A0A3Q0KGP9_SCHMA Loading...

Double-stranded nucleic acid 5'-3' helicase Upf1 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KGP9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,325 aa.

						>A0A3Q0KGP9_SCHMA|A0A3Q0KGP9
MGHMGSFDAYGPNSQALTFFDPEENDLIGGDTQGPDYDCSDFTLPSQSQTQASQLDPDKNCFSQQHDGTNTIDVLSHRVADLDFKDEDQDDSSVDLPEHACAYCGIHDPACVVFCNTTKKWFCNGRGNTSGSHIINHLVRARAKEVTLHKDGPLKDTLLECYVCGSKNVFLLGFVPAKSESVVVLLCRNICANANKDMYWDPAQWQPIIQGRQFLAWLVKVPSDEQQAKARQISAQQINRLEEIWKENPQAAVEDLEKPGADNEVNPVLLRYENSQQYRDVFIPLVELEADYDKKIKESLKLENVSVRWETALNKRRVAYFRIPGANEGPELRIMHGDELIIRQFNSPNDYLVGDGHVIKVPDNFSDEVGLEMKQVIDTPLEPVTYKIEFKWKSTPFDRMRRAISVVTDEQHGLLPPYIFYRLLGQELDDMVLKCNLPKRYSAPDLPELNHSQVFAVKTVLQRPLSLIQGPPGTGKTVTSASIVYHLNQIHQKKVLVVAPSNTAVDQLCEKIDRTGLKVVRLCARSREALASPVSRLMLHIQAQNVKGHTELRKLQQLKDETGELSQDDDKRYRVLKRELERELLMAADVVCCTCVTAGDARLERLSFHSVLIDESTQATEPECLIPLMVGCRQVVLVGDHCQLGPVITCKKAASAGLTQSLFERFVLLGIRPIRLQVQYRMHPALSAFPSNVFYEGSLQNGVTAEDRCKKIDFPWPNPDRPMFFYCTSGQEEISGNGVSYLNRTEAATVEKIVTKMLKIGVHPNTIGVITPYEGQRAYLAHYLHYSGSLNAKLYQEIEIASVDAFQGREKDYIILSCVRANENQGIGFLNDPRRLNVALTRARYGLIVVGNPKALCKQPLWNQLLHFYRDQHLLVEGPLNNLGEYMLQFPRPKVPYTFKPGGHYLAQLSANPVLLNSSQLNGQLSTHPGNQFNYLSHVSNSSQPCFDNPNGPTALVAAMAAAAAAAYFGGSGSNTRPNVSTLGLHGSSALNQPGASHAAAYAVAAAAAAQHQSSQPYSSQTNGSSHSMHQLLNQSLFDQVGYIGPNRQYAEANASSNLPMPLSMLMPAGRISNPTNVGNPFGSSGHFGNGKYGTNLGAAAPLGRSIQALGPLNVHPNYSQLNTGSTRAPGGPLPGNSVPGSAAPRYLGNARRNLQASSQNVSVGAAKSRQIDGPSSLTNVSVERGNPNTSNSGAGLLSQPGLSEFSGTQGTSGLSGIGVFSSQSRNSGLSGLSQESTSLDFRLGQGASQMDNLLLSQDSTFQGATVPASKVNSQRGSNLFATRSEDHTNINFDSGLVNGTDLENIGVSQNAVSCASSGAPLSQF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.7	Very low	27.8	Very low	251 Å²	251	146.8 Å²	146.8	100%	1.236	84%	0.838	S	S	*	*				0	143.3	0	-71.2	177.4	173.1	0	0	107.5
2	G	32.4	Very low	27.7	Very low	70 Å²	70	144.7 Å²	144.7	72%	0.722	83%	0.833	S	S	*	*			trans	85	142.6	172.9	0	0	0	0	0	115.9
3	H	30.1	Very low	27.5	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.866	83%	0.831	S	S	*	*			trans	48.5	78.4	160.8	-60.1	-78.6	0	0	0	119.7
4	M	32.6	Very low	27.4	Very low	202 Å²	202	141.7 Å²	141.7	100%	0.995	82%	0.821	S	S	*	*				-117.2	95	126.8	-85.2	-174.5	163.9	0	0	107.6
5	G	24.4	Very low	27.3	Very low	76 Å²	76	138.9 Å²	138.9	78%	0.784	80%	0.797	S	S	*	*			trans	-120.3	82.3	-175	0	0	0	0	0	111.6
6	S	30.1	Very low	27.3	Very low	110 Å²	110	132.5 Å²	132.5	77%	0.769	77%	0.766	S	S	*	*			trans	-164.6	100.8	161.2	-172.4	0	0	0	0	108
7	F	25.7	Very low	27.5	Very low	191 Å²	191	126.4 Å²	126.4	84%	0.838	73%	0.729	S	S	*	*			trans	-149.6	26.2	173.4	-134.6	-85.3	0	0	0	112.4
8	D	24.9	Very low	27.4	Very low	170 Å²	170	122.5 Å²	122.5	91%	0.909	71%	0.708	S	S	*	*			trans	-106.2	92.3	179.2	-67.9	-64.5	0	0	0	109.7
9	A	26.2	Very low	27.7	Very low	92 Å²	92	117.9 Å²	117.9	76%	0.76	68%	0.679	S	S	*	*			trans	-160.5	-39.3	171.4	0	0	0	0	0	112.1	G11	A9-G11 PolarHBondContact O-N 3.18Å
10	Y	26.4	Very low	27.6	Very low	220 Å²	220	113.6 Å²	113.6	86%	0.863	65%	0.652	S	S	*	*			trans	-81.8	78.1	-179	-75.6	-76.5	0	0	0	112.6
11	G	24.2	Very low	27.7	Very low	46 Å²	46	108.8 Å²	108.8	47%	0.474	62%	0.624	S	S	.	*			trans	-61.1	157.5	156.3	0	0	0	0	0	111.3	A9 N13	A9-G11 PolarHBondContact O-N 3.18Å; G11-N13 PolarHBondContact O-N 3.07Å
12	P	27.2	Very low	28	Very low	121 Å²	121	98.4 Å²	98.4	79%	0.786	58%	0.576	S	S	*	*	S	Bend	trans	-78	52.3	-171.7	34	-37.8	0	0	0	113.7	S14	P12-S14 PolarHBondContact O-N 3.47Å
13	N	24.8	Very low	28.1	Very low	151 Å²	151	97.5 Å²	97.5	81%	0.807	55%	0.553	S	S	*	*			trans	-73.9	-11.2	172	-77.5	3.2	0	0	0	112.7	G11 Q15	G11-N13 PolarHBondContact O-N 3.07Å; N13-Q15 PolarHBondContact O-N 3.28Å
14	S	26.5	Very low	28.2	Very low	97 Å²	97	90.5 Å²	90.5	68%	0.678	52%	0.52	S	S	*	.			trans	-71.3	73.8	165.6	46.5	0	0	0	0	110.9	P12 A16	P12-S14 PolarHBondContact O-N 3.47Å; S14-A16 VanDerWaalsContact C-N 3.32Å; S14-A16 PolarHBondContact O-N 3.37Å
15	Q	25.1	Very low	28.3	Very low	100 Å²	100	81.7 Å²	81.7	47%	0.467	48%	0.477	S	S	.	.			trans	-56.1	101.9	158	-73.7	-166.7	14.1	0	0	107.6	N13 L17	N13-Q15 PolarHBondContact O-N 3.28Å; Q15-L17 PolarHBondContact O-N 3.13Å
16	A	27.9	Very low	28.7	Very low	36 Å²	36	80.3 Å²	80.3	30%	0.298	45%	0.452	S	S	.	.			trans	-61.8	125.6	177.7	0	0	0	0	0	108.8	S14 T18	S14-A16 VanDerWaalsContact C-N 3.32Å; S14-A16 PolarHBondContact O-N 3.37Å; A16-T18 PolarHBondContact O-N 2.94Å
17	L	29.7	Very low	28.6	Very low	28 Å²	28	76 Å²	76	15%	0.147	42%	0.42	C	S	.	.			trans	-65.4	96.3	-178.3	-56.1	-174	0	0	0	109.9	Q15 F19 S130 A235	Q15-L17 PolarHBondContact O-N 3.13Å; L17-F19 VanDerWaalsContact C-N 3.28Å; L17-F19 HydrophobicContact CB-CD2 3.58Å; L17-F19 HydrophobicContact CB-CE2 3.52Å; L17-F19 HydrophobicContact CD1-CD2 4.44Å; L17-F19 HydrophobicContact CD1-CE2 3.58Å; L17-F19 HydrophobicContact CD1-CZ 4.22Å; L17-F19 HydrophobicContact CG-CE2 4.18Å; L17-F19 PolarHBondContact O-N 3.14Å; L17-F19 VanDerWaalsContact O-N 3.07Å; L17-S130 WeakPolarHBondContact CB-OG 3.46Å; L17-S130 WeakPolarHBondContact CD1-OG 3.28Å; L17-S130 VanDerWaalsContact CG-OG 3.32Å; L17-S130 WeakPolarHBondContact CG-OG 3.46Å; L17-A235 HydrophobicContact CD2-CB 3.4Å; L17-A235 VanDerWaalsContact CD2-CB 3.4Å
18	T	26.6	Very low	28.7	Very low	57 Å²	57	68.4 Å²	68.4	35%	0.35	39%	0.388	S	S	.	.			trans	-58.5	101	145	46.9	0	0	0	0	105.6	A16 F20	A16-T18 PolarHBondContact O-N 2.94Å; T18-F20 PolarHBondContact O-N 3.1Å
19	F	32.9	Very low	28.9	Very low	35 Å²	35	61.9 Å²	61.9	15%	0.154	36%	0.36	C	S	.	.			trans	-66.6	108.3	175.6	-95.6	-121.1	0	0	0	107.2	L17 V139 R212	L17-F19 VanDerWaalsContact C-N 3.28Å; L17-F19 HydrophobicContact CB-CD2 3.58Å; L17-F19 HydrophobicContact CB-CE2 3.52Å; L17-F19 HydrophobicContact CD1-CD2 4.44Å; L17-F19 HydrophobicContact CD1-CE2 3.58Å; L17-F19 HydrophobicContact CD1-CZ 4.22Å; L17-F19 HydrophobicContact CG-CE2 4.18Å; L17-F19 PolarHBondContact O-N 3.14Å; L17-F19 VanDerWaalsContact O-N 3.07Å; F19-V139 HydrophobicContact CD1-CG1 4.06Å; F19-V139 HydrophobicContact CE1-CB 4.24Å; F19-V139 HydrophobicContact CE1-CG1 3.73Å; F19-R212 VanDerWaalsContact CD2-CZ 3.43Å; F19-R212 VanDerWaalsContact CD2-NH1 3.32Å; F19-R212 VanDerWaalsContact CE2-NH2 3.33Å
20	F	25.8	Very low	28.9	Very low	31 Å²	31	58.4 Å²	58.4	14%	0.136	33%	0.334	C	S	.	.			trans	-127.3	84.7	168.1	-91.2	-53.3	0	0	0	105.6	T18 E24 D41 F42 T43 F829	T18-F20 PolarHBondContact O-N 3.1Å; F20-E24 WeakPolarHBondContact CD1-OE2 3.23Å; F20-D41 HydrophobicContact CE1-CB 3.77Å; F20-D41 HydrophobicContact CZ-CB 3.74Å; F20-F42 VanDerWaalsContact CD1-O 3.28Å; F20-F42 WeakPolarHBondContact CD1-O 3.37Å; F20-F42 VanDerWaalsContact CD2-O 3.26Å; F20-F42 WeakPolarHBondContact CD2-O 3.44Å; F20-F42 WeakPolarHBondContact CE1-O 3.3Å; F20-F42 HydrophobicContact CE2-CB 3.97Å; F20-F42 WeakPolarHBondContact CE2-O 3.36Å; F20-F42 WeakPolarHBondContact CG-O 3.37Å; F20-F42 HydrophobicContact CZ-CB 3.92Å; F20-F42 WeakPolarHBondContact CZ-O 3.3Å; F20-T43 HydrophobicContact CB-CG2 3.89Å; F20-T43 HydrophobicContact CD2-CG2 4.47Å; F20-T43 HydrophobicContact CG-CG2 4.31Å; F20-F829 HydrophobicContact CE1-CE1 4.23Å; F20-F829 HydrophobicContact CZ-CE1 4.35Å
21	D	29.7	Very low	28.9	Very low	14 Å²	14	48.9 Å²	48.9	8%	0.075	30%	0.298	C	S	.	.			trans	-69.8	137.8	173.7	-164.2	-80.5	0	0	0	109.2	E23 R140 K651	D21-E23 PolarHBondContact O-N 2.73Å; D21-E23 PolarHBondContact OD1-N 2.72Å; D21-R140 WeakPolarHBondContact OD2-CG 3.34Å; D21-R140 IonicContact OD2-NH1 3.88Å; D21-K651 WeakPolarHBondContact O-CE 3.27Å; D21-K651 PolarHBondContact O-NZ 3.36Å
22	P	35.7	Very low	29.1	Very low	33 Å²	33	48.5 Å²	48.5	21%	0.214	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-23	176.3	-28.7	35	0	0	0	115	E243 Y292	P22-E243 HydrophobicContact CG-CG 3.9Å; P22-E243 WeakPolarHBondContact CG-OE1 3.41Å; P22-Y292 PolarHBondContact O-OH 3.44Å
23	E	34.7	Very low	29.4	Very low	51 Å²	51	46.3 Å²	46.3	24%	0.238	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	74.3	177.4	-73.5	160.5	-164	0	0	111.8	D21 N25 R142 K246 K295	D21-E23 PolarHBondContact O-N 2.73Å; D21-E23 PolarHBondContact OD1-N 2.72Å; E23-N25 PolarHBondContact O-N 3.13Å; E23-N25 VanDerWaalsContact O-N 3.17Å; E23-R142 PolarHBondContact O-NH2 3.37Å; E23-K246 IonicContact OE1-NZ 2.66Å; E23-K246 PolarHBondContact OE1-NZ 3.34Å; E23-K246 VanDerWaalsContact OE1-NZ 3.07Å; E23-K246 IonicContact OE2-NZ 3.1Å; E23-K246 PolarHBondContact OE2-NZ 2.58Å; E23-K295 IonicContact OE1-NZ 2.8Å
24	E	30.8	Very low	29.6	Very low	40 Å²	40	40 Å²	40	19%	0.187	24%	0.236	C	C	.	.			trans	-77.6	89.3	170.1	-83.3	173.9	123.1	0	0	112.3	F20 D26 L27 K651	F20-E24 WeakPolarHBondContact CD1-OE2 3.23Å; E24-D26 VanDerWaalsContact C-N 3.26Å; E24-D26 PolarHBondContact O-N 3.37Å; E24-L27 HydrophobicContact CB-CD1 4.11Å; E24-L27 HydrophobicContact CG-CD1 4.38Å; E24-K651 IonicContact OE2-NZ 2.69Å; E24-K651 PolarHBondContact OE2-NZ 3.26Å
25	N	34.2	Very low	29.6	Very low	16 Å²	16	37.7 Å²	37.7	9%	0.086	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-72.3	-15	172	-74.9	33	0	0	0	113.5	E23 L27 I28 R142	E23-N25 PolarHBondContact O-N 3.13Å; E23-N25 VanDerWaalsContact O-N 3.17Å; N25-L27 PolarHBondContact O-N 3.48Å; N25-I28 HydrophobicContact CB-CD1 4.23Å; N25-I28 WeakPolarHBondContact O-CD1 3.45Å; N25-I28 VanDerWaalsContact O-CG1 3.24Å; N25-I28 WeakPolarHBondContact O-CG1 3.43Å; N25-R142 PolarHBondContact ND2-NH1 3.24Å; N25-R142 VanDerWaalsContact ND2-NH1 3.15Å; N25-R142 PolarHBondContact OD1-NH2 2.83Å
26	D	33.2	Very low	29.5	Very low	48 Å²	48	36.5 Å²	36.5	26%	0.257	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-68.7	-15.4	177.3	-84.1	19.8	0	0	0	112.5	E24 N737 V739	E24-D26 VanDerWaalsContact C-N 3.26Å; E24-D26 PolarHBondContact O-N 3.37Å; D26-N737 VanDerWaalsContact CG-ND2 3.33Å; D26-N737 PolarHBondContact OD1-ND2 3.06Å; D26-N737 VanDerWaalsContact OD1-ND2 3.1Å; D26-N737 PolarHBondContact OD2-ND2 2.82Å; D26-V739 WeakPolarHBondContact OD2-CG2 3.49Å
27	L	28.5	Very low	29.5	Very low	20 Å²	20	36 Å²	36	11%	0.105	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-114.2	34.8	-177.7	-65.7	89.3	0	0	0	112.6	E24 N25 G29 C39 S40	E24-L27 HydrophobicContact CB-CD1 4.11Å; E24-L27 HydrophobicContact CG-CD1 4.38Å; N25-L27 PolarHBondContact O-N 3.48Å; L27-G29 PolarHBondContact O-N 3.19Å; L27-G29 VanDerWaalsContact O-N 3.11Å; L27-C39 HydrophobicContact CB-CB 3.93Å; L27-C39 HydrophobicContact CD2-CB 3.95Å; L27-C39 HydrophobicContact CG-CB 3.95Å; L27-S40 VanDerWaalsContact CD2-O 3.31Å; L27-S40 WeakPolarHBondContact CD2-O 3.38Å
28	I	27.9	Very low	29.4	Very low	31 Å²	31	35.3 Å²	35.3	16%	0.159	20%	0.203	C	C	.	.			trans	-64.9	109.9	172.3	-66.5	158.2	0	0	0	110.4	N25 L300	N25-I28 HydrophobicContact CB-CD1 4.23Å; N25-I28 WeakPolarHBondContact O-CD1 3.45Å; N25-I28 VanDerWaalsContact O-CG1 3.24Å; N25-I28 WeakPolarHBondContact O-CG1 3.43Å; I28-L300 HydrophobicContact CD1-CD1 3.63Å; I28-L300 HydrophobicContact CD1-CD2 4.32Å; I28-L300 HydrophobicContact CG1-CD1 4.43Å
29	G	28.9	Very low	29.4	Very low	32 Å²	32	33.2 Å²	33.2	33%	0.33	19%	0.19	S	C	.	.			trans	98.8	76.3	160.5	0	0	0	0	0	116.2	L27 D38	L27-G29 PolarHBondContact O-N 3.19Å; L27-G29 VanDerWaalsContact O-N 3.11Å; G29-D38 CarbonylContact O-C 3.5Å; G29-D38 WeakPolarHBondContact O-CA 3.13Å; G29-D38 PolarHBondContact O-N 3.44Å; G29-D38 VanDerWaalsContact O-N 3.11Å
30	G	25.3	Very low	29.1	Very low	20 Å²	20	32.4 Å²	32.4	21%	0.206	19%	0.189	C	C	.	.			trans	-57.1	139.1	157.6	0	0	0	0	0	112.6	T32	G30-T32 PolarHBondContact O-N 3.31Å; G30-T32 VanDerWaalsContact O-N 3.14Å
31	D	28.2	Very low	29.3	Very low	19 Å²	19	31.7 Å²	31.7	10%	0.102	19%	0.187	C	C	.	.	S	Bend	trans	-80.9	100.4	-169.3	-166.8	-6.9	0	0	0	113.5	Q33 G34 Y37 S501	D31-Q33 PolarHBondContact OD1-N 3.5Å; D31-G34 WeakPolarHBondContact OD1-CA 3.44Å; D31-G34 PolarHBondContact OD1-N 2.86Å; D31-Y37 PolarHBondContact OD2-N 2.98Å; D31-S501 WeakPolarHBondContact O-CB 3.26Å; D31-S501 WeakPolarHBondContact OD1-CB 3.11Å
32	T	28.6	Very low	29	Very low	38 Å²	38	33.3 Å²	33.3	23%	0.233	19%	0.193	C	C	.	.	S	Bend	trans	-111.1	-1.1	157.9	56	0	0	0	0	112.8	G30 P500	G30-T32 PolarHBondContact O-N 3.31Å; G30-T32 VanDerWaalsContact O-N 3.14Å; T32-P500 CarbonylContact C-O 3.6Å; T32-P500 HydrophobicContact CG2-CB 4.06Å
33	Q	32	Very low	28.5	Very low	76 Å²	76	33.6 Å²	33.6	36%	0.355	19%	0.194	S	C	.	.	S	Bend	trans	-147.2	-4.4	-165.2	-66.2	-174.5	59.1	0	0	115.9	D31 N502 R527	D31-Q33 PolarHBondContact OD1-N 3.5Å; Q33-N502 VanDerWaalsContact C-ND2 3.32Å; Q33-N502 WeakPolarHBondContact CA-ND2 3.46Å; Q33-N502 PolarHBondContact O-ND2 3.49Å; Q33-R527 PolarHBondContact O-NE 3.14Å; Q33-R527 PolarHBondContact O-NH1 3.44Å; Q33-R527 VanDerWaalsContact O-NH1 3.15Å; Q33-R527 PolarHBondContact O-NH2 3.42Å
34	G	29.2	Very low	28	Very low	17 Å²	17	35.7 Å²	35.7	18%	0.175	21%	0.207	C	C	.	.			trans	-95.2	171.1	170.9	0	0	0	0	0	113.5	D31 D36 N502 T503	D31-G34 WeakPolarHBondContact OD1-CA 3.44Å; D31-G34 PolarHBondContact OD1-N 2.86Å; G34-D36 VanDerWaalsContact C-N 3.28Å; G34-N502 WeakPolarHBondContact O-CA 3.49Å; G34-N502 VanDerWaalsContact O-CB 3.29Å; G34-N502 WeakPolarHBondContact O-CB 3.07Å; G34-N502 PolarHBondContact O-N 3.23Å; G34-T503 PolarHBondContact O-N 2.63Å
35	P	26.5	Very low	27.6	Very low	50 Å²	50	37.1 Å²	37.1	33%	0.325	22%	0.219	S	C	.	.	S	Bend	trans	-82.8	-10.1	150.2	-5.8	25.1	0	0	0	112.2	T503	P35-T503 WeakPolarHBondContact CA-OG1 3.37Å; P35-T503 WeakPolarHBondContact CB-OG1 3.46Å; P35-T503 WeakPolarHBondContact O-CB 3.27Å; P35-T503 PolarHBondContact O-OG1 3.43Å
36	D	24.2	Very low	27.2	Very low	75 Å²	75	40.5 Å²	40.5	40%	0.401	24%	0.244	S	C	.	.	S	Bend	trans	-146.6	68.6	-150.6	-63	-53.2	0	0	0	114.1	G34 R809	G34-D36 VanDerWaalsContact C-N 3.28Å; D36-R809 VanDerWaalsContact CB-NH2 3.34Å; D36-R809 VanDerWaalsContact CG-NH2 3.34Å; D36-R809 IonicContact OD1-CZ 3.7Å; D36-R809 IonicContact OD1-NE 2.72Å; D36-R809 IonicContact OD1-NH2 3.45Å; D36-R809 PolarHBondContact OD1-NH2 3.13Å
37	Y	27.5	Very low	26.7	Very low	25 Å²	25	46 Å²	46	10%	0.098	27%	0.268	C	S	.	.			trans	77.7	174.1	160.7	-47.4	167	0	0	0	117.8	D31 E799 A801 A805 R809	D31-Y37 PolarHBondContact OD2-N 2.98Å; Y37-E799 PolarHBondContact OH-OE1 3.32Å; Y37-A801 HydrophobicContact CE1-CB 3.7Å; Y37-A801 WeakPolarHBondContact OH-CB 3.32Å; Y37-A805 HydrophobicContact CD1-CB 3.47Å; Y37-A805 VanDerWaalsContact CD1-CB 3.47Å; Y37-A805 HydrophobicContact CD2-CB 4.33Å; Y37-A805 WeakPolarHBondContact CD2-O 3.2Å; Y37-A805 HydrophobicContact CE1-CB 3.53Å; Y37-A805 HydrophobicContact CE2-CB 4.39Å; Y37-A805 WeakPolarHBondContact CE2-O 3.16Å; Y37-A805 HydrophobicContact CG-CB 3.81Å; Y37-A805 VanDerWaalsContact CZ-C 3.48Å; Y37-R809 VanDerWaalsContact CE2-CD 3.47Å; Y37-R809 HydrophobicContact CE2-CG 4.05Å; Y37-R809 VanDerWaalsContact CE2-NH1 3.31Å; Y37-R809 PolarHBondContact OH-NH1 2.75Å; Y37-R809 VanDerWaalsContact OH-NH1 3.16Å
38	D	27.8	Very low	26.4	Very low	14 Å²	14	48.6 Å²	48.6	8%	0.075	29%	0.288	C	S	.	.				168.6	154.5	-57	-138.6	-45.9	0	0	0	110.3	G29 D804	G29-D38 CarbonylContact O-C 3.5Å; G29-D38 WeakPolarHBondContact O-CA 3.13Å; G29-D38 PolarHBondContact O-N 3.44Å; G29-D38 VanDerWaalsContact O-N 3.11Å; D38-D804 HydrophobicContact CB-CB 4.37Å
39	C	25.1	Very low	26.2	Very low	13 Å²	13	55.9 Å²	55.9	9%	0.088	32%	0.322	C	S	.	.			trans	148.3	143.3	159.8	-92.8	0	0	0	0	115	L27 V647 S802 D804	L27-C39 HydrophobicContact CB-CB 3.93Å; L27-C39 HydrophobicContact CD2-CB 3.95Å; L27-C39 HydrophobicContact CG-CB 3.95Å; C39-V647 WeakPolarHBondContact O-CG1 3.42Å; C39-V647 WeakPolarHBondContact O-CG2 3.39Å; C39-S802 PolarHBondContact SG-OG 2.86Å; C39-S802 VanDerWaalsContact SG-OG 3.37Å; C39-D804 PolarHBondContact SG-OD2 2.79Å
40	S	27.4	Very low	25.9	Very low	17 Å²	17	61.1 Å²	61.1	12%	0.119	35%	0.347	C	S	.	.			trans	-101.6	-148.6	-163	62.4	0	0	0	0	117.5	L27 R835	L27-S40 VanDerWaalsContact CD2-O 3.31Å; L27-S40 WeakPolarHBondContact CD2-O 3.38Å; S40-R835 PolarHBondContact OG-NH2 2.96Å
41	D	31	Very low	25.9	Very low	17 Å²	17	68.9 Å²	68.9	9%	0.091	38%	0.378	C	S	.	.			cis	-158.4	-98.1	29.6	-144	34.4	0	0	0	118	F20 R835	F20-D41 HydrophobicContact CE1-CB 3.77Å; F20-D41 HydrophobicContact CZ-CB 3.74Å; D41-R835 IonicContact OD1-CZ 2.66Å; D41-R835 IonicContact OD1-NE 2.65Å; D41-R835 IonicContact OD1-NH2 3.59Å; D41-R835 PolarHBondContact OD1-NH2 3.13Å; D41-R835 IonicContact OD2-CZ 3.48Å; D41-R835 IonicContact OD2-NE 3.61Å; D41-R835 IonicContact OD2-NH2 3.74Å; D41-R835 PolarHBondContact OD2-NH2 3.19Å
42	F	22.6	Very low	25.7	Very low	47 Å²	47	72.2 Å²	72.2	21%	0.206	41%	0.408	C	S	.	.			trans	-149.2	171.3	-159.7	-71.5	-75	0	0	0	118.4	F20	F20-F42 VanDerWaalsContact CD1-O 3.28Å; F20-F42 WeakPolarHBondContact CD1-O 3.37Å; F20-F42 VanDerWaalsContact CD2-O 3.26Å; F20-F42 WeakPolarHBondContact CD2-O 3.44Å; F20-F42 WeakPolarHBondContact CE1-O 3.3Å; F20-F42 HydrophobicContact CE2-CB 3.97Å; F20-F42 WeakPolarHBondContact CE2-O 3.36Å; F20-F42 WeakPolarHBondContact CG-O 3.37Å; F20-F42 HydrophobicContact CZ-CB 3.92Å; F20-F42 WeakPolarHBondContact CZ-O 3.3Å
43	T	25.3	Very low	25.6	Very low	40 Å²	40	75.4 Å²	75.4	25%	0.245	43%	0.432	C	S	.	.			trans	-148.9	165.7	152.3	17.1	0	0	0	0	115.5	F20 K651 S655	F20-T43 HydrophobicContact CB-CG2 3.89Å; F20-T43 HydrophobicContact CD2-CG2 4.47Å; F20-T43 HydrophobicContact CG-CG2 4.31Å; T43-K651 HydrophobicContact CG2-CD 4.22Å; T43-S655 WeakPolarHBondContact CB-OG 3.45Å; T43-S655 PolarHBondContact O-OG 3.37Å; T43-S655 PolarHBondContact OG1-OG 3.32Å
44	L	24.9	Very low	25.3	Very low	95 Å²	95	80.8 Å²	80.8	50%	0.497	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-76.6	163.5	-157.7	-67.8	164.6	0	0	0	118.3
45	P	22.4	Very low	25.2	Very low	69 Å²	69	87.4 Å²	87.4	45%	0.448	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-77.4	158.3	168	31.7	-35.3	0	0	0	114.6	A911	P45-A911 HydrophobicContact CB-CB 3.43Å; P45-A911 VanDerWaalsContact CB-CB 3.43Å
46	S	25.2	Very low	25.1	Very low	87 Å²	87	92.3 Å²	92.3	61%	0.608	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-84.6	159.7	-179.4	-167.5	0	0	0	0	114
47	Q	21.9	Very low	25.6	Very low	163 Å²	163	94.6 Å²	94.6	76%	0.762	53%	0.53	S	S	*	.			trans	-109.9	120.6	171.3	-74.1	-171.8	-19.3	0	0	111.2
48	S	23.1	Very low	25.5	Very low	75 Å²	75	100.4 Å²	100.4	52%	0.524	56%	0.563	S	S	.	*			trans	-148.9	127.2	161.5	63.4	0	0	0	0	110.8
49	Q	22.7	Very low	25.6	Very low	185 Å²	185	109.6 Å²	109.6	86%	0.864	60%	0.602	S	S	*	*			trans	59.5	73.9	170.8	-54.8	-173.1	15	0	0	117.3
50	T	23.8	Very low	25.5	Very low	142 Å²	142	116.8 Å²	116.8	87%	0.871	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-76.2	118.8	143.6	46.7	0	0	0	0	108.8
51	Q	24.1	Very low	25.3	Very low	182 Å²	182	120.7 Å²	120.7	85%	0.85	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-62.9	136.1	175.1	-67.1	177.8	-3.1	0	0	110.6
52	A	25.3	Very low	25.1	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-77.7	142	178.1	0	0	0	0	0	111.8
53	S	26.8	Very low	25.1	Very low	105 Å²	105	132.1 Å²	132.1	73%	0.734	73%	0.729	S	S	*	*			trans	58	70.1	150.5	-53.2	0	0	0	0	118.2
54	Q	25.2	Very low	25.4	Very low	189 Å²	189	139.6 Å²	139.6	88%	0.883	76%	0.761	S	S	*	*			trans	-98.4	101.2	142.1	-74.6	-168.7	-10.3	0	0	109.1
55	L	26.5	Very low	25.3	Very low	157 Å²	157	144.1 Å²	144.1	82%	0.822	78%	0.78	S	S	*	*			trans	-93.7	103.1	170.7	-74.8	166.3	0	0	0	108.3	P57	L55-P57 WeakPolarHBondContact O-CD 3.41Å
56	D	25.1	Very low	25.8	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	80%	0.798	S	S	*	*			trans	-64.3	118.7	173.4	-82.9	-40.3	0	0	0	110.4	D58	D56-D58 VanDerWaalsContact C-N 3.28Å; D56-D58 PolarHBondContact O-N 2.81Å
57	P	34.9	Very low	26.1	Very low	123 Å²	123	152.3 Å²	152.3	80%	0.799	81%	0.807	S	S	*	*			trans	-87.6	49.5	-165.1	36.4	-38.2	0	0	0	113.5	L55	L55-P57 WeakPolarHBondContact O-CD 3.41Å
58	D	24.9	Very low	26.7	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	80%	0.802	S	S	*	*			trans	-126.6	55	-165.2	-127.8	-21.2	0	0	0	115.2	D56	D56-D58 VanDerWaalsContact C-N 3.28Å; D56-D58 PolarHBondContact O-N 2.81Å
59	K	29	Very low	27.4	Very low	207 Å²	207	150.3 Å²	150.3	90%	0.9	82%	0.816	S	S	*	*			trans	-137	59.3	164.4	-75.7	-163.2	177.3	176	0	113.3	C61	K59-C61 PolarHBondContact O-N 2.77Å; K59-C61 VanDerWaalsContact O-N 3.13Å
60	N	23.5	Very low	28.3	Very low	165 Å²	165	146.3 Å²	146.3	88%	0.882	80%	0.8	S	S	*	*			trans	-83.3	78.7	178.1	-169.7	7.8	0	0	0	112.5
61	C	23.9	Very low	29.8	Very low	99 Å²	99	145 Å²	145	67%	0.669	79%	0.792	S	S	*	*			trans	-159.4	95.3	167	-159.8	0	0	0	0	113.9	K59	K59-C61 PolarHBondContact O-N 2.77Å; K59-C61 VanDerWaalsContact O-N 3.13Å
62	F	26.9	Very low	31.5	Very low	193 Å²	193	142.9 Å²	142.9	85%	0.846	79%	0.785	S	S	*	*				-167.3	131.3	106.7	-117.6	-81.2	0	0	0	110.7
63	S	22.3	Very low	33	Very low	110 Å²	110	143.3 Å²	143.3	77%	0.769	78%	0.775	S	S	*	*			trans	-88.8	123.4	-179.5	54.1	0	0	0	0	111.8
64	Q	30	Very low	34.9	Very low	198 Å²	198	142.2 Å²	142.2	93%	0.925	76%	0.764	S	S	*	*			trans	-141.4	132.5	150.9	-110.1	169.9	18.6	0	0	109.4
65	Q	23.9	Very low	36.4	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	75%	0.75	S	S	*	*			trans	-86.8	127.1	-178.1	-62.8	161.6	-66.1	0	0	108.8
66	H	32.1	Very low	38.2	Very low	180 Å²	180	134.5 Å²	134.5	83%	0.833	74%	0.735	S	S	*	*			trans	-154.7	168.5	148.9	-108.5	-59.4	0	0	0	110.4
67	D	32.8	Very low	39.5	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	72%	0.723	S	S	*	*			trans	-70.1	148.3	-147.4	-60.3	-91.9	0	0	0	116.2
68	G	33.1	Very low	40.6	Very low	64 Å²	64	135.5 Å²	135.5	66%	0.66	72%	0.716	S	S	*	*			trans	-65.8	169.4	-178	0	0	0	0	0	115.6
69	T	37.5	Very low	42.5	Very low	132 Å²	132	132.9 Å²	132.9	81%	0.81	71%	0.705	S	S	*	*			trans	54.4	101	160.4	51.3	0	0	0	0	116.7
70	N	43.5	Very low	43.6	Very low	102 Å²	102	126.6 Å²	126.6	55%	0.545	69%	0.692	S	S	.	*				178.6	-0.8	127.6	-89	3.5	0	0	0	113.7	I72 D73 V74	N70-I72 VanDerWaalsContact C-N 3.26Å; N70-I72 PolarHBondContact O-N 2.93Å; N70-D73 PolarHBondContact O-N 3.43Å; N70-D73 VanDerWaalsContact O-N 3.17Å; N70-V74 PolarHBondContact O-N 3.48Å; N70-V74 VanDerWaalsContact O-N 3.09Å
71	T	54.5	Low	45	Very low	114 Å²	114	124 Å²	124	70%	0.699	68%	0.678	S	S	*	*	H	α-helix	trans	-60.6	-30.2	177.2	22.2	0	0	0	0	114.4	L75	T71-L75 PolarHBondContact O-N 3.36Å
72	I	59.3	Low	45.9	Very low	137 Å²	137	123.8 Å²	123.8	70%	0.703	67%	0.67	S	S	*	*	H	α-helix	trans	-70.2	-41.2	175.4	-63.9	176.4	0	0	0	110.5	N70 V74 L75 S76	N70-I72 VanDerWaalsContact C-N 3.26Å; N70-I72 PolarHBondContact O-N 2.93Å; I72-V74 PolarHBondContact O-N 3.19Å; I72-L75 PolarHBondContact O-N 3.09Å; I72-S76 WeakPolarHBondContact O-CB 3.29Å; I72-S76 PolarHBondContact O-N 2.91Å
73	D	57.5	Low	46.5	Very low	99 Å²	99	120.3 Å²	120.3	53%	0.529	66%	0.66	S	S	.	*	H	α-helix	trans	-68.6	-33.9	177.6	-66.6	-33.8	0	0	0	112.2	N70 L75 S76 H77	N70-D73 PolarHBondContact O-N 3.43Å; N70-D73 VanDerWaalsContact O-N 3.17Å; D73-L75 VanDerWaalsContact C-N 3.31Å; D73-L75 PolarHBondContact O-N 3.13Å; D73-S76 WeakPolarHBondContact O-CB 3.27Å; D73-S76 PolarHBondContact O-N 2.75Å; D73-H77 WeakPolarHBondContact O-CB 3.42Å; D73-H77 PolarHBondContact O-N 3.41Å
74	V	65.5	Low	47.3	Very low	81 Å²	81	123 Å²	123	49%	0.491	66%	0.658	S	S	.	*	H	α-helix	trans	-66.1	-33.4	172.5	175.1	0	0	0	0	112	N70 I72 R78	N70-V74 PolarHBondContact O-N 3.48Å; N70-V74 VanDerWaalsContact O-N 3.09Å; I72-V74 PolarHBondContact O-N 3.19Å; V74-R78 WeakPolarHBondContact O-CB 3.45Å; V74-R78 VanDerWaalsContact O-CG 3.25Å; V74-R78 WeakPolarHBondContact O-CG 3.08Å; V74-R78 PolarHBondContact O-N 2.88Å
75	L	56.9	Low	47.6	Very low	113 Å²	113	120 Å²	120	59%	0.592	64%	0.642	S	S	*	*	H	α-helix	trans	-74.9	-40.1	172.2	-75.4	167.1	0	0	0	111.8	T71 I72 D73 R78 V79	T71-L75 PolarHBondContact O-N 3.36Å; I72-L75 PolarHBondContact O-N 3.09Å; D73-L75 VanDerWaalsContact C-N 3.31Å; D73-L75 PolarHBondContact O-N 3.13Å; L75-R78 PolarHBondContact O-N 3.18Å; L75-V79 WeakPolarHBondContact O-CG2 3.36Å; L75-V79 PolarHBondContact O-N 2.86Å
76	S	65.9	Low	48.2	Very low	72 Å²	72	117.8 Å²	117.8	50%	0.503	64%	0.636	S	S	.	*	H	α-helix	trans	-57.3	-50.7	174.4	-174	0	0	0	0	111	I72 D73 R78 V79 A80	I72-S76 WeakPolarHBondContact O-CB 3.29Å; I72-S76 PolarHBondContact O-N 2.91Å; D73-S76 WeakPolarHBondContact O-CB 3.27Å; D73-S76 PolarHBondContact O-N 2.75Å; S76-R78 PolarHBondContact O-N 3.18Å; S76-V79 PolarHBondContact O-N 3.34Å; S76-V79 VanDerWaalsContact O-N 3.1Å; S76-A80 WeakPolarHBondContact O-CB 3.34Å; S76-A80 PolarHBondContact O-N 2.89Å
77	H	52.4	Low	48.4	Very low	122 Å²	122	116.7 Å²	116.7	57%	0.565	63%	0.632	S	S	*	*	H	α-helix	trans	-61.1	-44.7	176.3	-130.9	-65.8	0	0	0	111.4	D73 V79 A80 D81	D73-H77 WeakPolarHBondContact O-CB 3.42Å; D73-H77 PolarHBondContact O-N 3.41Å; H77-V79 PolarHBondContact O-N 3.3Å; H77-V79 VanDerWaalsContact O-N 3.15Å; H77-A80 CarbonylContact O-C 3.58Å; H77-A80 PolarHBondContact O-N 3.19Å; H77-A80 VanDerWaalsContact O-N 3.11Å; H77-D81 IonicContact CE1-OD1 3.66Å; H77-D81 IonicContact ND1-OD1 3.14Å; H77-D81 PolarHBondContact ND1-OD1 2.81Å; H77-D81 VanDerWaalsContact ND1-OD1 3.14Å; H77-D81 IonicContact ND1-OD2 3.23Å; H77-D81 PolarHBondContact ND1-OD2 3.42Å; H77-D81 VanDerWaalsContact O-CB 3.3Å; H77-D81 WeakPolarHBondContact O-CB 3.26Å; H77-D81 PolarHBondContact O-N 3.4Å; H77-D81 VanDerWaalsContact O-OD2 3.09Å
78	R	58.1	Low	48.7	Very low	174 Å²	174	117.1 Å²	117.1	66%	0.657	63%	0.634	S	S	*	*	H	α-helix	trans	-65.4	-15.5	176.3	-76.5	177.9	177.1	-155.7	-1	115.2	V74 L75 S76	V74-R78 WeakPolarHBondContact O-CB 3.45Å; V74-R78 VanDerWaalsContact O-CG 3.25Å; V74-R78 WeakPolarHBondContact O-CG 3.08Å; V74-R78 PolarHBondContact O-N 2.88Å; L75-R78 PolarHBondContact O-N 3.18Å; S76-R78 PolarHBondContact O-N 3.18Å
79	V	63.4	Low	48.8	Very low	92 Å²	92	122 Å²	122	56%	0.558	64%	0.64	S	S	*	*	H	α-helix	trans	-95.9	-29.1	172.7	172	0	0	0	0	111.2	L75 S76 H77 L82	L75-V79 WeakPolarHBondContact O-CG2 3.36Å; L75-V79 PolarHBondContact O-N 2.86Å; S76-V79 PolarHBondContact O-N 3.34Å; S76-V79 VanDerWaalsContact O-N 3.1Å; H77-V79 PolarHBondContact O-N 3.3Å; H77-V79 VanDerWaalsContact O-N 3.15Å; V79-L82 WeakPolarHBondContact O-CB 3.33Å; V79-L82 PolarHBondContact O-N 3.12Å
80	A	53.4	Low	48.9	Very low	75 Å²	75	122.2 Å²	122.2	62%	0.62	64%	0.636	S	S	*	*	H	α-helix	trans	-75.1	-30.1	170.8	0	0	0	0	0	112.9	S76 H77 L82	S76-A80 WeakPolarHBondContact O-CB 3.34Å; S76-A80 PolarHBondContact O-N 2.89Å; H77-A80 CarbonylContact O-C 3.58Å; H77-A80 PolarHBondContact O-N 3.19Å; H77-A80 VanDerWaalsContact O-N 3.11Å; A80-L82 PolarHBondContact O-N 2.6Å
81	D	53.1	Low	48.7	Very low	109 Å²	109	123.6 Å²	123.6	58%	0.583	64%	0.643	S	S	*	*	S	Bend	trans	-77.6	-3.2	172.3	-58.9	-28.7	0	0	0	111.7	H77 D83	H77-D81 IonicContact CE1-OD1 3.66Å; H77-D81 IonicContact ND1-OD1 3.14Å; H77-D81 PolarHBondContact ND1-OD1 2.81Å; H77-D81 VanDerWaalsContact ND1-OD1 3.14Å; H77-D81 IonicContact ND1-OD2 3.23Å; H77-D81 PolarHBondContact ND1-OD2 3.42Å; H77-D81 VanDerWaalsContact O-CB 3.3Å; H77-D81 WeakPolarHBondContact O-CB 3.26Å; H77-D81 PolarHBondContact O-N 3.4Å; H77-D81 VanDerWaalsContact O-OD2 3.09Å; D81-D83 VanDerWaalsContact C-N 3.26Å; D81-D83 PolarHBondContact O-N 2.64Å; D81-D83 VanDerWaalsContact O-N 3.07Å
82	L	42.1	Very low	48.2	Very low	96 Å²	96	123.5 Å²	123.5	50%	0.503	65%	0.647	S	S	.	*	S	Bend	trans	-76.1	87	159.9	-62	175.8	0	0	0	107.5	V79 A80 F84	V79-L82 WeakPolarHBondContact O-CB 3.33Å; V79-L82 PolarHBondContact O-N 3.12Å; A80-L82 PolarHBondContact O-N 2.6Å; L82-F84 HydrophobicContact CB-CD2 4.12Å; L82-F84 HydrophobicContact CB-CE2 3.8Å; L82-F84 HydrophobicContact CB-CZ 4.47Å; L82-F84 HydrophobicContact CD1-CE2 4.29Å; L82-F84 HydrophobicContact CD1-CZ 4.43Å; L82-F84 WeakPolarHBondContact O-CD2 3.23Å; L82-F84 PolarHBondContact O-N 2.84Å
83	D	38.2	Very low	47.5	Very low	120 Å²	120	121.2 Å²	121.2	64%	0.642	64%	0.643	S	S	*	*			trans	-64.3	80.8	172.9	-167.9	23.2	0	0	0	109.2	D81 K85	D81-D83 VanDerWaalsContact C-N 3.26Å; D81-D83 PolarHBondContact O-N 2.64Å; D81-D83 VanDerWaalsContact O-N 3.07Å; D83-K85 PolarHBondContact O-N 3.37Å; D83-K85 WeakPolarHBondContact OD2-CE 3.47Å; D83-K85 IonicContact OD2-NZ 2.73Å
84	F	40.9	Very low	47.5	Very low	167 Å²	167	120.7 Å²	120.7	73%	0.732	64%	0.643	S	S	*	*			trans	-65.9	78.2	170	-73.9	-83.1	0	0	0	108.3	L82 D86	L82-F84 HydrophobicContact CB-CD2 4.12Å; L82-F84 HydrophobicContact CB-CE2 3.8Å; L82-F84 HydrophobicContact CB-CZ 4.47Å; L82-F84 HydrophobicContact CD1-CE2 4.29Å; L82-F84 HydrophobicContact CD1-CZ 4.43Å; L82-F84 WeakPolarHBondContact O-CD2 3.23Å; L82-F84 PolarHBondContact O-N 2.84Å; F84-D86 PolarHBondContact O-N 2.82Å
85	K	35.1	Very low	47.8	Very low	135 Å²	135	124.5 Å²	124.5	59%	0.587	66%	0.661	S	S	*	*			trans	-67.1	123.5	168.3	-66.9	-172.1	-177.5	-177.7	0	108.4	D83 E87	D83-K85 PolarHBondContact O-N 3.37Å; D83-K85 WeakPolarHBondContact OD2-CE 3.47Å; D83-K85 IonicContact OD2-NZ 2.73Å; K85-E87 HydrophobicContact CB-CG 4.3Å; K85-E87 PolarHBondContact O-N 3.41Å
86	D	35.9	Very low	49.1	Very low	142 Å²	142	123.2 Å²	123.2	76%	0.759	65%	0.654	S	S	*	*			trans	-69.1	65.2	167.3	-52.5	-59.3	0	0	0	109.5	F84 D88	F84-D86 PolarHBondContact O-N 2.82Å; D86-D88 PolarHBondContact O-N 2.91Å
87	E	38.1	Very low	50.3	Low	158 Å²	158	122.1 Å²	122.1	74%	0.738	65%	0.645	S	S	*	*			trans	-75.3	74.2	161.9	-72.1	-174.3	-179.8	0	0	107.3	K85 Q89	K85-E87 HydrophobicContact CB-CG 4.3Å; K85-E87 PolarHBondContact O-N 3.41Å; E87-Q89 PolarHBondContact O-N 3.11Å
88	D	38.1	Very low	52	Low	155 Å²	155	125 Å²	125	83%	0.829	66%	0.659	S	S	*	*			trans	-63.8	65	169.6	-78.9	-40.4	0	0	0	110.2	D86	D86-D88 PolarHBondContact O-N 2.91Å
89	Q	35.1	Very low	53.7	Low	168 Å²	168	118.6 Å²	118.6	79%	0.785	64%	0.637	S	S	*	*			trans	-125.4	132.1	168.2	-66.4	-169.6	12.5	0	0	108.8	E87 D91	E87-Q89 PolarHBondContact O-N 3.11Å; Q89-D91 PolarHBondContact O-N 2.97Å
90	D	39.2	Very low	55.1	Low	136 Å²	136	115 Å²	115	73%	0.727	62%	0.616	S	S	*	*			trans	-70.3	71.3	176.5	-73.2	-70.1	0	0	0	111.6	S92 S93	D90-S92 PolarHBondContact O-N 2.82Å; D90-S93 PolarHBondContact O-N 3.29Å; D90-S93 PolarHBondContact O-OG 2.83Å
91	D	40.7	Very low	57.1	Low	130 Å²	130	111.5 Å²	111.5	70%	0.695	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-66.1	5.9	174.9	-153.6	45.9	0	0	0	112.7	Q89 S93 V94	Q89-D91 PolarHBondContact O-N 2.97Å; D91-S93 PolarHBondContact O-N 2.65Å; D91-S93 VanDerWaalsContact O-N 3.15Å; D91-V94 WeakPolarHBondContact OD1-CG2 3.34Å
92	S	43.2	Very low	59.1	Low	112 Å²	112	108 Å²	108	78%	0.783	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-64	-3	163.6	63.2	0	0	0	0	113.8	D90	D90-S92 PolarHBondContact O-N 2.82Å
93	S	45.7	Very low	61.5	Low	90 Å²	90	103.4 Å²	103.4	63%	0.629	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-124.8	25.8	-175.4	60.9	0	0	0	0	115	D90 D91 D95	D90-S93 PolarHBondContact O-N 3.29Å; D90-S93 PolarHBondContact O-OG 2.83Å; D91-S93 PolarHBondContact O-N 2.65Å; D91-S93 VanDerWaalsContact O-N 3.15Å; S93-D95 PolarHBondContact O-N 3.36Å
94	V	56.8	Low	64.2	Low	87 Å²	87	97.8 Å²	97.8	53%	0.527	52%	0.519	S	S	.	.			trans	-61.4	107.2	166	-179.9	0	0	0	0	109.5	D91 L96	D91-V94 WeakPolarHBondContact OD1-CG2 3.34Å; V94-L96 PolarHBondContact O-N 3.44Å
95	D	71.7	Confident	66.7	Low	162 Å²	162	90.5 Å²	90.5	87%	0.866	49%	0.491	S	S	*	.			trans	-57.5	98.7	174.7	-91.6	-32.2	0	0	0	110.4	S93	S93-D95 PolarHBondContact O-N 3.36Å
96	L	85	Confident	69.5	Low	86 Å²	86	84.6 Å²	84.6	45%	0.45	47%	0.466	S	S	.	.			trans	-65	136.7	176.1	-72.8	173.2	0	0	0	109.7	V94 A100	V94-L96 PolarHBondContact O-N 3.44Å; L96-A100 HydrophobicContact CB-CB 4.01Å
97	P	89.6	Confident	72.2	Confident	49 Å²	49	82.1 Å²	82.1	32%	0.318	45%	0.45	S	S	.	.			trans	-65.4	151.2	179.8	30.3	-37.2	0	0	0	110.8	H99 A100 H107	P97-H99 PolarHBondContact O-N 2.84Å; P97-A100 WeakPolarHBondContact O-CB 3.26Å; P97-A100 PolarHBondContact O-N 3.38Å; P97-H107 HydrophobicContact CG-CB 3.65Å
98	E	88.9	Confident	74.8	Confident	183 Å²	183	76.6 Å²	76.6	86%	0.855	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-28	-176	-169.8	-172.7	173.6	0	0	114.7	A100	E98-A100 VanDerWaalsContact C-N 3.34Å
99	H	92.8	Very high	77.4	Confident	39 Å²	39	71.2 Å²	71.2	18%	0.181	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	8.9	178.6	60.8	-90.8	0	0	0	115.1	P97 H107 V112 W121 H149	P97-H99 PolarHBondContact O-N 2.84Å; H99-H107 PolarHBondContact CD2-O 3.42Å; H99-H107 VanDerWaalsContact CD2-O 3.3Å; H99-H107 PolarHBondContact NE2-O 3.01Å; H99-H107 VanDerWaalsContact NE2-O 3.14Å; H99-V112 HydrophobicContact CB-CG2 4.37Å; H99-W121 HydrophobicContact CB-CD2 3.78Å; H99-W121 HydrophobicContact CB-CE3 4.17Å; H99-W121 HydrophobicContact CB-CG 4.06Å; H99-W121 HydrophobicContact CB-CZ2 4.35Å; H99-W121 WeakPolarHBondContact O-CB 3.46Å; H99-H149 AromaticContact CG-NE2 3.66Å; H99-H149 AromaticContact ND1-NE2 3.79Å
100	A	93.8	Very high	80.2	Confident	16 Å²	16	63.8 Å²	63.8	13%	0.132	37%	0.366	C	S	.	.	S	Bend	trans	-65.6	142	175	0	0	0	0	0	112.1	L96 P97 E98 A102 H107	L96-A100 HydrophobicContact CB-CB 4.01Å; P97-A100 WeakPolarHBondContact O-CB 3.26Å; P97-A100 PolarHBondContact O-N 3.38Å; E98-A100 VanDerWaalsContact C-N 3.34Å; A100-A102 PolarHBondContact O-N 2.94Å; A100-A102 VanDerWaalsContact O-N 3.16Å; A100-H107 HydrophobicContact CB-CB 3.9Å
101	C	95.5	Very high	82.9	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.014	33%	0.332	C	S	.	.			trans	-63.6	114.1	178.1	174.2	0	0	0	0	111.5	Y103 C104 G105 I106 W121 C123	C101-Y103 PolarHBondContact O-N 3.48Å; C101-C104 PolarHBondContact O-N 3.03Å; C101-G105 PolarHBondContact O-N 3.29Å; C101-I106 HydrophobicContact CB-CB 4.35Å; C101-I106 VanDerWaalsContact CB-O 3.26Å; C101-I106 WeakPolarHBondContact CB-O 3.26Å; C101-I106 PolarHBondContact N-O 2.96Å; C101-W121 WeakPolarHBondContact CA-O 3.41Å; C101-C123 HydrophobicContact CB-CB 3.86Å; C101-C123 PolarHBondContact SG-N 3.47Å; C101-C123 VanDerWaalsContact SG-SG 3.63Å
102	A	93.8	Very high	85.5	Confident	34 Å²	34	51.3 Å²	51.3	28%	0.281	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-15.5	-174.5	0	0	0	0	0	115.5	A100 W121 F122 W245	A100-A102 PolarHBondContact O-N 2.94Å; A100-A102 VanDerWaalsContact O-N 3.16Å; A102-W121 PolarHBondContact N-O 3.32Å; A102-F122 HydrophobicContact CB-CE1 3.97Å; A102-F122 HydrophobicContact CB-CZ 4.15Å; A102-W245 HydrophobicContact CB-CH2 3.84Å; A102-W245 HydrophobicContact CB-CZ2 4.05Å
103	Y	94.2	Very high	88	Confident	1 Å²	1	46 Å²	46	0%	0.004	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-32.7	172	-68.8	-18.4	0	0	0	115.3	C101 F122 H133 N136 H137 I238 L241 E242 W245	C101-Y103 PolarHBondContact O-N 3.48Å; Y103-F122 HydrophobicContact CD1-CD1 4.42Å; Y103-F122 AromaticContact CD1-CE1 3.91Å; Y103-F122 HydrophobicContact CD1-CE1 3.91Å; Y103-F122 HydrophobicContact CD2-CD1 4.02Å; Y103-F122 HydrophobicContact CD2-CE1 4.22Å; Y103-F122 HydrophobicContact CE1-CD1 4.49Å; Y103-F122 AromaticContact CE1-CE1 3.75Å; Y103-F122 HydrophobicContact CE1-CE1 3.75Å; Y103-F122 HydrophobicContact CE2-CD1 4.03Å; Y103-F122 HydrophobicContact CE2-CE1 4.01Å; Y103-F122 HydrophobicContact CG-CD1 4.19Å; Y103-F122 HydrophobicContact CG-CE1 4.14Å; Y103-F122 AromaticContact CZ-CE1 3.78Å; Y103-H133 HydrophobicContact CD2-CB 3.62Å; Y103-H133 AromaticContact CD2-CG 3.74Å; Y103-H133 HydrophobicContact CE2-CB 4.28Å; Y103-H133 WeakPolarHBondContact CE2-O 3.19Å; Y103-N136 HydrophobicContact CE2-CB 4.39Å; Y103-H137 HydrophobicContact CE2-CB 4.34Å; Y103-I238 HydrophobicContact CD1-CG1 4.18Å; Y103-I238 HydrophobicContact CD2-CD1 3.77Å; Y103-I238 HydrophobicContact CD2-CG1 3.97Å; Y103-I238 HydrophobicContact CE1-CG1 4.18Å; Y103-I238 HydrophobicContact CE1-CG2 4.21Å; Y103-I238 HydrophobicContact CE2-CD1 3.98Å; Y103-I238 HydrophobicContact CE2-CG1 4.05Å; Y103-I238 HydrophobicContact CE2-CG2 3.97Å; Y103-I238 HydrophobicContact CG-CD1 4.25Å; Y103-I238 HydrophobicContact CG-CG1 4.07Å; Y103-L241 HydrophobicContact CD1-CD2 3.95Å; Y103-L241 HydrophobicContact CE1-CD2 4.24Å; Y103-E242 WeakPolarHBondContact OH-CG 3.48Å; Y103-E242 PolarHBondContact OH-OE1 3.22Å; Y103-W245 AromaticContact CD1-CH2 3.86Å; Y103-W245 HydrophobicContact CD1-CH2 3.86Å; Y103-W245 HydrophobicContact CD1-CZ3 4.37Å; Y103-W245 AromaticContact CE1-CH2 3.57Å; Y103-W245 HydrophobicContact CE1-CH2 3.57Å; Y103-W245 AromaticContact CE1-CZ3 3.62Å; Y103-W245 HydrophobicContact CE1-CZ3 3.62Å
104	C	94	Very high	90.4	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.014	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.6	0.6	-164.7	72.5	0	0	0	0	116.9	C101 I106 H133 A230 R231	C101-C104 PolarHBondContact O-N 3.03Å; C104-I106 VanDerWaalsContact C-N 3.27Å; C104-I106 PolarHBondContact O-N 2.81Å; C104-H133 PolarHBondContact SG-CE1 2.97Å; C104-H133 PolarHBondContact SG-ND1 2.95Å; C104-A230 HydrophobicContact CB-CB 4.31Å; C104-R231 VanDerWaalsContact CB-O 3.31Å; C104-R231 WeakPolarHBondContact CB-O 3.22Å; C104-R231 PolarHBondContact O-N 3.02Å
105	G	92.6	Very high	92.3	Very high	14 Å²	14	39.6 Å²	39.6	14%	0.144	22%	0.216	C	C	.	.			trans	76.5	-1.6	177.5	0	0	0	0	0	116.3	C101 H107	C101-G105 PolarHBondContact O-N 3.29Å; G105-H107 PolarHBondContact O-N 2.91Å; G105-H107 PolarHBondContact O-ND1 3.3Å
106	I	94.4	Very high	93.3	Very high	11 Å²	11	33.2 Å²	33.2	6%	0.056	18%	0.182	C	C	.	.			trans	-62.8	121.7	175.2	-67.3	176.7	0	0	0	109.7	C101 C104 V112 C123 P222 A230	C101-I106 HydrophobicContact CB-CB 4.35Å; C101-I106 VanDerWaalsContact CB-O 3.26Å; C101-I106 WeakPolarHBondContact CB-O 3.26Å; C101-I106 PolarHBondContact N-O 2.96Å; C104-I106 VanDerWaalsContact C-N 3.27Å; C104-I106 PolarHBondContact O-N 2.81Å; I106-V112 WeakPolarHBondContact O-CG1 3.1Å; I106-C123 HydrophobicContact CB-CB 4.02Å; I106-C123 HydrophobicContact CG2-CB 3.84Å; I106-P222 HydrophobicContact CD1-CB 3.98Å; I106-P222 HydrophobicContact CD1-CG 3.94Å; I106-P222 HydrophobicContact CG2-CB 4.3Å; I106-P222 HydrophobicContact CG2-CG 3.87Å; I106-A230 HydrophobicContact CD1-CB 3.74Å; I106-A230 HydrophobicContact CG1-CB 3.51Å
107	H	93.3	Very high	93.6	Very high	89 Å²	89	33.1 Å²	33.1	41%	0.412	19%	0.185	S	C	.	.			trans	-129.6	20.5	-170.1	56.6	-96.3	0	0	0	113.6	P97 H99 A100 G105 P109	P97-H107 HydrophobicContact CG-CB 3.65Å; H99-H107 PolarHBondContact CD2-O 3.42Å; H99-H107 VanDerWaalsContact CD2-O 3.3Å; H99-H107 PolarHBondContact NE2-O 3.01Å; H99-H107 VanDerWaalsContact NE2-O 3.14Å; A100-H107 HydrophobicContact CB-CB 3.9Å; G105-H107 PolarHBondContact O-N 2.91Å; G105-H107 PolarHBondContact O-ND1 3.3Å; H107-P109 VanDerWaalsContact O-CD 3.22Å; H107-P109 WeakPolarHBondContact O-CD 3.44Å
108	D	93.5	Very high	93.7	Very high	43 Å²	43	33 Å²	33	23%	0.23	18%	0.183	C	C	.	.			trans	-65.5	118.6	171.4	171.8	0	0	0	0	109.8	A110 C111 V112	D108-A110 PolarHBondContact O-N 2.68Å; D108-A110 WeakPolarHBondContact OD1-CB 3.45Å; D108-A110 PolarHBondContact OD1-N 2.7Å; D108-C111 HydrophobicContact CB-CB 4.01Å; D108-C111 PolarHBondContact O-N 3.09Å; D108-C111 PolarHBondContact OD2-SG 3.34Å; D108-V112 PolarHBondContact O-N 3.28Å
109	P	92.6	Very high	93.9	Very high	42 Å²	42	30.6 Å²	30.6	27%	0.273	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-31.2	176.8	-34.4	41.3	0	0	0	115.6	H107 C111 H149 D151	H107-P109 VanDerWaalsContact O-CD 3.22Å; H107-P109 WeakPolarHBondContact O-CD 3.44Å; P109-C111 VanDerWaalsContact C-N 3.34Å; P109-H149 WeakPolarHBondContact CB-ND1 3.26Å; P109-H149 WeakPolarHBondContact O-CB 3.47Å; P109-D151 HydrophobicContact CB-CB 4.11Å
110	A	93.6	Very high	94	Very high	12 Å²	12	30.5 Å²	30.5	10%	0.099	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.6	179.7	0	0	0	0	0	113.5	D108 K220	D108-A110 PolarHBondContact O-N 2.68Å; D108-A110 WeakPolarHBondContact OD1-CB 3.45Å; D108-A110 PolarHBondContact OD1-N 2.7Å; A110-K220 HydrophobicContact CB-CB 4.42Å; A110-K220 HydrophobicContact CB-CD 3.7Å; A110-K220 HydrophobicContact CB-CG 4.09Å; A110-K220 WeakPolarHBondContact O-CB 3.25Å; A110-K220 PolarHBondContact O-N 2.83Å
111	C	94.7	Very high	94.1	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-6.5	-175.1	-66.5	0	0	0	0	114.5	D108 P109 C123 N124 K220 P222	D108-C111 HydrophobicContact CB-CB 4.01Å; D108-C111 PolarHBondContact O-N 3.09Å; D108-C111 PolarHBondContact OD2-SG 3.34Å; P109-C111 VanDerWaalsContact C-N 3.34Å; C111-C123 CarbonylContact O-C 3.41Å; C111-C123 VanDerWaalsContact O-CA 3.25Å; C111-C123 WeakPolarHBondContact O-CA 3.16Å; C111-N124 PolarHBondContact O-N 3.07Å; C111-K220 WeakPolarHBondContact CA-O 3.43Å; C111-K220 VanDerWaalsContact SG-CB 3.59Å; C111-P222 HydrophobicContact CB-CG 3.94Å
112	V	95.3	Very high	94.2	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	153	-175.3	-61.1	0	0	0	0	113.9	H99 I106 D108 W121 F122 C123 H149	H99-V112 HydrophobicContact CB-CG2 4.37Å; I106-V112 WeakPolarHBondContact O-CG1 3.1Å; D108-V112 PolarHBondContact O-N 3.28Å; V112-W121 HydrophobicContact CB-CE3 4.16Å; V112-W121 HydrophobicContact CG2-CE3 3.89Å; V112-W121 HydrophobicContact CG2-CZ3 4.17Å; V112-F122 WeakPolarHBondContact CA-O 3.47Å; V112-C123 HydrophobicContact CG1-CB 4.23Å; V112-H149 HydrophobicContact CG2-CB 4.3Å
113	V	95.6	Very high	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.7	-175.1	-176.7	0	0	0	0	109.4	W121 F122 I134 V146 V219	V113-W121 WeakPolarHBondContact O-CA 3.44Å; V113-F122 PolarHBondContact N-O 2.92Å; V113-F122 PolarHBondContact O-N 3.02Å; V113-I134 HydrophobicContact CB-CD1 4.05Å; V113-I134 HydrophobicContact CB-CG1 3.94Å; V113-I134 HydrophobicContact CG1-CD1 4.02Å; V113-I134 HydrophobicContact CG1-CG1 4.02Å; V113-I134 HydrophobicContact CG2-CG1 4.43Å; V113-V146 HydrophobicContact CG1-CB 3.51Å; V113-V146 HydrophobicContact CG1-CG1 3.88Å; V113-V146 HydrophobicContact CG1-CG2 3.74Å; V113-V219 HydrophobicContact CG2-CB 4.22Å; V113-V219 HydrophobicContact CG2-CG1 3.65Å; V113-V219 HydrophobicContact CG2-CG2 3.61Å
114	F	96.9	Very high	94.4	Very high	43 Å²	43	29.9 Å²	29.9	19%	0.189	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.6	176.3	-170.8	-121.8	0	0	0	111.3	N116 K119 W121 V146 T147	F114-N116 WeakPolarHBondContact CD1-OD1 3.36Å; F114-N116 PolarHBondContact O-N 3.23Å; F114-K119 HydrophobicContact CE1-CD 4Å; F114-K119 VanDerWaalsContact CE2-C 3.4Å; F114-K119 HydrophobicContact CE2-CB 4.32Å; F114-K119 WeakPolarHBondContact CE2-O 3.35Å; F114-K119 HydrophobicContact CZ-CB 3.92Å; F114-K119 HydrophobicContact CZ-CD 3.79Å; F114-K119 HydrophobicContact CZ-CG 4.46Å; F114-W121 HydrophobicContact CB-CD2 3.98Å; F114-W121 HydrophobicContact CB-CE3 3.89Å; F114-W121 HydrophobicContact CB-CH2 3.7Å; F114-W121 HydrophobicContact CB-CZ2 3.84Å; F114-W121 HydrophobicContact CB-CZ3 3.74Å; F114-W121 AromaticContact CD2-CD1 3.72Å; F114-W121 AromaticContact CD2-CD2 3.83Å; F114-W121 HydrophobicContact CD2-CD2 3.83Å; F114-W121 AromaticContact CD2-CE2 3.47Å; F114-W121 VanDerWaalsContact CD2-CE2 3.47Å; F114-W121 AromaticContact CD2-CG 3.98Å; F114-W121 HydrophobicContact CD2-CG 3.98Å; F114-W121 AromaticContact CD2-CZ2 3.94Å; F114-W121 HydrophobicContact CD2-CZ2 3.94Å; F114-W121 AromaticContact CD2-NE1 3.41Å; F114-W121 AromaticContact CE2-NE1 3.78Å; F114-W121 HydrophobicContact CG-CD2 4.38Å; F114-W121 HydrophobicContact CG-CH2 4.43Å; F114-W121 HydrophobicContact CG-CZ2 4.09Å; F114-V146 VanDerWaalsContact O-CA 3.24Å; F114-V146 WeakPolarHBondContact O-CA 3.24Å; F114-V146 WeakPolarHBondContact O-CB 3.46Å; F114-T147 PolarHBondContact N-O 2.74Å; F114-T147 PolarHBondContact O-N 2.79Å
115	C	95.6	Very high	94.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	111.3	170.7	-177.7	0	0	0	0	109.8	T117 T118 K119 K120 F122 H137 L138 A143	C115-T117 PolarHBondContact O-N 3.32Å; C115-T118 WeakPolarHBondContact CB-OG1 3.33Å; C115-T118 PolarHBondContact SG-OG1 3.48Å; C115-K119 WeakPolarHBondContact O-CA 3.47Å; C115-K119 PolarHBondContact O-N 3.1Å; C115-K120 WeakPolarHBondContact CB-O 3.3Å; C115-K120 PolarHBondContact N-O 3.24Å; C115-F122 HydrophobicContact CB-CD2 4.43Å; C115-F122 HydrophobicContact CB-CE2 4.29Å; C115-H137 PolarHBondContact SG-NE2 2.81Å; C115-H137 VanDerWaalsContact SG-NE2 3.43Å; C115-L138 HydrophobicContact CB-CD2 4.42Å; C115-A143 WeakPolarHBondContact SG-CB 3.45Å
116	N	94	Very high	94.2	Very high	27 Å²	27	33.4 Å²	33.4	14%	0.144	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.4	-175.7	-74.7	-30.9	0	0	0	113	F114 K119 E145 V146 T147 L158	F114-N116 WeakPolarHBondContact CD1-OD1 3.36Å; F114-N116 PolarHBondContact O-N 3.23Å; N116-K119 WeakPolarHBondContact O-CD 3.28Å; N116-K119 VanDerWaalsContact O-CE 3.26Å; N116-K119 WeakPolarHBondContact O-CE 3.4Å; N116-K119 PolarHBondContact O-NZ 3.42Å; N116-E145 HydrophobicContact CB-CB 4.02Å; N116-E145 PolarHBondContact N-O 2.88Å; N116-E145 VanDerWaalsContact N-O 3.13Å; N116-V146 VanDerWaalsContact ND2-C 3.32Å; N116-T147 VanDerWaalsContact CG-OG1 3.25Å; N116-T147 PolarHBondContact ND2-OG1 2.97Å; N116-T147 PolarHBondContact OD1-OG1 3.19Å; N116-L158 WeakPolarHBondContact ND2-CD1 3.46Å
117	T	90.4	Very high	93.8	Very high	84 Å²	84	34 Å²	34	52%	0.515	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-51.6	179.4	-49.2	0	0	0	0	111.7	C115 A143	C115-T117 PolarHBondContact O-N 3.32Å; T117-A143 HydrophobicContact CG2-CB 4.25Å; T117-A143 WeakPolarHBondContact OG1-CB 3.03Å
118	T	91.8	Very high	93.4	Very high	46 Å²	46	34.4 Å²	34.4	28%	0.282	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-6	-172.7	62.9	0	0	0	0	114.4	C115 K120 H137 A141	C115-T118 WeakPolarHBondContact CB-OG1 3.33Å; C115-T118 PolarHBondContact SG-OG1 3.48Å; T118-K120 PolarHBondContact O-N 3.15Å; T118-H137 WeakPolarHBondContact CG2-NE2 3.22Å; T118-H137 PolarHBondContact OG1-CE1 2.92Å; T118-H137 PolarHBondContact OG1-NE2 3.11Å; T118-A141 HydrophobicContact CG2-CB 3.77Å
119	K	93.5	Very high	93	Very high	134 Å²	134	33 Å²	33	58%	0.583	17%	0.172	S	C	*	.			trans	58.1	31.8	-178.2	-49.5	-55.3	-175.3	-169.3	0	114	F114 C115 N116	F114-K119 HydrophobicContact CE1-CD 4Å; F114-K119 VanDerWaalsContact CE2-C 3.4Å; F114-K119 HydrophobicContact CE2-CB 4.32Å; F114-K119 WeakPolarHBondContact CE2-O 3.35Å; F114-K119 HydrophobicContact CZ-CB 3.92Å; F114-K119 HydrophobicContact CZ-CD 3.79Å; F114-K119 HydrophobicContact CZ-CG 4.46Å; C115-K119 WeakPolarHBondContact O-CA 3.47Å; C115-K119 PolarHBondContact O-N 3.1Å; N116-K119 WeakPolarHBondContact O-CD 3.28Å; N116-K119 VanDerWaalsContact O-CE 3.26Å; N116-K119 WeakPolarHBondContact O-CE 3.4Å; N116-K119 PolarHBondContact O-NZ 3.42Å
120	K	94.7	Very high	92.5	Very high	37 Å²	37	31.8 Å²	31.8	16%	0.161	17%	0.165	C	C	.	.			trans	-117	149.4	178.5	-74.5	171.3	-178.7	167.7	0	111.6	C115 T118 F122 W245 P249	C115-K120 WeakPolarHBondContact CB-O 3.3Å; C115-K120 PolarHBondContact N-O 3.24Å; T118-K120 PolarHBondContact O-N 3.15Å; K120-F122 HydrophobicContact CB-CD2 4.42Å; K120-F122 HydrophobicContact CB-CE2 3.46Å; K120-F122 VanDerWaalsContact CB-CE2 3.46Å; K120-F122 HydrophobicContact CB-CZ 3.81Å; K120-F122 HydrophobicContact CD-CZ 4.42Å; K120-W245 HydrophobicContact CD-CD2 4.39Å; K120-W245 HydrophobicContact CD-CE3 4.37Å; K120-W245 HydrophobicContact CD-CH2 4.09Å; K120-W245 HydrophobicContact CD-CZ2 4.07Å; K120-W245 HydrophobicContact CD-CZ3 4.24Å; K120-W245 VanDerWaalsContact NZ-NE1 3.15Å; K120-P249 VanDerWaalsContact CE-O 3.25Å; K120-P249 WeakPolarHBondContact CE-O 3.12Å; K120-P249 PolarHBondContact NZ-O 3.13Å
121	W	96.4	Very high	92.3	Very high	40 Å²	40	31.2 Å²	31.2	15%	0.152	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.9	176	-69.1	90.7	0	0	0	111.7	H99 C101 A102 V112 V113 F114 H149	H99-W121 HydrophobicContact CB-CD2 3.78Å; H99-W121 HydrophobicContact CB-CE3 4.17Å; H99-W121 HydrophobicContact CB-CG 4.06Å; H99-W121 HydrophobicContact CB-CZ2 4.35Å; H99-W121 WeakPolarHBondContact O-CB 3.46Å; C101-W121 WeakPolarHBondContact CA-O 3.41Å; A102-W121 PolarHBondContact N-O 3.32Å; V112-W121 HydrophobicContact CB-CE3 4.16Å; V112-W121 HydrophobicContact CG2-CE3 3.89Å; V112-W121 HydrophobicContact CG2-CZ3 4.17Å; V113-W121 WeakPolarHBondContact O-CA 3.44Å; F114-W121 HydrophobicContact CB-CD2 3.98Å; F114-W121 HydrophobicContact CB-CE3 3.89Å; F114-W121 HydrophobicContact CB-CH2 3.7Å; F114-W121 HydrophobicContact CB-CZ2 3.84Å; F114-W121 HydrophobicContact CB-CZ3 3.74Å; F114-W121 AromaticContact CD2-CD1 3.72Å; F114-W121 AromaticContact CD2-CD2 3.83Å; F114-W121 HydrophobicContact CD2-CD2 3.83Å; F114-W121 AromaticContact CD2-CE2 3.47Å; F114-W121 VanDerWaalsContact CD2-CE2 3.47Å; F114-W121 AromaticContact CD2-CG 3.98Å; F114-W121 HydrophobicContact CD2-CG 3.98Å; F114-W121 AromaticContact CD2-CZ2 3.94Å; F114-W121 HydrophobicContact CD2-CZ2 3.94Å; F114-W121 AromaticContact CD2-NE1 3.41Å; F114-W121 AromaticContact CE2-NE1 3.78Å; F114-W121 HydrophobicContact CG-CD2 4.38Å; F114-W121 HydrophobicContact CG-CH2 4.43Å; F114-W121 HydrophobicContact CG-CZ2 4.09Å; W121-H149 HydrophobicContact CH2-CB 4.1Å; W121-H149 AromaticContact CH2-CD2 3.45Å; W121-H149 VanDerWaalsContact CH2-CD2 3.45Å; W121-H149 WeakPolarHBondContact CH2-CD2 3.35Å; W121-H149 HydrophobicContact CZ3-CB 3.83Å; W121-H149 AromaticContact CZ3-CD2 3.64Å
122	F	96.8	Very high	92.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.1	177.1	-59.8	-93.1	0	0	0	111.2	A102 Y103 V112 V113 C115 K120 I134 H137 W245	A102-F122 HydrophobicContact CB-CE1 3.97Å; A102-F122 HydrophobicContact CB-CZ 4.15Å; Y103-F122 HydrophobicContact CD1-CD1 4.42Å; Y103-F122 AromaticContact CD1-CE1 3.91Å; Y103-F122 HydrophobicContact CD1-CE1 3.91Å; Y103-F122 HydrophobicContact CD2-CD1 4.02Å; Y103-F122 HydrophobicContact CD2-CE1 4.22Å; Y103-F122 HydrophobicContact CE1-CD1 4.49Å; Y103-F122 AromaticContact CE1-CE1 3.75Å; Y103-F122 HydrophobicContact CE1-CE1 3.75Å; Y103-F122 HydrophobicContact CE2-CD1 4.03Å; Y103-F122 HydrophobicContact CE2-CE1 4.01Å; Y103-F122 HydrophobicContact CG-CD1 4.19Å; Y103-F122 HydrophobicContact CG-CE1 4.14Å; Y103-F122 AromaticContact CZ-CE1 3.78Å; V112-F122 WeakPolarHBondContact CA-O 3.47Å; V113-F122 PolarHBondContact N-O 2.92Å; V113-F122 PolarHBondContact O-N 3.02Å; C115-F122 HydrophobicContact CB-CD2 4.43Å; C115-F122 HydrophobicContact CB-CE2 4.29Å; K120-F122 HydrophobicContact CB-CD2 4.42Å; K120-F122 HydrophobicContact CB-CE2 3.46Å; K120-F122 VanDerWaalsContact CB-CE2 3.46Å; K120-F122 HydrophobicContact CB-CZ 3.81Å; K120-F122 HydrophobicContact CD-CZ 4.42Å; F122-I134 HydrophobicContact CB-CB 3.73Å; F122-I134 HydrophobicContact CB-CD1 3.91Å; F122-I134 HydrophobicContact CB-CG1 4.4Å; F122-I134 HydrophobicContact CD2-CD1 4.04Å; F122-I134 HydrophobicContact CG-CD1 4.33Å; F122-H137 HydrophobicContact CD1-CB 3.94Å; F122-H137 HydrophobicContact CD2-CB 4.17Å; F122-H137 AromaticContact CD2-CD2 3.63Å; F122-H137 AromaticContact CD2-CG 3.94Å; F122-H137 HydrophobicContact CE1-CB 3.77Å; F122-H137 AromaticContact CE1-CG 3.74Å; F122-H137 HydrophobicContact CE2-CB 4.03Å; F122-H137 AromaticContact CE2-CD2 3.07Å; F122-H137 WeakPolarHBondContact CE2-CD2 3.46Å; F122-H137 AromaticContact CE2-CE1 3.9Å; F122-H137 AromaticContact CE2-CG 3.38Å; F122-H137 AromaticContact CE2-ND1 3.89Å; F122-H137 AromaticContact CE2-NE2 3.44Å; F122-H137 WeakPolarHBondContact CE2-NE2 3.33Å; F122-H137 HydrophobicContact CG-CB 4.14Å; F122-H137 HydrophobicContact CZ-CB 3.84Å; F122-H137 AromaticContact CZ-CD2 3.47Å; F122-H137 VanDerWaalsContact CZ-CD2 3.47Å; F122-H137 WeakPolarHBondContact CZ-CD2 3.4Å; F122-H137 AromaticContact CZ-CE1 3.69Å; F122-H137 AromaticContact CZ-CG 3.26Å; F122-H137 AromaticContact CZ-ND1 3.43Å; F122-H137 WeakPolarHBondContact CZ-ND1 3.01Å; F122-H137 AromaticContact CZ-NE2 3.73Å; F122-W245 AromaticContact CE1-CH2 3.82Å; F122-W245 HydrophobicContact CE1-CH2 3.82Å; F122-W245 AromaticContact CE1-CZ3 3.96Å; F122-W245 HydrophobicContact CE1-CZ3 3.96Å; F122-W245 AromaticContact CZ-CH2 3.81Å; F122-W245 HydrophobicContact CZ-CH2 3.81Å; F122-W245 AromaticContact CZ-CZ3 3.73Å; F122-W245 HydrophobicContact CZ-CZ3 3.73Å
123	C	96.1	Very high	92.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	159.5	177.1	72.5	0	0	0	0	112.4	C101 I106 C111 V112 G125 H133 I134 P222	C101-C123 HydrophobicContact CB-CB 3.86Å; C101-C123 PolarHBondContact SG-N 3.47Å; C101-C123 VanDerWaalsContact SG-SG 3.63Å; I106-C123 HydrophobicContact CB-CB 4.02Å; I106-C123 HydrophobicContact CG2-CB 3.84Å; C111-C123 CarbonylContact O-C 3.41Å; C111-C123 VanDerWaalsContact O-CA 3.25Å; C111-C123 WeakPolarHBondContact O-CA 3.16Å; V112-C123 HydrophobicContact CG1-CB 4.23Å; C123-G125 PolarHBondContact O-N 3.12Å; C123-H133 PolarHBondContact O-N 2.83Å; C123-I134 PolarHBondContact O-N 3.31Å; C123-I134 VanDerWaalsContact O-N 3.08Å; C123-P222 HydrophobicContact CB-CG 4.34Å
124	N	95.7	Very high	92.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-85.5	13.7	170.8	-159.6	31.7	0	0	0	113	C111 S132 Q213 F214 V219	C111-N124 PolarHBondContact O-N 3.07Å; N124-S132 VanDerWaalsContact O-CB 3.23Å; N124-S132 WeakPolarHBondContact O-CB 3.32Å; N124-S132 WeakPolarHBondContact OD1-CB 3.31Å; N124-S132 PolarHBondContact OD1-OG 3.23Å; N124-Q213 PolarHBondContact O-NE2 3.15Å; N124-Q213 WeakPolarHBondContact OD1-CG 3.3Å; N124-F214 PolarHBondContact ND2-O 3.11Å; N124-F214 PolarHBondContact OD1-N 2.87Å; N124-V219 HydrophobicContact CB-CB 4.13Å; N124-V219 HydrophobicContact CB-CG1 3.68Å; N124-V219 PolarHBondContact ND2-O 2.78Å
125	G	93.3	Very high	92	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.			trans	-81.8	152.7	170.9	0	0	0	0	0	112.5	C123 S132 H133	C123-G125 PolarHBondContact O-N 3.12Å; G125-S132 CarbonylContact O-C 3.57Å; G125-S132 WeakPolarHBondContact O-CA 3.33Å; G125-S132 WeakPolarHBondContact O-CB 3.29Å; G125-H133 PolarHBondContact O-N 3.31Å
126	R	89	Confident	91.9	Very high	89 Å²	89	29.2 Å²	29.2	34%	0.336	15%	0.151	S	C	.	.			trans	-91.1	-25.5	-176.1	-71.7	-166.9	173.9	143.3	-1.2	115	N128 T129 G131 G211	R126-N128 PolarHBondContact O-N 3.17Å; R126-T129 PolarHBondContact O-N 2.86Å; R126-T129 VanDerWaalsContact O-N 3.13Å; R126-T129 PolarHBondContact O-OG1 3.5Å; R126-G131 WeakPolarHBondContact CA-O 3.39Å; R126-G211 PolarHBondContact NH2-O 3.2Å
127	G	86	Confident	91.9	Very high	24 Å²	24	28 Å²	28	25%	0.247	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	-138.4	-167.3	0	0	0	0	0	112.1	T129	G127-T129 PolarHBondContact O-N 3.03Å
128	N	84.8	Confident	92	Very high	97 Å²	97	24 Å²	24	52%	0.519	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	33.7	178	-59.2	-55.4	0	0	0	113.1	R126 Q232	R126-N128 PolarHBondContact O-N 3.17Å; N128-Q232 PolarHBondContact ND2-OE1 2.72Å
129	T	85.7	Confident	91.8	Very high	15 Å²	15	21.9 Å²	21.9	9%	0.092	11%	0.107	C	C	.	.	S	Bend	trans	-133.1	163.2	-173.2	81.2	0	0	0	0	113.1	R126 G127 G131 N136 A235 I238	R126-T129 PolarHBondContact O-N 2.86Å; R126-T129 VanDerWaalsContact O-N 3.13Å; R126-T129 PolarHBondContact O-OG1 3.5Å; G127-T129 PolarHBondContact O-N 3.03Å; T129-G131 VanDerWaalsContact C-N 3.26Å; T129-G131 PolarHBondContact O-N 3.16Å; T129-G131 PolarHBondContact OG1-O 2.92Å; T129-N136 PolarHBondContact OG1-ND2 2.87Å; T129-A235 HydrophobicContact CG2-CB 4.39Å; T129-I238 HydrophobicContact CG2-CD1 3.88Å
130	S	82.5	Confident	91.5	Very high	16 Å²	16	16.4 Å²	16.4	11%	0.112	8%	0.083	C	C	.	.	S	Bend	trans	-78.9	0.2	-173	77.6	0	0	0	0	115.7	L17 Q825	L17-S130 WeakPolarHBondContact CB-OG 3.46Å; L17-S130 WeakPolarHBondContact CD1-OG 3.28Å; L17-S130 VanDerWaalsContact CG-OG 3.32Å; L17-S130 WeakPolarHBondContact CG-OG 3.46Å; S130-Q825 PolarHBondContact O-NE2 2.89Å
131	G	88.6	Confident	91.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	-154.3	166.6	-174.1	0	0	0	0	0	110.1	R126 T129 N136 R212	R126-G131 WeakPolarHBondContact CA-O 3.39Å; T129-G131 VanDerWaalsContact C-N 3.26Å; T129-G131 PolarHBondContact O-N 3.16Å; T129-G131 PolarHBondContact OG1-O 2.92Å; G131-N136 PolarHBondContact O-ND2 3.41Å; G131-R212 CarbonylContact C-O 3.59Å; G131-R212 WeakPolarHBondContact CA-O 3.16Å
132	S	93.9	Very high	90.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.097	C	C	.	.			trans	-72.6	154.1	-179.4	63.5	0	0	0	0	112.5	N124 G125 I134 I135 N136 R212	N124-S132 VanDerWaalsContact O-CB 3.23Å; N124-S132 WeakPolarHBondContact O-CB 3.32Å; N124-S132 WeakPolarHBondContact OD1-CB 3.31Å; N124-S132 PolarHBondContact OD1-OG 3.23Å; G125-S132 CarbonylContact O-C 3.57Å; G125-S132 WeakPolarHBondContact O-CA 3.33Å; G125-S132 WeakPolarHBondContact O-CB 3.29Å; S132-I134 VanDerWaalsContact C-N 3.28Å; S132-I134 PolarHBondContact O-N 3.3Å; S132-I134 WeakPolarHBondContact OG-CG2 3.4Å; S132-I135 PolarHBondContact O-N 3.33Å; S132-I135 WeakPolarHBondContact OG-CG1 3.38Å; S132-N136 PolarHBondContact O-N 2.88Å; S132-N136 PolarHBondContact O-ND2 3.44Å; S132-R212 PolarHBondContact N-O 2.85Å; S132-R212 PolarHBondContact OG-O 3.09Å
133	H	94.8	Very high	90	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-55.1	-42.4	-177.1	-70.4	176	0	0	0	112.3	Y103 C104 C123 G125 N136 H137	Y103-H133 HydrophobicContact CD2-CB 3.62Å; Y103-H133 AromaticContact CD2-CG 3.74Å; Y103-H133 HydrophobicContact CE2-CB 4.28Å; Y103-H133 WeakPolarHBondContact CE2-O 3.19Å; C104-H133 PolarHBondContact SG-CE1 2.97Å; C104-H133 PolarHBondContact SG-ND1 2.95Å; C123-H133 PolarHBondContact O-N 2.83Å; G125-H133 PolarHBondContact O-N 3.31Å; H133-N136 PolarHBondContact O-N 3.1Å; H133-H137 WeakPolarHBondContact O-CB 3.19Å; H133-H137 PolarHBondContact O-N 3.45Å
134	I	95.5	Very high	89.7	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60	-47	172.1	-176.2	63.9	0	0	0	112.4	V113 F122 C123 S132 N136 H137 L138 V146 F214	V113-I134 HydrophobicContact CB-CD1 4.05Å; V113-I134 HydrophobicContact CB-CG1 3.94Å; V113-I134 HydrophobicContact CG1-CD1 4.02Å; V113-I134 HydrophobicContact CG1-CG1 4.02Å; V113-I134 HydrophobicContact CG2-CG1 4.43Å; F122-I134 HydrophobicContact CB-CB 3.73Å; F122-I134 HydrophobicContact CB-CD1 3.91Å; F122-I134 HydrophobicContact CB-CG1 4.4Å; F122-I134 HydrophobicContact CD2-CD1 4.04Å; F122-I134 HydrophobicContact CG-CD1 4.33Å; C123-I134 PolarHBondContact O-N 3.31Å; C123-I134 VanDerWaalsContact O-N 3.08Å; S132-I134 VanDerWaalsContact C-N 3.28Å; S132-I134 PolarHBondContact O-N 3.3Å; S132-I134 WeakPolarHBondContact OG-CG2 3.4Å; I134-N136 PolarHBondContact O-N 3.43Å; I134-H137 PolarHBondContact O-N 2.8Å; I134-L138 HydrophobicContact CD1-CD1 4.25Å; I134-L138 HydrophobicContact CD1-CD2 4.13Å; I134-L138 HydrophobicContact CD1-CG 3.96Å; I134-L138 HydrophobicContact CG1-CD1 4.03Å; I134-L138 HydrophobicContact CG1-CG 4.16Å; I134-L138 VanDerWaalsContact O-CG 3.29Å; I134-L138 WeakPolarHBondContact O-CG 3.26Å; I134-L138 PolarHBondContact O-N 3.41Å; I134-V146 HydrophobicContact CD1-CG1 4.26Å; I134-F214 HydrophobicContact CG1-CD2 4.41Å; I134-F214 HydrophobicContact CG1-CE2 3.82Å; I134-F214 HydrophobicContact CG2-CD2 3.75Å; I134-F214 HydrophobicContact CG2-CE2 3.97Å
135	I	93.6	Very high	89.7	Confident	1 Å²	1	25 Å²	25	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-68.9	-37.8	-179.1	-60	-53.4	0	0	0	111.8	S132 H137 L138 V139 I209 R212 F214 I734	S132-I135 PolarHBondContact O-N 3.33Å; S132-I135 WeakPolarHBondContact OG-CG1 3.38Å; I135-H137 VanDerWaalsContact C-N 3.28Å; I135-H137 PolarHBondContact O-N 3.05Å; I135-L138 HydrophobicContact CD1-CD1 4.27Å; I135-V139 HydrophobicContact CG2-CG2 4.43Å; I135-V139 VanDerWaalsContact O-CG2 3.29Å; I135-V139 WeakPolarHBondContact O-CG2 3.31Å; I135-V139 PolarHBondContact O-N 2.71Å; I135-I209 HydrophobicContact CD1-CD1 3.68Å; I135-I209 HydrophobicContact CD1-CG1 3.88Å; I135-I209 HydrophobicContact CD1-CG2 4.01Å; I135-I209 HydrophobicContact CG1-CG2 4.22Å; I135-R212 HydrophobicContact CG2-CB 3.98Å; I135-R212 HydrophobicContact CG2-CG 4.28Å; I135-F214 HydrophobicContact CD1-CD2 3.82Å; I135-F214 HydrophobicContact CD1-CE2 3.55Å; I135-F214 HydrophobicContact CD1-CZ 4.05Å; I135-F214 HydrophobicContact CG1-CD2 4.5Å; I135-I734 HydrophobicContact CG2-CD1 4.01Å
