PolarHBondContact OE2-NZ 3.45Å; L569-K572 PolarHBondContact O-N 2.82Å; R570-K572 VanDerWaalsContact C-N 3.26Å; R570-K572 PolarHBondContact O-N 3.27Å; K572-L576 WeakPolarHBondContact O-CB 3.41Å; K572-L576 PolarHBondContact O-N 2.9Å
573	H	90.2	Very high	89.7	Confident	32 Å²	32	70.6 Å²	70.6	15%	0.148	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-48.2	176.1	167.6	-84.6	0	0	0	111	M463 L569 R570 I575 L576 M577	M463-H573 HydrophobicContact CG-CB 4.27Å; M463-H573 VanDerWaalsContact SD-CA 3.59Å; M463-H573 HydrophobicContact SD-CB 4Å; M463-H573 PolarHBondContact SD-N 3.12Å; L569-H573 WeakPolarHBondContact O-CB 3.49Å; L569-H573 PolarHBondContact O-N 2.84Å; R570-H573 WeakPolarHBondContact O-CB 3.49Å; R570-H573 PolarHBondContact O-N 2.83Å; R570-H573 VanDerWaalsContact O-N 3.1Å; H573-I575 PolarHBondContact O-N 3.37Å; H573-L576 CarbonylContact O-C 3.4Å; H573-L576 WeakPolarHBondContact O-CB 3.29Å; H573-L576 PolarHBondContact O-N 2.77Å; H573-M577 WeakPolarHBondContact O-CG 3.49Å; H573-M577 PolarHBondContact O-N 3.28Å
574	D	89.8	Confident	89.5	Confident	68 Å²	68	72.2 Å²	72.2	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-42.1	-175.5	-62.8	-12	0	0	0	110.8	R570 L576 M577 D578	R570-D574 IonicContact NE-OD2 2.71Å; R570-D574 VanDerWaalsContact O-CG 3.28Å; R570-D574 PolarHBondContact O-N 2.87Å; D574-L576 VanDerWaalsContact C-N 3.29Å; D574-L576 PolarHBondContact O-N 2.59Å; D574-M577 PolarHBondContact O-N 3.27Å; D574-D578 PolarHBondContact O-N 3.46Å; D574-D578 VanDerWaalsContact O-N 3.09Å
575	I	90.8	Very high	89.3	Confident	100 Å²	100	72.9 Å²	72.9	51%	0.513	37%	0.366	S	S	.	.	H	α-helix	trans	-59.4	-36.9	171.6	-68.5	166.4	0	0	0	112.6	A571 H573 Q579	A571-I575 WeakPolarHBondContact O-CD1 3.44Å; A571-I575 VanDerWaalsContact O-CG1 3.27Å; A571-I575 WeakPolarHBondContact O-CG1 3.31Å; A571-I575 PolarHBondContact O-N 3.06Å; H573-I575 PolarHBondContact O-N 3.37Å; I575-Q579 WeakPolarHBondContact O-CG 3.44Å; I575-Q579 PolarHBondContact O-N 3.11Å
576	L	88.8	Confident	89.1	Confident	15 Å²	15	74.2 Å²	74.2	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-75.9	-32	179.6	-178.4	59.9	0	0	0	111.8	M456 R459 M463 K572 H573 D574 Q579 C580	M456-L576 HydrophobicContact CB-CD1 4.05Å; M456-L576 HydrophobicContact CG-CD1 4.24Å; R459-L576 HydrophobicContact CB-CD2 3.64Å; M463-L576 HydrophobicContact CE-CD2 4.12Å; K572-L576 WeakPolarHBondContact O-CB 3.41Å; K572-L576 PolarHBondContact O-N 2.9Å; H573-L576 CarbonylContact O-C 3.4Å; H573-L576 WeakPolarHBondContact O-CB 3.29Å; H573-L576 PolarHBondContact O-N 2.77Å; D574-L576 VanDerWaalsContact C-N 3.29Å; D574-L576 PolarHBondContact O-N 2.59Å; L576-Q579 PolarHBondContact O-N 3Å; L576-C580 PolarHBondContact O-N 3.04Å; L576-C580 PolarHBondContact O-SG 2.99Å
577	M	85.9	Confident	88.9	Confident	80 Å²	80	74.9 Å²	74.9	39%	0.394	37%	0.371	S	S	.	.	H	α-helix	trans	-66.6	-40.9	173.2	-72.2	-56.8	-59.1	0	0	111.9	H573 D574 Q579 C580 T581	H573-M577 WeakPolarHBondContact O-CG 3.49Å; H573-M577 PolarHBondContact O-N 3.28Å; D574-M577 PolarHBondContact O-N 3.27Å; M577-Q579 VanDerWaalsContact C-N 3.33Å; M577-Q579 PolarHBondContact O-N 2.69Å; M577-C580 WeakPolarHBondContact O-CB 3.31Å; M577-C580 PolarHBondContact O-N 3.49Å; M577-T581 PolarHBondContact O-N 3.11Å
578	D	89.8	Confident	88.7	Confident	105 Å²	105	73.7 Å²	73.7	56%	0.561	36%	0.364	S	S	*	.	H	α-helix	trans	-56.1	-49	171.8	-69.7	-21.1	0	0	0	110.5	D574 C580 T581 D582	D574-D578 PolarHBondContact O-N 3.46Å; D574-D578 VanDerWaalsContact O-N 3.09Å; D578-C580 VanDerWaalsContact C-N 3.32Å; D578-C580 PolarHBondContact O-N 3.24Å; D578-T581 PolarHBondContact O-N 2.92Å; D578-T581 PolarHBondContact O-OG1 2.86Å; D578-D582 PolarHBondContact O-N 3.47Å
579	Q	88.3	Confident	88.6	Confident	92 Å²	92	73 Å²	73	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-61	-35	176.8	-69.2	172.4	17.9	0	0	113.5	M456 I575 L576 M577 A583	M456-Q579 HydrophobicContact SD-CB 4.07Å; I575-Q579 WeakPolarHBondContact O-CG 3.44Å; I575-Q579 PolarHBondContact O-N 3.11Å; L576-Q579 PolarHBondContact O-N 3Å; M577-Q579 VanDerWaalsContact C-N 3.33Å; M577-Q579 PolarHBondContact O-N 2.69Å; Q579-A583 WeakPolarHBondContact O-CB 3.35Å; Q579-A583 PolarHBondContact O-N 2.81Å
580	C	86.6	Confident	88.3	Confident	8 Å²	8	72 Å²	72	5%	0.054	36%	0.357	C	S	.	.	H	α-helix	trans	-62.8	-42.6	171.1	-72.1	0	0	0	0	111.6	F453 M456 L576 M577 D578 A583 Q584	F453-C580 WeakPolarHBondContact CD2-O 3.41Å; F453-C580 HydrophobicContact CE2-CB 4.45Å; M456-C580 VanDerWaalsContact C-SG 3.5Å; M456-C580 VanDerWaalsContact CB-SG 3.59Å; L576-C580 PolarHBondContact O-N 3.04Å; L576-C580 PolarHBondContact O-SG 2.99Å; M577-C580 WeakPolarHBondContact O-CB 3.31Å; M577-C580 PolarHBondContact O-N 3.49Å; D578-C580 VanDerWaalsContact C-N 3.32Å; D578-C580 PolarHBondContact O-N 3.24Å; C580-A583 PolarHBondContact O-N 2.97Å; C580-Q584 WeakPolarHBondContact O-CB 3.25Å; C580-Q584 PolarHBondContact O-N 3.05Å
581	T	87.8	Confident	87.9	Confident	61 Å²	61	68.8 Å²	68.8	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-69.3	-36.8	179.3	65.9	0	0	0	0	113.1	M577 D578 Q584 Q585	M577-T581 PolarHBondContact O-N 3.11Å; D578-T581 PolarHBondContact O-N 2.92Å; D578-T581 PolarHBondContact O-OG1 2.86Å; T581-Q584 PolarHBondContact O-N 3.48Å; T581-Q585 WeakPolarHBondContact O-CG 3.44Å; T581-Q585 PolarHBondContact O-N 3.27Å; T581-Q585 PolarHBondContact O-NE2 3.03Å
582	D	88.8	Confident	87.6	Confident	93 Å²	93	70.4 Å²	70.4	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-63.1	-44.6	172.5	-79.3	-16.6	0	0	0	111.2	D578 Q584 Q585 N586	D578-D582 PolarHBondContact O-N 3.47Å; D582-Q584 VanDerWaalsContact C-N 3.34Å; D582-Q584 PolarHBondContact O-N 3.3Å; D582-Q585 PolarHBondContact O-N 3.05Å; D582-N586 PolarHBondContact O-N 2.83Å; D582-N586 PolarHBondContact O-ND2 3.41Å
583	A	86.1	Confident	87.2	Confident	6 Å²	6	69.5 Å²	69.5	5%	0.05	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-36	176.9	0	0	0	0	0	112.6	F453 M456 Q579 C580 N586 L587	F453-A583 HydrophobicContact CB-CB 4.21Å; F453-A583 HydrophobicContact CD2-CB 4.19Å; M456-A583 HydrophobicContact CE-CB 3.41Å; M456-A583 VanDerWaalsContact CE-CB 3.41Å; Q579-A583 WeakPolarHBondContact O-CB 3.35Å; Q579-A583 PolarHBondContact O-N 2.81Å; C580-A583 PolarHBondContact O-N 2.97Å; A583-N586 PolarHBondContact O-N 3.1Å; A583-L587 VanDerWaalsContact O-CB 3.29Å; A583-L587 WeakPolarHBondContact O-CB 3.37Å; A583-L587 PolarHBondContact O-N 3.32Å
584	Q	86.5	Confident	86.7	Confident	114 Å²	114	68.2 Å²	68.2	53%	0.533	34%	0.343	S	S	.	.	H	α-helix	trans	-64.8	-40.6	174.8	-164.6	179.4	19.7	0	0	112	F453 C580 T581 D582 K588	F453-Q584 HydrophobicContact CD2-CB 4.04Å; F453-Q584 HydrophobicContact CE2-CB 3.79Å; F453-Q584 HydrophobicContact CE2-CG 4.17Å; C580-Q584 WeakPolarHBondContact O-CB 3.25Å; C580-Q584 PolarHBondContact O-N 3.05Å; T581-Q584 PolarHBondContact O-N 3.48Å; D582-Q584 VanDerWaalsContact C-N 3.34Å; D582-Q584 PolarHBondContact O-N 3.3Å; Q584-K588 PolarHBondContact O-N 3.35Å
585	Q	88.8	Confident	86.2	Confident	126 Å²	126	69.8 Å²	69.8	59%	0.589	35%	0.348	S	S	*	.	H	α-helix	trans	-65.4	-44.8	175	-73	175.3	69.3	0	0	111.8	T581 D582 K588 M589	T581-Q585 WeakPolarHBondContact O-CG 3.44Å; T581-Q585 PolarHBondContact O-N 3.27Å; T581-Q585 PolarHBondContact O-NE2 3.03Å; D582-Q585 PolarHBondContact O-N 3.05Å; Q585-K588 PolarHBondContact O-N 3.45Å; Q585-M589 PolarHBondContact O-N 3.47Å
586	N	87.2	Confident	85.7	Confident	71 Å²	71	71.3 Å²	71.3	38%	0.38	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-45.1	176.1	-75.3	-59.2	0	0	0	112.1	E449 D582 A583 K588 M589 V590	E449-N586 HydrophobicContact CG-CB 4.44Å; D582-N586 PolarHBondContact O-N 2.83Å; D582-N586 PolarHBondContact O-ND2 3.41Å; A583-N586 PolarHBondContact O-N 3.1Å; N586-K588 VanDerWaalsContact C-N 3.33Å; N586-K588 PolarHBondContact O-N 2.94Å; N586-M589 PolarHBondContact O-N 3.28Å; N586-V590 WeakPolarHBondContact O-CG2 3.34Å; N586-V590 PolarHBondContact O-N 3.43Å; N586-V590 VanDerWaalsContact O-N 3.11Å
587	L	85.8	Confident	85	Confident	31 Å²	31	72.4 Å²	72.4	16%	0.162	36%	0.357	C	S	.	.	H	α-helix	trans	-57.6	-46	175.8	177.1	58.6	0	0	0	111.4	H446 E449 A450 A583 V590 Q591	H446-L587 VanDerWaalsContact CD2-CD1 3.48Å; H446-L587 WeakPolarHBondContact CD2-CD1 3.35Å; E449-L587 HydrophobicContact CB-CB 4.23Å; E449-L587 HydrophobicContact CB-CD1 4.25Å; A450-L587 HydrophobicContact CB-CD1 3.86Å; A450-L587 HydrophobicContact CB-CD2 4.32Å; A583-L587 VanDerWaalsContact O-CB 3.29Å; A583-L587 WeakPolarHBondContact O-CB 3.37Å; A583-L587 PolarHBondContact O-N 3.32Å; L587-V590 PolarHBondContact O-N 2.9Å; L587-Q591 PolarHBondContact O-N 3Å
588	K	86.8	Confident	84.5	Confident	119 Å²	119	73.2 Å²	73.2	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-44.9	177.1	-164.1	-155.2	169.1	-139	0	112.1	Q584 Q585 N586 V590 Q591 D592	Q584-K588 PolarHBondContact O-N 3.35Å; Q585-K588 PolarHBondContact O-N 3.45Å; N586-K588 VanDerWaalsContact C-N 3.33Å; N586-K588 PolarHBondContact O-N 2.94Å; K588-V590 PolarHBondContact O-N 3.45Å; K588-Q591 WeakPolarHBondContact O-CB 3.24Å; K588-Q591 PolarHBondContact O-N 3.15Å; K588-D592 WeakPolarHBondContact CE-OD1 3.39Å; K588-D592 VanDerWaalsContact CE-OD2 3.3Å; K588-D592 WeakPolarHBondContact CE-OD2 3.42Å; K588-D592 IonicContact NZ-OD1 3.07Å; K588-D592 IonicContact NZ-OD2 3.44Å; K588-D592 PolarHBondContact NZ-OD2 3.44Å; K588-D592 PolarHBondContact O-N 3.03Å
589	M	88.6	Confident	83.8	Confident	97 Å²	97	69.8 Å²	69.8	48%	0.478	34%	0.343	S	S	.	.	H	α-helix	trans	-57.3	-38.6	178.4	179.8	-178.9	62.9	0	0	112.2	Q585 N586 Q593	Q585-M589 PolarHBondContact O-N 3.47Å; N586-M589 PolarHBondContact O-N 3.28Å; M589-Q593 WeakPolarHBondContact O-CG 3.49Å; M589-Q593 PolarHBondContact O-N 3.3Å
590	V	85.4	Confident	83.1	Confident	10 Å²	10	68.8 Å²	68.8	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-74.7	-33.7	176.4	-177.9	0	0	0	0	111.8	N442 K445 H446 N586 L587 K588 L594	N442-V590 VanDerWaalsContact O-CG1 3.23Å; N442-V590 WeakPolarHBondContact O-CG1 3.47Å; K445-V590 HydrophobicContact CB-CG1 3.69Å; K445-V590 HydrophobicContact CB-CG2 4.23Å; H446-V590 HydrophobicContact CB-CG1 3.92Å; N586-V590 WeakPolarHBondContact O-CG2 3.34Å; N586-V590 PolarHBondContact O-N 3.43Å; N586-V590 VanDerWaalsContact O-N 3.11Å; L587-V590 PolarHBondContact O-N 2.9Å; K588-V590 PolarHBondContact O-N 3.45Å; V590-L594 WeakPolarHBondContact O-CB 3.43Å; V590-L594 PolarHBondContact O-N 3.18Å
591	Q	81.9	Confident	82	Confident	80 Å²	80	69 Å²	69	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-47.8	171	-174.5	-170.2	-26.9	0	0	111.5	L587 K588 Q593 L594 E595	L587-Q591 PolarHBondContact O-N 3Å; K588-Q591 WeakPolarHBondContact O-CB 3.24Å; K588-Q591 PolarHBondContact O-N 3.15Å; Q591-Q593 VanDerWaalsContact C-N 3.3Å; Q591-Q593 PolarHBondContact O-N 2.99Å; Q591-L594 WeakPolarHBondContact O-CB 3.45Å; Q591-L594 PolarHBondContact O-N 2.97Å; Q591-E595 PolarHBondContact NE2-OE1 2.91Å; Q591-E595 PolarHBondContact O-N 3.21Å
592	D	84.4	Confident	81.1	Confident	75 Å²	75	72.7 Å²	72.7	40%	0.401	35%	0.348	S	S	.	.	H	α-helix	trans	-57.9	-43.2	179.5	-68.4	-18.8	0	0	0	110	K588 E595 E596	K588-D592 WeakPolarHBondContact CE-OD1 3.39Å; K588-D592 VanDerWaalsContact CE-OD2 3.3Å; K588-D592 WeakPolarHBondContact CE-OD2 3.42Å; K588-D592 IonicContact NZ-OD1 3.07Å; K588-D592 IonicContact NZ-OD2 3.44Å; K588-D592 PolarHBondContact NZ-OD2 3.44Å; K588-D592 PolarHBondContact O-N 3.03Å; D592-E595 PolarHBondContact O-N 2.78Å; D592-E596 PolarHBondContact O-N 3.45Å
593	Q	82.9	Confident	80.2	Confident	77 Å²	77	74.8 Å²	74.8	36%	0.36	36%	0.355	S	S	.	.	H	α-helix	trans	-63.7	-38.9	173.3	-73.4	173.4	-0.4	0	0	113.7	M589 Q591 E595 E596 E597	M589-Q593 WeakPolarHBondContact O-CG 3.49Å; M589-Q593 PolarHBondContact O-N 3.3Å; Q591-Q593 VanDerWaalsContact C-N 3.3Å; Q591-Q593 PolarHBondContact O-N 2.99Å; Q593-E595 VanDerWaalsContact C-N 3.35Å; Q593-E596 PolarHBondContact O-N 2.87Å; Q593-E597 PolarHBondContact O-N 3.4Å
594	L	79.2	Confident	79.4	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.026	36%	0.36	C	S	.	.	H	α-helix	trans	-69.1	-33	179.2	177.6	57.4	0	0	0	112	M439 E443 V590 Q591 R598	M439-L594 HydrophobicContact CG-CD1 3.47Å; M439-L594 VanDerWaalsContact CG-CD1 3.47Å; M439-L594 HydrophobicContact SD-CD1 4.4Å; E443-L594 HydrophobicContact CG-CD1 3.51Å; E443-L594 HydrophobicContact CG-CD2 3.78Å; E443-L594 HydrophobicContact CG-CG 4.31Å; V590-L594 WeakPolarHBondContact O-CB 3.43Å; V590-L594 PolarHBondContact O-N 3.18Å; Q591-L594 WeakPolarHBondContact O-CB 3.45Å; Q591-L594 PolarHBondContact O-N 2.97Å; L594-R598 HydrophobicContact CD1-CG 4.26Å; L594-R598 VanDerWaalsContact O-CB 3.27Å; L594-R598 WeakPolarHBondContact O-CB 3.42Å; L594-R598 VanDerWaalsContact O-CD 3.31Å; L594-R598 WeakPolarHBondContact O-CD 3.45Å; L594-R598 WeakPolarHBondContact O-CG 3.42Å; L594-R598 PolarHBondContact O-N 3.4Å
595	E	80.1	Confident	78.4	Confident	100 Å²	100	74.2 Å²	74.2	47%	0.467	35%	0.352	S	S	.	.	H	α-helix	trans	-71	-32.2	175.8	-71.5	-175.1	-152.8	0	0	112.8	Q591 D592 Q593 A599	Q591-E595 PolarHBondContact NE2-OE1 2.91Å; Q591-E595 PolarHBondContact O-N 3.21Å; D592-E595 PolarHBondContact O-N 2.78Å; Q593-E595 VanDerWaalsContact C-N 3.35Å; E595-A599 PolarHBondContact O-N 3.16Å; E595-A599 VanDerWaalsContact O-N 3.13Å
596	E	79.3	Confident	77.3	Confident	133 Å²	133	74.5 Å²	74.5	62%	0.621	35%	0.354	S	S	*	.	H	α-helix	trans	-68.2	-53.1	174.7	-173.9	166.4	-153.2	0	0	112.2	D592 Q593 R598 A599 I600	D592-E596 PolarHBondContact O-N 3.45Å; Q593-E596 PolarHBondContact O-N 2.87Å; E596-R598 VanDerWaalsContact C-N 3.29Å; E596-R598 PolarHBondContact O-N 3.35Å; E596-A599 WeakPolarHBondContact O-CA 3.38Å; E596-A599 VanDerWaalsContact O-CB 3.3Å; E596-A599 WeakPolarHBondContact O-CB 3.36Å; E596-A599 PolarHBondContact O-N 2.84Å; E596-I600 PolarHBondContact O-N 3.39Å; E596-I600 VanDerWaalsContact O-N 3.1Å
597	E	75.3	Confident	76.3	Confident	38 Å²	38	73 Å²	73	18%	0.178	35%	0.352	C	S	.	.	H	α-helix	trans	-58.4	-41.3	176.6	-67.4	-69.7	-177.1	0	0	111.7	M439 Q593 A599 I600 S601	M439-E597 HydrophobicContact CB-CB 4.41Å; M439-E597 HydrophobicContact CG-CB 4.42Å; Q593-E597 PolarHBondContact O-N 3.4Å; E597-A599 PolarHBondContact O-N 3.18Å; E597-I600 PolarHBondContact O-N 3.1Å; E597-S601 PolarHBondContact O-N 3.42Å
598	R	74.8	Confident	75.1	Confident	96 Å²	96	74.4 Å²	74.4	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-27.4	173.6	-76.2	171.6	172.6	175.5	-3.4	112.7	M439 E443 L594 E596 R602	M439-R598 HydrophobicContact CG-CG 4.18Å; M439-R598 HydrophobicContact SD-CB 4.48Å; M439-R598 HydrophobicContact SD-CG 3.33Å; M439-R598 WeakPolarHBondContact SD-CG 3.39Å; E443-R598 IonicContact OE1-CZ 2.69Å; E443-R598 IonicContact OE1-NE 3.02Å; E443-R598 IonicContact OE1-NH2 2.83Å; E443-R598 PolarHBondContact OE1-NH2 2.86Å; L594-R598 HydrophobicContact CD1-CG 4.26Å; L594-R598 VanDerWaalsContact O-CB 3.27Å; L594-R598 WeakPolarHBondContact O-CB 3.42Å; L594-R598 VanDerWaalsContact O-CD 3.31Å; L594-R598 WeakPolarHBondContact O-CD 3.45Å; L594-R598 WeakPolarHBondContact O-CG 3.42Å; L594-R598 PolarHBondContact O-N 3.4Å; E596-R598 VanDerWaalsContact C-N 3.29Å; E596-R598 PolarHBondContact O-N 3.35Å; R598-R602 VanDerWaalsContact O-CG 3.3Å; R598-R602 WeakPolarHBondContact O-CG 3.33Å; R598-R602 PolarHBondContact O-N 2.79Å; R598-R602 PolarHBondContact O-NE 2.85Å; R598-R602 PolarHBondContact O-NH1 2.82Å
599	A	74.9	Confident	74	Confident	34 Å²	34	74 Å²	74	28%	0.281	36%	0.361	S	S	.	.	H	α-helix	trans	-75.4	-39.7	175.2	0	0	0	0	0	112.1	E595 E596 E597 R602 Q603	E595-A599 PolarHBondContact O-N 3.16Å; E595-A599 VanDerWaalsContact O-N 3.13Å; E596-A599 WeakPolarHBondContact O-CA 3.38Å; E596-A599 VanDerWaalsContact O-CB 3.3Å; E596-A599 WeakPolarHBondContact O-CB 3.36Å; E596-A599 PolarHBondContact O-N 2.84Å; E597-A599 PolarHBondContact O-N 3.18Å; A599-R602 VanDerWaalsContact CA-NH2 3.29Å; A599-Q603 PolarHBondContact O-N 3.12Å
600	I	73.3	Confident	73.1	Confident	70 Å²	70	74.9 Å²	74.9	36%	0.359	37%	0.367	S	S	.	.	H	α-helix	trans	-63.2	-52.2	175.5	-64.1	168.1	0	0	0	109.9	E596 E597 R602 Q603 H604	E596-I600 PolarHBondContact O-N 3.39Å; E596-I600 VanDerWaalsContact O-N 3.1Å; E597-I600 PolarHBondContact O-N 3.1Å; I600-R602 VanDerWaalsContact C-N 3.3Å; I600-R602 PolarHBondContact O-N 2.96Å; I600-Q603 WeakPolarHBondContact O-CB 3.46Å; I600-Q603 PolarHBondContact O-N 3Å; I600-H604 PolarHBondContact O-CD2 3.09Å; I600-H604 VanDerWaalsContact O-CD2 3.24Å; I600-H604 PolarHBondContact O-N 3.11Å
601	S	64.2	Low	72	Confident	12 Å²	12	78 Å²	78	8%	0.084	39%	0.386	C	S	.	.	H	α-helix	trans	-53.7	-42.8	178.8	-173.6	0	0	0	0	112.8	E597 Q603 H604 I605	E597-S601 PolarHBondContact O-N 3.42Å; S601-Q603 VanDerWaalsContact C-N 3.33Å; S601-Q603 PolarHBondContact O-N 3.28Å; S601-H604 PolarHBondContact O-N 3.36Å; S601-I605 WeakPolarHBondContact O-CG1 3.27Å; S601-I605 PolarHBondContact O-N 2.82Å; S601-I605 VanDerWaalsContact O-N 3.13Å
602	R	69.9	Low	71.2	Confident	139 Å²	139	79.1 Å²	79.1	53%	0.525	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-35.3	175.1	-77.6	-177.1	-64.1	-102.6	3.1	114	R598 A599 I600 Q606	R598-R602 VanDerWaalsContact O-CG 3.3Å; R598-R602 WeakPolarHBondContact O-CG 3.33Å; R598-R602 PolarHBondContact O-N 2.79Å; R598-R602 PolarHBondContact O-NE 2.85Å; R598-R602 PolarHBondContact O-NH1 2.82Å; A599-R602 VanDerWaalsContact CA-NH2 3.29Å; I600-R602 VanDerWaalsContact C-N 3.3Å; I600-R602 PolarHBondContact O-N 2.96Å; R602-Q606 WeakPolarHBondContact O-CG 3.35Å; R602-Q606 PolarHBondContact O-N 3.22Å
603	Q	68.8	Low	70.4	Confident	137 Å²	137	80.5 Å²	80.5	64%	0.64	39%	0.394	S	S	*	.	H	α-helix	trans	-70.9	-42.7	179.3	-67.1	178.2	20.9	0	0	111.4	A599 I600 S601 I605 Q606 A607	A599-Q603 PolarHBondContact O-N 3.12Å; I600-Q603 WeakPolarHBondContact O-CB 3.46Å; I600-Q603 PolarHBondContact O-N 3Å; S601-Q603 VanDerWaalsContact C-N 3.33Å; S601-Q603 PolarHBondContact O-N 3.28Å; Q603-I605 PolarHBondContact O-N 3.5Å; Q603-Q606 PolarHBondContact O-N 2.71Å; Q603-A607 PolarHBondContact O-N 3.25Å; Q603-A607 VanDerWaalsContact O-N 3.15Å
604	H	68.7	Low	69.7	Low	36 Å²	36	83.8 Å²	83.8	17%	0.167	41%	0.407	C	S	.	.	H	α-helix	trans	-62.6	-42.2	176.5	-68.2	-76.9	0	0	0	112.1	L428 Q431 L432 I600 S601 Q606 A607 V608	L428-H604 WeakPolarHBondContact CD2-ND1 3.4Å; Q431-H604 PolarHBondContact OE1-CE1 3.46Å; L432-H604 HydrophobicContact CD1-CB 3.71Å; I600-H604 PolarHBondContact O-CD2 3.09Å; I600-H604 VanDerWaalsContact O-CD2 3.24Å; I600-H604 PolarHBondContact O-N 3.11Å; S601-H604 PolarHBondContact O-N 3.36Å; H604-Q606 VanDerWaalsContact C-N 3.34Å; H604-Q606 PolarHBondContact O-N 2.91Å; H604-A607 PolarHBondContact O-N 3.15Å; H604-V608 WeakPolarHBondContact O-CG2 3.47Å; H604-V608 PolarHBondContact O-N 3.06Å; H604-V608 VanDerWaalsContact O-N 3.1Å
605	I	66.1	Low	68.9	Low	72 Å²	72	86.1 Å²	86.1	37%	0.369	42%	0.419	S	S	.	.	H	α-helix	trans	-59.8	-43	176.9	-67.8	166.5	0	0	0	111.5	L432 S601 Q603 A607 V608 Q609	L432-I605 HydrophobicContact CD1-CG1 4.26Å; S601-I605 WeakPolarHBondContact O-CG1 3.27Å; S601-I605 PolarHBondContact O-N 2.82Å; S601-I605 VanDerWaalsContact O-N 3.13Å; Q603-I605 PolarHBondContact O-N 3.5Å; I605-A607 PolarHBondContact O-N 3.4Å; I605-V608 PolarHBondContact O-N 3.5Å; I605-Q609 PolarHBondContact O-N 3.34Å; I605-Q609 VanDerWaalsContact O-N 3.08Å
606	Q	66.6	Low	68.3	Low	132 Å²	132	83.7 Å²	83.7	62%	0.617	41%	0.408	S	S	*	.	H	α-helix	trans	-63.3	-40.8	177	-74.2	-178.8	-8.3	0	0	112.4	R602 Q603 H604 Q609 I610	R602-Q606 WeakPolarHBondContact O-CG 3.35Å; R602-Q606 PolarHBondContact O-N 3.22Å; Q603-Q606 PolarHBondContact O-N 2.71Å; H604-Q606 VanDerWaalsContact C-N 3.34Å; H604-Q606 PolarHBondContact O-N 2.91Å; Q606-Q609 PolarHBondContact O-N 3.34Å; Q606-I610 WeakPolarHBondContact O-CG1 3.27Å; Q606-I610 PolarHBondContact O-N 3.15Å; Q606-I610 VanDerWaalsContact O-N 3.12Å
607	A	64.5	Low	67.9	Low	41 Å²	41	81.3 Å²	81.3	34%	0.339	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-46	177.1	0	0	0	0	0	112.1	Q603 H604 I605 Q609 I610 T611	Q603-A607 PolarHBondContact O-N 3.25Å; Q603-A607 VanDerWaalsContact O-N 3.15Å; H604-A607 PolarHBondContact O-N 3.15Å; I605-A607 PolarHBondContact O-N 3.4Å; A607-Q609 PolarHBondContact O-N 2.73Å; A607-I610 PolarHBondContact O-N 3.12Å; A607-T611 PolarHBondContact O-N 2.77Å; A607-T611 PolarHBondContact O-OG1 3.49Å
608	V	61.4	Low	67.6	Low	60 Å²	60	82.4 Å²	82.4	36%	0.364	41%	0.412	S	S	.	.	H	α-helix	trans	-62.4	-41.1	178.3	173.5	0	0	0	0	111.7	H604 I605 T611 K612	H604-V608 WeakPolarHBondContact O-CG2 3.47Å; H604-V608 PolarHBondContact O-N 3.06Å; H604-V608 VanDerWaalsContact O-N 3.1Å; I605-V608 PolarHBondContact O-N 3.5Å; V608-T611 WeakPolarHBondContact CA-OG1 3.32Å; V608-T611 PolarHBondContact O-N 3.35Å; V608-T611 PolarHBondContact O-OG1 3.12Å; V608-K612 PolarHBondContact O-N 3.17Å; V608-K612 VanDerWaalsContact O-N 3.14Å
609	Q	64.2	Low	67.4	Low	111 Å²	111	80.9 Å²	80.9	52%	0.519	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-45.2	178.4	-175.5	172.1	-27.2	0	0	112.1	I605 Q606 A607 T611 K612 E613	I605-Q609 PolarHBondContact O-N 3.34Å; I605-Q609 VanDerWaalsContact O-N 3.08Å; Q606-Q609 PolarHBondContact O-N 3.34Å; A607-Q609 PolarHBondContact O-N 2.73Å; Q609-T611 VanDerWaalsContact C-N 3.31Å; Q609-T611 PolarHBondContact O-N 3.08Å; Q609-K612 PolarHBondContact O-N 3.46Å; Q609-K612 VanDerWaalsContact O-N 3.1Å; Q609-E613 HydrophobicContact CG-CG 4.4Å; Q609-E613 WeakPolarHBondContact CG-OE1 3.5Å; Q609-E613 PolarHBondContact NE2-OE1 3.11Å; Q609-E613 WeakPolarHBondContact O-CG 3.49Å; Q609-E613 PolarHBondContact O-N 3.17Å
610	I	70.1	Confident	67.3	Low	115 Å²	115	82.1 Å²	82.1	59%	0.59	42%	0.42	S	S	*	.	H	α-helix	trans	-60.1	-40.7	178.4	-68	164.8	0	0	0	111.3	Q606 A607 K612 K614	Q606-I610 WeakPolarHBondContact O-CG1 3.27Å; Q606-I610 PolarHBondContact O-N 3.15Å; Q606-I610 VanDerWaalsContact O-N 3.12Å; A607-I610 PolarHBondContact O-N 3.12Å; I610-K612 VanDerWaalsContact C-N 3.33Å; I610-K612 PolarHBondContact O-N 2.95Å; I610-K614 PolarHBondContact O-N 2.92Å
611	T	60.9	Low	67.5	Low	76 Å²	76	82.5 Å²	82.5	47%	0.466	42%	0.42	S	S	.	.	H	α-helix	trans	-65.4	-35.7	176	43.6	0	0	0	0	113	A607 V608 Q609 N615	A607-T611 PolarHBondContact O-N 2.77Å; A607-T611 PolarHBondContact O-OG1 3.49Å; V608-T611 WeakPolarHBondContact CA-OG1 3.32Å; V608-T611 PolarHBondContact O-N 3.35Å; V608-T611 PolarHBondContact O-OG1 3.12Å; Q609-T611 VanDerWaalsContact C-N 3.31Å; Q609-T611 PolarHBondContact O-N 3.08Å; T611-N615 PolarHBondContact O-N 3.44Å
612	K	66.5	Low	67.8	Low	103 Å²	103	82.2 Å²	82.2	45%	0.448	42%	0.418	S	S	.	.	H	α-helix	trans	-69.4	-47.7	178.4	175.9	171.6	171.1	170	0	112.3	V608 Q609 I610 K614 N615 E616	V608-K612 PolarHBondContact O-N 3.17Å; V608-K612 VanDerWaalsContact O-N 3.14Å; Q609-K612 PolarHBondContact O-N 3.46Å; Q609-K612 VanDerWaalsContact O-N 3.1Å; I610-K612 VanDerWaalsContact C-N 3.33Å; I610-K612 PolarHBondContact O-N 2.95Å; K612-K614 PolarHBondContact O-N 2.89Å; K612-N615 PolarHBondContact O-N 3.14Å; K612-N615 VanDerWaalsContact O-N 3.09Å; K612-E616 WeakPolarHBondContact CE-OE1 3.1Å; K612-E616 IonicContact NZ-OE1 3.82Å; K612-E616 PolarHBondContact O-N 2.91Å
613	E	67	Low	68.1	Low	104 Å²	104	79.4 Å²	79.4	49%	0.486	41%	0.413	S	S	.	.	H	α-helix	trans	-58	-34	178.6	-70.7	172.6	-176.6	0	0	111.8	Q609 S617	Q609-E613 HydrophobicContact CG-CG 4.4Å; Q609-E613 WeakPolarHBondContact CG-OE1 3.5Å; Q609-E613 PolarHBondContact NE2-OE1 3.11Å; Q609-E613 WeakPolarHBondContact O-CG 3.49Å; Q609-E613 PolarHBondContact O-N 3.17Å; E613-S617 PolarHBondContact O-N 2.95Å
614	K	68.6	Low	68.7	Low	146 Å²	146	78.7 Å²	78.7	64%	0.635	41%	0.413	S	S	*	.	H	α-helix	trans	-67.6	-42	175	-167.7	-178.3	177.7	-169.1	0	113.2	I610 K612 S617 L618	I610-K614 PolarHBondContact O-N 2.92Å; K612-K614 PolarHBondContact O-N 2.89Å; K614-S617 PolarHBondContact O-N 2.89Å; K614-L618 PolarHBondContact O-N 3.27Å
615	N	61.4	Low	69	Low	54 Å²	54	78.3 Å²	78.3	29%	0.289	41%	0.412	S	S	.	.	H	α-helix	trans	-67.9	-39.6	176.6	-92	-1.2	0	0	0	112.1	T611 K612 S617 L618 Q619	T611-N615 PolarHBondContact O-N 3.44Å; K612-N615 PolarHBondContact O-N 3.14Å; K612-N615 VanDerWaalsContact O-N 3.09Å; N615-S617 VanDerWaalsContact C-N 3.27Å; N615-S617 PolarHBondContact O-N 3.43Å; N615-L618 PolarHBondContact O-N 3.36Å; N615-Q619 PolarHBondContact O-N 3.27Å; N615-Q619 VanDerWaalsContact O-N 3.15Å
616	E	67.9	Low	69.6	Low	48 Å²	48	76.9 Å²	76.9	22%	0.224	41%	0.407	C	S	.	.	H	α-helix	trans	-58.3	-39.1	174.9	-72.8	-179.6	-162.7	0	0	111.9	I418 K612 A620	I418-E616 HydrophobicContact CD1-CG 3.48Å; I418-E616 VanDerWaalsContact CD1-CG 3.48Å; I418-E616 WeakPolarHBondContact CD1-OE1 3.34Å; I418-E616 HydrophobicContact CG1-CG 4.38Å; K612-E616 WeakPolarHBondContact CE-OE1 3.1Å; K612-E616 IonicContact NZ-OE1 3.82Å; K612-E616 PolarHBondContact O-N 2.91Å; E616-A620 PolarHBondContact O-N 2.87Å
617	S	70.6	Confident	70.2	Confident	83 Å²	83	74 Å²	74	58%	0.58	40%	0.398	S	S	*	.	H	α-helix	trans	-67.7	-39.8	176.9	-167.4	0	0	0	0	113.6	E613 K614 N615 A620 E621	E613-S617 PolarHBondContact O-N 2.95Å; K614-S617 PolarHBondContact O-N 2.89Å; N615-S617 VanDerWaalsContact C-N 3.27Å; N615-S617 PolarHBondContact O-N 3.43Å; S617-A620 PolarHBondContact O-N 3.04Å; S617-E621 PolarHBondContact O-N 3.17Å
618	L	69.6	Low	70.9	Confident	61 Å²	61	76.7 Å²	76.7	32%	0.319	40%	0.4	S	S	.	.	H	α-helix	trans	-70.3	-41	-178.7	-72.6	169.6	0	0	0	112.6	K614 N615 A620 E621 L622	K614-L618 PolarHBondContact O-N 3.27Å; N615-L618 PolarHBondContact O-N 3.36Å; L618-A620 VanDerWaalsContact C-N 3.3Å; L618-A620 PolarHBondContact O-N 3.38Å; L618-E621 PolarHBondContact O-N 2.8Å; L618-L622 PolarHBondContact O-N 3.34Å
619	Q	70.3	Confident	71.7	Confident	64 Å²	64	75.2 Å²	75.2	30%	0.299	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-39.3	176.1	-172	62.8	48.6	0	0	111.4	N615 E621 L622 D623	N615-Q619 PolarHBondContact O-N 3.27Å; N615-Q619 VanDerWaalsContact O-N 3.15Å; Q619-E621 VanDerWaalsContact C-N 3.34Å; Q619-E621 PolarHBondContact O-N 2.86Å; Q619-L622 PolarHBondContact O-N 2.7Å; Q619-D623 PolarHBondContact NE2-OD1 2.83Å; Q619-D623 PolarHBondContact O-N 2.71Å
620	A	73.4	Confident	72.5	Confident	60 Å²	60	76.1 Å²	76.1	50%	0.496	39%	0.393	S	S	.	.	H	α-helix	trans	-64.3	-34.1	178.1	0	0	0	0	0	113.3	E616 S617 L618 L624	E616-A620 PolarHBondContact O-N 2.87Å; S617-A620 PolarHBondContact O-N 3.04Å; L618-A620 VanDerWaalsContact C-N 3.3Å; L618-A620 PolarHBondContact O-N 3.38Å; A620-L624 WeakPolarHBondContact O-CB 3.3Å; A620-L624 PolarHBondContact O-N 3.16Å
621	E	76.2	Confident	73	Confident	78 Å²	78	75 Å²	75	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-69.4	-41.2	173	-166.6	-178.6	157.3	0	0	111.4	S617 L618 Q619 L624 L625 K769	S617-E621 PolarHBondContact O-N 3.17Å; L618-E621 PolarHBondContact O-N 2.8Å; Q619-E621 VanDerWaalsContact C-N 3.34Å; Q619-E621 PolarHBondContact O-N 2.86Å; E621-L624 PolarHBondContact O-N 2.97Å; E621-L625 HydrophobicContact CG-CD1 3.88Å; E621-L625 HydrophobicContact CG-CG 4.36Å; E621-L625 WeakPolarHBondContact O-CB 3.27Å; E621-L625 VanDerWaalsContact O-CG 3.29Å; E621-L625 WeakPolarHBondContact O-CG 3.43Å; E621-L625 PolarHBondContact O-N 3.07Å; E621-K769 IonicContact OE1-NZ 3.63Å; E621-K769 PolarHBondContact OE1-NZ 3.29Å
622	L	72.4	Confident	73.8	Confident	7 Å²	7	71.9 Å²	71.9	4%	0.037	37%	0.366	C	S	.	.	H	α-helix	trans	-63.6	-46.2	178.6	175.5	57.6	0	0	0	112.6	L618 Q619 L624 L625 T626 I770 L773 V777	L618-L622 PolarHBondContact O-N 3.34Å; Q619-L622 PolarHBondContact O-N 2.7Å; L622-L624 VanDerWaalsContact C-N 3.32Å; L622-L624 PolarHBondContact O-N 3.45Å; L622-L625 PolarHBondContact O-N 3.05Å; L622-T626 VanDerWaalsContact O-CB 3.28Å; L622-T626 WeakPolarHBondContact O-CB 3.43Å; L622-T626 PolarHBondContact O-N 2.93Å; L622-T626 PolarHBondContact O-OG1 3.46Å; L622-I770 HydrophobicContact CD1-CG2 4.26Å; L622-L773 HydrophobicContact CD1-CB 3.91Å; L622-L773 HydrophobicContact CD1-CD1 4.46Å; L622-V777 HydrophobicContact CD2-CB 4.47Å; L622-V777 HydrophobicContact CD2-CG2 3.79Å
623	D	75.8	Confident	74.2	Confident	80 Å²	80	70.9 Å²	70.9	43%	0.428	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-40.2	179.4	-70.4	-3.5	0	0	0	111.3	Q619 T627	Q619-D623 PolarHBondContact NE2-OD1 2.83Å; Q619-D623 PolarHBondContact O-N 2.71Å; D623-T627 WeakPolarHBondContact O-CB 3.2Å; D623-T627 PolarHBondContact O-N 3.2Å; D623-T627 PolarHBondContact O-OG1 2.96Å
624	L	81.4	Confident	74.8	Confident	121 Å²	121	69.5 Å²	69.5	63%	0.634	36%	0.357	S	S	*	.	H	α-helix	trans	-64.9	-48.5	176.8	178.3	62.7	0	0	0	112.1	A620 E621 L622 T627 R628	A620-L624 WeakPolarHBondContact O-CB 3.3Å; A620-L624 PolarHBondContact O-N 3.16Å; E621-L624 PolarHBondContact O-N 2.97Å; L622-L624 VanDerWaalsContact C-N 3.32Å; L622-L624 PolarHBondContact O-N 3.45Å; L624-T627 PolarHBondContact O-N 2.95Å; L624-R628 PolarHBondContact O-N 3.3Å
625	L	75.3	Confident	75.4	Confident	29 Å²	29	66 Å²	66	15%	0.152	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-40.4	178.9	-70.3	170.9	0	0	0	111.6	E621 L622 T627 R628 H629 L766 K769 I770 L773	E621-L625 HydrophobicContact CG-CD1 3.88Å; E621-L625 HydrophobicContact CG-CG 4.36Å; E621-L625 WeakPolarHBondContact O-CB 3.27Å; E621-L625 VanDerWaalsContact O-CG 3.29Å; E621-L625 WeakPolarHBondContact O-CG 3.43Å; E621-L625 PolarHBondContact O-N 3.07Å; L622-L625 PolarHBondContact O-N 3.05Å; L625-T627 VanDerWaalsContact C-N 3.35Å; L625-T627 PolarHBondContact O-N 2.91Å; L625-R628 PolarHBondContact O-N 2.94Å; L625-H629 PolarHBondContact O-N 2.94Å; L625-L766 HydrophobicContact CD2-CD2 3.76Å; L625-K769 HydrophobicContact CD1-CD 3.95Å; L625-K769 HydrophobicContact CD1-CG 4.47Å; L625-I770 HydrophobicContact CB-CG1 4.24Å; L625-L773 HydrophobicContact CD1-CD1 3.54Å
626	T	77.4	Confident	75.9	Confident	42 Å²	42	64.2 Å²	64.2	26%	0.258	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-44.2	175.4	-59.4	0	0	0	0	111.3	L622 R628 H629 Q630	L622-T626 VanDerWaalsContact O-CB 3.28Å; L622-T626 WeakPolarHBondContact O-CB 3.43Å; L622-T626 PolarHBondContact O-N 2.93Å; L622-T626 PolarHBondContact O-OG1 3.46Å; T626-R628 PolarHBondContact O-N 2.82Å; T626-H629 PolarHBondContact O-N 2.95Å; T626-Q630 WeakPolarHBondContact O-CG 3.44Å; T626-Q630 PolarHBondContact O-N 3.03Å; T626-Q630 VanDerWaalsContact O-N 3.11Å
627	T	79.7	Confident	76.6	Confident	72 Å²	72	68.8 Å²	68.8	44%	0.442	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-42.5	175.4	-56.4	0	0	0	0	111.5	D623 L624 L625 Q630 Q631	D623-T627 WeakPolarHBondContact O-CB 3.2Å; D623-T627 PolarHBondContact O-N 3.2Å; D623-T627 PolarHBondContact O-OG1 2.96Å; L624-T627 PolarHBondContact O-N 2.95Å; L625-T627 VanDerWaalsContact C-N 3.35Å; L625-T627 PolarHBondContact O-N 2.91Å; T627-Q630 PolarHBondContact O-N 3.11Å; T627-Q631 WeakPolarHBondContact O-CG 3.27Å; T627-Q631 PolarHBondContact O-N 3.26Å
628	R	80	Confident	77.2	Confident	96 Å²	96	69.7 Å²	69.7	36%	0.362	35%	0.345	S	S	.	.	H	α-helix	trans	-68.5	-35.3	178.9	-172.8	58.5	-172.2	142.5	9.2	112.8	L624 L625 T626 Q631 L632 E635 L766	L624-R628 PolarHBondContact O-N 3.3Å; L625-R628 PolarHBondContact O-N 2.94Å; T626-R628 PolarHBondContact O-N 2.82Å; R628-Q631 VanDerWaalsContact CD-OE1 3.29Å; R628-Q631 PolarHBondContact O-N 2.79Å; R628-L632 HydrophobicContact CG-CD1 4.13Å; R628-L632 PolarHBondContact O-N 2.81Å; R628-L632 VanDerWaalsContact O-N 3.13Å; R628-E635 IonicContact CZ-OE1 2.66Å; R628-E635 IonicContact NH1-OE1 3.41Å; R628-E635 PolarHBondContact NH1-OE1 3.4Å; R628-E635 IonicContact NH2-OE1 3.69Å; R628-E635 IonicContact NH2-OE2 2.64Å; R628-L766 HydrophobicContact CG-CD1 4.28Å
629	H	77	Confident	77.6	Confident	30 Å²	30	68 Å²	68	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-42.4	173.6	-177.6	64.5	0	0	0	112.3	L625 T626 Q631 L632 M633 S763 L766 R767 I770	L625-H629 PolarHBondContact O-N 2.94Å; T626-H629 PolarHBondContact O-N 2.95Å; H629-Q631 VanDerWaalsContact C-N 3.35Å; H629-Q631 PolarHBondContact O-N 2.78Å; H629-L632 PolarHBondContact O-N 2.89Å; H629-M633 WeakPolarHBondContact O-CB 3.43Å; H629-M633 VanDerWaalsContact O-CG 3.31Å; H629-M633 WeakPolarHBondContact O-CG 3.3Å; H629-M633 PolarHBondContact O-N 3.43Å; H629-S763 PolarHBondContact CE1-O 3.38Å; H629-S763 PolarHBondContact CE1-OG 3.22Å; H629-S763 PolarHBondContact ND1-O 3.08Å; H629-L766 HydrophobicContact CB-CB 4.36Å; H629-R767 VanDerWaalsContact CE1-CB 3.49Å; H629-R767 WeakPolarHBondContact CE1-CB 3.24Å; H629-R767 PolarHBondContact CE1-NE 3.16Å; H629-R767 VanDerWaalsContact CE1-NE 3.29Å; H629-R767 PolarHBondContact CE1-NH2 3.23Å; H629-R767 PolarHBondContact NE2-NE 2.93Å; H629-R767 PolarHBondContact NE2-NH2 3.06Å; H629-I770 HydrophobicContact CB-CD1 3.44Å; H629-I770 VanDerWaalsContact CB-CD1 3.44Å
630	Q	80.6	Confident	77.9	Confident	129 Å²	129	66.9 Å²	66.9	60%	0.603	34%	0.335	S	S	*	.	H	α-helix	trans	-61.8	-40.6	175.6	-70.3	177.4	9.4	0	0	112.4	T626 T627 E634	T626-Q630 WeakPolarHBondContact O-CG 3.44Å; T626-Q630 PolarHBondContact O-N 3.03Å; T626-Q630 VanDerWaalsContact O-N 3.11Å; T627-Q630 PolarHBondContact O-N 3.11Å; Q630-E634 PolarHBondContact O-N 2.94Å
631	Q	81.6	Confident	78.4	Confident	93 Å²	93	67.5 Å²	67.5	44%	0.435	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-51.3	175.6	-69.4	172.1	-5.4	0	0	111.9	T627 R628 H629 M633 E634 E635	T627-Q631 WeakPolarHBondContact O-CG 3.27Å; T627-Q631 PolarHBondContact O-N 3.26Å; R628-Q631 VanDerWaalsContact CD-OE1 3.29Å; R628-Q631 PolarHBondContact O-N 2.79Å; H629-Q631 VanDerWaalsContact C-N 3.35Å; H629-Q631 PolarHBondContact O-N 2.78Å; Q631-M633 VanDerWaalsContact C-N 3.3Å; Q631-M633 PolarHBondContact O-N 2.76Å; Q631-E634 PolarHBondContact O-N 3.26Å; Q631-E634 VanDerWaalsContact O-N 3.12Å; Q631-E635 WeakPolarHBondContact O-CG 3.48Å; Q631-E635 PolarHBondContact O-N 2.82Å
632	L	76.9	Confident	78.7	Confident	10 Å²	10	69.4 Å²	69.4	5%	0.052	34%	0.337	C	S	.	.	H	α-helix	trans	-63.5	-33.7	-178.8	-75	162.2	0	0	0	112.9	R628 H629 S636 L759 L766	R628-L632 HydrophobicContact CG-CD1 4.13Å; R628-L632 PolarHBondContact O-N 2.81Å; R628-L632 VanDerWaalsContact O-N 3.13Å; H629-L632 PolarHBondContact O-N 2.89Å; L632-S636 VanDerWaalsContact O-CB 3.23Å; L632-S636 WeakPolarHBondContact O-CB 3.45Å; L632-S636 PolarHBondContact O-N 2.85Å; L632-L759 HydrophobicContact CD2-CD2 3.63Å; L632-L766 HydrophobicContact CD1-CD1 3.32Å
633	M	74.4	Confident	79	Confident	82 Å²	82	71 Å²	71	40%	0.404	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-40.9	172.7	-77.3	-68.5	-54.4	0	0	112.7	H629 Q631 R637 S763 R767	H629-M633 WeakPolarHBondContact O-CB 3.43Å; H629-M633 VanDerWaalsContact O-CG 3.31Å; H629-M633 WeakPolarHBondContact O-CG 3.3Å; H629-M633 PolarHBondContact O-N 3.43Å; Q631-M633 VanDerWaalsContact C-N 3.3Å; Q631-M633 PolarHBondContact O-N 2.76Å; M633-R637 WeakPolarHBondContact O-CB 3.48Å; M633-R637 PolarHBondContact O-N 3.21Å; M633-R637 VanDerWaalsContact O-N 3.08Å; M633-S763 PolarHBondContact SD-OG 3.28Å; M633-R767 PolarHBondContact SD-NH2 3.15Å; M633-R767 VanDerWaalsContact SD-NH2 3.44Å
634	E	81.4	Confident	79.3	Confident	74 Å²	74	74.7 Å²	74.7	35%	0.346	35%	0.352	S	S	.	.	H	α-helix	trans	-77.8	-38.1	178.8	-177.4	57	-147.5	0	0	111.8	Q630 Q631 S636 R637 Q638	Q630-E634 PolarHBondContact O-N 2.94Å; Q631-E634 PolarHBondContact O-N 3.26Å; Q631-E634 VanDerWaalsContact O-N 3.12Å; E634-S636 PolarHBondContact O-N 2.77Å; E634-R637 WeakPolarHBondContact O-CB 3.29Å; E634-R637 PolarHBondContact O-N 3.31Å; E634-R637 IonicContact OE1-NH1 2.84Å; E634-R637 VanDerWaalsContact OE2-CD 3.26Å; E634-R637 WeakPolarHBondContact OE2-CD 3.18Å; E634-R637 IonicContact OE2-CZ 3.19Å; E634-R637 IonicContact OE2-NE 2.69Å; E634-R637 IonicContact OE2-NH1 3.51Å; E634-R637 PolarHBondContact OE2-NH1 3.13Å; E634-Q638 WeakPolarHBondContact O-CG 3.48Å; E634-Q638 PolarHBondContact O-N 3.5Å; E634-Q638 WeakPolarHBondContact OE1-CG 3.29Å; E634-Q638 PolarHBondContact OE1-NE2 3.48Å
635	E	80.5	Confident	79.4	Confident	74 Å²	74	71.1 Å²	71.1	35%	0.346	34%	0.34	S	S	.	.	H	α-helix	trans	-55.5	-48.7	169.1	-70.8	170	-150.1	0	0	110.8	R628 Q631 R637 Q638 L639	R628-E635 IonicContact CZ-OE1 2.66Å; R628-E635 IonicContact NH1-OE1 3.41Å; R628-E635 PolarHBondContact NH1-OE1 3.4Å; R628-E635 IonicContact NH2-OE1 3.69Å; R628-E635 IonicContact NH2-OE2 2.64Å; Q631-E635 WeakPolarHBondContact O-CG 3.48Å; Q631-E635 PolarHBondContact O-N 2.82Å; E635-R637 PolarHBondContact O-N 3.19Å; E635-Q638 PolarHBondContact O-N 2.91Å; E635-L639 PolarHBondContact O-N 3.45Å
636	S	72.5	Confident	79.6	Confident	15 Å²	15	71.3 Å²	71.3	11%	0.105	34%	0.341	C	S	.	.	H	α-helix	trans	-63.1	-36.9	177.4	179.6	0	0	0	0	113.1	L632 E634 S640	L632-S636 VanDerWaalsContact O-CB 3.23Å; L632-S636 WeakPolarHBondContact O-CB 3.45Å; L632-S636 PolarHBondContact O-N 2.85Å; E634-S636 PolarHBondContact O-N 2.77Å; S636-S640 WeakPolarHBondContact O-CB 3.27Å; S636-S640 PolarHBondContact O-N 3.26Å
637	R	81.4	Confident	79.7	Confident	144 Å²	144	72.9 Å²	72.9	54%	0.543	35%	0.345	S	S	.	.	H	α-helix	trans	-65.1	-49.7	176.7	176.9	-166.9	173.3	-169.3	-0.4	111.2	M633 E634 E635 L639 S640 D641	M633-R637 WeakPolarHBondContact O-CB 3.48Å; M633-R637 PolarHBondContact O-N 3.21Å; M633-R637 VanDerWaalsContact O-N 3.08Å; E634-R637 WeakPolarHBondContact O-CB 3.29Å; E634-R637 PolarHBondContact O-N 3.31Å; E634-R637 IonicContact OE1-NH1 2.84Å; E634-R637 VanDerWaalsContact OE2-CD 3.26Å; E634-R637 WeakPolarHBondContact OE2-CD 3.18Å; E634-R637 IonicContact OE2-CZ 3.19Å; E634-R637 IonicContact OE2-NE 2.69Å; E634-R637 IonicContact OE2-NH1 3.51Å; E634-R637 PolarHBondContact OE2-NH1 3.13Å; E635-R637 PolarHBondContact O-N 3.19Å; R637-L639 VanDerWaalsContact C-N 3.27Å; R637-L639 PolarHBondContact O-N 3.38Å; R637-S640 WeakPolarHBondContact O-CB 3.48Å; R637-S640 PolarHBondContact O-N 3.18Å; R637-D641 PolarHBondContact O-N 3.17Å
638	Q	83	Confident	79.9	Confident	103 Å²	103	75.5 Å²	75.5	48%	0.481	35%	0.35	S	S	.	.	H	α-helix	trans	-62.2	-34.7	-178.1	-69.2	176.5	19.1	0	0	112.4	E634 E635 K642	E634-Q638 WeakPolarHBondContact O-CG 3.48Å; E634-Q638 PolarHBondContact O-N 3.5Å; E634-Q638 WeakPolarHBondContact OE1-CG 3.29Å; E634-Q638 PolarHBondContact OE1-NE2 3.48Å; E635-Q638 PolarHBondContact O-N 2.91Å; Q638-K642 WeakPolarHBondContact O-CG 3.3Å; Q638-K642 PolarHBondContact O-N 3.3Å
639	L	78.3	Confident	80	Confident	25 Å²	25	74 Å²	74	13%	0.131	35%	0.349	C	S	.	.	H	α-helix	trans	-73	-34.8	173	-68.6	166.7	0	0	0	112.5	E635 R637 K642 K643 F752 V756 L759	E635-L639 PolarHBondContact O-N 3.45Å; R637-L639 VanDerWaalsContact C-N 3.27Å; R637-L639 PolarHBondContact O-N 3.38Å; L639-K642 HydrophobicContact CD2-CD 4.43Å; L639-K642 PolarHBondContact O-N 2.74Å; L639-K643 WeakPolarHBondContact O-CB 3.4Å; L639-K643 PolarHBondContact O-N 3.26Å; L639-F752 HydrophobicContact CD2-CD1 3.9Å; L639-F752 HydrophobicContact CD2-CE1 4.04Å; L639-V756 HydrophobicContact CB-CG2 3.58Å; L639-L759 HydrophobicContact CD1-CD1 3.38Å
640	S	77.3	Confident	80.1	Confident	40 Å²	40	75 Å²	75	28%	0.28	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-41.4	174.2	-161.2	0	0	0	0	112.6	S636 R637 K643 R644	S636-S640 WeakPolarHBondContact O-CB 3.27Å; S636-S640 PolarHBondContact O-N 3.26Å; R637-S640 WeakPolarHBondContact O-CB 3.48Å; R637-S640 PolarHBondContact O-N 3.18Å; S640-K643 WeakPolarHBondContact O-CB 3.46Å; S640-K643 PolarHBondContact O-N 3.45Å; S640-R644 WeakPolarHBondContact O-CG 3.34Å; S640-R644 PolarHBondContact O-N 3.04Å
641	D	83.6	Confident	80.2	Confident	73 Å²	73	71.9 Å²	71.9	39%	0.39	35%	0.346	S	S	.	.	H	α-helix	trans	-73.1	-33.3	177.8	-71.7	-32.8	0	0	0	112.3	R637 R644 A645	R637-D641 PolarHBondContact O-N 3.17Å; D641-R644 PolarHBondContact O-N 3.23Å; D641-R644 IonicContact OD1-CZ 2.72Å; D641-R644 IonicContact OD1-NH1 3.22Å; D641-R644 PolarHBondContact OD1-NH1 3.31Å; D641-A645 PolarHBondContact O-N 3.16Å
642	K	82.2	Confident	80.3	Confident	119 Å²	119	71.6 Å²	71.6	52%	0.517	35%	0.346	S	S	.	.	H	α-helix	trans	-61.5	-45.2	167.6	-76.3	172.5	-179.5	174.7	0	112.3	Q638 L639 R644 A645 L646	Q638-K642 WeakPolarHBondContact O-CG 3.3Å; Q638-K642 PolarHBondContact O-N 3.3Å; L639-K642 HydrophobicContact CD2-CD 4.43Å; L639-K642 PolarHBondContact O-N 2.74Å; K642-R644 VanDerWaalsContact C-N 3.32Å; K642-R644 PolarHBondContact O-N 3.39Å; K642-A645 WeakPolarHBondContact O-CB 3.42Å; K642-A645 PolarHBondContact O-N 3.23Å; K642-A645 VanDerWaalsContact O-N 3.17Å; K642-L646 PolarHBondContact O-N 3.41Å; K642-L646 VanDerWaalsContact O-N 3.16Å
643	K	78.1	Confident	80.3	Confident	39 Å²	39	71.5 Å²	71.5	17%	0.17	35%	0.346	C	S	.	.	H	α-helix	trans	-57.3	-44.1	175.8	175.8	-179.4	171.9	-72.5	0	111.5	L639 S640 A645 L646 E647 K753	L639-K643 WeakPolarHBondContact O-CB 3.4Å; L639-K643 PolarHBondContact O-N 3.26Å; S640-K643 WeakPolarHBondContact O-CB 3.46Å; S640-K643 PolarHBondContact O-N 3.45Å; K643-A645 VanDerWaalsContact C-N 3.31Å; K643-A645 PolarHBondContact O-N 3.19Å; K643-L646 PolarHBondContact O-N 2.78Å; K643-E647 HydrophobicContact CG-CG 4.4Å; K643-E647 IonicContact NZ-OE1 2.81Å; K643-E647 PolarHBondContact NZ-OE1 3.01Å; K643-E647 IonicContact NZ-OE2 3.98Å; K643-E647 PolarHBondContact NZ-OE2 3.31Å; K643-E647 WeakPolarHBondContact O-CG 3.37Å; K643-E647 PolarHBondContact O-N 3.46Å; K643-K753 HydrophobicContact CD-CB 4.14Å
644	R	82.4	Confident	80.5	Confident	158 Å²	158	70.5 Å²	70.5	60%	0.596	34%	0.341	S	S	*	.	H	α-helix	trans	-61.3	-35	176.8	-75.3	168.8	168.1	164.6	-5	113.6	S640 D641 K642 K648	S640-R644 WeakPolarHBondContact O-CG 3.34Å; S640-R644 PolarHBondContact O-N 3.04Å; D641-R644 PolarHBondContact O-N 3.23Å; D641-R644 IonicContact OD1-CZ 2.72Å; D641-R644 IonicContact OD1-NH1 3.22Å; D641-R644 PolarHBondContact OD1-NH1 3.31Å; K642-R644 VanDerWaalsContact C-N 3.32Å; K642-R644 PolarHBondContact O-N 3.39Å; R644-K648 WeakPolarHBondContact O-CB 2.84Å; R644-K648 PolarHBondContact O-N 3.37Å
645	A	83.6	Confident	80.6	Confident	47 Å²	47	72.4 Å²	72.4	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-64.7	-50.5	173.6	0	0	0	0	0	110.7	D641 K642 K643 E647 K648 D649	D641-A645 PolarHBondContact O-N 3.16Å; K642-A645 WeakPolarHBondContact O-CB 3.42Å; K642-A645 PolarHBondContact O-N 3.23Å; K642-A645 VanDerWaalsContact O-N 3.17Å; K643-A645 VanDerWaalsContact C-N 3.31Å; K643-A645 PolarHBondContact O-N 3.19Å; A645-E647 PolarHBondContact O-N 3.5Å; A645-K648 WeakPolarHBondContact O-CB 3.16Å; A645-K648 PolarHBondContact O-N 3.08Å; A645-K648 VanDerWaalsContact O-N 3.1Å; A645-D649 VanDerWaalsContact O-CG 3.26Å; A645-D649 PolarHBondContact O-N 2.8Å
646	L	79.5	Confident	80.7	Confident	32 Å²	32	74.1 Å²	74.1	17%	0.168	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-39.2	178.2	-66.5	170.2	0	0	0	113	K642 K643 K648 D649 F650 L745 D748 F752	K642-L646 PolarHBondContact O-N 3.41Å; K642-L646 VanDerWaalsContact O-N 3.16Å; K643-L646 PolarHBondContact O-N 2.78Å; L646-K648 VanDerWaalsContact C-N 3.31Å; L646-K648 PolarHBondContact O-N 3.25Å; L646-D649 PolarHBondContact O-N 2.85Å; L646-F650 VanDerWaalsContact O-CB 3.23Å; L646-F650 WeakPolarHBondContact O-CB 3.34Å; L646-F650 PolarHBondContact O-N 3.22Å; L646-L745 HydrophobicContact CD2-CD2 3.9Å; L646-D748 HydrophobicContact CD1-CB 4.16Å; L646-F752 HydrophobicContact CD1-CD2 3.46Å; L646-F752 VanDerWaalsContact CD1-CD2 3.46Å; L646-F752 HydrophobicContact CD1-CE2 3.75Å
647	E	79.4	Confident	81.1	Confident	76 Å²	76	74 Å²	74	36%	0.355	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-36.1	174.8	-75.5	177.1	131.1	0	0	112.5	K643 A645 S651	K643-E647 HydrophobicContact CG-CG 4.4Å; K643-E647 IonicContact NZ-OE1 2.81Å; K643-E647 PolarHBondContact NZ-OE1 3.01Å; K643-E647 IonicContact NZ-OE2 3.98Å; K643-E647 PolarHBondContact NZ-OE2 3.31Å; K643-E647 WeakPolarHBondContact O-CG 3.37Å; K643-E647 PolarHBondContact O-N 3.46Å; A645-E647 PolarHBondContact O-N 3.5Å; E647-S651 WeakPolarHBondContact O-CB 3.47Å; E647-S651 PolarHBondContact O-N 2.97Å; E647-S651 VanDerWaalsContact O-N 3.14Å; E647-S651 PolarHBondContact O-OG 3.35Å
648	K	84.7	Confident	81.2	Confident	126 Å²	126	72.3 Å²	72.3	55%	0.548	36%	0.355	S	S	.	.	H	α-helix	trans	-70.1	-46	174.6	179.4	-160.3	163.2	-123	0	111.1	R644 A645 L646 S651 M652	R644-K648 WeakPolarHBondContact O-CB 2.84Å; R644-K648 PolarHBondContact O-N 3.37Å; A645-K648 WeakPolarHBondContact O-CB 3.16Å; A645-K648 PolarHBondContact O-N 3.08Å; A645-K648 VanDerWaalsContact O-N 3.1Å; L646-K648 VanDerWaalsContact C-N 3.31Å; L646-K648 PolarHBondContact O-N 3.25Å; K648-S651 WeakPolarHBondContact O-CA 3.48Å; K648-S651 WeakPolarHBondContact O-CB 2.96Å; K648-S651 PolarHBondContact O-N 3.47Å; K648-S651 VanDerWaalsContact O-N 3.1Å; K648-M652 HydrophobicContact CG-SD 4.49Å; K648-M652 PolarHBondContact O-N 3.43Å
649	D	82.2	Confident	81.1	Confident	64 Å²	64	69.9 Å²	69.9	34%	0.342	35%	0.35	S	S	.	.	H	α-helix	trans	-70.9	-36.3	-176.2	-60.4	-22.5	0	0	0	111	A645 L646 S651 M652 A653	A645-D649 VanDerWaalsContact O-CG 3.26Å; A645-D649 PolarHBondContact O-N 2.8Å; L646-D649 PolarHBondContact O-N 2.85Å; D649-S651 VanDerWaalsContact C-N 3.32Å; D649-S651 PolarHBondContact O-N 3.37Å; D649-M652 PolarHBondContact O-N 3.37Å; D649-A653 PolarHBondContact O-N 2.8Å
650	F	78.3	Confident	81.1	Confident	52 Å²	52	69.7 Å²	69.7	23%	0.228	35%	0.352	C	S	.	.	H	α-helix	trans	-58.7	-40.5	166.4	175.1	-91.4	0	0	0	112.4	L646 M652 A653 E654 K742 L745	L646-F650 VanDerWaalsContact O-CB 3.23Å; L646-F650 WeakPolarHBondContact O-CB 3.34Å; L646-F650 PolarHBondContact O-N 3.22Å; F650-M652 VanDerWaalsContact C-N 3.34Å; F650-A653 PolarHBondContact O-N 2.8Å; F650-E654 PolarHBondContact O-N 3.08Å; F650-K742 HydrophobicContact CD2-CG 3.97Å; F650-K742 HydrophobicContact CE2-CD 4.29Å; F650-K742 HydrophobicContact CE2-CG 3.52Å; F650-K742 VanDerWaalsContact CZ-CE 3.47Å; F650-K742 HydrophobicContact CZ-CG 4.23Å; F650-L745 HydrophobicContact CB-CB 4.19Å; F650-L745 HydrophobicContact CD2-CB 4.22Å
651	S	82	Confident	81.4	Confident	64 Å²	64	73.3 Å²	73.3	45%	0.448	36%	0.359	S	S	.	.	H	α-helix	trans	-67.6	-34.3	177	-59.9	0	0	0	0	112.2	E647 K648 D649 L655	E647-S651 WeakPolarHBondContact O-CB 3.47Å; E647-S651 PolarHBondContact O-N 2.97Å; E647-S651 VanDerWaalsContact O-N 3.14Å; E647-S651 PolarHBondContact O-OG 3.35Å; K648-S651 WeakPolarHBondContact O-CA 3.48Å; K648-S651 WeakPolarHBondContact O-CB 2.96Å; K648-S651 PolarHBondContact O-N 3.47Å; K648-S651 VanDerWaalsContact O-N 3.1Å; D649-S651 VanDerWaalsContact C-N 3.32Å; D649-S651 PolarHBondContact O-N 3.37Å; S651-L655 WeakPolarHBondContact O-CG 3.4Å; S651-L655 PolarHBondContact O-N 2.87Å; S651-L655 VanDerWaalsContact O-N 3.14Å
652	M	83.7	Confident	81.4	Confident	87 Å²	87	75.2 Å²	75.2	43%	0.429	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-49.5	172.1	-72.5	174.2	48.1	0	0	111	K648 D649 F650 E654 L655 E656	K648-M652 HydrophobicContact CG-SD 4.49Å; K648-M652 PolarHBondContact O-N 3.43Å; D649-M652 PolarHBondContact O-N 3.37Å; F650-M652 VanDerWaalsContact C-N 3.34Å; M652-E654 VanDerWaalsContact C-N 3.27Å; M652-E654 PolarHBondContact O-N 2.95Å; M652-L655 WeakPolarHBondContact O-CB 3.18Å; M652-L655 PolarHBondContact O-N 3.2Å; M652-E656 PolarHBondContact O-N 2.87Å
653	A	77.9	Confident	81.4	Confident	7 Å²	7	74.6 Å²	74.6	6%	0.058	36%	0.363	C	S	.	.	H	α-helix	trans	-59	-34.9	175.6	0	0	0	0	0	112.6	D649 F650 L657 V738 L745	D649-A653 PolarHBondContact O-N 2.8Å; F650-A653 PolarHBondContact O-N 2.8Å; A653-L657 VanDerWaalsContact O-CB 3.28Å; A653-L657 WeakPolarHBondContact O-CB 3.29Å; A653-L657 PolarHBondContact O-N 2.99Å; A653-V738 WeakPolarHBondContact O-CG1 3.31Å; A653-L745 HydrophobicContact CB-CD1 4.21Å
654	E	78.8	Confident	81.4	Confident	61 Å²	61	75.6 Å²	75.6	29%	0.285	37%	0.366	S	S	.	.	H	α-helix	trans	-70.5	-34.8	173.7	-172.8	175.7	-96.6	0	0	113.1	F650 M652 K658 K742	F650-E654 PolarHBondContact O-N 3.08Å; M652-E654 VanDerWaalsContact C-N 3.27Å; M652-E654 PolarHBondContact O-N 2.95Å; E654-K658 HydrophobicContact CG-CD 4.3Å; E654-K658 WeakPolarHBondContact O-CB 3.23Å; E654-K658 WeakPolarHBondContact O-CD 3.32Å; E654-K658 VanDerWaalsContact O-CG 3.27Å; E654-K658 WeakPolarHBondContact O-CG 3.44Å; E654-K658 PolarHBondContact O-N 2.99Å; E654-K658 WeakPolarHBondContact OE2-CE 3.27Å; E654-K658 IonicContact OE2-NZ 2.71Å; E654-K658 PolarHBondContact OE2-NZ 2.79Å; E654-K742 WeakPolarHBondContact OE1-CE 2.99Å; E654-K742 IonicContact OE1-NZ 2.69Å; E654-K742 PolarHBondContact OE1-NZ 3.06Å
655	L	84.1	Confident	81.3	Confident	114 Å²	114	73.7 Å²	73.7	60%	0.597	37%	0.365	S	S	*	.	H	α-helix	trans	-67.9	-40.3	173	-75.5	167.1	0	0	0	111.5	S651 M652 K658 S659	S651-L655 WeakPolarHBondContact O-CG 3.4Å; S651-L655 PolarHBondContact O-N 2.87Å; S651-L655 VanDerWaalsContact O-N 3.14Å; M652-L655 WeakPolarHBondContact O-CB 3.18Å; M652-L655 PolarHBondContact O-N 3.2Å; L655-K658 PolarHBondContact O-N 3.36Å; L655-S659 WeakPolarHBondContact O-CB 3.49Å; L655-S659 PolarHBondContact O-N 2.84Å
656	E	82.1	Confident	81.1	Confident	110 Å²	110	77 Å²	77	51%	0.514	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-40.3	175.1	-70.1	-176.8	-179	0	0	111.5	M652 K658 S659 A660 V738	M652-E656 PolarHBondContact O-N 2.87Å; E656-K658 PolarHBondContact O-N 2.64Å; E656-S659 WeakPolarHBondContact O-CB 3.37Å; E656-S659 PolarHBondContact O-N 2.96Å; E656-A660 WeakPolarHBondContact O-CB 3.39Å; E656-A660 PolarHBondContact O-N 3.06Å; E656-V738 HydrophobicContact CB-CG1 4.45Å
657	L	80.2	Confident	81.1	Confident	12 Å²	12	79.4 Å²	79.4	6%	0.063	38%	0.382	C	S	.	.	H	α-helix	trans	-60.7	-43.2	172.2	-178.7	57.2	0	0	0	112.2	A653 S659 A660 R661 L735 V738 E739 K742	A653-L657 VanDerWaalsContact O-CB 3.28Å; A653-L657 WeakPolarHBondContact O-CB 3.29Å; A653-L657 PolarHBondContact O-N 2.99Å; L657-S659 VanDerWaalsContact C-N 3.35Å; L657-A660 PolarHBondContact O-N 3.01Å; L657-R661 HydrophobicContact CD1-CG 4.19Å; L657-R661 WeakPolarHBondContact O-CB 3.41Å; L657-R661 VanDerWaalsContact O-CG 3.3Å; L657-R661 WeakPolarHBondContact O-CG 3.07Å; L657-R661 PolarHBondContact O-N 2.97Å; L657-L735 HydrophobicContact CD1-CD1 3.64Å; L657-V738 HydrophobicContact CB-CG1 3.89Å; L657-E739 HydrophobicContact CD1-CG 3.49Å; L657-E739 VanDerWaalsContact CD1-CG 3.49Å; L657-E739 HydrophobicContact CD2-CG 3.88Å; L657-E739 HydrophobicContact CG-CG 4.35Å; L657-K742 HydrophobicContact CD2-CD 3.82Å
658	K	83.5	Confident	81	Confident	109 Å²	109	78.8 Å²	78.8	47%	0.474	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-40.6	175.2	-74.1	164.9	-174.1	162.4	0	111.4	E654 L655 E656 Q662	E654-K658 HydrophobicContact CG-CD 4.3Å; E654-K658 WeakPolarHBondContact O-CB 3.23Å; E654-K658 WeakPolarHBondContact O-CD 3.32Å; E654-K658 VanDerWaalsContact O-CG 3.27Å; E654-K658 WeakPolarHBondContact O-CG 3.44Å; E654-K658 PolarHBondContact O-N 2.99Å; E654-K658 WeakPolarHBondContact OE2-CE 3.27Å; E654-K658 IonicContact OE2-NZ 2.71Å; E654-K658 PolarHBondContact OE2-NZ 2.79Å; L655-K658 PolarHBondContact O-N 3.36Å; E656-K658 PolarHBondContact O-N 2.64Å; K658-Q662 VanDerWaalsContact O-CB 3.25Å; K658-Q662 WeakPolarHBondContact O-CB 3.37Å; K658-Q662 PolarHBondContact O-N 2.66Å
659	S	81.3	Confident	80.7	Confident	52 Å²	52	75.4 Å²	75.4	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-64.4	-43.8	175.5	-176.6	0	0	0	0	112.4	L655 E656 L657 Q662 K663	L655-S659 WeakPolarHBondContact O-CB 3.49Å; L655-S659 PolarHBondContact O-N 2.84Å; E656-S659 WeakPolarHBondContact O-CB 3.37Å; E656-S659 PolarHBondContact O-N 2.96Å; L657-S659 VanDerWaalsContact C-N 3.35Å; S659-Q662 PolarHBondContact O-N 3.43Å; S659-K663 WeakPolarHBondContact O-CG 3.48Å; S659-K663 PolarHBondContact O-N 2.92Å; S659-K663 VanDerWaalsContact O-N 3.08Å
660	A	79.1	Confident	80.4	Confident	22 Å²	22	75.2 Å²	75.2	18%	0.182	38%	0.384	C	S	.	.	H	α-helix	trans	-65.3	-48.3	176.7	0	0	0	0	0	111.7	E656 L657 Q662 K663 Y664 L735	E656-A660 WeakPolarHBondContact O-CB 3.39Å; E656-A660 PolarHBondContact O-N 3.06Å; L657-A660 PolarHBondContact O-N 3.01Å; A660-Q662 VanDerWaalsContact C-N 3.35Å; A660-Q662 PolarHBondContact O-N 3.07Å; A660-K663 PolarHBondContact O-N 3.47Å; A660-Y664 PolarHBondContact O-N 2.67Å; A660-L735 HydrophobicContact CB-CD1 4.47Å
661	R	81.7	Confident	79.9	Confident	115 Å²	115	76.7 Å²	76.7	43%	0.434	39%	0.391	S	S	.	.	H	α-helix	trans	-57.6	-45.6	173.7	-75.3	178.1	168.7	-134.4	1.2	111.8	L657 K663 Y664 E665 L735 E739	L657-R661 HydrophobicContact CD1-CG 4.19Å; L657-R661 WeakPolarHBondContact O-CB 3.41Å; L657-R661 VanDerWaalsContact O-CG 3.3Å; L657-R661 WeakPolarHBondContact O-CG 3.07Å; L657-R661 PolarHBondContact O-N 2.97Å; R661-K663 VanDerWaalsContact C-N 3.33Å; R661-K663 PolarHBondContact O-N 3.38Å; R661-Y664 PolarHBondContact O-N 2.79Å; R661-E665 WeakPolarHBondContact O-CB 3.21Å; R661-E665 VanDerWaalsContact O-CG 3.31Å; R661-E665 WeakPolarHBondContact O-CG 3.17Å; R661-E665 PolarHBondContact O-N 3.03Å; R661-L735 HydrophobicContact CG-CD1 3.44Å; R661-L735 VanDerWaalsContact CG-CD1 3.44Å; R661-E739 IonicContact CZ-OE1 3.79Å; R661-E739 IonicContact NE-OE1 3.79Å; R661-E739 PolarHBondContact NE-OE1 2.69Å; R661-E739 IonicContact NH2-OE1 3.17Å; R661-E739 PolarHBondContact NH2-OE1 3.37Å
662	Q	84.3	Confident	79.4	Confident	114 Å²	114	78.5 Å²	78.5	53%	0.533	39%	0.393	S	S	.	.	H	α-helix	trans	-63.7	-36.3	179.9	-171.8	176.1	24.2	0	0	112.6	K658 S659 A660 Q666	K658-Q662 VanDerWaalsContact O-CB 3.25Å; K658-Q662 WeakPolarHBondContact O-CB 3.37Å; K658-Q662 PolarHBondContact O-N 2.66Å; S659-Q662 PolarHBondContact O-N 3.43Å; A660-Q662 VanDerWaalsContact C-N 3.35Å; A660-Q662 PolarHBondContact O-N 3.07Å; Q662-Q666 VanDerWaalsContact O-CB 3.31Å; Q662-Q666 WeakPolarHBondContact O-CB 3.41Å; Q662-Q666 WeakPolarHBondContact O-CG 3.5Å; Q662-Q666 PolarHBondContact O-N 2.76Å