136	N	91.9	Very high	89.8	Confident	1 Å²	1	25 Å²	25	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-59.5	-41.9	172.6	-66.9	-27.7	0	0	0	110.8	Y103 T129 G131 S132 H133 I134 R140	Y103-N136 HydrophobicContact CE2-CB 4.39Å; T129-N136 PolarHBondContact OG1-ND2 2.87Å; G131-N136 PolarHBondContact O-ND2 3.41Å; S132-N136 PolarHBondContact O-N 2.88Å; S132-N136 PolarHBondContact O-ND2 3.44Å; H133-N136 PolarHBondContact O-N 3.1Å; I134-N136 PolarHBondContact O-N 3.43Å; N136-R140 VanDerWaalsContact O-CD 3.23Å; N136-R140 WeakPolarHBondContact O-CD 3.46Å; N136-R140 WeakPolarHBondContact O-CG 3.14Å; N136-R140 PolarHBondContact O-N 2.69Å
137	H	94.1	Very high	90.1	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-67.1	-52.1	177.2	176.9	60.3	0	0	0	113.2	Y103 C115 T118 F122 H133 I134 I135 V139 R140 A141 E242 W245	Y103-H137 HydrophobicContact CE2-CB 4.34Å; C115-H137 PolarHBondContact SG-NE2 2.81Å; C115-H137 VanDerWaalsContact SG-NE2 3.43Å; T118-H137 WeakPolarHBondContact CG2-NE2 3.22Å; T118-H137 PolarHBondContact OG1-CE1 2.92Å; T118-H137 PolarHBondContact OG1-NE2 3.11Å; F122-H137 HydrophobicContact CD1-CB 3.94Å; F122-H137 HydrophobicContact CD2-CB 4.17Å; F122-H137 AromaticContact CD2-CD2 3.63Å; F122-H137 AromaticContact CD2-CG 3.94Å; F122-H137 HydrophobicContact CE1-CB 3.77Å; F122-H137 AromaticContact CE1-CG 3.74Å; F122-H137 HydrophobicContact CE2-CB 4.03Å; F122-H137 AromaticContact CE2-CD2 3.07Å; F122-H137 WeakPolarHBondContact CE2-CD2 3.46Å; F122-H137 AromaticContact CE2-CE1 3.9Å; F122-H137 AromaticContact CE2-CG 3.38Å; F122-H137 AromaticContact CE2-ND1 3.89Å; F122-H137 AromaticContact CE2-NE2 3.44Å; F122-H137 WeakPolarHBondContact CE2-NE2 3.33Å; F122-H137 HydrophobicContact CG-CB 4.14Å; F122-H137 HydrophobicContact CZ-CB 3.84Å; F122-H137 AromaticContact CZ-CD2 3.47Å; F122-H137 VanDerWaalsContact CZ-CD2 3.47Å; F122-H137 WeakPolarHBondContact CZ-CD2 3.4Å; F122-H137 AromaticContact CZ-CE1 3.69Å; F122-H137 AromaticContact CZ-CG 3.26Å; F122-H137 AromaticContact CZ-ND1 3.43Å; F122-H137 WeakPolarHBondContact CZ-ND1 3.01Å; F122-H137 AromaticContact CZ-NE2 3.73Å; H133-H137 WeakPolarHBondContact O-CB 3.19Å; H133-H137 PolarHBondContact O-N 3.45Å; I134-H137 PolarHBondContact O-N 2.8Å; I135-H137 VanDerWaalsContact C-N 3.28Å; I135-H137 PolarHBondContact O-N 3.05Å; H137-V139 PolarHBondContact O-N 2.88Å; H137-R140 PolarHBondContact O-N 3.01Å; H137-A141 VanDerWaalsContact CE1-CB 3.41Å; H137-A141 WeakPolarHBondContact CE1-CB 3.45Å; H137-A141 PolarHBondContact O-N 3.49Å; H137-E242 VanDerWaalsContact CA-OE1 3.3Å; H137-E242 WeakPolarHBondContact CA-OE1 3.39Å; H137-E242 IonicContact CE1-OE1 3.83Å; H137-E242 IonicContact CE1-OE2 3.23Å; H137-E242 IonicContact CG-OE1 2.95Å; H137-E242 IonicContact ND1-OE1 3.98Å; H137-E242 PolarHBondContact ND1-OE1 2.91Å; H137-E242 IonicContact ND1-OE2 2.68Å; H137-E242 PolarHBondContact ND1-OE2 3.1Å; H137-W245 AromaticContact ND1-CZ3 3.97Å
138	L	93.1	Very high	90.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-56.3	-37.6	-177	-69.2	-179	0	0	0	112.5	C115 I134 I135 R142 A143 V146 V169 F170 F214	C115-L138 HydrophobicContact CB-CD2 4.42Å; I134-L138 HydrophobicContact CD1-CD1 4.25Å; I134-L138 HydrophobicContact CD1-CD2 4.13Å; I134-L138 HydrophobicContact CD1-CG 3.96Å; I134-L138 HydrophobicContact CG1-CD1 4.03Å; I134-L138 HydrophobicContact CG1-CG 4.16Å; I134-L138 VanDerWaalsContact O-CG 3.29Å; I134-L138 WeakPolarHBondContact O-CG 3.26Å; I134-L138 PolarHBondContact O-N 3.41Å; I135-L138 HydrophobicContact CD1-CD1 4.27Å; L138-R142 CarbonylContact O-C 3.04Å; L138-R142 WeakPolarHBondContact O-CA 3.32Å; L138-R142 PolarHBondContact O-N 3.04Å; L138-A143 WeakPolarHBondContact CB-O 3.42Å; L138-A143 HydrophobicContact CD2-CB 3.76Å; L138-A143 WeakPolarHBondContact CD2-O 3.22Å; L138-A143 PolarHBondContact O-N 2.93Å; L138-V146 HydrophobicContact CD1-CG1 3.69Å; L138-V146 HydrophobicContact CD2-CG1 3.68Å; L138-V146 HydrophobicContact CG-CG1 4.26Å; L138-V169 HydrophobicContact CD1-CG2 3.89Å; L138-F170 HydrophobicContact CB-CE2 4.28Å; L138-F170 HydrophobicContact CB-CZ 3.72Å; L138-F214 HydrophobicContact CD1-CE2 4.16Å; L138-F214 HydrophobicContact CD1-CZ 4.14Å
139	V	88.7	Confident	91	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.018	8%	0.082	C	C	.	.	H	α-helix	trans	-69.9	-39.3	177.9	176.9	0	0	0	0	112.2	F19 I135 H137 F170 G738 V739	F19-V139 HydrophobicContact CD1-CG1 4.06Å; F19-V139 HydrophobicContact CE1-CB 4.24Å; F19-V139 HydrophobicContact CE1-CG1 3.73Å; I135-V139 HydrophobicContact CG2-CG2 4.43Å; I135-V139 VanDerWaalsContact O-CG2 3.29Å; I135-V139 WeakPolarHBondContact O-CG2 3.31Å; I135-V139 PolarHBondContact O-N 2.71Å; H137-V139 PolarHBondContact O-N 2.88Å; V139-F170 HydrophobicContact CG2-CE1 3.89Å; V139-F170 HydrophobicContact CG2-CZ 3.73Å; V139-G738 VanDerWaalsContact CG2-O 3.28Å; V139-G738 WeakPolarHBondContact CG2-O 3.43Å; V139-V739 HydrophobicContact CG1-CB 4.36Å; V139-V739 HydrophobicContact CG1-CG1 3.73Å
140	R	85.7	Confident	91.3	Very high	19 Å²	19	22 Å²	22	7%	0.072	10%	0.104	C	C	.	.	H	α-helix	trans	-79.2	-48.2	-175.3	-67	171	-175	-82.2	17.8	112.9	D21 N136 H137 R142 N239 E242	D21-R140 WeakPolarHBondContact OD2-CG 3.34Å; D21-R140 IonicContact OD2-NH1 3.88Å; N136-R140 VanDerWaalsContact O-CD 3.23Å; N136-R140 WeakPolarHBondContact O-CD 3.46Å; N136-R140 WeakPolarHBondContact O-CG 3.14Å; N136-R140 PolarHBondContact O-N 2.69Å; H137-R140 PolarHBondContact O-N 3.01Å; R140-R142 PolarHBondContact O-N 2.75Å; R140-R142 VanDerWaalsContact O-N 3.14Å; R140-N239 PolarHBondContact NH1-OD1 2.8Å; R140-N239 PolarHBondContact NH2-OD1 3.47Å; R140-E242 HydrophobicContact CB-CG 4.18Å
141	A	86.5	Confident	91.6	Very high	32 Å²	32	26.4 Å²	26.4	26%	0.264	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	4.1	173.7	0	0	0	0	0	113.2	T118 H137 A143	T118-A141 HydrophobicContact CG2-CB 3.77Å; H137-A141 VanDerWaalsContact CE1-CB 3.41Å; H137-A141 WeakPolarHBondContact CE1-CB 3.45Å; H137-A141 PolarHBondContact O-N 3.49Å; A141-A143 HydrophobicContact CB-CB 4.36Å; A141-A143 PolarHBondContact O-N 3.11Å
142	R	80.9	Confident	91.4	Very high	91 Å²	91	27 Å²	27	34%	0.343	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	26.1	-172.9	-56.3	-174.2	-175.2	176.2	4.6	113.6	E23 N25 L138 R140	E23-R142 PolarHBondContact O-NH2 3.37Å; N25-R142 PolarHBondContact ND2-NH1 3.24Å; N25-R142 VanDerWaalsContact ND2-NH1 3.15Å; N25-R142 PolarHBondContact OD1-NH2 2.83Å; L138-R142 CarbonylContact O-C 3.04Å; L138-R142 WeakPolarHBondContact O-CA 3.32Å; L138-R142 PolarHBondContact O-N 3.04Å; R140-R142 PolarHBondContact O-N 2.75Å; R140-R142 VanDerWaalsContact O-N 3.14Å
143	A	89.7	Confident	90.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.			trans	-80.5	124.6	-176.2	0	0	0	0	0	110.1	C115 T117 L138 A141	C115-A143 WeakPolarHBondContact SG-CB 3.45Å; T117-A143 HydrophobicContact CG2-CB 4.25Å; T117-A143 WeakPolarHBondContact OG1-CB 3.03Å; L138-A143 WeakPolarHBondContact CB-O 3.42Å; L138-A143 HydrophobicContact CD2-CB 3.76Å; L138-A143 WeakPolarHBondContact CD2-O 3.22Å; L138-A143 PolarHBondContact O-N 2.93Å; A141-A143 HydrophobicContact CB-CB 4.36Å; A141-A143 PolarHBondContact O-N 3.11Å
144	K	90.7	Very high	90.4	Very high	61 Å²	61	33.9 Å²	33.9	27%	0.265	17%	0.173	S	C	.	.			trans	-104.6	-12.3	-171.9	-61.4	170.1	-168.6	173	0	113	N168 V169 E331	K144-N168 HydrophobicContact CB-CB 4.29Å; K144-N168 WeakPolarHBondContact O-CA 3.45Å; K144-V169 PolarHBondContact O-N 3.32Å; K144-E331 IonicContact NZ-OE1 2.86Å; K144-E331 PolarHBondContact NZ-OE1 3.49Å
145	E	93.9	Very high	90	Very high	73 Å²	73	41 Å²	41	34%	0.341	20%	0.204	S	C	.	.			trans	-121.3	138.4	-170.8	-52.7	-165.9	176.4	0	0	113.1	N116 K167	N116-E145 HydrophobicContact CB-CB 4.02Å; N116-E145 PolarHBondContact N-O 2.88Å; N116-E145 VanDerWaalsContact N-O 3.13Å; E145-K167 HydrophobicContact CB-CB 4.33Å; E145-K167 VanDerWaalsContact CD-CD 3.47Å; E145-K167 HydrophobicContact CG-CB 3.6Å; E145-K167 HydrophobicContact CG-CD 4.44Å; E145-K167 WeakPolarHBondContact OE1-CD 3.38Å; E145-K167 WeakPolarHBondContact OE2-CD 3.31Å
146	V	95.9	Very high	89.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	158.1	175.6	-55	0	0	0	0	113.6	V113 F114 N116 I134 L138 L159 V169 F214	V113-V146 HydrophobicContact CG1-CB 3.51Å; V113-V146 HydrophobicContact CG1-CG1 3.88Å; V113-V146 HydrophobicContact CG1-CG2 3.74Å; F114-V146 VanDerWaalsContact O-CA 3.24Å; F114-V146 WeakPolarHBondContact O-CA 3.24Å; F114-V146 WeakPolarHBondContact O-CB 3.46Å; N116-V146 VanDerWaalsContact ND2-C 3.32Å; I134-V146 HydrophobicContact CD1-CG1 4.26Å; L138-V146 HydrophobicContact CD1-CG1 3.69Å; L138-V146 HydrophobicContact CD2-CG1 3.68Å; L138-V146 HydrophobicContact CG-CG1 4.26Å; V146-L159 HydrophobicContact CG2-CB 4.43Å; V146-L159 HydrophobicContact CG2-CD1 3.55Å; V146-L159 HydrophobicContact CG2-CG 4.03Å; V146-L159 PolarHBondContact O-N 3.45Å; V146-V169 HydrophobicContact CG2-CG1 3.84Å; V146-F214 HydrophobicContact CG2-CZ 4.01Å
147	T	95.4	Very high	89.5	Confident	18 Å²	18	49.3 Å²	49.3	11%	0.11	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.8	172.7	-48.7	0	0	0	0	109.8	F114 N116 D156	F114-T147 PolarHBondContact N-O 2.74Å; F114-T147 PolarHBondContact O-N 2.79Å; N116-T147 VanDerWaalsContact CG-OG1 3.25Å; N116-T147 PolarHBondContact ND2-OG1 2.97Å; N116-T147 PolarHBondContact OD1-OG1 3.19Å; T147-D156 WeakPolarHBondContact CG2-OD1 3.41Å
148	L	94.9	Very high	89.4	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	155.7	177.5	-61.7	-175.6	0	0	0	111.6	L154 K155 T157 L159 L218 V219	L148-L154 HydrophobicContact CD1-CB 3.88Å; L148-L154 HydrophobicContact CD1-CD1 3.99Å; L148-L154 HydrophobicContact CD1-CG 4.49Å; L148-K155 VanDerWaalsContact CB-O 3.29Å; L148-K155 WeakPolarHBondContact CB-O 3.49Å; L148-T157 PolarHBondContact N-O 2.67Å; L148-L159 HydrophobicContact CD1-CD2 4.05Å; L148-L159 HydrophobicContact CD2-CD1 4.46Å; L148-L159 HydrophobicContact CG-CD2 4.12Å; L148-L159 HydrophobicContact CG-CG 4.5Å; L148-L218 HydrophobicContact CD1-CD1 4.31Å; L148-L218 HydrophobicContact CD1-CG 4.37Å; L148-V219 HydrophobicContact CD2-CG2 3.64Å
149	H	94.6	Very high	89.5	Confident	8 Å²	8	52 Å²	52	4%	0.037	26%	0.264	C	S	.	.			trans	-70.4	140.5	179.7	-169.3	-94.7	0	0	0	112.3	H99 P109 V112 W121 D151 G152 K155	H99-H149 AromaticContact CG-NE2 3.66Å; H99-H149 AromaticContact ND1-NE2 3.79Å; P109-H149 WeakPolarHBondContact CB-ND1 3.26Å; P109-H149 WeakPolarHBondContact O-CB 3.47Å; V112-H149 HydrophobicContact CG2-CB 4.3Å; W121-H149 HydrophobicContact CH2-CB 4.1Å; W121-H149 AromaticContact CH2-CD2 3.45Å; W121-H149 VanDerWaalsContact CH2-CD2 3.45Å; W121-H149 WeakPolarHBondContact CH2-CD2 3.35Å; W121-H149 HydrophobicContact CZ3-CB 3.83Å; W121-H149 AromaticContact CZ3-CD2 3.64Å; H149-D151 IonicContact CE1-OD2 2.63Å; H149-D151 PolarHBondContact CE1-OD2 2.86Å; H149-D151 PolarHBondContact ND1-N 3.39Å; H149-D151 IonicContact ND1-OD2 3.64Å; H149-D151 PolarHBondContact O-N 3.48Å; H149-D151 VanDerWaalsContact O-N 3.14Å; H149-G152 WeakPolarHBondContact O-CA 3.42Å; H149-G152 PolarHBondContact O-N 2.88Å; H149-K155 CarbonylContact O-C 3.54Å; H149-K155 VanDerWaalsContact O-C 3.22Å; H149-K155 WeakPolarHBondContact O-CA 3.46Å
150	K	91.5	Very high	89.7	Confident	128 Å²	128	55.9 Å²	55.9	56%	0.557	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-34.9	-178.4	72.7	-163.8	177.6	-173.5	0	115.1	K155 D156	K150-K155 WeakPolarHBondContact O-CA 3.2Å; K150-K155 WeakPolarHBondContact O-CB 3.31Å; K150-D156 HydrophobicContact CB-CB 4.06Å
151	D	89.9	Confident	90	Very high	109 Å²	109	55 Å²	55	58%	0.583	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	6.9	178.5	-51.1	-62	0	0	0	112.8	P109 H149	P109-D151 HydrophobicContact CB-CB 4.11Å; H149-D151 IonicContact CE1-OD2 2.63Å; H149-D151 PolarHBondContact CE1-OD2 2.86Å; H149-D151 PolarHBondContact ND1-N 3.39Å; H149-D151 IonicContact ND1-OD2 3.64Å; H149-D151 PolarHBondContact O-N 3.48Å; H149-D151 VanDerWaalsContact O-N 3.14Å
152	G	84.4	Confident	90.1	Very high	11 Å²	11	61.4 Å²	61.4	11%	0.113	30%	0.298	C	S	.	.	S	Bend	trans	-79.2	174.3	175.6	0	0	0	0	0	113.3	H149 L154 K155	H149-G152 WeakPolarHBondContact O-CA 3.42Å; H149-G152 PolarHBondContact O-N 2.88Å; G152-L154 PolarHBondContact O-N 2.87Å; G152-K155 PolarHBondContact O-N 2.72Å
153	P	82.2	Confident	90.3	Very high	74 Å²	74	60.1 Å²	60.1	48%	0.481	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.7	-171.3	-26.5	35.2	0	0	0	115.7
154	L	84.9	Confident	90.2	Very high	74 Å²	74	63.5 Å²	63.5	39%	0.387	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	13.2	-179.1	-60	172.4	0	0	0	112.6	L148 G152 T157 W217 L218	L148-L154 HydrophobicContact CD1-CB 3.88Å; L148-L154 HydrophobicContact CD1-CD1 3.99Å; L148-L154 HydrophobicContact CD1-CG 4.49Å; G152-L154 PolarHBondContact O-N 2.87Å; L154-T157 PolarHBondContact O-OG1 3.01Å; L154-W217 HydrophobicContact CD1-CE3 4.46Å; L154-W217 HydrophobicContact CD1-CZ3 4.03Å; L154-L218 HydrophobicContact CD1-CD1 3.68Å
155	K	86.8	Confident	90.2	Very high	150 Å²	150	62.4 Å²	62.4	65%	0.652	33%	0.329	S	S	*	.			trans	55.2	-161.2	-175.3	-49.9	-177	-179.4	-178.2	0	113.4	L148 H149 K150 G152 T157	L148-K155 VanDerWaalsContact CB-O 3.29Å; L148-K155 WeakPolarHBondContact CB-O 3.49Å; H149-K155 CarbonylContact O-C 3.54Å; H149-K155 VanDerWaalsContact O-C 3.22Å; H149-K155 WeakPolarHBondContact O-CA 3.46Å; K150-K155 WeakPolarHBondContact O-CA 3.2Å; K150-K155 WeakPolarHBondContact O-CB 3.31Å; G152-K155 PolarHBondContact O-N 2.72Å; K155-T157 PolarHBondContact O-N 3.32Å
156	D	87.1	Confident	89.9	Confident	115 Å²	115	60.6 Å²	60.6	62%	0.615	32%	0.324	S	S	*	.	S	Bend	trans	-70.2	68.5	179.8	-163.5	6.8	0	0	0	111.3	T147 K150	T147-D156 WeakPolarHBondContact CG2-OD1 3.41Å; K150-D156 HydrophobicContact CB-CB 4.06Å
157	T	89.4	Confident	89.8	Confident	61 Å²	61	63.9 Å²	63.9	37%	0.374	34%	0.338	S	S	.	.			trans	-105.9	123.7	-177.8	-67.1	0	0	0	0	110.1	L148 L154 K155	L148-T157 PolarHBondContact N-O 2.67Å; L154-T157 PolarHBondContact O-OG1 3.01Å; K155-T157 PolarHBondContact O-N 3.32Å
158	L	91.7	Very high	89.6	Confident	55 Å²	55	63.6 Å²	63.6	29%	0.288	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-74.1	131.9	168.4	-178.5	65.1	0	0	0	109.7	N116 E160 K167	N116-L158 WeakPolarHBondContact ND2-CD1 3.46Å; L158-E160 PolarHBondContact O-N 3.29Å; L158-K167 HydrophobicContact CD2-CD 4.12Å
159	L	93.8	Very high	89.5	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	34%	0.335	C	S	.	.			trans	-86	106.7	-179.6	-58.8	-172.7	0	0	0	111.2	V146 L148 V169 L172 L185 I208 F214 L218	V146-L159 HydrophobicContact CG2-CB 4.43Å; V146-L159 HydrophobicContact CG2-CD1 3.55Å; V146-L159 HydrophobicContact CG2-CG 4.03Å; V146-L159 PolarHBondContact O-N 3.45Å; L148-L159 HydrophobicContact CD1-CD2 4.05Å; L148-L159 HydrophobicContact CD2-CD1 4.46Å; L148-L159 HydrophobicContact CG-CD2 4.12Å; L148-L159 HydrophobicContact CG-CG 4.5Å; L159-V169 HydrophobicContact CB-CG1 4.27Å; L159-V169 HydrophobicContact CD1-CG1 4.28Å; L159-L172 HydrophobicContact CB-CD1 4.07Å; L159-L185 HydrophobicContact CD2-CD1 4.19Å; L159-I208 HydrophobicContact CD1-CD1 3.99Å; L159-F214 HydrophobicContact CD1-CE1 4.06Å; L159-L218 HydrophobicContact CD1-CD2 3.88Å; L159-L218 HydrophobicContact CD2-CD1 4.26Å
160	E	93.3	Very high	89.4	Confident	84 Å²	84	63.3 Å²	63.3	39%	0.393	34%	0.335	S	S	.	.			trans	-142.2	160	179.6	68	-177.2	-156.3	0	0	113.9	L158 S166 K167 L185	L158-E160 PolarHBondContact O-N 3.29Å; E160-S166 CarbonylContact C-O 3.52Å; E160-S166 WeakPolarHBondContact CA-O 3.44Å; E160-K167 HydrophobicContact CB-CG 3.83Å; E160-K167 WeakPolarHBondContact OE2-CE 3.37Å; E160-L185 WeakPolarHBondContact O-CB 3.24Å
161	C	91.9	Very high	89.3	Confident	1 Å²	1	58 Å²	58	1%	0.007	31%	0.312	C	S	.	.			trans	-78.7	122.4	179.4	177.3	0	0	0	0	111.6	V163 C164 G165 S166 L172 L185 C187	C161-V163 PolarHBondContact O-N 3.33Å; C161-C164 PolarHBondContact O-N 2.9Å; C161-G165 WeakPolarHBondContact O-CA 3.33Å; C161-G165 PolarHBondContact O-N 2.88Å; C161-S166 PolarHBondContact N-O 2.85Å; C161-L172 HydrophobicContact CB-CD2 3.68Å; C161-L185 WeakPolarHBondContact CA-O 3.36Å; C161-C187 HydrophobicContact CB-CB 4.27Å; C161-C187 PolarHBondContact SG-N 3.2Å
162	Y	88.6	Confident	89.4	Confident	167 Å²	167	52.8 Å²	52.8	66%	0.655	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.7	-178.5	-179.7	-107.4	0	0	0	115.2	V184 L185 M198 W200	Y162-V184 HydrophobicContact CD1-CG1 3.92Å; Y162-V184 HydrophobicContact CG-CG1 3.86Å; Y162-L185 PolarHBondContact N-O 2.9Å; Y162-M198 HydrophobicContact CE1-CE 4.4Å; Y162-W200 HydrophobicContact CD1-CH2 4.41Å
163	V	86.1	Confident	89.8	Confident	63 Å²	63	52.3 Å²	52.3	38%	0.382	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-30.4	-174.1	175.3	0	0	0	0	113.4	C161 L186 C191 W200	C161-V163 PolarHBondContact O-N 3.33Å; V163-L186 HydrophobicContact CB-CD2 4.38Å; V163-L186 HydrophobicContact CG2-CD2 3.6Å; V163-C191 HydrophobicContact CB-CB 3.98Å; V163-C191 HydrophobicContact CG1-CB 4.25Å; V163-W200 HydrophobicContact CG2-CH2 4.04Å; V163-W200 HydrophobicContact CG2-CZ2 4.22Å
164	C	87.5	Confident	90.2	Very high	71 Å²	71	50.1 Å²	50.1	48%	0.48	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	0.5	-174.4	68.1	0	0	0	0	115.5	C161 S166	C161-C164 PolarHBondContact O-N 2.9Å; C164-S166 PolarHBondContact O-N 2.66Å; C164-S166 VanDerWaalsContact O-N 3.15Å; C164-S166 VanDerWaalsContact SG-CB 3.56Å
165	G	89.7	Confident	90.4	Very high	39 Å²	39	46.7 Å²	46.7	40%	0.402	24%	0.244	S	C	.	.			trans	66	10.6	-178.2	0	0	0	0	0	114.7	C161 K167	C161-G165 WeakPolarHBondContact O-CA 3.33Å; C161-G165 PolarHBondContact O-N 2.88Å; G165-K167 PolarHBondContact O-N 3.04Å
166	S	89.1	Confident	90.2	Very high	35 Å²	35	41.8 Å²	41.8	25%	0.245	23%	0.228	C	C	.	.			trans	-66.5	122.2	177.2	-177.3	0	0	0	0	110.6	E160 C161 C164	E160-S166 CarbonylContact C-O 3.52Å; E160-S166 WeakPolarHBondContact CA-O 3.44Å; C161-S166 PolarHBondContact N-O 2.85Å; C164-S166 PolarHBondContact O-N 2.66Å; C164-S166 VanDerWaalsContact O-N 3.15Å; C164-S166 VanDerWaalsContact SG-CB 3.56Å
167	K	92.2	Very high	89.7	Confident	68 Å²	68	38 Å²	38	30%	0.296	21%	0.212	S	C	.	.			trans	-93.6	0.2	-177	-63.6	174	-178.2	-175.6	0	113.9	E145 L158 E160 G165 V169	E145-K167 HydrophobicContact CB-CB 4.33Å; E145-K167 VanDerWaalsContact CD-CD 3.47Å; E145-K167 HydrophobicContact CG-CB 3.6Å; E145-K167 HydrophobicContact CG-CD 4.44Å; E145-K167 WeakPolarHBondContact OE1-CD 3.38Å; E145-K167 WeakPolarHBondContact OE2-CD 3.31Å; L158-K167 HydrophobicContact CD2-CD 4.12Å; E160-K167 HydrophobicContact CB-CG 3.83Å; E160-K167 WeakPolarHBondContact OE2-CE 3.37Å; G165-K167 PolarHBondContact O-N 3.04Å; K167-V169 PolarHBondContact O-N 3.36Å; K167-V169 VanDerWaalsContact O-N 3.08Å
168	N	91.3	Very high	88.8	Confident	13 Å²	13	41.9 Å²	41.9	7%	0.07	22%	0.224	C	C	.	.			trans	-72.1	100.6	-176.2	-178.5	-10.3	0	0	0	111.2	K144 F170 L171 L172 G736	K144-N168 HydrophobicContact CB-CB 4.29Å; K144-N168 WeakPolarHBondContact O-CA 3.45Å; N168-F170 PolarHBondContact O-N 2.97Å; N168-F170 VanDerWaalsContact O-N 3.09Å; N168-F170 PolarHBondContact OD1-N 3.31Å; N168-F170 VanDerWaalsContact OD1-N 3.1Å; N168-L171 HydrophobicContact CB-CB 4.35Å; N168-L171 HydrophobicContact CB-CD1 4.22Å; N168-L171 HydrophobicContact CB-CG 4.38Å; N168-L171 PolarHBondContact O-N 2.93Å; N168-L172 PolarHBondContact O-N 3.22Å; N168-G736 PolarHBondContact ND2-O 3.22Å
169	V	93.5	Very high	87.5	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.1	-176.3	-61.9	0	0	0	0	114.4	L138 K144 V146 L159 K167 L171 L172 I208 I209 F214	L138-V169 HydrophobicContact CD1-CG2 3.89Å; K144-V169 PolarHBondContact O-N 3.32Å; V146-V169 HydrophobicContact CG2-CG1 3.84Å; L159-V169 HydrophobicContact CB-CG1 4.27Å; L159-V169 HydrophobicContact CD1-CG1 4.28Å; K167-V169 PolarHBondContact O-N 3.36Å; K167-V169 VanDerWaalsContact O-N 3.08Å; V169-L171 VanDerWaalsContact C-N 3.31Å; V169-L172 PolarHBondContact O-N 3.15Å; V169-I208 HydrophobicContact CB-CD1 4.39Å; V169-I209 HydrophobicContact CB-CD1 4.13Å; V169-I209 HydrophobicContact CG2-CD1 3.86Å; V169-F214 HydrophobicContact CB-CE1 4.15Å; V169-F214 HydrophobicContact CB-CZ 4.16Å; V169-F214 HydrophobicContact CG1-CE1 4.29Å; V169-F214 HydrophobicContact CG1-CZ 4.2Å; V169-F214 HydrophobicContact CG2-CZ 4.14Å
170	F	92.2	Very high	86	Confident	9 Å²	9	50.9 Å²	50.9	4%	0.039	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-16	177.2	-54	-72.6	0	0	0	113.4	L138 V139 N168 R188 I209 I734 S735	L138-F170 HydrophobicContact CB-CE2 4.28Å; L138-F170 HydrophobicContact CB-CZ 3.72Å; V139-F170 HydrophobicContact CG2-CE1 3.89Å; V139-F170 HydrophobicContact CG2-CZ 3.73Å; N168-F170 PolarHBondContact O-N 2.97Å; N168-F170 VanDerWaalsContact O-N 3.09Å; N168-F170 PolarHBondContact OD1-N 3.31Å; N168-F170 VanDerWaalsContact OD1-N 3.1Å; F170-R188 PolarHBondContact O-NH1 3.47Å; F170-R188 VanDerWaalsContact O-NH1 3.07Å; F170-I209 HydrophobicContact CD1-CD1 3.78Å; F170-I209 HydrophobicContact CE1-CD1 4.07Å; F170-I734 HydrophobicContact CD1-CB 4.23Å; F170-I734 HydrophobicContact CD1-CD1 4.26Å; F170-I734 HydrophobicContact CD1-CG2 3.73Å; F170-I734 HydrophobicContact CE1-CD1 4.23Å; F170-I734 HydrophobicContact CE1-CG2 4.22Å; F170-I734 HydrophobicContact CG-CG2 4.42Å; F170-S735 VanDerWaalsContact CB-O 3.3Å; F170-S735 WeakPolarHBondContact CB-O 3.41Å
171	L	89.1	Confident	84.9	Confident	15 Å²	15	53.2 Å²	53.2	8%	0.079	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-17.7	169.6	-68.9	178.6	0	0	0	112.8	N168 V169 C187 R188 G736	N168-L171 HydrophobicContact CB-CB 4.35Å; N168-L171 HydrophobicContact CB-CD1 4.22Å; N168-L171 HydrophobicContact CB-CG 4.38Å; N168-L171 PolarHBondContact O-N 2.93Å; V169-L171 VanDerWaalsContact C-N 3.31Å; L171-C187 HydrophobicContact CB-CB 4.4Å; L171-C187 CarbonylContact O-C 3.57Å; L171-C187 VanDerWaalsContact O-CA 3.28Å; L171-C187 WeakPolarHBondContact O-CA 3.41Å; L171-R188 PolarHBondContact O-N 3.11Å; L171-G736 VanDerWaalsContact CD2-CA 3.49Å
172	L	92.6	Very high	84.3	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	138.3	-178.9	-66.6	-178.8	0	0	0	112.7	L159 C161 N168 V169 I208	L159-L172 HydrophobicContact CB-CD1 4.07Å; C161-L172 HydrophobicContact CB-CD2 3.68Å; N168-L172 PolarHBondContact O-N 3.22Å; V169-L172 PolarHBondContact O-N 3.15Å; L172-I208 HydrophobicContact CB-CD1 3.7Å; L172-I208 HydrophobicContact CB-CG1 4.01Å; L172-I208 HydrophobicContact CD1-CD1 4.11Å; L172-I208 PolarHBondContact O-N 2.94Å
173	G	92.2	Very high	84.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	172.6	164.2	0	0	0	0	0	110	L185 L186 W205 Q206	G173-L185 CarbonylContact O-C 3.48Å; G173-L185 WeakPolarHBondContact O-CA 3.26Å; G173-L186 PolarHBondContact N-O 2.93Å; G173-L186 PolarHBondContact O-N 3.01Å; G173-W205 VanDerWaalsContact CA-CE2 3.46Å; G173-W205 VanDerWaalsContact CA-CZ2 3.42Å; G173-W205 VanDerWaalsContact N-CZ2 3.3Å; G173-Q206 CarbonylContact C-O 3.26Å; G173-Q206 WeakPolarHBondContact CA-O 3.49Å
174	F	91.4	Very high	84.2	Confident	28 Å²	28	49.9 Å²	49.9	12%	0.123	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.8	-178.2	78.2	-84.1	0	0	0	111	V183 V184 L185 Q206 I208 L215 W217	F174-V183 HydrophobicContact CB-CG1 3.57Å; F174-V183 HydrophobicContact CD2-CG1 3.7Å; F174-V183 HydrophobicContact CG-CG1 4.03Å; F174-V184 WeakPolarHBondContact CA-O 3.37Å; F174-L185 HydrophobicContact CB-CD2 3.99Å; F174-Q206 HydrophobicContact CD1-CB 4.08Å; F174-Q206 WeakPolarHBondContact CD1-O 3.2Å; F174-Q206 HydrophobicContact CE1-CB 3.53Å; F174-Q206 HydrophobicContact CE1-CG 4.46Å; F174-Q206 HydrophobicContact CZ-CB 4Å; F174-Q206 HydrophobicContact CZ-CG 4.47Å; F174-Q206 PolarHBondContact N-O 3.02Å; F174-Q206 PolarHBondContact O-N 3.42Å; F174-I208 HydrophobicContact CB-CG2 4.31Å; F174-I208 HydrophobicContact CD1-CG2 4.44Å; F174-L215 HydrophobicContact CD1-CD1 3.67Å; F174-L215 HydrophobicContact CE1-CD1 3.32Å; F174-L215 HydrophobicContact CZ-CD1 4.27Å; F174-W217 HydrophobicContact CB-CZ2 4.44Å; F174-W217 HydrophobicContact CD1-CZ2 4.21Å; F174-W217 HydrophobicContact CD2-CZ2 4.38Å; F174-W217 HydrophobicContact CG-CZ2 4.09Å
175	V	88.4	Confident	84.4	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.1	168.8	-164.1	0	0	0	0	108.5	V184 L186 W200 Q204 W205	V175-V184 PolarHBondContact N-O 2.85Å; V175-V184 PolarHBondContact O-N 3.23Å; V175-L186 HydrophobicContact CG2-CD1 3.94Å; V175-W200 HydrophobicContact CG1-CB 3.97Å; V175-Q204 HydrophobicContact CG1-CB 4.18Å; V175-W205 HydrophobicContact CG2-CB 4.05Å; V175-W205 HydrophobicContact CG2-CG 4.3Å
176	P	84.3	Confident	84.4	Confident	48 Å²	48	46 Å²	46	31%	0.312	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138.4	173	29.9	-34.1	0	0	0	110.8
177	A	75.8	Confident	84.3	Confident	34 Å²	34	45 Å²	45	28%	0.281	26%	0.257	S	S	.	.			trans	-71.8	146.4	170.5	0	0	0	0	0	110.9	S179 V182	A177-S179 VanDerWaalsContact C-N 3.32Å; A177-S179 PolarHBondContact O-N 3.44Å; A177-V182 HydrophobicContact CB-CB 4.31Å; A177-V182 WeakPolarHBondContact CB-O 3.32Å; A177-V182 PolarHBondContact N-O 3.15Å
178	K	70	Confident	83.9	Confident	143 Å²	143	42.3 Å²	42.3	62%	0.622	25%	0.245	S	C	*	.	S	Bend	trans	-74.2	-17.4	-177.9	-70.4	-179.2	-176	159.8	0	114.7	Y199	K178-Y199 VanDerWaalsContact CD-O 3.28Å; K178-Y199 WeakPolarHBondContact CD-O 3.41Å; K178-Y199 WeakPolarHBondContact CE-O 3.01Å
179	S	64.8	Low	82.8	Confident	110 Å²	110	43.7 Å²	43.7	77%	0.769	25%	0.253	S	S	*	.	S	Bend	trans	-115.5	-18.2	-167	51.8	0	0	0	0	115.2	A177	A177-S179 VanDerWaalsContact C-N 3.32Å; A177-S179 PolarHBondContact O-N 3.44Å
180	E	63.3	Low	81.8	Confident	136 Å²	136	49.5 Å²	49.5	64%	0.636	28%	0.282	S	S	*	.	S	Bend	trans	-147.8	164	-175.1	-62.9	-173.7	174.3	0	0	110.1	V182	E180-V182 HydrophobicContact CB-CB 4.42Å; E180-V182 HydrophobicContact CB-CG2 3.89Å; E180-V182 PolarHBondContact O-N 2.89Å
181	S	69.4	Low	81.3	Confident	134 Å²	134	49.4 Å²	49.4	94%	0.937	28%	0.282	S	S	*	.	S	Bend	trans	-68.9	26.2	175.5	-47.8	0	0	0	0	114.2
182	V	79.7	Confident	80.7	Confident	68 Å²	68	48.9 Å²	48.9	41%	0.412	28%	0.28	S	S	.	.			trans	-93.8	134.7	-174.5	177.4	0	0	0	0	109.6	A177 E180 V184	A177-V182 HydrophobicContact CB-CB 4.31Å; A177-V182 WeakPolarHBondContact CB-O 3.32Å; A177-V182 PolarHBondContact N-O 3.15Å; E180-V182 HydrophobicContact CB-CB 4.42Å; E180-V182 HydrophobicContact CB-CG2 3.89Å; E180-V182 PolarHBondContact O-N 2.89Å; V182-V184 HydrophobicContact CG1-CG2 4.48Å
183	V	83.3	Confident	79.8	Confident	65 Å²	65	54 Å²	54	39%	0.394	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.4	179.7	174.4	0	0	0	0	108.5	F174 W217	F174-V183 HydrophobicContact CB-CG1 3.57Å; F174-V183 HydrophobicContact CD2-CG1 3.7Å; F174-V183 HydrophobicContact CG-CG1 4.03Å; V183-W217 HydrophobicContact CG1-CH2 4.03Å; V183-W217 HydrophobicContact CG1-CZ2 4.42Å
184	V	88.2	Confident	78.4	Confident	28 Å²	28	55.9 Å²	55.9	17%	0.17	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.6	-177.3	-175.3	0	0	0	0	110	Y162 F174 V175 V182 L186 W200	Y162-V184 HydrophobicContact CD1-CG1 3.92Å; Y162-V184 HydrophobicContact CG-CG1 3.86Å; F174-V184 WeakPolarHBondContact CA-O 3.37Å; V175-V184 PolarHBondContact N-O 2.85Å; V175-V184 PolarHBondContact O-N 3.23Å; V182-V184 HydrophobicContact CG1-CG2 4.48Å; V184-L186 HydrophobicContact CG1-CD2 4.07Å; V184-L186 HydrophobicContact CG1-CG 4.17Å; V184-W200 HydrophobicContact CG1-CZ3 4.48Å
185	L	91.1	Very high	76.7	Confident	29 Å²	29	58.3 Å²	58.3	15%	0.152	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.6	175	-61.4	-175.1	0	0	0	111.2	L159 E160 C161 Y162 G173 F174 I208	L159-L185 HydrophobicContact CD2-CD1 4.19Å; E160-L185 WeakPolarHBondContact O-CB 3.24Å; C161-L185 WeakPolarHBondContact CA-O 3.36Å; Y162-L185 PolarHBondContact N-O 2.9Å; G173-L185 CarbonylContact O-C 3.48Å; G173-L185 WeakPolarHBondContact O-CA 3.26Å; F174-L185 HydrophobicContact CB-CD2 3.99Å; L185-I208 HydrophobicContact CD2-CG2 3.74Å
186	L	90.1	Very high	75.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.7	-177.6	-63.1	178.1	0	0	0	110.9	V163 G173 V175 V184 C191 W200 W205	V163-L186 HydrophobicContact CB-CD2 4.38Å; V163-L186 HydrophobicContact CG2-CD2 3.6Å; G173-L186 PolarHBondContact N-O 2.93Å; G173-L186 PolarHBondContact O-N 3.01Å; V175-L186 HydrophobicContact CG2-CD1 3.94Å; V184-L186 HydrophobicContact CG1-CD2 4.07Å; V184-L186 HydrophobicContact CG1-CG 4.17Å; L186-C191 HydrophobicContact CD2-CB 4.44Å; L186-W200 HydrophobicContact CD1-CD2 4.02Å; L186-W200 HydrophobicContact CD1-CG 4.36Å; L186-W200 HydrophobicContact CD1-CH2 4.42Å; L186-W200 HydrophobicContact CD1-CZ2 3.88Å; L186-W200 HydrophobicContact CD2-CH2 4.23Å; L186-W200 HydrophobicContact CD2-CZ2 4.17Å; L186-W205 PolarHBondContact O-NE1 3.26Å
187	C	88.5	Confident	73.6	Confident	12 Å²	12	72.9 Å²	72.9	8%	0.081	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	142.8	177.3	77.4	0	0	0	0	112.8	C161 L171 N189 C191 A192	C161-C187 HydrophobicContact CB-CB 4.27Å; C161-C187 PolarHBondContact SG-N 3.2Å; L171-C187 HydrophobicContact CB-CB 4.4Å; L171-C187 CarbonylContact O-C 3.57Å; L171-C187 VanDerWaalsContact O-CA 3.28Å; L171-C187 WeakPolarHBondContact O-CA 3.41Å; C187-N189 PolarHBondContact O-N 2.8Å; C187-C191 PolarHBondContact O-N 2.89Å; C187-A192 WeakPolarHBondContact O-CB 3.47Å; C187-A192 PolarHBondContact O-N 3.2Å
188	R	81.9	Confident	72.9	Confident	12 Å²	12	74.3 Å²	74.3	5%	0.045	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-49	-167.8	-171.3	-171.4	-81.5	116.9	-14	115.4	F170 L171 N193 W205 E733 I734	F170-R188 PolarHBondContact O-NH1 3.47Å; F170-R188 VanDerWaalsContact O-NH1 3.07Å; L171-R188 PolarHBondContact O-N 3.11Å; R188-N193 PolarHBondContact O-ND2 2.84Å; R188-W205 HydrophobicContact CB-CH2 3.65Å; R188-W205 HydrophobicContact CB-CZ2 3.59Å; R188-W205 HydrophobicContact CB-CZ3 4.4Å; R188-W205 HydrophobicContact CG-CH2 3.68Å; R188-W205 HydrophobicContact CG-CZ2 4.06Å; R188-W205 HydrophobicContact CG-CZ3 3.97Å; R188-E733 IonicContact CZ-OE2 3.19Å; R188-E733 IonicContact NE-OE2 2.75Å; R188-E733 PolarHBondContact NE-OE2 2.8Å; R188-E733 VanDerWaalsContact NE-OE2 3.14Å; R188-E733 IonicContact NH2-OE2 2.77Å; R188-E733 PolarHBondContact NH2-OE2 2.96Å; R188-I734 PolarHBondContact NH1-O 3.37Å; R188-I734 PolarHBondContact NH2-O 3.44Å
189	N	69.3	Low	72.8	Confident	43 Å²	43	77.3 Å²	77.3	23%	0.23	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-51.3	-164.2	-68.5	1.9	0	0	0	113.1	C187 N193	C187-N189 PolarHBondContact O-N 2.8Å; N189-N193 PolarHBondContact O-ND2 2.83Å
190	I	73.2	Confident	73.3	Confident	122 Å²	122	73.7 Å²	73.7	63%	0.626	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-60.6	-173.1	-59.2	170.7	0	0	0	110.3	A192 N193 A194	I190-A192 PolarHBondContact O-N 2.97Å; I190-N193 PolarHBondContact O-N 3.18Å; I190-A194 VanDerWaalsContact O-CB 3.24Å; I190-A194 WeakPolarHBondContact O-CB 3.48Å; I190-A194 PolarHBondContact O-N 2.81Å
191	C	81.7	Confident	73.7	Confident	7 Å²	7	69.7 Å²	69.7	5%	0.047	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-26.3	-167	-64.3	0	0	0	0	114.5	V163 L186 C187	V163-C191 HydrophobicContact CB-CB 3.98Å; V163-C191 HydrophobicContact CG1-CB 4.25Å; L186-C191 HydrophobicContact CD2-CB 4.44Å; C187-C191 PolarHBondContact O-N 2.89Å
192	A	76.7	Confident	73.9	Confident	4 Å²	4	66.1 Å²	66.1	3%	0.033	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-23.4	173.3	0	0	0	0	0	113.5	C187 I190 P202 W205	C187-A192 WeakPolarHBondContact O-CB 3.47Å; C187-A192 PolarHBondContact O-N 3.2Å; I190-A192 PolarHBondContact O-N 2.97Å; A192-P202 WeakPolarHBondContact O-CB 3.38Å; A192-P202 WeakPolarHBondContact O-CG 3.04Å; A192-W205 VanDerWaalsContact CB-CD1 3.49Å; A192-W205 HydrophobicContact CB-CG 3.97Å
193	N	72.4	Confident	73.7	Confident	110 Å²	110	67.1 Å²	67.1	59%	0.588	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-22.2	-177.6	-63.2	-56.4	0	0	0	113.5	R188 N189 I190	R188-N193 PolarHBondContact O-ND2 2.84Å; N189-N193 PolarHBondContact O-ND2 2.83Å; I190-N193 PolarHBondContact O-N 3.18Å
194	A	63.5	Low	73.8	Confident	38 Å²	38	67.8 Å²	67.8	31%	0.314	35%	0.353	S	S	.	.	S	Bend	trans	-75.9	161.8	176	0	0	0	0	0	112.5	I190	I190-A194 VanDerWaalsContact O-CB 3.24Å; I190-A194 WeakPolarHBondContact O-CB 3.48Å; I190-A194 PolarHBondContact O-N 2.81Å
195	N	54.4	Low	73.8	Confident	80 Å²	80	66.8 Å²	66.8	43%	0.428	35%	0.346	S	S	.	.			trans	57.6	85.9	178.1	-62.3	-3	0	0	0	115.3	D197 M198	N195-D197 PolarHBondContact O-N 3.47Å; N195-M198 HydrophobicContact CB-CB 4.33Å; N195-M198 HydrophobicContact CB-CG 3.91Å; N195-M198 HydrophobicContact CB-SD 3.96Å; N195-M198 PolarHBondContact ND2-SD 2.89Å; N195-M198 VanDerWaalsContact ND2-SD 3.35Å; N195-M198 PolarHBondContact O-N 2.89Å
196	K	55.4	Low	73.7	Confident	212 Å²	212	69.7 Å²	69.7	92%	0.922	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.3	162	-69	-179.3	178	176.4	0	113.1	M198	K196-M198 VanDerWaalsContact C-N 3.3Å
197	D	53.5	Low	73.8	Confident	144 Å²	144	70.3 Å²	70.3	77%	0.77	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.4	-177	-47.5	-61.1	0	0	0	113.4	N195	N195-D197 PolarHBondContact O-N 3.47Å
198	M	61.3	Low	74	Confident	63 Å²	63	69.7 Å²	69.7	31%	0.31	36%	0.359	S	S	.	.	S	Bend	trans	-107.6	137.8	177.7	-62.1	-177.1	88.5	0	0	110.3	Y162 N195 K196 W200	Y162-M198 HydrophobicContact CE1-CE 4.4Å; N195-M198 HydrophobicContact CB-CB 4.33Å; N195-M198 HydrophobicContact CB-CG 3.91Å; N195-M198 HydrophobicContact CB-SD 3.96Å; N195-M198 PolarHBondContact ND2-SD 2.89Å; N195-M198 VanDerWaalsContact ND2-SD 3.35Å; N195-M198 PolarHBondContact O-N 2.89Å; K196-M198 VanDerWaalsContact C-N 3.3Å; M198-W200 HydrophobicContact CB-CD2 4.05Å; M198-W200 HydrophobicContact CB-CE3 4.16Å; M198-W200 HydrophobicContact CB-CH2 3.89Å; M198-W200 HydrophobicContact CB-CZ2 3.73Å; M198-W200 HydrophobicContact CB-CZ3 4.08Å; M198-W200 HydrophobicContact CE-CH2 3.36Å; M198-W200 HydrophobicContact CE-CZ2 4.19Å; M198-W200 HydrophobicContact CE-CZ3 3.79Å; M198-W200 HydrophobicContact CG-CH2 4.26Å; M198-W200 HydrophobicContact CG-CZ2 4.28Å; M198-W200 PolarHBondContact O-N 3.15Å; M198-W200 HydrophobicContact SD-CH2 3.45Å; M198-W200 WeakPolarHBondContact SD-CH2 3.49Å; M198-W200 HydrophobicContact SD-CZ2 3.65Å; M198-W200 HydrophobicContact SD-CZ3 4.3Å
199	Y	66.7	Low	74.5	Confident	206 Å²	206	69.6 Å²	69.6	81%	0.808	36%	0.36	S	S	*	.	S	Bend	trans	-73.1	15.2	-160.2	-70.6	-84.1	0	0	0	117	K178	K178-Y199 VanDerWaalsContact CD-O 3.28Å; K178-Y199 WeakPolarHBondContact CD-O 3.41Å; K178-Y199 WeakPolarHBondContact CE-O 3.01Å
200	W	74.9	Confident	75.4	Confident	35 Å²	35	71.5 Å²	71.5	13%	0.133	37%	0.367	C	S	.	.			trans	-92.4	176.4	178.1	51.4	69.1	0	0	0	113.1	Y162 V163 V175 V184 L186 M198	Y162-W200 HydrophobicContact CD1-CH2 4.41Å; V163-W200 HydrophobicContact CG2-CH2 4.04Å; V163-W200 HydrophobicContact CG2-CZ2 4.22Å; V175-W200 HydrophobicContact CG1-CB 3.97Å; V184-W200 HydrophobicContact CG1-CZ3 4.48Å; L186-W200 HydrophobicContact CD1-CD2 4.02Å; L186-W200 HydrophobicContact CD1-CG 4.36Å; L186-W200 HydrophobicContact CD1-CH2 4.42Å; L186-W200 HydrophobicContact CD1-CZ2 3.88Å; L186-W200 HydrophobicContact CD2-CH2 4.23Å; L186-W200 HydrophobicContact CD2-CZ2 4.17Å; M198-W200 HydrophobicContact CB-CD2 4.05Å; M198-W200 HydrophobicContact CB-CE3 4.16Å; M198-W200 HydrophobicContact CB-CH2 3.89Å; M198-W200 HydrophobicContact CB-CZ2 3.73Å; M198-W200 HydrophobicContact CB-CZ3 4.08Å; M198-W200 HydrophobicContact CE-CH2 3.36Å; M198-W200 HydrophobicContact CE-CZ2 4.19Å; M198-W200 HydrophobicContact CE-CZ3 3.79Å; M198-W200 HydrophobicContact CG-CH2 4.26Å; M198-W200 HydrophobicContact CG-CZ2 4.28Å; M198-W200 PolarHBondContact O-N 3.15Å; M198-W200 HydrophobicContact SD-CH2 3.45Å; M198-W200 WeakPolarHBondContact SD-CH2 3.49Å; M198-W200 HydrophobicContact SD-CZ2 3.65Å; M198-W200 HydrophobicContact SD-CZ3 4.3Å
201	D	71.9	Confident	76	Confident	51 Å²	51	67.7 Å²	67.7	27%	0.273	36%	0.358	S	S	.	.			trans	-124.7	112.5	179.9	179.3	0.7	0	0	0	109.8	A203 Q204	D201-A203 PolarHBondContact O-N 2.82Å; D201-A203 VanDerWaalsContact O-N 3.15Å; D201-A203 WeakPolarHBondContact OD1-CB 3.4Å; D201-A203 PolarHBondContact OD1-N 2.86Å; D201-Q204 HydrophobicContact CB-CB 4.38Å; D201-Q204 HydrophobicContact CB-CG 3.97Å; D201-Q204 WeakPolarHBondContact O-CB 3.39Å; D201-Q204 PolarHBondContact O-N 2.89Å; D201-Q204 PolarHBondContact OD2-NE2 3.13Å
202	P	74.2	Confident	76.3	Confident	59 Å²	59	67.8 Å²	67.8	38%	0.383	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-55.7	-28.6	177.8	-27.3	36	0	0	0	114.1	A192 Q204 W205	A192-P202 WeakPolarHBondContact O-CB 3.38Å; A192-P202 WeakPolarHBondContact O-CG 3.04Å; P202-Q204 PolarHBondContact O-N 3.24Å; P202-W205 WeakPolarHBondContact O-CB 3.47Å; P202-W205 PolarHBondContact O-N 3.47Å
203	A	75.9	Confident	77	Confident	89 Å²	89	69.2 Å²	69.2	74%	0.736	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-69.1	-16.4	177.8	0	0	0	0	0	113.1	D201	D201-A203 PolarHBondContact O-N 2.82Å; D201-A203 VanDerWaalsContact O-N 3.15Å; D201-A203 WeakPolarHBondContact OD1-CB 3.4Å; D201-A203 PolarHBondContact OD1-N 2.86Å
204	Q	84.2	Confident	78.1	Confident	79 Å²	79	64 Å²	64	37%	0.369	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-93.9	1	178.3	-60.9	178.3	38.1	0	0	112.9	V175 D201 P202 Q206	V175-Q204 HydrophobicContact CG1-CB 4.18Å; D201-Q204 HydrophobicContact CB-CB 4.38Å; D201-Q204 HydrophobicContact CB-CG 3.97Å; D201-Q204 WeakPolarHBondContact O-CB 3.39Å; D201-Q204 PolarHBondContact O-N 2.89Å; D201-Q204 PolarHBondContact OD2-NE2 3.13Å; P202-Q204 PolarHBondContact O-N 3.24Å; Q204-Q206 PolarHBondContact O-N 2.99Å
205	W	88.7	Confident	79.6	Confident	7 Å²	7	63.4 Å²	63.4	3%	0.027	33%	0.327	C	S	.	.			trans	-67.5	124	176.8	-173.1	97.3	0	0	0	112.2	G173 V175 L186 R188 A192 P202 P207 R744	G173-W205 VanDerWaalsContact CA-CE2 3.46Å; G173-W205 VanDerWaalsContact CA-CZ2 3.42Å; G173-W205 VanDerWaalsContact N-CZ2 3.3Å; V175-W205 HydrophobicContact CG2-CB 4.05Å; V175-W205 HydrophobicContact CG2-CG 4.3Å; L186-W205 PolarHBondContact O-NE1 3.26Å; R188-W205 HydrophobicContact CB-CH2 3.65Å; R188-W205 HydrophobicContact CB-CZ2 3.59Å; R188-W205 HydrophobicContact CB-CZ3 4.4Å; R188-W205 HydrophobicContact CG-CH2 3.68Å; R188-W205 HydrophobicContact CG-CZ2 4.06Å; R188-W205 HydrophobicContact CG-CZ3 3.97Å; A192-W205 VanDerWaalsContact CB-CD1 3.49Å; A192-W205 HydrophobicContact CB-CG 3.97Å; P202-W205 WeakPolarHBondContact O-CB 3.47Å; P202-W205 PolarHBondContact O-N 3.47Å; W205-P207 HydrophobicContact CH2-CB 4Å; W205-P207 HydrophobicContact CZ3-CB 4.16Å; W205-P207 HydrophobicContact CZ3-CG 4.48Å; W205-R744 PolarHBondContact O-NH1 3.03Å; W205-R744 PolarHBondContact O-NH2 3.15Å
206	Q	89.4	Confident	81.4	Confident	91 Å²	91	62.5 Å²	62.5	43%	0.425	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.1	176.7	-63.1	-177.9	23.4	0	0	110.3	G173 F174 Q204	G173-Q206 CarbonylContact C-O 3.26Å; G173-Q206 WeakPolarHBondContact CA-O 3.49Å; F174-Q206 HydrophobicContact CD1-CB 4.08Å; F174-Q206 WeakPolarHBondContact CD1-O 3.2Å; F174-Q206 HydrophobicContact CE1-CB 3.53Å; F174-Q206 HydrophobicContact CE1-CG 4.46Å; F174-Q206 HydrophobicContact CZ-CB 4Å; F174-Q206 HydrophobicContact CZ-CG 4.47Å; F174-Q206 PolarHBondContact N-O 3.02Å; F174-Q206 PolarHBondContact O-N 3.42Å; Q204-Q206 PolarHBondContact O-N 2.99Å
207	P	92.1	Very high	83.1	Confident	12 Å²	12	57.5 Å²	57.5	8%	0.078	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	146.7	179.5	29.3	-35.8	0	0	0	111.4	W205 I209 Q210 E733	W205-P207 HydrophobicContact CH2-CB 4Å; W205-P207 HydrophobicContact CZ3-CB 4.16Å; W205-P207 HydrophobicContact CZ3-CG 4.48Å; P207-I209 PolarHBondContact O-N 3.3Å; P207-Q210 HydrophobicContact CG-CG 4.1Å; P207-Q210 PolarHBondContact O-NE2 3.32Å; P207-E733 HydrophobicContact CG-CG 4.17Å
208	I	93.7	Very high	84.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-75.7	-9.4	176.4	65.1	171.7	0	0	0	113.6	L159 V169 L172 F174 L185 F214 L215 L218	L159-I208 HydrophobicContact CD1-CD1 3.99Å; V169-I208 HydrophobicContact CB-CD1 4.39Å; L172-I208 HydrophobicContact CB-CD1 3.7Å; L172-I208 HydrophobicContact CB-CG1 4.01Å; L172-I208 HydrophobicContact CD1-CD1 4.11Å; L172-I208 PolarHBondContact O-N 2.94Å; F174-I208 HydrophobicContact CB-CG2 4.31Å; F174-I208 HydrophobicContact CD1-CG2 4.44Å; L185-I208 HydrophobicContact CD2-CG2 3.74Å; I208-F214 HydrophobicContact CD1-CD1 4.42Å; I208-F214 HydrophobicContact CD1-CE1 4.03Å; I208-F214 HydrophobicContact CG1-CD1 4.44Å; I208-F214 HydrophobicContact CG1-CE1 4.33Å; I208-F214 WeakPolarHBondContact O-CA 3.33Å; I208-L215 PolarHBondContact O-N 3.19Å; I208-L215 VanDerWaalsContact O-N 3.07Å; I208-L218 HydrophobicContact CB-CD2 4.41Å; I208-L218 HydrophobicContact CD1-CD2 4.37Å
209	I	92.5	Very high	86.4	Confident	10 Å²	10	48 Å²	48	5%	0.051	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.7	172.7	-61.6	163.5	0	0	0	108.2	I135 V169 F170 P207 Q213 F214 I734	I135-I209 HydrophobicContact CD1-CD1 3.68Å; I135-I209 HydrophobicContact CD1-CG1 3.88Å; I135-I209 HydrophobicContact CD1-CG2 4.01Å; I135-I209 HydrophobicContact CG1-CG2 4.22Å; V169-I209 HydrophobicContact CB-CD1 4.13Å; V169-I209 HydrophobicContact CG2-CD1 3.86Å; F170-I209 HydrophobicContact CD1-CD1 3.78Å; F170-I209 HydrophobicContact CE1-CD1 4.07Å; P207-I209 PolarHBondContact O-N 3.3Å; I209-Q213 CarbonylContact C-O 3.48Å; I209-Q213 VanDerWaalsContact CA-O 3.28Å; I209-Q213 WeakPolarHBondContact CA-O 3.3Å; I209-F214 HydrophobicContact CD1-CE1 4Å; I209-F214 HydrophobicContact CD1-CZ 4.17Å; I209-F214 HydrophobicContact CG1-CD1 3.78Å; I209-F214 HydrophobicContact CG1-CE1 3.7Å; I209-F214 HydrophobicContact CG1-CG 4.39Å; I209-F214 HydrophobicContact CG1-CZ 4.24Å; I209-I734 HydrophobicContact CG2-CD1 3.84Å
210	Q	87.8	Confident	87.7	Confident	82 Å²	82	43.2 Å²	43.2	38%	0.383	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.5	177.6	-64.6	-174.3	16.7	0	0	109.5	P207 R212 Q213 L215	P207-Q210 HydrophobicContact CG-CG 4.1Å; P207-Q210 PolarHBondContact O-NE2 3.32Å; Q210-R212 PolarHBondContact O-N 3.12Å; Q210-Q213 PolarHBondContact N-O 2.85Å; Q210-Q213 WeakPolarHBondContact O-CB 3.34Å; Q210-Q213 PolarHBondContact O-N 2.85Å; Q210-Q213 VanDerWaalsContact O-O 3.09Å; Q210-L215 HydrophobicContact CB-CD2 4.26Å; Q210-L215 HydrophobicContact CG-CD2 3.97Å
211	G	84.5	Confident	88.6	Confident	43 Å²	43	44.6 Å²	44.6	44%	0.443	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	36.1	-178.7	0	0	0	0	0	114.4	R126 Q213	R126-G211 PolarHBondContact NH2-O 3.2Å; G211-Q213 VanDerWaalsContact C-N 3.34Å; G211-Q213 PolarHBondContact O-N 2.8Å
212	R	88.4	Confident	89.7	Confident	9 Å²	9	42.6 Å²	42.6	3%	0.034	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	42.4	-170.7	-69.3	-174	161.1	137.7	-3.1	114.1	F19 G131 S132 I135 Q210 I734 Y741	F19-R212 VanDerWaalsContact CD2-CZ 3.43Å; F19-R212 VanDerWaalsContact CD2-NH1 3.32Å; F19-R212 VanDerWaalsContact CE2-NH2 3.33Å; G131-R212 CarbonylContact C-O 3.59Å; G131-R212 WeakPolarHBondContact CA-O 3.16Å; S132-R212 PolarHBondContact N-O 2.85Å; S132-R212 PolarHBondContact OG-O 3.09Å; I135-R212 HydrophobicContact CG2-CB 3.98Å; I135-R212 HydrophobicContact CG2-CG 4.28Å; Q210-R212 PolarHBondContact O-N 3.12Å; R212-I734 HydrophobicContact CG-CD1 4.1Å; R212-Y741 PolarHBondContact NH1-OH 3.05Å; R212-Y741 PolarHBondContact NH2-OH 2.89Å; R212-Y741 VanDerWaalsContact NH2-OH 3.14Å
213	Q	92.6	Very high	90.6	Very high	33 Å²	33	42.5 Å²	42.5	15%	0.154	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	143.6	178.3	-163.4	168.3	34.8	0	0	108.9	N124 I209 Q210 G211 V221	N124-Q213 PolarHBondContact O-NE2 3.15Å; N124-Q213 WeakPolarHBondContact OD1-CG 3.3Å; I209-Q213 CarbonylContact C-O 3.48Å; I209-Q213 VanDerWaalsContact CA-O 3.28Å; I209-Q213 WeakPolarHBondContact CA-O 3.3Å; Q210-Q213 PolarHBondContact N-O 2.85Å; Q210-Q213 WeakPolarHBondContact O-CB 3.34Å; Q210-Q213 PolarHBondContact O-N 2.85Å; Q210-Q213 VanDerWaalsContact O-O 3.09Å; G211-Q213 VanDerWaalsContact C-N 3.34Å; G211-Q213 PolarHBondContact O-N 2.8Å; Q213-V221 VanDerWaalsContact NE2-CG2 3.28Å
214	F	95	Very high	91.2	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	148.6	166.6	-78.3	-76.3	0	0	0	109.4	N124 I134 I135 L138 V146 L159 V169 I208 I209 A216 L218 V219	N124-F214 PolarHBondContact ND2-O 3.11Å; N124-F214 PolarHBondContact OD1-N 2.87Å; I134-F214 HydrophobicContact CG1-CD2 4.41Å; I134-F214 HydrophobicContact CG1-CE2 3.82Å; I134-F214 HydrophobicContact CG2-CD2 3.75Å; I134-F214 HydrophobicContact CG2-CE2 3.97Å; I135-F214 HydrophobicContact CD1-CD2 3.82Å; I135-F214 HydrophobicContact CD1-CE2 3.55Å; I135-F214 HydrophobicContact CD1-CZ 4.05Å; I135-F214 HydrophobicContact CG1-CD2 4.5Å; L138-F214 HydrophobicContact CD1-CE2 4.16Å; L138-F214 HydrophobicContact CD1-CZ 4.14Å; V146-F214 HydrophobicContact CG2-CZ 4.01Å; L159-F214 HydrophobicContact CD1-CE1 4.06Å; V169-F214 HydrophobicContact CB-CE1 4.15Å; V169-F214 HydrophobicContact CB-CZ 4.16Å; V169-F214 HydrophobicContact CG1-CE1 4.29Å; V169-F214 HydrophobicContact CG1-CZ 4.2Å; V169-F214 HydrophobicContact CG2-CZ 4.14Å; I208-F214 HydrophobicContact CD1-CD1 4.42Å; I208-F214 HydrophobicContact CD1-CE1 4.03Å; I208-F214 HydrophobicContact CG1-CD1 4.44Å; I208-F214 HydrophobicContact CG1-CE1 4.33Å; I208-F214 WeakPolarHBondContact O-CA 3.33Å; I209-F214 HydrophobicContact CD1-CE1 4Å; I209-F214 HydrophobicContact CD1-CZ 4.17Å; I209-F214 HydrophobicContact CG1-CD1 3.78Å; I209-F214 HydrophobicContact CG1-CE1 3.7Å; I209-F214 HydrophobicContact CG1-CG 4.39Å; I209-F214 HydrophobicContact CG1-CZ 4.24Å; F214-A216 PolarHBondContact O-N 3.05Å; F214-L218 HydrophobicContact CB-CD2 4.48Å; F214-L218 HydrophobicContact CD1-CD2 3.76Å; F214-L218 HydrophobicContact CE1-CD2 4.44Å; F214-L218 HydrophobicContact CG-CD2 4.44Å; F214-V219 HydrophobicContact CB-CB 4.25Å; F214-V219 HydrophobicContact CB-CG2 4.03Å; F214-V219 HydrophobicContact CG-CG2 4.36Å
215	L	93.5	Very high	91.4	Very high	24 Å²	24	48.1 Å²	48.1	13%	0.126	26%	0.258	C	S	.	.			trans	-57.8	134.9	178.4	-68.3	171.1	0	0	0	111.6	F174 I208 Q210 W217 L218 V219	F174-L215 HydrophobicContact CD1-CD1 3.67Å; F174-L215 HydrophobicContact CE1-CD1 3.32Å; F174-L215 HydrophobicContact CZ-CD1 4.27Å; I208-L215 PolarHBondContact O-N 3.19Å; I208-L215 VanDerWaalsContact O-N 3.07Å; Q210-L215 HydrophobicContact CB-CD2 4.26Å; Q210-L215 HydrophobicContact CG-CD2 3.97Å; L215-W217 HydrophobicContact CB-CG 4.46Å; L215-W217 HydrophobicContact CD1-CZ2 4.18Å; L215-W217 PolarHBondContact O-N 2.84Å; L215-L218 WeakPolarHBondContact O-CA 3.5Å; L215-L218 WeakPolarHBondContact O-CB 3.43Å; L215-L218 PolarHBondContact O-N 3.3Å; L215-V219 PolarHBondContact O-N 3.02Å
216	A	92.5	Very high	91.5	Very high	62 Å²	62	51.2 Å²	51.2	51%	0.512	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-17.1	-172.2	0	0	0	0	0	115.2	F214 V219 V221	F214-A216 PolarHBondContact O-N 3.05Å; A216-V219 WeakPolarHBondContact CA-O 3.21Å; A216-V221 HydrophobicContact CB-CG2 4.23Å
217	W	91.1	Very high	91.5	Very high	107 Å²	107	48.3 Å²	48.3	41%	0.405	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-26.7	173.1	66.3	-101.7	0	0	0	113.3	L154 F174 V183 L215	L154-W217 HydrophobicContact CD1-CE3 4.46Å; L154-W217 HydrophobicContact CD1-CZ3 4.03Å; F174-W217 HydrophobicContact CB-CZ2 4.44Å; F174-W217 HydrophobicContact CD1-CZ2 4.21Å; F174-W217 HydrophobicContact CD2-CZ2 4.38Å; F174-W217 HydrophobicContact CG-CZ2 4.09Å; V183-W217 HydrophobicContact CG1-CH2 4.03Å; V183-W217 HydrophobicContact CG1-CZ2 4.42Å; L215-W217 HydrophobicContact CB-CG 4.46Å; L215-W217 HydrophobicContact CD1-CZ2 4.18Å; L215-W217 PolarHBondContact O-N 2.84Å
218	L	91.3	Very high	91.3	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.021	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-45.3	178	-169.9	83.4	0	0	0	110	L148 L154 L159 I208 F214 L215	L148-L218 HydrophobicContact CD1-CD1 4.31Å; L148-L218 HydrophobicContact CD1-CG 4.37Å; L154-L218 HydrophobicContact CD1-CD1 3.68Å; L159-L218 HydrophobicContact CD1-CD2 3.88Å; L159-L218 HydrophobicContact CD2-CD1 4.26Å; I208-L218 HydrophobicContact CB-CD2 4.41Å; I208-L218 HydrophobicContact CD1-CD2 4.37Å; F214-L218 HydrophobicContact CB-CD2 4.48Å; F214-L218 HydrophobicContact CD1-CD2 3.76Å; F214-L218 HydrophobicContact CE1-CD2 4.44Å; F214-L218 HydrophobicContact CG-CD2 4.44Å; L215-L218 WeakPolarHBondContact O-CA 3.5Å; L215-L218 WeakPolarHBondContact O-CB 3.43Å; L215-L218 PolarHBondContact O-N 3.3Å
219	V	93.6	Very high	91	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.024	32%	0.319	C	S	.	.	S	Bend	trans	-141.8	119.9	175.4	-168.3	0	0	0	0	108	V113 N124 L148 F214 L215 A216	V113-V219 HydrophobicContact CG2-CB 4.22Å; V113-V219 HydrophobicContact CG2-CG1 3.65Å; V113-V219 HydrophobicContact CG2-CG2 3.61Å; N124-V219 HydrophobicContact CB-CB 4.13Å; N124-V219 HydrophobicContact CB-CG1 3.68Å; N124-V219 PolarHBondContact ND2-O 2.78Å; L148-V219 HydrophobicContact CD2-CG2 3.64Å; F214-V219 HydrophobicContact CB-CB 4.25Å; F214-V219 HydrophobicContact CB-CG2 4.03Å; F214-V219 HydrophobicContact CG-CG2 4.36Å; L215-V219 PolarHBondContact O-N 3.02Å; A216-V219 WeakPolarHBondContact CA-O 3.21Å
220	K	94.4	Very high	90.9	Very high	105 Å²	105	59.5 Å²	59.5	46%	0.457	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-62.1	152.2	-179.2	-66.6	-172.1	-170.2	169.3	0	111.1	A110 C111	A110-K220 HydrophobicContact CB-CB 4.42Å; A110-K220 HydrophobicContact CB-CD 3.7Å; A110-K220 HydrophobicContact CB-CG 4.09Å; A110-K220 WeakPolarHBondContact O-CB 3.25Å; A110-K220 PolarHBondContact O-N 2.83Å; C111-K220 WeakPolarHBondContact CA-O 3.43Å; C111-K220 VanDerWaalsContact SG-CB 3.59Å
221	V	93.9	Very high	91	Very high	64 Å²	64	60.3 Å²	60.3	39%	0.388	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-86.2	132.5	166.9	-170.8	0	0	0	0	107.4	Q213 A216	Q213-V221 VanDerWaalsContact NE2-CG2 3.28Å; A216-V221 HydrophobicContact CB-CG2 4.23Å
222	P	93.9	Very high	91.3	Very high	8 Å²	8	62.5 Å²	62.5	5%	0.052	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-54.4	148.5	171.4	-24.8	33.8	0	0	0	111.7	I106 C111 C123 Q226	I106-P222 HydrophobicContact CD1-CB 3.98Å; I106-P222 HydrophobicContact CD1-CG 3.94Å; I106-P222 HydrophobicContact CG2-CB 4.3Å; I106-P222 HydrophobicContact CG2-CG 3.87Å; C111-P222 HydrophobicContact CB-CG 3.94Å; C123-P222 HydrophobicContact CB-CG 4.34Å; P222-Q226 VanDerWaalsContact CA-OE1 3.3Å; P222-Q226 HydrophobicContact CB-CB 4.18Å
223	S	93	Very high	91.3	Very high	57 Å²	57	62.3 Å²	62.3	40%	0.399	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-67.5	157.2	174.6	72	0	0	0	0	111.5	E225 Q226 Q227	S223-E225 PolarHBondContact O-N 2.74Å; S223-Q226 WeakPolarHBondContact O-CB 3.43Å; S223-Q226 PolarHBondContact O-N 2.74Å; S223-Q226 WeakPolarHBondContact OG-CG 3.35Å; S223-Q226 PolarHBondContact OG-N 3.16Å; S223-Q227 WeakPolarHBondContact O-CB 3.48Å; S223-Q227 PolarHBondContact O-N 2.83Å
224	D	88.9	Confident	91.1	Very high	146 Å²	146	62.8 Å²	62.8	78%	0.781	33%	0.327	S	S	*	.	H	α-helix	trans	-58.2	-33.8	177.7	-61.1	-43.7	0	0	0	111.9	Q227 A228	D224-Q227 PolarHBondContact O-N 3.36Å; D224-A228 VanDerWaalsContact O-CB 3.26Å; D224-A228 WeakPolarHBondContact O-CB 3.11Å; D224-A228 PolarHBondContact O-N 3.3Å
225	E	89	Confident	90.5	Very high	140 Å²	140	63.6 Å²	63.6	65%	0.654	33%	0.334	S	S	*	.	H	α-helix	trans	-65.4	-45.2	173.1	-66.4	-177	-153.2	0	0	113.1	S223 Q227 A228 K229	S223-E225 PolarHBondContact O-N 2.74Å; E225-Q227 VanDerWaalsContact C-N 3.29Å; E225-A228 PolarHBondContact O-N 3.44Å; E225-K229 WeakPolarHBondContact O-CB 3.32Å; E225-K229 WeakPolarHBondContact O-CG 3.35Å; E225-K229 PolarHBondContact O-N 3.41Å
226	Q	90	Very high	90	Very high	73 Å²	73	66.9 Å²	66.9	34%	0.341	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-41.1	173.9	-73.5	171.1	-32.7	0	0	110.3	P222 S223 A230	P222-Q226 VanDerWaalsContact CA-OE1 3.3Å; P222-Q226 HydrophobicContact CB-CB 4.18Å; S223-Q226 WeakPolarHBondContact O-CB 3.43Å; S223-Q226 PolarHBondContact O-N 2.74Å; S223-Q226 WeakPolarHBondContact OG-CG 3.35Å; S223-Q226 PolarHBondContact OG-N 3.16Å; Q226-A230 VanDerWaalsContact O-CB 3.24Å; Q226-A230 WeakPolarHBondContact O-CB 3.24Å; Q226-A230 PolarHBondContact O-N 3.18Å
227	Q	89.7	Confident	89.8	Confident	30 Å²	30	67.1 Å²	67.1	14%	0.14	34%	0.339	C	S	.	.	H	α-helix	trans	-71.9	-28.3	-177	-172.6	61.3	97.9	0	0	112.9	S223 D224 E225 Q232	S223-Q227 WeakPolarHBondContact O-CB 3.48Å; S223-Q227 PolarHBondContact O-N 2.83Å; D224-Q227 PolarHBondContact O-N 3.36Å; E225-Q227 VanDerWaalsContact C-N 3.29Å; Q227-Q232 PolarHBondContact O-NE2 2.75Å
228	A	87.8	Confident	89.6	Confident	70 Å²	70	62 Å²	62	58%	0.579	32%	0.32	S	S	*	.	H	α-helix	trans	-78.8	-41.7	172.9	0	0	0	0	0	112.7	D224 E225 A230 Q232	D224-A228 VanDerWaalsContact O-CB 3.26Å; D224-A228 WeakPolarHBondContact O-CB 3.11Å; D224-A228 PolarHBondContact O-N 3.3Å; E225-A228 PolarHBondContact O-N 3.44Å; A228-A230 VanDerWaalsContact C-N 3.3Å; A228-Q232 PolarHBondContact O-NE2 2.84Å; A228-Q232 VanDerWaalsContact O-NE2 3.12Å
229	K	88.5	Confident	89.3	Confident	173 Å²	173	63.9 Å²	63.9	75%	0.752	33%	0.33	S	S	*	.	H	α-helix	trans	-71	-24.1	176	-70.7	172.6	-179.8	172.2	0	113.3	E225	E225-K229 WeakPolarHBondContact O-CB 3.32Å; E225-K229 WeakPolarHBondContact O-CG 3.35Å; E225-K229 PolarHBondContact O-N 3.41Å
230	A	89.1	Confident	88.8	Confident	13 Å²	13	69.8 Å²	69.8	11%	0.107	35%	0.352	C	S	.	.	S	Bend	trans	-63.7	156	175.5	0	0	0	0	0	112.8	C104 I106 Q226 A228 Q232	C104-A230 HydrophobicContact CB-CB 4.31Å; I106-A230 HydrophobicContact CD1-CB 3.74Å; I106-A230 HydrophobicContact CG1-CB 3.51Å; Q226-A230 VanDerWaalsContact O-CB 3.24Å; Q226-A230 WeakPolarHBondContact O-CB 3.24Å; Q226-A230 PolarHBondContact O-N 3.18Å; A228-A230 VanDerWaalsContact C-N 3.3Å; A230-Q232 PolarHBondContact O-N 2.97Å; A230-Q232 VanDerWaalsContact O-N 3.15Å; A230-Q232 PolarHBondContact O-NE2 3.06Å
231	R	90.3	Very high	88.5	Confident	100 Å²	100	64.8 Å²	64.8	38%	0.377	33%	0.33	S	S	.	.			trans	-58.2	118	175	171.1	-171	-56.7	-163.1	-8.3	110	C104 I233 V253 E254	C104-R231 VanDerWaalsContact CB-O 3.31Å; C104-R231 WeakPolarHBondContact CB-O 3.22Å; C104-R231 PolarHBondContact O-N 3.02Å; R231-I233 PolarHBondContact O-N 3.49Å; R231-V253 VanDerWaalsContact NH1-CG2 3.35Å; R231-E254 IonicContact CZ-OE1 3.33Å; R231-E254 IonicContact CZ-OE2 3.61Å; R231-E254 IonicContact NH1-OE1 3.73Å; R231-E254 PolarHBondContact NH1-OE1 3.27Å; R231-E254 IonicContact NH1-OE2 3.03Å; R231-E254 PolarHBondContact NH1-OE2 3.37Å; R231-E254 IonicContact NH2-OE1 3.54Å; R231-E254 PolarHBondContact NH2-OE1 2.71Å
232	Q	89.7	Confident	88.3	Confident	89 Å²	89	62.5 Å²	62.5	42%	0.416	32%	0.315	S	S	.	.			trans	-78.6	109.5	-178.9	-60.6	-56.7	-38.7	0	0	109.9	N128 Q227 A228 A230	N128-Q232 PolarHBondContact ND2-OE1 2.72Å; Q227-Q232 PolarHBondContact O-NE2 2.75Å; A228-Q232 PolarHBondContact O-NE2 2.84Å; A228-Q232 VanDerWaalsContact O-NE2 3.12Å; A230-Q232 PolarHBondContact O-N 2.97Å; A230-Q232 VanDerWaalsContact O-N 3.15Å; A230-Q232 PolarHBondContact O-NE2 3.06Å
233	I	88.8	Confident	87.7	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.021	33%	0.329	C	S	.	.			trans	-117.4	136.2	-179.5	-167.7	172.5	0	0	0	110.2	R231 Q237 I238 L241 V253	R231-I233 PolarHBondContact O-N 3.49Å; I233-Q237 HydrophobicContact CD1-CB 4.18Å; I233-Q237 HydrophobicContact CG1-CB 3.62Å; I233-I238 HydrophobicContact CD1-CG1 3.81Å; I233-I238 HydrophobicContact CG1-CG1 4.08Å; I233-I238 HydrophobicContact CG2-CD1 4.02Å; I233-I238 HydrophobicContact CG2-CG1 4.28Å; I233-L241 HydrophobicContact CD1-CD2 4.45Å; I233-V253 HydrophobicContact CD1-CG1 3.8Å; I233-V253 HydrophobicContact CD1-CG2 4.25Å; I233-V253 HydrophobicContact CG1-CG1 4.4Å
234	S	88.5	Confident	87.3	Confident	43 Å²	43	65.5 Å²	65.5	30%	0.301	32%	0.323	S	S	.	.			trans	-85	161.7	176.7	70.1	0	0	0	0	112.2	Q236 Q237 I238	S234-Q236 PolarHBondContact O-N 2.84Å; S234-Q237 VanDerWaalsContact CB-OE1 3.27Å; S234-Q237 PolarHBondContact O-N 2.83Å; S234-Q237 WeakPolarHBondContact OG-CG 3.48Å; S234-Q237 PolarHBondContact OG-N 3.17Å; S234-Q237 PolarHBondContact OG-OE1 3.37Å; S234-I238 PolarHBondContact O-N 3.35Å
235	A	83	Confident	87.3	Confident	19 Å²	19	59.6 Å²	59.6	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-32.3	174.1	0	0	0	0	0	113.6	L17 T129 I238 N239	L17-A235 HydrophobicContact CD2-CB 3.4Å; L17-A235 VanDerWaalsContact CD2-CB 3.4Å; T129-A235 HydrophobicContact CG2-CB 4.39Å; A235-I238 PolarHBondContact O-N 3.02Å; A235-N239 PolarHBondContact O-N 3.06Å; A235-N239 PolarHBondContact O-OD1 3.17Å; A235-N239 VanDerWaalsContact O-OD1 3.07Å
236	Q	83.5	Confident	86.8	Confident	93 Å²	93	57.6 Å²	57.6	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-74.4	-36.5	178	-65.7	-177.5	-5.4	0	0	112	S234 I238 N239 R240	S234-Q236 PolarHBondContact O-N 2.84Å; Q236-I238 VanDerWaalsContact C-N 3.34Å; Q236-N239 WeakPolarHBondContact O-CB 3.46Å; Q236-N239 PolarHBondContact O-N 3.4Å; Q236-R240 WeakPolarHBondContact O-CG 3.26Å; Q236-R240 PolarHBondContact O-N 2.56Å; Q236-R240 VanDerWaalsContact O-N 3.11Å
237	Q	87	Confident	86.4	Confident	67 Å²	67	62.6 Å²	62.6	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-39.2	170.6	-75.6	161.2	-58.9	0	0	111.3	I233 S234 R240 L241 L256	I233-Q237 HydrophobicContact CD1-CB 4.18Å; I233-Q237 HydrophobicContact CG1-CB 3.62Å; S234-Q237 VanDerWaalsContact CB-OE1 3.27Å; S234-Q237 PolarHBondContact O-N 2.83Å; S234-Q237 WeakPolarHBondContact OG-CG 3.48Å; S234-Q237 PolarHBondContact OG-N 3.17Å; S234-Q237 PolarHBondContact OG-OE1 3.37Å; Q237-R240 PolarHBondContact O-N 2.75Å; Q237-L241 VanDerWaalsContact O-CB 3.29Å; Q237-L241 WeakPolarHBondContact O-CB 3.28Å; Q237-L241 PolarHBondContact O-N 2.95Å; Q237-L256 HydrophobicContact CB-CD1 3.68Å; Q237-L256 HydrophobicContact CG-CD1 3.97Å
238	I	88.5	Confident	86.2	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-43.6	172.3	-75.9	166.4	0	0	0	112	Y103 T129 I233 S234 A235 Q236 L241 E242	Y103-I238 HydrophobicContact CD1-CG1 4.18Å; Y103-I238 HydrophobicContact CD2-CD1 3.77Å; Y103-I238 HydrophobicContact CD2-CG1 3.97Å; Y103-I238 HydrophobicContact CE1-CG1 4.18Å; Y103-I238 HydrophobicContact CE1-CG2 4.21Å; Y103-I238 HydrophobicContact CE2-CD1 3.98Å; Y103-I238 HydrophobicContact CE2-CG1 4.05Å; Y103-I238 HydrophobicContact CE2-CG2 3.97Å; Y103-I238 HydrophobicContact CG-CD1 4.25Å; Y103-I238 HydrophobicContact CG-CG1 4.07Å; T129-I238 HydrophobicContact CG2-CD1 3.88Å; I233-I238 HydrophobicContact CD1-CG1 3.81Å; I233-I238 HydrophobicContact CG1-CG1 4.08Å; I233-I238 HydrophobicContact CG2-CD1 4.02Å; I233-I238 HydrophobicContact CG2-CG1 4.28Å; S234-I238 PolarHBondContact O-N 3.35Å; A235-I238 PolarHBondContact O-N 3.02Å; Q236-I238 VanDerWaalsContact C-N 3.34Å; I238-L241 PolarHBondContact O-N 3.29Å; I238-E242 WeakPolarHBondContact O-CG 3.3Å; I238-E242 PolarHBondContact O-N 2.84Å
239	N	83.7	Confident	86.1	Confident	42 Å²	42	64.6 Å²	64.6	23%	0.225	31%	0.308	C	S	.	.	H	α-helix	trans	-53.7	-56.8	174	-73.9	12.1	0	0	0	110.6	R140 A235 Q236 L241 E242 E243	R140-N239 PolarHBondContact NH1-OD1 2.8Å; R140-N239 PolarHBondContact NH2-OD1 3.47Å; A235-N239 PolarHBondContact O-N 3.06Å; A235-N239 PolarHBondContact O-OD1 3.17Å; A235-N239 VanDerWaalsContact O-OD1 3.07Å; Q236-N239 WeakPolarHBondContact O-CB 3.46Å; Q236-N239 PolarHBondContact O-N 3.4Å; N239-L241 VanDerWaalsContact C-N 3.3Å; N239-L241 PolarHBondContact O-N 2.76Å; N239-E242 PolarHBondContact O-N 2.73Å; N239-E243 VanDerWaalsContact O-CG 3.28Å; N239-E243 WeakPolarHBondContact O-CG 3.48Å; N239-E243 PolarHBondContact O-N 2.96Å
240	R	82.9	Confident	86	Confident	129 Å²	129	64.3 Å²	64.3	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-36.2	-178.1	-70.3	178.6	-177.3	170.7	0.8	112.9	Q236 Q237 E243 I244 L256	Q236-R240 WeakPolarHBondContact O-CG 3.26Å; Q236-R240 PolarHBondContact O-N 2.56Å; Q236-R240 VanDerWaalsContact O-N 3.11Å; Q237-R240 PolarHBondContact O-N 2.75Å; R240-E243 WeakPolarHBondContact O-CB 3.28Å; R240-E243 PolarHBondContact O-N 3.39Å; R240-I244 VanDerWaalsContact O-CG1 3.26Å; R240-I244 WeakPolarHBondContact O-CG1 3.46Å; R240-I244 PolarHBondContact O-N 2.95Å; R240-L256 HydrophobicContact CB-CD2 3.54Å
241	L	89.3	Confident	85.8	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.4	-39.5	179.1	-175.2	58.1	0	0	0	111.6	Y103 I233 Q237 I238 N239 W245 A252 V253 L256	Y103-L241 HydrophobicContact CD1-CD2 3.95Å; Y103-L241 HydrophobicContact CE1-CD2 4.24Å; I233-L241 HydrophobicContact CD1-CD2 4.45Å; Q237-L241 VanDerWaalsContact O-CB 3.29Å; Q237-L241 WeakPolarHBondContact O-CB 3.28Å; Q237-L241 PolarHBondContact O-N 2.95Å; I238-L241 PolarHBondContact O-N 3.29Å; N239-L241 VanDerWaalsContact C-N 3.3Å; N239-L241 PolarHBondContact O-N 2.76Å; L241-W245 HydrophobicContact CD1-CD2 4.49Å; L241-W245 HydrophobicContact CD1-CZ2 4.12Å; L241-W245 HydrophobicContact CD2-CH2 4.03Å; L241-W245 HydrophobicContact CD2-CZ2 3.69Å; L241-W245 HydrophobicContact CG-CD2 4.13Å; L241-W245 HydrophobicContact CG-CH2 4.18Å; L241-W245 HydrophobicContact CG-CZ2 3.69Å; L241-W245 WeakPolarHBondContact O-CB 3.31Å; L241-W245 PolarHBondContact O-N 2.82Å; L241-A252 WeakPolarHBondContact CD1-O 3.35Å; L241-V253 HydrophobicContact CD2-CG2 3.98Å; L241-L256 HydrophobicContact CB-CD1 4.42Å; L241-L256 HydrophobicContact CB-CD2 4.15Å
242	E	88.4	Confident	85.5	Confident	15 Å²	15	61.2 Å²	61.2	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-68.6	-34.7	172.8	-70.8	-89.7	-146	0	0	112.1	Y103 H137 R140 I238 N239 W245 K246	Y103-E242 WeakPolarHBondContact OH-CG 3.48Å; Y103-E242 PolarHBondContact OH-OE1 3.22Å; H137-E242 VanDerWaalsContact CA-OE1 3.3Å; H137-E242 WeakPolarHBondContact CA-OE1 3.39Å; H137-E242 IonicContact CE1-OE1 3.83Å; H137-E242 IonicContact CE1-OE2 3.23Å; H137-E242 IonicContact CG-OE1 2.95Å; H137-E242 IonicContact ND1-OE1 3.98Å; H137-E242 PolarHBondContact ND1-OE1 2.91Å; H137-E242 IonicContact ND1-OE2 2.68Å; H137-E242 PolarHBondContact ND1-OE2 3.1Å; R140-E242 HydrophobicContact CB-CG 4.18Å; I238-E242 WeakPolarHBondContact O-CG 3.3Å; I238-E242 PolarHBondContact O-N 2.84Å; N239-E242 PolarHBondContact O-N 2.73Å; E242-W245 HydrophobicContact CG-CE3 4.25Å; E242-W245 HydrophobicContact CG-CZ3 4.42Å; E242-K246 WeakPolarHBondContact O-CG 3.39Å
243	E	81.5	Confident	85.1	Confident	75 Å²	75	57.8 Å²	57.8	35%	0.35	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-51.7	171.5	-70.3	153.5	-154.4	0	0	110.8	P22 N239 R240 W245 K246	P22-E243 HydrophobicContact CG-CG 3.9Å; P22-E243 WeakPolarHBondContact CG-OE1 3.41Å; N239-E243 VanDerWaalsContact O-CG 3.28Å; N239-E243 WeakPolarHBondContact O-CG 3.48Å; N239-E243 PolarHBondContact O-N 2.96Å; R240-E243 WeakPolarHBondContact O-CB 3.28Å; R240-E243 PolarHBondContact O-N 3.39Å; E243-W245 VanDerWaalsContact C-N 3.31Å; E243-W245 PolarHBondContact O-N 3.24Å; E243-K246 WeakPolarHBondContact O-CB 3.37Å; E243-K246 PolarHBondContact O-N 2.87Å; E243-K246 VanDerWaalsContact O-N 3.14Å
244	I	85	Confident	84.7	Confident	53 Å²	53	62.5 Å²	62.5	27%	0.272	31%	0.313	S	S	.	.	H	α-helix	trans	-63.2	-36.2	177.3	-64.4	169.4	0	0	0	111.1	R240 K246 E247 N248 A251 L256	R240-I244 VanDerWaalsContact O-CG1 3.26Å; R240-I244 WeakPolarHBondContact O-CG1 3.46Å; R240-I244 PolarHBondContact O-N 2.95Å; I244-K246 PolarHBondContact O-N 3.11Å; I244-K246 VanDerWaalsContact O-N 3.08Å; I244-E247 PolarHBondContact O-N 3.29Å; I244-N248 HydrophobicContact CG2-CB 4.37Å; I244-N248 PolarHBondContact O-N 2.93Å; I244-A251 HydrophobicContact CB-CB 4.45Å; I244-A251 HydrophobicContact CG2-CB 3.42Å; I244-A251 VanDerWaalsContact CG2-CB 3.42Å; I244-L256 HydrophobicContact CD1-CD2 3.88Å
245	W	88.8	Confident	84.3	Confident	22 Å²	22	62.2 Å²	62.2	8%	0.083	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.5	176.6	-77.5	-15.3	0	0	0	114.6	A102 Y103 K120 F122 H137 L241 E242 E243 A251	A102-W245 HydrophobicContact CB-CH2 3.84Å; A102-W245 HydrophobicContact CB-CZ2 4.05Å; Y103-W245 AromaticContact CD1-CH2 3.86Å; Y103-W245 HydrophobicContact CD1-CH2 3.86Å; Y103-W245 HydrophobicContact CD1-CZ3 4.37Å; Y103-W245 AromaticContact CE1-CH2 3.57Å; Y103-W245 HydrophobicContact CE1-CH2 3.57Å; Y103-W245 AromaticContact CE1-CZ3 3.62Å; Y103-W245 HydrophobicContact CE1-CZ3 3.62Å; K120-W245 HydrophobicContact CD-CD2 4.39Å; K120-W245 HydrophobicContact CD-CE3 4.37Å; K120-W245 HydrophobicContact CD-CH2 4.09Å; K120-W245 HydrophobicContact CD-CZ2 4.07Å; K120-W245 HydrophobicContact CD-CZ3 4.24Å; K120-W245 VanDerWaalsContact NZ-NE1 3.15Å; F122-W245 AromaticContact CE1-CH2 3.82Å; F122-W245 HydrophobicContact CE1-CH2 3.82Å; F122-W245 AromaticContact CE1-CZ3 3.96Å; F122-W245 HydrophobicContact CE1-CZ3 3.96Å; F122-W245 AromaticContact CZ-CH2 3.81Å; F122-W245 HydrophobicContact CZ-CH2 3.81Å; F122-W245 AromaticContact CZ-CZ3 3.73Å; F122-W245 HydrophobicContact CZ-CZ3 3.73Å; H137-W245 AromaticContact ND1-CZ3 3.97Å; L241-W245 HydrophobicContact CD1-CD2 4.49Å; L241-W245 HydrophobicContact CD1-CZ2 4.12Å; L241-W245 HydrophobicContact CD2-CH2 4.03Å; L241-W245 HydrophobicContact CD2-CZ2 3.69Å; L241-W245 HydrophobicContact CG-CD2 4.13Å; L241-W245 HydrophobicContact CG-CH2 4.18Å; L241-W245 HydrophobicContact CG-CZ2 3.69Å; L241-W245 WeakPolarHBondContact O-CB 3.31Å; L241-W245 PolarHBondContact O-N 2.82Å; E242-W245 HydrophobicContact CG-CE3 4.25Å; E242-W245 HydrophobicContact CG-CZ3 4.42Å; E243-W245 VanDerWaalsContact C-N 3.31Å; E243-W245 PolarHBondContact O-N 3.24Å; W245-A251 PolarHBondContact NE1-O 2.9Å
246	K	79.8	Confident	83.9	Confident	98 Å²	98	62.6 Å²	62.6	43%	0.426	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-27.7	171.5	-59.5	179.1	-171.9	-170.8	0	112.7	E23 E242 E243 I244	E23-K246 IonicContact OE1-NZ 2.66Å; E23-K246 PolarHBondContact OE1-NZ 3.34Å; E23-K246 VanDerWaalsContact OE1-NZ 3.07Å; E23-K246 IonicContact OE2-NZ 3.1Å; E23-K246 PolarHBondContact OE2-NZ 2.58Å; E242-K246 WeakPolarHBondContact O-CG 3.39Å; E243-K246 WeakPolarHBondContact O-CB 3.37Å; E243-K246 PolarHBondContact O-N 2.87Å; E243-K246 VanDerWaalsContact O-N 3.14Å; I244-K246 PolarHBondContact O-N 3.11Å; I244-K246 VanDerWaalsContact O-N 3.08Å
247	E	80.5	Confident	83.3	Confident	178 Å²	178	66.1 Å²	66.1	83%	0.832	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-43.6	-178.2	-59.4	-171.4	167.4	0	0	111.9	I244	I244-E247 PolarHBondContact O-N 3.29Å
248	N	84.8	Confident	82.5	Confident	69 Å²	69	69.7 Å²	69.7	37%	0.369	34%	0.338	S	S	.	.			trans	-122.4	92.8	172.3	177.2	13.5	0	0	0	110.4	I244 Q250 A251	I244-N248 HydrophobicContact CG2-CB 4.37Å; I244-N248 PolarHBondContact O-N 2.93Å; N248-Q250 PolarHBondContact O-N 3.48Å; N248-Q250 PolarHBondContact OD1-N 3.26Å; N248-A251 HydrophobicContact CB-CB 4.3Å; N248-A251 WeakPolarHBondContact O-CB 3.28Å; N248-A251 PolarHBondContact O-N 3.39Å; N248-A251 PolarHBondContact OD1-N 2.95Å
249	P	87.1	Confident	80.8	Confident	74 Å²	74	76.1 Å²	76.1	48%	0.481	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.9	176.7	-26.9	35.9	0	0	0	115.2	K120	K120-P249 VanDerWaalsContact CE-O 3.25Å; K120-P249 WeakPolarHBondContact CE-O 3.12Å; K120-P249 PolarHBondContact NZ-O 3.13Å
250	Q	85	Confident	79.5	Confident	167 Å²	167	77.7 Å²	77.7	78%	0.78	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	5.7	178.9	-60.2	-62.8	-16.6	0	0	113.7	N248	N248-Q250 PolarHBondContact O-N 3.48Å; N248-Q250 PolarHBondContact OD1-N 3.26Å
251	A	85.9	Confident	78	Confident	6 Å²	6	76.3 Å²	76.3	5%	0.05	42%	0.422	C	S	.	.			trans	-62.7	142	179.3	0	0	0	0	0	112.6	I244 W245 N248 D255	I244-A251 HydrophobicContact CB-CB 4.45Å; I244-A251 HydrophobicContact CG2-CB 3.42Å; I244-A251 VanDerWaalsContact CG2-CB 3.42Å; W245-A251 PolarHBondContact NE1-O 2.9Å; N248-A251 HydrophobicContact CB-CB 4.3Å; N248-A251 WeakPolarHBondContact O-CB 3.28Å; N248-A251 PolarHBondContact O-N 3.39Å; N248-A251 PolarHBondContact OD1-N 2.95Å; A251-D255 VanDerWaalsContact CA-OD2 3.22Å; A251-D255 WeakPolarHBondContact CA-OD2 3.25Å; A251-D255 HydrophobicContact CB-CB 4.26Å
252	A	83.3	Confident	76.3	Confident	41 Å²	41	81.6 Å²	81.6	34%	0.339	45%	0.45	S	S	.	.			trans	-99.5	174.3	176	0	0	0	0	0	111.3	L241 E254 D255	L241-A252 WeakPolarHBondContact CD1-O 3.35Å; A252-E254 HydrophobicContact CB-CB 4.38Å; A252-E254 VanDerWaalsContact CB-OE2 3.28Å; A252-E254 WeakPolarHBondContact CB-OE2 3.45Å; A252-E254 PolarHBondContact O-N 2.72Å; A252-D255 PolarHBondContact N-OD2 3.07Å; A252-D255 WeakPolarHBondContact O-CB 3.46Å; A252-D255 PolarHBondContact O-N 2.76Å; A252-D255 VanDerWaalsContact O-N 3.17Å
253	V	82.2	Confident	75	Confident	17 Å²	17	87.7 Å²	87.7	10%	0.103	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-64.7	-29.2	175.8	-168.3	0	0	0	0	110.4	R231 I233 L241 D255 L256	R231-V253 VanDerWaalsContact NH1-CG2 3.35Å; I233-V253 HydrophobicContact CD1-CG1 3.8Å; I233-V253 HydrophobicContact CD1-CG2 4.25Å; I233-V253 HydrophobicContact CG1-CG1 4.4Å; L241-V253 HydrophobicContact CD2-CG2 3.98Å; V253-D255 VanDerWaalsContact C-N 3.26Å; V253-D255 PolarHBondContact O-N 3Å; V253-L256 HydrophobicContact CG1-CD1 3.78Å; V253-L256 WeakPolarHBondContact O-CB 3.41Å; V253-L256 WeakPolarHBondContact O-CD1 2.93Å; V253-L256 WeakPolarHBondContact O-CG 3.35Å; V253-L256 PolarHBondContact O-N 3.22Å; V253-L256 VanDerWaalsContact O-N 3.17Å
254	E	80	Confident	74.6	Confident	104 Å²	104	92.5 Å²	92.5	49%	0.486	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-64.3	-25.1	176.8	-64.8	81.3	167.6	0	0	112.6	R231 A252 L256	R231-E254 IonicContact CZ-OE1 3.33Å; R231-E254 IonicContact CZ-OE2 3.61Å; R231-E254 IonicContact NH1-OE1 3.73Å; R231-E254 PolarHBondContact NH1-OE1 3.27Å; R231-E254 IonicContact NH1-OE2 3.03Å; R231-E254 PolarHBondContact NH1-OE2 3.37Å; R231-E254 IonicContact NH2-OE1 3.54Å; R231-E254 PolarHBondContact NH2-OE1 2.71Å; A252-E254 HydrophobicContact CB-CB 4.38Å; A252-E254 VanDerWaalsContact CB-OE2 3.28Å; A252-E254 WeakPolarHBondContact CB-OE2 3.45Å; A252-E254 PolarHBondContact O-N 2.72Å; E254-L256 PolarHBondContact O-N 3.03Å
255	D	80	Confident	74.6	Confident	36 Å²	36	92 Å²	92	19%	0.193	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-71.8	-17.8	174.6	-72.7	-58.7	0	0	0	112.9	A251 A252 V253 E257 K258	A251-D255 VanDerWaalsContact CA-OD2 3.22Å; A251-D255 WeakPolarHBondContact CA-OD2 3.25Å; A251-D255 HydrophobicContact CB-CB 4.26Å; A252-D255 PolarHBondContact N-OD2 3.07Å; A252-D255 WeakPolarHBondContact O-CB 3.46Å; A252-D255 PolarHBondContact O-N 2.76Å; A252-D255 VanDerWaalsContact O-N 3.17Å; V253-D255 VanDerWaalsContact C-N 3.26Å; V253-D255 PolarHBondContact O-N 3Å; D255-E257 PolarHBondContact O-N 2.95Å; D255-K258 WeakPolarHBondContact O-CB 3.38Å; D255-K258 PolarHBondContact O-N 2.99Å; D255-K258 VanDerWaalsContact OD1-CE 3.25Å; D255-K258 WeakPolarHBondContact OD1-CE 3.18Å; D255-K258 IonicContact OD1-NZ 2.76Å; D255-K258 PolarHBondContact OD1-NZ 3.39Å
256	L	75.7	Confident	74.7	Confident	28 Å²	28	95.5 Å²	95.5	15%	0.147	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-65.7	-16.7	-179.8	-63.4	174.9	0	0	0	114	Q237 R240 L241 I244 V253 E254	Q237-L256 HydrophobicContact CB-CD1 3.68Å; Q237-L256 HydrophobicContact CG-CD1 3.97Å; R240-L256 HydrophobicContact CB-CD2 3.54Å; L241-L256 HydrophobicContact CB-CD1 4.42Å; L241-L256 HydrophobicContact CB-CD2 4.15Å; I244-L256 HydrophobicContact CD1-CD2 3.88Å; V253-L256 HydrophobicContact CG1-CD1 3.78Å; V253-L256 WeakPolarHBondContact O-CB 3.41Å; V253-L256 WeakPolarHBondContact O-CD1 2.93Å; V253-L256 WeakPolarHBondContact O-CG 3.35Å; V253-L256 PolarHBondContact O-N 3.22Å; V253-L256 VanDerWaalsContact O-N 3.17Å; E254-L256 PolarHBondContact O-N 3.03Å
257	E	70.8	Confident	75.3	Confident	167 Å²	167	92.5 Å²	92.5	78%	0.78	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-90.3	-7.6	-179	-58	-166.9	164.1	0	0	112.9	D255 P259	D255-E257 PolarHBondContact O-N 2.95Å; E257-P259 WeakPolarHBondContact O-CD 3.22Å
258	K	69.9	Low	76	Confident	142 Å²	142	84.6 Å²	84.6	62%	0.617	48%	0.48	S	S	*	.			trans	-70.7	113.8	-179.7	-70.9	176.7	173.9	172.7	0	111.1	D255	D255-K258 WeakPolarHBondContact O-CB 3.38Å; D255-K258 PolarHBondContact O-N 2.99Å; D255-K258 VanDerWaalsContact OD1-CE 3.25Å; D255-K258 WeakPolarHBondContact OD1-CE 3.18Å; D255-K258 IonicContact OD1-NZ 2.76Å; D255-K258 PolarHBondContact OD1-NZ 3.39Å
259	P	52.3	Low	76.5	Confident	135 Å²	135	83 Å²	83	88%	0.877	47%	0.471	S	S	*	.	S	Bend	trans	-73.5	137.8	178.9	-14.2	30.9	0	0	0	111.2	E257	E257-P259 WeakPolarHBondContact O-CD 3.22Å
260	G	56.5	Low	76.9	Confident	75 Å²	75	82.2 Å²	82.2	77%	0.773	46%	0.462	S	S	*	.			trans	140.1	-7.5	166.1	0	0	0	0	0	117.8
261	A	51	Low	77.4	Confident	100 Å²	100	78.5 Å²	78.5	83%	0.826	44%	0.441	S	S	*	.	S	Bend	trans	-76.2	-27	-176.9	0	0	0	0	0	114.5
262	D	54.3	Low	77.9	Confident	112 Å²	112	78.5 Å²	78.5	60%	0.599	44%	0.44	S	S	*	.			trans	-105.4	105	-174.2	-98.3	-52.2	0	0	0	112.6	E264 K652	D262-E264 PolarHBondContact O-N 2.75Å; D262-K652 IonicContact OD1-NZ 3.13Å; D262-K652 PolarHBondContact OD1-NZ 2.9Å
263	N	60.7	Low	78.3	Confident	142 Å²	142	83.9 Å²	83.9	76%	0.759	46%	0.458	S	S	*	.			trans	-65.2	110.3	154	-72.1	-35.8	0	0	0	108.1	K652	N263-K652 WeakPolarHBondContact O-CE 3.34Å; N263-K652 PolarHBondContact O-NZ 2.92Å
264	E	74	Confident	78.7	Confident	177 Å²	177	86.2 Å²	86.2	83%	0.827	47%	0.47	S	S	*	.			trans	-62.9	140.6	172.1	-65.8	-166.9	146.1	0	0	110.4	D262	D262-E264 PolarHBondContact O-N 2.75Å
265	V	84.7	Confident	79.3	Confident	43 Å²	43	81.8 Å²	81.8	26%	0.261	45%	0.45	S	S	.	.			trans	-110.4	141.5	177.1	-74.8	0	0	0	0	111.2	L285 L288 K652 A656	V265-L285 HydrophobicContact CB-CD2 4.34Å; V265-L285 HydrophobicContact CG2-CD2 4.21Å; V265-L288 HydrophobicContact CG1-CD1 3.71Å; V265-L288 HydrophobicContact CG2-CD1 4.47Å; V265-K652 HydrophobicContact CG2-CG 3.99Å; V265-A656 HydrophobicContact CG2-CB 3.92Å
266	N	90.7	Very high	79.9	Confident	95 Å²	95	84.4 Å²	84.4	51%	0.508	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-62	127.7	179	-60.9	-43.7	0	0	0	110.4	D280 V281	N266-D280 PolarHBondContact ND2-O 3.02Å; N266-V281 HydrophobicContact CB-CG2 3.83Å
267	P	92.9	Very high	80.8	Confident	34 Å²	34	85.7 Å²	85.7	22%	0.221	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-74	153.1	177.7	30.5	-34.9	0	0	0	112	L269 A656 L915	P267-L269 PolarHBondContact O-N 3.4Å; P267-A656 CarbonylContact C-O 3.53Å; P267-A656 WeakPolarHBondContact CA-O 3.27Å; P267-L915 HydrophobicContact CG-CD1 4.28Å
268	V	94.6	Very high	82	Confident	13 Å²	13	77.8 Å²	77.8	8%	0.079	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-61	120.6	171.7	175	0	0	0	0	109.8	V281 F282 L285 A656	V268-V281 HydrophobicContact CG2-CG1 4.34Å; V268-F282 HydrophobicContact CG1-CE1 4.32Å; V268-F282 HydrophobicContact CG1-CZ 3.83Å; V268-F282 HydrophobicContact CG2-CE1 3.81Å; V268-F282 HydrophobicContact CG2-CZ 4.11Å; V268-L285 HydrophobicContact CG2-CD1 3.69Å; V268-A656 PolarHBondContact N-O 2.67Å
269	L	95.3	Very high	83.2	Confident	36 Å²	36	75.2 Å²	75.2	19%	0.188	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-92.6	150.2	179.5	-52.5	-179.7	0	0	0	110.6	P267 R271 Y272 R665 L915	P267-L269 PolarHBondContact O-N 3.4Å; L269-R271 WeakPolarHBondContact CB-O 3.39Å; L269-Y272 HydrophobicContact CB-CD1 4.34Å; L269-Y272 HydrophobicContact CB-CE1 3.91Å; L269-Y272 HydrophobicContact CB-CE2 4.24Å; L269-Y272 HydrophobicContact CD1-CD1 4.26Å; L269-Y272 HydrophobicContact CD1-CE1 4.26Å; L269-Y272 HydrophobicContact CG-CE1 4.17Å; L269-Y272 PolarHBondContact N-OH 2.68Å; L269-Y272 WeakPolarHBondContact O-CE2 3.43Å; L269-Y272 PolarHBondContact O-OH 3.13Å; L269-R665 VanDerWaalsContact O-CD 3.3Å; L269-R665 WeakPolarHBondContact O-CD 3.35Å; L269-L915 HydrophobicContact CD2-CD2 4.43Å
270	L	94.7	Very high	85.3	Confident	56 Å²	56	71.7 Å²	71.7	29%	0.293	39%	0.39	S	S	.	.	S	Bend	trans	-68.1	-43.2	170.7	-65.2	-179.2	0	0	0	111.1	R665 L668 L669	L270-R665 HydrophobicContact CD2-CG 4.02Å; L270-R665 PolarHBondContact O-NH1 3.21Å; L270-L668 HydrophobicContact CD2-CB 3.87Å; L270-L668 HydrophobicContact CD2-CD1 3.91Å; L270-L669 HydrophobicContact CB-CD2 4.29Å
271	R	96	Very high	87.2	Confident	89 Å²	89	68.4 Å²	68.4	34%	0.336	36%	0.355	S	S	.	.	S	Bend	trans	-124	146.1	-179.8	-53	-169	-171.9	-118.1	19.3	109.9	L269 L424 G425 E427 L669	L269-R271 WeakPolarHBondContact CB-O 3.39Å; R271-L424 WeakPolarHBondContact CA-O 3.38Å; R271-G425 WeakPolarHBondContact CD-O 3.34Å; R271-G425 VanDerWaalsContact CG-O 3.29Å; R271-G425 WeakPolarHBondContact CG-O 3.37Å; R271-G425 PolarHBondContact NH1-O 3.06Å; R271-E427 IonicContact CZ-OE2 2.74Å; R271-E427 IonicContact NH1-OE2 3.79Å; R271-E427 PolarHBondContact NH1-OE2 3.05Å; R271-E427 IonicContact NH2-OE2 2.64Å; R271-E427 PolarHBondContact NH2-OE2 3.41Å; R271-L669 HydrophobicContact CG-CD2 3.63Å
272	Y	95.7	Very high	89.4	Confident	7 Å²	7	63.7 Å²	63.7	3%	0.027	32%	0.316	C	S	.	.			trans	-123.8	140.3	179.9	-62.2	-94.4	0	0	0	109.6	L269 Q277 Y278 V281 F282 L424	L269-Y272 HydrophobicContact CB-CD1 4.34Å; L269-Y272 HydrophobicContact CB-CE1 3.91Å; L269-Y272 HydrophobicContact CB-CE2 4.24Å; L269-Y272 HydrophobicContact CD1-CD1 4.26Å; L269-Y272 HydrophobicContact CD1-CE1 4.26Å; L269-Y272 HydrophobicContact CG-CE1 4.17Å; L269-Y272 PolarHBondContact N-OH 2.68Å; L269-Y272 WeakPolarHBondContact O-CE2 3.43Å; L269-Y272 PolarHBondContact O-OH 3.13Å; Y272-Q277 VanDerWaalsContact CA-OE1 3.3Å; Y272-Q277 HydrophobicContact CD1-CG 4.22Å; Y272-Y278 HydrophobicContact CD1-CD2 4.21Å; Y272-Y278 AromaticContact CD2-CD2 3.7Å; Y272-Y278 HydrophobicContact CD2-CD2 3.7Å; Y272-Y278 HydrophobicContact CD2-CE2 4.41Å; Y272-Y278 HydrophobicContact CE1-CD2 4.23Å; Y272-Y278 AromaticContact CE2-CD2 3.74Å; Y272-Y278 HydrophobicContact CE2-CD2 3.74Å; Y272-Y278 HydrophobicContact CE2-CE2 4.14Å; Y272-Y278 AromaticContact CG-CD2 3.95Å; Y272-Y278 HydrophobicContact CG-CD2 3.95Å; Y272-V281 HydrophobicContact CE1-CB 4.05Å; Y272-V281 HydrophobicContact CE1-CG1 4.26Å; Y272-V281 HydrophobicContact CE1-CG2 4Å; Y272-F282 HydrophobicContact CE2-CE2 4.39Å; Y272-F282 AromaticContact CZ-CE2 3.91Å; Y272-F282 VanDerWaalsContact OH-CE2 3.31Å; Y272-F282 WeakPolarHBondContact OH-CE2 3.38Å; Y272-L424 PolarHBondContact N-O 3.38Å
273	E	92	Very high	91.4	Very high	153 Å²	153	59.2 Å²	59.2	72%	0.715	29%	0.292	S	S	*	.	S	Bend	trans	-68	-38.4	-179.6	-63.7	-179.8	179.9	0	0	111.8
274	N	91.4	Very high	93.1	Very high	67 Å²	67	54.8 Å²	54.8	36%	0.358	27%	0.27	S	S	.	.	S	Bend	trans	-156.3	173.7	-175.5	57.3	63.4	0	0	0	110.9	Q276 Q277 Y278	N274-Q276 VanDerWaalsContact C-N 3.34Å; N274-Q276 PolarHBondContact O-N 2.76Å; N274-Q276 WeakPolarHBondContact OD1-CA 3.3Å; N274-Q276 WeakPolarHBondContact OD1-CB 3.49Å; N274-Q276 PolarHBondContact OD1-N 2.93Å; N274-Q277 PolarHBondContact OD1-N 2.63Å; N274-Y278 PolarHBondContact O-N 3.09Å
275	S	92.2	Very high	94.2	Very high	10 Å²	10	46.3 Å²	46.3	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-32.2	177.1	41	0	0	0	0	113.9	Y278 R279 T408	S275-Y278 WeakPolarHBondContact O-CB 3.47Å; S275-Y278 PolarHBondContact O-N 2.95Å; S275-R279 PolarHBondContact O-N 3.19Å; S275-T408 WeakPolarHBondContact CB-O 3.11Å; S275-T408 WeakPolarHBondContact O-CG2 3.39Å; S275-T408 PolarHBondContact OG-O 2.77Å
276	Q	93	Very high	94.8	Very high	92 Å²	92	44.4 Å²	44.4	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-68.2	-44	-179.8	-174.6	62.5	27.6	0	0	111.4	N274 Y278 R279 D280	N274-Q276 VanDerWaalsContact C-N 3.34Å; N274-Q276 PolarHBondContact O-N 2.76Å; N274-Q276 WeakPolarHBondContact OD1-CA 3.3Å; N274-Q276 WeakPolarHBondContact OD1-CB 3.49Å; N274-Q276 PolarHBondContact OD1-N 2.93Å; Q276-Y278 VanDerWaalsContact C-N 3.28Å; Q276-Y278 PolarHBondContact O-N 3.34Å; Q276-R279 VanDerWaalsContact O-CB 3.31Å; Q276-R279 WeakPolarHBondContact O-CB 3.34Å; Q276-R279 PolarHBondContact O-N 3.11Å; Q276-R279 VanDerWaalsContact O-N 3.13Å; Q276-D280 WeakPolarHBondContact CG-OD2 3.39Å; Q276-D280 PolarHBondContact NE2-OD1 3.44Å; Q276-D280 PolarHBondContact NE2-OD2 2.96Å; Q276-D280 WeakPolarHBondContact O-CB 3.42Å; Q276-D280 VanDerWaalsContact O-CG 3.25Å; Q276-D280 PolarHBondContact O-N 3.22Å
277	Q	95.3	Very high	95.1	Very high	55 Å²	55	43.1 Å²	43.1	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-60.7	-38.4	173.5	-169.3	-172.7	47.3	0	0	111.8	Y272 N274 D280 V281	Y272-Q277 VanDerWaalsContact CA-OE1 3.3Å; Y272-Q277 HydrophobicContact CD1-CG 4.22Å; N274-Q277 PolarHBondContact OD1-N 2.63Å; Q277-D280 PolarHBondContact O-N 3.31Å; Q277-V281 WeakPolarHBondContact O-CG2 3.39Å; Q277-V281 PolarHBondContact O-N 2.86Å; Q277-V281 VanDerWaalsContact O-N 3.12Å
278	Y	95.8	Very high	95.1	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-43.3	174.1	-176.1	-88.1	0	0	0	111.9	Y272 N274 S275 Q276 F282 I404 V407 T408 L423 L424 E621 L625	Y272-Y278 HydrophobicContact CD1-CD2 4.21Å; Y272-Y278 AromaticContact CD2-CD2 3.7Å; Y272-Y278 HydrophobicContact CD2-CD2 3.7Å; Y272-Y278 HydrophobicContact CD2-CE2 4.41Å; Y272-Y278 HydrophobicContact CE1-CD2 4.23Å; Y272-Y278 AromaticContact CE2-CD2 3.74Å; Y272-Y278 HydrophobicContact CE2-CD2 3.74Å; Y272-Y278 HydrophobicContact CE2-CE2 4.14Å; Y272-Y278 AromaticContact CG-CD2 3.95Å; Y272-Y278 HydrophobicContact CG-CD2 3.95Å; N274-Y278 PolarHBondContact O-N 3.09Å; S275-Y278 WeakPolarHBondContact O-CB 3.47Å; S275-Y278 PolarHBondContact O-N 2.95Å; Q276-Y278 VanDerWaalsContact C-N 3.28Å; Q276-Y278 PolarHBondContact O-N 3.34Å; Y278-F282 HydrophobicContact CD1-CD2 4.24Å; Y278-F282 HydrophobicContact CD2-CD2 4.03Å; Y278-F282 AromaticContact CD2-CE2 4Å; Y278-F282 HydrophobicContact CD2-CE2 4Å; Y278-F282 AromaticContact CE1-CD2 3.92Å; Y278-F282 HydrophobicContact CE1-CD2 3.92Å; Y278-F282 HydrophobicContact CE1-CE2 4.44Å; Y278-F282 AromaticContact CE2-CD2 3.7Å; Y278-F282 HydrophobicContact CE2-CD2 3.7Å; Y278-F282 AromaticContact CE2-CE2 3.44Å; Y278-F282 HydrophobicContact CE2-CE2 3.44Å; Y278-F282 VanDerWaalsContact CE2-CE2 3.44Å; Y278-F282 HydrophobicContact CG-CD2 4.28Å; Y278-F282 AromaticContact CZ-CD2 3.62Å; Y278-F282 AromaticContact CZ-CE2 3.68Å; Y278-F282 PolarHBondContact O-N 3.4Å; Y278-F282 VanDerWaalsContact O-N 3.1Å; Y278-I404 HydrophobicContact CD1-CG2 4.41Å; Y278-I404 HydrophobicContact CE1-CG2 4.42Å; Y278-V407 HydrophobicContact CE1-CG1 4.42Å; Y278-T408 HydrophobicContact CD1-CG2 3.88Å; Y278-L423 HydrophobicContact CE2-CD1 4.39Å; Y278-L423 HydrophobicContact CE2-CG 4.25Å; Y278-L424 HydrophobicContact CD2-CD2 4.2Å; Y278-L424 HydrophobicContact CG-CD2 4.16Å; Y278-E621 WeakPolarHBondContact CE2-OE1 3.39Å; Y278-E621 VanDerWaalsContact CZ-OE1 3.3Å; Y278-E621 PolarHBondContact OH-OE1 3.44Å; Y278-L625 HydrophobicContact CE1-CD1 3.98Å
279	R	95.2	Very high	95.2	Very high	88 Å²	88	44.1 Å²	44.1	33%	0.332	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-49.1	175.2	-170.6	179.1	165	-81.7	4.2	112.1	S275 Q276 V281 F282 I283 I404 T408	S275-R279 PolarHBondContact O-N 3.19Å; Q276-R279 VanDerWaalsContact O-CB 3.31Å; Q276-R279 WeakPolarHBondContact O-CB 3.34Å; Q276-R279 PolarHBondContact O-N 3.11Å; Q276-R279 VanDerWaalsContact O-N 3.13Å; R279-V281 PolarHBondContact O-N 3.18Å; R279-F282 PolarHBondContact O-N 2.59Å; R279-I283 HydrophobicContact CG-CG1 3.78Å; R279-I283 WeakPolarHBondContact O-CB 3.25Å; R279-I283 WeakPolarHBondContact O-CG1 3.31Å; R279-I283 PolarHBondContact O-N 3.04Å; R279-I404 HydrophobicContact CB-CG2 4.38Å; R279-I404 HydrophobicContact CG-CG2 4.24Å; R279-T408 HydrophobicContact CB-CG2 3.96Å
280	D	95	Very high	95.2	Very high	61 Å²	61	42.6 Å²	42.6	33%	0.326	21%	0.205	S	C	.	.	H	α-helix	trans	-80.2	-7.4	-170.9	-60.3	-18.6	0	0	0	113.1	N266 Q276 Q277	N266-D280 PolarHBondContact ND2-O 3.02Å; Q276-D280 WeakPolarHBondContact CG-OD2 3.39Å; Q276-D280 PolarHBondContact NE2-OD1 3.44Å; Q276-D280 PolarHBondContact NE2-OD2 2.96Å; Q276-D280 WeakPolarHBondContact O-CB 3.42Å; Q276-D280 VanDerWaalsContact O-CG 3.25Å; Q276-D280 PolarHBondContact O-N 3.22Å; Q277-D280 PolarHBondContact O-N 3.31Å
281	V	95.9	Very high	95.1	Very high	6 Å²	6	44.9 Å²	44.9	4%	0.036	22%	0.218	C	C	.	.	H	α-helix	trans	-86.9	-55	161.5	171.2	0	0	0	0	110.8	N266 V268 Y272 Q277 R279 L285	N266-V281 HydrophobicContact CB-CG2 3.83Å; V268-V281 HydrophobicContact CG2-CG1 4.34Å; Y272-V281 HydrophobicContact CE1-CB 4.05Å; Y272-V281 HydrophobicContact CE1-CG1 4.26Å; Y272-V281 HydrophobicContact CE1-CG2 4Å; Q277-V281 WeakPolarHBondContact O-CG2 3.39Å; Q277-V281 PolarHBondContact O-N 2.86Å; Q277-V281 VanDerWaalsContact O-N 3.12Å; R279-V281 PolarHBondContact O-N 3.18Å; V281-L285 HydrophobicContact CG1-CD1 4.09Å; V281-L285 WeakPolarHBondContact O-CD1 3.49Å; V281-L285 VanDerWaalsContact O-CG 3.25Å; V281-L285 WeakPolarHBondContact O-CG 3.37Å
282	F	97.5	Very high	94.8	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-79.8	-28.3	-169.4	-80.5	-68.9	0	0	0	115.6	V268 Y272 Y278 R279 V286 I404 E621 P622 L658	V268-F282 HydrophobicContact CG1-CE1 4.32Å; V268-F282 HydrophobicContact CG1-CZ 3.83Å; V268-F282 HydrophobicContact CG2-CE1 3.81Å; V268-F282 HydrophobicContact CG2-CZ 4.11Å; Y272-F282 HydrophobicContact CE2-CE2 4.39Å; Y272-F282 AromaticContact CZ-CE2 3.91Å; Y272-F282 VanDerWaalsContact OH-CE2 3.31Å; Y272-F282 WeakPolarHBondContact OH-CE2 3.38Å; Y278-F282 HydrophobicContact CD1-CD2 4.24Å; Y278-F282 HydrophobicContact CD2-CD2 4.03Å; Y278-F282 AromaticContact CD2-CE2 4Å; Y278-F282 HydrophobicContact CD2-CE2 4Å; Y278-F282 AromaticContact CE1-CD2 3.92Å; Y278-F282 HydrophobicContact CE1-CD2 3.92Å; Y278-F282 HydrophobicContact CE1-CE2 4.44Å; Y278-F282 AromaticContact CE2-CD2 3.7Å; Y278-F282 HydrophobicContact CE2-CD2 3.7Å; Y278-F282 AromaticContact CE2-CE2 3.44Å; Y278-F282 HydrophobicContact CE2-CE2 3.44Å; Y278-F282 VanDerWaalsContact CE2-CE2 3.44Å; Y278-F282 HydrophobicContact CG-CD2 4.28Å; Y278-F282 AromaticContact CZ-CD2 3.62Å; Y278-F282 AromaticContact CZ-CE2 3.68Å; Y278-F282 PolarHBondContact O-N 3.4Å; Y278-F282 VanDerWaalsContact O-N 3.1Å; R279-F282 PolarHBondContact O-N 2.59Å; F282-V286 WeakPolarHBondContact O-CG2 3.49Å; F282-V286 PolarHBondContact O-N 3.4Å; F282-V286 VanDerWaalsContact O-N 3.14Å; F282-I404 HydrophobicContact CB-CD1 3.71Å; F282-I404 HydrophobicContact CB-CG1 4.24Å; F282-E621 HydrophobicContact CE1-CB 4.2Å; F282-E621 HydrophobicContact CE1-CG 4.41Å; F282-E621 HydrophobicContact CE2-CG 4.43Å; F282-E621 HydrophobicContact CZ-CB 4.13Å; F282-E621 HydrophobicContact CZ-CG 3.98Å; F282-P622 HydrophobicContact CB-CG 4.3Å; F282-P622 HydrophobicContact CD1-CG 3.58Å; F282-P622 HydrophobicContact CE1-CG 4.16Å; F282-P622 HydrophobicContact CG-CG 4.15Å; F282-L658 HydrophobicContact CD1-CD1 4.08Å; F282-L658 HydrophobicContact CE1-CD1 4.21Å
283	I	97	Very high	94.5	Very high	19 Å²	19	43.2 Å²	43.2	10%	0.097	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-53.7	178.8	-66.8	-69.1	0	0	0	111.5	R279 L285 V286 E287 R401 I404	R279-I283 HydrophobicContact CG-CG1 3.78Å; R279-I283 WeakPolarHBondContact O-CB 3.25Å; R279-I283 WeakPolarHBondContact O-CG1 3.31Å; R279-I283 PolarHBondContact O-N 3.04Å; I283-L285 VanDerWaalsContact C-N 3.26Å; I283-L285 PolarHBondContact O-N 3.45Å; I283-V286 PolarHBondContact O-N 3.46Å; I283-V286 VanDerWaalsContact O-N 3.15Å; I283-E287 HydrophobicContact CG2-CG 4.43Å; I283-E287 WeakPolarHBondContact O-CG 3.46Å; I283-E287 PolarHBondContact O-N 2.86Å; I283-R401 HydrophobicContact CD1-CB 3.91Å; I283-R401 HydrophobicContact CD1-CG 4.02Å; I283-I404 HydrophobicContact CD1-CB 3.87Å; I283-I404 HydrophobicContact CD1-CD1 3.83Å; I283-I404 HydrophobicContact CD1-CG1 4.49Å; I283-I404 HydrophobicContact CD1-CG2 3.92Å; I283-I404 HydrophobicContact CG1-CB 4.46Å; I283-I404 HydrophobicContact CG1-CD1 4.41Å; I283-I404 HydrophobicContact CG1-CG2 3.96Å
284	P	96.3	Very high	94.4	Very high	48 Å²	48	39.3 Å²	39.3	31%	0.312	19%	0.194	S	C	.	.	H	α-helix	trans	-61.8	-32	-179.4	-24.2	35.6	0	0	0	113.6	E287 L288	P284-E287 PolarHBondContact O-N 2.72Å; P284-L288 WeakPolarHBondContact O-CB 3.45Å; P284-L288 WeakPolarHBondContact O-CG 3.47Å; P284-L288 PolarHBondContact O-N 3.13Å
285	L	96.6	Very high	94.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.5	-38.7	177.5	-62.6	175.7	0	0	0	112.1	V265 V268 V281 I283 E287 E289 A653 A656 L658	V265-L285 HydrophobicContact CB-CD2 4.34Å; V265-L285 HydrophobicContact CG2-CD2 4.21Å; V268-L285 HydrophobicContact CG2-CD1 3.69Å; V281-L285 HydrophobicContact CG1-CD1 4.09Å; V281-L285 WeakPolarHBondContact O-CD1 3.49Å; V281-L285 VanDerWaalsContact O-CG 3.25Å; V281-L285 WeakPolarHBondContact O-CG 3.37Å; I283-L285 VanDerWaalsContact C-N 3.26Å; I283-L285 PolarHBondContact O-N 3.45Å; L285-E287 VanDerWaalsContact C-N 3.32Å; L285-E289 PolarHBondContact O-N 3.11Å; L285-E289 VanDerWaalsContact O-N 3.15Å; L285-A653 HydrophobicContact CD2-CB 4.35Å; L285-A656 HydrophobicContact CD1-CB 4.49Å; L285-A656 HydrophobicContact CD2-CB 3.52Å; L285-L658 HydrophobicContact CB-CD1 4.28Å; L285-L658 HydrophobicContact CB-CD2 4.23Å
286	V	97.4	Very high	93.7	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-69	-31.7	173.3	171.4	0	0	0	0	111.6	F282 I283 A290 F397 M400 R401 I404 P622	F282-V286 WeakPolarHBondContact O-CG2 3.49Å; F282-V286 PolarHBondContact O-N 3.4Å; F282-V286 VanDerWaalsContact O-N 3.14Å; I283-V286 PolarHBondContact O-N 3.46Å; I283-V286 VanDerWaalsContact O-N 3.15Å; V286-A290 VanDerWaalsContact O-CB 3.31Å; V286-A290 WeakPolarHBondContact O-CB 3.24Å; V286-A290 PolarHBondContact O-N 2.74Å; V286-F397 HydrophobicContact CG1-CB 4.16Å; V286-F397 HydrophobicContact CG1-CD1 4.29Å; V286-M400 HydrophobicContact CG1-CB 4Å; V286-M400 HydrophobicContact CG1-CE 4.18Å; V286-M400 HydrophobicContact CG2-CB 4.33Å; V286-R401 HydrophobicContact CB-CG 4.34Å; V286-R401 HydrophobicContact CG1-CG 3.7Å; V286-I404 HydrophobicContact CG2-CD1 4.07Å; V286-P622 HydrophobicContact CG2-CB 3.83Å; V286-P622 HydrophobicContact CG2-CG 3.76Å
287	E	96.7	Very high	93.2	Very high	68 Å²	68	40.6 Å²	40.6	32%	0.318	19%	0.194	S	C	.	.	H	α-helix	trans	-73.9	-43.1	177	-68.9	178.3	155.4	0	0	111.9	I283 P284 L285 E289 A290 D291 R401	I283-E287 HydrophobicContact CG2-CG 4.43Å; I283-E287 WeakPolarHBondContact O-CG 3.46Å; I283-E287 PolarHBondContact O-N 2.86Å; P284-E287 PolarHBondContact O-N 2.72Å; L285-E287 VanDerWaalsContact C-N 3.32Å; E287-E289 VanDerWaalsContact C-N 3.3Å; E287-E289 PolarHBondContact O-N 2.86Å; E287-A290 PolarHBondContact O-N 2.74Å; E287-A290 VanDerWaalsContact O-N 3.13Å; E287-D291 PolarHBondContact O-N 3.09Å; E287-R401 WeakPolarHBondContact OE1-CD 3.49Å; E287-R401 IonicContact OE1-CZ 3.57Å; E287-R401 IonicContact OE1-NE 3.48Å; E287-R401 IonicContact OE1-NH1 3.74Å; E287-R401 PolarHBondContact OE1-NH1 2.81Å
288	L	94.2	Very high	92.6	Very high	52 Å²	52	42.5 Å²	42.5	27%	0.272	20%	0.203	S	C	.	.	H	α-helix	trans	-60.8	-35.9	172	-77.3	-175.1	0	0	0	113.2	V265 P284 Y292 C650 K652 A653	V265-L288 HydrophobicContact CG1-CD1 3.71Å; V265-L288 HydrophobicContact CG2-CD1 4.47Å; P284-L288 WeakPolarHBondContact O-CB 3.45Å; P284-L288 WeakPolarHBondContact O-CG 3.47Å; P284-L288 PolarHBondContact O-N 3.13Å; L288-Y292 WeakPolarHBondContact O-CB 3.24Å; L288-Y292 PolarHBondContact O-N 3.23Å; L288-C650 PolarHBondContact O-SG 3.08Å; L288-C650 VanDerWaalsContact O-SG 3.34Å; L288-K652 HydrophobicContact CD1-CB 4.26Å; L288-K652 HydrophobicContact CD1-CD 4.14Å; L288-K652 HydrophobicContact CD1-CG 3.95Å; L288-A653 HydrophobicContact CB-CB 4.48Å
289	E	95.4	Very high	91.6	Very high	17 Å²	17	46.1 Å²	46.1	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-42.5	172.5	-174.7	66.5	-167.7	0	0	111.2	L285 E287 Y292 D293 F397 I648 T649 C650 L658	L285-E289 PolarHBondContact O-N 3.11Å; L285-E289 VanDerWaalsContact O-N 3.15Å; E287-E289 VanDerWaalsContact C-N 3.3Å; E287-E289 PolarHBondContact O-N 2.86Å; E289-Y292 PolarHBondContact O-N 2.86Å; E289-D293 VanDerWaalsContact O-CB 3.25Å; E289-D293 WeakPolarHBondContact O-CB 3.49Å; E289-D293 PolarHBondContact O-N 3.08Å; E289-F397 HydrophobicContact CB-CE1 4.22Å; E289-F397 HydrophobicContact CG-CE1 3.7Å; E289-F397 HydrophobicContact CG-CZ 4.38Å; E289-I648 WeakPolarHBondContact OE2-CG2 3.47Å; E289-T649 WeakPolarHBondContact OE1-CB 3.47Å; E289-T649 PolarHBondContact OE1-N 2.69Å; E289-T649 PolarHBondContact OE1-OG1 3.41Å; E289-T649 PolarHBondContact OE2-N 3.06Å; E289-C650 WeakPolarHBondContact OE2-CA 3.33Å; E289-C650 WeakPolarHBondContact OE2-CB 3.45Å; E289-C650 PolarHBondContact OE2-N 3.11Å; E289-L658 HydrophobicContact CB-CD2 4.31Å
290	A	95.7	Very high	90.7	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-47.7	-179.2	0	0	0	0	0	112.8	V286 E287 Y292 K294 W392 F397	V286-A290 VanDerWaalsContact O-CB 3.31Å; V286-A290 WeakPolarHBondContact O-CB 3.24Å; V286-A290 PolarHBondContact O-N 2.74Å; E287-A290 PolarHBondContact O-N 2.74Å; E287-A290 VanDerWaalsContact O-N 3.13Å; A290-Y292 VanDerWaalsContact C-N 3.34Å; A290-K294 VanDerWaalsContact O-CB 3.26Å; A290-K294 WeakPolarHBondContact O-CB 3.33Å; A290-K294 PolarHBondContact O-N 2.8Å; A290-W392 HydrophobicContact CB-CZ2 4.17Å; A290-W392 WeakPolarHBondContact O-CZ2 3.31Å; A290-F397 HydrophobicContact CB-CB 3.76Å; A290-F397 HydrophobicContact CB-CD1 3.77Å; A290-F397 HydrophobicContact CB-CD2 3.78Å; A290-F397 HydrophobicContact CB-CE1 4.33Å; A290-F397 HydrophobicContact CB-CE2 4.31Å; A290-F397 HydrophobicContact CB-CG 3.47Å; A290-F397 VanDerWaalsContact CB-CG 3.47Å
291	D	93.6	Very high	90	Very high	104 Å²	104	43.8 Å²	43.8	56%	0.556	22%	0.218	S	C	*	.	H	α-helix	trans	-70	-32.8	-179.3	-74.8	-26.8	0	0	0	112	E287 K295	E287-D291 PolarHBondContact O-N 3.09Å; D291-K295 WeakPolarHBondContact O-CB 3.24Å; D291-K295 PolarHBondContact O-N 2.85Å
292	Y	90	Very high	89.3	Confident	37 Å²	37	44.3 Å²	44.3	15%	0.145	22%	0.221	C	C	.	.	H	α-helix	trans	-73.9	-44	175.4	-178.2	-99.1	0	0	0	112.3	P22 L288 E289 A290 K294 K295 I296 T649 C650	P22-Y292 PolarHBondContact O-OH 3.44Å; L288-Y292 WeakPolarHBondContact O-CB 3.24Å; L288-Y292 PolarHBondContact O-N 3.23Å; E289-Y292 PolarHBondContact O-N 2.86Å; A290-Y292 VanDerWaalsContact C-N 3.34Å; Y292-K294 VanDerWaalsContact C-N 3.25Å; Y292-K294 PolarHBondContact O-N 2.9Å; Y292-K295 PolarHBondContact O-N 2.84Å; Y292-K295 VanDerWaalsContact O-N 3.15Å; Y292-I296 HydrophobicContact CD1-CD1 4Å; Y292-I296 HydrophobicContact CE1-CD1 3.32Å; Y292-I296 HydrophobicContact CE1-CG1 4.11Å; Y292-I296 PolarHBondContact O-N 3Å; Y292-T649 WeakPolarHBondContact CD1-OG1 3.41Å; Y292-T649 WeakPolarHBondContact CE1-O 3.29Å; Y292-C650 HydrophobicContact CD1-CB 3.77Å; Y292-C650 HydrophobicContact CG-CB 3.86Å
293	D	88.9	Confident	88.7	Confident	23 Å²	23	49.3 Å²	49.3	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-38	171.6	-179.2	63.6	0	0	0	111.7	E289 K297 W392 F397	E289-D293 VanDerWaalsContact O-CB 3.25Å; E289-D293 WeakPolarHBondContact O-CB 3.49Å; E289-D293 PolarHBondContact O-N 3.08Å; D293-K297 WeakPolarHBondContact O-CG 3.26Å; D293-K297 PolarHBondContact O-N 3.32Å; D293-K297 IonicContact OD1-NZ 2.74Å; D293-K297 PolarHBondContact OD1-NZ 3.25Å; D293-K297 IonicContact OD2-NZ 2.76Å; D293-K297 PolarHBondContact OD2-NZ 3.47Å; D293-W392 PolarHBondContact OD2-NE1 3.49Å; D293-F397 HydrophobicContact CB-CE2 4.31Å; D293-F397 HydrophobicContact CB-CZ 3.96Å
294	K	90.3	Very high	88	Confident	72 Å²	72	53.3 Å²	53.3	31%	0.313	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-51.4	171.7	-174.8	-175	170.1	-165.2	0	111.3	A290 Y292 I296 K297 E298 W392	A290-K294 VanDerWaalsContact O-CB 3.26Å; A290-K294 WeakPolarHBondContact O-CB 3.33Å; A290-K294 PolarHBondContact O-N 2.8Å; Y292-K294 VanDerWaalsContact C-N 3.25Å; Y292-K294 PolarHBondContact O-N 2.9Å; K294-I296 VanDerWaalsContact C-N 3.3Å; K294-I296 PolarHBondContact O-N 2.88Å; K294-K297 PolarHBondContact O-N 2.72Å; K294-E298 WeakPolarHBondContact CE-OE1 3.44Å; K294-E298 WeakPolarHBondContact CE-OE2 3.21Å; K294-E298 HydrophobicContact CG-CG 4.18Å; K294-E298 WeakPolarHBondContact O-CB 3.23Å; K294-E298 WeakPolarHBondContact O-CG 3.37Å; K294-E298 PolarHBondContact O-N 3.21Å; K294-W392 VanDerWaalsContact CA-CD1 3.48Å; K294-W392 HydrophobicContact CB-CD2 3.77Å; K294-W392 HydrophobicContact CB-CE3 4.28Å; K294-W392 HydrophobicContact CB-CG 4.03Å; K294-W392 HydrophobicContact CB-CH2 4.46Å; K294-W392 HydrophobicContact CB-CZ2 4Å; K294-W392 HydrophobicContact CD-CD2 4.32Å; K294-W392 HydrophobicContact CD-CE3 4Å; K294-W392 HydrophobicContact CD-CH2 4.43Å; K294-W392 HydrophobicContact CD-CZ3 4.05Å; K294-W392 HydrophobicContact CG-CD2 3.78Å; K294-W392 HydrophobicContact CG-CE3 3.94Å; K294-W392 HydrophobicContact CG-CG 4.02Å; K294-W392 HydrophobicContact CG-CZ3 4.41Å
295	K	85.7	Confident	87.5	Confident	124 Å²	124	51.5 Å²	51.5	54%	0.539	25%	0.254	S	S	.	.	H	α-helix	trans	-56.5	-42.8	178.2	-173.5	-176.6	177	-169	0	111.5	E23 D291 Y292 S299	E23-K295 IonicContact OE1-NZ 2.8Å; D291-K295 WeakPolarHBondContact O-CB 3.24Å; D291-K295 PolarHBondContact O-N 2.85Å; Y292-K295 PolarHBondContact O-N 2.84Å; Y292-K295 VanDerWaalsContact O-N 3.15Å; K295-S299 VanDerWaalsContact O-CB 3.31Å; K295-S299 WeakPolarHBondContact O-CB 3.29Å; K295-S299 PolarHBondContact O-N 3.07Å; K295-S299 PolarHBondContact O-OG 2.86Å
296	I	81.8	Confident	87	Confident	17 Å²	17	56.1 Å²	56.1	9%	0.087	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-60.6	172.5	-70.7	175.8	0	0	0	110.1	Y292 K294 E298 S299 L300	Y292-I296 HydrophobicContact CD1-CD1 4Å; Y292-I296 HydrophobicContact CE1-CD1 3.32Å; Y292-I296 HydrophobicContact CE1-CG1 4.11Å; Y292-I296 PolarHBondContact O-N 3Å; K294-I296 VanDerWaalsContact C-N 3.3Å; K294-I296 PolarHBondContact O-N 2.88Å; I296-E298 VanDerWaalsContact C-N 3.3Å; I296-E298 PolarHBondContact O-N 2.79Å; I296-S299 PolarHBondContact O-N 3.3Å; I296-S299 PolarHBondContact O-OG 3.18Å; I296-L300 HydrophobicContact CG2-CD1 3.78Å; I296-L300 HydrophobicContact CG2-CG 4.43Å; I296-L300 WeakPolarHBondContact O-CG 3.4Å; I296-L300 PolarHBondContact O-N 2.91Å
297	K	82.9	Confident	86.6	Confident	54 Å²	54	57 Å²	57	24%	0.235	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-34.2	-172.9	-69.8	-161.9	-177.4	72.5	0	113	D293 K294 L300 F390 W392	D293-K297 WeakPolarHBondContact O-CG 3.26Å; D293-K297 PolarHBondContact O-N 3.32Å; D293-K297 IonicContact OD1-NZ 2.74Å; D293-K297 PolarHBondContact OD1-NZ 3.25Å; D293-K297 IonicContact OD2-NZ 2.76Å; D293-K297 PolarHBondContact OD2-NZ 3.47Å; K294-K297 PolarHBondContact O-N 2.72Å; K297-L300 PolarHBondContact O-N 3.15Å; K297-F390 HydrophobicContact CB-CB 4.06Å; K297-W392 HydrophobicContact CB-CB 4.37Å
298	E	82.8	Confident	86.2	Confident	96 Å²	96	59 Å²	59	45%	0.449	30%	0.296	S	S	.	.	H	α-helix	trans	-76.4	-22.1	176.1	-68.6	-178	169.3	0	0	113.3	K294 I296 K301	K294-E298 WeakPolarHBondContact CE-OE1 3.44Å; K294-E298 WeakPolarHBondContact CE-OE2 3.21Å; K294-E298 HydrophobicContact CG-CG 4.18Å; K294-E298 WeakPolarHBondContact O-CB 3.23Å; K294-E298 WeakPolarHBondContact O-CG 3.37Å; K294-E298 PolarHBondContact O-N 3.21Å; I296-E298 VanDerWaalsContact C-N 3.3Å; I296-E298 PolarHBondContact O-N 2.79Å; E298-K301 WeakPolarHBondContact O-CE 3.36Å
299	S	75.3	Confident	85.9	Confident	75 Å²	75	58.9 Å²	58.9	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-76.6	-26	170.6	75.8	0	0	0	0	113.5	K295 I296 K301	K295-S299 VanDerWaalsContact O-CB 3.31Å; K295-S299 WeakPolarHBondContact O-CB 3.29Å; K295-S299 PolarHBondContact O-N 3.07Å; K295-S299 PolarHBondContact O-OG 2.86Å; I296-S299 PolarHBondContact O-N 3.3Å; I296-S299 PolarHBondContact O-OG 3.18Å; S299-K301 PolarHBondContact O-N 2.87Å
300	L	76.7	Confident	85.5	Confident	11 Å²	11	61.8 Å²	61.8	6%	0.058	31%	0.305	C	S	.	.			trans	-80.9	96	-176.5	-71.4	172.2	0	0	0	111.3	I28 I296 K297 E331 L332 F390	I28-L300 HydrophobicContact CD1-CD1 3.63Å; I28-L300 HydrophobicContact CD1-CD2 4.32Å; I28-L300 HydrophobicContact CG1-CD1 4.43Å; I296-L300 HydrophobicContact CG2-CD1 3.78Å; I296-L300 HydrophobicContact CG2-CG 4.43Å; I296-L300 WeakPolarHBondContact O-CG 3.4Å; I296-L300 PolarHBondContact O-N 2.91Å; K297-L300 PolarHBondContact O-N 3.15Å; L300-E331 VanDerWaalsContact CD2-O 3.26Å; L300-E331 WeakPolarHBondContact CD2-O 3.47Å; L300-L332 HydrophobicContact CB-CD1 3.82Å; L300-L332 HydrophobicContact CB-CG 4.26Å; L300-L332 HydrophobicContact CD2-CB 4.4Å; L300-L332 HydrophobicContact CD2-CD1 4.13Å; L300-L332 HydrophobicContact CD2-CG 4.15Å; L300-F390 HydrophobicContact CB-CD2 3.74Å; L300-F390 HydrophobicContact CB-CE2 4.16Å; L300-F390 HydrophobicContact CD1-CD2 4.19Å; L300-F390 HydrophobicContact CD1-CE2 4.07Å
301	K	80.1	Confident	85	Confident	90 Å²	90	65.3 Å²	65.3	39%	0.391	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.7	-178.6	-53.3	-170.2	180	-154.1	0	111	E298 S299 I388 E389	E298-K301 WeakPolarHBondContact O-CE 3.36Å; S299-K301 PolarHBondContact O-N 2.87Å; K301-I388 WeakPolarHBondContact CA-O 3.37Å; K301-E389 HydrophobicContact CD-CG 4.09Å; K301-E389 WeakPolarHBondContact CD-OE1 3.16Å; K301-E389 WeakPolarHBondContact CE-OE1 3.46Å; K301-E389 HydrophobicContact CG-CG 4.12Å; K301-E389 IonicContact NZ-OE1 2.73Å; K301-E389 PolarHBondContact NZ-OE1 2.74Å
302	L	81.8	Confident	84.1	Confident	17 Å²	17	61.8 Å²	61.8	9%	0.089	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125	167.3	-59.1	177.6	0	0	0	108.6	V305 F321 I323 L332 K387 I388	L302-V305 HydrophobicContact CB-CG2 3.55Å; L302-F321 HydrophobicContact CD1-CE2 4.14Å; L302-I323 HydrophobicContact CD1-CG1 4.21Å; L302-I323 HydrophobicContact CD1-CG2 4.21Å; L302-I323 HydrophobicContact CD2-CG2 4.08Å; L302-L332 HydrophobicContact CD1-CD2 4.38Å; L302-L332 HydrophobicContact CD2-CD1 3.81Å; L302-L332 HydrophobicContact CG-CD1 3.89Å; L302-L332 HydrophobicContact CG-CD2 4.43Å; L302-K387 CarbonylContact O-C 3.59Å; L302-K387 VanDerWaalsContact O-CA 3.31Å; L302-K387 WeakPolarHBondContact O-CA 3.21Å; L302-I388 HydrophobicContact CB-CB 4.34Å; L302-I388 PolarHBondContact N-O 3.22Å; L302-I388 PolarHBondContact O-N 2.89Å
303	E	83.9	Confident	83.2	Confident	106 Å²	106	69 Å²	69	50%	0.495	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	160.2	178.9	-55.3	-153.7	142.7	0	0	111.3	V305 F345 K387	E303-V305 PolarHBondContact O-N 2.81Å; E303-F345 HydrophobicContact CB-CD2 4.34Å; E303-F345 HydrophobicContact CB-CE2 3.81Å; E303-F345 HydrophobicContact CB-CZ 4.32Å; E303-F345 HydrophobicContact CG-CE2 4.35Å; E303-K387 HydrophobicContact CG-CG 4.34Å; E303-K387 VanDerWaalsContact OE1-CE 3.3Å; E303-K387 WeakPolarHBondContact OE1-CE 3.44Å
304	N	82.5	Confident	82.3	Confident	103 Å²	103	71.7 Å²	71.7	55%	0.551	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.5	33	178.7	-162.4	34.3	0	0	0	114.8	F345 T385 Y386	N304-F345 HydrophobicContact CB-CD1 4.23Å; N304-F345 HydrophobicContact CB-CE1 3.91Å; N304-F345 HydrophobicContact CB-CZ 4.36Å; N304-T385 WeakPolarHBondContact OD1-CG2 3.17Å; N304-Y386 PolarHBondContact N-O 3.38Å
305	V	85.6	Confident	81.6	Confident	9 Å²	9	73.5 Å²	73.5	6%	0.055	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	132.1	-174.2	-171.3	0	0	0	0	111.2	L302 E303 F321 T385 Y386 I388	L302-V305 HydrophobicContact CB-CG2 3.55Å; E303-V305 PolarHBondContact O-N 2.81Å; V305-F321 HydrophobicContact CG1-CB 3.68Å; V305-F321 HydrophobicContact CG1-CD2 4.1Å; V305-F321 HydrophobicContact CG1-CG 4.15Å; V305-T385 CarbonylContact O-C 3.59Å; V305-T385 WeakPolarHBondContact O-CA 3.48Å; V305-Y386 WeakPolarHBondContact CB-O 3.29Å; V305-Y386 PolarHBondContact N-O 2.76Å; V305-Y386 PolarHBondContact O-N 2.8Å; V305-I388 HydrophobicContact CB-CD1 4.17Å; V305-I388 HydrophobicContact CG1-CD1 3.92Å; V305-I388 HydrophobicContact CG2-CD1 4.28Å; V305-I388 HydrophobicContact CG2-CG1 4.44Å
306	S	86.4	Confident	81.3	Confident	97 Å²	97	72.4 Å²	72.4	68%	0.678	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.1	167.8	47.2	0	0	0	0	110.6	F321	S306-F321 WeakPolarHBondContact O-CB 3.43Å
307	V	88.1	Confident	81.5	Confident	21 Å²	21	74.5 Å²	74.5	13%	0.127	37%	0.374	C	S	.	.			trans	-118.1	124.3	-178.4	176.3	0	0	0	0	109.8	W309 A319 Y320 F321 Y386 I388	V307-W309 HydrophobicContact CG1-CD2 3.94Å; V307-W309 HydrophobicContact CG1-CG 4.23Å; V307-W309 HydrophobicContact CG1-CZ2 3.99Å; V307-A319 HydrophobicContact CG1-CB 3.49Å; V307-A319 VanDerWaalsContact CG1-CB 3.49Å; V307-Y320 CarbonylContact C-O 3.38Å; V307-Y320 WeakPolarHBondContact CA-O 3.47Å; V307-F321 HydrophobicContact CG2-CB 4.22Å; V307-Y386 HydrophobicContact CB-CD2 3.64Å; V307-Y386 HydrophobicContact CB-CE2 3.83Å; V307-Y386 HydrophobicContact CG2-CD2 3.43Å; V307-Y386 VanDerWaalsContact CG2-CD2 3.43Å; V307-Y386 HydrophobicContact CG2-CE2 4.14Å; V307-Y386 HydrophobicContact CG2-CG 3.91Å; V307-I388 HydrophobicContact CG2-CD1 4.44Å
308	R	88.2	Confident	81.8	Confident	110 Å²	110	72 Å²	72	42%	0.415	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.1	167.3	-175	178.5	76.3	-115.8	-2.1	108.5	E310 Y320 E368	R308-E310 IonicContact CZ-OE1 3.37Å; R308-E310 IonicContact NE-OE1 3.93Å; R308-E310 PolarHBondContact NE-OE1 3.37Å; R308-E310 IonicContact NH2-OE1 3.6Å; R308-E310 PolarHBondContact NH2-OE1 3.19Å; R308-Y320 PolarHBondContact N-O 3Å; R308-Y320 PolarHBondContact O-N 3.24Å; R308-E368 IonicContact CZ-OE2 3.65Å; R308-E368 VanDerWaalsContact CZ-OE2 3.29Å; R308-E368 IonicContact NH1-OE1 2.64Å; R308-E368 PolarHBondContact NH1-OE1 3.2Å; R308-E368 IonicContact NH1-OE2 2.7Å; R308-E368 PolarHBondContact NH1-OE2 3.38Å; R308-E368 IonicContact NH2-OE2 3.64Å; R308-E368 PolarHBondContact NH2-OE2 3.3Å
309	W	88.3	Confident	82.1	Confident	50 Å²	50	67.4 Å²	67.4	19%	0.189	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.6	179.1	-65.3	97.2	0	0	0	111.1	V307 R317 A319 I342 V353 M373 T379 Y386	V307-W309 HydrophobicContact CG1-CD2 3.94Å; V307-W309 HydrophobicContact CG1-CG 4.23Å; V307-W309 HydrophobicContact CG1-CZ2 3.99Å; W309-R317 HydrophobicContact CE3-CB 4.36Å; W309-A319 HydrophobicContact CE3-CB 4.03Å; W309-A319 HydrophobicContact CH2-CB 4.03Å; W309-A319 HydrophobicContact CZ3-CB 3.73Å; W309-I342 HydrophobicContact CH2-CD1 4.02Å; W309-V353 HydrophobicContact CH2-CG1 3.97Å; W309-V353 HydrophobicContact CZ2-CG1 4.12Å; W309-M373 HydrophobicContact CH2-CG 4.42Å; W309-M373 HydrophobicContact CH2-SD 4.47Å; W309-M373 HydrophobicContact CZ3-CG 3.8Å; W309-M373 HydrophobicContact CZ3-SD 4.32Å; W309-T379 HydrophobicContact CB-CG2 4.02Å; W309-T379 VanDerWaalsContact CD1-CG2 3.41Å; W309-T379 HydrophobicContact CD2-CG2 4.05Å; W309-T379 HydrophobicContact CG-CG2 3.56Å; W309-Y386 HydrophobicContact CZ2-CE1 4.07Å; W309-Y386 HydrophobicContact CZ2-CE2 4.46Å; W309-Y386 AromaticContact CZ2-CZ 3.95Å; W309-Y386 AromaticContact NE1-CE2 3.7Å; W309-Y386 AromaticContact NE1-CZ 3.56Å; W309-Y386 PolarHBondContact NE1-OH 2.97Å
310	E	87.9	Confident	82.9	Confident	77 Å²	77	66 Å²	66	36%	0.36	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	169.4	175.3	-69.4	-178.4	-139.5	0	0	110.5	R308 R317 V318 Y320	R308-E310 IonicContact CZ-OE1 3.37Å; R308-E310 IonicContact NE-OE1 3.93Å; R308-E310 PolarHBondContact NE-OE1 3.37Å; R308-E310 IonicContact NH2-OE1 3.6Å; R308-E310 PolarHBondContact NH2-OE1 3.19Å; E310-R317 WeakPolarHBondContact O-CA 3.38Å; E310-V318 PolarHBondContact N-O 2.83Å; E310-V318 PolarHBondContact O-N 2.82Å; E310-Y320 HydrophobicContact CB-CD2 4.11Å; E310-Y320 HydrophobicContact CB-CE2 3.91Å; E310-Y320 VanDerWaalsContact CD-CE2 3.4Å; E310-Y320 HydrophobicContact CG-CD2 3.92Å; E310-Y320 HydrophobicContact CG-CE2 4.02Å; E310-Y320 VanDerWaalsContact OE1-CD2 3.24Å; E310-Y320 WeakPolarHBondContact OE1-CD2 3.36Å; E310-Y320 WeakPolarHBondContact OE1-CE2 3.17Å
311	T	84	Confident	83.5	Confident	79 Å²	79	65.6 Å²	65.6	49%	0.485	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.2	175.1	-55.5	0	0	0	0	109.3	R316 R317	T311-R316 CarbonylContact C-O 3.6Å; T311-R316 WeakPolarHBondContact CA-O 3.38Å; T311-R317 PolarHBondContact OG1-NH1 3.41Å
312	A	74.3	Confident	83.5	Confident	29 Å²	29	68.4 Å²	68.4	24%	0.24	33%	0.331	C	S	.	.			trans	-74.2	166.1	179.4	0	0	0	0	0	112	N314 K315 R316 V318	A312-N314 VanDerWaalsContact CB-OD1 3.31Å; A312-N314 WeakPolarHBondContact CB-OD1 3.46Å; A312-N314 PolarHBondContact O-N 2.88Å; A312-N314 VanDerWaalsContact O-N 3.1Å; A312-K315 WeakPolarHBondContact O-CA 3.18Å; A312-K315 PolarHBondContact O-N 2.89Å; A312-R316 PolarHBondContact N-O 2.82Å; A312-V318 HydrophobicContact CB-CG2 3.83Å
313	L	72.2	Confident	83.1	Confident	189 Å²	189	68.3 Å²	68.3	99%	0.99	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.9	-178.8	-62.8	173.9	0	0	0	113.5	K315	L313-K315 VanDerWaalsContact C-N 3.25Å; L313-K315 PolarHBondContact O-N 3.23Å
314	N	69.4	Low	82	Confident	79 Å²	79	68 Å²	68	42%	0.422	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	13.5	174	64.9	7	0	0	0	113.7	A312 R316 E372	A312-N314 VanDerWaalsContact CB-OD1 3.31Å; A312-N314 WeakPolarHBondContact CB-OD1 3.46Å; A312-N314 PolarHBondContact O-N 2.88Å; A312-N314 VanDerWaalsContact O-N 3.1Å; N314-R316 PolarHBondContact O-N 3.29Å; N314-R316 VanDerWaalsContact O-N 3.15Å; N314-R316 WeakPolarHBondContact OD1-CB 3.22Å; N314-R316 PolarHBondContact OD1-N 2.91Å; N314-E372 PolarHBondContact ND2-OE1 3.25Å
315	K	75	Confident	80.7	Confident	111 Å²	111	64.9 Å²	64.9	48%	0.483	33%	0.33	S	S	.	.	S	Bend	trans	65.6	1.3	-177.2	-50.7	179.1	-175.6	-177.1	0	116	A312 L313 E561	A312-K315 WeakPolarHBondContact O-CA 3.18Å; A312-K315 PolarHBondContact O-N 2.89Å; L313-K315 VanDerWaalsContact C-N 3.25Å; L313-K315 PolarHBondContact O-N 3.23Å; K315-E561 PolarHBondContact NZ-O 3.3Å
316	R	79.9	Confident	79	Confident	100 Å²	100	65.7 Å²	65.7	38%	0.377	34%	0.338	S	S	.	.			trans	-73.5	154.4	174.1	-64.4	-179	174.3	175.5	-1.7	111.3	T311 A312 N314 E372	T311-R316 CarbonylContact C-O 3.6Å; T311-R316 WeakPolarHBondContact CA-O 3.38Å; A312-R316 PolarHBondContact N-O 2.82Å; N314-R316 PolarHBondContact O-N 3.29Å; N314-R316 VanDerWaalsContact O-N 3.15Å; N314-R316 WeakPolarHBondContact OD1-CB 3.22Å; N314-R316 PolarHBondContact OD1-N 2.91Å; R316-E372 HydrophobicContact CB-CG 3.92Å; R316-E372 WeakPolarHBondContact CD-OE2 3.42Å; R316-E372 IonicContact CZ-OE2 3.64Å; R316-E372 IonicContact NE-OE2 3.49Å; R316-E372 IonicContact NH1-OE2 3.7Å; R316-E372 PolarHBondContact NH1-OE2 2.85Å
317	R	85.7	Confident	77	Confident	62 Å²	62	66.3 Å²	66.3	23%	0.234	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	138.8	170.7	-64.6	-62.9	-165.9	-116.8	-14.9	110.1	W309 E310 T311 M373	W309-R317 HydrophobicContact CE3-CB 4.36Å; E310-R317 WeakPolarHBondContact O-CA 3.38Å; T311-R317 PolarHBondContact OG1-NH1 3.41Å; R317-M373 HydrophobicContact CB-CG 4.44Å; R317-M373 PolarHBondContact O-N 2.87Å
318	V	89.2	Confident	75.1	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.7	171.1	-177.2	0	0	0	0	108.7	E310 A312 Y320 I359 L371 E372	E310-V318 PolarHBondContact N-O 2.83Å; E310-V318 PolarHBondContact O-N 2.82Å; A312-V318 HydrophobicContact CB-CG2 3.83Å; V318-Y320 HydrophobicContact CB-CE2 4.03Å; V318-Y320 HydrophobicContact CG1-CD1 4.44Å; V318-Y320 HydrophobicContact CG1-CD2 4.01Å; V318-Y320 HydrophobicContact CG1-CE1 4.02Å; V318-Y320 HydrophobicContact CG1-CE2 3.56Å; V318-Y320 HydrophobicContact CG1-CG 4.43Å; V318-I359 HydrophobicContact CG1-CD1 4.04Å; V318-I359 HydrophobicContact CG2-CD1 3.97Å; V318-L371 CarbonylContact C-O 3.5Å; V318-L371 WeakPolarHBondContact CA-O 3.17Å; V318-E372 HydrophobicContact CG2-CB 4.42Å; V318-E372 HydrophobicContact CG2-CG 4.46Å
319	A	90.7	Very high	73.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.3	171.4	0	0	0	0	0	109.4	V307 W309 I342 L371	V307-A319 HydrophobicContact CG1-CB 3.49Å; V307-A319 VanDerWaalsContact CG1-CB 3.49Å; W309-A319 HydrophobicContact CE3-CB 4.03Å; W309-A319 HydrophobicContact CH2-CB 4.03Å; W309-A319 HydrophobicContact CZ3-CB 3.73Å; A319-I342 HydrophobicContact CB-CD1 3.58Å; A319-L371 HydrophobicContact CB-CB 4.32Å; A319-L371 PolarHBondContact N-O 3.47Å; A319-L371 PolarHBondContact O-N 3.48Å
320	Y	90.7	Very high	71.2	Confident	44 Å²	44	64.2 Å²	64.2	17%	0.173	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.2	171.6	-69.9	-73.4	0	0	0	111	V307 R308 E310 V318 K360 V369	V307-Y320 CarbonylContact C-O 3.38Å; V307-Y320 WeakPolarHBondContact CA-O 3.47Å; R308-Y320 PolarHBondContact N-O 3Å; R308-Y320 PolarHBondContact O-N 3.24Å; E310-Y320 HydrophobicContact CB-CD2 4.11Å; E310-Y320 HydrophobicContact CB-CE2 3.91Å; E310-Y320 VanDerWaalsContact CD-CE2 3.4Å; E310-Y320 HydrophobicContact CG-CD2 3.92Å; E310-Y320 HydrophobicContact CG-CE2 4.02Å; E310-Y320 VanDerWaalsContact OE1-CD2 3.24Å; E310-Y320 WeakPolarHBondContact OE1-CD2 3.36Å; E310-Y320 WeakPolarHBondContact OE1-CE2 3.17Å; V318-Y320 HydrophobicContact CB-CE2 4.03Å; V318-Y320 HydrophobicContact CG1-CD1 4.44Å; V318-Y320 HydrophobicContact CG1-CD2 4.01Å; V318-Y320 HydrophobicContact CG1-CE1 4.02Å; V318-Y320 HydrophobicContact CG1-CE2 3.56Å; V318-Y320 HydrophobicContact CG1-CG 4.43Å; Y320-K360 HydrophobicContact CE1-CD 4.11Å; Y320-V369 VanDerWaalsContact CA-O 3.29Å; Y320-V369 WeakPolarHBondContact CA-O 3.23Å
321	F	88.9	Confident	69.4	Low	4 Å²	4	65.8 Å²	65.8	2%	0.018	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	169	-179.7	61.2	-87.2	0	0	0	111.3	L302 V305 S306 V307 I334 L340 E368 V369 L371 I388	L302-F321 HydrophobicContact CD1-CE2 4.14Å; V305-F321 HydrophobicContact CG1-CB 3.68Å; V305-F321 HydrophobicContact CG1-CD2 4.1Å; V305-F321 HydrophobicContact CG1-CG 4.15Å; S306-F321 WeakPolarHBondContact O-CB 3.43Å; V307-F321 HydrophobicContact CG2-CB 4.22Å; F321-I334 HydrophobicContact CE2-CD1 4.28Å; F321-I334 HydrophobicContact CZ-CD1 4.4Å; F321-L340 HydrophobicContact CZ-CD1 3.82Å; F321-E368 CarbonylContact O-C 3.16Å; F321-E368 WeakPolarHBondContact O-CA 3.32Å; F321-V369 HydrophobicContact CD1-CB 4.38Å; F321-V369 HydrophobicContact CD2-CB 4.14Å; F321-V369 HydrophobicContact CD2-CG2 4.25Å; F321-V369 HydrophobicContact CE1-CB 4.02Å; F321-V369 HydrophobicContact CE1-CG1 3.91Å; F321-V369 HydrophobicContact CE2-CB 3.76Å; F321-V369 HydrophobicContact CE2-CG1 4.03Å; F321-V369 HydrophobicContact CE2-CG2 3.81Å; F321-V369 HydrophobicContact CG-CB 4.44Å; F321-V369 HydrophobicContact CZ-CB 3.69Å; F321-V369 HydrophobicContact CZ-CG1 3.51Å; F321-V369 HydrophobicContact CZ-CG2 4.18Å; F321-V369 PolarHBondContact N-O 3.04Å; F321-V369 VanDerWaalsContact N-O 3.08Å; F321-V369 PolarHBondContact O-N 3.45Å; F321-L371 HydrophobicContact CE1-CB 4.15Å; F321-I388 HydrophobicContact CB-CD1 4.47Å; F321-I388 HydrophobicContact CD1-CD1 3.73Å; F321-I388 HydrophobicContact CD2-CD1 3.66Å; F321-I388 HydrophobicContact CE1-CD1 3.76Å; F321-I388 HydrophobicContact CE2-CD1 3.68Å; F321-I388 HydrophobicContact CG-CD1 3.69Å; F321-I388 HydrophobicContact CZ-CD1 3.73Å; F321-I388 HydrophobicContact CZ-CG2 4.23Å
322	R	81.2	Confident	68	Low	148 Å²	148	62.5 Å²	62.5	56%	0.558	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.4	178.4	-62.3	-178.8	-168.7	-175.3	1.7	110.3	P324 E368	R322-P324 WeakPolarHBondContact O-CD 3.31Å; R322-E368 HydrophobicContact CG-CG 3.77Å; R322-E368 IonicContact CZ-OE1 3.82Å; R322-E368 IonicContact NE-OE1 3.6Å; R322-E368 PolarHBondContact NE-OE1 3.28Å; R322-E368 IonicContact NH2-OE1 3.83Å; R322-E368 PolarHBondContact NH2-OE1 3.45Å
323	I	73.2	Confident	67.4	Low	15 Å²	15	65.8 Å²	65.8	8%	0.077	33%	0.326	C	S	.	.			trans	-90.1	118	175.1	-49.9	179	0	0	0	108	L302 A326 L332 I334 P362 V369	L302-I323 HydrophobicContact CD1-CG1 4.21Å; L302-I323 HydrophobicContact CD1-CG2 4.21Å; L302-I323 HydrophobicContact CD2-CG2 4.08Å; I323-A326 HydrophobicContact CB-CB 4.39Å; I323-A326 PolarHBondContact O-N 3.28Å; I323-L332 HydrophobicContact CG2-CB 4.49Å; I323-I334 HydrophobicContact CD1-CD1 3.59Å; I323-I334 HydrophobicContact CD1-CG1 3.77Å; I323-I334 HydrophobicContact CG1-CD1 4.23Å; I323-P362 HydrophobicContact CD1-CG 4.24Å; I323-V369 HydrophobicContact CD1-CG2 3.78Å; I323-V369 HydrophobicContact CG1-CG2 3.65Å
324	P	59.7	Low	67.5	Low	100 Å²	100	57.1 Å²	57.1	65%	0.649	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	140.2	170.5	-22.4	34.2	0	0	0	110.7	R322 A326	R322-P324 WeakPolarHBondContact O-CD 3.31Å; P324-A326 VanDerWaalsContact C-N 3.29Å; P324-A326 PolarHBondContact O-N 2.83Å
325	G	56.6	Low	67.9	Low	38 Å²	38	55.4 Å²	55.4	39%	0.392	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	2	177.5	0	0	0	0	0	116.4	N327 E328	G325-N327 PolarHBondContact O-N 2.87Å; G325-E328 PolarHBondContact O-N 2.88Å
326	A	49.8	Very low	68	Low	26 Å²	26	53.6 Å²	53.6	22%	0.215	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-52	-31.8	178	0	0	0	0	0	114.1	I323 P324	I323-A326 HydrophobicContact CB-CB 4.39Å; I323-A326 PolarHBondContact O-N 3.28Å; P324-A326 VanDerWaalsContact C-N 3.29Å; P324-A326 PolarHBondContact O-N 2.83Å
327	N	44.4	Very low	67.9	Low	110 Å²	110	49.1 Å²	49.1	59%	0.588	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-86.1	-4.9	178.4	-69.6	-48.9	0	0	0	114.7	G325 D367	G325-N327 PolarHBondContact O-N 2.87Å; N327-D367 PolarHBondContact ND2-OD2 2.98Å; N327-D367 VanDerWaalsContact ND2-OD2 3.16Å
328	E	48.8	Very low	67.9	Low	102 Å²	102	48.2 Å²	48.2	48%	0.477	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-100.2	-2.2	177.3	-57.9	-160.7	162.4	0	0	113.4	G325	G325-E328 PolarHBondContact O-N 2.88Å
329	G	46.1	Very low	67.8	Low	9 Å²	9	49.1 Å²	49.1	9%	0.093	25%	0.253	C	S	.	.			trans	103	116.2	-162.2	0	0	0	0	0	108.9	E331	G329-E331 PolarHBondContact O-N 3.12Å
330	P	47.3	Very low	67.8	Low	26 Å²	26	49.2 Å²	49.2	17%	0.169	25%	0.253	C	S	.	.			trans	-77	115	-166.7	29.5	-34.4	0	0	0	112	L332 R333	P330-L332 PolarHBondContact O-N 3.01Å; P330-R333 HydrophobicContact CG-CB 4.48Å
331	E	49.9	Very low	67.8	Low	109 Å²	109	48.6 Å²	48.6	51%	0.509	25%	0.253	S	S	.	.	S	Bend	trans	-60.6	-13.7	165.9	-67.2	-178.7	164.7	0	0	112.6	K144 L300 G329	K144-E331 IonicContact NZ-OE1 2.86Å; K144-E331 PolarHBondContact NZ-OE1 3.49Å; L300-E331 VanDerWaalsContact CD2-O 3.26Å; L300-E331 WeakPolarHBondContact CD2-O 3.47Å; G329-E331 PolarHBondContact O-N 3.12Å
332	L	55.6	Low	67.8	Low	11 Å²	11	48.4 Å²	48.4	6%	0.058	25%	0.252	C	S	.	.	S	Bend	trans	-149.6	99	-173.8	-158.5	148.7	0	0	0	110.4	L300 L302 I323 P330 I334 F390	L300-L332 HydrophobicContact CB-CD1 3.82Å; L300-L332 HydrophobicContact CB-CG 4.26Å; L300-L332 HydrophobicContact CD2-CB 4.4Å; L300-L332 HydrophobicContact CD2-CD1 4.13Å; L300-L332 HydrophobicContact CD2-CG 4.15Å; L302-L332 HydrophobicContact CD1-CD2 4.38Å; L302-L332 HydrophobicContact CD2-CD1 3.81Å; L302-L332 HydrophobicContact CG-CD1 3.89Å; L302-L332 HydrophobicContact CG-CD2 4.43Å; I323-L332 HydrophobicContact CG2-CB 4.49Å; P330-L332 PolarHBondContact O-N 3.01Å; L332-I334 HydrophobicContact CD2-CD1 3.68Å; L332-I334 HydrophobicContact CD2-CG1 3.49Å; L332-I334 VanDerWaalsContact CD2-CG1 3.49Å; L332-F390 HydrophobicContact CD1-CE2 4.45Å; L332-F390 HydrophobicContact CD2-CD2 4.44Å; L332-F390 HydrophobicContact CD2-CE2 3.57Å; L332-F390 HydrophobicContact CD2-CZ 4.17Å; L332-F390 HydrophobicContact CG-CE2 3.85Å
333	R	60.8	Low	68.1	Low	97 Å²	97	44.4 Å²	44.4	37%	0.366	24%	0.237	S	C	.	.			trans	-96.7	122.4	178.1	-167.6	177	-174.5	-150	-5.1	110.5	P330 M335	P330-R333 HydrophobicContact CG-CB 4.48Å; R333-M335 HydrophobicContact CG-CE 4.38Å