663	K	81.6	Confident	78.8	Confident	105 Å²	105	78.1 Å²	78.1	46%	0.457	40%	0.399	S	S	.	.	H	α-helix	trans	-67	-49.3	174.1	-71.6	170	-174.9	176.5	0	111.6	S659 A660 R661 E665 Q666 E667	S659-K663 WeakPolarHBondContact O-CG 3.48Å; S659-K663 PolarHBondContact O-N 2.92Å; S659-K663 VanDerWaalsContact O-N 3.08Å; A660-K663 PolarHBondContact O-N 3.47Å; R661-K663 VanDerWaalsContact C-N 3.33Å; R661-K663 PolarHBondContact O-N 3.38Å; K663-E665 VanDerWaalsContact C-N 3.32Å; K663-E665 PolarHBondContact O-N 2.72Å; K663-Q666 WeakPolarHBondContact O-CB 3.35Å; K663-Q666 PolarHBondContact O-N 3.26Å; K663-Q666 VanDerWaalsContact O-N 3.09Å; K663-E667 WeakPolarHBondContact O-CG 3.41Å; K663-E667 PolarHBondContact O-N 3.14Å
664	Y	78.2	Confident	78.3	Confident	60 Å²	60	83 Å²	83	24%	0.235	42%	0.42	C	S	.	.	H	α-helix	trans	-58	-43.2	176	-178.1	-88.5	0	0	0	111.8	A660 R661 E667 L668 R728	A660-Y664 PolarHBondContact O-N 2.67Å; R661-Y664 PolarHBondContact O-N 2.79Å; Y664-E667 PolarHBondContact O-N 2.89Å; Y664-L668 WeakPolarHBondContact O-CB 3.34Å; Y664-L668 PolarHBondContact O-N 3.08Å; Y664-R728 HydrophobicContact CD2-CG 4.41Å; Y664-R728 HydrophobicContact CE2-CG 3.8Å
665	E	81	Confident	77.7	Confident	119 Å²	119	85 Å²	85	56%	0.556	43%	0.432	S	S	*	.	H	α-helix	trans	-66	-36.5	174.5	-74.8	173.7	-169.3	0	0	112.6	R661 K663 A669	R661-E665 WeakPolarHBondContact O-CB 3.21Å; R661-E665 VanDerWaalsContact O-CG 3.31Å; R661-E665 WeakPolarHBondContact O-CG 3.17Å; R661-E665 PolarHBondContact O-N 3.03Å; K663-E665 VanDerWaalsContact C-N 3.32Å; K663-E665 PolarHBondContact O-N 2.72Å; E665-A669 WeakPolarHBondContact O-CB 3.44Å; E665-A669 PolarHBondContact O-N 3.18Å
666	Q	80.2	Confident	76.7	Confident	115 Å²	115	82.8 Å²	82.8	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-67.4	-42.8	175.3	-80.3	170.5	1.4	0	0	112.2	Q662 K663 A669 A670	Q662-Q666 VanDerWaalsContact O-CB 3.31Å; Q662-Q666 WeakPolarHBondContact O-CB 3.41Å; Q662-Q666 WeakPolarHBondContact O-CG 3.5Å; Q662-Q666 PolarHBondContact O-N 2.76Å; K663-Q666 WeakPolarHBondContact O-CB 3.35Å; K663-Q666 PolarHBondContact O-N 3.26Å; K663-Q666 VanDerWaalsContact O-N 3.09Å; Q666-A669 PolarHBondContact O-N 3.13Å; Q666-A670 VanDerWaalsContact O-CB 3.31Å; Q666-A670 WeakPolarHBondContact O-CB 3.46Å; Q666-A670 PolarHBondContact O-N 2.94Å
667	E	78.2	Confident	75.7	Confident	84 Å²	84	80.2 Å²	80.2	39%	0.393	42%	0.419	S	S	.	.	H	α-helix	trans	-67.7	-44.4	176.3	-70.8	161.1	-171	0	0	111	K663 Y664 A669 A670 Q671 L731	K663-E667 WeakPolarHBondContact O-CG 3.41Å; K663-E667 PolarHBondContact O-N 3.14Å; Y664-E667 PolarHBondContact O-N 2.89Å; E667-A669 VanDerWaalsContact C-N 3.34Å; E667-A669 PolarHBondContact O-N 3.49Å; E667-A670 PolarHBondContact O-N 3.05Å; E667-Q671 WeakPolarHBondContact O-CB 2.93Å; E667-Q671 PolarHBondContact O-N 3.09Å; E667-L731 WeakPolarHBondContact OE2-CD1 3.11Å
668	L	77.9	Confident	74.7	Confident	63 Å²	63	85.8 Å²	85.8	33%	0.33	44%	0.443	S	S	.	.	H	α-helix	trans	-60.3	-42.3	173.3	-168.5	78.4	0	0	0	111.6	Y664 Q671 Q672	Y664-L668 WeakPolarHBondContact O-CB 3.34Å; Y664-L668 PolarHBondContact O-N 3.08Å; L668-Q671 PolarHBondContact O-N 3.1Å; L668-Q672 WeakPolarHBondContact O-CB 3.43Å; L668-Q672 VanDerWaalsContact O-CG 3.27Å; L668-Q672 WeakPolarHBondContact O-CG 3.46Å; L668-Q672 PolarHBondContact O-N 3.15Å
669	A	78.9	Confident	73.3	Confident	54 Å²	54	89.8 Å²	89.8	45%	0.446	46%	0.455	S	S	.	.	H	α-helix	trans	-69.8	-36.4	177.2	0	0	0	0	0	112.5	E665 Q666 E667 S673	E665-A669 WeakPolarHBondContact O-CB 3.44Å; E665-A669 PolarHBondContact O-N 3.18Å; Q666-A669 PolarHBondContact O-N 3.13Å; E667-A669 VanDerWaalsContact C-N 3.34Å; E667-A669 PolarHBondContact O-N 3.49Å; A669-S673 VanDerWaalsContact O-CB 3.27Å; A669-S673 WeakPolarHBondContact O-CB 3.44Å; A669-S673 PolarHBondContact O-N 3.07Å
670	A	75.8	Confident	72.1	Confident	60 Å²	60	93.7 Å²	93.7	50%	0.496	47%	0.47	S	S	.	.	H	α-helix	trans	-63.8	-46.7	172.7	0	0	0	0	0	110.9	Q666 E667 S673 E674	Q666-A670 VanDerWaalsContact O-CB 3.31Å; Q666-A670 WeakPolarHBondContact O-CB 3.46Å; Q666-A670 PolarHBondContact O-N 2.94Å; E667-A670 PolarHBondContact O-N 3.05Å; A670-S673 WeakPolarHBondContact O-CB 3.33Å; A670-S673 PolarHBondContact O-N 2.78Å; A670-S673 VanDerWaalsContact O-N 3.16Å; A670-E674 PolarHBondContact O-N 3.48Å
671	Q	67.5	Low	70.8	Confident	83 Å²	83	100 Å²	100	39%	0.388	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-41.4	176.7	-168	178.2	78	0	0	111.9	E667 L668 E674 L675	E667-Q671 WeakPolarHBondContact O-CB 2.93Å; E667-Q671 PolarHBondContact O-N 3.09Å; L668-Q671 PolarHBondContact O-N 3.1Å; Q671-E674 PolarHBondContact O-N 2.81Å; Q671-L675 HydrophobicContact CG-CD1 4.28Å; Q671-L675 WeakPolarHBondContact O-CB 3.2Å; Q671-L675 WeakPolarHBondContact O-CG 3.25Å; Q671-L675 PolarHBondContact O-N 3.06Å
672	Q	71.6	Confident	69.1	Low	103 Å²	103	97.1 Å²	97.1	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-64	-38.8	171.6	-75.9	179.8	19.6	0	0	112.4	L668 N676	L668-Q672 WeakPolarHBondContact O-CB 3.43Å; L668-Q672 VanDerWaalsContact O-CG 3.27Å; L668-Q672 WeakPolarHBondContact O-CG 3.46Å; L668-Q672 PolarHBondContact O-N 3.15Å; Q672-N676 VanDerWaalsContact O-CB 3.24Å; Q672-N676 WeakPolarHBondContact O-CB 3.31Å; Q672-N676 PolarHBondContact O-N 3.22Å; Q672-N676 PolarHBondContact O-ND2 3.45Å
673	S	70.2	Confident	67	Low	79 Å²	79	100.6 Å²	100.6	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-64.2	-44.5	176.5	-165.5	0	0	0	0	111.2	A669 A670 N676 A677	A669-S673 VanDerWaalsContact O-CB 3.27Å; A669-S673 WeakPolarHBondContact O-CB 3.44Å; A669-S673 PolarHBondContact O-N 3.07Å; A670-S673 WeakPolarHBondContact O-CB 3.33Å; A670-S673 PolarHBondContact O-N 2.78Å; A670-S673 VanDerWaalsContact O-N 3.16Å; S673-N676 PolarHBondContact O-N 3.29Å; S673-A677 WeakPolarHBondContact O-CB 3.46Å; S673-A677 PolarHBondContact O-N 3.49Å
674	E	68.1	Low	64.8	Low	110 Å²	110	100.1 Å²	100.1	51%	0.514	54%	0.537	S	S	.	.	H	α-helix	trans	-68.5	-39.6	178.3	-148	-153.9	167	0	0	112.2	A670 Q671 A677 K678	A670-E674 PolarHBondContact O-N 3.48Å; Q671-E674 PolarHBondContact O-N 2.81Å; E674-A677 PolarHBondContact O-N 2.87Å; E674-K678 WeakPolarHBondContact O-CB 3.45Å; E674-K678 WeakPolarHBondContact O-CD 3.49Å; E674-K678 VanDerWaalsContact O-CG 3.26Å; E674-K678 WeakPolarHBondContact O-CG 3.39Å; E674-K678 PolarHBondContact O-N 3.19Å; E674-K678 WeakPolarHBondContact OE1-CE 3.12Å; E674-K678 IonicContact OE1-NZ 2.73Å; E674-K678 PolarHBondContact OE1-NZ 3.16Å; E674-K678 IonicContact OE2-NZ 3.64Å; E674-K678 PolarHBondContact OE2-NZ 3.46Å
675	L	65.6	Low	62.9	Low	101 Å²	101	103.5 Å²	103.5	53%	0.529	56%	0.559	S	S	.	*	H	α-helix	trans	-63.3	-44.4	172.5	-78.8	166.9	0	0	0	111.8	Q671 K678 R679	Q671-L675 HydrophobicContact CG-CD1 4.28Å; Q671-L675 WeakPolarHBondContact O-CB 3.2Å; Q671-L675 WeakPolarHBondContact O-CG 3.25Å; Q671-L675 PolarHBondContact O-N 3.06Å; L675-K678 PolarHBondContact O-N 2.7Å; L675-R679 WeakPolarHBondContact O-CB 3.22Å; L675-R679 PolarHBondContact O-N 2.74Å
676	N	64.2	Low	60.8	Low	69 Å²	69	108.5 Å²	108.5	37%	0.369	57%	0.573	S	S	.	*	H	α-helix	trans	-66	-41.3	177	-75.4	-36.8	0	0	0	111.6	Q672 S673 K678 R679 I680	Q672-N676 VanDerWaalsContact O-CB 3.24Å; Q672-N676 WeakPolarHBondContact O-CB 3.31Å; Q672-N676 PolarHBondContact O-N 3.22Å; Q672-N676 PolarHBondContact O-ND2 3.45Å; S673-N676 PolarHBondContact O-N 3.29Å; N676-K678 VanDerWaalsContact C-N 3.3Å; N676-K678 PolarHBondContact O-N 2.84Å; N676-R679 PolarHBondContact O-N 2.85Å; N676-I680 HydrophobicContact CB-CD1 4.46Å; N676-I680 WeakPolarHBondContact O-CB 3.46Å; N676-I680 WeakPolarHBondContact O-CD1 3.35Å; N676-I680 WeakPolarHBondContact O-CG1 3.18Å; N676-I680 PolarHBondContact O-N 2.79Å
677	A	61.2	Low	58.7	Low	56 Å²	56	108.8 Å²	108.8	46%	0.463	58%	0.584	S	S	.	*	H	α-helix	trans	-59.1	-41	173.9	0	0	0	0	0	112	S673 E674	S673-A677 WeakPolarHBondContact O-CB 3.46Å; S673-A677 PolarHBondContact O-N 3.49Å; E674-A677 PolarHBondContact O-N 2.87Å
678	K	58.2	Low	56.4	Low	129 Å²	129	114 Å²	114	56%	0.561	61%	0.609	S	S	*	*	H	α-helix	trans	-68	-31	173.6	-70.3	164.4	-173.2	168.6	0	112.7	E674 L675 N676	E674-K678 WeakPolarHBondContact O-CB 3.45Å; E674-K678 WeakPolarHBondContact O-CD 3.49Å; E674-K678 VanDerWaalsContact O-CG 3.26Å; E674-K678 WeakPolarHBondContact O-CG 3.39Å; E674-K678 PolarHBondContact O-N 3.19Å; E674-K678 WeakPolarHBondContact OE1-CE 3.12Å; E674-K678 IonicContact OE1-NZ 2.73Å; E674-K678 PolarHBondContact OE1-NZ 3.16Å; E674-K678 IonicContact OE2-NZ 3.64Å; E674-K678 PolarHBondContact OE2-NZ 3.46Å; L675-K678 PolarHBondContact O-N 2.7Å; N676-K678 VanDerWaalsContact C-N 3.3Å; N676-K678 PolarHBondContact O-N 2.84Å
679	R	55.8	Low	54	Low	193 Å²	193	116.4 Å²	116.4	73%	0.728	63%	0.631	S	S	*	*	H	α-helix	trans	-85	-19.6	-178.3	-147.7	177.6	84.5	-160.4	6.9	114.8	L675 N676	L675-R679 WeakPolarHBondContact O-CB 3.22Å; L675-R679 PolarHBondContact O-N 2.74Å; N676-R679 PolarHBondContact O-N 2.85Å
680	I	54.1	Low	51.7	Low	134 Å²	134	117.9 Å²	117.9	69%	0.687	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-12.7	-175.4	-75.8	165.1	0	0	0	113.5	N676	N676-I680 HydrophobicContact CB-CD1 4.46Å; N676-I680 WeakPolarHBondContact O-CB 3.46Å; N676-I680 WeakPolarHBondContact O-CD1 3.35Å; N676-I680 WeakPolarHBondContact O-CG1 3.18Å; N676-I680 PolarHBondContact O-N 2.79Å
681	I	52.9	Low	49.5	Very low	154 Å²	154	122.7 Å²	122.7	79%	0.79	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-11.5	-174.3	-65.7	175.9	0	0	0	113.4
682	G	46.8	Very low	47.8	Very low	54 Å²	54	124.9 Å²	124.9	56%	0.557	67%	0.673	S	S	*	*	S	Bend	trans	-135.1	102.9	179.7	0	0	0	0	0	113.1
683	E	39.9	Very low	45.8	Very low	188 Å²	188	129.1 Å²	129.1	88%	0.879	69%	0.693	S	S	*	*			trans	66.6	105.2	173.5	-57.8	172.8	-178.6	0	0	113.8
684	A	35.2	Very low	44.2	Very low	95 Å²	95	129 Å²	129	79%	0.785	70%	0.703	S	S	*	*				80.7	119.2	60.6	0	0	0	0	0	114.6
685	D	38.6	Very low	42.4	Very low	130 Å²	130	130.2 Å²	130.2	70%	0.695	72%	0.718	S	S	*	*			trans	55.6	107	170.3	-86.7	-58.3	0	0	0	121.2
686	R	35.6	Very low	40.8	Very low	225 Å²	225	133 Å²	133	85%	0.849	73%	0.728	S	S	*	*			trans	86.7	159	131.7	-70.7	169.3	-165.6	-121.5	-3.7	120.7
687	P	35.7	Very low	39.7	Very low	120 Å²	120	139.5 Å²	139.5	78%	0.779	75%	0.749	S	S	*	*			trans	-125.3	-172.1	-155.7	43.4	-27.9	0	0	0	115
688	E	30	Very low	38.3	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	77%	0.767	S	S	*	*			trans	97.6	139.4	158.2	-158.1	164.7	-122.2	0	0	118.2
689	S	28.5	Very low	37.2	Very low	115 Å²	115	144 Å²	144	80%	0.804	77%	0.768	S	S	*	*			trans	80.2	146.2	174.2	-155.8	0	0	0	0	119.9
690	A	30.8	Very low	36	Very low	84 Å²	84	137.4 Å²	137.4	69%	0.694	75%	0.747	S	S	*	*			trans	54.2	129.8	169.5	0	0	0	0	0	118.2
691	L	29.1	Very low	35	Very low	161 Å²	161	132.7 Å²	132.7	84%	0.843	72%	0.722	S	S	*	*			cis	70	139	48.4	-159.5	81.4	0	0	0	113.4
692	I	32.1	Very low	34.3	Very low	130 Å²	130	127.6 Å²	127.6	67%	0.667	70%	0.704	S	S	*	*			trans	91.7	115	167.2	-50	-177.3	0	0	0	117.1
693	Q	28.9	Very low	33.7	Very low	192 Å²	192	128.5 Å²	128.5	90%	0.897	70%	0.695	S	S	*	*			trans	61.8	139.8	153.3	-67.9	162.8	-10.6	0	0	120.5
694	G	37.4	Very low	33.9	Very low	75 Å²	75	122.2 Å²	122.2	77%	0.773	67%	0.671	S	S	*	*			trans	-96	168.3	-175.8	0	0	0	0	0	115.1
695	T	30.6	Very low	34.5	Very low	136 Å²	136	124.1 Å²	124.1	83%	0.834	66%	0.663	S	S	*	*			trans	-143	133.9	166	25.6	0	0	0	0	105.7
696	H	30.8	Very low	35	Very low	159 Å²	159	122.2 Å²	122.2	74%	0.736	67%	0.666	S	S	*	*				73.3	100.4	63	-169.8	81.8	0	0	0	112.3
697	Y	41.5	Very low	35.4	Very low	206 Å²	206	117.6 Å²	117.6	81%	0.808	65%	0.652	S	S	*	*				60.6	92.7	129.5	-154.1	-93.9	0	0	0	117.1
698	M	32.6	Very low	36.1	Very low	169 Å²	169	115.1 Å²	115.1	83%	0.833	63%	0.632	S	S	*	*			trans	-148.3	135.5	155.4	-118.3	-132.9	-62.2	0	0	115.7	L700	M698-L700 PolarHBondContact O-N 2.65Å
699	L	35	Very low	37.1	Very low	112 Å²	112	113.4 Å²	113.4	59%	0.586	62%	0.624	S	S	*	*			trans	54	48.6	137.7	-148	79.4	0	0	0	118.6	I701	L699-I701 HydrophobicContact CG-CG1 4.43Å; L699-I701 WeakPolarHBondContact O-CG1 3.29Å
700	L	29.6	Very low	38.2	Very low	54 Å²	54	113.5 Å²	113.5	28%	0.283	61%	0.607	S	S	.	*				-51.8	93.3	103.8	-69.8	154.4	0	0	0	109	M698 I714 L717 E718 L721	M698-L700 PolarHBondContact O-N 2.65Å; L700-I714 HydrophobicContact CB-CD1 3.89Å; L700-I714 HydrophobicContact CB-CG1 3.56Å; L700-I714 HydrophobicContact CD2-CG1 4.09Å; L700-I714 HydrophobicContact CG-CG1 4.49Å; L700-I714 WeakPolarHBondContact O-CD1 3.41Å; L700-L717 HydrophobicContact CD2-CB 3.49Å; L700-L717 VanDerWaalsContact CD2-CB 3.49Å; L700-E718 HydrophobicContact CD1-CB 4.41Å; L700-E718 HydrophobicContact CD1-CG 3.83Å; L700-E718 VanDerWaalsContact CD2-CA 3.49Å; L700-E718 HydrophobicContact CD2-CB 3.71Å; L700-E718 HydrophobicContact CD2-CG 4.03Å; L700-E718 HydrophobicContact CG-CG 4.46Å; L700-L721 HydrophobicContact CD1-CD2 3.85Å
701	I	34.4	Very low	39.6	Very low	34 Å²	34	114.8 Å²	114.8	17%	0.174	60%	0.595	C	S	.	*				73.9	43.4	67	-37.8	-144.1	0	0	0	115.3	L699 R710 I713 I714 L717	L699-I701 HydrophobicContact CG-CG1 4.43Å; L699-I701 WeakPolarHBondContact O-CG1 3.29Å; I701-R710 HydrophobicContact CG2-CG 3.87Å; I701-R710 CarbonylContact O-C 3.59Å; I701-I713 HydrophobicContact CG2-CB 4.02Å; I701-I713 HydrophobicContact CG2-CG2 3.75Å; I701-I714 VanDerWaalsContact C-CG1 3.5Å; I701-I714 HydrophobicContact CB-CG1 4.4Å; I701-I714 WeakPolarHBondContact O-CB 3.46Å; I701-I714 WeakPolarHBondContact O-CG1 3.5Å; I701-I714 PolarHBondContact O-N 3.42Å; I701-L717 HydrophobicContact CB-CD1 4.37Å; I701-L717 HydrophobicContact CD1-CD1 3.57Å; I701-L717 HydrophobicContact CG1-CD1 3.96Å
702	A	36.8	Very low	41.4	Very low	48 Å²	48	113.8 Å²	113.8	40%	0.397	59%	0.586	S	S	.	*			trans	-99	131.8	-175.8	0	0	0	0	0	117.2	Y711 I714	A702-Y711 HydrophobicContact CB-CD2 3.71Å; A702-Y711 HydrophobicContact CB-CE2 3.74Å; A702-I714 HydrophobicContact CB-CD1 3.72Å
703	L	35	Very low	43	Very low	72 Å²	72	111 Å²	111	38%	0.377	57%	0.571	S	S	.	*			trans	-164.8	120.2	153.5	-55.3	172.8	0	0	0	111.9	K707 D708 R710 Y711	L703-K707 CarbonylContact C-O 3.39Å; L703-K707 HydrophobicContact CB-CD 4.1Å; L703-K707 WeakPolarHBondContact CB-O 3.47Å; L703-K707 HydrophobicContact CD1-CB 3.98Å; L703-K707 HydrophobicContact CD1-CD 3.97Å; L703-K707 HydrophobicContact CD1-CG 4.28Å; L703-K707 HydrophobicContact CD2-CD 4.18Å; L703-K707 HydrophobicContact CG-CD 4.3Å; L703-D708 CarbonylContact O-C 3.59Å; L703-D708 VanDerWaalsContact O-O 3.12Å; L703-R710 HydrophobicContact CB-CB 3.77Å; L703-R710 HydrophobicContact CD1-CB 4.09Å; L703-R710 HydrophobicContact CD1-CG 4.48Å; L703-R710 HydrophobicContact CG-CB 3.82Å; L703-Y711 WeakPolarHBondContact O-CB 2.96Å; L703-Y711 PolarHBondContact O-N 3.08Å
704	P	43.8	Very low	44.7	Very low	57 Å²	57	102.2 Å²	102.2	37%	0.37	53%	0.53	S	S	.	.			trans	-63.6	157.6	135.4	39.8	-12.2	0	0	0	121.6	K707 Y711	P704-K707 CarbonylContact C-O 3.58Å; P704-K707 WeakPolarHBondContact O-CD 3.24Å; P704-K707 PolarHBondContact O-NZ 2.98Å; P704-Y711 HydrophobicContact CG-CD2 4.5Å; P704-Y711 HydrophobicContact CG-CG 4.12Å
705	Q	46.8	Very low	46.4	Very low	134 Å²	134	101 Å²	101	63%	0.626	51%	0.513	S	S	*	.	S	Bend	trans	39.3	109.3	146.7	-78.3	74	71.3	0	0	118.6	K707 D708	Q705-K707 WeakPolarHBondContact O-CE 3.47Å; Q705-K707 PolarHBondContact O-NZ 3.24Å; Q705-D708 VanDerWaalsContact CA-OD1 3.25Å; Q705-D708 WeakPolarHBondContact CA-OD1 3.31Å; Q705-D708 PolarHBondContact N-OD1 3.4Å; Q705-D708 PolarHBondContact NE2-OD1 2.93Å
706	A	50.3	Low	48.6	Very low	91 Å²	91	99 Å²	99	75%	0.752	49%	0.494	S	S	*	.	S	Bend	cis	-135	70.3	-7.4	0	0	0	0	0	114.5	D708	A706-D708 WeakPolarHBondContact CA-OD2 3.33Å
707	K	43.3	Very low	50.6	Low	127 Å²	127	94.5 Å²	94.5	55%	0.552	48%	0.475	S	S	*	.	S	Bend	cis	106.2	-11.3	-26.3	97.5	72.7	-154.5	158.1	0	118.5	L703 P704 Q705	L703-K707 CarbonylContact C-O 3.39Å; L703-K707 HydrophobicContact CB-CD 4.1Å; L703-K707 WeakPolarHBondContact CB-O 3.47Å; L703-K707 HydrophobicContact CD1-CB 3.98Å; L703-K707 HydrophobicContact CD1-CD 3.97Å; L703-K707 HydrophobicContact CD1-CG 4.28Å; L703-K707 HydrophobicContact CD2-CD 4.18Å; L703-K707 HydrophobicContact CG-CD 4.3Å; P704-K707 CarbonylContact C-O 3.58Å; P704-K707 WeakPolarHBondContact O-CD 3.24Å; P704-K707 PolarHBondContact O-NZ 2.98Å; Q705-K707 WeakPolarHBondContact O-CE 3.47Å; Q705-K707 PolarHBondContact O-NZ 3.24Å
708	D	50.8	Low	52.1	Low	69 Å²	69	87.4 Å²	87.4	37%	0.369	45%	0.449	S	S	.	.			trans	-80.1	-28.6	-151.2	-52.4	-86	0	0	0	115.7	L703 Q705 A706 R710	L703-D708 CarbonylContact O-C 3.59Å; L703-D708 VanDerWaalsContact O-O 3.12Å; Q705-D708 VanDerWaalsContact CA-OD1 3.25Å; Q705-D708 WeakPolarHBondContact CA-OD1 3.31Å; Q705-D708 PolarHBondContact N-OD1 3.4Å; Q705-D708 PolarHBondContact NE2-OD1 2.93Å; A706-D708 WeakPolarHBondContact CA-OD2 3.33Å; D708-R710 PolarHBondContact O-N 3.18Å
709	E	50.8	Low	54.3	Low	157 Å²	157	83.4 Å²	83.4	73%	0.734	43%	0.428	S	S	*	.	H	α-helix	trans	-72.9	-27.3	-159.1	-61	165.9	135.2	0	0	113.5	Y711 Q712 I713	E709-Y711 PolarHBondContact O-N 3.44Å; E709-Q712 WeakPolarHBondContact O-CB 3.49Å; E709-Q712 PolarHBondContact O-N 2.81Å; E709-I713 PolarHBondContact O-N 3.35Å
710	R	50.9	Low	56.4	Low	117 Å²	117	84.6 Å²	84.6	44%	0.442	43%	0.425	S	S	.	.	H	α-helix	trans	-69.5	-38.4	-169.4	-105.2	-168.5	173.6	-162.7	-3.6	113	I701 L703 D708 Q712 I713 I714	I701-R710 HydrophobicContact CG2-CG 3.87Å; I701-R710 CarbonylContact O-C 3.59Å; L703-R710 HydrophobicContact CB-CB 3.77Å; L703-R710 HydrophobicContact CD1-CB 4.09Å; L703-R710 HydrophobicContact CD1-CG 4.48Å; L703-R710 HydrophobicContact CG-CB 3.82Å; D708-R710 PolarHBondContact O-N 3.18Å; R710-Q712 PolarHBondContact O-N 2.8Å; R710-I713 CarbonylContact O-C 3.33Å; R710-I713 VanDerWaalsContact O-CA 3.32Å; R710-I713 WeakPolarHBondContact O-CA 3.34Å; R710-I713 WeakPolarHBondContact O-CB 3.33Å; R710-I713 PolarHBondContact O-N 3.25Å; R710-I714 PolarHBondContact O-N 3.35Å
711	Y	60.7	Low	58.6	Low	111 Å²	111	85.5 Å²	85.5	44%	0.435	43%	0.43	S	S	.	.	H	α-helix	trans	-71.4	-17.3	177.2	-137.1	-86.4	0	0	0	113.7	A702 L703 P704 E709 I714 A715	A702-Y711 HydrophobicContact CB-CD2 3.71Å; A702-Y711 HydrophobicContact CB-CE2 3.74Å; L703-Y711 WeakPolarHBondContact O-CB 2.96Å; L703-Y711 PolarHBondContact O-N 3.08Å; P704-Y711 HydrophobicContact CG-CD2 4.5Å; P704-Y711 HydrophobicContact CG-CG 4.12Å; E709-Y711 PolarHBondContact O-N 3.44Å; Y711-I714 HydrophobicContact CD1-CB 4.47Å; Y711-I714 HydrophobicContact CD1-CG2 3.37Å; Y711-I714 HydrophobicContact CD2-CG2 4.06Å; Y711-I714 HydrophobicContact CE1-CG2 3.39Å; Y711-I714 HydrophobicContact CE2-CD1 4.31Å; Y711-I714 HydrophobicContact CE2-CG2 4.09Å; Y711-I714 HydrophobicContact CG-CB 4.39Å; Y711-I714 HydrophobicContact CG-CG2 3.71Å; Y711-I714 WeakPolarHBondContact O-CG2 3.37Å; Y711-A715 WeakPolarHBondContact O-CB 3.26Å; Y711-A715 PolarHBondContact O-N 3.47Å
712	Q	66.9	Low	60.6	Low	140 Å²	140	88.9 Å²	88.9	65%	0.654	44%	0.44	S	S	*	.	H	α-helix	trans	-62.4	-49	163.3	-139.1	86.6	49.2	0	0	109.1	E709 R710 I714 A715 E716	E709-Q712 WeakPolarHBondContact O-CB 3.49Å; E709-Q712 PolarHBondContact O-N 2.81Å; R710-Q712 PolarHBondContact O-N 2.8Å; Q712-I714 PolarHBondContact O-N 2.94Å; Q712-A715 PolarHBondContact O-N 3.45Å; Q712-A715 VanDerWaalsContact O-N 3.15Å; Q712-E716 WeakPolarHBondContact O-CB 3.36Å; Q712-E716 PolarHBondContact O-N 2.82Å
713	I	65.3	Low	62.7	Low	70 Å²	70	90.4 Å²	90.4	36%	0.359	44%	0.442	S	S	.	.	H	α-helix	trans	-68.6	-29.5	177.9	-53.4	166.9	0	0	0	111.9	I701 E709 R710 L717	I701-I713 HydrophobicContact CG2-CB 4.02Å; I701-I713 HydrophobicContact CG2-CG2 3.75Å; E709-I713 PolarHBondContact O-N 3.35Å; R710-I713 CarbonylContact O-C 3.33Å; R710-I713 VanDerWaalsContact O-CA 3.32Å; R710-I713 WeakPolarHBondContact O-CA 3.34Å; R710-I713 WeakPolarHBondContact O-CB 3.33Å; R710-I713 PolarHBondContact O-N 3.25Å; I713-L717 HydrophobicContact CG2-CD1 3.81Å; I713-L717 HydrophobicContact CG2-CG 4.24Å; I713-L717 VanDerWaalsContact O-CB 3.24Å; I713-L717 WeakPolarHBondContact O-CB 3.38Å; I713-L717 VanDerWaalsContact O-CG 3.3Å; I713-L717 WeakPolarHBondContact O-CG 3.42Å; I713-L717 PolarHBondContact O-N 3.21Å
714	I	65.8	Low	64.6	Low	9 Å²	9	92.2 Å²	92.2	5%	0.046	45%	0.448	C	S	.	.	H	α-helix	trans	-61	-58.4	165.2	-130.7	-179.1	0	0	0	108.7	L700 I701 A702 R710 Y711 Q712 E716 L717 E718	L700-I714 HydrophobicContact CB-CD1 3.89Å; L700-I714 HydrophobicContact CB-CG1 3.56Å; L700-I714 HydrophobicContact CD2-CG1 4.09Å; L700-I714 HydrophobicContact CG-CG1 4.49Å; L700-I714 WeakPolarHBondContact O-CD1 3.41Å; I701-I714 VanDerWaalsContact C-CG1 3.5Å; I701-I714 HydrophobicContact CB-CG1 4.4Å; I701-I714 WeakPolarHBondContact O-CB 3.46Å; I701-I714 WeakPolarHBondContact O-CG1 3.5Å; I701-I714 PolarHBondContact O-N 3.42Å; A702-I714 HydrophobicContact CB-CD1 3.72Å; R710-I714 PolarHBondContact O-N 3.35Å; Y711-I714 HydrophobicContact CD1-CB 4.47Å; Y711-I714 HydrophobicContact CD1-CG2 3.37Å; Y711-I714 HydrophobicContact CD2-CG2 4.06Å; Y711-I714 HydrophobicContact CE1-CG2 3.39Å; Y711-I714 HydrophobicContact CE2-CD1 4.31Å; Y711-I714 HydrophobicContact CE2-CG2 4.09Å; Y711-I714 HydrophobicContact CG-CB 4.39Å; Y711-I714 HydrophobicContact CG-CG2 3.71Å; Y711-I714 WeakPolarHBondContact O-CG2 3.37Å; Q712-I714 PolarHBondContact O-N 2.94Å; I714-E716 PolarHBondContact O-N 2.85Å; I714-L717 CarbonylContact O-C 3.37Å; I714-L717 PolarHBondContact O-N 3.42Å; I714-E718 WeakPolarHBondContact O-CB 3.47Å; I714-E718 PolarHBondContact O-N 3.42Å
715	A	73.7	Confident	66.2	Low	48 Å²	48	94 Å²	94	40%	0.397	45%	0.452	S	S	.	.	H	α-helix	trans	-63.1	-36.7	-169.2	0	0	0	0	0	110.8	Y711 Q712 Q719	Y711-A715 WeakPolarHBondContact O-CB 3.26Å; Y711-A715 PolarHBondContact O-N 3.47Å; Q712-A715 PolarHBondContact O-N 3.45Å; Q712-A715 VanDerWaalsContact O-N 3.15Å; A715-Q719 WeakPolarHBondContact O-CB 3.32Å; A715-Q719 PolarHBondContact O-N 3.2Å
716	E	75.7	Confident	67.9	Low	95 Å²	95	89 Å²	89	44%	0.444	43%	0.434	S	S	.	.	H	α-helix	trans	-63.1	-50.9	169.5	-77	-156.6	89.4	0	0	113.5	Q712 I714 E718 R720	Q712-E716 WeakPolarHBondContact O-CB 3.36Å; Q712-E716 PolarHBondContact O-N 2.82Å; I714-E716 PolarHBondContact O-N 2.85Å; E716-E718 VanDerWaalsContact C-N 3.32Å; E716-E718 PolarHBondContact O-N 3.3Å; E716-R720 VanDerWaalsContact O-CB 3.3Å; E716-R720 WeakPolarHBondContact O-CB 3.44Å; E716-R720 WeakPolarHBondContact O-CG 3.3Å; E716-R720 PolarHBondContact O-N 2.84Å; E716-R720 IonicContact OE1-CZ 2.79Å; E716-R720 IonicContact OE1-NE 2.78Å; E716-R720 IonicContact OE1-NH2 2.82Å; E716-R720 PolarHBondContact OE1-NH2 2.74Å; E716-R720 IonicContact OE2-NH2 3.25Å
717	L	73.3	Confident	69.2	Low	64 Å²	64	86.2 Å²	86.2	34%	0.335	41%	0.409	S	S	.	.	H	α-helix	trans	-71.6	-26.7	-179.6	-73	173.6	0	0	0	112.8	L700 I701 I713 I714 L721	L700-L717 HydrophobicContact CD2-CB 3.49Å; L700-L717 VanDerWaalsContact CD2-CB 3.49Å; I701-L717 HydrophobicContact CB-CD1 4.37Å; I701-L717 HydrophobicContact CD1-CD1 3.57Å; I701-L717 HydrophobicContact CG1-CD1 3.96Å; I713-L717 HydrophobicContact CG2-CD1 3.81Å; I713-L717 HydrophobicContact CG2-CG 4.24Å; I713-L717 VanDerWaalsContact O-CB 3.24Å; I713-L717 WeakPolarHBondContact O-CB 3.38Å; I713-L717 VanDerWaalsContact O-CG 3.3Å; I713-L717 WeakPolarHBondContact O-CG 3.42Å; I713-L717 PolarHBondContact O-N 3.21Å; I714-L717 CarbonylContact O-C 3.37Å; I714-L717 PolarHBondContact O-N 3.42Å; L717-L721 WeakPolarHBondContact O-CB 3.39Å; L717-L721 PolarHBondContact O-N 3.34Å
718	E	73.5	Confident	70.8	Confident	58 Å²	58	84.9 Å²	84.9	27%	0.271	40%	0.4	S	S	.	.	H	α-helix	trans	-78.5	-38.2	179.3	-144.3	-179.1	-102.5	0	0	109.4	L700 I714 E716 R722	L700-E718 HydrophobicContact CD1-CB 4.41Å; L700-E718 HydrophobicContact CD1-CG 3.83Å; L700-E718 VanDerWaalsContact CD2-CA 3.49Å; L700-E718 HydrophobicContact CD2-CB 3.71Å; L700-E718 HydrophobicContact CD2-CG 4.03Å; L700-E718 HydrophobicContact CG-CG 4.46Å; I714-E718 WeakPolarHBondContact O-CB 3.47Å; I714-E718 PolarHBondContact O-N 3.42Å; E716-E718 VanDerWaalsContact C-N 3.32Å; E716-E718 PolarHBondContact O-N 3.3Å; E718-R722 VanDerWaalsContact CG-NH1 3.32Å; E718-R722 WeakPolarHBondContact O-CB 3.45Å; E718-R722 VanDerWaalsContact O-CG 3.29Å; E718-R722 WeakPolarHBondContact O-CG 3.39Å; E718-R722 PolarHBondContact O-N 3.16Å; E718-R722 PolarHBondContact O-NE 3.46Å; E718-R722 IonicContact OE2-CZ 3.85Å; E718-R722 IonicContact OE2-NH1 2.77Å; E718-R722 PolarHBondContact OE2-NH1 2.78Å; E718-R722 IonicContact OE2-NH2 3.67Å
719	Q	78	Confident	72.2	Confident	84 Å²	84	87.6 Å²	87.6	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-68.7	-45.8	170.1	-165.5	56.5	36.7	0	0	110.9	A715 L721 R722 D723	A715-Q719 WeakPolarHBondContact O-CB 3.32Å; A715-Q719 PolarHBondContact O-N 3.2Å; Q719-L721 VanDerWaalsContact C-N 3.33Å; Q719-L721 PolarHBondContact O-N 2.96Å; Q719-R722 CarbonylContact O-C 3.54Å; Q719-R722 PolarHBondContact O-N 2.91Å; Q719-D723 PolarHBondContact NE2-OD1 2.88Å; Q719-D723 VanDerWaalsContact O-CB 3.27Å; Q719-D723 WeakPolarHBondContact O-CB 3.35Å; Q719-D723 PolarHBondContact O-N 3.4Å
720	R	78.3	Confident	73.8	Confident	138 Å²	138	87 Å²	87	52%	0.521	40%	0.401	S	S	.	.	H	α-helix	trans	-59.5	-42	172.9	-70.8	169.8	-159.2	-160.7	9.6	111.7	E716 D723 E724	E716-R720 VanDerWaalsContact O-CB 3.3Å; E716-R720 WeakPolarHBondContact O-CB 3.44Å; E716-R720 WeakPolarHBondContact O-CG 3.3Å; E716-R720 PolarHBondContact O-N 2.84Å; E716-R720 IonicContact OE1-CZ 2.79Å; E716-R720 IonicContact OE1-NE 2.78Å; E716-R720 IonicContact OE1-NH2 2.82Å; E716-R720 PolarHBondContact OE1-NH2 2.74Å; E716-R720 IonicContact OE2-NH2 3.25Å; R720-D723 PolarHBondContact O-N 3.26Å; R720-E724 VanDerWaalsContact O-CB 3.29Å; R720-E724 WeakPolarHBondContact O-CB 3.38Å; R720-E724 WeakPolarHBondContact O-CG 3.35Å; R720-E724 PolarHBondContact O-N 2.67Å
721	L	75.6	Confident	75.2	Confident	72 Å²	72	83.4 Å²	83.4	38%	0.377	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-44.9	175.9	-177.9	63.4	0	0	0	111.1	L700 L717 Q719 E724 E725	L700-L721 HydrophobicContact CD1-CD2 3.85Å; L717-L721 WeakPolarHBondContact O-CB 3.39Å; L717-L721 PolarHBondContact O-N 3.34Å; Q719-L721 VanDerWaalsContact C-N 3.33Å; Q719-L721 PolarHBondContact O-N 2.96Å; L721-E724 PolarHBondContact O-N 3.26Å; L721-E725 HydrophobicContact CD1-CG 4.2Å; L721-E725 HydrophobicContact CG-CG 4.36Å; L721-E725 VanDerWaalsContact O-CB 3.28Å; L721-E725 WeakPolarHBondContact O-CB 3.41Å; L721-E725 VanDerWaalsContact O-CG 3.24Å; L721-E725 WeakPolarHBondContact O-CG 3.47Å; L721-E725 PolarHBondContact O-N 2.89Å
722	R	77.9	Confident	76.2	Confident	105 Å²	105	82 Å²	82	40%	0.396	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-38	174.8	-74.5	-177	-64.9	-103.2	-0.5	113	E718 Q719 A726	E718-R722 VanDerWaalsContact CG-NH1 3.32Å; E718-R722 WeakPolarHBondContact O-CB 3.45Å; E718-R722 VanDerWaalsContact O-CG 3.29Å; E718-R722 WeakPolarHBondContact O-CG 3.39Å; E718-R722 PolarHBondContact O-N 3.16Å; E718-R722 PolarHBondContact O-NE 3.46Å; E718-R722 IonicContact OE2-CZ 3.85Å; E718-R722 IonicContact OE2-NH1 2.77Å; E718-R722 PolarHBondContact OE2-NH1 2.78Å; E718-R722 IonicContact OE2-NH2 3.67Å; Q719-R722 CarbonylContact O-C 3.54Å; Q719-R722 PolarHBondContact O-N 2.91Å; R722-A726 WeakPolarHBondContact O-CB 3.43Å; R722-A726 PolarHBondContact O-N 3.21Å
723	D	80.6	Confident	77	Confident	81 Å²	81	81.3 Å²	81.3	43%	0.433	39%	0.385	S	S	.	.	H	α-helix	trans	-69.7	-35.7	179.3	-67.1	-20.5	0	0	0	110.9	Q719 R720 S727	Q719-D723 PolarHBondContact NE2-OD1 2.88Å; Q719-D723 VanDerWaalsContact O-CB 3.27Å; Q719-D723 WeakPolarHBondContact O-CB 3.35Å; Q719-D723 PolarHBondContact O-N 3.4Å; R720-D723 PolarHBondContact O-N 3.26Å; D723-S727 WeakPolarHBondContact O-CB 3.38Å; D723-S727 PolarHBondContact O-N 2.92Å
724	E	74.7	Confident	77.8	Confident	109 Å²	109	83.7 Å²	83.7	51%	0.509	39%	0.393	S	S	.	.	H	α-helix	trans	-77.4	-38.1	173.4	-69.2	-69.5	-176.3	0	0	113	R720 L721 A726 S727 R728	R720-E724 VanDerWaalsContact O-CB 3.29Å; R720-E724 WeakPolarHBondContact O-CB 3.38Å; R720-E724 WeakPolarHBondContact O-CG 3.35Å; R720-E724 PolarHBondContact O-N 2.67Å; L721-E724 PolarHBondContact O-N 3.26Å; E724-A726 VanDerWaalsContact C-N 3.31Å; E724-A726 PolarHBondContact O-N 2.8Å; E724-S727 WeakPolarHBondContact CA-OG 3.37Å; E724-S727 PolarHBondContact O-N 2.81Å; E724-S727 PolarHBondContact O-OG 2.9Å; E724-S727 PolarHBondContact OE2-OG 2.65Å; E724-S727 VanDerWaalsContact OE2-OG 3.06Å; E724-R728 WeakPolarHBondContact O-CB 3.23Å; E724-R728 PolarHBondContact O-N 3.45Å
725	E	78	Confident	78.5	Confident	94 Å²	94	84.6 Å²	84.6	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-61.8	-44	171.1	-77.6	176	153.2	0	0	109.9	L721 R728 E729	L721-E725 HydrophobicContact CD1-CG 4.2Å; L721-E725 HydrophobicContact CG-CG 4.36Å; L721-E725 VanDerWaalsContact O-CB 3.28Å; L721-E725 WeakPolarHBondContact O-CB 3.41Å; L721-E725 VanDerWaalsContact O-CG 3.24Å; L721-E725 WeakPolarHBondContact O-CG 3.47Å; L721-E725 PolarHBondContact O-N 2.89Å; E725-R728 PolarHBondContact O-N 2.91Å; E725-E729 VanDerWaalsContact O-CB 3.3Å; E725-E729 WeakPolarHBondContact O-CB 3.4Å; E725-E729 PolarHBondContact O-N 3.37Å
726	A	81.2	Confident	79	Confident	31 Å²	31	85.7 Å²	85.7	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-73.4	-21.7	173.9	0	0	0	0	0	113.6	R722 E724 R730	R722-A726 WeakPolarHBondContact O-CB 3.43Å; R722-A726 PolarHBondContact O-N 3.21Å; E724-A726 VanDerWaalsContact C-N 3.31Å; E724-A726 PolarHBondContact O-N 2.8Å; A726-R730 WeakPolarHBondContact O-CB 3.47Å; A726-R730 WeakPolarHBondContact O-CG 3.3Å; A726-R730 PolarHBondContact O-N 2.89Å; A726-R730 PolarHBondContact O-NE 2.93Å; A726-R730 PolarHBondContact O-NH2 3.45Å
727	S	78.1	Confident	79.5	Confident	31 Å²	31	86.7 Å²	86.7	22%	0.217	40%	0.401	C	S	.	.	H	α-helix	trans	-71.8	-48.3	171.6	79.4	0	0	0	0	109.3	D723 E724 R730 L731	D723-S727 WeakPolarHBondContact O-CB 3.38Å; D723-S727 PolarHBondContact O-N 2.92Å; E724-S727 WeakPolarHBondContact CA-OG 3.37Å; E724-S727 PolarHBondContact O-N 2.81Å; E724-S727 PolarHBondContact O-OG 2.9Å; E724-S727 PolarHBondContact OE2-OG 2.65Å; E724-S727 VanDerWaalsContact OE2-OG 3.06Å; S727-R730 PolarHBondContact O-N 3.12Å; S727-L731 WeakPolarHBondContact O-CG 3.05Å; S727-L731 PolarHBondContact O-N 3.13Å; S727-L731 VanDerWaalsContact O-N 3.14Å
728	R	77.2	Confident	79.9	Confident	100 Å²	100	84.5 Å²	84.5	38%	0.377	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-45	176.9	-170	-168.2	68.4	-179.2	-3.5	112.2	Y664 E724 E725 R730 L731 E732	Y664-R728 HydrophobicContact CD2-CG 4.41Å; Y664-R728 HydrophobicContact CE2-CG 3.8Å; E724-R728 WeakPolarHBondContact O-CB 3.23Å; E724-R728 PolarHBondContact O-N 3.45Å; E725-R728 PolarHBondContact O-N 2.91Å; R728-R730 PolarHBondContact O-N 3.35Å; R728-L731 CarbonylContact O-C 3.6Å; R728-L731 PolarHBondContact O-N 3.21Å; R728-E732 WeakPolarHBondContact O-CB 3.38Å; R728-E732 PolarHBondContact O-N 2.61Å
729	E	81.1	Confident	80.3	Confident	125 Å²	125	85.2 Å²	85.2	58%	0.584	39%	0.394	S	S	*	.	H	α-helix	trans	-59	-45.6	177.5	-171.4	169.4	-135	0	0	110.9	E725 L731 E732 E733	E725-E729 VanDerWaalsContact O-CB 3.3Å; E725-E729 WeakPolarHBondContact O-CB 3.4Å; E725-E729 PolarHBondContact O-N 3.37Å; E729-L731 PolarHBondContact O-N 2.9Å; E729-E732 PolarHBondContact O-N 3.47Å; E729-E733 WeakPolarHBondContact O-CG 3.39Å; E729-E733 PolarHBondContact O-N 3.45Å
730	R	82.9	Confident	80.6	Confident	144 Å²	144	89.5 Å²	89.5	54%	0.543	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-14.1	174.1	-77.2	177.5	-70.7	-175.1	-4.8	114.8	A726 S727 R728 K734	A726-R730 WeakPolarHBondContact O-CB 3.47Å; A726-R730 WeakPolarHBondContact O-CG 3.3Å; A726-R730 PolarHBondContact O-N 2.89Å; A726-R730 PolarHBondContact O-NE 2.93Å; A726-R730 PolarHBondContact O-NH2 3.45Å; S727-R730 PolarHBondContact O-N 3.12Å; R728-R730 PolarHBondContact O-N 3.35Å; R730-K734 WeakPolarHBondContact O-CD 3.22Å; R730-K734 VanDerWaalsContact O-CG 3.31Å; R730-K734 WeakPolarHBondContact O-CG 3.3Å
731	L	81	Confident	80.9	Confident	43 Å²	43	88 Å²	88	23%	0.225	41%	0.405	C	S	.	.	H	α-helix	trans	-95.9	-31.2	173.2	-73.7	168	0	0	0	112	E667 S727 R728 E729 K734 L735	E667-L731 WeakPolarHBondContact OE2-CD1 3.11Å; S727-L731 WeakPolarHBondContact O-CG 3.05Å; S727-L731 PolarHBondContact O-N 3.13Å; S727-L731 VanDerWaalsContact O-N 3.14Å; R728-L731 CarbonylContact O-C 3.6Å; R728-L731 PolarHBondContact O-N 3.21Å; E729-L731 PolarHBondContact O-N 2.9Å; L731-K734 PolarHBondContact O-N 2.92Å; L731-L735 WeakPolarHBondContact O-CB 3.35Å; L731-L735 PolarHBondContact O-N 3.23Å
732	E	80.7	Confident	81.2	Confident	81 Å²	81	86.8 Å²	86.8	38%	0.379	40%	0.397	S	S	.	.	H	α-helix	trans	-69.6	-40.4	171	-170.4	166.3	176.9	0	0	111.3	R728 E729 K734 L735 I736	R728-E732 WeakPolarHBondContact O-CB 3.38Å; R728-E732 PolarHBondContact O-N 2.61Å; E729-E732 PolarHBondContact O-N 3.47Å; E732-K734 PolarHBondContact O-N 2.83Å; E732-L735 WeakPolarHBondContact O-CB 3.24Å; E732-L735 PolarHBondContact O-N 2.84Å; E732-I736 HydrophobicContact CG-CD1 4.29Å; E732-I736 WeakPolarHBondContact O-CD1 3.46Å; E732-I736 VanDerWaalsContact O-CG1 3.29Å; E732-I736 WeakPolarHBondContact O-CG1 3.26Å; E732-I736 PolarHBondContact O-N 3.49Å
733	E	84.4	Confident	81.5	Confident	125 Å²	125	88.9 Å²	88.9	58%	0.584	41%	0.408	S	S	*	.	H	α-helix	trans	-56.6	-49	169.1	-75.4	-173.6	134.4	0	0	111.6	E729 L735 I736 E737	E729-E733 WeakPolarHBondContact O-CG 3.39Å; E729-E733 PolarHBondContact O-N 3.45Å; E733-L735 VanDerWaalsContact C-N 3.34Å; E733-L735 PolarHBondContact O-N 2.8Å; E733-I736 PolarHBondContact O-N 2.96Å; E733-E737 WeakPolarHBondContact O-CB 3.33Å; E733-E737 PolarHBondContact O-N 3.48Å
734	K	82.5	Confident	81.8	Confident	120 Å²	120	88.9 Å²	88.9	52%	0.522	41%	0.412	S	S	.	.	H	α-helix	trans	-65.1	-35.2	177.8	-75.6	177.1	-179.4	-179.9	0	113.1	R730 L731 E732 E737 V738	R730-K734 WeakPolarHBondContact O-CD 3.22Å; R730-K734 VanDerWaalsContact O-CG 3.31Å; R730-K734 WeakPolarHBondContact O-CG 3.3Å; L731-K734 PolarHBondContact O-N 2.92Å; E732-K734 PolarHBondContact O-N 2.83Å; K734-E737 PolarHBondContact O-N 3.3Å; K734-V738 WeakPolarHBondContact O-CG2 3.27Å; K734-V738 PolarHBondContact O-N 3.38Å
735	L	81.1	Confident	82.2	Confident	28 Å²	28	85.4 Å²	85.4	15%	0.147	40%	0.396	C	S	.	.	H	α-helix	trans	-61	-47.8	173.2	-175.3	74.1	0	0	0	110.3	L657 A660 R661 L731 E732 E733 E737 E739	L657-L735 HydrophobicContact CD1-CD1 3.64Å; A660-L735 HydrophobicContact CB-CD1 4.47Å; R661-L735 HydrophobicContact CG-CD1 3.44Å; R661-L735 VanDerWaalsContact CG-CD1 3.44Å; L731-L735 WeakPolarHBondContact O-CB 3.35Å; L731-L735 PolarHBondContact O-N 3.23Å; E732-L735 WeakPolarHBondContact O-CB 3.24Å; E732-L735 PolarHBondContact O-N 2.84Å; E733-L735 VanDerWaalsContact C-N 3.34Å; E733-L735 PolarHBondContact O-N 2.8Å; L735-E737 VanDerWaalsContact C-N 3.34Å; L735-E737 PolarHBondContact O-N 3.16Å; L735-E739 WeakPolarHBondContact O-CB 3.33Å; L735-E739 WeakPolarHBondContact O-CG 3.39Å; L735-E739 PolarHBondContact O-N 3.16Å
736	I	84.4	Confident	82.4	Confident	71 Å²	71	83 Å²	83	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-36.2	178.4	-68	164.5	0	0	0	111.6	E732 E733 R740	E732-I736 HydrophobicContact CG-CD1 4.29Å; E732-I736 WeakPolarHBondContact O-CD1 3.46Å; E732-I736 VanDerWaalsContact O-CG1 3.29Å; E732-I736 WeakPolarHBondContact O-CG1 3.26Å; E732-I736 PolarHBondContact O-N 3.49Å; E733-I736 PolarHBondContact O-N 2.96Å; I736-R740 WeakPolarHBondContact O-CD 3.43Å; I736-R740 VanDerWaalsContact O-CG 3.24Å; I736-R740 WeakPolarHBondContact O-CG 3.43Å; I736-R740 PolarHBondContact O-N 3.28Å; I736-R740 VanDerWaalsContact O-N 3.11Å
737	E	84.1	Confident	82.6	Confident	116 Å²	116	87 Å²	87	54%	0.542	41%	0.406	S	S	.	.	H	α-helix	trans	-64	-55.1	176.6	-170.6	162.6	-125.2	0	0	111.4	E733 K734 L735 E739 R740 E741	E733-E737 WeakPolarHBondContact O-CB 3.33Å; E733-E737 PolarHBondContact O-N 3.48Å; K734-E737 PolarHBondContact O-N 3.3Å; L735-E737 VanDerWaalsContact C-N 3.34Å; L735-E737 PolarHBondContact O-N 3.16Å; E737-E739 VanDerWaalsContact C-N 3.3Å; E737-E739 PolarHBondContact O-N 3.18Å; E737-R740 WeakPolarHBondContact O-CB 3.14Å; E737-R740 PolarHBondContact O-N 3.5Å; E737-E741 PolarHBondContact O-N 3.5Å
738	V	81.9	Confident	82.8	Confident	19 Å²	19	88.8 Å²	88.8	12%	0.115	41%	0.413	C	S	.	.	H	α-helix	trans	-65.5	-31.9	179.3	-179	0	0	0	0	111.9	A653 E656 L657 K734 R740 E741 K742	A653-V738 WeakPolarHBondContact O-CG1 3.31Å; E656-V738 HydrophobicContact CB-CG1 4.45Å; L657-V738 HydrophobicContact CB-CG1 3.89Å; K734-V738 WeakPolarHBondContact O-CG2 3.27Å; K734-V738 PolarHBondContact O-N 3.38Å; V738-R740 VanDerWaalsContact C-N 3.34Å; V738-E741 PolarHBondContact O-N 3.07Å; V738-K742 WeakPolarHBondContact O-CB 3.12Å; V738-K742 PolarHBondContact O-N 3.29Å
739	E	82.4	Confident	82.7	Confident	73 Å²	73	84.8 Å²	84.8	34%	0.341	40%	0.401	S	S	.	.	H	α-helix	trans	-66.9	-31.6	172	-76.2	-167.4	-179.7	0	0	113.5	L657 R661 L735 E737 K743	L657-E739 HydrophobicContact CD1-CG 3.49Å; L657-E739 VanDerWaalsContact CD1-CG 3.49Å; L657-E739 HydrophobicContact CD2-CG 3.88Å; L657-E739 HydrophobicContact CG-CG 4.35Å; R661-E739 IonicContact CZ-OE1 3.79Å; R661-E739 IonicContact NE-OE1 3.79Å; R661-E739 PolarHBondContact NE-OE1 2.69Å; R661-E739 IonicContact NH2-OE1 3.17Å; R661-E739 PolarHBondContact NH2-OE1 3.37Å; L735-E739 WeakPolarHBondContact O-CB 3.33Å; L735-E739 WeakPolarHBondContact O-CG 3.39Å; L735-E739 PolarHBondContact O-N 3.16Å; E737-E739 VanDerWaalsContact C-N 3.3Å; E737-E739 PolarHBondContact O-N 3.18Å; E739-K743 WeakPolarHBondContact O-CB 3.47Å; E739-K743 PolarHBondContact O-N 2.86Å
740	R	85.7	Confident	82.8	Confident	174 Å²	174	82.2 Å²	82.2	66%	0.657	39%	0.391	S	S	*	.	H	α-helix	trans	-70.4	-48.3	173	-72.4	165.4	-177.5	-179.6	4.7	111	I736 E737 V738 K742 K743 V744	I736-R740 WeakPolarHBondContact O-CD 3.43Å; I736-R740 VanDerWaalsContact O-CG 3.24Å; I736-R740 WeakPolarHBondContact O-CG 3.43Å; I736-R740 PolarHBondContact O-N 3.28Å; I736-R740 VanDerWaalsContact O-N 3.11Å; E737-R740 WeakPolarHBondContact O-CB 3.14Å; E737-R740 PolarHBondContact O-N 3.5Å; V738-R740 VanDerWaalsContact C-N 3.34Å; R740-K742 PolarHBondContact O-N 3.45Å; R740-K743 WeakPolarHBondContact O-CB 3.47Å; R740-K743 PolarHBondContact O-N 2.96Å; R740-K743 VanDerWaalsContact O-N 3.08Å; R740-V744 PolarHBondContact O-N 3.26Å
741	E	83.2	Confident	82.9	Confident	106 Å²	106	80 Å²	80	50%	0.495	39%	0.387	S	S	.	.	H	α-helix	trans	-59.1	-47.6	179.1	-67.8	-171.3	142.3	0	0	111.6	E737 V738 K743 V744 L745	E737-E741 PolarHBondContact O-N 3.5Å; V738-E741 PolarHBondContact O-N 3.07Å; E741-K743 PolarHBondContact O-N 2.78Å; E741-V744 PolarHBondContact O-N 3.49Å; E741-V744 VanDerWaalsContact O-N 3.15Å; E741-L745 WeakPolarHBondContact O-CG 3.4Å; E741-L745 PolarHBondContact O-N 2.96Å
742	K	82.2	Confident	82.8	Confident	47 Å²	47	80.4 Å²	80.4	20%	0.204	39%	0.386	C	S	.	.	H	α-helix	trans	-53.6	-40.3	174	-175.6	-178.1	-178.1	-174.7	0	112.3	F650 E654 L657 V738 R740 S746	F650-K742 HydrophobicContact CD2-CG 3.97Å; F650-K742 HydrophobicContact CE2-CD 4.29Å; F650-K742 HydrophobicContact CE2-CG 3.52Å; F650-K742 VanDerWaalsContact CZ-CE 3.47Å; F650-K742 HydrophobicContact CZ-CG 4.23Å; E654-K742 WeakPolarHBondContact OE1-CE 2.99Å; E654-K742 IonicContact OE1-NZ 2.69Å; E654-K742 PolarHBondContact OE1-NZ 3.06Å; L657-K742 HydrophobicContact CD2-CD 3.82Å; V738-K742 WeakPolarHBondContact O-CB 3.12Å; V738-K742 PolarHBondContact O-N 3.29Å; R740-K742 PolarHBondContact O-N 3.45Å; K742-S746 WeakPolarHBondContact O-CB 3.19Å; K742-S746 PolarHBondContact O-N 3.45Å; K742-S746 VanDerWaalsContact O-N 3.11Å
743	K	85	Confident	82.7	Confident	148 Å²	148	81.6 Å²	81.6	64%	0.643	39%	0.391	S	S	*	.	H	α-helix	trans	-72.7	-35	-178.5	-168.7	174.5	-178.2	179.5	0	112.8	E739 R740 E741 L747	E739-K743 WeakPolarHBondContact O-CB 3.47Å; E739-K743 PolarHBondContact O-N 2.86Å; R740-K743 WeakPolarHBondContact O-CB 3.47Å; R740-K743 PolarHBondContact O-N 2.96Å; R740-K743 VanDerWaalsContact O-N 3.08Å; E741-K743 PolarHBondContact O-N 2.78Å; K743-L747 WeakPolarHBondContact O-CG 3.14Å; K743-L747 PolarHBondContact O-N 2.97Å
744	V	85.6	Confident	82.7	Confident	82 Å²	82	82.5 Å²	82.5	50%	0.497	40%	0.395	S	S	.	.	H	α-helix	trans	-66.2	-52.9	173.3	175.2	0	0	0	0	110.2	R740 E741 S746 L747 D748	R740-V744 PolarHBondContact O-N 3.26Å; E741-V744 PolarHBondContact O-N 3.49Å; E741-V744 VanDerWaalsContact O-N 3.15Å; V744-S746 PolarHBondContact O-N 2.91Å; V744-S746 VanDerWaalsContact O-N 3.17Å; V744-L747 PolarHBondContact O-N 3.23Å; V744-D748 PolarHBondContact O-N 3.28Å; V744-D748 VanDerWaalsContact O-N 3.1Å
745	L	82.9	Confident	82.5	Confident	35 Å²	35	79.8 Å²	79.8	18%	0.183	38%	0.384	C	S	.	.	H	α-helix	trans	-57.4	-34.2	180	-68.4	170.5	0	0	0	112.9	L646 F650 A653 E741 S749	L646-L745 HydrophobicContact CD2-CD2 3.9Å; F650-L745 HydrophobicContact CB-CB 4.19Å; F650-L745 HydrophobicContact CD2-CB 4.22Å; A653-L745 HydrophobicContact CB-CD1 4.21Å; E741-L745 WeakPolarHBondContact O-CG 3.4Å; E741-L745 PolarHBondContact O-N 2.96Å; L745-S749 WeakPolarHBondContact O-CB 3.45Å; L745-S749 PolarHBondContact O-N 3.1Å
746	S	82.2	Confident	82.4	Confident	44 Å²	44	79.5 Å²	79.5	31%	0.308	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-44	173.5	-166.4	0	0	0	0	112.8	K742 V744 D750	K742-S746 WeakPolarHBondContact O-CB 3.19Å; K742-S746 PolarHBondContact O-N 3.45Å; K742-S746 VanDerWaalsContact O-N 3.11Å; V744-S746 PolarHBondContact O-N 2.91Å; V744-S746 VanDerWaalsContact O-N 3.17Å; S746-D750 PolarHBondContact O-N 2.9Å; S746-D750 VanDerWaalsContact O-N 3.09Å
747	L	85.5	Confident	82.3	Confident	116 Å²	116	83.3 Å²	83.3	61%	0.607	40%	0.399	S	S	*	.	H	α-helix	trans	-70.1	-42.4	-177.3	-70.1	168.7	0	0	0	111.3	K743 V744 D750 H751	K743-L747 WeakPolarHBondContact O-CG 3.14Å; K743-L747 PolarHBondContact O-N 2.97Å; V744-L747 PolarHBondContact O-N 3.23Å; L747-D750 PolarHBondContact O-N 3.13Å; L747-H751 WeakPolarHBondContact O-CB 3.47Å; L747-H751 PolarHBondContact O-N 3.17Å
748	D	82.2	Confident	82.2	Confident	67 Å²	67	84.2 Å²	84.2	36%	0.358	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-42.4	176.3	-66.7	-28.3	0	0	0	111.1	L646 V744 D750 H751 F752	L646-D748 HydrophobicContact CD1-CB 4.16Å; V744-D748 PolarHBondContact O-N 3.28Å; V744-D748 VanDerWaalsContact O-N 3.1Å; D748-D750 PolarHBondContact O-N 3.32Å; D748-H751 PolarHBondContact O-N 2.74Å; D748-F752 WeakPolarHBondContact O-CD2 3.41Å; D748-F752 PolarHBondContact O-N 3.35Å
749	S	76.9	Confident	81.9	Confident	16 Å²	16	84.8 Å²	84.8	11%	0.112	41%	0.406	C	S	.	.	H	α-helix	trans	-60	-43.6	176.3	175.4	0	0	0	0	112.8	L745 K753	L745-S749 WeakPolarHBondContact O-CB 3.45Å; L745-S749 PolarHBondContact O-N 3.1Å; S749-K753 VanDerWaalsContact O-CB 3.26Å; S749-K753 WeakPolarHBondContact O-CB 3.45Å; S749-K753 PolarHBondContact O-N 2.82Å
750	D	83	Confident	81.8	Confident	71 Å²	71	84.1 Å²	84.1	38%	0.38	41%	0.406	S	S	.	.	H	α-helix	trans	-70.5	-35.5	175.9	-82.7	-42.6	0	0	0	112.2	S746 L747 D748 K753 E754	S746-D750 PolarHBondContact O-N 2.9Å; S746-D750 VanDerWaalsContact O-N 3.09Å; L747-D750 PolarHBondContact O-N 3.13Å; D748-D750 PolarHBondContact O-N 3.32Å; D750-K753 WeakPolarHBondContact O-CB 3.11Å; D750-K753 PolarHBondContact O-N 3.2Å; D750-K753 IonicContact OD1-NZ 3.62Å; D750-K753 PolarHBondContact OD1-NZ 2.86Å; D750-E754 PolarHBondContact O-N 3.45Å; D750-E754 VanDerWaalsContact O-N 3.15Å
751	H	83.5	Confident	81.5	Confident	98 Å²	98	77.5 Å²	77.5	45%	0.454	39%	0.392	S	S	.	.	H	α-helix	trans	-64.5	-46.5	176.1	-175	54.1	0	0	0	112.8	L747 D748 K753 E754 Q755	L747-H751 WeakPolarHBondContact O-CB 3.47Å; L747-H751 PolarHBondContact O-N 3.17Å; D748-H751 PolarHBondContact O-N 2.74Å; H751-K753 VanDerWaalsContact C-N 3.25Å; H751-K753 PolarHBondContact O-N 3.49Å; H751-E754 PolarHBondContact O-N 3.43Å; H751-Q755 PolarHBondContact NE2-NE2 2.85Å; H751-Q755 PolarHBondContact O-N 3.38Å
752	F	78.9	Confident	81.2	Confident	51 Å²	51	76 Å²	76	22%	0.224	39%	0.388	C	S	.	.	H	α-helix	trans	-66.7	-27.7	176.3	-74.3	-61.9	0	0	0	112.9	L639 L646 D748 Q755 V756	L639-F752 HydrophobicContact CD2-CD1 3.9Å; L639-F752 HydrophobicContact CD2-CE1 4.04Å; L646-F752 HydrophobicContact CD1-CD2 3.46Å; L646-F752 VanDerWaalsContact CD1-CD2 3.46Å; L646-F752 HydrophobicContact CD1-CE2 3.75Å; D748-F752 WeakPolarHBondContact O-CD2 3.41Å; D748-F752 PolarHBondContact O-N 3.35Å; F752-Q755 PolarHBondContact O-N 3.22Å; F752-V756 WeakPolarHBondContact O-CG2 3.42Å; F752-V756 PolarHBondContact O-N 2.78Å
753	K	79.4	Confident	80.8	Confident	107 Å²	107	74.1 Å²	74.1	47%	0.465	38%	0.38	S	S	.	.	H	α-helix	trans	-67.8	-37.2	174.7	171.4	178.2	149	-154	0	112.5	K643 S749 D750 H751 H757	K643-K753 HydrophobicContact CD-CB 4.14Å; S749-K753 VanDerWaalsContact O-CB 3.26Å; S749-K753 WeakPolarHBondContact O-CB 3.45Å; S749-K753 PolarHBondContact O-N 2.82Å; D750-K753 WeakPolarHBondContact O-CB 3.11Å; D750-K753 PolarHBondContact O-N 3.2Å; D750-K753 IonicContact OD1-NZ 3.62Å; D750-K753 PolarHBondContact OD1-NZ 2.86Å; H751-K753 VanDerWaalsContact C-N 3.25Å; H751-K753 PolarHBondContact O-N 3.49Å; K753-H757 PolarHBondContact O-N 2.8Å
754	E	83.5	Confident	80.5	Confident	143 Å²	143	72.9 Å²	72.9	67%	0.668	38%	0.377	S	S	*	.	H	α-helix	trans	-67.1	-46.2	170.8	-69.8	-171.8	144.8	0	0	111.9	D750 H751 V756 H757 Q758	D750-E754 PolarHBondContact O-N 3.45Å; D750-E754 VanDerWaalsContact O-N 3.15Å; H751-E754 PolarHBondContact O-N 3.43Å; E754-V756 PolarHBondContact O-N 3.45Å; E754-H757 PolarHBondContact O-N 3Å; E754-H757 VanDerWaalsContact O-N 3.13Å; E754-Q758 PolarHBondContact O-N 2.84Å
755	Q	79.6	Confident	80.2	Confident	64 Å²	64	72.9 Å²	72.9	30%	0.299	38%	0.38	S	S	.	.	H	α-helix	trans	-58	-44.6	178.2	-67.8	-173	11.1	0	0	112.6	H751 F752 H757 Q758 L759	H751-Q755 PolarHBondContact NE2-NE2 2.85Å; H751-Q755 PolarHBondContact O-N 3.38Å; F752-Q755 PolarHBondContact O-N 3.22Å; Q755-H757 VanDerWaalsContact C-N 3.35Å; Q755-H757 PolarHBondContact O-N 3.22Å; Q755-Q758 PolarHBondContact O-N 2.78Å; Q755-L759 WeakPolarHBondContact O-CG 3.49Å; Q755-L759 PolarHBondContact O-N 3Å; Q755-L759 VanDerWaalsContact O-N 3.12Å
756	V	78.2	Confident	79.9	Confident	21 Å²	21	72.7 Å²	72.7	13%	0.127	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-40.7	176.6	170.2	0	0	0	0	111.2	L639 F752 E754 Q758 L759 V760	L639-V756 HydrophobicContact CB-CG2 3.58Å; F752-V756 WeakPolarHBondContact O-CG2 3.42Å; F752-V756 PolarHBondContact O-N 2.78Å; E754-V756 PolarHBondContact O-N 3.45Å; V756-Q758 VanDerWaalsContact C-N 3.31Å; V756-Q758 PolarHBondContact O-N 3.28Å; V756-L759 PolarHBondContact O-N 3.39Å; V756-V760 HydrophobicContact CG1-CG2 4.31Å; V756-V760 WeakPolarHBondContact O-CB 3.31Å; V756-V760 VanDerWaalsContact O-CG2 3.28Å; V756-V760 WeakPolarHBondContact O-CG2 3.41Å; V756-V760 PolarHBondContact O-N 3.45Å
757	H	83	Confident	79.7	Confident	151 Å²	151	76.5 Å²	76.5	70%	0.699	39%	0.387	S	S	*	.	H	α-helix	trans	-63.8	-36.1	178	-167.6	-51.5	0	0	0	112.3	K753 E754 Q755 G761	K753-H757 PolarHBondContact O-N 2.8Å; E754-H757 PolarHBondContact O-N 3Å; E754-H757 VanDerWaalsContact O-N 3.13Å; Q755-H757 VanDerWaalsContact C-N 3.35Å; Q755-H757 PolarHBondContact O-N 3.22Å; H757-G761 PolarHBondContact O-N 3.49Å
758	Q	81.8	Confident	79.5	Confident	136 Å²	136	77.4 Å²	77.4	64%	0.636	39%	0.39	S	S	*	.	H	α-helix	trans	-67.6	-50.2	176.5	-173.4	171.7	-5	0	0	111.6	E754 Q755 V756 V760 G761 D762	E754-Q758 PolarHBondContact O-N 2.84Å; Q755-Q758 PolarHBondContact O-N 2.78Å; V756-Q758 VanDerWaalsContact C-N 3.31Å; V756-Q758 PolarHBondContact O-N 3.28Å; Q758-V760 VanDerWaalsContact C-N 3.3Å; Q758-V760 PolarHBondContact O-N 3.25Å; Q758-G761 PolarHBondContact O-N 3.06Å; Q758-G761 VanDerWaalsContact O-N 3.08Å; Q758-D762 PolarHBondContact O-N 3.29Å
759	L	76.6	Confident	79.4	Confident	31 Å²	31	78.6 Å²	78.6	16%	0.162	39%	0.392	C	S	.	.	H	α-helix	trans	-64.5	-32	-178.7	-68.9	168.1	0	0	0	113.2	L632 L639 Q755 V756 S763	L632-L759 HydrophobicContact CD2-CD2 3.63Å; L639-L759 HydrophobicContact CD1-CD1 3.38Å; Q755-L759 WeakPolarHBondContact O-CG 3.49Å; Q755-L759 PolarHBondContact O-N 3Å; Q755-L759 VanDerWaalsContact O-N 3.12Å; V756-L759 PolarHBondContact O-N 3.39Å; L759-S763 WeakPolarHBondContact O-CB 3.33Å; L759-S763 PolarHBondContact O-N 2.8Å
760	V	78.3	Confident	79.3	Confident	58 Å²	58	78.6 Å²	78.6	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-64.7	-43	171.9	169.1	0	0	0	0	111	V756 Q758 S763 E764	V756-V760 HydrophobicContact CG1-CG2 4.31Å; V756-V760 WeakPolarHBondContact O-CB 3.31Å; V756-V760 VanDerWaalsContact O-CG2 3.28Å; V756-V760 WeakPolarHBondContact O-CG2 3.41Å; V756-V760 PolarHBondContact O-N 3.45Å; Q758-V760 VanDerWaalsContact C-N 3.3Å; Q758-V760 PolarHBondContact O-N 3.25Å; V760-S763 WeakPolarHBondContact O-CB 3.38Å; V760-S763 PolarHBondContact O-N 3.13Å; V760-E764 WeakPolarHBondContact O-CG 3.5Å; V760-E764 PolarHBondContact O-N 2.95Å
761	G	79.4	Confident	79.1	Confident	35 Å²	35	78.9 Å²	78.9	36%	0.361	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-43.3	177	0	0	0	0	0	113.3	H757 Q758 S763 E764 S765	H757-G761 PolarHBondContact O-N 3.49Å; Q758-G761 PolarHBondContact O-N 3.06Å; Q758-G761 VanDerWaalsContact O-N 3.08Å; G761-S763 VanDerWaalsContact C-N 3.31Å; G761-S763 PolarHBondContact O-N 3.19Å; G761-E764 PolarHBondContact O-N 3Å; G761-S765 WeakPolarHBondContact O-CB 3.27Å; G761-S765 PolarHBondContact O-N 3.28Å
762	D	78.8	Confident	79	Confident	76 Å²	76	80.2 Å²	80.2	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-37.5	175	-70.7	-27.9	0	0	0	111.8	Q758 S765 L766	Q758-D762 PolarHBondContact O-N 3.29Å; D762-S765 PolarHBondContact O-N 3Å; D762-L766 PolarHBondContact O-N 3.14Å
763	S	72.8	Confident	78.8	Confident	6 Å²	6	78.6 Å²	78.6	4%	0.042	40%	0.398	C	S	.	.	H	α-helix	trans	-66.9	-40.7	175	-179.4	0	0	0	0	112.8	H629 M633 L759 V760 G761 R767	H629-S763 PolarHBondContact CE1-O 3.38Å; H629-S763 PolarHBondContact CE1-OG 3.22Å; H629-S763 PolarHBondContact ND1-O 3.08Å; M633-S763 PolarHBondContact SD-OG 3.28Å; L759-S763 WeakPolarHBondContact O-CB 3.33Å; L759-S763 PolarHBondContact O-N 2.8Å; V760-S763 WeakPolarHBondContact O-CB 3.38Å; V760-S763 PolarHBondContact O-N 3.13Å; G761-S763 VanDerWaalsContact C-N 3.31Å; G761-S763 PolarHBondContact O-N 3.19Å; S763-R767 VanDerWaalsContact O-CB 3.3Å; S763-R767 WeakPolarHBondContact O-CB 3.24Å; S763-R767 PolarHBondContact O-N 3.27Å
764	E	78.7	Confident	78.5	Confident	123 Å²	123	77 Å²	77	58%	0.575	39%	0.394	S	S	*	.	H	α-helix	trans	-66.5	-41	174.2	-73.5	-175.7	165.7	0	0	112	V760 G761 R767 M768	V760-E764 WeakPolarHBondContact O-CG 3.5Å; V760-E764 PolarHBondContact O-N 2.95Å; G761-E764 PolarHBondContact O-N 3Å; E764-R767 WeakPolarHBondContact O-CB 3.22Å; E764-R767 PolarHBondContact O-N 3.28Å; E764-M768 WeakPolarHBondContact O-CG 3.41Å; E764-M768 PolarHBondContact O-N 3.15Å
765	S	80.4	Confident	78.1	Confident	81 Å²	81	72.5 Å²	72.5	57%	0.566	38%	0.379	S	S	*	.	H	α-helix	trans	-58.4	-48	174.7	-175.3	0	0	0	0	112.1	G761 D762 M768 K769	G761-S765 WeakPolarHBondContact O-CB 3.27Å; G761-S765 PolarHBondContact O-N 3.28Å; D762-S765 PolarHBondContact O-N 3Å; S765-M768 PolarHBondContact O-N 3.13Å; S765-K769 PolarHBondContact O-N 2.98Å
766	L	74.8	Confident	77.9	Confident	31 Å²	31	73.6 Å²	73.6	16%	0.162	38%	0.384	C	S	.	.	H	α-helix	trans	-65.7	-38.9	175.4	-76.8	167.1	0	0	0	112.6	L625 R628 H629 L632 D762 M768 K769 I770	L625-L766 HydrophobicContact CD2-CD2 3.76Å; R628-L766 HydrophobicContact CG-CD1 4.28Å; H629-L766 HydrophobicContact CB-CB 4.36Å; L632-L766 HydrophobicContact CD1-CD1 3.32Å; D762-L766 PolarHBondContact O-N 3.14Å; L766-M768 VanDerWaalsContact C-N 3.32Å; L766-M768 PolarHBondContact O-N 3.16Å; L766-K769 PolarHBondContact O-N 2.99Å; L766-I770 WeakPolarHBondContact O-CB 3.26Å; L766-I770 WeakPolarHBondContact O-CD1 3.31Å; L766-I770 VanDerWaalsContact O-CG1 3.29Å; L766-I770 WeakPolarHBondContact O-CG1 3.49Å; L766-I770 PolarHBondContact O-N 2.99Å
767	R	78.4	Confident	77.5	Confident	124 Å²	124	74.5 Å²	74.5	47%	0.468	39%	0.389	S	S	.	.	H	α-helix	trans	-59.7	-41.5	175.5	-171.5	-176.6	-60.5	-116	-2.3	112.1	H629 M633 S763 E764 I770 S771	H629-R767 VanDerWaalsContact CE1-CB 3.49Å; H629-R767 WeakPolarHBondContact CE1-CB 3.24Å; H629-R767 PolarHBondContact CE1-NE 3.16Å; H629-R767 VanDerWaalsContact CE1-NE 3.29Å; H629-R767 PolarHBondContact CE1-NH2 3.23Å; H629-R767 PolarHBondContact NE2-NE 2.93Å; H629-R767 PolarHBondContact NE2-NH2 3.06Å; M633-R767 PolarHBondContact SD-NH2 3.15Å; M633-R767 VanDerWaalsContact SD-NH2 3.44Å; S763-R767 VanDerWaalsContact O-CB 3.3Å; S763-R767 WeakPolarHBondContact O-CB 3.24Å; S763-R767 PolarHBondContact O-N 3.27Å; E764-R767 WeakPolarHBondContact O-CB 3.22Å; E764-R767 PolarHBondContact O-N 3.28Å; R767-I770 PolarHBondContact O-N 2.95Å; R767-S771 WeakPolarHBondContact O-CB 3.3Å; R767-S771 PolarHBondContact O-N 3.08Å
768	M	81.8	Confident	76.9	Confident	135 Å²	135	73.6 Å²	73.6	67%	0.665	39%	0.385	S	S	*	.	H	α-helix	trans	-62.7	-46	175	-71.4	-61	-63.4	0	0	111.3	E764 S765 L766 I770 S771 E772	E764-M768 WeakPolarHBondContact O-CG 3.41Å; E764-M768 PolarHBondContact O-N 3.15Å; S765-M768 PolarHBondContact O-N 3.13Å; L766-M768 VanDerWaalsContact C-N 3.32Å; L766-M768 PolarHBondContact O-N 3.16Å; M768-I770 PolarHBondContact O-N 2.96Å; M768-S771 WeakPolarHBondContact O-CB 3.41Å; M768-S771 PolarHBondContact O-N 2.83Å; M768-S771 VanDerWaalsContact O-N 3.15Å; M768-E772 PolarHBondContact O-N 3.11Å
769	K	79.1	Confident	76.4	Confident	92 Å²	92	72.5 Å²	72.5	40%	0.4	38%	0.38	S	S	.	.	H	α-helix	trans	-65.8	-37	178.4	-160.1	-177.9	-176.6	-157.9	0	112.7	E621 L625 S765 L766 E772 L773	E621-K769 IonicContact OE1-NZ 3.63Å; E621-K769 PolarHBondContact OE1-NZ 3.29Å; L625-K769 HydrophobicContact CD1-CD 3.95Å; L625-K769 HydrophobicContact CD1-CG 4.47Å; S765-K769 PolarHBondContact O-N 2.98Å; L766-K769 PolarHBondContact O-N 2.99Å; K769-E772 PolarHBondContact O-N 2.76Å; K769-L773 HydrophobicContact CG-CD1 4.45Å; K769-L773 WeakPolarHBondContact O-CG 3.5Å; K769-L773 PolarHBondContact O-N 3.49Å