334	I	75.7	Confident	68.7	Low	7 Å²	7	46.4 Å²	46.4	4%	0.036	25%	0.246	C	C	.	.			trans	-109	135.1	-175.9	-51.3	-176.6	0	0	0	109.7	F321 I323 L332 L340 V358 V361 V369 F390	F321-I334 HydrophobicContact CE2-CD1 4.28Å; F321-I334 HydrophobicContact CZ-CD1 4.4Å; I323-I334 HydrophobicContact CD1-CD1 3.59Å; I323-I334 HydrophobicContact CD1-CG1 3.77Å; I323-I334 HydrophobicContact CG1-CD1 4.23Å; L332-I334 HydrophobicContact CD2-CD1 3.68Å; L332-I334 HydrophobicContact CD2-CG1 3.49Å; L332-I334 VanDerWaalsContact CD2-CG1 3.49Å; I334-L340 HydrophobicContact CD1-CD1 3.96Å; I334-L340 HydrophobicContact CG2-CD1 4.13Å; I334-V358 HydrophobicContact CG2-CB 4.28Å; I334-V358 HydrophobicContact CG2-CG1 3.95Å; I334-V358 HydrophobicContact CG2-CG2 3.57Å; I334-V361 VanDerWaalsContact O-CG1 3.24Å; I334-V361 WeakPolarHBondContact O-CG1 3.26Å; I334-V369 HydrophobicContact CD1-CG1 4.32Å; I334-V369 HydrophobicContact CD1-CG2 4.16Å; I334-V369 HydrophobicContact CG2-CG1 4.48Å; I334-F390 HydrophobicContact CG1-CZ 4Å
335	M	76	Confident	69.7	Low	44 Å²	44	43.6 Å²	43.6	22%	0.217	22%	0.224	C	C	.	.			trans	-111.8	155.7	-176.2	-57.2	-61.3	-158.9	0	0	113	R333 G337 D338 V358	R333-M335 HydrophobicContact CG-CE 4.38Å; M335-G337 PolarHBondContact O-N 3.45Å; M335-D338 WeakPolarHBondContact CA-OD2 3.48Å; M335-D338 WeakPolarHBondContact CB-OD2 3.46Å; M335-D338 PolarHBondContact N-OD2 3.15Å; M335-D338 WeakPolarHBondContact O-CB 3.43Å; M335-D338 PolarHBondContact O-N 2.89Å; M335-V358 WeakPolarHBondContact O-CB 3.36Å; M335-V358 WeakPolarHBondContact O-CG1 3.35Å
336	H	78.7	Confident	70.8	Confident	72 Å²	72	48.4 Å²	48.4	33%	0.333	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	125.8	174.1	-79	-85.3	0	0	0	111.6	V358 I359 R527	H336-V358 WeakPolarHBondContact CA-O 3.33Å; H336-I359 PolarHBondContact CE1-O 3.03Å; H336-I359 PolarHBondContact ND1-O 2.86Å; H336-I359 VanDerWaalsContact ND1-O 3.11Å; H336-R527 PolarHBondContact O-NH1 2.96Å; H336-R527 PolarHBondContact O-NH2 2.89Å
337	G	78.1	Confident	71.9	Confident	6 Å²	6	48.4 Å²	48.4	6%	0.062	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	1.5	-179.9	0	0	0	0	0	115.5	M335 V358	M335-G337 PolarHBondContact O-N 3.45Å; G337-V358 PolarHBondContact N-O 3.37Å
338	D	84.5	Confident	73.1	Confident	43 Å²	43	49.1 Å²	49.1	23%	0.23	25%	0.25	C	C	.	.			trans	-60.7	153.1	167.5	-74.2	-19.5	0	0	0	110.9	M335 H357 V358 F390	M335-D338 WeakPolarHBondContact CA-OD2 3.48Å; M335-D338 WeakPolarHBondContact CB-OD2 3.46Å; M335-D338 PolarHBondContact N-OD2 3.15Å; M335-D338 WeakPolarHBondContact O-CB 3.43Å; M335-D338 PolarHBondContact O-N 2.89Å; D338-H357 WeakPolarHBondContact O-CA 3.5Å; D338-V358 HydrophobicContact CB-CB 4.48Å; D338-V358 HydrophobicContact CB-CG2 4.06Å; D338-V358 PolarHBondContact O-N 3.34Å; D338-F390 HydrophobicContact CB-CE1 4.31Å
339	E	88	Confident	74.2	Confident	20 Å²	20	51 Å²	51	9%	0.093	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.3	170	-77.9	179.5	-152.4	0	0	110.2	G356 H357 K374 K391 K393	E339-G356 VanDerWaalsContact CA-O 3.3Å; E339-G356 WeakPolarHBondContact CA-O 3.39Å; E339-H357 WeakPolarHBondContact CG-CD2 3.3Å; E339-H357 VanDerWaalsContact CG-NE2 3.34Å; E339-H357 WeakPolarHBondContact CG-NE2 3.45Å; E339-H357 IonicContact OE1-CD2 2.74Å; E339-H357 IonicContact OE1-CE1 2.7Å; E339-H357 IonicContact OE1-NE2 3.71Å; E339-H357 PolarHBondContact OE1-NE2 3.36Å; E339-K374 IonicContact OE1-NZ 3.64Å; E339-K374 PolarHBondContact OE1-NZ 3.1Å; E339-K374 IonicContact OE2-NZ 3.83Å; E339-K374 PolarHBondContact OE2-NZ 3.13Å; E339-K391 HydrophobicContact CB-CB 3.82Å; E339-K391 HydrophobicContact CB-CD 4.12Å; E339-K391 HydrophobicContact CB-CG 4.45Å; E339-K391 VanDerWaalsContact O-CB 3.3Å; E339-K391 WeakPolarHBondContact O-CB 3.48Å; E339-K391 PolarHBondContact O-N 3.32Å; E339-K391 WeakPolarHBondContact OE2-CD 3.42Å; E339-K391 IonicContact OE2-NZ 2.66Å; E339-K391 PolarHBondContact OE2-NZ 3.35Å; E339-K393 WeakPolarHBondContact OE1-CE 3.5Å; E339-K393 IonicContact OE1-NZ 3.1Å; E339-K393 PolarHBondContact OE1-NZ 2.91Å; E339-K393 WeakPolarHBondContact OE2-CE 3.36Å; E339-K393 IonicContact OE2-NZ 2.7Å
340	L	90.2	Very high	75.2	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	147.8	173.4	-52.9	-179.4	0	0	0	109.7	F321 I334 D355 G356 V358 L371 I388 E389 F390	F321-L340 HydrophobicContact CZ-CD1 3.82Å; I334-L340 HydrophobicContact CD1-CD1 3.96Å; I334-L340 HydrophobicContact CG2-CD1 4.13Å; L340-D355 VanDerWaalsContact O-CA 3.32Å; L340-D355 WeakPolarHBondContact O-CA 3.49Å; L340-G356 PolarHBondContact N-O 3.13Å; L340-G356 PolarHBondContact O-N 3.45Å; L340-V358 HydrophobicContact CD1-CG2 3.77Å; L340-V358 HydrophobicContact CG-CG2 3.87Å; L340-L371 HydrophobicContact CB-CD1 3.8Å; L340-L371 HydrophobicContact CB-CD2 4.02Å; L340-L371 HydrophobicContact CD1-CD1 4.05Å; L340-L371 HydrophobicContact CG-CD1 3.97Å; L340-I388 HydrophobicContact CB-CG2 4.06Å; L340-I388 HydrophobicContact CD1-CG2 3.98Å; L340-E389 WeakPolarHBondContact CA-O 3.32Å; L340-F390 HydrophobicContact CD2-CD1 3.45Å; L340-F390 VanDerWaalsContact CD2-CD1 3.45Å; L340-F390 HydrophobicContact CD2-CD2 4.49Å; L340-F390 HydrophobicContact CD2-CE1 3.71Å; L340-F390 HydrophobicContact CD2-CG 3.9Å; L340-F390 HydrophobicContact CD2-CZ 4.35Å
341	I	89.8	Confident	76.7	Confident	32 Å²	32	58.1 Å²	58.1	16%	0.164	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.9	175	-49.2	-175.8	0	0	0	107.5	R343 L352 I388 E389 K391	I341-R343 HydrophobicContact CG2-CG 4.36Å; I341-L352 HydrophobicContact CG2-CD1 3.33Å; I341-I388 WeakPolarHBondContact O-CA 3.39Å; I341-E389 HydrophobicContact CB-CB 4.46Å; I341-E389 PolarHBondContact N-O 2.93Å; I341-E389 PolarHBondContact O-N 3.36Å; I341-K391 HydrophobicContact CD1-CB 4.12Å; I341-K391 HydrophobicContact CD1-CD 4.47Å; I341-K391 HydrophobicContact CD1-CG 4.13Å; I341-K391 HydrophobicContact CG1-CB 3.82Å; I341-K391 HydrophobicContact CG1-CD 4.3Å; I341-K391 HydrophobicContact CG1-CG 4.21Å
342	I	89.3	Confident	78.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.7	169.4	-60.3	-169.3	0	0	0	108.8	W309 A319 V353 G354 L371 M373 Y386 I388	W309-I342 HydrophobicContact CH2-CD1 4.02Å; A319-I342 HydrophobicContact CB-CD1 3.58Å; I342-V353 HydrophobicContact CB-CB 4.17Å; I342-V353 HydrophobicContact CG2-CB 3.85Å; I342-V353 HydrophobicContact CG2-CG1 4.22Å; I342-V353 HydrophobicContact CG2-CG2 4.02Å; I342-V353 WeakPolarHBondContact O-CB 3.46Å; I342-V353 PolarHBondContact O-N 3.35Å; I342-G354 PolarHBondContact N-O 2.9Å; I342-G354 PolarHBondContact O-N 2.98Å; I342-L371 HydrophobicContact CD1-CD2 3.68Å; I342-L371 HydrophobicContact CG1-CD2 3.76Å; I342-M373 HydrophobicContact CB-CE 4.47Å; I342-M373 HydrophobicContact CD1-CE 4.41Å; I342-M373 HydrophobicContact CD1-SD 4.06Å; I342-M373 HydrophobicContact CG1-CE 4.44Å; I342-Y386 HydrophobicContact CG2-CD1 3.46Å; I342-Y386 VanDerWaalsContact CG2-CD1 3.46Å; I342-Y386 HydrophobicContact CG2-CE1 4.24Å; I342-Y386 HydrophobicContact CG2-CG 3.95Å; I342-I388 HydrophobicContact CG1-CG1 4.34Å
343	R	87.7	Confident	79.5	Confident	64 Å²	64	57.6 Å²	57.6	24%	0.242	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	154.5	170.5	-63.3	178.4	-179.4	-86.8	3.2	110.8	I341 F345 D350 Y351 Y386 K387 E389	I341-R343 HydrophobicContact CG2-CG 4.36Å; R343-F345 PolarHBondContact O-N 2.9Å; R343-D350 VanDerWaalsContact CD-CG 3.49Å; R343-D350 WeakPolarHBondContact CD-O 3.39Å; R343-D350 VanDerWaalsContact CD-OD2 3.28Å; R343-D350 WeakPolarHBondContact CD-OD2 3.39Å; R343-D350 IonicContact NE-OD2 3.71Å; R343-D350 PolarHBondContact NH1-O 3.02Å; R343-Y351 CarbonylContact C-O 3.59Å; R343-Y351 VanDerWaalsContact CA-O 3.24Å; R343-Y351 WeakPolarHBondContact CA-O 3.31Å; R343-Y386 CarbonylContact O-C 3.55Å; R343-Y386 VanDerWaalsContact O-CA 3.28Å; R343-Y386 WeakPolarHBondContact O-CA 3.21Å; R343-Y386 WeakPolarHBondContact O-CB 3.48Å; R343-Y386 WeakPolarHBondContact O-CD1 3.25Å; R343-K387 HydrophobicContact CB-CB 4.21Å; R343-K387 PolarHBondContact N-O 2.96Å; R343-K387 PolarHBondContact O-N 2.83Å; R343-E389 IonicContact CZ-OE2 3.81Å; R343-E389 IonicContact NE-OE2 2.71Å; R343-E389 PolarHBondContact NE-OE2 2.96Å; R343-E389 IonicContact NH2-OE2 3.86Å
344	Q	85.7	Confident	80.7	Confident	57 Å²	57	53.2 Å²	53.2	27%	0.266	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	113.8	173.8	-168.4	-173.1	-1.1	0	0	110.1	S347 Y351 V353 V384	Q344-S347 VanDerWaalsContact O-CB 3.26Å; Q344-S347 WeakPolarHBondContact O-CB 3.38Å; Q344-S347 PolarHBondContact O-N 3.13Å; Q344-Y351 HydrophobicContact CB-CD1 4.4Å; Q344-Y351 PolarHBondContact N-O 2.88Å; Q344-V353 HydrophobicContact CB-CG2 4.34Å; Q344-V384 HydrophobicContact CG-CG1 3.57Å
345	F	81.7	Confident	81.4	Confident	41 Å²	41	54.5 Å²	54.5	18%	0.18	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	146.7	-179.6	-170.8	-115.9	0	0	0	110.7	E303 N304 R343 S347 T385 K387	E303-F345 HydrophobicContact CB-CD2 4.34Å; E303-F345 HydrophobicContact CB-CE2 3.81Å; E303-F345 HydrophobicContact CB-CZ 4.32Å; E303-F345 HydrophobicContact CG-CE2 4.35Å; N304-F345 HydrophobicContact CB-CD1 4.23Å; N304-F345 HydrophobicContact CB-CE1 3.91Å; N304-F345 HydrophobicContact CB-CZ 4.36Å; R343-F345 PolarHBondContact O-N 2.9Å; F345-S347 PolarHBondContact O-N 3.01Å; F345-T385 VanDerWaalsContact CB-O 3.26Å; F345-T385 WeakPolarHBondContact CB-O 3.41Å; F345-T385 PolarHBondContact N-O 3.21Å; F345-K387 HydrophobicContact CB-CB 4.47Å; F345-K387 HydrophobicContact CD2-CB 4.23Å
346	N	78.3	Confident	82	Confident	138 Å²	138	52.4 Å²	52.4	74%	0.738	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	12.1	-173.6	-63.8	-28.6	0	0	0	116.1
347	S	73.1	Confident	82.5	Confident	26 Å²	26	50.3 Å²	50.3	18%	0.182	26%	0.26	C	S	.	.			trans	-73.5	135.5	168.2	-175.2	0	0	0	0	109.7	Q344 F345 N349 D350 Y351	Q344-S347 VanDerWaalsContact O-CB 3.26Å; Q344-S347 WeakPolarHBondContact O-CB 3.38Å; Q344-S347 PolarHBondContact O-N 3.13Å; F345-S347 PolarHBondContact O-N 3.01Å; S347-N349 PolarHBondContact O-N 3.37Å; S347-D350 PolarHBondContact O-N 3.36Å; S347-Y351 WeakPolarHBondContact OG-CB 3.26Å
348	P	70.7	Confident	83	Confident	126 Å²	126	50 Å²	50	82%	0.818	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-19.1	-173.6	23.2	-34.2	0	0	0	114.5
349	N	71.1	Confident	83.1	Confident	142 Å²	142	50.3 Å²	50.3	76%	0.759	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	16.8	176	-67.4	-1.3	0	0	0	112.9	S347 Y351	S347-N349 PolarHBondContact O-N 3.37Å; N349-Y351 PolarHBondContact O-N 3.24Å
350	D	68.4	Low	82.9	Confident	45 Å²	45	52.1 Å²	52.1	24%	0.241	27%	0.266	C	S	.	.			trans	47.2	47.9	-176.4	-154	17.3	0	0	0	111.8	R343 S347 L352 K387	R343-D350 VanDerWaalsContact CD-CG 3.49Å; R343-D350 WeakPolarHBondContact CD-O 3.39Å; R343-D350 VanDerWaalsContact CD-OD2 3.28Å; R343-D350 WeakPolarHBondContact CD-OD2 3.39Å; R343-D350 IonicContact NE-OD2 3.71Å; R343-D350 PolarHBondContact NH1-O 3.02Å; S347-D350 PolarHBondContact O-N 3.36Å; D350-L352 PolarHBondContact O-N 3.14Å; D350-K387 WeakPolarHBondContact OD1-CD 3.15Å; D350-K387 IonicContact OD2-NZ 3.51Å; D350-K387 PolarHBondContact OD2-NZ 3.1Å
351	Y	77.7	Confident	82.5	Confident	139 Å²	139	53.4 Å²	53.4	55%	0.545	27%	0.274	S	S	.	.			trans	-51.2	122.6	-159.1	173.2	-94.6	0	0	0	112.7	R343 Q344 S347 N349 V353	R343-Y351 CarbonylContact C-O 3.59Å; R343-Y351 VanDerWaalsContact CA-O 3.24Å; R343-Y351 WeakPolarHBondContact CA-O 3.31Å; Q344-Y351 HydrophobicContact CB-CD1 4.4Å; Q344-Y351 PolarHBondContact N-O 2.88Å; S347-Y351 WeakPolarHBondContact OG-CB 3.26Å; N349-Y351 PolarHBondContact O-N 3.24Å; Y351-V353 HydrophobicContact CD1-CG2 4.28Å; Y351-V353 PolarHBondContact O-N 3.31Å
352	L	80.8	Confident	81.8	Confident	96 Å²	96	54 Å²	54	50%	0.503	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	109.6	179.3	176.5	60.7	0	0	0	110.3	I341 D350	I341-L352 HydrophobicContact CG2-CD1 3.33Å; D350-L352 PolarHBondContact O-N 3.14Å
353	V	82.9	Confident	80.8	Confident	13 Å²	13	57.6 Å²	57.6	8%	0.079	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-33	174.5	-176.3	0	0	0	0	110.2	W309 I342 Q344 Y351 I377 Y386	W309-V353 HydrophobicContact CH2-CG1 3.97Å; W309-V353 HydrophobicContact CZ2-CG1 4.12Å; I342-V353 HydrophobicContact CB-CB 4.17Å; I342-V353 HydrophobicContact CG2-CB 3.85Å; I342-V353 HydrophobicContact CG2-CG1 4.22Å; I342-V353 HydrophobicContact CG2-CG2 4.02Å; I342-V353 WeakPolarHBondContact O-CB 3.46Å; I342-V353 PolarHBondContact O-N 3.35Å; Q344-V353 HydrophobicContact CB-CG2 4.34Å; Y351-V353 HydrophobicContact CD1-CG2 4.28Å; Y351-V353 PolarHBondContact O-N 3.31Å; V353-I377 HydrophobicContact CG1-CD1 4.43Å; V353-I377 HydrophobicContact CG1-CG2 4.08Å; V353-I377 WeakPolarHBondContact O-CD1 3.46Å; V353-I377 WeakPolarHBondContact O-CG1 3.49Å; V353-Y386 HydrophobicContact CG2-CD1 4.02Å; V353-Y386 HydrophobicContact CG2-CE1 3.88Å
354	G	87.5	Confident	79.7	Confident	5 Å²	5	58.4 Å²	58.4	5%	0.052	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148	-176.2	171.7	0	0	0	0	0	112.4	I342	I342-G354 PolarHBondContact N-O 2.9Å; I342-G354 PolarHBondContact O-N 2.98Å
355	D	88.9	Confident	78.8	Confident	33 Å²	33	62.6 Å²	62.6	18%	0.176	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149.3	170.5	73.7	-40.9	0	0	0	112.6	L340 K374 K391	L340-D355 VanDerWaalsContact O-CA 3.32Å; L340-D355 WeakPolarHBondContact O-CA 3.49Å; D355-K374 WeakPolarHBondContact O-CB 3.36Å; D355-K374 WeakPolarHBondContact O-CG 3.29Å; D355-K374 PolarHBondContact O-N 3.21Å; D355-K374 VanDerWaalsContact O-N 3.11Å; D355-K374 IonicContact OD1-NZ 2.72Å; D355-K374 IonicContact OD2-NZ 2.69Å; D355-K374 PolarHBondContact OD2-NZ 3.18Å; D355-K391 HydrophobicContact CB-CD 4.29Å; D355-K391 WeakPolarHBondContact OD2-CD 3.37Å; D355-K391 IonicContact OD2-NZ 3.93Å; D355-K391 PolarHBondContact OD2-NZ 2.95Å
356	G	89.2	Confident	78.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	175.7	-173.5	0	0	0	0	0	113.6	E339 L340 E372	E339-G356 VanDerWaalsContact CA-O 3.3Å; E339-G356 WeakPolarHBondContact CA-O 3.39Å; L340-G356 PolarHBondContact N-O 3.13Å; L340-G356 PolarHBondContact O-N 3.45Å; G356-E372 CarbonylContact C-O 3.59Å; G356-E372 WeakPolarHBondContact CA-O 3.41Å
357	H	88.7	Confident	78.2	Confident	28 Å²	28	58.5 Å²	58.5	13%	0.13	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133	176	-69.9	125.1	0	0	0	111.2	D338 E339 I359 E372 K374 S526	D338-H357 WeakPolarHBondContact O-CA 3.5Å; E339-H357 WeakPolarHBondContact CG-CD2 3.3Å; E339-H357 VanDerWaalsContact CG-NE2 3.34Å; E339-H357 WeakPolarHBondContact CG-NE2 3.45Å; E339-H357 IonicContact OE1-CD2 2.74Å; E339-H357 IonicContact OE1-CE1 2.7Å; E339-H357 IonicContact OE1-NE2 3.71Å; E339-H357 PolarHBondContact OE1-NE2 3.36Å; H357-I359 PolarHBondContact O-N 2.96Å; H357-I359 VanDerWaalsContact O-N 3.15Å; H357-E372 PolarHBondContact N-O 3.31Å; H357-E372 PolarHBondContact O-N 2.96Å; H357-K374 WeakPolarHBondContact CE1-CE 3.34Å; H357-K374 WeakPolarHBondContact NE2-CE 3.31Å; H357-S526 WeakPolarHBondContact NE2-CB 3.47Å
358	V	88.5	Confident	78.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	109.9	179.8	178.4	0	0	0	0	109.6	I334 M335 H336 G337 D338 L340 K360 V361 V369 L371	I334-V358 HydrophobicContact CG2-CB 4.28Å; I334-V358 HydrophobicContact CG2-CG1 3.95Å; I334-V358 HydrophobicContact CG2-CG2 3.57Å; M335-V358 WeakPolarHBondContact O-CB 3.36Å; M335-V358 WeakPolarHBondContact O-CG1 3.35Å; H336-V358 WeakPolarHBondContact CA-O 3.33Å; G337-V358 PolarHBondContact N-O 3.37Å; D338-V358 HydrophobicContact CB-CB 4.48Å; D338-V358 HydrophobicContact CB-CG2 4.06Å; D338-V358 PolarHBondContact O-N 3.34Å; L340-V358 HydrophobicContact CD1-CG2 3.77Å; L340-V358 HydrophobicContact CG-CG2 3.87Å; V358-K360 WeakPolarHBondContact CG1-O 3.1Å; V358-V361 HydrophobicContact CG1-CG1 3.93Å; V358-V369 HydrophobicContact CG1-CG1 4.22Å; V358-L371 HydrophobicContact CG2-CD1 3.71Å
359	I	86.3	Confident	79.5	Confident	49 Å²	49	52.5 Å²	52.5	25%	0.251	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-17.5	179	58.7	161.3	0	0	0	112.8	V318 H336 H357 G370 E372	V318-I359 HydrophobicContact CG1-CD1 4.04Å; V318-I359 HydrophobicContact CG2-CD1 3.97Å; H336-I359 PolarHBondContact CE1-O 3.03Å; H336-I359 PolarHBondContact ND1-O 2.86Å; H336-I359 VanDerWaalsContact ND1-O 3.11Å; H357-I359 PolarHBondContact O-N 2.96Å; H357-I359 VanDerWaalsContact O-N 3.15Å; I359-G370 WeakPolarHBondContact CG1-O 3.37Å; I359-G370 PolarHBondContact N-O 2.94Å; I359-E372 HydrophobicContact CD1-CB 4.16Å; I359-E372 HydrophobicContact CG1-CB 4.28Å; I359-E372 HydrophobicContact CG2-CB 3.79Å
360	K	84.6	Confident	80.4	Confident	58 Å²	58	45.8 Å²	45.8	25%	0.252	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	132.9	175.4	178	-173.9	173.7	-166.5	0	110.1	Y320 V358 S366 E368 V369 G370	Y320-K360 HydrophobicContact CE1-CD 4.11Å; V358-K360 WeakPolarHBondContact CG1-O 3.1Å; K360-S366 WeakPolarHBondContact CE-OG 3.46Å; K360-S366 PolarHBondContact NZ-OG 3.4Å; K360-E368 WeakPolarHBondContact CD-O 2.87Å; K360-E368 WeakPolarHBondContact CE-O 3.38Å; K360-E368 PolarHBondContact NZ-O 3.29Å; K360-V369 WeakPolarHBondContact O-CA 3.13Å; K360-G370 PolarHBondContact N-O 3.48Å; K360-G370 VanDerWaalsContact N-O 3.13Å; K360-G370 PolarHBondContact O-N 2.83Å
361	V	82.2	Confident	81.5	Confident	30 Å²	30	43.6 Å²	43.6	18%	0.182	22%	0.219	C	C	.	.			trans	-106.2	165	171.8	-56.2	0	0	0	0	110.3	I334 V358	I334-V361 VanDerWaalsContact O-CG1 3.24Å; I334-V361 WeakPolarHBondContact O-CG1 3.26Å; V358-V361 HydrophobicContact CG1-CG1 3.93Å
362	P	74.2	Confident	82	Confident	45 Å²	45	37.6 Å²	37.6	29%	0.292	20%	0.196	S	C	.	.			trans	-62.5	135.5	171.6	-22.3	35.9	0	0	0	111.5	I323 S366 V369	I323-P362 HydrophobicContact CD1-CG 4.24Å; P362-S366 WeakPolarHBondContact CA-O 3.35Å; P362-V369 HydrophobicContact CG-CG2 3.91Å
363	D	68.9	Low	82.4	Confident	74 Å²	74	33.1 Å²	33.1	40%	0.396	17%	0.172	S	C	.	.	B	Isolated β-bridge	trans	-136.3	179.6	-178.7	70.5	15.3	0	0	0	112	F365 S366	D363-F365 PolarHBondContact O-N 2.91Å; D363-F365 WeakPolarHBondContact OD1-CA 3.41Å; D363-F365 WeakPolarHBondContact OD1-CB 3.31Å; D363-F365 PolarHBondContact OD1-N 2.64Å; D363-S366 PolarHBondContact N-O 3.44Å; D363-S366 PolarHBondContact O-N 3.44Å; D363-S366 PolarHBondContact OD1-N 3.23Å
364	N	63.9	Low	82.3	Confident	81 Å²	81	35.9 Å²	35.9	43%	0.433	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-2.7	-179.8	-70.2	-6.8	0	0	0	114.3	Q796	N364-Q796 HydrophobicContact CB-CB 4.14Å; N364-Q796 HydrophobicContact CB-CG 4.43Å; N364-Q796 PolarHBondContact ND2-O 3.25Å; N364-Q796 PolarHBondContact O-NE2 3.26Å
365	F	68.4	Low	81.7	Confident	146 Å²	146	41.6 Å²	41.6	64%	0.64	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-17.1	177.4	-51.3	-72.1	0	0	0	113	D363	D363-F365 PolarHBondContact O-N 2.91Å; D363-F365 WeakPolarHBondContact OD1-CA 3.41Å; D363-F365 WeakPolarHBondContact OD1-CB 3.31Å; D363-F365 PolarHBondContact OD1-N 2.64Å
366	S	71.3	Confident	80.6	Confident	25 Å²	25	43.9 Å²	43.9	18%	0.175	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-163.8	118.3	-167.1	154.6	0	0	0	0	114.1	K360 P362 D363 E368	K360-S366 WeakPolarHBondContact CE-OG 3.46Å; K360-S366 PolarHBondContact NZ-OG 3.4Å; P362-S366 WeakPolarHBondContact CA-O 3.35Å; D363-S366 PolarHBondContact N-O 3.44Å; D363-S366 PolarHBondContact O-N 3.44Å; D363-S366 PolarHBondContact OD1-N 3.23Å; S366-E368 PolarHBondContact O-N 3.12Å; S366-E368 VanDerWaalsContact O-N 3.11Å; S366-E368 PolarHBondContact OG-N 3.43Å
367	D	74.1	Confident	79.5	Confident	68 Å²	68	45 Å²	45	36%	0.364	23%	0.229	S	C	.	.			trans	-70	-0.2	171.3	-58.8	1.5	0	0	0	114.9	N327	N327-D367 PolarHBondContact ND2-OD2 2.98Å; N327-D367 VanDerWaalsContact ND2-OD2 3.16Å
368	E	84.9	Confident	78.4	Confident	26 Å²	26	50.9 Å²	50.9	12%	0.121	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118.2	-174.2	-63.2	-174.5	171.7	0	0	114.1	R308 F321 R322 K360 S366	R308-E368 IonicContact CZ-OE2 3.65Å; R308-E368 VanDerWaalsContact CZ-OE2 3.29Å; R308-E368 IonicContact NH1-OE1 2.64Å; R308-E368 PolarHBondContact NH1-OE1 3.2Å; R308-E368 IonicContact NH1-OE2 2.7Å; R308-E368 PolarHBondContact NH1-OE2 3.38Å; R308-E368 IonicContact NH2-OE2 3.64Å; R308-E368 PolarHBondContact NH2-OE2 3.3Å; F321-E368 CarbonylContact O-C 3.16Å; F321-E368 WeakPolarHBondContact O-CA 3.32Å; R322-E368 HydrophobicContact CG-CG 3.77Å; R322-E368 IonicContact CZ-OE1 3.82Å; R322-E368 IonicContact NE-OE1 3.6Å; R322-E368 PolarHBondContact NE-OE1 3.28Å; R322-E368 IonicContact NH2-OE1 3.83Å; R322-E368 PolarHBondContact NH2-OE1 3.45Å; K360-E368 WeakPolarHBondContact CD-O 2.87Å; K360-E368 WeakPolarHBondContact CE-O 3.38Å; K360-E368 PolarHBondContact NZ-O 3.29Å; S366-E368 PolarHBondContact O-N 3.12Å; S366-E368 VanDerWaalsContact O-N 3.11Å; S366-E368 PolarHBondContact OG-N 3.43Å
369	V	87.6	Confident	77.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	141.2	164.6	-170.4	0	0	0	0	109	Y320 F321 I323 I334 V358 K360 P362	Y320-V369 VanDerWaalsContact CA-O 3.29Å; Y320-V369 WeakPolarHBondContact CA-O 3.23Å; F321-V369 HydrophobicContact CD1-CB 4.38Å; F321-V369 HydrophobicContact CD2-CB 4.14Å; F321-V369 HydrophobicContact CD2-CG2 4.25Å; F321-V369 HydrophobicContact CE1-CB 4.02Å; F321-V369 HydrophobicContact CE1-CG1 3.91Å; F321-V369 HydrophobicContact CE2-CB 3.76Å; F321-V369 HydrophobicContact CE2-CG1 4.03Å; F321-V369 HydrophobicContact CE2-CG2 3.81Å; F321-V369 HydrophobicContact CG-CB 4.44Å; F321-V369 HydrophobicContact CZ-CB 3.69Å; F321-V369 HydrophobicContact CZ-CG1 3.51Å; F321-V369 HydrophobicContact CZ-CG2 4.18Å; F321-V369 PolarHBondContact N-O 3.04Å; F321-V369 VanDerWaalsContact N-O 3.08Å; F321-V369 PolarHBondContact O-N 3.45Å; I323-V369 HydrophobicContact CD1-CG2 3.78Å; I323-V369 HydrophobicContact CG1-CG2 3.65Å; I334-V369 HydrophobicContact CD1-CG1 4.32Å; I334-V369 HydrophobicContact CD1-CG2 4.16Å; I334-V369 HydrophobicContact CG2-CG1 4.48Å; V358-V369 HydrophobicContact CG1-CG1 4.22Å; K360-V369 WeakPolarHBondContact O-CA 3.13Å; P362-V369 HydrophobicContact CG-CG2 3.91Å
370	G	90.2	Very high	75.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	119.7	171.7	0	0	0	0	0	111.6	I359 K360	I359-G370 WeakPolarHBondContact CG1-O 3.37Å; I359-G370 PolarHBondContact N-O 2.94Å; K360-G370 PolarHBondContact N-O 3.48Å; K360-G370 VanDerWaalsContact N-O 3.13Å; K360-G370 PolarHBondContact O-N 2.83Å
371	L	90.6	Very high	74.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	114	-178.5	-175.2	78.5	0	0	0	110.2	V318 A319 F321 L340 I342 V358 M373	V318-L371 CarbonylContact C-O 3.5Å; V318-L371 WeakPolarHBondContact CA-O 3.17Å; A319-L371 HydrophobicContact CB-CB 4.32Å; A319-L371 PolarHBondContact N-O 3.47Å; A319-L371 PolarHBondContact O-N 3.48Å; F321-L371 HydrophobicContact CE1-CB 4.15Å; L340-L371 HydrophobicContact CB-CD1 3.8Å; L340-L371 HydrophobicContact CB-CD2 4.02Å; L340-L371 HydrophobicContact CD1-CD1 4.05Å; L340-L371 HydrophobicContact CG-CD1 3.97Å; I342-L371 HydrophobicContact CD1-CD2 3.68Å; I342-L371 HydrophobicContact CG1-CD2 3.76Å; V358-L371 HydrophobicContact CG2-CD1 3.71Å; L371-M373 HydrophobicContact CD2-SD 3.78Å; L371-M373 HydrophobicContact CG-SD 4.22Å
372	E	88.5	Confident	73.6	Confident	13 Å²	13	65.1 Å²	65.1	6%	0.061	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	122	173.1	-173.3	-176.7	-99.4	0	0	110.1	N314 R316 V318 G356 H357 I359	N314-E372 PolarHBondContact ND2-OE1 3.25Å; R316-E372 HydrophobicContact CB-CG 3.92Å; R316-E372 WeakPolarHBondContact CD-OE2 3.42Å; R316-E372 IonicContact CZ-OE2 3.64Å; R316-E372 IonicContact NE-OE2 3.49Å; R316-E372 IonicContact NH1-OE2 3.7Å; R316-E372 PolarHBondContact NH1-OE2 2.85Å; V318-E372 HydrophobicContact CG2-CB 4.42Å; V318-E372 HydrophobicContact CG2-CG 4.46Å; G356-E372 CarbonylContact C-O 3.59Å; G356-E372 WeakPolarHBondContact CA-O 3.41Å; H357-E372 PolarHBondContact N-O 3.31Å; H357-E372 PolarHBondContact O-N 2.96Å; I359-E372 HydrophobicContact CD1-CB 4.16Å; I359-E372 HydrophobicContact CG1-CB 4.28Å; I359-E372 HydrophobicContact CG2-CB 3.79Å
373	M	88.4	Confident	72.9	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	140	-179.8	-56.2	-53.3	-70.8	0	0	111.4	W309 R317 I342 L371 Q375 I377	W309-M373 HydrophobicContact CH2-CG 4.42Å; W309-M373 HydrophobicContact CH2-SD 4.47Å; W309-M373 HydrophobicContact CZ3-CG 3.8Å; W309-M373 HydrophobicContact CZ3-SD 4.32Å; R317-M373 HydrophobicContact CB-CG 4.44Å; R317-M373 PolarHBondContact O-N 2.87Å; I342-M373 HydrophobicContact CB-CE 4.47Å; I342-M373 HydrophobicContact CD1-CE 4.41Å; I342-M373 HydrophobicContact CD1-SD 4.06Å; I342-M373 HydrophobicContact CG1-CE 4.44Å; L371-M373 HydrophobicContact CD2-SD 3.78Å; L371-M373 HydrophobicContact CG-SD 4.22Å; M373-Q375 VanDerWaalsContact C-N 3.34Å; M373-I377 HydrophobicContact CB-CD1 3.84Å; M373-I377 HydrophobicContact CE-CD1 3.62Å; M373-I377 HydrophobicContact CG-CD1 3.87Å
374	K	81.5	Confident	73.3	Confident	72 Å²	72	67.5 Å²	67.5	31%	0.313	36%	0.358	S	S	.	.	S	Bend	trans	-72.3	-27.6	179	-69.6	172.1	179.7	175	0	114	E339 D355 H357	E339-K374 IonicContact OE1-NZ 3.64Å; E339-K374 PolarHBondContact OE1-NZ 3.1Å; E339-K374 IonicContact OE2-NZ 3.83Å; E339-K374 PolarHBondContact OE2-NZ 3.13Å; D355-K374 WeakPolarHBondContact O-CB 3.36Å; D355-K374 WeakPolarHBondContact O-CG 3.29Å; D355-K374 PolarHBondContact O-N 3.21Å; D355-K374 VanDerWaalsContact O-N 3.11Å; D355-K374 IonicContact OD1-NZ 2.72Å; D355-K374 IonicContact OD2-NZ 2.69Å; D355-K374 PolarHBondContact OD2-NZ 3.18Å; H357-K374 WeakPolarHBondContact CE1-CE 3.34Å; H357-K374 WeakPolarHBondContact NE2-CE 3.31Å
375	Q	74.7	Confident	74.2	Confident	124 Å²	124	65.7 Å²	65.7	58%	0.579	35%	0.349	S	S	*	.	S	Bend	trans	-111.5	149.5	-179.7	-69.1	175.9	-26.4	0	0	109.2	M373 I377	M373-Q375 VanDerWaalsContact C-N 3.34Å; Q375-I377 HydrophobicContact CB-CG1 4.43Å; Q375-I377 PolarHBondContact O-N 3.42Å
376	V	65.9	Low	75.2	Confident	82 Å²	82	59 Å²	59	50%	0.497	32%	0.32	S	S	.	.			trans	-74.2	121.5	166.6	-175.4	0	0	0	0	107.4
377	I	67.1	Low	75.9	Confident	23 Å²	23	58.7 Å²	58.7	12%	0.118	32%	0.315	C	S	.	.			trans	-117.9	127.3	-175.6	-62.7	149.7	0	0	0	108.1	V353 M373 Q375 T379	V353-I377 HydrophobicContact CG1-CD1 4.43Å; V353-I377 HydrophobicContact CG1-CG2 4.08Å; V353-I377 WeakPolarHBondContact O-CD1 3.46Å; V353-I377 WeakPolarHBondContact O-CG1 3.49Å; M373-I377 HydrophobicContact CB-CD1 3.84Å; M373-I377 HydrophobicContact CE-CD1 3.62Å; M373-I377 HydrophobicContact CG-CD1 3.87Å; Q375-I377 HydrophobicContact CB-CG1 4.43Å; Q375-I377 PolarHBondContact O-N 3.42Å; I377-T379 PolarHBondContact O-N 3.02Å
378	D	65.4	Low	76.6	Confident	151 Å²	151	55.7 Å²	55.7	81%	0.807	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-69.9	116	167.6	-81.1	-33.7	0	0	0	109.1
379	T	60.7	Low	76.7	Confident	48 Å²	48	55.2 Å²	55.2	29%	0.294	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-77.7	134.5	-172.6	-45.5	0	0	0	0	110	W309 I377 L381	W309-T379 HydrophobicContact CB-CG2 4.02Å; W309-T379 VanDerWaalsContact CD1-CG2 3.41Å; W309-T379 HydrophobicContact CD2-CG2 4.05Å; W309-T379 HydrophobicContact CG-CG2 3.56Å; I377-T379 PolarHBondContact O-N 3.02Å; T379-L381 PolarHBondContact O-N 3.41Å
380	P	61.5	Low	76.7	Confident	55 Å²	55	56 Å²	56	36%	0.357	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-53	135.8	169.9	-26.2	34.9	0	0	0	111.3	E382 V384	P380-E382 PolarHBondContact O-N 2.8Å; P380-V384 HydrophobicContact CB-CG2 4.1Å
381	L	56.7	Low	76.6	Confident	185 Å²	185	59.5 Å²	59.5	97%	0.969	32%	0.316	S	S	*	.	S	Bend	trans	-70.4	-18.5	178.3	-73.1	166.8	0	0	0	113	T379	T379-L381 PolarHBondContact O-N 3.41Å
382	E	60.3	Low	76.5	Confident	149 Å²	149	62.2 Å²	62.2	70%	0.696	33%	0.326	S	S	*	.	S	Bend	trans	-99.4	152.1	-178	-64.9	-172.7	168.5	0	0	111.8	P380 V384	P380-E382 PolarHBondContact O-N 2.8Å; E382-V384 VanDerWaalsContact C-N 3.31Å; E382-V384 PolarHBondContact O-N 3.42Å
383	P	60.7	Low	76.5	Confident	136 Å²	136	64.9 Å²	64.9	88%	0.883	34%	0.338	S	S	*	.			trans	-73.7	81.8	177.9	31.3	-35.7	0	0	0	111.2
384	V	75.9	Confident	76.7	Confident	33 Å²	33	66.6 Å²	66.6	20%	0.2	35%	0.349	C	S	.	.			trans	-84.8	145.6	177	-166.8	0	0	0	0	111.1	Q344 P380 E382 Y386	Q344-V384 HydrophobicContact CG-CG1 3.57Å; P380-V384 HydrophobicContact CB-CG2 4.1Å; E382-V384 VanDerWaalsContact C-N 3.31Å; E382-V384 PolarHBondContact O-N 3.42Å; V384-Y386 WeakPolarHBondContact O-CD2 3.39Å; V384-Y386 WeakPolarHBondContact O-CE2 3.48Å
385	T	84.8	Confident	77.3	Confident	42 Å²	42	66.1 Å²	66.1	26%	0.258	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	148	171.4	52.4	0	0	0	0	111.1	N304 V305 F345	N304-T385 WeakPolarHBondContact OD1-CG2 3.17Å; V305-T385 CarbonylContact O-C 3.59Å; V305-T385 WeakPolarHBondContact O-CA 3.48Å; F345-T385 VanDerWaalsContact CB-O 3.26Å; F345-T385 WeakPolarHBondContact CB-O 3.41Å; F345-T385 PolarHBondContact N-O 3.21Å
386	Y	87.8	Confident	78.3	Confident	5 Å²	5	61.3 Å²	61.3	2%	0.02	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	157.3	-172.2	-61.8	-86.7	0	0	0	111.7	N304 V305 V307 W309 I342 R343 V353 V384	N304-Y386 PolarHBondContact N-O 3.38Å; V305-Y386 WeakPolarHBondContact CB-O 3.29Å; V305-Y386 PolarHBondContact N-O 2.76Å; V305-Y386 PolarHBondContact O-N 2.8Å; V307-Y386 HydrophobicContact CB-CD2 3.64Å; V307-Y386 HydrophobicContact CB-CE2 3.83Å; V307-Y386 HydrophobicContact CG2-CD2 3.43Å; V307-Y386 VanDerWaalsContact CG2-CD2 3.43Å; V307-Y386 HydrophobicContact CG2-CE2 4.14Å; V307-Y386 HydrophobicContact CG2-CG 3.91Å; W309-Y386 HydrophobicContact CZ2-CE1 4.07Å; W309-Y386 HydrophobicContact CZ2-CE2 4.46Å; W309-Y386 AromaticContact CZ2-CZ 3.95Å; W309-Y386 AromaticContact NE1-CE2 3.7Å; W309-Y386 AromaticContact NE1-CZ 3.56Å; W309-Y386 PolarHBondContact NE1-OH 2.97Å; I342-Y386 HydrophobicContact CG2-CD1 3.46Å; I342-Y386 VanDerWaalsContact CG2-CD1 3.46Å; I342-Y386 HydrophobicContact CG2-CE1 4.24Å; I342-Y386 HydrophobicContact CG2-CG 3.95Å; R343-Y386 CarbonylContact O-C 3.55Å; R343-Y386 VanDerWaalsContact O-CA 3.28Å; R343-Y386 WeakPolarHBondContact O-CA 3.21Å; R343-Y386 WeakPolarHBondContact O-CB 3.48Å; R343-Y386 WeakPolarHBondContact O-CD1 3.25Å; V353-Y386 HydrophobicContact CG2-CD1 4.02Å; V353-Y386 HydrophobicContact CG2-CE1 3.88Å; V384-Y386 WeakPolarHBondContact O-CD2 3.39Å; V384-Y386 WeakPolarHBondContact O-CE2 3.48Å
387	K	87.3	Confident	79.8	Confident	19 Å²	19	58.4 Å²	58.4	8%	0.083	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.8	171.7	179.5	-172.5	-172	-141.1	0	107.3	L302 E303 R343 F345 D350 E389	L302-K387 CarbonylContact O-C 3.59Å; L302-K387 VanDerWaalsContact O-CA 3.31Å; L302-K387 WeakPolarHBondContact O-CA 3.21Å; E303-K387 HydrophobicContact CG-CG 4.34Å; E303-K387 VanDerWaalsContact OE1-CE 3.3Å; E303-K387 WeakPolarHBondContact OE1-CE 3.44Å; R343-K387 HydrophobicContact CB-CB 4.21Å; R343-K387 PolarHBondContact N-O 2.96Å; R343-K387 PolarHBondContact O-N 2.83Å; F345-K387 HydrophobicContact CB-CB 4.47Å; F345-K387 HydrophobicContact CD2-CB 4.23Å; D350-K387 WeakPolarHBondContact OD1-CD 3.15Å; D350-K387 IonicContact OD2-NZ 3.51Å; D350-K387 PolarHBondContact OD2-NZ 3.1Å; K387-E389 VanDerWaalsContact CE-OE1 3.31Å; K387-E389 WeakPolarHBondContact CE-OE1 3.31Å; K387-E389 HydrophobicContact CG-CG 4.38Å; K387-E389 IonicContact NZ-OE1 3.22Å; K387-E389 PolarHBondContact NZ-OE1 3.49Å
388	I	88.4	Confident	81.2	Confident	5 Å²	5	60 Å²	60	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.6	-173.5	-55.7	177.4	0	0	0	108.5	K301 L302 V305 V307 F321 L340 I341 I342	K301-I388 WeakPolarHBondContact CA-O 3.37Å; L302-I388 HydrophobicContact CB-CB 4.34Å; L302-I388 PolarHBondContact N-O 3.22Å; L302-I388 PolarHBondContact O-N 2.89Å; V305-I388 HydrophobicContact CB-CD1 4.17Å; V305-I388 HydrophobicContact CG1-CD1 3.92Å; V305-I388 HydrophobicContact CG2-CD1 4.28Å; V305-I388 HydrophobicContact CG2-CG1 4.44Å; V307-I388 HydrophobicContact CG2-CD1 4.44Å; F321-I388 HydrophobicContact CB-CD1 4.47Å; F321-I388 HydrophobicContact CD1-CD1 3.73Å; F321-I388 HydrophobicContact CD2-CD1 3.66Å; F321-I388 HydrophobicContact CE1-CD1 3.76Å; F321-I388 HydrophobicContact CE2-CD1 3.68Å; F321-I388 HydrophobicContact CG-CD1 3.69Å; F321-I388 HydrophobicContact CZ-CD1 3.73Å; F321-I388 HydrophobicContact CZ-CG2 4.23Å; L340-I388 HydrophobicContact CB-CG2 4.06Å; L340-I388 HydrophobicContact CD1-CG2 3.98Å; I341-I388 WeakPolarHBondContact O-CA 3.39Å; I342-I388 HydrophobicContact CG1-CG1 4.34Å
389	E	87.2	Confident	82.7	Confident	17 Å²	17	55 Å²	55	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142	-175	-53	-178.3	135.6	0	0	109.3	K301 L340 I341 R343 K387	K301-E389 HydrophobicContact CD-CG 4.09Å; K301-E389 WeakPolarHBondContact CD-OE1 3.16Å; K301-E389 WeakPolarHBondContact CE-OE1 3.46Å; K301-E389 HydrophobicContact CG-CG 4.12Å; K301-E389 IonicContact NZ-OE1 2.73Å; K301-E389 PolarHBondContact NZ-OE1 2.74Å; L340-E389 WeakPolarHBondContact CA-O 3.32Å; I341-E389 HydrophobicContact CB-CB 4.46Å; I341-E389 PolarHBondContact N-O 2.93Å; I341-E389 PolarHBondContact O-N 3.36Å; R343-E389 IonicContact CZ-OE2 3.81Å; R343-E389 IonicContact NE-OE2 2.71Å; R343-E389 PolarHBondContact NE-OE2 2.96Å; R343-E389 IonicContact NH2-OE2 3.86Å; K387-E389 VanDerWaalsContact CE-OE1 3.31Å; K387-E389 WeakPolarHBondContact CE-OE1 3.31Å; K387-E389 HydrophobicContact CG-CG 4.38Å; K387-E389 IonicContact NZ-OE1 3.22Å; K387-E389 PolarHBondContact NZ-OE1 3.49Å
390	F	86.7	Confident	84.5	Confident	17 Å²	17	53.6 Å²	53.6	8%	0.075	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	139.2	170.7	-87.9	-81.3	0	0	0	111.1	K297 L300 L332 I334 D338 L340 W392	K297-F390 HydrophobicContact CB-CB 4.06Å; L300-F390 HydrophobicContact CB-CD2 3.74Å; L300-F390 HydrophobicContact CB-CE2 4.16Å; L300-F390 HydrophobicContact CD1-CD2 4.19Å; L300-F390 HydrophobicContact CD1-CE2 4.07Å; L332-F390 HydrophobicContact CD1-CE2 4.45Å; L332-F390 HydrophobicContact CD2-CD2 4.44Å; L332-F390 HydrophobicContact CD2-CE2 3.57Å; L332-F390 HydrophobicContact CD2-CZ 4.17Å; L332-F390 HydrophobicContact CG-CE2 3.85Å; I334-F390 HydrophobicContact CG1-CZ 4Å; D338-F390 HydrophobicContact CB-CE1 4.31Å; L340-F390 HydrophobicContact CD2-CD1 3.45Å; L340-F390 VanDerWaalsContact CD2-CD1 3.45Å; L340-F390 HydrophobicContact CD2-CD2 4.49Å; L340-F390 HydrophobicContact CD2-CE1 3.71Å; L340-F390 HydrophobicContact CD2-CG 3.9Å; L340-F390 HydrophobicContact CD2-CZ 4.35Å; F390-W392 PolarHBondContact O-N 3.26Å
391	K	87.9	Confident	86.2	Confident	72 Å²	72	54.6 Å²	54.6	31%	0.313	28%	0.278	S	S	.	.			trans	-93.4	98.8	172.1	-168.5	174.2	169.3	-153.4	0	110.6	E339 I341 D355	E339-K391 HydrophobicContact CB-CB 3.82Å; E339-K391 HydrophobicContact CB-CD 4.12Å; E339-K391 HydrophobicContact CB-CG 4.45Å; E339-K391 VanDerWaalsContact O-CB 3.3Å; E339-K391 WeakPolarHBondContact O-CB 3.48Å; E339-K391 PolarHBondContact O-N 3.32Å; E339-K391 WeakPolarHBondContact OE2-CD 3.42Å; E339-K391 IonicContact OE2-NZ 2.66Å; E339-K391 PolarHBondContact OE2-NZ 3.35Å; I341-K391 HydrophobicContact CD1-CB 4.12Å; I341-K391 HydrophobicContact CD1-CD 4.47Å; I341-K391 HydrophobicContact CD1-CG 4.13Å; I341-K391 HydrophobicContact CG1-CB 3.82Å; I341-K391 HydrophobicContact CG1-CD 4.3Å; I341-K391 HydrophobicContact CG1-CG 4.21Å; D355-K391 HydrophobicContact CB-CD 4.29Å; D355-K391 WeakPolarHBondContact OD2-CD 3.37Å; D355-K391 IonicContact OD2-NZ 3.93Å; D355-K391 PolarHBondContact OD2-NZ 2.95Å
392	W	89.5	Confident	88.1	Confident	57 Å²	57	53.5 Å²	53.5	22%	0.216	26%	0.261	C	S	.	.			trans	-59.4	151.6	174.1	-174.5	76.6	0	0	0	112.3	A290 D293 K294 K297 F390 F397	A290-W392 HydrophobicContact CB-CZ2 4.17Å; A290-W392 WeakPolarHBondContact O-CZ2 3.31Å; D293-W392 PolarHBondContact OD2-NE1 3.49Å; K294-W392 VanDerWaalsContact CA-CD1 3.48Å; K294-W392 HydrophobicContact CB-CD2 3.77Å; K294-W392 HydrophobicContact CB-CE3 4.28Å; K294-W392 HydrophobicContact CB-CG 4.03Å; K294-W392 HydrophobicContact CB-CH2 4.46Å; K294-W392 HydrophobicContact CB-CZ2 4Å; K294-W392 HydrophobicContact CD-CD2 4.32Å; K294-W392 HydrophobicContact CD-CE3 4Å; K294-W392 HydrophobicContact CD-CH2 4.43Å; K294-W392 HydrophobicContact CD-CZ3 4.05Å; K294-W392 HydrophobicContact CG-CD2 3.78Å; K294-W392 HydrophobicContact CG-CE3 3.94Å; K294-W392 HydrophobicContact CG-CG 4.02Å; K294-W392 HydrophobicContact CG-CZ3 4.41Å; K297-W392 HydrophobicContact CB-CB 4.37Å; F390-W392 PolarHBondContact O-N 3.26Å; W392-F397 AromaticContact CZ2-CD2 3.93Å; W392-F397 HydrophobicContact CZ2-CD2 3.93Å; W392-F397 HydrophobicContact CZ2-CE2 4.12Å
393	K	87.8	Confident	89.7	Confident	70 Å²	70	46.6 Å²	46.6	30%	0.304	23%	0.23	S	C	.	.			trans	-139.8	111.5	-178.8	-71.9	176.4	178.1	171.9	0	110.5	E339 T395 P396	E339-K393 WeakPolarHBondContact OE1-CE 3.5Å; E339-K393 IonicContact OE1-NZ 3.1Å; E339-K393 PolarHBondContact OE1-NZ 2.91Å; E339-K393 WeakPolarHBondContact OE2-CE 3.36Å; E339-K393 IonicContact OE2-NZ 2.7Å; K393-T395 PolarHBondContact O-N 3.43Å; K393-T395 VanDerWaalsContact O-N 3.17Å; K393-P396 VanDerWaalsContact O-CD 3.29Å; K393-P396 WeakPolarHBondContact O-CD 3.42Å
394	S	93.5	Very high	91.4	Very high	36 Å²	36	40.1 Å²	40.1	25%	0.252	19%	0.188	S	C	.	.			trans	-62.7	-17.5	173.7	61.7	0	0	0	0	114.4	P396 F397 D398	S394-P396 VanDerWaalsContact C-CD 3.45Å; S394-P396 VanDerWaalsContact O-N 3.14Å; S394-F397 CarbonylContact O-C 3.56Å; S394-F397 WeakPolarHBondContact O-CA 3.47Å; S394-F397 WeakPolarHBondContact O-CB 3.25Å; S394-F397 PolarHBondContact O-N 3.34Å; S394-D398 WeakPolarHBondContact CB-OD2 3.34Å; S394-D398 PolarHBondContact O-N 3.1Å; S394-D398 PolarHBondContact OG-OD2 3.14Å
395	T	94	Very high	92.3	Very high	62 Å²	62	40.7 Å²	40.7	38%	0.38	19%	0.194	S	C	.	.	H	α-helix	trans	-51.9	-39	-166.3	-48.6	0	0	0	0	116.4	K393 R399	K393-T395 PolarHBondContact O-N 3.43Å; K393-T395 VanDerWaalsContact O-N 3.17Å; T395-R399 WeakPolarHBondContact O-CB 3.24Å; T395-R399 VanDerWaalsContact O-CG 3.28Å; T395-R399 WeakPolarHBondContact O-CG 3.45Å; T395-R399 PolarHBondContact O-N 3.47Å
396	P	94.4	Very high	92.7	Very high	24 Å²	24	40.3 Å²	40.3	16%	0.156	19%	0.191	C	C	.	.	H	α-helix	trans	-63.6	-49.3	173.4	-19.9	33.7	0	0	0	111.7	K393 S394 R399 M400 V596	K393-P396 VanDerWaalsContact O-CD 3.29Å; K393-P396 WeakPolarHBondContact O-CD 3.42Å; S394-P396 VanDerWaalsContact C-CD 3.45Å; S394-P396 VanDerWaalsContact O-N 3.14Å; P396-R399 PolarHBondContact O-N 2.83Å; P396-M400 WeakPolarHBondContact O-CG 3.44Å; P396-M400 PolarHBondContact O-N 3.03Å; P396-V596 HydrophobicContact CB-CG1 4.04Å; P396-V596 HydrophobicContact CB-CG2 4.14Å; P396-V596 HydrophobicContact CG-CG1 4.29Å
397	F	97.5	Very high	92.8	Very high	20 Å²	20	40.5 Å²	40.5	9%	0.088	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-41.6	179.9	-50.7	-72	0	0	0	112.1	V286 E289 A290 D293 W392 S394 R399 M400 R401	V286-F397 HydrophobicContact CG1-CB 4.16Å; V286-F397 HydrophobicContact CG1-CD1 4.29Å; E289-F397 HydrophobicContact CB-CE1 4.22Å; E289-F397 HydrophobicContact CG-CE1 3.7Å; E289-F397 HydrophobicContact CG-CZ 4.38Å; A290-F397 HydrophobicContact CB-CB 3.76Å; A290-F397 HydrophobicContact CB-CD1 3.77Å; A290-F397 HydrophobicContact CB-CD2 3.78Å; A290-F397 HydrophobicContact CB-CE1 4.33Å; A290-F397 HydrophobicContact CB-CE2 4.31Å; A290-F397 HydrophobicContact CB-CG 3.47Å; A290-F397 VanDerWaalsContact CB-CG 3.47Å; D293-F397 HydrophobicContact CB-CE2 4.31Å; D293-F397 HydrophobicContact CB-CZ 3.96Å; W392-F397 AromaticContact CZ2-CD2 3.93Å; W392-F397 HydrophobicContact CZ2-CD2 3.93Å; W392-F397 HydrophobicContact CZ2-CE2 4.12Å; S394-F397 CarbonylContact O-C 3.56Å; S394-F397 WeakPolarHBondContact O-CA 3.47Å; S394-F397 WeakPolarHBondContact O-CB 3.25Å; S394-F397 PolarHBondContact O-N 3.34Å; F397-R399 VanDerWaalsContact C-N 3.3Å; F397-R399 PolarHBondContact O-N 3.18Å; F397-M400 HydrophobicContact CD1-CE 3.52Å; F397-M400 HydrophobicContact CE1-CE 4.03Å; F397-M400 HydrophobicContact CG-CE 4.31Å; F397-M400 PolarHBondContact O-N 2.72Å; F397-R401 WeakPolarHBondContact O-CG 3.47Å; F397-R401 PolarHBondContact O-N 3.35Å
398	D	97.6	Very high	92.7	Very high	56 Å²	56	40.2 Å²	40.2	30%	0.299	19%	0.192	S	C	.	.	H	α-helix	trans	-62.2	-37.5	175.4	-63.8	-26.5	0	0	0	112.3	S394 R401 R402	S394-D398 WeakPolarHBondContact CB-OD2 3.34Å; S394-D398 PolarHBondContact O-N 3.1Å; S394-D398 PolarHBondContact OG-OD2 3.14Å; D398-R401 IonicContact OD1-CZ 2.93Å; D398-R401 IonicContact OD1-NE 2.76Å; D398-R401 IonicContact OD1-NH2 3.81Å; D398-R401 PolarHBondContact OD1-NH2 3.11Å; D398-R402 WeakPolarHBondContact O-CB 3.26Å; D398-R402 PolarHBondContact O-N 2.92Å
399	R	97.4	Very high	92.6	Very high	48 Å²	48	42.7 Å²	42.7	18%	0.181	21%	0.206	C	C	.	.	H	α-helix	trans	-71.1	-38.8	175.4	-73	176.3	175.5	166.5	5.2	111.6	T395 P396 F397 A403 V596 G599 I626	T395-R399 WeakPolarHBondContact O-CB 3.24Å; T395-R399 VanDerWaalsContact O-CG 3.28Å; T395-R399 WeakPolarHBondContact O-CG 3.45Å; T395-R399 PolarHBondContact O-N 3.47Å; P396-R399 PolarHBondContact O-N 2.83Å; F397-R399 VanDerWaalsContact C-N 3.3Å; F397-R399 PolarHBondContact O-N 3.18Å; R399-A403 VanDerWaalsContact O-CB 3.25Å; R399-A403 WeakPolarHBondContact O-CB 3.27Å; R399-A403 PolarHBondContact O-N 3.07Å; R399-V596 WeakPolarHBondContact CD-O 3.44Å; R399-V596 PolarHBondContact NH1-O 2.9Å; R399-G599 VanDerWaalsContact CZ-O 3.26Å; R399-G599 VanDerWaalsContact NE-C 3.34Å; R399-G599 PolarHBondContact NE-O 3.1Å; R399-G599 PolarHBondContact NH2-O 3.45Å; R399-I626 HydrophobicContact CB-CD1 3.8Å; R399-I626 HydrophobicContact CB-CG1 4.29Å; R399-I626 HydrophobicContact CB-CG2 4.38Å
400	M	97.9	Very high	91.8	Very high	17 Å²	17	50 Å²	50	8%	0.084	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-50.7	172.5	-70.8	-170.3	-71.3	0	0	111.6	V286 P396 F397 R402 A403 I404 P622 E623 I626	V286-M400 HydrophobicContact CG1-CB 4Å; V286-M400 HydrophobicContact CG1-CE 4.18Å; V286-M400 HydrophobicContact CG2-CB 4.33Å; P396-M400 WeakPolarHBondContact O-CG 3.44Å; P396-M400 PolarHBondContact O-N 3.03Å; F397-M400 HydrophobicContact CD1-CE 3.52Å; F397-M400 HydrophobicContact CE1-CE 4.03Å; F397-M400 HydrophobicContact CG-CE 4.31Å; F397-M400 PolarHBondContact O-N 2.72Å; M400-R402 VanDerWaalsContact C-N 3.34Å; M400-R402 PolarHBondContact O-N 2.85Å; M400-A403 PolarHBondContact O-N 3.04Å; M400-A403 VanDerWaalsContact O-N 3.11Å; M400-I404 WeakPolarHBondContact O-CG1 3.29Å; M400-I404 PolarHBondContact O-N 3.38Å; M400-P622 HydrophobicContact CB-CB 3.87Å; M400-P622 HydrophobicContact CG-CB 4.01Å; M400-P622 HydrophobicContact SD-CB 3.9Å; M400-E623 HydrophobicContact CG-CB 4.44Å; M400-E623 HydrophobicContact SD-CB 3.94Å; M400-I626 HydrophobicContact CG-CD1 3.82Å; M400-I626 HydrophobicContact CG-CG1 4.4Å
401	R	97.3	Very high	91.1	Very high	76 Å²	76	57.8 Å²	57.8	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-41.6	176.9	-69.2	-171.1	-65.9	179.8	-5.3	112.6	I283 V286 E287 F397 D398 S405	I283-R401 HydrophobicContact CD1-CB 3.91Å; I283-R401 HydrophobicContact CD1-CG 4.02Å; V286-R401 HydrophobicContact CB-CG 4.34Å; V286-R401 HydrophobicContact CG1-CG 3.7Å; E287-R401 WeakPolarHBondContact OE1-CD 3.49Å; E287-R401 IonicContact OE1-CZ 3.57Å; E287-R401 IonicContact OE1-NE 3.48Å; E287-R401 IonicContact OE1-NH1 3.74Å; E287-R401 PolarHBondContact OE1-NH1 2.81Å; F397-R401 WeakPolarHBondContact O-CG 3.47Å; F397-R401 PolarHBondContact O-N 3.35Å; D398-R401 IonicContact OD1-CZ 2.93Å; D398-R401 IonicContact OD1-NE 2.76Å; D398-R401 IonicContact OD1-NH2 3.81Å; D398-R401 PolarHBondContact OD1-NH2 3.11Å; R401-S405 WeakPolarHBondContact O-CB 3.36Å; R401-S405 PolarHBondContact O-N 2.82Å; R401-S405 PolarHBondContact O-OG 2.89Å
402	R	95.6	Very high	90.2	Very high	162 Å²	162	59.2 Å²	59.2	61%	0.611	28%	0.284	S	S	*	.	H	α-helix	trans	-63.3	-44.5	173.1	-175.1	-177.1	-65.4	-167.6	-2.8	111.5	D398 M400 S405 V406	D398-R402 WeakPolarHBondContact O-CB 3.26Å; D398-R402 PolarHBondContact O-N 2.92Å; M400-R402 VanDerWaalsContact C-N 3.34Å; M400-R402 PolarHBondContact O-N 2.85Å; R402-S405 PolarHBondContact O-N 2.93Å; R402-V406 HydrophobicContact CG-CG2 4.31Å; R402-V406 WeakPolarHBondContact O-CB 3.5Å; R402-V406 VanDerWaalsContact O-CG2 3.31Å; R402-V406 WeakPolarHBondContact O-CG2 3.41Å; R402-V406 PolarHBondContact O-N 3.05Å
403	A	95.5	Very high	89.6	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.033	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-42.4	-179.1	0	0	0	0	0	112.3	R399 M400 V406 V407 L625 I626 M629	R399-A403 VanDerWaalsContact O-CB 3.25Å; R399-A403 WeakPolarHBondContact O-CB 3.27Å; R399-A403 PolarHBondContact O-N 3.07Å; M400-A403 PolarHBondContact O-N 3.04Å; M400-A403 VanDerWaalsContact O-N 3.11Å; A403-V406 PolarHBondContact O-N 3.14Å; A403-V407 WeakPolarHBondContact O-CG2 3.35Å; A403-V407 PolarHBondContact O-N 3.43Å; A403-L625 HydrophobicContact CB-CB 3.79Å; A403-I626 HydrophobicContact CB-CB 4.44Å; A403-I626 HydrophobicContact CB-CG1 3.96Å; A403-M629 HydrophobicContact CB-CG 3.97Å
404	I	95.9	Very high	89.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.1	-53.7	170.4	-62.1	157.7	0	0	0	109.5	Y278 R279 F282 I283 V286 M400 V406 V407 T408 P622 L625	Y278-I404 HydrophobicContact CD1-CG2 4.41Å; Y278-I404 HydrophobicContact CE1-CG2 4.42Å; R279-I404 HydrophobicContact CB-CG2 4.38Å; R279-I404 HydrophobicContact CG-CG2 4.24Å; F282-I404 HydrophobicContact CB-CD1 3.71Å; F282-I404 HydrophobicContact CB-CG1 4.24Å; I283-I404 HydrophobicContact CD1-CB 3.87Å; I283-I404 HydrophobicContact CD1-CD1 3.83Å; I283-I404 HydrophobicContact CD1-CG1 4.49Å; I283-I404 HydrophobicContact CD1-CG2 3.92Å; I283-I404 HydrophobicContact CG1-CB 4.46Å; I283-I404 HydrophobicContact CG1-CD1 4.41Å; I283-I404 HydrophobicContact CG1-CG2 3.96Å; V286-I404 HydrophobicContact CG2-CD1 4.07Å; M400-I404 WeakPolarHBondContact O-CG1 3.29Å; M400-I404 PolarHBondContact O-N 3.38Å; I404-V406 VanDerWaalsContact C-N 3.31Å; I404-V406 PolarHBondContact O-N 3.02Å; I404-V407 WeakPolarHBondContact O-CB 3.46Å; I404-V407 PolarHBondContact O-N 2.58Å; I404-V407 VanDerWaalsContact O-N 3.13Å; I404-T408 HydrophobicContact CG2-CG2 4.36Å; I404-T408 VanDerWaalsContact O-CG2 3.3Å; I404-T408 WeakPolarHBondContact O-CG2 3.36Å; I404-T408 PolarHBondContact O-N 2.81Å; I404-T408 PolarHBondContact O-OG1 3.49Å; I404-P622 HydrophobicContact CD1-CB 3.93Å; I404-P622 HydrophobicContact CD1-CG 4.09Å; I404-P622 HydrophobicContact CG1-CB 4.23Å; I404-L625 HydrophobicContact CB-CD1 4.41Å; I404-L625 HydrophobicContact CG1-CD1 3.76Å
405	S	94.4	Very high	89.4	Confident	46 Å²	46	57.4 Å²	57.4	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-56.3	-43.1	-177.1	-57.9	0	0	0	0	112.8	R401 R402 T408 D409	R401-S405 WeakPolarHBondContact O-CB 3.36Å; R401-S405 PolarHBondContact O-N 2.82Å; R401-S405 PolarHBondContact O-OG 2.89Å; R402-S405 PolarHBondContact O-N 2.93Å; S405-T408 WeakPolarHBondContact CA-OG1 3.43Å; S405-T408 PolarHBondContact O-N 3.14Å; S405-T408 PolarHBondContact O-OG1 3.23Å; S405-D409 PolarHBondContact O-N 2.81Å
406	V	92.2	Very high	89.3	Confident	34 Å²	34	55.3 Å²	55.3	21%	0.206	28%	0.279	C	S	.	.	H	α-helix	trans	-76.4	-27.7	180	177.1	0	0	0	0	113	R402 A403 I404 T408 H412 L414 M629	R402-V406 HydrophobicContact CG-CG2 4.31Å; R402-V406 WeakPolarHBondContact O-CB 3.5Å; R402-V406 VanDerWaalsContact O-CG2 3.31Å; R402-V406 WeakPolarHBondContact O-CG2 3.41Å; R402-V406 PolarHBondContact O-N 3.05Å; A403-V406 PolarHBondContact O-N 3.14Å; I404-V406 VanDerWaalsContact C-N 3.31Å; I404-V406 PolarHBondContact O-N 3.02Å; V406-T408 VanDerWaalsContact C-N 3.26Å; V406-H412 HydrophobicContact CG1-CB 4.39Å; V406-L414 HydrophobicContact CG1-CD1 3.54Å; V406-L414 HydrophobicContact CG1-CG 4.42Å; V406-M629 HydrophobicContact CB-SD 3.89Å; V406-M629 HydrophobicContact CG1-SD 3.67Å
407	V	90.1	Very high	89.2	Confident	8 Å²	8	58.4 Å²	58.4	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-40.6	165.4	161.6	0	0	0	0	110.4	Y278 A403 I404 L415 F420 L423 L625 M629	Y278-V407 HydrophobicContact CE1-CG1 4.42Å; A403-V407 WeakPolarHBondContact O-CG2 3.35Å; A403-V407 PolarHBondContact O-N 3.43Å; I404-V407 WeakPolarHBondContact O-CB 3.46Å; I404-V407 PolarHBondContact O-N 2.58Å; I404-V407 VanDerWaalsContact O-N 3.13Å; V407-L415 HydrophobicContact CG2-CD1 4.34Å; V407-F420 HydrophobicContact CG1-CE2 4.45Å; V407-F420 WeakPolarHBondContact O-CE2 3.34Å; V407-L423 HydrophobicContact CG1-CD2 3.67Å; V407-L423 HydrophobicContact CG2-CD2 4.26Å; V407-L625 HydrophobicContact CG2-CB 4.48Å; V407-L625 HydrophobicContact CG2-CD1 4.16Å; V407-L625 HydrophobicContact CG2-CD2 4.23Å; V407-M629 HydrophobicContact CG2-CE 3.31Å; V407-M629 HydrophobicContact CG2-SD 3.76Å
408	T	86.7	Confident	89	Confident	13 Å²	13	58.8 Å²	58.8	8%	0.08	30%	0.3	C	S	.	.	H	α-helix	trans	-90.4	-13.5	-166.3	56.6	0	0	0	0	114.5	S275 Y278 R279 I404 S405 V406 E410	S275-T408 WeakPolarHBondContact CB-O 3.11Å; S275-T408 WeakPolarHBondContact O-CG2 3.39Å; S275-T408 PolarHBondContact OG-O 2.77Å; Y278-T408 HydrophobicContact CD1-CG2 3.88Å; R279-T408 HydrophobicContact CB-CG2 3.96Å; I404-T408 HydrophobicContact CG2-CG2 4.36Å; I404-T408 VanDerWaalsContact O-CG2 3.3Å; I404-T408 WeakPolarHBondContact O-CG2 3.36Å; I404-T408 PolarHBondContact O-N 2.81Å; I404-T408 PolarHBondContact O-OG1 3.49Å; S405-T408 WeakPolarHBondContact CA-OG1 3.43Å; S405-T408 PolarHBondContact O-N 3.14Å; S405-T408 PolarHBondContact O-OG1 3.23Å; V406-T408 VanDerWaalsContact C-N 3.26Å; T408-E410 PolarHBondContact O-N 3.32Å
409	D	85.1	Confident	88.9	Confident	58 Å²	58	56.3 Å²	56.3	31%	0.31	29%	0.287	S	S	.	.			trans	-77	111.1	174.2	-174.3	-11	0	0	0	111.6	S405 Q411 H412	S405-D409 PolarHBondContact O-N 2.81Å; D409-Q411 PolarHBondContact O-N 2.99Å; D409-Q411 VanDerWaalsContact OD1-CB 3.28Å; D409-Q411 WeakPolarHBondContact OD1-CB 3.49Å; D409-Q411 WeakPolarHBondContact OD1-CG 3.24Å; D409-Q411 PolarHBondContact OD1-N 3.04Å; D409-H412 HydrophobicContact CB-CB 4.32Å; D409-H412 PolarHBondContact O-N 3.3Å; D409-H412 VanDerWaalsContact O-N 3.15Å; D409-H412 IonicContact OD2-CD2 2.79Å; D409-H412 PolarHBondContact OD2-CD2 3.07Å; D409-H412 VanDerWaalsContact OD2-CD2 3.22Å; D409-H412 IonicContact OD2-NE2 3.1Å
410	E	71.8	Confident	88.7	Confident	170 Å²	170	56.1 Å²	56.1	79%	0.794	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.2	178.6	-57.8	-170.5	153.6	0	0	113.3	T408	T408-E410 PolarHBondContact O-N 3.32Å
411	Q	70.2	Confident	88.6	Confident	181 Å²	181	60 Å²	60	85%	0.846	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-28	178.6	-53.5	-174.2	32.2	0	0	112.2	D409	D409-Q411 PolarHBondContact O-N 2.99Å; D409-Q411 VanDerWaalsContact OD1-CB 3.28Å; D409-Q411 WeakPolarHBondContact OD1-CB 3.49Å; D409-Q411 WeakPolarHBondContact OD1-CG 3.24Å; D409-Q411 PolarHBondContact OD1-N 3.04Å
412	H	69.9	Low	88.5	Confident	101 Å²	101	57.6 Å²	57.6	47%	0.468	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-37.4	-174.4	-90.8	-47.2	0	0	0	113.5	V406 D409 L414	V406-H412 HydrophobicContact CG1-CB 4.39Å; D409-H412 HydrophobicContact CB-CB 4.32Å; D409-H412 PolarHBondContact O-N 3.3Å; D409-H412 VanDerWaalsContact O-N 3.15Å; D409-H412 IonicContact OD2-CD2 2.79Å; D409-H412 PolarHBondContact OD2-CD2 3.07Å; D409-H412 VanDerWaalsContact OD2-CD2 3.22Å; D409-H412 IonicContact OD2-NE2 3.1Å; H412-L414 HydrophobicContact CB-CG 4.4Å; H412-L414 WeakPolarHBondContact O-CD2 3.35Å; H412-L414 PolarHBondContact O-N 3.12Å
413	G	77.7	Confident	88.4	Confident	55 Å²	55	50 Å²	50	57%	0.567	27%	0.265	S	S	*	.			trans	52.8	26	166.3	0	0	0	0	0	116.8	L415	G413-L415 PolarHBondContact O-N 3.18Å
414	L	85.6	Confident	88.4	Confident	56 Å²	56	50 Å²	50	29%	0.293	26%	0.264	S	S	.	.			trans	-66.5	-37	-166.9	-62.9	-177.6	0	0	0	113.1	V406 H412 M629 R633	V406-L414 HydrophobicContact CG1-CD1 3.54Å; V406-L414 HydrophobicContact CG1-CG 4.42Å; H412-L414 HydrophobicContact CB-CG 4.4Å; H412-L414 WeakPolarHBondContact O-CD2 3.35Å; H412-L414 PolarHBondContact O-N 3.12Å; L414-M629 HydrophobicContact CD1-SD 4.42Å; L414-R633 PolarHBondContact O-NH1 2.71Å
415	L	91.2	Very high	88.4	Confident	14 Å²	14	50 Å²	50	7%	0.073	27%	0.265	C	S	.	.	S	Bend	trans	-81.9	144.8	180	-59.7	-177.1	0	0	0	111.3	V407 G413 F420 L423 L628 M629	V407-L415 HydrophobicContact CG2-CD1 4.34Å; G413-L415 PolarHBondContact O-N 3.18Å; L415-F420 HydrophobicContact CB-CB 4.26Å; L415-L423 HydrophobicContact CD1-CD2 4.38Å; L415-L628 HydrophobicContact CD2-CB 3.95Å; L415-M629 HydrophobicContact CD1-CE 4.03Å; L415-M629 HydrophobicContact CD2-CE 3.91Å; L415-M629 HydrophobicContact CG-CE 3.94Å
416	P	91.4	Very high	88.3	Confident	18 Å²	18	51 Å²	51	12%	0.117	26%	0.264	C	S	.	.			trans	-56.6	143.2	166.9	-19	29.1	0	0	0	110.3	Y418 I419 F420 C632	P416-Y418 PolarHBondContact O-N 3.26Å; P416-I419 HydrophobicContact CB-CG1 4.32Å; P416-I419 HydrophobicContact CG-CD1 3.93Å; P416-I419 HydrophobicContact CG-CG1 4.14Å; P416-I419 PolarHBondContact O-N 2.97Å; P416-F420 PolarHBondContact O-N 2.89Å; P416-C632 VanDerWaalsContact CD-O 3.24Å; P416-C632 WeakPolarHBondContact CD-O 3.47Å
417	P	91.8	Very high	88.1	Confident	89 Å²	89	56.2 Å²	56.2	58%	0.578	29%	0.286	S	S	*	.	H	α-helix	trans	-50.3	-37.1	177.1	-30.4	35.9	0	0	0	113.3	I419 F420 Y421	P417-I419 PolarHBondContact O-N 2.7Å; P417-F420 PolarHBondContact O-N 2.82Å; P417-Y421 HydrophobicContact CB-CD2 4.08Å; P417-Y421 HydrophobicContact CB-CE2 3.92Å; P417-Y421 WeakPolarHBondContact O-CB 3.19Å; P417-Y421 WeakPolarHBondContact O-CD2 3.42Å; P417-Y421 PolarHBondContact O-N 2.73Å
418	Y	93.9	Very high	88.1	Confident	28 Å²	28	58.6 Å²	58.6	11%	0.11	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-46.5	174.3	-168	-88.2	0	0	0	113.4	P416 R422 L428 D429 M431 P464 L465	P416-Y418 PolarHBondContact O-N 3.26Å; Y418-R422 HydrophobicContact CD1-CG 4.19Å; Y418-R422 HydrophobicContact CE1-CG 3.8Å; Y418-R422 VanDerWaalsContact O-CB 3.3Å; Y418-R422 WeakPolarHBondContact O-CB 3.3Å; Y418-R422 WeakPolarHBondContact O-CG 3.21Å; Y418-R422 PolarHBondContact O-N 3.21Å; Y418-R422 VanDerWaalsContact O-N 3.12Å; Y418-R422 PolarHBondContact OH-NE 3.18Å; Y418-R422 PolarHBondContact OH-NH2 3.17Å; Y418-L428 HydrophobicContact CD2-CD1 3.92Å; Y418-L428 HydrophobicContact CE2-CB 4.13Å; Y418-L428 HydrophobicContact CE2-CD1 4.08Å; Y418-L428 HydrophobicContact CG-CD1 4.46Å; Y418-D429 WeakPolarHBondContact CE2-O 3.26Å; Y418-D429 PolarHBondContact OH-O 3.19Å; Y418-M431 HydrophobicContact CD1-CE 4.47Å; Y418-M431 HydrophobicContact CD2-CB 3.75Å; Y418-M431 HydrophobicContact CD2-CE 4.07Å; Y418-M431 HydrophobicContact CD2-SD 4.46Å; Y418-M431 HydrophobicContact CE2-CB 3.58Å; Y418-M431 HydrophobicContact CG-CB 4.45Å; Y418-M431 HydrophobicContact CG-CE 3.82Å; Y418-P464 HydrophobicContact CD1-CB 4.12Å; Y418-P464 HydrophobicContact CD1-CG 3.42Å; Y418-P464 VanDerWaalsContact CD1-CG 3.42Å; Y418-P464 HydrophobicContact CE1-CG 3.57Å; Y418-P464 HydrophobicContact CG-CG 4.05Å; Y418-L465 HydrophobicContact CE1-CB 4.35Å
419	I	94.5	Very high	88.2	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-77.1	-38.9	-176.3	-56	-172.9	0	0	0	109.8	P416 P417 L423 V635	P416-I419 HydrophobicContact CB-CG1 4.32Å; P416-I419 HydrophobicContact CG-CD1 3.93Å; P416-I419 HydrophobicContact CG-CG1 4.14Å; P416-I419 PolarHBondContact O-N 2.97Å; P417-I419 PolarHBondContact O-N 2.7Å; I419-L423 WeakPolarHBondContact O-CB 3.4Å; I419-L423 PolarHBondContact O-N 3.05Å; I419-V635 HydrophobicContact CD1-CB 4.5Å; I419-V635 HydrophobicContact CD1-CG2 3.91Å; I419-V635 HydrophobicContact CG2-CG2 4.37Å
420	F	94.7	Very high	88.3	Confident	44 Å²	44	66.4 Å²	66.4	19%	0.193	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-51.7	175.7	176.5	-103.4	0	0	0	112.7	V407 L415 P416 P417 R422 L423 L424	V407-F420 HydrophobicContact CG1-CE2 4.45Å; V407-F420 WeakPolarHBondContact O-CE2 3.34Å; L415-F420 HydrophobicContact CB-CB 4.26Å; P416-F420 PolarHBondContact O-N 2.89Å; P417-F420 PolarHBondContact O-N 2.82Å; F420-R422 PolarHBondContact O-N 2.65Å; F420-L423 WeakPolarHBondContact O-CB 3.47Å; F420-L423 PolarHBondContact O-N 2.58Å; F420-L423 VanDerWaalsContact O-N 3.12Å; F420-L424 HydrophobicContact CD1-CD1 4.4Å; F420-L424 HydrophobicContact CE1-CD1 3.76Å; F420-L424 HydrophobicContact CZ-CD1 3.83Å; F420-L424 HydrophobicContact CZ-CG 4.49Å; F420-L424 PolarHBondContact O-N 2.66Å
421	Y	94.3	Very high	89.1	Confident	99 Å²	99	62.2 Å²	62.2	39%	0.388	32%	0.321	S	S	.	.	H	α-helix	trans	-69.9	-33.5	179.4	-66.7	-49.1	0	0	0	112.5	P417 L423 L424 G425 Q426	P417-Y421 HydrophobicContact CB-CD2 4.08Å; P417-Y421 HydrophobicContact CB-CE2 3.92Å; P417-Y421 WeakPolarHBondContact O-CB 3.19Å; P417-Y421 WeakPolarHBondContact O-CD2 3.42Å; P417-Y421 PolarHBondContact O-N 2.73Å; Y421-L423 VanDerWaalsContact C-N 3.34Å; Y421-L424 HydrophobicContact CD1-CD1 4.47Å; Y421-L424 PolarHBondContact O-N 3.18Å; Y421-G425 PolarHBondContact O-N 2.97Å; Y421-Q426 WeakPolarHBondContact O-CB 3.25Å; Y421-Q426 PolarHBondContact O-N 3.06Å
422	R	94.8	Very high	90.1	Very high	24 Å²	24	58.1 Å²	58.1	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-42.5	167.4	-77.1	-59.7	-159.9	-164.2	1.9	111.5	Y418 F420 L424 G425 L428 D430 L465 F666	Y418-R422 HydrophobicContact CD1-CG 4.19Å; Y418-R422 HydrophobicContact CE1-CG 3.8Å; Y418-R422 VanDerWaalsContact O-CB 3.3Å; Y418-R422 WeakPolarHBondContact O-CB 3.3Å; Y418-R422 WeakPolarHBondContact O-CG 3.21Å; Y418-R422 PolarHBondContact O-N 3.21Å; Y418-R422 VanDerWaalsContact O-N 3.12Å; Y418-R422 PolarHBondContact OH-NE 3.18Å; Y418-R422 PolarHBondContact OH-NH2 3.17Å; F420-R422 PolarHBondContact O-N 2.65Å; R422-L424 PolarHBondContact O-N 2.89Å; R422-G425 WeakPolarHBondContact O-CA 3.47Å; R422-G425 PolarHBondContact O-N 3.48Å; R422-L428 HydrophobicContact CG-CD1 4.41Å; R422-L428 VanDerWaalsContact CZ-O 3.24Å; R422-L428 PolarHBondContact NH1-O 2.91Å; R422-L428 PolarHBondContact NH2-O 2.93Å; R422-D430 IonicContact NH2-OD1 3.58Å; R422-L465 HydrophobicContact CB-CD2 3.92Å; R422-L465 HydrophobicContact CG-CD2 4.15Å; R422-F666 WeakPolarHBondContact O-CE1 3.19Å
423	L	94.9	Very high	91	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-60.1	-42.7	176.3	-178.5	66.2	0	0	0	111.8	Y278 V407 L415 I419 F420 Y421 G425 L625 L662 R665 F666	Y278-L423 HydrophobicContact CE2-CD1 4.39Å; Y278-L423 HydrophobicContact CE2-CG 4.25Å; V407-L423 HydrophobicContact CG1-CD2 3.67Å; V407-L423 HydrophobicContact CG2-CD2 4.26Å; L415-L423 HydrophobicContact CD1-CD2 4.38Å; I419-L423 WeakPolarHBondContact O-CB 3.4Å; I419-L423 PolarHBondContact O-N 3.05Å; F420-L423 WeakPolarHBondContact O-CB 3.47Å; F420-L423 PolarHBondContact O-N 2.58Å; F420-L423 VanDerWaalsContact O-N 3.12Å; Y421-L423 VanDerWaalsContact C-N 3.34Å; L423-G425 PolarHBondContact O-N 3.32Å; L423-L625 HydrophobicContact CD1-CD2 3.94Å; L423-L625 HydrophobicContact CD2-CD2 3.74Å; L423-L625 HydrophobicContact CG-CD2 4.5Å; L423-L662 HydrophobicContact CD1-CD1 3.52Å; L423-L662 HydrophobicContact CD1-CD2 4.36Å; L423-R665 VanDerWaalsContact O-CZ 3.31Å; L423-R665 PolarHBondContact O-NH1 3.36Å; L423-R665 PolarHBondContact O-NH2 3.23Å; L423-F666 HydrophobicContact CD1-CZ 4.5Å
424	L	95.5	Very high	91.4	Very high	3 Å²	3	63.1 Å²	63.1	2%	0.016	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-1.1	171.5	-61.4	-177.9	0	0	0	113.8	R271 Y272 Y278 F420 Y421 R422 Q426	R271-L424 WeakPolarHBondContact CA-O 3.38Å; Y272-L424 PolarHBondContact N-O 3.38Å; Y278-L424 HydrophobicContact CD2-CD2 4.2Å; Y278-L424 HydrophobicContact CG-CD2 4.16Å; F420-L424 HydrophobicContact CD1-CD1 4.4Å; F420-L424 HydrophobicContact CE1-CD1 3.76Å; F420-L424 HydrophobicContact CZ-CD1 3.83Å; F420-L424 HydrophobicContact CZ-CG 4.49Å; F420-L424 PolarHBondContact O-N 2.66Å; Y421-L424 HydrophobicContact CD1-CD1 4.47Å; Y421-L424 PolarHBondContact O-N 3.18Å; R422-L424 PolarHBondContact O-N 2.89Å; L424-Q426 VanDerWaalsContact C-N 3.33Å; L424-Q426 HydrophobicContact CB-CG 4.28Å
425	G	94.8	Very high	91.5	Very high	2 Å²	2	61.9 Å²	61.9	2%	0.021	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	17.8	-179.6	0	0	0	0	0	114.2	R271 Y421 R422 L423	R271-G425 WeakPolarHBondContact CD-O 3.34Å; R271-G425 VanDerWaalsContact CG-O 3.29Å; R271-G425 WeakPolarHBondContact CG-O 3.37Å; R271-G425 PolarHBondContact NH1-O 3.06Å; Y421-G425 PolarHBondContact O-N 2.97Å; R422-G425 WeakPolarHBondContact O-CA 3.47Å; R422-G425 PolarHBondContact O-N 3.48Å; L423-G425 PolarHBondContact O-N 3.32Å