770	I	75.9	Confident	75.6	Confident	17 Å²	17	74 Å²	74	9%	0.087	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-40.5	172	-69.9	161.1	0	0	0	110.7	L622 L625 H629 L766 R767 M768 E772 L773 N774	L622-I770 HydrophobicContact CD1-CG2 4.26Å; L625-I770 HydrophobicContact CB-CG1 4.24Å; H629-I770 HydrophobicContact CB-CD1 3.44Å; H629-I770 VanDerWaalsContact CB-CD1 3.44Å; L766-I770 WeakPolarHBondContact O-CB 3.26Å; L766-I770 WeakPolarHBondContact O-CD1 3.31Å; L766-I770 VanDerWaalsContact O-CG1 3.29Å; L766-I770 WeakPolarHBondContact O-CG1 3.49Å; L766-I770 PolarHBondContact O-N 2.99Å; R767-I770 PolarHBondContact O-N 2.95Å; M768-I770 PolarHBondContact O-N 2.96Å; I770-E772 VanDerWaalsContact C-N 3.34Å; I770-E772 PolarHBondContact O-N 2.96Å; I770-L773 PolarHBondContact O-N 3.44Å; I770-N774 VanDerWaalsContact O-CB 3.26Å; I770-N774 WeakPolarHBondContact O-CB 3.35Å; I770-N774 PolarHBondContact O-N 3.45Å
771	S	78.4	Confident	74.6	Confident	76 Å²	76	75.8 Å²	75.8	53%	0.531	39%	0.392	S	S	.	.	H	α-helix	trans	-64.8	-37.1	176.9	-166.3	0	0	0	0	112.7	R767 M768 S775	R767-S771 WeakPolarHBondContact O-CB 3.3Å; R767-S771 PolarHBondContact O-N 3.08Å; M768-S771 WeakPolarHBondContact O-CB 3.41Å; M768-S771 PolarHBondContact O-N 2.83Å; M768-S771 VanDerWaalsContact O-N 3.15Å; S771-S775 PolarHBondContact O-N 2.81Å; S771-S775 VanDerWaalsContact O-N 3.15Å
772	E	80.8	Confident	73.8	Confident	126 Å²	126	81.8 Å²	81.8	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-70.1	-43.9	176.9	-171.8	171.3	-171.1	0	0	111.7	M768 K769 I770 S775 Q776	M768-E772 PolarHBondContact O-N 3.11Å; K769-E772 PolarHBondContact O-N 2.76Å; I770-E772 VanDerWaalsContact C-N 3.34Å; I770-E772 PolarHBondContact O-N 2.96Å; E772-S775 PolarHBondContact O-N 2.81Å; E772-Q776 WeakPolarHBondContact O-CG 3.3Å; E772-Q776 PolarHBondContact O-N 2.85Å
773	L	75	Confident	72.8	Confident	17 Å²	17	81.7 Å²	81.7	9%	0.089	41%	0.407	C	S	.	.	H	α-helix	trans	-65.7	-40.9	174.6	-73.2	169.5	0	0	0	112.4	L622 L625 K769 I770 S775 Q776 V777	L622-L773 HydrophobicContact CD1-CB 3.91Å; L622-L773 HydrophobicContact CD1-CD1 4.46Å; L625-L773 HydrophobicContact CD1-CD1 3.54Å; K769-L773 HydrophobicContact CG-CD1 4.45Å; K769-L773 WeakPolarHBondContact O-CG 3.5Å; K769-L773 PolarHBondContact O-N 3.49Å; I770-L773 PolarHBondContact O-N 3.44Å; L773-S775 VanDerWaalsContact C-N 3.32Å; L773-S775 PolarHBondContact O-N 3.3Å; L773-Q776 WeakPolarHBondContact O-CB 3.35Å; L773-Q776 PolarHBondContact O-N 3.49Å; L773-Q776 VanDerWaalsContact O-N 3.16Å; L773-V777 WeakPolarHBondContact O-CG2 3.21Å; L773-V777 PolarHBondContact O-N 2.86Å
774	N	73	Confident	71.8	Confident	73 Å²	73	82.5 Å²	82.5	39%	0.39	41%	0.409	S	S	.	.	H	α-helix	trans	-59.1	-42.2	174.5	-79.7	-12.3	0	0	0	111.6	I770 Q776 V777 E778	I770-N774 VanDerWaalsContact O-CB 3.26Å; I770-N774 WeakPolarHBondContact O-CB 3.35Å; I770-N774 PolarHBondContact O-N 3.45Å; N774-Q776 VanDerWaalsContact C-N 3.3Å; N774-Q776 PolarHBondContact O-N 3.18Å; N774-V777 PolarHBondContact O-N 3.25Å; N774-E778 PolarHBondContact O-N 3.25Å
775	S	76.1	Confident	70.7	Confident	49 Å²	49	81.6 Å²	81.6	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-32.6	177.3	-168.9	0	0	0	0	112.7	S771 E772 L773 Q779	S771-S775 PolarHBondContact O-N 2.81Å; S771-S775 VanDerWaalsContact O-N 3.15Å; E772-S775 PolarHBondContact O-N 2.81Å; L773-S775 VanDerWaalsContact C-N 3.32Å; L773-S775 PolarHBondContact O-N 3.3Å; S775-Q779 WeakPolarHBondContact O-CB 3.28Å; S775-Q779 VanDerWaalsContact O-CG 3.29Å; S775-Q779 WeakPolarHBondContact O-CG 3.28Å; S775-Q779 PolarHBondContact O-N 2.95Å; S775-Q779 VanDerWaalsContact O-N 3.16Å; S775-Q779 PolarHBondContact O-NE2 2.95Å
776	Q	75.3	Confident	69.7	Low	88 Å²	88	83.5 Å²	83.5	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-68.8	-40	171.9	-66.2	174	30.7	0	0	111.5	E772 L773 N774 Q779 E780	E772-Q776 WeakPolarHBondContact O-CG 3.3Å; E772-Q776 PolarHBondContact O-N 2.85Å; L773-Q776 WeakPolarHBondContact O-CB 3.35Å; L773-Q776 PolarHBondContact O-N 3.49Å; L773-Q776 VanDerWaalsContact O-N 3.16Å; N774-Q776 VanDerWaalsContact C-N 3.3Å; N774-Q776 PolarHBondContact O-N 3.18Å; Q776-Q779 PolarHBondContact O-N 2.92Å; Q776-E780 PolarHBondContact O-N 3.41Å
777	V	69.2	Low	68.6	Low	39 Å²	39	83.1 Å²	83.1	24%	0.236	41%	0.41	C	S	.	.	H	α-helix	trans	-68.9	-39.6	176.4	171.1	0	0	0	0	112.4	L622 L773 N774 E780 M781	L622-V777 HydrophobicContact CD2-CB 4.47Å; L622-V777 HydrophobicContact CD2-CG2 3.79Å; L773-V777 WeakPolarHBondContact O-CG2 3.21Å; L773-V777 PolarHBondContact O-N 2.86Å; N774-V777 PolarHBondContact O-N 3.25Å; V777-E780 PolarHBondContact O-N 2.95Å; V777-M781 WeakPolarHBondContact O-CB 3.24Å; V777-M781 PolarHBondContact O-N 2.97Å
778	E	70.4	Confident	67.3	Low	132 Å²	132	81.3 Å²	81.3	62%	0.617	41%	0.407	S	S	*	.	H	α-helix	trans	-60.8	-44.6	173.2	-76.7	-176.7	142.5	0	0	111.6	N774 E780 M781 E782	N774-E778 PolarHBondContact O-N 3.25Å; E778-E780 PolarHBondContact O-N 2.89Å; E778-M781 PolarHBondContact O-N 3.08Å; E778-M781 VanDerWaalsContact O-N 3.14Å; E778-E782 PolarHBondContact O-N 3.44Å
779	Q	70.4	Confident	66.4	Low	113 Å²	113	76.8 Å²	76.8	53%	0.528	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-26	177.3	-76.2	176.7	47.8	0	0	113.4	S775 Q776 K783	S775-Q779 WeakPolarHBondContact O-CB 3.28Å; S775-Q779 VanDerWaalsContact O-CG 3.29Å; S775-Q779 WeakPolarHBondContact O-CG 3.28Å; S775-Q779 PolarHBondContact O-N 2.95Å; S775-Q779 VanDerWaalsContact O-N 3.16Å; S775-Q779 PolarHBondContact O-NE2 2.95Å; Q776-Q779 PolarHBondContact O-N 2.92Å; Q779-K783 WeakPolarHBondContact O-CD 3.37Å; Q779-K783 WeakPolarHBondContact O-CE 3.28Å; Q779-K783 WeakPolarHBondContact O-CG 3.4Å
780	E	59.8	Low	65.3	Low	64 Å²	64	77.2 Å²	77.2	30%	0.299	40%	0.398	S	S	.	.	H	α-helix	trans	-80.5	-44.7	168.4	-66.4	-50.4	132.6	0	0	111.5	S421 Q776 V777 E778 E782 K783 R784	S421-E780 WeakPolarHBondContact CB-O 3.14Å; S421-E780 WeakPolarHBondContact CB-OE2 3.31Å; S421-E780 PolarHBondContact OG-OE2 3.08Å; Q776-E780 PolarHBondContact O-N 3.41Å; V777-E780 PolarHBondContact O-N 2.95Å; E778-E780 PolarHBondContact O-N 2.89Å; E780-E782 PolarHBondContact O-N 3.39Å; E780-K783 VanDerWaalsContact CD-NZ 3.28Å; E780-K783 WeakPolarHBondContact O-CB 3.42Å; E780-K783 PolarHBondContact O-N 3.38Å; E780-K783 IonicContact OE1-NZ 3.59Å; E780-K783 PolarHBondContact OE1-NZ 3.36Å; E780-K783 IonicContact OE2-NZ 3.34Å; E780-K783 PolarHBondContact OE2-NZ 3Å; E780-R784 PolarHBondContact O-N 3.47Å
781	M	57.4	Low	64.1	Low	95 Å²	95	81.4 Å²	81.4	47%	0.468	42%	0.42	S	S	.	.	H	α-helix	trans	-57.9	-40.9	-179.9	-97.9	-164	168.2	0	0	113.9	V777 E778 K783 R784 N785	V777-M781 WeakPolarHBondContact O-CB 3.24Å; V777-M781 PolarHBondContact O-N 2.97Å; E778-M781 PolarHBondContact O-N 3.08Å; E778-M781 VanDerWaalsContact O-N 3.14Å; M781-K783 PolarHBondContact O-N 2.96Å; M781-R784 WeakPolarHBondContact O-CB 3.33Å; M781-R784 PolarHBondContact O-N 3.08Å; M781-N785 PolarHBondContact O-ND2 2.89Å
782	E	63	Low	63.5	Low	160 Å²	160	81 Å²	81	75%	0.748	42%	0.417	S	S	*	.	H	α-helix	trans	-58.2	-36.9	176	-76	-158.4	135.9	0	0	111.8	E778 E780 R784	E778-E782 PolarHBondContact O-N 3.44Å; E780-E782 PolarHBondContact O-N 3.39Å; E782-R784 PolarHBondContact O-N 3.24Å
783	K	57.5	Low	62.8	Low	74 Å²	74	80 Å²	80	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-69	-19.2	179.1	-55	166.3	-172.3	164.8	0	112.6	D422 Q779 E780 M781	D422-K783 WeakPolarHBondContact CB-O 2.87Å; D422-K783 PolarHBondContact N-O 3.1Å; Q779-K783 WeakPolarHBondContact O-CD 3.37Å; Q779-K783 WeakPolarHBondContact O-CE 3.28Å; Q779-K783 WeakPolarHBondContact O-CG 3.4Å; E780-K783 VanDerWaalsContact CD-NZ 3.28Å; E780-K783 WeakPolarHBondContact O-CB 3.42Å; E780-K783 PolarHBondContact O-N 3.38Å; E780-K783 IonicContact OE1-NZ 3.59Å; E780-K783 PolarHBondContact OE1-NZ 3.36Å; E780-K783 IonicContact OE2-NZ 3.34Å; E780-K783 PolarHBondContact OE2-NZ 3Å; M781-K783 PolarHBondContact O-N 2.96Å
784	R	52.9	Low	61.8	Low	23 Å²	23	81.3 Å²	81.3	9%	0.087	43%	0.433	C	S	.	.	H	α-helix	trans	-61.6	-54.9	175.6	175.2	167.3	178.2	91	-11.3	111.5	H420 E780 M781 E782 L786 V787 E788	H420-R784 PolarHBondContact CD2-NH1 3.28Å; H420-R784 PolarHBondContact CE1-NH1 3.08Å; H420-R784 PolarHBondContact ND1-NH1 3.29Å; H420-R784 PolarHBondContact NE2-NH1 3.43Å; H420-R784 VanDerWaalsContact NE2-NH1 3.12Å; H420-R784 WeakPolarHBondContact O-CB 3.21Å; E780-R784 PolarHBondContact O-N 3.47Å; M781-R784 WeakPolarHBondContact O-CB 3.33Å; M781-R784 PolarHBondContact O-N 3.08Å; E782-R784 PolarHBondContact O-N 3.24Å; R784-L786 PolarHBondContact O-N 2.69Å; R784-V787 PolarHBondContact O-N 2.86Å; R784-V787 VanDerWaalsContact O-N 3.12Å; R784-E788 IonicContact CZ-OE1 3.61Å; R784-E788 IonicContact CZ-OE2 3.44Å; R784-E788 IonicContact NE-OE1 3.27Å; R784-E788 IonicContact NE-OE2 2.73Å; R784-E788 PolarHBondContact NE-OE2 2.97Å; R784-E788 IonicContact NH2-OE1 2.7Å; R784-E788 PolarHBondContact NH2-OE1 3.36Å; R784-E788 IonicContact NH2-OE2 3.57Å; R784-E788 PolarHBondContact NH2-OE2 3.28Å; R784-E788 VanDerWaalsContact NH2-OE2 3.14Å; R784-E788 PolarHBondContact O-N 3.13Å
785	N	56	Low	61.2	Low	105 Å²	105	80.1 Å²	80.1	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-69.4	-16.1	-151.9	-60.7	-38.8	0	0	0	112	M781	M781-N785 PolarHBondContact O-ND2 2.89Å
786	L	58.7	Low	61	Low	120 Å²	120	82.1 Å²	82.1	63%	0.628	44%	0.437	S	S	*	.	H	α-helix	trans	-67.5	-55.5	173.3	-155.2	70.7	0	0	0	112.1	R784 G789 E790	R784-L786 PolarHBondContact O-N 2.69Å; L786-G789 PolarHBondContact O-N 3.45Å; L786-G789 VanDerWaalsContact O-N 3.16Å; L786-E790 PolarHBondContact O-N 2.91Å
787	V	52.6	Low	60.5	Low	23 Å²	23	80.6 Å²	80.6	14%	0.139	44%	0.44	C	S	.	.	H	α-helix	trans	-77	-24.1	-177.5	170.1	0	0	0	0	112.5	D422 R784 G789 E790 L791	D422-V787 HydrophobicContact CB-CB 3.54Å; D422-V787 HydrophobicContact CB-CG1 4.31Å; D422-V787 HydrophobicContact CB-CG2 3.53Å; D422-V787 VanDerWaalsContact CG-CB 3.4Å; R784-V787 PolarHBondContact O-N 2.86Å; R784-V787 VanDerWaalsContact O-N 3.12Å; V787-G789 PolarHBondContact O-N 2.91Å; V787-E790 PolarHBondContact O-N 3.44Å; V787-L791 VanDerWaalsContact O-CB 3.24Å; V787-L791 WeakPolarHBondContact O-CB 3.4Å; V787-L791 PolarHBondContact O-N 3.04Å
788	E	51	Low	60.3	Low	87 Å²	87	83.2 Å²	83.2	41%	0.407	45%	0.452	S	S	.	.	H	α-helix	trans	-62.6	-25.4	169.6	-167.1	156	-141.4	0	0	111.7	R784 S792	R784-E788 IonicContact CZ-OE1 3.61Å; R784-E788 IonicContact CZ-OE2 3.44Å; R784-E788 IonicContact NE-OE1 3.27Å; R784-E788 IonicContact NE-OE2 2.73Å; R784-E788 PolarHBondContact NE-OE2 2.97Å; R784-E788 IonicContact NH2-OE1 2.7Å; R784-E788 PolarHBondContact NH2-OE1 3.36Å; R784-E788 IonicContact NH2-OE2 3.57Å; R784-E788 PolarHBondContact NH2-OE2 3.28Å; R784-E788 VanDerWaalsContact NH2-OE2 3.14Å; R784-E788 PolarHBondContact O-N 3.13Å; E788-S792 PolarHBondContact O-N 2.89Å
789	G	61.1	Low	60.3	Low	40 Å²	40	82.4 Å²	82.4	41%	0.412	45%	0.446	S	S	.	.	H	α-helix	trans	-71.6	-45.4	166.1	0	0	0	0	0	113.8	L786 V787 S792 V793	L786-G789 PolarHBondContact O-N 3.45Å; L786-G789 VanDerWaalsContact O-N 3.16Å; V787-G789 PolarHBondContact O-N 2.91Å; G789-S792 VanDerWaalsContact O-CB 3.24Å; G789-S792 WeakPolarHBondContact O-CB 3.44Å; G789-S792 PolarHBondContact O-N 3.31Å; G789-V793 PolarHBondContact O-N 3.32Å
790	E	56.4	Low	60.4	Low	100 Å²	100	79.8 Å²	79.8	47%	0.467	44%	0.444	S	S	.	.	H	α-helix	trans	-67.9	-37.8	179.8	-61.9	-177	155	0	0	112.2	L786 V787 S792 V793 A794	L786-E790 PolarHBondContact O-N 2.91Å; V787-E790 PolarHBondContact O-N 3.44Å; E790-S792 PolarHBondContact O-N 3.15Å; E790-V793 WeakPolarHBondContact O-CB 3.3Å; E790-V793 PolarHBondContact O-N 3.16Å; E790-A794 PolarHBondContact O-N 3.27Å
791	L	52.2	Low	60.8	Low	106 Å²	106	82.2 Å²	82.2	56%	0.555	46%	0.457	S	S	*	.	H	α-helix	trans	-59.9	-30.9	172.1	-169.3	74.2	0	0	0	111.7	V787 S795	V787-L791 VanDerWaalsContact O-CB 3.24Å; V787-L791 WeakPolarHBondContact O-CB 3.4Å; V787-L791 PolarHBondContact O-N 3.04Å; L791-S795 VanDerWaalsContact O-CB 3.24Å; L791-S795 WeakPolarHBondContact O-CB 3.43Å; L791-S795 PolarHBondContact O-N 3.17Å
792	S	64.7	Low	61.4	Low	66 Å²	66	83.5 Å²	83.5	46%	0.462	46%	0.46	S	S	.	.	H	α-helix	trans	-67.4	-43.8	173.2	-164.8	0	0	0	0	111.6	E788 G789 E790 S795 D796	E788-S792 PolarHBondContact O-N 2.89Å; G789-S792 VanDerWaalsContact O-CB 3.24Å; G789-S792 WeakPolarHBondContact O-CB 3.44Å; G789-S792 PolarHBondContact O-N 3.31Å; E790-S792 PolarHBondContact O-N 3.15Å; S792-S795 VanDerWaalsContact O-CB 3.31Å; S792-S795 WeakPolarHBondContact O-CB 3.31Å; S792-S795 PolarHBondContact O-N 3.41Å; S792-D796 PolarHBondContact O-N 2.87Å
793	V	67.3	Low	61.9	Low	107 Å²	107	82.2 Å²	82.2	65%	0.648	45%	0.452	S	S	*	.	H	α-helix	trans	-65.4	-42.2	175	-177.2	0	0	0	0	110.9	G789 E790 S795 D796 A797	G789-V793 PolarHBondContact O-N 3.32Å; E790-V793 WeakPolarHBondContact O-CB 3.3Å; E790-V793 PolarHBondContact O-N 3.16Å; V793-S795 VanDerWaalsContact C-N 3.3Å; V793-S795 PolarHBondContact O-N 3.45Å; V793-D796 PolarHBondContact O-N 3.23Å; V793-A797 PolarHBondContact O-N 3.05Å
794	A	53.5	Low	62.8	Low	44 Å²	44	85.1 Å²	85.1	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-35.8	172.5	0	0	0	0	0	112	E790 A797 L798	E790-A794 PolarHBondContact O-N 3.27Å; A794-A797 PolarHBondContact O-N 3.25Å; A794-L798 VanDerWaalsContact O-CB 3.3Å; A794-L798 WeakPolarHBondContact O-CB 3.42Å; A794-L798 PolarHBondContact O-N 2.88Å
795	S	60.9	Low	63.6	Low	47 Å²	47	88.3 Å²	88.3	33%	0.329	48%	0.48	S	S	.	.	H	α-helix	trans	-65.1	-40	174	-169	0	0	0	0	112.1	L791 S792 V793 L798 K799	L791-S795 VanDerWaalsContact O-CB 3.24Å; L791-S795 WeakPolarHBondContact O-CB 3.43Å; L791-S795 PolarHBondContact O-N 3.17Å; S792-S795 VanDerWaalsContact O-CB 3.31Å; S792-S795 WeakPolarHBondContact O-CB 3.31Å; S792-S795 PolarHBondContact O-N 3.41Å; V793-S795 VanDerWaalsContact C-N 3.3Å; V793-S795 PolarHBondContact O-N 3.45Å; S795-L798 PolarHBondContact O-N 3.24Å; S795-K799 WeakPolarHBondContact O-CE 3.24Å; S795-K799 VanDerWaalsContact O-CG 3.24Å; S795-K799 WeakPolarHBondContact O-CG 3.44Å; S795-K799 PolarHBondContact O-N 3.49Å; S795-K799 VanDerWaalsContact OG-CE 3.22Å; S795-K799 WeakPolarHBondContact OG-CE 3.49Å; S795-K799 PolarHBondContact OG-NZ 3.13Å
796	D	70.2	Confident	64.4	Low	92 Å²	92	85.4 Å²	85.4	49%	0.492	47%	0.468	S	S	.	.	H	α-helix	trans	-70.6	-36.8	174.7	-78.7	-16.3	0	0	0	112.5	S792 V793 L798 K799 A800	S792-D796 PolarHBondContact O-N 2.87Å; V793-D796 PolarHBondContact O-N 3.23Å; D796-L798 VanDerWaalsContact C-N 3.35Å; D796-K799 PolarHBondContact O-N 3.3Å; D796-K799 WeakPolarHBondContact OD1-CD 3.47Å; D796-K799 WeakPolarHBondContact OD1-CE 3.41Å; D796-K799 IonicContact OD1-NZ 3.31Å; D796-K799 PolarHBondContact OD1-NZ 2.76Å; D796-A800 PolarHBondContact O-N 3.22Å
797	A	66.6	Low	65.2	Low	56 Å²	56	82.8 Å²	82.8	46%	0.463	46%	0.455	S	S	.	.	H	α-helix	trans	-61.9	-41.8	168.7	0	0	0	0	0	111.7	V793 A794 K799 A800 M801	V793-A797 PolarHBondContact O-N 3.05Å; A794-A797 PolarHBondContact O-N 3.25Å; A797-K799 PolarHBondContact O-N 2.71Å; A797-A800 WeakPolarHBondContact O-CB 3.33Å; A797-A800 PolarHBondContact O-N 3.04Å; A797-M801 WeakPolarHBondContact O-CG 3.39Å; A797-M801 PolarHBondContact O-N 3.48Å
798	L	64.4	Low	66.2	Low	94 Å²	94	86.3 Å²	86.3	49%	0.492	47%	0.472	S	S	.	.	H	α-helix	trans	-64.8	-37.4	175.3	-169.2	73.9	0	0	0	111.7	A794 S795 D796 M801 K802	A794-L798 VanDerWaalsContact O-CB 3.3Å; A794-L798 WeakPolarHBondContact O-CB 3.42Å; A794-L798 PolarHBondContact O-N 2.88Å; S795-L798 PolarHBondContact O-N 3.24Å; D796-L798 VanDerWaalsContact C-N 3.35Å; L798-M801 PolarHBondContact O-N 3.34Å; L798-K802 WeakPolarHBondContact O-CB 3.48Å; L798-K802 WeakPolarHBondContact O-CG 3.47Å; L798-K802 PolarHBondContact O-N 3.33Å
799	K	70.2	Confident	67.3	Low	114 Å²	114	87.2 Å²	87.2	50%	0.496	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-42.1	172.1	-70.2	161.1	-145.2	160	0	111.2	S795 D796 A797 K802 F803	S795-K799 WeakPolarHBondContact O-CE 3.24Å; S795-K799 VanDerWaalsContact O-CG 3.24Å; S795-K799 WeakPolarHBondContact O-CG 3.44Å; S795-K799 PolarHBondContact O-N 3.49Å; S795-K799 VanDerWaalsContact OG-CE 3.22Å; S795-K799 WeakPolarHBondContact OG-CE 3.49Å; S795-K799 PolarHBondContact OG-NZ 3.13Å; D796-K799 PolarHBondContact O-N 3.3Å; D796-K799 WeakPolarHBondContact OD1-CD 3.47Å; D796-K799 WeakPolarHBondContact OD1-CE 3.41Å; D796-K799 IonicContact OD1-NZ 3.31Å; D796-K799 PolarHBondContact OD1-NZ 2.76Å; A797-K799 PolarHBondContact O-N 2.71Å; K799-K802 PolarHBondContact O-N 2.96Å; K799-F803 PolarHBondContact O-N 3.42Å
800	A	71.3	Confident	68	Low	59 Å²	59	90.7 Å²	90.7	49%	0.488	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-38.2	175.1	0	0	0	0	0	112.5	D796 A797 F803 K804	D796-A800 PolarHBondContact O-N 3.22Å; A797-A800 WeakPolarHBondContact O-CB 3.33Å; A797-A800 PolarHBondContact O-N 3.04Å; A800-F803 WeakPolarHBondContact O-CB 3.41Å; A800-F803 PolarHBondContact O-N 3.24Å; A800-K804 PolarHBondContact O-N 2.99Å
801	M	69.8	Low	69	Low	114 Å²	114	91.5 Å²	91.5	56%	0.562	48%	0.484	S	S	*	.	H	α-helix	trans	-69.7	-41.1	174.5	-69.7	-65.1	-81.7	0	0	111.8	A797 L798 F803 K804 E805	A797-M801 WeakPolarHBondContact O-CG 3.39Å; A797-M801 PolarHBondContact O-N 3.48Å; L798-M801 PolarHBondContact O-N 3.34Å; M801-F803 VanDerWaalsContact C-N 3.25Å; M801-F803 PolarHBondContact O-N 3.29Å; M801-K804 CarbonylContact O-C 3.58Å; M801-K804 WeakPolarHBondContact O-CB 3.08Å; M801-K804 PolarHBondContact O-N 2.92Å; M801-K804 VanDerWaalsContact O-N 3.12Å; M801-K804 HydrophobicContact SD-CD 4.13Å; M801-E805 WeakPolarHBondContact O-CB 3.4Å; M801-E805 PolarHBondContact O-N 3.29Å
802	K	69.6	Low	69.9	Low	122 Å²	122	90.4 Å²	90.4	53%	0.53	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-26.6	171.2	-74	-173.8	175.2	-172.3	0	113.1	L798 K799 S806	L798-K802 WeakPolarHBondContact O-CB 3.48Å; L798-K802 WeakPolarHBondContact O-CG 3.47Å; L798-K802 PolarHBondContact O-N 3.33Å; K799-K802 PolarHBondContact O-N 2.96Å; K802-S806 VanDerWaalsContact O-CB 3.32Å; K802-S806 WeakPolarHBondContact O-CB 3.48Å; K802-S806 PolarHBondContact O-N 3.34Å
803	F	74.3	Confident	70.4	Confident	134 Å²	134	90 Å²	90	59%	0.588	48%	0.478	S	S	*	.	H	α-helix	trans	-71.6	-40.9	169.9	-173.6	-96.5	0	0	0	112.4	K799 A800 M801 S806 N807	K799-F803 PolarHBondContact O-N 3.42Å; A800-F803 WeakPolarHBondContact O-CB 3.41Å; A800-F803 PolarHBondContact O-N 3.24Å; M801-F803 VanDerWaalsContact C-N 3.25Å; M801-F803 PolarHBondContact O-N 3.29Å; F803-S806 PolarHBondContact O-N 2.87Å; F803-N807 WeakPolarHBondContact CE1-ND2 3.29Å; F803-N807 PolarHBondContact O-N 3.34Å; F803-N807 VanDerWaalsContact O-N 3.17Å; F803-N807 PolarHBondContact O-ND2 3.19Å
804	K	75.5	Confident	71	Confident	134 Å²	134	90 Å²	90	58%	0.583	47%	0.471	S	S	*	.	H	α-helix	trans	-60.9	-47.4	168.6	-83.5	-176.6	174.9	178.2	0	111.4	A800 M801 S806 N807 L808	A800-K804 PolarHBondContact O-N 2.99Å; M801-K804 CarbonylContact O-C 3.58Å; M801-K804 WeakPolarHBondContact O-CB 3.08Å; M801-K804 PolarHBondContact O-N 2.92Å; M801-K804 VanDerWaalsContact O-N 3.12Å; M801-K804 HydrophobicContact SD-CD 4.13Å; K804-S806 PolarHBondContact O-N 3.22Å; K804-N807 CarbonylContact O-C 3.51Å; K804-N807 WeakPolarHBondContact O-CA 3.25Å; K804-N807 PolarHBondContact O-N 2.81Å; K804-L808 PolarHBondContact O-N 3.43Å
805	E	69.1	Low	72	Confident	91 Å²	91	92.4 Å²	92.4	43%	0.425	48%	0.477	S	S	.	.	H	α-helix	trans	-56.7	-47.4	177.2	-163.6	-147.7	148.2	0	0	110.6	M801 N807 L808 Q809	M801-E805 WeakPolarHBondContact O-CB 3.4Å; M801-E805 PolarHBondContact O-N 3.29Å; E805-N807 VanDerWaalsContact C-N 3.25Å; E805-N807 PolarHBondContact O-N 3.45Å; E805-L808 CarbonylContact O-C 3.57Å; E805-L808 PolarHBondContact O-N 2.71Å; E805-L808 VanDerWaalsContact O-N 3.17Å; E805-Q809 WeakPolarHBondContact O-CB 3.17Å; E805-Q809 VanDerWaalsContact O-CG 3.31Å; E805-Q809 WeakPolarHBondContact O-CG 3.21Å; E805-Q809 PolarHBondContact O-N 3.31Å; E805-Q809 PolarHBondContact OE1-NE2 2.99Å
806	S	73.5	Confident	72.7	Confident	43 Å²	43	96.9 Å²	96.9	30%	0.301	49%	0.491	S	S	.	.	H	α-helix	trans	-58.3	-34.7	174.6	-176.7	0	0	0	0	113	K802 F803 K804 K810	K802-S806 VanDerWaalsContact O-CB 3.32Å; K802-S806 WeakPolarHBondContact O-CB 3.48Å; K802-S806 PolarHBondContact O-N 3.34Å; F803-S806 PolarHBondContact O-N 2.87Å; K804-S806 PolarHBondContact O-N 3.22Å; S806-K810 WeakPolarHBondContact O-CD 3.31Å; S806-K810 VanDerWaalsContact O-CE 3.23Å; S806-K810 WeakPolarHBondContact O-CE 3.47Å; S806-K810 VanDerWaalsContact O-CG 3.25Å; S806-K810 WeakPolarHBondContact O-CG 3.49Å; S806-K810 PolarHBondContact O-N 2.75Å; S806-K810 WeakPolarHBondContact OG-CE 3.1Å; S806-K810 PolarHBondContact OG-NZ 3.3Å
807	N	75.9	Confident	73.1	Confident	66 Å²	66	96.5 Å²	96.5	35%	0.353	49%	0.486	S	S	.	.	H	α-helix	trans	-76	-40.1	175.6	-68.8	-24.7	0	0	0	112.2	F803 K804 E805 Q809 K810 E811	F803-N807 WeakPolarHBondContact CE1-ND2 3.29Å; F803-N807 PolarHBondContact O-N 3.34Å; F803-N807 VanDerWaalsContact O-N 3.17Å; F803-N807 PolarHBondContact O-ND2 3.19Å; K804-N807 CarbonylContact O-C 3.51Å; K804-N807 WeakPolarHBondContact O-CA 3.25Å; K804-N807 PolarHBondContact O-N 2.81Å; E805-N807 VanDerWaalsContact C-N 3.25Å; E805-N807 PolarHBondContact O-N 3.45Å; N807-Q809 VanDerWaalsContact C-N 3.33Å; N807-Q809 PolarHBondContact O-N 2.95Å; N807-K810 WeakPolarHBondContact O-CB 3.41Å; N807-K810 PolarHBondContact O-N 2.99Å; N807-K810 PolarHBondContact OD1-NZ 3.17Å; N807-E811 PolarHBondContact O-N 3.48Å
808	L	73.1	Confident	73.7	Confident	96 Å²	96	99.1 Å²	99.1	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-64.8	-35.8	171.9	-70	171.4	0	0	0	111.8	K804 E805 K810 E811 I812	K804-L808 PolarHBondContact O-N 3.43Å; E805-L808 CarbonylContact O-C 3.57Å; E805-L808 PolarHBondContact O-N 2.71Å; E805-L808 VanDerWaalsContact O-N 3.17Å; L808-K810 VanDerWaalsContact C-N 3.35Å; L808-K810 PolarHBondContact O-N 3.2Å; L808-E811 PolarHBondContact O-N 3.42Å; L808-I812 VanDerWaalsContact O-CB 3.28Å; L808-I812 WeakPolarHBondContact O-CB 3.4Å; L808-I812 WeakPolarHBondContact O-CD1 3.44Å; L808-I812 WeakPolarHBondContact O-CG1 3.21Å; L808-I812 PolarHBondContact O-N 3.28Å
809	Q	72.8	Confident	74.1	Confident	106 Å²	106	98 Å²	98	50%	0.495	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-38.1	172.2	-75.3	-175.6	8.3	0	0	111.6	E805 N807 A813	E805-Q809 WeakPolarHBondContact O-CB 3.17Å; E805-Q809 VanDerWaalsContact O-CG 3.31Å; E805-Q809 WeakPolarHBondContact O-CG 3.21Å; E805-Q809 PolarHBondContact O-N 3.31Å; E805-Q809 PolarHBondContact OE1-NE2 2.99Å; N807-Q809 VanDerWaalsContact C-N 3.33Å; N807-Q809 PolarHBondContact O-N 2.95Å; Q809-A813 VanDerWaalsContact O-CB 3.23Å; Q809-A813 WeakPolarHBondContact O-CB 3.41Å; Q809-A813 PolarHBondContact O-N 3.43Å
810	K	77.5	Confident	74.3	Confident	113 Å²	113	95.7 Å²	95.7	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-66.8	-40.8	172.4	-67.5	159.7	-153	158.6	0	111.5	S806 N807 L808 A813 H814	S806-K810 WeakPolarHBondContact O-CD 3.31Å; S806-K810 VanDerWaalsContact O-CE 3.23Å; S806-K810 WeakPolarHBondContact O-CE 3.47Å; S806-K810 VanDerWaalsContact O-CG 3.25Å; S806-K810 WeakPolarHBondContact O-CG 3.49Å; S806-K810 PolarHBondContact O-N 2.75Å; S806-K810 WeakPolarHBondContact OG-CE 3.1Å; S806-K810 PolarHBondContact OG-NZ 3.3Å; N807-K810 WeakPolarHBondContact O-CB 3.41Å; N807-K810 PolarHBondContact O-N 2.99Å; N807-K810 PolarHBondContact OD1-NZ 3.17Å; L808-K810 VanDerWaalsContact C-N 3.35Å; L808-K810 PolarHBondContact O-N 3.2Å; K810-A813 WeakPolarHBondContact O-CB 3.38Å; K810-A813 PolarHBondContact O-N 3.06Å; K810-H814 WeakPolarHBondContact O-CB 3.14Å; K810-H814 PolarHBondContact O-N 3.39Å
811	E	76.1	Confident	74.6	Confident	117 Å²	117	98 Å²	98	55%	0.547	48%	0.483	S	S	.	.	H	α-helix	trans	-68.3	-42.1	178.3	-164.9	160.5	-135.4	0	0	111.4	N807 L808 A813 H814 L815	N807-E811 PolarHBondContact O-N 3.48Å; L808-E811 PolarHBondContact O-N 3.42Å; E811-A813 VanDerWaalsContact C-N 3.33Å; E811-A813 PolarHBondContact O-N 3.13Å; E811-H814 PolarHBondContact O-N 3.15Å; E811-L815 WeakPolarHBondContact O-CB 3.4Å; E811-L815 VanDerWaalsContact O-CG 3.31Å; E811-L815 WeakPolarHBondContact O-CG 3.46Å; E811-L815 PolarHBondContact O-N 3.07Å
812	I	71.6	Confident	74.9	Confident	84 Å²	84	97.7 Å²	97.7	43%	0.431	48%	0.482	S	S	.	.	H	α-helix	trans	-62.7	-37.2	169.4	-70.7	165.2	0	0	0	111.1	L808 K816	L808-I812 VanDerWaalsContact O-CB 3.28Å; L808-I812 WeakPolarHBondContact O-CB 3.4Å; L808-I812 WeakPolarHBondContact O-CD1 3.44Å; L808-I812 WeakPolarHBondContact O-CG1 3.21Å; L808-I812 PolarHBondContact O-N 3.28Å; I812-K816 HydrophobicContact CG2-CD 3.98Å; I812-K816 HydrophobicContact CG2-CG 4.4Å; I812-K816 VanDerWaalsContact O-CB 3.27Å; I812-K816 WeakPolarHBondContact O-CB 3.32Å; I812-K816 WeakPolarHBondContact O-CG 3.42Å; I812-K816 PolarHBondContact O-N 3Å
813	A	75.4	Confident	74.9	Confident	56 Å²	56	97.6 Å²	97.6	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-67.5	-40.7	174.8	0	0	0	0	0	111.7	Q809 K810 E811 K816 Q817	Q809-A813 VanDerWaalsContact O-CB 3.23Å; Q809-A813 WeakPolarHBondContact O-CB 3.41Å; Q809-A813 PolarHBondContact O-N 3.43Å; K810-A813 WeakPolarHBondContact O-CB 3.38Å; K810-A813 PolarHBondContact O-N 3.06Å; E811-A813 VanDerWaalsContact C-N 3.33Å; E811-A813 PolarHBondContact O-N 3.13Å; A813-K816 PolarHBondContact O-N 2.96Å; A813-Q817 WeakPolarHBondContact O-CB 3.49Å; A813-Q817 PolarHBondContact O-N 3.29Å
814	H	80.3	Confident	75.1	Confident	107 Å²	107	96.3 Å²	96.3	50%	0.495	48%	0.483	S	S	.	.	H	α-helix	trans	-66.6	-41.5	174.1	-176.4	56.7	0	0	0	111.9	K810 E811 Q817 K818	K810-H814 WeakPolarHBondContact O-CB 3.14Å; K810-H814 PolarHBondContact O-N 3.39Å; E811-H814 PolarHBondContact O-N 3.15Å; H814-Q817 WeakPolarHBondContact O-CB 3.39Å; H814-Q817 PolarHBondContact O-N 3.17Å; H814-K818 WeakPolarHBondContact O-CB 3.41Å; H814-K818 PolarHBondContact O-N 3Å
815	L	74.6	Confident	75.2	Confident	95 Å²	95	92.7 Å²	92.7	50%	0.497	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-40.3	173.3	-72	171.1	0	0	0	111.7	E811 K818 C819	E811-L815 WeakPolarHBondContact O-CB 3.4Å; E811-L815 VanDerWaalsContact O-CG 3.31Å; E811-L815 WeakPolarHBondContact O-CG 3.46Å; E811-L815 PolarHBondContact O-N 3.07Å; L815-K818 CarbonylContact O-C 3.53Å; L815-K818 WeakPolarHBondContact O-CB 3.43Å; L815-K818 PolarHBondContact O-N 3.2Å; L815-C819 PolarHBondContact O-N 3.05Å; L815-C819 PolarHBondContact O-SG 2.87Å; L815-C819 VanDerWaalsContact O-SG 3.32Å
816	K	74.2	Confident	75.2	Confident	141 Å²	141	93 Å²	93	61%	0.613	48%	0.477	S	S	*	.	H	α-helix	trans	-62.2	-43.8	172.1	-78.8	171.1	-180	173.7	0	111.8	I812 A813 K818 C819 T820	I812-K816 HydrophobicContact CG2-CD 3.98Å; I812-K816 HydrophobicContact CG2-CG 4.4Å; I812-K816 VanDerWaalsContact O-CB 3.27Å; I812-K816 WeakPolarHBondContact O-CB 3.32Å; I812-K816 WeakPolarHBondContact O-CG 3.42Å; I812-K816 PolarHBondContact O-N 3Å; A813-K816 PolarHBondContact O-N 2.96Å; K816-K818 VanDerWaalsContact C-N 3.27Å; K816-K818 PolarHBondContact O-N 3.48Å; K816-C819 WeakPolarHBondContact O-CB 3.43Å; K816-C819 PolarHBondContact O-N 2.9Å; K816-T820 PolarHBondContact O-N 3.34Å; K816-T820 PolarHBondContact O-OG1 3.13Å
817	Q	79.2	Confident	75.2	Confident	85 Å²	85	92.7 Å²	92.7	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-59.7	-38.8	174.1	-175.1	-171.9	23.4	0	0	111.7	A813 H814 T820 Q821	A813-Q817 WeakPolarHBondContact O-CB 3.49Å; A813-Q817 PolarHBondContact O-N 3.29Å; H814-Q817 WeakPolarHBondContact O-CB 3.39Å; H814-Q817 PolarHBondContact O-N 3.17Å; Q817-T820 WeakPolarHBondContact CA-OG1 3.27Å; Q817-T820 PolarHBondContact O-N 3.44Å; Q817-T820 PolarHBondContact O-OG1 2.85Å; Q817-Q821 VanDerWaalsContact O-CG 3.29Å; Q817-Q821 WeakPolarHBondContact O-CG 3.49Å; Q817-Q821 PolarHBondContact O-N 3.4Å
818	K	78.7	Confident	75.3	Confident	111 Å²	111	96.1 Å²	96.1	48%	0.483	49%	0.492	S	S	.	.	H	α-helix	trans	-71.6	-36.5	176.3	-159.2	171.9	-172.7	175	0	112.2	H814 L815 K816 Q821 L822	H814-K818 WeakPolarHBondContact O-CB 3.41Å; H814-K818 PolarHBondContact O-N 3Å; L815-K818 CarbonylContact O-C 3.53Å; L815-K818 WeakPolarHBondContact O-CB 3.43Å; L815-K818 PolarHBondContact O-N 3.2Å; K816-K818 VanDerWaalsContact C-N 3.27Å; K816-K818 PolarHBondContact O-N 3.48Å; K818-Q821 PolarHBondContact O-N 3.38Å; K818-L822 WeakPolarHBondContact O-CG 3.47Å; K818-L822 PolarHBondContact O-N 3Å
819	C	73.5	Confident	75.4	Confident	69 Å²	69	97.4 Å²	97.4	47%	0.466	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-47.5	169.1	-71.4	0	0	0	0	110.9	L815 K816 Q821 L822 E823	L815-C819 PolarHBondContact O-N 3.05Å; L815-C819 PolarHBondContact O-SG 2.87Å; L815-C819 VanDerWaalsContact O-SG 3.32Å; K816-C819 WeakPolarHBondContact O-CB 3.43Å; K816-C819 PolarHBondContact O-N 2.9Å; C819-Q821 VanDerWaalsContact C-N 3.31Å; C819-Q821 PolarHBondContact O-N 2.83Å; C819-L822 CarbonylContact O-C 3.57Å; C819-L822 WeakPolarHBondContact O-CA 3.47Å; C819-L822 WeakPolarHBondContact O-CB 3.34Å; C819-L822 PolarHBondContact O-N 3.41Å; C819-E823 WeakPolarHBondContact O-CG 3.22Å; C819-E823 PolarHBondContact O-N 3.1Å
820	T	74.5	Confident	75.5	Confident	67 Å²	67	100.4 Å²	100.4	41%	0.411	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-36.2	177.4	52.9	0	0	0	0	112.2	K816 Q817 L822 E823 D824	K816-T820 PolarHBondContact O-N 3.34Å; K816-T820 PolarHBondContact O-OG1 3.13Å; Q817-T820 WeakPolarHBondContact CA-OG1 3.27Å; Q817-T820 PolarHBondContact O-N 3.44Å; Q817-T820 PolarHBondContact O-OG1 2.85Å; T820-L822 VanDerWaalsContact C-N 3.32Å; T820-L822 PolarHBondContact O-N 3.38Å; T820-E823 PolarHBondContact O-N 3.21Å; T820-D824 WeakPolarHBondContact O-CB 3.24Å; T820-D824 PolarHBondContact O-N 3.27Å
821	Q	77.7	Confident	75.5	Confident	108 Å²	108	103.8 Å²	103.8	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-37.3	171.6	-75.9	170.3	0.8	0	0	112.7	Q817 K818 C819 S825	Q817-Q821 VanDerWaalsContact O-CG 3.29Å; Q817-Q821 WeakPolarHBondContact O-CG 3.49Å; Q817-Q821 PolarHBondContact O-N 3.4Å; K818-Q821 PolarHBondContact O-N 3.38Å; C819-Q821 VanDerWaalsContact C-N 3.31Å; C819-Q821 PolarHBondContact O-N 2.83Å; Q821-S825 WeakPolarHBondContact O-CB 3.44Å; Q821-S825 PolarHBondContact O-N 3.34Å; Q821-S825 PolarHBondContact O-OG 3.47Å
822	L	75	Confident	75.5	Confident	106 Å²	106	105.5 Å²	105.5	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-74.3	-36.1	174.9	-70.6	168.7	0	0	0	112	K818 C819 T820 S825 M826	K818-L822 WeakPolarHBondContact O-CG 3.47Å; K818-L822 PolarHBondContact O-N 3Å; C819-L822 CarbonylContact O-C 3.57Å; C819-L822 WeakPolarHBondContact O-CA 3.47Å; C819-L822 WeakPolarHBondContact O-CB 3.34Å; C819-L822 PolarHBondContact O-N 3.41Å; T820-L822 VanDerWaalsContact C-N 3.32Å; T820-L822 PolarHBondContact O-N 3.38Å; L822-S825 PolarHBondContact O-N 2.95Å; L822-M826 WeakPolarHBondContact O-CB 3.18Å; L822-M826 VanDerWaalsContact O-CG 3.25Å; L822-M826 WeakPolarHBondContact O-CG 3.49Å; L822-M826 PolarHBondContact O-N 3.48Å
823	E	71.3	Confident	75.8	Confident	120 Å²	120	109.5 Å²	109.5	56%	0.561	53%	0.53	S	S	*	.	H	α-helix	trans	-67	-41.7	174.2	-71.6	174.9	145.5	0	0	111.6	C819 T820 M826 A827	C819-E823 WeakPolarHBondContact O-CG 3.22Å; C819-E823 PolarHBondContact O-N 3.1Å; T820-E823 PolarHBondContact O-N 3.21Å; E823-M826 CarbonylContact O-C 3.57Å; E823-M826 PolarHBondContact O-N 3.37Å; E823-A827 VanDerWaalsContact O-CB 3.31Å; E823-A827 WeakPolarHBondContact O-CB 3.45Å; E823-A827 PolarHBondContact O-N 2.99Å
824	D	76.8	Confident	75.7	Confident	108 Å²	108	110.3 Å²	110.3	58%	0.578	53%	0.533	S	S	*	.	H	α-helix	trans	-61.2	-46.7	171.1	-77.1	-32.5	0	0	0	110.5	T820 M826 A827 E828	T820-D824 WeakPolarHBondContact O-CB 3.24Å; T820-D824 PolarHBondContact O-N 3.27Å; D824-M826 VanDerWaalsContact C-N 3.32Å; D824-M826 PolarHBondContact O-N 2.7Å; D824-A827 CarbonylContact O-C 3.04Å; D824-A827 WeakPolarHBondContact O-CA 3.38Å; D824-A827 WeakPolarHBondContact O-CB 3.47Å; D824-A827 PolarHBondContact O-N 3.14Å; D824-E828 PolarHBondContact O-N 3.18Å
825	S	77.8	Confident	75.5	Confident	58 Å²	58	109.1 Å²	109.1	41%	0.406	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-40.5	174.9	-58.5	0	0	0	0	112	Q821 L822 A827 E828 L829	Q821-S825 WeakPolarHBondContact O-CB 3.44Å; Q821-S825 PolarHBondContact O-N 3.34Å; Q821-S825 PolarHBondContact O-OG 3.47Å; L822-S825 PolarHBondContact O-N 2.95Å; S825-A827 VanDerWaalsContact C-N 3.35Å; S825-E828 PolarHBondContact O-N 3.47Å; S825-L829 WeakPolarHBondContact O-CB 3.1Å; S825-L829 VanDerWaalsContact O-CG 3.3Å; S825-L829 WeakPolarHBondContact O-CG 3.29Å; S825-L829 PolarHBondContact O-N 3.47Å
826	M	70	Confident	75.4	Confident	96 Å²	96	106.4 Å²	106.4	47%	0.473	52%	0.522	S	S	.	.	H	α-helix	trans	-69.7	-30.3	173.9	-75.2	179.3	70.8	0	0	112.3	L822 E823 D824 R830	L822-M826 WeakPolarHBondContact O-CB 3.18Å; L822-M826 VanDerWaalsContact O-CG 3.25Å; L822-M826 WeakPolarHBondContact O-CG 3.49Å; L822-M826 PolarHBondContact O-N 3.48Å; E823-M826 CarbonylContact O-C 3.57Å; E823-M826 PolarHBondContact O-N 3.37Å; D824-M826 VanDerWaalsContact C-N 3.32Å; D824-M826 PolarHBondContact O-N 2.7Å; M826-R830 VanDerWaalsContact O-CB 3.24Å; M826-R830 WeakPolarHBondContact O-CB 3.27Å; M826-R830 WeakPolarHBondContact O-CD 3.34Å; M826-R830 WeakPolarHBondContact O-CG 3.29Å; M826-R830 PolarHBondContact O-N 3.35Å
827	A	74	Confident	75.4	Confident	38 Å²	38	104 Å²	104	31%	0.314	51%	0.512	S	S	.	.	H	α-helix	trans	-72.5	-38.3	174.5	0	0	0	0	0	111.5	E823 D824 S825 R830 R831	E823-A827 VanDerWaalsContact O-CB 3.31Å; E823-A827 WeakPolarHBondContact O-CB 3.45Å; E823-A827 PolarHBondContact O-N 2.99Å; D824-A827 CarbonylContact O-C 3.04Å; D824-A827 WeakPolarHBondContact O-CA 3.38Å; D824-A827 WeakPolarHBondContact O-CB 3.47Å; D824-A827 PolarHBondContact O-N 3.14Å; S825-A827 VanDerWaalsContact C-N 3.35Å; A827-R830 PolarHBondContact O-N 3.13Å; A827-R831 WeakPolarHBondContact O-CB 3.48Å; A827-R831 WeakPolarHBondContact O-CG 3.39Å; A827-R831 PolarHBondContact O-N 2.91Å
828	E	77.4	Confident	75.1	Confident	137 Å²	137	102.4 Å²	102.4	64%	0.64	51%	0.511	S	S	*	.	H	α-helix	trans	-63.7	-47.4	169.5	-70.2	-160.9	140.7	0	0	111.5	D824 S825 R830 R831 F832	D824-E828 PolarHBondContact O-N 3.18Å; S825-E828 PolarHBondContact O-N 3.47Å; E828-R830 VanDerWaalsContact C-N 3.32Å; E828-R830 PolarHBondContact O-N 3.41Å; E828-R831 WeakPolarHBondContact O-CB 3.45Å; E828-R831 PolarHBondContact O-N 2.83Å; E828-R831 VanDerWaalsContact O-N 3.16Å; E828-F832 WeakPolarHBondContact O-CB 3.44Å; E828-F832 PolarHBondContact O-N 3.1Å
829	L	75.2	Confident	75	Confident	123 Å²	123	102.4 Å²	102.4	64%	0.644	51%	0.513	S	S	*	.	H	α-helix	trans	-62	-37	175.4	-72.1	169.2	0	0	0	112.6	S825 F832 R833	S825-L829 WeakPolarHBondContact O-CB 3.1Å; S825-L829 VanDerWaalsContact O-CG 3.3Å; S825-L829 WeakPolarHBondContact O-CG 3.29Å; S825-L829 PolarHBondContact O-N 3.47Å; L829-F832 PolarHBondContact O-N 2.98Å; L829-R833 VanDerWaalsContact O-CB 3.32Å; L829-R833 WeakPolarHBondContact O-CB 2.97Å; L829-R833 PolarHBondContact O-N 3.12Å
830	R	75.3	Confident	75.1	Confident	170 Å²	170	103.9 Å²	103.9	64%	0.642	52%	0.515	S	S	*	.	H	α-helix	trans	-67.1	-40	172.6	-78.8	167.1	175	165.2	-2.1	112.1	M826 A827 E828 S834	M826-R830 VanDerWaalsContact O-CB 3.24Å; M826-R830 WeakPolarHBondContact O-CB 3.27Å; M826-R830 WeakPolarHBondContact O-CD 3.34Å; M826-R830 WeakPolarHBondContact O-CG 3.29Å; M826-R830 PolarHBondContact O-N 3.35Å; A827-R830 PolarHBondContact O-N 3.13Å; E828-R830 VanDerWaalsContact C-N 3.32Å; E828-R830 PolarHBondContact O-N 3.41Å; R830-S834 VanDerWaalsContact O-CB 3.3Å; R830-S834 WeakPolarHBondContact O-CB 3.15Å; R830-S834 PolarHBondContact O-N 2.9Å
831	R	76	Confident	75.2	Confident	184 Å²	184	107.7 Å²	107.7	69%	0.694	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-45.5	173	-78.5	174.2	176.1	168.2	1.5	111.2	A827 E828 S834 V835	A827-R831 WeakPolarHBondContact O-CB 3.48Å; A827-R831 WeakPolarHBondContact O-CG 3.39Å; A827-R831 PolarHBondContact O-N 2.91Å; E828-R831 WeakPolarHBondContact O-CB 3.45Å; E828-R831 PolarHBondContact O-N 2.83Å; E828-R831 VanDerWaalsContact O-N 3.16Å; R831-S834 WeakPolarHBondContact O-CB 3.5Å; R831-S834 PolarHBondContact O-N 3.37Å; R831-V835 WeakPolarHBondContact O-CG2 3.47Å; R831-V835 PolarHBondContact O-N 2.86Å
832	F	76.2	Confident	75.1	Confident	152 Å²	152	106 Å²	106	67%	0.667	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-48.6	177.4	-158.2	-83.1	0	0	0	110.8	E828 L829 S834 V835 S836	E828-F832 WeakPolarHBondContact O-CB 3.44Å; E828-F832 PolarHBondContact O-N 3.1Å; L829-F832 PolarHBondContact O-N 2.98Å; F832-S834 VanDerWaalsContact C-N 3.31Å; F832-S834 PolarHBondContact O-N 2.68Å; F832-V835 PolarHBondContact O-N 2.85Å; F832-S836 PolarHBondContact O-N 3.28Å; F832-S836 PolarHBondContact O-OG 3.37Å
833	R	77.9	Confident	75.2	Confident	168 Å²	168	105.1 Å²	105.1	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-57.7	-40.4	172.9	179.8	176.6	172.8	164.6	4.3	112.4	L829 S836 Q837	L829-R833 VanDerWaalsContact O-CB 3.32Å; L829-R833 WeakPolarHBondContact O-CB 2.97Å; L829-R833 PolarHBondContact O-N 3.12Å; R833-S836 PolarHBondContact O-N 2.76Å; R833-Q837 HydrophobicContact CG-CG 4.42Å; R833-Q837 WeakPolarHBondContact O-CB 3.49Å; R833-Q837 WeakPolarHBondContact O-CG 3.46Å; R833-Q837 PolarHBondContact O-N 3.4Å
834	S	73.9	Confident	75.4	Confident	74 Å²	74	104.4 Å²	104.4	52%	0.517	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-44	177.4	-172	0	0	0	0	112	R830 R831 F832 Q837 S838	R830-S834 VanDerWaalsContact O-CB 3.3Å; R830-S834 WeakPolarHBondContact O-CB 3.15Å; R830-S834 PolarHBondContact O-N 2.9Å; R831-S834 WeakPolarHBondContact O-CB 3.5Å; R831-S834 PolarHBondContact O-N 3.37Å; F832-S834 VanDerWaalsContact C-N 3.31Å; F832-S834 PolarHBondContact O-N 2.68Å; S834-Q837 CarbonylContact O-C 3.58Å; S834-Q837 PolarHBondContact O-N 2.99Å; S834-S838 PolarHBondContact O-N 2.86Å
835	V	76.8	Confident	75.4	Confident	82 Å²	82	105.6 Å²	105.6	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-62.9	-45.7	174	172.8	0	0	0	0	110.8	R831 F832 Q837 S838 Q839	R831-V835 WeakPolarHBondContact O-CG2 3.47Å; R831-V835 PolarHBondContact O-N 2.86Å; F832-V835 PolarHBondContact O-N 2.85Å; V835-Q837 VanDerWaalsContact C-N 3.33Å; V835-Q837 PolarHBondContact O-N 2.81Å; V835-S838 WeakPolarHBondContact O-CB 3.45Å; V835-S838 PolarHBondContact O-N 3.15Å; V835-S838 VanDerWaalsContact O-N 3.1Å; V835-Q839 WeakPolarHBondContact O-CG 3.33Å; V835-Q839 PolarHBondContact O-N 3.24Å
836	S	72.4	Confident	75.3	Confident	37 Å²	37	108.2 Å²	108.2	26%	0.259	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-33.9	175.4	-58.3	0	0	0	0	113	F832 R833 Q839 L840	F832-S836 PolarHBondContact O-N 3.28Å; F832-S836 PolarHBondContact O-OG 3.37Å; R833-S836 PolarHBondContact O-N 2.76Å; S836-Q839 PolarHBondContact O-N 2.85Å; S836-L840 VanDerWaalsContact O-CB 3.3Å; S836-L840 WeakPolarHBondContact O-CB 3.49Å; S836-L840 VanDerWaalsContact O-CG 3.26Å; S836-L840 WeakPolarHBondContact O-CG 3.4Å; S836-L840 PolarHBondContact O-N 3.37Å
837	Q	74.2	Confident	75.7	Confident	90 Å²	90	108 Å²	108	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-76.4	-19.4	172.5	-76.9	-170.3	-92.9	0	0	113.5	R833 S834 V835 R841	R833-Q837 HydrophobicContact CG-CG 4.42Å; R833-Q837 WeakPolarHBondContact O-CB 3.49Å; R833-Q837 WeakPolarHBondContact O-CG 3.46Å; R833-Q837 PolarHBondContact O-N 3.4Å; S834-Q837 CarbonylContact O-C 3.58Å; S834-Q837 PolarHBondContact O-N 2.99Å; V835-Q837 VanDerWaalsContact C-N 3.33Å; V835-Q837 PolarHBondContact O-N 2.81Å; Q837-R841 WeakPolarHBondContact O-CG 3.39Å; Q837-R841 PolarHBondContact O-N 3.29Å; Q837-R841 PolarHBondContact O-NE 3.22Å
838	S	73	Confident	75.7	Confident	52 Å²	52	112.9 Å²	112.9	36%	0.364	54%	0.537	S	S	.	.	H	α-helix	trans	-72.1	-54.9	164.2	-155.2	0	0	0	0	109	S834 V835 L840 R841 D842	S834-S838 PolarHBondContact O-N 2.86Å; V835-S838 WeakPolarHBondContact O-CB 3.45Å; V835-S838 PolarHBondContact O-N 3.15Å; V835-S838 VanDerWaalsContact O-N 3.1Å; S838-L840 VanDerWaalsContact C-N 3.29Å; S838-L840 PolarHBondContact O-N 2.95Å; S838-R841 CarbonylContact O-C 3.57Å; S838-R841 WeakPolarHBondContact O-CA 3.25Å; S838-R841 PolarHBondContact O-N 3.19Å; S838-D842 PolarHBondContact O-N 3.47Å
839	Q	76.6	Confident	75.6	Confident	112 Å²	112	109.4 Å²	109.4	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-58.4	-36.5	-179.4	-70	174	-28.7	0	0	113.5	V835 S836 V843	V835-Q839 WeakPolarHBondContact O-CG 3.33Å; V835-Q839 PolarHBondContact O-N 3.24Å; S836-Q839 PolarHBondContact O-N 2.85Å; Q839-V843 WeakPolarHBondContact O-CB 3.41Å; Q839-V843 VanDerWaalsContact O-CG2 3.24Å; Q839-V843 WeakPolarHBondContact O-CG2 3.27Å; Q839-V843 PolarHBondContact O-N 3.12Å
840	L	75.9	Confident	75.5	Confident	99 Å²	99	110 Å²	110	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-45	172.1	-79.5	165.6	0	0	0	111.4	S836 S838 V843 E844	S836-L840 VanDerWaalsContact O-CB 3.3Å; S836-L840 WeakPolarHBondContact O-CB 3.49Å; S836-L840 VanDerWaalsContact O-CG 3.26Å; S836-L840 WeakPolarHBondContact O-CG 3.4Å; S836-L840 PolarHBondContact O-N 3.37Å; S838-L840 VanDerWaalsContact C-N 3.29Å; S838-L840 PolarHBondContact O-N 2.95Å; L840-V843 CarbonylContact O-C 3.54Å; L840-V843 PolarHBondContact O-N 3Å; L840-V843 VanDerWaalsContact O-N 3.16Å; L840-E844 WeakPolarHBondContact O-CB 3.49Å; L840-E844 VanDerWaalsContact O-CG 3.25Å; L840-E844 WeakPolarHBondContact O-CG 3.4Å; L840-E844 PolarHBondContact O-N 3.07Å
841	R	75.5	Confident	75.5	Confident	147 Å²	147	107.4 Å²	107.4	56%	0.555	52%	0.52	S	S	*	.	H	α-helix	trans	-68	-36.9	176.2	-77.6	179.1	-65.6	178.9	5.9	113.1	Q837 S838 V843 E844 E845	Q837-R841 WeakPolarHBondContact O-CG 3.39Å; Q837-R841 PolarHBondContact O-N 3.29Å; Q837-R841 PolarHBondContact O-NE 3.22Å; S838-R841 CarbonylContact O-C 3.57Å; S838-R841 WeakPolarHBondContact O-CA 3.25Å; S838-R841 PolarHBondContact O-N 3.19Å; R841-V843 PolarHBondContact O-N 3.2Å; R841-E844 WeakPolarHBondContact CA-OE2 3.35Å; R841-E844 WeakPolarHBondContact CG-OE2 3.33Å; R841-E844 PolarHBondContact O-N 3.26Å; R841-E845 WeakPolarHBondContact O-CB 3.46Å; R841-E845 PolarHBondContact O-N 3.43Å
842	D	76.2	Confident	75.3	Confident	74 Å²	74	105.5 Å²	105.5	40%	0.396	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-32.7	173	-53.2	-26.3	0	0	0	110.6	S838 Q846	S838-D842 PolarHBondContact O-N 3.47Å; D842-Q846 WeakPolarHBondContact O-CB 3.32Å; D842-Q846 WeakPolarHBondContact O-CG 3.24Å; D842-Q846 PolarHBondContact O-N 3Å; D842-Q846 PolarHBondContact O-NE2 3.14Å
843	V	76.3	Confident	75.2	Confident	87 Å²	87	103.7 Å²	103.7	53%	0.527	51%	0.506	S	S	.	.	H	α-helix	trans	-82.3	-35.1	175.5	168.3	0	0	0	0	112.3	Q839 L840 R841 Q846 L847	Q839-V843 WeakPolarHBondContact O-CB 3.41Å; Q839-V843 VanDerWaalsContact O-CG2 3.24Å; Q839-V843 WeakPolarHBondContact O-CG2 3.27Å; Q839-V843 PolarHBondContact O-N 3.12Å; L840-V843 CarbonylContact O-C 3.54Å; L840-V843 PolarHBondContact O-N 3Å; L840-V843 VanDerWaalsContact O-N 3.16Å; R841-V843 PolarHBondContact O-N 3.2Å; V843-Q846 PolarHBondContact O-N 3.12Å; V843-L847 VanDerWaalsContact O-CB 3.27Å; V843-L847 WeakPolarHBondContact O-CB 3.49Å; V843-L847 PolarHBondContact O-N 2.9Å
844	E	75.8	Confident	75	Confident	105 Å²	105	97.9 Å²	97.9	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-65.7	-44.8	173.1	-72.6	162.2	164	0	0	110.4	L840 R841 L847 E848	L840-E844 WeakPolarHBondContact O-CB 3.49Å; L840-E844 VanDerWaalsContact O-CG 3.25Å; L840-E844 WeakPolarHBondContact O-CG 3.4Å; L840-E844 PolarHBondContact O-N 3.07Å; R841-E844 WeakPolarHBondContact CA-OE2 3.35Å; R841-E844 WeakPolarHBondContact CG-OE2 3.33Å; R841-E844 PolarHBondContact O-N 3.26Å; E844-L847 CarbonylContact O-C 3.58Å; E844-L847 WeakPolarHBondContact O-CA 3.25Å; E844-L847 WeakPolarHBondContact O-CB 3.49Å; E844-L847 PolarHBondContact O-N 2.98Å; E844-L847 VanDerWaalsContact O-N 3.09Å; E844-E848 WeakPolarHBondContact O-CG 3.49Å; E844-E848 PolarHBondContact O-N 3.47Å
845	E	76.3	Confident	75	Confident	132 Å²	132	97.4 Å²	97.4	62%	0.617	49%	0.487	S	S	*	.	H	α-helix	trans	-67	-35.8	174.7	-171	173.8	-151.5	0	0	111.6	R841 L847 T849	R841-E845 WeakPolarHBondContact O-CB 3.46Å; R841-E845 PolarHBondContact O-N 3.43Å; E845-L847 VanDerWaalsContact C-N 3.34Å; E845-T849 WeakPolarHBondContact O-CB 3.2Å; E845-T849 WeakPolarHBondContact O-CG2 3.36Å; E845-T849 PolarHBondContact O-N 2.91Å; E845-T849 PolarHBondContact O-OG1 3.36Å
846	Q	76.4	Confident	74.7	Confident	113 Å²	113	96.8 Å²	96.8	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-65.7	-34.2	168.6	-81.4	170.2	71	0	0	112.8	D842 V843 T849 Q850	D842-Q846 WeakPolarHBondContact O-CB 3.32Å; D842-Q846 WeakPolarHBondContact O-CG 3.24Å; D842-Q846 PolarHBondContact O-N 3Å; D842-Q846 PolarHBondContact O-NE2 3.14Å; V843-Q846 PolarHBondContact O-N 3.12Å; Q846-T849 WeakPolarHBondContact CA-OG1 3.26Å; Q846-T849 PolarHBondContact O-OG1 3.36Å; Q846-Q850 VanDerWaalsContact O-CB 3.3Å; Q846-Q850 WeakPolarHBondContact O-CB 3.38Å; Q846-Q850 WeakPolarHBondContact O-CG 3.36Å; Q846-Q850 PolarHBondContact O-N 2.77Å
847	L	78.6	Confident	74.6	Confident	93 Å²	93	102.5 Å²	102.5	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-75.1	-42.5	177.1	-178.9	61.5	0	0	0	111.3	V843 E844 E845 Q850 Q851	V843-L847 VanDerWaalsContact O-CB 3.27Å; V843-L847 WeakPolarHBondContact O-CB 3.49Å; V843-L847 PolarHBondContact O-N 2.9Å; E844-L847 CarbonylContact O-C 3.58Å; E844-L847 WeakPolarHBondContact O-CA 3.25Å; E844-L847 WeakPolarHBondContact O-CB 3.49Å; E844-L847 PolarHBondContact O-N 2.98Å; E844-L847 VanDerWaalsContact O-N 3.09Å; E845-L847 VanDerWaalsContact C-N 3.34Å; L847-Q850 CarbonylContact O-C 3.56Å; L847-Q850 PolarHBondContact O-N 2.9Å; L847-Q851 HydrophobicContact CD1-CG 4.42Å; L847-Q851 WeakPolarHBondContact O-CB 3.46Å; L847-Q851 VanDerWaalsContact O-CG 3.26Å; L847-Q851 WeakPolarHBondContact O-CG 3.17Å; L847-Q851 PolarHBondContact O-N 2.95Å
848	E	74.5	Confident	74.7	Confident	139 Å²	139	104.1 Å²	104.1	65%	0.65	50%	0.503	S	S	*	.	H	α-helix	trans	-63.7	-44.1	173.9	-75.4	-167.3	167.2	0	0	111.1	E844 Q851 Y852	E844-E848 WeakPolarHBondContact O-CG 3.49Å; E844-E848 PolarHBondContact O-N 3.47Å; E848-Q851 CarbonylContact O-C 3.37Å; E848-Q851 PolarHBondContact O-N 3Å; E848-Y852 VanDerWaalsContact O-CB 3.32Å; E848-Y852 WeakPolarHBondContact O-CB 3.36Å; E848-Y852 PolarHBondContact O-N 2.81Å
849	T	74.5	Confident	74.7	Confident	64 Å²	64	103.9 Å²	103.9	39%	0.393	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-37.6	173.8	52.2	0	0	0	0	111.9	E845 Q846 Y852 F853	E845-T849 WeakPolarHBondContact O-CB 3.2Å; E845-T849 WeakPolarHBondContact O-CG2 3.36Å; E845-T849 PolarHBondContact O-N 2.91Å; E845-T849 PolarHBondContact O-OG1 3.36Å; Q846-T849 WeakPolarHBondContact CA-OG1 3.26Å; Q846-T849 PolarHBondContact O-OG1 3.36Å; T849-Y852 PolarHBondContact O-N 3.34Å; T849-F853 WeakPolarHBondContact O-CB 3.05Å; T849-F853 WeakPolarHBondContact O-CD2 3.12Å; T849-F853 PolarHBondContact O-N 3.03Å
850	Q	73.7	Confident	74.4	Confident	135 Å²	135	102.9 Å²	102.9	63%	0.631	50%	0.497	S	S	*	.	H	α-helix	trans	-67.3	-33.9	170.6	-80.4	-165.8	33	0	0	113.3	Q846 L847 S854	Q846-Q850 VanDerWaalsContact O-CB 3.3Å; Q846-Q850 WeakPolarHBondContact O-CB 3.38Å; Q846-Q850 WeakPolarHBondContact O-CG 3.36Å; Q846-Q850 PolarHBondContact O-N 2.77Å; L847-Q850 CarbonylContact O-C 3.56Å; L847-Q850 PolarHBondContact O-N 2.9Å; Q850-S854 WeakPolarHBondContact O-CA 3.44Å; Q850-S854 WeakPolarHBondContact O-CB 3.31Å; Q850-S854 PolarHBondContact O-N 3.01Å
851	Q	75.7	Confident	74.3	Confident	117 Å²	117	100.7 Å²	100.7	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-70.1	-37.9	173.5	-75.8	-178	30.9	0	0	111.3	L847 E848 S854 S855	L847-Q851 HydrophobicContact CD1-CG 4.42Å; L847-Q851 WeakPolarHBondContact O-CB 3.46Å; L847-Q851 VanDerWaalsContact O-CG 3.26Å; L847-Q851 WeakPolarHBondContact O-CG 3.17Å; L847-Q851 PolarHBondContact O-N 2.95Å; E848-Q851 CarbonylContact O-C 3.37Å; E848-Q851 PolarHBondContact O-N 3Å; Q851-S854 PolarHBondContact O-N 2.81Å; Q851-S855 WeakPolarHBondContact O-CB 3.5Å; Q851-S855 PolarHBondContact O-N 3.03Å; Q851-S855 PolarHBondContact O-OG 2.64Å
852	Y	71.8	Confident	74.2	Confident	143 Å²	143	101.7 Å²	101.7	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-63.7	-51.9	171.7	-177.7	-101.4	0	0	0	110.9	E848 T849 S854 S855 L856	E848-Y852 VanDerWaalsContact O-CB 3.32Å; E848-Y852 WeakPolarHBondContact O-CB 3.36Å; E848-Y852 PolarHBondContact O-N 2.81Å; T849-Y852 PolarHBondContact O-N 3.34Å; Y852-S854 VanDerWaalsContact C-N 3.29Å; Y852-S854 PolarHBondContact O-N 3.16Å; Y852-S855 PolarHBondContact O-N 2.69Å; Y852-S855 PolarHBondContact O-OG 2.73Å; Y852-L856 HydrophobicContact CD1-CD1 4.41Å; Y852-L856 HydrophobicContact CE1-CD1 3.65Å; Y852-L856 VanDerWaalsContact O-CB 3.23Å; Y852-L856 WeakPolarHBondContact O-CB 3.47Å; Y852-L856 PolarHBondContact O-N 3.36Å
853	F	73.6	Confident	74.1	Confident	115 Å²	115	103 Å²	103	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-35.6	173.3	-74.2	-59.8	0	0	0	112.1	T849 L856 Y857	T849-F853 WeakPolarHBondContact O-CB 3.05Å; T849-F853 WeakPolarHBondContact O-CD2 3.12Å; T849-F853 PolarHBondContact O-N 3.03Å; F853-L856 PolarHBondContact O-N 2.87Å; F853-Y857 HydrophobicContact CB-CD2 4.42Å; F853-Y857 HydrophobicContact CB-CE2 4.48Å; F853-Y857 VanDerWaalsContact O-CB 3.31Å; F853-Y857 WeakPolarHBondContact O-CB 3.2Å; F853-Y857 WeakPolarHBondContact O-CD2 3.43Å; F853-Y857 PolarHBondContact O-N 3.33Å
854	S	72.9	Confident	73.9	Confident	46 Å²	46	103.4 Å²	103.4	32%	0.322	50%	0.496	S	S	.	.	H	α-helix	trans	-67.4	-40.3	175.1	-170	0	0	0	0	111.9	Q850 Q851 Y852 K858	Q850-S854 WeakPolarHBondContact O-CA 3.44Å; Q850-S854 WeakPolarHBondContact O-CB 3.31Å; Q850-S854 PolarHBondContact O-N 3.01Å; Q851-S854 PolarHBondContact O-N 2.81Å; Y852-S854 VanDerWaalsContact C-N 3.29Å; Y852-S854 PolarHBondContact O-N 3.16Å; S854-K858 VanDerWaalsContact O-CB 3.26Å; S854-K858 WeakPolarHBondContact O-CB 3.45Å; S854-K858 VanDerWaalsContact O-CD 3.27Å; S854-K858 WeakPolarHBondContact O-CD 3.25Å; S854-K858 WeakPolarHBondContact O-CG 3.18Å; S854-K858 PolarHBondContact O-N 3.16Å; S854-K858 WeakPolarHBondContact OG-CE 3.13Å; S854-K858 PolarHBondContact OG-NZ 3.12Å
855	S	73.9	Confident	73.9	Confident	64 Å²	64	104.7 Å²	104.7	45%	0.448	50%	0.501	S	S	.	.	H	α-helix	trans	-70.7	-35.9	175.9	74.9	0	0	0	0	111.3	Q851 Y852 K858 S859	Q851-S855 WeakPolarHBondContact O-CB 3.5Å; Q851-S855 PolarHBondContact O-N 3.03Å; Q851-S855 PolarHBondContact O-OG 2.64Å; Y852-S855 PolarHBondContact O-N 2.69Å; Y852-S855 PolarHBondContact O-OG 2.73Å; S855-K858 CarbonylContact O-C 3.55Å; S855-K858 PolarHBondContact O-N 3.16Å; S855-S859 WeakPolarHBondContact O-CB 3.44Å; S855-S859 PolarHBondContact O-N 3.12Å
856	L	71.2	Confident	73.9	Confident	68 Å²	68	103.4 Å²	103.4	36%	0.356	50%	0.498	S	S	.	.	H	α-helix	trans	-72	-41.2	176.5	-155.2	158.8	0	0	0	111.3	Y852 F853 K858 S859 Q860	Y852-L856 HydrophobicContact CD1-CD1 4.41Å; Y852-L856 HydrophobicContact CE1-CD1 3.65Å; Y852-L856 VanDerWaalsContact O-CB 3.23Å; Y852-L856 WeakPolarHBondContact O-CB 3.47Å; Y852-L856 PolarHBondContact O-N 3.36Å; F853-L856 PolarHBondContact O-N 2.87Å; L856-K858 VanDerWaalsContact C-N 3.34Å; L856-K858 PolarHBondContact O-N 3.45Å; L856-S859 PolarHBondContact O-N 3.05Å; L856-Q860 WeakPolarHBondContact O-CB 3.47Å; L856-Q860 PolarHBondContact O-N 2.99Å
857	Y	70.3	Confident	73.8	Confident	158 Å²	158	103.3 Å²	103.3	62%	0.62	50%	0.497	S	S	*	.	H	α-helix	trans	-66.3	-32.3	168.6	-79.6	-57.3	0	0	0	112.4	F853 S861	F853-Y857 HydrophobicContact CB-CD2 4.42Å; F853-Y857 HydrophobicContact CB-CE2 4.48Å; F853-Y857 VanDerWaalsContact O-CB 3.31Å; F853-Y857 WeakPolarHBondContact O-CB 3.2Å; F853-Y857 WeakPolarHBondContact O-CD2 3.43Å; F853-Y857 PolarHBondContact O-N 3.33Å; Y857-S861 WeakPolarHBondContact O-CA 3.38Å; Y857-S861 WeakPolarHBondContact O-CB 3.45Å; Y857-S861 PolarHBondContact O-N 2.71Å
858	K	75.5	Confident	73.5	Confident	123 Å²	123	104.5 Å²	104.5	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-71.9	-35.6	172.1	-76.6	161.7	-176.3	152.1	0	112.1	S854 S855 L856 R862	S854-K858 VanDerWaalsContact O-CB 3.26Å; S854-K858 WeakPolarHBondContact O-CB 3.45Å; S854-K858 VanDerWaalsContact O-CD 3.27Å; S854-K858 WeakPolarHBondContact O-CD 3.25Å; S854-K858 WeakPolarHBondContact O-CG 3.18Å; S854-K858 PolarHBondContact O-N 3.16Å; S854-K858 WeakPolarHBondContact OG-CE 3.13Å; S854-K858 PolarHBondContact OG-NZ 3.12Å; S855-K858 CarbonylContact O-C 3.55Å; S855-K858 PolarHBondContact O-N 3.16Å; L856-K858 VanDerWaalsContact C-N 3.34Å; L856-K858 PolarHBondContact O-N 3.45Å; K858-R862 VanDerWaalsContact O-CG 3.29Å; K858-R862 WeakPolarHBondContact O-CG 3.46Å; K858-R862 PolarHBondContact O-N 3.1Å
859	S	73.1	Confident	73.6	Confident	48 Å²	48	101.8 Å²	101.8	34%	0.336	50%	0.496	S	S	.	.	H	α-helix	trans	-70	-53.8	174.5	-154.9	0	0	0	0	109.5	S855 L856 S861 R862 E863	S855-S859 WeakPolarHBondContact O-CB 3.44Å; S855-S859 PolarHBondContact O-N 3.12Å; L856-S859 PolarHBondContact O-N 3.05Å; S859-S861 PolarHBondContact O-N 2.78Å; S859-R862 CarbonylContact O-C 3.6Å; S859-R862 WeakPolarHBondContact O-CA 3.31Å; S859-R862 WeakPolarHBondContact O-CB 3.49Å; S859-R862 PolarHBondContact O-N 3.07Å; S859-E863 VanDerWaalsContact C-OE1 3.23Å; S859-E863 VanDerWaalsContact CB-OE1 3.25Å; S859-E863 WeakPolarHBondContact CB-OE1 3.29Å; S859-E863 WeakPolarHBondContact O-CB 3.29Å; S859-E863 WeakPolarHBondContact O-CG 3.29Å; S859-E863 PolarHBondContact O-N 3.32Å; S859-E863 PolarHBondContact OG-OE1 3.34Å
860	Q	71	Confident	73.5	Confident	90 Å²	90	101.7 Å²	101.7	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-31.4	174.4	-171	171.9	71.8	0	0	112.7	L856 L864	L856-Q860 WeakPolarHBondContact O-CB 3.47Å; L856-Q860 PolarHBondContact O-N 2.99Å; Q860-L864 HydrophobicContact CG-CD1 4.07Å; Q860-L864 HydrophobicContact CG-CG 4.45Å; Q860-L864 WeakPolarHBondContact O-CB 3.47Å; Q860-L864 WeakPolarHBondContact O-CD1 3.38Å; Q860-L864 WeakPolarHBondContact O-CG 3.44Å; Q860-L864 PolarHBondContact O-N 2.82Å
861	S	72.8	Confident	73.4	Confident	54 Å²	54	100.3 Å²	100.3	38%	0.378	49%	0.489	S	S	.	.	H	α-helix	trans	-81.1	-15.9	171.7	-179	0	0	0	0	114	Y857 S859 K865	Y857-S861 WeakPolarHBondContact O-CA 3.38Å; Y857-S861 WeakPolarHBondContact O-CB 3.45Å; Y857-S861 PolarHBondContact O-N 2.71Å; S859-S861 PolarHBondContact O-N 2.78Å; S861-K865 WeakPolarHBondContact O-CB 3.28Å; S861-K865 WeakPolarHBondContact O-CD 3.36Å; S861-K865 WeakPolarHBondContact O-CG 3.37Å; S861-K865 PolarHBondContact O-N 3.21Å
862	R	75	Confident	73.3	Confident	168 Å²	168	98.3 Å²	98.3	63%	0.634	48%	0.483	S	S	*	.	H	α-helix	trans	-81.6	-53.1	165.2	-76.9	172.6	-171.3	163.5	0.9	109.3	K858 S859 L864 K865 D866	K858-R862 VanDerWaalsContact O-CG 3.29Å; K858-R862 WeakPolarHBondContact O-CG 3.46Å; K858-R862 PolarHBondContact O-N 3.1Å; S859-R862 CarbonylContact O-C 3.6Å; S859-R862 WeakPolarHBondContact O-CA 3.31Å; S859-R862 WeakPolarHBondContact O-CB 3.49Å; S859-R862 PolarHBondContact O-N 3.07Å; R862-L864 VanDerWaalsContact C-N 3.32Å; R862-L864 PolarHBondContact O-N 2.76Å; R862-K865 CarbonylContact O-C 3.51Å; R862-K865 VanDerWaalsContact O-CA 3.3Å; R862-K865 WeakPolarHBondContact O-CA 3.34Å; R862-K865 WeakPolarHBondContact O-CB 3.48Å; R862-K865 PolarHBondContact O-N 3Å; R862-D866 WeakPolarHBondContact O-CB 3.4Å; R862-D866 VanDerWaalsContact O-CG 3.23Å; R862-D866 PolarHBondContact O-N 2.73Å
863	E	73.6	Confident	73.4	Confident	102 Å²	102	97.6 Å²	97.6	48%	0.477	48%	0.484	S	S	.	.	H	α-helix	trans	-50	-47.9	172.1	-68.3	152.9	-135.9	0	0	111.5	S859 K865 D866 E867	S859-E863 VanDerWaalsContact C-OE1 3.23Å; S859-E863 VanDerWaalsContact CB-OE1 3.25Å; S859-E863 WeakPolarHBondContact CB-OE1 3.29Å; S859-E863 WeakPolarHBondContact O-CB 3.29Å; S859-E863 WeakPolarHBondContact O-CG 3.29Å; S859-E863 PolarHBondContact O-N 3.32Å; S859-E863 PolarHBondContact OG-OE1 3.34Å; E863-K865 VanDerWaalsContact C-N 3.29Å; E863-K865 PolarHBondContact O-N 3.36Å; E863-D866 PolarHBondContact O-N 2.82Å; E863-E867 WeakPolarHBondContact O-CA 3.4Å; E863-E867 WeakPolarHBondContact O-CB 3.37Å; E863-E867 VanDerWaalsContact O-CG 3.3Å; E863-E867 WeakPolarHBondContact O-CG 3.44Å; E863-E867 PolarHBondContact O-N 2.99Å
864	L	72.3	Confident	73.3	Confident	94 Å²	94	96.3 Å²	96.3	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-68.8	-21.2	174.3	-75.6	169	0	0	0	114.1	Q860 R862 L868	Q860-L864 HydrophobicContact CG-CD1 4.07Å; Q860-L864 HydrophobicContact CG-CG 4.45Å; Q860-L864 WeakPolarHBondContact O-CB 3.47Å; Q860-L864 WeakPolarHBondContact O-CD1 3.38Å; Q860-L864 WeakPolarHBondContact O-CG 3.44Å; Q860-L864 PolarHBondContact O-N 2.82Å; R862-L864 VanDerWaalsContact C-N 3.32Å; R862-L864 PolarHBondContact O-N 2.76Å; L864-L868 WeakPolarHBondContact O-CB 3.1Å; L864-L868 PolarHBondContact O-N 3.25Å
865	K	75.6	Confident	73.2	Confident	133 Å²	133	98.3 Å²	98.3	58%	0.578	49%	0.486	S	S	*	.	H	α-helix	trans	-84.9	-37.9	173.2	-84	177.8	-179	179.6	0	112.4	S861 R862 E863 L868 V869	S861-K865 WeakPolarHBondContact O-CB 3.28Å; S861-K865 WeakPolarHBondContact O-CD 3.36Å; S861-K865 WeakPolarHBondContact O-CG 3.37Å; S861-K865 PolarHBondContact O-N 3.21Å; R862-K865 CarbonylContact O-C 3.51Å; R862-K865 VanDerWaalsContact O-CA 3.3Å; R862-K865 WeakPolarHBondContact O-CA 3.34Å; R862-K865 WeakPolarHBondContact O-CB 3.48Å; R862-K865 PolarHBondContact O-N 3Å; E863-K865 VanDerWaalsContact C-N 3.29Å; E863-K865 PolarHBondContact O-N 3.36Å; K865-L868 CarbonylContact O-C 3.53Å; K865-L868 WeakPolarHBondContact O-CB 3.49Å; K865-L868 PolarHBondContact O-N 2.88Å; K865-V869 WeakPolarHBondContact O-CB 3.42Å; K865-V869 VanDerWaalsContact O-CG2 3.32Å; K865-V869 WeakPolarHBondContact O-CG2 3.32Å; K865-V869 PolarHBondContact O-N 2.77Å
866	D	75.8	Confident	73.2	Confident	104 Å²	104	98.1 Å²	98.1	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-75.4	-36.9	177.3	-61.4	-29.6	0	0	0	109.2	R862 E863 C870	R862-D866 WeakPolarHBondContact O-CB 3.4Å; R862-D866 VanDerWaalsContact O-CG 3.23Å; R862-D866 PolarHBondContact O-N 2.73Å; E863-D866 PolarHBondContact O-N 2.82Å; D866-C870 WeakPolarHBondContact O-CB 3.18Å; D866-C870 PolarHBondContact O-N 3.45Å
867	E	73.6	Confident	73.3	Confident	112 Å²	112	98 Å²	98	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-41.6	160.7	-77	-160.9	144.5	0	0	111.1	E863 V869 C870 K871	E863-E867 WeakPolarHBondContact O-CA 3.4Å; E863-E867 WeakPolarHBondContact O-CB 3.37Å; E863-E867 VanDerWaalsContact O-CG 3.3Å; E863-E867 WeakPolarHBondContact O-CG 3.44Å; E863-E867 PolarHBondContact O-N 2.99Å; E867-V869 PolarHBondContact O-N 3.12Å; E867-C870 PolarHBondContact O-N 2.85Å; E867-K871 WeakPolarHBondContact O-CA 3.16Å; E867-K871 WeakPolarHBondContact O-CB 3.16Å; E867-K871 WeakPolarHBondContact O-CG 3.48Å; E867-K871 PolarHBondContact O-N 3.21Å
868	L	72.9	Confident	73.2	Confident	118 Å²	118	94.3 Å²	94.3	62%	0.618	48%	0.479	S	S	*	.	H	α-helix	trans	-64.9	-38.5	175.3	-109.8	158.9	0	0	0	112.8	L864 K865 K871 D872	L864-L868 WeakPolarHBondContact O-CB 3.1Å; L864-L868 PolarHBondContact O-N 3.25Å; K865-L868 CarbonylContact O-C 3.53Å; K865-L868 WeakPolarHBondContact O-CB 3.49Å; K865-L868 PolarHBondContact O-N 2.88Å; L868-K871 CarbonylContact O-C 3.59Å; L868-D872 VanDerWaalsContact O-CB 3.28Å; L868-D872 WeakPolarHBondContact O-CB 3.47Å; L868-D872 PolarHBondContact O-N 2.68Å
869	V	76.7	Confident	73.1	Confident	81 Å²	81	93.5 Å²	93.5	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-70.1	-44	176.1	167.8	0	0	0	0	110.1	K865 E867 K871 D872 Q873	K865-V869 WeakPolarHBondContact O-CB 3.42Å; K865-V869 VanDerWaalsContact O-CG2 3.32Å; K865-V869 WeakPolarHBondContact O-CG2 3.32Å; K865-V869 PolarHBondContact O-N 2.77Å; E867-V869 PolarHBondContact O-N 3.12Å; V869-K871 VanDerWaalsContact C-N 3.34Å; V869-D872 PolarHBondContact O-N 3.12Å; V869-Q873 WeakPolarHBondContact O-CB 3.35Å; V869-Q873 VanDerWaalsContact O-CG 3.24Å; V869-Q873 WeakPolarHBondContact O-CG 3.21Å; V869-Q873 PolarHBondContact O-N 3.1Å
870	C	72.1	Confident	73.2	Confident	62 Å²	62	96.1 Å²	96.1	42%	0.419	49%	0.485	S	S	.	.	H	α-helix	trans	-66.8	-36.6	175	-165.3	0	0	0	0	111.3	D866 E867 Q873 E874	D866-C870 WeakPolarHBondContact O-CB 3.18Å; D866-C870 PolarHBondContact O-N 3.45Å; E867-C870 PolarHBondContact O-N 2.85Å; C870-Q873 PolarHBondContact O-N 3.41Å; C870-E874 WeakPolarHBondContact O-CB 3.49Å; C870-E874 WeakPolarHBondContact O-CG 3.37Å; C870-E874 PolarHBondContact O-N 3.22Å
871	K	72.4	Confident	73.2	Confident	106 Å²	106	97.1 Å²	97.1	46%	0.461	49%	0.489	S	S	.	.	H	α-helix	trans	-74.5	-26.8	174.9	-72.3	-85.5	168.6	-90	0	112.7	E867 L868 V869 E874 L875	E867-K871 WeakPolarHBondContact O-CA 3.16Å; E867-K871 WeakPolarHBondContact O-CB 3.16Å; E867-K871 WeakPolarHBondContact O-CG 3.48Å; E867-K871 PolarHBondContact O-N 3.21Å; L868-K871 CarbonylContact O-C 3.59Å; V869-K871 VanDerWaalsContact C-N 3.34Å; K871-E874 WeakPolarHBondContact CD-OE2 3.18Å; K871-E874 IonicContact NZ-OE1 3.65Å; K871-E874 PolarHBondContact NZ-OE1 3.14Å; K871-E874 VanDerWaalsContact NZ-OE1 3.09Å; K871-E874 IonicContact NZ-OE2 3.63Å; K871-E874 PolarHBondContact NZ-OE2 2.7Å; K871-L875 WeakPolarHBondContact O-CA 3.19Å; K871-L875 WeakPolarHBondContact O-CB 3.25Å; K871-L875 PolarHBondContact O-N 3.16Å
872	D	74.2	Confident	72.9	Confident	76 Å²	76	99.1 Å²	99.1	41%	0.406	50%	0.495	S	S	.	.	H	α-helix	trans	-84.2	-27.9	171.5	-164.7	59	0	0	0	111.7	L868 V869 L875 N876	L868-D872 VanDerWaalsContact O-CB 3.28Å; L868-D872 WeakPolarHBondContact O-CB 3.47Å; L868-D872 PolarHBondContact O-N 2.68Å; V869-D872 PolarHBondContact O-N 3.12Å; D872-L875 PolarHBondContact O-N 3.37Å; D872-N876 VanDerWaalsContact O-CB 3.24Å; D872-N876 WeakPolarHBondContact O-CB 3.44Å; D872-N876 VanDerWaalsContact O-CG 3.3Å; D872-N876 PolarHBondContact O-N 3.33Å; D872-N876 PolarHBondContact O-ND2 3.39Å; D872-N876 PolarHBondContact OD2-ND2 2.99Å
873	Q	73.2	Confident	72.8	Confident	128 Å²	128	96.8 Å²	96.8	60%	0.598	50%	0.495	S	S	*	.	H	α-helix	trans	-68.6	-41.2	164.8	-72.4	175.5	14.9	0	0	111.3	V869 C870 S877	V869-Q873 WeakPolarHBondContact O-CB 3.35Å; V869-Q873 VanDerWaalsContact O-CG 3.24Å; V869-Q873 WeakPolarHBondContact O-CG 3.21Å; V869-Q873 PolarHBondContact O-N 3.1Å; C870-Q873 PolarHBondContact O-N 3.41Å; Q873-S877 VanDerWaalsContact O-CB 3.23Å; Q873-S877 WeakPolarHBondContact O-CB 3.33Å; Q873-S877 PolarHBondContact O-N 3.12Å; Q873-S877 PolarHBondContact O-OG 2.9Å
874	E	70.4	Confident	72.7	Confident	88 Å²	88	100.4 Å²	100.4	41%	0.411	50%	0.504	S	S	.	.	H	α-helix	trans	-62.6	-43.6	166.8	-78.2	179.4	-168.7	0	0	110.7	C870 K871 N876 S877 V878	C870-E874 WeakPolarHBondContact O-CB 3.49Å; C870-E874 WeakPolarHBondContact O-CG 3.37Å; C870-E874 PolarHBondContact O-N 3.22Å; K871-E874 WeakPolarHBondContact CD-OE2 3.18Å; K871-E874 IonicContact NZ-OE1 3.65Å; K871-E874 PolarHBondContact NZ-OE1 3.14Å; K871-E874 VanDerWaalsContact NZ-OE1 3.09Å; K871-E874 IonicContact NZ-OE2 3.63Å; K871-E874 PolarHBondContact NZ-OE2 2.7Å; E874-N876 PolarHBondContact O-N 3.41Å; E874-S877 WeakPolarHBondContact CA-OG 3.4Å; E874-S877 PolarHBondContact O-N 3.35Å; E874-S877 PolarHBondContact O-OG 3.15Å; E874-S877 VanDerWaalsContact O-OG 3.11Å; E874-V878 WeakPolarHBondContact O-CA 3.38Å; E874-V878 WeakPolarHBondContact O-CB 3.46Å; E874-V878 WeakPolarHBondContact O-CG2 3.4Å; E874-V878 PolarHBondContact O-N 3.5Å
875	L	72.4	Confident	72.4	Confident	87 Å²	87	100 Å²	100	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-69.3	-35.3	-179	-175.1	64.6	0	0	0	112	K871 D872 K879	K871-L875 WeakPolarHBondContact O-CA 3.19Å; K871-L875 WeakPolarHBondContact O-CB 3.25Å; K871-L875 PolarHBondContact O-N 3.16Å; D872-L875 PolarHBondContact O-N 3.37Å; L875-K879 VanDerWaalsContact O-CB 3.31Å; L875-K879 WeakPolarHBondContact O-CB 3.4Å; L875-K879 VanDerWaalsContact O-CG 3.23Å; L875-K879 WeakPolarHBondContact O-CG 3.31Å; L875-K879 PolarHBondContact O-N 3.15Å
876	N	73.7	Confident	72.1	Confident	61 Å²	61	96 Å²	96	33%	0.326	49%	0.489	S	S	.	.	H	α-helix	trans	-77.6	-39.1	175.7	-72.3	-50.4	0	0	0	111.7	D872 E874 K879 I880	D872-N876 VanDerWaalsContact O-CB 3.24Å; D872-N876 WeakPolarHBondContact O-CB 3.44Å; D872-N876 VanDerWaalsContact O-CG 3.3Å; D872-N876 PolarHBondContact O-N 3.33Å; D872-N876 PolarHBondContact O-ND2 3.39Å; D872-N876 PolarHBondContact OD2-ND2 2.99Å; E874-N876 PolarHBondContact O-N 3.41Å; N876-K879 PolarHBondContact O-N 3.33Å; N876-K879 PolarHBondContact OD1-NZ 3.08Å; N876-I880 WeakPolarHBondContact O-CB 3.45Å; N876-I880 WeakPolarHBondContact O-CD1 3.38Å; N876-I880 VanDerWaalsContact O-CG1 3.25Å; N876-I880 WeakPolarHBondContact O-CG1 3.39Å; N876-I880 PolarHBondContact O-N 3.14Å
877	S	72.5	Confident	71.9	Confident	65 Å²	65	95.5 Å²	95.5	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-66.6	-37.1	170.9	60.6	0	0	0	0	112	Q873 E874 I880 H881	Q873-S877 VanDerWaalsContact O-CB 3.23Å; Q873-S877 WeakPolarHBondContact O-CB 3.33Å; Q873-S877 PolarHBondContact O-N 3.12Å; Q873-S877 PolarHBondContact O-OG 2.9Å; E874-S877 WeakPolarHBondContact CA-OG 3.4Å; E874-S877 PolarHBondContact O-N 3.35Å; E874-S877 PolarHBondContact O-OG 3.15Å; E874-S877 VanDerWaalsContact O-OG 3.11Å; S877-I880 PolarHBondContact O-N 2.9Å; S877-H881 WeakPolarHBondContact O-CB 3.44Å; S877-H881 PolarHBondContact O-N 2.75Å
878	V	68.9	Low	71.6	Confident	80 Å²	80	95 Å²	95	49%	0.485	48%	0.482	S	S	.	.	H	α-helix	trans	-70.2	-34.3	170.8	170.1	0	0	0	0	111.5	E874 H881 L882	E874-V878 WeakPolarHBondContact O-CA 3.38Å; E874-V878 WeakPolarHBondContact O-CB 3.46Å; E874-V878 WeakPolarHBondContact O-CG2 3.4Å; E874-V878 PolarHBondContact O-N 3.5Å; V878-H881 PolarHBondContact O-N 3.25Å; V878-L882 WeakPolarHBondContact O-CA 3.41Å; V878-L882 WeakPolarHBondContact O-CB 3.3Å; V878-L882 PolarHBondContact O-N 3.01Å
879	K	73.4	Confident	71.2	Confident	106 Å²	106	93.5 Å²	93.5	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-45.4	169.1	-84.7	169.5	-175.2	162.7	0	111	L875 N876 H881 L882 N883	L875-K879 VanDerWaalsContact O-CB 3.31Å; L875-K879 WeakPolarHBondContact O-CB 3.4Å; L875-K879 VanDerWaalsContact O-CG 3.23Å; L875-K879 WeakPolarHBondContact O-CG 3.31Å; L875-K879 PolarHBondContact O-N 3.15Å; N876-K879 PolarHBondContact O-N 3.33Å; N876-K879 PolarHBondContact OD1-NZ 3.08Å; K879-H881 VanDerWaalsContact C-N 3.35Å; K879-L882 PolarHBondContact O-N 2.99Å; K879-N883 VanDerWaalsContact O-CB 3.27Å; K879-N883 WeakPolarHBondContact O-CB 3.4Å; K879-N883 PolarHBondContact O-N 2.93Å; K879-N883 PolarHBondContact O-ND2 2.99Å
880	I	74.4	Confident	70.8	Confident	104 Å²	104	97.1 Å²	97.1	53%	0.533	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-42.9	176.6	-69	163.5	0	0	0	110.3	N876 S877 R884	N876-I880 WeakPolarHBondContact O-CB 3.45Å; N876-I880 WeakPolarHBondContact O-CD1 3.38Å; N876-I880 VanDerWaalsContact O-CG1 3.25Å; N876-I880 WeakPolarHBondContact O-CG1 3.39Å; N876-I880 PolarHBondContact O-N 3.14Å; S877-I880 PolarHBondContact O-N 2.9Å; I880-R884 WeakPolarHBondContact O-CB 3.3Å; I880-R884 PolarHBondContact O-N 2.93Å
881	H	71	Confident	70.7	Confident	111 Å²	111	98.5 Å²	98.5	51%	0.514	48%	0.482	S	S	.	.	H	α-helix	trans	-72	-35.6	179.4	-158.2	-56.9	0	0	0	112.3	S877 V878 K879 R884 Q885	S877-H881 WeakPolarHBondContact O-CB 3.44Å; S877-H881 PolarHBondContact O-N 2.75Å; V878-H881 PolarHBondContact O-N 3.25Å; K879-H881 VanDerWaalsContact C-N 3.35Å; H881-R884 PolarHBondContact O-N 2.99Å; H881-Q885 WeakPolarHBondContact O-CB 3.39Å; H881-Q885 PolarHBondContact O-N 3Å
882	L	67.9	Low	70.3	Confident	95 Å²	95	99 Å²	99	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-76.3	-34.4	178	-173.8	68.3	0	0	0	111.2	V878 K879 Q885 S886	V878-L882 WeakPolarHBondContact O-CA 3.41Å; V878-L882 WeakPolarHBondContact O-CB 3.3Å; V878-L882 PolarHBondContact O-N 3.01Å; K879-L882 PolarHBondContact O-N 2.99Å; L882-Q885 PolarHBondContact O-N 3.01Å; L882-S886 WeakPolarHBondContact O-CB 3.13Å; L882-S886 PolarHBondContact O-N 3.44Å; L882-S886 PolarHBondContact O-OG 3.05Å
883	N	72.6	Confident	69.8	Low	120 Å²	120	101.3 Å²	101.3	64%	0.642	50%	0.495	S	S	*	.	H	α-helix	trans	-65	-45.9	167.9	-80	-23	0	0	0	110.8	K879 Q885 S886 Q887	K879-N883 VanDerWaalsContact O-CB 3.27Å; K879-N883 WeakPolarHBondContact O-CB 3.4Å; K879-N883 PolarHBondContact O-N 2.93Å; K879-N883 PolarHBondContact O-ND2 2.99Å; N883-Q885 PolarHBondContact O-N 3.06Å; N883-S886 PolarHBondContact O-N 3.23Å; N883-Q887 PolarHBondContact O-N 3.04Å
884	R	71.7	Confident	69.2	Low	178 Å²	178	102.5 Å²	102.5	67%	0.672	50%	0.5	S	S	*	.	H	α-helix	trans	-60.4	-42.8	172.3	-83.3	-178.3	165.7	165.5	-2.5	112.5	I880 H881 Q887 M888	I880-R884 WeakPolarHBondContact O-CB 3.3Å; I880-R884 PolarHBondContact O-N 2.93Å; H881-R884 PolarHBondContact O-N 2.99Å; R884-Q887 WeakPolarHBondContact O-CB 3.2Å; R884-Q887 PolarHBondContact O-N 3.47Å; R884-M888 WeakPolarHBondContact O-CG 3.09Å; R884-M888 PolarHBondContact O-N 3.14Å
885	Q	65	Low	68.9	Low	86 Å²	86	101.1 Å²	101.1	40%	0.402	50%	0.504	S	S	.	.	H	α-helix	trans	-74.5	-31.3	-178.1	-170.2	172.7	16.8	0	0	112.3	H881 L882 N883 Q887 M888 L889	H881-Q885 WeakPolarHBondContact O-CB 3.39Å; H881-Q885 PolarHBondContact O-N 3Å; L882-Q885 PolarHBondContact O-N 3.01Å; N883-Q885 PolarHBondContact O-N 3.06Å; Q885-Q887 VanDerWaalsContact C-N 3.27Å; Q885-M888 HydrophobicContact CB-CE 4.47Å; Q885-M888 PolarHBondContact O-N 2.9Å; Q885-L889 HydrophobicContact CG-CD1 4.08Å; Q885-L889 HydrophobicContact CG-CG 4.43Å; Q885-L889 WeakPolarHBondContact O-CB 3.33Å; Q885-L889 VanDerWaalsContact O-CG 3.31Å; Q885-L889 WeakPolarHBondContact O-CG 3.4Å; Q885-L889 PolarHBondContact O-N 3.31Å
886	S	68.8	Low	68.2	Low	49 Å²	49	100 Å²	100	34%	0.343	50%	0.498	S	S	.	.	H	α-helix	trans	-74	-18.8	170.6	-58.8	0	0	0	0	112.5	L882 N883 R890	L882-S886 WeakPolarHBondContact O-CB 3.13Å; L882-S886 PolarHBondContact O-N 3.44Å; L882-S886 PolarHBondContact O-OG 3.05Å; N883-S886 PolarHBondContact O-N 3.23Å; S886-R890 WeakPolarHBondContact O-CG 3.49Å; S886-R890 PolarHBondContact O-NE 3.4Å
887	Q	72.1	Confident	67.5	Low	92 Å²	92	105.8 Å²	105.8	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-76.9	-58.3	164.5	-159.7	61.6	23.7	0	0	110.2	N883 R884 Q885 L889 R890 D891	N883-Q887 PolarHBondContact O-N 3.04Å; R884-Q887 WeakPolarHBondContact O-CB 3.2Å; R884-Q887 PolarHBondContact O-N 3.47Å; Q885-Q887 VanDerWaalsContact C-N 3.27Å; Q887-L889 VanDerWaalsContact C-N 3.27Å; Q887-L889 PolarHBondContact O-N 3.34Å; Q887-L889 VanDerWaalsContact O-N 3.16Å; Q887-R890 WeakPolarHBondContact O-CA 3.3Å; Q887-R890 WeakPolarHBondContact O-CB 3.49Å; Q887-R890 PolarHBondContact O-N 3.26Å; Q887-D891 PolarHBondContact O-N 3.05Å; Q887-D891 VanDerWaalsContact O-N 3.12Å
888	M	67.7	Low	66.9	Low	101 Å²	101	107 Å²	107	50%	0.498	52%	0.524	S	S	.	.	H	α-helix	trans	-57.1	-34.3	-179.6	-67.7	-172.6	-56.5	0	0	113.8	R884 Q885 R890 D891 Q892	R884-M888 WeakPolarHBondContact O-CG 3.09Å; R884-M888 PolarHBondContact O-N 3.14Å; Q885-M888 HydrophobicContact CB-CE 4.47Å; Q885-M888 PolarHBondContact O-N 2.9Å; M888-R890 VanDerWaalsContact C-N 3.33Å; M888-R890 PolarHBondContact O-N 2.87Å; M888-D891 PolarHBondContact O-N 3.44Å; M888-Q892 WeakPolarHBondContact O-CB 3.24Å; M888-Q892 PolarHBondContact O-N 3.34Å
889	L	64.5	Low	66.5	Low	88 Å²	88	106 Å²	106	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-70	-27.1	176.1	-82.5	167.6	0	0	0	113.2	Q885 Q887 Q893	Q885-L889 HydrophobicContact CG-CD1 4.08Å; Q885-L889 HydrophobicContact CG-CG 4.43Å; Q885-L889 WeakPolarHBondContact O-CB 3.33Å; Q885-L889 VanDerWaalsContact O-CG 3.31Å; Q885-L889 WeakPolarHBondContact O-CG 3.4Å; Q885-L889 PolarHBondContact O-N 3.31Å; Q887-L889 VanDerWaalsContact C-N 3.27Å; Q887-L889 PolarHBondContact O-N 3.34Å; Q887-L889 VanDerWaalsContact O-N 3.16Å; L889-Q893 WeakPolarHBondContact O-CB 3.04Å; L889-Q893 WeakPolarHBondContact O-CG 3.49Å; L889-Q893 PolarHBondContact O-N 2.94Å; L889-Q893 VanDerWaalsContact O-N 3.11Å
890	R	68.5	Low	65.6	Low	157 Å²	157	110.2 Å²	110.2	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-71.7	-49.8	170.7	-73	-178.1	-78.4	-160.7	4.7	109.4	S886 Q887 M888 Q892 Q893 E894	S886-R890 WeakPolarHBondContact O-CG 3.49Å; S886-R890 PolarHBondContact O-NE 3.4Å; Q887-R890 WeakPolarHBondContact O-CA 3.3Å; Q887-R890 WeakPolarHBondContact O-CB 3.49Å; Q887-R890 PolarHBondContact O-N 3.26Å; M888-R890 VanDerWaalsContact C-N 3.33Å; M888-R890 PolarHBondContact O-N 2.87Å; R890-Q892 VanDerWaalsContact C-N 3.29Å; R890-Q892 PolarHBondContact O-N 3.43Å; R890-Q893 PolarHBondContact O-N 3.4Å; R890-E894 PolarHBondContact O-N 2.87Å
891	D	68.8	Low	64.7	Low	90 Å²	90	116.1 Å²	116.1	48%	0.481	55%	0.552	S	S	.	*	H	α-helix	trans	-59.7	-38.2	178.1	-49	-31.8	0	0	0	112	Q887 M888 E894 A895	Q887-D891 PolarHBondContact O-N 3.05Å; Q887-D891 VanDerWaalsContact O-N 3.12Å; M888-D891 PolarHBondContact O-N 3.44Å; D891-E894 WeakPolarHBondContact O-CB 3.23Å; D891-A895 PolarHBondContact O-N 2.92Å
892	Q	64.2	Low	64.2	Low	118 Å²	118	117.4 Å²	117.4	55%	0.551	56%	0.562	S	S	*	*	H	α-helix	trans	-79.8	-30.3	-178.8	-169.7	172	7	0	0	113.5	M888 R890 E894 A895 D896	M888-Q892 WeakPolarHBondContact O-CB 3.24Å; M888-Q892 PolarHBondContact O-N 3.34Å; R890-Q892 VanDerWaalsContact C-N 3.29Å; R890-Q892 PolarHBondContact O-N 3.43Å; Q892-E894 VanDerWaalsContact C-N 3.26Å; Q892-E894 PolarHBondContact O-N 2.96Å; Q892-A895 PolarHBondContact O-N 3.4Å; Q892-D896 WeakPolarHBondContact O-CB 3.35Å; Q892-D896 PolarHBondContact O-N 2.71Å
893	Q	63.8	Low	63.6	Low	124 Å²	124	117.3 Å²	117.3	58%	0.579	58%	0.575	S	S	*	*	H	α-helix	trans	-67.9	-26.3	171.7	-83.2	-167.3	6.8	0	0	112.9	L889 R890 R897	L889-Q893 WeakPolarHBondContact O-CB 3.04Å; L889-Q893 WeakPolarHBondContact O-CG 3.49Å; L889-Q893 PolarHBondContact O-N 2.94Å; L889-Q893 VanDerWaalsContact O-N 3.11Å; R890-Q893 PolarHBondContact O-N 3.4Å; Q893-R897 WeakPolarHBondContact O-CD 3.24Å; Q893-R897 WeakPolarHBondContact O-CG 3.37Å; Q893-R897 PolarHBondContact O-NE 2.98Å
894	E	60.8	Low	62.3	Low	152 Å²	152	120.2 Å²	120.2	71%	0.71	59%	0.585	S	S	*	*	H	α-helix	trans	-67.8	-45.3	170.4	-149.2	85.2	-114.2	0	0	110.3	R890 D891 Q892	R890-E894 PolarHBondContact O-N 2.87Å; D891-E894 WeakPolarHBondContact O-CB 3.23Å; Q892-E894 VanDerWaalsContact C-N 3.26Å; Q892-E894 PolarHBondContact O-N 2.96Å
895	A	63.6	Low	60.9	Low	60 Å²	60	119.1 Å²	119.1	50%	0.496	59%	0.592	S	S	.	*	H	α-helix	trans	-74.7	-45.5	-175.1	0	0	0	0	0	114.8	D891 Q892 R897 S898	D891-A895 PolarHBondContact O-N 2.92Å; Q892-A895 PolarHBondContact O-N 3.4Å; A895-R897 PolarHBondContact O-N 3.04Å; A895-R897 VanDerWaalsContact O-N 3.15Å; A895-S898 VanDerWaalsContact O-CB 3.29Å; A895-S898 WeakPolarHBondContact O-CB 3.42Å; A895-S898 PolarHBondContact O-N 2.69Å
896	D	57.9	Low	59.9	Low	63 Å²	63	120.8 Å²	120.8	34%	0.337	61%	0.613	S	S	.	*	H	α-helix	trans	-67.7	-21.8	-169.4	-149.1	58.4	0	0	0	112.9	Q892 S898 A899 R900	Q892-D896 WeakPolarHBondContact O-CB 3.35Å; Q892-D896 PolarHBondContact O-N 2.71Å; D896-S898 PolarHBondContact O-N 2.81Å; D896-A899 PolarHBondContact O-N 3.49Å; D896-R900 IonicContact OD2-CZ 3.51Å; D896-R900 IonicContact OD2-NE 3.76Å; D896-R900 PolarHBondContact OD2-NE 2.77Å; D896-R900 IonicContact OD2-NH2 2.66Å; D896-R900 PolarHBondContact OD2-NH2 3.29Å
897	R	59.5	Low	58.5	Low	182 Å²	182	126.6 Å²	126.6	69%	0.687	64%	0.639	S	S	*	*	H	α-helix	trans	-64.8	-23.5	170.9	-67.2	176.4	-174.2	-175.1	4.1	113.3	Q893 A895	Q893-R897 WeakPolarHBondContact O-CD 3.24Å; Q893-R897 WeakPolarHBondContact O-CG 3.37Å; Q893-R897 PolarHBondContact O-NE 2.98Å; A895-R897 PolarHBondContact O-N 3.04Å; A895-R897 VanDerWaalsContact O-N 3.15Å
898	S	60.4	Low	57.2	Low	92 Å²	92	127.6 Å²	127.6	64%	0.643	66%	0.657	S	S	*	*	H	α-helix	trans	-83	-30.8	-179.9	-166.4	0	0	0	0	112.9	A895 D896	A895-S898 VanDerWaalsContact O-CB 3.29Å; A895-S898 WeakPolarHBondContact O-CB 3.42Å; A895-S898 PolarHBondContact O-N 2.69Å; D896-S898 PolarHBondContact O-N 2.81Å
899	A	58.8	Low	56.3	Low	57 Å²	57	129.1 Å²	129.1	47%	0.471	67%	0.667	S	S	.	*	H	α-helix	trans	-86.1	-37.9	-165.9	0	0	0	0	0	114.5	D896 R901	D896-A899 PolarHBondContact O-N 3.49Å; A899-R901 PolarHBondContact O-N 3.39Å
900	R	55.2	Low	56.4	Low	195 Å²	195	131 Å²	131	74%	0.736	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-3.5	-168.4	-61.4	-172.1	-168	-167.6	1.5	115.9	D896 I902	D896-R900 IonicContact OD2-CZ 3.51Å; D896-R900 IonicContact OD2-NE 3.76Å; D896-R900 PolarHBondContact OD2-NE 2.77Å; D896-R900 IonicContact OD2-NH2 2.66Å; D896-R900 PolarHBondContact OD2-NH2 3.29Å; R900-I902 VanDerWaalsContact C-N 3.29Å; R900-I902 PolarHBondContact O-N 3.41Å
901	R	56.6	Low	56.2	Low	228 Å²	228	132 Å²	132	86%	0.86	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	9.2	-179.3	-75.1	-176.4	168.8	179.1	-2.7	114.8	A899	A899-R901 PolarHBondContact O-N 3.39Å
902	I	59.2	Low	55.6	Low	139 Å²	139	136.6 Å²	136.6	71%	0.713	71%	0.709	S	S	*	*	S	Bend	trans	-125	-11.8	-154.9	-61.3	179.3	0	0	0	115.2	R900	R900-I902 VanDerWaalsContact C-N 3.29Å; R900-I902 PolarHBondContact O-N 3.41Å
903	A	54.9	Low	56	Low	93 Å²	93	135.2 Å²	135.2	77%	0.769	72%	0.717	S	S	*	*			trans	-146.6	73.8	-159.3	0	0	0	0	0	117.4
904	E	46.2	Very low	56.7	Low	181 Å²	181	140.3 Å²	140.3	85%	0.846	73%	0.731	S	S	*	*			trans	-123.5	10.1	-172.2	-64.1	-170.4	116.3	0	0	118.3
905	D	43.3	Very low	57.1	Low	155 Å²	155	137.4 Å²	137.4	83%	0.829	73%	0.733	S	S	*	*			trans	-125.9	124.2	-164.8	-62.2	-67.8	0	0	0	120.6
906	S	42.2	Very low	57.4	Low	121 Å²	121	142.1 Å²	142.1	85%	0.846	75%	0.747	S	S	*	*			trans	92.6	157.1	147.5	76.3	0	0	0	0	125.9
907	L	40.7	Very low	58.2	Low	170 Å²	170	145.4 Å²	145.4	89%	0.89	76%	0.764	S	S	*	*			trans	-159.8	178	-161.8	-78.1	179.5	0	0	0	113
908	S	45.2	Very low	58.9	Low	114 Å²	114	144.7 Å²	144.7	80%	0.797	77%	0.768	S	S	*	*			cis	-171.9	176.6	-5.7	42.8	0	0	0	0	112.9
909	D	48.1	Very low	59.4	Low	133 Å²	133	146.4 Å²	146.4	71%	0.711	77%	0.769	S	S	*	*			trans	-142.4	162.4	175	-179.9	32.1	0	0	0	114.1
910	V	66.8	Low	60.2	Low	127 Å²	127	150.3 Å²	150.3	77%	0.77	78%	0.777	S	S	*	*			trans	-148.3	-59.5	-174.6	-167.3	0	0	0	0	120.3	K912	V910-K912 PolarHBondContact O-N 2.89Å; V910-K912 VanDerWaalsContact O-N 3.08Å
911	E	63.4	Low	61.1	Low	177 Å²	177	147.7 Å²	147.7	83%	0.827	78%	0.775	S	S	*	*				-72.1	-4.4	-125.6	-59.1	-175.7	122.3	0	0	123	A913	E911-A913 PolarHBondContact O-N 3.35Å
912	K	57.6	Low	62.1	Low	188 Å²	188	144.9 Å²	144.9	82%	0.817	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-6.8	-153.1	-72	163	-175.1	138.5	0	119.3	V910	V910-K912 PolarHBondContact O-N 2.89Å; V910-K912 VanDerWaalsContact O-N 3.08Å
913	A	72.4	Confident	62.7	Low	88 Å²	88	145 Å²	145	73%	0.727	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-15	-159.8	0	0	0	0	0	117.8	E911	E911-A913 PolarHBondContact O-N 3.35Å
914	R	77.1	Confident	63.7	Low	232 Å²	232	145.2 Å²	145.2	88%	0.875	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-75.4	-30.1	-157.4	-173.3	173.1	173.8	178.2	-2.2	116.8	M916	R914-M916 PolarHBondContact O-N 3.14Å
915	A	69.7	Low	65.3	Low	90 Å²	90	141.9 Å²	141.9	74%	0.744	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-79.7	-10.2	-161.6	0	0	0	0	0	116.2
916	M	70	Confident	66.9	Low	160 Å²	160	140.2 Å²	140.2	79%	0.788	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-84.9	-25.8	-165.1	-142.7	174.7	-60.9	0	0	114.6	R914 E918	R914-M916 PolarHBondContact O-N 3.14Å; M916-E918 PolarHBondContact O-N 2.98Å
917	L	74.7	Confident	68.6	Low	132 Å²	132	141.2 Å²	141.2	69%	0.691	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-18.7	-168.2	-71.2	163.4	0	0	0	114.9	I919	L917-I919 PolarHBondContact O-N 2.88Å
918	E	75.1	Confident	70.4	Confident	166 Å²	166	137.7 Å²	137.7	78%	0.776	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-19.2	-166.4	-161.7	166.8	-135.9	0	0	113.8	M916	M916-E918 PolarHBondContact O-N 2.98Å
919	I	70.1	Confident	72	Confident	129 Å²	129	139.6 Å²	139.6	66%	0.662	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-38.7	-177.2	-63.9	176.4	0	0	0	111.8	L917 M921 K922	L917-I919 PolarHBondContact O-N 2.88Å; I919-M921 VanDerWaalsContact C-N 3.32Å; I919-M921 PolarHBondContact O-N 3.15Å; I919-K922 PolarHBondContact O-N 3.26Å
920	E	75.6	Confident	73.4	Confident	139 Å²	139	140.2 Å²	140.2	65%	0.65	69%	0.689	S	S	*	*	H	α-helix	trans	-63.9	-36.1	-173.6	-60.9	-170.1	131.8	0	0	112.4	K922 Q923	E920-K922 VanDerWaalsContact C-N 3.27Å; E920-K922 PolarHBondContact O-N 3.35Å; E920-Q923 PolarHBondContact O-N 2.92Å; E920-Q923 VanDerWaalsContact O-N 3.16Å
921	M	74.9	Confident	73.9	Confident	139 Å²	139	136.6 Å²	136.6	69%	0.685	66%	0.663	S	S	*	*	H	α-helix	trans	-62.2	-30	-174.2	-167.8	156.2	73.1	0	0	113.6	I919 Q923 L924	I919-M921 VanDerWaalsContact C-N 3.32Å; I919-M921 PolarHBondContact O-N 3.15Å; M921-Q923 PolarHBondContact O-N 2.94Å; M921-L924 PolarHBondContact O-N 2.91Å
922	K	76.1	Confident	74.7	Confident	169 Å²	169	131.8 Å²	131.8	74%	0.735	64%	0.643	S	S	*	*	H	α-helix	trans	-71.5	-27.7	179.2	-72.9	-178.3	179	173.3	0	113.5	I919 E920 L924	I919-K922 PolarHBondContact O-N 3.26Å; E920-K922 VanDerWaalsContact C-N 3.27Å; E920-K922 PolarHBondContact O-N 3.35Å; K922-L924 VanDerWaalsContact C-N 3.35Å
923	Q	73.6	Confident	75.6	Confident	143 Å²	143	127.2 Å²	127.2	67%	0.668	63%	0.63	S	S	*	*	H	α-helix	trans	-84	-8.7	179.9	-65.4	-170.7	-2.2	0	0	113.9	E920 M921 R927	E920-Q923 PolarHBondContact O-N 2.92Å; E920-Q923 VanDerWaalsContact O-N 3.16Å; M921-Q923 PolarHBondContact O-N 2.94Å; Q923-R927 PolarHBondContact O-NH2 2.68Å; Q923-R927 VanDerWaalsContact O-NH2 3.11Å
924	L	74.8	Confident	75.9	Confident	96 Å²	96	124.2 Å²	124.2	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-80.1	-48.7	174.8	-137.5	79.8	0	0	0	111.1	M921 K922 N926 R927	M921-L924 PolarHBondContact O-N 2.91Å; K922-L924 VanDerWaalsContact C-N 3.35Å; L924-N926 VanDerWaalsContact C-N 3.26Å; L924-N926 PolarHBondContact O-N 3.43Å; L924-N926 VanDerWaalsContact O-N 3.14Å; L924-R927 PolarHBondContact O-N 2.96Å
925	I	80.8	Confident	76	Confident	111 Å²	111	114.7 Å²	114.7	57%	0.569	57%	0.574	S	S	*	*	H	α-helix	trans	-56	-37.1	-170.5	-63.6	168.5	0	0	0	112.8	R927	I925-R927 PolarHBondContact O-N 2.48Å
926	N	76.4	Confident	76.4	Confident	121 Å²	121	115.4 Å²	115.4	65%	0.647	56%	0.562	S	S	*	*	H	α-helix	trans	-77.2	-21.7	-172	-143	38	0	0	0	114	L924	L924-N926 VanDerWaalsContact C-N 3.26Å; L924-N926 PolarHBondContact O-N 3.43Å; L924-N926 VanDerWaalsContact O-N 3.14Å
927	R	77.2	Confident	76.8	Confident	141 Å²	141	110.1 Å²	110.1	53%	0.532	54%	0.543	S	S	.	.	H	α-helix	trans	-74.1	-48.5	176.2	-94	174.4	-75.1	158.9	-2.5	111.7	Q923 L924 I925 K929 Q930 E931	Q923-R927 PolarHBondContact O-NH2 2.68Å; Q923-R927 VanDerWaalsContact O-NH2 3.11Å; L924-R927 PolarHBondContact O-N 2.96Å; I925-R927 PolarHBondContact O-N 2.48Å; R927-K929 PolarHBondContact O-N 3.39Å; R927-Q930 PolarHBondContact O-N 3.3Å; R927-E931 PolarHBondContact O-N 2.94Å
928	H	78.2	Confident	76.9	Confident	97 Å²	97	106.9 Å²	106.9	45%	0.449	53%	0.529	S	S	.	.	H	α-helix	trans	-55.2	-24.2	179	-68.3	-40.7	0	0	0	113.9	E931 I932	H928-E931 WeakPolarHBondContact CA-OE2 3.29Å; H928-E931 IonicContact CE1-OE2 3.14Å; H928-E931 IonicContact CG-OE2 3.21Å; H928-E931 IonicContact ND1-OE2 2.7Å; H928-E931 PolarHBondContact ND1-OE2 3.44Å; H928-I932 WeakPolarHBondContact O-CD1 3.19Å; H928-I932 WeakPolarHBondContact O-CG1 3.4Å; H928-I932 PolarHBondContact O-N 3.12Å; H928-I932 VanDerWaalsContact O-N 3.15Å
929	K	80	Confident	77.2	Confident	153 Å²	153	101.8 Å²	101.8	67%	0.665	51%	0.506	S	S	*	.	H	α-helix	trans	-70.6	-32.9	175.6	-104.5	-167	172	-167.7	0	114.9	R927	R927-K929 PolarHBondContact O-N 3.39Å
930	Q	77.3	Confident	77.6	Confident	146 Å²	146	98.1 Å²	98.1	68%	0.682	49%	0.488	S	S	*	.	H	α-helix	trans	-82.7	-37.4	179	-63.9	-177.4	-57.2	0	0	111.1	R927 T933 G934	R927-Q930 PolarHBondContact O-N 3.3Å; Q930-T933 PolarHBondContact O-N 2.93Å; Q930-T933 PolarHBondContact O-OG1 3.42Å; Q930-G934 PolarHBondContact O-N 2.8Å
931	E	76.7	Confident	77.7	Confident	51 Å²	51	91.6 Å²	91.6	24%	0.238	46%	0.458	C	S	.	.	H	α-helix	trans	-48.5	-52.9	167.3	-97.8	163.7	-163.5	0	0	111.7	R927 H928 T933 G934 K935 D1118 S1120	R927-E931 PolarHBondContact O-N 2.94Å; H928-E931 WeakPolarHBondContact CA-OE2 3.29Å; H928-E931 IonicContact CE1-OE2 3.14Å; H928-E931 IonicContact CG-OE2 3.21Å; H928-E931 IonicContact ND1-OE2 2.7Å; H928-E931 PolarHBondContact ND1-OE2 3.44Å; E931-T933 PolarHBondContact O-N 3.09Å; E931-G934 PolarHBondContact O-N 3.05Å; E931-K935 PolarHBondContact O-N 2.79Å; E931-D1118 VanDerWaalsContact C-OD1 3.26Å; E931-D1118 WeakPolarHBondContact CB-OD1 3.48Å; E931-D1118 HydrophobicContact CG-CB 4.33Å; E931-S1120 VanDerWaalsContact CG-OG 3.31Å; E931-S1120 WeakPolarHBondContact CG-OG 3.41Å
932	I	80.1	Confident	77.9	Confident	76 Å²	76	89.5 Å²	89.5	39%	0.39	45%	0.449	S	S	.	.	H	α-helix	trans	-51.2	-50.6	176.9	-72.9	163.6	0	0	0	113.4	H928 G934 K935 E936	H928-I932 WeakPolarHBondContact O-CD1 3.19Å; H928-I932 WeakPolarHBondContact O-CG1 3.4Å; H928-I932 PolarHBondContact O-N 3.12Å; H928-I932 VanDerWaalsContact O-N 3.15Å; I932-G934 PolarHBondContact O-N 3.14Å; I932-K935 HydrophobicContact CG1-CD 4.37Å; I932-K935 WeakPolarHBondContact O-CB 3.4Å; I932-K935 PolarHBondContact O-N 3.44Å; I932-E936 PolarHBondContact O-N 3.37Å
933	T	76.7	Confident	78.2	Confident	92 Å²	92	87 Å²	87	56%	0.564	44%	0.438	S	S	*	.	H	α-helix	trans	-66.5	-22.2	-179	39.2	0	0	0	0	114.2	Q930 E931	Q930-T933 PolarHBondContact O-N 2.93Å; Q930-T933 PolarHBondContact O-OG1 3.42Å; E931-T933 PolarHBondContact O-N 3.09Å
934	G	78	Confident	78.5	Confident	26 Å²	26	84.1 Å²	84.1	27%	0.268	42%	0.424	S	S	.	.	H	α-helix	trans	-73.5	-42.5	172.4	0	0	0	0	0	112.2	Q930 E931 I932 E936 T938	Q930-G934 PolarHBondContact O-N 2.8Å; E931-G934 PolarHBondContact O-N 3.05Å; I932-G934 PolarHBondContact O-N 3.14Å; G934-E936 VanDerWaalsContact C-N 3.3Å; G934-E936 PolarHBondContact O-N 3.23Å; G934-T938 PolarHBondContact O-N 3.41Å; G934-T938 PolarHBondContact O-OG1 2.75Å; G934-T938 VanDerWaalsContact O-OG1 3.06Å
935	K	79.1	Confident	78.8	Confident	32 Å²	32	80.9 Å²	80.9	14%	0.139	41%	0.406	C	S	.	.	H	α-helix	trans	-58.5	-40.1	178.1	-62.3	149.2	125.3	157.6	0	112.8	E931 I932 A937 T938 I939 A1116 D1118	E931-K935 PolarHBondContact O-N 2.79Å; I932-K935 HydrophobicContact CG1-CD 4.37Å; I932-K935 WeakPolarHBondContact O-CB 3.4Å; I932-K935 PolarHBondContact O-N 3.44Å; K935-A937 PolarHBondContact O-N 2.69Å; K935-T938 CarbonylContact O-C 3.49Å; K935-T938 WeakPolarHBondContact O-CA 3.36Å; K935-T938 WeakPolarHBondContact O-CB 3.32Å; K935-T938 PolarHBondContact O-N 2.83Å; K935-I939 HydrophobicContact CB-CD1 4.29Å; K935-I939 WeakPolarHBondContact O-CD1 3.31Å; K935-I939 VanDerWaalsContact O-CG1 3.32Å; K935-I939 WeakPolarHBondContact O-CG1 3.43Å; K935-I939 PolarHBondContact O-N 3.02Å; K935-A1116 HydrophobicContact CB-CB 4.37Å; K935-A1116 HydrophobicContact CD-CB 4.26Å; K935-A1116 WeakPolarHBondContact CE-O 3.44Å; K935-A1116 HydrophobicContact CG-CB 4.43Å; K935-A1116 PolarHBondContact NZ-O 3.47Å; K935-D1118 WeakPolarHBondContact CD-OD1 3.49Å; K935-D1118 WeakPolarHBondContact CE-OD1 3.47Å; K935-D1118 WeakPolarHBondContact CE-OD2 3.29Å; K935-D1118 VanDerWaalsContact CG-OD1 3.28Å; K935-D1118 WeakPolarHBondContact CG-OD1 3.49Å; K935-D1118 VanDerWaalsContact NZ-CG 3.27Å; K935-D1118 IonicContact NZ-OD1 3.65Å; K935-D1118 PolarHBondContact NZ-OD1 2.92Å; K935-D1118 IonicContact NZ-OD2 3.65Å; K935-D1118 PolarHBondContact NZ-OD2 3.15Å
936	E	79.5	Confident	78.9	Confident	105 Å²	105	81 Å²	81	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-62.4	-45.2	-170.5	-72.8	172.7	148.1	0	0	111	I932 G934 T938 I939 D940	I932-E936 PolarHBondContact O-N 3.37Å; G934-E936 VanDerWaalsContact C-N 3.3Å; G934-E936 PolarHBondContact O-N 3.23Å; E936-T938 VanDerWaalsContact C-N 3.32Å; E936-T938 PolarHBondContact O-N 3.29Å; E936-I939 WeakPolarHBondContact O-CB 3.38Å; E936-I939 PolarHBondContact O-N 2.7Å; E936-D940 PolarHBondContact O-N 3.23Å; E936-D940 VanDerWaalsContact O-N 3.15Å
937	A	77.4	Confident	79.2	Confident	49 Å²	49	78.2 Å²	78.2	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-58.2	-43.3	168.8	0	0	0	0	0	111.8	K935 I939 D940 T941 S1102	K935-A937 PolarHBondContact O-N 2.69Å; A937-I939 PolarHBondContact O-N 2.69Å; A937-D940 PolarHBondContact O-N 3.47Å; A937-T941 PolarHBondContact O-N 2.92Å; A937-T941 VanDerWaalsContact O-N 3.15Å; A937-T941 PolarHBondContact O-OG1 2.93Å; A937-S1102 WeakPolarHBondContact O-CB 3.48Å
938	T	77.7	Confident	79.5	Confident	63 Å²	63	74.4 Å²	74.4	39%	0.387	39%	0.387	S	S	.	.	H	α-helix	trans	-68.1	-13.6	177.3	-30.5	0	0	0	0	114.2	G934 K935 E936 T941 L942	G934-T938 PolarHBondContact O-N 3.41Å; G934-T938 PolarHBondContact O-OG1 2.75Å; G934-T938 VanDerWaalsContact O-OG1 3.06Å; K935-T938 CarbonylContact O-C 3.49Å; K935-T938 WeakPolarHBondContact O-CA 3.36Å; K935-T938 WeakPolarHBondContact O-CB 3.32Å; K935-T938 PolarHBondContact O-N 2.83Å; E936-T938 VanDerWaalsContact C-N 3.32Å; E936-T938 PolarHBondContact O-N 3.29Å; T938-T941 WeakPolarHBondContact CA-OG1 3.39Å; T938-T941 WeakPolarHBondContact O-CB 3.43Å; T938-T941 PolarHBondContact O-OG1 2.78Å; T938-L942 WeakPolarHBondContact O-CD1 3.48Å; T938-L942 WeakPolarHBondContact O-CG 3.4Å
939	I	79.9	Confident	79.5	Confident	60 Å²	60	73 Å²	73	31%	0.308	38%	0.378	S	S	.	.	H	α-helix	trans	-87.9	-36.2	175	-71.9	156.8	0	0	0	110.6	K935 E936 A937 T941 L942 K943 A1116	K935-I939 HydrophobicContact CB-CD1 4.29Å; K935-I939 WeakPolarHBondContact O-CD1 3.31Å; K935-I939 VanDerWaalsContact O-CG1 3.32Å; K935-I939 WeakPolarHBondContact O-CG1 3.43Å; K935-I939 PolarHBondContact O-N 3.02Å; E936-I939 WeakPolarHBondContact O-CB 3.38Å; E936-I939 PolarHBondContact O-N 2.7Å; A937-I939 PolarHBondContact O-N 2.69Å; I939-T941 PolarHBondContact O-N 3.4Å; I939-L942 PolarHBondContact O-N 2.94Å; I939-K943 PolarHBondContact O-N 3.08Å; I939-A1116 HydrophobicContact CD1-CB 3.81Å
940	D	79.4	Confident	79.7	Confident	51 Å²	51	70.6 Å²	70.6	27%	0.273	37%	0.372	S	S	.	.	H	α-helix	trans	-69	-21.3	171.5	-68.9	-32.6	0	0	0	111.6	E936 A937 K943	E936-D940 PolarHBondContact O-N 3.23Å; E936-D940 VanDerWaalsContact O-N 3.15Å; A937-D940 PolarHBondContact O-N 3.47Å; D940-K943 WeakPolarHBondContact OD1-CE 3.32Å; D940-K943 IonicContact OD1-NZ 3.62Å; D940-K943 PolarHBondContact OD1-NZ 2.73Å
941	T	77.8	Confident	79.9	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.012	37%	0.368	C	S	.	.	H	α-helix	trans	-55.8	-61.3	157.2	-14.5	0	0	0	0	110.3	A937 T938 I939 K943 E944 H1098 S1102	A937-T941 PolarHBondContact O-N 2.92Å; A937-T941 VanDerWaalsContact O-N 3.15Å; A937-T941 PolarHBondContact O-OG1 2.93Å; T938-T941 WeakPolarHBondContact CA-OG1 3.39Å; T938-T941 WeakPolarHBondContact O-CB 3.43Å; T938-T941 PolarHBondContact O-OG1 2.78Å; I939-T941 PolarHBondContact O-N 3.4Å; T941-K943 PolarHBondContact O-N 3.36Å; T941-K943 VanDerWaalsContact O-N 3.09Å; T941-E944 PolarHBondContact O-N 2.91Å; T941-H1098 VanDerWaalsContact CB-CE1 3.42Å; T941-H1098 WeakPolarHBondContact CB-CE1 3Å; T941-H1098 WeakPolarHBondContact CB-NE2 3.5Å; T941-H1098 HydrophobicContact CG2-CB 4.07Å; T941-H1098 WeakPolarHBondContact CG2-CD2 3.37Å; T941-H1098 WeakPolarHBondContact CG2-CE1 3.13Å; T941-H1098 VanDerWaalsContact CG2-ND1 3.34Å; T941-H1098 WeakPolarHBondContact CG2-ND1 3.35Å; T941-H1098 WeakPolarHBondContact CG2-NE2 3.22Å; T941-H1098 WeakPolarHBondContact CG2-O 3.49Å; T941-H1098 PolarHBondContact O-CD2 3.33Å; T941-H1098 PolarHBondContact O-NE2 2.84Å; T941-S1102 WeakPolarHBondContact CB-OG 3.27Å; T941-S1102 WeakPolarHBondContact CG2-OG 3.47Å; T941-S1102 WeakPolarHBondContact OG1-CB 3.29Å; T941-S1102 PolarHBondContact OG1-OG 2.96Å
942	L	80.1	Confident	80.1	Confident	96 Å²	96	71.1 Å²	71.1	50%	0.503	38%	0.375	S	S	.	.	H	α-helix	trans	-54.7	-40.7	-158	-79.3	161.5	0	0	0	112	T938 I939 E944 E946 H1098	T938-L942 WeakPolarHBondContact O-CD1 3.48Å; T938-L942 WeakPolarHBondContact O-CG 3.4Å; I939-L942 PolarHBondContact O-N 2.94Å; L942-E944 PolarHBondContact O-N 3.22Å; L942-E946 WeakPolarHBondContact O-CB 3.44Å; L942-E946 PolarHBondContact O-N 2.69Å; L942-E946 VanDerWaalsContact O-N 3.12Å; L942-H1098 WeakPolarHBondContact CA-NE2 3.48Å; L942-H1098 PolarHBondContact N-NE2 3.01Å
943	K	81.9	Confident	80.1	Confident	116 Å²	116	71.4 Å²	71.4	50%	0.504	38%	0.376	S	S	.	.	H	α-helix	trans	-56.3	-39.3	175.8	-61.7	166.8	-172.3	170	0	114.4	I939 D940 T941 E946 A947	I939-K943 PolarHBondContact O-N 3.08Å; D940-K943 WeakPolarHBondContact OD1-CE 3.32Å; D940-K943 IonicContact OD1-NZ 3.62Å; D940-K943 PolarHBondContact OD1-NZ 2.73Å; T941-K943 PolarHBondContact O-N 3.36Å; T941-K943 VanDerWaalsContact O-N 3.09Å; K943-E946 WeakPolarHBondContact O-CB 3.45Å; K943-E946 PolarHBondContact O-N 2.93Å; K943-A947 PolarHBondContact O-N 3.16Å
944	E	79.6	Confident	80.4	Confident	82 Å²	82	71.1 Å²	71.1	38%	0.383	37%	0.369	S	S	.	.	H	α-helix	trans	-83.8	-29.4	-169.3	-148.8	165	179.7	0	0	113.1	T941 L942 M948 L1101 C1105	T941-E944 PolarHBondContact O-N 2.91Å; L942-E944 PolarHBondContact O-N 3.22Å; E944-M948 PolarHBondContact O-N 3.1Å; E944-L1101 HydrophobicContact CB-CB 4.41Å; E944-L1101 HydrophobicContact CB-CD1 4.16Å; E944-L1101 HydrophobicContact CG-CD1 4.01Å; E944-C1105 PolarHBondContact OE2-SG 2.86Å
945	K	81.6	Confident	80.6	Confident	29 Å²	29	73.5 Å²	73.5	13%	0.126	38%	0.375	C	S	.	.	H	α-helix	trans	-62.9	-46	158.8	-111	178.9	-167.1	145.2	0	111.1	A947 M948 Y949 Q1094 Q1095 H1098	K945-A947 VanDerWaalsContact C-N 3.28Å; K945-A947 PolarHBondContact O-N 2.96Å; K945-M948 CarbonylContact O-C 3.4Å; K945-M948 WeakPolarHBondContact O-CA 3.39Å; K945-M948 PolarHBondContact O-N 2.93Å; K945-Y949 HydrophobicContact CB-CD2 4.21Å; K945-Y949 HydrophobicContact CB-CE2 4.2Å; K945-Y949 HydrophobicContact CD-CD2 4.49Å; K945-Y949 HydrophobicContact CD-CE2 3.7Å; K945-Y949 HydrophobicContact CG-CD2 4.4Å; K945-Y949 HydrophobicContact CG-CE2 3.95Å; K945-Y949 PolarHBondContact O-N 3.27Å; K945-Q1094 VanDerWaalsContact CE-C 3.47Å; K945-Q1094 VanDerWaalsContact CE-O 3.29Å; K945-Q1094 WeakPolarHBondContact CE-O 3.22Å; K945-Q1095 VanDerWaalsContact NZ-CG 3.34Å; K945-H1098 WeakPolarHBondContact CB-CD2 3.46Å; K945-H1098 HydrophobicContact CD-CB 3.84Å; K945-H1098 VanDerWaalsContact CD-CD2 3.45Å; K945-H1098 WeakPolarHBondContact CD-CD2 3.16Å; K945-H1098 VanDerWaalsContact CE-CB 3.41Å; K945-H1098 VanDerWaalsContact CE-CG 3.41Å; K945-H1098 HydrophobicContact CG-CB 3.84Å; K945-H1098 WeakPolarHBondContact CG-CD2 3.25Å; K945-H1098 VanDerWaalsContact NZ-CG 3.32Å; K945-H1098 PolarHBondContact NZ-ND1 3.13Å
946	E	82.5	Confident	80.5	Confident	114 Å²	114	77.8 Å²	77.8	53%	0.533	40%	0.399	S	S	.	.	H	α-helix	trans	-60.3	-42.8	-171.4	-175.3	170	-153	0	0	110	L942 K943 M948 Y949 L950	L942-E946 WeakPolarHBondContact O-CB 3.44Å; L942-E946 PolarHBondContact O-N 2.69Å; L942-E946 VanDerWaalsContact O-N 3.12Å; K943-E946 WeakPolarHBondContact O-CB 3.45Å; K943-E946 PolarHBondContact O-N 2.93Å; E946-M948 PolarHBondContact O-N 2.98Å; E946-Y949 PolarHBondContact O-N 3.02Å; E946-L950 HydrophobicContact CG-CD1 3.98Å; E946-L950 HydrophobicContact CG-CG 4.4Å; E946-L950 VanDerWaalsContact O-CB 3.29Å; E946-L950 WeakPolarHBondContact O-CB 3.24Å; E946-L950 WeakPolarHBondContact O-CG 3.25Å; E946-L950 PolarHBondContact O-N 3.49Å
947	A	83.1	Confident	80.6	Confident	61 Å²	61	79.6 Å²	79.6	50%	0.504	40%	0.401	S	S	.	.	H	α-helix	trans	-55.6	-45.3	169.8	0	0	0	0	0	113.4	K943 K945 K951	K943-A947 PolarHBondContact O-N 3.16Å; K945-A947 VanDerWaalsContact C-N 3.28Å; K945-A947 PolarHBondContact O-N 2.96Å; A947-K951 PolarHBondContact O-N 3.05Å; A947-K951 VanDerWaalsContact O-N 3.16Å
948	M	81.9	Confident	80.9	Confident	62 Å²	62	82 Å²	82	31%	0.305	40%	0.402	S	S	.	.	H	α-helix	trans	-69.1	-40.7	178.5	-173.5	176.4	61.4	0	0	112.8	E944 K945 E946 K951 N952 Q1094 L1097	E944-M948 PolarHBondContact O-N 3.1Å; K945-M948 CarbonylContact O-C 3.4Å; K945-M948 WeakPolarHBondContact O-CA 3.39Å; K945-M948 PolarHBondContact O-N 2.93Å; E946-M948 PolarHBondContact O-N 2.98Å; M948-K951 PolarHBondContact O-N 3.3Å; M948-N952 PolarHBondContact O-N 3.49Å; M948-N952 VanDerWaalsContact O-N 3.1Å; M948-N952 PolarHBondContact O-OD1 3.34Å; M948-Q1094 HydrophobicContact CE-CB 4.49Å; M948-Q1094 HydrophobicContact CE-CG 3.88Å; M948-L1097 HydrophobicContact CE-CD2 3.85Å; M948-L1097 HydrophobicContact SD-CD2 4.1Å
949	Y	79.7	Confident	80.9	Confident	67 Å²	67	81.8 Å²	81.8	26%	0.263	41%	0.407	S	S	.	.	H	α-helix	trans	-67.4	-41	175.8	-74.1	-38.6	0	0	0	112.2	K945 E946 K951 N952 I953 Q1094	K945-Y949 HydrophobicContact CB-CD2 4.21Å; K945-Y949 HydrophobicContact CB-CE2 4.2Å; K945-Y949 HydrophobicContact CD-CD2 4.49Å; K945-Y949 HydrophobicContact CD-CE2 3.7Å; K945-Y949 HydrophobicContact CG-CD2 4.4Å; K945-Y949 HydrophobicContact CG-CE2 3.95Å; K945-Y949 PolarHBondContact O-N 3.27Å; E946-Y949 PolarHBondContact O-N 3.02Å; Y949-K951 VanDerWaalsContact C-N 3.27Å; Y949-K951 PolarHBondContact O-N 3.31Å; Y949-N952 PolarHBondContact O-N 3.03Å; Y949-I953 WeakPolarHBondContact O-CB 3.47Å; Y949-I953 VanDerWaalsContact O-CG1 3.28Å; Y949-I953 WeakPolarHBondContact O-CG1 3.41Å; Y949-I953 PolarHBondContact O-N 2.61Å; Y949-Q1094 HydrophobicContact CE1-CG 4.35Å; Y949-Q1094 PolarHBondContact OH-OE1 3.46Å
950	L	83.1	Confident	80.9	Confident	103 Å²	103	84.6 Å²	84.6	54%	0.539	42%	0.419	S	S	.	.	H	α-helix	trans	-59.6	-39.7	175.2	-75	168.7	0	0	0	111.1	E946 I953 E954	E946-L950 HydrophobicContact CG-CD1 3.98Å; E946-L950 HydrophobicContact CG-CG 4.4Å; E946-L950 VanDerWaalsContact O-CB 3.29Å; E946-L950 WeakPolarHBondContact O-CB 3.24Å; E946-L950 WeakPolarHBondContact O-CG 3.25Å; E946-L950 PolarHBondContact O-N 3.49Å; L950-I953 PolarHBondContact O-N 2.79Å; L950-E954 VanDerWaalsContact O-CB 3.3Å; L950-E954 WeakPolarHBondContact O-CB 3.37Å; L950-E954 PolarHBondContact O-N 3.35Å
951	K	82.9	Confident	81	Confident	136 Å²	136	88.4 Å²	88.4	59%	0.591	44%	0.435	S	S	*	.	H	α-helix	trans	-61.8	-48.2	172.5	-171.6	-175.5	175.8	-172	0	112.2	A947 M948 Y949 I953 E954 D955	A947-K951 PolarHBondContact O-N 3.05Å; A947-K951 VanDerWaalsContact O-N 3.16Å; M948-K951 PolarHBondContact O-N 3.3Å; Y949-K951 VanDerWaalsContact C-N 3.27Å; Y949-K951 PolarHBondContact O-N 3.31Å; K951-I953 VanDerWaalsContact C-N 3.31Å; K951-I953 PolarHBondContact O-N 3.19Å; K951-E954 WeakPolarHBondContact O-CB 3.38Å; K951-E954 PolarHBondContact O-N 3.18Å; K951-D955 PolarHBondContact O-N 3.37Å
952	N	79.5	Confident	81	Confident	72 Å²	72	91.8 Å²	91.8	39%	0.385	46%	0.459	S	S	.	.	H	α-helix	trans	-63.4	-36.8	179.2	-68.9	0.9	0	0	0	112.3	M948 Y949 L956	M948-N952 PolarHBondContact O-N 3.49Å; M948-N952 VanDerWaalsContact O-N 3.1Å; M948-N952 PolarHBondContact O-OD1 3.34Å; Y949-N952 PolarHBondContact O-N 3.03Å; N952-L956 WeakPolarHBondContact O-CB 3.33Å; N952-L956 VanDerWaalsContact O-CG 3.3Å; N952-L956 WeakPolarHBondContact O-CG 3.36Å; N952-L956 PolarHBondContact O-N 3.44Å
953	I	81.2	Confident	80.7	Confident	81 Å²	81	92.7 Å²	92.7	42%	0.415	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-39.7	174.7	-70.7	164.7	0	0	0	111	Y949 L950 K951 L956 R957	Y949-I953 WeakPolarHBondContact O-CB 3.47Å; Y949-I953 VanDerWaalsContact O-CG1 3.28Å; Y949-I953 WeakPolarHBondContact O-CG1 3.41Å; Y949-I953 PolarHBondContact O-N 2.61Å; L950-I953 PolarHBondContact O-N 2.79Å; K951-I953 VanDerWaalsContact C-N 3.31Å; K951-I953 PolarHBondContact O-N 3.19Å; I953-L956 PolarHBondContact O-N 3.4Å; I953-R957 WeakPolarHBondContact O-CB 3.01Å; I953-R957 WeakPolarHBondContact O-CG 3.34Å; I953-R957 PolarHBondContact O-N 3.47Å
954	E	83.3	Confident	80.5	Confident	87 Å²	87	90.6 Å²	90.6	41%	0.407	46%	0.458	S	S	.	.	H	α-helix	trans	-67.1	-38.2	177.9	-179.8	56.1	-156.6	0	0	112.2	L950 K951 R957 K958	L950-E954 VanDerWaalsContact O-CB 3.3Å; L950-E954 WeakPolarHBondContact O-CB 3.37Å; L950-E954 PolarHBondContact O-N 3.35Å; K951-E954 WeakPolarHBondContact O-CB 3.38Å; K951-E954 PolarHBondContact O-N 3.18Å; E954-R957 PolarHBondContact O-N 3.01Å; E954-K958 WeakPolarHBondContact O-CE 3.33Å; E954-K958 WeakPolarHBondContact O-CG 3.04Å; E954-K958 PolarHBondContact O-N 3.09Å; E954-K958 WeakPolarHBondContact OE1-CE 2.81Å; E954-K958 IonicContact OE1-NZ 3.33Å
955	D	80.9	Confident	80.6	Confident	76 Å²	76	91.4 Å²	91.4	41%	0.406	47%	0.469	S	S	.	.	H	α-helix	trans	-73.9	-34.3	175.4	-66.8	-26.5	0	0	0	112.2	K951 K958 A959	K951-D955 PolarHBondContact O-N 3.37Å; D955-K958 PolarHBondContact O-N 3.23Å; D955-K958 IonicContact OD1-NZ 2.71Å; D955-K958 PolarHBondContact OD1-NZ 3.05Å; D955-A959 PolarHBondContact O-N 3.1Å
956	L	77	Confident	80.4	Confident	122 Å²	122	94.7 Å²	94.7	64%	0.639	49%	0.487	S	S	*	.	H	α-helix	trans	-65.7	-34.9	169.6	-75.5	169.9	0	0	0	112.9	N952 I953 A959 Q960	N952-L956 WeakPolarHBondContact O-CB 3.33Å; N952-L956 VanDerWaalsContact O-CG 3.3Å; N952-L956 WeakPolarHBondContact O-CG 3.36Å; N952-L956 PolarHBondContact O-N 3.44Å; I953-L956 PolarHBondContact O-N 3.4Å; L956-A959 PolarHBondContact O-N 3.48Å; L956-Q960 PolarHBondContact O-N 2.96Å
957	R	82.9	Confident	80.1	Confident	142 Å²	142	93.7 Å²	93.7	54%	0.536	49%	0.485	S	S	.	.	H	α-helix	trans	-63.3	-42.9	175.1	-83	173	172	-179.4	-2.8	112.5	I953 E954 A959 Q960 E961	I953-R957 WeakPolarHBondContact O-CB 3.01Å; I953-R957 WeakPolarHBondContact O-CG 3.34Å; I953-R957 PolarHBondContact O-N 3.47Å; E954-R957 PolarHBondContact O-N 3.01Å; R957-A959 VanDerWaalsContact C-N 3.3Å; R957-A959 PolarHBondContact O-N 3.3Å; R957-Q960 CarbonylContact O-C 3.59Å; R957-Q960 WeakPolarHBondContact O-CA 3.11Å; R957-Q960 WeakPolarHBondContact O-CB 3.49Å; R957-Q960 PolarHBondContact O-N 3.48Å; R957-Q960 VanDerWaalsContact O-N 3.1Å; R957-E961 PolarHBondContact O-N 3.42Å
958	K	82.9	Confident	79.9	Confident	99 Å²	99	96.1 Å²	96.1	43%	0.43	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-38.6	176.5	-64.7	161.7	-158.2	158.2	0	111.7	E954 D955 E961 S962	E954-K958 WeakPolarHBondContact O-CE 3.33Å; E954-K958 WeakPolarHBondContact O-CG 3.04Å; E954-K958 PolarHBondContact O-N 3.09Å; E954-K958 WeakPolarHBondContact OE1-CE 2.81Å; E954-K958 IonicContact OE1-NZ 3.33Å; D955-K958 PolarHBondContact O-N 3.23Å; D955-K958 IonicContact OD1-NZ 2.71Å; D955-K958 PolarHBondContact OD1-NZ 3.05Å; K958-E961 PolarHBondContact O-N 3.06Å; K958-S962 PolarHBondContact O-N 2.92Å
959	A	77.8	Confident	79.7	Confident	59 Å²	59	96.7 Å²	96.7	49%	0.488	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-40.9	172.5	0	0	0	0	0	112.1	D955 L956 R957 S962 L963	D955-A959 PolarHBondContact O-N 3.1Å; L956-A959 PolarHBondContact O-N 3.48Å; R957-A959 VanDerWaalsContact C-N 3.3Å; R957-A959 PolarHBondContact O-N 3.3Å; A959-S962 PolarHBondContact O-N 2.76Å; A959-L963 WeakPolarHBondContact O-CB 3.23Å; A959-L963 PolarHBondContact O-N 3.3Å
960	Q	79.1	Confident	79.4	Confident	120 Å²	120	96.4 Å²	96.4	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-40.7	174.7	-172.6	-175.5	0.4	0	0	112.5	L956 R957 L963 N964	L956-Q960 PolarHBondContact O-N 2.96Å; R957-Q960 CarbonylContact O-C 3.59Å; R957-Q960 WeakPolarHBondContact O-CA 3.11Å; R957-Q960 WeakPolarHBondContact O-CB 3.49Å; R957-Q960 PolarHBondContact O-N 3.48Å; R957-Q960 VanDerWaalsContact O-N 3.1Å; Q960-L963 PolarHBondContact O-N 3.21Å; Q960-N964 WeakPolarHBondContact O-CB 3.46Å; Q960-N964 PolarHBondContact O-N 3.48Å
961	E	81.6	Confident	78.9	Confident	131 Å²	131	95.1 Å²	95.1	61%	0.612	50%	0.501	S	S	*	.	H	α-helix	trans	-65.4	-42.8	176.5	-75	-174.5	140.3	0	0	111.7	R957 K958 L963 N964 V965	R957-E961 PolarHBondContact O-N 3.42Å; K958-E961 PolarHBondContact O-N 3.06Å; E961-L963 PolarHBondContact O-N 3.03Å; E961-N964 PolarHBondContact O-N 2.93Å; E961-V965 WeakPolarHBondContact O-CG2 3.31Å; E961-V965 PolarHBondContact O-N 2.83Å
962	S	78.6	Confident	78.7	Confident	73 Å²	73	94.8 Å²	94.8	51%	0.51	50%	0.5	S	S	.	.	H	α-helix	trans	-57.4	-49.7	172.6	-166.9	0	0	0	0	111.4	K958 A959 N964 V965 D966	K958-S962 PolarHBondContact O-N 2.92Å; A959-S962 PolarHBondContact O-N 2.76Å; S962-N964 VanDerWaalsContact C-N 3.3Å; S962-N964 PolarHBondContact O-N 3.31Å; S962-V965 PolarHBondContact O-N 3.23Å; S962-V965 VanDerWaalsContact O-N 3.13Å; S962-D966 PolarHBondContact O-N 2.87Å; S962-D966 VanDerWaalsContact O-N 3.11Å
963	L	73.3	Confident	78.5	Confident	115 Å²	115	96.5 Å²	96.5	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-34.5	-179.5	-164.5	72.2	0	0	0	112.3	A959 Q960 E961 D966 L967	A959-L963 WeakPolarHBondContact O-CB 3.23Å; A959-L963 PolarHBondContact O-N 3.3Å; Q960-L963 PolarHBondContact O-N 3.21Å; E961-L963 PolarHBondContact O-N 3.03Å; L963-D966 PolarHBondContact O-N 2.86Å; L963-L967 WeakPolarHBondContact O-CB 3.45Å; L963-L967 PolarHBondContact O-N 3.43Å
964	N	78.1	Confident	78	Confident	71 Å²	71	97.3 Å²	97.3	38%	0.38	51%	0.51	S	S	.	.	H	α-helix	trans	-66.5	-36.7	173.5	-85.1	-12.4	0	0	0	112.4	Q960 E961 S962 L967 E968	Q960-N964 WeakPolarHBondContact O-CB 3.46Å; Q960-N964 PolarHBondContact O-N 3.48Å; E961-N964 PolarHBondContact O-N 2.93Å; S962-N964 VanDerWaalsContact C-N 3.3Å; S962-N964 PolarHBondContact O-N 3.31Å; N964-L967 PolarHBondContact O-N 3.46Å; N964-E968 WeakPolarHBondContact O-CB 3.37Å; N964-E968 PolarHBondContact O-N 3.41Å
965	V	82	Confident	77.4	Confident	100 Å²	100	96.6 Å²	96.6	61%	0.606	52%	0.515	S	S	*	.	H	α-helix	trans	-65.6	-43.8	175.4	170.1	0	0	0	0	110.9	E961 S962 L967 E968 S969	E961-V965 WeakPolarHBondContact O-CG2 3.31Å; E961-V965 PolarHBondContact O-N 2.83Å; S962-V965 PolarHBondContact O-N 3.23Å; S962-V965 VanDerWaalsContact O-N 3.13Å; V965-L967 VanDerWaalsContact C-N 3.34Å; V965-E968 PolarHBondContact O-N 2.85Å; V965-S969 PolarHBondContact O-N 3.48Å
966	D	77.7	Confident	77.1	Confident	97 Å²	97	102.4 Å²	102.4	52%	0.519	53%	0.531	S	S	.	.	H	α-helix	trans	-63.7	-40.5	175.1	-67	-36.4	0	0	0	111.7	S962 L963 S969 A970	S962-D966 PolarHBondContact O-N 2.87Å; S962-D966 VanDerWaalsContact O-N 3.11Å; L963-D966 PolarHBondContact O-N 2.86Å; D966-S969 WeakPolarHBondContact O-CB 3.33Å; D966-S969 PolarHBondContact O-N 3.27Å; D966-A970 WeakPolarHBondContact O-CB 3.32Å; D966-A970 PolarHBondContact O-N 3.22Å
967	L	74.7	Confident	76.6	Confident	94 Å²	94	102.7 Å²	102.7	49%	0.492	53%	0.527	S	S	.	.	H	α-helix	trans	-71.9	-31	178.5	-165.3	147.3	0	0	0	112.3	L963 N964 V965 N971	L963-L967 WeakPolarHBondContact O-CB 3.45Å; L963-L967 PolarHBondContact O-N 3.43Å; N964-L967 PolarHBondContact O-N 3.46Å; V965-L967 VanDerWaalsContact C-N 3.34Å; L967-N971 VanDerWaalsContact CD2-ND2 3.3Å; L967-N971 WeakPolarHBondContact CD2-ND2 3.35Å; L967-N971 VanDerWaalsContact O-CB 3.28Å; L967-N971 WeakPolarHBondContact O-CB 3.35Å; L967-N971 PolarHBondContact O-N 3.27Å; L967-N971 PolarHBondContact O-ND2 2.93Å; L967-N971 VanDerWaalsContact O-ND2 3.09Å
968	E	79.4	Confident	75.6	Confident	112 Å²	112	99.2 Å²	99.2	52%	0.523	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-40.9	166.4	-94.7	-157.7	-152.6	0	0	112.2	N964 V965 N971 K972	N964-E968 WeakPolarHBondContact O-CB 3.37Å; N964-E968 PolarHBondContact O-N 3.41Å; V965-E968 PolarHBondContact O-N 2.85Å; E968-N971 PolarHBondContact O-N 3.15Å; E968-K972 WeakPolarHBondContact O-CB 3.22Å; E968-K972 WeakPolarHBondContact O-CD 3.45Å; E968-K972 VanDerWaalsContact O-CG 3.27Å; E968-K972 WeakPolarHBondContact O-CG 3.45Å; E968-K972 PolarHBondContact O-N 3.25Å; E968-K972 WeakPolarHBondContact OE2-CE 3.44Å; E968-K972 IonicContact OE2-NZ 3.88Å; E968-K972 PolarHBondContact OE2-NZ 2.91Å
969	S	77.9	Confident	74.8	Confident	74 Å²	74	98.1 Å²	98.1	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-61.4	-50.7	176.4	-169.5	0	0	0	0	110.6	V965 D966 N971 K972 E973	V965-S969 PolarHBondContact O-N 3.48Å; D966-S969 WeakPolarHBondContact O-CB 3.33Å; D966-S969 PolarHBondContact O-N 3.27Å; S969-N971 PolarHBondContact O-N 2.99Å; S969-K972 PolarHBondContact O-N 3.1Å; S969-K972 VanDerWaalsContact O-N 3.16Å; S969-E973 PolarHBondContact O-N 2.86Å
970	A	73.1	Confident	73.9	Confident	61 Å²	61	102.5 Å²	102.5	50%	0.504	54%	0.539	S	S	.	.	H	α-helix	trans	-59	-42.5	175	0	0	0	0	0	112.3	D966 E973 L974	D966-A970 WeakPolarHBondContact O-CB 3.32Å; D966-A970 PolarHBondContact O-N 3.22Å; A970-E973 PolarHBondContact O-N 2.8Å; A970-L974 VanDerWaalsContact O-CB 3.25Å; A970-L974 WeakPolarHBondContact O-CB 3.42Å; A970-L974 PolarHBondContact O-N 2.87Å