426	Q	92.3	Very high	91.4	Very high	65 Å²	65	68.4 Å²	68.4	30%	0.304	35%	0.346	S	S	.	.			trans	-72.2	147.4	176.3	-58.9	-174	-0.4	0	0	111.3	Y421 L424	Y421-Q426 WeakPolarHBondContact O-CB 3.25Å; Y421-Q426 PolarHBondContact O-N 3.06Å; L424-Q426 VanDerWaalsContact C-N 3.33Å; L424-Q426 HydrophobicContact CB-CG 4.28Å
427	E	88.3	Confident	91.4	Very high	145 Å²	145	70.4 Å²	70.4	68%	0.678	36%	0.355	S	S	*	.			trans	-84.3	123.6	177.4	-152.4	148.4	138	0	0	110	R271	R271-E427 IonicContact CZ-OE2 2.74Å; R271-E427 IonicContact NH1-OE2 3.79Å; R271-E427 PolarHBondContact NH1-OE2 3.05Å; R271-E427 IonicContact NH2-OE2 2.64Å; R271-E427 PolarHBondContact NH2-OE2 3.41Å
428	L	90.5	Very high	91.4	Very high	58 Å²	58	67.6 Å²	67.6	30%	0.304	34%	0.337	S	S	.	.			trans	-134.2	155.8	178.3	-64.3	-179.7	0	0	0	109.2	Y418 R422	Y418-L428 HydrophobicContact CD2-CD1 3.92Å; Y418-L428 HydrophobicContact CE2-CB 4.13Å; Y418-L428 HydrophobicContact CE2-CD1 4.08Å; Y418-L428 HydrophobicContact CG-CD1 4.46Å; R422-L428 HydrophobicContact CG-CD1 4.41Å; R422-L428 VanDerWaalsContact CZ-O 3.24Å; R422-L428 PolarHBondContact NH1-O 2.91Å; R422-L428 PolarHBondContact NH2-O 2.93Å
429	D	89.1	Confident	91.2	Very high	150 Å²	150	76.8 Å²	76.8	80%	0.802	38%	0.377	S	S	*	.			trans	-61	162.4	168.2	-66.2	-54.8	0	0	0	112.1	Y418 M431	Y418-D429 WeakPolarHBondContact CE2-O 3.26Å; Y418-D429 PolarHBondContact OH-O 3.19Å; D429-M431 PolarHBondContact O-N 2.87Å
430	D	86.7	Confident	91.1	Very high	85 Å²	85	82.6 Å²	82.6	46%	0.455	40%	0.399	S	S	.	.			trans	-78.8	101.5	174.8	-94.6	-18.5	0	0	0	111.1	R422 V432 R463	R422-D430 IonicContact NH2-OD1 3.58Å; D430-V432 PolarHBondContact O-N 3.49Å; D430-R463 IonicContact OD1-CZ 3.68Å; D430-R463 IonicContact OD1-NH1 3.71Å; D430-R463 PolarHBondContact OD1-NH1 3.35Å; D430-R463 IonicContact OD1-NH2 3.88Å; D430-R463 IonicContact OD2-CZ 2.72Å; D430-R463 VanDerWaalsContact OD2-CZ 3.23Å; D430-R463 IonicContact OD2-NH1 3.35Å; D430-R463 PolarHBondContact OD2-NH1 2.91Å; D430-R463 IonicContact OD2-NH2 2.71Å; D430-R463 PolarHBondContact OD2-NH2 3.1Å
431	M	89.5	Confident	91.2	Very high	81 Å²	81	82.3 Å²	82.3	40%	0.399	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-72.9	124.3	177.4	-179.5	166.5	71.3	0	0	111.4	Y418 D429 L433 P464	Y418-M431 HydrophobicContact CD1-CE 4.47Å; Y418-M431 HydrophobicContact CD2-CB 3.75Å; Y418-M431 HydrophobicContact CD2-CE 4.07Å; Y418-M431 HydrophobicContact CD2-SD 4.46Å; Y418-M431 HydrophobicContact CE2-CB 3.58Å; Y418-M431 HydrophobicContact CG-CB 4.45Å; Y418-M431 HydrophobicContact CG-CE 3.82Å; D429-M431 PolarHBondContact O-N 2.87Å; M431-L433 HydrophobicContact CE-CD2 4.42Å; M431-P464 HydrophobicContact CB-CG 4.21Å; M431-P464 HydrophobicContact CE-CB 3.8Å; M431-P464 HydrophobicContact CE-CG 3.63Å; M431-P464 WeakPolarHBondContact O-CD 3.32Å
432	V	89.6	Confident	91.2	Very high	95 Å²	95	78 Å²	78	58%	0.576	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-99.7	122.8	176.1	-178.7	0	0	0	0	110.8	D430 Q462	D430-V432 PolarHBondContact O-N 3.49Å; V432-Q462 CarbonylContact C-O 3.6Å; V432-Q462 WeakPolarHBondContact CA-O 3.41Å; V432-Q462 HydrophobicContact CG1-CB 4.35Å
433	L	89.1	Confident	91.3	Very high	44 Å²	44	76.9 Å²	76.9	23%	0.23	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-76	136.5	173.8	-59.2	-177.5	0	0	0	111	M431 C435 Q462 R463 P464 Q634	M431-L433 HydrophobicContact CE-CD2 4.42Å; L433-C435 PolarHBondContact O-N 3.28Å; L433-Q462 PolarHBondContact N-O 3.3Å; L433-R463 WeakPolarHBondContact CD1-O 3.31Å; L433-P464 HydrophobicContact CD2-CB 4.31Å; L433-Q634 HydrophobicContact CD1-CG 4.47Å
434	K	86.7	Confident	91.3	Very high	217 Å²	217	78.8 Å²	78.8	94%	0.943	39%	0.389	S	S	*	.			trans	-83.6	107.6	172.8	-66.3	179.7	-179.1	176.6	0	109.6
435	C	88	Confident	91.3	Very high	31 Å²	31	85.1 Å²	85.1	21%	0.209	42%	0.423	C	S	.	.			trans	-136.2	155.9	177.3	61.5	0	0	0	0	111.4	L433 L437 L461 I490	L433-C435 PolarHBondContact O-N 3.28Å; C435-L437 PolarHBondContact O-N 3.34Å; C435-L461 PolarHBondContact SG-O 3.15Å; C435-I490 HydrophobicContact CB-CG2 4.04Å
436	N	88.8	Confident	91.3	Very high	151 Å²	151	85.9 Å²	85.9	81%	0.807	43%	0.427	S	S	*	.			trans	-84.9	102.3	171.7	-71.8	-29.8	0	0	0	108.7
437	L	91.7	Very high	91.4	Very high	60 Å²	60	86.8 Å²	86.8	31%	0.314	44%	0.438	S	S	.	.			trans	-64.9	142.1	-178.6	-71.7	174.2	0	0	0	112.4	C435 Y441 K458 L461 Q462	C435-L437 PolarHBondContact O-N 3.34Å; L437-Y441 HydrophobicContact CD2-CE1 4.36Å; L437-K458 HydrophobicContact CD1-CG 4.24Å; L437-K458 HydrophobicContact CD2-CG 4.39Å; L437-L461 HydrophobicContact CD2-CB 4.25Å; L437-Q462 HydrophobicContact CD2-CG 3.92Å
438	P	91.1	Very high	91.8	Very high	29 Å²	29	86.4 Å²	86.4	19%	0.188	44%	0.436	C	S	.	.			trans	-73.8	151.3	179.6	32.7	-35.8	0	0	0	111.2	R440 Y441 L461	P438-R440 VanDerWaalsContact C-N 3.32Å; P438-R440 PolarHBondContact O-N 3.15Å; P438-Y441 HydrophobicContact CG-CD1 3.77Å; P438-Y441 HydrophobicContact CG-CE1 3.73Å; P438-Y441 HydrophobicContact CG-CG 4.44Å; P438-L461 HydrophobicContact CG-CD1 4.31Å
439	K	90.2	Very high	92.1	Very high	221 Å²	221	84.2 Å²	84.2	96%	0.961	43%	0.425	S	S	*	.	S	Bend	trans	-71.9	-24.4	175.9	-65.2	-175.2	-178.8	179.6	0	113.4
440	R	93.2	Very high	92.5	Very high	128 Å²	128	78 Å²	78	48%	0.483	39%	0.392	S	S	.	.			trans	-132.9	125.6	176.9	-174.6	177.9	-171.7	-115.3	5.6	108.5	P438 S442 E448 H486	P438-R440 VanDerWaalsContact C-N 3.32Å; P438-R440 PolarHBondContact O-N 3.15Å; R440-S442 PolarHBondContact NH1-O 2.89Å; R440-E448 IonicContact CZ-OE1 3.85Å; R440-E448 IonicContact NE-OE1 3.74Å; R440-E448 PolarHBondContact NE-OE1 2.82Å; R440-E448 IonicContact NH2-OE1 2.75Å; R440-E448 PolarHBondContact NH2-OE1 3.4Å; R440-H486 PolarHBondContact O-CE1 3.01Å; R440-H486 VanDerWaalsContact O-CE1 3.23Å
441	Y	95.9	Very high	92.9	Very high	38 Å²	38	78.9 Å²	78.9	15%	0.149	39%	0.393	C	S	.	.			trans	-89.9	-17.3	-177	-65.8	-86.9	0	0	0	113.3	L437 P438 L449 V454 V457 K458 L461 H486	L437-Y441 HydrophobicContact CD2-CE1 4.36Å; P438-Y441 HydrophobicContact CG-CD1 3.77Å; P438-Y441 HydrophobicContact CG-CE1 3.73Å; P438-Y441 HydrophobicContact CG-CG 4.44Å; Y441-L449 WeakPolarHBondContact O-CD1 3.31Å; Y441-V454 HydrophobicContact CD2-CG1 3.69Å; Y441-V454 HydrophobicContact CE2-CG1 4.37Å; Y441-V454 HydrophobicContact CG-CG1 4.02Å; Y441-V457 HydrophobicContact CD1-CB 4.22Å; Y441-V457 HydrophobicContact CD1-CG1 3.81Å; Y441-K458 HydrophobicContact CD1-CB 4.32Å; Y441-K458 HydrophobicContact CE1-CB 3.7Å; Y441-K458 HydrophobicContact CE1-CG 4.11Å; Y441-L461 HydrophobicContact CE1-CD1 4.47Å; Y441-H486 VanDerWaalsContact C-NE2 3.33Å; Y441-H486 PolarHBondContact O-CD2 3.16Å; Y441-H486 PolarHBondContact O-NE2 2.89Å
442	S	95.2	Very high	93.3	Very high	9 Å²	9	75.3 Å²	75.3	6%	0.063	38%	0.376	C	S	.	.	S	Bend	trans	-74.9	126.6	170.1	-48.3	0	0	0	0	110.7	R440 L449	R440-S442 PolarHBondContact NH1-O 2.89Å; S442-L449 PolarHBondContact OG-N 3.12Å
443	A	95.5	Very high	93.7	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-64.2	162.5	173.7	0	0	0	0	0	112	L446 Y485 T515	A443-L446 HydrophobicContact CB-CD1 4.21Å; A443-Y485 HydrophobicContact CB-CD1 4.02Å; A443-Y485 HydrophobicContact CB-CG 3.93Å; A443-T515 HydrophobicContact CB-CG2 3.81Å
444	P	95	Very high	94.1	Very high	42 Å²	42	71.1 Å²	71.1	27%	0.273	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	150.5	167.1	28.2	-35.8	0	0	0	111.5	L446 Y485 T515	P444-L446 PolarHBondContact O-N 2.86Å; P444-Y485 VanDerWaalsContact CD-CZ 3.43Å; P444-Y485 HydrophobicContact CG-CD2 4.31Å; P444-Y485 HydrophobicContact CG-CE2 3.68Å; P444-T515 WeakPolarHBondContact CG-O 3.15Å
445	D	96	Very high	94.7	Very high	137 Å²	137	66.5 Å²	66.5	73%	0.733	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	13.5	172.2	-56.2	-60.9	0	0	0	117.1	R514	D445-R514 WeakPolarHBondContact CB-O 3.42Å
446	L	95.5	Very high	95.1	Very high	17 Å²	17	65 Å²	65	9%	0.089	32%	0.322	C	S	.	.	S	Bend	trans	-110.5	157.8	167.2	-67.5	-175.4	0	0	0	110.9	A443 P444 V478 A481 K511 R514 T515	A443-L446 HydrophobicContact CB-CD1 4.21Å; P444-L446 PolarHBondContact O-N 2.86Å; L446-V478 HydrophobicContact CB-CG1 4.36Å; L446-V478 HydrophobicContact CD1-CG1 4.48Å; L446-A481 HydrophobicContact CD1-CB 3.74Å; L446-K511 HydrophobicContact CD2-CB 4.41Å; L446-K511 HydrophobicContact CD2-CD 4.46Å; L446-R514 HydrophobicContact CD2-CB 4.3Å; L446-T515 HydrophobicContact CD1-CG2 3.6Å; L446-T515 HydrophobicContact CG-CG2 3.91Å
447	P	94.4	Very high	95.6	Very high	85 Å²	85	57.9 Å²	57.9	55%	0.552	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-54.9	150.7	174.8	-25.9	35.2	0	0	0	113.2
448	E	96.2	Very high	95.8	Very high	136 Å²	136	59.2 Å²	59.2	64%	0.636	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-65.5	135.8	174.9	-171.8	140	-100.7	0	0	111.1	R440	R440-E448 IonicContact CZ-OE1 3.85Å; R440-E448 IonicContact NE-OE1 3.74Å; R440-E448 PolarHBondContact NE-OE1 2.82Å; R440-E448 IonicContact NH2-OE1 2.75Å; R440-E448 PolarHBondContact NH2-OE1 3.4Å
449	L	96.9	Very high	96	Very high	13 Å²	13	58.9 Å²	58.9	7%	0.068	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-82.9	135.6	-173	-63.4	-177.8	0	0	0	110.7	Y441 S442 Q453 V454 V457 V478	Y441-L449 WeakPolarHBondContact O-CD1 3.31Å; S442-L449 PolarHBondContact OG-N 3.12Å; L449-Q453 HydrophobicContact CB-CB 3.96Å; L449-Q453 HydrophobicContact CD2-CB 4.17Å; L449-Q453 HydrophobicContact CG-CB 4.45Å; L449-V454 HydrophobicContact CB-CG2 3.69Å; L449-V457 HydrophobicContact CD1-CG2 3.74Å; L449-V478 HydrophobicContact CD2-CG1 4.05Å
450	N	96.8	Very high	96.4	Very high	19 Å²	19	48.4 Å²	48.4	10%	0.102	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-74.6	169.9	173.7	70.2	58.8	0	0	0	112.4	S452 Q453 V454 V678 Y680	N450-S452 VanDerWaalsContact C-N 3.28Å; N450-S452 PolarHBondContact O-N 2.82Å; N450-S452 VanDerWaalsContact O-N 3.16Å; N450-S452 PolarHBondContact OD1-N 3.5Å; N450-S452 PolarHBondContact OD1-OG 3.01Å; N450-Q453 PolarHBondContact ND2-NE2 2.87Å; N450-Q453 PolarHBondContact ND2-OE1 3.24Å; N450-Q453 PolarHBondContact O-N 3.33Å; N450-Q453 PolarHBondContact OD1-N 3.5Å; N450-V454 WeakPolarHBondContact O-CG2 3.5Å; N450-V454 PolarHBondContact O-N 3.12Å; N450-V678 HydrophobicContact CB-CG2 4.3Å; N450-Y680 PolarHBondContact ND2-OH 3.07Å
451	H	96.7	Very high	96.5	Very high	104 Å²	104	42.3 Å²	42.3	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-50.1	-42.3	-177.6	62.6	-91	0	0	0	114.1	F455 Q700	H451-F455 WeakPolarHBondContact O-CB 3.1Å; H451-F455 PolarHBondContact O-N 3.02Å; H451-Q700 PolarHBondContact CE1-OE1 3.07Å
452	S	97.4	Very high	96.5	Very high	5 Å²	5	43 Å²	43	4%	0.035	22%	0.221	C	C	.	.	H	α-helix	trans	-72.6	-36.3	-178.7	71.5	0	0	0	0	112.3	N450 A456 Q677	N450-S452 VanDerWaalsContact C-N 3.28Å; N450-S452 PolarHBondContact O-N 2.82Å; N450-S452 VanDerWaalsContact O-N 3.16Å; N450-S452 PolarHBondContact OD1-N 3.5Å; N450-S452 PolarHBondContact OD1-OG 3.01Å; S452-A456 WeakPolarHBondContact O-CB 3.25Å; S452-A456 PolarHBondContact O-N 2.82Å; S452-Q677 PolarHBondContact OG-N 3.36Å
453	Q	98.1	Very high	96.5	Very high	9 Å²	9	45.9 Å²	45.9	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-70.3	-43.5	174.8	-64.6	168.6	-22.7	0	0	111.3	L449 N450 F455 A456 V457 T474 T479 L676	L449-Q453 HydrophobicContact CB-CB 3.96Å; L449-Q453 HydrophobicContact CD2-CB 4.17Å; L449-Q453 HydrophobicContact CG-CB 4.45Å; N450-Q453 PolarHBondContact ND2-NE2 2.87Å; N450-Q453 PolarHBondContact ND2-OE1 3.24Å; N450-Q453 PolarHBondContact O-N 3.33Å; N450-Q453 PolarHBondContact OD1-N 3.5Å; Q453-F455 VanDerWaalsContact C-N 3.32Å; Q453-F455 PolarHBondContact O-N 3.11Å; Q453-A456 WeakPolarHBondContact O-CB 3.35Å; Q453-A456 PolarHBondContact O-N 3.17Å; Q453-A456 VanDerWaalsContact O-N 3.17Å; Q453-V457 WeakPolarHBondContact O-CG2 3.38Å; Q453-V457 PolarHBondContact O-N 2.78Å; Q453-T474 PolarHBondContact NE2-O 2.8Å; Q453-T479 HydrophobicContact CB-CG2 4.3Å; Q453-T479 WeakPolarHBondContact CG-OG1 3.48Å; Q453-L676 HydrophobicContact CG-CD2 4.04Å
454	V	97.9	Very high	96.5	Very high	42 Å²	42	46 Å²	46	26%	0.255	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-42.2	174.2	171.1	0	0	0	0	111.2	Y441 L449 N450 K458	Y441-V454 HydrophobicContact CD2-CG1 3.69Å; Y441-V454 HydrophobicContact CE2-CG1 4.37Å; Y441-V454 HydrophobicContact CG-CG1 4.02Å; L449-V454 HydrophobicContact CB-CG2 3.69Å; N450-V454 WeakPolarHBondContact O-CG2 3.5Å; N450-V454 PolarHBondContact O-N 3.12Å; V454-K458 WeakPolarHBondContact O-CB 3.45Å; V454-K458 PolarHBondContact O-N 3.2Å
455	F	97.5	Very high	96.6	Very high	121 Å²	121	44.5 Å²	44.5	53%	0.531	22%	0.221	S	C	.	.	H	α-helix	trans	-62.7	-40.9	174	178.6	-99.3	0	0	0	112.4	H451 Q453 T459 I674	H451-F455 WeakPolarHBondContact O-CB 3.1Å; H451-F455 PolarHBondContact O-N 3.02Å; Q453-F455 VanDerWaalsContact C-N 3.32Å; Q453-F455 PolarHBondContact O-N 3.11Å; F455-T459 WeakPolarHBondContact O-CB 3.39Å; F455-T459 PolarHBondContact O-N 3.42Å; F455-T459 PolarHBondContact O-OG1 3.05Å; F455-I674 HydrophobicContact CD1-CG2 3.78Å; F455-I674 HydrophobicContact CE1-CG2 3.97Å
456	A	98	Very high	96.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-51.9	175	0	0	0	0	0	112	S452 Q453 K458 T459 V460 I468 T479 I674 L676	S452-A456 WeakPolarHBondContact O-CB 3.25Å; S452-A456 PolarHBondContact O-N 2.82Å; Q453-A456 WeakPolarHBondContact O-CB 3.35Å; Q453-A456 PolarHBondContact O-N 3.17Å; Q453-A456 VanDerWaalsContact O-N 3.17Å; A456-K458 PolarHBondContact O-N 2.78Å; A456-T459 PolarHBondContact O-N 2.85Å; A456-V460 WeakPolarHBondContact O-CB 3.39Å; A456-V460 VanDerWaalsContact O-CG2 3.26Å; A456-V460 WeakPolarHBondContact O-CG2 3.33Å; A456-V460 PolarHBondContact O-N 2.65Å; A456-I468 HydrophobicContact CB-CD1 4.09Å; A456-I468 HydrophobicContact CB-CG1 4.43Å; A456-T479 HydrophobicContact CB-CG2 4.38Å; A456-I674 HydrophobicContact CB-CG2 3.82Å; A456-L676 HydrophobicContact CB-CD2 3.92Å
457	V	98	Very high	96.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-55.8	-51.7	176.5	-179	0	0	0	0	110.3	Y441 L449 Q453 T459 V460 L461 T479 I483	Y441-V457 HydrophobicContact CD1-CB 4.22Å; Y441-V457 HydrophobicContact CD1-CG1 3.81Å; L449-V457 HydrophobicContact CD1-CG2 3.74Å; Q453-V457 WeakPolarHBondContact O-CG2 3.38Å; Q453-V457 PolarHBondContact O-N 2.78Å; V457-T459 PolarHBondContact O-N 2.62Å; V457-V460 PolarHBondContact O-N 3.12Å; V457-L461 HydrophobicContact CG1-CD1 3.88Å; V457-L461 HydrophobicContact CG1-CG 4.36Å; V457-L461 VanDerWaalsContact O-CG 3.25Å; V457-L461 WeakPolarHBondContact O-CG 3.34Å; V457-L461 PolarHBondContact O-N 2.89Å; V457-L461 VanDerWaalsContact O-N 3.11Å; V457-T479 HydrophobicContact CG2-CG2 4.29Å; V457-I483 HydrophobicContact CB-CG1 4.38Å; V457-I483 HydrophobicContact CG1-CG1 4.43Å; V457-I483 HydrophobicContact CG2-CG1 3.94Å
458	K	96.7	Very high	97	Very high	88 Å²	88	33.7 Å²	33.7	38%	0.383	16%	0.158	S	C	.	.	H	α-helix	trans	-55.8	-48.3	-179.9	-179.1	-177.9	174.3	-170.8	0	112.1	L437 Y441 V454 A456 Q462	L437-K458 HydrophobicContact CD1-CG 4.24Å; L437-K458 HydrophobicContact CD2-CG 4.39Å; Y441-K458 HydrophobicContact CD1-CB 4.32Å; Y441-K458 HydrophobicContact CE1-CB 3.7Å; Y441-K458 HydrophobicContact CE1-CG 4.11Å; V454-K458 WeakPolarHBondContact O-CB 3.45Å; V454-K458 PolarHBondContact O-N 3.2Å; A456-K458 PolarHBondContact O-N 2.78Å; K458-Q462 WeakPolarHBondContact O-CG 3.37Å
459	T	96.1	Very high	97.1	Very high	23 Å²	23	27.2 Å²	27.2	14%	0.141	13%	0.128	C	C	.	.	H	α-helix	trans	-69.8	-39.8	-175.5	-56.8	0	0	0	0	112	F455 A456 V457 Q462 R463 I674	F455-T459 WeakPolarHBondContact O-CB 3.39Å; F455-T459 PolarHBondContact O-N 3.42Å; F455-T459 PolarHBondContact O-OG1 3.05Å; A456-T459 PolarHBondContact O-N 2.85Å; V457-T459 PolarHBondContact O-N 2.62Å; T459-Q462 PolarHBondContact O-N 2.95Å; T459-Q462 VanDerWaalsContact O-N 3.14Å; T459-R463 PolarHBondContact O-N 2.97Å; T459-I674 HydrophobicContact CG2-CD1 3.72Å
460	V	96.9	Very high	97.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.8	-45.3	177.1	167.8	0	0	0	0	111.7	A456 V457 Q462 R463 I468 I483 Q634 V636 I674	A456-V460 WeakPolarHBondContact O-CB 3.39Å; A456-V460 VanDerWaalsContact O-CG2 3.26Å; A456-V460 WeakPolarHBondContact O-CG2 3.33Å; A456-V460 PolarHBondContact O-N 2.65Å; V457-V460 PolarHBondContact O-N 3.12Å; V460-Q462 PolarHBondContact O-N 3.39Å; V460-R463 PolarHBondContact O-N 3.36Å; V460-R463 VanDerWaalsContact O-N 3.07Å; V460-I468 HydrophobicContact CG2-CD1 3.95Å; V460-I468 HydrophobicContact CG2-CG1 4.26Å; V460-I483 HydrophobicContact CB-CD1 4.43Å; V460-I483 HydrophobicContact CG1-CD1 4.39Å; V460-I483 HydrophobicContact CG1-CG2 3.81Å; V460-I483 HydrophobicContact CG2-CD1 4.18Å; V460-Q634 PolarHBondContact O-NE2 3.07Å; V460-V636 HydrophobicContact CG1-CB 4.4Å; V460-V636 HydrophobicContact CG1-CG1 3.98Å; V460-V636 HydrophobicContact CG1-CG2 3.48Å; V460-V636 VanDerWaalsContact CG1-CG2 3.48Å; V460-V636 HydrophobicContact CG2-CG1 4.21Å; V460-I674 HydrophobicContact CG2-CD1 4.31Å
461	L	96.5	Very high	97	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.7	-17.5	177.3	-66.4	174.9	0	0	0	113.4	C435 L437 P438 Y441 V457 H486 L487 I490	C435-L461 PolarHBondContact SG-O 3.15Å; L437-L461 HydrophobicContact CD2-CB 4.25Å; P438-L461 HydrophobicContact CG-CD1 4.31Å; Y441-L461 HydrophobicContact CE1-CD1 4.47Å; V457-L461 HydrophobicContact CG1-CD1 3.88Å; V457-L461 HydrophobicContact CG1-CG 4.36Å; V457-L461 VanDerWaalsContact O-CG 3.25Å; V457-L461 WeakPolarHBondContact O-CG 3.34Å; V457-L461 PolarHBondContact O-N 2.89Å; V457-L461 VanDerWaalsContact O-N 3.11Å; L461-H486 HydrophobicContact CD1-CB 3.72Å; L461-H486 HydrophobicContact CD2-CB 3.87Å; L461-H486 HydrophobicContact CG-CB 4.38Å; L461-L487 HydrophobicContact CD2-CD2 3.66Å; L461-L487 HydrophobicContact CD2-CG 3.98Å; L461-I490 HydrophobicContact CD1-CD1 3.78Å; L461-I490 HydrophobicContact CD2-CD1 3.93Å; L461-I490 HydrophobicContact CG-CD1 4.29Å
462	Q	95.5	Very high	96.9	Very high	54 Å²	54	21.1 Å²	21.1	25%	0.252	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	6.3	179.4	-61.3	-169.5	-97.1	0	0	113.8	V432 L433 L437 K458 T459 V460	V432-Q462 CarbonylContact C-O 3.6Å; V432-Q462 WeakPolarHBondContact CA-O 3.41Å; V432-Q462 HydrophobicContact CG1-CB 4.35Å; L433-Q462 PolarHBondContact N-O 3.3Å; L437-Q462 HydrophobicContact CD2-CG 3.92Å; K458-Q462 WeakPolarHBondContact O-CG 3.37Å; T459-Q462 PolarHBondContact O-N 2.95Å; T459-Q462 VanDerWaalsContact O-N 3.14Å; V460-Q462 PolarHBondContact O-N 3.39Å
463	R	95.4	Very high	96.8	Very high	69 Å²	69	22 Å²	22	26%	0.26	11%	0.109	S	C	.	.			trans	-131.8	145.3	-176.5	-75.3	-175.2	177.3	-123.6	-10.3	113.2	D430 L433 T459 V460 S466 Q634	D430-R463 IonicContact OD1-CZ 3.68Å; D430-R463 IonicContact OD1-NH1 3.71Å; D430-R463 PolarHBondContact OD1-NH1 3.35Å; D430-R463 IonicContact OD1-NH2 3.88Å; D430-R463 IonicContact OD2-CZ 2.72Å; D430-R463 VanDerWaalsContact OD2-CZ 3.23Å; D430-R463 IonicContact OD2-NH1 3.35Å; D430-R463 PolarHBondContact OD2-NH1 2.91Å; D430-R463 IonicContact OD2-NH2 2.71Å; D430-R463 PolarHBondContact OD2-NH2 3.1Å; L433-R463 WeakPolarHBondContact CD1-O 3.31Å; T459-R463 PolarHBondContact O-N 2.97Å; V460-R463 PolarHBondContact O-N 3.36Å; V460-R463 VanDerWaalsContact O-N 3.07Å; R463-S466 WeakPolarHBondContact CB-OG 3.33Å; R463-Q634 WeakPolarHBondContact O-CG 3.41Å; R463-Q634 PolarHBondContact O-NE2 3.28Å
464	P	95.7	Very high	96.7	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.019	11%	0.108	C	C	.	.	S	Bend	trans	-77	-28.1	176.8	33.4	-38.4	0	0	0	113.2	Y418 M431 L433 Q634 V635	Y418-P464 HydrophobicContact CD1-CB 4.12Å; Y418-P464 HydrophobicContact CD1-CG 3.42Å; Y418-P464 VanDerWaalsContact CD1-CG 3.42Å; Y418-P464 HydrophobicContact CE1-CG 3.57Å; Y418-P464 HydrophobicContact CG-CG 4.05Å; M431-P464 HydrophobicContact CB-CG 4.21Å; M431-P464 HydrophobicContact CE-CB 3.8Å; M431-P464 HydrophobicContact CE-CG 3.63Å; M431-P464 WeakPolarHBondContact O-CD 3.32Å; L433-P464 HydrophobicContact CD2-CB 4.31Å; P464-Q634 CarbonylContact O-C 3.57Å; P464-Q634 VanDerWaalsContact O-CA 3.26Å; P464-Q634 WeakPolarHBondContact O-CA 3.07Å; P464-V635 PolarHBondContact O-N 3.48Å
465	L	96.9	Very high	96.5	Very high	10 Å²	10	20.8 Å²	20.8	5%	0.052	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.7	174.4	178.2	62.1	0	0	0	107.1	Y418 R422 V635 F666 I671	Y418-L465 HydrophobicContact CE1-CB 4.35Å; R422-L465 HydrophobicContact CB-CD2 3.92Å; R422-L465 HydrophobicContact CG-CD2 4.15Å; L465-V635 CarbonylContact C-O 3.57Å; L465-V635 WeakPolarHBondContact CA-O 3.38Å; L465-V635 HydrophobicContact CD1-CB 3.93Å; L465-V635 HydrophobicContact CD1-CG1 3.91Å; L465-F666 HydrophobicContact CD1-CE2 4.1Å; L465-F666 HydrophobicContact CD2-CD2 4.43Å; L465-F666 HydrophobicContact CD2-CE1 4.49Å; L465-F666 HydrophobicContact CD2-CE2 3.93Å; L465-F666 HydrophobicContact CD2-CZ 3.96Å; L465-I671 HydrophobicContact CD2-CD1 4.11Å
466	S	97.7	Very high	96.4	Very high	6 Å²	6	16 Å²	16	4%	0.042	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	142.5	176.7	-73.5	0	0	0	0	111.7	R463 V635 L637	R463-S466 WeakPolarHBondContact CB-OG 3.33Å; S466-V635 PolarHBondContact N-O 3.01Å; S466-L637 PolarHBondContact O-N 3.28Å
467	L	98.2	Very high	96.3	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.021	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.6	171.9	-44.8	-176.3	0	0	0	109	L637 F663 F666 V667 I671 P673 I674	L467-L637 CarbonylContact C-O 3.52Å; L467-L637 WeakPolarHBondContact CA-O 3.45Å; L467-L637 HydrophobicContact CD2-CB 3.87Å; L467-L637 HydrophobicContact CD2-CD1 3.85Å; L467-L637 HydrophobicContact CD2-CG 4.12Å; L467-F663 HydrophobicContact CB-CD2 4.32Å; L467-F663 HydrophobicContact CB-CE2 3.79Å; L467-F663 HydrophobicContact CB-CZ 4.09Å; L467-F663 HydrophobicContact CD2-CD2 4.29Å; L467-F666 HydrophobicContact CD1-CB 3.76Å; L467-F666 HydrophobicContact CD2-CB 4.27Å; L467-F666 HydrophobicContact CD2-CD2 3.89Å; L467-V667 HydrophobicContact CD1-CG2 3.89Å; L467-I671 HydrophobicContact CD1-CB 4.22Å; L467-I671 HydrophobicContact CD1-CG2 4.08Å; L467-I671 WeakPolarHBondContact CD1-O 3.34Å; L467-I671 HydrophobicContact CG-CG2 4.11Å; L467-P673 HydrophobicContact CB-CB 3.82Å; L467-P673 HydrophobicContact CD1-CB 4.48Å; L467-I674 PolarHBondContact O-N 3.38Å
468	I	98.5	Very high	96.2	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.7	167.3	-65.1	174.9	0	0	0	108.3	A456 V460 I483 V636 L637 V638 G639 F663 I674 L676	A456-I468 HydrophobicContact CB-CD1 4.09Å; A456-I468 HydrophobicContact CB-CG1 4.43Å; V460-I468 HydrophobicContact CG2-CD1 3.95Å; V460-I468 HydrophobicContact CG2-CG1 4.26Å; I468-I483 HydrophobicContact CD1-CD1 3.34Å; I468-V636 HydrophobicContact CD1-CG1 4.48Å; I468-L637 PolarHBondContact N-O 2.84Å; I468-V638 HydrophobicContact CB-CB 4.47Å; I468-V638 HydrophobicContact CB-CG1 4.12Å; I468-V638 HydrophobicContact CB-CG2 4.21Å; I468-V638 HydrophobicContact CD1-CG2 4.29Å; I468-V638 HydrophobicContact CG2-CG1 4.14Å; I468-V638 WeakPolarHBondContact O-CA 3.49Å; I468-G639 PolarHBondContact O-N 3.32Å; I468-G639 VanDerWaalsContact O-N 3.07Å; I468-F663 WeakPolarHBondContact O-CE2 3.27Å; I468-I674 CarbonylContact C-O 3.59Å; I468-I674 WeakPolarHBondContact CA-O 3.47Å; I468-I674 HydrophobicContact CG1-CB 4.47Å; I468-L676 HydrophobicContact CG2-CD1 4.22Å; I468-L676 HydrophobicContact CG2-CD2 4.23Å; I468-L676 HydrophobicContact CG2-CG 3.95Å
469	Q	97.6	Very high	96.3	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	119.6	164.4	-172.6	-173.2	10.8	0	0	108.1	P471 G639 D640 H641 C642 F663 P673 I674 R675 L676	Q469-P471 HydrophobicContact CG-CG 4.46Å; Q469-P471 WeakPolarHBondContact O-CD 3.3Å; Q469-G639 CarbonylContact C-O 3.54Å; Q469-G639 WeakPolarHBondContact CA-O 3.43Å; Q469-D640 WeakPolarHBondContact CG-OD1 3.43Å; Q469-D640 PolarHBondContact NE2-OD1 2.89Å; Q469-H641 PolarHBondContact NE2-CE1 2.89Å; Q469-H641 VanDerWaalsContact NE2-CE1 3.33Å; Q469-H641 PolarHBondContact NE2-ND1 3.01Å; Q469-C642 PolarHBondContact NE2-SG 2.84Å; Q469-F663 HydrophobicContact CB-CZ 4.4Å; Q469-P673 HydrophobicContact CB-CB 4.12Å; Q469-P673 HydrophobicContact CB-CG 4.36Å; Q469-I674 PolarHBondContact N-O 2.83Å; Q469-R675 HydrophobicContact CB-CB 4.36Å; Q469-R675 HydrophobicContact CB-CG 4.38Å; Q469-R675 HydrophobicContact CG-CG 4.47Å; Q469-R675 CarbonylContact O-C 3.58Å; Q469-R675 WeakPolarHBondContact O-CA 3.32Å; Q469-L676 PolarHBondContact O-N 2.9Å
470	G	96.1	Very high	96.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.08	C	C	.	.			trans	-119	89.3	177.9	0	0	0	0	0	112.8	K476 G639	G470-K476 VanDerWaalsContact O-CD 3.29Å; G470-K476 WeakPolarHBondContact O-CD 3.46Å; G470-K476 WeakPolarHBondContact O-CE 3.41Å; G470-G639 PolarHBondContact N-O 3.49Å
471	P	95.8	Very high	96.4	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.006	8%	0.08	C	C	.	.			trans	-57.7	163	176.6	-28.3	39	0	0	0	113.8	Q469 G473 T474 R675 Y695 L699	Q469-P471 HydrophobicContact CG-CG 4.46Å; Q469-P471 WeakPolarHBondContact O-CD 3.3Å; P471-G473 PolarHBondContact O-N 3.11Å; P471-T474 HydrophobicContact CB-CG2 3.9Å; P471-T474 HydrophobicContact CG-CG2 4.4Å; P471-T474 WeakPolarHBondContact O-CB 3.41Å; P471-T474 VanDerWaalsContact O-CG2 3.31Å; P471-T474 WeakPolarHBondContact O-CG2 3.47Å; P471-T474 PolarHBondContact O-N 2.93Å; P471-T474 VanDerWaalsContact O-N 3.11Å; P471-T474 PolarHBondContact O-OG1 2.88Å; P471-R675 HydrophobicContact CG-CG 4.05Å; P471-Y695 HydrophobicContact CB-CD1 3.93Å; P471-Y695 HydrophobicContact CB-CE1 3.56Å; P471-Y695 HydrophobicContact CB-CE2 4.26Å; P471-Y695 HydrophobicContact CB-CG 4.42Å; P471-Y695 HydrophobicContact CG-CD1 3.59Å; P471-Y695 HydrophobicContact CG-CE1 3.51Å; P471-Y695 HydrophobicContact CG-CG 4.37Å; P471-L699 HydrophobicContact CB-CD1 4.12Å; P471-L699 HydrophobicContact CB-CD2 3.78Å; P471-L699 HydrophobicContact CG-CD2 3.87Å
472	P	94.8	Very high	96.5	Very high	7 Å²	7	13.8 Å²	13.8	5%	0.045	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	130.5	-178.5	-31.6	38.1	0	0	0	113.9	T474 M682 Y695 T841	P472-T474 VanDerWaalsContact C-N 3.27Å; P472-T474 PolarHBondContact O-N 3.43Å; P472-M682 HydrophobicContact CB-CE 4.32Å; P472-Y695 WeakPolarHBondContact CD-OH 3.26Å; P472-T841 HydrophobicContact CB-CG2 4.14Å; P472-T841 HydrophobicContact CG-CG2 3.92Å; P472-T841 WeakPolarHBondContact CG-OG1 3.33Å
473	G	94.6	Very high	96.6	Very high	23 Å²	23	11.2 Å²	11.2	24%	0.237	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	3.3	179.1	0	0	0	0	0	116.2	P471 G475 Y680	P471-G473 PolarHBondContact O-N 3.11Å; G473-G475 VanDerWaalsContact C-N 3.29Å; G473-G475 PolarHBondContact O-N 2.68Å; G473-Y680 PolarHBondContact O-N 2.91Å
474	T	96.4	Very high	96.8	Very high	1 Å²	1	8 Å²	8	1%	0.006	6%	0.056	C	C	.	.	S	Bend	trans	-82.1	4.5	-176.2	61.9	0	0	0	0	115.9	Q453 P471 P472 L676 V678 Q679 L699	Q453-T474 PolarHBondContact NE2-O 2.8Å; P471-T474 HydrophobicContact CB-CG2 3.9Å; P471-T474 HydrophobicContact CG-CG2 4.4Å; P471-T474 WeakPolarHBondContact O-CB 3.41Å; P471-T474 VanDerWaalsContact O-CG2 3.31Å; P471-T474 WeakPolarHBondContact O-CG2 3.47Å; P471-T474 PolarHBondContact O-N 2.93Å; P471-T474 VanDerWaalsContact O-N 3.11Å; P471-T474 PolarHBondContact O-OG1 2.88Å; P472-T474 VanDerWaalsContact C-N 3.27Å; P472-T474 PolarHBondContact O-N 3.43Å; T474-L676 HydrophobicContact CG2-CB 4.35Å; T474-V678 VanDerWaalsContact CA-O 3.31Å; T474-V678 WeakPolarHBondContact CA-O 3.18Å; T474-Q679 HydrophobicContact CG2-CB 4.19Å; T474-L699 HydrophobicContact CG2-CD2 4.22Å
475	G	94.7	Very high	96.9	Very high	24 Å²	24	10 Å²	10	25%	0.247	6%	0.063	C	C	.	.			trans	78.4	35	176	0	0	0	0	0	115.1	G473 T477 V478 T479	G473-G475 VanDerWaalsContact C-N 3.29Å; G473-G475 PolarHBondContact O-N 2.68Å; G475-T477 PolarHBondContact O-N 2.95Å; G475-V478 PolarHBondContact O-N 3.07Å; G475-T479 PolarHBondContact O-N 3.14Å; G475-T479 PolarHBondContact O-OG1 3.03Å
476	K	95.4	Very high	97	Very high	22 Å²	22	10 Å²	10	10%	0.096	6%	0.063	C	C	.	.	H	α-helix	trans	-40.3	-66.3	173.4	-83.5	-166.7	-66.7	-163.5	0	112.3	G470 V478 T479 S480 E615 V638	G470-K476 VanDerWaalsContact O-CD 3.29Å; G470-K476 WeakPolarHBondContact O-CD 3.46Å; G470-K476 WeakPolarHBondContact O-CE 3.41Å; K476-V478 PolarHBondContact O-N 3.11Å; K476-V478 VanDerWaalsContact O-N 3.12Å; K476-T479 CarbonylContact O-C 3.6Å; K476-T479 WeakPolarHBondContact O-CA 3.49Å; K476-T479 VanDerWaalsContact O-CB 3.3Å; K476-T479 WeakPolarHBondContact O-CB 3.46Å; K476-T479 PolarHBondContact O-N 3.01Å; K476-S480 PolarHBondContact O-N 2.76Å; K476-S480 PolarHBondContact O-OG 3.15Å; K476-S480 VanDerWaalsContact O-OG 3.12Å; K476-E615 WeakPolarHBondContact CE-OE1 3.33Å; K476-E615 IonicContact NZ-OE1 3.93Å; K476-E615 PolarHBondContact NZ-OE1 2.99Å; K476-E615 IonicContact NZ-OE2 2.61Å; K476-E615 PolarHBondContact NZ-OE2 3.29Å; K476-V638 HydrophobicContact CD-CG1 4.03Å; K476-V638 HydrophobicContact CG-CG1 4.15Å
477	T	94.4	Very high	96.9	Very high	35 Å²	35	9.7 Å²	9.7	22%	0.215	6%	0.061	C	C	.	.	H	α-helix	trans	-57	-33.8	-173.6	-31.1	0	0	0	0	113.5	G475 A481 L508 K511	G475-T477 PolarHBondContact O-N 2.95Å; T477-A481 VanDerWaalsContact O-CB 3.25Å; T477-A481 WeakPolarHBondContact O-CB 3.32Å; T477-A481 PolarHBondContact O-N 2.81Å; T477-L508 HydrophobicContact CG2-CB 3.95Å; T477-L508 HydrophobicContact CG2-CD1 3.76Å; T477-L508 HydrophobicContact CG2-CG 4.42Å; T477-K511 HydrophobicContact CG2-CB 4.43Å; T477-K511 HydrophobicContact CG2-CG 3.9Å
478	V	96.8	Very high	96.8	Very high	28 Å²	28	10 Å²	10	17%	0.17	6%	0.063	C	C	.	.	H	α-helix	trans	-73	-37.4	176	-179.4	0	0	0	0	111.2	L446 L449 G475 K476 S482	L446-V478 HydrophobicContact CB-CG1 4.36Å; L446-V478 HydrophobicContact CD1-CG1 4.48Å; L449-V478 HydrophobicContact CD2-CG1 4.05Å; G475-V478 PolarHBondContact O-N 3.07Å; K476-V478 PolarHBondContact O-N 3.11Å; K476-V478 VanDerWaalsContact O-N 3.12Å; V478-S482 WeakPolarHBondContact O-CB 3.33Å; V478-S482 PolarHBondContact O-N 3.37Å; V478-S482 PolarHBondContact O-OG 3.41Å
479	T	97.9	Very high	96.7	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.006	8%	0.08	C	C	.	.	H	α-helix	trans	-69	-47.5	174.3	-46.4	0	0	0	0	110.4	Q453 A456 V457 G475 K476 A481 S482 I483 L676	Q453-T479 HydrophobicContact CB-CG2 4.3Å; Q453-T479 WeakPolarHBondContact CG-OG1 3.48Å; A456-T479 HydrophobicContact CB-CG2 4.38Å; V457-T479 HydrophobicContact CG2-CG2 4.29Å; G475-T479 PolarHBondContact O-N 3.14Å; G475-T479 PolarHBondContact O-OG1 3.03Å; K476-T479 CarbonylContact O-C 3.6Å; K476-T479 WeakPolarHBondContact O-CA 3.49Å; K476-T479 VanDerWaalsContact O-CB 3.3Å; K476-T479 WeakPolarHBondContact O-CB 3.46Å; K476-T479 PolarHBondContact O-N 3.01Å; T479-A481 PolarHBondContact O-N 3.22Å; T479-S482 PolarHBondContact O-N 3.29Å; T479-I483 HydrophobicContact CG2-CD1 4.19Å; T479-I483 WeakPolarHBondContact O-CG1 3.46Å; T479-I483 PolarHBondContact O-N 3.22Å; T479-L676 HydrophobicContact CG2-CD2 4.38Å
480	S	98.2	Very high	96.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-55.8	-49.4	174.3	-55	0	0	0	0	111.5	K476 S482 I483 V484 D614	K476-S480 PolarHBondContact O-N 2.76Å; K476-S480 PolarHBondContact O-OG 3.15Å; K476-S480 VanDerWaalsContact O-OG 3.12Å; S480-S482 VanDerWaalsContact C-N 3.34Å; S480-S482 PolarHBondContact O-N 2.76Å; S480-I483 WeakPolarHBondContact O-CB 3.46Å; S480-I483 PolarHBondContact O-N 3.25Å; S480-V484 VanDerWaalsContact O-CG2 3.31Å; S480-V484 WeakPolarHBondContact O-CG2 3.41Å; S480-V484 PolarHBondContact O-N 2.81Å; S480-D614 VanDerWaalsContact CB-OD2 3.27Å; S480-D614 WeakPolarHBondContact CB-OD2 3.46Å; S480-D614 PolarHBondContact OG-OD2 2.97Å
481	A	98.2	Very high	96.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.7	-38.6	176.6	0	0	0	0	0	112.8	L446 T477 T479 V484 Y485 L508 K511 I512	L446-A481 HydrophobicContact CD1-CB 3.74Å; T477-A481 VanDerWaalsContact O-CB 3.25Å; T477-A481 WeakPolarHBondContact O-CB 3.32Å; T477-A481 PolarHBondContact O-N 2.81Å; T479-A481 PolarHBondContact O-N 3.22Å; A481-V484 PolarHBondContact O-N 3.11Å; A481-Y485 WeakPolarHBondContact O-CB 3.32Å; A481-Y485 PolarHBondContact O-N 2.88Å; A481-L508 HydrophobicContact CB-CD1 4.23Å; A481-K511 HydrophobicContact CB-CB 3.76Å; A481-I512 HydrophobicContact CB-CG1 3.79Å
482	S	98.1	Very high	96.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-36.6	174.8	-59.8	0	0	0	0	112.6	V478 T479 S480 Y485 H486	V478-S482 WeakPolarHBondContact O-CB 3.33Å; V478-S482 PolarHBondContact O-N 3.37Å; V478-S482 PolarHBondContact O-OG 3.41Å; T479-S482 PolarHBondContact O-N 3.29Å; S480-S482 VanDerWaalsContact C-N 3.34Å; S480-S482 PolarHBondContact O-N 2.76Å; S482-Y485 PolarHBondContact O-N 2.77Å; S482-H486 PolarHBondContact O-CD2 3.42Å; S482-H486 PolarHBondContact O-N 3.02Å; S482-H486 VanDerWaalsContact O-N 3.13Å
483	I	98.3	Very high	96.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-50.7	172.9	-72.5	167	0	0	0	110	V457 V460 I468 T479 S480 Y485 H486 L487 L612 V636	V457-I483 HydrophobicContact CB-CG1 4.38Å; V457-I483 HydrophobicContact CG1-CG1 4.43Å; V457-I483 HydrophobicContact CG2-CG1 3.94Å; V460-I483 HydrophobicContact CB-CD1 4.43Å; V460-I483 HydrophobicContact CG1-CD1 4.39Å; V460-I483 HydrophobicContact CG1-CG2 3.81Å; V460-I483 HydrophobicContact CG2-CD1 4.18Å; I468-I483 HydrophobicContact CD1-CD1 3.34Å; T479-I483 HydrophobicContact CG2-CD1 4.19Å; T479-I483 WeakPolarHBondContact O-CG1 3.46Å; T479-I483 PolarHBondContact O-N 3.22Å; S480-I483 WeakPolarHBondContact O-CB 3.46Å; S480-I483 PolarHBondContact O-N 3.25Å; I483-Y485 VanDerWaalsContact C-N 3.26Å; I483-Y485 PolarHBondContact O-N 3.37Å; I483-H486 PolarHBondContact O-N 3Å; I483-L487 HydrophobicContact CG2-CD1 3.54Å; I483-L487 HydrophobicContact CG2-CG 4.05Å; I483-L487 WeakPolarHBondContact O-CB 2.99Å; I483-L487 VanDerWaalsContact O-CG 3.23Å; I483-L487 WeakPolarHBondContact O-CG 3.21Å; I483-L487 PolarHBondContact O-N 2.84Å; I483-L612 HydrophobicContact CB-CD1 4.33Å; I483-L612 HydrophobicContact CG2-CD1 3.98Å; I483-V636 HydrophobicContact CG2-CG2 4.41Å
484	V	98.3	Very high	96.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.9	-42.5	177.6	171.7	0	0	0	0	111.3	S480 A481 L487 N488 V495 V497 I512 V590 L612	S480-V484 VanDerWaalsContact O-CG2 3.31Å; S480-V484 WeakPolarHBondContact O-CG2 3.41Å; S480-V484 PolarHBondContact O-N 2.81Å; A481-V484 PolarHBondContact O-N 3.11Å; V484-L487 PolarHBondContact O-N 3.14Å; V484-N488 PolarHBondContact O-N 2.97Å; V484-V495 HydrophobicContact CG1-CB 4.31Å; V484-V495 HydrophobicContact CG1-CG1 4.21Å; V484-V495 HydrophobicContact CG2-CG1 4.24Å; V484-V497 HydrophobicContact CB-CG2 4.45Å; V484-V497 HydrophobicContact CG1-CG2 4.06Å; V484-V497 HydrophobicContact CG2-CG2 3.48Å; V484-V497 VanDerWaalsContact CG2-CG2 3.48Å; V484-I512 HydrophobicContact CB-CD1 4.33Å; V484-I512 HydrophobicContact CB-CG1 4.36Å; V484-I512 HydrophobicContact CG1-CD1 4.09Å; V484-I512 HydrophobicContact CG1-CG1 4.26Å; V484-I512 HydrophobicContact CG1-CG2 3.94Å; V484-I512 HydrophobicContact CG2-CD1 4.16Å; V484-V590 HydrophobicContact CG1-CB 4.4Å; V484-V590 HydrophobicContact CG1-CG1 3.89Å; V484-V590 HydrophobicContact CG1-CG2 3.55Å; V484-L612 HydrophobicContact CG2-CB 4.48Å; V484-L612 HydrophobicContact CG2-CD1 4.24Å
485	Y	98.2	Very high	96.3	Very high	45 Å²	45	30.7 Å²	30.7	18%	0.176	15%	0.151	C	C	.	.	H	α-helix	trans	-57.4	-54.4	175.2	178.2	-91.7	0	0	0	112.7	A443 P444 A481 S482 I483 L487 N488 Q489 T515 L517	A443-Y485 HydrophobicContact CB-CD1 4.02Å; A443-Y485 HydrophobicContact CB-CG 3.93Å; P444-Y485 VanDerWaalsContact CD-CZ 3.43Å; P444-Y485 HydrophobicContact CG-CD2 4.31Å; P444-Y485 HydrophobicContact CG-CE2 3.68Å; A481-Y485 WeakPolarHBondContact O-CB 3.32Å; A481-Y485 PolarHBondContact O-N 2.88Å; S482-Y485 PolarHBondContact O-N 2.77Å; I483-Y485 VanDerWaalsContact C-N 3.26Å; I483-Y485 PolarHBondContact O-N 3.37Å; Y485-L487 PolarHBondContact O-N 3.42Å; Y485-N488 PolarHBondContact O-N 3.23Å; Y485-Q489 HydrophobicContact CD1-CG 4.38Å; Y485-Q489 HydrophobicContact CE1-CG 3.99Å; Y485-Q489 HydrophobicContact CE2-CG 4.17Å; Y485-Q489 WeakPolarHBondContact O-CB 3.42Å; Y485-Q489 VanDerWaalsContact O-CG 3.25Å; Y485-Q489 WeakPolarHBondContact O-CG 3.3Å; Y485-Q489 PolarHBondContact O-N 3.07Å; Y485-Q489 PolarHBondContact OH-NE2 2.81Å; Y485-T515 HydrophobicContact CD2-CG2 4.48Å; Y485-L517 HydrophobicContact CD2-CD1 4.35Å; Y485-L517 HydrophobicContact CD2-CD2 4.48Å; Y485-L517 HydrophobicContact CD2-CG 4.27Å
486	H	97.9	Very high	96.5	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.046	14%	0.139	C	C	.	.	H	α-helix	trans	-70.1	-31.1	-179.3	-67.9	-64.6	0	0	0	113.1	R440 Y441 L461 S482 I483 Q489 I490	R440-H486 PolarHBondContact O-CE1 3.01Å; R440-H486 VanDerWaalsContact O-CE1 3.23Å; Y441-H486 VanDerWaalsContact C-NE2 3.33Å; Y441-H486 PolarHBondContact O-CD2 3.16Å; Y441-H486 PolarHBondContact O-NE2 2.89Å; L461-H486 HydrophobicContact CD1-CB 3.72Å; L461-H486 HydrophobicContact CD2-CB 3.87Å; L461-H486 HydrophobicContact CG-CB 4.38Å; S482-H486 PolarHBondContact O-CD2 3.42Å; S482-H486 PolarHBondContact O-N 3.02Å; S482-H486 VanDerWaalsContact O-N 3.13Å; I483-H486 PolarHBondContact O-N 3Å; H486-Q489 PolarHBondContact O-N 3.19Å; H486-I490 HydrophobicContact CB-CD1 4.25Å; H486-I490 VanDerWaalsContact O-CB 3.24Å; H486-I490 WeakPolarHBondContact O-CB 3.18Å; H486-I490 WeakPolarHBondContact O-CD1 3.15Å; H486-I490 VanDerWaalsContact O-CG1 3.24Å; H486-I490 WeakPolarHBondContact O-CG1 3.24Å; H486-I490 PolarHBondContact O-N 3.27Å
487	L	96.8	Very high	96.7	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-62.8	-48.3	174.4	-74.5	175.8	0	0	0	111.7	L461 I483 V484 Y485 H491 V495 V636	L461-L487 HydrophobicContact CD2-CD2 3.66Å; L461-L487 HydrophobicContact CD2-CG 3.98Å; I483-L487 HydrophobicContact CG2-CD1 3.54Å; I483-L487 HydrophobicContact CG2-CG 4.05Å; I483-L487 WeakPolarHBondContact O-CB 2.99Å; I483-L487 VanDerWaalsContact O-CG 3.23Å; I483-L487 WeakPolarHBondContact O-CG 3.21Å; I483-L487 PolarHBondContact O-N 2.84Å; V484-L487 PolarHBondContact O-N 3.14Å; Y485-L487 PolarHBondContact O-N 3.42Å; L487-H491 WeakPolarHBondContact O-CB 3.38Å; L487-H491 PolarHBondContact O-CD2 3.08Å; L487-H491 VanDerWaalsContact O-CD2 3.23Å; L487-H491 PolarHBondContact O-N 2.96Å; L487-H491 VanDerWaalsContact O-N 3.12Å; L487-V495 HydrophobicContact CB-CG2 3.89Å; L487-V636 HydrophobicContact CD1-CG2 4.42Å
488	N	96.4	Very high	96.9	Very high	9 Å²	9	27 Å²	27	5%	0.048	13%	0.125	C	C	.	.	H	α-helix	trans	-59.7	-48.3	174	172.7	-94.5	0	0	0	110.8	V484 Y485 I490 Q492 K493 V495 L517	V484-N488 PolarHBondContact O-N 2.97Å; Y485-N488 PolarHBondContact O-N 3.23Å; N488-I490 PolarHBondContact O-N 3.29Å; N488-Q492 WeakPolarHBondContact O-CA 3.29Å; N488-Q492 PolarHBondContact O-N 3.39Å; N488-K493 PolarHBondContact ND2-O 2.71Å; N488-V495 HydrophobicContact CB-CG2 4.17Å; N488-L517 HydrophobicContact CB-CD1 4.26Å; N488-L517 WeakPolarHBondContact OD1-CD2 3.46Å
489	Q	95.3	Very high	96.9	Very high	78 Å²	78	25.6 Å²	25.6	36%	0.364	12%	0.117	S	C	.	.	H	α-helix	trans	-68	-34.9	-175.7	-68.5	-73.2	15.8	0	0	114.3	Y485 H486 Q492	Y485-Q489 HydrophobicContact CD1-CG 4.38Å; Y485-Q489 HydrophobicContact CE1-CG 3.99Å; Y485-Q489 HydrophobicContact CE2-CG 4.17Å; Y485-Q489 WeakPolarHBondContact O-CB 3.42Å; Y485-Q489 VanDerWaalsContact O-CG 3.25Å; Y485-Q489 WeakPolarHBondContact O-CG 3.3Å; Y485-Q489 PolarHBondContact O-N 3.07Å; Y485-Q489 PolarHBondContact OH-NE2 2.81Å; H486-Q489 PolarHBondContact O-N 3.19Å; Q489-Q492 PolarHBondContact O-NE2 2.65Å
490	I	94	Very high	96.8	Very high	48 Å²	48	25.6 Å²	25.6	25%	0.246	12%	0.117	C	C	.	.	H	α-helix	trans	-79.2	-39.4	-179.7	-71.9	166.3	0	0	0	111.6	C435 L461 H486 N488	C435-I490 HydrophobicContact CB-CG2 4.04Å; L461-I490 HydrophobicContact CD1-CD1 3.78Å; L461-I490 HydrophobicContact CD2-CD1 3.93Å; L461-I490 HydrophobicContact CG-CD1 4.29Å; H486-I490 HydrophobicContact CB-CD1 4.25Å; H486-I490 VanDerWaalsContact O-CB 3.24Å; H486-I490 WeakPolarHBondContact O-CB 3.18Å; H486-I490 WeakPolarHBondContact O-CD1 3.15Å; H486-I490 VanDerWaalsContact O-CG1 3.24Å; H486-I490 WeakPolarHBondContact O-CG1 3.24Å; H486-I490 PolarHBondContact O-N 3.27Å; N488-I490 PolarHBondContact O-N 3.29Å
491	H	92.5	Very high	96.4	Very high	43 Å²	43	25.9 Å²	25.9	20%	0.199	12%	0.119	C	C	.	.	H	α-helix	trans	-96	-12.2	-175	-60.3	-69.9	0	0	0	113.8	L487 K493 H609	L487-H491 WeakPolarHBondContact O-CB 3.38Å; L487-H491 PolarHBondContact O-CD2 3.08Å; L487-H491 VanDerWaalsContact O-CD2 3.23Å; L487-H491 PolarHBondContact O-N 2.96Å; L487-H491 VanDerWaalsContact O-N 3.12Å; H491-K493 HydrophobicContact CB-CB 4.33Å; H491-K493 WeakPolarHBondContact O-CG 3.27Å; H491-K493 PolarHBondContact O-N 2.74Å; H491-H609 AromaticContact CD2-CD2 3.75Å; H491-H609 AromaticContact CE1-CD2 3.99Å; H491-H609 AromaticContact CE1-NE2 3.67Å; H491-H609 AromaticContact CG-CD2 3.32Å; H491-H609 AromaticContact CG-NE2 3.69Å; H491-H609 AromaticContact ND1-CD2 3.51Å; H491-H609 AromaticContact ND1-NE2 3.32Å; H491-H609 PolarHBondContact ND1-NE2 3.14Å
492	Q	93.2	Very high	96	Very high	138 Å²	138	26.4 Å²	26.4	65%	0.645	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	45.3	-175.6	-65.8	-67.1	-41.8	0	0	111.7	N488 Q489	N488-Q492 WeakPolarHBondContact O-CA 3.29Å; N488-Q492 PolarHBondContact O-N 3.39Å; Q489-Q492 PolarHBondContact O-NE2 2.65Å
493	K	94.8	Very high	95.6	Very high	117 Å²	117	28.1 Å²	28.1	51%	0.509	13%	0.132	S	C	.	.	S	Bend	trans	-143.7	160.2	-171	-80.1	172.4	-170.9	177.2	0	111.3	N488 H491 H609	N488-K493 PolarHBondContact ND2-O 2.71Å; H491-K493 HydrophobicContact CB-CB 4.33Å; H491-K493 WeakPolarHBondContact O-CG 3.27Å; H491-K493 PolarHBondContact O-N 2.74Å; K493-H609 HydrophobicContact CB-CB 3.8Å; K493-H609 HydrophobicContact CD-CB 3.84Å; K493-H609 HydrophobicContact CG-CB 4.43Å
494	K	95.5	Very high	95.3	Very high	44 Å²	44	28.8 Å²	28.8	19%	0.191	14%	0.138	C	C	.	.			trans	-63.9	135.3	176.3	-75.1	168.5	170.5	45	0	111.7	L585 M586 A588 D589 F608 H609	K494-L585 WeakPolarHBondContact CE-O 3.04Å; K494-M586 WeakPolarHBondContact CE-O 3.32Å; K494-M586 PolarHBondContact NZ-O 3.25Å; K494-A588 WeakPolarHBondContact CE-O 3.14Å; K494-A588 WeakPolarHBondContact CG-O 3.48Å; K494-A588 PolarHBondContact NZ-O 2.84Å; K494-D589 WeakPolarHBondContact CA-O 3.44Å; K494-F608 HydrophobicContact CB-CD1 3.66Å; K494-F608 HydrophobicContact CB-CE1 4.02Å; K494-F608 WeakPolarHBondContact O-CA 3.2Å; K494-H609 PolarHBondContact O-N 3.02Å
495	V	98.1	Very high	95.2	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.5	169.7	-174.7	0	0	0	0	108.2	V484 L487 N488 V497 D589 V590 V591 S610	V484-V495 HydrophobicContact CG1-CB 4.31Å; V484-V495 HydrophobicContact CG1-CG1 4.21Å; V484-V495 HydrophobicContact CG2-CG1 4.24Å; L487-V495 HydrophobicContact CB-CG2 3.89Å; N488-V495 HydrophobicContact CB-CG2 4.17Å; V495-V497 HydrophobicContact CG1-CG2 4.03Å; V495-D589 PolarHBondContact N-O 2.91Å; V495-V590 WeakPolarHBondContact O-CA 3.34Å; V495-V591 PolarHBondContact O-N 2.89Å; V495-V591 VanDerWaalsContact O-N 3.15Å; V495-S610 WeakPolarHBondContact CA-O 3.34Å
496	L	98.5	Very high	95.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.5	168.6	178.2	61	0	0	0	108	V498 V591 A598 F608 S610 V611 L612 P627 V630	L496-V498 HydrophobicContact CD1-CG1 4.09Å; L496-V498 HydrophobicContact CD2-CG1 4.47Å; L496-V498 HydrophobicContact CG-CG1 4.07Å; L496-V591 HydrophobicContact CD1-CB 4.47Å; L496-A598 HydrophobicContact CD2-CB 4.29Å; L496-F608 HydrophobicContact CB-CB 3.84Å; L496-F608 HydrophobicContact CB-CD1 3.66Å; L496-F608 HydrophobicContact CB-CD2 4.13Å; L496-F608 HydrophobicContact CB-CE1 4.21Å; L496-F608 HydrophobicContact CB-CG 3.61Å; L496-F608 HydrophobicContact CD1-CE1 4.49Å; L496-F608 HydrophobicContact CD1-CZ 4.41Å; L496-F608 HydrophobicContact CD2-CD2 4.43Å; L496-S610 PolarHBondContact N-O 3.01Å; L496-V611 HydrophobicContact CB-CG2 4.15Å; L496-V611 HydrophobicContact CD2-CG2 4.3Å; L496-V611 CarbonylContact O-C 3.54Å; L496-V611 WeakPolarHBondContact O-CA 3.31Å; L496-L612 PolarHBondContact O-N 2.94Å; L496-P627 HydrophobicContact CD2-CB 3.97Å; L496-V630 HydrophobicContact CD2-CG1 4.02Å; L496-V630 HydrophobicContact CD2-CG2 4.04Å
497	V	98.6	Very high	94.9	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.6	179.4	175.8	0	0	0	0	108.4	V484 V495 L508 I512 V590 V591 C592 C593 L612	V484-V497 HydrophobicContact CB-CG2 4.45Å; V484-V497 HydrophobicContact CG1-CG2 4.06Å; V484-V497 HydrophobicContact CG2-CG2 3.48Å; V484-V497 VanDerWaalsContact CG2-CG2 3.48Å; V495-V497 HydrophobicContact CG1-CG2 4.03Å; V497-L508 HydrophobicContact CG1-CD2 3.36Å; V497-L508 HydrophobicContact CG1-CG 3.84Å; V497-I512 HydrophobicContact CB-CD1 4.39Å; V497-I512 HydrophobicContact CG1-CD1 3.97Å; V497-I512 HydrophobicContact CG2-CD1 4.02Å; V497-V590 HydrophobicContact CB-CG1 4.22Å; V497-V590 HydrophobicContact CG2-CG1 3.56Å; V497-V591 PolarHBondContact N-O 2.93Å; V497-C592 VanDerWaalsContact O-CA 3.26Å; V497-C592 WeakPolarHBondContact O-CA 3.42Å; V497-C593 PolarHBondContact O-N 3.35Å; V497-L612 WeakPolarHBondContact CA-O 3.43Å; V497-L612 HydrophobicContact CG1-CD2 4.42Å
498	V	98.5	Very high	94.9	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.3	179.9	-60.9	0	0	0	0	112.4	L496 C593 A598 L612 I613 D614 P627	L496-V498 HydrophobicContact CD1-CG1 4.09Å; L496-V498 HydrophobicContact CD2-CG1 4.47Å; L496-V498 HydrophobicContact CG-CG1 4.07Å; V498-C593 WeakPolarHBondContact CA-O 3.42Å; V498-C593 WeakPolarHBondContact CB-O 3.44Å; V498-C593 WeakPolarHBondContact CG1-O 3.43Å; V498-A598 HydrophobicContact CG1-CB 4.36Å; V498-L612 PolarHBondContact N-O 3.07Å; V498-I613 HydrophobicContact CG2-CB 4.13Å; V498-I613 HydrophobicContact CG2-CD1 4.41Å; V498-I613 HydrophobicContact CG2-CG1 3.73Å; V498-I613 HydrophobicContact CG2-CG2 4.11Å; V498-I613 CarbonylContact O-C 3.6Å; V498-I613 WeakPolarHBondContact O-CA 3.4Å; V498-D614 PolarHBondContact O-N 2.79Å; V498-P627 HydrophobicContact CG1-CB 4.16Å; V498-P627 HydrophobicContact CG2-CB 3.79Å; V498-P627 HydrophobicContact CG2-CG 3.9Å
499	A	97.5	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	165.6	166.5	0	0	0	0	0	107.7	A504 V505 T594 C595 D614	A499-A504 HydrophobicContact CB-CB 3.58Å; A499-V505 HydrophobicContact CB-CG2 3.86Å; A499-T594 CarbonylContact O-C 3.55Å; A499-T594 WeakPolarHBondContact O-CA 3.33Å; A499-C595 VanDerWaalsContact C-SG 3.52Å; A499-C595 PolarHBondContact O-N 2.76Å; A499-D614 VanDerWaalsContact CA-O 3.27Å; A499-D614 WeakPolarHBondContact CA-O 3.42Å; A499-D614 VanDerWaalsContact CB-O 3.26Å; A499-D614 WeakPolarHBondContact CB-O 3.49Å
500	P	94.9	Very high	95	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-61.4	-69.8	171	17.4	-24.7	0	0	0	111.2	T32 T594 D614 E615 Q618 A619	T32-P500 CarbonylContact C-O 3.6Å; T32-P500 HydrophobicContact CG2-CB 4.06Å; P500-T594 WeakPolarHBondContact O-CB 3.47Å; P500-T594 WeakPolarHBondContact O-CG2 3.26Å; P500-D614 WeakPolarHBondContact CD-O 3.26Å; P500-E615 HydrophobicContact CG-CB 4.39Å; P500-Q618 HydrophobicContact CG-CB 3.82Å; P500-A619 HydrophobicContact CB-CB 4.13Å; P500-A619 HydrophobicContact CG-CB 4.12Å
501	S	90.3	Very high	95.2	Very high	7 Å²	7	30 Å²	30	5%	0.049	14%	0.144	C	C	.	.	S	Bend	trans	-72.8	151.1	-174.3	67.3	0	0	0	0	114.8	D31 T503 A504 V505	D31-S501 WeakPolarHBondContact O-CB 3.26Å; D31-S501 WeakPolarHBondContact OD1-CB 3.11Å; S501-T503 VanDerWaalsContact C-N 3.33Å; S501-T503 PolarHBondContact O-N 3.44Å; S501-A504 PolarHBondContact O-N 2.87Å; S501-A504 WeakPolarHBondContact OG-CB 3.33Å; S501-A504 PolarHBondContact OG-N 3.34Å; S501-V505 WeakPolarHBondContact O-CG2 3.26Å; S501-V505 PolarHBondContact O-N 3.4Å
502	N	90.6	Very high	95.4	Very high	11 Å²	11	28 Å²	28	6%	0.059	13%	0.134	C	C	.	.	H	α-helix	trans	-68.8	-30.9	178.2	-84.2	-57.1	0	0	0	112.1	Q33 G34 V505 D506 R521 R527 T594	Q33-N502 VanDerWaalsContact C-ND2 3.32Å; Q33-N502 WeakPolarHBondContact CA-ND2 3.46Å; Q33-N502 PolarHBondContact O-ND2 3.49Å; G34-N502 WeakPolarHBondContact O-CA 3.49Å; G34-N502 VanDerWaalsContact O-CB 3.29Å; G34-N502 WeakPolarHBondContact O-CB 3.07Å; G34-N502 PolarHBondContact O-N 3.23Å; N502-V505 PolarHBondContact O-N 2.87Å; N502-D506 WeakPolarHBondContact O-CB 3.33Å; N502-D506 PolarHBondContact O-N 3.16Å; N502-R521 PolarHBondContact O-NH2 3.28Å; N502-R521 PolarHBondContact OD1-NH1 3.46Å; N502-R521 PolarHBondContact OD1-NH2 3.22Å; N502-R527 PolarHBondContact ND2-NE 3.36Å; N502-T594 WeakPolarHBondContact OD1-CG2 3.21Å
503	T	89.8	Confident	95.7	Very high	35 Å²	35	23 Å²	23	22%	0.215	11%	0.112	C	C	.	.	H	α-helix	trans	-60.4	-44	173.6	-112.9	0	0	0	0	111.8	G34 P35 S501 V505 D506 Q507	G34-T503 PolarHBondContact O-N 2.63Å; P35-T503 WeakPolarHBondContact CA-OG1 3.37Å; P35-T503 WeakPolarHBondContact CB-OG1 3.46Å; P35-T503 WeakPolarHBondContact O-CB 3.27Å; P35-T503 PolarHBondContact O-OG1 3.43Å; S501-T503 VanDerWaalsContact C-N 3.33Å; S501-T503 PolarHBondContact O-N 3.44Å; T503-V505 PolarHBondContact O-N 2.95Å; T503-D506 PolarHBondContact O-N 3.07Å; T503-Q507 WeakPolarHBondContact O-CB 3.3Å; T503-Q507 WeakPolarHBondContact O-CG 3.33Å; T503-Q507 PolarHBondContact O-N 2.77Å
504	A	92.4	Very high	95.8	Very high	15 Å²	15	23.2 Å²	23.2	12%	0.124	11%	0.11	C	C	.	.	H	α-helix	trans	-64.8	-42.3	-179.5	0	0	0	0	0	111.5	A499 S501 L508 E615	A499-A504 HydrophobicContact CB-CB 3.58Å; S501-A504 PolarHBondContact O-N 2.87Å; S501-A504 WeakPolarHBondContact OG-CB 3.33Å; S501-A504 PolarHBondContact OG-N 3.34Å; A504-L508 VanDerWaalsContact O-CB 3.31Å; A504-L508 WeakPolarHBondContact O-CB 3.29Å; A504-L508 PolarHBondContact O-N 3.24Å; A504-L508 VanDerWaalsContact O-N 3.1Å; A504-E615 HydrophobicContact CB-CG 4.23Å
505	V	96.3	Very high	95.9	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-62.6	-46.1	174.6	-175.5	0	0	0	0	111.3	A499 S501 N502 T503 L508 C509 R521 C592 C593 T594	A499-V505 HydrophobicContact CB-CG2 3.86Å; S501-V505 WeakPolarHBondContact O-CG2 3.26Å; S501-V505 PolarHBondContact O-N 3.4Å; N502-V505 PolarHBondContact O-N 2.87Å; T503-V505 PolarHBondContact O-N 2.95Å; V505-L508 PolarHBondContact O-N 2.85Å; V505-C509 PolarHBondContact O-N 2.77Å; V505-C509 PolarHBondContact O-SG 2.83Å; V505-R521 VanDerWaalsContact CG1-CZ 3.48Å; V505-C592 HydrophobicContact CG1-CB 4.01Å; V505-C593 VanDerWaalsContact CG2-O 3.23Å; V505-C593 WeakPolarHBondContact CG2-O 3.3Å; V505-T594 HydrophobicContact CG2-CG2 4.03Å
506	D	95.3	Very high	95.8	Very high	14 Å²	14	24.6 Å²	24.6	8%	0.075	14%	0.136	C	C	.	.	H	α-helix	trans	-67.5	-41.3	-176.5	-78.3	13.5	0	0	0	112.2	N502 T503 L508 C509 E510 R521 S532 V534	N502-D506 WeakPolarHBondContact O-CB 3.33Å; N502-D506 PolarHBondContact O-N 3.16Å; T503-D506 PolarHBondContact O-N 3.07Å; D506-L508 VanDerWaalsContact C-N 3.31Å; D506-L508 PolarHBondContact O-N 2.99Å; D506-C509 WeakPolarHBondContact O-CB 3.1Å; D506-C509 PolarHBondContact O-N 2.74Å; D506-E510 PolarHBondContact O-N 3.16Å; D506-E510 VanDerWaalsContact O-N 3.12Å; D506-R521 IonicContact OD1-CZ 3.22Å; D506-R521 IonicContact OD1-NE 3.63Å; D506-R521 PolarHBondContact OD1-NE 3.27Å; D506-R521 IonicContact OD1-NH2 2.78Å; D506-R521 PolarHBondContact OD1-NH2 3.07Å; D506-S532 WeakPolarHBondContact OD2-CB 3.2Å; D506-S532 PolarHBondContact OD2-OG 3.05Å; D506-V534 HydrophobicContact CB-CG2 3.79Å; D506-V534 WeakPolarHBondContact O-CG1 3.29Å; D506-V534 WeakPolarHBondContact OD1-CG2 3.35Å
507	Q	94.2	Very high	95.8	Very high	94 Å²	94	25.3 Å²	25.3	44%	0.439	14%	0.139	S	C	.	.	H	α-helix	trans	-60.9	-40.2	172.7	-71.4	-178.7	16.5	0	0	111.9	T503 E510 K511	T503-Q507 WeakPolarHBondContact O-CB 3.3Å; T503-Q507 WeakPolarHBondContact O-CG 3.33Å; T503-Q507 PolarHBondContact O-N 2.77Å; Q507-E510 PolarHBondContact O-N 3.45Å; Q507-K511 PolarHBondContact O-N 2.93Å
508	L	96.1	Very high	95.7	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-73.9	-37.3	180	-175.3	51.3	0	0	0	112.2	T477 A481 V497 A504 V505 D506 E510 K511 I512 L612 D614	T477-L508 HydrophobicContact CG2-CB 3.95Å; T477-L508 HydrophobicContact CG2-CD1 3.76Å; T477-L508 HydrophobicContact CG2-CG 4.42Å; A481-L508 HydrophobicContact CB-CD1 4.23Å; V497-L508 HydrophobicContact CG1-CD2 3.36Å; V497-L508 HydrophobicContact CG1-CG 3.84Å; A504-L508 VanDerWaalsContact O-CB 3.31Å; A504-L508 WeakPolarHBondContact O-CB 3.29Å; A504-L508 PolarHBondContact O-N 3.24Å; A504-L508 VanDerWaalsContact O-N 3.1Å; V505-L508 PolarHBondContact O-N 2.85Å; D506-L508 VanDerWaalsContact C-N 3.31Å; D506-L508 PolarHBondContact O-N 2.99Å; L508-E510 VanDerWaalsContact C-N 3.28Å; L508-E510 PolarHBondContact O-N 2.99Å; L508-K511 PolarHBondContact O-N 3.07Å; L508-I512 HydrophobicContact CD1-CD1 3.87Å; L508-I512 HydrophobicContact CD1-CG1 4.08Å; L508-I512 HydrophobicContact CG-CD1 3.77Å; L508-I512 HydrophobicContact CG-CG1 4.46Å; L508-I512 WeakPolarHBondContact O-CD1 3.37Å; L508-I512 VanDerWaalsContact O-CG1 3.29Å; L508-I512 WeakPolarHBondContact O-CG1 3.49Å; L508-I512 PolarHBondContact O-N 2.73Å; L508-L612 HydrophobicContact CD2-CD2 4.03Å; L508-D614 HydrophobicContact CD2-CB 3.79Å
509	C	97.7	Very high	95.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-52.1	-49.7	168.8	-69.1	0	0	0	0	110.9	V505 D506 K511 I512 D513 V519 V534 L537 C592	V505-C509 PolarHBondContact O-N 2.77Å; V505-C509 PolarHBondContact O-SG 2.83Å; D506-C509 WeakPolarHBondContact O-CB 3.1Å; D506-C509 PolarHBondContact O-N 2.74Å; C509-K511 VanDerWaalsContact C-N 3.26Å; C509-K511 PolarHBondContact O-N 3.17Å; C509-I512 PolarHBondContact O-N 2.99Å; C509-D513 WeakPolarHBondContact O-CB 3.46Å; C509-D513 PolarHBondContact O-N 3.07Å; C509-V519 HydrophobicContact CB-CG1 4.47Å; C509-V534 HydrophobicContact CB-CB 4.41Å; C509-V534 HydrophobicContact CB-CG1 4.09Å; C509-V534 HydrophobicContact CB-CG2 4.34Å; C509-L537 HydrophobicContact CB-CD1 4.07Å; C509-C592 WeakPolarHBondContact SG-CB 3.26Å
510	E	96.5	Very high	95.8	Very high	56 Å²	56	32 Å²	32	26%	0.262	17%	0.169	S	C	.	.	H	α-helix	trans	-65.4	-26.3	-176.4	-157.4	-106	147.2	0	0	112.8	D506 Q507 L508 R514 V534	D506-E510 PolarHBondContact O-N 3.16Å; D506-E510 VanDerWaalsContact O-N 3.12Å; Q507-E510 PolarHBondContact O-N 3.45Å; L508-E510 VanDerWaalsContact C-N 3.28Å; L508-E510 PolarHBondContact O-N 2.99Å; E510-R514 WeakPolarHBondContact O-CD 3.05Å; E510-R514 WeakPolarHBondContact O-CG 3.33Å; E510-R514 PolarHBondContact O-NE 3.01Å; E510-R514 IonicContact OE1-CZ 2.77Å; E510-R514 IonicContact OE1-NE 3.24Å; E510-R514 PolarHBondContact OE1-NE 3.16Å; E510-R514 IonicContact OE1-NH2 3.73Å; E510-R514 PolarHBondContact OE1-NH2 2.77Å; E510-R514 IonicContact OE2-NE 2.83Å; E510-R514 IonicContact OE2-NH2 3.9Å; E510-V534 HydrophobicContact CB-CG1 3.89Å; E510-V534 HydrophobicContact CG-CG1 4.29Å
511	K	97.1	Very high	95.9	Very high	51 Å²	51	32.1 Å²	32.1	22%	0.222	17%	0.169	C	C	.	.	H	α-helix	trans	-84.7	-33.1	172.5	-60.1	-44.6	176.2	-144	0	113.8	L446 T477 A481 Q507 L508 C509	L446-K511 HydrophobicContact CD2-CB 4.41Å; L446-K511 HydrophobicContact CD2-CD 4.46Å; T477-K511 HydrophobicContact CG2-CB 4.43Å; T477-K511 HydrophobicContact CG2-CG 3.9Å; A481-K511 HydrophobicContact CB-CB 3.76Å; Q507-K511 PolarHBondContact O-N 2.93Å; L508-K511 PolarHBondContact O-N 3.07Å; C509-K511 VanDerWaalsContact C-N 3.26Å; C509-K511 PolarHBondContact O-N 3.17Å
512	I	98.2	Very high	96.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-73.8	-43.4	178.4	-63.2	160.7	0	0	0	110.5	A481 V484 V497 L508 C509 R514 T515 L517 V519 V590	A481-I512 HydrophobicContact CB-CG1 3.79Å; V484-I512 HydrophobicContact CB-CD1 4.33Å; V484-I512 HydrophobicContact CB-CG1 4.36Å; V484-I512 HydrophobicContact CG1-CD1 4.09Å; V484-I512 HydrophobicContact CG1-CG1 4.26Å; V484-I512 HydrophobicContact CG1-CG2 3.94Å; V484-I512 HydrophobicContact CG2-CD1 4.16Å; V497-I512 HydrophobicContact CB-CD1 4.39Å; V497-I512 HydrophobicContact CG1-CD1 3.97Å; V497-I512 HydrophobicContact CG2-CD1 4.02Å; L508-I512 HydrophobicContact CD1-CD1 3.87Å; L508-I512 HydrophobicContact CD1-CG1 4.08Å; L508-I512 HydrophobicContact CG-CD1 3.77Å; L508-I512 HydrophobicContact CG-CG1 4.46Å; L508-I512 WeakPolarHBondContact O-CD1 3.37Å; L508-I512 VanDerWaalsContact O-CG1 3.29Å; L508-I512 WeakPolarHBondContact O-CG1 3.49Å; L508-I512 PolarHBondContact O-N 2.73Å; C509-I512 PolarHBondContact O-N 2.99Å; I512-R514 VanDerWaalsContact C-N 3.29Å; I512-R514 PolarHBondContact O-N 2.65Å; I512-T515 WeakPolarHBondContact O-CB 3.44Å; I512-T515 PolarHBondContact O-N 2.86Å; I512-T515 PolarHBondContact O-OG1 3.31Å; I512-L517 HydrophobicContact CG2-CD1 4.18Å; I512-V519 HydrophobicContact CB-CG2 3.99Å; I512-V519 HydrophobicContact CG2-CG2 3.52Å; I512-V590 HydrophobicContact CD1-CG1 4.39Å; I512-V590 HydrophobicContact CG2-CB 4.33Å; I512-V590 HydrophobicContact CG2-CG1 4.34Å; I512-V590 HydrophobicContact CG2-CG2 3.98Å
513	D	97.9	Very high	96.4	Very high	34 Å²	34	31.7 Å²	31.7	18%	0.182	17%	0.167	C	C	.	.	H	α-helix	trans	-57.7	-40.1	178	159.3	93.5	0	0	0	112.4	C509 T515 G516 V519 R536 L537	C509-D513 WeakPolarHBondContact O-CB 3.46Å; C509-D513 PolarHBondContact O-N 3.07Å; D513-T515 PolarHBondContact O-N 2.91Å; D513-T515 VanDerWaalsContact O-N 3.09Å; D513-G516 PolarHBondContact O-N 2.68Å; D513-V519 HydrophobicContact CB-CB 4.43Å; D513-V519 HydrophobicContact CB-CG2 4.08Å; D513-R536 IonicContact OD1-CZ 3.94Å; D513-R536 IonicContact OD1-NH1 2.66Å; D513-R536 PolarHBondContact OD1-NH1 3.01Å; D513-R536 IonicContact OD1-NH2 3.32Å; D513-R536 IonicContact OD2-CZ 2.88Å; D513-R536 IonicContact OD2-NH1 2.67Å; D513-R536 PolarHBondContact OD2-NH1 2.7Å; D513-R536 VanDerWaalsContact OD2-NH1 3.13Å; D513-R536 IonicContact OD2-NH2 2.72Å; D513-R536 PolarHBondContact OD2-NH2 3.03Å; D513-L537 HydrophobicContact CB-CD1 3.72Å; D513-L537 HydrophobicContact CB-CD2 4.4Å; D513-L537 WeakPolarHBondContact OD1-CD2 3.3Å
514	R	97.4	Very high	96.4	Very high	121 Å²	121	31.1 Å²	31.1	46%	0.457	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-27.5	173.3	-74	166.4	-179.4	-116.1	4.4	113.3	D445 L446 E510 I512 G516	D445-R514 WeakPolarHBondContact CB-O 3.42Å; L446-R514 HydrophobicContact CD2-CB 4.3Å; E510-R514 WeakPolarHBondContact O-CD 3.05Å; E510-R514 WeakPolarHBondContact O-CG 3.33Å; E510-R514 PolarHBondContact O-NE 3.01Å; E510-R514 IonicContact OE1-CZ 2.77Å; E510-R514 IonicContact OE1-NE 3.24Å; E510-R514 PolarHBondContact OE1-NE 3.16Å; E510-R514 IonicContact OE1-NH2 3.73Å; E510-R514 PolarHBondContact OE1-NH2 2.77Å; E510-R514 IonicContact OE2-NE 2.83Å; E510-R514 IonicContact OE2-NH2 3.9Å; I512-R514 VanDerWaalsContact C-N 3.29Å; I512-R514 PolarHBondContact O-N 2.65Å; R514-G516 PolarHBondContact O-N 2.86Å
515	T	97.4	Very high	96.1	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.043	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-0.6	177.6	72.3	0	0	0	0	114.4	A443 P444 L446 Y485 I512 D513	A443-T515 HydrophobicContact CB-CG2 3.81Å; P444-T515 WeakPolarHBondContact CG-O 3.15Å; L446-T515 HydrophobicContact CD1-CG2 3.6Å; L446-T515 HydrophobicContact CG-CG2 3.91Å; Y485-T515 HydrophobicContact CD2-CG2 4.48Å; I512-T515 WeakPolarHBondContact O-CB 3.44Å; I512-T515 PolarHBondContact O-N 2.86Å; I512-T515 PolarHBondContact O-OG1 3.31Å; D513-T515 PolarHBondContact O-N 2.91Å; D513-T515 VanDerWaalsContact O-N 3.09Å
516	G	96.8	Very high	95.3	Very high	68 Å²	68	37.3 Å²	37.3	70%	0.701	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	6.1	178.6	0	0	0	0	0	115.5	D513 R514	D513-G516 PolarHBondContact O-N 2.68Å; R514-G516 PolarHBondContact O-N 2.86Å