971	N	73.5	Confident	72.7	Confident	76 Å²	76	98.7 Å²	98.7	41%	0.406	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-33.1	176.1	-86.2	-43.9	0	0	0	113.4	L967 E968 S969 S975	L967-N971 VanDerWaalsContact CD2-ND2 3.3Å; L967-N971 WeakPolarHBondContact CD2-ND2 3.35Å; L967-N971 VanDerWaalsContact O-CB 3.28Å; L967-N971 WeakPolarHBondContact O-CB 3.35Å; L967-N971 PolarHBondContact O-N 3.27Å; L967-N971 PolarHBondContact O-ND2 2.93Å; L967-N971 VanDerWaalsContact O-ND2 3.09Å; E968-N971 PolarHBondContact O-N 3.15Å; S969-N971 PolarHBondContact O-N 2.99Å; N971-S975 VanDerWaalsContact O-CB 3.23Å; N971-S975 WeakPolarHBondContact O-CB 3.19Å; N971-S975 PolarHBondContact O-N 3.04Å; N971-S975 PolarHBondContact O-OG 3.18Å
972	K	78.3	Confident	71.5	Confident	128 Å²	128	96.1 Å²	96.1	56%	0.557	52%	0.519	S	S	*	.	H	α-helix	trans	-67.2	-43.2	173.9	-75.5	160.8	-170	156.6	0	111	E968 S969 R976	E968-K972 WeakPolarHBondContact O-CB 3.22Å; E968-K972 WeakPolarHBondContact O-CD 3.45Å; E968-K972 VanDerWaalsContact O-CG 3.27Å; E968-K972 WeakPolarHBondContact O-CG 3.45Å; E968-K972 PolarHBondContact O-N 3.25Å; E968-K972 WeakPolarHBondContact OE2-CE 3.44Å; E968-K972 IonicContact OE2-NZ 3.88Å; E968-K972 PolarHBondContact OE2-NZ 2.91Å; S969-K972 PolarHBondContact O-N 3.1Å; S969-K972 VanDerWaalsContact O-N 3.16Å; K972-R976 WeakPolarHBondContact O-CB 3.11Å; K972-R976 PolarHBondContact O-N 3.25Å
973	E	74.8	Confident	70.5	Confident	108 Å²	108	96 Å²	96	51%	0.505	52%	0.518	S	S	.	.	H	α-helix	trans	-70.3	-39.7	176	-165.2	177.1	137.8	0	0	112.4	S969 A970 R976 K977	S969-E973 PolarHBondContact O-N 2.86Å; A970-E973 PolarHBondContact O-N 2.8Å; E973-R976 WeakPolarHBondContact O-CB 3.49Å; E973-R976 PolarHBondContact O-N 3.45Å; E973-R976 VanDerWaalsContact O-N 3.15Å; E973-K977 PolarHBondContact O-N 2.88Å; E973-K977 WeakPolarHBondContact OE1-CE 3.46Å; E973-K977 IonicContact OE1-NZ 3.56Å; E973-K977 PolarHBondContact OE1-NZ 3.18Å
974	L	70.6	Confident	69.7	Low	98 Å²	98	93.9 Å²	93.9	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-59.2	-48.4	172.8	-176.6	63.3	0	0	0	110.7	A970 R976 K977 T978	A970-L974 VanDerWaalsContact O-CB 3.25Å; A970-L974 WeakPolarHBondContact O-CB 3.42Å; A970-L974 PolarHBondContact O-N 2.87Å; L974-R976 PolarHBondContact O-N 3.01Å; L974-K977 CarbonylContact O-C 3.32Å; L974-K977 PolarHBondContact O-N 3.18Å; L974-T978 PolarHBondContact O-N 2.76Å; L974-T978 PolarHBondContact O-OG1 3.15Å; L974-T978 VanDerWaalsContact O-OG1 3.07Å
975	S	71.4	Confident	69	Low	72 Å²	72	94 Å²	94	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-58.9	-35	175.8	-60.8	0	0	0	0	112.2	N971 S979	N971-S975 VanDerWaalsContact O-CB 3.23Å; N971-S975 WeakPolarHBondContact O-CB 3.19Å; N971-S975 PolarHBondContact O-N 3.04Å; N971-S975 PolarHBondContact O-OG 3.18Å; S975-S979 WeakPolarHBondContact O-CB 3.41Å; S975-S979 PolarHBondContact O-N 3.47Å; S975-S979 PolarHBondContact O-OG 3.49Å
976	R	74	Confident	68.5	Low	199 Å²	199	95.5 Å²	95.5	75%	0.751	51%	0.511	S	S	*	.	H	α-helix	trans	-70.5	-30.9	176	-160.6	171.2	-174.8	166.4	0.6	112.9	K972 E973 L974 S979	K972-R976 WeakPolarHBondContact O-CB 3.11Å; K972-R976 PolarHBondContact O-N 3.25Å; E973-R976 WeakPolarHBondContact O-CB 3.49Å; E973-R976 PolarHBondContact O-N 3.45Å; E973-R976 VanDerWaalsContact O-N 3.15Å; L974-R976 PolarHBondContact O-N 3.01Å; R976-S979 WeakPolarHBondContact CA-OG 3.35Å; R976-S979 PolarHBondContact O-OG 3.05Å
977	K	68.1	Low	68.2	Low	127 Å²	127	96.4 Å²	96.4	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-77	-42.5	171.6	-68.6	171.4	-174.8	168.8	0	111.7	E973 L974 S979 M980 S981	E973-K977 PolarHBondContact O-N 2.88Å; E973-K977 WeakPolarHBondContact OE1-CE 3.46Å; E973-K977 IonicContact OE1-NZ 3.56Å; E973-K977 PolarHBondContact OE1-NZ 3.18Å; L974-K977 CarbonylContact O-C 3.32Å; L974-K977 PolarHBondContact O-N 3.18Å; K977-S979 PolarHBondContact O-N 3.03Å; K977-M980 PolarHBondContact O-N 3.48Å; K977-M980 VanDerWaalsContact O-N 3.14Å; K977-S981 PolarHBondContact O-N 2.84Å
978	T	61.7	Low	68.1	Low	69 Å²	69	95.3 Å²	95.3	42%	0.423	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-36.4	176.8	-54.1	0	0	0	0	112.8	L974 M980 S981 T982	L974-T978 PolarHBondContact O-N 2.76Å; L974-T978 PolarHBondContact O-OG1 3.15Å; L974-T978 VanDerWaalsContact O-OG1 3.07Å; T978-M980 PolarHBondContact O-N 3.44Å; T978-S981 PolarHBondContact O-N 2.9Å; T978-S981 PolarHBondContact O-OG 2.73Å; T978-T982 PolarHBondContact O-N 3.07Å
979	S	64.5	Low	67.8	Low	77 Å²	77	95.8 Å²	95.8	54%	0.538	51%	0.509	S	S	.	.	H	α-helix	trans	-71.2	-16.3	174	48.1	0	0	0	0	114	S975 R976 K977 T982	S975-S979 WeakPolarHBondContact O-CB 3.41Å; S975-S979 PolarHBondContact O-N 3.47Å; S975-S979 PolarHBondContact O-OG 3.49Å; R976-S979 WeakPolarHBondContact CA-OG 3.35Å; R976-S979 PolarHBondContact O-OG 3.05Å; K977-S979 PolarHBondContact O-N 3.03Å; S979-T982 PolarHBondContact O-OG1 2.8Å
980	M	59.3	Low	67.8	Low	150 Å²	150	98.2 Å²	98.2	74%	0.739	51%	0.512	S	S	*	.	H	α-helix	trans	-84	-33.7	162.7	-71.6	-163.6	68.5	0	0	112.2	K977 T978 T982 S983	K977-M980 PolarHBondContact O-N 3.48Å; K977-M980 VanDerWaalsContact O-N 3.14Å; T978-M980 PolarHBondContact O-N 3.44Å; M980-T982 PolarHBondContact O-N 3.03Å; M980-S983 PolarHBondContact O-N 2.98Å
981	S	53.6	Low	67.7	Low	41 Å²	41	100.7 Å²	100.7	29%	0.287	52%	0.516	S	S	.	.	H	α-helix	trans	-69.2	-29.7	-179.5	82	0	0	0	0	113.4	K977 T978 S983 T984 D985	K977-S981 PolarHBondContact O-N 2.84Å; T978-S981 PolarHBondContact O-N 2.9Å; T978-S981 PolarHBondContact O-OG 2.73Å; S981-S983 VanDerWaalsContact C-N 3.29Å; S981-S983 PolarHBondContact O-N 3.11Å; S981-T984 WeakPolarHBondContact CA-OG1 3.4Å; S981-T984 CarbonylContact O-C 3.59Å; S981-T984 PolarHBondContact O-N 2.61Å; S981-T984 PolarHBondContact O-OG1 3.04Å; S981-D985 PolarHBondContact O-N 2.87Å
982	T	56.2	Low	67.8	Low	77 Å²	77	103 Å²	103	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-58.6	-37.8	177	48	0	0	0	0	113	T978 S979 M980 T984 D985 E986	T978-T982 PolarHBondContact O-N 3.07Å; S979-T982 PolarHBondContact O-OG1 2.8Å; M980-T982 PolarHBondContact O-N 3.03Å; T982-T984 VanDerWaalsContact C-N 3.33Å; T982-T984 PolarHBondContact O-N 2.91Å; T982-D985 PolarHBondContact O-N 2.98Å; T982-E986 PolarHBondContact O-N 3.08Å
983	S	58.9	Low	67.9	Low	71 Å²	71	103.9 Å²	103.9	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-61.1	-40.4	174.3	-177.6	0	0	0	0	112	M980 S981 Q987	M980-S983 PolarHBondContact O-N 2.98Å; S981-S983 VanDerWaalsContact C-N 3.29Å; S981-S983 PolarHBondContact O-N 3.11Å; S983-Q987 PolarHBondContact O-N 2.92Å
984	T	56.6	Low	68.1	Low	70 Å²	70	104 Å²	104	43%	0.429	53%	0.53	S	S	.	.	H	α-helix	trans	-75.4	-33.2	174.7	49.4	0	0	0	0	113	S981 T982 Q987 I988	S981-T984 WeakPolarHBondContact CA-OG1 3.4Å; S981-T984 CarbonylContact O-C 3.59Å; S981-T984 PolarHBondContact O-N 2.61Å; S981-T984 PolarHBondContact O-OG1 3.04Å; T982-T984 VanDerWaalsContact C-N 3.33Å; T982-T984 PolarHBondContact O-N 2.91Å; T984-Q987 PolarHBondContact O-N 2.85Å; T984-I988 WeakPolarHBondContact O-CB 3.27Å; T984-I988 WeakPolarHBondContact O-CD1 3.42Å; T984-I988 VanDerWaalsContact O-CG1 3.24Å; T984-I988 WeakPolarHBondContact O-CG1 3.26Å; T984-I988 PolarHBondContact O-N 2.91Å
985	D	63.1	Low	68.4	Low	74 Å²	74	103.6 Å²	103.6	40%	0.396	53%	0.528	S	S	.	.	H	α-helix	trans	-67.8	-35.6	176.1	-94.9	-49.9	0	0	0	112.2	S981 T982 I988 Q989	S981-D985 PolarHBondContact O-N 2.87Å; T982-D985 PolarHBondContact O-N 2.98Å; D985-I988 PolarHBondContact O-N 3.05Å; D985-Q989 WeakPolarHBondContact O-CB 3.15Å; D985-Q989 WeakPolarHBondContact O-CG 3.25Å; D985-Q989 PolarHBondContact O-N 3.14Å
986	E	71.4	Confident	68.7	Low	131 Å²	131	105.9 Å²	105.9	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-62.4	-43.1	171.3	-75.1	-168.8	172.3	0	0	111.6	T982 Q989 Q990	T982-E986 PolarHBondContact O-N 3.08Å; E986-Q989 PolarHBondContact O-N 2.84Å; E986-Q990 WeakPolarHBondContact O-CG 3.34Å; E986-Q990 PolarHBondContact O-N 2.95Å
987	Q	72	Confident	69	Low	116 Å²	116	102.8 Å²	102.8	54%	0.542	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-41.9	174.4	-66.5	-178.2	13.5	0	0	111.7	S983 T984 Q989 Q990 L991	S983-Q987 PolarHBondContact O-N 2.92Å; T984-Q987 PolarHBondContact O-N 2.85Å; Q987-Q989 VanDerWaalsContact C-N 3.35Å; Q987-Q989 PolarHBondContact O-N 3.24Å; Q987-Q990 PolarHBondContact O-N 3.35Å; Q987-L991 WeakPolarHBondContact O-CB 3.43Å; Q987-L991 VanDerWaalsContact O-CG 3.29Å; Q987-L991 WeakPolarHBondContact O-CG 3.27Å; Q987-L991 PolarHBondContact O-N 3.29Å
988	I	71.4	Confident	69.5	Low	71 Å²	71	100.9 Å²	100.9	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-64.6	-37.3	175.7	-70.7	163.7	0	0	0	111.1	T984 D985 K992	T984-I988 WeakPolarHBondContact O-CB 3.27Å; T984-I988 WeakPolarHBondContact O-CD1 3.42Å; T984-I988 VanDerWaalsContact O-CG1 3.24Å; T984-I988 WeakPolarHBondContact O-CG1 3.26Å; T984-I988 PolarHBondContact O-N 2.91Å; D985-I988 PolarHBondContact O-N 3.05Å; I988-K992 HydrophobicContact CG2-CD 3.99Å; I988-K992 HydrophobicContact CG2-CG 4.43Å; I988-K992 VanDerWaalsContact O-CB 3.29Å; I988-K992 WeakPolarHBondContact O-CB 3.45Å; I988-K992 VanDerWaalsContact O-CG 3.25Å; I988-K992 WeakPolarHBondContact O-CG 3.47Å; I988-K992 PolarHBondContact O-N 3.29Å
989	Q	73.8	Confident	70.3	Confident	122 Å²	122	102.8 Å²	102.8	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-70.2	-38.4	174.3	-76.2	-169	32.3	0	0	112.6	D985 E986 Q987 K992 K993	D985-Q989 WeakPolarHBondContact O-CB 3.15Å; D985-Q989 WeakPolarHBondContact O-CG 3.25Å; D985-Q989 PolarHBondContact O-N 3.14Å; E986-Q989 PolarHBondContact O-N 2.84Å; Q987-Q989 VanDerWaalsContact C-N 3.35Å; Q987-Q989 PolarHBondContact O-N 3.24Å; Q989-K992 PolarHBondContact O-N 3.31Å; Q989-K993 WeakPolarHBondContact O-CB 3.34Å; Q989-K993 PolarHBondContact O-N 2.86Å
990	Q	76.7	Confident	70.9	Confident	125 Å²	125	106 Å²	106	58%	0.584	53%	0.526	S	S	*	.	H	α-helix	trans	-63.3	-45.5	172.5	-72.4	-178.8	26.2	0	0	111	E986 Q987 K993 L994	E986-Q990 WeakPolarHBondContact O-CG 3.34Å; E986-Q990 PolarHBondContact O-N 2.95Å; Q987-Q990 PolarHBondContact O-N 3.35Å; Q990-K993 PolarHBondContact O-N 3.28Å; Q990-L994 WeakPolarHBondContact O-CB 3.39Å; Q990-L994 WeakPolarHBondContact O-CG 3.49Å; Q990-L994 PolarHBondContact O-N 3.08Å
991	L	72.4	Confident	71.9	Confident	113 Å²	113	104.2 Å²	104.2	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-64.9	-38.9	175.9	-71.2	169.2	0	0	0	112.3	Q987 L994 L995	Q987-L991 WeakPolarHBondContact O-CB 3.43Å; Q987-L991 VanDerWaalsContact O-CG 3.29Å; Q987-L991 WeakPolarHBondContact O-CG 3.27Å; Q987-L991 PolarHBondContact O-N 3.29Å; L991-L994 PolarHBondContact O-N 3.23Å; L991-L995 WeakPolarHBondContact O-CB 3.5Å; L991-L995 PolarHBondContact O-N 2.94Å
992	K	75.2	Confident	73	Confident	125 Å²	125	107.6 Å²	107.6	54%	0.543	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-44.9	172.4	-79.1	172.4	179.6	173	0	111.8	I988 Q989 L994 L995 E996	I988-K992 HydrophobicContact CG2-CD 3.99Å; I988-K992 HydrophobicContact CG2-CG 4.43Å; I988-K992 VanDerWaalsContact O-CB 3.29Å; I988-K992 WeakPolarHBondContact O-CB 3.45Å; I988-K992 VanDerWaalsContact O-CG 3.25Å; I988-K992 WeakPolarHBondContact O-CG 3.47Å; I988-K992 PolarHBondContact O-N 3.29Å; Q989-K992 PolarHBondContact O-N 3.31Å; K992-L994 VanDerWaalsContact C-N 3.33Å; K992-L994 PolarHBondContact O-N 2.99Å; K992-L995 PolarHBondContact O-N 3Å; K992-E996 WeakPolarHBondContact O-CB 3.35Å; K992-E996 WeakPolarHBondContact O-CG 3.11Å; K992-E996 PolarHBondContact O-N 2.81Å
993	K	79.6	Confident	74	Confident	145 Å²	145	110.4 Å²	110.4	63%	0.63	53%	0.534	S	S	*	.	H	α-helix	trans	-63.1	-37.1	174.2	-86.4	-179.9	173.8	170.1	0	112.9	Q989 Q990 K997	Q989-K993 WeakPolarHBondContact O-CB 3.34Å; Q989-K993 PolarHBondContact O-N 2.86Å; Q990-K993 PolarHBondContact O-N 3.28Å; K993-K997 WeakPolarHBondContact O-CB 3.29Å; K993-K997 PolarHBondContact O-N 2.92Å
994	L	79.7	Confident	74.8	Confident	111 Å²	111	109.5 Å²	109.5	58%	0.581	53%	0.527	S	S	*	.	H	α-helix	trans	-66.3	-42	173.2	-73.7	168.6	0	0	0	111.2	Q990 L991 K992 K997 E998	Q990-L994 WeakPolarHBondContact O-CB 3.39Å; Q990-L994 WeakPolarHBondContact O-CG 3.49Å; Q990-L994 PolarHBondContact O-N 3.08Å; L991-L994 PolarHBondContact O-N 3.23Å; K992-L994 VanDerWaalsContact C-N 3.33Å; K992-L994 PolarHBondContact O-N 2.99Å; L994-K997 PolarHBondContact O-N 3.28Å; L994-E998 VanDerWaalsContact O-CB 3.32Å; L994-E998 WeakPolarHBondContact O-CB 3.27Å; L994-E998 PolarHBondContact O-N 3.3Å
995	L	76.5	Confident	75.6	Confident	90 Å²	90	108.4 Å²	108.4	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-65.3	-46.5	176.2	-178.8	63.6	0	0	0	112.2	L991 K992 K997 E998 Q999	L991-L995 WeakPolarHBondContact O-CB 3.5Å; L991-L995 PolarHBondContact O-N 2.94Å; K992-L995 PolarHBondContact O-N 3Å; L995-K997 VanDerWaalsContact C-N 3.33Å; L995-K997 PolarHBondContact O-N 3.16Å; L995-E998 PolarHBondContact O-N 3.31Å; L995-Q999 HydrophobicContact CD1-CG 4.33Å; L995-Q999 HydrophobicContact CG-CG 4.47Å; L995-Q999 VanDerWaalsContact O-CB 3.32Å; L995-Q999 WeakPolarHBondContact O-CB 3.3Å; L995-Q999 VanDerWaalsContact O-CG 3.25Å; L995-Q999 WeakPolarHBondContact O-CG 3.48Å; L995-Q999 PolarHBondContact O-N 2.96Å
996	E	77.7	Confident	76.2	Confident	119 Å²	119	109.7 Å²	109.7	56%	0.556	53%	0.532	S	S	*	.	H	α-helix	trans	-60.9	-42.1	175.1	-74.8	178.8	155.8	0	0	111.4	K992 Q999 Q1000	K992-E996 WeakPolarHBondContact O-CB 3.35Å; K992-E996 WeakPolarHBondContact O-CG 3.11Å; K992-E996 PolarHBondContact O-N 2.81Å; E996-Q999 PolarHBondContact O-N 3.14Å; E996-Q1000 WeakPolarHBondContact O-CB 3.39Å; E996-Q1000 WeakPolarHBondContact O-CG 3.49Å; E996-Q1000 PolarHBondContact O-N 2.84Å
997	K	80.2	Confident	76.3	Confident	135 Å²	135	107.4 Å²	107.4	59%	0.587	52%	0.524	S	S	*	.	H	α-helix	trans	-66.3	-38.9	176	-170.8	176	-176.9	-179.3	0	111.8	K993 L994 L995 Q1000 L1001	K993-K997 WeakPolarHBondContact O-CB 3.29Å; K993-K997 PolarHBondContact O-N 2.92Å; L994-K997 PolarHBondContact O-N 3.28Å; L995-K997 VanDerWaalsContact C-N 3.33Å; L995-K997 PolarHBondContact O-N 3.16Å; K997-Q1000 PolarHBondContact O-N 3.3Å; K997-L1001 HydrophobicContact CG-CD1 4.3Å; K997-L1001 WeakPolarHBondContact O-CB 3.39Å; K997-L1001 VanDerWaalsContact O-CG 3.23Å; K997-L1001 WeakPolarHBondContact O-CG 3.46Å; K997-L1001 PolarHBondContact O-N 3.47Å
998	E	79	Confident	76.4	Confident	86 Å²	86	107.9 Å²	107.9	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-71.4	-36.1	175.9	-157.8	-127	-158.6	0	0	111.9	L994 L995 L1001 K1002	L994-E998 VanDerWaalsContact O-CB 3.32Å; L994-E998 WeakPolarHBondContact O-CB 3.27Å; L994-E998 PolarHBondContact O-N 3.3Å; L995-E998 PolarHBondContact O-N 3.31Å; E998-L1001 PolarHBondContact O-N 3.16Å; E998-K1002 VanDerWaalsContact O-CB 3.3Å; E998-K1002 WeakPolarHBondContact O-CB 3.28Å; E998-K1002 WeakPolarHBondContact O-CG 3.5Å; E998-K1002 PolarHBondContact O-N 3.35Å; E998-K1002 WeakPolarHBondContact OE1-CE 3.25Å; E998-K1002 IonicContact OE1-NZ 2.85Å; E998-K1002 PolarHBondContact OE1-NZ 2.62Å; E998-K1002 VanDerWaalsContact OE2-CE 3.27Å; E998-K1002 WeakPolarHBondContact OE2-CE 3.37Å; E998-K1002 IonicContact OE2-NZ 3.09Å; E998-K1002 PolarHBondContact OE2-NZ 3.23Å
999	Q	77.9	Confident	76	Confident	110 Å²	110	109.6 Å²	109.6	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-41	171.1	-75.7	177.5	1.1	0	0	112	L995 E996 K1002 K1003	L995-Q999 HydrophobicContact CD1-CG 4.33Å; L995-Q999 HydrophobicContact CG-CG 4.47Å; L995-Q999 VanDerWaalsContact O-CB 3.32Å; L995-Q999 WeakPolarHBondContact O-CB 3.3Å; L995-Q999 VanDerWaalsContact O-CG 3.25Å; L995-Q999 WeakPolarHBondContact O-CG 3.48Å; L995-Q999 PolarHBondContact O-N 2.96Å; E996-Q999 PolarHBondContact O-N 3.14Å; Q999-K1002 PolarHBondContact O-N 3.42Å; Q999-K1003 WeakPolarHBondContact O-CB 3.37Å; Q999-K1003 PolarHBondContact O-N 3.15Å
1000	Q	77.8	Confident	75.6	Confident	145 Å²	145	106.6 Å²	106.6	68%	0.678	52%	0.523	S	S	*	.	H	α-helix	trans	-66.2	-39.7	173	-78.9	-174.1	-8.4	0	0	111.9	E996 K997 K1003 S1004	E996-Q1000 WeakPolarHBondContact O-CB 3.39Å; E996-Q1000 WeakPolarHBondContact O-CG 3.49Å; E996-Q1000 PolarHBondContact O-N 2.84Å; K997-Q1000 PolarHBondContact O-N 3.3Å; Q1000-K1003 PolarHBondContact O-N 3.25Å; Q1000-S1004 VanDerWaalsContact O-CB 3.25Å; Q1000-S1004 WeakPolarHBondContact O-CB 3.39Å; Q1000-S1004 PolarHBondContact O-N 3.19Å
1001	L	80.4	Confident	75.2	Confident	112 Å²	112	105.4 Å²	105.4	59%	0.586	52%	0.518	S	S	*	.	H	α-helix	trans	-67.2	-42.4	174.9	-74.7	168.1	0	0	0	111.7	K997 E998 A1005	K997-L1001 HydrophobicContact CG-CD1 4.3Å; K997-L1001 WeakPolarHBondContact O-CB 3.39Å; K997-L1001 VanDerWaalsContact O-CG 3.23Å; K997-L1001 WeakPolarHBondContact O-CG 3.46Å; K997-L1001 PolarHBondContact O-N 3.47Å; E998-L1001 PolarHBondContact O-N 3.16Å; L1001-A1005 VanDerWaalsContact O-CB 3.23Å; L1001-A1005 WeakPolarHBondContact O-CB 3.06Å; L1001-A1005 PolarHBondContact O-N 3.25Å
1002	K	77.3	Confident	74.8	Confident	112 Å²	112	104 Å²	104	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-42.7	173.4	-79.3	174	176.6	164.2	0	111.9	E998 Q999 A1005 I1006	E998-K1002 VanDerWaalsContact O-CB 3.3Å; E998-K1002 WeakPolarHBondContact O-CB 3.28Å; E998-K1002 WeakPolarHBondContact O-CG 3.5Å; E998-K1002 PolarHBondContact O-N 3.35Å; E998-K1002 WeakPolarHBondContact OE1-CE 3.25Å; E998-K1002 IonicContact OE1-NZ 2.85Å; E998-K1002 PolarHBondContact OE1-NZ 2.62Å; E998-K1002 VanDerWaalsContact OE2-CE 3.27Å; E998-K1002 WeakPolarHBondContact OE2-CE 3.37Å; E998-K1002 IonicContact OE2-NZ 3.09Å; E998-K1002 PolarHBondContact OE2-NZ 3.23Å; Q999-K1002 PolarHBondContact O-N 3.42Å; K1002-A1005 PolarHBondContact O-N 3.24Å; K1002-I1006 WeakPolarHBondContact O-CB 3.43Å; K1002-I1006 VanDerWaalsContact O-CG1 3.25Å; K1002-I1006 WeakPolarHBondContact O-CG1 3.47Å; K1002-I1006 PolarHBondContact O-N 2.67Å
1003	K	75.7	Confident	73.8	Confident	135 Å²	135	104.7 Å²	104.7	59%	0.587	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-47.7	175.8	-171.3	175.3	177.5	-179.7	0	110.7	Q999 Q1000 A1005 I1006 D1007	Q999-K1003 WeakPolarHBondContact O-CB 3.37Å; Q999-K1003 PolarHBondContact O-N 3.15Å; Q1000-K1003 PolarHBondContact O-N 3.25Å; K1003-A1005 VanDerWaalsContact C-N 3.25Å; K1003-A1005 PolarHBondContact O-N 3.1Å; K1003-I1006 CarbonylContact O-C 3.59Å; K1003-I1006 PolarHBondContact O-N 3.26Å; K1003-D1007 WeakPolarHBondContact O-CB 3.38Å; K1003-D1007 PolarHBondContact O-N 3.04Å
1004	S	76.4	Confident	72.7	Confident	52 Å²	52	104.2 Å²	104.2	36%	0.364	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-30.8	174.5	-172.8	0	0	0	0	112.9	Q1000 K1008	Q1000-S1004 VanDerWaalsContact O-CB 3.25Å; Q1000-S1004 WeakPolarHBondContact O-CB 3.39Å; Q1000-S1004 PolarHBondContact O-N 3.19Å; S1004-K1008 WeakPolarHBondContact O-CB 3.11Å; S1004-K1008 VanDerWaalsContact O-CG 3.26Å; S1004-K1008 WeakPolarHBondContact O-CG 3.39Å; S1004-K1008 PolarHBondContact O-N 2.94Å
1005	A	73.7	Confident	71.4	Confident	48 Å²	48	105.2 Å²	105.2	40%	0.397	52%	0.524	S	S	.	.	H	α-helix	trans	-72.8	-36.1	172.1	0	0	0	0	0	112.7	L1001 K1002 K1003 L1009	L1001-A1005 VanDerWaalsContact O-CB 3.23Å; L1001-A1005 WeakPolarHBondContact O-CB 3.06Å; L1001-A1005 PolarHBondContact O-N 3.25Å; K1002-A1005 PolarHBondContact O-N 3.24Å; K1003-A1005 VanDerWaalsContact C-N 3.25Å; K1003-A1005 PolarHBondContact O-N 3.1Å; A1005-L1009 VanDerWaalsContact O-CB 3.24Å; A1005-L1009 WeakPolarHBondContact O-CB 3.07Å; A1005-L1009 WeakPolarHBondContact O-CD1 3.16Å; A1005-L1009 VanDerWaalsContact O-CG 3.27Å; A1005-L1009 WeakPolarHBondContact O-CG 3.47Å; A1005-L1009 PolarHBondContact O-N 3.32Å
1006	I	74.5	Confident	69.9	Low	101 Å²	101	109.6 Å²	109.6	52%	0.518	54%	0.539	S	S	.	.	H	α-helix	trans	-69.7	-43.7	172.9	-71.5	162.9	0	0	0	110.6	K1002 K1003 L1009 T1010	K1002-I1006 WeakPolarHBondContact O-CB 3.43Å; K1002-I1006 VanDerWaalsContact O-CG1 3.25Å; K1002-I1006 WeakPolarHBondContact O-CG1 3.47Å; K1002-I1006 PolarHBondContact O-N 2.67Å; K1003-I1006 CarbonylContact O-C 3.59Å; K1003-I1006 PolarHBondContact O-N 3.26Å; I1006-L1009 PolarHBondContact O-N 3.5Å; I1006-T1010 WeakPolarHBondContact O-CB 3.33Å; I1006-T1010 PolarHBondContact O-N 2.81Å; I1006-T1010 PolarHBondContact O-OG1 3.04Å
1007	D	73.6	Confident	68.1	Low	83 Å²	83	108.3 Å²	108.3	44%	0.444	54%	0.543	S	S	.	.	H	α-helix	trans	-63	-44.4	176.6	-63.1	-22.1	0	0	0	109.5	K1003 T1010 E1011	K1003-D1007 WeakPolarHBondContact O-CB 3.38Å; K1003-D1007 PolarHBondContact O-N 3.04Å; D1007-T1010 CarbonylContact O-C 3.59Å; D1007-T1010 WeakPolarHBondContact O-CB 3.45Å; D1007-T1010 PolarHBondContact O-N 2.9Å; D1007-E1011 WeakPolarHBondContact O-CB 3.47Å; D1007-E1011 PolarHBondContact O-N 3.16Å
1008	K	74.4	Confident	66.1	Low	125 Å²	125	107.4 Å²	107.4	54%	0.543	55%	0.549	S	S	.	.	H	α-helix	trans	-68.8	-32.6	172.8	-77.3	175.1	175.7	173.6	0	113.9	S1004 T1010 V1012	S1004-K1008 WeakPolarHBondContact O-CB 3.11Å; S1004-K1008 VanDerWaalsContact O-CG 3.26Å; S1004-K1008 WeakPolarHBondContact O-CG 3.39Å; S1004-K1008 PolarHBondContact O-N 2.94Å; K1008-T1010 VanDerWaalsContact C-N 3.33Å; K1008-V1012 VanDerWaalsContact O-CB 3.23Å; K1008-V1012 WeakPolarHBondContact O-CB 3.39Å; K1008-V1012 WeakPolarHBondContact O-CG2 3.43Å; K1008-V1012 PolarHBondContact O-N 3.02Å
1009	L	62.5	Low	64.3	Low	108 Å²	108	109.1 Å²	109.1	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-67.2	-38.3	170.8	-85.7	163.9	0	0	0	110.7	A1005 I1006 V1012 M1013	A1005-L1009 VanDerWaalsContact O-CB 3.24Å; A1005-L1009 WeakPolarHBondContact O-CB 3.07Å; A1005-L1009 WeakPolarHBondContact O-CD1 3.16Å; A1005-L1009 VanDerWaalsContact O-CG 3.27Å; A1005-L1009 WeakPolarHBondContact O-CG 3.47Å; A1005-L1009 PolarHBondContact O-N 3.32Å; I1006-L1009 PolarHBondContact O-N 3.5Å; L1009-V1012 PolarHBondContact O-N 3.1Å; L1009-M1013 VanDerWaalsContact O-CB 3.26Å; L1009-M1013 WeakPolarHBondContact O-CB 3.47Å; L1009-M1013 WeakPolarHBondContact O-CG 3.46Å; L1009-M1013 PolarHBondContact O-N 2.96Å
1010	T	66	Low	62.4	Low	59 Å²	59	108.8 Å²	108.8	36%	0.362	59%	0.587	S	S	.	*	H	α-helix	trans	-67.7	-43	176.1	-54.3	0	0	0	0	110.6	I1006 D1007 K1008 M1013 Q1014	I1006-T1010 WeakPolarHBondContact O-CB 3.33Å; I1006-T1010 PolarHBondContact O-N 2.81Å; I1006-T1010 PolarHBondContact O-OG1 3.04Å; D1007-T1010 CarbonylContact O-C 3.59Å; D1007-T1010 WeakPolarHBondContact O-CB 3.45Å; D1007-T1010 PolarHBondContact O-N 2.9Å; K1008-T1010 VanDerWaalsContact C-N 3.33Å; T1010-M1013 PolarHBondContact O-N 2.99Å; T1010-Q1014 WeakPolarHBondContact O-CB 3.41Å; T1010-Q1014 VanDerWaalsContact O-CG 3.29Å; T1010-Q1014 WeakPolarHBondContact O-CG 3.26Å; T1010-Q1014 PolarHBondContact O-N 3.3Å
1011	E	69.5	Low	60.5	Low	99 Å²	99	105.4 Å²	105.4	46%	0.463	59%	0.591	S	S	.	*	H	α-helix	trans	-62.1	-46.1	172.9	-173.1	176.5	-146.2	0	0	111.5	D1007 M1013 Q1014 M1015	D1007-E1011 WeakPolarHBondContact O-CB 3.47Å; D1007-E1011 PolarHBondContact O-N 3.16Å; E1011-M1013 VanDerWaalsContact C-N 3.33Å; E1011-M1013 PolarHBondContact O-N 2.95Å; E1011-Q1014 PolarHBondContact O-N 2.86Å; E1011-M1015 HydrophobicContact CG-CE 3.99Å; E1011-M1015 HydrophobicContact CG-CG 4.47Å; E1011-M1015 HydrophobicContact CG-SD 4.45Å; E1011-M1015 VanDerWaalsContact O-CB 3.29Å; E1011-M1015 WeakPolarHBondContact O-CB 3.39Å; E1011-M1015 WeakPolarHBondContact O-CG 3.31Å; E1011-M1015 PolarHBondContact O-N 2.95Å
1012	V	63.7	Low	58.4	Low	85 Å²	85	109.5 Å²	109.5	52%	0.515	60%	0.604	S	S	.	*	H	α-helix	trans	-67.2	-30.5	175.7	167.1	0	0	0	0	112.5	K1008 L1009 K1016	K1008-V1012 VanDerWaalsContact O-CB 3.23Å; K1008-V1012 WeakPolarHBondContact O-CB 3.39Å; K1008-V1012 WeakPolarHBondContact O-CG2 3.43Å; K1008-V1012 PolarHBondContact O-N 3.02Å; L1009-V1012 PolarHBondContact O-N 3.1Å; V1012-K1016 PolarHBondContact O-N 2.9Å
1013	M	52.9	Low	56.5	Low	139 Å²	139	114 Å²	114	69%	0.685	62%	0.623	S	S	*	*	H	α-helix	trans	-73.2	-40.6	172.4	-76.8	174.6	67	0	0	111.7	L1009 T1010 E1011 K1016	L1009-M1013 VanDerWaalsContact O-CB 3.26Å; L1009-M1013 WeakPolarHBondContact O-CB 3.47Å; L1009-M1013 WeakPolarHBondContact O-CG 3.46Å; L1009-M1013 PolarHBondContact O-N 2.96Å; T1010-M1013 PolarHBondContact O-N 2.99Å; E1011-M1013 VanDerWaalsContact C-N 3.33Å; E1011-M1013 PolarHBondContact O-N 2.95Å; M1013-K1016 PolarHBondContact O-N 2.73Å
1014	Q	57.3	Low	54.6	Low	134 Å²	134	111.3 Å²	111.3	63%	0.626	63%	0.634	S	S	*	*	H	α-helix	trans	-73.2	-38.2	178	-71.5	176.3	3.9	0	0	112.2	T1010 E1011 K1016 S1017	T1010-Q1014 WeakPolarHBondContact O-CB 3.41Å; T1010-Q1014 VanDerWaalsContact O-CG 3.29Å; T1010-Q1014 WeakPolarHBondContact O-CG 3.26Å; T1010-Q1014 PolarHBondContact O-N 3.3Å; E1011-Q1014 PolarHBondContact O-N 2.86Å; Q1014-K1016 PolarHBondContact O-N 2.72Å; Q1014-S1017 WeakPolarHBondContact O-CB 3.4Å; Q1014-S1017 PolarHBondContact O-N 2.81Å; Q1014-S1017 PolarHBondContact O-OG 2.77Å
1015	M	52.3	Low	52.8	Low	133 Å²	133	114 Å²	114	66%	0.655	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-73.8	-7.2	175	-69.4	-159.9	-176.7	0	0	114.4	E1011 S1017	E1011-M1015 HydrophobicContact CG-CE 3.99Å; E1011-M1015 HydrophobicContact CG-CG 4.47Å; E1011-M1015 HydrophobicContact CG-SD 4.45Å; E1011-M1015 VanDerWaalsContact O-CB 3.29Å; E1011-M1015 WeakPolarHBondContact O-CB 3.39Å; E1011-M1015 WeakPolarHBondContact O-CG 3.31Å; E1011-M1015 PolarHBondContact O-N 2.95Å; M1015-S1017 VanDerWaalsContact C-N 3.26Å
1016	K	46.2	Very low	51.1	Low	182 Å²	182	123.6 Å²	123.6	79%	0.791	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-83.5	3.2	169.7	-104	-179.3	174.9	178.9	0	114.4	V1012 M1013 Q1014	V1012-K1016 PolarHBondContact O-N 2.9Å; M1013-K1016 PolarHBondContact O-N 2.73Å; Q1014-K1016 PolarHBondContact O-N 2.72Å
1017	S	38.4	Very low	49.4	Very low	91 Å²	91	123.1 Å²	123.1	64%	0.636	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-94.6	9	-175.9	-31	0	0	0	0	114.9	Q1014 M1015	Q1014-S1017 WeakPolarHBondContact O-CB 3.4Å; Q1014-S1017 PolarHBondContact O-N 2.81Å; Q1014-S1017 PolarHBondContact O-OG 2.77Å; M1015-S1017 VanDerWaalsContact C-N 3.26Å
1018	T	39.3	Very low	47.7	Very low	117 Å²	117	126 Å²	126	72%	0.718	70%	0.704	S	S	*	*	S	Bend	trans	-140.1	56	-169.1	41.4	0	0	0	0	115.1
1019	S	41.2	Very low	45.9	Very low	121 Å²	121	127.4 Å²	127.4	85%	0.846	72%	0.718	S	S	*	*			trans	-166	138.3	154.4	24.4	0	0	0	0	116.7
1020	A	37.2	Very low	44.7	Very low	104 Å²	104	132.5 Å²	132.5	86%	0.86	73%	0.73	S	S	*	*			trans	34.4	105.1	149.2	0	0	0	0	0	122.3
1021	G	37.5	Very low	43.2	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	75%	0.754	S	S	*	*				89.1	109.2	97.7	0	0	0	0	0	122.3
1022	K	37.8	Very low	41.7	Very low	198 Å²	198	140.7 Å²	140.7	86%	0.861	77%	0.77	S	S	*	*			trans	69.8	110.2	141.8	-64.7	177	179	172	0	121.8
1023	K	35.9	Very low	40.2	Very low	208 Å²	208	141.2 Å²	141.2	90%	0.904	78%	0.783	S	S	*	*			trans	72.9	113.5	131.7	-66.2	-169.4	173.3	-169.9	0	122.3
1024	G	36.7	Very low	39.4	Very low	78 Å²	78	146.5 Å²	146.5	80%	0.804	80%	0.795	S	S	*	*			trans	89.5	165.8	141.8	0	0	0	0	0	117.8
1025	S	38	Very low	38.2	Very low	107 Å²	107	146 Å²	146	75%	0.748	81%	0.805	S	S	*	*			cis	178.2	109.3	-24.6	161.8	0	0	0	0	110.7
1026	R	37.7	Very low	37.4	Very low	251 Å²	251	145.5 Å²	145.5	95%	0.947	82%	0.815	S	S	*	*			trans	58.3	150.3	171.6	-69.4	175.2	160.5	166.8	-7.3	115.1
1027	A	39.5	Very low	36.7	Very low	90 Å²	90	141.2 Å²	141.2	74%	0.744	81%	0.807	S	S	*	*			cis	-146.8	-160.9	18.9	0	0	0	0	0	111.4
1028	D	38.2	Very low	36.4	Very low	143 Å²	143	144.9 Å²	144.9	77%	0.765	81%	0.814	S	S	*	*			trans	-42.3	141.2	-179.3	-58.9	-96.7	0	0	0	116.9
1029	D	37	Very low	36.2	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	82%	0.819	S	S	*	*				-150.3	167.5	102.4	-141.9	-26.6	0	0	0	112
1030	R	35.9	Very low	36.1	Very low	216 Å²	216	145 Å²	145	82%	0.815	82%	0.817	S	S	*	*			trans	-100.6	99.3	-158.8	-60.8	170.3	178.6	167.2	-1.4	114
1031	F	34.5	Very low	36.1	Very low	197 Å²	197	145.2 Å²	145.2	86%	0.864	82%	0.818	S	S	*	*			trans	-162.4	157.2	145.6	-132.2	-115.8	0	0	0	110.5
1032	V	38.5	Very low	36.4	Very low	133 Å²	133	145.1 Å²	145.1	81%	0.806	81%	0.806	S	S	*	*	S	Bend	trans	61.7	73.6	172	-162.2	0	0	0	0	117.1
1033	A	33.1	Very low	36.8	Very low	95 Å²	95	140 Å²	140	79%	0.785	79%	0.793	S	S	*	*			trans	-170.7	105.4	147.9	0	0	0	0	0	113.8
1034	R	34.5	Very low	37.2	Very low	250 Å²	250	139.5 Å²	139.5	94%	0.943	79%	0.786	S	S	*	*			trans	147.3	103.1	146.4	-87.8	177.4	166	175.7	-4.7	112.6
1035	C	33.1	Very low	37.9	Very low	123 Å²	123	143.7 Å²	143.7	83%	0.831	78%	0.782	S	S	*	*			trans	-162.2	101.2	137.2	-124.5	0	0	0	0	107.5
1036	S	34.6	Very low	38.7	Very low	124 Å²	124	145.1 Å²	145.1	87%	0.867	78%	0.777	S	S	*	*			trans	-143.1	48.7	-176.3	-55.5	0	0	0	0	110.3
1037	C	32	Very low	39.8	Very low	92 Å²	92	138.2 Å²	138.2	62%	0.622	76%	0.755	S	S	*	*	S	Bend	trans	-163.3	147	172.7	49.9	0	0	0	0	108.3
1038	E	32.7	Very low	41.1	Very low	168 Å²	168	139.9 Å²	139.9	79%	0.785	75%	0.746	S	S	*	*			trans	52.3	97	154.7	-65.1	163.8	-152.3	0	0	119.9
1039	S	34.7	Very low	42.5	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	74%	0.743	S	S	*	*			trans	-171.3	145.4	134.2	59.6	0	0	0	0	112
1040	P	39.9	Very low	44.2	Very low	125 Å²	125	141.3 Å²	141.3	81%	0.812	73%	0.733	S	S	*	*			trans	-81.3	-176.8	172.4	35.8	-36.5	0	0	0	112.8
1041	A	37	Very low	46	Very low	107 Å²	107	138.6 Å²	138.6	88%	0.884	72%	0.723	S	S	*	*			trans	72.2	96.8	173.9	0	0	0	0	0	117.1
1042	S	42.4	Very low	47.8	Very low	71 Å²	71	132.9 Å²	132.9	50%	0.497	70%	0.702	S	S	.	*			trans	-138.5	136.5	157.2	-179.6	0	0	0	0	108.4	R1044 F1045	S1042-R1044 PolarHBondContact O-N 2.8Å; S1042-R1044 VanDerWaalsContact O-N 3.16Å; S1042-F1045 PolarHBondContact O-N 2.99Å
1043	P	47.4	Very low	49.7	Very low	92 Å²	92	132 Å²	132	60%	0.597	69%	0.692	S	S	*	*	H	α-helix	trans	-55.9	-36.1	-174.4	18.9	-31.4	0	0	0	112.8	F1045 Q1046 E1047	P1043-F1045 PolarHBondContact O-N 3.49Å; P1043-F1045 VanDerWaalsContact O-N 3.11Å; P1043-Q1046 PolarHBondContact O-N 3.32Å; P1043-E1047 WeakPolarHBondContact O-CG 3.45Å; P1043-E1047 PolarHBondContact O-N 2.84Å
1044	R	44.7	Very low	51.7	Low	197 Å²	197	132.2 Å²	132.2	74%	0.743	68%	0.677	S	S	*	*	H	α-helix	trans	-54.7	-30.8	177.1	-86	-176.6	167.9	172.9	-3.1	114.9	S1042 E1047 K1048	S1042-R1044 PolarHBondContact O-N 2.8Å; S1042-R1044 VanDerWaalsContact O-N 3.16Å; R1044-E1047 WeakPolarHBondContact CA-OE2 3.27Å; R1044-K1048 WeakPolarHBondContact O-CB 3.45Å; R1044-K1048 PolarHBondContact O-N 3.45Å
1045	F	50.2	Low	53.8	Low	165 Å²	165	123.9 Å²	123.9	72%	0.724	65%	0.654	S	S	*	*	H	α-helix	trans	-80.4	-29.1	178.4	-122.3	-77.7	0	0	0	112.4	S1042 P1043 R1049	S1042-F1045 PolarHBondContact O-N 2.99Å; P1043-F1045 PolarHBondContact O-N 3.49Å; P1043-F1045 VanDerWaalsContact O-N 3.11Å; F1045-R1049 WeakPolarHBondContact O-CB 3.31Å; F1045-R1049 PolarHBondContact O-N 2.8Å; F1045-R1049 VanDerWaalsContact O-N 3.15Å
1046	Q	56	Low	55.9	Low	138 Å²	138	122.4 Å²	122.4	65%	0.645	64%	0.642	S	S	*	*	H	α-helix	trans	-72.9	-41.3	167.7	-73.6	-170.2	-6.2	0	0	111.4	P1043 R1049 K1050	P1043-Q1046 PolarHBondContact O-N 3.32Å; Q1046-R1049 PolarHBondContact O-N 3.27Å; Q1046-K1050 WeakPolarHBondContact O-CG 3.45Å; Q1046-K1050 PolarHBondContact O-N 3.24Å
1047	E	59.7	Low	58.2	Low	106 Å²	106	124.3 Å²	124.3	50%	0.495	63%	0.63	S	S	.	*	H	α-helix	trans	-59.1	-48.3	174.2	-70.2	176.4	133.2	0	0	111.2	P1043 R1044 R1049 K1050 Y1051	P1043-E1047 WeakPolarHBondContact O-CG 3.45Å; P1043-E1047 PolarHBondContact O-N 2.84Å; R1044-E1047 WeakPolarHBondContact CA-OE2 3.27Å; E1047-R1049 PolarHBondContact O-N 3.4Å; E1047-K1050 WeakPolarHBondContact O-CB 3.32Å; E1047-K1050 PolarHBondContact O-N 3.1Å; E1047-Y1051 WeakPolarHBondContact O-CD2 3.17Å; E1047-Y1051 PolarHBondContact O-N 3.43Å
1048	K	66.9	Low	60.4	Low	124 Å²	124	125 Å²	125	54%	0.539	62%	0.623	S	S	.	*	H	α-helix	trans	-58.5	-47.3	175.3	-167.7	-172.1	171.6	-174.3	0	111.2	R1044 K1050 Y1051 D1052	R1044-K1048 WeakPolarHBondContact O-CB 3.45Å; R1044-K1048 PolarHBondContact O-N 3.45Å; K1048-K1050 VanDerWaalsContact C-N 3.29Å; K1048-K1050 PolarHBondContact O-N 3Å; K1048-Y1051 CarbonylContact O-C 3.58Å; K1048-Y1051 WeakPolarHBondContact O-CA 3.14Å; K1048-Y1051 WeakPolarHBondContact O-CB 3.47Å; K1048-Y1051 PolarHBondContact O-N 3.42Å; K1048-D1052 WeakPolarHBondContact CE-OD2 3.27Å; K1048-D1052 VanDerWaalsContact O-CG 3.22Å; K1048-D1052 PolarHBondContact O-N 2.81Å
1049	R	67.1	Low	62.5	Low	190 Å²	190	123.1 Å²	123.1	72%	0.717	61%	0.614	S	S	*	*	H	α-helix	trans	-63.8	-32.5	179.8	-152.5	177.8	-164.5	-169.3	4.9	112.8	F1045 Q1046 E1047 I1053	F1045-R1049 WeakPolarHBondContact O-CB 3.31Å; F1045-R1049 PolarHBondContact O-N 2.8Å; F1045-R1049 VanDerWaalsContact O-N 3.15Å; Q1046-R1049 PolarHBondContact O-N 3.27Å; E1047-R1049 PolarHBondContact O-N 3.4Å; R1049-I1053 WeakPolarHBondContact O-CD1 3.4Å; R1049-I1053 VanDerWaalsContact O-CG1 3.23Å; R1049-I1053 WeakPolarHBondContact O-CG1 3.34Å; R1049-I1053 PolarHBondContact O-N 2.86Å; R1049-I1053 VanDerWaalsContact O-N 3.16Å
1050	K	73.2	Confident	64.8	Low	139 Å²	139	124 Å²	124	60%	0.604	60%	0.603	S	S	*	*	H	α-helix	trans	-66.6	-44.2	170.3	-73.8	174.5	178.8	-178.1	0	111.6	Q1046 E1047 K1048 I1053 M1054	Q1046-K1050 WeakPolarHBondContact O-CG 3.45Å; Q1046-K1050 PolarHBondContact O-N 3.24Å; E1047-K1050 WeakPolarHBondContact O-CB 3.32Å; E1047-K1050 PolarHBondContact O-N 3.1Å; K1048-K1050 VanDerWaalsContact C-N 3.29Å; K1048-K1050 PolarHBondContact O-N 3Å; K1050-I1053 PolarHBondContact O-N 2.82Å; K1050-M1054 WeakPolarHBondContact O-CB 3.48Å; K1050-M1054 PolarHBondContact O-N 3.43Å
1051	Y	73.2	Confident	66.7	Low	158 Å²	158	121.1 Å²	121.1	62%	0.62	58%	0.579	S	S	*	*	H	α-helix	trans	-62.2	-45.7	174.7	-96.7	-75.3	0	0	0	112.3	E1047 K1048 I1053 M1054 V1055	E1047-Y1051 WeakPolarHBondContact O-CD2 3.17Å; E1047-Y1051 PolarHBondContact O-N 3.43Å; K1048-Y1051 CarbonylContact O-C 3.58Å; K1048-Y1051 WeakPolarHBondContact O-CA 3.14Å; K1048-Y1051 WeakPolarHBondContact O-CB 3.47Å; K1048-Y1051 PolarHBondContact O-N 3.42Å; Y1051-I1053 VanDerWaalsContact C-N 3.32Å; Y1051-I1053 PolarHBondContact O-N 3.07Å; Y1051-M1054 PolarHBondContact O-N 2.8Å; Y1051-M1054 VanDerWaalsContact O-N 3.14Å; Y1051-V1055 WeakPolarHBondContact O-CG2 3.37Å; Y1051-V1055 PolarHBondContact O-N 3.15Å
1052	D	73.7	Confident	68.5	Low	77 Å²	77	120.4 Å²	120.4	41%	0.412	56%	0.559	S	S	.	*	H	α-helix	trans	-60.7	-41.3	178.7	-63.2	-27.8	0	0	0	110.7	K1048 T1056	K1048-D1052 WeakPolarHBondContact CE-OD2 3.27Å; K1048-D1052 VanDerWaalsContact O-CG 3.22Å; K1048-D1052 PolarHBondContact O-N 2.81Å; D1052-T1056 WeakPolarHBondContact O-CB 3.36Å; D1052-T1056 PolarHBondContact O-N 2.78Å; D1052-T1056 PolarHBondContact O-OG1 2.82Å
1053	I	77.7	Confident	70.1	Confident	116 Å²	116	120.1 Å²	120.1	60%	0.595	56%	0.557	S	S	*	*	H	α-helix	trans	-65.1	-43	173.3	-69.7	165.9	0	0	0	111.6	R1049 K1050 Y1051 T1056 R1057	R1049-I1053 WeakPolarHBondContact O-CD1 3.4Å; R1049-I1053 VanDerWaalsContact O-CG1 3.23Å; R1049-I1053 WeakPolarHBondContact O-CG1 3.34Å; R1049-I1053 PolarHBondContact O-N 2.86Å; R1049-I1053 VanDerWaalsContact O-N 3.16Å; K1050-I1053 PolarHBondContact O-N 2.82Å; Y1051-I1053 VanDerWaalsContact C-N 3.32Å; Y1051-I1053 PolarHBondContact O-N 3.07Å; I1053-T1056 PolarHBondContact O-N 3.1Å; I1053-R1057 PolarHBondContact O-N 3.11Å
1054	M	75.8	Confident	71.5	Confident	98 Å²	98	119.6 Å²	119.6	48%	0.483	55%	0.549	S	S	.	.	H	α-helix	trans	-64.1	-42.3	178.3	-177.2	-176.4	-71.7	0	0	112	K1050 Y1051 R1057 F1058	K1050-M1054 WeakPolarHBondContact O-CB 3.48Å; K1050-M1054 PolarHBondContact O-N 3.43Å; Y1051-M1054 PolarHBondContact O-N 2.8Å; Y1051-M1054 VanDerWaalsContact O-N 3.14Å; M1054-R1057 PolarHBondContact O-N 2.88Å; M1054-F1058 HydrophobicContact CG-CD2 3.81Å; M1054-F1058 HydrophobicContact CG-CE2 3.45Å; M1054-F1058 VanDerWaalsContact CG-CE2 3.45Å; M1054-F1058 HydrophobicContact CG-CZ 4.31Å; M1054-F1058 WeakPolarHBondContact O-CD2 3.5Å; M1054-F1058 PolarHBondContact O-N 2.94Å; M1054-F1058 HydrophobicContact SD-CE2 3.92Å
1055	V	77.7	Confident	73.1	Confident	75 Å²	75	116 Å²	116	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-63.3	-44.4	174	170.5	0	0	0	0	110.7	Y1051 R1057 F1058 Q1059	Y1051-V1055 WeakPolarHBondContact O-CG2 3.37Å; Y1051-V1055 PolarHBondContact O-N 3.15Å; V1055-R1057 VanDerWaalsContact C-N 3.29Å; V1055-R1057 PolarHBondContact O-N 2.95Å; V1055-F1058 PolarHBondContact O-N 2.93Å; V1055-Q1059 HydrophobicContact CG1-CG 4.48Å; V1055-Q1059 WeakPolarHBondContact O-CB 3.25Å; V1055-Q1059 WeakPolarHBondContact O-CG 3.35Å; V1055-Q1059 PolarHBondContact O-N 3.34Å
1056	T	77.7	Confident	74.3	Confident	93 Å²	93	114.1 Å²	114.1	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-60.4	-40.4	176.6	-51.5	0	0	0	0	111.4	D1052 I1053 K1060	D1052-T1056 WeakPolarHBondContact O-CB 3.36Å; D1052-T1056 PolarHBondContact O-N 2.78Å; D1052-T1056 PolarHBondContact O-OG1 2.82Å; I1053-T1056 PolarHBondContact O-N 3.1Å; T1056-K1060 PolarHBondContact O-N 2.81Å; T1056-K1060 VanDerWaalsContact O-N 3.14Å
1057	R	82	Confident	75.2	Confident	163 Å²	163	110.1 Å²	110.1	62%	0.615	53%	0.528	S	S	*	.	H	α-helix	trans	-63.2	-51	174.5	178.2	178.3	169.9	167.6	0.5	111.7	I1053 M1054 V1055 Q1059 K1060 E1061	I1053-R1057 PolarHBondContact O-N 3.11Å; M1054-R1057 PolarHBondContact O-N 2.88Å; V1055-R1057 VanDerWaalsContact C-N 3.29Å; V1055-R1057 PolarHBondContact O-N 2.95Å; R1057-Q1059 VanDerWaalsContact C-N 3.32Å; R1057-Q1059 PolarHBondContact O-N 2.93Å; R1057-K1060 WeakPolarHBondContact O-CB 3.37Å; R1057-K1060 PolarHBondContact O-N 2.82Å; R1057-K1060 VanDerWaalsContact O-N 3.09Å; R1057-E1061 IonicContact CZ-OE1 3.85Å; R1057-E1061 VanDerWaalsContact CZ-OE1 3.22Å; R1057-E1061 IonicContact NE-OE1 3.52Å; R1057-E1061 PolarHBondContact NE-OE1 3.31Å; R1057-E1061 IonicContact NH2-OE1 2.75Å; R1057-E1061 PolarHBondContact NH2-OE1 2.79Å; R1057-E1061 PolarHBondContact O-N 2.79Å
1058	F	79.1	Confident	75.9	Confident	108 Å²	108	108.4 Å²	108.4	47%	0.474	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-33.5	179.5	-72.3	-46.5	0	0	0	112.8	M1054 V1055 K1060 E1061 I1062	M1054-F1058 HydrophobicContact CG-CD2 3.81Å; M1054-F1058 HydrophobicContact CG-CE2 3.45Å; M1054-F1058 VanDerWaalsContact CG-CE2 3.45Å; M1054-F1058 HydrophobicContact CG-CZ 4.31Å; M1054-F1058 WeakPolarHBondContact O-CD2 3.5Å; M1054-F1058 PolarHBondContact O-N 2.94Å; M1054-F1058 HydrophobicContact SD-CE2 3.92Å; V1055-F1058 PolarHBondContact O-N 2.93Å; F1058-K1060 VanDerWaalsContact C-N 3.31Å; F1058-K1060 PolarHBondContact O-N 3.44Å; F1058-E1061 VanDerWaalsContact CD1-OE2 3.31Å; F1058-E1061 WeakPolarHBondContact CD1-OE2 3.36Å; F1058-E1061 PolarHBondContact O-N 2.99Å; F1058-I1062 WeakPolarHBondContact O-CB 3.38Å; F1058-I1062 WeakPolarHBondContact O-CD1 3.42Å; F1058-I1062 VanDerWaalsContact O-CG1 3.22Å; F1058-I1062 WeakPolarHBondContact O-CG1 3.45Å; F1058-I1062 PolarHBondContact O-N 3.25Å
1059	Q	77.5	Confident	76.2	Confident	128 Å²	128	108.2 Å²	108.2	60%	0.598	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-34.8	172.1	-76.2	-176.4	-72.9	0	0	112.2	V1055 R1057 S1063	V1055-Q1059 HydrophobicContact CG1-CG 4.48Å; V1055-Q1059 WeakPolarHBondContact O-CB 3.25Å; V1055-Q1059 WeakPolarHBondContact O-CG 3.35Å; V1055-Q1059 PolarHBondContact O-N 3.34Å; R1057-Q1059 VanDerWaalsContact C-N 3.32Å; R1057-Q1059 PolarHBondContact O-N 2.93Å; Q1059-S1063 WeakPolarHBondContact O-CB 3.26Å; Q1059-S1063 PolarHBondContact O-N 2.79Å
1060	K	81.2	Confident	76.4	Confident	133 Å²	133	105.9 Å²	105.9	58%	0.578	53%	0.525	S	S	*	.	H	α-helix	trans	-67.2	-49.3	171	-162.4	-157.9	171.4	-144.9	0	111.5	T1056 R1057 F1058 I1062 S1063 D1064	T1056-K1060 PolarHBondContact O-N 2.81Å; T1056-K1060 VanDerWaalsContact O-N 3.14Å; R1057-K1060 WeakPolarHBondContact O-CB 3.37Å; R1057-K1060 PolarHBondContact O-N 2.82Å; R1057-K1060 VanDerWaalsContact O-N 3.09Å; F1058-K1060 VanDerWaalsContact C-N 3.31Å; F1058-K1060 PolarHBondContact O-N 3.44Å; K1060-I1062 VanDerWaalsContact C-N 3.26Å; K1060-I1062 PolarHBondContact O-N 3.37Å; K1060-S1063 CarbonylContact O-C 3.55Å; K1060-S1063 WeakPolarHBondContact O-CA 3.4Å; K1060-S1063 WeakPolarHBondContact O-CB 3.36Å; K1060-S1063 PolarHBondContact O-N 3.42Å; K1060-D1064 WeakPolarHBondContact CE-OD2 3.24Å; K1060-D1064 IonicContact NZ-OD2 3.01Å; K1060-D1064 PolarHBondContact NZ-OD2 2.99Å; K1060-D1064 VanDerWaalsContact NZ-OD2 3.17Å; K1060-D1064 PolarHBondContact O-N 2.81Å
1061	E	79.8	Confident	76.2	Confident	65 Å²	65	105.8 Å²	105.8	30%	0.304	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-36.2	179.2	-70.1	173.2	175.2	0	0	111.9	R1057 F1058 L1065	R1057-E1061 IonicContact CZ-OE1 3.85Å; R1057-E1061 VanDerWaalsContact CZ-OE1 3.22Å; R1057-E1061 IonicContact NE-OE1 3.52Å; R1057-E1061 PolarHBondContact NE-OE1 3.31Å; R1057-E1061 IonicContact NH2-OE1 2.75Å; R1057-E1061 PolarHBondContact NH2-OE1 2.79Å; R1057-E1061 PolarHBondContact O-N 2.79Å; F1058-E1061 VanDerWaalsContact CD1-OE2 3.31Å; F1058-E1061 WeakPolarHBondContact CD1-OE2 3.36Å; F1058-E1061 PolarHBondContact O-N 2.99Å; E1061-L1065 WeakPolarHBondContact O-CB 3.33Å; E1061-L1065 VanDerWaalsContact O-CG 3.25Å; E1061-L1065 WeakPolarHBondContact O-CG 3.29Å; E1061-L1065 PolarHBondContact O-N 3.15Å
1062	I	75.5	Confident	76	Confident	92 Å²	92	104.7 Å²	104.7	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-42.3	171.2	-71.2	165.2	0	0	0	111.7	F1058 K1060 L1065 Q1066	F1058-I1062 WeakPolarHBondContact O-CB 3.38Å; F1058-I1062 WeakPolarHBondContact O-CD1 3.42Å; F1058-I1062 VanDerWaalsContact O-CG1 3.22Å; F1058-I1062 WeakPolarHBondContact O-CG1 3.45Å; F1058-I1062 PolarHBondContact O-N 3.25Å; K1060-I1062 VanDerWaalsContact C-N 3.26Å; K1060-I1062 PolarHBondContact O-N 3.37Å; I1062-L1065 PolarHBondContact O-N 3.16Å; I1062-Q1066 HydrophobicContact CG2-CG 4.46Å; I1062-Q1066 WeakPolarHBondContact O-CB 3.33Å; I1062-Q1066 VanDerWaalsContact O-CG 3.26Å; I1062-Q1066 WeakPolarHBondContact O-CG 3.47Å; I1062-Q1066 PolarHBondContact O-N 2.83Å
1063	S	75.5	Confident	75.8	Confident	66 Å²	66	102.8 Å²	102.8	46%	0.462	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-41.1	177.2	-170.8	0	0	0	0	112.2	Q1059 K1060 Q1066 A1067	Q1059-S1063 WeakPolarHBondContact O-CB 3.26Å; Q1059-S1063 PolarHBondContact O-N 2.79Å; K1060-S1063 CarbonylContact O-C 3.55Å; K1060-S1063 WeakPolarHBondContact O-CA 3.4Å; K1060-S1063 WeakPolarHBondContact O-CB 3.36Å; K1060-S1063 PolarHBondContact O-N 3.42Å; S1063-Q1066 PolarHBondContact O-N 2.77Å; S1063-A1067 PolarHBondContact O-N 3.34Å
1064	D	77.9	Confident	75.4	Confident	80 Å²	80	98.9 Å²	98.9	43%	0.428	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-40.3	178.4	-66.3	-16.5	0	0	0	110	K1060 A1067 S1068	K1060-D1064 WeakPolarHBondContact CE-OD2 3.24Å; K1060-D1064 IonicContact NZ-OD2 3.01Å; K1060-D1064 PolarHBondContact NZ-OD2 2.99Å; K1060-D1064 VanDerWaalsContact NZ-OD2 3.17Å; K1060-D1064 PolarHBondContact O-N 2.81Å; D1064-A1067 PolarHBondContact O-N 3.48Å; D1064-S1068 PolarHBondContact O-N 2.88Å; D1064-S1068 VanDerWaalsContact O-N 3.07Å
1065	L	77	Confident	75	Confident	121 Å²	121	96.8 Å²	96.8	63%	0.634	50%	0.5	S	S	*	.	H	α-helix	trans	-66.1	-38	172.1	-75.3	169.3	0	0	0	113.2	E1061 I1062 A1067 S1068 L1069	E1061-L1065 WeakPolarHBondContact O-CB 3.33Å; E1061-L1065 VanDerWaalsContact O-CG 3.25Å; E1061-L1065 WeakPolarHBondContact O-CG 3.29Å; E1061-L1065 PolarHBondContact O-N 3.15Å; I1062-L1065 PolarHBondContact O-N 3.16Å; L1065-A1067 VanDerWaalsContact C-N 3.34Å; L1065-S1068 PolarHBondContact O-N 2.82Å; L1065-L1069 WeakPolarHBondContact O-CB 3.49Å; L1065-L1069 PolarHBondContact O-N 3.19Å
1066	Q	75.4	Confident	74.7	Confident	126 Å²	126	99.7 Å²	99.7	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-65.2	-37.1	175.3	-79.1	175.1	-8.9	0	0	112.1	I1062 S1063 Y1070	I1062-Q1066 HydrophobicContact CG2-CG 4.46Å; I1062-Q1066 WeakPolarHBondContact O-CB 3.33Å; I1062-Q1066 VanDerWaalsContact O-CG 3.26Å; I1062-Q1066 WeakPolarHBondContact O-CG 3.47Å; I1062-Q1066 PolarHBondContact O-N 2.83Å; S1063-Q1066 PolarHBondContact O-N 2.77Å; Q1066-Y1070 PolarHBondContact O-N 3.39Å; Q1066-Y1070 VanDerWaalsContact O-N 3.14Å
1067	A	75.9	Confident	74.1	Confident	55 Å²	55	97.4 Å²	97.4	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-46.5	172.8	0	0	0	0	0	111.6	S1063 D1064 L1065 L1069 Y1070 E1071	S1063-A1067 PolarHBondContact O-N 3.34Å; D1064-A1067 PolarHBondContact O-N 3.48Å; L1065-A1067 VanDerWaalsContact C-N 3.34Å; A1067-L1069 PolarHBondContact O-N 3.16Å; A1067-Y1070 WeakPolarHBondContact O-CB 3.48Å; A1067-Y1070 PolarHBondContact O-N 2.98Å; A1067-Y1070 VanDerWaalsContact O-N 3.15Å; A1067-E1071 PolarHBondContact O-N 3.3Å; A1067-E1071 VanDerWaalsContact O-N 3.07Å
1068	S	75.2	Confident	73.6	Confident	70 Å²	70	95.9 Å²	95.9	49%	0.49	49%	0.485	S	S	.	.	H	α-helix	trans	-60.5	-43	177.1	-166.4	0	0	0	0	112.4	D1064 L1065 Y1070 E1071 E1072	D1064-S1068 PolarHBondContact O-N 2.88Å; D1064-S1068 VanDerWaalsContact O-N 3.07Å; L1065-S1068 PolarHBondContact O-N 2.82Å; S1068-Y1070 VanDerWaalsContact C-N 3.26Å; S1068-Y1070 PolarHBondContact O-N 3.18Å; S1068-E1071 PolarHBondContact O-N 2.92Å; S1068-E1072 WeakPolarHBondContact O-CB 3.48Å; S1068-E1072 PolarHBondContact O-N 3.42Å
1069	L	73	Confident	73.3	Confident	119 Å²	119	96.6 Å²	96.6	62%	0.623	49%	0.491	S	S	*	.	H	α-helix	trans	-62.8	-32.9	176.8	-173.6	69.7	0	0	0	112.3	L1065 A1067 G1073	L1065-L1069 WeakPolarHBondContact O-CB 3.49Å; L1065-L1069 PolarHBondContact O-N 3.19Å; A1067-L1069 PolarHBondContact O-N 3.16Å; L1069-G1073 PolarHBondContact O-N 2.81Å
1070	Y	70.3	Confident	73	Confident	142 Å²	142	94.7 Å²	94.7	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-70.3	-43.7	175.1	179.4	-97.8	0	0	0	112	Q1066 A1067 S1068 G1073 Q1074	Q1066-Y1070 PolarHBondContact O-N 3.39Å; Q1066-Y1070 VanDerWaalsContact O-N 3.14Å; A1067-Y1070 WeakPolarHBondContact O-CB 3.48Å; A1067-Y1070 PolarHBondContact O-N 2.98Å; A1067-Y1070 VanDerWaalsContact O-N 3.15Å; S1068-Y1070 VanDerWaalsContact C-N 3.26Å; S1068-Y1070 PolarHBondContact O-N 3.18Å; Y1070-G1073 PolarHBondContact O-N 3.23Å; Y1070-Q1074 HydrophobicContact CD1-CG 4.41Å; Y1070-Q1074 HydrophobicContact CE1-CG 4.12Å; Y1070-Q1074 VanDerWaalsContact O-CG 3.24Å; Y1070-Q1074 WeakPolarHBondContact O-CG 3.36Å; Y1070-Q1074 PolarHBondContact O-N 3.42Å; Y1070-Q1074 PolarHBondContact OH-NE2 3.29Å
1071	E	70.1	Confident	72.5	Confident	137 Å²	137	88.6 Å²	88.6	64%	0.64	46%	0.457	S	S	*	.	H	α-helix	trans	-66.5	-38.9	176	-66.9	-165.4	161.5	0	0	112.7	A1067 S1068 Q1074 S1075	A1067-E1071 PolarHBondContact O-N 3.3Å; A1067-E1071 VanDerWaalsContact O-N 3.07Å; S1068-E1071 PolarHBondContact O-N 2.92Å; E1071-Q1074 PolarHBondContact O-N 3.38Å; E1071-S1075 WeakPolarHBondContact O-CB 3.47Å; E1071-S1075 PolarHBondContact O-N 3.33Å; E1071-S1075 PolarHBondContact O-OG 2.75Å
1072	E	69	Low	72.4	Confident	134 Å²	134	90 Å²	90	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-66.1	-41.5	173.8	-170.3	173.9	-152.9	0	0	111.2	S1068 Q1074 S1075 K1076	S1068-E1072 WeakPolarHBondContact O-CB 3.48Å; S1068-E1072 PolarHBondContact O-N 3.42Å; E1072-Q1074 PolarHBondContact O-N 3.18Å; E1072-S1075 PolarHBondContact O-N 3.29Å; E1072-K1076 WeakPolarHBondContact O-CB 3.23Å; E1072-K1076 PolarHBondContact O-N 3.43Å
1073	G	67.9	Low	72.4	Confident	38 Å²	38	90.8 Å²	90.8	39%	0.392	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-42.6	173.6	0	0	0	0	0	113.5	L1069 Y1070 S1075 L1077	L1069-G1073 PolarHBondContact O-N 2.81Å; Y1070-G1073 PolarHBondContact O-N 3.23Å; G1073-S1075 VanDerWaalsContact C-N 3.34Å; G1073-L1077 WeakPolarHBondContact O-CB 3.38Å; G1073-L1077 PolarHBondContact O-N 3.47Å
1074	Q	70	Confident	72.3	Confident	34 Å²	34	89.1 Å²	89.1	16%	0.159	45%	0.453	C	S	.	.	H	α-helix	trans	-65	-37.4	173.9	-71.6	-80.6	6.4	0	0	112.2	Y1070 E1071 E1072 L1077 R1078 V1217	Y1070-Q1074 HydrophobicContact CD1-CG 4.41Å; Y1070-Q1074 HydrophobicContact CE1-CG 4.12Å; Y1070-Q1074 VanDerWaalsContact O-CG 3.24Å; Y1070-Q1074 WeakPolarHBondContact O-CG 3.36Å; Y1070-Q1074 PolarHBondContact O-N 3.42Å; Y1070-Q1074 PolarHBondContact OH-NE2 3.29Å; E1071-Q1074 PolarHBondContact O-N 3.38Å; E1072-Q1074 PolarHBondContact O-N 3.18Å; Q1074-L1077 PolarHBondContact O-N 2.98Å; Q1074-R1078 PolarHBondContact O-N 3.14Å; Q1074-R1078 VanDerWaalsContact O-N 3.09Å; Q1074-V1217 PolarHBondContact NE2-O 3.2Å
1075	S	67.7	Low	72.2	Confident	54 Å²	54	85.3 Å²	85.3	38%	0.378	43%	0.432	S	S	.	.	H	α-helix	trans	-69.5	-44.7	178	-59.5	0	0	0	0	111.6	E1071 E1072 G1073 L1077 R1078 M1079	E1071-S1075 WeakPolarHBondContact O-CB 3.47Å; E1071-S1075 PolarHBondContact O-N 3.33Å; E1071-S1075 PolarHBondContact O-OG 2.75Å; E1072-S1075 PolarHBondContact O-N 3.29Å; G1073-S1075 VanDerWaalsContact C-N 3.34Å; S1075-L1077 VanDerWaalsContact C-N 3.35Å; S1075-L1077 PolarHBondContact O-N 3.01Å; S1075-R1078 PolarHBondContact O-N 2.96Å; S1075-M1079 PolarHBondContact O-N 3.45Å; S1075-M1079 VanDerWaalsContact O-N 3.07Å
1076	K	71.2	Confident	72.1	Confident	136 Å²	136	83.6 Å²	83.6	59%	0.591	42%	0.42	S	S	*	.	H	α-helix	trans	-57.5	-45.4	171.4	177.6	-179.8	176.5	179.1	0	111.8	E1072 R1078 M1079 M1080	E1072-K1076 WeakPolarHBondContact O-CB 3.23Å; E1072-K1076 PolarHBondContact O-N 3.43Å; K1076-R1078 VanDerWaalsContact C-N 3.33Å; K1076-R1078 PolarHBondContact O-N 3.22Å; K1076-M1079 PolarHBondContact O-N 2.85Å; K1076-M1080 HydrophobicContact CG-SD 4.25Å; K1076-M1080 WeakPolarHBondContact O-CG 3.36Å; K1076-M1080 PolarHBondContact O-N 3.36Å
1077	L	65.2	Low	72.2	Confident	45 Å²	45	83.1 Å²	83.1	24%	0.236	42%	0.418	C	S	.	.	H	α-helix	trans	-60.2	-42.5	177.9	179.1	61.4	0	0	0	111.6	G1073 Q1074 S1075 M1080 L1081 V1217	G1073-L1077 WeakPolarHBondContact O-CB 3.38Å; G1073-L1077 PolarHBondContact O-N 3.47Å; Q1074-L1077 PolarHBondContact O-N 2.98Å; S1075-L1077 VanDerWaalsContact C-N 3.35Å; S1075-L1077 PolarHBondContact O-N 3.01Å; L1077-M1080 PolarHBondContact O-N 2.65Å; L1077-L1081 HydrophobicContact CG-CD1 4.36Å; L1077-L1081 WeakPolarHBondContact O-CG 2.75Å; L1077-L1081 PolarHBondContact O-N 3.17Å; L1077-L1081 VanDerWaalsContact O-N 3.08Å; L1077-V1217 HydrophobicContact CD2-CB 4.4Å; L1077-V1217 HydrophobicContact CD2-CG2 3.79Å
1078	R	70.5	Confident	72.2	Confident	131 Å²	131	81 Å²	81	49%	0.494	40%	0.398	S	S	.	.	H	α-helix	trans	-61.6	-45.4	175.6	-167.6	-177.8	-58	149.3	8.3	112.1	Q1074 S1075 K1076 M1080 L1081 E1082 L1216	Q1074-R1078 PolarHBondContact O-N 3.14Å; Q1074-R1078 VanDerWaalsContact O-N 3.09Å; S1075-R1078 PolarHBondContact O-N 2.96Å; K1076-R1078 VanDerWaalsContact C-N 3.33Å; K1076-R1078 PolarHBondContact O-N 3.22Å; R1078-M1080 VanDerWaalsContact C-N 3.33Å; R1078-M1080 PolarHBondContact O-N 3.01Å; R1078-L1081 PolarHBondContact O-N 2.92Å; R1078-E1082 PolarHBondContact O-N 2.86Å; R1078-L1216 HydrophobicContact CB-CD2 4.15Å; R1078-L1216 HydrophobicContact CG-CD2 4.3Å
1079	M	73	Confident	72.3	Confident	123 Å²	123	80 Å²	80	61%	0.606	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-35.6	176.9	-68.8	177.6	177	0	0	112.6	S1075 K1076 E1082 L1083	S1075-M1079 PolarHBondContact O-N 3.45Å; S1075-M1079 VanDerWaalsContact O-N 3.07Å; K1076-M1079 PolarHBondContact O-N 2.85Å; M1079-E1082 PolarHBondContact O-N 3.08Å; M1079-L1083 WeakPolarHBondContact O-CB 3.39Å; M1079-L1083 WeakPolarHBondContact O-CG 3.48Å; M1079-L1083 PolarHBondContact O-N 2.96Å
1080	M	72.1	Confident	72.3	Confident	87 Å²	87	79 Å²	79	43%	0.429	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-44.2	173.7	-74.9	177.5	58.3	0	0	112.2	K1076 L1077 R1078 E1082 L1083 E1084	K1076-M1080 HydrophobicContact CG-SD 4.25Å; K1076-M1080 WeakPolarHBondContact O-CG 3.36Å; K1076-M1080 PolarHBondContact O-N 3.36Å; L1077-M1080 PolarHBondContact O-N 2.65Å; R1078-M1080 VanDerWaalsContact C-N 3.33Å; R1078-M1080 PolarHBondContact O-N 3.01Å; M1080-E1082 VanDerWaalsContact C-N 3.32Å; M1080-E1082 PolarHBondContact O-N 2.9Å; M1080-L1083 PolarHBondContact O-N 3.21Å; M1080-E1084 WeakPolarHBondContact O-CG 3.34Å; M1080-E1084 PolarHBondContact O-N 2.73Å
1081	L	70.6	Confident	72.5	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.026	36%	0.363	C	S	.	.	H	α-helix	trans	-64.7	-36.3	177.5	-64.3	167.2	0	0	0	112.1	L1077 R1078 C1085 I1175 L1216	L1077-L1081 HydrophobicContact CG-CD1 4.36Å; L1077-L1081 WeakPolarHBondContact O-CG 2.75Å; L1077-L1081 PolarHBondContact O-N 3.17Å; L1077-L1081 VanDerWaalsContact O-N 3.08Å; R1078-L1081 PolarHBondContact O-N 2.92Å; L1081-C1085 PolarHBondContact O-N 3.28Å; L1081-C1085 VanDerWaalsContact O-N 3.12Å; L1081-I1175 HydrophobicContact CB-CD1 4.32Å; L1081-I1175 HydrophobicContact CD2-CD1 3.5Å; L1081-I1175 HydrophobicContact CD2-CG1 4.08Å; L1081-L1216 HydrophobicContact CD1-CD1 4.32Å; L1081-L1216 HydrophobicContact CD1-CD2 4.25Å; L1081-L1216 HydrophobicContact CD1-CG 3.68Å
1082	E	76.6	Confident	72.7	Confident	95 Å²	95	68.1 Å²	68.1	44%	0.444	34%	0.335	S	S	.	.	H	α-helix	trans	-66.9	-43.3	173.7	-173.5	173.7	-177	0	0	111.6	R1078 M1079 M1080 C1085 K1086	R1078-E1082 PolarHBondContact O-N 2.86Å; M1079-E1082 PolarHBondContact O-N 3.08Å; M1080-E1082 VanDerWaalsContact C-N 3.32Å; M1080-E1082 PolarHBondContact O-N 2.9Å; E1082-C1085 WeakPolarHBondContact O-CB 3.48Å; E1082-C1085 PolarHBondContact O-N 2.81Å; E1082-K1086 WeakPolarHBondContact O-CG 3.48Å; E1082-K1086 PolarHBondContact O-N 3.39Å
1083	L	76.4	Confident	72.7	Confident	108 Å²	108	66.1 Å²	66.1	57%	0.565	33%	0.332	S	S	*	.	H	α-helix	trans	-60.4	-48.5	173.8	-78.3	166	0	0	0	111.9	M1079 M1080 C1085 K1086 E1087	M1079-L1083 WeakPolarHBondContact O-CB 3.39Å; M1079-L1083 WeakPolarHBondContact O-CG 3.48Å; M1079-L1083 PolarHBondContact O-N 2.96Å; M1080-L1083 PolarHBondContact O-N 3.21Å; L1083-C1085 PolarHBondContact O-N 3.07Å; L1083-K1086 CarbonylContact O-C 3.53Å; L1083-K1086 WeakPolarHBondContact O-CA 3.49Å; L1083-K1086 PolarHBondContact O-N 3.46Å; L1083-E1087 WeakPolarHBondContact O-CG 3.18Å; L1083-E1087 PolarHBondContact O-N 3.36Å
1084	E	74.3	Confident	73	Confident	31 Å²	31	65.7 Å²	65.7	15%	0.145	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-36.5	176.5	-73.7	-175.3	-151.8	0	0	112.3	M1080 E1087 E1088 K1157 F1159 I1175	M1080-E1084 WeakPolarHBondContact O-CG 3.34Å; M1080-E1084 PolarHBondContact O-N 2.73Å; E1084-E1087 PolarHBondContact O-N 3.14Å; E1084-E1088 PolarHBondContact O-N 3.44Å; E1084-K1157 IonicContact OE1-NZ 2.68Å; E1084-K1157 IonicContact OE2-NZ 3.8Å; E1084-K1157 PolarHBondContact OE2-NZ 2.85Å; E1084-F1159 WeakPolarHBondContact O-CZ 3.19Å; E1084-I1175 HydrophobicContact CB-CD1 4.16Å
1085	C	74.4	Confident	72.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-41.2	172.8	-177.5	0	0	0	0	111.7	L1081 E1082 L1083 E1089 F1159 Y1161 S1170	L1081-C1085 PolarHBondContact O-N 3.28Å; L1081-C1085 VanDerWaalsContact O-N 3.12Å; E1082-C1085 WeakPolarHBondContact O-CB 3.48Å; E1082-C1085 PolarHBondContact O-N 2.81Å; L1083-C1085 PolarHBondContact O-N 3.07Å; C1085-E1089 WeakPolarHBondContact O-CB 3.36Å; C1085-E1089 WeakPolarHBondContact O-CG 3.3Å; C1085-E1089 PolarHBondContact O-N 3.08Å; C1085-E1089 VanDerWaalsContact O-N 3.11Å; C1085-F1159 VanDerWaalsContact CA-CE1 3.44Å; C1085-F1159 HydrophobicContact CB-CD1 4.26Å; C1085-F1159 HydrophobicContact CB-CE1 3.84Å; C1085-Y1161 PolarHBondContact SG-OH 3.26Å; C1085-S1170 PolarHBondContact SG-OG 3.19Å
1086	K	75.6	Confident	73	Confident	85 Å²	85	68.5 Å²	68.5	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-72.7	-30.1	177.6	-63.1	-64.4	152.8	-152.1	0	112.7	E1082 L1083 E1089 L1090 S1170	E1082-K1086 WeakPolarHBondContact O-CG 3.48Å; E1082-K1086 PolarHBondContact O-N 3.39Å; L1083-K1086 CarbonylContact O-C 3.53Å; L1083-K1086 WeakPolarHBondContact O-CA 3.49Å; L1083-K1086 PolarHBondContact O-N 3.46Å; K1086-E1089 IonicContact NZ-OE2 3.57Å; K1086-E1089 PolarHBondContact NZ-OE2 3.36Å; K1086-L1090 VanDerWaalsContact O-CB 3.25Å; K1086-L1090 WeakPolarHBondContact O-CB 3.31Å; K1086-L1090 WeakPolarHBondContact O-CD1 3.47Å; K1086-L1090 WeakPolarHBondContact O-CG 3.28Å; K1086-L1090 PolarHBondContact O-N 2.77Å; K1086-S1170 WeakPolarHBondContact CE-OG 3.5Å; K1086-S1170 PolarHBondContact NZ-OG 2.84Å
1087	E	77.6	Confident	72.8	Confident	117 Å²	117	66 Å²	66	55%	0.547	32%	0.317	S	S	.	.	H	α-helix	trans	-65.5	-46.9	174.7	-73.9	178	163.1	0	0	112.5	L1083 E1084 L1090 E1091	L1083-E1087 WeakPolarHBondContact O-CG 3.18Å; L1083-E1087 PolarHBondContact O-N 3.36Å; E1084-E1087 PolarHBondContact O-N 3.14Å; E1087-L1090 PolarHBondContact O-N 3.14Å; E1087-E1091 PolarHBondContact O-N 3.42Å
1088	E	76.6	Confident	72.9	Confident	10 Å²	10	64.3 Å²	64.3	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-73.2	-29.6	176.2	-74	-92.5	177.1	0	0	112.3	E1084 L1092 F1154 R1156 K1157 F1159	E1084-E1088 PolarHBondContact O-N 3.44Å; E1088-L1092 VanDerWaalsContact O-CB 3.27Å; E1088-L1092 WeakPolarHBondContact O-CB 3.36Å; E1088-L1092 PolarHBondContact O-N 2.77Å; E1088-F1154 HydrophobicContact CB-CB 4.29Å; E1088-F1154 HydrophobicContact CB-CD1 3.79Å; E1088-F1154 HydrophobicContact CB-CD2 4.49Å; E1088-F1154 HydrophobicContact CB-CE1 4.14Å; E1088-F1154 HydrophobicContact CB-CG 3.98Å; E1088-F1154 WeakPolarHBondContact O-CD1 3.5Å; E1088-F1154 WeakPolarHBondContact OE2-CB 3.49Å; E1088-R1156 WeakPolarHBondContact OE1-CB 3.45Å; E1088-K1157 HydrophobicContact CG-CB 4.26Å; E1088-K1157 HydrophobicContact CG-CD 4.17Å; E1088-F1159 HydrophobicContact CB-CE2 3.88Å; E1088-F1159 HydrophobicContact CB-CZ 4.02Å; E1088-F1159 HydrophobicContact CG-CE2 3.9Å; E1088-F1159 HydrophobicContact CG-CZ 3.99Å
1089	E	75.6	Confident	72.7	Confident	50 Å²	50	60.5 Å²	60.5	23%	0.234	30%	0.3	C	S	.	.	H	α-helix	trans	-66.5	-38.5	168.2	-74.1	-169.1	139.2	0	0	112.1	C1085 K1086 L1092 V1093 R1128 F1154	C1085-E1089 WeakPolarHBondContact O-CB 3.36Å; C1085-E1089 WeakPolarHBondContact O-CG 3.3Å; C1085-E1089 PolarHBondContact O-N 3.08Å; C1085-E1089 VanDerWaalsContact O-N 3.11Å; K1086-E1089 IonicContact NZ-OE2 3.57Å; K1086-E1089 PolarHBondContact NZ-OE2 3.36Å; E1089-L1092 PolarHBondContact O-N 2.98Å; E1089-V1093 WeakPolarHBondContact O-CB 3.39Å; E1089-V1093 VanDerWaalsContact O-CG2 3.31Å; E1089-V1093 WeakPolarHBondContact O-CG2 3.19Å; E1089-V1093 PolarHBondContact O-N 3.36Å; E1089-R1128 IonicContact OE1-NH1 3.41Å; E1089-F1154 HydrophobicContact CG-CE1 3.91Å; E1089-F1154 HydrophobicContact CG-CZ 3.85Å
1090	L	74.1	Confident	72.2	Confident	97 Å²	97	59.8 Å²	59.8	51%	0.508	30%	0.298	S	S	.	.	H	α-helix	trans	-67.4	-47	173	-78.3	166.5	0	0	0	111.5	K1086 E1087 L1092 V1093 Q1094	K1086-L1090 VanDerWaalsContact O-CB 3.25Å; K1086-L1090 WeakPolarHBondContact O-CB 3.31Å; K1086-L1090 WeakPolarHBondContact O-CD1 3.47Å; K1086-L1090 WeakPolarHBondContact O-CG 3.28Å; K1086-L1090 PolarHBondContact O-N 2.77Å; E1087-L1090 PolarHBondContact O-N 3.14Å; L1090-L1092 PolarHBondContact O-N 3.28Å; L1090-V1093 PolarHBondContact O-N 3.26Å; L1090-Q1094 VanDerWaalsContact O-CB 3.22Å; L1090-Q1094 WeakPolarHBondContact O-CB 3.29Å; L1090-Q1094 VanDerWaalsContact O-CD 3.25Å; L1090-Q1094 WeakPolarHBondContact O-CG 3.1Å; L1090-Q1094 PolarHBondContact O-N 3.41Å; L1090-Q1094 PolarHBondContact O-OE1 3.01Å
1091	E	74.4	Confident	71.7	Confident	41 Å²	41	57.8 Å²	57.8	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-35.9	174.5	-94.2	-144.9	-165	0	0	111.5	E1087 Q1095 R1156	E1087-E1091 PolarHBondContact O-N 3.42Å; E1091-Q1095 VanDerWaalsContact O-CB 3.27Å; E1091-Q1095 WeakPolarHBondContact O-CB 3.19Å; E1091-Q1095 WeakPolarHBondContact O-CG 3.45Å; E1091-Q1095 PolarHBondContact O-N 3.42Å; E1091-R1156 IonicContact OE1-CZ 2.67Å; E1091-R1156 VanDerWaalsContact OE1-CZ 3.23Å; E1091-R1156 IonicContact OE1-NH1 2.79Å; E1091-R1156 PolarHBondContact OE1-NH1 3.48Å; E1091-R1156 IonicContact OE1-NH2 3.22Å; E1091-R1156 PolarHBondContact OE1-NH2 3.46Å; E1091-R1156 IonicContact OE2-CZ 2.67Å; E1091-R1156 IonicContact OE2-NH1 3.86Å; E1091-R1156 IonicContact OE2-NH2 2.71Å; E1091-R1156 PolarHBondContact OE2-NH2 3.3Å
1092	L	73.7	Confident	71.2	Confident	9 Å²	9	58.1 Å²	58.1	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-72.1	-42.1	175.8	-179.7	62.1	0	0	0	112.7	E1088 E1089 L1090 Q1094 Q1095 K1096 H1127 R1128 F1154	E1088-L1092 VanDerWaalsContact O-CB 3.27Å; E1088-L1092 WeakPolarHBondContact O-CB 3.36Å; E1088-L1092 PolarHBondContact O-N 2.77Å; E1089-L1092 PolarHBondContact O-N 2.98Å; L1090-L1092 PolarHBondContact O-N 3.28Å; L1092-Q1094 VanDerWaalsContact C-N 3.35Å; L1092-Q1095 PolarHBondContact O-N 3.37Å; L1092-K1096 WeakPolarHBondContact O-CG 3.42Å; L1092-K1096 PolarHBondContact O-N 3.15Å; L1092-H1127 HydrophobicContact CD1-CB 3.82Å; L1092-R1128 HydrophobicContact CD2-CB 4.16Å; L1092-R1128 HydrophobicContact CD2-CG 4.48Å; L1092-F1154 HydrophobicContact CB-CD1 4.33Å; L1092-F1154 HydrophobicContact CB-CE1 4.43Å; L1092-F1154 HydrophobicContact CD2-CD1 4.17Å; L1092-F1154 HydrophobicContact CD2-CE1 4Å
1093	V	70.1	Confident	70.4	Confident	92 Å²	92	60.3 Å²	60.3	56%	0.558	30%	0.301	S	S	*	.	H	α-helix	trans	-63.7	-43.7	174.3	166.2	0	0	0	0	110.2	E1089 L1090 Q1095 K1096 L1097	E1089-V1093 WeakPolarHBondContact O-CB 3.39Å; E1089-V1093 VanDerWaalsContact O-CG2 3.31Å; E1089-V1093 WeakPolarHBondContact O-CG2 3.19Å; E1089-V1093 PolarHBondContact O-N 3.36Å; L1090-V1093 PolarHBondContact O-N 3.26Å; V1093-Q1095 VanDerWaalsContact C-N 3.35Å; V1093-Q1095 PolarHBondContact O-N 2.77Å; V1093-K1096 PolarHBondContact O-N 3.43Å; V1093-L1097 WeakPolarHBondContact O-CB 3.29Å; V1093-L1097 PolarHBondContact O-N 3Å
1094	Q	72.6	Confident	69.3	Low	30 Å²	30	60.2 Å²	60.2	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-43.5	172.6	-69.6	158.4	-18	0	0	110	K945 M948 Y949 L1090 L1092 K1096 H1098	K945-Q1094 VanDerWaalsContact CE-C 3.47Å; K945-Q1094 VanDerWaalsContact CE-O 3.29Å; K945-Q1094 WeakPolarHBondContact CE-O 3.22Å; M948-Q1094 HydrophobicContact CE-CB 4.49Å; M948-Q1094 HydrophobicContact CE-CG 3.88Å; Y949-Q1094 HydrophobicContact CE1-CG 4.35Å; Y949-Q1094 PolarHBondContact OH-OE1 3.46Å; L1090-Q1094 VanDerWaalsContact O-CB 3.22Å; L1090-Q1094 WeakPolarHBondContact O-CB 3.29Å; L1090-Q1094 VanDerWaalsContact O-CD 3.25Å; L1090-Q1094 WeakPolarHBondContact O-CG 3.1Å; L1090-Q1094 PolarHBondContact O-N 3.41Å; L1090-Q1094 PolarHBondContact O-OE1 3.01Å; L1092-Q1094 VanDerWaalsContact C-N 3.35Å; Q1094-K1096 VanDerWaalsContact C-N 3.32Å; Q1094-K1096 PolarHBondContact O-N 2.99Å; Q1094-H1098 WeakPolarHBondContact O-CB 3.44Å; Q1094-H1098 PolarHBondContact O-N 2.82Å
1095	Q	69.3	Low	67.9	Low	32 Å²	32	61.2 Å²	61.2	15%	0.15	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-33	173.7	-80.8	178	35	0	0	114.2	K945 E1091 L1092 V1093 H1098 T1099 N1155	K945-Q1095 VanDerWaalsContact NZ-CG 3.34Å; E1091-Q1095 VanDerWaalsContact O-CB 3.27Å; E1091-Q1095 WeakPolarHBondContact O-CB 3.19Å; E1091-Q1095 WeakPolarHBondContact O-CG 3.45Å; E1091-Q1095 PolarHBondContact O-N 3.42Å; L1092-Q1095 PolarHBondContact O-N 3.37Å; V1093-Q1095 VanDerWaalsContact C-N 3.35Å; V1093-Q1095 PolarHBondContact O-N 2.77Å; Q1095-H1098 WeakPolarHBondContact O-CB 3.26Å; Q1095-T1099 PolarHBondContact O-N 2.9Å; Q1095-T1099 VanDerWaalsContact O-N 3.17Å; Q1095-T1099 PolarHBondContact O-OG1 3.4Å; Q1095-T1099 VanDerWaalsContact O-OG1 3.13Å; Q1095-N1155 VanDerWaalsContact CD-ND2 3.35Å; Q1095-N1155 PolarHBondContact NE2-ND2 2.76Å; Q1095-N1155 PolarHBondContact OE1-ND2 3Å
1096	K	70	Confident	65.9	Low	115 Å²	115	66.4 Å²	66.4	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-78.4	-48.9	176	-71.2	178.6	178	-172.5	0	112.8	L1092 V1093 Q1094 H1098 T1099 L1100	L1092-K1096 WeakPolarHBondContact O-CG 3.42Å; L1092-K1096 PolarHBondContact O-N 3.15Å; V1093-K1096 PolarHBondContact O-N 3.43Å; Q1094-K1096 VanDerWaalsContact C-N 3.32Å; Q1094-K1096 PolarHBondContact O-N 2.99Å; K1096-H1098 PolarHBondContact O-N 3.46Å; K1096-T1099 PolarHBondContact O-N 2.65Å; K1096-L1100 WeakPolarHBondContact O-CD1 3.28Å; K1096-L1100 VanDerWaalsContact O-CG 3.29Å; K1096-L1100 WeakPolarHBondContact O-CG 3.44Å; K1096-L1100 PolarHBondContact O-N 2.77Å
1097	L	67.1	Low	64	Low	82 Å²	82	68.2 Å²	68.2	43%	0.429	37%	0.369	S	S	.	.	H	α-helix	trans	-49.5	-42.8	172.2	-178.3	74.6	0	0	0	109.9	M948 V1093 L1101	M948-L1097 HydrophobicContact CE-CD2 3.85Å; M948-L1097 HydrophobicContact SD-CD2 4.1Å; V1093-L1097 WeakPolarHBondContact O-CB 3.29Å; V1093-L1097 PolarHBondContact O-N 3Å; L1097-L1101 HydrophobicContact CG-CD1 4.16Å; L1097-L1101 WeakPolarHBondContact O-CD1 3.44Å; L1097-L1101 VanDerWaalsContact O-CG 3.24Å; L1097-L1101 WeakPolarHBondContact O-CG 3.47Å; L1097-L1101 PolarHBondContact O-N 3.17Å
1098	H	66.9	Low	61.9	Low	11 Å²	11	69.8 Å²	69.8	5%	0.051	38%	0.382	C	S	.	.	H	α-helix	trans	-60.4	-65	176.4	-169.1	-128.7	0	0	0	113.3	T941 L942 K945 Q1094 Q1095 K1096 L1100 L1101 S1102	T941-H1098 VanDerWaalsContact CB-CE1 3.42Å; T941-H1098 WeakPolarHBondContact CB-CE1 3Å; T941-H1098 WeakPolarHBondContact CB-NE2 3.5Å; T941-H1098 HydrophobicContact CG2-CB 4.07Å; T941-H1098 WeakPolarHBondContact CG2-CD2 3.37Å; T941-H1098 WeakPolarHBondContact CG2-CE1 3.13Å; T941-H1098 VanDerWaalsContact CG2-ND1 3.34Å; T941-H1098 WeakPolarHBondContact CG2-ND1 3.35Å; T941-H1098 WeakPolarHBondContact CG2-NE2 3.22Å; T941-H1098 WeakPolarHBondContact CG2-O 3.49Å; T941-H1098 PolarHBondContact O-CD2 3.33Å; T941-H1098 PolarHBondContact O-NE2 2.84Å; L942-H1098 WeakPolarHBondContact CA-NE2 3.48Å; L942-H1098 PolarHBondContact N-NE2 3.01Å; K945-H1098 WeakPolarHBondContact CB-CD2 3.46Å; K945-H1098 HydrophobicContact CD-CB 3.84Å; K945-H1098 VanDerWaalsContact CD-CD2 3.45Å; K945-H1098 WeakPolarHBondContact CD-CD2 3.16Å; K945-H1098 VanDerWaalsContact CE-CB 3.41Å; K945-H1098 VanDerWaalsContact CE-CG 3.41Å; K945-H1098 HydrophobicContact CG-CB 3.84Å; K945-H1098 WeakPolarHBondContact CG-CD2 3.25Å; K945-H1098 VanDerWaalsContact NZ-CG 3.32Å; K945-H1098 PolarHBondContact NZ-ND1 3.13Å; Q1094-H1098 WeakPolarHBondContact O-CB 3.44Å; Q1094-H1098 PolarHBondContact O-N 2.82Å; Q1095-H1098 WeakPolarHBondContact O-CB 3.26Å; K1096-H1098 PolarHBondContact O-N 3.46Å; H1098-L1100 PolarHBondContact O-N 2.87Å; H1098-L1101 WeakPolarHBondContact O-CA 3.47Å; H1098-L1101 VanDerWaalsContact O-CB 3.31Å; H1098-L1101 WeakPolarHBondContact O-CB 3.43Å; H1098-L1101 PolarHBondContact O-N 3.4Å; H1098-S1102 PolarHBondContact O-N 3.35Å
1099	T	66.8	Low	59.8	Low	50 Å²	50	74.2 Å²	74.2	31%	0.307	41%	0.414	S	S	.	.	H	α-helix	trans	-53.5	-35.6	-175.2	-53.2	0	0	0	0	112.6	Q1095 K1096 L1101 S1102 E1103	Q1095-T1099 PolarHBondContact O-N 2.9Å; Q1095-T1099 VanDerWaalsContact O-N 3.17Å; Q1095-T1099 PolarHBondContact O-OG1 3.4Å; Q1095-T1099 VanDerWaalsContact O-OG1 3.13Å; K1096-T1099 PolarHBondContact O-N 2.65Å; T1099-L1101 PolarHBondContact O-N 2.81Å; T1099-S1102 PolarHBondContact O-N 3.4Å; T1099-S1102 PolarHBondContact O-OG 3.22Å; T1099-E1103 WeakPolarHBondContact CG2-OE1 3.49Å; T1099-E1103 WeakPolarHBondContact O-CG 3.36Å; T1099-E1103 PolarHBondContact O-N 2.89Å; T1099-E1103 VanDerWaalsContact O-N 3.16Å
1100	L	61.4	Low	57.8	Low	109 Å²	109	78 Å²	78	57%	0.571	44%	0.44	S	S	*	.	H	α-helix	trans	-61.1	-37.2	172.2	-65.7	166.2	0	0	0	113.6	K1096 H1098 E1103 T1104	K1096-L1100 WeakPolarHBondContact O-CD1 3.28Å; K1096-L1100 VanDerWaalsContact O-CG 3.29Å; K1096-L1100 WeakPolarHBondContact O-CG 3.44Å; K1096-L1100 PolarHBondContact O-N 2.77Å; H1098-L1100 PolarHBondContact O-N 2.87Å; L1100-E1103 PolarHBondContact O-N 3.43Å; L1100-T1104 PolarHBondContact O-N 2.93Å; L1100-T1104 PolarHBondContact O-OG1 2.83Å
1101	L	62.2	Low	55.7	Low	45 Å²	45	77.7 Å²	77.7	24%	0.236	45%	0.446	C	S	.	.	H	α-helix	trans	-69.7	-34.5	175.4	-68.7	165.6	0	0	0	112.8	E944 L1097 H1098 T1099 T1104 C1105	E944-L1101 HydrophobicContact CB-CB 4.41Å; E944-L1101 HydrophobicContact CB-CD1 4.16Å; E944-L1101 HydrophobicContact CG-CD1 4.01Å; L1097-L1101 HydrophobicContact CG-CD1 4.16Å; L1097-L1101 WeakPolarHBondContact O-CD1 3.44Å; L1097-L1101 VanDerWaalsContact O-CG 3.24Å; L1097-L1101 WeakPolarHBondContact O-CG 3.47Å; L1097-L1101 PolarHBondContact O-N 3.17Å; H1098-L1101 WeakPolarHBondContact O-CA 3.47Å; H1098-L1101 VanDerWaalsContact O-CB 3.31Å; H1098-L1101 WeakPolarHBondContact O-CB 3.43Å; H1098-L1101 PolarHBondContact O-N 3.4Å; T1099-L1101 PolarHBondContact O-N 2.81Å; L1101-T1104 WeakPolarHBondContact CA-OG1 3.4Å; L1101-T1104 PolarHBondContact O-N 3Å; L1101-T1104 PolarHBondContact O-OG1 2.97Å; L1101-C1105 WeakPolarHBondContact O-CB 3.24Å; L1101-C1105 PolarHBondContact O-N 3.44Å
1102	S	60.7	Low	53.8	Low	11 Å²	11	84.3 Å²	84.3	8%	0.077	48%	0.479	C	S	.	.	H	α-helix	trans	-65.3	-42.5	168.8	31	0	0	0	0	113	A937 T941 H1098 T1099 T1104 C1105	A937-S1102 WeakPolarHBondContact O-CB 3.48Å; T941-S1102 WeakPolarHBondContact CB-OG 3.27Å; T941-S1102 WeakPolarHBondContact CG2-OG 3.47Å; T941-S1102 WeakPolarHBondContact OG1-CB 3.29Å; T941-S1102 PolarHBondContact OG1-OG 2.96Å; H1098-S1102 PolarHBondContact O-N 3.35Å; T1099-S1102 PolarHBondContact O-N 3.4Å; T1099-S1102 PolarHBondContact O-OG 3.22Å; S1102-T1104 PolarHBondContact O-N 3.4Å; S1102-C1105 PolarHBondContact O-N 3.23Å
1103	E	58.9	Low	51.9	Low	141 Å²	141	88.6 Å²	88.6	66%	0.659	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	0.9	-174.6	-67.7	171.2	175.4	0	0	111.4	T1099 L1100	T1099-E1103 WeakPolarHBondContact CG2-OE1 3.49Å; T1099-E1103 WeakPolarHBondContact O-CG 3.36Å; T1099-E1103 PolarHBondContact O-N 2.89Å; T1099-E1103 VanDerWaalsContact O-N 3.16Å; L1100-E1103 PolarHBondContact O-N 3.43Å
1104	T	52.9	Low	50	Low	107 Å²	107	87.5 Å²	87.5	66%	0.656	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	-7.5	176.5	48.1	0	0	0	0	115.5	L1100 L1101 S1102	L1100-T1104 PolarHBondContact O-N 2.93Å; L1100-T1104 PolarHBondContact O-OG1 2.83Å; L1101-T1104 WeakPolarHBondContact CA-OG1 3.4Å; L1101-T1104 PolarHBondContact O-N 3Å; L1101-T1104 PolarHBondContact O-OG1 2.97Å; S1102-T1104 PolarHBondContact O-N 3.4Å
1105	C	44.2	Very low	48.3	Very low	52 Å²	52	94.2 Å²	94.2	35%	0.351	56%	0.56	S	S	.	*			trans	-111.4	95	-173.8	-79.7	0	0	0	0	114.4	E944 L1101 S1102	E944-C1105 PolarHBondContact OE2-SG 2.86Å; L1101-C1105 WeakPolarHBondContact O-CB 3.24Å; L1101-C1105 PolarHBondContact O-N 3.44Å; S1102-C1105 PolarHBondContact O-N 3.23Å
1106	S	34.2	Very low	46.4	Very low	108 Å²	108	94.5 Å²	94.5	76%	0.755	57%	0.568	S	S	*	*			trans	-156.9	134.4	165.8	-151.2	0	0	0	0	106.8
1107	V	35	Very low	44.9	Very low	123 Å²	123	94.8 Å²	94.8	75%	0.745	58%	0.579	S	S	*	*			cis	-141.7	135.5	19.8	175.9	0	0	0	0	108.6
1108	D	32.9	Very low	43.4	Very low	151 Å²	151	93 Å²	93	81%	0.807	57%	0.57	S	S	*	*			trans	178.8	143.2	133.9	-103.1	-27.7	0	0	0	116.1
1109	S	33.6	Very low	41.6	Very low	103 Å²	103	100.2 Å²	100.2	72%	0.72	60%	0.602	S	S	*	*			trans	72.2	97.8	153.1	-63.6	0	0	0	0	123.8
1110	V	31.9	Very low	39.9	Very low	128 Å²	128	100.2 Å²	100.2	78%	0.776	60%	0.603	S	S	*	*				73.9	96.1	128.2	-173.9	0	0	0	0	121
1111	S	30.7	Very low	38.6	Very low	91 Å²	91	103 Å²	103	64%	0.636	62%	0.619	S	S	*	*			trans	41.5	120.6	141	71.9	0	0	0	0	122.2
1112	M	35.3	Very low	37	Very low	180 Å²	180	104.1 Å²	104.1	89%	0.887	64%	0.642	S	S	*	*				-156.9	154.4	90.8	-94.7	-59.8	164.1	0	0	110.8
1113	A	33	Very low	35.6	Very low	100 Å²	100	109.3 Å²	109.3	83%	0.826	67%	0.668	S	S	*	*			trans	-83.5	155.9	-179	0	0	0	0	0	112.3
1114	G	30.9	Very low	34.4	Very low	69 Å²	69	108 Å²	108	71%	0.711	68%	0.675	S	S	*	*			cis	141	128.5	-4.8	0	0	0	0	0	112
1115	D	36.3	Very low	33.6	Very low	171 Å²	171	110.6 Å²	110.6	91%	0.914	68%	0.684	S	S	*	*			trans	-159.5	104.8	165	-119.4	-22.9	0	0	0	108.4
1116	A	30.5	Very low	33.9	Very low	38 Å²	38	111.5 Å²	111.5	31%	0.314	68%	0.683	S	S	.	*			trans	-125.8	140.3	-173.1	0	0	0	0	0	110.8	K935 I939	K935-A1116 HydrophobicContact CB-CB 4.37Å; K935-A1116 HydrophobicContact CD-CB 4.26Å; K935-A1116 WeakPolarHBondContact CE-O 3.44Å; K935-A1116 HydrophobicContact CG-CB 4.43Å; K935-A1116 PolarHBondContact NZ-O 3.47Å; I939-A1116 HydrophobicContact CD1-CB 3.81Å
1117	V	38.5	Very low	34.9	Very low	121 Å²	121	109.9 Å²	109.9	73%	0.733	66%	0.664	S	S	*	*			trans	-140.2	73.2	-176.1	-161	0	0	0	0	113.2
1118	D	35.1	Very low	36.4	Very low	45 Å²	45	107.2 Å²	107.2	24%	0.241	64%	0.64	C	S	.	*			trans	54.2	99.1	139.2	-68.7	-48.8	0	0	0	119.7	E931 K935	E931-D1118 VanDerWaalsContact C-OD1 3.26Å; E931-D1118 WeakPolarHBondContact CB-OD1 3.48Å; E931-D1118 HydrophobicContact CG-CB 4.33Å; K935-D1118 WeakPolarHBondContact CD-OD1 3.49Å; K935-D1118 WeakPolarHBondContact CE-OD1 3.47Å; K935-D1118 WeakPolarHBondContact CE-OD2 3.29Å; K935-D1118 VanDerWaalsContact CG-OD1 3.28Å; K935-D1118 WeakPolarHBondContact CG-OD1 3.49Å; K935-D1118 VanDerWaalsContact NZ-CG 3.27Å; K935-D1118 IonicContact NZ-OD1 3.65Å; K935-D1118 PolarHBondContact NZ-OD1 2.92Å; K935-D1118 IonicContact NZ-OD2 3.65Å; K935-D1118 PolarHBondContact NZ-OD2 3.15Å
1119	F	29	Very low	38.7	Very low	162 Å²	162	101.2 Å²	101.2	71%	0.711	61%	0.608	S	S	*	*			trans	-122.8	74.4	158.6	-76.1	-85.6	0	0	0	110.5
1120	S	30.8	Very low	41.1	Very low	49 Å²	49	99.8 Å²	99.8	34%	0.343	59%	0.59	S	S	.	*			trans	-119.6	63.9	173.8	69.5	0	0	0	0	112.4	E931	E931-S1120 VanDerWaalsContact CG-OG 3.31Å; E931-S1120 WeakPolarHBondContact CG-OG 3.41Å
1121	N	33.1	Very low	43.7	Very low	167 Å²	167	94.7 Å²	94.7	89%	0.893	56%	0.56	S	S	*	*	S	Bend	trans	-149.8	126.7	156.8	-96.4	-51.1	0	0	0	107.5
1122	G	29.1	Very low	46.4	Very low	70 Å²	70	91.8 Å²	91.8	72%	0.722	54%	0.54	S	S	*	.			trans	-79	136.9	-165.3	0	0	0	0	0	114.3
1123	D	32.8	Very low	49	Very low	119 Å²	119	83.3 Å²	83.3	64%	0.636	50%	0.498	S	S	*	.			trans	-155.6	59.5	163.8	-133.1	-13.5	0	0	0	109.2	L1125	D1123-L1125 PolarHBondContact O-N 3.47Å
1124	S	32.4	Very low	51.8	Low	113 Å²	113	81.5 Å²	81.5	79%	0.79	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	33.3	-156.8	-45.2	0	0	0	0	116.4
1125	L	36.8	Very low	54.5	Low	163 Å²	163	79.3 Å²	79.3	85%	0.853	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.3	-23.5	-172.3	-101.8	149.5	0	0	0	115.5	D1123 H1127	D1123-L1125 PolarHBondContact O-N 3.47Å; L1125-H1127 PolarHBondContact O-N 2.92Å
1126	E	50.5	Low	56.7	Low	71 Å²	71	73 Å²	73	33%	0.332	41%	0.409	S	S	.	.			trans	-95.9	50.1	-168.1	-61.9	-160.5	151.6	0	0	115.7	R1128 R1320	E1126-R1128 VanDerWaalsContact C-N 3.27Å; E1126-R1128 PolarHBondContact O-N 3.48Å; E1126-R1320 PolarHBondContact O-NH1 2.66Å; E1126-R1320 PolarHBondContact O-NH2 2.69Å; E1126-R1320 VanDerWaalsContact O-NH2 3.17Å
1127	H	55.1	Low	58.9	Low	74 Å²	74	74.6 Å²	74.6	34%	0.343	41%	0.411	S	S	.	.	S	Bend	trans	-78.1	-7.7	174.1	-82	-97.4	0	0	0	114.7	L1092 L1125	L1092-H1127 HydrophobicContact CD1-CB 3.82Å; L1125-H1127 PolarHBondContact O-N 2.92Å
1128	R	66.1	Low	60.1	Low	66 Å²	66	75.9 Å²	75.9	25%	0.249	41%	0.406	C	S	.	.			trans	-146.2	115.1	-178.4	176.7	176.3	175.4	135.4	1.8	107.9	E1089 L1092 E1126 E1130 V1152	E1089-R1128 IonicContact OE1-NH1 3.41Å; L1092-R1128 HydrophobicContact CD2-CB 4.16Å; L1092-R1128 HydrophobicContact CD2-CG 4.48Å; E1126-R1128 VanDerWaalsContact C-N 3.27Å; E1126-R1128 PolarHBondContact O-N 3.48Å; R1128-E1130 IonicContact CZ-OE2 3.15Å; R1128-E1130 VanDerWaalsContact CZ-OE2 3.25Å; R1128-E1130 IonicContact NE-OE1 3.5Å; R1128-E1130 IonicContact NE-OE2 2.79Å; R1128-E1130 PolarHBondContact NE-OE2 2.86Å; R1128-E1130 IonicContact NH2-OE2 3.29Å; R1128-E1130 PolarHBondContact NH2-OE2 3.22Å; R1128-V1152 HydrophobicContact CG-CG1 3.89Å
1129	L	80.4	Confident	61	Low	26 Å²	26	78.9 Å²	78.9	14%	0.136	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.1	174.5	178	64.6	0	0	0	107.8	L1153 V1316 W1317 R1320	L1129-L1153 HydrophobicContact CB-CB 4.24Å; L1129-L1153 HydrophobicContact CB-CD2 4.34Å; L1129-L1153 HydrophobicContact CD2-CD2 4.18Å; L1129-L1153 PolarHBondContact N-O 2.66Å; L1129-L1153 PolarHBondContact O-N 2.8Å; L1129-V1316 HydrophobicContact CD1-CG1 3.99Å; L1129-V1316 HydrophobicContact CD2-CG1 4.1Å; L1129-W1317 HydrophobicContact CD2-CB 4.39Å; L1129-W1317 HydrophobicContact CD2-CD2 3.57Å; L1129-W1317 HydrophobicContact CD2-CE3 4.05Å; L1129-W1317 HydrophobicContact CD2-CG 3.73Å; L1129-W1317 HydrophobicContact CD2-CZ2 4.25Å; L1129-W1317 HydrophobicContact CG-CD2 4.3Å; L1129-W1317 HydrophobicContact CG-CZ2 4.08Å; L1129-R1320 HydrophobicContact CD2-CB 4.11Å; L1129-R1320 HydrophobicContact CD2-CG 4.28Å
1130	E	85.7	Confident	61.8	Low	73 Å²	73	74.2 Å²	74.2	34%	0.341	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.3	177.6	59.2	-179.4	-158.5	0	0	112.3	R1128 Y1150 A1151 V1152 K1167	R1128-E1130 IonicContact CZ-OE2 3.15Å; R1128-E1130 VanDerWaalsContact CZ-OE2 3.25Å; R1128-E1130 IonicContact NE-OE1 3.5Å; R1128-E1130 IonicContact NE-OE2 2.79Å; R1128-E1130 PolarHBondContact NE-OE2 2.86Å; R1128-E1130 IonicContact NH2-OE2 3.29Å; R1128-E1130 PolarHBondContact NH2-OE2 3.22Å; E1130-Y1150 HydrophobicContact CB-CE1 4.22Å; E1130-A1151 VanDerWaalsContact CA-O 3.27Å; E1130-A1151 WeakPolarHBondContact CA-O 3.38Å; E1130-V1152 HydrophobicContact CB-CB 4.36Å; E1130-V1152 HydrophobicContact CB-CG1 4.26Å; E1130-V1152 HydrophobicContact CB-CG2 3.97Å; E1130-K1167 IonicContact OE1-NZ 3.68Å; E1130-K1167 PolarHBondContact OE1-NZ 2.5Å; E1130-K1167 IonicContact OE2-NZ 2.71Å; E1130-K1167 PolarHBondContact OE2-NZ 3.18Å
1131	S	85.1	Confident	62.6	Low	21 Å²	21	77.3 Å²	77.3	15%	0.147	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	158.8	-177.6	61.9	0	0	0	0	111.7	V1133 A1151 W1317	S1131-V1133 PolarHBondContact O-N 3.43Å; S1131-A1151 PolarHBondContact N-O 3.3Å; S1131-A1151 VanDerWaalsContact N-O 3.11Å; S1131-A1151 PolarHBondContact O-N 3.05Å; S1131-W1317 WeakPolarHBondContact OG-CZ2 3.29Å; S1131-W1317 PolarHBondContact OG-NE1 3.34Å
1132	S	88	Confident	63.3	Low	30 Å²	30	78.8 Å²	78.8	21%	0.21	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	124.1	161	-69.6	0	0	0	0	109.9	W1134 K1148	S1132-W1134 WeakPolarHBondContact O-CZ3 3.44Å; S1132-K1148 WeakPolarHBondContact OG-CE 3.5Å; S1132-K1148 PolarHBondContact OG-NZ 2.86Å; S1132-K1148 VanDerWaalsContact OG-NZ 3.16Å
1133	V	90.6	Very high	64.4	Low	1 Å²	1	82.7 Å²	82.7	1%	0.006	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	161.8	176.6	-55.2	0	0	0	0	110.4	S1131 I1135 K1148 H1149 A1151 V1306 V1308 W1317	S1131-V1133 PolarHBondContact O-N 3.43Å; V1133-I1135 HydrophobicContact CG2-CG1 4.48Å; V1133-K1148 CarbonylContact O-C 3.6Å; V1133-K1148 WeakPolarHBondContact O-CA 3.36Å; V1133-H1149 HydrophobicContact CG2-CB 4.09Å; V1133-H1149 PolarHBondContact N-O 3.47Å; V1133-H1149 PolarHBondContact O-N 2.73Å; V1133-H1149 VanDerWaalsContact O-O 3.11Å; V1133-A1151 HydrophobicContact CB-CB 4.37Å; V1133-A1151 HydrophobicContact CG1-CB 3.67Å; V1133-A1151 HydrophobicContact CG2-CB 3.71Å; V1133-V1306 HydrophobicContact CB-CG1 3.88Å; V1133-V1306 HydrophobicContact CG1-CG1 4.19Å; V1133-V1306 HydrophobicContact CG2-CG1 4.43Å; V1133-V1308 HydrophobicContact CG1-CG1 4.16Å; V1133-W1317 HydrophobicContact CG1-CZ2 4.16Å
1134	W	90.7	Very high	65.8	Low	63 Å²	63	82.9 Å²	82.9	24%	0.239	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.2	178	-70.9	-98	0	0	0	110.1	S1132 W1146 K1147 M1307	S1132-W1134 WeakPolarHBondContact O-CZ3 3.44Å; W1134-W1146 HydrophobicContact CB-CB 4.1Å; W1134-W1146 HydrophobicContact CB-CD2 4.41Å; W1134-W1146 HydrophobicContact CB-CE3 3.96Å; W1134-W1146 HydrophobicContact CG-CB 4.38Å; W1134-K1147 WeakPolarHBondContact CA-O 3.31Å; W1134-M1307 HydrophobicContact CB-CB 4.11Å; W1134-M1307 HydrophobicContact CB-CE 3.79Å; W1134-M1307 HydrophobicContact CD2-CE 4.33Å; W1134-M1307 HydrophobicContact CG-CE 3.91Å; W1134-M1307 PolarHBondContact N-O 2.93Å; W1134-M1307 PolarHBondContact O-N 2.87Å
1135	I	87.9	Confident	67.6	Low	22 Å²	22	78.6 Å²	78.6	11%	0.113	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.4	-177	-61.5	174.9	0	0	0	108.6	V1133 H1137 K1147 H1149 I1160 L1304	V1133-I1135 HydrophobicContact CG2-CG1 4.48Å; I1135-H1137 PolarHBondContact O-N 3.48Å; I1135-K1147 PolarHBondContact N-O 2.7Å; I1135-K1147 PolarHBondContact O-N 3.23Å; I1135-H1149 HydrophobicContact CD1-CB 4.36Å; I1135-I1160 HydrophobicContact CD1-CD1 4.11Å; I1135-I1160 HydrophobicContact CD1-CG2 3.81Å; I1135-L1304 HydrophobicContact CG2-CD1 3.76Å
1136	P	82.8	Confident	69.8	Low	38 Å²	38	73.3 Å²	73.3	25%	0.247	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	127	179.4	-23.5	34.5	0	0	0	112.7	G1145 W1146 F1194 L1305	P1136-G1145 CarbonylContact C-O 3.49Å; P1136-G1145 WeakPolarHBondContact CA-O 3.49Å; P1136-W1146 HydrophobicContact CG-CE3 4.17Å; P1136-W1146 HydrophobicContact CG-CH2 4.23Å; P1136-W1146 HydrophobicContact CG-CZ3 3.69Å; P1136-F1194 HydrophobicContact CB-CE2 4.48Å; P1136-F1194 HydrophobicContact CB-CZ 4.14Å; P1136-F1194 HydrophobicContact CG-CE2 4.43Å; P1136-F1194 HydrophobicContact CG-CZ 3.9Å; P1136-L1305 WeakPolarHBondContact CD-O 3.48Å; P1136-L1305 HydrophobicContact CG-CB 4.02Å; P1136-L1305 HydrophobicContact CG-CD1 4.46Å
1137	H	76.6	Confident	71.4	Confident	73 Å²	73	73.7 Å²	73.7	34%	0.338	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	138.2	178.6	-171.7	-91.6	0	0	0	109.7	I1135 V1139 G1145 K1147	I1135-H1137 PolarHBondContact O-N 3.48Å; H1137-V1139 PolarHBondContact O-N 3.37Å; H1137-G1145 PolarHBondContact N-O 3.46Å; H1137-G1145 PolarHBondContact O-N 2.73Å; H1137-K1147 HydrophobicContact CB-CB 3.7Å; H1137-K1147 HydrophobicContact CB-CD 4.38Å; H1137-K1147 WeakPolarHBondContact CD2-CD 3.3Å
1138	K	64.5	Low	73	Confident	148 Å²	148	75.7 Å²	75.7	64%	0.643	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	114	172.4	-70.1	178.8	-179.4	173.5	0	108.2
1139	V	53.8	Low	74.1	Confident	107 Å²	107	73.6 Å²	73.6	65%	0.648	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	-30.9	172.5	-176.5	0	0	0	0	110.2	H1137 K1143	H1137-V1139 PolarHBondContact O-N 3.37Å; V1139-K1143 PolarHBondContact N-O 3.2Å
1140	S	45.5	Very low	74.5	Confident	64 Å²	64	73.3 Å²	73.3	45%	0.448	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	174.1	162	78.1	0	0	0	0	110.4	K1142 K1143	S1140-K1142 PolarHBondContact O-N 3.37Å; S1140-K1142 PolarHBondContact OG-N 3.37Å; S1140-K1143 PolarHBondContact N-O 3.01Å; S1140-K1143 PolarHBondContact O-N 3.49Å; S1140-K1143 PolarHBondContact OG-N 3.11Å
1141	A	48.2	Very low	74.7	Confident	114 Å²	114	70 Å²	70	94%	0.942	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.9	174.2	0	0	0	0	0	114.4
1142	K	48	Very low	74.9	Confident	199 Å²	199	69 Å²	69	87%	0.865	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	0.3	178.9	-65.7	-174.9	177.9	-179.3	0	114.6	S1140	S1140-K1142 PolarHBondContact O-N 3.37Å; S1140-K1142 PolarHBondContact OG-N 3.37Å
1143	K	51.5	Low	74.8	Confident	152 Å²	152	67.7 Å²	67.7	66%	0.661	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	115	175.4	-76.7	-168.7	174	-175	0	112.4	V1139 S1140	V1139-K1143 PolarHBondContact N-O 3.2Å; S1140-K1143 PolarHBondContact N-O 3.01Å; S1140-K1143 PolarHBondContact O-N 3.49Å; S1140-K1143 PolarHBondContact OG-N 3.11Å
1144	K	61.4	Low	74.4	Confident	123 Å²	123	67.7 Å²	67.7	54%	0.535	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	136.2	156.5	-68.6	-177.4	177.3	-176.8	0	108.1	F1194	K1144-F1194 HydrophobicContact CB-CD2 4.03Å; K1144-F1194 HydrophobicContact CB-CE2 4.19Å; K1144-F1194 HydrophobicContact CB-CG 4.37Å; K1144-F1194 HydrophobicContact CD-CD1 3.85Å; K1144-F1194 HydrophobicContact CD-CD2 4.43Å; K1144-F1194 HydrophobicContact CD-CE1 3.71Å; K1144-F1194 HydrophobicContact CD-CE2 4.32Å; K1144-F1194 HydrophobicContact CD-CG 4.22Å; K1144-F1194 HydrophobicContact CD-CZ 3.97Å
1145	G	70.9	Confident	73.6	Confident	22 Å²	22	66.3 Å²	66.3	23%	0.227	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	168.6	170.9	0	0	0	0	0	111	P1136 H1137	P1136-G1145 CarbonylContact C-O 3.49Å; P1136-G1145 WeakPolarHBondContact CA-O 3.49Å; H1137-G1145 PolarHBondContact N-O 3.46Å; H1137-G1145 PolarHBondContact O-N 2.73Å
1146	W	82.8	Confident	73.2	Confident	53 Å²	53	69.6 Å²	69.6	20%	0.201	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	111.2	-179.8	-69.9	118.3	0	0	0	111.3	W1134 P1136 F1194 A1195 E1199 I1203 M1307	W1134-W1146 HydrophobicContact CB-CB 4.1Å; W1134-W1146 HydrophobicContact CB-CD2 4.41Å; W1134-W1146 HydrophobicContact CB-CE3 3.96Å; W1134-W1146 HydrophobicContact CG-CB 4.38Å; P1136-W1146 HydrophobicContact CG-CE3 4.17Å; P1136-W1146 HydrophobicContact CG-CH2 4.23Å; P1136-W1146 HydrophobicContact CG-CZ3 3.69Å; W1146-F1194 HydrophobicContact CH2-CE2 4.38Å; W1146-F1194 HydrophobicContact CZ2-CE2 4.01Å; W1146-A1195 HydrophobicContact CZ2-CB 4.22Å; W1146-E1199 PolarHBondContact NE1-OE1 3.39Å; W1146-E1199 PolarHBondContact NE1-OE2 3.37Å; W1146-I1203 HydrophobicContact CH2-CD1 3.99Å; W1146-I1203 HydrophobicContact CH2-CG1 4.4Å; W1146-I1203 HydrophobicContact CH2-CG2 4.03Å; W1146-I1203 HydrophobicContact CZ2-CD1 3.72Å; W1146-I1203 HydrophobicContact CZ2-CG1 4.41Å; W1146-M1307 HydrophobicContact CB-CE 4.05Å; W1146-M1307 HydrophobicContact CD2-CB 4.39Å; W1146-M1307 HydrophobicContact CD2-CE 3.62Å; W1146-M1307 HydrophobicContact CD2-SD 4.42Å; W1146-M1307 HydrophobicContact CE3-CB 4.02Å; W1146-M1307 HydrophobicContact CE3-CE 4.23Å; W1146-M1307 HydrophobicContact CG-CE 3.51Å; W1146-M1307 HydrophobicContact CH2-CB 3.77Å; W1146-M1307 HydrophobicContact CZ2-CB 4.14Å; W1146-M1307 HydrophobicContact CZ2-SD 4.27Å; W1146-M1307 HydrophobicContact CZ3-CB 3.68Å
1147	K	84.6	Confident	73.3	Confident	78 Å²	78	69.3 Å²	69.3	34%	0.339	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	122.6	174.4	-179.2	175.5	173.2	-177.7	0	109.8	W1134 I1135 H1137 H1149	W1134-K1147 WeakPolarHBondContact CA-O 3.31Å; I1135-K1147 PolarHBondContact N-O 2.7Å; I1135-K1147 PolarHBondContact O-N 3.23Å; H1137-K1147 HydrophobicContact CB-CB 3.7Å; H1137-K1147 HydrophobicContact CB-CD 4.38Å; H1137-K1147 WeakPolarHBondContact CD2-CD 3.3Å; K1147-H1149 VanDerWaalsContact CG-CE1 3.49Å; K1147-H1149 WeakPolarHBondContact CG-CE1 3.45Å; K1147-H1149 PolarHBondContact O-ND1 3.27Å
1148	K	89.2	Confident	73.9	Confident	116 Å²	116	66 Å²	66	50%	0.504	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	134.2	175.2	-167.4	-171.1	-178.2	-166.6	0	109.7	S1132 V1133	S1132-K1148 WeakPolarHBondContact OG-CE 3.5Å; S1132-K1148 PolarHBondContact OG-NZ 2.86Å; S1132-K1148 VanDerWaalsContact OG-NZ 3.16Å; V1133-K1148 CarbonylContact O-C 3.6Å; V1133-K1148 WeakPolarHBondContact O-CA 3.36Å
1149	H	88.3	Confident	75	Confident	22 Å²	22	59 Å²	59	10%	0.102	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	170.2	172.2	-65.4	83.6	0	0	0	108.3	V1133 I1135 K1147 I1160 Y1161	V1133-H1149 HydrophobicContact CG2-CB 4.09Å; V1133-H1149 PolarHBondContact N-O 3.47Å; V1133-H1149 PolarHBondContact O-N 2.73Å; V1133-H1149 VanDerWaalsContact O-O 3.11Å; I1135-H1149 HydrophobicContact CD1-CB 4.36Å; K1147-H1149 VanDerWaalsContact CG-CE1 3.49Å; K1147-H1149 WeakPolarHBondContact CG-CE1 3.45Å; K1147-H1149 PolarHBondContact O-ND1 3.27Å; H1149-I1160 HydrophobicContact CB-CG2 3.89Å; H1149-Y1161 WeakPolarHBondContact CA-O 3.22Å; H1149-Y1161 WeakPolarHBondContact CB-O 3.26Å
1150	Y	89.5	Confident	76.6	Confident	21 Å²	21	54.2 Å²	54.2	8%	0.082	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.9	171.9	-162.8	-84	0	0	0	108.8	E1130 V1152 Y1161 E1164 K1167	E1130-Y1150 HydrophobicContact CB-CE1 4.22Å; Y1150-V1152 HydrophobicContact CD1-CG2 4.05Å; Y1150-V1152 HydrophobicContact CE1-CG2 3.92Å; Y1150-Y1161 PolarHBondContact N-O 3.29Å; Y1150-Y1161 PolarHBondContact O-N 3.34Å; Y1150-E1164 HydrophobicContact CD2-CB 3.75Å; Y1150-E1164 HydrophobicContact CD2-CG 3.91Å; Y1150-E1164 HydrophobicContact CE2-CB 3.94Å; Y1150-E1164 HydrophobicContact CE2-CG 3.55Å; Y1150-E1164 WeakPolarHBondContact CE2-OE1 3.37Å; Y1150-E1164 HydrophobicContact CG-CB 4.31Å; Y1150-E1164 PolarHBondContact OH-OE1 2.92Å; Y1150-K1167 HydrophobicContact CD1-CD 4.04Å; Y1150-K1167 HydrophobicContact CE1-CD 3.45Å; Y1150-K1167 VanDerWaalsContact CE1-CD 3.45Å; Y1150-K1167 PolarHBondContact OH-NZ 2.85Å
1151	A	89.4	Confident	78.6	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.3	-179.7	0	0	0	0	0	111.2	E1130 S1131 V1133 F1159 I1160 W1317	E1130-A1151 VanDerWaalsContact CA-O 3.27Å; E1130-A1151 WeakPolarHBondContact CA-O 3.38Å; S1131-A1151 PolarHBondContact N-O 3.3Å; S1131-A1151 VanDerWaalsContact N-O 3.11Å; S1131-A1151 PolarHBondContact O-N 3.05Å; V1133-A1151 HydrophobicContact CB-CB 4.37Å; V1133-A1151 HydrophobicContact CG1-CB 3.67Å; V1133-A1151 HydrophobicContact CG2-CB 3.71Å; A1151-F1159 WeakPolarHBondContact CA-O 3.45Å; A1151-I1160 HydrophobicContact CB-CG1 4.3Å; A1151-W1317 HydrophobicContact CB-CH2 3.87Å; A1151-W1317 HydrophobicContact CB-CZ2 4.2Å
1152	V	88	Confident	80.3	Confident	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	114.1	172.3	-172.3	0	0	0	0	108	R1128 E1130 Y1150 F1154 F1159 Y1161 K1167	R1128-V1152 HydrophobicContact CG-CG1 3.89Å; E1130-V1152 HydrophobicContact CB-CB 4.36Å; E1130-V1152 HydrophobicContact CB-CG1 4.26Å; E1130-V1152 HydrophobicContact CB-CG2 3.97Å; Y1150-V1152 HydrophobicContact CD1-CG2 4.05Å; Y1150-V1152 HydrophobicContact CE1-CG2 3.92Å; V1152-F1154 HydrophobicContact CB-CD2 4.42Å; V1152-F1154 HydrophobicContact CB-CE2 3.94Å; V1152-F1154 HydrophobicContact CG1-CD2 3.79Å; V1152-F1154 HydrophobicContact CG1-CE2 3.32Å; V1152-F1154 HydrophobicContact CG1-CZ 3.91Å; V1152-F1159 PolarHBondContact N-O 3.37Å; V1152-F1159 PolarHBondContact O-N 2.86Å; V1152-Y1161 HydrophobicContact CB-CE2 4.42Å; V1152-Y1161 HydrophobicContact CG2-CD2 4.36Å; V1152-Y1161 HydrophobicContact CG2-CE2 3.9Å; V1152-K1167 HydrophobicContact CG2-CD 4.33Å
1153	L	87.3	Confident	82.1	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.7	172.8	169.6	63.3	0	0	0	109.4	L1129 I1158 V1178 W1317 R1320 L1321	L1129-L1153 HydrophobicContact CB-CB 4.24Å; L1129-L1153 HydrophobicContact CB-CD2 4.34Å; L1129-L1153 HydrophobicContact CD2-CD2 4.18Å; L1129-L1153 PolarHBondContact N-O 2.66Å; L1129-L1153 PolarHBondContact O-N 2.8Å; L1153-I1158 HydrophobicContact CD1-CD1 4.48Å; L1153-I1158 HydrophobicContact CD1-CG1 3.92Å; L1153-V1178 HydrophobicContact CD1-CG2 4.31Å; L1153-W1317 HydrophobicContact CB-CH2 3.84Å; L1153-W1317 HydrophobicContact CB-CZ3 3.77Å; L1153-W1317 HydrophobicContact CD2-CE3 4.25Å; L1153-W1317 HydrophobicContact CD2-CZ3 4.05Å; L1153-W1317 HydrophobicContact CG-CZ3 4.48Å; L1153-R1320 HydrophobicContact CD2-CB 4.11Å; L1153-R1320 HydrophobicContact CD2-CG 3.57Å; L1153-L1321 HydrophobicContact CD1-CD2 3.62Å; L1153-L1321 HydrophobicContact CD2-CD2 3.65Å; L1153-L1321 HydrophobicContact CD2-CG 4.05Å; L1153-L1321 HydrophobicContact CG-CD2 4.29Å
1154	F	81.3	Confident	83.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.009	19%	0.192	C	C	.	.			trans	-95.7	-157.9	166.7	-63.7	-108.2	0	0	0	109.2	E1088 E1089 L1092 V1152 K1157 F1159	E1088-F1154 HydrophobicContact CB-CB 4.29Å; E1088-F1154 HydrophobicContact CB-CD1 3.79Å; E1088-F1154 HydrophobicContact CB-CD2 4.49Å; E1088-F1154 HydrophobicContact CB-CE1 4.14Å; E1088-F1154 HydrophobicContact CB-CG 3.98Å; E1088-F1154 WeakPolarHBondContact O-CD1 3.5Å; E1088-F1154 WeakPolarHBondContact OE2-CB 3.49Å; E1089-F1154 HydrophobicContact CG-CE1 3.91Å; E1089-F1154 HydrophobicContact CG-CZ 3.85Å; L1092-F1154 HydrophobicContact CB-CD1 4.33Å; L1092-F1154 HydrophobicContact CB-CE1 4.43Å; L1092-F1154 HydrophobicContact CD2-CD1 4.17Å; L1092-F1154 HydrophobicContact CD2-CE1 4Å; V1152-F1154 HydrophobicContact CB-CD2 4.42Å; V1152-F1154 HydrophobicContact CB-CE2 3.94Å; V1152-F1154 HydrophobicContact CG1-CD2 3.79Å; V1152-F1154 HydrophobicContact CG1-CE2 3.32Å; V1152-F1154 HydrophobicContact CG1-CZ 3.91Å; F1154-K1157 PolarHBondContact N-O 3.44Å; F1154-F1159 AromaticContact CD2-CD2 3.43Å; F1154-F1159 HydrophobicContact CD2-CD2 3.43Å; F1154-F1159 VanDerWaalsContact CD2-CD2 3.43Å; F1154-F1159 AromaticContact CD2-CE2 3.61Å; F1154-F1159 HydrophobicContact CD2-CE2 3.61Å; F1154-F1159 AromaticContact CE2-CD2 3.49Å; F1154-F1159 HydrophobicContact CE2-CD2 3.49Å; F1154-F1159 VanDerWaalsContact CE2-CD2 3.49Å; F1154-F1159 AromaticContact CE2-CE2 3.8Å; F1154-F1159 HydrophobicContact CE2-CE2 3.8Å; F1154-F1159 HydrophobicContact CE2-CG 4.28Å; F1154-F1159 HydrophobicContact CG-CD2 4.5Å; F1154-F1159 HydrophobicContact CG-CE2 4.31Å
1155	N	73.7	Confident	84.5	Confident	34 Å²	34	36.6 Å²	36.6	18%	0.182	19%	0.187	C	C	.	.	S	Bend	trans	-83.9	-41.2	-173.9	-65.8	-67.2	0	0	0	113	Q1095	Q1095-N1155 VanDerWaalsContact CD-ND2 3.35Å; Q1095-N1155 PolarHBondContact NE2-ND2 2.76Å; Q1095-N1155 PolarHBondContact OE1-ND2 3Å
1156	R	79.1	Confident	85	Confident	91 Å²	91	37 Å²	37	34%	0.343	19%	0.185	S	C	.	.	S	Bend	trans	-109.6	-21.1	177.8	-49.3	-171.9	-165.3	103.4	11.1	113.8	E1088 E1091 V1178 E1179	E1088-R1156 WeakPolarHBondContact OE1-CB 3.45Å; E1091-R1156 IonicContact OE1-CZ 2.67Å; E1091-R1156 VanDerWaalsContact OE1-CZ 3.23Å; E1091-R1156 IonicContact OE1-NH1 2.79Å; E1091-R1156 PolarHBondContact OE1-NH1 3.48Å; E1091-R1156 IonicContact OE1-NH2 3.22Å; E1091-R1156 PolarHBondContact OE1-NH2 3.46Å; E1091-R1156 IonicContact OE2-CZ 2.67Å; E1091-R1156 IonicContact OE2-NH1 3.86Å; E1091-R1156 IonicContact OE2-NH2 2.71Å; E1091-R1156 PolarHBondContact OE2-NH2 3.3Å; R1156-V1178 VanDerWaalsContact O-CB 3.27Å; R1156-V1178 WeakPolarHBondContact O-CB 3.26Å; R1156-V1178 WeakPolarHBondContact O-CG2 3.47Å; R1156-V1178 PolarHBondContact O-N 3.08Å; R1156-E1179 WeakPolarHBondContact CD-OE1 3.45Å
1157	K	85.3	Confident	84.8	Confident	31 Å²	31	36.4 Å²	36.4	14%	0.135	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.9	-176	-71.1	179	172.8	-174.1	0	113.7	E1084 E1088 F1154 F1159 I1175 L1176 D1177	E1084-K1157 IonicContact OE1-NZ 2.68Å; E1084-K1157 IonicContact OE2-NZ 3.8Å; E1084-K1157 PolarHBondContact OE2-NZ 2.85Å; E1088-K1157 HydrophobicContact CG-CB 4.26Å; E1088-K1157 HydrophobicContact CG-CD 4.17Å; F1154-K1157 PolarHBondContact N-O 3.44Å; K1157-F1159 HydrophobicContact CB-CD2 4.21Å; K1157-F1159 HydrophobicContact CB-CE2 3.57Å; K1157-F1159 HydrophobicContact CB-CZ 4.1Å; K1157-F1159 HydrophobicContact CD-CE2 4.46Å; K1157-F1159 HydrophobicContact CD-CZ 4.14Å; K1157-I1175 HydrophobicContact CB-CG2 4.22Å; K1157-I1175 HydrophobicContact CD-CG2 3.92Å; K1157-I1175 HydrophobicContact CG-CG2 4.23Å; K1157-L1176 WeakPolarHBondContact CA-O 3.32Å; K1157-D1177 WeakPolarHBondContact CE-OD1 3.42Å
1158	I	88.7	Confident	84.4	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.4	163.1	-39.1	-172.4	0	0	0	108.3	L1153 I1160 I1175 L1176 V1178 F1181 I1206 L1321	L1153-I1158 HydrophobicContact CD1-CD1 4.48Å; L1153-I1158 HydrophobicContact CD1-CG1 3.92Å; I1158-I1160 HydrophobicContact CG2-CG1 4.16Å; I1158-I1175 WeakPolarHBondContact O-CA 3.43Å; I1158-L1176 HydrophobicContact CB-CB 4.27Å; I1158-L1176 HydrophobicContact CG1-CB 4.44Å; I1158-L1176 PolarHBondContact N-O 3.06Å; I1158-L1176 PolarHBondContact O-N 3Å; I1158-V1178 HydrophobicContact CG1-CG2 4.07Å; I1158-F1181 HydrophobicContact CD1-CE2 3.85Å; I1158-F1181 HydrophobicContact CD1-CZ 3.65Å; I1158-F1181 HydrophobicContact CG1-CZ 4.12Å; I1158-I1206 HydrophobicContact CD1-CD1 3.93Å; I1158-L1321 HydrophobicContact CD1-CD2 3.66Å; I1158-L1321 HydrophobicContact CG1-CD2 4.35Å
1159	F	87.9	Confident	83.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.9	172.6	-62.9	-104.2	0	0	0	109	E1084 C1085 E1088 A1151 V1152 F1154 K1157 Y1161 A1172 I1175	E1084-F1159 WeakPolarHBondContact O-CZ 3.19Å; C1085-F1159 VanDerWaalsContact CA-CE1 3.44Å; C1085-F1159 HydrophobicContact CB-CD1 4.26Å; C1085-F1159 HydrophobicContact CB-CE1 3.84Å; E1088-F1159 HydrophobicContact CB-CE2 3.88Å; E1088-F1159 HydrophobicContact CB-CZ 4.02Å; E1088-F1159 HydrophobicContact CG-CE2 3.9Å; E1088-F1159 HydrophobicContact CG-CZ 3.99Å; A1151-F1159 WeakPolarHBondContact CA-O 3.45Å; V1152-F1159 PolarHBondContact N-O 3.37Å; V1152-F1159 PolarHBondContact O-N 2.86Å; F1154-F1159 AromaticContact CD2-CD2 3.43Å; F1154-F1159 HydrophobicContact CD2-CD2 3.43Å; F1154-F1159 VanDerWaalsContact CD2-CD2 3.43Å; F1154-F1159 AromaticContact CD2-CE2 3.61Å; F1154-F1159 HydrophobicContact CD2-CE2 3.61Å; F1154-F1159 AromaticContact CE2-CD2 3.49Å; F1154-F1159 HydrophobicContact CE2-CD2 3.49Å; F1154-F1159 VanDerWaalsContact CE2-CD2 3.49Å; F1154-F1159 AromaticContact CE2-CE2 3.8Å; F1154-F1159 HydrophobicContact CE2-CE2 3.8Å; F1154-F1159 HydrophobicContact CE2-CG 4.28Å; F1154-F1159 HydrophobicContact CG-CD2 4.5Å; F1154-F1159 HydrophobicContact CG-CE2 4.31Å; K1157-F1159 HydrophobicContact CB-CD2 4.21Å; K1157-F1159 HydrophobicContact CB-CE2 3.57Å; K1157-F1159 HydrophobicContact CB-CZ 4.1Å; K1157-F1159 HydrophobicContact CD-CE2 4.46Å; K1157-F1159 HydrophobicContact CD-CZ 4.14Å; F1159-Y1161 HydrophobicContact CB-CD2 4.47Å; F1159-Y1161 HydrophobicContact CB-CE2 3.6Å; F1159-A1172 HydrophobicContact CB-CB 4.46Å; F1159-A1172 HydrophobicContact CD1-CB 4.04Å; F1159-I1175 HydrophobicContact CD1-CD1 3.81Å; F1159-I1175 HydrophobicContact CD1-CG1 3.78Å; F1159-I1175 HydrophobicContact CD1-CG2 4.38Å; F1159-I1175 HydrophobicContact CE1-CD1 3.58Å; F1159-I1175 HydrophobicContact CE1-CG1 4.02Å; F1159-I1175 HydrophobicContact CE1-CG2 4.21Å; F1159-I1175 HydrophobicContact CZ-CG2 4.45Å
1160	I	88.2	Confident	82.9	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.036	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.2	-179.7	-59	174.3	0	0	0	107.5	I1135 H1149 A1151 I1158 S1173 L1174 L1176 L1304	I1135-I1160 HydrophobicContact CD1-CD1 4.11Å; I1135-I1160 HydrophobicContact CD1-CG2 3.81Å; H1149-I1160 HydrophobicContact CB-CG2 3.89Å; A1151-I1160 HydrophobicContact CB-CG1 4.3Å; I1158-I1160 HydrophobicContact CG2-CG1 4.16Å; I1160-S1173 PolarHBondContact O-N 2.89Å; I1160-S1173 PolarHBondContact O-OG 3.35Å; I1160-L1174 HydrophobicContact CB-CB 4.22Å; I1160-L1174 HydrophobicContact CD1-CD2 3.94Å; I1160-L1174 HydrophobicContact CD1-CG 4.23Å; I1160-L1174 PolarHBondContact N-O 3.46Å; I1160-L1174 PolarHBondContact O-N 3.28Å; I1160-L1176 HydrophobicContact CD1-CD1 4.27Å; I1160-L1304 HydrophobicContact CD1-CD2 4.25Å
1161	Y	88.3	Confident	82.2	Confident	3 Å²	3	40.3 Å²	40.3	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	147.7	-178.7	-58.5	-89.1	0	0	0	109.4	C1085 H1149 Y1150 V1152 F1159 N1163 D1166 K1167 A1172	C1085-Y1161 PolarHBondContact SG-OH 3.26Å; H1149-Y1161 WeakPolarHBondContact CA-O 3.22Å; H1149-Y1161 WeakPolarHBondContact CB-O 3.26Å; Y1150-Y1161 PolarHBondContact N-O 3.29Å; Y1150-Y1161 PolarHBondContact O-N 3.34Å; V1152-Y1161 HydrophobicContact CB-CE2 4.42Å; V1152-Y1161 HydrophobicContact CG2-CD2 4.36Å; V1152-Y1161 HydrophobicContact CG2-CE2 3.9Å; F1159-Y1161 HydrophobicContact CB-CD2 4.47Å; F1159-Y1161 HydrophobicContact CB-CE2 3.6Å; Y1161-N1163 VanDerWaalsContact C-N 3.33Å; Y1161-N1163 WeakPolarHBondContact CB-O 3.49Å; Y1161-D1166 HydrophobicContact CD1-CB 4.11Å; Y1161-K1167 HydrophobicContact CD1-CB 4.16Å; Y1161-K1167 HydrophobicContact CD2-CB 4.18Å; Y1161-K1167 HydrophobicContact CE1-CB 4.25Å; Y1161-K1167 HydrophobicContact CE2-CB 4.28Å; Y1161-K1167 HydrophobicContact CG-CB 4.13Å; Y1161-A1172 HydrophobicContact CD1-CB 4.23Å; Y1161-A1172 HydrophobicContact CE1-CB 3.87Å
1162	A	84	Confident	81.7	Confident	46 Å²	46	40.2 Å²	40.2	38%	0.38	21%	0.213	S	C	.	.	S	Bend	trans	-70.7	-32.7	179.5	0	0	0	0	0	111.6	D1166	A1162-D1166 WeakPolarHBondContact CA-OD2 3.49Å; A1162-D1166 WeakPolarHBondContact CB-OD2 3.36Å; A1162-D1166 PolarHBondContact N-OD2 2.99Å; A1162-D1166 VanDerWaalsContact N-OD2 3.16Å
1163	N	84.2	Confident	81.2	Confident	74 Å²	74	42.1 Å²	42.1	40%	0.396	23%	0.227	S	C	.	.	S	Bend	trans	-145.8	177.3	169.7	71.4	80.7	0	0	0	112	Y1161 A1165 D1166	Y1161-N1163 VanDerWaalsContact C-N 3.33Å; Y1161-N1163 WeakPolarHBondContact CB-O 3.49Å; N1163-A1165 WeakPolarHBondContact OD1-CA 3.23Å; N1163-A1165 VanDerWaalsContact OD1-CB 3.23Å; N1163-A1165 WeakPolarHBondContact OD1-CB 3.44Å; N1163-A1165 PolarHBondContact OD1-N 2.97Å; N1163-D1166 PolarHBondContact N-OD2 3.49Å; N1163-D1166 PolarHBondContact ND2-OD1 3.03Å; N1163-D1166 PolarHBondContact ND2-OD2 3.17Å; N1163-D1166 PolarHBondContact O-N 3.21Å; N1163-D1166 PolarHBondContact OD1-N 3.38Å
1164	E	83.2	Confident	81	Confident	106 Å²	106	42.7 Å²	42.7	50%	0.495	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-18.5	-176.3	-175	161.7	-154.4	0	0	114.2	Y1150	Y1150-E1164 HydrophobicContact CD2-CB 3.75Å; Y1150-E1164 HydrophobicContact CD2-CG 3.91Å; Y1150-E1164 HydrophobicContact CE2-CB 3.94Å; Y1150-E1164 HydrophobicContact CE2-CG 3.55Å; Y1150-E1164 WeakPolarHBondContact CE2-OE1 3.37Å; Y1150-E1164 HydrophobicContact CG-CB 4.31Å; Y1150-E1164 PolarHBondContact OH-OE1 2.92Å
1165	A	81.5	Confident	81.2	Confident	53 Å²	53	42.7 Å²	42.7	44%	0.438	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-31.6	172.1	0	0	0	0	0	111.9	N1163 K1167 Q1168 T1169	N1163-A1165 WeakPolarHBondContact OD1-CA 3.23Å; N1163-A1165 VanDerWaalsContact OD1-CB 3.23Å; N1163-A1165 WeakPolarHBondContact OD1-CB 3.44Å; N1163-A1165 PolarHBondContact OD1-N 2.97Å; A1165-K1167 PolarHBondContact O-N 2.55Å; A1165-Q1168 WeakPolarHBondContact O-CA 3.45Å; A1165-Q1168 VanDerWaalsContact O-CB 3.3Å; A1165-Q1168 WeakPolarHBondContact O-CB 3.28Å; A1165-Q1168 PolarHBondContact O-N 3.12Å; A1165-T1169 PolarHBondContact O-N 3.08Å
1166	D	79.6	Confident	81.9	Confident	31 Å²	31	41.1 Å²	41.1	17%	0.166	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.7	175.8	-50.3	-30.7	0	0	0	112.1	Y1161 A1162 N1163 Q1168 T1169 S1170 N1171	Y1161-D1166 HydrophobicContact CD1-CB 4.11Å; A1162-D1166 WeakPolarHBondContact CA-OD2 3.49Å; A1162-D1166 WeakPolarHBondContact CB-OD2 3.36Å; A1162-D1166 PolarHBondContact N-OD2 2.99Å; A1162-D1166 VanDerWaalsContact N-OD2 3.16Å; N1163-D1166 PolarHBondContact N-OD2 3.49Å; N1163-D1166 PolarHBondContact ND2-OD1 3.03Å; N1163-D1166 PolarHBondContact ND2-OD2 3.17Å; N1163-D1166 PolarHBondContact O-N 3.21Å; N1163-D1166 PolarHBondContact OD1-N 3.38Å; D1166-Q1168 VanDerWaalsContact C-N 3.29Å; D1166-Q1168 PolarHBondContact O-N 3.26Å; D1166-T1169 CarbonylContact O-C 3.56Å; D1166-T1169 PolarHBondContact O-N 3.35Å; D1166-T1169 PolarHBondContact O-OG1 3.04Å; D1166-T1169 VanDerWaalsContact O-OG1 3.07Å; D1166-S1170 PolarHBondContact O-N 2.89Å; D1166-N1171 HydrophobicContact CB-CB 4.48Å; D1166-N1171 PolarHBondContact O-N 3.01Å
1167	K	78.7	Confident	82.1	Confident	41 Å²	41	38.8 Å²	38.8	18%	0.178	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-31	171.2	155.3	179.9	160.5	-180	0	112.3	E1130 Y1150 V1152 Y1161 A1165 T1169 S1170	E1130-K1167 IonicContact OE1-NZ 3.68Å; E1130-K1167 PolarHBondContact OE1-NZ 2.5Å; E1130-K1167 IonicContact OE2-NZ 2.71Å; E1130-K1167 PolarHBondContact OE2-NZ 3.18Å; Y1150-K1167 HydrophobicContact CD1-CD 4.04Å; Y1150-K1167 HydrophobicContact CE1-CD 3.45Å; Y1150-K1167 VanDerWaalsContact CE1-CD 3.45Å; Y1150-K1167 PolarHBondContact OH-NZ 2.85Å; V1152-K1167 HydrophobicContact CG2-CD 4.33Å; Y1161-K1167 HydrophobicContact CD1-CB 4.16Å; Y1161-K1167 HydrophobicContact CD2-CB 4.18Å; Y1161-K1167 HydrophobicContact CE1-CB 4.25Å; Y1161-K1167 HydrophobicContact CE2-CB 4.28Å; Y1161-K1167 HydrophobicContact CG-CB 4.13Å; A1165-K1167 PolarHBondContact O-N 2.55Å; K1167-T1169 VanDerWaalsContact C-N 3.32Å; K1167-S1170 PolarHBondContact O-N 3.41Å
1168	Q	76.2	Confident	82.1	Confident	167 Å²	167	37.3 Å²	37.3	78%	0.78	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-26.6	175.5	-56.3	-175.9	1.4	0	0	112	A1165 D1166	A1165-Q1168 WeakPolarHBondContact O-CA 3.45Å; A1165-Q1168 VanDerWaalsContact O-CB 3.3Å; A1165-Q1168 WeakPolarHBondContact O-CB 3.28Å; A1165-Q1168 PolarHBondContact O-N 3.12Å; D1166-Q1168 VanDerWaalsContact C-N 3.29Å; D1166-Q1168 PolarHBondContact O-N 3.26Å
1169	T	71.5	Confident	81.8	Confident	89 Å²	89	41.5 Å²	41.5	55%	0.546	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	13.3	175.3	57.2	0	0	0	0	113.3	A1165 D1166 K1167 N1171	A1165-T1169 PolarHBondContact O-N 3.08Å; D1166-T1169 CarbonylContact O-C 3.56Å; D1166-T1169 PolarHBondContact O-N 3.35Å; D1166-T1169 PolarHBondContact O-OG1 3.04Å; D1166-T1169 VanDerWaalsContact O-OG1 3.07Å; K1167-T1169 VanDerWaalsContact C-N 3.32Å; T1169-N1171 PolarHBondContact O-N 2.72Å
1170	S	75.9	Confident	81.5	Confident	2 Å²	2	45 Å²	45	1%	0.014	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	26.2	-177.8	-75.3	0	0	0	0	115.9	C1085 K1086 D1166 K1167 A1172	C1085-S1170 PolarHBondContact SG-OG 3.19Å; K1086-S1170 WeakPolarHBondContact CE-OG 3.5Å; K1086-S1170 PolarHBondContact NZ-OG 2.84Å; D1166-S1170 PolarHBondContact O-N 2.89Å; K1167-S1170 PolarHBondContact O-N 3.41Å; S1170-A1172 PolarHBondContact O-N 3.13Å
1171	N	73.6	Confident	81.4	Confident	60 Å²	60	44.8 Å²	44.8	32%	0.321	24%	0.242	S	C	.	.			trans	-94.7	72.4	-170.9	-172.5	29.9	0	0	0	110.6	D1166 T1169	D1166-N1171 HydrophobicContact CB-CB 4.48Å; D1166-N1171 PolarHBondContact O-N 3.01Å; T1169-N1171 PolarHBondContact O-N 2.72Å
1172	A	78.7	Confident	80.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	25%	0.253	C	S	.	.			trans	-69.8	132.5	-179	0	0	0	0	0	111.7	F1159 Y1161 S1170 I1175	F1159-A1172 HydrophobicContact CB-CB 4.46Å; F1159-A1172 HydrophobicContact CD1-CB 4.04Å; Y1161-A1172 HydrophobicContact CD1-CB 4.23Å; Y1161-A1172 HydrophobicContact CE1-CB 3.87Å; S1170-A1172 PolarHBondContact O-N 3.13Å; A1172-I1175 HydrophobicContact CB-CD1 4.39Å; A1172-I1175 HydrophobicContact CB-CG1 3.97Å
1173	S	78.1	Confident	80.6	Confident	41 Å²	41	46.8 Å²	46.8	29%	0.287	24%	0.242	S	C	.	.	S	Bend	trans	-84.3	-25.5	178.7	63.2	0	0	0	0	113.1	I1160	I1160-S1173 PolarHBondContact O-N 2.89Å; I1160-S1173 PolarHBondContact O-OG 3.35Å
1174	L	83.8	Confident	80.6	Confident	14 Å²	14	43.3 Å²	43.3	7%	0.073	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	127.2	176.1	165.6	60.5	0	0	0	109.7	I1160 L1176 E1213 S1214 R1215	I1160-L1174 HydrophobicContact CB-CB 4.22Å; I1160-L1174 HydrophobicContact CD1-CD2 3.94Å; I1160-L1174 HydrophobicContact CD1-CG 4.23Å; I1160-L1174 PolarHBondContact N-O 3.46Å; I1160-L1174 PolarHBondContact O-N 3.28Å; L1174-L1176 HydrophobicContact CD1-CD2 3.98Å; L1174-L1176 HydrophobicContact CD1-CG 3.99Å; L1174-L1176 HydrophobicContact CD2-CD1 4.37Å; L1174-L1176 HydrophobicContact CD2-CG 4.47Å; L1174-L1176 HydrophobicContact CG-CG 4.14Å; L1174-E1213 HydrophobicContact CD1-CG 3.43Å; L1174-E1213 VanDerWaalsContact CD1-CG 3.43Å; L1174-S1214 WeakPolarHBondContact CA-O 3.28Å; L1174-R1215 HydrophobicContact CB-CG 4.32Å; L1174-R1215 HydrophobicContact CD1-CG 3.73Å
1175	I	85.7	Confident	80.7	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.2	169.3	-52.3	179.2	0	0	0	108.6	L1081 E1084 K1157 I1158 F1159 A1172 S1214	L1081-I1175 HydrophobicContact CB-CD1 4.32Å; L1081-I1175 HydrophobicContact CD2-CD1 3.5Å; L1081-I1175 HydrophobicContact CD2-CG1 4.08Å; E1084-I1175 HydrophobicContact CB-CD1 4.16Å; K1157-I1175 HydrophobicContact CB-CG2 4.22Å; K1157-I1175 HydrophobicContact CD-CG2 3.92Å; K1157-I1175 HydrophobicContact CG-CG2 4.23Å; I1158-I1175 WeakPolarHBondContact O-CA 3.43Å; F1159-I1175 HydrophobicContact CD1-CD1 3.81Å; F1159-I1175 HydrophobicContact CD1-CG1 3.78Å; F1159-I1175 HydrophobicContact CD1-CG2 4.38Å; F1159-I1175 HydrophobicContact CE1-CD1 3.58Å; F1159-I1175 HydrophobicContact CE1-CG1 4.02Å; F1159-I1175 HydrophobicContact CE1-CG2 4.21Å; F1159-I1175 HydrophobicContact CZ-CG2 4.45Å; A1172-I1175 HydrophobicContact CB-CD1 4.39Å; A1172-I1175 HydrophobicContact CB-CG1 3.97Å; I1175-S1214 PolarHBondContact N-O 3.36Å; I1175-S1214 PolarHBondContact O-N 3.15Å
1176	L	87.3	Confident	80.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	124	-179.6	-72.9	173.4	0	0	0	111.9	K1157 I1158 I1160 L1174 V1178 F1181 Y1208 G1212 E1213 L1304	K1157-L1176 WeakPolarHBondContact CA-O 3.32Å; I1158-L1176 HydrophobicContact CB-CB 4.27Å; I1158-L1176 HydrophobicContact CG1-CB 4.44Å; I1158-L1176 PolarHBondContact N-O 3.06Å; I1158-L1176 PolarHBondContact O-N 3Å; I1160-L1176 HydrophobicContact CD1-CD1 4.27Å; L1174-L1176 HydrophobicContact CD1-CD2 3.98Å; L1174-L1176 HydrophobicContact CD1-CG 3.99Å; L1174-L1176 HydrophobicContact CD2-CD1 4.37Å; L1174-L1176 HydrophobicContact CD2-CG 4.47Å; L1174-L1176 HydrophobicContact CG-CG 4.14Å; L1176-V1178 PolarHBondContact O-N 3.32Å; L1176-F1181 HydrophobicContact CB-CE1 4Å; L1176-F1181 HydrophobicContact CB-CZ 4.07Å; L1176-Y1208 HydrophobicContact CD2-CD2 3.69Å; L1176-Y1208 HydrophobicContact CD2-CE1 4.49Å; L1176-Y1208 HydrophobicContact CD2-CE2 3.4Å; L1176-Y1208 VanDerWaalsContact CD2-CE2 3.4Å; L1176-Y1208 HydrophobicContact CD2-CG 4.34Å; L1176-G1212 WeakPolarHBondContact CA-O 3.46Å; L1176-E1213 HydrophobicContact CD2-CB 4.18Å; L1176-E1213 HydrophobicContact CD2-CG 3.86Å; L1176-L1304 HydrophobicContact CD1-CD2 3.62Å