517	L	97.7	Very high	94.6	Very high	14 Å²	14	38 Å²	38	7%	0.073	19%	0.191	C	C	.	.			trans	-76.9	150.2	174	-65.4	-178.7	0	0	0	112.2	Y485 N488 I512 V519 D589 V590	Y485-L517 HydrophobicContact CD2-CD1 4.35Å; Y485-L517 HydrophobicContact CD2-CD2 4.48Å; Y485-L517 HydrophobicContact CD2-CG 4.27Å; N488-L517 HydrophobicContact CB-CD1 4.26Å; N488-L517 WeakPolarHBondContact OD1-CD2 3.46Å; I512-L517 HydrophobicContact CG2-CD1 4.18Å; L517-V519 PolarHBondContact O-N 3.28Å; L517-D589 HydrophobicContact CB-CB 4.2Å; L517-D589 HydrophobicContact CD2-CB 4.29Å; L517-V590 HydrophobicContact CB-CG2 4.4Å; L517-V590 HydrophobicContact CD1-CG2 3.74Å
518	K	97.6	Very high	94.1	Very high	133 Å²	133	35.3 Å²	35.3	58%	0.578	18%	0.178	S	C	*	.			trans	-74.7	93.4	173.1	-61.1	168.8	-174.8	171	0	110.5	A587 D589 V590	K518-A587 WeakPolarHBondContact CD-O 3.45Å; K518-D589 HydrophobicContact CB-CB 4.3Å; K518-D589 VanDerWaalsContact CB-OD2 3.24Å; K518-D589 WeakPolarHBondContact CB-OD2 3.48Å; K518-D589 WeakPolarHBondContact CG-OD2 3.33Å; K518-D589 PolarHBondContact N-OD2 3.02Å; K518-D589 PolarHBondContact O-N 2.57Å; K518-V590 PolarHBondContact O-N 3.25Å
519	V	98.3	Very high	93.1	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.03	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133.5	176.2	-177.4	0	0	0	0	111.2	C509 I512 D513 L517 L537 Q542 V590	C509-V519 HydrophobicContact CB-CG1 4.47Å; I512-V519 HydrophobicContact CB-CG2 3.99Å; I512-V519 HydrophobicContact CG2-CG2 3.52Å; D513-V519 HydrophobicContact CB-CB 4.43Å; D513-V519 HydrophobicContact CB-CG2 4.08Å; L517-V519 PolarHBondContact O-N 3.28Å; V519-L537 HydrophobicContact CB-CD1 4.35Å; V519-L537 HydrophobicContact CB-CD2 4.47Å; V519-L537 HydrophobicContact CG1-CD1 4.16Å; V519-Q542 PolarHBondContact O-NE2 3.14Å; V519-V590 WeakPolarHBondContact CA-O 2.71Å; V519-V590 HydrophobicContact CG2-CB 4.45Å
520	V	98.3	Very high	92.3	Very high	5 Å²	5	40 Å²	40	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.5	168.3	177	0	0	0	0	109.6	L539 L585 A588 V590 V591 C592	V520-L539 HydrophobicContact CG1-CB 3.92Å; V520-L539 HydrophobicContact CG1-CD1 3.87Å; V520-L539 HydrophobicContact CG1-CG 4.4Å; V520-L585 HydrophobicContact CB-CD2 4.49Å; V520-L585 HydrophobicContact CG1-CD2 3.82Å; V520-A588 HydrophobicContact CB-CB 4.17Å; V520-A588 HydrophobicContact CG2-CB 3.59Å; V520-V590 PolarHBondContact N-O 2.87Å; V520-V591 WeakPolarHBondContact O-CA 3.34Å; V520-C592 PolarHBondContact O-N 3.08Å
521	R	97.8	Very high	91.6	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.9	173.8	173.4	51.5	157.9	127.6	-4.5	109.8	N502 V505 D506 V534 L537 M538 L539 C592	N502-R521 PolarHBondContact O-NH2 3.28Å; N502-R521 PolarHBondContact OD1-NH1 3.46Å; N502-R521 PolarHBondContact OD1-NH2 3.22Å; V505-R521 VanDerWaalsContact CG1-CZ 3.48Å; D506-R521 IonicContact OD1-CZ 3.22Å; D506-R521 IonicContact OD1-NE 3.63Å; D506-R521 PolarHBondContact OD1-NE 3.27Å; D506-R521 IonicContact OD1-NH2 2.78Å; D506-R521 PolarHBondContact OD1-NH2 3.07Å; R521-V534 HydrophobicContact CG-CG2 4.34Å; R521-L537 HydrophobicContact CB-CB 4.14Å; R521-L537 PolarHBondContact N-O 2.79Å; R521-M538 HydrophobicContact CB-CG 4.26Å; R521-M538 HydrophobicContact CG-CE 4.27Å; R521-M538 HydrophobicContact CG-CG 3.94Å; R521-M538 CarbonylContact O-C 3.57Å; R521-M538 VanDerWaalsContact O-CA 3.31Å; R521-M538 WeakPolarHBondContact O-CA 3.5Å; R521-L539 PolarHBondContact O-N 3.42Å; R521-C592 CarbonylContact C-O 3.56Å; R521-C592 WeakPolarHBondContact CA-O 2.81Å; R521-C592 VanDerWaalsContact CD-O 3.26Å; R521-C592 WeakPolarHBondContact CD-O 3.31Å
522	L	97.2	Very high	91.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.237	C	C	.	.			trans	-95.3	133.9	172.4	-178.4	67.1	0	0	0	110.4	L539 C592 C593 T597 D600 L603	L522-L539 HydrophobicContact CD1-CB 4.5Å; L522-L539 HydrophobicContact CD1-CD2 3.7Å; L522-C592 PolarHBondContact N-O 2.67Å; L522-C593 HydrophobicContact CB-CB 3.99Å; L522-C593 WeakPolarHBondContact O-CB 3Å; L522-T597 HydrophobicContact CD2-CG2 4.05Å; L522-T597 HydrophobicContact CG-CG2 3.91Å; L522-D600 HydrophobicContact CD2-CB 4.15Å; L522-L603 HydrophobicContact CD2-CD1 3.76Å; L522-L603 HydrophobicContact CD2-CD2 3.74Å; L522-L603 HydrophobicContact CD2-CG 3.57Å
523	C	93.8	Very high	90.7	Very high	8 Å²	8	46.4 Å²	46.4	5%	0.054	27%	0.273	C	S	.	.			trans	-125.2	154.5	178.5	-59.8	0	0	0	0	110.4	R602	C523-R602 PolarHBondContact O-NH2 2.8Å
524	A	90	Very high	90.5	Very high	23 Å²	23	44.8 Å²	44.8	19%	0.19	26%	0.264	C	S	.	.			trans	-59.7	142.8	168.9	0	0	0	0	0	110.8	S526 R527	A524-S526 PolarHBondContact O-N 3.04Å; A524-S526 VanDerWaalsContact O-N 3.11Å; A524-R527 PolarHBondContact O-N 3.47Å
525	R	85.7	Confident	90.4	Very high	126 Å²	126	41.6 Å²	41.6	48%	0.475	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-57.8	-29.9	-173.1	-67.8	-172.9	175.7	-81.6	-2.1	114	R527 E528 E581	R525-R527 PolarHBondContact O-N 2.78Å; R525-E528 IonicContact NH1-OE1 2.65Å; R525-E528 PolarHBondContact O-N 2.65Å; R525-E581 IonicContact NH1-OE1 2.7Å; R525-E581 IonicContact NH2-OE1 3.46Å; R525-E581 IonicContact NH2-OE2 3.29Å; R525-E581 PolarHBondContact NH2-OE2 2.94Å
526	S	79.7	Confident	90.3	Very high	20 Å²	20	47.5 Å²	47.5	14%	0.14	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-71.2	-8.8	174.7	53.3	0	0	0	0	114.8	H357 A524	H357-S526 WeakPolarHBondContact NE2-CB 3.47Å; A524-S526 PolarHBondContact O-N 3.04Å; A524-S526 VanDerWaalsContact O-N 3.11Å
527	R	80.7	Confident	90.3	Very high	29 Å²	29	44.6 Å²	44.6	11%	0.109	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-110.7	2.2	178.5	-55.2	-169.8	78.4	81	4.5	113.2	Q33 H336 N502 A524 R525 A529 L530	Q33-R527 PolarHBondContact O-NE 3.14Å; Q33-R527 PolarHBondContact O-NH1 3.44Å; Q33-R527 VanDerWaalsContact O-NH1 3.15Å; Q33-R527 PolarHBondContact O-NH2 3.42Å; H336-R527 PolarHBondContact O-NH1 2.96Å; H336-R527 PolarHBondContact O-NH2 2.89Å; N502-R527 PolarHBondContact ND2-NE 3.36Å; A524-R527 PolarHBondContact O-N 3.47Å; R525-R527 PolarHBondContact O-N 2.78Å; R527-A529 PolarHBondContact O-N 3.17Å; R527-A529 VanDerWaalsContact O-N 3.13Å; R527-L530 HydrophobicContact CB-CD1 4.06Å; R527-L530 HydrophobicContact CG-CD1 4.05Å; R527-L530 VanDerWaalsContact CZ-CD1 3.44Å; R527-L530 VanDerWaalsContact NH2-CD1 3.32Å; R527-L530 PolarHBondContact O-N 3.44Å; R527-L530 VanDerWaalsContact O-N 3.15Å
528	E	84.6	Confident	90.2	Very high	37 Å²	37	44.3 Å²	44.3	17%	0.173	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-5.2	176.5	-63.8	-176.4	-159.9	0	0	113.5	R525 H540 K577 R602	R525-E528 IonicContact NH1-OE1 2.65Å; R525-E528 PolarHBondContact O-N 2.65Å; E528-H540 HydrophobicContact CG-CB 4.26Å; E528-H540 PolarHBondContact O-NE2 3.43Å; E528-H540 WeakPolarHBondContact OE2-CB 3.28Å; E528-H540 IonicContact OE2-CG 2.68Å; E528-K577 IonicContact OE2-NZ 3.85Å; E528-K577 PolarHBondContact OE2-NZ 2.8Å; E528-R602 IonicContact OE1-CZ 3.85Å; E528-R602 IonicContact OE1-NH1 3.8Å; E528-R602 PolarHBondContact OE1-NH1 3.47Å; E528-R602 IonicContact OE1-NH2 3.87Å
529	A	74.8	Confident	90.2	Very high	66 Å²	66	38.1 Å²	38.1	55%	0.545	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-3.5	174.5	0	0	0	0	0	113.9	R527	R527-A529 PolarHBondContact O-N 3.17Å; R527-A529 VanDerWaalsContact O-N 3.13Å
530	L	80.3	Confident	89.8	Confident	34 Å²	34	38.3 Å²	38.3	18%	0.178	22%	0.223	C	C	.	.	S	Bend	trans	-92.3	140.9	-175.4	-62.4	177.3	0	0	0	111.6	R527	R527-L530 HydrophobicContact CB-CD1 4.06Å; R527-L530 HydrophobicContact CG-CD1 4.05Å; R527-L530 VanDerWaalsContact CZ-CD1 3.44Å; R527-L530 VanDerWaalsContact NH2-CD1 3.32Å; R527-L530 PolarHBondContact O-N 3.44Å; R527-L530 VanDerWaalsContact O-N 3.15Å
531	A	82.3	Confident	89.6	Confident	104 Å²	104	40.3 Å²	40.3	86%	0.86	23%	0.233	S	C	*	.			trans	-66.1	145.1	174.2	0	0	0	0	0	111.7
532	S	87.4	Confident	89.4	Confident	21 Å²	21	42.1 Å²	42.1	15%	0.147	24%	0.241	C	C	.	.			trans	-153.2	147.2	175.2	158.4	0	0	0	0	110.6	D506 V534 S535 M538	D506-S532 WeakPolarHBondContact OD2-CB 3.2Å; D506-S532 PolarHBondContact OD2-OG 3.05Å; S532-V534 PolarHBondContact O-N 3.29Å; S532-V534 WeakPolarHBondContact OG-CG2 3.37Å; S532-V534 PolarHBondContact OG-N 3.13Å; S532-V534 VanDerWaalsContact OG-N 3.11Å; S532-S535 WeakPolarHBondContact O-CB 3.39Å; S532-S535 PolarHBondContact O-N 2.92Å; S532-S535 PolarHBondContact O-OG 2.89Å; S532-M538 VanDerWaalsContact OG-CE 3.31Å; S532-M538 WeakPolarHBondContact OG-CE 3.4Å
533	P	90	Very high	89.1	Confident	116 Å²	116	42.4 Å²	42.4	75%	0.753	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.9	174.5	27.1	-36.4	0	0	0	113.8
534	V	93.5	Very high	88.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	23	178.3	-62.1	0	0	0	0	113.4	D506 C509 E510 R521 S532 R536 L537 M538	D506-V534 HydrophobicContact CB-CG2 3.79Å; D506-V534 WeakPolarHBondContact O-CG1 3.29Å; D506-V534 WeakPolarHBondContact OD1-CG2 3.35Å; C509-V534 HydrophobicContact CB-CB 4.41Å; C509-V534 HydrophobicContact CB-CG1 4.09Å; C509-V534 HydrophobicContact CB-CG2 4.34Å; E510-V534 HydrophobicContact CB-CG1 3.89Å; E510-V534 HydrophobicContact CG-CG1 4.29Å; R521-V534 HydrophobicContact CG-CG2 4.34Å; S532-V534 PolarHBondContact O-N 3.29Å; S532-V534 WeakPolarHBondContact OG-CG2 3.37Å; S532-V534 PolarHBondContact OG-N 3.13Å; S532-V534 VanDerWaalsContact OG-N 3.11Å; V534-R536 VanDerWaalsContact C-N 3.27Å; V534-R536 PolarHBondContact O-N 3.36Å; V534-R536 VanDerWaalsContact O-N 3.15Å; V534-L537 HydrophobicContact CB-CB 4.42Å; V534-L537 HydrophobicContact CB-CD1 4.21Å; V534-L537 HydrophobicContact CB-CG 4.49Å; V534-L537 HydrophobicContact CG1-CD1 4.35Å; V534-L537 WeakPolarHBondContact O-CA 3.47Å; V534-L537 WeakPolarHBondContact O-CB 3.31Å; V534-L537 PolarHBondContact O-N 3.01Å; V534-M538 HydrophobicContact CG2-CE 4.39Å; V534-M538 PolarHBondContact O-N 2.68Å
535	S	93.9	Very high	88.6	Confident	54 Å²	54	50.6 Å²	50.6	38%	0.378	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-45.4	-44.2	176.7	53.5	0	0	0	0	114.1	S532 L537 M538 I541	S532-S535 WeakPolarHBondContact O-CB 3.39Å; S532-S535 PolarHBondContact O-N 2.92Å; S532-S535 PolarHBondContact O-OG 2.89Å; S535-L537 PolarHBondContact O-N 2.95Å; S535-L537 VanDerWaalsContact O-N 3.11Å; S535-M538 WeakPolarHBondContact O-CB 3.38Å; S535-M538 PolarHBondContact O-N 3.41Å; S535-I541 VanDerWaalsContact O-CB 3.29Å; S535-I541 WeakPolarHBondContact O-CB 3.33Å; S535-I541 WeakPolarHBondContact O-CG1 3.26Å
536	R	95.3	Very high	88.6	Confident	132 Å²	132	46.3 Å²	46.3	50%	0.498	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-59.2	-20.1	175.5	68.1	179.5	173	85.4	1.8	115.3	D513 V534 Q542	D513-R536 IonicContact OD1-CZ 3.94Å; D513-R536 IonicContact OD1-NH1 2.66Å; D513-R536 PolarHBondContact OD1-NH1 3.01Å; D513-R536 IonicContact OD1-NH2 3.32Å; D513-R536 IonicContact OD2-CZ 2.88Å; D513-R536 IonicContact OD2-NH1 2.67Å; D513-R536 PolarHBondContact OD2-NH1 2.7Å; D513-R536 VanDerWaalsContact OD2-NH1 3.13Å; D513-R536 IonicContact OD2-NH2 2.72Å; D513-R536 PolarHBondContact OD2-NH2 3.03Å; V534-R536 VanDerWaalsContact C-N 3.27Å; V534-R536 PolarHBondContact O-N 3.36Å; V534-R536 VanDerWaalsContact O-N 3.15Å; R536-Q542 WeakPolarHBondContact O-CG 3.13Å; R536-Q542 PolarHBondContact O-NE2 3.24Å
537	L	96.6	Very high	88.8	Confident	7 Å²	7	54 Å²	54	4%	0.037	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-93.3	-12.7	176.1	-58.6	-178.3	0	0	0	112.4	C509 D513 V519 R521 V534 S535 L539 Q542	C509-L537 HydrophobicContact CB-CD1 4.07Å; D513-L537 HydrophobicContact CB-CD1 3.72Å; D513-L537 HydrophobicContact CB-CD2 4.4Å; D513-L537 WeakPolarHBondContact OD1-CD2 3.3Å; V519-L537 HydrophobicContact CB-CD1 4.35Å; V519-L537 HydrophobicContact CB-CD2 4.47Å; V519-L537 HydrophobicContact CG1-CD1 4.16Å; R521-L537 HydrophobicContact CB-CB 4.14Å; R521-L537 PolarHBondContact N-O 2.79Å; V534-L537 HydrophobicContact CB-CB 4.42Å; V534-L537 HydrophobicContact CB-CD1 4.21Å; V534-L537 HydrophobicContact CB-CG 4.49Å; V534-L537 HydrophobicContact CG1-CD1 4.35Å; V534-L537 WeakPolarHBondContact O-CA 3.47Å; V534-L537 WeakPolarHBondContact O-CB 3.31Å; V534-L537 PolarHBondContact O-N 3.01Å; S535-L537 PolarHBondContact O-N 2.95Å; S535-L537 VanDerWaalsContact O-N 3.11Å; L537-L539 PolarHBondContact O-N 2.93Å; L537-Q542 PolarHBondContact O-NE2 3.46Å
538	M	96.8	Very high	88.7	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.039	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-71.7	131.4	-175.4	-65.2	-172.2	164.5	0	0	111.3	R521 S532 V534 S535 H540 I541 Q542	R521-M538 HydrophobicContact CB-CG 4.26Å; R521-M538 HydrophobicContact CG-CE 4.27Å; R521-M538 HydrophobicContact CG-CG 3.94Å; R521-M538 CarbonylContact O-C 3.57Å; R521-M538 VanDerWaalsContact O-CA 3.31Å; R521-M538 WeakPolarHBondContact O-CA 3.5Å; S532-M538 VanDerWaalsContact OG-CE 3.31Å; S532-M538 WeakPolarHBondContact OG-CE 3.4Å; V534-M538 HydrophobicContact CG2-CE 4.39Å; V534-M538 PolarHBondContact O-N 2.68Å; S535-M538 WeakPolarHBondContact O-CB 3.38Å; S535-M538 PolarHBondContact O-N 3.41Å; M538-H540 PolarHBondContact O-N 2.84Å; M538-H540 VanDerWaalsContact O-N 3.1Å; M538-H540 VanDerWaalsContact SD-CE1 3.6Å; M538-I541 HydrophobicContact CB-CB 4.47Å; M538-I541 HydrophobicContact CB-CG1 4.13Å; M538-I541 PolarHBondContact O-N 3.48Å; M538-Q542 PolarHBondContact O-N 2.75Å
539	L	96.5	Very high	88.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-51.9	-39.5	-174.2	178.9	61.6	0	0	0	113.4	V520 R521 L522 L537 A543 E581 L584 L585	V520-L539 HydrophobicContact CG1-CB 3.92Å; V520-L539 HydrophobicContact CG1-CD1 3.87Å; V520-L539 HydrophobicContact CG1-CG 4.4Å; R521-L539 PolarHBondContact O-N 3.42Å; L522-L539 HydrophobicContact CD1-CB 4.5Å; L522-L539 HydrophobicContact CD1-CD2 3.7Å; L537-L539 PolarHBondContact O-N 2.93Å; L539-A543 VanDerWaalsContact O-CB 3.28Å; L539-A543 WeakPolarHBondContact O-CB 3.28Å; L539-A543 PolarHBondContact O-N 2.95Å; L539-E581 HydrophobicContact CD2-CB 4.08Å; L539-E581 HydrophobicContact CD2-CG 4.02Å; L539-E581 HydrophobicContact CG-CB 4.4Å; L539-E581 HydrophobicContact CG-CG 4.09Å; L539-L584 HydrophobicContact CD1-CB 3.67Å; L539-L584 HydrophobicContact CD1-CD1 3.94Å; L539-L584 HydrophobicContact CD1-CG 4.47Å; L539-L585 HydrophobicContact CD1-CG 4.13Å; L539-L585 HydrophobicContact CD2-CD1 3.71Å; L539-L585 HydrophobicContact CD2-CD2 4.31Å; L539-L585 HydrophobicContact CD2-CG 3.93Å
540	H	91.6	Very high	89.3	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.046	33%	0.328	C	S	.	.	H	α-helix	trans	-71.7	-38.2	-179.7	60.8	-87.5	0	0	0	112.7	E528 M538 Q544	E528-H540 HydrophobicContact CG-CB 4.26Å; E528-H540 PolarHBondContact O-NE2 3.43Å; E528-H540 WeakPolarHBondContact OE2-CB 3.28Å; E528-H540 IonicContact OE2-CG 2.68Å; M538-H540 PolarHBondContact O-N 2.84Å; M538-H540 VanDerWaalsContact O-N 3.1Å; M538-H540 VanDerWaalsContact SD-CE1 3.6Å; H540-Q544 WeakPolarHBondContact O-CG 3.29Å; H540-Q544 PolarHBondContact O-N 2.87Å; H540-Q544 VanDerWaalsContact O-N 3.1Å
541	I	92.5	Very high	89.8	Confident	47 Å²	47	59.8 Å²	59.8	24%	0.241	34%	0.338	C	S	.	.	H	α-helix	trans	-68.8	-42.3	173.8	-57	-57.7	0	0	0	110.4	S535 M538 Q544 N545	S535-I541 VanDerWaalsContact O-CB 3.29Å; S535-I541 WeakPolarHBondContact O-CB 3.33Å; S535-I541 WeakPolarHBondContact O-CG1 3.26Å; M538-I541 HydrophobicContact CB-CB 4.47Å; M538-I541 HydrophobicContact CB-CG1 4.13Å; M538-I541 PolarHBondContact O-N 3.48Å; I541-Q544 PolarHBondContact O-N 2.7Å; I541-N545 PolarHBondContact O-N 2.84Å; I541-N545 PolarHBondContact O-ND2 3.33Å
542	Q	93.7	Very high	90.2	Very high	40 Å²	40	55.4 Å²	55.4	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-48.6	174.5	-71.7	-175.2	-8.2	0	0	110.6	V519 R536 L537 M538 Q544 N545 V546 L584	V519-Q542 PolarHBondContact O-NE2 3.14Å; R536-Q542 WeakPolarHBondContact O-CG 3.13Å; R536-Q542 PolarHBondContact O-NE2 3.24Å; L537-Q542 PolarHBondContact O-NE2 3.46Å; M538-Q542 PolarHBondContact O-N 2.75Å; Q542-Q544 VanDerWaalsContact C-N 3.31Å; Q542-Q544 PolarHBondContact O-N 3.24Å; Q542-N545 PolarHBondContact O-N 3.28Å; Q542-V546 WeakPolarHBondContact O-CG2 3.43Å; Q542-V546 PolarHBondContact O-N 2.91Å; Q542-L584 HydrophobicContact CB-CD1 3.84Å; Q542-L584 HydrophobicContact CB-CD2 4.49Å
543	A	91.4	Very high	90.2	Very high	7 Å²	7	59.1 Å²	59.1	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-57.3	-38.8	177.5	0	0	0	0	0	113.4	L539 N545 L580 L584	L539-A543 VanDerWaalsContact O-CB 3.28Å; L539-A543 WeakPolarHBondContact O-CB 3.28Å; L539-A543 PolarHBondContact O-N 2.95Å; A543-N545 VanDerWaalsContact C-N 3.28Å; A543-N545 PolarHBondContact O-N 2.94Å; A543-L580 HydrophobicContact CB-CD2 4.16Å; A543-L580 HydrophobicContact CB-CG 4.26Å; A543-L580 VanDerWaalsContact O-CD2 3.23Å; A543-L580 WeakPolarHBondContact O-CD2 3.41Å; A543-L584 HydrophobicContact CB-CD1 3.99Å
544	Q	87.1	Confident	90.2	Very high	88 Å²	88	60.8 Å²	60.8	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-65.5	-29.5	174.6	-74.5	167.8	-25.2	0	0	113.2	H540 I541 Q542	H540-Q544 WeakPolarHBondContact O-CG 3.29Å; H540-Q544 PolarHBondContact O-N 2.87Å; H540-Q544 VanDerWaalsContact O-N 3.1Å; I541-Q544 PolarHBondContact O-N 2.7Å; Q542-Q544 VanDerWaalsContact C-N 3.31Å; Q542-Q544 PolarHBondContact O-N 3.24Å
545	N	87.2	Confident	90	Very high	115 Å²	115	61.4 Å²	61.4	62%	0.615	31%	0.309	S	S	*	.	H	α-helix	trans	-97.4	-1.9	-173.6	-75.7	-78	0	0	0	114.8	I541 Q542 A543 K547	I541-N545 PolarHBondContact O-N 2.84Å; I541-N545 PolarHBondContact O-ND2 3.33Å; Q542-N545 PolarHBondContact O-N 3.28Å; A543-N545 VanDerWaalsContact C-N 3.28Å; A543-N545 PolarHBondContact O-N 2.94Å; N545-K547 PolarHBondContact O-N 3.37Å
546	V	85.9	Confident	89.7	Confident	35 Å²	35	60.3 Å²	60.3	21%	0.212	30%	0.298	C	S	.	.			trans	-70.2	132.1	-178.4	-165.9	0	0	0	0	111.8	Q542 L580 L584	Q542-V546 WeakPolarHBondContact O-CG2 3.43Å; Q542-V546 PolarHBondContact O-N 2.91Å; V546-L580 HydrophobicContact CB-CD1 4.12Å; V546-L580 HydrophobicContact CB-CD2 4.04Å; V546-L580 HydrophobicContact CG1-CD1 4.13Å; V546-L580 HydrophobicContact CG2-CD1 3.89Å; V546-L580 HydrophobicContact CG2-CD2 3.98Å; V546-L580 HydrophobicContact CG2-CG 4.23Å; V546-L584 HydrophobicContact CG2-CD1 4.05Å; V546-L584 HydrophobicContact CG2-CD2 4.07Å; V546-L584 HydrophobicContact CG2-CG 4.4Å
547	K	82.6	Confident	89.4	Confident	182 Å²	182	59.2 Å²	59.2	79%	0.791	30%	0.299	S	S	*	.	S	Bend	trans	-77.7	163.2	175.6	-62.2	176.4	-175.6	174.2	0	110.5	N545 H549	N545-K547 PolarHBondContact O-N 3.37Å; K547-H549 VanDerWaalsContact C-N 3.27Å; K547-H549 PolarHBondContact O-N 3.21Å; K547-H549 VanDerWaalsContact O-N 3.12Å
548	G	79.6	Confident	89	Confident	61 Å²	61	62.3 Å²	62.3	63%	0.629	32%	0.315	S	S	*	.	S	Bend	trans	84.9	-42.3	-179.6	0	0	0	0	0	114.9	T550	G548-T550 VanDerWaalsContact C-N 3.34Å; G548-T550 PolarHBondContact O-N 3.44Å
549	H	84.3	Confident	88.4	Confident	54 Å²	54	64.4 Å²	64.4	25%	0.25	32%	0.324	C	S	.	.			trans	-69.5	79.9	179.6	-74.8	86.1	0	0	0	112.5	K547 L552 R553 L580 E583	K547-H549 VanDerWaalsContact C-N 3.27Å; K547-H549 PolarHBondContact O-N 3.21Å; K547-H549 VanDerWaalsContact O-N 3.12Å; H549-L552 HydrophobicContact CB-CB 4.37Å; H549-R553 WeakPolarHBondContact O-CB 3.38Å; H549-R553 WeakPolarHBondContact O-CG 3.4Å; H549-R553 PolarHBondContact O-N 3.21Å; H549-R553 PolarHBondContact O-NE 2.77Å; H549-L580 HydrophobicContact CB-CD2 4.47Å; H549-E583 IonicContact CE1-OE2 3.63Å; H549-E583 PolarHBondContact CE1-OE2 3.33Å; H549-E583 VanDerWaalsContact CE1-OE2 3.29Å; H549-E583 IonicContact NE2-OE2 3.57Å
550	T	86	Confident	87.8	Confident	90 Å²	90	69.2 Å²	69.2	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-77.9	-41.3	-173.5	50.4	0	0	0	0	113.3	G548 R553 K554	G548-T550 VanDerWaalsContact C-N 3.34Å; G548-T550 PolarHBondContact O-N 3.44Å; T550-R553 PolarHBondContact O-N 2.96Å; T550-K554 WeakPolarHBondContact O-CG 3.43Å; T550-K554 PolarHBondContact O-N 2.88Å
551	E	91.3	Very high	87.5	Confident	82 Å²	82	74 Å²	74	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-51.7	177.9	-169.6	-176.6	171.2	0	0	111.1	R553 K554 L555 R572 L576	E551-R553 VanDerWaalsContact C-N 3.3Å; E551-R553 PolarHBondContact O-N 2.73Å; E551-K554 WeakPolarHBondContact O-CB 3.2Å; E551-K554 PolarHBondContact O-N 2.87Å; E551-K554 VanDerWaalsContact O-N 3.13Å; E551-L555 HydrophobicContact CG-CD1 4.34Å; E551-L555 WeakPolarHBondContact O-CG 3.26Å; E551-L555 PolarHBondContact O-N 3.12Å; E551-R572 WeakPolarHBondContact OE1-CG 3.43Å; E551-R572 IonicContact OE1-CZ 3.15Å; E551-R572 IonicContact OE1-NE 2.67Å; E551-R572 PolarHBondContact OE1-NE 3.34Å; E551-R572 IonicContact OE1-NH2 2.78Å; E551-R572 PolarHBondContact OE1-NH2 3.15Å; E551-R572 IonicContact OE2-CZ 2.65Å; E551-R572 IonicContact OE2-NE 2.68Å; E551-R572 IonicContact OE2-NH2 3.99Å; E551-R572 PolarHBondContact OE2-NH2 3.06Å; E551-L576 HydrophobicContact CB-CD1 4.11Å; E551-L576 HydrophobicContact CG-CD1 3.78Å
552	L	90.4	Very high	87	Confident	12 Å²	12	75.7 Å²	75.7	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-57.6	-40.5	176.8	-179.7	60.3	0	0	0	112.4	H549 L555 Q556 Y573 L576 K577 L580	H549-L552 HydrophobicContact CB-CB 4.37Å; L552-L555 PolarHBondContact O-N 2.8Å; L552-Q556 WeakPolarHBondContact O-CB 3.48Å; L552-Q556 PolarHBondContact O-N 3.17Å; L552-Y573 HydrophobicContact CD1-CD2 3.57Å; L552-Y573 HydrophobicContact CD1-CE2 3.79Å; L552-Y573 HydrophobicContact CD1-CG 4.46Å; L552-L576 HydrophobicContact CB-CB 4.11Å; L552-L576 HydrophobicContact CB-CD1 4.37Å; L552-L576 HydrophobicContact CD1-CB 3.89Å; L552-L576 HydrophobicContact CD2-CB 4.49Å; L552-L576 HydrophobicContact CG-CB 4.38Å; L552-K577 HydrophobicContact CD1-CB 4.21Å; L552-L580 HydrophobicContact CD2-CB 4.2Å; L552-L580 HydrophobicContact CD2-CD2 3.55Å
553	R	87.6	Confident	86.1	Confident	99 Å²	99	75.3 Å²	75.3	37%	0.374	39%	0.392	S	S	.	.	H	α-helix	trans	-70.7	-33.2	177.4	-76.5	-179.8	-64.9	147.6	2.7	113.3	H549 T550 E551 Q557	H549-R553 WeakPolarHBondContact O-CB 3.38Å; H549-R553 WeakPolarHBondContact O-CG 3.4Å; H549-R553 PolarHBondContact O-N 3.21Å; H549-R553 PolarHBondContact O-NE 2.77Å; T550-R553 PolarHBondContact O-N 2.96Å; E551-R553 VanDerWaalsContact C-N 3.3Å; E551-R553 PolarHBondContact O-N 2.73Å; R553-Q557 VanDerWaalsContact O-CB 3.27Å; R553-Q557 WeakPolarHBondContact O-CB 3.41Å; R553-Q557 PolarHBondContact O-N 3.24Å
554	K	89.8	Confident	85.5	Confident	151 Å²	151	81.1 Å²	81.1	66%	0.657	42%	0.418	S	S	*	.	H	α-helix	trans	-64.4	-43.5	170	-75.4	177.6	177.8	-175.4	0	111.5	T550 E551 Q557 L558	T550-K554 WeakPolarHBondContact O-CG 3.43Å; T550-K554 PolarHBondContact O-N 2.88Å; E551-K554 WeakPolarHBondContact O-CB 3.2Å; E551-K554 PolarHBondContact O-N 2.87Å; E551-K554 VanDerWaalsContact O-N 3.13Å; K554-Q557 PolarHBondContact O-N 3.31Å; K554-L558 VanDerWaalsContact O-CB 3.23Å; K554-L558 WeakPolarHBondContact O-CB 3.22Å; K554-L558 PolarHBondContact O-N 3.42Å
555	L	90.3	Very high	85.3	Confident	13 Å²	13	78.1 Å²	78.1	7%	0.068	40%	0.404	C	S	.	.	H	α-helix	trans	-67.8	-38.4	177.5	-65.8	173.8	0	0	0	112	E551 L552 K559 L565 D569 R572 Y573 L576	E551-L555 HydrophobicContact CG-CD1 4.34Å; E551-L555 WeakPolarHBondContact O-CG 3.26Å; E551-L555 PolarHBondContact O-N 3.12Å; L552-L555 PolarHBondContact O-N 2.8Å; L555-K559 VanDerWaalsContact O-CB 3.26Å; L555-K559 WeakPolarHBondContact O-CB 3.14Å; L555-K559 PolarHBondContact O-N 2.95Å; L555-L565 HydrophobicContact CB-CD1 4.37Å; L555-D569 HydrophobicContact CD2-CB 3.88Å; L555-D569 WeakPolarHBondContact CD2-OD1 3.49Å; L555-R572 HydrophobicContact CD1-CB 4.28Å; L555-R572 HydrophobicContact CD1-CG 4Å; L555-Y573 HydrophobicContact CB-CD2 4.07Å; L555-L576 HydrophobicContact CD1-CD1 4.03Å
556	Q	88.1	Confident	85.3	Confident	31 Å²	31	75.4 Å²	75.4	15%	0.145	39%	0.394	C	S	.	.	H	α-helix	trans	-62.8	-52.6	172.1	-180	63.2	68.5	0	0	111	L552 L558 K559 D560 Y573	L552-Q556 WeakPolarHBondContact O-CB 3.48Å; L552-Q556 PolarHBondContact O-N 3.17Å; Q556-L558 PolarHBondContact O-N 2.81Å; Q556-K559 WeakPolarHBondContact O-CB 3.36Å; Q556-K559 PolarHBondContact O-N 3.33Å; Q556-K559 VanDerWaalsContact O-N 3.11Å; Q556-D560 PolarHBondContact NE2-OD1 2.95Å; Q556-D560 PolarHBondContact NE2-OD2 3.49Å; Q556-D560 VanDerWaalsContact O-CG 3.25Å; Q556-D560 PolarHBondContact O-N 3.3Å; Q556-D560 VanDerWaalsContact O-OD2 3.07Å; Q556-Y573 HydrophobicContact CB-CE2 4.33Å; Q556-Y573 PolarHBondContact OE1-OH 3.39Å; Q556-Y573 VanDerWaalsContact OE1-OH 3.11Å
557	Q	88	Confident	85.3	Confident	110 Å²	110	82.3 Å²	82.3	51%	0.514	43%	0.425	S	S	.	.	H	α-helix	trans	-57.8	-46.8	177.8	178.5	-180	-6.6	0	0	111.6	R553 K554 K559 D560 E561	R553-Q557 VanDerWaalsContact O-CB 3.27Å; R553-Q557 WeakPolarHBondContact O-CB 3.41Å; R553-Q557 PolarHBondContact O-N 3.24Å; K554-Q557 PolarHBondContact O-N 3.31Å; Q557-K559 VanDerWaalsContact C-N 3.3Å; Q557-K559 PolarHBondContact O-N 3.19Å; Q557-D560 PolarHBondContact O-N 3.39Å; Q557-E561 HydrophobicContact CG-CG 4.39Å; Q557-E561 VanDerWaalsContact CG-OE1 3.29Å; Q557-E561 WeakPolarHBondContact CG-OE1 3.38Å; Q557-E561 PolarHBondContact NE2-OE1 3.17Å; Q557-E561 WeakPolarHBondContact O-CB 3.43Å; Q557-E561 WeakPolarHBondContact O-CG 3.39Å; Q557-E561 PolarHBondContact O-N 3.19Å
558	L	87.9	Confident	85.6	Confident	71 Å²	71	79.3 Å²	79.3	37%	0.372	42%	0.417	S	S	.	.	H	α-helix	trans	-57.2	-46.3	176.3	-178.9	62.9	0	0	0	110.4	K554 Q556 D560 E561 T562 L565	K554-L558 VanDerWaalsContact O-CB 3.23Å; K554-L558 WeakPolarHBondContact O-CB 3.22Å; K554-L558 PolarHBondContact O-N 3.42Å; Q556-L558 PolarHBondContact O-N 2.81Å; L558-D560 VanDerWaalsContact C-N 3.34Å; L558-D560 PolarHBondContact O-N 3.11Å; L558-E561 PolarHBondContact O-N 3.28Å; L558-T562 HydrophobicContact CD1-CG2 3.83Å; L558-T562 HydrophobicContact CG-CG2 4.45Å; L558-T562 PolarHBondContact O-N 3.39Å; L558-T562 PolarHBondContact O-OG1 2.91Å; L558-L565 HydrophobicContact CB-CD2 3.99Å; L558-L565 HydrophobicContact CD2-CD2 3.71Å; L558-L565 HydrophobicContact CG-CD2 3.75Å
559	K	85	Confident	86.1	Confident	53 Å²	53	79.1 Å²	79.1	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-61.3	-37.4	177.3	-167.6	166.2	-169.2	154.4	0	113.5	L555 Q556 Q557 G563 L565 D570 Y573	L555-K559 VanDerWaalsContact O-CB 3.26Å; L555-K559 WeakPolarHBondContact O-CB 3.14Å; L555-K559 PolarHBondContact O-N 2.95Å; Q556-K559 WeakPolarHBondContact O-CB 3.36Å; Q556-K559 PolarHBondContact O-N 3.33Å; Q556-K559 VanDerWaalsContact O-N 3.11Å; Q557-K559 VanDerWaalsContact C-N 3.3Å; Q557-K559 PolarHBondContact O-N 3.19Å; K559-G563 CarbonylContact O-C 3.29Å; K559-G563 VanDerWaalsContact O-C 3.29Å; K559-G563 WeakPolarHBondContact O-CA 3.42Å; K559-G563 PolarHBondContact O-N 3.21Å; K559-L565 HydrophobicContact CB-CD1 4.08Å; K559-L565 HydrophobicContact CB-CD2 4.03Å; K559-L565 HydrophobicContact CB-CG 3.78Å; K559-L565 HydrophobicContact CD-CD1 3.93Å; K559-L565 HydrophobicContact CD-CG 4.06Å; K559-L565 HydrophobicContact CG-CD1 4.37Å; K559-L565 HydrophobicContact CG-CG 4.02Å; K559-D570 IonicContact NZ-OD1 2.73Å; K559-D570 PolarHBondContact NZ-OD1 2.92Å; K559-Y573 HydrophobicContact CD-CE1 4.35Å
560	D	83.6	Confident	86.3	Confident	103 Å²	103	77.6 Å²	77.6	55%	0.551	40%	0.395	S	S	*	.	H	α-helix	trans	-74.9	-31.1	177.1	-59.9	-37.7	0	0	0	111.4	Q556 Q557 L558	Q556-D560 PolarHBondContact NE2-OD1 2.95Å; Q556-D560 PolarHBondContact NE2-OD2 3.49Å; Q556-D560 VanDerWaalsContact O-CG 3.25Å; Q556-D560 PolarHBondContact O-N 3.3Å; Q556-D560 VanDerWaalsContact O-OD2 3.07Å; Q557-D560 PolarHBondContact O-N 3.39Å; L558-D560 VanDerWaalsContact C-N 3.34Å; L558-D560 PolarHBondContact O-N 3.11Å
561	E	85.6	Confident	86.5	Confident	110 Å²	110	80 Å²	80	51%	0.514	40%	0.398	S	S	.	.	H	α-helix	trans	-75.8	-41.3	175.8	-74.8	176.4	-168.9	0	0	112.9	K315 Q557 L558	K315-E561 PolarHBondContact NZ-O 3.3Å; Q557-E561 HydrophobicContact CG-CG 4.39Å; Q557-E561 VanDerWaalsContact CG-OE1 3.29Å; Q557-E561 WeakPolarHBondContact CG-OE1 3.38Å; Q557-E561 PolarHBondContact NE2-OE1 3.17Å; Q557-E561 WeakPolarHBondContact O-CB 3.43Å; Q557-E561 WeakPolarHBondContact O-CG 3.39Å; Q557-E561 PolarHBondContact O-N 3.19Å; L558-E561 PolarHBondContact O-N 3.28Å
562	T	81.2	Confident	86.6	Confident	82 Å²	82	80.8 Å²	80.8	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-94.7	-22.3	-178.8	57.5	0	0	0	0	114	L558 E564	L558-T562 HydrophobicContact CD1-CG2 3.83Å; L558-T562 HydrophobicContact CG-CG2 4.45Å; L558-T562 PolarHBondContact O-N 3.39Å; L558-T562 PolarHBondContact O-OG1 2.91Å; T562-E564 WeakPolarHBondContact CB-O 3.42Å; T562-E564 PolarHBondContact O-N 2.91Å; T562-E564 PolarHBondContact OG1-N 2.72Å; T562-E564 PolarHBondContact OG1-O 3.01Å
563	G	75.6	Confident	86.7	Confident	33 Å²	33	81.4 Å²	81.4	34%	0.34	40%	0.399	S	S	.	.	S	Bend	trans	86.6	-39.6	-167.3	0	0	0	0	0	113.1	K559	K559-G563 CarbonylContact O-C 3.29Å; K559-G563 VanDerWaalsContact O-C 3.29Å; K559-G563 WeakPolarHBondContact O-CA 3.42Å; K559-G563 PolarHBondContact O-N 3.21Å
564	E	78.4	Confident	86.8	Confident	129 Å²	129	83.3 Å²	83.3	60%	0.603	41%	0.407	S	S	*	.	S	Bend	trans	-134.5	148.8	-176.3	-60.9	-168.1	169.7	0	0	112.7	T562	T562-E564 WeakPolarHBondContact CB-O 3.42Å; T562-E564 PolarHBondContact O-N 2.91Å; T562-E564 PolarHBondContact OG1-N 2.72Å; T562-E564 PolarHBondContact OG1-O 3.01Å
565	L	83.5	Confident	87	Confident	24 Å²	24	78.6 Å²	78.6	13%	0.126	39%	0.39	C	S	.	.			trans	-101.5	159.3	177.8	-73.3	179	0	0	0	111	L555 L558 K559 D569 D570 Y573	L555-L565 HydrophobicContact CB-CD1 4.37Å; L558-L565 HydrophobicContact CB-CD2 3.99Å; L558-L565 HydrophobicContact CD2-CD2 3.71Å; L558-L565 HydrophobicContact CG-CD2 3.75Å; K559-L565 HydrophobicContact CB-CD1 4.08Å; K559-L565 HydrophobicContact CB-CD2 4.03Å; K559-L565 HydrophobicContact CB-CG 3.78Å; K559-L565 HydrophobicContact CD-CD1 3.93Å; K559-L565 HydrophobicContact CD-CG 4.06Å; K559-L565 HydrophobicContact CG-CD1 4.37Å; K559-L565 HydrophobicContact CG-CG 4.02Å; L565-D569 HydrophobicContact CB-CB 3.96Å; L565-D569 HydrophobicContact CD1-CB 4.37Å; L565-D569 HydrophobicContact CD2-CB 4.22Å; L565-D569 HydrophobicContact CG-CB 4.41Å; L565-D570 HydrophobicContact CB-CB 3.89Å; L565-D570 HydrophobicContact CD1-CB 4.46Å; L565-Y573 HydrophobicContact CD1-CD1 4.42Å; L565-Y573 HydrophobicContact CD1-CD2 4.44Å; L565-Y573 HydrophobicContact CD1-CG 3.98Å
566	S	86.3	Confident	87.1	Confident	58 Å²	58	78.7 Å²	78.7	41%	0.406	39%	0.391	S	S	.	.			trans	-60.2	161	167.5	84.8	0	0	0	0	110.9	D568 D569 D570	S566-D568 VanDerWaalsContact C-N 3.29Å; S566-D568 PolarHBondContact O-N 3.03Å; S566-D569 WeakPolarHBondContact CB-OD2 3.25Å; S566-D569 PolarHBondContact O-N 3.41Å; S566-D569 VanDerWaalsContact OG-CB 3.3Å; S566-D569 WeakPolarHBondContact OG-CB 3.49Å; S566-D569 PolarHBondContact OG-N 3.42Å; S566-D569 VanDerWaalsContact OG-N 3.13Å; S566-D569 PolarHBondContact OG-OD2 3.19Å; S566-D570 WeakPolarHBondContact O-CB 3.28Å; S566-D570 PolarHBondContact O-N 3.07Å
567	Q	85.2	Confident	87.3	Confident	181 Å²	181	78.7 Å²	78.7	85%	0.846	39%	0.39	S	S	*	.	H	α-helix	trans	-61.1	-38.3	-177.2	-63.9	-171.7	8.9	0	0	112.5	K571	Q567-K571 WeakPolarHBondContact O-CB 3.22Å; Q567-K571 PolarHBondContact O-N 3.14Å; Q567-K571 VanDerWaalsContact O-N 3.09Å
568	D	90.2	Very high	87.5	Confident	119 Å²	119	80.6 Å²	80.6	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-73.9	-40.3	176	-73.1	-51	0	0	0	112.1	S566 K571 R572	S566-D568 VanDerWaalsContact C-N 3.29Å; S566-D568 PolarHBondContact O-N 3.03Å; D568-K571 PolarHBondContact O-N 3.14Å; D568-R572 VanDerWaalsContact O-CB 3.3Å; D568-R572 WeakPolarHBondContact O-CB 3.31Å; D568-R572 PolarHBondContact O-N 2.82Å
569	D	90.1	Very high	87.7	Confident	57 Å²	57	82.2 Å²	82.2	31%	0.305	40%	0.398	S	S	.	.	H	α-helix	trans	-63.6	-43.3	175.8	-73.1	-51.7	0	0	0	111.9	L555 L565 S566 R572 Y573	L555-D569 HydrophobicContact CD2-CB 3.88Å; L555-D569 WeakPolarHBondContact CD2-OD1 3.49Å; L565-D569 HydrophobicContact CB-CB 3.96Å; L565-D569 HydrophobicContact CD1-CB 4.37Å; L565-D569 HydrophobicContact CD2-CB 4.22Å; L565-D569 HydrophobicContact CG-CB 4.41Å; S566-D569 WeakPolarHBondContact CB-OD2 3.25Å; S566-D569 PolarHBondContact O-N 3.41Å; S566-D569 VanDerWaalsContact OG-CB 3.3Å; S566-D569 WeakPolarHBondContact OG-CB 3.49Å; S566-D569 PolarHBondContact OG-N 3.42Å; S566-D569 VanDerWaalsContact OG-N 3.13Å; S566-D569 PolarHBondContact OG-OD2 3.19Å; D569-R572 PolarHBondContact O-N 3.34Å; D569-Y573 WeakPolarHBondContact O-CB 3.45Å; D569-Y573 PolarHBondContact O-N 2.87Å
570	D	87.3	Confident	88.1	Confident	22 Å²	22	79.7 Å²	79.7	12%	0.118	39%	0.387	C	S	.	.	H	α-helix	trans	-69.6	-36.3	177.7	-162.5	60.4	0	0	0	111.4	K559 L565 S566 R574	K559-D570 IonicContact NZ-OD1 2.73Å; K559-D570 PolarHBondContact NZ-OD1 2.92Å; L565-D570 HydrophobicContact CB-CB 3.89Å; L565-D570 HydrophobicContact CD1-CB 4.46Å; S566-D570 WeakPolarHBondContact O-CB 3.28Å; S566-D570 PolarHBondContact O-N 3.07Å; D570-R574 WeakPolarHBondContact O-CB 3.34Å; D570-R574 WeakPolarHBondContact O-CG 3.26Å; D570-R574 PolarHBondContact O-N 3.03Å; D570-R574 IonicContact OD2-CZ 3.46Å; D570-R574 IonicContact OD2-NE 3.34Å; D570-R574 PolarHBondContact OD2-NE 2.71Å; D570-R574 IonicContact OD2-NH2 2.72Å; D570-R574 PolarHBondContact OD2-NH2 2.73Å
571	K	91.9	Very high	88.6	Confident	140 Å²	140	74.9 Å²	74.9	61%	0.609	36%	0.362	S	S	*	.	H	α-helix	trans	-62.9	-44.6	172.2	-177.7	-179.6	178.8	-175.7	0	111.2	Q567 D568 R574 V575	Q567-K571 WeakPolarHBondContact O-CB 3.22Å; Q567-K571 PolarHBondContact O-N 3.14Å; Q567-K571 VanDerWaalsContact O-N 3.09Å; D568-K571 PolarHBondContact O-N 3.14Å; K571-R574 PolarHBondContact O-N 2.7Å; K571-V575 WeakPolarHBondContact O-CG2 3.2Å; K571-V575 PolarHBondContact O-N 2.9Å; K571-V575 VanDerWaalsContact O-N 3.13Å
572	R	93.5	Very high	89.1	Confident	99 Å²	99	74.7 Å²	74.7	37%	0.374	36%	0.356	S	S	.	.	H	α-helix	trans	-66.9	-44.6	176.9	-176.3	57.8	176.4	152.7	5.5	111.8	E551 L555 D568 D569 R574 V575 L576	E551-R572 WeakPolarHBondContact OE1-CG 3.43Å; E551-R572 IonicContact OE1-CZ 3.15Å; E551-R572 IonicContact OE1-NE 2.67Å; E551-R572 PolarHBondContact OE1-NE 3.34Å; E551-R572 IonicContact OE1-NH2 2.78Å; E551-R572 PolarHBondContact OE1-NH2 3.15Å; E551-R572 IonicContact OE2-CZ 2.65Å; E551-R572 IonicContact OE2-NE 2.68Å; E551-R572 IonicContact OE2-NH2 3.99Å; E551-R572 PolarHBondContact OE2-NH2 3.06Å; L555-R572 HydrophobicContact CD1-CB 4.28Å; L555-R572 HydrophobicContact CD1-CG 4Å; D568-R572 VanDerWaalsContact O-CB 3.3Å; D568-R572 WeakPolarHBondContact O-CB 3.31Å; D568-R572 PolarHBondContact O-N 2.82Å; D569-R572 PolarHBondContact O-N 3.34Å; R572-R574 PolarHBondContact O-N 3.12Å; R572-V575 PolarHBondContact O-N 2.86Å; R572-L576 HydrophobicContact CG-CD1 3.99Å; R572-L576 WeakPolarHBondContact O-CG 3.34Å; R572-L576 PolarHBondContact O-N 2.7Å
573	Y	90.9	Very high	89.7	Confident	25 Å²	25	75.8 Å²	75.8	10%	0.098	36%	0.356	C	S	.	.	H	α-helix	trans	-57	-45.6	172.5	168.6	-96.3	0	0	0	111.8	L552 L555 Q556 K559 L565 D569 V575 L576 K577	L552-Y573 HydrophobicContact CD1-CD2 3.57Å; L552-Y573 HydrophobicContact CD1-CE2 3.79Å; L552-Y573 HydrophobicContact CD1-CG 4.46Å; L555-Y573 HydrophobicContact CB-CD2 4.07Å; Q556-Y573 HydrophobicContact CB-CE2 4.33Å; Q556-Y573 PolarHBondContact OE1-OH 3.39Å; Q556-Y573 VanDerWaalsContact OE1-OH 3.11Å; K559-Y573 HydrophobicContact CD-CE1 4.35Å; L565-Y573 HydrophobicContact CD1-CD1 4.42Å; L565-Y573 HydrophobicContact CD1-CD2 4.44Å; L565-Y573 HydrophobicContact CD1-CG 3.98Å; D569-Y573 WeakPolarHBondContact O-CB 3.45Å; D569-Y573 PolarHBondContact O-N 2.87Å; Y573-V575 VanDerWaalsContact C-N 3.33Å; Y573-V575 PolarHBondContact O-N 2.66Å; Y573-L576 PolarHBondContact O-N 3.18Å; Y573-K577 WeakPolarHBondContact O-CB 3.5Å; Y573-K577 PolarHBondContact O-N 3Å
574	R	90	Very high	90.6	Very high	139 Å²	139	75.6 Å²	75.6	53%	0.525	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-36.7	175.8	-75.8	173	-161.8	-155.7	9.3	112.6	D570 K571 R572 R578	D570-R574 WeakPolarHBondContact O-CB 3.34Å; D570-R574 WeakPolarHBondContact O-CG 3.26Å; D570-R574 PolarHBondContact O-N 3.03Å; D570-R574 IonicContact OD2-CZ 3.46Å; D570-R574 IonicContact OD2-NE 3.34Å; D570-R574 PolarHBondContact OD2-NE 2.71Å; D570-R574 IonicContact OD2-NH2 2.72Å; D570-R574 PolarHBondContact OD2-NH2 2.73Å; K571-R574 PolarHBondContact O-N 2.7Å; R572-R574 PolarHBondContact O-N 3.12Å; R574-R578 VanDerWaalsContact O-CD 3.25Å; R574-R578 WeakPolarHBondContact O-CD 3.25Å; R574-R578 WeakPolarHBondContact O-CG 3.48Å; R574-R578 PolarHBondContact O-N 2.91Å
575	V	93.7	Very high	91.5	Very high	52 Å²	52	69.5 Å²	69.5	32%	0.315	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-55.3	175.3	170.3	0	0	0	0	110.1	K571 R572 Y573 K577 R578 E579	K571-V575 WeakPolarHBondContact O-CG2 3.2Å; K571-V575 PolarHBondContact O-N 2.9Å; K571-V575 VanDerWaalsContact O-N 3.13Å; R572-V575 PolarHBondContact O-N 2.86Å; Y573-V575 VanDerWaalsContact C-N 3.33Å; Y573-V575 PolarHBondContact O-N 2.66Å; V575-K577 PolarHBondContact O-N 2.97Å; V575-R578 WeakPolarHBondContact O-CB 3.19Å; V575-R578 PolarHBondContact O-N 3.35Å; V575-E579 HydrophobicContact CG1-CG 4.41Å; V575-E579 WeakPolarHBondContact CG1-OE1 3.37Å; V575-E579 WeakPolarHBondContact O-CG 3.17Å; V575-E579 PolarHBondContact O-N 3.11Å
576	L	93.2	Very high	92.1	Very high	15 Å²	15	72.5 Å²	72.5	8%	0.079	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-40.1	-178.7	-70.9	168.3	0	0	0	113	E551 L552 L555 R572 Y573 R578 E579 L580	E551-L576 HydrophobicContact CB-CD1 4.11Å; E551-L576 HydrophobicContact CG-CD1 3.78Å; L552-L576 HydrophobicContact CB-CB 4.11Å; L552-L576 HydrophobicContact CB-CD1 4.37Å; L552-L576 HydrophobicContact CD1-CB 3.89Å; L552-L576 HydrophobicContact CD2-CB 4.49Å; L552-L576 HydrophobicContact CG-CB 4.38Å; L555-L576 HydrophobicContact CD1-CD1 4.03Å; R572-L576 HydrophobicContact CG-CD1 3.99Å; R572-L576 WeakPolarHBondContact O-CG 3.34Å; R572-L576 PolarHBondContact O-N 2.7Å; Y573-L576 PolarHBondContact O-N 3.18Å; L576-R578 VanDerWaalsContact C-N 3.34Å; L576-R578 PolarHBondContact O-N 3.31Å; L576-E579 PolarHBondContact O-N 3Å; L576-L580 WeakPolarHBondContact O-CB 3.31Å; L576-L580 PolarHBondContact O-N 3.39Å
577	K	91.9	Very high	92.5	Very high	31 Å²	31	72.2 Å²	72.2	14%	0.135	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-40.4	174	178.1	168.8	171	174.6	0	111	E528 L552 Y573 V575 E581	E528-K577 IonicContact OE2-NZ 3.85Å; E528-K577 PolarHBondContact OE2-NZ 2.8Å; L552-K577 HydrophobicContact CD1-CB 4.21Å; Y573-K577 WeakPolarHBondContact O-CB 3.5Å; Y573-K577 PolarHBondContact O-N 3Å; V575-K577 PolarHBondContact O-N 2.97Å; K577-E581 WeakPolarHBondContact CE-OE1 3.35Å; K577-E581 HydrophobicContact CG-CG 4.15Å; K577-E581 IonicContact NZ-OE1 2.65Å; K577-E581 VanDerWaalsContact O-CB 3.26Å; K577-E581 WeakPolarHBondContact O-CB 3.45Å; K577-E581 VanDerWaalsContact O-CG 3.22Å; K577-E581 WeakPolarHBondContact O-CG 2.92Å; K577-E581 PolarHBondContact O-N 3.42Å
578	R	91.7	Very high	93	Very high	149 Å²	149	63.7 Å²	63.7	56%	0.562	29%	0.294	S	S	*	.	H	α-helix	trans	-68.4	-38.2	177.4	-73.2	166.1	-178.9	165.1	-4.4	112.6	R574 V575 L576 R582	R574-R578 VanDerWaalsContact O-CD 3.25Å; R574-R578 WeakPolarHBondContact O-CD 3.25Å; R574-R578 WeakPolarHBondContact O-CG 3.48Å; R574-R578 PolarHBondContact O-N 2.91Å; V575-R578 WeakPolarHBondContact O-CB 3.19Å; V575-R578 PolarHBondContact O-N 3.35Å; L576-R578 VanDerWaalsContact C-N 3.34Å; L576-R578 PolarHBondContact O-N 3.31Å; R578-R582 VanDerWaalsContact O-CB 3.26Å; R578-R582 WeakPolarHBondContact O-CB 3.38Å; R578-R582 PolarHBondContact O-N 2.64Å
579	E	92.5	Very high	93.4	Very high	105 Å²	105	60.1 Å²	60.1	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-45.5	176.3	-71.8	168.2	165.1	0	0	110.4	V575 L576 R582 E583	V575-E579 HydrophobicContact CG1-CG 4.41Å; V575-E579 WeakPolarHBondContact CG1-OE1 3.37Å; V575-E579 WeakPolarHBondContact O-CG 3.17Å; V575-E579 PolarHBondContact O-N 3.11Å; L576-E579 PolarHBondContact O-N 3Å; E579-R582 WeakPolarHBondContact O-CB 3.42Å; E579-R582 PolarHBondContact O-N 3.28Å; E579-E583 PolarHBondContact O-N 2.92Å
580	L	93.8	Very high	93.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-70.7	-40.1	175.8	-174.8	55.1	0	0	0	113.8	A543 V546 H549 L552 L576 R582 E583 L584	A543-L580 HydrophobicContact CB-CD2 4.16Å; A543-L580 HydrophobicContact CB-CG 4.26Å; A543-L580 VanDerWaalsContact O-CD2 3.23Å; A543-L580 WeakPolarHBondContact O-CD2 3.41Å; V546-L580 HydrophobicContact CB-CD1 4.12Å; V546-L580 HydrophobicContact CB-CD2 4.04Å; V546-L580 HydrophobicContact CG1-CD1 4.13Å; V546-L580 HydrophobicContact CG2-CD1 3.89Å; V546-L580 HydrophobicContact CG2-CD2 3.98Å; V546-L580 HydrophobicContact CG2-CG 4.23Å; H549-L580 HydrophobicContact CB-CD2 4.47Å; L552-L580 HydrophobicContact CD2-CB 4.2Å; L552-L580 HydrophobicContact CD2-CD2 3.55Å; L576-L580 WeakPolarHBondContact O-CB 3.31Å; L576-L580 PolarHBondContact O-N 3.39Å; L580-R582 PolarHBondContact O-N 3.27Å; L580-E583 HydrophobicContact CD1-CB 4.45Å; L580-E583 PolarHBondContact O-N 3.08Å; L580-L584 HydrophobicContact CD1-CG 4.41Å; L580-L584 HydrophobicContact CG-CD1 4.37Å; L580-L584 WeakPolarHBondContact O-CG 3.35Å; L580-L584 PolarHBondContact O-N 3.37Å
581	E	95	Very high	94.3	Very high	3 Å²	3	56.3 Å²	56.3	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-55.1	-40.8	170.9	-81.4	-179	158.2	0	0	110.1	R525 L539 K577 L585 R602	R525-E581 IonicContact NH1-OE1 2.7Å; R525-E581 IonicContact NH2-OE1 3.46Å; R525-E581 IonicContact NH2-OE2 3.29Å; R525-E581 PolarHBondContact NH2-OE2 2.94Å; L539-E581 HydrophobicContact CD2-CB 4.08Å; L539-E581 HydrophobicContact CD2-CG 4.02Å; L539-E581 HydrophobicContact CG-CB 4.4Å; L539-E581 HydrophobicContact CG-CG 4.09Å; K577-E581 WeakPolarHBondContact CE-OE1 3.35Å; K577-E581 HydrophobicContact CG-CG 4.15Å; K577-E581 IonicContact NZ-OE1 2.65Å; K577-E581 VanDerWaalsContact O-CB 3.26Å; K577-E581 WeakPolarHBondContact O-CB 3.45Å; K577-E581 VanDerWaalsContact O-CG 3.22Å; K577-E581 WeakPolarHBondContact O-CG 2.92Å; K577-E581 PolarHBondContact O-N 3.42Å; E581-L585 WeakPolarHBondContact O-CB 3.39Å; E581-L585 WeakPolarHBondContact O-CD1 3.31Å; E581-L585 VanDerWaalsContact O-CG 3.3Å; E581-L585 WeakPolarHBondContact O-CG 3.25Å; E581-L585 PolarHBondContact O-N 3.44Å; E581-L585 VanDerWaalsContact O-N 3.16Å; E581-R602 IonicContact OE1-NH1 2.79Å; E581-R602 WeakPolarHBondContact OE2-CD 3.44Å
582	R	94.5	Very high	94.6	Very high	105 Å²	105	49.7 Å²	49.7	40%	0.396	23%	0.226	S	C	.	.	H	α-helix	trans	-72	-39.6	177.9	-172.2	179.9	-173.1	80	8.6	112.7	R578 E579 L580 L585 M586	R578-R582 VanDerWaalsContact O-CB 3.26Å; R578-R582 WeakPolarHBondContact O-CB 3.38Å; R578-R582 PolarHBondContact O-N 2.64Å; E579-R582 WeakPolarHBondContact O-CB 3.42Å; E579-R582 PolarHBondContact O-N 3.28Å; L580-R582 PolarHBondContact O-N 3.27Å; R582-L585 PolarHBondContact O-N 3.17Å; R582-M586 HydrophobicContact CG-CG 4.48Å; R582-M586 WeakPolarHBondContact O-CB 3.41Å; R582-M586 WeakPolarHBondContact O-CG 3.4Å; R582-M586 PolarHBondContact O-N 3.44Å
583	E	94.5	Very high	94.9	Very high	105 Å²	105	45 Å²	45	49%	0.491	21%	0.208	S	C	.	.	H	α-helix	trans	-59.8	-49.6	175.3	-171.2	-171.2	163.6	0	0	111	H549 E579 L580 L585 M586 A587	H549-E583 IonicContact CE1-OE2 3.63Å; H549-E583 PolarHBondContact CE1-OE2 3.33Å; H549-E583 VanDerWaalsContact CE1-OE2 3.29Å; H549-E583 IonicContact NE2-OE2 3.57Å; E579-E583 PolarHBondContact O-N 2.92Å; L580-E583 HydrophobicContact CD1-CB 4.45Å; L580-E583 PolarHBondContact O-N 3.08Å; E583-L585 PolarHBondContact O-N 3.09Å; E583-M586 CarbonylContact O-C 3.53Å; E583-M586 PolarHBondContact O-N 3.43Å; E583-M586 VanDerWaalsContact O-N 3.12Å; E583-A587 WeakPolarHBondContact O-CB 3.44Å; E583-A587 PolarHBondContact O-N 2.96Å
584	L	95.6	Very high	95.2	Very high	29 Å²	29	43.9 Å²	43.9	15%	0.152	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-45.2	178.7	-70.7	168.4	0	0	0	112.1	L539 Q542 A543 V546 L580 M586 A587 A588	L539-L584 HydrophobicContact CD1-CB 3.67Å; L539-L584 HydrophobicContact CD1-CD1 3.94Å; L539-L584 HydrophobicContact CD1-CG 4.47Å; Q542-L584 HydrophobicContact CB-CD1 3.84Å; Q542-L584 HydrophobicContact CB-CD2 4.49Å; A543-L584 HydrophobicContact CB-CD1 3.99Å; V546-L584 HydrophobicContact CG2-CD1 4.05Å; V546-L584 HydrophobicContact CG2-CD2 4.07Å; V546-L584 HydrophobicContact CG2-CG 4.4Å; L580-L584 HydrophobicContact CD1-CG 4.41Å; L580-L584 HydrophobicContact CG-CD1 4.37Å; L580-L584 WeakPolarHBondContact O-CG 3.35Å; L580-L584 PolarHBondContact O-N 3.37Å; L584-M586 VanDerWaalsContact C-N 3.29Å; L584-M586 PolarHBondContact O-N 3.22Å; L584-A587 PolarHBondContact O-N 2.78Å; L584-A587 VanDerWaalsContact O-N 3.17Å; L584-A588 PolarHBondContact O-N 3.02Å
585	L	96.7	Very high	95.6	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-64.8	-31.3	175	-73.9	168.6	0	0	0	113	K494 V520 L539 E581 R582 E583 V591 R602 L603 L606	K494-L585 WeakPolarHBondContact CE-O 3.04Å; V520-L585 HydrophobicContact CB-CD2 4.49Å; V520-L585 HydrophobicContact CG1-CD2 3.82Å; L539-L585 HydrophobicContact CD1-CG 4.13Å; L539-L585 HydrophobicContact CD2-CD1 3.71Å; L539-L585 HydrophobicContact CD2-CD2 4.31Å; L539-L585 HydrophobicContact CD2-CG 3.93Å; E581-L585 WeakPolarHBondContact O-CB 3.39Å; E581-L585 WeakPolarHBondContact O-CD1 3.31Å; E581-L585 VanDerWaalsContact O-CG 3.3Å; E581-L585 WeakPolarHBondContact O-CG 3.25Å; E581-L585 PolarHBondContact O-N 3.44Å; E581-L585 VanDerWaalsContact O-N 3.16Å; R582-L585 PolarHBondContact O-N 3.17Å; E583-L585 PolarHBondContact O-N 3.09Å; L585-V591 HydrophobicContact CD2-CG1 3.99Å; L585-V591 HydrophobicContact CD2-CG2 3.87Å; L585-R602 HydrophobicContact CD1-CB 4.06Å; L585-R602 WeakPolarHBondContact CD1-O 3.46Å; L585-L603 HydrophobicContact CD1-CD2 4.31Å; L585-L603 HydrophobicContact CD2-CD2 4.02Å; L585-L606 HydrophobicContact CB-CD1 3.98Å; L585-L606 HydrophobicContact CD1-CD1 4.44Å; L585-L606 HydrophobicContact CD2-CD1 4.49Å
586	M	95	Very high	95.7	Very high	88 Å²	88	35.3 Å²	35.3	43%	0.433	17%	0.167	S	C	.	.	H	α-helix	trans	-75.9	-28.2	172.6	-74.3	-68.6	-172	0	0	113	K494 R582 E583 L584 L606	K494-M586 WeakPolarHBondContact CE-O 3.32Å; K494-M586 PolarHBondContact NZ-O 3.25Å; R582-M586 HydrophobicContact CG-CG 4.48Å; R582-M586 WeakPolarHBondContact O-CB 3.41Å; R582-M586 WeakPolarHBondContact O-CG 3.4Å; R582-M586 PolarHBondContact O-N 3.44Å; E583-M586 CarbonylContact O-C 3.53Å; E583-M586 PolarHBondContact O-N 3.43Å; E583-M586 VanDerWaalsContact O-N 3.12Å; L584-M586 VanDerWaalsContact C-N 3.29Å; L584-M586 PolarHBondContact O-N 3.22Å; M586-L606 HydrophobicContact CE-CD2 3.58Å; M586-L606 HydrophobicContact CG-CD2 4.22Å; M586-L606 HydrophobicContact SD-CD2 3.61Å
587	A	94.9	Very high	95.9	Very high	52 Å²	52	34.9 Å²	34.9	43%	0.43	17%	0.165	S	C	.	.	H	α-helix	trans	-83.3	-15.4	177.3	0	0	0	0	0	114.2	K518 E583 L584	K518-A587 WeakPolarHBondContact CD-O 3.45Å; E583-A587 WeakPolarHBondContact O-CB 3.44Å; E583-A587 PolarHBondContact O-N 2.96Å; L584-A587 PolarHBondContact O-N 2.78Å; L584-A587 VanDerWaalsContact O-N 3.17Å
588	A	97	Very high	96.1	Very high	2 Å²	2	33.7 Å²	33.7	2%	0.017	16%	0.161	C	C	.	.			trans	-66.5	147.3	-179.4	0	0	0	0	0	114	K494 V520 L584 V591	K494-A588 WeakPolarHBondContact CE-O 3.14Å; K494-A588 WeakPolarHBondContact CG-O 3.48Å; K494-A588 PolarHBondContact NZ-O 2.84Å; V520-A588 HydrophobicContact CB-CB 4.17Å; V520-A588 HydrophobicContact CG2-CB 3.59Å; L584-A588 PolarHBondContact O-N 3.02Å; A588-V591 HydrophobicContact CB-CG2 4.08Å
589	D	98	Very high	96.2	Very high	43 Å²	43	28 Å²	28	23%	0.23	15%	0.149	C	C	.	.	S	Bend	trans	-89.2	-35	167.1	-65.7	-49	0	0	0	110.9	K494 V495 L517 K518	K494-D589 WeakPolarHBondContact CA-O 3.44Å; V495-D589 PolarHBondContact N-O 2.91Å; L517-D589 HydrophobicContact CB-CB 4.2Å; L517-D589 HydrophobicContact CD2-CB 4.29Å; K518-D589 HydrophobicContact CB-CB 4.3Å; K518-D589 VanDerWaalsContact CB-OD2 3.24Å; K518-D589 WeakPolarHBondContact CB-OD2 3.48Å; K518-D589 WeakPolarHBondContact CG-OD2 3.33Å; K518-D589 PolarHBondContact N-OD2 3.02Å; K518-D589 PolarHBondContact O-N 2.57Å
590	V	98.3	Very high	96.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.7	-178.5	-172.9	0	0	0	0	109.4	V484 V495 V497 I512 L517 K518 V519 V520	V484-V590 HydrophobicContact CG1-CB 4.4Å; V484-V590 HydrophobicContact CG1-CG1 3.89Å; V484-V590 HydrophobicContact CG1-CG2 3.55Å; V495-V590 WeakPolarHBondContact O-CA 3.34Å; V497-V590 HydrophobicContact CB-CG1 4.22Å; V497-V590 HydrophobicContact CG2-CG1 3.56Å; I512-V590 HydrophobicContact CD1-CG1 4.39Å; I512-V590 HydrophobicContact CG2-CB 4.33Å; I512-V590 HydrophobicContact CG2-CG1 4.34Å; I512-V590 HydrophobicContact CG2-CG2 3.98Å; L517-V590 HydrophobicContact CB-CG2 4.4Å; L517-V590 HydrophobicContact CD1-CG2 3.74Å; K518-V590 PolarHBondContact O-N 3.25Å; V519-V590 WeakPolarHBondContact CA-O 2.71Å; V519-V590 HydrophobicContact CG2-CB 4.45Å; V520-V590 PolarHBondContact N-O 2.87Å
591	V	98.4	Very high	96.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129	170	-180	0	0	0	0	108.9	V495 L496 V497 V520 L585 A588 L603 F608	V495-V591 PolarHBondContact O-N 2.89Å; V495-V591 VanDerWaalsContact O-N 3.15Å; L496-V591 HydrophobicContact CD1-CB 4.47Å; V497-V591 PolarHBondContact N-O 2.93Å; V520-V591 WeakPolarHBondContact O-CA 3.34Å; L585-V591 HydrophobicContact CD2-CG1 3.99Å; L585-V591 HydrophobicContact CD2-CG2 3.87Å; A588-V591 HydrophobicContact CB-CG2 4.08Å; V591-L603 HydrophobicContact CG1-CD2 3.94Å; V591-F608 HydrophobicContact CB-CE1 3.77Å; V591-F608 HydrophobicContact CB-CZ 4.01Å; V591-F608 HydrophobicContact CG2-CE1 3.73Å; V591-F608 HydrophobicContact CG2-CZ 3.96Å
592	C	98.5	Very high	96.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.6	-177.6	-63.6	0	0	0	0	110.7	V497 V505 C509 V520 R521 L522	V497-C592 VanDerWaalsContact O-CA 3.26Å; V497-C592 WeakPolarHBondContact O-CA 3.42Å; V505-C592 HydrophobicContact CG1-CB 4.01Å; C509-C592 WeakPolarHBondContact SG-CB 3.26Å; V520-C592 PolarHBondContact O-N 3.08Å; R521-C592 CarbonylContact C-O 3.56Å; R521-C592 WeakPolarHBondContact CA-O 2.81Å; R521-C592 VanDerWaalsContact CD-O 3.26Å; R521-C592 WeakPolarHBondContact CD-O 3.31Å; L522-C592 PolarHBondContact N-O 2.67Å
593	C	98.1	Very high	96.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	175	178	70.1	0	0	0	0	111.8	V497 V498 V505 L522 T597	V497-C593 PolarHBondContact O-N 3.35Å; V498-C593 WeakPolarHBondContact CA-O 3.42Å; V498-C593 WeakPolarHBondContact CB-O 3.44Å; V498-C593 WeakPolarHBondContact CG1-O 3.43Å; V505-C593 VanDerWaalsContact CG2-O 3.23Å; V505-C593 WeakPolarHBondContact CG2-O 3.3Å; L522-C593 HydrophobicContact CB-CB 3.99Å; L522-C593 WeakPolarHBondContact O-CB 3Å; C593-T597 HydrophobicContact CB-CG2 3.77Å
594	T	97.3	Very high	96	Very high	2 Å²	2	23 Å²	23	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	158.7	170.6	63.5	0	0	0	0	111.1	A499 P500 N502 V505 V596 T597 A598	A499-T594 CarbonylContact O-C 3.55Å; A499-T594 WeakPolarHBondContact O-CA 3.33Å; P500-T594 WeakPolarHBondContact O-CB 3.47Å; P500-T594 WeakPolarHBondContact O-CG2 3.26Å; N502-T594 WeakPolarHBondContact OD1-CG2 3.21Å; V505-T594 HydrophobicContact CG2-CG2 4.03Å; T594-V596 VanDerWaalsContact C-N 3.3Å; T594-V596 PolarHBondContact O-N 3.37Å; T594-T597 CarbonylContact O-C 3.55Å; T594-T597 WeakPolarHBondContact O-CA 3.2Å; T594-T597 WeakPolarHBondContact O-CB 3.33Å; T594-T597 PolarHBondContact O-N 3.15Å; T594-T597 WeakPolarHBondContact OG1-CB 3.42Å; T594-T597 PolarHBondContact OG1-N 3.33Å; T594-T597 PolarHBondContact OG1-OG1 3.22Å; T594-A598 PolarHBondContact O-N 3.15Å
595	C	98	Very high	95.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-48.1	177.2	-64.4	0	0	0	0	111.9	A499 T597 A598 E623 I626	A499-C595 VanDerWaalsContact C-SG 3.52Å; A499-C595 PolarHBondContact O-N 2.76Å; C595-T597 VanDerWaalsContact C-N 3.31Å; C595-T597 PolarHBondContact O-N 3.33Å; C595-A598 VanDerWaalsContact O-CB 3.32Å; C595-A598 WeakPolarHBondContact O-CB 3.35Å; C595-A598 PolarHBondContact O-N 2.79Å; C595-E623 HydrophobicContact CB-CG 3.49Å; C595-E623 VanDerWaalsContact CB-CG 3.49Å; C595-I626 WeakPolarHBondContact O-CG2 3.32Å
596	V	96.8	Very high	95.3	Very high	11 Å²	11	32.6 Å²	32.6	7%	0.067	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-60	-36.2	172.1	176	0	0	0	0	112.8	P396 R399 T594 A598 G599 E623 I626	P396-V596 HydrophobicContact CB-CG1 4.04Å; P396-V596 HydrophobicContact CB-CG2 4.14Å; P396-V596 HydrophobicContact CG-CG1 4.29Å; R399-V596 WeakPolarHBondContact CD-O 3.44Å; R399-V596 PolarHBondContact NH1-O 2.9Å; T594-V596 VanDerWaalsContact C-N 3.3Å; T594-V596 PolarHBondContact O-N 3.37Å; V596-A598 VanDerWaalsContact C-N 3.27Å; V596-A598 PolarHBondContact O-N 2.82Å; V596-G599 PolarHBondContact O-N 2.97Å; V596-E623 HydrophobicContact CG2-CG 4.23Å; V596-I626 HydrophobicContact CG2-CD1 4.33Å
597	T	96.4	Very high	95	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.037	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-72.3	-17.9	179.5	-55.7	0	0	0	0	113	L522 C593 T594 C595 G599 D600	L522-T597 HydrophobicContact CD2-CG2 4.05Å; L522-T597 HydrophobicContact CG-CG2 3.91Å; C593-T597 HydrophobicContact CB-CG2 3.77Å; T594-T597 CarbonylContact O-C 3.55Å; T594-T597 WeakPolarHBondContact O-CA 3.2Å; T594-T597 WeakPolarHBondContact O-CB 3.33Å; T594-T597 PolarHBondContact O-N 3.15Å; T594-T597 WeakPolarHBondContact OG1-CB 3.42Å; T594-T597 PolarHBondContact OG1-N 3.33Å; T594-T597 PolarHBondContact OG1-OG1 3.22Å; C595-T597 VanDerWaalsContact C-N 3.31Å; C595-T597 PolarHBondContact O-N 3.33Å; T597-G599 PolarHBondContact O-N 2.75Å; T597-G599 VanDerWaalsContact O-N 3.16Å; T597-D600 HydrophobicContact CG2-CB 4.45Å; T597-D600 VanDerWaalsContact O-CB 3.22Å; T597-D600 WeakPolarHBondContact O-CB 3.44Å; T597-D600 PolarHBondContact O-N 3.3Å
598	A	96.8	Very high	95.1	Very high	6 Å²	6	30.6 Å²	30.6	5%	0.05	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-61.3	-23.5	174.8	0	0	0	0	0	113.3	L496 V498 T594 C595 V596 D600 I626 P627	L496-A598 HydrophobicContact CD2-CB 4.29Å; V498-A598 HydrophobicContact CG1-CB 4.36Å; T594-A598 PolarHBondContact O-N 3.15Å; C595-A598 VanDerWaalsContact O-CB 3.32Å; C595-A598 WeakPolarHBondContact O-CB 3.35Å; C595-A598 PolarHBondContact O-N 2.79Å; V596-A598 VanDerWaalsContact C-N 3.27Å; V596-A598 PolarHBondContact O-N 2.82Å; A598-D600 VanDerWaalsContact C-N 3.32Å; A598-D600 PolarHBondContact O-N 2.77Å; A598-I626 HydrophobicContact CB-CG2 4.25Å; A598-P627 HydrophobicContact CB-CB 3.82Å
599	G	94.9	Very high	95	Very high	30 Å²	30	32.5 Å²	32.5	31%	0.309	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-86.4	20.3	172	0	0	0	0	0	115.3	R399 V596 T597	R399-G599 VanDerWaalsContact CZ-O 3.26Å; R399-G599 VanDerWaalsContact NE-C 3.34Å; R399-G599 PolarHBondContact NE-O 3.1Å; R399-G599 PolarHBondContact NH2-O 3.45Å; V596-G599 PolarHBondContact O-N 2.97Å; T597-G599 PolarHBondContact O-N 2.75Å; T597-G599 VanDerWaalsContact O-N 3.16Å
600	D	95	Very high	94.9	Very high	16 Å²	16	30.5 Å²	30.5	9%	0.086	17%	0.165	C	C	.	.			trans	-79.5	134.7	174.3	-170.2	-65.2	0	0	0	111.3	L522 T597 A598 R602 L603	L522-D600 HydrophobicContact CD2-CB 4.15Å; T597-D600 HydrophobicContact CG2-CB 4.45Å; T597-D600 VanDerWaalsContact O-CB 3.22Å; T597-D600 WeakPolarHBondContact O-CB 3.44Å; T597-D600 PolarHBondContact O-N 3.3Å; A598-D600 VanDerWaalsContact C-N 3.32Å; A598-D600 PolarHBondContact O-N 2.77Å; D600-R602 PolarHBondContact O-N 3.24Å; D600-R602 VanDerWaalsContact OD1-CB 3.31Å; D600-R602 WeakPolarHBondContact OD1-CB 3.5Å; D600-R602 WeakPolarHBondContact OD1-CG 3.18Å; D600-R602 IonicContact OD1-CZ 3.23Å; D600-R602 PolarHBondContact OD1-N 2.7Å; D600-R602 IonicContact OD1-NE 3.94Å; D600-R602 PolarHBondContact OD1-NE 2.64Å; D600-R602 IonicContact OD1-NH2 3.97Å; D600-R602 IonicContact OD2-CZ 3.03Å; D600-R602 IonicContact OD2-NE 3.98Å; D600-R602 PolarHBondContact OD2-NE 2.85Å; D600-R602 IonicContact OD2-NH2 3.56Å; D600-R602 PolarHBondContact OD2-NH2 3.45Å; D600-L603 PolarHBondContact O-N 3.3Å
601	A	93.4	Very high	94.9	Very high	64 Å²	64	30.5 Å²	30.5	53%	0.529	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-58.6	-17.1	-177.6	0	0	0	0	0	114.2	L603 E604	A601-L603 PolarHBondContact O-N 2.85Å; A601-E604 WeakPolarHBondContact O-CB 3.38Å; A601-E604 PolarHBondContact O-N 3.1Å
602	R	94.1	Very high	94.9	Very high	25 Å²	25	30.5 Å²	30.5	9%	0.094	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-65.9	-22.7	170.8	-71.8	171.5	-79.5	-175.2	9.1	113.4	C523 E528 E581 L585 D600	C523-R602 PolarHBondContact O-NH2 2.8Å; E528-R602 IonicContact OE1-CZ 3.85Å; E528-R602 IonicContact OE1-NH1 3.8Å; E528-R602 PolarHBondContact OE1-NH1 3.47Å; E528-R602 IonicContact OE1-NH2 3.87Å; E581-R602 IonicContact OE1-NH1 2.79Å; E581-R602 WeakPolarHBondContact OE2-CD 3.44Å; L585-R602 HydrophobicContact CD1-CB 4.06Å; L585-R602 WeakPolarHBondContact CD1-O 3.46Å; D600-R602 PolarHBondContact O-N 3.24Å; D600-R602 VanDerWaalsContact OD1-CB 3.31Å; D600-R602 WeakPolarHBondContact OD1-CB 3.5Å; D600-R602 WeakPolarHBondContact OD1-CG 3.18Å; D600-R602 IonicContact OD1-CZ 3.23Å; D600-R602 PolarHBondContact OD1-N 2.7Å; D600-R602 IonicContact OD1-NE 3.94Å; D600-R602 PolarHBondContact OD1-NE 2.64Å; D600-R602 IonicContact OD1-NH2 3.97Å; D600-R602 IonicContact OD2-CZ 3.03Å; D600-R602 IonicContact OD2-NE 3.98Å; D600-R602 PolarHBondContact OD2-NE 2.85Å; D600-R602 IonicContact OD2-NH2 3.56Å; D600-R602 PolarHBondContact OD2-NH2 3.45Å
603	L	94.1	Very high	94.9	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.031	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-92.5	-8.5	176.4	-58	179.7	0	0	0	113.3	L522 L585 V591 D600 A601 R605 L606 F608	L522-L603 HydrophobicContact CD2-CD1 3.76Å; L522-L603 HydrophobicContact CD2-CD2 3.74Å; L522-L603 HydrophobicContact CD2-CG 3.57Å; L585-L603 HydrophobicContact CD1-CD2 4.31Å; L585-L603 HydrophobicContact CD2-CD2 4.02Å; V591-L603 HydrophobicContact CG1-CD2 3.94Å; D600-L603 PolarHBondContact O-N 3.3Å; A601-L603 PolarHBondContact O-N 2.85Å; L603-R605 PolarHBondContact O-N 2.84Å; L603-L606 HydrophobicContact CB-CD1 4.38Å; L603-L606 HydrophobicContact CD2-CD1 3.66Å; L603-L606 WeakPolarHBondContact O-CB 3.38Å; L603-L606 PolarHBondContact O-N 2.97Å; L603-L606 VanDerWaalsContact O-N 3.09Å; L603-F608 HydrophobicContact CD2-CZ 4.37Å
604	E	88.5	Confident	94.9	Very high	102 Å²	102	30.8 Å²	30.8	48%	0.477	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	135.7	176.6	-74.5	173.1	-157	0	0	111.4	A601 L606	A601-E604 WeakPolarHBondContact O-CB 3.38Å; A601-E604 PolarHBondContact O-N 3.1Å; E604-L606 PolarHBondContact O-N 2.9Å
605	R	85.4	Confident	94.8	Very high	215 Å²	215	32.4 Å²	32.4	81%	0.811	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	12.1	-176	-39.2	175.8	-167.8	-175.9	0.5	114.3	L603	L603-R605 PolarHBondContact O-N 2.84Å
606	L	91.7	Very high	94.8	Very high	17 Å²	17	32.4 Å²	32.4	9%	0.089	17%	0.174	C	C	.	.			trans	-83.1	155.6	155.4	-56.8	179.4	0	0	0	109	L585 M586 L603 E604 F608	L585-L606 HydrophobicContact CB-CD1 3.98Å; L585-L606 HydrophobicContact CD1-CD1 4.44Å; L585-L606 HydrophobicContact CD2-CD1 4.49Å; M586-L606 HydrophobicContact CE-CD2 3.58Å; M586-L606 HydrophobicContact CG-CD2 4.22Å; M586-L606 HydrophobicContact SD-CD2 3.61Å; L603-L606 HydrophobicContact CB-CD1 4.38Å; L603-L606 HydrophobicContact CD2-CD1 3.66Å; L603-L606 WeakPolarHBondContact O-CB 3.38Å; L603-L606 PolarHBondContact O-N 2.97Å; L603-L606 VanDerWaalsContact O-N 3.09Å; E604-L606 PolarHBondContact O-N 2.9Å; L606-F608 HydrophobicContact CB-CE2 3.73Å; L606-F608 HydrophobicContact CB-CZ 4.07Å; L606-F608 HydrophobicContact CD1-CE2 4.23Å; L606-F608 HydrophobicContact CD1-CZ 3.88Å
607	S	90	Very high	94.7	Very high	94 Å²	94	32 Å²	32	66%	0.657	17%	0.171	S	C	*	.			trans	-129.7	130.9	172.9	63.5	0	0	0	0	109.6