1177	D	84.2	Confident	81	Confident	43 Å²	43	40.3 Å²	40.3	23%	0.23	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	112.9	175	-76	-25.1	0	0	0	111.3	K1157 E1179 K1180 F1181 G1212	K1157-D1177 WeakPolarHBondContact CE-OD1 3.42Å; D1177-E1179 PolarHBondContact O-N 3.34Å; D1177-K1180 HydrophobicContact CB-CB 4.04Å; D1177-K1180 HydrophobicContact CB-CG 3.63Å; D1177-K1180 WeakPolarHBondContact O-CB 3.45Å; D1177-K1180 PolarHBondContact O-N 3.03Å; D1177-F1181 WeakPolarHBondContact O-CD1 3.5Å; D1177-F1181 WeakPolarHBondContact O-CE1 3.36Å; D1177-G1212 PolarHBondContact N-O 3.24Å
1178	V	85.1	Confident	81	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-61.1	-30.3	175.5	-179.6	0	0	0	0	111.3	L1153 R1156 I1158 L1176 K1180 F1181 C1324 L1325	L1153-V1178 HydrophobicContact CD1-CG2 4.31Å; R1156-V1178 VanDerWaalsContact O-CB 3.27Å; R1156-V1178 WeakPolarHBondContact O-CB 3.26Å; R1156-V1178 WeakPolarHBondContact O-CG2 3.47Å; R1156-V1178 PolarHBondContact O-N 3.08Å; I1158-V1178 HydrophobicContact CG1-CG2 4.07Å; L1176-V1178 PolarHBondContact O-N 3.32Å; V1178-K1180 PolarHBondContact O-N 3.01Å; V1178-F1181 HydrophobicContact CB-CD2 4.47Å; V1178-F1181 HydrophobicContact CB-CE2 4.42Å; V1178-F1181 HydrophobicContact CG1-CD2 4.18Å; V1178-F1181 HydrophobicContact CG1-CE2 4.44Å; V1178-F1181 HydrophobicContact CG2-CE2 4.05Å; V1178-F1181 HydrophobicContact CG2-CZ 4.18Å; V1178-F1181 WeakPolarHBondContact O-CB 3.16Å; V1178-F1181 PolarHBondContact O-N 3.41Å; V1178-F1181 VanDerWaalsContact O-N 3.11Å; V1178-C1324 HydrophobicContact CG1-CB 3.93Å; V1178-L1325 HydrophobicContact CG1-CB 4.18Å; V1178-L1325 WeakPolarHBondContact O-CD1 3.39Å
1179	E	81.5	Confident	80.9	Confident	92 Å²	92	38.7 Å²	38.7	43%	0.43	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-61.6	-29.4	175.4	-45	-149.6	149.6	0	0	112.6	R1156 D1177 F1181 C1328	R1156-E1179 WeakPolarHBondContact CD-OE1 3.45Å; D1177-E1179 PolarHBondContact O-N 3.34Å; E1179-F1181 VanDerWaalsContact C-N 3.3Å; E1179-C1328 HydrophobicContact CB-CB 4.38Å; E1179-C1328 HydrophobicContact CG-CB 3.88Å
1180	K	82.3	Confident	80.6	Confident	73 Å²	73	36.8 Å²	36.8	32%	0.317	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-87.9	4.4	-179.6	-58.6	-78.3	-167.3	175.4	0	112.5	D1177 V1178 Y1208 A1209 E1211	D1177-K1180 HydrophobicContact CB-CB 4.04Å; D1177-K1180 HydrophobicContact CB-CG 3.63Å; D1177-K1180 WeakPolarHBondContact O-CB 3.45Å; D1177-K1180 PolarHBondContact O-N 3.03Å; V1178-K1180 PolarHBondContact O-N 3.01Å; K1180-Y1208 WeakPolarHBondContact O-CA 3.39Å; K1180-A1209 HydrophobicContact CB-CB 4.33Å; K1180-A1209 PolarHBondContact O-N 3.17Å; K1180-E1211 HydrophobicContact CD-CG 4.41Å; K1180-E1211 IonicContact NZ-OE2 2.77Å; K1180-E1211 PolarHBondContact NZ-OE2 2.9Å
1181	F	85.6	Confident	80.4	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.009	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	126.6	178.5	-67.9	7.3	0	0	0	110.7	I1158 L1176 D1177 V1178 E1179 V1184 I1206 Y1208 L1321 L1325 R1329	I1158-F1181 HydrophobicContact CD1-CE2 3.85Å; I1158-F1181 HydrophobicContact CD1-CZ 3.65Å; I1158-F1181 HydrophobicContact CG1-CZ 4.12Å; L1176-F1181 HydrophobicContact CB-CE1 4Å; L1176-F1181 HydrophobicContact CB-CZ 4.07Å; D1177-F1181 WeakPolarHBondContact O-CD1 3.5Å; D1177-F1181 WeakPolarHBondContact O-CE1 3.36Å; V1178-F1181 HydrophobicContact CB-CD2 4.47Å; V1178-F1181 HydrophobicContact CB-CE2 4.42Å; V1178-F1181 HydrophobicContact CG1-CD2 4.18Å; V1178-F1181 HydrophobicContact CG1-CE2 4.44Å; V1178-F1181 HydrophobicContact CG2-CE2 4.05Å; V1178-F1181 HydrophobicContact CG2-CZ 4.18Å; V1178-F1181 WeakPolarHBondContact O-CB 3.16Å; V1178-F1181 PolarHBondContact O-N 3.41Å; V1178-F1181 VanDerWaalsContact O-N 3.11Å; E1179-F1181 VanDerWaalsContact C-N 3.3Å; F1181-V1184 HydrophobicContact CD2-CG2 3.79Å; F1181-V1184 HydrophobicContact CE2-CG2 4.37Å; F1181-I1206 HydrophobicContact CD1-CG2 4.03Å; F1181-I1206 HydrophobicContact CD2-CG2 3.6Å; F1181-I1206 HydrophobicContact CE1-CG2 3.92Å; F1181-I1206 HydrophobicContact CE2-CD1 4.16Å; F1181-I1206 HydrophobicContact CE2-CG2 3.46Å; F1181-I1206 VanDerWaalsContact CE2-CG2 3.46Å; F1181-I1206 HydrophobicContact CG-CG2 3.89Å; F1181-I1206 HydrophobicContact CZ-CD1 4.31Å; F1181-I1206 HydrophobicContact CZ-CG2 3.64Å; F1181-Y1208 HydrophobicContact CD1-CG 4.48Å; F1181-L1321 HydrophobicContact CE2-CD2 4.28Å; F1181-L1325 HydrophobicContact CB-CD1 4.11Å; F1181-L1325 HydrophobicContact CB-CD2 4.26Å; F1181-L1325 WeakPolarHBondContact O-CD1 3.33Å; F1181-R1329 PolarHBondContact O-NH2 2.98Å
1182	Y	77.3	Confident	80.4	Confident	59 Å²	59	35.6 Å²	35.6	23%	0.231	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-48.8	172.7	-62.8	-65.6	0	0	0	110.5	I1207 A1209 Y1296 A1301 R1329	Y1182-I1207 HydrophobicContact CD2-CG2 4.16Å; Y1182-I1207 PolarHBondContact N-O 3.38Å; Y1182-A1209 HydrophobicContact CE2-CB 3.87Å; Y1182-A1209 VanDerWaalsContact CE2-N 3.35Å; Y1182-Y1296 HydrophobicContact CD2-CD1 4.34Å; Y1182-Y1296 HydrophobicContact CD2-CG 4.11Å; Y1182-Y1296 HydrophobicContact CE2-CG 4.38Å; Y1182-Y1296 HydrophobicContact CG-CD1 4.15Å; Y1182-Y1296 HydrophobicContact CG-CG 4.2Å; Y1182-A1301 HydrophobicContact CD2-CB 4.1Å; Y1182-A1301 HydrophobicContact CE2-CB 3.75Å; Y1182-R1329 PolarHBondContact O-NH2 3.04Å
1183	H	79.4	Confident	80.1	Confident	32 Å²	32	46.5 Å²	46.5	15%	0.148	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	164.1	170.8	74	-86.8	0	0	0	113.6	I1207 R1272 Y1296	H1183-I1207 PolarHBondContact N-O 3.38Å; H1183-I1207 WeakPolarHBondContact NE2-CD1 3.42Å; H1183-I1207 PolarHBondContact O-N 2.64Å; H1183-I1207 VanDerWaalsContact O-N 3.07Å; H1183-R1272 PolarHBondContact NE2-O 3.03Å; H1183-Y1296 AromaticContact CE1-CE1 3.78Å; H1183-Y1296 AromaticContact NE2-CE1 3.78Å
1184	V	83.9	Confident	79.9	Confident	2 Å²	2	48 Å²	48	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.1	170	179.5	0	0	0	0	109.3	F1181 F1204 Q1205 I1206 V1318 L1321 R1322	F1181-V1184 HydrophobicContact CD2-CG2 3.79Å; F1181-V1184 HydrophobicContact CE2-CG2 4.37Å; V1184-F1204 HydrophobicContact CG1-CD2 4.23Å; V1184-Q1205 WeakPolarHBondContact CA-O 3.39Å; V1184-I1206 HydrophobicContact CG2-CG1 4.33Å; V1184-I1206 HydrophobicContact CG2-CG2 4.22Å; V1184-V1318 HydrophobicContact CG1-CG2 4.37Å; V1184-L1321 HydrophobicContact CB-CB 4.44Å; V1184-L1321 HydrophobicContact CG1-CB 4.09Å; V1184-L1321 HydrophobicContact CG1-CD1 3.95Å; V1184-L1321 HydrophobicContact CG2-CB 4.19Å; V1184-L1321 HydrophobicContact CG2-CD1 4.45Å; V1184-R1322 PolarHBondContact O-NE 3.32Å; V1184-R1322 PolarHBondContact O-NH2 2.97Å
1185	R	84.1	Confident	79.5	Confident	32 Å²	32	48.1 Å²	48.1	12%	0.121	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	159.2	-178.5	63.4	171.4	176.1	131.1	-2.6	112.6	D1191 F1204 Q1205 H1274	R1185-D1191 IonicContact CZ-OD1 3.67Å; R1185-D1191 IonicContact CZ-OD2 3.07Å; R1185-D1191 VanDerWaalsContact NH1-CG 3.25Å; R1185-D1191 IonicContact NH1-OD1 3.29Å; R1185-D1191 PolarHBondContact NH1-OD1 2.82Å; R1185-D1191 IonicContact NH1-OD2 2.88Å; R1185-D1191 PolarHBondContact NH1-OD2 3.13Å; R1185-D1191 VanDerWaalsContact NH2-CG 3.33Å; R1185-D1191 IonicContact NH2-OD1 3.65Å; R1185-D1191 PolarHBondContact NH2-OD1 3.2Å; R1185-D1191 IonicContact NH2-OD2 2.76Å; R1185-F1204 WeakPolarHBondContact O-CA 3.42Å; R1185-F1204 WeakPolarHBondContact O-CB 3.48Å; R1185-Q1205 HydrophobicContact CG-CB 4.2Å; R1185-Q1205 PolarHBondContact N-O 2.71Å; R1185-Q1205 VanDerWaalsContact N-O 3.08Å; R1185-Q1205 PolarHBondContact O-N 3.24Å; R1185-H1274 PolarHBondContact NH2-CD2 2.9Å; R1185-H1274 PolarHBondContact NH2-NE2 3.47Å; R1185-H1274 VanDerWaalsContact NH2-NE2 3.17Å
1186	H	85.4	Confident	79.3	Confident	82 Å²	82	53.9 Å²	53.9	38%	0.38	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	148.8	161.9	-67.4	-70.4	0	0	0	110.5	C1314	H1186-C1314 PolarHBondContact ND1-SG 3.43Å; H1186-C1314 VanDerWaalsContact ND1-SG 3.36Å
1187	V	82.8	Confident	78.9	Confident	13 Å²	13	61.7 Å²	61.7	8%	0.079	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-74.1	141	175.8	155.7	0	0	0	0	111.1	D1191 V1192 I1200 I1203 Q1205 L1305	V1187-D1191 HydrophobicContact CG1-CB 4.34Å; V1187-V1192 HydrophobicContact CB-CG2 4.28Å; V1187-V1192 HydrophobicContact CG1-CB 3.85Å; V1187-V1192 HydrophobicContact CG1-CG2 3.42Å; V1187-V1192 VanDerWaalsContact CG1-CG2 3.42Å; V1187-V1192 HydrophobicContact CG2-CG2 3.82Å; V1187-I1200 HydrophobicContact CG1-CG2 4.38Å; V1187-I1203 HydrophobicContact CB-CB 4.06Å; V1187-I1203 HydrophobicContact CB-CG2 4.35Å; V1187-I1203 HydrophobicContact CG1-CB 4.4Å; V1187-I1203 HydrophobicContact CG2-CB 4Å; V1187-I1203 HydrophobicContact CG2-CG2 3.74Å; V1187-I1203 PolarHBondContact N-O 3.43Å; V1187-Q1205 HydrophobicContact CG2-CB 4.34Å; V1187-L1305 HydrophobicContact CG2-CD2 3.76Å
1188	T	79	Confident	78.8	Confident	59 Å²	59	67.6 Å²	67.6	36%	0.362	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-101.7	163.4	165.6	76.8	0	0	0	0	110.4	A1190 D1191	T1188-A1190 PolarHBondContact O-N 3.46Å; T1188-A1190 VanDerWaalsContact O-N 3.08Å; T1188-A1190 PolarHBondContact OG1-N 2.92Å; T1188-D1191 WeakPolarHBondContact CA-OD2 3.23Å; T1188-D1191 VanDerWaalsContact CB-OD2 3.29Å; T1188-D1191 WeakPolarHBondContact CB-OD2 3.18Å; T1188-D1191 PolarHBondContact N-OD2 3.49Å; T1188-D1191 PolarHBondContact O-N 3.2Å; T1188-D1191 PolarHBondContact OG1-OD2 3.06Å
1189	N	73	Confident	78.8	Confident	114 Å²	114	69.2 Å²	69.2	61%	0.61	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.2	178.1	-159.2	-10.1	0	0	0	112.9	I1200	N1189-I1200 HydrophobicContact CB-CD1 4.35Å
1190	A	66.3	Low	78.9	Confident	49 Å²	49	66.2 Å²	66.2	41%	0.405	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-30.7	174.1	0	0	0	0	0	113.4	T1188	T1188-A1190 PolarHBondContact O-N 3.46Å; T1188-A1190 VanDerWaalsContact O-N 3.08Å; T1188-A1190 PolarHBondContact OG1-N 2.92Å
1191	D	70.6	Confident	79.1	Confident	37 Å²	37	66.1 Å²	66.1	20%	0.198	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-31.9	-171	-52.4	-63.5	0	0	0	112.7	R1185 V1187 T1188	R1185-D1191 IonicContact CZ-OD1 3.67Å; R1185-D1191 IonicContact CZ-OD2 3.07Å; R1185-D1191 VanDerWaalsContact NH1-CG 3.25Å; R1185-D1191 IonicContact NH1-OD1 3.29Å; R1185-D1191 PolarHBondContact NH1-OD1 2.82Å; R1185-D1191 IonicContact NH1-OD2 2.88Å; R1185-D1191 PolarHBondContact NH1-OD2 3.13Å; R1185-D1191 VanDerWaalsContact NH2-CG 3.33Å; R1185-D1191 IonicContact NH2-OD1 3.65Å; R1185-D1191 PolarHBondContact NH2-OD1 3.2Å; R1185-D1191 IonicContact NH2-OD2 2.76Å; V1187-D1191 HydrophobicContact CG1-CB 4.34Å; T1188-D1191 WeakPolarHBondContact CA-OD2 3.23Å; T1188-D1191 VanDerWaalsContact CB-OD2 3.29Å; T1188-D1191 WeakPolarHBondContact CB-OD2 3.18Å; T1188-D1191 PolarHBondContact N-OD2 3.49Å; T1188-D1191 PolarHBondContact O-N 3.2Å; T1188-D1191 PolarHBondContact OG1-OD2 3.06Å
1192	V	74.6	Confident	79.3	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.006	33%	0.331	C	S	.	.			trans	-129.9	72.1	-172.7	-170.6	0	0	0	0	111.8	V1187 F1194 A1195 I1203 L1305	V1187-V1192 HydrophobicContact CB-CG2 4.28Å; V1187-V1192 HydrophobicContact CG1-CB 3.85Å; V1187-V1192 HydrophobicContact CG1-CG2 3.42Å; V1187-V1192 VanDerWaalsContact CG1-CG2 3.42Å; V1187-V1192 HydrophobicContact CG2-CG2 3.82Å; V1192-F1194 HydrophobicContact CG1-CD1 3.93Å; V1192-F1194 HydrophobicContact CG1-CD2 4.41Å; V1192-F1194 HydrophobicContact CG1-CE1 3.63Å; V1192-F1194 HydrophobicContact CG1-CE2 4.13Å; V1192-F1194 HydrophobicContact CG1-CG 4.31Å; V1192-F1194 HydrophobicContact CG1-CZ 3.73Å; V1192-F1194 PolarHBondContact O-N 3.44Å; V1192-A1195 HydrophobicContact CG1-CB 3.55Å; V1192-A1195 PolarHBondContact O-N 3.41Å; V1192-I1203 HydrophobicContact CG1-CD1 4.08Å; V1192-L1305 HydrophobicContact CG2-CD1 3.74Å; V1192-L1305 HydrophobicContact CG2-CD2 3.59Å; V1192-L1305 HydrophobicContact CG2-CG 4.28Å
1193	R	71.3	Confident	79.8	Confident	230 Å²	230	66.1 Å²	66.1	87%	0.868	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	7.2	178.9	-52.5	-176.6	-171.6	-178.5	0.9	115.9
1194	F	75.1	Confident	80.4	Confident	71 Å²	71	64.6 Å²	64.6	31%	0.311	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	-2.2	-174.3	69	-94.7	0	0	0	114.2	P1136 K1144 W1146 V1192 L1305	P1136-F1194 HydrophobicContact CB-CE2 4.48Å; P1136-F1194 HydrophobicContact CB-CZ 4.14Å; P1136-F1194 HydrophobicContact CG-CE2 4.43Å; P1136-F1194 HydrophobicContact CG-CZ 3.9Å; K1144-F1194 HydrophobicContact CB-CD2 4.03Å; K1144-F1194 HydrophobicContact CB-CE2 4.19Å; K1144-F1194 HydrophobicContact CB-CG 4.37Å; K1144-F1194 HydrophobicContact CD-CD1 3.85Å; K1144-F1194 HydrophobicContact CD-CD2 4.43Å; K1144-F1194 HydrophobicContact CD-CE1 3.71Å; K1144-F1194 HydrophobicContact CD-CE2 4.32Å; K1144-F1194 HydrophobicContact CD-CG 4.22Å; K1144-F1194 HydrophobicContact CD-CZ 3.97Å; W1146-F1194 HydrophobicContact CH2-CE2 4.38Å; W1146-F1194 HydrophobicContact CZ2-CE2 4.01Å; V1192-F1194 HydrophobicContact CG1-CD1 3.93Å; V1192-F1194 HydrophobicContact CG1-CD2 4.41Å; V1192-F1194 HydrophobicContact CG1-CE1 3.63Å; V1192-F1194 HydrophobicContact CG1-CE2 4.13Å; V1192-F1194 HydrophobicContact CG1-CG 4.31Å; V1192-F1194 HydrophobicContact CG1-CZ 3.73Å; V1192-F1194 PolarHBondContact O-N 3.44Å; F1194-L1305 HydrophobicContact CE1-CD1 4.07Å; F1194-L1305 HydrophobicContact CZ-CD1 4.09Å
1195	A	75.9	Confident	80.6	Confident	18 Å²	18	65 Å²	65	15%	0.149	31%	0.314	C	S	.	.	S	Bend	trans	-96	153.4	176.8	0	0	0	0	0	110.6	W1146 V1192 E1199 I1203	W1146-A1195 HydrophobicContact CZ2-CB 4.22Å; V1192-A1195 HydrophobicContact CG1-CB 3.55Å; V1192-A1195 PolarHBondContact O-N 3.41Å; A1195-E1199 WeakPolarHBondContact CA-OE2 3.46Å; A1195-E1199 HydrophobicContact CB-CB 4.08Å; A1195-E1199 WeakPolarHBondContact CB-OE2 3.41Å; A1195-I1203 HydrophobicContact CB-CD1 3.57Å
1196	E	80.9	Confident	80.9	Confident	122 Å²	122	63.5 Å²	63.5	57%	0.57	31%	0.309	S	S	*	.			trans	-70.9	155.2	173.7	-61.8	-170.6	-177.6	0	0	111.5	K1198 E1199 I1200	E1196-K1198 PolarHBondContact O-N 3.04Å; E1196-K1198 VanDerWaalsContact O-N 3.08Å; E1196-E1199 HydrophobicContact CB-CG 4.15Å; E1196-E1199 PolarHBondContact N-OE2 3.12Å; E1196-E1199 VanDerWaalsContact N-OE2 3.13Å; E1196-E1199 WeakPolarHBondContact O-CA 3.46Å; E1196-E1199 WeakPolarHBondContact O-CB 3.48Å; E1196-E1199 PolarHBondContact O-N 3.31Å; E1196-I1200 PolarHBondContact O-N 3.06Å; E1196-I1200 VanDerWaalsContact O-N 3.15Å
1197	E	78.3	Confident	80.8	Confident	164 Å²	164	60 Å²	60	77%	0.766	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-29.5	176.3	-172.1	175.6	-144.8	0	0	112.8	P1201	E1197-P1201 WeakPolarHBondContact O-CD 3.42Å
1198	K	82.3	Confident	81	Confident	167 Å²	167	59.7 Å²	59.7	73%	0.726	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-22	173.8	-60.8	171.1	-173.2	162.7	0	113.8	E1196	E1196-K1198 PolarHBondContact O-N 3.04Å; E1196-K1198 VanDerWaalsContact O-N 3.08Å
1199	E	84.6	Confident	80.9	Confident	34 Å²	34	57 Å²	57	16%	0.159	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-40.1	176.7	-68.2	-174	142.3	0	0	111.3	W1146 A1195 E1196 P1201 R1202 I1203 M1307	W1146-E1199 PolarHBondContact NE1-OE1 3.39Å; W1146-E1199 PolarHBondContact NE1-OE2 3.37Å; A1195-E1199 WeakPolarHBondContact CA-OE2 3.46Å; A1195-E1199 HydrophobicContact CB-CB 4.08Å; A1195-E1199 WeakPolarHBondContact CB-OE2 3.41Å; E1196-E1199 HydrophobicContact CB-CG 4.15Å; E1196-E1199 PolarHBondContact N-OE2 3.12Å; E1196-E1199 VanDerWaalsContact N-OE2 3.13Å; E1196-E1199 WeakPolarHBondContact O-CA 3.46Å; E1196-E1199 WeakPolarHBondContact O-CB 3.48Å; E1196-E1199 PolarHBondContact O-N 3.31Å; E1199-P1201 VanDerWaalsContact C-CD 3.43Å; E1199-P1201 VanDerWaalsContact C-N 3.35Å; E1199-P1201 VanDerWaalsContact O-N 3.09Å; E1199-R1202 WeakPolarHBondContact O-CA 3.44Å; E1199-R1202 VanDerWaalsContact O-CB 3.23Å; E1199-R1202 WeakPolarHBondContact O-CB 3.49Å; E1199-R1202 PolarHBondContact O-N 3.22Å; E1199-I1203 HydrophobicContact CB-CD1 4.34Å; E1199-I1203 WeakPolarHBondContact O-CG1 3.27Å; E1199-M1307 HydrophobicContact CB-SD 4.03Å; E1199-M1307 HydrophobicContact CG-SD 3.96Å
1200	I	83.5	Confident	80.7	Confident	29 Å²	29	52.7 Å²	52.7	15%	0.149	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-43.9	-46.9	-174.5	-65.4	171.8	0	0	0	114.2	V1187 N1189 E1196 R1202 I1203	V1187-I1200 HydrophobicContact CG1-CG2 4.38Å; N1189-I1200 HydrophobicContact CB-CD1 4.35Å; E1196-I1200 PolarHBondContact O-N 3.06Å; E1196-I1200 VanDerWaalsContact O-N 3.15Å; I1200-R1202 PolarHBondContact O-N 2.94Å; I1200-I1203 PolarHBondContact O-N 3.44Å; I1200-I1203 VanDerWaalsContact O-N 3.15Å
1201	P	86.6	Confident	80.9	Confident	72 Å²	72	56.3 Å²	56.3	47%	0.468	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-62.6	-15.2	178.8	-23.5	35.6	0	0	0	115	E1197 E1199 A1311 C1314	E1197-P1201 WeakPolarHBondContact O-CD 3.42Å; E1199-P1201 VanDerWaalsContact C-CD 3.43Å; E1199-P1201 VanDerWaalsContact C-N 3.35Å; E1199-P1201 VanDerWaalsContact O-N 3.09Å; P1201-A1311 HydrophobicContact CB-CB 3.83Å; P1201-C1314 WeakPolarHBondContact O-CB 3.42Å
1202	R	89.6	Confident	80.8	Confident	60 Å²	60	54.6 Å²	54.6	23%	0.226	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-100.1	4.4	-177.6	-54.3	164.3	52.3	-152.2	-7.9	112.8	E1199 I1200 M1307 V1308 S1309	E1199-R1202 WeakPolarHBondContact O-CA 3.44Å; E1199-R1202 VanDerWaalsContact O-CB 3.23Å; E1199-R1202 WeakPolarHBondContact O-CB 3.49Å; E1199-R1202 PolarHBondContact O-N 3.22Å; I1200-R1202 PolarHBondContact O-N 2.94Å; R1202-M1307 HydrophobicContact CB-CG 4.12Å; R1202-M1307 WeakPolarHBondContact O-CA 3.44Å; R1202-V1308 PolarHBondContact NE-O 3.49Å; R1202-V1308 PolarHBondContact NH2-O 3.02Å; R1202-V1308 WeakPolarHBondContact O-CG2 3.26Å; R1202-V1308 PolarHBondContact O-N 3.45Å; R1202-S1309 PolarHBondContact NE-O 2.92Å
1203	I	89.3	Confident	81	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.5	-175.1	-37.6	176.1	0	0	0	111.3	W1146 V1187 V1192 A1195 E1199 I1200 V1306 M1307	W1146-I1203 HydrophobicContact CH2-CD1 3.99Å; W1146-I1203 HydrophobicContact CH2-CG1 4.4Å; W1146-I1203 HydrophobicContact CH2-CG2 4.03Å; W1146-I1203 HydrophobicContact CZ2-CD1 3.72Å; W1146-I1203 HydrophobicContact CZ2-CG1 4.41Å; V1187-I1203 HydrophobicContact CB-CB 4.06Å; V1187-I1203 HydrophobicContact CB-CG2 4.35Å; V1187-I1203 HydrophobicContact CG1-CB 4.4Å; V1187-I1203 HydrophobicContact CG2-CB 4Å; V1187-I1203 HydrophobicContact CG2-CG2 3.74Å; V1187-I1203 PolarHBondContact N-O 3.43Å; V1192-I1203 HydrophobicContact CG1-CD1 4.08Å; A1195-I1203 HydrophobicContact CB-CD1 3.57Å; E1199-I1203 HydrophobicContact CB-CD1 4.34Å; E1199-I1203 WeakPolarHBondContact O-CG1 3.27Å; I1200-I1203 PolarHBondContact O-N 3.44Å; I1200-I1203 VanDerWaalsContact O-N 3.15Å; I1203-V1306 WeakPolarHBondContact CA-O 3.4Å; I1203-V1306 WeakPolarHBondContact CG2-O 3.49Å; I1203-M1307 HydrophobicContact CG1-CB 4.17Å; I1203-M1307 HydrophobicContact CG1-CG 4.31Å
1204	F	91.5	Very high	81.2	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	161	168.1	64.5	-89.5	0	0	0	111.8	V1184 R1185 I1206 V1306 V1308 W1317 V1318 L1321	V1184-F1204 HydrophobicContact CG1-CD2 4.23Å; R1185-F1204 WeakPolarHBondContact O-CA 3.42Å; R1185-F1204 WeakPolarHBondContact O-CB 3.48Å; F1204-I1206 HydrophobicContact CD2-CG1 4.14Å; F1204-I1206 HydrophobicContact CE2-CD1 4.05Å; F1204-I1206 HydrophobicContact CE2-CG1 3.96Å; F1204-V1306 HydrophobicContact CD1-CB 4.37Å; F1204-V1306 HydrophobicContact CD2-CB 4.32Å; F1204-V1306 HydrophobicContact CE1-CB 3.92Å; F1204-V1306 HydrophobicContact CE1-CG1 3.89Å; F1204-V1306 HydrophobicContact CE2-CB 3.85Å; F1204-V1306 HydrophobicContact CE2-CG1 4.37Å; F1204-V1306 HydrophobicContact CE2-CG2 4.08Å; F1204-V1306 HydrophobicContact CZ-CB 3.64Å; F1204-V1306 HydrophobicContact CZ-CG1 3.68Å; F1204-V1306 HydrophobicContact CZ-CG2 4.21Å; F1204-V1306 PolarHBondContact N-O 3.18Å; F1204-V1306 PolarHBondContact O-N 3.06Å; F1204-V1308 HydrophobicContact CE1-CG1 3.91Å; F1204-W1317 HydrophobicContact CD1-CB 4.2Å; F1204-W1317 HydrophobicContact CE1-CB 3.54Å; F1204-W1317 HydrophobicContact CE1-CD2 4.25Å; F1204-W1317 AromaticContact CE1-CG 3.84Å; F1204-W1317 HydrophobicContact CE1-CG 3.84Å; F1204-W1317 HydrophobicContact CZ-CB 3.8Å; F1204-W1317 AromaticContact CZ-CD2 3.94Å; F1204-W1317 HydrophobicContact CZ-CD2 3.94Å; F1204-W1317 AromaticContact CZ-CE3 3.78Å; F1204-W1317 HydrophobicContact CZ-CE3 3.78Å; F1204-W1317 AromaticContact CZ-CG 3.98Å; F1204-W1317 HydrophobicContact CZ-CG 3.98Å; F1204-V1318 HydrophobicContact CB-CG2 3.36Å; F1204-V1318 HydrophobicContact CD1-CG2 4.33Å; F1204-V1318 HydrophobicContact CD2-CG2 4.32Å; F1204-V1318 HydrophobicContact CG-CG2 3.8Å; F1204-L1321 HydrophobicContact CD2-CD1 4.21Å; F1204-L1321 HydrophobicContact CE2-CD1 3.51Å; F1204-L1321 HydrophobicContact CZ-CD1 4.14Å
1205	Q	88.8	Confident	81	Confident	9 Å²	9	49 Å²	49	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.7	-179.9	-165.7	-172.9	41	0	0	110.1	V1184 R1185 V1187 I1207 D1303 L1305	V1184-Q1205 WeakPolarHBondContact CA-O 3.39Å; R1185-Q1205 HydrophobicContact CG-CB 4.2Å; R1185-Q1205 PolarHBondContact N-O 2.71Å; R1185-Q1205 VanDerWaalsContact N-O 3.08Å; R1185-Q1205 PolarHBondContact O-N 3.24Å; V1187-Q1205 HydrophobicContact CG2-CB 4.34Å; Q1205-I1207 HydrophobicContact CG-CG1 4.13Å; Q1205-D1303 WeakPolarHBondContact CG-OD1 3.15Å; Q1205-D1303 PolarHBondContact NE2-OD1 3.09Å; Q1205-D1303 PolarHBondContact NE2-OD2 2.88Å; Q1205-L1305 HydrophobicContact CB-CD2 4.15Å; Q1205-L1305 HydrophobicContact CG-CD2 4.02Å
1206	I	88.7	Confident	80.3	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.8	168.3	-51.3	177.7	0	0	0	107.7	I1158 F1181 V1184 F1204 Y1208 L1304 V1306 L1321	I1158-I1206 HydrophobicContact CD1-CD1 3.93Å; F1181-I1206 HydrophobicContact CD1-CG2 4.03Å; F1181-I1206 HydrophobicContact CD2-CG2 3.6Å; F1181-I1206 HydrophobicContact CE1-CG2 3.92Å; F1181-I1206 HydrophobicContact CE2-CD1 4.16Å; F1181-I1206 HydrophobicContact CE2-CG2 3.46Å; F1181-I1206 VanDerWaalsContact CE2-CG2 3.46Å; F1181-I1206 HydrophobicContact CG-CG2 3.89Å; F1181-I1206 HydrophobicContact CZ-CD1 4.31Å; F1181-I1206 HydrophobicContact CZ-CG2 3.64Å; V1184-I1206 HydrophobicContact CG2-CG1 4.33Å; V1184-I1206 HydrophobicContact CG2-CG2 4.22Å; F1204-I1206 HydrophobicContact CD2-CG1 4.14Å; F1204-I1206 HydrophobicContact CE2-CD1 4.05Å; F1204-I1206 HydrophobicContact CE2-CG1 3.96Å; I1206-Y1208 HydrophobicContact CG2-CD1 3.97Å; I1206-L1304 HydrophobicContact CB-CB 4.49Å; I1206-L1304 PolarHBondContact N-O 3.49Å; I1206-L1304 PolarHBondContact O-N 2.88Å; I1206-V1306 HydrophobicContact CD1-CG2 4.36Å; I1206-L1321 HydrophobicContact CD1-CD1 4.19Å; I1206-L1321 HydrophobicContact CG1-CD1 4.42Å
1207	I	84.3	Confident	78.9	Confident	9 Å²	9	47.6 Å²	47.6	5%	0.046	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.1	169.2	-61.4	-166.5	0	0	0	109.1	Y1182 H1183 Q1205 Y1296 A1301 R1302 D1303	Y1182-I1207 HydrophobicContact CD2-CG2 4.16Å; Y1182-I1207 PolarHBondContact N-O 3.38Å; H1183-I1207 PolarHBondContact N-O 3.38Å; H1183-I1207 WeakPolarHBondContact NE2-CD1 3.42Å; H1183-I1207 PolarHBondContact O-N 2.64Å; H1183-I1207 VanDerWaalsContact O-N 3.07Å; Q1205-I1207 HydrophobicContact CG-CG1 4.13Å; I1207-Y1296 HydrophobicContact CG2-CD1 4.34Å; I1207-Y1296 HydrophobicContact CG2-CE1 4.04Å; I1207-A1301 HydrophobicContact CG2-CB 4.14Å; I1207-R1302 WeakPolarHBondContact CA-O 3.41Å; I1207-D1303 HydrophobicContact CG1-CB 4.43Å
1208	Y	85.6	Confident	77.3	Confident	5 Å²	5	43 Å²	43	2%	0.02	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	157.3	-165.6	57.8	-77.1	0	0	0	111.7	L1176 K1180 F1181 I1206 E1213 A1301 R1302 L1304	L1176-Y1208 HydrophobicContact CD2-CD2 3.69Å; L1176-Y1208 HydrophobicContact CD2-CE1 4.49Å; L1176-Y1208 HydrophobicContact CD2-CE2 3.4Å; L1176-Y1208 VanDerWaalsContact CD2-CE2 3.4Å; L1176-Y1208 HydrophobicContact CD2-CG 4.34Å; K1180-Y1208 WeakPolarHBondContact O-CA 3.39Å; F1181-Y1208 HydrophobicContact CD1-CG 4.48Å; I1206-Y1208 HydrophobicContact CG2-CD1 3.97Å; Y1208-E1213 HydrophobicContact CE2-CB 4.12Å; Y1208-E1213 HydrophobicContact CE2-CG 4.13Å; Y1208-E1213 PolarHBondContact OH-OE2 3.29Å; Y1208-A1301 CarbonylContact O-C 3.58Å; Y1208-A1301 WeakPolarHBondContact O-CA 3.27Å; Y1208-R1302 HydrophobicContact CD1-CB 4.43Å; Y1208-R1302 WeakPolarHBondContact CD1-O 3.33Å; Y1208-R1302 HydrophobicContact CD2-CB 4.18Å; Y1208-R1302 HydrophobicContact CE1-CB 3.9Å; Y1208-R1302 HydrophobicContact CE2-CB 3.62Å; Y1208-R1302 HydrophobicContact CE2-CG 4.41Å; Y1208-R1302 VanDerWaalsContact CZ-CB 3.46Å; Y1208-R1302 PolarHBondContact N-O 2.84Å; Y1208-R1302 PolarHBondContact O-N 3.44Å; Y1208-L1304 HydrophobicContact CE1-CB 3.72Å
1209	A	77	Confident	74.9	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.033	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	134.5	173.3	0	0	0	0	0	110.2	K1180 Y1182 E1211 G1212	K1180-A1209 HydrophobicContact CB-CB 4.33Å; K1180-A1209 PolarHBondContact O-N 3.17Å; Y1182-A1209 HydrophobicContact CE2-CB 3.87Å; Y1182-A1209 VanDerWaalsContact CE2-N 3.35Å; A1209-E1211 HydrophobicContact CB-CG 3.69Å; A1209-E1211 PolarHBondContact O-N 3.41Å; A1209-E1211 VanDerWaalsContact O-N 3.07Å; A1209-G1212 PolarHBondContact O-N 3.17Å
1210	G	69.2	Low	72.3	Confident	23 Å²	23	46.8 Å²	46.8	24%	0.237	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.7	-179.7	0	0	0	0	0	115.1	G1212 L1300	G1210-G1212 VanDerWaalsContact C-N 3.34Å; G1210-L1300 PolarHBondContact N-O 3.36Å
1211	E	71.5	Confident	69.6	Low	124 Å²	124	52.7 Å²	52.7	58%	0.579	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.2	169.4	53.2	170.4	96.9	0	0	113.8	K1180 A1209	K1180-E1211 HydrophobicContact CD-CG 4.41Å; K1180-E1211 IonicContact NZ-OE2 2.77Å; K1180-E1211 PolarHBondContact NZ-OE2 2.9Å; A1209-E1211 HydrophobicContact CB-CG 3.69Å; A1209-E1211 PolarHBondContact O-N 3.41Å; A1209-E1211 VanDerWaalsContact O-N 3.07Å
1212	G	68.2	Low	66.7	Low	1 Å²	1	54.8 Å²	54.8	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-104.7	31.5	174.2	0	0	0	0	0	113.4	L1176 D1177 A1209 G1210	L1176-G1212 WeakPolarHBondContact CA-O 3.46Å; D1177-G1212 PolarHBondContact N-O 3.24Å; A1209-G1212 PolarHBondContact O-N 3.17Å; G1210-G1212 VanDerWaalsContact C-N 3.34Å
1213	E	78.6	Confident	63.8	Low	30 Å²	30	56.3 Å²	56.3	14%	0.14	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	115.4	-171	-167.2	-154.3	95.7	0	0	110.9	L1174 L1176 Y1208 R1215 R1302	L1174-E1213 HydrophobicContact CD1-CG 3.43Å; L1174-E1213 VanDerWaalsContact CD1-CG 3.43Å; L1176-E1213 HydrophobicContact CD2-CB 4.18Å; L1176-E1213 HydrophobicContact CD2-CG 3.86Å; Y1208-E1213 HydrophobicContact CE2-CB 4.12Å; Y1208-E1213 HydrophobicContact CE2-CG 4.13Å; Y1208-E1213 PolarHBondContact OH-OE2 3.29Å; E1213-R1215 VanDerWaalsContact CD-NH2 3.28Å; E1213-R1215 HydrophobicContact CG-CG 4.46Å; E1213-R1215 IonicContact OE1-CZ 3.15Å; E1213-R1215 IonicContact OE1-NE 2.73Å; E1213-R1215 PolarHBondContact OE1-NE 3.3Å; E1213-R1215 IonicContact OE1-NH2 3.51Å; E1213-R1215 PolarHBondContact OE1-NH2 3.19Å; E1213-R1215 IonicContact OE2-CZ 2.86Å; E1213-R1215 IonicContact OE2-NE 2.75Å; E1213-R1215 IonicContact OE2-NH2 2.81Å; E1213-R1215 PolarHBondContact OE2-NH2 3.47Å; E1213-R1302 IonicContact OE1-CZ 3.41Å; E1213-R1302 IonicContact OE1-NH1 2.67Å; E1213-R1302 PolarHBondContact OE1-NH1 3.44Å; E1213-R1302 VanDerWaalsContact OE2-CD 3.24Å; E1213-R1302 WeakPolarHBondContact OE2-CD 3.24Å; E1213-R1302 IonicContact OE2-CZ 2.64Å; E1213-R1302 IonicContact OE2-NE 2.91Å; E1213-R1302 IonicContact OE2-NH1 3.92Å; E1213-R1302 PolarHBondContact OE2-NH1 2.84Å
1214	S	75.1	Confident	60.7	Low	39 Å²	39	65.2 Å²	65.2	27%	0.273	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.7	175.6	-54.2	0	0	0	0	110	L1174 I1175	L1174-S1214 WeakPolarHBondContact CA-O 3.28Å; I1175-S1214 PolarHBondContact N-O 3.36Å; I1175-S1214 PolarHBondContact O-N 3.15Å
1215	R	71.6	Confident	57.8	Low	115 Å²	115	70 Å²	70	43%	0.434	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151	175.8	-59.8	-169.9	-156	-167.9	1.9	111.1	L1174 E1213 V1217	L1174-R1215 HydrophobicContact CB-CG 4.32Å; L1174-R1215 HydrophobicContact CD1-CG 3.73Å; E1213-R1215 VanDerWaalsContact CD-NH2 3.28Å; E1213-R1215 HydrophobicContact CG-CG 4.46Å; E1213-R1215 IonicContact OE1-CZ 3.15Å; E1213-R1215 IonicContact OE1-NE 2.73Å; E1213-R1215 PolarHBondContact OE1-NE 3.3Å; E1213-R1215 IonicContact OE1-NH2 3.51Å; E1213-R1215 PolarHBondContact OE1-NH2 3.19Å; E1213-R1215 IonicContact OE2-CZ 2.86Å; E1213-R1215 IonicContact OE2-NE 2.75Å; E1213-R1215 IonicContact OE2-NH2 2.81Å; E1213-R1215 PolarHBondContact OE2-NH2 3.47Å; R1215-V1217 PolarHBondContact O-N 2.98Å
1216	L	61.6	Low	54.9	Low	48 Å²	48	75.3 Å²	75.3	25%	0.251	43%	0.428	S	S	.	.			trans	-62.5	127	162.1	-82	150.2	0	0	0	109.9	R1078 L1081 G1218	R1078-L1216 HydrophobicContact CB-CD2 4.15Å; R1078-L1216 HydrophobicContact CG-CD2 4.3Å; L1081-L1216 HydrophobicContact CD1-CD1 4.32Å; L1081-L1216 HydrophobicContact CD1-CD2 4.25Å; L1081-L1216 HydrophobicContact CD1-CG 3.68Å; L1216-G1218 PolarHBondContact O-N 3.19Å
1217	V	51.4	Low	52.1	Low	63 Å²	63	81.4 Å²	81.4	38%	0.382	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	72.5	-175	178.9	0	0	0	0	110	Q1074 L1077 R1215 V1220	Q1074-V1217 PolarHBondContact NE2-O 3.2Å; L1077-V1217 HydrophobicContact CD2-CB 4.4Å; L1077-V1217 HydrophobicContact CD2-CG2 3.79Å; R1215-V1217 PolarHBondContact O-N 2.98Å; V1217-V1220 HydrophobicContact CG1-CG2 4.06Å
1218	G	44.5	Very low	49.6	Very low	69 Å²	69	85.9 Å²	85.9	71%	0.711	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	-19.9	178.6	0	0	0	0	0	115.3	L1216	L1216-G1218 PolarHBondContact O-N 3.19Å
1219	E	32.7	Very low	47.4	Very low	169 Å²	169	90.7 Å²	90.7	79%	0.79	51%	0.508	S	S	*	.			trans	-127.7	66.6	178.2	-70.8	-172.2	166.6	0	0	111
1220	V	29.5	Very low	45.7	Very low	111 Å²	111	99 Å²	99	67%	0.673	55%	0.546	S	S	*	.			trans	-108.7	86.5	172.7	-174.1	0	0	0	0	110.1	V1217	V1217-V1220 HydrophobicContact CG1-CG2 4.06Å
1221	Q	26.5	Very low	45.1	Very low	153 Å²	153	104.4 Å²	104.4	72%	0.715	57%	0.57	S	S	*	*			trans	-76.6	128.9	152	-77	-172	-22.2	0	0	108.1	T1223	Q1221-T1223 VanDerWaalsContact C-N 3.26Å; Q1221-T1223 HydrophobicContact CB-CG2 4.24Å; Q1221-T1223 PolarHBondContact O-N 3.16Å
1222	P	26	Very low	44.7	Very low	115 Å²	115	100.7 Å²	100.7	75%	0.747	56%	0.555	S	S	*	*			trans	-70.7	86.9	166.4	29.9	-32.6	0	0	0	108.6	E1224	P1222-E1224 PolarHBondContact O-N 2.91Å
1223	T	27.5	Very low	45	Very low	92 Å²	92	104.1 Å²	104.1	56%	0.564	57%	0.572	S	S	*	*			trans	-79.1	75.2	171.3	58.3	0	0	0	0	109.9	Q1221 S1225	Q1221-T1223 VanDerWaalsContact C-N 3.26Å; Q1221-T1223 HydrophobicContact CB-CG2 4.24Å; Q1221-T1223 PolarHBondContact O-N 3.16Å; T1223-S1225 PolarHBondContact O-N 2.94Å
1224	E	26.2	Very low	44.8	Very low	187 Å²	187	107 Å²	107	87%	0.874	60%	0.596	S	S	*	*			trans	-53.9	126	154.7	-63.9	-176.1	156.8	0	0	107.7	P1222	P1222-E1224 PolarHBondContact O-N 2.91Å
1225	S	28.8	Very low	44.9	Very low	101 Å²	101	106.8 Å²	106.8	71%	0.706	59%	0.59	S	S	*	*			trans	-128.7	130	173.5	55.5	0	0	0	0	108.9	T1223	T1223-S1225 PolarHBondContact O-N 2.94Å
1226	P	28.7	Very low	45.2	Very low	122 Å²	122	104.9 Å²	104.9	79%	0.792	59%	0.585	S	S	*	*			trans	-66.3	147.6	-167.9	-23.2	34.2	0	0	0	113.8	P1228	P1226-P1228 WeakPolarHBondContact O-CD 3.34Å
1227	N	29.1	Very low	45.6	Very low	130 Å²	130	104.5 Å²	104.5	70%	0.695	59%	0.592	S	S	*	*			trans	-54.4	121.8	176.5	-86.6	-25.9	0	0	0	113.2	W1229	N1227-W1229 VanDerWaalsContact OD1-CD1 3.31Å
1228	P	32.8	Very low	46.9	Very low	102 Å²	102	101.7 Å²	101.7	66%	0.662	58%	0.575	S	S	*	*			trans	-113	64.2	164.2	32.5	-13.4	0	0	0	109.2	P1226	P1226-P1228 WeakPolarHBondContact O-CD 3.34Å
1229	W	39.2	Very low	48.5	Very low	106 Å²	106	98.9 Å²	98.9	40%	0.402	54%	0.544	S	S	.	.			trans	-116.1	59.7	-177.4	-64.8	104.5	0	0	0	111.7	N1227 V1232 K1271 P1298	N1227-W1229 VanDerWaalsContact OD1-CD1 3.31Å; W1229-V1232 HydrophobicContact CE3-CG2 3.81Å; W1229-V1232 HydrophobicContact CZ3-CG2 4Å; W1229-K1271 VanDerWaalsContact CE3-NZ 3.35Å; W1229-K1271 HydrophobicContact CH2-CD 4.32Å; W1229-K1271 HydrophobicContact CZ3-CD 3.93Å; W1229-P1298 HydrophobicContact CH2-CB 3.59Å; W1229-P1298 HydrophobicContact CH2-CG 4.03Å; W1229-P1298 HydrophobicContact CZ2-CB 4Å
1230	Q	41.6	Very low	51.1	Low	178 Å²	178	90.9 Å²	90.9	83%	0.832	51%	0.506	S	S	*	.	S	Bend	trans	-110	149	160.2	-72.2	171.9	-36.5	0	0	108.1
1231	D	55.9	Low	53.6	Low	138 Å²	138	87.5 Å²	87.5	74%	0.738	48%	0.484	S	S	*	.	S	Bend	trans	50.1	64.9	-178.3	-66.8	1.5	0	0	0	116.6
1232	V	64.2	Low	56.3	Low	45 Å²	45	83.7 Å²	83.7	27%	0.273	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.3	159.6	179.1	0	0	0	0	109.8	W1229 D1239 F1240 I1241 K1271	W1229-V1232 HydrophobicContact CE3-CG2 3.81Å; W1229-V1232 HydrophobicContact CZ3-CG2 4Å; V1232-D1239 HydrophobicContact CG1-CB 3.64Å; V1232-F1240 CarbonylContact C-O 3.55Å; V1232-F1240 WeakPolarHBondContact CA-O 3.45Å; V1232-I1241 HydrophobicContact CG2-CG2 3.86Å; V1232-K1271 HydrophobicContact CG2-CD 4.13Å; V1232-K1271 VanDerWaalsContact CG2-NZ 3.32Å
1233	M	73.1	Confident	58.8	Low	74 Å²	74	80.7 Å²	80.7	37%	0.365	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	101	176.8	-67.2	-173.2	-68.9	0	0	110.6	H1235 F1240 L1268 L1282	M1233-H1235 PolarHBondContact O-N 2.76Å; M1233-F1240 HydrophobicContact CB-CB 4.36Å; M1233-F1240 PolarHBondContact N-O 2.9Å; M1233-F1240 PolarHBondContact O-N 2.71Å; M1233-L1268 HydrophobicContact CE-CD1 3.73Å; M1233-L1268 HydrophobicContact CE-CD2 3.41Å; M1233-L1268 VanDerWaalsContact CE-CD2 3.41Å; M1233-L1268 HydrophobicContact CE-CG 4.23Å; M1233-L1282 HydrophobicContact CB-CD2 4.45Å; M1233-L1282 HydrophobicContact CE-CD2 4.2Å; M1233-L1282 HydrophobicContact SD-CD2 4.17Å
1234	S	74.2	Confident	61.4	Low	90 Å²	90	80.1 Å²	80.1	63%	0.629	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	117	177.2	-59.1	0	0	0	0	111.6	H1238 D1239	S1234-H1238 CarbonylContact C-O 3.6Å; S1234-H1238 WeakPolarHBondContact CA-O 3.49Å; S1234-D1239 WeakPolarHBondContact CB-OD1 3.39Å; S1234-D1239 PolarHBondContact OG-OD1 2.93Å
1235	H	78.1	Confident	64	Low	35 Å²	35	71.9 Å²	71.9	16%	0.162	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	125.7	-178.2	176.7	91.8	0	0	0	111.4	M1233 G1237 H1238 F1240 L1282 D1286	M1233-H1235 PolarHBondContact O-N 2.76Å; H1235-G1237 PolarHBondContact O-N 3.1Å; H1235-G1237 VanDerWaalsContact O-N 3.1Å; H1235-H1238 PolarHBondContact N-O 2.97Å; H1235-H1238 VanDerWaalsContact O-CB 3.32Å; H1235-H1238 WeakPolarHBondContact O-CB 3.39Å; H1235-H1238 PolarHBondContact O-CD2 3.44Å; H1235-H1238 PolarHBondContact O-N 3.1Å; H1235-F1240 HydrophobicContact CB-CD2 4.31Å; H1235-F1240 HydrophobicContact CB-CE2 4.38Å; H1235-L1282 HydrophobicContact CB-CD1 3.93Å; H1235-D1286 IonicContact CE1-OD1 2.9Å; H1235-D1286 IonicContact CE1-OD2 3.39Å; H1235-D1286 PolarHBondContact CE1-OD2 3.14Å
1236	K	77	Confident	66.3	Low	75 Å²	75	72.1 Å²	72.1	33%	0.326	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	36.2	-176.9	-64.3	175.8	-176.9	169.4	0	114.4	H1238 D1286 V1289 P1291 C1292	K1236-H1238 VanDerWaalsContact C-N 3.29Å; K1236-H1238 PolarHBondContact O-N 3.26Å; K1236-D1286 WeakPolarHBondContact CE-OD1 3.3Å; K1236-D1286 PolarHBondContact NZ-O 2.86Å; K1236-D1286 IonicContact NZ-OD1 2.72Å; K1236-D1286 PolarHBondContact NZ-OD1 3.36Å; K1236-V1289 VanDerWaalsContact CD-O 3.23Å; K1236-V1289 WeakPolarHBondContact CD-O 3.25Å; K1236-V1289 PolarHBondContact NZ-O 3.04Å; K1236-P1291 HydrophobicContact CB-CB 4.44Å; K1236-P1291 WeakPolarHBondContact O-CA 3.19Å; K1236-C1292 PolarHBondContact O-N 3.38Å
1237	G	70.4	Confident	68.6	Low	39 Å²	39	69.8 Å²	69.8	40%	0.402	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-3.3	-178.2	0	0	0	0	0	115.5	H1235 R1272 C1292	H1235-G1237 PolarHBondContact O-N 3.1Å; H1235-G1237 VanDerWaalsContact O-N 3.1Å; G1237-R1272 WeakPolarHBondContact O-CD 3.34Å; G1237-R1272 PolarHBondContact O-NH1 3.08Å; G1237-C1292 VanDerWaalsContact O-CB 3.26Å; G1237-C1292 WeakPolarHBondContact O-CB 3.36Å
1238	H	79.7	Confident	71.1	Confident	5 Å²	5	68.5 Å²	68.5	2%	0.023	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	147.9	166.8	-62.8	-82	0	0	0	109.3	S1234 H1235 K1236 F1240 C1270 C1273 A1290 C1292	S1234-H1238 CarbonylContact C-O 3.6Å; S1234-H1238 WeakPolarHBondContact CA-O 3.49Å; H1235-H1238 PolarHBondContact N-O 2.97Å; H1235-H1238 VanDerWaalsContact O-CB 3.32Å; H1235-H1238 WeakPolarHBondContact O-CB 3.39Å; H1235-H1238 PolarHBondContact O-CD2 3.44Å; H1235-H1238 PolarHBondContact O-N 3.1Å; K1236-H1238 VanDerWaalsContact C-N 3.29Å; K1236-H1238 PolarHBondContact O-N 3.26Å; H1238-F1240 HydrophobicContact CB-CD2 3.77Å; H1238-F1240 HydrophobicContact CB-CE1 4.4Å; H1238-F1240 HydrophobicContact CB-CE2 3.38Å; H1238-F1240 HydrophobicContact CB-CG 4.43Å; H1238-F1240 HydrophobicContact CB-CZ 3.73Å; H1238-F1240 AromaticContact CD2-CE2 3.88Å; H1238-F1240 AromaticContact CD2-CZ 3.88Å; H1238-F1240 AromaticContact CG-CE2 3.72Å; H1238-F1240 AromaticContact CG-CZ 3.66Å; H1238-C1270 HydrophobicContact CB-CB 4.14Å; H1238-C1270 VanDerWaalsContact CB-SG 3.52Å; H1238-C1270 PolarHBondContact ND1-SG 2.98Å; H1238-C1273 VanDerWaalsContact CE1-SG 3.53Å; H1238-C1273 PolarHBondContact ND1-SG 3.48Å; H1238-A1290 PolarHBondContact NE2-O 2.89Å; H1238-C1292 HydrophobicContact CB-CB 4.23Å; H1238-C1292 WeakPolarHBondContact ND1-CB 3.29Å; H1238-C1292 PolarHBondContact ND1-SG 3.01Å; H1238-C1292 VanDerWaalsContact ND1-SG 3.37Å; H1238-C1292 PolarHBondContact NE2-N 3.27Å
1239	D	78.4	Confident	73.4	Confident	10 Å²	10	64.7 Å²	64.7	5%	0.053	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	91.1	167.2	-75.1	-23.1	0	0	0	108.3	V1232 S1234 C1270 K1271 R1272	V1232-D1239 HydrophobicContact CG1-CB 3.64Å; S1234-D1239 WeakPolarHBondContact CB-OD1 3.39Å; S1234-D1239 PolarHBondContact OG-OD1 2.93Å; D1239-C1270 CarbonylContact O-C 3.53Å; D1239-C1270 WeakPolarHBondContact O-CA 3.34Å; D1239-K1271 HydrophobicContact CB-CB 4.2Å; D1239-K1271 WeakPolarHBondContact O-CB 3.41Å; D1239-K1271 PolarHBondContact O-N 3.43Å; D1239-R1272 HydrophobicContact CB-CG 4.38Å; D1239-R1272 VanDerWaalsContact CG-NE 3.32Å; D1239-R1272 IonicContact OD1-NE 2.68Å; D1239-R1272 IonicContact OD1-NH2 3.57Å; D1239-R1272 IonicContact OD2-CZ 3.9Å; D1239-R1272 IonicContact OD2-NE 3.7Å; D1239-R1272 PolarHBondContact OD2-NE 3.09Å; D1239-R1272 IonicContact OD2-NH2 2.89Å; D1239-R1272 PolarHBondContact OD2-NH2 3.1Å
1240	F	85.3	Confident	75.6	Confident	0 Å²	0	63 Å²	63	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	135.2	-176.8	-72.8	-71.6	0	0	0	112.2	V1232 M1233 H1235 H1238 L1268 E1269 C1270 I1277 L1282 V1289	V1232-F1240 CarbonylContact C-O 3.55Å; V1232-F1240 WeakPolarHBondContact CA-O 3.45Å; M1233-F1240 HydrophobicContact CB-CB 4.36Å; M1233-F1240 PolarHBondContact N-O 2.9Å; M1233-F1240 PolarHBondContact O-N 2.71Å; H1235-F1240 HydrophobicContact CB-CD2 4.31Å; H1235-F1240 HydrophobicContact CB-CE2 4.38Å; H1238-F1240 HydrophobicContact CB-CD2 3.77Å; H1238-F1240 HydrophobicContact CB-CE1 4.4Å; H1238-F1240 HydrophobicContact CB-CE2 3.38Å; H1238-F1240 HydrophobicContact CB-CG 4.43Å; H1238-F1240 HydrophobicContact CB-CZ 3.73Å; H1238-F1240 AromaticContact CD2-CE2 3.88Å; H1238-F1240 AromaticContact CD2-CZ 3.88Å; H1238-F1240 AromaticContact CG-CE2 3.72Å; H1238-F1240 AromaticContact CG-CZ 3.66Å; F1240-L1268 HydrophobicContact CB-CB 4.18Å; F1240-L1268 HydrophobicContact CB-CD1 4.34Å; F1240-L1268 HydrophobicContact CD1-CB 3.81Å; F1240-L1268 HydrophobicContact CG-CB 4.23Å; F1240-L1268 HydrophobicContact CG-CD1 4.43Å; F1240-E1269 WeakPolarHBondContact CA-O 3.29Å; F1240-C1270 HydrophobicContact CD1-CB 3.98Å; F1240-C1270 HydrophobicContact CE1-CB 3.84Å; F1240-C1270 HydrophobicContact CZ-CB 4.49Å; F1240-I1277 HydrophobicContact CD1-CD1 4.39Å; F1240-I1277 HydrophobicContact CD1-CG1 4.5Å; F1240-I1277 HydrophobicContact CE1-CD1 3.71Å; F1240-I1277 HydrophobicContact CE1-CG1 3.96Å; F1240-I1277 HydrophobicContact CE2-CD1 4.22Å; F1240-I1277 HydrophobicContact CZ-CD1 3.61Å; F1240-I1277 HydrophobicContact CZ-CG1 4.37Å; F1240-L1282 HydrophobicContact CD2-CD1 3.96Å; F1240-L1282 HydrophobicContact CE2-CD1 3.84Å; F1240-V1289 HydrophobicContact CZ-CG1 4.42Å
1241	I	82.1	Confident	77.8	Confident	41 Å²	41	55.1 Å²	55.1	21%	0.21	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146.6	166.4	48.9	172.5	0	0	0	110.3	V1232 I1243 L1268 E1269 K1271	V1232-I1241 HydrophobicContact CG2-CG2 3.86Å; I1241-I1243 HydrophobicContact CD1-CD1 3.84Å; I1241-I1243 HydrophobicContact CD1-CG1 4.2Å; I1241-I1243 HydrophobicContact CG1-CD1 4.21Å; I1241-I1243 HydrophobicContact CG1-CG1 4.22Å; I1241-L1268 CarbonylContact O-C 3.6Å; I1241-L1268 VanDerWaalsContact O-CA 3.31Å; I1241-L1268 WeakPolarHBondContact O-CA 3.44Å; I1241-E1269 VanDerWaalsContact CG1-O 3.28Å; I1241-E1269 WeakPolarHBondContact CG1-O 3.49Å; I1241-E1269 PolarHBondContact N-O 2.99Å; I1241-E1269 PolarHBondContact O-N 3.03Å; I1241-K1271 HydrophobicContact CD1-CG 3.91Å; I1241-K1271 HydrophobicContact CG1-CG 4.11Å; I1241-K1271 HydrophobicContact CG2-CD 3.8Å; I1241-K1271 HydrophobicContact CG2-CG 3.99Å
1242	A	84.3	Confident	79.1	Confident	73 Å²	73	53.2 Å²	53.2	60%	0.603	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.7	172.6	0	0	0	0	0	110.8	L1268	A1242-L1268 HydrophobicContact CB-CD2 4.39Å
1243	I	77.8	Confident	79.9	Confident	52 Å²	52	53.4 Å²	53.4	27%	0.267	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	144.2	178.3	-71.3	-166.6	0	0	0	110.1	I1241 F1245 A1267 E1269	I1241-I1243 HydrophobicContact CD1-CD1 3.84Å; I1241-I1243 HydrophobicContact CD1-CG1 4.2Å; I1241-I1243 HydrophobicContact CG1-CD1 4.21Å; I1241-I1243 HydrophobicContact CG1-CG1 4.22Å; I1243-F1245 HydrophobicContact CB-CE2 4.3Å; I1243-F1245 HydrophobicContact CB-CZ 4.13Å; I1243-F1245 HydrophobicContact CG2-CD1 4.09Å; I1243-F1245 HydrophobicContact CG2-CD2 4.27Å; I1243-F1245 HydrophobicContact CG2-CE1 3.61Å; I1243-F1245 HydrophobicContact CG2-CE2 3.84Å; I1243-F1245 HydrophobicContact CG2-CG 4.39Å; I1243-F1245 HydrophobicContact CG2-CZ 3.47Å; I1243-F1245 VanDerWaalsContact CG2-CZ 3.47Å; I1243-A1267 PolarHBondContact N-O 3.28Å; I1243-A1267 WeakPolarHBondContact O-CB 3.24Å; I1243-E1269 HydrophobicContact CD1-CB 3.88Å; I1243-E1269 HydrophobicContact CG1-CB 4.36Å
1244	S	82.5	Confident	80.5	Confident	79 Å²	79	51.7 Å²	51.7	55%	0.552	32%	0.319	S	S	*	.			trans	-109	114.1	175.6	-72	0	0	0	0	110.6
1245	F	79.9	Confident	80.9	Confident	15 Å²	15	53.3 Å²	53.3	7%	0.066	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-92.2	105	-179	-61.3	-77.2	0	0	0	111.3	I1243 S1247 T1249 L1258 W1259 N1260 P1264 A1267 E1269 K1276	I1243-F1245 HydrophobicContact CB-CE2 4.3Å; I1243-F1245 HydrophobicContact CB-CZ 4.13Å; I1243-F1245 HydrophobicContact CG2-CD1 4.09Å; I1243-F1245 HydrophobicContact CG2-CD2 4.27Å; I1243-F1245 HydrophobicContact CG2-CE1 3.61Å; I1243-F1245 HydrophobicContact CG2-CE2 3.84Å; I1243-F1245 HydrophobicContact CG2-CG 4.39Å; I1243-F1245 HydrophobicContact CG2-CZ 3.47Å; I1243-F1245 VanDerWaalsContact CG2-CZ 3.47Å; F1245-S1247 VanDerWaalsContact C-N 3.27Å; F1245-S1247 PolarHBondContact O-N 3.22Å; F1245-T1249 HydrophobicContact CB-CG2 4.46Å; F1245-T1249 HydrophobicContact CD1-CG2 3.89Å; F1245-T1249 HydrophobicContact CD2-CG2 4.15Å; F1245-T1249 HydrophobicContact CE1-CG2 4.18Å; F1245-T1249 HydrophobicContact CE2-CG2 4.4Å; F1245-T1249 HydrophobicContact CG-CG2 3.89Å; F1245-T1249 HydrophobicContact CZ-CG2 4.42Å; F1245-L1258 HydrophobicContact CD2-CB 3.87Å; F1245-L1258 HydrophobicContact CD2-CD1 4.41Å; F1245-L1258 HydrophobicContact CE2-CB 4.47Å; F1245-L1258 HydrophobicContact CE2-CD1 4.21Å; F1245-W1259 HydrophobicContact CB-CB 4.01Å; F1245-W1259 WeakPolarHBondContact O-CA 3.39Å; F1245-W1259 WeakPolarHBondContact O-CB 3.31Å; F1245-N1260 PolarHBondContact O-N 3.14Å; F1245-P1264 WeakPolarHBondContact O-CB 3.33Å; F1245-A1267 HydrophobicContact CD2-CB 3.84Å; F1245-A1267 HydrophobicContact CE2-CB 3.77Å; F1245-E1269 WeakPolarHBondContact CE1-OE2 3.45Å; F1245-E1269 HydrophobicContact CZ-CB 4.41Å; F1245-E1269 VanDerWaalsContact CZ-OE2 3.28Å; F1245-E1269 WeakPolarHBondContact CZ-OE2 3.48Å; F1245-K1276 HydrophobicContact CE1-CD 3.98Å; F1245-K1276 HydrophobicContact CE2-CD 4.46Å; F1245-K1276 HydrophobicContact CZ-CB 4.47Å; F1245-K1276 HydrophobicContact CZ-CD 3.7Å; F1245-K1276 HydrophobicContact CZ-CG 4.24Å
1246	H	78.9	Confident	81.2	Confident	106 Å²	106	58.3 Å²	58.3	49%	0.491	35%	0.352	S	S	.	.			trans	-85.1	1.2	175	-69.3	-94.6	0	0	0	113.6	V1261	H1246-V1261 PolarHBondContact ND1-O 3.17Å
1247	S	75.4	Confident	81.6	Confident	73 Å²	73	59.3 Å²	59.3	51%	0.51	36%	0.358	S	S	.	.	S	Bend	trans	-129	154.5	-178.3	56.8	0	0	0	0	112	F1245 T1249 W1259	F1245-S1247 VanDerWaalsContact C-N 3.27Å; F1245-S1247 PolarHBondContact O-N 3.22Å; S1247-T1249 PolarHBondContact O-N 3.43Å; S1247-T1249 PolarHBondContact O-OG1 3.43Å; S1247-W1259 WeakPolarHBondContact O-CB 3.47Å
1248	P	83.3	Confident	82.3	Confident	103 Å²	103	57.5 Å²	57.5	67%	0.669	34%	0.339	S	S	*	.			trans	-45.5	105.3	-174.8	-33.5	37.4	0	0	0	115.7	W1259	P1248-W1259 HydrophobicContact CB-CZ2 4.44Å; P1248-W1259 HydrophobicContact CG-CD2 4.33Å; P1248-W1259 HydrophobicContact CG-CE3 4.44Å; P1248-W1259 HydrophobicContact CG-CH2 4.1Å; P1248-W1259 HydrophobicContact CG-CZ2 3.96Å; P1248-W1259 HydrophobicContact CG-CZ3 4.33Å
1249	T	80.2	Confident	82.5	Confident	22 Å²	22	61.1 Å²	61.1	14%	0.135	35%	0.352	C	S	.	.			trans	-140.3	123.3	-176.3	-53.1	0	0	0	0	110.3	F1245 S1247 Q1257 L1258 K1276	F1245-T1249 HydrophobicContact CB-CG2 4.46Å; F1245-T1249 HydrophobicContact CD1-CG2 3.89Å; F1245-T1249 HydrophobicContact CD2-CG2 4.15Å; F1245-T1249 HydrophobicContact CE1-CG2 4.18Å; F1245-T1249 HydrophobicContact CE2-CG2 4.4Å; F1245-T1249 HydrophobicContact CG-CG2 3.89Å; F1245-T1249 HydrophobicContact CZ-CG2 4.42Å; S1247-T1249 PolarHBondContact O-N 3.43Å; S1247-T1249 PolarHBondContact O-OG1 3.43Å; T1249-Q1257 PolarHBondContact O-OE1 2.98Å; T1249-L1258 HydrophobicContact CG2-CB 4.25Å; T1249-L1258 HydrophobicContact CG2-CD1 4.15Å; T1249-L1258 PolarHBondContact O-N 2.96Å; T1249-K1276 HydrophobicContact CG2-CD 3.82Å
1250	S	84.5	Confident	82.7	Confident	71 Å²	71	64.2 Å²	64.2	50%	0.497	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-89.3	154.8	176.5	50.3	0	0	0	0	112.6	L1258	S1250-L1258 WeakPolarHBondContact O-CD1 3.31Å
1251	C	88.5	Confident	82.3	Confident	11 Å²	11	68.8 Å²	68.8	7%	0.074	40%	0.397	C	S	.	.			trans	-82.9	140.2	169.4	-178.7	0	0	0	0	111.5	I1253 K1256 L1258 H1281	C1251-I1253 VanDerWaalsContact C-N 3.31Å; C1251-I1253 PolarHBondContact O-N 3.15Å; C1251-I1253 PolarHBondContact SG-N 2.9Å; C1251-I1253 VanDerWaalsContact SG-N 3.44Å; C1251-K1256 WeakPolarHBondContact CB-O 3.16Å; C1251-K1256 PolarHBondContact N-O 2.89Å; C1251-L1258 HydrophobicContact CB-CD1 4.26Å; C1251-L1258 HydrophobicContact CB-CD2 3.93Å; C1251-L1258 HydrophobicContact CB-CG 3.88Å; C1251-H1281 VanDerWaalsContact SG-CD2 3.58Å
1252	D	83.3	Confident	81.8	Confident	99 Å²	99	73.9 Å²	73.9	53%	0.529	42%	0.423	S	S	.	.	S	Bend	trans	-76.4	-14.2	178.8	-68.2	-39.9	0	0	0	113.9	V1275 K1276	D1252-V1275 HydrophobicContact CB-CG1 4.29Å; D1252-V1275 VanDerWaalsContact OD2-CA 3.27Å; D1252-V1275 WeakPolarHBondContact OD2-CA 3.39Å; D1252-K1276 PolarHBondContact N-O 3.08Å; D1252-K1276 PolarHBondContact OD2-N 3.44Å
1253	I	82	Confident	81.6	Confident	49 Å²	49	78.9 Å²	78.9	25%	0.251	43%	0.431	S	S	.	.	S	Bend	trans	-105.2	-29.1	-178.1	-63.2	178.6	0	0	0	113.3	C1251 I1277 H1281 D1288 V1289	C1251-I1253 VanDerWaalsContact C-N 3.31Å; C1251-I1253 PolarHBondContact O-N 3.15Å; C1251-I1253 PolarHBondContact SG-N 2.9Å; C1251-I1253 VanDerWaalsContact SG-N 3.44Å; I1253-I1277 HydrophobicContact CD1-CB 4.33Å; I1253-I1277 HydrophobicContact CD1-CG2 3.59Å; I1253-I1277 HydrophobicContact CG1-CG2 3.8Å; I1253-H1281 HydrophobicContact CD1-CB 4.04Å; I1253-H1281 VanDerWaalsContact CG2-CE1 3.46Å; I1253-H1281 WeakPolarHBondContact CG2-CE1 3.27Å; I1253-H1281 WeakPolarHBondContact CG2-ND1 3.42Å; I1253-D1288 HydrophobicContact CG2-CB 3.87Å; I1253-V1289 HydrophobicContact CD1-CB 4.37Å; I1253-V1289 HydrophobicContact CD1-CG2 3.76Å
1254	C	85.6	Confident	81.9	Confident	37 Å²	37	77.5 Å²	77.5	25%	0.25	43%	0.426	C	S	.	.	S	Bend	trans	-145	162.1	-177.5	83.7	0	0	0	0	113.2	K1256 H1281	C1254-K1256 PolarHBondContact O-N 3.21Å; C1254-H1281 PolarHBondContact SG-NE2 3.21Å
1255	S	82.5	Confident	82	Confident	124 Å²	124	75.7 Å²	75.7	87%	0.867	41%	0.412	S	S	*	.	S	Bend	trans	-68	6.8	-178	53.6	0	0	0	0	115.8
1256	K	82.9	Confident	82.3	Confident	140 Å²	140	78.8 Å²	78.8	61%	0.609	43%	0.434	S	S	*	.	S	Bend	trans	-87.1	148.3	179.1	-63.2	175.9	-176.5	172.8	0	109.9	C1251 C1254 H1278	C1251-K1256 WeakPolarHBondContact CB-O 3.16Å; C1251-K1256 PolarHBondContact N-O 2.89Å; C1254-K1256 PolarHBondContact O-N 3.21Å; K1256-H1278 VanDerWaalsContact CB-CE1 3.5Å; K1256-H1278 WeakPolarHBondContact CB-CE1 3.36Å
1257	Q	86.6	Confident	82.7	Confident	97 Å²	97	73.9 Å²	73.9	45%	0.453	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-78.2	145.5	175.5	-63.7	-62.3	-45.6	0	0	110.9	T1249 W1259 P1265 H1278	T1249-Q1257 PolarHBondContact O-OE1 2.98Å; Q1257-W1259 VanDerWaalsContact OE1-NE1 3.07Å; Q1257-P1265 WeakPolarHBondContact O-CG 3.44Å; Q1257-H1278 PolarHBondContact O-CE1 3.11Å; Q1257-H1278 PolarHBondContact O-NE2 3.03Å
1258	L	83.7	Confident	83.3	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	39%	0.388	C	S	.	.	S	Bend	trans	-91.6	1.3	173.3	-66.2	175.5	0	0	0	113.2	F1245 T1249 S1250 C1251 P1265 A1267 K1276 I1277 H1278	F1245-L1258 HydrophobicContact CD2-CB 3.87Å; F1245-L1258 HydrophobicContact CD2-CD1 4.41Å; F1245-L1258 HydrophobicContact CE2-CB 4.47Å; F1245-L1258 HydrophobicContact CE2-CD1 4.21Å; T1249-L1258 HydrophobicContact CG2-CB 4.25Å; T1249-L1258 HydrophobicContact CG2-CD1 4.15Å; T1249-L1258 PolarHBondContact O-N 2.96Å; S1250-L1258 WeakPolarHBondContact O-CD1 3.31Å; C1251-L1258 HydrophobicContact CB-CD1 4.26Å; C1251-L1258 HydrophobicContact CB-CD2 3.93Å; C1251-L1258 HydrophobicContact CB-CG 3.88Å; L1258-P1265 WeakPolarHBondContact O-CD 3.44Å; L1258-A1267 HydrophobicContact CB-CB 4.26Å; L1258-A1267 HydrophobicContact CD1-CB 4.49Å; L1258-A1267 HydrophobicContact CD2-CB 3.78Å; L1258-A1267 HydrophobicContact CG-CB 4.42Å; L1258-K1276 HydrophobicContact CD1-CB 3.44Å; L1258-K1276 VanDerWaalsContact CD1-CB 3.44Å; L1258-I1277 VanDerWaalsContact CD2-C 3.46Å; L1258-H1278 HydrophobicContact CD2-CB 4.31Å; L1258-H1278 VanDerWaalsContact CD2-CE1 3.48Å; L1258-H1278 WeakPolarHBondContact CD2-CE1 3.34Å; L1258-H1278 VanDerWaalsContact CD2-N 3.32Å
1259	W	84	Confident	83.5	Confident	82 Å²	82	66.2 Å²	66.2	31%	0.311	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-123.7	154.7	-167	79.5	-80.3	0	0	0	114	F1245 S1247 P1248 Q1257 V1261	F1245-W1259 HydrophobicContact CB-CB 4.01Å; F1245-W1259 WeakPolarHBondContact O-CA 3.39Å; F1245-W1259 WeakPolarHBondContact O-CB 3.31Å; S1247-W1259 WeakPolarHBondContact O-CB 3.47Å; P1248-W1259 HydrophobicContact CB-CZ2 4.44Å; P1248-W1259 HydrophobicContact CG-CD2 4.33Å; P1248-W1259 HydrophobicContact CG-CE3 4.44Å; P1248-W1259 HydrophobicContact CG-CH2 4.1Å; P1248-W1259 HydrophobicContact CG-CZ2 3.96Å; P1248-W1259 HydrophobicContact CG-CZ3 4.33Å; Q1257-W1259 VanDerWaalsContact OE1-NE1 3.07Å; W1259-V1261 HydrophobicContact CZ3-CG2 3.95Å
1260	N	82.5	Confident	83.6	Confident	74 Å²	74	65.1 Å²	65.1	40%	0.396	35%	0.352	S	S	.	.			trans	-161.3	145.6	168	-176.4	-71.2	0	0	0	107.9	F1245 L1262 K1263	F1245-N1260 PolarHBondContact O-N 3.14Å; N1260-L1262 VanDerWaalsContact C-N 3.32Å; N1260-L1262 PolarHBondContact O-N 3.42Å; N1260-L1262 PolarHBondContact OD1-N 3.11Å; N1260-K1263 VanDerWaalsContact CB-O 3.28Å; N1260-K1263 WeakPolarHBondContact CB-O 3.31Å; N1260-K1263 PolarHBondContact OD1-N 2.62Å
1261	V	77	Confident	82.9	Confident	97 Å²	97	64.3 Å²	64.3	59%	0.588	34%	0.34	S	S	*	.	S	Bend	trans	-60.2	-40.7	-178.5	-177.5	0	0	0	0	112.2	H1246 W1259	H1246-V1261 PolarHBondContact ND1-O 3.17Å; W1259-V1261 HydrophobicContact CZ3-CG2 3.95Å
1262	L	71.6	Confident	81.7	Confident	148 Å²	148	65.5 Å²	65.5	78%	0.775	34%	0.343	S	S	*	.	S	Bend	trans	-108.1	-40.6	-171.3	-64.9	173.6	0	0	0	113.8	N1260	N1260-L1262 VanDerWaalsContact C-N 3.32Å; N1260-L1262 PolarHBondContact O-N 3.42Å; N1260-L1262 PolarHBondContact OD1-N 3.11Å
1263	K	81.7	Confident	81.2	Confident	177 Å²	177	62.4 Å²	62.4	77%	0.77	33%	0.328	S	S	*	.	S	Bend	trans	-139.5	79	-176.7	-71	-170	176.1	-175.3	0	110.8	N1260	N1260-K1263 VanDerWaalsContact CB-O 3.28Å; N1260-K1263 WeakPolarHBondContact CB-O 3.31Å; N1260-K1263 PolarHBondContact OD1-N 2.62Å
1264	P	82.2	Confident	80.9	Confident	24 Å²	24	62.2 Å²	62.2	16%	0.156	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-60.6	142	178.2	22.5	-31.4	0	0	0	111.3	F1245	F1245-P1264 WeakPolarHBondContact O-CB 3.33Å
1265	P	85	Confident	80.7	Confident	40 Å²	40	62.5 Å²	62.5	26%	0.26	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-64.9	149.4	174.9	29.5	-35.6	0	0	0	110.3	Q1257 L1258 A1267	Q1257-P1265 WeakPolarHBondContact O-CG 3.44Å; L1258-P1265 WeakPolarHBondContact O-CD 3.44Å; P1265-A1267 PolarHBondContact O-N 2.62Å; P1265-A1267 VanDerWaalsContact O-N 3.11Å
1266	P	87.2	Confident	80.9	Confident	81 Å²	81	58.1 Å²	58.1	53%	0.526	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-55.9	118.7	-179.2	-26.9	35.7	0	0	0	112	H1278 K1279	P1266-H1278 CarbonylContact O-C 3.47Å; P1266-H1278 WeakPolarHBondContact O-CA 3.37Å; P1266-K1279 HydrophobicContact CB-CB 3.82Å; P1266-K1279 HydrophobicContact CB-CD 4.28Å; P1266-K1279 PolarHBondContact O-N 3.33Å