608	F	95.8	Very high	94.6	Very high	4 Å²	4	33 Å²	33	2%	0.018	18%	0.176	C	C	.	.			trans	-115	130.3	179.4	-60	-89.7	0	0	0	109	K494 L496 V591 L603 L606 V630 C632	K494-F608 HydrophobicContact CB-CD1 3.66Å; K494-F608 HydrophobicContact CB-CE1 4.02Å; K494-F608 WeakPolarHBondContact O-CA 3.2Å; L496-F608 HydrophobicContact CB-CB 3.84Å; L496-F608 HydrophobicContact CB-CD1 3.66Å; L496-F608 HydrophobicContact CB-CD2 4.13Å; L496-F608 HydrophobicContact CB-CE1 4.21Å; L496-F608 HydrophobicContact CB-CG 3.61Å; L496-F608 HydrophobicContact CD1-CE1 4.49Å; L496-F608 HydrophobicContact CD1-CZ 4.41Å; L496-F608 HydrophobicContact CD2-CD2 4.43Å; V591-F608 HydrophobicContact CB-CE1 3.77Å; V591-F608 HydrophobicContact CB-CZ 4.01Å; V591-F608 HydrophobicContact CG2-CE1 3.73Å; V591-F608 HydrophobicContact CG2-CZ 3.96Å; L603-F608 HydrophobicContact CD2-CZ 4.37Å; L606-F608 HydrophobicContact CB-CE2 3.73Å; L606-F608 HydrophobicContact CB-CZ 4.07Å; L606-F608 HydrophobicContact CD1-CE2 4.23Å; L606-F608 HydrophobicContact CD1-CZ 3.88Å; F608-V630 HydrophobicContact CB-CG2 3.93Å; F608-V630 HydrophobicContact CD2-CB 3.83Å; F608-V630 HydrophobicContact CD2-CG1 4.15Å; F608-V630 HydrophobicContact CD2-CG2 3.74Å; F608-V630 HydrophobicContact CE2-CG1 4.45Å; F608-V630 HydrophobicContact CG-CG2 4.27Å; F608-C632 WeakPolarHBondContact O-CA 3.44Å
609	H	94.4	Very high	94.6	Very high	42 Å²	42	32.7 Å²	32.7	19%	0.194	17%	0.173	C	C	.	.	S	Bend	trans	-74.9	-43.6	-176	-172.5	56.4	0	0	0	111.5	H491 K493 K494 R633 Q634	H491-H609 AromaticContact CD2-CD2 3.75Å; H491-H609 AromaticContact CE1-CD2 3.99Å; H491-H609 AromaticContact CE1-NE2 3.67Å; H491-H609 AromaticContact CG-CD2 3.32Å; H491-H609 AromaticContact CG-NE2 3.69Å; H491-H609 AromaticContact ND1-CD2 3.51Å; H491-H609 AromaticContact ND1-NE2 3.32Å; H491-H609 PolarHBondContact ND1-NE2 3.14Å; K493-H609 HydrophobicContact CB-CB 3.8Å; K493-H609 HydrophobicContact CD-CB 3.84Å; K493-H609 HydrophobicContact CG-CB 4.43Å; K494-H609 PolarHBondContact O-N 3.02Å; H609-R633 PolarHBondContact O-N 3.11Å; H609-Q634 PolarHBondContact O-N 3.12Å
610	S	97.3	Very high	94.7	Very high	1 Å²	1	32 Å²	32	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.1	-178.2	-45.2	0	0	0	0	109.2	V495 L496 Q634	V495-S610 WeakPolarHBondContact CA-O 3.34Å; L496-S610 PolarHBondContact N-O 3.01Å; S610-Q634 CarbonylContact C-O 3.43Å; S610-Q634 VanDerWaalsContact CA-O 3.31Å; S610-Q634 WeakPolarHBondContact CA-O 3.28Å; S610-Q634 PolarHBondContact OG-OE1 3.14Å
611	V	98.3	Very high	94.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.6	173.7	175.4	0	0	0	0	108.3	L496 I613 P627 L628 V630 C632 Q634 V635 V636	L496-V611 HydrophobicContact CB-CG2 4.15Å; L496-V611 HydrophobicContact CD2-CG2 4.3Å; L496-V611 CarbonylContact O-C 3.54Å; L496-V611 WeakPolarHBondContact O-CA 3.31Å; V611-I613 HydrophobicContact CG1-CG1 3.99Å; V611-P627 HydrophobicContact CG1-CB 4.1Å; V611-P627 WeakPolarHBondContact CG2-O 3.43Å; V611-L628 HydrophobicContact CB-CD2 4.31Å; V611-L628 HydrophobicContact CG1-CD2 4.1Å; V611-V630 HydrophobicContact CG2-CG2 4.18Å; V611-C632 HydrophobicContact CB-CB 4.33Å; V611-C632 HydrophobicContact CG2-CB 3.4Å; V611-C632 VanDerWaalsContact CG2-CB 3.4Å; V611-Q634 PolarHBondContact N-O 3.23Å; V611-V635 CarbonylContact O-C 3.56Å; V611-V635 WeakPolarHBondContact O-CA 3.21Å; V611-V636 PolarHBondContact O-N 3.2Å
612	L	98.6	Very high	95.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127	166.7	-175.4	146.1	0	0	0	109.4	I483 V484 L496 V497 V498 L508 D614 V636 V638	I483-L612 HydrophobicContact CB-CD1 4.33Å; I483-L612 HydrophobicContact CG2-CD1 3.98Å; V484-L612 HydrophobicContact CG2-CB 4.48Å; V484-L612 HydrophobicContact CG2-CD1 4.24Å; L496-L612 PolarHBondContact O-N 2.94Å; V497-L612 WeakPolarHBondContact CA-O 3.43Å; V497-L612 HydrophobicContact CG1-CD2 4.42Å; V498-L612 PolarHBondContact N-O 3.07Å; L508-L612 HydrophobicContact CD2-CD2 4.03Å; L612-D614 HydrophobicContact CD2-CB 3.97Å; L612-V636 CarbonylContact C-O 3.56Å; L612-V636 WeakPolarHBondContact CA-O 3.4Å; L612-V636 HydrophobicContact CB-CB 4.31Å; L612-V636 HydrophobicContact CD1-CB 4.16Å; L612-V636 HydrophobicContact CD1-CG1 4.08Å; L612-V636 HydrophobicContact CG-CB 4.15Å; L612-V636 HydrophobicContact CG-CG1 4.43Å; L612-V638 HydrophobicContact CD1-CG2 4.23Å; L612-V638 HydrophobicContact CD2-CG2 4.48Å; L612-V638 HydrophobicContact CG-CG2 4.29Å
613	I	98.6	Very high	95.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	107.3	172.4	-46.7	-169.3	0	0	0	107	V498 V611 C624 P627 L628 V636 L637 V638	V498-I613 HydrophobicContact CG2-CB 4.13Å; V498-I613 HydrophobicContact CG2-CD1 4.41Å; V498-I613 HydrophobicContact CG2-CG1 3.73Å; V498-I613 HydrophobicContact CG2-CG2 4.11Å; V498-I613 CarbonylContact O-C 3.6Å; V498-I613 WeakPolarHBondContact O-CA 3.4Å; V611-I613 HydrophobicContact CG1-CG1 3.99Å; I613-C624 HydrophobicContact CD1-CB 4.23Å; I613-P627 HydrophobicContact CD1-CG 3.65Å; I613-P627 HydrophobicContact CG1-CG 4.32Å; I613-L628 HydrophobicContact CD1-CD2 4.46Å; I613-V636 PolarHBondContact N-O 3.35Å; I613-L637 HydrophobicContact CB-CD2 3.81Å; I613-L637 HydrophobicContact CD1-CD2 3.63Å; I613-L637 HydrophobicContact CG1-CD2 3.75Å; I613-V638 PolarHBondContact O-N 3.28Å
614	D	97.6	Very high	95.5	Very high	5 Å²	5	27 Å²	27	3%	0.027	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	156.2	171.7	-146	-28	0	0	0	110.7	S480 V498 A499 P500 L508 L612 S616 V638	S480-D614 VanDerWaalsContact CB-OD2 3.27Å; S480-D614 WeakPolarHBondContact CB-OD2 3.46Å; S480-D614 PolarHBondContact OG-OD2 2.97Å; V498-D614 PolarHBondContact O-N 2.79Å; A499-D614 VanDerWaalsContact CA-O 3.27Å; A499-D614 WeakPolarHBondContact CA-O 3.42Å; A499-D614 VanDerWaalsContact CB-O 3.26Å; A499-D614 WeakPolarHBondContact CB-O 3.49Å; P500-D614 WeakPolarHBondContact CD-O 3.26Å; L508-D614 HydrophobicContact CD2-CB 3.79Å; L612-D614 HydrophobicContact CD2-CB 3.97Å; D614-S616 PolarHBondContact O-N 3.47Å; D614-S616 VanDerWaalsContact O-N 3.1Å; D614-V638 CarbonylContact C-O 3.52Å
615	E	95.9	Very high	95.9	Very high	37 Å²	37	22.2 Å²	22.2	17%	0.173	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	33.6	-166.6	-62	-63	179.1	0	0	114.5	K476 P500 A504 T617 Q618 V638	K476-E615 WeakPolarHBondContact CE-OE1 3.33Å; K476-E615 IonicContact NZ-OE1 3.93Å; K476-E615 PolarHBondContact NZ-OE1 2.99Å; K476-E615 IonicContact NZ-OE2 2.61Å; K476-E615 PolarHBondContact NZ-OE2 3.29Å; P500-E615 HydrophobicContact CG-CB 4.39Å; A504-E615 HydrophobicContact CB-CG 4.23Å; E615-T617 PolarHBondContact O-N 3Å; E615-Q618 HydrophobicContact CB-CG 4.27Å; E615-Q618 WeakPolarHBondContact O-CB 3.39Å; E615-Q618 PolarHBondContact O-N 2.88Å; E615-Q618 PolarHBondContact OE2-NE2 3.31Å; E615-Q618 VanDerWaalsContact OE2-NE2 3.07Å; E615-V638 CarbonylContact C-O 3.51Å; E615-V638 WeakPolarHBondContact CA-O 3.49Å; E615-V638 PolarHBondContact N-O 2.9Å
616	S	97.4	Very high	96.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-7.4	-173.5	75.8	0	0	0	0	115	D614 Q618 V638 F663	D614-S616 PolarHBondContact O-N 3.47Å; D614-S616 VanDerWaalsContact O-N 3.1Å; S616-Q618 VanDerWaalsContact C-N 3.35Å; S616-V638 PolarHBondContact N-O 3.49Å; S616-V638 PolarHBondContact OG-O 2.88Å; S616-F663 WeakPolarHBondContact OG-CD2 3.09Å
617	T	95.3	Very high	96.7	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.012	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14	172.5	47.4	0	0	0	0	112.9	E615 D640 H641 G645 P646 F663	E615-T617 PolarHBondContact O-N 3Å; T617-D640 PolarHBondContact OG1-N 3.28Å; T617-H641 HydrophobicContact CG2-CB 4.38Å; T617-G645 CarbonylContact O-C 3.59Å; T617-G645 VanDerWaalsContact O-CA 3.3Å; T617-G645 WeakPolarHBondContact O-CA 3.42Å; T617-P646 VanDerWaalsContact O-CD 3.27Å; T617-P646 WeakPolarHBondContact O-CD 3.18Å; T617-F663 HydrophobicContact CG2-CB 3.74Å; T617-F663 HydrophobicContact CG2-CD1 3.49Å; T617-F663 VanDerWaalsContact CG2-CD1 3.49Å; T617-F663 HydrophobicContact CG2-CD2 4.24Å; T617-F663 HydrophobicContact CG2-CE1 4.13Å; T617-F663 HydrophobicContact CG2-CG 3.57Å
618	Q	93.7	Very high	96.9	Very high	26 Å²	26	7.2 Å²	7.2	12%	0.121	4%	0.035	C	C	.	.	S	Bend	trans	-94	-7.4	176.3	-48.8	175.5	23.7	0	0	112.3	P500 E615 S616 P646	P500-Q618 HydrophobicContact CG-CB 3.82Å; E615-Q618 HydrophobicContact CB-CG 4.27Å; E615-Q618 WeakPolarHBondContact O-CB 3.39Å; E615-Q618 PolarHBondContact O-N 2.88Å; E615-Q618 PolarHBondContact OE2-NE2 3.31Å; E615-Q618 VanDerWaalsContact OE2-NE2 3.07Å; S616-Q618 VanDerWaalsContact C-N 3.35Å; Q618-P646 VanDerWaalsContact O-CA 3.3Å; Q618-P646 WeakPolarHBondContact O-CA 3.29Å; Q618-P646 WeakPolarHBondContact O-CB 3.28Å
619	A	96.6	Very high	96.8	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.043	C	C	.	.	S	Bend	trans	-97.4	146.3	177.7	0	0	0	0	0	110.8	P500 E623 S661	P500-A619 HydrophobicContact CB-CB 4.13Å; P500-A619 HydrophobicContact CG-CB 4.12Å; A619-E623 WeakPolarHBondContact CA-OE2 3.42Å; A619-E623 HydrophobicContact CB-CG 4.3Å; A619-E623 WeakPolarHBondContact CB-OE2 3.43Å; A619-S661 VanDerWaalsContact O-CB 3.29Å; A619-S661 WeakPolarHBondContact O-CB 3.35Å
620	T	97.5	Very high	96.6	Very high	15 Å²	15	7.8 Å²	7.8	9%	0.092	4%	0.04	C	C	.	.			trans	-68.1	159.4	172.4	72.5	0	0	0	0	110.2	E623 C624 P646 I648	T620-E623 PolarHBondContact N-OE2 2.81Å; T620-E623 PolarHBondContact O-N 3.3Å; T620-E623 VanDerWaalsContact OG1-CB 3.24Å; T620-E623 WeakPolarHBondContact OG1-CB 3.15Å; T620-E623 PolarHBondContact OG1-N 2.91Å; T620-E623 VanDerWaalsContact OG1-N 3.07Å; T620-C624 PolarHBondContact O-N 3.26Å; T620-C624 PolarHBondContact O-SG 2.9Å; T620-P646 HydrophobicContact CG2-CB 3.95Å; T620-I648 HydrophobicContact CG2-CD1 3.61Å
621	E	97.7	Very high	95.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.4	-48.8	173.4	172.3	161.6	161	0	0	112.8	Y278 F282 E623 C624 L625 L662 R665	Y278-E621 WeakPolarHBondContact CE2-OE1 3.39Å; Y278-E621 VanDerWaalsContact CZ-OE1 3.3Å; Y278-E621 PolarHBondContact OH-OE1 3.44Å; F282-E621 HydrophobicContact CE1-CB 4.2Å; F282-E621 HydrophobicContact CE1-CG 4.41Å; F282-E621 HydrophobicContact CE2-CG 4.43Å; F282-E621 HydrophobicContact CZ-CB 4.13Å; F282-E621 HydrophobicContact CZ-CG 3.98Å; E621-E623 VanDerWaalsContact C-N 3.29Å; E621-E623 PolarHBondContact O-N 3.5Å; E621-C624 WeakPolarHBondContact O-CA 3.23Å; E621-C624 WeakPolarHBondContact O-CB 3.16Å; E621-C624 PolarHBondContact O-N 2.79Å; E621-L625 PolarHBondContact O-N 3.13Å; E621-L662 HydrophobicContact CB-CB 4.08Å; E621-L662 HydrophobicContact CG-CB 3.99Å; E621-L662 HydrophobicContact CG-CD1 4.01Å; E621-L662 HydrophobicContact CG-CG 4.48Å; E621-L662 WeakPolarHBondContact OE2-CD1 3.35Å; E621-R665 VanDerWaalsContact CD-NH2 3.3Å; E621-R665 IonicContact OE1-CZ 3.95Å; E621-R665 IonicContact OE1-NE 3.96Å; E621-R665 IonicContact OE1-NH2 3.74Å; E621-R665 PolarHBondContact OE1-NH2 2.85Å; E621-R665 IonicContact OE2-CZ 3.86Å; E621-R665 IonicContact OE2-NE 2.68Å; E621-R665 PolarHBondContact OE2-NE 3.03Å; E621-R665 IonicContact OE2-NH2 2.73Å; E621-R665 PolarHBondContact OE2-NH2 3.17Å
622	P	98.1	Very high	95.6	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58.1	-34.4	174	-29.9	38.8	0	0	0	114.9	F282 V286 M400 I404 L625 L658	F282-P622 HydrophobicContact CB-CG 4.3Å; F282-P622 HydrophobicContact CD1-CG 3.58Å; F282-P622 HydrophobicContact CE1-CG 4.16Å; F282-P622 HydrophobicContact CG-CG 4.15Å; V286-P622 HydrophobicContact CG2-CB 3.83Å; V286-P622 HydrophobicContact CG2-CG 3.76Å; M400-P622 HydrophobicContact CB-CB 3.87Å; M400-P622 HydrophobicContact CG-CB 4.01Å; M400-P622 HydrophobicContact SD-CB 3.9Å; I404-P622 HydrophobicContact CD1-CB 3.93Å; I404-P622 HydrophobicContact CD1-CG 4.09Å; I404-P622 HydrophobicContact CG1-CB 4.23Å; P622-L625 WeakPolarHBondContact O-CB 3.4Å; P622-L625 PolarHBondContact O-N 3.43Å; P622-L658 HydrophobicContact CG-CD1 4.11Å
623	E	98.3	Very high	95.3	Very high	8 Å²	8	14.9 Å²	14.9	4%	0.037	7%	0.074	C	C	.	.	H	α-helix	trans	-66	-40.3	173.2	178.6	179.1	-162.8	0	0	111.5	M400 C595 V596 A619 T620 E621 L625 I626 P627	M400-E623 HydrophobicContact CG-CB 4.44Å; M400-E623 HydrophobicContact SD-CB 3.94Å; C595-E623 HydrophobicContact CB-CG 3.49Å; C595-E623 VanDerWaalsContact CB-CG 3.49Å; V596-E623 HydrophobicContact CG2-CG 4.23Å; A619-E623 WeakPolarHBondContact CA-OE2 3.42Å; A619-E623 HydrophobicContact CB-CG 4.3Å; A619-E623 WeakPolarHBondContact CB-OE2 3.43Å; T620-E623 PolarHBondContact N-OE2 2.81Å; T620-E623 PolarHBondContact O-N 3.3Å; T620-E623 VanDerWaalsContact OG1-CB 3.24Å; T620-E623 WeakPolarHBondContact OG1-CB 3.15Å; T620-E623 PolarHBondContact OG1-N 2.91Å; T620-E623 VanDerWaalsContact OG1-N 3.07Å; E621-E623 VanDerWaalsContact C-N 3.29Å; E621-E623 PolarHBondContact O-N 3.5Å; E623-L625 PolarHBondContact O-N 3.34Å; E623-I626 PolarHBondContact O-N 3.22Å; E623-P627 WeakPolarHBondContact O-CD 3.39Å
624	C	98	Very high	95.2	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63.6	-21.6	175.7	-67.8	0	0	0	0	113.1	I613 T620 E621 P627 L628 L662	I613-C624 HydrophobicContact CD1-CB 4.23Å; T620-C624 PolarHBondContact O-N 3.26Å; T620-C624 PolarHBondContact O-SG 2.9Å; E621-C624 WeakPolarHBondContact O-CA 3.23Å; E621-C624 WeakPolarHBondContact O-CB 3.16Å; E621-C624 PolarHBondContact O-N 2.79Å; C624-P627 WeakPolarHBondContact O-CD 3.41Å; C624-P627 WeakPolarHBondContact O-CG 3.3Å; C624-L628 WeakPolarHBondContact O-CG 3.44Å; C624-L662 HydrophobicContact CB-CB 4.15Å; C624-L662 HydrophobicContact CB-CD2 3.87Å
625	L	96.8	Very high	95.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-72.9	-35.5	176.6	-57.2	-178.5	0	0	0	113.1	Y278 A403 I404 V407 L423 E621 P622 E623 L628 M629	Y278-L625 HydrophobicContact CE1-CD1 3.98Å; A403-L625 HydrophobicContact CB-CB 3.79Å; I404-L625 HydrophobicContact CB-CD1 4.41Å; I404-L625 HydrophobicContact CG1-CD1 3.76Å; V407-L625 HydrophobicContact CG2-CB 4.48Å; V407-L625 HydrophobicContact CG2-CD1 4.16Å; V407-L625 HydrophobicContact CG2-CD2 4.23Å; L423-L625 HydrophobicContact CD1-CD2 3.94Å; L423-L625 HydrophobicContact CD2-CD2 3.74Å; L423-L625 HydrophobicContact CG-CD2 4.5Å; E621-L625 PolarHBondContact O-N 3.13Å; P622-L625 WeakPolarHBondContact O-CB 3.4Å; P622-L625 PolarHBondContact O-N 3.43Å; E623-L625 PolarHBondContact O-N 3.34Å; L625-L628 HydrophobicContact CD2-CD1 4.5Å; L625-L628 WeakPolarHBondContact O-CA 3.42Å; L625-L628 WeakPolarHBondContact O-CB 3.39Å; L625-L628 PolarHBondContact O-N 2.9Å; L625-M629 PolarHBondContact O-N 3.04Å
626	I	97.3	Very high	95.3	Very high	7 Å²	7	13.1 Å²	13.1	4%	0.036	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-49.8	-52.1	-176.1	-52.5	170.8	0	0	0	112.3	R399 M400 A403 C595 V596 A598 E623 L628 M629	R399-I626 HydrophobicContact CB-CD1 3.8Å; R399-I626 HydrophobicContact CB-CG1 4.29Å; R399-I626 HydrophobicContact CB-CG2 4.38Å; M400-I626 HydrophobicContact CG-CD1 3.82Å; M400-I626 HydrophobicContact CG-CG1 4.4Å; A403-I626 HydrophobicContact CB-CB 4.44Å; A403-I626 HydrophobicContact CB-CG1 3.96Å; C595-I626 WeakPolarHBondContact O-CG2 3.32Å; V596-I626 HydrophobicContact CG2-CD1 4.33Å; A598-I626 HydrophobicContact CB-CG2 4.25Å; E623-I626 PolarHBondContact O-N 3.22Å; I626-L628 PolarHBondContact O-N 3.43Å; I626-M629 PolarHBondContact O-N 3.17Å
627	P	97.2	Very high	95.4	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-69.9	-13.9	178.2	31	-40.3	0	0	0	114.7	L496 V498 A598 V611 I613 E623 C624 V630	L496-P627 HydrophobicContact CD2-CB 3.97Å; V498-P627 HydrophobicContact CG1-CB 4.16Å; V498-P627 HydrophobicContact CG2-CB 3.79Å; V498-P627 HydrophobicContact CG2-CG 3.9Å; A598-P627 HydrophobicContact CB-CB 3.82Å; V611-P627 HydrophobicContact CG1-CB 4.1Å; V611-P627 WeakPolarHBondContact CG2-O 3.43Å; I613-P627 HydrophobicContact CD1-CG 3.65Å; I613-P627 HydrophobicContact CG1-CG 4.32Å; E623-P627 WeakPolarHBondContact O-CD 3.39Å; C624-P627 WeakPolarHBondContact O-CD 3.41Å; C624-P627 WeakPolarHBondContact O-CG 3.3Å; P627-V630 WeakPolarHBondContact O-CG2 3.43Å
628	L	95.2	Very high	95.5	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.021	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-82.5	-24.2	178	-50	-176.8	0	0	0	112.1	L415 V611 I613 C624 L625 I626 V630 G631 V635	L415-L628 HydrophobicContact CD2-CB 3.95Å; V611-L628 HydrophobicContact CB-CD2 4.31Å; V611-L628 HydrophobicContact CG1-CD2 4.1Å; I613-L628 HydrophobicContact CD1-CD2 4.46Å; C624-L628 WeakPolarHBondContact O-CG 3.44Å; L625-L628 HydrophobicContact CD2-CD1 4.5Å; L625-L628 WeakPolarHBondContact O-CA 3.42Å; L625-L628 WeakPolarHBondContact O-CB 3.39Å; L625-L628 PolarHBondContact O-N 2.9Å; I626-L628 PolarHBondContact O-N 3.43Å; L628-V630 PolarHBondContact O-N 3.44Å; L628-G631 PolarHBondContact O-N 3.23Å; L628-V635 HydrophobicContact CD2-CB 4.47Å; L628-V635 HydrophobicContact CD2-CG1 3.96Å; L628-V635 HydrophobicContact CD2-CG2 3.61Å
629	M	92.8	Very high	95.7	Very high	35 Å²	35	11.9 Å²	11.9	17%	0.172	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-69.8	2.4	-178.7	-63	-57.7	92.5	0	0	114.6	A403 V406 V407 L414 L415 L625 I626 G631	A403-M629 HydrophobicContact CB-CG 3.97Å; V406-M629 HydrophobicContact CB-SD 3.89Å; V406-M629 HydrophobicContact CG1-SD 3.67Å; V407-M629 HydrophobicContact CG2-CE 3.31Å; V407-M629 HydrophobicContact CG2-SD 3.76Å; L414-M629 HydrophobicContact CD1-SD 4.42Å; L415-M629 HydrophobicContact CD1-CE 4.03Å; L415-M629 HydrophobicContact CD2-CE 3.91Å; L415-M629 HydrophobicContact CG-CE 3.94Å; L625-M629 PolarHBondContact O-N 3.04Å; I626-M629 PolarHBondContact O-N 3.17Å; M629-G631 PolarHBondContact O-N 2.86Å
630	V	89.8	Confident	95.6	Very high	24 Å²	24	11.9 Å²	11.9	15%	0.145	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-80.2	7.6	168.9	-51.9	0	0	0	0	113.8	L496 F608 V611 P627 L628 C632	L496-V630 HydrophobicContact CD2-CG1 4.02Å; L496-V630 HydrophobicContact CD2-CG2 4.04Å; F608-V630 HydrophobicContact CB-CG2 3.93Å; F608-V630 HydrophobicContact CD2-CB 3.83Å; F608-V630 HydrophobicContact CD2-CG1 4.15Å; F608-V630 HydrophobicContact CD2-CG2 3.74Å; F608-V630 HydrophobicContact CE2-CG1 4.45Å; F608-V630 HydrophobicContact CG-CG2 4.27Å; V611-V630 HydrophobicContact CG2-CG2 4.18Å; P627-V630 WeakPolarHBondContact O-CG2 3.43Å; L628-V630 PolarHBondContact O-N 3.44Å; V630-C632 HydrophobicContact CG2-CB 4.47Å
631	G	83.1	Confident	95.4	Very high	24 Å²	24	11.7 Å²	11.7	25%	0.247	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	32.9	178.2	0	0	0	0	0	114.3	L628 M629	L628-G631 PolarHBondContact O-N 3.23Å; M629-G631 PolarHBondContact O-N 2.86Å
632	C	91.9	Very high	95.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.058	C	C	.	.			trans	-64.6	146.4	-175.2	65	0	0	0	0	113.2	P416 F608 V611 V630	P416-C632 VanDerWaalsContact CD-O 3.24Å; P416-C632 WeakPolarHBondContact CD-O 3.47Å; F608-C632 WeakPolarHBondContact O-CA 3.44Å; V611-C632 HydrophobicContact CB-CB 4.33Å; V611-C632 HydrophobicContact CG2-CB 3.4Å; V611-C632 VanDerWaalsContact CG2-CB 3.4Å; V630-C632 HydrophobicContact CG2-CB 4.47Å
633	R	93.2	Very high	94.8	Very high	126 Å²	126	12.5 Å²	12.5	48%	0.475	6%	0.062	S	C	.	.	S	Bend	trans	-104.7	-10.5	177	-61.5	-55.6	-169.4	-158.8	7.7	113.7	L414 H609	L414-R633 PolarHBondContact O-NH1 2.71Å; H609-R633 PolarHBondContact O-N 3.11Å
634	Q	96.1	Very high	94.4	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	140.6	178	-174.1	179.1	30.1	0	0	110.5	L433 V460 R463 P464 H609 S610 V611	L433-Q634 HydrophobicContact CD1-CG 4.47Å; V460-Q634 PolarHBondContact O-NE2 3.07Å; R463-Q634 WeakPolarHBondContact O-CG 3.41Å; R463-Q634 PolarHBondContact O-NE2 3.28Å; P464-Q634 CarbonylContact O-C 3.57Å; P464-Q634 VanDerWaalsContact O-CA 3.26Å; P464-Q634 WeakPolarHBondContact O-CA 3.07Å; H609-Q634 PolarHBondContact O-N 3.12Å; S610-Q634 CarbonylContact C-O 3.43Å; S610-Q634 VanDerWaalsContact CA-O 3.31Å; S610-Q634 WeakPolarHBondContact CA-O 3.28Å; S610-Q634 PolarHBondContact OG-OE1 3.14Å; V611-Q634 PolarHBondContact N-O 3.23Å
635	V	97.8	Very high	94.1	Very high	4 Å²	4	13.4 Å²	13.4	2%	0.024	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	130.4	-176.1	177.3	0	0	0	0	110.5	I419 P464 L465 S466 V611 L628 L637	I419-V635 HydrophobicContact CD1-CB 4.5Å; I419-V635 HydrophobicContact CD1-CG2 3.91Å; I419-V635 HydrophobicContact CG2-CG2 4.37Å; P464-V635 PolarHBondContact O-N 3.48Å; L465-V635 CarbonylContact C-O 3.57Å; L465-V635 WeakPolarHBondContact CA-O 3.38Å; L465-V635 HydrophobicContact CD1-CB 3.93Å; L465-V635 HydrophobicContact CD1-CG1 3.91Å; S466-V635 PolarHBondContact N-O 3.01Å; V611-V635 CarbonylContact O-C 3.56Å; V611-V635 WeakPolarHBondContact O-CA 3.21Å; L628-V635 HydrophobicContact CD2-CB 4.47Å; L628-V635 HydrophobicContact CD2-CG1 3.96Å; L628-V635 HydrophobicContact CD2-CG2 3.61Å; V635-L637 HydrophobicContact CG1-CD2 3.77Å; V635-L637 HydrophobicContact CG1-CG 4.16Å
636	V	98.4	Very high	93.8	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	114.6	176.3	-167.4	0	0	0	0	108.2	V460 I468 I483 L487 V611 L612 I613 V638	V460-V636 HydrophobicContact CG1-CB 4.4Å; V460-V636 HydrophobicContact CG1-CG1 3.98Å; V460-V636 HydrophobicContact CG1-CG2 3.48Å; V460-V636 VanDerWaalsContact CG1-CG2 3.48Å; V460-V636 HydrophobicContact CG2-CG1 4.21Å; I468-V636 HydrophobicContact CD1-CG1 4.48Å; I483-V636 HydrophobicContact CG2-CG2 4.41Å; L487-V636 HydrophobicContact CD1-CG2 4.42Å; V611-V636 PolarHBondContact O-N 3.2Å; L612-V636 CarbonylContact C-O 3.56Å; L612-V636 WeakPolarHBondContact CA-O 3.4Å; L612-V636 HydrophobicContact CB-CB 4.31Å; L612-V636 HydrophobicContact CD1-CB 4.16Å; L612-V636 HydrophobicContact CD1-CG1 4.08Å; L612-V636 HydrophobicContact CG-CB 4.15Å; L612-V636 HydrophobicContact CG-CG1 4.43Å; I613-V636 PolarHBondContact N-O 3.35Å; V636-V638 HydrophobicContact CG1-CG2 4.02Å
637	L	98.6	Very high	93.4	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.3	173.6	-54	-172.8	0	0	0	108.7	S466 L467 I468 I613 V635 L662 F663 F666	S466-L637 PolarHBondContact O-N 3.28Å; L467-L637 CarbonylContact C-O 3.52Å; L467-L637 WeakPolarHBondContact CA-O 3.45Å; L467-L637 HydrophobicContact CD2-CB 3.87Å; L467-L637 HydrophobicContact CD2-CD1 3.85Å; L467-L637 HydrophobicContact CD2-CG 4.12Å; I468-L637 PolarHBondContact N-O 2.84Å; I613-L637 HydrophobicContact CB-CD2 3.81Å; I613-L637 HydrophobicContact CD1-CD2 3.63Å; I613-L637 HydrophobicContact CG1-CD2 3.75Å; V635-L637 HydrophobicContact CG1-CD2 3.77Å; V635-L637 HydrophobicContact CG1-CG 4.16Å; L637-L662 HydrophobicContact CD1-CD2 4.12Å; L637-L662 HydrophobicContact CD1-CG 4.11Å; L637-F663 HydrophobicContact CB-CD2 3.87Å; L637-F666 HydrophobicContact CD1-CD2 3.85Å; L637-F666 HydrophobicContact CD1-CE2 3.9Å
638	V	98.4	Very high	93	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.6	-179.1	-171.8	0	0	0	0	108	I468 K476 L612 I613 D614 E615 S616 V636	I468-V638 HydrophobicContact CB-CB 4.47Å; I468-V638 HydrophobicContact CB-CG1 4.12Å; I468-V638 HydrophobicContact CB-CG2 4.21Å; I468-V638 HydrophobicContact CD1-CG2 4.29Å; I468-V638 HydrophobicContact CG2-CG1 4.14Å; I468-V638 WeakPolarHBondContact O-CA 3.49Å; K476-V638 HydrophobicContact CD-CG1 4.03Å; K476-V638 HydrophobicContact CG-CG1 4.15Å; L612-V638 HydrophobicContact CD1-CG2 4.23Å; L612-V638 HydrophobicContact CD2-CG2 4.48Å; L612-V638 HydrophobicContact CG-CG2 4.29Å; I613-V638 PolarHBondContact O-N 3.28Å; D614-V638 CarbonylContact C-O 3.52Å; E615-V638 CarbonylContact C-O 3.51Å; E615-V638 WeakPolarHBondContact CA-O 3.49Å; E615-V638 PolarHBondContact N-O 2.9Å; S616-V638 PolarHBondContact N-O 3.49Å; S616-V638 PolarHBondContact OG-O 2.88Å; V636-V638 HydrophobicContact CG1-CG2 4.02Å
639	G	96.3	Very high	92.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	-163.8	-175.9	0	0	0	0	0	112.3	I468 Q469 G470	I468-G639 PolarHBondContact O-N 3.32Å; I468-G639 VanDerWaalsContact O-N 3.07Å; Q469-G639 CarbonylContact C-O 3.54Å; Q469-G639 WeakPolarHBondContact CA-O 3.43Å; G470-G639 PolarHBondContact N-O 3.49Å
640	D	95.2	Very high	92.2	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	9%	0.086	C	C	.	.			trans	-153.2	99	171.8	-175.8	19.1	0	0	0	113.1	Q469 T617 C642 Q643 Y695	Q469-D640 WeakPolarHBondContact CG-OD1 3.43Å; Q469-D640 PolarHBondContact NE2-OD1 2.89Å; T617-D640 PolarHBondContact OG1-N 3.28Å; D640-C642 PolarHBondContact O-N 2.77Å; D640-C642 WeakPolarHBondContact OD1-CB 3.39Å; D640-C642 PolarHBondContact OD1-N 3.49Å; D640-C642 VanDerWaalsContact OD1-N 3.15Å; D640-Q643 PolarHBondContact O-N 2.72Å; D640-Q643 PolarHBondContact OD2-NE2 2.76Å; D640-Y695 WeakPolarHBondContact OD2-CE1 3.41Å; D640-Y695 PolarHBondContact OD2-OH 3.37Å
641	H	92.3	Very high	92	Very high	10 Å²	10	15.9 Å²	15.9	5%	0.046	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-1	177.2	68.8	-24.5	0	0	0	115.4	Q469 T617 F663 E664 R834	Q469-H641 PolarHBondContact NE2-CE1 2.89Å; Q469-H641 VanDerWaalsContact NE2-CE1 3.33Å; Q469-H641 PolarHBondContact NE2-ND1 3.01Å; T617-H641 HydrophobicContact CG2-CB 4.38Å; H641-F663 HydrophobicContact CB-CD1 4.41Å; H641-F663 HydrophobicContact CB-CE1 4.41Å; H641-E664 HydrophobicContact CB-CG 3.97Å; H641-R834 PolarHBondContact O-NH2 3.49Å
642	C	92	Very high	92.2	Very high	1 Å²	1	18 Å²	18	1%	0.007	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.1	168.7	-58.3	0	0	0	0	113.2	Q469 D640 F694 Y695 N837 F899	Q469-C642 PolarHBondContact NE2-SG 2.84Å; D640-C642 PolarHBondContact O-N 2.77Å; D640-C642 WeakPolarHBondContact OD1-CB 3.39Å; D640-C642 PolarHBondContact OD1-N 3.49Å; D640-C642 VanDerWaalsContact OD1-N 3.15Å; C642-F694 HydrophobicContact CB-CB 4.41Å; C642-F694 PolarHBondContact SG-O 3.49Å; C642-Y695 HydrophobicContact CB-CD1 4.4Å; C642-Y695 HydrophobicContact CB-CE1 3.57Å; C642-N837 PolarHBondContact O-ND2 3.45Å; C642-F899 HydrophobicContact CB-CE1 3.9Å
643	Q	91.9	Very high	92.1	Very high	17 Å²	17	18 Å²	18	8%	0.079	9%	0.089	C	C	.	.	S	Bend	trans	-105.3	-168	170.5	-72.4	173.7	92.1	0	0	109.6	D640 R834 V838	D640-Q643 PolarHBondContact O-N 2.72Å; D640-Q643 PolarHBondContact OD2-NE2 2.76Å; Q643-R834 WeakPolarHBondContact O-CD 3.31Å; Q643-R834 WeakPolarHBondContact O-CG 3.37Å; Q643-R834 PolarHBondContact O-NE 3.43Å; Q643-V838 HydrophobicContact CB-CG2 3.88Å; Q643-V838 HydrophobicContact CG-CG2 3.84Å
644	L	90	Very high	92	Very high	10 Å²	10	12.2 Å²	12.2	5%	0.052	7%	0.068	C	C	.	.			trans	-65.8	151.9	-174.7	-69.2	163.7	0	0	0	112.8	D804 R834 R835 V838	L644-D804 HydrophobicContact CD1-CB 3.77Å; L644-R834 HydrophobicContact CD2-CB 4.2Å; L644-R835 HydrophobicContact CD2-CG 3.94Å; L644-V838 HydrophobicContact CD1-CG2 4.2Å; L644-V838 HydrophobicContact CG-CG2 4.14Å
645	G	91.1	Very high	91.5	Very high	17 Å²	17	14.5 Å²	14.5	18%	0.175	8%	0.083	C	C	.	.			trans	-91.1	-167.6	177.2	0	0	0	0	0	112.7	T617	T617-G645 CarbonylContact O-C 3.59Å; T617-G645 VanDerWaalsContact O-CA 3.3Å; T617-G645 WeakPolarHBondContact O-CA 3.42Å
646	P	92.2	Very high	91.2	Very high	9 Å²	9	14.9 Å²	14.9	6%	0.058	9%	0.087	C	C	.	.			trans	-68.9	151.2	168.2	31.8	-35.5	0	0	0	111.9	T617 Q618 T620 T659	T617-P646 VanDerWaalsContact O-CD 3.27Å; T617-P646 WeakPolarHBondContact O-CD 3.18Å; Q618-P646 VanDerWaalsContact O-CA 3.3Å; Q618-P646 WeakPolarHBondContact O-CA 3.29Å; Q618-P646 WeakPolarHBondContact O-CB 3.28Å; T620-P646 HydrophobicContact CG2-CB 3.95Å; P646-T659 WeakPolarHBondContact CD-O 3.47Å; P646-T659 WeakPolarHBondContact CG-O 3.17Å
647	V	87.1	Confident	91	Very high	30 Å²	30	15.2 Å²	15.2	18%	0.182	9%	0.09	C	C	.	.			trans	-86	126.2	174.2	170.2	0	0	0	0	109.6	C39 T649	C39-V647 WeakPolarHBondContact O-CG1 3.42Å; C39-V647 WeakPolarHBondContact O-CG2 3.39Å; V647-T649 HydrophobicContact CG1-CG2 4.43Å
648	I	90	Very high	90.8	Very high	6 Å²	6	15.4 Å²	15.4	3%	0.031	9%	0.092	C	C	.	.			trans	-124.8	123.5	172.7	-53.9	-60.6	0	0	0	107.3	E289 T620 A653 A654 L658 T659	E289-I648 WeakPolarHBondContact OE2-CG2 3.47Å; T620-I648 HydrophobicContact CG2-CD1 3.61Å; I648-A653 HydrophobicContact CG2-CB 4.13Å; I648-A654 HydrophobicContact CB-CB 3.98Å; I648-A654 HydrophobicContact CG2-CB 3.77Å; I648-L658 HydrophobicContact CD1-CB 4.15Å; I648-L658 HydrophobicContact CD1-CD2 3.86Å; I648-L658 HydrophobicContact CD1-CG 3.66Å; I648-L658 HydrophobicContact CG1-CB 4.3Å; I648-L658 HydrophobicContact CG1-CG 4.36Å; I648-L658 HydrophobicContact CG2-CB 4.5Å; I648-L658 HydrophobicContact CG2-CD2 4.34Å; I648-T659 HydrophobicContact CB-CG2 3.97Å; I648-T659 HydrophobicContact CG1-CG2 3.6Å
649	T	84.4	Confident	90.5	Very high	30 Å²	30	15.7 Å²	15.7	18%	0.184	9%	0.093	C	C	.	.			trans	-88.4	-35.6	-176.3	64.9	0	0	0	0	111.7	E289 Y292 V647 K651	E289-T649 WeakPolarHBondContact OE1-CB 3.47Å; E289-T649 PolarHBondContact OE1-N 2.69Å; E289-T649 PolarHBondContact OE1-OG1 3.41Å; E289-T649 PolarHBondContact OE2-N 3.06Å; Y292-T649 WeakPolarHBondContact CD1-OG1 3.41Å; Y292-T649 WeakPolarHBondContact CE1-O 3.29Å; V647-T649 HydrophobicContact CG1-CG2 4.43Å; T649-K651 PolarHBondContact O-N 3.43Å
650	C	87.5	Confident	90.4	Very high	11 Å²	11	16 Å²	16	7%	0.074	10%	0.095	C	C	.	.			trans	-77.6	105.8	177.6	-174.8	0	0	0	0	110.8	L288 E289 Y292 K652 A653 A654	L288-C650 PolarHBondContact O-SG 3.08Å; L288-C650 VanDerWaalsContact O-SG 3.34Å; E289-C650 WeakPolarHBondContact OE2-CA 3.33Å; E289-C650 WeakPolarHBondContact OE2-CB 3.45Å; E289-C650 PolarHBondContact OE2-N 3.11Å; Y292-C650 HydrophobicContact CD1-CB 3.77Å; Y292-C650 HydrophobicContact CG-CB 3.86Å; C650-K652 PolarHBondContact O-N 2.99Å; C650-K652 VanDerWaalsContact O-N 3.14Å; C650-A653 HydrophobicContact CB-CB 4.13Å; C650-A653 WeakPolarHBondContact O-CA 3.39Å; C650-A653 PolarHBondContact O-N 3.35Å; C650-A654 PolarHBondContact O-N 3.38Å
651	K	84.1	Confident	90.5	Very high	36 Å²	36	16 Å²	16	16%	0.157	9%	0.094	C	C	.	.	H	α-helix	trans	-58	-32	-176.6	-58.3	-158.8	179.4	-162.2	0	113.7	D21 E24 T43 T649 A654 S655	D21-K651 WeakPolarHBondContact O-CE 3.27Å; D21-K651 PolarHBondContact O-NZ 3.36Å; E24-K651 IonicContact OE2-NZ 2.69Å; E24-K651 PolarHBondContact OE2-NZ 3.26Å; T43-K651 HydrophobicContact CG2-CD 4.22Å; T649-K651 PolarHBondContact O-N 3.43Å; K651-A654 PolarHBondContact O-N 2.66Å; K651-S655 WeakPolarHBondContact O-CB 3.41Å; K651-S655 PolarHBondContact O-N 3.03Å; K651-S655 PolarHBondContact O-OG 3.4Å
652	K	86.8	Confident	90.7	Very high	69 Å²	69	15.6 Å²	15.6	30%	0.3	9%	0.093	S	C	.	.	H	α-helix	trans	-66.4	-40.4	175.7	-166.6	161	-177.9	166.8	0	111.8	D262 N263 V265 L288 C650 A656	D262-K652 IonicContact OD1-NZ 3.13Å; D262-K652 PolarHBondContact OD1-NZ 2.9Å; N263-K652 WeakPolarHBondContact O-CE 3.34Å; N263-K652 PolarHBondContact O-NZ 2.92Å; V265-K652 HydrophobicContact CG2-CG 3.99Å; L288-K652 HydrophobicContact CD1-CB 4.26Å; L288-K652 HydrophobicContact CD1-CD 4.14Å; L288-K652 HydrophobicContact CD1-CG 3.95Å; C650-K652 PolarHBondContact O-N 2.99Å; C650-K652 VanDerWaalsContact O-N 3.14Å; K652-A656 VanDerWaalsContact O-CB 3.26Å; K652-A656 WeakPolarHBondContact O-CB 3.45Å; K652-A656 PolarHBondContact O-N 3.07Å
653	A	91.6	Very high	91	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-72	-38.3	172.6	0	0	0	0	0	112.4	L285 L288 I648 C650 A656 G657 L658	L285-A653 HydrophobicContact CD2-CB 4.35Å; L288-A653 HydrophobicContact CB-CB 4.48Å; I648-A653 HydrophobicContact CG2-CB 4.13Å; C650-A653 HydrophobicContact CB-CB 4.13Å; C650-A653 WeakPolarHBondContact O-CA 3.39Å; C650-A653 PolarHBondContact O-N 3.35Å; A653-A656 PolarHBondContact O-N 3.06Å; A653-G657 PolarHBondContact O-N 3.3Å; A653-L658 HydrophobicContact CB-CB 4.26Å; A653-L658 HydrophobicContact CB-CD2 3.91Å; A653-L658 VanDerWaalsContact O-CB 3.27Å; A653-L658 WeakPolarHBondContact O-CB 3.37Å; A653-L658 PolarHBondContact O-N 3.31Å
654	A	89.4	Confident	91.2	Very high	4 Å²	4	15 Å²	15	3%	0.033	9%	0.09	C	C	.	.	I	π-helix	trans	-64.4	-49.3	178.1	0	0	0	0	0	112.4	I648 C650 K651 A656 G657 T659	I648-A654 HydrophobicContact CB-CB 3.98Å; I648-A654 HydrophobicContact CG2-CB 3.77Å; C650-A654 PolarHBondContact O-N 3.38Å; K651-A654 PolarHBondContact O-N 2.66Å; A654-A656 VanDerWaalsContact C-N 3.29Å; A654-A656 PolarHBondContact O-N 3.43Å; A654-G657 WeakPolarHBondContact O-CA 3.45Å; A654-G657 PolarHBondContact O-N 2.86Å; A654-T659 HydrophobicContact CB-CG2 3.84Å
655	S	87.1	Confident	91.5	Very high	48 Å²	48	14.5 Å²	14.5	34%	0.336	9%	0.087	S	C	.	.	I	π-helix	trans	-70.2	-23.4	177.6	-72.6	0	0	0	0	113.2	T43 K651 G657	T43-S655 WeakPolarHBondContact CB-OG 3.45Å; T43-S655 PolarHBondContact O-OG 3.37Å; T43-S655 PolarHBondContact OG1-OG 3.32Å; K651-S655 WeakPolarHBondContact O-CB 3.41Å; K651-S655 PolarHBondContact O-N 3.03Å; K651-S655 PolarHBondContact O-OG 3.4Å; S655-G657 PolarHBondContact O-N 2.61Å
656	A	91.8	Very high	91.7	Very high	12 Å²	12	13.9 Å²	13.9	10%	0.099	8%	0.08	C	C	.	.	I	π-helix	trans	-75.4	-6.8	166.2	0	0	0	0	0	113.6	V265 P267 V268 L285 K652 A653 A654	V265-A656 HydrophobicContact CG2-CB 3.92Å; P267-A656 CarbonylContact C-O 3.53Å; P267-A656 WeakPolarHBondContact CA-O 3.27Å; V268-A656 PolarHBondContact N-O 2.67Å; L285-A656 HydrophobicContact CD1-CB 4.49Å; L285-A656 HydrophobicContact CD2-CB 3.52Å; K652-A656 VanDerWaalsContact O-CB 3.26Å; K652-A656 WeakPolarHBondContact O-CB 3.45Å; K652-A656 PolarHBondContact O-N 3.07Å; A653-A656 PolarHBondContact O-N 3.06Å; A654-A656 VanDerWaalsContact C-N 3.29Å; A654-A656 PolarHBondContact O-N 3.43Å
657	G	93.1	Very high	91.9	Very high	7 Å²	7	14 Å²	14	7%	0.072	8%	0.08	C	C	.	.	I	π-helix	trans	103.4	11.5	170.7	0	0	0	0	0	116.1	A653 A654 S655 T659 Q660	A653-G657 PolarHBondContact O-N 3.3Å; A654-G657 WeakPolarHBondContact O-CA 3.45Å; A654-G657 PolarHBondContact O-N 2.86Å; S655-G657 PolarHBondContact O-N 2.61Å; G657-T659 PolarHBondContact O-N 2.91Å; G657-T659 VanDerWaalsContact O-N 3.11Å; G657-Q660 VanDerWaalsContact O-CB 3.29Å; G657-Q660 WeakPolarHBondContact O-CB 3.33Å; G657-Q660 PolarHBondContact O-N 2.88Å
658	L	94.8	Very high	92.2	Very high	5 Å²	5	14.4 Å²	14.4	3%	0.026	8%	0.081	C	C	.	.	I	π-helix	trans	-62.1	-17.2	175.2	-168.2	63.5	0	0	0	112.8	F282 L285 E289 P622 I648 A653 Q660	F282-L658 HydrophobicContact CD1-CD1 4.08Å; F282-L658 HydrophobicContact CE1-CD1 4.21Å; L285-L658 HydrophobicContact CB-CD1 4.28Å; L285-L658 HydrophobicContact CB-CD2 4.23Å; E289-L658 HydrophobicContact CB-CD2 4.31Å; P622-L658 HydrophobicContact CG-CD1 4.11Å; I648-L658 HydrophobicContact CD1-CB 4.15Å; I648-L658 HydrophobicContact CD1-CD2 3.86Å; I648-L658 HydrophobicContact CD1-CG 3.66Å; I648-L658 HydrophobicContact CG1-CB 4.3Å; I648-L658 HydrophobicContact CG1-CG 4.36Å; I648-L658 HydrophobicContact CG2-CB 4.5Å; I648-L658 HydrophobicContact CG2-CD2 4.34Å; A653-L658 HydrophobicContact CB-CB 4.26Å; A653-L658 HydrophobicContact CB-CD2 3.91Å; A653-L658 VanDerWaalsContact O-CB 3.27Å; A653-L658 WeakPolarHBondContact O-CB 3.37Å; A653-L658 PolarHBondContact O-N 3.31Å; L658-Q660 PolarHBondContact O-N 2.77Å
659	T	92.2	Very high	92.4	Very high	6 Å²	6	15.5 Å²	15.5	4%	0.037	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-12.4	169.9	54.3	0	0	0	0	113.6	P646 I648 A654 G657 S661 Y905	P646-T659 WeakPolarHBondContact CD-O 3.47Å; P646-T659 WeakPolarHBondContact CG-O 3.17Å; I648-T659 HydrophobicContact CB-CG2 3.97Å; I648-T659 HydrophobicContact CG1-CG2 3.6Å; A654-T659 HydrophobicContact CB-CG2 3.84Å; G657-T659 PolarHBondContact O-N 2.91Å; G657-T659 VanDerWaalsContact O-N 3.11Å; T659-S661 PolarHBondContact O-N 3.11Å; T659-Y905 VanDerWaalsContact C-OH 3.29Å; T659-Y905 PolarHBondContact O-OH 2.85Å; T659-Y905 VanDerWaalsContact O-OH 3.13Å; T659-Y905 PolarHBondContact OG1-OH 3.29Å
660	Q	93.9	Very high	92.7	Very high	7 Å²	7	16.9 Å²	16.9	3%	0.033	11%	0.108	C	C	.	.			trans	-79.8	112.6	177.8	-165.3	170.7	114.5	0	0	110.1	G657 L658 E664 R665 Y905	G657-Q660 VanDerWaalsContact O-CB 3.29Å; G657-Q660 WeakPolarHBondContact O-CB 3.33Å; G657-Q660 PolarHBondContact O-N 2.88Å; L658-Q660 PolarHBondContact O-N 2.77Å; Q660-E664 HydrophobicContact CG-CB 4.01Å; Q660-R665 HydrophobicContact CG-CB 4.29Å; Q660-R665 VanDerWaalsContact OE1-CB 3.23Å; Q660-R665 VanDerWaalsContact OE1-CG 3.26Å; Q660-Y905 VanDerWaalsContact CA-OH 3.26Å; Q660-Y905 WeakPolarHBondContact CA-OH 3.41Å; Q660-Y905 HydrophobicContact CB-CE1 4.04Å; Q660-Y905 HydrophobicContact CB-CE2 4.27Å; Q660-Y905 HydrophobicContact CG-CD2 4.48Å; Q660-Y905 HydrophobicContact CG-CE1 4.49Å; Q660-Y905 HydrophobicContact CG-CE2 3.95Å; Q660-Y905 PolarHBondContact N-OH 3.41Å; Q660-Y905 VanDerWaalsContact NE2-CD2 3.35Å; Q660-Y905 VanDerWaalsContact NE2-CG 3.3Å
661	S	96.9	Very high	93	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.109	C	C	.	.			trans	-71.1	152.6	172.8	62.6	0	0	0	0	111.1	A619 T659 F663 E664 R665	A619-S661 VanDerWaalsContact O-CB 3.29Å; A619-S661 WeakPolarHBondContact O-CB 3.35Å; T659-S661 PolarHBondContact O-N 3.11Å; S661-F663 PolarHBondContact O-N 2.93Å; S661-F663 VanDerWaalsContact O-N 3.14Å; S661-E664 WeakPolarHBondContact O-CA 3.22Å; S661-E664 WeakPolarHBondContact O-CB 3.38Å; S661-E664 PolarHBondContact O-N 2.8Å; S661-E664 WeakPolarHBondContact OG-CG 3.45Å; S661-E664 PolarHBondContact OG-N 3.01Å; S661-R665 PolarHBondContact O-N 3.08Å
662	L	97.4	Very high	93.4	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-54.8	-34.8	176.5	179.9	61.1	0	0	0	112.2	L423 E621 C624 L637 F666	L423-L662 HydrophobicContact CD1-CD1 3.52Å; L423-L662 HydrophobicContact CD1-CD2 4.36Å; E621-L662 HydrophobicContact CB-CB 4.08Å; E621-L662 HydrophobicContact CG-CB 3.99Å; E621-L662 HydrophobicContact CG-CD1 4.01Å; E621-L662 HydrophobicContact CG-CG 4.48Å; E621-L662 WeakPolarHBondContact OE2-CD1 3.35Å; C624-L662 HydrophobicContact CB-CB 4.15Å; C624-L662 HydrophobicContact CB-CD2 3.87Å; L637-L662 HydrophobicContact CD1-CD2 4.12Å; L637-L662 HydrophobicContact CD1-CG 4.11Å; L662-F666 HydrophobicContact CD1-CD1 4.39Å; L662-F666 HydrophobicContact CD1-CD2 4.1Å; L662-F666 HydrophobicContact CD1-CE1 3.9Å; L662-F666 HydrophobicContact CD1-CE2 3.63Å; L662-F666 HydrophobicContact CD1-CG 4.48Å; L662-F666 HydrophobicContact CD1-CZ 3.53Å; L662-F666 HydrophobicContact CD2-CE2 3.96Å; L662-F666 HydrophobicContact CD2-CZ 4.35Å; L662-F666 HydrophobicContact CG-CD2 3.93Å; L662-F666 HydrophobicContact CG-CE2 3.56Å; L662-F666 HydrophobicContact CG-CZ 4Å; L662-F666 WeakPolarHBondContact O-CB 3.24Å; L662-F666 WeakPolarHBondContact O-CD2 3.49Å; L662-F666 VanDerWaalsContact O-CG 3.31Å; L662-F666 WeakPolarHBondContact O-CG 3.36Å; L662-F666 PolarHBondContact O-N 2.86Å
663	F	98	Very high	93.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-46.7	174.2	-172.4	-72.3	0	0	0	111.5	L467 I468 Q469 S616 T617 L637 H641 S661 F666 V667 P673	L467-F663 HydrophobicContact CB-CD2 4.32Å; L467-F663 HydrophobicContact CB-CE2 3.79Å; L467-F663 HydrophobicContact CB-CZ 4.09Å; L467-F663 HydrophobicContact CD2-CD2 4.29Å; I468-F663 WeakPolarHBondContact O-CE2 3.27Å; Q469-F663 HydrophobicContact CB-CZ 4.4Å; S616-F663 WeakPolarHBondContact OG-CD2 3.09Å; T617-F663 HydrophobicContact CG2-CB 3.74Å; T617-F663 HydrophobicContact CG2-CD1 3.49Å; T617-F663 VanDerWaalsContact CG2-CD1 3.49Å; T617-F663 HydrophobicContact CG2-CD2 4.24Å; T617-F663 HydrophobicContact CG2-CE1 4.13Å; T617-F663 HydrophobicContact CG2-CG 3.57Å; L637-F663 HydrophobicContact CB-CD2 3.87Å; H641-F663 HydrophobicContact CB-CD1 4.41Å; H641-F663 HydrophobicContact CB-CE1 4.41Å; S661-F663 PolarHBondContact O-N 2.93Å; S661-F663 VanDerWaalsContact O-N 3.14Å; F663-F666 PolarHBondContact O-N 2.87Å; F663-V667 HydrophobicContact CD1-CG2 4.02Å; F663-V667 HydrophobicContact CE1-CG2 3.84Å; F663-V667 WeakPolarHBondContact O-CG2 3.35Å; F663-V667 PolarHBondContact O-N 2.79Å; F663-P673 HydrophobicContact CE1-CB 4.46Å; F663-P673 HydrophobicContact CZ-CB 4.03Å
664	E	95.4	Very high	94.1	Very high	6 Å²	6	22.1 Å²	22.1	3%	0.028	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-46.4	177	-74.6	175.3	177.4	0	0	111.8	H641 Q660 S661 F666 V667 L668 R834 Y905	H641-E664 HydrophobicContact CB-CG 3.97Å; Q660-E664 HydrophobicContact CG-CB 4.01Å; S661-E664 WeakPolarHBondContact O-CA 3.22Å; S661-E664 WeakPolarHBondContact O-CB 3.38Å; S661-E664 PolarHBondContact O-N 2.8Å; S661-E664 WeakPolarHBondContact OG-CG 3.45Å; S661-E664 PolarHBondContact OG-N 3.01Å; E664-F666 VanDerWaalsContact C-N 3.32Å; E664-F666 PolarHBondContact O-N 3.43Å; E664-V667 PolarHBondContact O-N 3.37Å; E664-V667 VanDerWaalsContact O-N 3.14Å; E664-L668 WeakPolarHBondContact O-CG 3.21Å; E664-L668 PolarHBondContact O-N 2.82Å; E664-R834 IonicContact OE1-CZ 3.17Å; E664-R834 IonicContact OE1-NH1 2.68Å; E664-R834 PolarHBondContact OE1-NH1 2.88Å; E664-R834 IonicContact OE1-NH2 2.74Å; E664-R834 PolarHBondContact OE1-NH2 3.38Å; E664-Y905 VanDerWaalsContact OE2-CE2 3.28Å; E664-Y905 WeakPolarHBondContact OE2-CE2 3.47Å; E664-Y905 PolarHBondContact OE2-OH 2.81Å; E664-Y905 VanDerWaalsContact OE2-OH 3.05Å
665	R	96.1	Very high	94.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-42.1	178.9	-165.8	167.9	62.8	83.8	3.2	111.6	L269 L270 L423 E621 Q660 S661 V667 L668 L669	L269-R665 VanDerWaalsContact O-CD 3.3Å; L269-R665 WeakPolarHBondContact O-CD 3.35Å; L270-R665 HydrophobicContact CD2-CG 4.02Å; L270-R665 PolarHBondContact O-NH1 3.21Å; L423-R665 VanDerWaalsContact O-CZ 3.31Å; L423-R665 PolarHBondContact O-NH1 3.36Å; L423-R665 PolarHBondContact O-NH2 3.23Å; E621-R665 VanDerWaalsContact CD-NH2 3.3Å; E621-R665 IonicContact OE1-CZ 3.95Å; E621-R665 IonicContact OE1-NE 3.96Å; E621-R665 IonicContact OE1-NH2 3.74Å; E621-R665 PolarHBondContact OE1-NH2 2.85Å; E621-R665 IonicContact OE2-CZ 3.86Å; E621-R665 IonicContact OE2-NE 2.68Å; E621-R665 PolarHBondContact OE2-NE 3.03Å; E621-R665 IonicContact OE2-NH2 2.73Å; E621-R665 PolarHBondContact OE2-NH2 3.17Å; Q660-R665 HydrophobicContact CG-CB 4.29Å; Q660-R665 VanDerWaalsContact OE1-CB 3.23Å; Q660-R665 VanDerWaalsContact OE1-CG 3.26Å; S661-R665 PolarHBondContact O-N 3.08Å; R665-V667 PolarHBondContact O-N 3.48Å; R665-L668 PolarHBondContact O-N 2.79Å; R665-L669 HydrophobicContact CG-CD1 4.13Å; R665-L669 WeakPolarHBondContact O-CB 3.49Å; R665-L669 WeakPolarHBondContact O-CD1 3.25Å; R665-L669 VanDerWaalsContact O-CG 3.26Å; R665-L669 WeakPolarHBondContact O-CG 3.18Å; R665-L669 PolarHBondContact O-N 3.47Å
666	F	96.7	Very high	95	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-36.4	174.3	-73.4	-28.9	0	0	0	113.6	R422 L423 L465 L467 L637 L662 F663 E664 L669 G670 I671	R422-F666 WeakPolarHBondContact O-CE1 3.19Å; L423-F666 HydrophobicContact CD1-CZ 4.5Å; L465-F666 HydrophobicContact CD1-CE2 4.1Å; L465-F666 HydrophobicContact CD2-CD2 4.43Å; L465-F666 HydrophobicContact CD2-CE1 4.49Å; L465-F666 HydrophobicContact CD2-CE2 3.93Å; L465-F666 HydrophobicContact CD2-CZ 3.96Å; L467-F666 HydrophobicContact CD1-CB 3.76Å; L467-F666 HydrophobicContact CD2-CB 4.27Å; L467-F666 HydrophobicContact CD2-CD2 3.89Å; L637-F666 HydrophobicContact CD1-CD2 3.85Å; L637-F666 HydrophobicContact CD1-CE2 3.9Å; L662-F666 HydrophobicContact CD1-CD1 4.39Å; L662-F666 HydrophobicContact CD1-CD2 4.1Å; L662-F666 HydrophobicContact CD1-CE1 3.9Å; L662-F666 HydrophobicContact CD1-CE2 3.63Å; L662-F666 HydrophobicContact CD1-CG 4.48Å; L662-F666 HydrophobicContact CD1-CZ 3.53Å; L662-F666 HydrophobicContact CD2-CE2 3.96Å; L662-F666 HydrophobicContact CD2-CZ 4.35Å; L662-F666 HydrophobicContact CG-CD2 3.93Å; L662-F666 HydrophobicContact CG-CE2 3.56Å; L662-F666 HydrophobicContact CG-CZ 4Å; L662-F666 WeakPolarHBondContact O-CB 3.24Å; L662-F666 WeakPolarHBondContact O-CD2 3.49Å; L662-F666 VanDerWaalsContact O-CG 3.31Å; L662-F666 WeakPolarHBondContact O-CG 3.36Å; L662-F666 PolarHBondContact O-N 2.86Å; F663-F666 PolarHBondContact O-N 2.87Å; E664-F666 VanDerWaalsContact C-N 3.32Å; E664-F666 PolarHBondContact O-N 3.43Å; F666-L669 HydrophobicContact CD1-CD1 4.08Å; F666-L669 PolarHBondContact O-N 2.88Å; F666-G670 PolarHBondContact O-N 2.89Å; F666-I671 HydrophobicContact CB-CB 4.28Å; F666-I671 HydrophobicContact CB-CD1 4.02Å; F666-I671 HydrophobicContact CB-CG1 4.43Å; F666-I671 HydrophobicContact CD1-CD1 3.78Å; F666-I671 HydrophobicContact CE1-CD1 4.42Å; F666-I671 HydrophobicContact CG-CD1 3.97Å; F666-I671 VanDerWaalsContact O-CB 3.28Å; F666-I671 WeakPolarHBondContact O-CB 3.45Å; F666-I671 PolarHBondContact O-N 3.43Å
667	V	94.9	Very high	95.3	Very high	10 Å²	10	24.9 Å²	24.9	6%	0.061	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-42.3	172.6	175	0	0	0	0	111.2	L467 F663 E664 R665 L669 G670 P673	L467-V667 HydrophobicContact CD1-CG2 3.89Å; F663-V667 HydrophobicContact CD1-CG2 4.02Å; F663-V667 HydrophobicContact CE1-CG2 3.84Å; F663-V667 WeakPolarHBondContact O-CG2 3.35Å; F663-V667 PolarHBondContact O-N 2.79Å; E664-V667 PolarHBondContact O-N 3.37Å; E664-V667 VanDerWaalsContact O-N 3.14Å; R665-V667 PolarHBondContact O-N 3.48Å; V667-L669 VanDerWaalsContact C-N 3.27Å; V667-L669 PolarHBondContact O-N 2.79Å; V667-G670 PolarHBondContact O-N 3.39Å; V667-P673 HydrophobicContact CG2-CB 4.46Å; V667-P673 HydrophobicContact CG2-CG 3.95Å
668	L	93.8	Very high	95.5	Very high	39 Å²	39	25 Å²	25	20%	0.204	13%	0.129	C	C	.	.	H	α-helix	trans	-66.2	-28.3	176.2	-67.5	172.8	0	0	0	112.9	L270 E664 R665 G670 Y905 F969	L270-L668 HydrophobicContact CD2-CB 3.87Å; L270-L668 HydrophobicContact CD2-CD1 3.91Å; E664-L668 WeakPolarHBondContact O-CG 3.21Å; E664-L668 PolarHBondContact O-N 2.82Å; R665-L668 PolarHBondContact O-N 2.79Å; L668-G670 PolarHBondContact O-N 3.28Å; L668-Y905 HydrophobicContact CD1-CD2 4.1Å; L668-F969 HydrophobicContact CD2-CZ 4.46Å
669	L	93.9	Very high	95.6	Very high	29 Å²	29	24.8 Å²	24.8	15%	0.152	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	5.3	170	-72.1	164.9	0	0	0	114.1	L270 R271 R665 F666 V667	L270-L669 HydrophobicContact CB-CD2 4.29Å; R271-L669 HydrophobicContact CG-CD2 3.63Å; R665-L669 HydrophobicContact CG-CD1 4.13Å; R665-L669 WeakPolarHBondContact O-CB 3.49Å; R665-L669 WeakPolarHBondContact O-CD1 3.25Å; R665-L669 VanDerWaalsContact O-CG 3.26Å; R665-L669 WeakPolarHBondContact O-CG 3.18Å; R665-L669 PolarHBondContact O-N 3.47Å; F666-L669 HydrophobicContact CD1-CD1 4.08Å; F666-L669 PolarHBondContact O-N 2.88Å; V667-L669 VanDerWaalsContact C-N 3.27Å; V667-L669 PolarHBondContact O-N 2.79Å
670	G	91.6	Very high	95.8	Very high	60 Å²	60	28.7 Å²	28.7	62%	0.619	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	82	6.5	177.2	0	0	0	0	0	115.2	F666 V667 L668 R672	F666-G670 PolarHBondContact O-N 2.89Å; V667-G670 PolarHBondContact O-N 3.39Å; L668-G670 PolarHBondContact O-N 3.28Å; G670-R672 VanDerWaalsContact C-N 3.32Å; G670-R672 PolarHBondContact O-N 2.88Å
671	I	93.3	Very high	95.9	Very high	20 Å²	20	29.7 Å²	29.7	10%	0.103	15%	0.146	C	C	.	.			trans	-72.6	90.5	172.6	-51	-174.7	0	0	0	108	L465 L467 F666 P673	L465-I671 HydrophobicContact CD2-CD1 4.11Å; L467-I671 HydrophobicContact CD1-CB 4.22Å; L467-I671 HydrophobicContact CD1-CG2 4.08Å; L467-I671 WeakPolarHBondContact CD1-O 3.34Å; L467-I671 HydrophobicContact CG-CG2 4.11Å; F666-I671 HydrophobicContact CB-CB 4.28Å; F666-I671 HydrophobicContact CB-CD1 4.02Å; F666-I671 HydrophobicContact CB-CG1 4.43Å; F666-I671 HydrophobicContact CD1-CD1 3.78Å; F666-I671 HydrophobicContact CE1-CD1 4.42Å; F666-I671 HydrophobicContact CG-CD1 3.97Å; F666-I671 VanDerWaalsContact O-CB 3.28Å; F666-I671 WeakPolarHBondContact O-CB 3.45Å; F666-I671 PolarHBondContact O-N 3.43Å; I671-P673 WeakPolarHBondContact O-CD 3.34Å
672	R	92.8	Very high	95.9	Very high	172 Å²	172	29.8 Å²	29.8	65%	0.649	15%	0.146	S	C	*	.			trans	-61.3	122.2	-173.6	-175	176.1	-178.7	169.4	2.1	111.5	G670	G670-R672 VanDerWaalsContact C-N 3.32Å; G670-R672 PolarHBondContact O-N 2.88Å
673	P	96.5	Very high	95.9	Very high	12 Å²	12	30 Å²	30	8%	0.078	15%	0.147	C	C	.	.			trans	-77.6	146.7	178.9	32.2	-33.9	0	0	0	111.7	L467 Q469 F663 V667 I671 R675	L467-P673 HydrophobicContact CB-CB 3.82Å; L467-P673 HydrophobicContact CD1-CB 4.48Å; Q469-P673 HydrophobicContact CB-CB 4.12Å; Q469-P673 HydrophobicContact CB-CG 4.36Å; F663-P673 HydrophobicContact CE1-CB 4.46Å; F663-P673 HydrophobicContact CZ-CB 4.03Å; V667-P673 HydrophobicContact CG2-CB 4.46Å; V667-P673 HydrophobicContact CG2-CG 3.95Å; I671-P673 WeakPolarHBondContact O-CD 3.34Å; P673-R675 PolarHBondContact O-N 3.27Å
674	I	97.3	Very high	95.8	Very high	21 Å²	21	31.5 Å²	31.5	11%	0.108	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	104.4	174.2	-50.9	168.4	0	0	0	107.7	F455 A456 T459 V460 L467 I468 Q469	F455-I674 HydrophobicContact CD1-CG2 3.78Å; F455-I674 HydrophobicContact CE1-CG2 3.97Å; A456-I674 HydrophobicContact CB-CG2 3.82Å; T459-I674 HydrophobicContact CG2-CD1 3.72Å; V460-I674 HydrophobicContact CG2-CD1 4.31Å; L467-I674 PolarHBondContact O-N 3.38Å; I468-I674 CarbonylContact C-O 3.59Å; I468-I674 WeakPolarHBondContact CA-O 3.47Å; I468-I674 HydrophobicContact CG1-CB 4.47Å; Q469-I674 PolarHBondContact N-O 2.83Å
675	R	96.9	Very high	95.9	Very high	52 Å²	52	31.9 Å²	31.9	20%	0.196	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	126.5	178.8	-168.4	-176.5	-65.3	156.3	1.3	111.1	Q469 P471 P673 Y695 E696 S698	Q469-R675 HydrophobicContact CB-CB 4.36Å; Q469-R675 HydrophobicContact CB-CG 4.38Å; Q469-R675 HydrophobicContact CG-CG 4.47Å; Q469-R675 CarbonylContact O-C 3.58Å; Q469-R675 WeakPolarHBondContact O-CA 3.32Å; P471-R675 HydrophobicContact CG-CG 4.05Å; P673-R675 PolarHBondContact O-N 3.27Å; R675-Y695 PolarHBondContact NH1-O 2.86Å; R675-E696 IonicContact CZ-OE2 3.11Å; R675-E696 IonicContact NH1-OE2 3.73Å; R675-E696 PolarHBondContact NH1-OE2 3.42Å; R675-E696 IonicContact NH2-OE2 3.15Å; R675-E696 PolarHBondContact NH2-OE2 3.28Å; R675-S698 WeakPolarHBondContact CD-OG 3.37Å; R675-S698 PolarHBondContact NH1-OG 2.74Å
676	L	98.1	Very high	95.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.163	C	C	.	.			trans	-73.7	132.7	167.1	-56.5	-176.5	0	0	0	109.7	Q453 A456 I468 Q469 T474 T479	Q453-L676 HydrophobicContact CG-CD2 4.04Å; A456-L676 HydrophobicContact CB-CD2 3.92Å; I468-L676 HydrophobicContact CG2-CD1 4.22Å; I468-L676 HydrophobicContact CG2-CD2 4.23Å; I468-L676 HydrophobicContact CG2-CG 3.95Å; Q469-L676 PolarHBondContact O-N 2.9Å; T474-L676 HydrophobicContact CG2-CB 4.35Å; T479-L676 HydrophobicContact CG2-CD2 4.38Å
677	Q	97.3	Very high	95.9	Very high	70 Å²	70	32.1 Å²	32.1	33%	0.327	16%	0.163	S	C	.	.			trans	-110.5	-13.6	-162.4	-67.1	179.9	-38.3	0	0	115.4	S452 L699 Q700	S452-Q677 PolarHBondContact OG-N 3.36Å; Q677-L699 WeakPolarHBondContact O-CA 3.23Å; Q677-Q700 PolarHBondContact O-N 2.88Å
678	V	98	Very high	96	Very high	10 Å²	10	33.1 Å²	33.1	6%	0.061	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.8	-175.6	-168.2	0	0	0	0	109.9	N450 T474 Y680 Q700 G702	N450-V678 HydrophobicContact CB-CG2 4.3Å; T474-V678 VanDerWaalsContact CA-O 3.31Å; T474-V678 WeakPolarHBondContact CA-O 3.18Å; V678-Y680 HydrophobicContact CB-CE2 4.17Å; V678-Y680 HydrophobicContact CG1-CE1 4.26Å; V678-Y680 HydrophobicContact CG1-CE2 4.05Å; V678-Y680 WeakPolarHBondContact O-CE2 3.24Å; V678-Q700 WeakPolarHBondContact CA-O 3.48Å; V678-Q700 HydrophobicContact CG2-CB 4.4Å; V678-G702 VanDerWaalsContact CG1-CA 3.48Å
679	Q	96.9	Very high	96.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.2	179.8	82.2	80	21.9	0	0	111.9	T474 M682 Q700 N701 G702	T474-Q679 HydrophobicContact CG2-CB 4.19Å; Q679-M682 HydrophobicContact CB-CE 4.47Å; Q679-M682 HydrophobicContact CG-CE 4.1Å; Q679-M682 PolarHBondContact NE2-O 3.05Å; Q679-Q700 PolarHBondContact N-O 3.43Å; Q679-N701 PolarHBondContact NE2-OD1 2.66Å; Q679-G702 PolarHBondContact O-N 2.78Å
680	Y	96.3	Very high	96.3	Very high	87 Å²	87	30.3 Å²	30.3	34%	0.341	16%	0.158	S	C	.	.			trans	-121.5	5.5	-176.8	-56.3	-92.8	0	0	0	114	N450 G473 V678 G702 V703 R708	N450-Y680 PolarHBondContact ND2-OH 3.07Å; G473-Y680 PolarHBondContact O-N 2.91Å; V678-Y680 HydrophobicContact CB-CE2 4.17Å; V678-Y680 HydrophobicContact CG1-CE1 4.26Å; V678-Y680 HydrophobicContact CG1-CE2 4.05Å; V678-Y680 WeakPolarHBondContact O-CE2 3.24Å; Y680-G702 WeakPolarHBondContact CD1-O 3.43Å; Y680-V703 HydrophobicContact CD1-CG1 4.35Å; Y680-R708 PolarHBondContact O-NH2 3.32Å
681	R	95	Very high	96.6	Very high	29 Å²	29	27.8 Å²	27.8	11%	0.109	13%	0.13	C	C	.	.	S	Bend	trans	-87.5	-60.5	-175.9	175.6	-176.6	-80.4	-175.5	-9	111.7	R708 E810 T841 R844	R681-R708 PolarHBondContact O-NE 3.42Å; R681-E810 IonicContact CZ-OE2 3.38Å; R681-E810 IonicContact NE-OE2 3.14Å; R681-E810 PolarHBondContact NE-OE2 2.86Å; R681-E810 IonicContact NH2-OE2 2.76Å; R681-E810 PolarHBondContact NH2-OE2 3.49Å; R681-T841 VanDerWaalsContact CD-O 3.25Å; R681-T841 WeakPolarHBondContact CD-O 3.49Å; R681-T841 PolarHBondContact NH1-O 3.26Å; R681-R844 HydrophobicContact CG-CG 4.01Å
682	M	97	Very high	96.6	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.152	C	C	.	.	S	Bend	trans	-89	147.9	-163.1	-66.5	166.6	-75.6	0	0	112.1	P472 Q679 L686 T841 A843	P472-M682 HydrophobicContact CB-CE 4.32Å; Q679-M682 HydrophobicContact CB-CE 4.47Å; Q679-M682 HydrophobicContact CG-CE 4.1Å; Q679-M682 PolarHBondContact NE2-O 3.05Å; M682-L686 HydrophobicContact CB-CB 4.17Å; M682-T841 HydrophobicContact CE-CG2 4.41Å; M682-T841 HydrophobicContact SD-CG2 3.88Å; M682-A843 WeakPolarHBondContact CG-O 3.44Å
683	H	97.4	Very high	96.7	Very high	7 Å²	7	24.1 Å²	24.1	3%	0.032	12%	0.124	C	C	.	.			trans	-53.4	139	160.5	-177.2	-96.2	0	0	0	110.8	A685 L686 S687 A705 R708 D720 R844	H683-A685 WeakPolarHBondContact ND1-CB 3.32Å; H683-A685 PolarHBondContact ND1-N 2.87Å; H683-A685 PolarHBondContact O-N 3.38Å; H683-L686 HydrophobicContact CB-CD1 3.84Å; H683-L686 HydrophobicContact CB-CG 4Å; H683-L686 WeakPolarHBondContact O-CB 3.39Å; H683-L686 PolarHBondContact O-N 2.99Å; H683-S687 PolarHBondContact O-N 2.87Å; H683-A705 PolarHBondContact CD2-O 2.6Å; H683-A705 WeakPolarHBondContact NE2-CA 3.44Å; H683-A705 WeakPolarHBondContact NE2-CB 3.42Å; H683-R708 HydrophobicContact CB-CB 3.69Å; H683-R708 HydrophobicContact CB-CG 4.49Å; H683-D720 PolarHBondContact CE1-O 2.91Å; H683-R844 PolarHBondContact N-O 2.91Å
684	P	97.3	Very high	96.6	Very high	32 Å²	32	23.8 Å²	23.8	21%	0.208	12%	0.122	C	C	.	.	H	α-helix	trans	-52.9	-30.4	-176.4	-32.7	38.3	0	0	0	116.2	S687 A688 N701 T704	P684-S687 PolarHBondContact O-OG 3.09Å; P684-S687 VanDerWaalsContact O-OG 3.1Å; P684-A688 PolarHBondContact O-N 3.34Å; P684-N701 HydrophobicContact CB-CB 4.49Å; P684-N701 HydrophobicContact CG-CB 4.25Å; P684-T704 WeakPolarHBondContact CD-O 3.49Å
685	A	96.6	Very high	96.4	Very high	14 Å²	14	22.8 Å²	22.8	12%	0.116	12%	0.116	C	C	.	.	H	α-helix	trans	-70.8	-36.7	174.9	0	0	0	0	0	112.6	H683 R721 M723	H683-A685 WeakPolarHBondContact ND1-CB 3.32Å; H683-A685 PolarHBondContact ND1-N 2.87Å; H683-A685 PolarHBondContact O-N 3.38Å; A685-R721 HydrophobicContact CB-CB 4.31Å; A685-R721 HydrophobicContact CB-CG 4.19Å; A685-M723 HydrophobicContact CB-CE 3.94Å; A685-M723 WeakPolarHBondContact O-CE 3.19Å
686	L	97.2	Very high	96.2	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.037	14%	0.141	C	C	.	.	H	α-helix	trans	-69	-40.4	179.5	-61.5	173.9	0	0	0	111.4	M682 H683 A688 P690 M723 A843 L847	M682-L686 HydrophobicContact CB-CB 4.17Å; H683-L686 HydrophobicContact CB-CD1 3.84Å; H683-L686 HydrophobicContact CB-CG 4Å; H683-L686 WeakPolarHBondContact O-CB 3.39Å; H683-L686 PolarHBondContact O-N 2.99Å; L686-A688 VanDerWaalsContact C-N 3.29Å; L686-A688 PolarHBondContact O-N 3.4Å; L686-P690 WeakPolarHBondContact O-CD 3.49Å; L686-M723 HydrophobicContact CD2-CB 3.69Å; L686-M723 HydrophobicContact CD2-CG 3.98Å; L686-M723 HydrophobicContact CD2-SD 3.83Å; L686-A843 HydrophobicContact CD1-CB 4.09Å; L686-L847 HydrophobicContact CD2-CB 3.6Å; L686-L847 HydrophobicContact CD2-CD2 4.44Å
687	S	96.9	Very high	95.9	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-72.3	-19.6	-179.3	61.6	0	0	0	0	113.6	H683 P684 F689 P690 S691 N701	H683-S687 PolarHBondContact O-N 2.87Å; P684-S687 PolarHBondContact O-OG 3.09Å; P684-S687 VanDerWaalsContact O-OG 3.1Å; S687-F689 PolarHBondContact O-N 3.49Å; S687-P690 WeakPolarHBondContact O-CD 3.19Å; S687-S691 WeakPolarHBondContact O-CB 3.41Å; S687-S691 PolarHBondContact O-N 3.2Å; S687-N701 PolarHBondContact OG-OD1 3.01Å
688	A	96.8	Very high	95.7	Very high	32 Å²	32	27.2 Å²	27.2	26%	0.264	15%	0.152	S	C	.	.	H	α-helix	trans	-61.8	-44.6	-173.9	0	0	0	0	0	113.7	P684 L686 N692 F868	P684-A688 PolarHBondContact O-N 3.34Å; L686-A688 VanDerWaalsContact C-N 3.29Å; L686-A688 PolarHBondContact O-N 3.4Å; A688-N692 WeakPolarHBondContact O-CB 3.38Å; A688-N692 VanDerWaalsContact O-CG 3.27Å; A688-N692 PolarHBondContact O-N 3.31Å; A688-N692 VanDerWaalsContact O-N 3.14Å; A688-N692 PolarHBondContact O-ND2 3.47Å; A688-F868 HydrophobicContact CB-CE2 4.35Å; A688-F868 HydrophobicContact CB-CZ 4.27Å
689	F	97.1	Very high	95.6	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-69.2	-52.2	177.6	179.8	-83.9	0	0	0	112.1	S687 S691 N692 V693 F694 L840 L861 Q864 L865 F868	S687-F689 PolarHBondContact O-N 3.49Å; F689-S691 VanDerWaalsContact C-N 3.32Å; F689-S691 PolarHBondContact O-N 2.85Å; F689-N692 PolarHBondContact O-N 3.34Å; F689-V693 HydrophobicContact CD1-CG2 4.23Å; F689-V693 HydrophobicContact CD2-CG2 4.02Å; F689-V693 HydrophobicContact CE1-CB 4.2Å; F689-V693 HydrophobicContact CE1-CG1 4.39Å; F689-V693 HydrophobicContact CE1-CG2 3.96Å; F689-V693 HydrophobicContact CE2-CG2 3.74Å; F689-V693 HydrophobicContact CG-CG2 4.27Å; F689-V693 HydrophobicContact CZ-CB 4.35Å; F689-V693 HydrophobicContact CZ-CG1 4.39Å; F689-V693 HydrophobicContact CZ-CG2 3.71Å; F689-V693 WeakPolarHBondContact O-CB 3.45Å; F689-V693 WeakPolarHBondContact O-CG2 3.28Å; F689-V693 PolarHBondContact O-N 3.43Å; F689-F694 HydrophobicContact CE1-CE2 4.25Å; F689-L840 HydrophobicContact CD1-CD1 3.64Å; F689-L840 HydrophobicContact CE1-CD1 3.82Å; F689-L861 HydrophobicContact CE1-CD1 4.45Å; F689-L861 HydrophobicContact CZ-CD1 4.1Å; F689-Q864 HydrophobicContact CE2-CG 4.32Å; F689-L865 HydrophobicContact CD1-CD1 3.89Å; F689-L865 HydrophobicContact CD2-CD1 3.83Å; F689-L865 HydrophobicContact CE1-CB 4.38Å; F689-L865 HydrophobicContact CE1-CD1 3.87Å; F689-L865 HydrophobicContact CE2-CB 3.9Å; F689-L865 HydrophobicContact CE2-CD1 3.81Å; F689-L865 HydrophobicContact CE2-CG 4.48Å; F689-L865 HydrophobicContact CG-CD1 3.87Å; F689-L865 HydrophobicContact CZ-CB 3.69Å; F689-L865 HydrophobicContact CZ-CD1 3.82Å; F689-L865 HydrophobicContact CZ-CG 4.29Å; F689-F868 HydrophobicContact CB-CD1 4.05Å; F689-F868 HydrophobicContact CB-CD2 4.1Å; F689-F868 HydrophobicContact CB-CE1 3.83Å; F689-F868 HydrophobicContact CB-CE2 3.87Å; F689-F868 HydrophobicContact CB-CG 4.18Å; F689-F868 HydrophobicContact CB-CZ 3.74Å; F689-F868 HydrophobicContact CD2-CB 3.75Å; F689-F868 HydrophobicContact CD2-CD1 4.1Å; F689-F868 AromaticContact CD2-CD2 3.94Å; F689-F868 HydrophobicContact CD2-CD2 3.94Å; F689-F868 AromaticContact CD2-CG 3.67Å; F689-F868 HydrophobicContact CD2-CG 3.67Å; F689-F868 HydrophobicContact CE2-CB 4.19Å; F689-F868 HydrophobicContact CG-CD1 4.42Å; F689-F868 HydrophobicContact CG-CG 4.36Å
690	P	96.4	Very high	95.5	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.013	17%	0.173	C	C	.	.	H	α-helix	trans	-58.6	-40.9	177.2	-26.3	36.1	0	0	0	113.3	L686 S687 V693 F694 Y695 L840 T841	L686-P690 WeakPolarHBondContact O-CD 3.49Å; S687-P690 WeakPolarHBondContact O-CD 3.19Å; P690-V693 PolarHBondContact O-N 3.05Å; P690-F694 HydrophobicContact CB-CD2 4.14Å; P690-F694 PolarHBondContact O-N 3Å; P690-Y695 WeakPolarHBondContact O-CD2 3.46Å; P690-Y695 PolarHBondContact O-N 2.97Å; P690-L840 HydrophobicContact CG-CB 4.06Å; P690-L840 HydrophobicContact CG-CD1 4.4Å; P690-T841 HydrophobicContact CB-CG2 3.82Å; P690-T841 HydrophobicContact CG-CG2 3.87Å