1267	A	87.9	Confident	81.2	Confident	3 Å²	3	51.5 Å²	51.5	3%	0.025	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.5	-176.5	0	0	0	0	0	112.1	I1243 F1245 L1258 P1265 I1277	I1243-A1267 PolarHBondContact N-O 3.28Å; I1243-A1267 WeakPolarHBondContact O-CB 3.24Å; F1245-A1267 HydrophobicContact CD2-CB 3.84Å; F1245-A1267 HydrophobicContact CE2-CB 3.77Å; L1258-A1267 HydrophobicContact CB-CB 4.26Å; L1258-A1267 HydrophobicContact CD1-CB 4.49Å; L1258-A1267 HydrophobicContact CD2-CB 3.78Å; L1258-A1267 HydrophobicContact CG-CB 4.42Å; P1265-A1267 PolarHBondContact O-N 2.62Å; P1265-A1267 VanDerWaalsContact O-N 3.11Å; A1267-I1277 CarbonylContact C-O 3.6Å; A1267-I1277 VanDerWaalsContact CA-O 3.31Å; A1267-I1277 WeakPolarHBondContact CA-O 3.02Å
1268	L	87.8	Confident	81.4	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.6	179.4	-57	179.2	0	0	0	109	M1233 F1240 I1241 A1242 K1276 I1277 K1279 L1282	M1233-L1268 HydrophobicContact CE-CD1 3.73Å; M1233-L1268 HydrophobicContact CE-CD2 3.41Å; M1233-L1268 VanDerWaalsContact CE-CD2 3.41Å; M1233-L1268 HydrophobicContact CE-CG 4.23Å; F1240-L1268 HydrophobicContact CB-CB 4.18Å; F1240-L1268 HydrophobicContact CB-CD1 4.34Å; F1240-L1268 HydrophobicContact CD1-CB 3.81Å; F1240-L1268 HydrophobicContact CG-CB 4.23Å; F1240-L1268 HydrophobicContact CG-CD1 4.43Å; I1241-L1268 CarbonylContact O-C 3.6Å; I1241-L1268 VanDerWaalsContact O-CA 3.31Å; I1241-L1268 WeakPolarHBondContact O-CA 3.44Å; A1242-L1268 HydrophobicContact CB-CD2 4.39Å; L1268-K1276 WeakPolarHBondContact O-CA 3.47Å; L1268-I1277 HydrophobicContact CB-CG1 3.97Å; L1268-I1277 HydrophobicContact CD1-CD1 4.5Å; L1268-I1277 HydrophobicContact CD1-CG1 4.49Å; L1268-I1277 PolarHBondContact N-O 2.92Å; L1268-I1277 PolarHBondContact O-N 3.36Å; L1268-K1279 HydrophobicContact CD1-CG 4.41Å; L1268-K1279 HydrophobicContact CD2-CG 4.39Å; L1268-K1279 HydrophobicContact CG-CB 4.33Å; L1268-K1279 HydrophobicContact CG-CG 4.46Å; L1268-L1282 HydrophobicContact CD1-CB 4.05Å; L1268-L1282 HydrophobicContact CD1-CD2 4Å; L1268-L1282 HydrophobicContact CD1-CG 4.48Å
1269	E	85.6	Confident	81.6	Confident	13 Å²	13	51.5 Å²	51.5	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.5	170.8	-175.1	163.9	162.4	0	0	109.8	F1240 I1241 I1243 F1245 K1271 H1274 V1275 K1276	F1240-E1269 WeakPolarHBondContact CA-O 3.29Å; I1241-E1269 VanDerWaalsContact CG1-O 3.28Å; I1241-E1269 WeakPolarHBondContact CG1-O 3.49Å; I1241-E1269 PolarHBondContact N-O 2.99Å; I1241-E1269 PolarHBondContact O-N 3.03Å; I1243-E1269 HydrophobicContact CD1-CB 3.88Å; I1243-E1269 HydrophobicContact CG1-CB 4.36Å; F1245-E1269 WeakPolarHBondContact CE1-OE2 3.45Å; F1245-E1269 HydrophobicContact CZ-CB 4.41Å; F1245-E1269 VanDerWaalsContact CZ-OE2 3.28Å; F1245-E1269 WeakPolarHBondContact CZ-OE2 3.48Å; E1269-K1271 PolarHBondContact O-N 2.8Å; E1269-H1274 IonicContact OE1-CE1 3.28Å; E1269-H1274 IonicContact OE1-CG 3.76Å; E1269-H1274 IonicContact OE1-ND1 2.76Å; E1269-H1274 PolarHBondContact OE1-ND1 2.86Å; E1269-V1275 WeakPolarHBondContact CA-O 3.49Å; E1269-K1276 HydrophobicContact CG-CG 4.17Å; E1269-K1276 IonicContact OE1-NZ 2.8Å; E1269-K1276 PolarHBondContact OE1-NZ 3.48Å; E1269-K1276 WeakPolarHBondContact OE2-CE 3.43Å; E1269-K1276 IonicContact OE2-NZ 3.16Å; E1269-K1276 PolarHBondContact OE2-NZ 3Å
1270	C	82.5	Confident	81.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	118.1	176.4	175.8	0	0	0	0	111.1	H1238 D1239 F1240 R1272 C1273 H1274 V1275	H1238-C1270 HydrophobicContact CB-CB 4.14Å; H1238-C1270 VanDerWaalsContact CB-SG 3.52Å; H1238-C1270 PolarHBondContact ND1-SG 2.98Å; D1239-C1270 CarbonylContact O-C 3.53Å; D1239-C1270 WeakPolarHBondContact O-CA 3.34Å; F1240-C1270 HydrophobicContact CD1-CB 3.98Å; F1240-C1270 HydrophobicContact CE1-CB 3.84Å; F1240-C1270 HydrophobicContact CZ-CB 4.49Å; C1270-R1272 PolarHBondContact O-N 3.49Å; C1270-R1272 PolarHBondContact SG-N 3.47Å; C1270-R1272 VanDerWaalsContact SG-N 3.41Å; C1270-C1273 PolarHBondContact O-N 3.05Å; C1270-H1274 VanDerWaalsContact O-CA 3.3Å; C1270-H1274 WeakPolarHBondContact O-CA 3.18Å; C1270-H1274 PolarHBondContact O-N 3.21Å; C1270-V1275 PolarHBondContact N-O 2.89Å
1271	K	70.9	Confident	81.7	Confident	54 Å²	54	47.7 Å²	47.7	24%	0.235	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-19.4	174.6	-89.9	179.1	163	169.4	0	114.6	W1229 V1232 D1239 I1241 E1269 Y1296	W1229-K1271 VanDerWaalsContact CE3-NZ 3.35Å; W1229-K1271 HydrophobicContact CH2-CD 4.32Å; W1229-K1271 HydrophobicContact CZ3-CD 3.93Å; V1232-K1271 HydrophobicContact CG2-CD 4.13Å; V1232-K1271 VanDerWaalsContact CG2-NZ 3.32Å; D1239-K1271 HydrophobicContact CB-CB 4.2Å; D1239-K1271 WeakPolarHBondContact O-CB 3.41Å; D1239-K1271 PolarHBondContact O-N 3.43Å; I1241-K1271 HydrophobicContact CD1-CG 3.91Å; I1241-K1271 HydrophobicContact CG1-CG 4.11Å; I1241-K1271 HydrophobicContact CG2-CD 3.8Å; I1241-K1271 HydrophobicContact CG2-CG 3.99Å; E1269-K1271 PolarHBondContact O-N 2.8Å; K1271-Y1296 PolarHBondContact O-OH 3.29Å
1272	R	63.8	Low	81.9	Confident	35 Å²	35	44.8 Å²	44.8	13%	0.132	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-44.7	-176.1	-54.7	-177	-176.3	-158.4	-5.3	113.7	H1183 G1237 D1239 C1270 V1294 N1295 Y1296	H1183-R1272 PolarHBondContact NE2-O 3.03Å; G1237-R1272 WeakPolarHBondContact O-CD 3.34Å; G1237-R1272 PolarHBondContact O-NH1 3.08Å; D1239-R1272 HydrophobicContact CB-CG 4.38Å; D1239-R1272 VanDerWaalsContact CG-NE 3.32Å; D1239-R1272 IonicContact OD1-NE 2.68Å; D1239-R1272 IonicContact OD1-NH2 3.57Å; D1239-R1272 IonicContact OD2-CZ 3.9Å; D1239-R1272 IonicContact OD2-NE 3.7Å; D1239-R1272 PolarHBondContact OD2-NE 3.09Å; D1239-R1272 IonicContact OD2-NH2 2.89Å; D1239-R1272 PolarHBondContact OD2-NH2 3.1Å; C1270-R1272 PolarHBondContact O-N 3.49Å; C1270-R1272 PolarHBondContact SG-N 3.47Å; C1270-R1272 VanDerWaalsContact SG-N 3.41Å; R1272-V1294 HydrophobicContact CB-CB 4.22Å; R1272-V1294 HydrophobicContact CB-CG1 4.28Å; R1272-V1294 WeakPolarHBondContact CB-O 3.1Å; R1272-V1294 VanDerWaalsContact CD-O 3.27Å; R1272-V1294 WeakPolarHBondContact CD-O 3.37Å; R1272-V1294 WeakPolarHBondContact O-CG1 3.31Å; R1272-N1295 PolarHBondContact NH1-OD1 3.2Å; R1272-Y1296 HydrophobicContact CB-CE1 4.39Å
1273	C	72	Confident	82	Confident	34 Å²	34	42.9 Å²	42.9	23%	0.23	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	3	-173.9	71.5	0	0	0	0	114.9	H1238 C1270 V1275 V1294	H1238-C1273 VanDerWaalsContact CE1-SG 3.53Å; H1238-C1273 PolarHBondContact ND1-SG 3.48Å; C1270-C1273 PolarHBondContact O-N 3.05Å; C1273-V1275 PolarHBondContact O-N 3.33Å; C1273-V1275 VanDerWaalsContact O-N 3.08Å; C1273-V1275 VanDerWaalsContact SG-CG2 3.53Å; C1273-V1294 HydrophobicContact CB-CB 3.98Å; C1273-V1294 HydrophobicContact CB-CG2 3.61Å
1274	H	75	Confident	81.5	Confident	45 Å²	45	41 Å²	41	21%	0.208	21%	0.207	C	C	.	.			trans	56.2	21.9	178.4	-63	-84.5	0	0	0	115.6	R1185 E1269 C1270 K1276	R1185-H1274 PolarHBondContact NH2-CD2 2.9Å; R1185-H1274 PolarHBondContact NH2-NE2 3.47Å; R1185-H1274 VanDerWaalsContact NH2-NE2 3.17Å; E1269-H1274 IonicContact OE1-CE1 3.28Å; E1269-H1274 IonicContact OE1-CG 3.76Å; E1269-H1274 IonicContact OE1-ND1 2.76Å; E1269-H1274 PolarHBondContact OE1-ND1 2.86Å; C1270-H1274 VanDerWaalsContact O-CA 3.3Å; C1270-H1274 WeakPolarHBondContact O-CA 3.18Å; C1270-H1274 PolarHBondContact O-N 3.21Å; H1274-K1276 VanDerWaalsContact O-CG 3.27Å; H1274-K1276 WeakPolarHBondContact O-CG 3.45Å
1275	V	81.5	Confident	80.9	Confident	43 Å²	43	44.2 Å²	44.2	26%	0.261	22%	0.22	S	C	.	.			trans	-65.4	133.8	168.6	161	0	0	0	0	109.8	D1252 E1269 C1270 C1273 I1277	D1252-V1275 HydrophobicContact CB-CG1 4.29Å; D1252-V1275 VanDerWaalsContact OD2-CA 3.27Å; D1252-V1275 WeakPolarHBondContact OD2-CA 3.39Å; E1269-V1275 WeakPolarHBondContact CA-O 3.49Å; C1270-V1275 PolarHBondContact N-O 2.89Å; C1273-V1275 PolarHBondContact O-N 3.33Å; C1273-V1275 VanDerWaalsContact O-N 3.08Å; C1273-V1275 VanDerWaalsContact SG-CG2 3.53Å; V1275-I1277 HydrophobicContact CG1-CG2 3.93Å
1276	K	87.5	Confident	79.9	Confident	33 Å²	33	46 Å²	46	14%	0.143	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.7	-170.9	-48.2	-174.2	-173.8	-129.7	0	110.2	F1245 T1249 D1252 L1258 L1268 E1269 H1274	F1245-K1276 HydrophobicContact CE1-CD 3.98Å; F1245-K1276 HydrophobicContact CE2-CD 4.46Å; F1245-K1276 HydrophobicContact CZ-CB 4.47Å; F1245-K1276 HydrophobicContact CZ-CD 3.7Å; F1245-K1276 HydrophobicContact CZ-CG 4.24Å; T1249-K1276 HydrophobicContact CG2-CD 3.82Å; D1252-K1276 PolarHBondContact N-O 3.08Å; D1252-K1276 PolarHBondContact OD2-N 3.44Å; L1258-K1276 HydrophobicContact CD1-CB 3.44Å; L1258-K1276 VanDerWaalsContact CD1-CB 3.44Å; L1268-K1276 WeakPolarHBondContact O-CA 3.47Å; E1269-K1276 HydrophobicContact CG-CG 4.17Å; E1269-K1276 IonicContact OE1-NZ 2.8Å; E1269-K1276 PolarHBondContact OE1-NZ 3.48Å; E1269-K1276 WeakPolarHBondContact OE2-CE 3.43Å; E1269-K1276 IonicContact OE2-NZ 3.16Å; E1269-K1276 PolarHBondContact OE2-NZ 3Å; H1274-K1276 VanDerWaalsContact O-CG 3.27Å; H1274-K1276 WeakPolarHBondContact O-CG 3.45Å
1277	I	88.9	Confident	79	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.6	-174.1	64.8	175.3	0	0	0	111.7	F1240 I1253 L1258 A1267 L1268 V1275 H1281 L1282 V1289	F1240-I1277 HydrophobicContact CD1-CD1 4.39Å; F1240-I1277 HydrophobicContact CD1-CG1 4.5Å; F1240-I1277 HydrophobicContact CE1-CD1 3.71Å; F1240-I1277 HydrophobicContact CE1-CG1 3.96Å; F1240-I1277 HydrophobicContact CE2-CD1 4.22Å; F1240-I1277 HydrophobicContact CZ-CD1 3.61Å; F1240-I1277 HydrophobicContact CZ-CG1 4.37Å; I1253-I1277 HydrophobicContact CD1-CB 4.33Å; I1253-I1277 HydrophobicContact CD1-CG2 3.59Å; I1253-I1277 HydrophobicContact CG1-CG2 3.8Å; L1258-I1277 VanDerWaalsContact CD2-C 3.46Å; A1267-I1277 CarbonylContact C-O 3.6Å; A1267-I1277 VanDerWaalsContact CA-O 3.31Å; A1267-I1277 WeakPolarHBondContact CA-O 3.02Å; L1268-I1277 HydrophobicContact CB-CG1 3.97Å; L1268-I1277 HydrophobicContact CD1-CD1 4.5Å; L1268-I1277 HydrophobicContact CD1-CG1 4.49Å; L1268-I1277 PolarHBondContact N-O 2.92Å; L1268-I1277 PolarHBondContact O-N 3.36Å; V1275-I1277 HydrophobicContact CG1-CG2 3.93Å; I1277-H1281 HydrophobicContact CB-CB 4.31Å; I1277-H1281 HydrophobicContact CD1-CB 4.27Å; I1277-L1282 HydrophobicContact CD1-CD1 4.36Å; I1277-V1289 HydrophobicContact CD1-CG2 4.48Å
1278	H	90.3	Very high	78.4	Confident	15 Å²	15	55.7 Å²	55.7	7%	0.069	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	146.4	165.6	-63	88.8	0	0	0	110	K1256 Q1257 L1258 P1266 D1280 H1281	K1256-H1278 VanDerWaalsContact CB-CE1 3.5Å; K1256-H1278 WeakPolarHBondContact CB-CE1 3.36Å; Q1257-H1278 PolarHBondContact O-CE1 3.11Å; Q1257-H1278 PolarHBondContact O-NE2 3.03Å; L1258-H1278 HydrophobicContact CD2-CB 4.31Å; L1258-H1278 VanDerWaalsContact CD2-CE1 3.48Å; L1258-H1278 WeakPolarHBondContact CD2-CE1 3.34Å; L1258-H1278 VanDerWaalsContact CD2-N 3.32Å; P1266-H1278 CarbonylContact O-C 3.47Å; P1266-H1278 WeakPolarHBondContact O-CA 3.37Å; H1278-D1280 HydrophobicContact CB-CB 4.27Å; H1278-D1280 PolarHBondContact O-N 3.41Å; H1278-H1281 AromaticContact ND1-CD2 3.99Å; H1278-H1281 AromaticContact ND1-NE2 3.9Å; H1278-H1281 WeakPolarHBondContact O-CB 3.3Å; H1278-H1281 PolarHBondContact O-N 3.49Å
1279	K	87.5	Confident	78	Confident	82 Å²	82	55.9 Å²	55.9	36%	0.357	27%	0.266	S	S	.	.	H	α-helix	trans	-56.2	-38.3	174.4	-167.2	173.7	-176.3	-87.3	0	111.5	P1266 L1268 H1281 L1282 E1283	P1266-K1279 HydrophobicContact CB-CB 3.82Å; P1266-K1279 HydrophobicContact CB-CD 4.28Å; P1266-K1279 PolarHBondContact O-N 3.33Å; L1268-K1279 HydrophobicContact CD1-CG 4.41Å; L1268-K1279 HydrophobicContact CD2-CG 4.39Å; L1268-K1279 HydrophobicContact CG-CB 4.33Å; L1268-K1279 HydrophobicContact CG-CG 4.46Å; K1279-H1281 PolarHBondContact O-N 3.03Å; K1279-L1282 PolarHBondContact O-N 3.45Å; K1279-E1283 IonicContact NZ-OE1 2.72Å; K1279-E1283 PolarHBondContact NZ-OE1 2.89Å; K1279-E1283 PolarHBondContact O-N 3.29Å
1280	D	84.9	Confident	77.7	Confident	63 Å²	63	58.5 Å²	58.5	34%	0.337	29%	0.29	S	S	.	.	H	α-helix	trans	-47.5	-30.5	169.2	-76.7	64.1	0	0	0	114.8	H1278 E1283 K1284	H1278-D1280 HydrophobicContact CB-CB 4.27Å; H1278-D1280 PolarHBondContact O-N 3.41Å; D1280-E1283 PolarHBondContact O-N 2.99Å; D1280-K1284 HydrophobicContact CB-CD 4.41Å; D1280-K1284 WeakPolarHBondContact O-CB 3.27Å; D1280-K1284 PolarHBondContact O-N 2.91Å; D1280-K1284 IonicContact OD2-NZ 3.96Å; D1280-K1284 PolarHBondContact OD2-NZ 2.81Å
1281	H	85.7	Confident	77.5	Confident	13 Å²	13	62.9 Å²	62.9	6%	0.06	32%	0.319	C	S	.	.	H	α-helix	trans	-71.3	-33.9	179.4	-75.5	-59.6	0	0	0	112.8	C1251 I1253 C1254 I1277 H1278 K1279 H1285 D1286	C1251-H1281 VanDerWaalsContact SG-CD2 3.58Å; I1253-H1281 HydrophobicContact CD1-CB 4.04Å; I1253-H1281 VanDerWaalsContact CG2-CE1 3.46Å; I1253-H1281 WeakPolarHBondContact CG2-CE1 3.27Å; I1253-H1281 WeakPolarHBondContact CG2-ND1 3.42Å; C1254-H1281 PolarHBondContact SG-NE2 3.21Å; I1277-H1281 HydrophobicContact CB-CB 4.31Å; I1277-H1281 HydrophobicContact CD1-CB 4.27Å; H1278-H1281 AromaticContact ND1-CD2 3.99Å; H1278-H1281 AromaticContact ND1-NE2 3.9Å; H1278-H1281 WeakPolarHBondContact O-CB 3.3Å; H1278-H1281 PolarHBondContact O-N 3.49Å; K1279-H1281 PolarHBondContact O-N 3.03Å; H1281-H1285 AromaticContact ND1-CG 4Å; H1281-H1285 CarbonylContact O-C 3.42Å; H1281-H1285 WeakPolarHBondContact O-CA 3.15Å; H1281-H1285 PolarHBondContact O-N 3.47Å; H1281-H1285 VanDerWaalsContact O-N 3.12Å; H1281-D1286 PolarHBondContact O-N 2.87Å
1282	L	80.2	Confident	77.6	Confident	36 Å²	36	61.3 Å²	61.3	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-72.8	-34.3	173.6	-145.3	76.6	0	0	0	111.4	M1233 H1235 F1240 L1268 I1277 K1279	M1233-L1282 HydrophobicContact CB-CD2 4.45Å; M1233-L1282 HydrophobicContact CE-CD2 4.2Å; M1233-L1282 HydrophobicContact SD-CD2 4.17Å; H1235-L1282 HydrophobicContact CB-CD1 3.93Å; F1240-L1282 HydrophobicContact CD2-CD1 3.96Å; F1240-L1282 HydrophobicContact CE2-CD1 3.84Å; L1268-L1282 HydrophobicContact CD1-CB 4.05Å; L1268-L1282 HydrophobicContact CD1-CD2 4Å; L1268-L1282 HydrophobicContact CD1-CG 4.48Å; I1277-L1282 HydrophobicContact CD1-CD1 4.36Å; K1279-L1282 PolarHBondContact O-N 3.45Å
1283	E	73.8	Confident	77.9	Confident	108 Å²	108	71.2 Å²	71.2	51%	0.505	35%	0.352	S	S	.	.	H	α-helix	trans	-84.3	-30.8	-175.1	-65.8	175.9	179	0	0	114.3	K1279 D1280	K1279-E1283 IonicContact NZ-OE1 2.72Å; K1279-E1283 PolarHBondContact NZ-OE1 2.89Å; K1279-E1283 PolarHBondContact O-N 3.29Å; D1280-E1283 PolarHBondContact O-N 2.99Å
1284	K	71.4	Confident	77.5	Confident	137 Å²	137	70.9 Å²	70.9	60%	0.596	35%	0.349	S	S	*	.	H	α-helix	trans	-127.5	-19.4	-169.1	-58.5	166.9	-169.1	167.2	0	113.9	D1280	D1280-K1284 HydrophobicContact CB-CD 4.41Å; D1280-K1284 WeakPolarHBondContact O-CB 3.27Å; D1280-K1284 PolarHBondContact O-N 2.91Å; D1280-K1284 IonicContact OD2-NZ 3.96Å; D1280-K1284 PolarHBondContact OD2-NZ 2.81Å
1285	H	69.2	Low	77	Confident	93 Å²	93	74.9 Å²	74.9	43%	0.431	37%	0.372	S	S	.	.			trans	-131.6	34	-171	-76.9	-95.1	0	0	0	113.1	H1281 K1287 D1288	H1281-H1285 AromaticContact ND1-CG 4Å; H1281-H1285 CarbonylContact O-C 3.42Å; H1281-H1285 WeakPolarHBondContact O-CA 3.15Å; H1281-H1285 PolarHBondContact O-N 3.47Å; H1281-H1285 VanDerWaalsContact O-N 3.12Å; H1285-K1287 PolarHBondContact O-N 3.39Å; H1285-D1288 HydrophobicContact CB-CB 4.45Å; H1285-D1288 WeakPolarHBondContact CB-OD2 3.37Å; H1285-D1288 IonicContact CE1-OD2 2.66Å; H1285-D1288 IonicContact CG-OD2 2.72Å; H1285-D1288 IonicContact ND1-OD2 3.79Å; H1285-D1288 PolarHBondContact ND1-OD2 3.45Å; H1285-D1288 WeakPolarHBondContact O-CB 3.13Å; H1285-D1288 PolarHBondContact O-N 3.38Å
1286	D	63.6	Low	76.1	Confident	77 Å²	77	74 Å²	74	41%	0.412	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-38.3	-52.9	178.7	175.1	-40.9	0	0	0	111.9	H1235 K1236 H1281 D1288 V1289	H1235-D1286 IonicContact CE1-OD1 2.9Å; H1235-D1286 IonicContact CE1-OD2 3.39Å; H1235-D1286 PolarHBondContact CE1-OD2 3.14Å; K1236-D1286 WeakPolarHBondContact CE-OD1 3.3Å; K1236-D1286 PolarHBondContact NZ-O 2.86Å; K1236-D1286 IonicContact NZ-OD1 2.72Å; K1236-D1286 PolarHBondContact NZ-OD1 3.36Å; H1281-D1286 PolarHBondContact O-N 2.87Å; D1286-D1288 PolarHBondContact O-N 3.47Å; D1286-V1289 WeakPolarHBondContact O-CB 3.3Å; D1286-V1289 PolarHBondContact O-N 3.32Å
1287	K	69	Low	74.9	Confident	197 Å²	197	75.9 Å²	75.9	86%	0.857	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-55.1	-28.7	-175.6	-67.7	-176.5	179.4	177.9	0	114.3	H1285 V1289	H1285-K1287 PolarHBondContact O-N 3.39Å; K1287-V1289 VanDerWaalsContact C-N 3.35Å
1288	D	75.2	Confident	73.7	Confident	90 Å²	90	77.9 Å²	77.9	48%	0.481	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-82.7	-14.8	-178.5	-54.2	-35.8	0	0	0	112	I1253 H1285 D1286 A1290	I1253-D1288 HydrophobicContact CG2-CB 3.87Å; H1285-D1288 HydrophobicContact CB-CB 4.45Å; H1285-D1288 WeakPolarHBondContact CB-OD2 3.37Å; H1285-D1288 IonicContact CE1-OD2 2.66Å; H1285-D1288 IonicContact CG-OD2 2.72Å; H1285-D1288 IonicContact ND1-OD2 3.79Å; H1285-D1288 PolarHBondContact ND1-OD2 3.45Å; H1285-D1288 WeakPolarHBondContact O-CB 3.13Å; H1285-D1288 PolarHBondContact O-N 3.38Å; D1286-D1288 PolarHBondContact O-N 3.47Å; D1288-A1290 PolarHBondContact O-N 2.66Å
1289	V	79.9	Confident	72.2	Confident	5 Å²	5	83.4 Å²	83.4	3%	0.03	42%	0.416	C	S	.	.	S	Bend	trans	-77	106.5	174.6	-171.7	0	0	0	0	110.1	K1236 F1240 I1253 I1277 D1286 K1287	K1236-V1289 VanDerWaalsContact CD-O 3.23Å; K1236-V1289 WeakPolarHBondContact CD-O 3.25Å; K1236-V1289 PolarHBondContact NZ-O 3.04Å; F1240-V1289 HydrophobicContact CZ-CG1 4.42Å; I1253-V1289 HydrophobicContact CD1-CB 4.37Å; I1253-V1289 HydrophobicContact CD1-CG2 3.76Å; I1277-V1289 HydrophobicContact CD1-CG2 4.48Å; D1286-V1289 WeakPolarHBondContact O-CB 3.3Å; D1286-V1289 PolarHBondContact O-N 3.32Å; K1287-V1289 VanDerWaalsContact C-N 3.35Å
1290	A	77.9	Confident	71.1	Confident	68 Å²	68	82.9 Å²	82.9	56%	0.562	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-67.6	144.8	173.2	0	0	0	0	0	111.9	H1238 D1288	H1238-A1290 PolarHBondContact NE2-O 2.89Å; D1288-A1290 PolarHBondContact O-N 2.66Å
1291	P	78.7	Confident	70.3	Confident	93 Å²	93	80.9 Å²	80.9	60%	0.604	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-60.9	148.6	179.4	-23.9	34.1	0	0	0	114.2	K1236 R1293	K1236-P1291 HydrophobicContact CB-CB 4.44Å; K1236-P1291 WeakPolarHBondContact O-CA 3.19Å; P1291-R1293 PolarHBondContact O-N 3.14Å
1292	C	74.6	Confident	69.9	Low	21 Å²	21	85.7 Å²	85.7	14%	0.142	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-68.7	124.5	179.6	-159.9	0	0	0	0	111.2	K1236 G1237 H1238 V1294	K1236-C1292 PolarHBondContact O-N 3.38Å; G1237-C1292 VanDerWaalsContact O-CB 3.26Å; G1237-C1292 WeakPolarHBondContact O-CB 3.36Å; H1238-C1292 HydrophobicContact CB-CB 4.23Å; H1238-C1292 WeakPolarHBondContact ND1-CB 3.29Å; H1238-C1292 PolarHBondContact ND1-SG 3.01Å; H1238-C1292 VanDerWaalsContact ND1-SG 3.37Å; H1238-C1292 PolarHBondContact NE2-N 3.27Å; C1292-V1294 VanDerWaalsContact C-N 3.32Å; C1292-V1294 PolarHBondContact SG-O 3.02Å
1293	R	68.9	Low	69.9	Low	242 Å²	242	88 Å²	88	91%	0.913	44%	0.439	S	S	*	.	S	Bend	trans	-88.4	-0.1	175.8	-59.4	-173.4	-177.1	-166.6	1.3	113.3	P1291	P1291-R1293 PolarHBondContact O-N 3.14Å
1294	V	63.2	Low	70.5	Confident	27 Å²	27	83.6 Å²	83.6	16%	0.164	42%	0.419	C	S	.	.			trans	-114.8	104.3	179	-173.1	0	0	0	0	108.3	R1272 C1273 C1292 Y1296	R1272-V1294 HydrophobicContact CB-CB 4.22Å; R1272-V1294 HydrophobicContact CB-CG1 4.28Å; R1272-V1294 WeakPolarHBondContact CB-O 3.1Å; R1272-V1294 VanDerWaalsContact CD-O 3.27Å; R1272-V1294 WeakPolarHBondContact CD-O 3.37Å; R1272-V1294 WeakPolarHBondContact O-CG1 3.31Å; C1273-V1294 HydrophobicContact CB-CB 3.98Å; C1273-V1294 HydrophobicContact CB-CG2 3.61Å; C1292-V1294 VanDerWaalsContact C-N 3.32Å; C1292-V1294 PolarHBondContact SG-O 3.02Å; V1294-Y1296 HydrophobicContact CG1-CD1 3.49Å; V1294-Y1296 VanDerWaalsContact CG1-CD1 3.49Å; V1294-Y1296 HydrophobicContact CG1-CE1 3.64Å
1295	N	64.1	Low	71.3	Confident	130 Å²	130	77.8 Å²	77.8	70%	0.695	39%	0.394	S	S	*	.			trans	-117.2	93.1	-179.7	-170.2	32.6	0	0	0	109	R1272	R1272-N1295 PolarHBondContact NH1-OD1 3.2Å
1296	Y	64.5	Low	72.3	Confident	24 Å²	24	73.7 Å²	73.7	9%	0.094	38%	0.376	C	S	.	.			trans	-125.4	152.6	168.7	63.3	-106.8	0	0	0	109.9	Y1182 H1183 I1207 K1271 R1272 V1294 P1298 A1301	Y1182-Y1296 HydrophobicContact CD2-CD1 4.34Å; Y1182-Y1296 HydrophobicContact CD2-CG 4.11Å; Y1182-Y1296 HydrophobicContact CE2-CG 4.38Å; Y1182-Y1296 HydrophobicContact CG-CD1 4.15Å; Y1182-Y1296 HydrophobicContact CG-CG 4.2Å; H1183-Y1296 AromaticContact CE1-CE1 3.78Å; H1183-Y1296 AromaticContact NE2-CE1 3.78Å; I1207-Y1296 HydrophobicContact CG2-CD1 4.34Å; I1207-Y1296 HydrophobicContact CG2-CE1 4.04Å; K1271-Y1296 PolarHBondContact O-OH 3.29Å; R1272-Y1296 HydrophobicContact CB-CE1 4.39Å; V1294-Y1296 HydrophobicContact CG1-CD1 3.49Å; V1294-Y1296 VanDerWaalsContact CG1-CD1 3.49Å; V1294-Y1296 HydrophobicContact CG1-CE1 3.64Å; Y1296-P1298 WeakPolarHBondContact O-CD 3.28Å; Y1296-A1301 HydrophobicContact CD2-CB 3.39Å; Y1296-A1301 HydrophobicContact CE2-CB 3.87Å; Y1296-A1301 HydrophobicContact CG-CB 3.98Å
1297	D	62.3	Low	73.6	Confident	72 Å²	72	70.3 Å²	70.3	39%	0.385	36%	0.358	S	S	.	.			trans	-81.9	117.6	171.3	-179.5	-11.6	0	0	0	108.6	M1299 L1300 A1301	D1297-M1299 PolarHBondContact O-N 2.86Å; D1297-M1299 VanDerWaalsContact O-N 3.13Å; D1297-M1299 WeakPolarHBondContact OD1-CB 3.09Å; D1297-M1299 PolarHBondContact OD1-N 3.22Å; D1297-L1300 HydrophobicContact CB-CB 4.16Å; D1297-L1300 HydrophobicContact CB-CD1 4.13Å; D1297-L1300 HydrophobicContact CB-CG 4.2Å; D1297-L1300 PolarHBondContact O-N 2.81Å; D1297-A1301 WeakPolarHBondContact O-CB 3.24Å; D1297-A1301 PolarHBondContact O-N 3.38Å
1298	P	62	Low	74.6	Confident	43 Å²	43	60.9 Å²	60.9	28%	0.279	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.2	178.8	-23.1	35.2	0	0	0	114.8	W1229 Y1296	W1229-P1298 HydrophobicContact CH2-CB 3.59Å; W1229-P1298 HydrophobicContact CH2-CG 4.03Å; W1229-P1298 HydrophobicContact CZ2-CB 4Å; Y1296-P1298 WeakPolarHBondContact O-CD 3.28Å
1299	M	60.6	Low	75.2	Confident	131 Å²	131	59.6 Å²	59.6	65%	0.645	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-21	173.7	-62.1	-64.1	-161.6	0	0	113	D1297	D1297-M1299 PolarHBondContact O-N 2.86Å; D1297-M1299 VanDerWaalsContact O-N 3.13Å; D1297-M1299 WeakPolarHBondContact OD1-CB 3.09Å; D1297-M1299 PolarHBondContact OD1-N 3.22Å
1300	L	63.9	Low	75.6	Confident	70 Å²	70	61.3 Å²	61.3	37%	0.366	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-19	-177.4	-60.2	176.2	0	0	0	113.1	G1210 D1297	G1210-L1300 PolarHBondContact N-O 3.36Å; D1297-L1300 HydrophobicContact CB-CB 4.16Å; D1297-L1300 HydrophobicContact CB-CD1 4.13Å; D1297-L1300 HydrophobicContact CB-CG 4.2Å; D1297-L1300 PolarHBondContact O-N 2.81Å
1301	A	67.4	Low	76	Confident	22 Å²	22	59.5 Å²	59.5	18%	0.182	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.6	178.4	0	0	0	0	0	112.3	Y1182 I1207 Y1208 Y1296 D1297	Y1182-A1301 HydrophobicContact CD2-CB 4.1Å; Y1182-A1301 HydrophobicContact CE2-CB 3.75Å; I1207-A1301 HydrophobicContact CG2-CB 4.14Å; Y1208-A1301 CarbonylContact O-C 3.58Å; Y1208-A1301 WeakPolarHBondContact O-CA 3.27Å; Y1296-A1301 HydrophobicContact CD2-CB 3.39Å; Y1296-A1301 HydrophobicContact CE2-CB 3.87Å; Y1296-A1301 HydrophobicContact CG-CB 3.98Å; D1297-A1301 WeakPolarHBondContact O-CB 3.24Å; D1297-A1301 PolarHBondContact O-N 3.38Å
1302	R	76.7	Confident	76.3	Confident	114 Å²	114	59.7 Å²	59.7	43%	0.43	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	153.2	171.8	-65.9	-173	178.3	-164.8	4.5	110.4	I1207 Y1208 E1213	I1207-R1302 WeakPolarHBondContact CA-O 3.41Å; Y1208-R1302 HydrophobicContact CD1-CB 4.43Å; Y1208-R1302 WeakPolarHBondContact CD1-O 3.33Å; Y1208-R1302 HydrophobicContact CD2-CB 4.18Å; Y1208-R1302 HydrophobicContact CE1-CB 3.9Å; Y1208-R1302 HydrophobicContact CE2-CB 3.62Å; Y1208-R1302 HydrophobicContact CE2-CG 4.41Å; Y1208-R1302 VanDerWaalsContact CZ-CB 3.46Å; Y1208-R1302 PolarHBondContact N-O 2.84Å; Y1208-R1302 PolarHBondContact O-N 3.44Å; E1213-R1302 IonicContact OE1-CZ 3.41Å; E1213-R1302 IonicContact OE1-NH1 2.67Å; E1213-R1302 PolarHBondContact OE1-NH1 3.44Å; E1213-R1302 VanDerWaalsContact OE2-CD 3.24Å; E1213-R1302 WeakPolarHBondContact OE2-CD 3.24Å; E1213-R1302 IonicContact OE2-CZ 2.64Å; E1213-R1302 IonicContact OE2-NE 2.91Å; E1213-R1302 IonicContact OE2-NH1 3.92Å; E1213-R1302 PolarHBondContact OE2-NH1 2.84Å
1303	D	80.7	Confident	76.9	Confident	83 Å²	83	61.2 Å²	61.2	44%	0.444	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.6	179.9	-179	16.4	0	0	0	110	Q1205 I1207	Q1205-D1303 WeakPolarHBondContact CG-OD1 3.15Å; Q1205-D1303 PolarHBondContact NE2-OD1 3.09Å; Q1205-D1303 PolarHBondContact NE2-OD2 2.88Å; I1207-D1303 HydrophobicContact CG1-CB 4.43Å
1304	L	86.7	Confident	77.8	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.084	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	114.6	172.2	179.2	62.8	0	0	0	110.2	I1135 I1160 L1176 I1206 Y1208 V1306	I1135-L1304 HydrophobicContact CG2-CD1 3.76Å; I1160-L1304 HydrophobicContact CD1-CD2 4.25Å; L1176-L1304 HydrophobicContact CD1-CD2 3.62Å; I1206-L1304 HydrophobicContact CB-CB 4.49Å; I1206-L1304 PolarHBondContact N-O 3.49Å; I1206-L1304 PolarHBondContact O-N 2.88Å; Y1208-L1304 HydrophobicContact CE1-CB 3.72Å; L1304-V1306 HydrophobicContact CD2-CG2 4.12Å; L1304-V1306 HydrophobicContact CG-CG2 3.88Å
1305	L	88.8	Confident	78.9	Confident	16 Å²	16	53.5 Å²	53.5	8%	0.084	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.4	168.4	-64	168.1	0	0	0	109.6	P1136 V1187 V1192 F1194 Q1205	P1136-L1305 WeakPolarHBondContact CD-O 3.48Å; P1136-L1305 HydrophobicContact CG-CB 4.02Å; P1136-L1305 HydrophobicContact CG-CD1 4.46Å; V1187-L1305 HydrophobicContact CG2-CD2 3.76Å; V1192-L1305 HydrophobicContact CG2-CD1 3.74Å; V1192-L1305 HydrophobicContact CG2-CD2 3.59Å; V1192-L1305 HydrophobicContact CG2-CG 4.28Å; F1194-L1305 HydrophobicContact CE1-CD1 4.07Å; F1194-L1305 HydrophobicContact CZ-CD1 4.09Å; Q1205-L1305 HydrophobicContact CB-CD2 4.15Å; Q1205-L1305 HydrophobicContact CG-CD2 4.02Å
1306	V	89.4	Confident	80	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.1	179.2	-173.2	0	0	0	0	109.3	V1133 I1203 F1204 I1206 L1304	V1133-V1306 HydrophobicContact CB-CG1 3.88Å; V1133-V1306 HydrophobicContact CG1-CG1 4.19Å; V1133-V1306 HydrophobicContact CG2-CG1 4.43Å; I1203-V1306 WeakPolarHBondContact CA-O 3.4Å; I1203-V1306 WeakPolarHBondContact CG2-O 3.49Å; F1204-V1306 HydrophobicContact CD1-CB 4.37Å; F1204-V1306 HydrophobicContact CD2-CB 4.32Å; F1204-V1306 HydrophobicContact CE1-CB 3.92Å; F1204-V1306 HydrophobicContact CE1-CG1 3.89Å; F1204-V1306 HydrophobicContact CE2-CB 3.85Å; F1204-V1306 HydrophobicContact CE2-CG1 4.37Å; F1204-V1306 HydrophobicContact CE2-CG2 4.08Å; F1204-V1306 HydrophobicContact CZ-CB 3.64Å; F1204-V1306 HydrophobicContact CZ-CG1 3.68Å; F1204-V1306 HydrophobicContact CZ-CG2 4.21Å; F1204-V1306 PolarHBondContact N-O 3.18Å; F1204-V1306 PolarHBondContact O-N 3.06Å; I1206-V1306 HydrophobicContact CD1-CG2 4.36Å; L1304-V1306 HydrophobicContact CD2-CG2 4.12Å; L1304-V1306 HydrophobicContact CG-CG2 3.88Å
1307	M	90.9	Very high	81.2	Confident	5 Å²	5	49 Å²	49	3%	0.025	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	145.1	169.2	176.7	176.1	67.9	0	0	110.5	W1134 W1146 E1199 R1202 I1203	W1134-M1307 HydrophobicContact CB-CB 4.11Å; W1134-M1307 HydrophobicContact CB-CE 3.79Å; W1134-M1307 HydrophobicContact CD2-CE 4.33Å; W1134-M1307 HydrophobicContact CG-CE 3.91Å; W1134-M1307 PolarHBondContact N-O 2.93Å; W1134-M1307 PolarHBondContact O-N 2.87Å; W1146-M1307 HydrophobicContact CB-CE 4.05Å; W1146-M1307 HydrophobicContact CD2-CB 4.39Å; W1146-M1307 HydrophobicContact CD2-CE 3.62Å; W1146-M1307 HydrophobicContact CD2-SD 4.42Å; W1146-M1307 HydrophobicContact CE3-CB 4.02Å; W1146-M1307 HydrophobicContact CE3-CE 4.23Å; W1146-M1307 HydrophobicContact CG-CE 3.51Å; W1146-M1307 HydrophobicContact CH2-CB 3.77Å; W1146-M1307 HydrophobicContact CZ2-CB 4.14Å; W1146-M1307 HydrophobicContact CZ2-SD 4.27Å; W1146-M1307 HydrophobicContact CZ3-CB 3.68Å; E1199-M1307 HydrophobicContact CB-SD 4.03Å; E1199-M1307 HydrophobicContact CG-SD 3.96Å; R1202-M1307 HydrophobicContact CB-CG 4.12Å; R1202-M1307 WeakPolarHBondContact O-CA 3.44Å; I1203-M1307 HydrophobicContact CG1-CB 4.17Å; I1203-M1307 HydrophobicContact CG1-CG 4.31Å
1308	V	90.3	Very high	82.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.247	C	C	.	.			trans	-124.4	178	179.5	-69.3	0	0	0	0	112.5	V1133 R1202 F1204 D1313 C1314 W1317	V1133-V1308 HydrophobicContact CG1-CG1 4.16Å; R1202-V1308 PolarHBondContact NE-O 3.49Å; R1202-V1308 PolarHBondContact NH2-O 3.02Å; R1202-V1308 WeakPolarHBondContact O-CG2 3.26Å; R1202-V1308 PolarHBondContact O-N 3.45Å; F1204-V1308 HydrophobicContact CE1-CG1 3.91Å; V1308-D1313 HydrophobicContact CB-CB 4.11Å; V1308-D1313 HydrophobicContact CG2-CB 3.84Å; V1308-C1314 HydrophobicContact CG2-CB 3.74Å; V1308-W1317 HydrophobicContact CG1-CG 4.31Å
1309	S	87.2	Confident	83.4	Confident	62 Å²	62	46.7 Å²	46.7	43%	0.434	26%	0.255	S	S	.	.	S	Bend	trans	-61.7	-47.9	-174	23.4	0	0	0	0	113.5	R1202 D1313	R1202-S1309 PolarHBondContact NE-O 2.92Å; S1309-D1313 VanDerWaalsContact CB-OD2 3.27Å; S1309-D1313 WeakPolarHBondContact CB-OD2 3.48Å; S1309-D1313 PolarHBondContact OG-OD2 3.22Å
1310	S	88.1	Confident	84.5	Confident	41 Å²	41	42 Å²	42	29%	0.287	23%	0.23	S	C	.	.	S	Bend	trans	-131.3	167.7	-178.2	74.1	0	0	0	0	113.2	D1312 D1313 C1314	S1310-D1312 PolarHBondContact O-N 2.84Å; S1310-D1312 PolarHBondContact OG-N 2.87Å; S1310-D1313 VanDerWaalsContact CB-OD2 3.32Å; S1310-D1313 WeakPolarHBondContact CB-OD2 3.3Å; S1310-D1313 PolarHBondContact N-OD2 3.5Å; S1310-D1313 PolarHBondContact OG-N 2.75Å; S1310-D1313 PolarHBondContact OG-OD1 3.16Å; S1310-D1313 PolarHBondContact OG-OD2 2.86Å; S1310-C1314 PolarHBondContact O-N 3.28Å
1311	A	86.4	Confident	85.5	Confident	31 Å²	31	38.7 Å²	38.7	26%	0.256	21%	0.212	S	C	.	.	H	α-helix	trans	-70.4	-20.1	174.9	0	0	0	0	0	112.4	P1201 K1315	P1201-A1311 HydrophobicContact CB-CB 3.83Å; A1311-K1315 WeakPolarHBondContact O-CE 3.33Å; A1311-K1315 WeakPolarHBondContact O-CG 3.32Å; A1311-K1315 PolarHBondContact O-N 2.85Å
1312	D	86.3	Confident	86.2	Confident	96 Å²	96	43.2 Å²	43.2	51%	0.513	23%	0.225	S	C	.	.	H	α-helix	trans	-82.2	-40.3	175.8	-64.4	-63.8	0	0	0	111.2	S1310 C1314 K1315 V1316	S1310-D1312 PolarHBondContact O-N 2.84Å; S1310-D1312 PolarHBondContact OG-N 2.87Å; D1312-C1314 PolarHBondContact O-N 3.48Å; D1312-K1315 WeakPolarHBondContact O-CB 3.18Å; D1312-K1315 PolarHBondContact O-N 2.95Å; D1312-K1315 IonicContact OD1-NZ 2.62Å; D1312-K1315 PolarHBondContact OD1-NZ 3.21Å; D1312-V1316 WeakPolarHBondContact O-CG2 3.24Å; D1312-V1316 PolarHBondContact O-N 2.76Å
1313	D	85.8	Confident	86.4	Confident	54 Å²	54	43 Å²	43	29%	0.289	22%	0.224	S	C	.	.	H	α-helix	trans	-54.8	-37.9	168	-56	-42.3	0	0	0	111.1	V1308 S1309 S1310 K1315 V1316 W1317	V1308-D1313 HydrophobicContact CB-CB 4.11Å; V1308-D1313 HydrophobicContact CG2-CB 3.84Å; S1309-D1313 VanDerWaalsContact CB-OD2 3.27Å; S1309-D1313 WeakPolarHBondContact CB-OD2 3.48Å; S1309-D1313 PolarHBondContact OG-OD2 3.22Å; S1310-D1313 VanDerWaalsContact CB-OD2 3.32Å; S1310-D1313 WeakPolarHBondContact CB-OD2 3.3Å; S1310-D1313 PolarHBondContact N-OD2 3.5Å; S1310-D1313 PolarHBondContact OG-N 2.75Å; S1310-D1313 PolarHBondContact OG-OD1 3.16Å; S1310-D1313 PolarHBondContact OG-OD2 2.86Å; D1313-K1315 VanDerWaalsContact C-N 3.34Å; D1313-K1315 PolarHBondContact O-N 3.28Å; D1313-V1316 PolarHBondContact O-N 2.89Å; D1313-W1317 WeakPolarHBondContact O-CB 3.5Å; D1313-W1317 PolarHBondContact O-N 2.83Å
1314	C	88.4	Confident	86.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.9	-38.8	178	-172.6	0	0	0	0	111.8	H1186 P1201 V1308 S1310 D1312 V1318	H1186-C1314 PolarHBondContact ND1-SG 3.43Å; H1186-C1314 VanDerWaalsContact ND1-SG 3.36Å; P1201-C1314 WeakPolarHBondContact O-CB 3.42Å; V1308-C1314 HydrophobicContact CG2-CB 3.74Å; S1310-C1314 PolarHBondContact O-N 3.28Å; D1312-C1314 PolarHBondContact O-N 3.48Å; C1314-V1318 WeakPolarHBondContact O-CB 3.17Å; C1314-V1318 WeakPolarHBondContact O-CG2 3.4Å; C1314-V1318 PolarHBondContact O-N 2.81Å
1315	K	86.8	Confident	86.1	Confident	106 Å²	106	39.1 Å²	39.1	46%	0.461	20%	0.204	S	C	.	.	H	α-helix	trans	-67.3	-41.7	173.7	-61.8	162.9	-160	166.2	0	111	A1311 D1312 D1313 S1319	A1311-K1315 WeakPolarHBondContact O-CE 3.33Å; A1311-K1315 WeakPolarHBondContact O-CG 3.32Å; A1311-K1315 PolarHBondContact O-N 2.85Å; D1312-K1315 WeakPolarHBondContact O-CB 3.18Å; D1312-K1315 PolarHBondContact O-N 2.95Å; D1312-K1315 IonicContact OD1-NZ 2.62Å; D1312-K1315 PolarHBondContact OD1-NZ 3.21Å; D1313-K1315 VanDerWaalsContact C-N 3.34Å; D1313-K1315 PolarHBondContact O-N 3.28Å; K1315-S1319 WeakPolarHBondContact O-CB 3.21Å; K1315-S1319 PolarHBondContact O-N 2.74Å; K1315-S1319 PolarHBondContact O-OG 2.89Å
1316	V	86.7	Confident	85.5	Confident	53 Å²	53	43.6 Å²	43.6	32%	0.321	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-52.9	176.6	174.5	0	0	0	0	110.3	L1129 D1312 D1313 V1318 S1319 R1320	L1129-V1316 HydrophobicContact CD1-CG1 3.99Å; L1129-V1316 HydrophobicContact CD2-CG1 4.1Å; D1312-V1316 WeakPolarHBondContact O-CG2 3.24Å; D1312-V1316 PolarHBondContact O-N 2.76Å; D1313-V1316 PolarHBondContact O-N 2.89Å; V1316-V1318 PolarHBondContact O-N 2.78Å; V1316-S1319 PolarHBondContact O-N 3.02Å; V1316-R1320 VanDerWaalsContact O-CB 3.26Å; V1316-R1320 WeakPolarHBondContact O-CB 3.4Å; V1316-R1320 PolarHBondContact O-N 3.44Å
1317	W	89	Confident	84.7	Confident	7 Å²	7	46.2 Å²	46.2	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-56.8	-50.7	177.3	-90.2	94.1	0	0	0	112.7	L1129 S1131 V1133 A1151 L1153 F1204 V1308 D1313 S1319 R1320 L1321	L1129-W1317 HydrophobicContact CD2-CB 4.39Å; L1129-W1317 HydrophobicContact CD2-CD2 3.57Å; L1129-W1317 HydrophobicContact CD2-CE3 4.05Å; L1129-W1317 HydrophobicContact CD2-CG 3.73Å; L1129-W1317 HydrophobicContact CD2-CZ2 4.25Å; L1129-W1317 HydrophobicContact CG-CD2 4.3Å; L1129-W1317 HydrophobicContact CG-CZ2 4.08Å; S1131-W1317 WeakPolarHBondContact OG-CZ2 3.29Å; S1131-W1317 PolarHBondContact OG-NE1 3.34Å; V1133-W1317 HydrophobicContact CG1-CZ2 4.16Å; A1151-W1317 HydrophobicContact CB-CH2 3.87Å; A1151-W1317 HydrophobicContact CB-CZ2 4.2Å; L1153-W1317 HydrophobicContact CB-CH2 3.84Å; L1153-W1317 HydrophobicContact CB-CZ3 3.77Å; L1153-W1317 HydrophobicContact CD2-CE3 4.25Å; L1153-W1317 HydrophobicContact CD2-CZ3 4.05Å; L1153-W1317 HydrophobicContact CG-CZ3 4.48Å; F1204-W1317 HydrophobicContact CD1-CB 4.2Å; F1204-W1317 HydrophobicContact CE1-CB 3.54Å; F1204-W1317 HydrophobicContact CE1-CD2 4.25Å; F1204-W1317 AromaticContact CE1-CG 3.84Å; F1204-W1317 HydrophobicContact CE1-CG 3.84Å; F1204-W1317 HydrophobicContact CZ-CB 3.8Å; F1204-W1317 AromaticContact CZ-CD2 3.94Å; F1204-W1317 HydrophobicContact CZ-CD2 3.94Å; F1204-W1317 AromaticContact CZ-CE3 3.78Å; F1204-W1317 HydrophobicContact CZ-CE3 3.78Å; F1204-W1317 AromaticContact CZ-CG 3.98Å; F1204-W1317 HydrophobicContact CZ-CG 3.98Å; V1308-W1317 HydrophobicContact CG1-CG 4.31Å; D1313-W1317 WeakPolarHBondContact O-CB 3.5Å; D1313-W1317 PolarHBondContact O-N 2.83Å; W1317-S1319 PolarHBondContact O-N 2.85Å; W1317-R1320 PolarHBondContact O-N 3.38Å; W1317-L1321 HydrophobicContact CE3-CD1 4.03Å; W1317-L1321 HydrophobicContact CE3-CG 4.25Å; W1317-L1321 VanDerWaalsContact O-CB 3.31Å; W1317-L1321 WeakPolarHBondContact O-CB 3.38Å; W1317-L1321 VanDerWaalsContact O-CG 3.26Å; W1317-L1321 WeakPolarHBondContact O-CG 3.32Å; W1317-L1321 PolarHBondContact O-N 2.78Å
1318	V	86.6	Confident	83.7	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-64.4	-39.3	179.3	172	0	0	0	0	111.8	V1184 F1204 C1314 V1316 R1322	V1184-V1318 HydrophobicContact CG1-CG2 4.37Å; F1204-V1318 HydrophobicContact CB-CG2 3.36Å; F1204-V1318 HydrophobicContact CD1-CG2 4.33Å; F1204-V1318 HydrophobicContact CD2-CG2 4.32Å; F1204-V1318 HydrophobicContact CG-CG2 3.8Å; C1314-V1318 WeakPolarHBondContact O-CB 3.17Å; C1314-V1318 WeakPolarHBondContact O-CG2 3.4Å; C1314-V1318 PolarHBondContact O-N 2.81Å; V1316-V1318 PolarHBondContact O-N 2.78Å; V1318-R1322 WeakPolarHBondContact O-CB 3.19Å; V1318-R1322 VanDerWaalsContact O-CG 3.25Å; V1318-R1322 WeakPolarHBondContact O-CG 3.19Å; V1318-R1322 PolarHBondContact O-N 3.49Å
1319	S	84	Confident	82.7	Confident	63 Å²	63	52 Å²	52	44%	0.441	26%	0.261	S	S	.	.	H	α-helix	trans	-68.4	-42.1	178.1	-58.3	0	0	0	0	111.9	K1315 V1316 W1317 R1323	K1315-S1319 WeakPolarHBondContact O-CB 3.21Å; K1315-S1319 PolarHBondContact O-N 2.74Å; K1315-S1319 PolarHBondContact O-OG 2.89Å; V1316-S1319 PolarHBondContact O-N 3.02Å; W1317-S1319 PolarHBondContact O-N 2.85Å; S1319-R1323 WeakPolarHBondContact O-CB 3.44Å; S1319-R1323 PolarHBondContact O-N 3.48Å
1320	R	83.5	Confident	81.5	Confident	33 Å²	33	55.1 Å²	55.1	13%	0.125	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-47.6	177.9	-169.7	73.3	-160.5	-170.5	1.4	111.2	E1126 L1129 L1153 V1316 W1317 R1322 R1323 C1324	E1126-R1320 PolarHBondContact O-NH1 2.66Å; E1126-R1320 PolarHBondContact O-NH2 2.69Å; E1126-R1320 VanDerWaalsContact O-NH2 3.17Å; L1129-R1320 HydrophobicContact CD2-CB 4.11Å; L1129-R1320 HydrophobicContact CD2-CG 4.28Å; L1153-R1320 HydrophobicContact CD2-CB 4.11Å; L1153-R1320 HydrophobicContact CD2-CG 3.57Å; V1316-R1320 VanDerWaalsContact O-CB 3.26Å; V1316-R1320 WeakPolarHBondContact O-CB 3.4Å; V1316-R1320 PolarHBondContact O-N 3.44Å; W1317-R1320 PolarHBondContact O-N 3.38Å; R1320-R1322 PolarHBondContact O-N 2.69Å; R1320-R1323 WeakPolarHBondContact O-CB 2.97Å; R1320-R1323 PolarHBondContact O-N 2.86Å; R1320-C1324 PolarHBondContact O-N 2.92Å; R1320-C1324 PolarHBondContact O-SG 3.02Å
1321	L	85.7	Confident	79.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-40.5	177.9	-73.4	175.1	0	0	0	112.7	L1153 I1158 F1181 V1184 F1204 I1206 W1317 C1324 L1325	L1153-L1321 HydrophobicContact CD1-CD2 3.62Å; L1153-L1321 HydrophobicContact CD2-CD2 3.65Å; L1153-L1321 HydrophobicContact CD2-CG 4.05Å; L1153-L1321 HydrophobicContact CG-CD2 4.29Å; I1158-L1321 HydrophobicContact CD1-CD2 3.66Å; I1158-L1321 HydrophobicContact CG1-CD2 4.35Å; F1181-L1321 HydrophobicContact CE2-CD2 4.28Å; V1184-L1321 HydrophobicContact CB-CB 4.44Å; V1184-L1321 HydrophobicContact CG1-CB 4.09Å; V1184-L1321 HydrophobicContact CG1-CD1 3.95Å; V1184-L1321 HydrophobicContact CG2-CB 4.19Å; V1184-L1321 HydrophobicContact CG2-CD1 4.45Å; F1204-L1321 HydrophobicContact CD2-CD1 4.21Å; F1204-L1321 HydrophobicContact CE2-CD1 3.51Å; F1204-L1321 HydrophobicContact CZ-CD1 4.14Å; I1206-L1321 HydrophobicContact CD1-CD1 4.19Å; I1206-L1321 HydrophobicContact CG1-CD1 4.42Å; W1317-L1321 HydrophobicContact CE3-CD1 4.03Å; W1317-L1321 HydrophobicContact CE3-CG 4.25Å; W1317-L1321 VanDerWaalsContact O-CB 3.31Å; W1317-L1321 WeakPolarHBondContact O-CB 3.38Å; W1317-L1321 VanDerWaalsContact O-CG 3.26Å; W1317-L1321 WeakPolarHBondContact O-CG 3.32Å; W1317-L1321 PolarHBondContact O-N 2.78Å; L1321-C1324 PolarHBondContact O-N 3.41Å; L1321-L1325 VanDerWaalsContact O-CB 3.31Å; L1321-L1325 WeakPolarHBondContact O-CB 3.39Å; L1321-L1325 PolarHBondContact O-N 2.88Å
1322	R	83	Confident	78	Confident	117 Å²	117	57.9 Å²	57.9	44%	0.442	28%	0.281	S	S	.	.	H	α-helix	trans	-62.8	-43.3	173.2	-76.1	175.7	174.4	-158.6	-4.5	111.8	V1184 V1318 R1320 L1325 E1326	V1184-R1322 PolarHBondContact O-NE 3.32Å; V1184-R1322 PolarHBondContact O-NH2 2.97Å; V1318-R1322 WeakPolarHBondContact O-CB 3.19Å; V1318-R1322 VanDerWaalsContact O-CG 3.25Å; V1318-R1322 WeakPolarHBondContact O-CG 3.19Å; V1318-R1322 PolarHBondContact O-N 3.49Å; R1320-R1322 PolarHBondContact O-N 2.69Å; R1322-L1325 PolarHBondContact O-N 2.9Å; R1322-E1326 WeakPolarHBondContact O-CB 3.47Å; R1322-E1326 WeakPolarHBondContact O-CG 3.43Å; R1322-E1326 PolarHBondContact O-N 2.99Å
1323	R	80.9	Confident	76.1	Confident	109 Å²	109	59.4 Å²	59.4	41%	0.411	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-43	176.3	-167.3	-177	-63.5	157.3	-0.6	112	S1319 R1320 N1327	S1319-R1323 WeakPolarHBondContact O-CB 3.44Å; S1319-R1323 PolarHBondContact O-N 3.48Å; R1320-R1323 WeakPolarHBondContact O-CB 2.97Å; R1320-R1323 PolarHBondContact O-N 2.86Å; R1323-N1327 WeakPolarHBondContact O-CB 3.19Å; R1323-N1327 PolarHBondContact O-N 3.06Å; R1323-N1327 PolarHBondContact O-ND2 3.4Å; R1323-N1327 PolarHBondContact O-OD1 3.2Å
1324	C	80.9	Confident	74	Confident	6 Å²	6	60.3 Å²	60.3	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-47.6	173.9	-64	0	0	0	0	111.3	V1178 R1320 L1321 E1326 N1327 C1328	V1178-C1324 HydrophobicContact CG1-CB 3.93Å; R1320-C1324 PolarHBondContact O-N 2.92Å; R1320-C1324 PolarHBondContact O-SG 3.02Å; L1321-C1324 PolarHBondContact O-N 3.41Å; C1324-E1326 PolarHBondContact O-N 2.96Å; C1324-N1327 PolarHBondContact O-N 2.93Å; C1324-N1327 VanDerWaalsContact O-N 3.09Å; C1324-C1328 PolarHBondContact O-N 3.01Å; C1324-C1328 PolarHBondContact O-SG 3.25Å
1325	L	79.6	Confident	71.8	Confident	13 Å²	13	68.9 Å²	68.9	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-42.5	178.1	179.6	56.2	0	0	0	113.2	V1178 F1181 L1321 R1322 N1327 R1329	V1178-L1325 HydrophobicContact CG1-CB 4.18Å; V1178-L1325 WeakPolarHBondContact O-CD1 3.39Å; F1181-L1325 HydrophobicContact CB-CD1 4.11Å; F1181-L1325 HydrophobicContact CB-CD2 4.26Å; F1181-L1325 WeakPolarHBondContact O-CD1 3.33Å; L1321-L1325 VanDerWaalsContact O-CB 3.31Å; L1321-L1325 WeakPolarHBondContact O-CB 3.39Å; L1321-L1325 PolarHBondContact O-N 2.88Å; R1322-L1325 PolarHBondContact O-N 2.9Å; L1325-N1327 VanDerWaalsContact C-N 3.31Å; L1325-N1327 PolarHBondContact O-N 2.73Å; L1325-R1329 HydrophobicContact CD1-CG 4.4Å; L1325-R1329 WeakPolarHBondContact O-CG 3.25Å; L1325-R1329 PolarHBondContact O-N 3.4Å; L1325-R1329 VanDerWaalsContact O-N 3.13Å
1326	E	76.1	Confident	69.4	Low	110 Å²	110	69.7 Å²	69.7	51%	0.514	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-36.6	173.7	-76.8	177	-153.1	0	0	112.3	R1322 C1324 K1330	R1322-E1326 WeakPolarHBondContact O-CB 3.47Å; R1322-E1326 WeakPolarHBondContact O-CG 3.43Å; R1322-E1326 PolarHBondContact O-N 2.99Å; C1324-E1326 PolarHBondContact O-N 2.96Å; E1326-K1330 VanDerWaalsContact O-CD 3.31Å; E1326-K1330 WeakPolarHBondContact O-CD 3.45Å; E1326-K1330 WeakPolarHBondContact O-CE 3.36Å; E1326-K1330 WeakPolarHBondContact O-CG 3.49Å; E1326-K1330 PolarHBondContact O-N 2.92Å; E1326-K1330 IonicContact OE2-NZ 3.45Å
1327	N	73	Confident	66.9	Low	62 Å²	62	71.4 Å²	71.4	33%	0.332	37%	0.37	S	S	.	.	H	α-helix	trans	-73.1	-43.9	178.5	-71.4	-6.7	0	0	0	112	R1323 C1324 L1325 R1329 K1330 T1331	R1323-N1327 WeakPolarHBondContact O-CB 3.19Å; R1323-N1327 PolarHBondContact O-N 3.06Å; R1323-N1327 PolarHBondContact O-ND2 3.4Å; R1323-N1327 PolarHBondContact O-OD1 3.2Å; C1324-N1327 PolarHBondContact O-N 2.93Å; C1324-N1327 VanDerWaalsContact O-N 3.09Å; L1325-N1327 VanDerWaalsContact C-N 3.31Å; L1325-N1327 PolarHBondContact O-N 2.73Å; N1327-R1329 VanDerWaalsContact C-N 3.32Å; N1327-R1329 PolarHBondContact O-N 3.29Å; N1327-K1330 WeakPolarHBondContact O-CB 3.13Å; N1327-K1330 PolarHBondContact O-N 3.15Å; N1327-K1330 VanDerWaalsContact O-N 3.14Å; N1327-K1330 PolarHBondContact OD1-NZ 3.47Å; N1327-T1331 PolarHBondContact O-N 3.2Å; N1327-T1331 PolarHBondContact O-OG1 3.35Å
1328	C	69.3	Low	64.1	Low	8 Å²	8	82.3 Å²	82.3	5%	0.054	41%	0.411	C	S	.	.	H	α-helix	trans	-56.5	-44.8	174.6	-69.1	0	0	0	0	111.9	E1179 C1324 K1330 T1331 S1332	E1179-C1328 HydrophobicContact CB-CB 4.38Å; E1179-C1328 HydrophobicContact CG-CB 3.88Å; C1324-C1328 PolarHBondContact O-N 3.01Å; C1324-C1328 PolarHBondContact O-SG 3.25Å; C1328-K1330 PolarHBondContact O-N 3.48Å; C1328-T1331 WeakPolarHBondContact CA-OG1 3.04Å; C1328-T1331 PolarHBondContact O-N 2.96Å; C1328-T1331 VanDerWaalsContact O-N 3.14Å; C1328-T1331 PolarHBondContact O-OG1 3.32Å; C1328-S1332 PolarHBondContact O-N 2.74Å; C1328-S1332 VanDerWaalsContact O-N 3.08Å; C1328-S1332 PolarHBondContact O-OG 3.32Å
1329	R	68.8	Low	61.6	Low	119 Å²	119	88.3 Å²	88.3	45%	0.449	45%	0.453	S	S	.	.	H	α-helix	trans	-65	-35.6	177	-69.7	176.3	-176.5	-173.5	4.1	112.8	F1181 Y1182 L1325 N1327 T1331 S1332	F1181-R1329 PolarHBondContact O-NH2 2.98Å; Y1182-R1329 PolarHBondContact O-NH2 3.04Å; L1325-R1329 HydrophobicContact CD1-CG 4.4Å; L1325-R1329 WeakPolarHBondContact O-CG 3.25Å; L1325-R1329 PolarHBondContact O-N 3.4Å; L1325-R1329 VanDerWaalsContact O-N 3.13Å; N1327-R1329 VanDerWaalsContact C-N 3.32Å; N1327-R1329 PolarHBondContact O-N 3.29Å; R1329-T1331 VanDerWaalsContact C-N 3.33Å; R1329-S1332 PolarHBondContact O-OG 2.71Å
1330	K	61.9	Low	59	Low	127 Å²	127	91.2 Å²	91.2	55%	0.552	47%	0.473	S	S	*	.	H	α-helix	trans	-66.2	-33.3	172.5	-68.1	160.6	-159.3	163.1	0	112.1	E1326 N1327 C1328	E1326-K1330 VanDerWaalsContact O-CD 3.31Å; E1326-K1330 WeakPolarHBondContact O-CD 3.45Å; E1326-K1330 WeakPolarHBondContact O-CE 3.36Å; E1326-K1330 WeakPolarHBondContact O-CG 3.49Å; E1326-K1330 PolarHBondContact O-N 2.92Å; E1326-K1330 IonicContact OE2-NZ 3.45Å; N1327-K1330 WeakPolarHBondContact O-CB 3.13Å; N1327-K1330 PolarHBondContact O-N 3.15Å; N1327-K1330 VanDerWaalsContact O-N 3.14Å; N1327-K1330 PolarHBondContact OD1-NZ 3.47Å; C1328-K1330 PolarHBondContact O-N 3.48Å
1331	T	55.7	Low	56.4	Low	70 Å²	70	93.1 Å²	93.1	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-80.7	-23	179.5	47	0	0	0	0	114.8	N1327 C1328 R1329	N1327-T1331 PolarHBondContact O-N 3.2Å; N1327-T1331 PolarHBondContact O-OG1 3.35Å; C1328-T1331 WeakPolarHBondContact CA-OG1 3.04Å; C1328-T1331 PolarHBondContact O-N 2.96Å; C1328-T1331 VanDerWaalsContact O-N 3.14Å; C1328-T1331 PolarHBondContact O-OG1 3.32Å; R1329-T1331 VanDerWaalsContact C-N 3.33Å
1332	S	46.8	Very low	53.8	Low	59 Å²	59	98.5 Å²	98.5	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-74.3	-42.8	177.5	51.4	0	0	0	0	112.8	C1328 R1329 A1334 K1335	C1328-S1332 PolarHBondContact O-N 2.74Å; C1328-S1332 VanDerWaalsContact O-N 3.08Å; C1328-S1332 PolarHBondContact O-OG 3.32Å; R1329-S1332 PolarHBondContact O-OG 2.71Å; S1332-A1334 VanDerWaalsContact C-N 3.26Å; S1332-A1334 PolarHBondContact O-N 2.95Å; S1332-K1335 PolarHBondContact O-N 3.3Å
1333	D	44.8	Very low	51.2	Low	128 Å²	128	97.4 Å²	97.4	68%	0.684	55%	0.551	S	S	*	*	H	α-helix	trans	-64.7	-30.6	-178.1	-72.9	-20.7	0	0	0	112.4	K1335 T1336	D1333-K1335 PolarHBondContact O-N 3.23Å; D1333-T1336 PolarHBondContact O-OG1 2.76Å
1334	A	43.2	Very low	48.7	Very low	73 Å²	73	97.1 Å²	97.1	60%	0.603	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-72.7	-20.7	-177.4	0	0	0	0	0	115	S1332	S1332-A1334 VanDerWaalsContact C-N 3.26Å; S1332-A1334 PolarHBondContact O-N 2.95Å
1335	K	41.1	Very low	46.3	Very low	181 Å²	181	105 Å²	105	79%	0.787	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-86.2	-2.1	-172.3	-76.2	-176.8	175.7	178.7	0	115.2	S1332 D1333 S1337	S1332-K1335 PolarHBondContact O-N 3.3Å; D1333-K1335 PolarHBondContact O-N 3.23Å; K1335-S1337 PolarHBondContact O-N 2.74Å
1336	T	36.6	Very low	44.2	Very low	122 Å²	122	112.8 Å²	112.8	75%	0.748	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-90.1	7	-169.4	55.3	0	0	0	0	115.5	D1333	D1333-T1336 PolarHBondContact O-OG1 2.76Å
1337	S	33.6	Very low	42.1	Very low	90 Å²	90	114 Å²	114	63%	0.629	65%	0.645	S	S	*	*	S	Bend	trans	-140.2	40.3	-163.9	61.8	0	0	0	0	117.7	K1335	K1335-S1337 PolarHBondContact O-N 2.74Å
1338	R	31.3	Very low	40	Very low	236 Å²	236	116.6 Å²	116.6	89%	0.891	67%	0.668	S	S	*	*	S	Bend	trans	-161.1	140.2	160.8	-107.9	145.6	-167.4	-162.2	4	115.9
1339	S	33.2	Very low	38	Very low	128 Å²	128	124.8 Å²	124.8	90%	0.895	71%	0.71	S	S	*	*			trans	61.1	147.5	162.6	46.1	0	0	0	0	119.6
1340	S	29.8	Very low	36.1	Very low	124 Å²	124	129.3 Å²	129.3	87%	0.867	73%	0.727	S	S	*	*			trans	-140.6	145.9	-173.1	53.5	0	0	0	0	110.8
1341	G	29.5	Very low	34.6	Very low	74 Å²	74	131.5 Å²	131.5	76%	0.763	74%	0.744	S	S	*	*			trans	177.4	116.8	174.2	0	0	0	0	0	116.1
1342	S	29.9	Very low	33.4	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	76%	0.761	S	S	*	*			trans	63.8	131.4	159.3	-154.2	0	0	0	0	122
1343	S	28.1	Very low	32.5	Very low	93 Å²	93	142.1 Å²	142.1	65%	0.65	79%	0.785	S	S	*	*			trans	47	134.5	146.3	53.3	0	0	0	0	121.6
1344	S	30.1	Very low	31.8	Very low	103 Å²	103	144.9 Å²	144.9	72%	0.72	79%	0.791	S	S	*	*			cis	-172.1	147.5	-7.3	50.5	0	0	0	0	111.2
1345	H	30.4	Very low	31.1	Very low	173 Å²	173	147 Å²	147	80%	0.801	80%	0.798	S	S	*	*			trans	27.7	129.8	154.5	-66.6	-74.3	0	0	0	120.5
1346	K	34	Very low	30.6	Very low	176 Å²	176	149.7 Å²	149.7	77%	0.765	81%	0.805	S	S	*	*			cis	-151.7	151.2	33.6	-71.2	-173.6	-178.9	177.4	0	114.6
1347	D	32	Very low	30.3	Very low	136 Å²	136	150.1 Å²	150.1	73%	0.727	81%	0.807	S	S	*	*			trans	33.8	110.4	137.5	-37.3	-29.5	0	0	0	118.5
1348	S	29	Very low	30.2	Very low	115 Å²	115	150.5 Å²	150.5	80%	0.804	82%	0.816	S	S	*	*			cis	83.1	100.4	16.4	-157.2	0	0	0	0	118.1
1349	L	27.1	Very low	30.2	Very low	180 Å²	180	145.8 Å²	145.8	94%	0.942	81%	0.808	S	S	*	*			trans	-145.2	77.4	161.9	-92.5	-179.8	0	0	0	112.1
1350	R	30	Very low	30.1	Very low	214 Å²	214	150.3 Å²	150.3	81%	0.808	81%	0.806	S	S	*	*			trans	-158.3	124.7	153.6	-114.3	172.6	-175.7	-173.2	-0.2	110.4
1351	L	31.3	Very low	30.1	Very low	174 Å²	174	149.2 Å²	149.2	91%	0.911	80%	0.798	S	S	*	*			trans	-81.1	142.2	-177.7	-77.8	152.2	0	0	0	111.5
1352	P	28.8	Very low	30.2	Very low	120 Å²	120	150 Å²	150	78%	0.779	80%	0.798	S	S	*	*			trans	-85.3	146.1	176.7	34	-34	0	0	0	112
1353	Y	29	Very low	30.4	Very low	232 Å²	232	150.8 Å²	150.8	91%	0.91	80%	0.798	S	S	*	*			trans	-127	136.5	166.2	-144	-95.6	0	0	0	110.5
1354	K	29.1	Very low	30.7	Very low	186 Å²	186	150.9 Å²	150.9	81%	0.809	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-84.5	140.1	-169.7	-64.8	178.4	179.4	177.5	0	112.1
1355	P	29.8	Very low	31.1	Very low	118 Å²	118	151.2 Å²	151.2	77%	0.766	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.8	142.1	164.7	32	-33.2	0	0	0	110.9
1356	Y	30.9	Very low	31.1	Very low	237 Å²	237	148.4 Å²	148.4	93%	0.929	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-86	134.9	173.6	-118.5	-94.7	0	0	0	110.8
1357	T	28.5	Very low	30.9	Very low	130 Å²	130	145 Å²	145	80%	0.798	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-102.1	126.8	-176.6	53	0	0	0	0	112.8
1358	A	32.5	Very low	30.9	Very low	98 Å²	98	147.4 Å²	147.4	81%	0.81	80%	0.801	S	S	*	*			trans	-153.2	91.9	166.2	0	0	0	0	0	113.7
1359	N	31	Very low	31.1	Very low	137 Å²	137	151.6 Å²	151.6	73%	0.733	80%	0.804	S	S	*	*			trans	29.2	125	144.6	-77.7	-36.6	0	0	0	123.2
1360	R	30.6	Very low	31.4	Very low	223 Å²	223	146.2 Å²	146.2	84%	0.842	79%	0.793	S	S	*	*				58.8	144.1	117.6	-61	179.1	-177.9	-147.8	-3.8	120.3
1361	S	30.9	Very low	31.5	Very low	101 Å²	101	141.3 Å²	141.3	71%	0.706	79%	0.791	S	S	*	*			cis	-169.5	144.7	-8	-95.9	0	0	0	0	111.6
1362	A	32	Very low	31.6	Very low	92 Å²	92	138.6 Å²	138.6	76%	0.76	79%	0.787	S	S	*	*			trans	61.4	170.6	155.4	0	0	0	0	0	117.5
1363	T	33.7	Very low	31.9	Very low	129 Å²	129	137.5 Å²	137.5	79%	0.791	79%	0.788	S	S	*	*			cis	-151	129.8	8.6	-40	0	0	0	0	112.9
1364	A	33.1	Very low	32.1	Very low	95 Å²	95	132.2 Å²	132.2	79%	0.785	78%	0.783	S	S	*	*			trans	49	166.6	145.7	0	0	0	0	0	124
1365	P	40.4	Very low	32.6	Very low	110 Å²	110	128.4 Å²	128.4	71%	0.714	78%	0.778	S	S	*	*			trans	-132.9	175.1	-163.3	44.1	-28.3	0	0	0	117.6
1366	C	28.7	Very low	32.9	Very low	113 Å²	113	130.4 Å²	130.4	76%	0.764	78%	0.781	S	S	*	*			trans	-154.7	123.8	147.8	-96.3	0	0	0	0	108.7
1367	T	31	Very low	33.4	Very low	106 Å²	106	124.1 Å²	124.1	65%	0.65	77%	0.77	S	S	*	*				73.3	141.5	58.2	78.6	0	0	0	0	115.9
1368	K	32.5	Very low	33.9	Very low	186 Å²	186	123.6 Å²	123.6	81%	0.809	77%	0.766	S	S	*	*			trans	93.3	142.5	170.7	-60.2	169.4	-172.1	168.8	0	117.1
1369	K	32.5	Very low	34.3	Very low	202 Å²	202	124.7 Å²	124.7	88%	0.878	76%	0.763	S	S	*	*			cis	-168.3	144.1	-27	-126.3	-178	-176.5	-171.7	0	110.4
1370	G	32.5	Very low	34.7	Very low	68 Å²	68	122.8 Å²	122.8	70%	0.701	77%	0.766	S	S	*	*			trans	79.5	161.6	153.7	0	0	0	0	0	118.2
1371	S	32.7	Very low	35.1	Very low	110 Å²	110	117.2 Å²	117.2	77%	0.769	76%	0.761	S	S	*	*			cis	-177.3	150.2	-18.3	35.1	0	0	0	0	112.5
1372	S	33.6	Very low	35.6	Very low	117 Å²	117	120.8 Å²	120.8	82%	0.818	77%	0.766	S	S	*	*			trans	73.9	159	149.6	69	0	0	0	0	121.2
1373	A	34.9	Very low	35.7	Very low	97 Å²	97	130.9 Å²	130.9	80%	0.802	79%	0.787	S	S	*	*			trans	83.1	82	167	0	0	0	0	0	119.7
1374	C	33	Very low	35.8	Very low	121 Å²	121	131 Å²	131	82%	0.818	79%	0.786	S	S	*	*			trans	-71.7	-168.3	141.3	-48	0	0	0	0	109.2
1375	P	40	Very low	36	Very low	106 Å²	106	132.8 Å²	132.8	69%	0.688	79%	0.787	S	S	*	*			cis	-148.9	163.2	7.2	38.4	-15.7	0	0	0	120.4
1376	L	36	Very low	35.7	Very low	160 Å²	160	134.1 Å²	134.1	84%	0.838	79%	0.791	S	S	*	*			trans	69.2	-179	144.6	-65.3	166.4	0	0	0	117.2
1377	P	42.5	Very low	36.2	Very low	106 Å²	106	135.4 Å²	135.4	69%	0.688	79%	0.792	S	S	*	*				-138.1	-160.3	-101.1	39.2	-15.4	0	0	0	114.2
1378	V	39	Very low	36.5	Very low	119 Å²	119	137.2 Å²	137.2	72%	0.721	80%	0.801	S	S	*	*			trans	152.7	112	135.1	161.9	0	0	0	0	115.1
1379	T	40	Very low	36.7	Very low	121 Å²	121	133.9 Å²	133.9	74%	0.742	80%	0.801	S	S	*	*			trans	46.9	132.2	147.8	66.7	0	0	0	0	125.6
1380	A	39.2	Very low	37	Very low	96 Å²	96	129.1 Å²	129.1	79%	0.793	80%	0.795	S	S	*	*			trans	65.1	146.8	131.3	0	0	0	0	0	119.7
1381	S	39.2	Very low	37.4	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	80%	0.802	S	S	*	*			cis	-160.7	170.1	33.3	49.6	0	0	0	0	113.6
1382	H	40.3	Very low	37.8	Very low	175 Å²	175	135.8 Å²	135.8	81%	0.81	81%	0.805	S	S	*	*			trans	1.3	122.6	168.7	-66	-79.5	0	0	0	120.7
1383	Y	35.7	Very low	38.2	Very low	304 Å²	304	137.5 Å²	137.5	100%	1.192	80%	0.804	S	S	*	*				-143.6	0	100.1	-115.8	-79.9	0	0	0	110.6

Retrieved 1,383 of 1,383 residues in 815.1 ms (Link to these results)

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