691	S	96.6	Very high	95.6	Very high	6 Å²	6	30.8 Å²	30.8	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-55.6	-55.5	175.3	-175.7	0	0	0	0	111.1	S687 F689 V693 Y695 E696 G697 L699	S687-S691 WeakPolarHBondContact O-CB 3.41Å; S687-S691 PolarHBondContact O-N 3.2Å; F689-S691 VanDerWaalsContact C-N 3.32Å; F689-S691 PolarHBondContact O-N 2.85Å; S691-V693 PolarHBondContact O-N 3Å; S691-Y695 CarbonylContact O-C 3.6Å; S691-Y695 WeakPolarHBondContact O-CA 3.43Å; S691-Y695 PolarHBondContact O-N 3.3Å; S691-Y695 VanDerWaalsContact O-N 3.16Å; S691-E696 PolarHBondContact O-N 2.8Å; S691-E696 VanDerWaalsContact O-N 3.07Å; S691-G697 PolarHBondContact O-N 3.12Å; S691-L699 WeakPolarHBondContact OG-CB 3.32Å; S691-L699 PolarHBondContact OG-N 3.35Å; S691-L699 VanDerWaalsContact OG-N 3.16Å; S691-L699 PolarHBondContact OG-O 3.31Å
692	N	94.7	Very high	95.6	Very high	105 Å²	105	31 Å²	31	56%	0.561	19%	0.185	S	C	*	.	H	α-helix	trans	-66.6	-34	-176.3	-70.8	-19.2	0	0	0	113.3	A688 F689 G697	A688-N692 WeakPolarHBondContact O-CB 3.38Å; A688-N692 VanDerWaalsContact O-CG 3.27Å; A688-N692 PolarHBondContact O-N 3.31Å; A688-N692 VanDerWaalsContact O-N 3.14Å; A688-N692 PolarHBondContact O-ND2 3.47Å; F689-N692 PolarHBondContact O-N 3.34Å; N692-G697 WeakPolarHBondContact OD1-CA 3.41Å
693	V	94	Very high	95.5	Very high	11 Å²	11	31.8 Å²	31.8	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-93.5	-45.2	-171.4	178.1	0	0	0	0	113.6	F689 P690 S691 L861 Y897 F899	F689-V693 HydrophobicContact CD1-CG2 4.23Å; F689-V693 HydrophobicContact CD2-CG2 4.02Å; F689-V693 HydrophobicContact CE1-CB 4.2Å; F689-V693 HydrophobicContact CE1-CG1 4.39Å; F689-V693 HydrophobicContact CE1-CG2 3.96Å; F689-V693 HydrophobicContact CE2-CG2 3.74Å; F689-V693 HydrophobicContact CG-CG2 4.27Å; F689-V693 HydrophobicContact CZ-CB 4.35Å; F689-V693 HydrophobicContact CZ-CG1 4.39Å; F689-V693 HydrophobicContact CZ-CG2 3.71Å; F689-V693 WeakPolarHBondContact O-CB 3.45Å; F689-V693 WeakPolarHBondContact O-CG2 3.28Å; F689-V693 PolarHBondContact O-N 3.43Å; P690-V693 PolarHBondContact O-N 3.05Å; S691-V693 PolarHBondContact O-N 3Å; V693-L861 HydrophobicContact CG1-CD1 3.74Å; V693-Y897 HydrophobicContact CG1-CD1 3.94Å; V693-Y897 HydrophobicContact CG1-CE1 4.28Å; V693-F899 WeakPolarHBondContact O-CB 3.37Å
694	F	94.5	Very high	95.4	Very high	5 Å²	5	34.5 Å²	34.5	2%	0.022	21%	0.207	C	C	.	.	H	α-helix	trans	-102.8	-13.6	-175.1	-52.5	-68.2	0	0	0	113.5	C642 F689 P690 P833 L836 N837 L861 F899	C642-F694 HydrophobicContact CB-CB 4.41Å; C642-F694 PolarHBondContact SG-O 3.49Å; F689-F694 HydrophobicContact CE1-CE2 4.25Å; P690-F694 HydrophobicContact CB-CD2 4.14Å; P690-F694 PolarHBondContact O-N 3Å; F694-P833 HydrophobicContact CE1-CB 3.88Å; F694-P833 WeakPolarHBondContact CE1-O 3.13Å; F694-L836 HydrophobicContact CZ-CB 4.48Å; F694-L836 HydrophobicContact CZ-CD2 4.47Å; F694-L836 HydrophobicContact CZ-CG 4.41Å; F694-N837 HydrophobicContact CD1-CB 4.1Å; F694-N837 HydrophobicContact CD2-CB 3.54Å; F694-N837 VanDerWaalsContact CD2-OD1 3.25Å; F694-N837 WeakPolarHBondContact CD2-OD1 3.41Å; F694-N837 HydrophobicContact CE1-CB 4.11Å; F694-N837 HydrophobicContact CE2-CB 3.57Å; F694-N837 HydrophobicContact CG-CB 3.83Å; F694-N837 HydrophobicContact CZ-CB 3.86Å; F694-L861 HydrophobicContact CE1-CD1 4.38Å; F694-L861 HydrophobicContact CE1-CD2 4.26Å; F694-L861 HydrophobicContact CZ-CD1 4.17Å; F694-L861 HydrophobicContact CZ-CD2 4.32Å; F694-F899 HydrophobicContact CB-CD1 4.31Å; F694-F899 HydrophobicContact CD1-CB 4.16Å; F694-F899 AromaticContact CD1-CD1 3.99Å; F694-F899 HydrophobicContact CD1-CD1 3.99Å; F694-F899 HydrophobicContact CD1-CD2 4.17Å; F694-F899 HydrophobicContact CD1-CE1 4.44Å; F694-F899 AromaticContact CD1-CG 3.84Å; F694-F899 HydrophobicContact CD1-CG 3.84Å
695	Y	94.4	Very high	95.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-134	23.6	-175.9	-51.8	-76.8	0	0	0	113.3	P471 P472 D640 C642 R675 P690 S691 G697 S698 L699 N837	P471-Y695 HydrophobicContact CB-CD1 3.93Å; P471-Y695 HydrophobicContact CB-CE1 3.56Å; P471-Y695 HydrophobicContact CB-CE2 4.26Å; P471-Y695 HydrophobicContact CB-CG 4.42Å; P471-Y695 HydrophobicContact CG-CD1 3.59Å; P471-Y695 HydrophobicContact CG-CE1 3.51Å; P471-Y695 HydrophobicContact CG-CG 4.37Å; P472-Y695 WeakPolarHBondContact CD-OH 3.26Å; D640-Y695 WeakPolarHBondContact OD2-CE1 3.41Å; D640-Y695 PolarHBondContact OD2-OH 3.37Å; C642-Y695 HydrophobicContact CB-CD1 4.4Å; C642-Y695 HydrophobicContact CB-CE1 3.57Å; R675-Y695 PolarHBondContact NH1-O 2.86Å; P690-Y695 WeakPolarHBondContact O-CD2 3.46Å; P690-Y695 PolarHBondContact O-N 2.97Å; S691-Y695 CarbonylContact O-C 3.6Å; S691-Y695 WeakPolarHBondContact O-CA 3.43Å; S691-Y695 PolarHBondContact O-N 3.3Å; S691-Y695 VanDerWaalsContact O-N 3.16Å; Y695-G697 PolarHBondContact O-N 3.19Å; Y695-G697 VanDerWaalsContact O-N 3.09Å; Y695-S698 VanDerWaalsContact O-CB 3.32Å; Y695-S698 WeakPolarHBondContact O-CB 3.26Å; Y695-S698 PolarHBondContact O-N 2.94Å; Y695-S698 PolarHBondContact O-OG 2.68Å; Y695-L699 HydrophobicContact CD2-CD1 3.57Å; Y695-L699 HydrophobicContact CD2-CG 4.22Å; Y695-L699 HydrophobicContact CE2-CD1 4.14Å; Y695-L699 HydrophobicContact CG-CD1 3.97Å; Y695-L699 HydrophobicContact CG-CD2 4.49Å; Y695-L699 HydrophobicContact CG-CG 4.15Å; Y695-N837 PolarHBondContact OH-ND2 3.39Å
696	E	91.1	Very high	95	Very high	151 Å²	151	40.9 Å²	40.9	71%	0.706	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	26.1	169.1	-54.4	154.9	133.8	0	0	114.6	R675 S691 S698	R675-E696 IonicContact CZ-OE2 3.11Å; R675-E696 IonicContact NH1-OE2 3.73Å; R675-E696 PolarHBondContact NH1-OE2 3.42Å; R675-E696 IonicContact NH2-OE2 3.15Å; R675-E696 PolarHBondContact NH2-OE2 3.28Å; S691-E696 PolarHBondContact O-N 2.8Å; S691-E696 VanDerWaalsContact O-N 3.07Å; E696-S698 PolarHBondContact O-N 3.23Å
697	G	93.1	Very high	94.8	Very high	36 Å²	36	44.6 Å²	44.6	37%	0.371	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	8.2	-175.4	0	0	0	0	0	114.4	S691 N692 Y695 L699	S691-G697 PolarHBondContact O-N 3.12Å; N692-G697 WeakPolarHBondContact OD1-CA 3.41Å; Y695-G697 PolarHBondContact O-N 3.19Å; Y695-G697 VanDerWaalsContact O-N 3.09Å; G697-L699 PolarHBondContact O-N 3.04Å
698	S	92.8	Very high	94.6	Very high	29 Å²	29	46.2 Å²	46.2	20%	0.203	26%	0.264	C	S	.	.			trans	-83.2	-4.6	-171.7	67.8	0	0	0	0	115.6	R675 Y695 E696	R675-S698 WeakPolarHBondContact CD-OG 3.37Å; R675-S698 PolarHBondContact NH1-OG 2.74Å; Y695-S698 VanDerWaalsContact O-CB 3.32Å; Y695-S698 WeakPolarHBondContact O-CB 3.26Å; Y695-S698 PolarHBondContact O-N 2.94Å; Y695-S698 PolarHBondContact O-OG 2.68Å; E696-S698 PolarHBondContact O-N 3.23Å
699	L	94.8	Very high	94	Very high	12 Å²	12	48.3 Å²	48.3	6%	0.063	28%	0.275	C	S	.	.			trans	-84.2	115.6	175.1	-55.7	-178.3	0	0	0	111.3	P471 T474 Q677 S691 Y695 G697	P471-L699 HydrophobicContact CB-CD1 4.12Å; P471-L699 HydrophobicContact CB-CD2 3.78Å; P471-L699 HydrophobicContact CG-CD2 3.87Å; T474-L699 HydrophobicContact CG2-CD2 4.22Å; Q677-L699 WeakPolarHBondContact O-CA 3.23Å; S691-L699 WeakPolarHBondContact OG-CB 3.32Å; S691-L699 PolarHBondContact OG-N 3.35Å; S691-L699 VanDerWaalsContact OG-N 3.16Å; S691-L699 PolarHBondContact OG-O 3.31Å; Y695-L699 HydrophobicContact CD2-CD1 3.57Å; Y695-L699 HydrophobicContact CD2-CG 4.22Å; Y695-L699 HydrophobicContact CE2-CD1 4.14Å; Y695-L699 HydrophobicContact CG-CD1 3.97Å; Y695-L699 HydrophobicContact CG-CD2 4.49Å; Y695-L699 HydrophobicContact CG-CG 4.15Å; G697-L699 PolarHBondContact O-N 3.04Å
700	Q	96.6	Very high	93.3	Very high	92 Å²	92	51.8 Å²	51.8	43%	0.43	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	150.8	167.5	-57	168.7	29.5	0	0	109.7	H451 Q677 V678 Q679	H451-Q700 PolarHBondContact CE1-OE1 3.07Å; Q677-Q700 PolarHBondContact O-N 2.88Å; V678-Q700 WeakPolarHBondContact CA-O 3.48Å; V678-Q700 HydrophobicContact CG2-CB 4.4Å; Q679-Q700 PolarHBondContact N-O 3.43Å
701	N	96.8	Very high	92.4	Very high	68 Å²	68	61.9 Å²	61.9	36%	0.364	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	121	175	-64.8	-54.7	0	0	0	110.1	Q679 P684 S687 V703	Q679-N701 PolarHBondContact NE2-OD1 2.66Å; P684-N701 HydrophobicContact CB-CB 4.49Å; P684-N701 HydrophobicContact CG-CB 4.25Å; S687-N701 PolarHBondContact OG-OD1 3.01Å; N701-V703 VanDerWaalsContact C-N 3.31Å
702	G	95.5	Very high	91.8	Very high	34 Å²	34	63.5 Å²	63.5	35%	0.351	34%	0.342	S	S	.	.	S	Bend	trans	-92.6	11.4	174.4	0	0	0	0	0	113.7	V678 Q679 Y680	V678-G702 VanDerWaalsContact CG1-CA 3.48Å; Q679-G702 PolarHBondContact O-N 2.78Å; Y680-G702 WeakPolarHBondContact CD1-O 3.43Å
703	V	95.3	Very high	91.5	Very high	16 Å²	16	64.5 Å²	64.5	10%	0.097	35%	0.347	C	S	.	.	S	Bend	trans	-140.7	146.1	177.4	-68.5	0	0	0	0	108.3	Y680 N701 D707 R708	Y680-V703 HydrophobicContact CD1-CG1 4.35Å; N701-V703 VanDerWaalsContact C-N 3.31Å; V703-D707 WeakPolarHBondContact CA-OD2 3.12Å; V703-D707 HydrophobicContact CB-CB 4.08Å; V703-R708 HydrophobicContact CB-CG 4.39Å; V703-R708 HydrophobicContact CG2-CG 3.98Å
704	T	95	Very high	91.5	Very high	64 Å²	64	64.5 Å²	64.5	39%	0.393	35%	0.347	S	S	.	.			trans	-84.3	-179.3	-179.5	80.8	0	0	0	0	112.4	P684 E706 D707	P684-T704 WeakPolarHBondContact CD-O 3.49Å; T704-E706 WeakPolarHBondContact CB-OE2 3.3Å; T704-E706 PolarHBondContact OG1-N 3.39Å; T704-E706 PolarHBondContact OG1-OE2 3.04Å; T704-D707 PolarHBondContact N-OD2 2.87Å; T704-D707 PolarHBondContact OG1-N 3.3Å; T704-D707 VanDerWaalsContact OG1-N 3.13Å
705	A	93.7	Very high	91.4	Very high	37 Å²	37	66.2 Å²	66.2	31%	0.306	36%	0.358	S	S	.	.	S	Bend	trans	-67.4	-41	170.3	0	0	0	0	0	110.8	H683 R708 C709	H683-A705 PolarHBondContact CD2-O 2.6Å; H683-A705 WeakPolarHBondContact NE2-CA 3.44Å; H683-A705 WeakPolarHBondContact NE2-CB 3.42Å; A705-R708 CarbonylContact O-C 3.22Å; A705-R708 WeakPolarHBondContact O-CA 3.28Å; A705-R708 PolarHBondContact O-N 3.32Å; A705-C709 WeakPolarHBondContact O-CB 3.22Å; A705-C709 PolarHBondContact O-N 2.93Å
706	E	91.5	Very high	91.3	Very high	144 Å²	144	67.7 Å²	67.7	67%	0.673	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-64.2	-43.1	179.3	-55	75.6	-167	0	0	111.8	T704 R708 C709	T704-E706 WeakPolarHBondContact CB-OE2 3.3Å; T704-E706 PolarHBondContact OG1-N 3.39Å; T704-E706 PolarHBondContact OG1-OE2 3.04Å; E706-R708 PolarHBondContact O-N 3.42Å; E706-C709 PolarHBondContact O-N 3.09Å; E706-C709 VanDerWaalsContact O-N 3.16Å
707	D	92.6	Very high	91.5	Very high	84 Å²	84	63 Å²	63	45%	0.449	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-56.3	-22.4	172.2	-72.5	-33.1	0	0	0	113.1	V703 T704	V703-D707 WeakPolarHBondContact CA-OD2 3.12Å; V703-D707 HydrophobicContact CB-CB 4.08Å; T704-D707 PolarHBondContact N-OD2 2.87Å; T704-D707 PolarHBondContact OG1-N 3.3Å; T704-D707 VanDerWaalsContact OG1-N 3.13Å
708	R	92.8	Very high	91.4	Very high	35 Å²	35	63.4 Å²	63.4	13%	0.132	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-122.8	22.4	-175.9	-66.7	-67.3	176.3	-82.2	0.4	112.8	Y680 R681 H683 V703 A705 E706 Y845	Y680-R708 PolarHBondContact O-NH2 3.32Å; R681-R708 PolarHBondContact O-NE 3.42Å; H683-R708 HydrophobicContact CB-CB 3.69Å; H683-R708 HydrophobicContact CB-CG 4.49Å; V703-R708 HydrophobicContact CB-CG 4.39Å; V703-R708 HydrophobicContact CG2-CG 3.98Å; A705-R708 CarbonylContact O-C 3.22Å; A705-R708 WeakPolarHBondContact O-CA 3.28Å; A705-R708 PolarHBondContact O-N 3.32Å; E706-R708 PolarHBondContact O-N 3.42Å; R708-Y845 VanDerWaalsContact C-CD1 3.46Å; R708-Y845 HydrophobicContact CB-CD1 4.49Å; R708-Y845 VanDerWaalsContact O-CD1 3.24Å; R708-Y845 WeakPolarHBondContact O-CD1 3.22Å
709	C	85.5	Confident	91.2	Very high	76 Å²	76	66.7 Å²	66.7	51%	0.514	36%	0.361	S	S	.	.			trans	-111.8	115.1	171.8	-177.8	0	0	0	0	110.4	A705 E706	A705-C709 WeakPolarHBondContact O-CB 3.22Å; A705-C709 PolarHBondContact O-N 2.93Å; E706-C709 PolarHBondContact O-N 3.09Å; E706-C709 VanDerWaalsContact O-N 3.16Å
710	K	80.9	Confident	91	Very high	80 Å²	80	72.2 Å²	72.2	35%	0.348	39%	0.391	S	S	.	.			trans	-94.7	134.5	165.9	-65.2	-170.3	-172.4	-177.4	0	109.2	I712 D812 Y845	K710-I712 VanDerWaalsContact C-N 3.25Å; K710-I712 HydrophobicContact CB-CG2 4.26Å; K710-I712 PolarHBondContact O-N 3.45Å; K710-D812 IonicContact NZ-OD2 2.73Å; K710-D812 PolarHBondContact NZ-OD2 2.81Å; K710-Y845 HydrophobicContact CD-CD1 4.34Å; K710-Y845 HydrophobicContact CD-CG 4.46Å; K710-Y845 HydrophobicContact CG-CD1 3.66Å; K710-Y845 HydrophobicContact CG-CE1 3.8Å; K710-Y845 HydrophobicContact CG-CG 4.22Å
711	K	78.2	Confident	90.9	Very high	214 Å²	214	72.5 Å²	72.5	93%	0.93	39%	0.388	S	S	*	.			trans	-75	73.6	176.1	-62.1	-176.6	-179.2	-178.4	0	111
712	I	84.8	Confident	90.8	Very high	41 Å²	41	69.8 Å²	69.8	21%	0.21	37%	0.374	C	S	.	.			trans	-108.8	140.2	175.7	58.5	164.5	0	0	0	111	K710 F714 I760 V762 Y813	K710-I712 VanDerWaalsContact C-N 3.25Å; K710-I712 HydrophobicContact CB-CG2 4.26Å; K710-I712 PolarHBondContact O-N 3.45Å; I712-F714 HydrophobicContact CD1-CB 3.84Å; I712-F714 HydrophobicContact CG1-CB 4.17Å; I712-F714 PolarHBondContact O-N 3.37Å; I712-I760 HydrophobicContact CB-CG2 3.89Å; I712-I760 HydrophobicContact CG2-CG2 4.4Å; I712-V762 HydrophobicContact CD1-CG2 4.18Å; I712-V762 HydrophobicContact CG2-CG2 4.44Å; I712-Y813 HydrophobicContact CD1-CE1 3.96Å; I712-Y813 HydrophobicContact CD1-CE2 4.27Å; I712-Y813 WeakPolarHBondContact CD1-OH 3.18Å
713	D	88.5	Confident	90.8	Very high	125 Å²	125	68.3 Å²	68.3	67%	0.668	36%	0.358	S	S	*	.			trans	-77.8	56.1	174.8	-178.7	55.5	0	0	0	112.1	K756 I760	D713-K756 PolarHBondContact O-NZ 3.01Å; D713-K756 IonicContact OD2-NZ 3.89Å; D713-K756 PolarHBondContact OD2-NZ 3.26Å; D713-I760 HydrophobicContact CB-CG2 4.28Å; D713-I760 WeakPolarHBondContact O-CD1 3.46Å; D713-I760 WeakPolarHBondContact O-CG1 3.31Å
714	F	93.3	Very high	91	Very high	11 Å²	11	67.6 Å²	67.6	5%	0.048	35%	0.353	C	S	.	.			trans	-100.3	134.3	174.5	-169.6	-81.6	0	0	0	110	I712 W716 F724 I753 K756 M757 I760 I848 L880	I712-F714 HydrophobicContact CD1-CB 3.84Å; I712-F714 HydrophobicContact CG1-CB 4.17Å; I712-F714 PolarHBondContact O-N 3.37Å; F714-W716 AromaticContact CD1-CD2 3.74Å; F714-W716 HydrophobicContact CD1-CD2 3.74Å; F714-W716 AromaticContact CD1-CE2 3.61Å; F714-W716 HydrophobicContact CD1-CE3 4.24Å; F714-W716 HydrophobicContact CD1-CG 4.03Å; F714-W716 HydrophobicContact CD1-CH2 4.46Å; F714-W716 AromaticContact CD1-CZ2 4Å; F714-W716 HydrophobicContact CD1-CZ2 4Å; F714-W716 AromaticContact CD1-NE1 3.83Å; F714-W716 HydrophobicContact CE1-CD2 4.31Å; F714-W716 HydrophobicContact CE1-CE3 4.36Å; F714-W716 HydrophobicContact CE1-CZ3 4.49Å; F714-W716 HydrophobicContact CG-CZ2 4.42Å; F714-W716 PolarHBondContact O-N 3.13Å; F714-F724 AromaticContact CE1-CE1 3.94Å; F714-F724 HydrophobicContact CE1-CE1 3.94Å; F714-F724 HydrophobicContact CE1-CZ 4.2Å; F714-I753 HydrophobicContact CE2-CG2 4.38Å; F714-I753 HydrophobicContact CZ-CG2 4.19Å; F714-K756 HydrophobicContact CD2-CG 4.16Å; F714-K756 HydrophobicContact CE2-CB 4.41Å; F714-K756 HydrophobicContact CE2-CG 4.05Å; F714-M757 HydrophobicContact CD2-CE 4.19Å; F714-M757 HydrophobicContact CD2-CG 3.67Å; F714-M757 HydrophobicContact CE2-CE 3.83Å; F714-M757 HydrophobicContact CE2-CG 3.57Å; F714-M757 HydrophobicContact CZ-CE 4.09Å; F714-I760 HydrophobicContact CB-CD1 3.82Å; F714-I760 HydrophobicContact CD2-CD1 3.73Å; F714-I760 HydrophobicContact CG-CD1 4.24Å; F714-I848 HydrophobicContact CE1-CD1 3.94Å; F714-I848 HydrophobicContact CZ-CD1 3.71Å; F714-L880 HydrophobicContact CE1-CD1 4.38Å; F714-L880 HydrophobicContact CZ-CD1 3.94Å; F714-L880 HydrophobicContact CZ-CD2 4.43Å
715	P	91.8	Very high	91.1	Very high	42 Å²	42	64.5 Å²	64.5	27%	0.273	34%	0.335	S	S	.	.			trans	-74.8	71.7	-178.6	32.1	-37.2	0	0	0	111.6	L880	P715-L880 HydrophobicContact CG-CD1 4.1Å; P715-L880 HydrophobicContact CG-CG 4.14Å; P715-L880 VanDerWaalsContact CG-O 3.29Å; P715-L880 WeakPolarHBondContact CG-O 3.45Å
716	W	93.5	Very high	91.3	Very high	30 Å²	30	63.5 Å²	63.5	11%	0.114	32%	0.323	C	S	.	.			trans	-69.2	127.8	167.8	-61.8	107.8	0	0	0	109.3	F714 N718 P722 F724 M757 Y813 I848	F714-W716 AromaticContact CD1-CD2 3.74Å; F714-W716 HydrophobicContact CD1-CD2 3.74Å; F714-W716 AromaticContact CD1-CE2 3.61Å; F714-W716 HydrophobicContact CD1-CE3 4.24Å; F714-W716 HydrophobicContact CD1-CG 4.03Å; F714-W716 HydrophobicContact CD1-CH2 4.46Å; F714-W716 AromaticContact CD1-CZ2 4Å; F714-W716 HydrophobicContact CD1-CZ2 4Å; F714-W716 AromaticContact CD1-NE1 3.83Å; F714-W716 HydrophobicContact CE1-CD2 4.31Å; F714-W716 HydrophobicContact CE1-CE3 4.36Å; F714-W716 HydrophobicContact CE1-CZ3 4.49Å; F714-W716 HydrophobicContact CG-CZ2 4.42Å; F714-W716 PolarHBondContact O-N 3.13Å; W716-N718 PolarHBondContact O-N 3.24Å; W716-N718 VanDerWaalsContact O-N 3.13Å; W716-P722 HydrophobicContact CD2-CB 4.01Å; W716-P722 VanDerWaalsContact CE3-C 3.43Å; W716-P722 HydrophobicContact CE3-CB 4.24Å; W716-P722 HydrophobicContact CH2-CB 4.42Å; W716-P722 HydrophobicContact CZ2-CB 4.18Å; W716-P722 HydrophobicContact CZ3-CB 4.44Å; W716-P722 VanDerWaalsContact CZ3-O 3.31Å; W716-P722 WeakPolarHBondContact CZ3-O 3.32Å; W716-F724 AromaticContact CE3-CD1 3.8Å; W716-F724 HydrophobicContact CE3-CD1 3.8Å; W716-F724 AromaticContact CE3-CE1 3.76Å; W716-F724 HydrophobicContact CE3-CE1 3.76Å; W716-F724 AromaticContact CZ3-CD1 3.97Å; W716-F724 HydrophobicContact CZ3-CD1 3.97Å; W716-F724 AromaticContact CZ3-CE1 3.83Å; W716-F724 HydrophobicContact CZ3-CE1 3.83Å; W716-M757 HydrophobicContact CH2-CE 4.33Å; W716-Y813 HydrophobicContact CH2-CD1 4.33Å; W716-Y813 HydrophobicContact CZ2-CD1 4.06Å; W716-Y813 AromaticContact CZ2-CE1 3.92Å; W716-Y813 HydrophobicContact CZ2-CE1 3.92Å; W716-I848 HydrophobicContact CH2-CD1 4.1Å; W716-I848 HydrophobicContact CH2-CG1 4.05Å; W716-I848 HydrophobicContact CZ3-CD1 4.04Å; W716-I848 HydrophobicContact CZ3-CG1 3.74Å
717	P	93.8	Very high	91.5	Very high	52 Å²	52	57.1 Å²	57.1	34%	0.338	29%	0.294	S	S	.	.	S	Bend	trans	-57	-28.3	176.8	-27.5	36.1	0	0	0	113.6	F724 L874 V876 L883	P717-F724 VanDerWaalsContact CD-CD1 3.47Å; P717-F724 HydrophobicContact CG-CB 3.98Å; P717-F724 HydrophobicContact CG-CD1 4.07Å; P717-F724 HydrophobicContact CG-CD2 4.41Å; P717-F724 HydrophobicContact CG-CG 3.92Å; P717-L874 HydrophobicContact CB-CD2 4.19Å; P717-V876 HydrophobicContact CB-CG1 4.25Å; P717-V876 HydrophobicContact CG-CG1 4.11Å; P717-V876 HydrophobicContact CG-CG2 4.15Å; P717-L883 HydrophobicContact CG-CD1 4.01Å
718	N	91.8	Very high	91.6	Very high	46 Å²	46	53.6 Å²	53.6	25%	0.246	28%	0.276	C	S	.	.	S	Bend	trans	-134.6	114.6	167	-174	-33.4	0	0	0	109.2	W716 D720 R721 L874	W716-N718 PolarHBondContact O-N 3.24Å; W716-N718 VanDerWaalsContact O-N 3.13Å; N718-D720 VanDerWaalsContact C-N 3.25Å; N718-D720 PolarHBondContact O-N 3.38Å; N718-D720 WeakPolarHBondContact OD1-CB 3.36Å; N718-D720 PolarHBondContact OD1-N 3.19Å; N718-R721 HydrophobicContact CB-CB 4.24Å; N718-R721 CarbonylContact O-C 3.07Å; N718-R721 VanDerWaalsContact O-C 3.26Å; N718-R721 PolarHBondContact O-N 2.91Å; N718-L874 HydrophobicContact CB-CD2 3.76Å
719	P	88.3	Confident	91.4	Very high	98 Å²	98	56.8 Å²	56.8	64%	0.636	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.8	179.6	-27.9	36.7	0	0	0	114.9	R721	P719-R721 PolarHBondContact O-N 2.85Å
720	D	91.2	Very high	91.5	Very high	128 Å²	128	53.5 Å²	53.5	68%	0.684	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.8	179.3	-55.3	-38.1	0	0	0	112.5	H683 N718	H683-D720 PolarHBondContact CE1-O 2.91Å; N718-D720 VanDerWaalsContact C-N 3.25Å; N718-D720 PolarHBondContact O-N 3.38Å; N718-D720 WeakPolarHBondContact OD1-CB 3.36Å; N718-D720 PolarHBondContact OD1-N 3.19Å
721	R	93.8	Very high	91.9	Very high	97 Å²	97	55.4 Å²	55.4	37%	0.366	29%	0.292	S	S	.	.	S	Bend	trans	-135.1	83.6	179.3	-56.8	-175.2	-172.3	-136.2	-1.1	108.5	A685 N718 P719 M723 L874	A685-R721 HydrophobicContact CB-CB 4.31Å; A685-R721 HydrophobicContact CB-CG 4.19Å; N718-R721 HydrophobicContact CB-CB 4.24Å; N718-R721 CarbonylContact O-C 3.07Å; N718-R721 VanDerWaalsContact O-C 3.26Å; N718-R721 PolarHBondContact O-N 2.91Å; P719-R721 PolarHBondContact O-N 2.85Å; R721-M723 PolarHBondContact O-N 3.09Å; R721-L874 HydrophobicContact CB-CD1 3.93Å
722	P	95	Very high	92.5	Very high	11 Å²	11	46.5 Å²	46.5	7%	0.071	25%	0.254	C	S	.	.			trans	-73	57.8	-175.8	31.1	-37.2	0	0	0	112.8	W716 Y845 G846 L847	W716-P722 HydrophobicContact CD2-CB 4.01Å; W716-P722 VanDerWaalsContact CE3-C 3.43Å; W716-P722 HydrophobicContact CE3-CB 4.24Å; W716-P722 HydrophobicContact CH2-CB 4.42Å; W716-P722 HydrophobicContact CZ2-CB 4.18Å; W716-P722 HydrophobicContact CZ3-CB 4.44Å; W716-P722 VanDerWaalsContact CZ3-O 3.31Å; W716-P722 WeakPolarHBondContact CZ3-O 3.32Å; P722-Y845 WeakPolarHBondContact CB-O 3.27Å; P722-Y845 WeakPolarHBondContact CG-O 3.36Å; P722-G846 CarbonylContact O-C 3.51Å; P722-G846 WeakPolarHBondContact O-CA 3.34Å; P722-L847 PolarHBondContact O-N 2.92Å; P722-L847 VanDerWaalsContact O-N 3.08Å
723	M	96.5	Very high	92.7	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	152.5	172.9	56	171.7	176.4	0	0	111.3	A685 L686 R721 L847 F868 Y869 L874	A685-M723 HydrophobicContact CB-CE 3.94Å; A685-M723 WeakPolarHBondContact O-CE 3.19Å; L686-M723 HydrophobicContact CD2-CB 3.69Å; L686-M723 HydrophobicContact CD2-CG 3.98Å; L686-M723 HydrophobicContact CD2-SD 3.83Å; R721-M723 PolarHBondContact O-N 3.09Å; M723-L847 WeakPolarHBondContact CA-O 3.37Å; M723-L847 HydrophobicContact CB-CB 4.18Å; M723-L847 WeakPolarHBondContact CB-O 3.32Å; M723-F868 HydrophobicContact CE-CE1 3.65Å; M723-F868 HydrophobicContact CE-CZ 3.95Å; M723-F868 HydrophobicContact SD-CE1 4.27Å; M723-Y869 HydrophobicContact CB-CE1 4.17Å; M723-Y869 HydrophobicContact CG-CE1 4Å; M723-Y869 HydrophobicContact SD-CE1 3.83Å; M723-L874 HydrophobicContact CE-CD1 4.28Å; M723-L874 HydrophobicContact CG-CD1 4.31Å; M723-L874 WeakPolarHBondContact O-CD2 3.29Å
724	F	97.8	Very high	92.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	160.8	169.3	57.9	-81.3	0	0	0	111	F714 W716 P717 Y726 L847 I848 V849 L874 V876 L880 L883	F714-F724 AromaticContact CE1-CE1 3.94Å; F714-F724 HydrophobicContact CE1-CE1 3.94Å; F714-F724 HydrophobicContact CE1-CZ 4.2Å; W716-F724 AromaticContact CE3-CD1 3.8Å; W716-F724 HydrophobicContact CE3-CD1 3.8Å; W716-F724 AromaticContact CE3-CE1 3.76Å; W716-F724 HydrophobicContact CE3-CE1 3.76Å; W716-F724 AromaticContact CZ3-CD1 3.97Å; W716-F724 HydrophobicContact CZ3-CD1 3.97Å; W716-F724 AromaticContact CZ3-CE1 3.83Å; W716-F724 HydrophobicContact CZ3-CE1 3.83Å; P717-F724 VanDerWaalsContact CD-CD1 3.47Å; P717-F724 HydrophobicContact CG-CB 3.98Å; P717-F724 HydrophobicContact CG-CD1 4.07Å; P717-F724 HydrophobicContact CG-CD2 4.41Å; P717-F724 HydrophobicContact CG-CG 3.92Å; F724-Y726 AromaticContact CE2-CD2 3.76Å; F724-Y726 HydrophobicContact CE2-CD2 3.76Å; F724-Y726 HydrophobicContact CE2-CG 4.17Å; F724-L847 PolarHBondContact N-O 2.97Å; F724-I848 HydrophobicContact CD1-CG1 4.11Å; F724-I848 HydrophobicContact CD2-CG2 4.2Å; F724-I848 HydrophobicContact CE1-CD1 3.63Å; F724-I848 HydrophobicContact CE1-CG1 3.58Å; F724-I848 HydrophobicContact CE1-CG2 4.23Å; F724-I848 HydrophobicContact CE2-CG2 3.76Å; F724-I848 HydrophobicContact CZ-CB 4.48Å; F724-I848 HydrophobicContact CZ-CD1 3.7Å; F724-I848 HydrophobicContact CZ-CG1 3.89Å; F724-I848 HydrophobicContact CZ-CG2 3.77Å; F724-V849 PolarHBondContact O-N 2.91Å; F724-L874 WeakPolarHBondContact CA-O 3.5Å; F724-L874 HydrophobicContact CB-CB 4.4Å; F724-L874 WeakPolarHBondContact CB-O 3.45Å; F724-V876 HydrophobicContact CB-CG2 4.19Å; F724-V876 HydrophobicContact CD2-CG2 3.45Å; F724-V876 VanDerWaalsContact CD2-CG2 3.45Å; F724-V876 HydrophobicContact CE2-CG2 4.16Å; F724-V876 HydrophobicContact CG-CG2 4.15Å; F724-L880 HydrophobicContact CZ-CD1 4.34Å; F724-L883 HydrophobicContact CE2-CD1 3.97Å; F724-L883 HydrophobicContact CZ-CD1 4.16Å
725	F	98.2	Very high	92.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.7	167.6	-169.8	-68.4	0	0	0	109	V849 G851 P853 L856 W862 L866 Y869 L874 L875 V876	F725-V849 CarbonylContact C-O 3.43Å; F725-V849 VanDerWaalsContact CA-O 3.29Å; F725-V849 WeakPolarHBondContact CA-O 3.34Å; F725-V849 HydrophobicContact CD2-CB 3.75Å; F725-V849 HydrophobicContact CD2-CG1 3.58Å; F725-V849 HydrophobicContact CE2-CB 4.18Å; F725-V849 HydrophobicContact CE2-CG1 3.49Å; F725-V849 VanDerWaalsContact CE2-CG1 3.49Å; F725-V849 HydrophobicContact CG-CB 4.41Å; F725-V849 HydrophobicContact CZ-CG1 4.42Å; F725-G851 WeakPolarHBondContact CE1-O 3.48Å; F725-P853 HydrophobicContact CE1-CG 3.96Å; F725-L856 HydrophobicContact CE2-CD1 3.89Å; F725-L856 HydrophobicContact CZ-CD1 3.57Å; F725-W862 HydrophobicContact CE2-CZ3 4.45Å; F725-L866 HydrophobicContact CD1-CD2 4.12Å; F725-L866 HydrophobicContact CD2-CD2 3.87Å; F725-L866 HydrophobicContact CE1-CD2 4.04Å; F725-L866 HydrophobicContact CE2-CD2 3.78Å; F725-L866 HydrophobicContact CG-CD2 4.07Å; F725-L866 HydrophobicContact CZ-CD2 3.89Å; F725-Y869 HydrophobicContact CB-CD1 4.4Å; F725-Y869 HydrophobicContact CB-CD2 3.75Å; F725-Y869 HydrophobicContact CB-CE2 4.17Å; F725-Y869 HydrophobicContact CB-CG 3.88Å; F725-Y869 HydrophobicContact CD2-CD2 4.31Å; F725-Y869 HydrophobicContact CD2-CE2 4.42Å; F725-Y869 HydrophobicContact CG-CD2 4.5Å; F725-L874 PolarHBondContact N-O 2.86Å; F725-L875 HydrophobicContact CB-CD1 3.67Å; F725-L875 HydrophobicContact CD1-CD1 3.42Å; F725-L875 VanDerWaalsContact CD1-CD1 3.42Å; F725-L875 HydrophobicContact CE1-CD1 4.31Å; F725-L875 HydrophobicContact CG-CD1 3.67Å; F725-V876 PolarHBondContact O-N 3.47Å
726	Y	97.8	Very high	91.7	Very high	15 Å²	15	38.5 Å²	38.5	6%	0.059	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	106.2	176.5	-156.7	-30.9	0	0	0	109	F724 T749 I753 V849 V850 G851 V876 G878 L880 L883	F724-Y726 AromaticContact CE2-CD2 3.76Å; F724-Y726 HydrophobicContact CE2-CD2 3.76Å; F724-Y726 HydrophobicContact CE2-CG 4.17Å; Y726-T749 HydrophobicContact CD1-CG2 4.12Å; Y726-T749 HydrophobicContact CD2-CG2 3.66Å; Y726-T749 HydrophobicContact CE1-CG2 3.98Å; Y726-T749 HydrophobicContact CE2-CG2 3.48Å; Y726-T749 VanDerWaalsContact CE2-CG2 3.48Å; Y726-T749 HydrophobicContact CG-CG2 3.99Å; Y726-I753 HydrophobicContact CD2-CD1 3.88Å; Y726-I753 HydrophobicContact CD2-CG1 4.35Å; Y726-I753 HydrophobicContact CE2-CD1 4.27Å; Y726-I753 HydrophobicContact CE2-CG1 4.32Å; Y726-V849 PolarHBondContact N-O 2.71Å; Y726-V850 WeakPolarHBondContact O-CA 3.28Å; Y726-G851 PolarHBondContact O-N 2.95Å; Y726-G851 VanDerWaalsContact O-N 3.14Å; Y726-V876 WeakPolarHBondContact CA-O 3.29Å; Y726-G878 WeakPolarHBondContact CE1-O 3.46Å; Y726-G878 PolarHBondContact OH-O 2.83Å; Y726-L880 HydrophobicContact CE2-CD1 4.35Å; Y726-L880 PolarHBondContact OH-N 3.45Å; Y726-L883 HydrophobicContact CE1-CD2 4.16Å; Y726-L883 HydrophobicContact CE2-CD2 4.19Å
727	C	96.5	Very high	90.8	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.068	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	127.8	178.7	-58.4	0	0	0	0	111.3	G851 P853 L875 V876 E877 Y886	C727-G851 WeakPolarHBondContact CA-O 3.24Å; C727-P853 HydrophobicContact CB-CG 3.97Å; C727-P853 WeakPolarHBondContact SG-CG 3.33Å; C727-L875 WeakPolarHBondContact SG-CD1 3.29Å; C727-V876 WeakPolarHBondContact CB-O 3.28Å; C727-V876 PolarHBondContact N-O 3.46Å; C727-E877 HydrophobicContact CB-CB 4.11Å; C727-Y886 HydrophobicContact CB-CD2 3.59Å; C727-Y886 HydrophobicContact CB-CE2 3.93Å; C727-Y886 HydrophobicContact CB-CG 4.14Å
728	T	93.5	Very high	90	Very high	11 Å²	11	36 Å²	36	7%	0.067	20%	0.197	C	C	.	.			trans	-126.3	135.6	176.5	55.6	0	0	0	0	111.8	E746 T749 V850 G851 N852	T728-E746 HydrophobicContact CG2-CG 4.3Å; T728-E746 WeakPolarHBondContact OG1-CG 3.43Å; T728-T749 HydrophobicContact CG2-CG2 4.33Å; T728-V850 HydrophobicContact CG2-CG1 3.6Å; T728-G851 PolarHBondContact N-O 3.28Å; T728-G851 VanDerWaalsContact OG1-C 3.31Å; T728-G851 PolarHBondContact OG1-O 2.98Å; T728-N852 WeakPolarHBondContact O-CA 3.37Å; T728-N852 WeakPolarHBondContact O-CB 3.47Å
729	S	88.4	Confident	89.4	Confident	102 Å²	102	36 Å²	36	71%	0.713	20%	0.199	S	C	*	.			trans	-93.4	1.3	178.8	53.3	0	0	0	0	114.7	Q731	S729-Q731 PolarHBondContact O-NE2 3.28Å
730	G	87.9	Confident	89.3	Confident	6 Å²	6	31.7 Å²	31.7	6%	0.062	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-61.9	146.8	177.3	0	0	0	0	0	112.9	N743 T745 A821	G730-N743 PolarHBondContact O-ND2 2.83Å; G730-N743 VanDerWaalsContact O-ND2 3.07Å; G730-T745 WeakPolarHBondContact CA-OG1 3.34Å; G730-A821 WeakPolarHBondContact O-CB 3.47Å
731	Q	88.9	Confident	89.3	Confident	121 Å²	121	26.3 Å²	26.3	57%	0.565	14%	0.142	S	C	*	.	P	Polyproline II helix	trans	-86.2	154.4	-179.6	-58.9	-60	-65.3	0	0	111.7	S729 N743	S729-Q731 PolarHBondContact O-NE2 3.28Å; Q731-N743 PolarHBondContact O-ND2 3.49Å
732	E	91.1	Very high	89.2	Confident	27 Å²	27	22 Å²	22	13%	0.126	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-78.5	133.7	169.2	65.6	-170.7	-130.6	0	0	111.2	Y741 R820 A821 N822	E732-Y741 HydrophobicContact CB-CD1 4.18Å; E732-Y741 HydrophobicContact CG-CD1 4.3Å; E732-Y741 HydrophobicContact CG-CE1 4.23Å; E732-Y741 WeakPolarHBondContact OE1-CE1 3.2Å; E732-R820 IonicContact OE1-CZ 3.4Å; E732-R820 IonicContact OE1-NE 2.65Å; E732-R820 PolarHBondContact OE1-NE 2.95Å; E732-R820 VanDerWaalsContact OE1-NE 3.11Å; E732-R820 IonicContact OE1-NH2 2.71Å; E732-R820 PolarHBondContact OE1-NH2 2.84Å; E732-R820 VanDerWaalsContact OE2-CA 3.27Å; E732-R820 WeakPolarHBondContact OE2-CA 3.21Å; E732-R820 IonicContact OE2-CZ 2.76Å; E732-R820 IonicContact OE2-NE 3.07Å; E732-R820 PolarHBondContact OE2-NE 3.14Å; E732-R820 IonicContact OE2-NH2 3.29Å; E732-A821 PolarHBondContact OE2-N 2.79Å; E732-N822 HydrophobicContact CG-CB 4.37Å; E732-N822 PolarHBondContact OE1-ND2 2.83Å; E732-N822 PolarHBondContact OE2-ND2 3.19Å
733	E	89.8	Confident	89.2	Confident	23 Å²	23	21.4 Å²	21.4	11%	0.107	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	157	174.2	-59.5	-177.3	-173.7	0	0	110	R188 P207 Y741 L742 R744	R188-E733 IonicContact CZ-OE2 3.19Å; R188-E733 IonicContact NE-OE2 2.75Å; R188-E733 PolarHBondContact NE-OE2 2.8Å; R188-E733 VanDerWaalsContact NE-OE2 3.14Å; R188-E733 IonicContact NH2-OE2 2.77Å; R188-E733 PolarHBondContact NH2-OE2 2.96Å; P207-E733 HydrophobicContact CG-CG 4.17Å; E733-Y741 WeakPolarHBondContact O-CA 3.37Å; E733-L742 HydrophobicContact CB-CD1 3.93Å; E733-L742 HydrophobicContact CB-CG 4.39Å; E733-L742 PolarHBondContact N-O 3.5Å; E733-L742 PolarHBondContact O-N 3.2Å; E733-R744 IonicContact OE1-CZ 3.84Å; E733-R744 IonicContact OE1-NE 3.76Å; E733-R744 PolarHBondContact OE1-NE 3.48Å; E733-R744 IonicContact OE1-NH2 2.74Å; E733-R744 PolarHBondContact OE1-NH2 2.76Å; E733-R744 IonicContact OE2-NE 3.37Å; E733-R744 PolarHBondContact OE2-NE 3.39Å
734	I	86.8	Confident	89	Confident	15 Å²	15	24.5 Å²	24.5	8%	0.077	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	140.6	171.2	-49.7	-178.8	0	0	0	109.2	I135 F170 R188 I209 R212 G738	I135-I734 HydrophobicContact CG2-CD1 4.01Å; F170-I734 HydrophobicContact CD1-CB 4.23Å; F170-I734 HydrophobicContact CD1-CD1 4.26Å; F170-I734 HydrophobicContact CD1-CG2 3.73Å; F170-I734 HydrophobicContact CE1-CD1 4.23Å; F170-I734 HydrophobicContact CE1-CG2 4.22Å; F170-I734 HydrophobicContact CG-CG2 4.42Å; R188-I734 PolarHBondContact NH1-O 3.37Å; R188-I734 PolarHBondContact NH2-O 3.44Å; I209-I734 HydrophobicContact CG2-CD1 3.84Å; R212-I734 HydrophobicContact CG-CD1 4.1Å; I734-G738 WeakPolarHBondContact CG2-O 3.45Å
735	S	85.8	Confident	88.8	Confident	6 Å²	6	27.7 Å²	27.7	4%	0.042	15%	0.153	C	C	.	.			trans	-73.2	162.8	173.8	149.7	0	0	0	0	112.2	F170 N737 G738 S740	F170-S735 VanDerWaalsContact CB-O 3.3Å; F170-S735 WeakPolarHBondContact CB-O 3.41Å; S735-N737 WeakPolarHBondContact CB-OD1 3.32Å; S735-N737 PolarHBondContact O-N 3.07Å; S735-N737 VanDerWaalsContact O-N 3.11Å; S735-N737 PolarHBondContact OG-N 3.3Å; S735-N737 PolarHBondContact OG-OD1 3.08Å; S735-G738 PolarHBondContact O-N 2.87Å; S735-S740 WeakPolarHBondContact CB-O 3.14Å; S735-S740 PolarHBondContact N-O 3.01Å
736	G	79.5	Confident	88.7	Confident	7 Å²	7	27.7 Å²	27.7	7%	0.072	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.2	178.3	0	0	0	0	0	114.9	N168 L171 G738	N168-G736 PolarHBondContact ND2-O 3.22Å; L171-G736 VanDerWaalsContact CD2-CA 3.49Å; G736-G738 VanDerWaalsContact C-N 3.34Å
737	N	74	Confident	88.5	Confident	26 Å²	26	27 Å²	27	14%	0.139	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.9	175.1	74.1	-13.9	0	0	0	114.7	D26 S735 V739 S740	D26-N737 VanDerWaalsContact CG-ND2 3.33Å; D26-N737 PolarHBondContact OD1-ND2 3.06Å; D26-N737 VanDerWaalsContact OD1-ND2 3.1Å; D26-N737 PolarHBondContact OD2-ND2 2.82Å; S735-N737 WeakPolarHBondContact CB-OD1 3.32Å; S735-N737 PolarHBondContact O-N 3.07Å; S735-N737 VanDerWaalsContact O-N 3.11Å; S735-N737 PolarHBondContact OG-N 3.3Å; S735-N737 PolarHBondContact OG-OD1 3.08Å; N737-V739 HydrophobicContact CB-CG2 4.39Å; N737-V739 VanDerWaalsContact ND2-CG2 3.33Å; N737-V739 WeakPolarHBondContact ND2-CG2 3.46Å; N737-V739 PolarHBondContact O-N 2.8Å; N737-S740 VanDerWaalsContact OD1-CB 3.3Å; N737-S740 WeakPolarHBondContact OD1-CB 3.47Å; N737-S740 PolarHBondContact OD1-N 3.4Å; N737-S740 VanDerWaalsContact OD1-N 3.12Å
738	G	78	Confident	88.3	Confident	2 Å²	2	27.1 Å²	27.1	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	75.3	-37.8	178.9	0	0	0	0	0	115.3	V139 I734 S735 G736	V139-G738 VanDerWaalsContact CG2-O 3.28Å; V139-G738 WeakPolarHBondContact CG2-O 3.43Å; I734-G738 WeakPolarHBondContact CG2-O 3.45Å; S735-G738 PolarHBondContact O-N 2.87Å; G736-G738 VanDerWaalsContact C-N 3.34Å
739	V	79.5	Confident	88.4	Confident	47 Å²	47	27.1 Å²	27.1	29%	0.285	15%	0.152	S	C	.	.	S	Bend	trans	-78.7	-32.8	-177.7	-65.7	0	0	0	0	113.6	D26 V139 N737	D26-V739 WeakPolarHBondContact OD2-CG2 3.49Å; V139-V739 HydrophobicContact CG1-CB 4.36Å; V139-V739 HydrophobicContact CG1-CG1 3.73Å; N737-V739 HydrophobicContact CB-CG2 4.39Å; N737-V739 VanDerWaalsContact ND2-CG2 3.33Å; N737-V739 WeakPolarHBondContact ND2-CG2 3.46Å; N737-V739 PolarHBondContact O-N 2.8Å
740	S	86.2	Confident	88.8	Confident	8 Å²	8	22.3 Å²	22.3	6%	0.056	12%	0.118	C	C	.	.	S	Bend	trans	-99.2	171.1	-173.1	-147	0	0	0	0	113.7	S735 N737 E774 G775	S735-S740 WeakPolarHBondContact CB-O 3.14Å; S735-S740 PolarHBondContact N-O 3.01Å; N737-S740 VanDerWaalsContact OD1-CB 3.3Å; N737-S740 WeakPolarHBondContact OD1-CB 3.47Å; N737-S740 PolarHBondContact OD1-N 3.4Å; N737-S740 VanDerWaalsContact OD1-N 3.12Å; S740-E774 PolarHBondContact OG-N 3.34Å; S740-G775 PolarHBondContact OG-N 3.04Å
741	Y	90.6	Very high	89.2	Confident	14 Å²	14	22.9 Å²	22.9	6%	0.055	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	155.1	-179	-71.4	-95.4	0	0	0	112.4	R212 E732 E733 Y773 G775 Q776 R820 Q825	R212-Y741 PolarHBondContact NH1-OH 3.05Å; R212-Y741 PolarHBondContact NH2-OH 2.89Å; R212-Y741 VanDerWaalsContact NH2-OH 3.14Å; E732-Y741 HydrophobicContact CB-CD1 4.18Å; E732-Y741 HydrophobicContact CG-CD1 4.3Å; E732-Y741 HydrophobicContact CG-CE1 4.23Å; E732-Y741 WeakPolarHBondContact OE1-CE1 3.2Å; E733-Y741 WeakPolarHBondContact O-CA 3.37Å; Y741-Y773 AromaticContact CD2-CD1 3.75Å; Y741-Y773 HydrophobicContact CD2-CD1 3.75Å; Y741-Y773 AromaticContact CD2-CE1 3.55Å; Y741-Y773 HydrophobicContact CD2-CE1 3.55Å; Y741-Y773 HydrophobicContact CE2-CE1 4.16Å; Y741-Y773 HydrophobicContact CG-CD1 4.31Å; Y741-Y773 HydrophobicContact CG-CE1 4.36Å; Y741-Y773 WeakPolarHBondContact O-CB 3.42Å; Y741-G775 CarbonylContact O-C 3.58Å; Y741-Q776 PolarHBondContact O-N 2.87Å; Y741-R820 VanDerWaalsContact CZ-CZ 3.49Å; Y741-R820 PolarHBondContact OH-NH2 3.07Å; Y741-Q825 PolarHBondContact OH-OE1 2.99Å; Y741-Q825 VanDerWaalsContact OH-OE1 3.13Å
742	L	92	Very high	89.4	Confident	6 Å²	6	22.2 Å²	22.2	3%	0.031	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	163.1	167.8	64.9	84.1	0	0	0	111.7	E733 R744 Q776 Y779 V819	E733-L742 HydrophobicContact CB-CD1 3.93Å; E733-L742 HydrophobicContact CB-CG 4.39Å; E733-L742 PolarHBondContact N-O 3.5Å; E733-L742 PolarHBondContact O-N 3.2Å; L742-R744 HydrophobicContact CD1-CG 3.85Å; L742-Q776 HydrophobicContact CB-CB 4.47Å; L742-Y779 HydrophobicContact CD2-CD2 4.1Å; L742-Y779 HydrophobicContact CD2-CG 4.17Å; L742-V819 VanDerWaalsContact C-CG1 3.46Å
743	N	94.2	Very high	89.7	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.			trans	-140.3	104.1	176.5	-173.9	-38	0	0	0	109	G730 Q731 T745 E746 A747 Q776 V819	G730-N743 PolarHBondContact O-ND2 2.83Å; G730-N743 VanDerWaalsContact O-ND2 3.07Å; Q731-N743 PolarHBondContact O-ND2 3.49Å; N743-T745 VanDerWaalsContact C-N 3.29Å; N743-T745 PolarHBondContact O-N 3.43Å; N743-T745 PolarHBondContact OD1-N 3.17Å; N743-E746 HydrophobicContact CB-CB 4.09Å; N743-E746 HydrophobicContact CB-CG 4.15Å; N743-E746 PolarHBondContact O-N 2.98Å; N743-E746 PolarHBondContact OD1-N 2.96Å; N743-A747 PolarHBondContact O-N 2.96Å; N743-Q776 PolarHBondContact O-NE2 2.69Å; N743-Q776 PolarHBondContact O-OE1 2.87Å; N743-V819 HydrophobicContact CB-CG1 3.88Å; N743-V819 WeakPolarHBondContact CB-O 3.45Å; N743-V819 PolarHBondContact ND2-O 3.11Å
744	R	91.8	Very high	90	Very high	69 Å²	69	19.9 Å²	19.9	26%	0.26	10%	0.104	S	C	.	.	H	α-helix	trans	-61.2	-35.2	-173.3	-66.5	-167.9	-77.4	151	-4.2	112.6	W205 E733 L742 A747 A748 Y779	W205-R744 PolarHBondContact O-NH1 3.03Å; W205-R744 PolarHBondContact O-NH2 3.15Å; E733-R744 IonicContact OE1-CZ 3.84Å; E733-R744 IonicContact OE1-NE 3.76Å; E733-R744 PolarHBondContact OE1-NE 3.48Å; E733-R744 IonicContact OE1-NH2 2.74Å; E733-R744 PolarHBondContact OE1-NH2 2.76Å; E733-R744 IonicContact OE2-NE 3.37Å; E733-R744 PolarHBondContact OE2-NE 3.39Å; L742-R744 HydrophobicContact CD1-CG 3.85Å; R744-A747 PolarHBondContact O-N 3.3Å; R744-A748 WeakPolarHBondContact O-CB 3.24Å; R744-A748 PolarHBondContact O-N 3.16Å; R744-Y779 HydrophobicContact CB-CE1 4.47Å; R744-Y779 HydrophobicContact CG-CE1 4.14Å; R744-Y779 HydrophobicContact CG-CE2 4.41Å
745	T	93.7	Very high	90.4	Very high	66 Å²	66	19.6 Å²	19.6	41%	0.405	10%	0.103	S	C	.	.	H	α-helix	trans	-73.5	-38.8	179.6	-46.7	0	0	0	0	111.9	G730 N743 T749	G730-T745 WeakPolarHBondContact CA-OG1 3.34Å; N743-T745 VanDerWaalsContact C-N 3.29Å; N743-T745 PolarHBondContact O-N 3.43Å; N743-T745 PolarHBondContact OD1-N 3.17Å; T745-T749 WeakPolarHBondContact O-CB 3.21Å; T745-T749 PolarHBondContact O-N 2.91Å; T745-T749 VanDerWaalsContact O-N 3.08Å; T745-T749 PolarHBondContact O-OG1 2.83Å
746	E	95.7	Very high	90.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.9	-46.6	171.2	-74.2	-169.1	-147.4	0	0	110.7	T728 N743 A748 T749 V750 S817 C818 V819 V850 G851	T728-E746 HydrophobicContact CG2-CG 4.3Å; T728-E746 WeakPolarHBondContact OG1-CG 3.43Å; N743-E746 HydrophobicContact CB-CB 4.09Å; N743-E746 HydrophobicContact CB-CG 4.15Å; N743-E746 PolarHBondContact O-N 2.98Å; N743-E746 PolarHBondContact OD1-N 2.96Å; E746-A748 PolarHBondContact O-N 2.93Å; E746-T749 CarbonylContact O-C 3.47Å; E746-T749 WeakPolarHBondContact O-CA 3.36Å; E746-T749 VanDerWaalsContact O-CB 3.31Å; E746-T749 WeakPolarHBondContact O-CB 3.38Å; E746-T749 PolarHBondContact O-N 2.9Å; E746-V750 WeakPolarHBondContact O-CG2 3.41Å; E746-V750 PolarHBondContact O-N 3.01Å; E746-S817 PolarHBondContact OE2-OG 3.03Å; E746-C818 PolarHBondContact OE2-N 3.21Å; E746-V819 VanDerWaalsContact OE1-CA 3.23Å; E746-V819 WeakPolarHBondContact OE1-CA 3.32Å; E746-V819 PolarHBondContact OE1-N 3.09Å; E746-V819 PolarHBondContact OE2-N 2.8Å; E746-V850 HydrophobicContact CB-CG1 4.23Å; E746-V850 HydrophobicContact CG-CG1 4Å; E746-G851 WeakPolarHBondContact OE1-CA 3.43Å
747	A	94.1	Very high	91.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61	-42.1	179.2	0	0	0	0	0	112.8	N743 R744 T749 V750 E751 Y779 L780	N743-A747 PolarHBondContact O-N 2.96Å; R744-A747 PolarHBondContact O-N 3.3Å; A747-T749 PolarHBondContact O-N 3.46Å; A747-V750 PolarHBondContact O-N 3.25Å; A747-E751 PolarHBondContact O-N 2.83Å; A747-Y779 HydrophobicContact CB-CD1 3.66Å; A747-Y779 HydrophobicContact CB-CE1 3.6Å; A747-L780 HydrophobicContact CB-CD2 3.78Å; A747-L780 HydrophobicContact CB-CG 4.33Å
748	A	93.7	Very high	92.5	Very high	14 Å²	14	20.9 Å²	20.9	12%	0.116	11%	0.105	C	C	.	.	H	α-helix	trans	-71.7	-5.1	172.2	0	0	0	0	0	114.3	R744 E746 K752 Y783	R744-A748 WeakPolarHBondContact O-CB 3.24Å; R744-A748 PolarHBondContact O-N 3.16Å; E746-A748 PolarHBondContact O-N 2.93Å; A748-K752 WeakPolarHBondContact O-CD 3.45Å; A748-K752 WeakPolarHBondContact O-CE 3.39Å; A748-K752 WeakPolarHBondContact O-CG 3.43Å; A748-K752 PolarHBondContact O-NZ 2.85Å; A748-Y783 HydrophobicContact CB-CE1 4.1Å
749	T	95.4	Very high	93.3	Very high	11 Å²	11	26.6 Å²	26.6	7%	0.067	13%	0.13	C	C	.	.	H	α-helix	trans	-96.3	-42.6	170.8	-57.5	0	0	0	0	110.1	Y726 T728 T745 E746 A747 E751 K752 I753 V850	Y726-T749 HydrophobicContact CD1-CG2 4.12Å; Y726-T749 HydrophobicContact CD2-CG2 3.66Å; Y726-T749 HydrophobicContact CE1-CG2 3.98Å; Y726-T749 HydrophobicContact CE2-CG2 3.48Å; Y726-T749 VanDerWaalsContact CE2-CG2 3.48Å; Y726-T749 HydrophobicContact CG-CG2 3.99Å; T728-T749 HydrophobicContact CG2-CG2 4.33Å; T745-T749 WeakPolarHBondContact O-CB 3.21Å; T745-T749 PolarHBondContact O-N 2.91Å; T745-T749 VanDerWaalsContact O-N 3.08Å; T745-T749 PolarHBondContact O-OG1 2.83Å; E746-T749 CarbonylContact O-C 3.47Å; E746-T749 WeakPolarHBondContact O-CA 3.36Å; E746-T749 VanDerWaalsContact O-CB 3.31Å; E746-T749 WeakPolarHBondContact O-CB 3.38Å; E746-T749 PolarHBondContact O-N 2.9Å; A747-T749 PolarHBondContact O-N 3.46Å; T749-E751 VanDerWaalsContact C-N 3.34Å; T749-E751 PolarHBondContact O-N 2.9Å; T749-K752 PolarHBondContact O-N 3.01Å; T749-I753 HydrophobicContact CG2-CD1 4.15Å; T749-I753 WeakPolarHBondContact O-CD1 3.48Å; T749-I753 VanDerWaalsContact O-CG1 3.32Å; T749-I753 WeakPolarHBondContact O-CG1 3.46Å; T749-I753 PolarHBondContact O-N 3.15Å; T749-I753 VanDerWaalsContact O-N 3.09Å; T749-V850 HydrophobicContact CG2-CG1 4.07Å
750	V	96.6	Very high	93.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-57.1	-44.8	171.3	175.5	0	0	0	0	111.2	E746 A747 K752 I753 V754 V769 L780 I815 V850	E746-V750 WeakPolarHBondContact O-CG2 3.41Å; E746-V750 PolarHBondContact O-N 3.01Å; A747-V750 PolarHBondContact O-N 3.25Å; V750-K752 VanDerWaalsContact C-N 3.34Å; V750-K752 PolarHBondContact O-N 2.7Å; V750-I753 PolarHBondContact O-N 3.19Å; V750-V754 HydrophobicContact CG1-CG2 4.18Å; V750-V754 WeakPolarHBondContact O-CB 3.44Å; V750-V754 WeakPolarHBondContact O-CG2 3.03Å; V750-V754 PolarHBondContact O-N 3.29Å; V750-V769 HydrophobicContact CG1-CG1 3.9Å; V750-V769 HydrophobicContact CG1-CG2 4.12Å; V750-L780 HydrophobicContact CB-CD2 3.8Å; V750-L780 HydrophobicContact CG1-CD2 3.78Å; V750-L780 HydrophobicContact CG2-CD2 4.2Å; V750-I815 HydrophobicContact CG1-CD1 4.5Å; V750-I815 HydrophobicContact CG1-CG2 4.24Å; V750-I815 HydrophobicContact CG2-CG2 3.95Å; V750-V850 HydrophobicContact CG2-CG2 4.28Å
751	E	94.8	Very high	94.1	Very high	19 Å²	19	29.1 Å²	29.1	9%	0.089	16%	0.156	C	C	.	.	H	α-helix	trans	-53.2	-49.7	174.2	-178.5	-75.1	133.9	0	0	111.8	A747 T749 I753 V754 T755 Y783 L784	A747-E751 PolarHBondContact O-N 2.83Å; T749-E751 VanDerWaalsContact C-N 3.34Å; T749-E751 PolarHBondContact O-N 2.9Å; E751-I753 VanDerWaalsContact C-N 3.33Å; E751-I753 PolarHBondContact O-N 2.86Å; E751-V754 PolarHBondContact O-N 2.82Å; E751-T755 WeakPolarHBondContact O-CB 3.35Å; E751-T755 PolarHBondContact O-N 2.91Å; E751-T755 PolarHBondContact O-OG1 3.45Å; E751-T755 VanDerWaalsContact O-OG1 3.13Å; E751-T755 VanDerWaalsContact OE1-CB 3.27Å; E751-T755 WeakPolarHBondContact OE1-CB 3.27Å; E751-T755 PolarHBondContact OE1-OG1 2.87Å; E751-Y783 HydrophobicContact CB-CD1 4.08Å; E751-Y783 HydrophobicContact CB-CE1 3.83Å; E751-Y783 HydrophobicContact CG-CD1 4.41Å; E751-Y783 HydrophobicContact CG-CE1 4.07Å; E751-L784 HydrophobicContact CB-CD2 3.92Å; E751-L784 HydrophobicContact CG-CD2 4.08Å
752	K	95	Very high	94.3	Very high	107 Å²	107	29 Å²	29	47%	0.465	16%	0.156	S	C	.	.	H	α-helix	trans	-64.3	-38.7	-177.7	-66.2	167.7	-170.7	141.8	0	112.1	A748 T749 V750 K756	A748-K752 WeakPolarHBondContact O-CD 3.45Å; A748-K752 WeakPolarHBondContact O-CE 3.39Å; A748-K752 WeakPolarHBondContact O-CG 3.43Å; A748-K752 PolarHBondContact O-NZ 2.85Å; T749-K752 PolarHBondContact O-N 3.01Å; V750-K752 VanDerWaalsContact C-N 3.34Å; V750-K752 PolarHBondContact O-N 2.7Å; K752-K756 WeakPolarHBondContact O-CB 3.18Å; K752-K756 PolarHBondContact O-N 3.08Å
753	I	96.3	Very high	94.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-53.2	175.5	-63.7	158.8	0	0	0	110.1	F714 Y726 T749 V750 E751 T755 K756 M757 I815 I848 V850 L880	F714-I753 HydrophobicContact CE2-CG2 4.38Å; F714-I753 HydrophobicContact CZ-CG2 4.19Å; Y726-I753 HydrophobicContact CD2-CD1 3.88Å; Y726-I753 HydrophobicContact CD2-CG1 4.35Å; Y726-I753 HydrophobicContact CE2-CD1 4.27Å; Y726-I753 HydrophobicContact CE2-CG1 4.32Å; T749-I753 HydrophobicContact CG2-CD1 4.15Å; T749-I753 WeakPolarHBondContact O-CD1 3.48Å; T749-I753 VanDerWaalsContact O-CG1 3.32Å; T749-I753 WeakPolarHBondContact O-CG1 3.46Å; T749-I753 PolarHBondContact O-N 3.15Å; T749-I753 VanDerWaalsContact O-N 3.09Å; V750-I753 PolarHBondContact O-N 3.19Å; E751-I753 VanDerWaalsContact C-N 3.33Å; E751-I753 PolarHBondContact O-N 2.86Å; I753-T755 PolarHBondContact O-N 3.35Å; I753-K756 PolarHBondContact O-N 3.39Å; I753-M757 HydrophobicContact CG2-CE 4.04Å; I753-M757 HydrophobicContact CG2-SD 4.46Å; I753-M757 WeakPolarHBondContact O-CG 3.13Å; I753-M757 PolarHBondContact O-N 2.98Å; I753-I815 HydrophobicContact CB-CD1 4.12Å; I753-I815 HydrophobicContact CD1-CG2 4.37Å; I753-I815 HydrophobicContact CG2-CD1 3.51Å; I753-I815 HydrophobicContact CG2-CG1 4.04Å; I753-I848 HydrophobicContact CD1-CG2 3.97Å; I753-I848 HydrophobicContact CG2-CD1 3.53Å; I753-V850 HydrophobicContact CD1-CG2 3.86Å; I753-L880 HydrophobicContact CG1-CD2 4.26Å
754	V	95.8	Very high	94.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56	-52.2	177.6	165.9	0	0	0	0	110.8	V750 E751 K756 M757 L758 V769 L784 Y795 I798 I815	V750-V754 HydrophobicContact CG1-CG2 4.18Å; V750-V754 WeakPolarHBondContact O-CB 3.44Å; V750-V754 WeakPolarHBondContact O-CG2 3.03Å; V750-V754 PolarHBondContact O-N 3.29Å; E751-V754 PolarHBondContact O-N 2.82Å; V754-K756 VanDerWaalsContact C-N 3.32Å; V754-K756 PolarHBondContact O-N 2.93Å; V754-M757 WeakPolarHBondContact O-CB 3.46Å; V754-M757 PolarHBondContact O-N 3.13Å; V754-M757 VanDerWaalsContact O-N 3.12Å; V754-L758 HydrophobicContact CG1-CD1 3.89Å; V754-L758 HydrophobicContact CG1-CG 4.31Å; V754-L758 WeakPolarHBondContact O-CG 3.35Å; V754-L758 PolarHBondContact O-N 3.12Å; V754-V769 HydrophobicContact CG2-CG2 4.32Å; V754-L784 HydrophobicContact CB-CD2 4.29Å; V754-L784 HydrophobicContact CG1-CD2 4.22Å; V754-Y795 HydrophobicContact CG1-CD1 3.92Å; V754-Y795 HydrophobicContact CG1-CE1 3.91Å; V754-I798 HydrophobicContact CG1-CD1 3.26Å; V754-I815 HydrophobicContact CG2-CD1 3.57Å
755	T	94.9	Very high	94.5	Very high	9 Å²	9	34.5 Å²	34.5	6%	0.055	19%	0.188	C	C	.	.	H	α-helix	trans	-60.6	-36.5	179.9	-73.9	0	0	0	0	112.5	E751 I753 K759 S789 Y795	E751-T755 WeakPolarHBondContact O-CB 3.35Å; E751-T755 PolarHBondContact O-N 2.91Å; E751-T755 PolarHBondContact O-OG1 3.45Å; E751-T755 VanDerWaalsContact O-OG1 3.13Å; E751-T755 VanDerWaalsContact OE1-CB 3.27Å; E751-T755 WeakPolarHBondContact OE1-CB 3.27Å; E751-T755 PolarHBondContact OE1-OG1 2.87Å; I753-T755 PolarHBondContact O-N 3.35Å; T755-K759 HydrophobicContact CG2-CD 3.98Å; T755-K759 VanDerWaalsContact CG2-NZ 3.32Å; T755-K759 WeakPolarHBondContact O-CB 3.12Å; T755-K759 WeakPolarHBondContact O-CD 3.27Å; T755-K759 WeakPolarHBondContact O-CG 3.36Å; T755-K759 PolarHBondContact O-N 3.16Å; T755-K759 VanDerWaalsContact O-N 3.07Å; T755-S789 VanDerWaalsContact CG2-OG 3.24Å; T755-S789 WeakPolarHBondContact CG2-OG 3.23Å; T755-Y795 PolarHBondContact OG1-OH 3.01Å
756	K	94.7	Very high	94.5	Very high	46 Å²	46	33.1 Å²	33.1	20%	0.2	18%	0.18	C	C	.	.	H	α-helix	trans	-69.2	-44.2	172.6	176.2	54.2	169.2	146.6	0	111.1	D713 F714 K752 I753 V754 L758 K759 I760 L880	D713-K756 PolarHBondContact O-NZ 3.01Å; D713-K756 IonicContact OD2-NZ 3.89Å; D713-K756 PolarHBondContact OD2-NZ 3.26Å; F714-K756 HydrophobicContact CD2-CG 4.16Å; F714-K756 HydrophobicContact CE2-CB 4.41Å; F714-K756 HydrophobicContact CE2-CG 4.05Å; K752-K756 WeakPolarHBondContact O-CB 3.18Å; K752-K756 PolarHBondContact O-N 3.08Å; I753-K756 PolarHBondContact O-N 3.39Å; V754-K756 VanDerWaalsContact C-N 3.32Å; V754-K756 PolarHBondContact O-N 2.93Å; K756-L758 PolarHBondContact O-N 3.25Å; K756-K759 PolarHBondContact O-N 3.05Å; K756-I760 HydrophobicContact CD-CD1 3.72Å; K756-I760 HydrophobicContact CD-CG1 4.09Å; K756-I760 HydrophobicContact CG-CD1 3.88Å; K756-I760 WeakPolarHBondContact O-CD1 3.12Å; K756-I760 WeakPolarHBondContact O-CG1 3.39Å; K756-I760 PolarHBondContact O-N 3.18Å; K756-I760 VanDerWaalsContact O-N 3.13Å; K756-L880 HydrophobicContact CB-CD2 3.73Å; K756-L880 HydrophobicContact CG-CD2 4.02Å
757	M	95	Very high	94.6	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-48.8	175.3	-72.3	-174.4	175.5	0	0	112.3	F714 W716 I753 V754 K759 I760 G761 V762 I767 Y813 I848	F714-M757 HydrophobicContact CD2-CE 4.19Å; F714-M757 HydrophobicContact CD2-CG 3.67Å; F714-M757 HydrophobicContact CE2-CE 3.83Å; F714-M757 HydrophobicContact CE2-CG 3.57Å; F714-M757 HydrophobicContact CZ-CE 4.09Å; W716-M757 HydrophobicContact CH2-CE 4.33Å; I753-M757 HydrophobicContact CG2-CE 4.04Å; I753-M757 HydrophobicContact CG2-SD 4.46Å; I753-M757 WeakPolarHBondContact O-CG 3.13Å; I753-M757 PolarHBondContact O-N 2.98Å; V754-M757 WeakPolarHBondContact O-CB 3.46Å; V754-M757 PolarHBondContact O-N 3.13Å; V754-M757 VanDerWaalsContact O-N 3.12Å; M757-K759 VanDerWaalsContact C-N 3.35Å; M757-K759 PolarHBondContact O-N 3.13Å; M757-I760 PolarHBondContact O-N 3.35Å; M757-I760 VanDerWaalsContact O-N 3.12Å; M757-G761 PolarHBondContact O-N 3.07Å; M757-V762 HydrophobicContact CB-CB 4.1Å; M757-V762 HydrophobicContact CB-CG2 4.11Å; M757-V762 WeakPolarHBondContact O-CB 3.13Å; M757-V762 WeakPolarHBondContact O-CG2 3.45Å; M757-V762 PolarHBondContact O-N 3.11Å; M757-V762 VanDerWaalsContact O-N 3.11Å; M757-I767 HydrophobicContact CB-CD1 3.88Å; M757-I767 HydrophobicContact SD-CD1 4.31Å; M757-Y813 HydrophobicContact CE-CD1 4.34Å; M757-Y813 HydrophobicContact CE-CG 4.34Å; M757-Y813 HydrophobicContact SD-CG 4.3Å; M757-I848 HydrophobicContact CE-CD1 3.61Å
758	L	94.5	Very high	94.7	Very high	19 Å²	19	33.1 Å²	33.1	10%	0.099	18%	0.18	C	C	.	.	H	α-helix	trans	-59.7	-42.7	176.3	-67.8	175.6	0	0	0	111.8	V754 K756 I760 G761 P764 I767 L790 L794 Y795 I798	V754-L758 HydrophobicContact CG1-CD1 3.89Å; V754-L758 HydrophobicContact CG1-CG 4.31Å; V754-L758 WeakPolarHBondContact O-CG 3.35Å; V754-L758 PolarHBondContact O-N 3.12Å; K756-L758 PolarHBondContact O-N 3.25Å; L758-I760 PolarHBondContact O-N 3.33Å; L758-G761 PolarHBondContact O-N 3.25Å; L758-P764 HydrophobicContact CD2-CB 3.92Å; L758-P764 HydrophobicContact CD2-CG 4.34Å; L758-I767 HydrophobicContact CD2-CD1 4.19Å; L758-I767 HydrophobicContact CG-CD1 4.48Å; L758-L790 HydrophobicContact CB-CD1 3.47Å; L758-L790 VanDerWaalsContact CB-CD1 3.47Å; L758-L790 HydrophobicContact CD1-CD1 3.76Å; L758-L790 HydrophobicContact CG-CD1 4.28Å; L758-L794 HydrophobicContact CD1-CB 4.29Å; L758-Y795 HydrophobicContact CD1-CD1 4.08Å; L758-Y795 HydrophobicContact CD1-CE1 3.87Å; L758-I798 HydrophobicContact CD1-CD1 4.14Å; L758-I798 HydrophobicContact CD2-CD1 4.37Å; L758-I798 HydrophobicContact CG-CD1 4.48Å
759	K	94	Very high	94.9	Very high	123 Å²	123	32.5 Å²	32.5	54%	0.535	17%	0.174	S	C	.	.	H	α-helix	trans	-66.9	-16.7	177	-75.5	170.4	-174.3	173.1	0	114.4	T755 K756 M757 S789 L790	T755-K759 HydrophobicContact CG2-CD 3.98Å; T755-K759 VanDerWaalsContact CG2-NZ 3.32Å; T755-K759 WeakPolarHBondContact O-CB 3.12Å; T755-K759 WeakPolarHBondContact O-CD 3.27Å; T755-K759 WeakPolarHBondContact O-CG 3.36Å; T755-K759 PolarHBondContact O-N 3.16Å; T755-K759 VanDerWaalsContact O-N 3.07Å; K756-K759 PolarHBondContact O-N 3.05Å; M757-K759 VanDerWaalsContact C-N 3.35Å; M757-K759 PolarHBondContact O-N 3.13Å; K759-S789 PolarHBondContact NZ-OG 2.59Å; K759-L790 HydrophobicContact CG-CD1 4.23Å; K759-L790 HydrophobicContact CG-CD2 4.08Å
760	I	92.3	Very high	95	Very high	41 Å²	41	32 Å²	32	21%	0.21	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-8.4	172.6	-60.6	152.6	0	0	0	111.5	I712 D713 F714 K756 M757 L758	I712-I760 HydrophobicContact CB-CG2 3.89Å; I712-I760 HydrophobicContact CG2-CG2 4.4Å; D713-I760 HydrophobicContact CB-CG2 4.28Å; D713-I760 WeakPolarHBondContact O-CD1 3.46Å; D713-I760 WeakPolarHBondContact O-CG1 3.31Å; F714-I760 HydrophobicContact CB-CD1 3.82Å; F714-I760 HydrophobicContact CD2-CD1 3.73Å; F714-I760 HydrophobicContact CG-CD1 4.24Å; K756-I760 HydrophobicContact CD-CD1 3.72Å; K756-I760 HydrophobicContact CD-CG1 4.09Å; K756-I760 HydrophobicContact CG-CD1 3.88Å; K756-I760 WeakPolarHBondContact O-CD1 3.12Å; K756-I760 WeakPolarHBondContact O-CG1 3.39Å; K756-I760 PolarHBondContact O-N 3.18Å; K756-I760 VanDerWaalsContact O-N 3.13Å; M757-I760 PolarHBondContact O-N 3.35Å; M757-I760 VanDerWaalsContact O-N 3.12Å; L758-I760 PolarHBondContact O-N 3.33Å
761	G	91.8	Very high	94.9	Very high	66 Å²	66	32 Å²	32	68%	0.68	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.6	19.5	-177.1	0	0	0	0	0	114.5	M757 L758 H763	M757-G761 PolarHBondContact O-N 3.07Å; L758-G761 PolarHBondContact O-N 3.25Å; G761-H763 PolarHBondContact O-N 3.43Å
762	V	94.1	Very high	94.7	Very high	11 Å²	11	31.5 Å²	31.5	7%	0.067	17%	0.17	C	C	.	.			trans	-69.3	124.6	167.2	-178.6	0	0	0	0	108.6	I712 M757 I767 Y813	I712-V762 HydrophobicContact CD1-CG2 4.18Å; I712-V762 HydrophobicContact CG2-CG2 4.44Å; M757-V762 HydrophobicContact CB-CB 4.1Å; M757-V762 HydrophobicContact CB-CG2 4.11Å; M757-V762 WeakPolarHBondContact O-CB 3.13Å; M757-V762 WeakPolarHBondContact O-CG2 3.45Å; M757-V762 PolarHBondContact O-N 3.11Å; M757-V762 VanDerWaalsContact O-N 3.11Å; V762-I767 HydrophobicContact CB-CD1 4.39Å; V762-I767 HydrophobicContact CG1-CD1 3.89Å; V762-I767 HydrophobicContact CG1-CG1 3.69Å; V762-Y813 HydrophobicContact CG1-CD2 3.63Å; V762-Y813 HydrophobicContact CG1-CE2 3.87Å; V762-Y813 HydrophobicContact CG2-CE2 4.26Å
763	H	94.3	Very high	94.5	Very high	105 Å²	105	26.6 Å²	26.6	49%	0.486	15%	0.148	S	C	.	.			trans	-68.2	130.2	-178.5	-164	-47.4	0	0	0	110.6	G761 N765 T766 E797	G761-H763 PolarHBondContact O-N 3.43Å; H763-N765 PolarHBondContact CE1-ND2 2.95Å; H763-N765 PolarHBondContact O-N 2.94Å; H763-T766 HydrophobicContact CB-CG2 4.19Å; H763-T766 WeakPolarHBondContact O-CB 3.46Å; H763-T766 PolarHBondContact O-N 3.46Å; H763-T766 PolarHBondContact O-OG1 3.5Å; H763-E797 IonicContact CE1-OE2 2.82Å; H763-E797 PolarHBondContact CE1-OE2 2.6Å
764	P	93.9	Very high	93.9	Very high	7 Å²	7	28.3 Å²	28.3	5%	0.045	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-54	-46.7	-174.5	17.7	-33.3	0	0	0	114.2	L758 T766 I767 L794 E797 I798	L758-P764 HydrophobicContact CD2-CB 3.92Å; L758-P764 HydrophobicContact CD2-CG 4.34Å; P764-T766 PolarHBondContact O-N 3.05Å; P764-I767 WeakPolarHBondContact O-CB 3.27Å; P764-I767 PolarHBondContact O-N 2.87Å; P764-L794 WeakPolarHBondContact CB-O 3.42Å; P764-L794 HydrophobicContact CG-CD2 4.32Å; P764-E797 CarbonylContact C-O 3.55Å; P764-E797 HydrophobicContact CB-CB 3.6Å; P764-E797 HydrophobicContact CG-CB 3.61Å; P764-E797 HydrophobicContact CG-CG 4.4Å; P764-I798 HydrophobicContact CB-CD1 4.3Å; P764-I798 HydrophobicContact CB-CG1 3.59Å
765	N	93.5	Very high	93.4	Very high	80 Å²	80	28.6 Å²	28.6	43%	0.428	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-52.4	-19.2	174.2	-63.1	-44	0	0	0	115.5	H763 E797 K811	H763-N765 PolarHBondContact CE1-ND2 2.95Å; H763-N765 PolarHBondContact O-N 2.94Å; N765-E797 PolarHBondContact N-O 3.12Å; N765-E797 PolarHBondContact ND2-OE2 2.93Å; N765-E797 PolarHBondContact OD1-O 2.98Å; N765-E797 VanDerWaalsContact OD1-O 3.12Å; N765-K811 WeakPolarHBondContact O-CD 3.48Å; N765-K811 PolarHBondContact O-NZ 3.47Å
766	T	94.9	Very high	93.3	Very high	37 Å²	37	28.1 Å²	28.1	23%	0.227	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-94.1	-1.5	177.8	69.6	0	0	0	0	114.3	H763 P764 D812 Y813	H763-T766 HydrophobicContact CB-CG2 4.19Å; H763-T766 WeakPolarHBondContact O-CB 3.46Å; H763-T766 PolarHBondContact O-N 3.46Å; H763-T766 PolarHBondContact O-OG1 3.5Å; P764-T766 PolarHBondContact O-N 3.05Å; T766-D812 PolarHBondContact O-N 3.13Å; T766-D812 VanDerWaalsContact O-N 3.08Å; T766-Y813 PolarHBondContact O-N 2.7Å; T766-Y813 VanDerWaalsContact O-N 3.11Å
767	I	97	Very high	93	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139	173.5	-52.5	175.3	0	0	0	108.4	M757 L758 V762 P764 I798 Y813 I815	M757-I767 HydrophobicContact CB-CD1 3.88Å; M757-I767 HydrophobicContact SD-CD1 4.31Å; L758-I767 HydrophobicContact CD2-CD1 4.19Å; L758-I767 HydrophobicContact CG-CD1 4.48Å; V762-I767 HydrophobicContact CB-CD1 4.39Å; V762-I767 HydrophobicContact CG1-CD1 3.89Å; V762-I767 HydrophobicContact CG1-CG1 3.69Å; P764-I767 WeakPolarHBondContact O-CB 3.27Å; P764-I767 PolarHBondContact O-N 2.87Å; I767-I798 HydrophobicContact CB-CG2 4.36Å; I767-I798 HydrophobicContact CD1-CD1 4.32Å; I767-I798 HydrophobicContact CG2-CG2 4.19Å; I767-Y813 CarbonylContact C-O 3.59Å; I767-Y813 WeakPolarHBondContact CA-O 3.12Å; I767-I815 HydrophobicContact CG2-CD1 4.38Å
768	G	96.9	Very high	92.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.3	167.6	0	0	0	0	0	111.3	E799 Y813 I814 I815	G768-E799 CarbonylContact C-O 3.42Å; G768-E799 WeakPolarHBondContact CA-O 3.46Å; G768-Y813 PolarHBondContact N-O 3.31Å; G768-I814 CarbonylContact O-C 3.41Å; G768-I814 WeakPolarHBondContact O-CA 3.36Å; G768-I815 PolarHBondContact O-N 2.56Å
769	V	97.8	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119.1	173.7	-174.7	0	0	0	0	108.4	V750 V754 L780 I798 E799 I800 A801 I815	V750-V769 HydrophobicContact CG1-CG1 3.9Å; V750-V769 HydrophobicContact CG1-CG2 4.12Å; V754-V769 HydrophobicContact CG2-CG2 4.32Å; V769-L780 HydrophobicContact CG1-CD1 3.84Å; V769-I798 HydrophobicContact CG2-CG2 4.1Å; V769-E799 PolarHBondContact N-O 3.06Å; V769-I800 HydrophobicContact CB-CB 4.46Å; V769-I800 HydrophobicContact CB-CG1 4.2Å; V769-I800 HydrophobicContact CB-CG2 4.2Å; V769-I800 HydrophobicContact CG1-CG2 4.35Å; V769-I800 HydrophobicContact CG2-CG1 4.42Å; V769-I800 WeakPolarHBondContact O-CA 3.43Å; V769-A801 PolarHBondContact O-N 2.97Å; V769-I815 CarbonylContact C-O 3.37Å; V769-I815 WeakPolarHBondContact CA-O 3.4Å; V769-I815 HydrophobicContact CG2-CB 4.45Å; V769-I815 HydrophobicContact CG2-CD1 4.43Å
770	I	96.9	Very high	92	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.9	-179.7	-56.9	-177.9	0	0	0	108.4	A801 V803 F806 I814 I815 L816 S817 A839 R842	I770-A801 WeakPolarHBondContact CA-O 3.48Å; I770-V803 HydrophobicContact CG2-CB 4.26Å; I770-V803 HydrophobicContact CG2-CG2 3.61Å; I770-F806 HydrophobicContact CD1-CB 3.9Å; I770-F806 HydrophobicContact CD1-CD1 4.2Å; I770-F806 HydrophobicContact CD1-CD2 3.94Å; I770-F806 HydrophobicContact CD1-CG 3.73Å; I770-F806 HydrophobicContact CG1-CB 4.25Å; I770-F806 HydrophobicContact CG1-CD2 3.55Å; I770-F806 HydrophobicContact CG1-CE2 4.04Å; I770-F806 HydrophobicContact CG1-CG 3.9Å; I770-I814 HydrophobicContact CD1-CD1 4.15Å; I770-I814 HydrophobicContact CD1-CG2 3.7Å; I770-I814 HydrophobicContact CG1-CD1 4.46Å; I770-I814 HydrophobicContact CG1-CG2 4.01Å; I770-I815 PolarHBondContact N-O 3.13Å; I770-L816 HydrophobicContact CB-CD1 4.03Å; I770-L816 HydrophobicContact CG2-CD1 3.84Å; I770-L816 CarbonylContact O-C 3.55Å; I770-L816 WeakPolarHBondContact O-CA 3.42Å; I770-S817 PolarHBondContact O-N 2.79Å; I770-A839 HydrophobicContact CG2-CB 4.42Å; I770-R842 HydrophobicContact CD1-CB 4.04Å; I770-R842 HydrophobicContact CD1-CG 3.64Å
771	T	95.2	Very high	91.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.143	C	C	.	.			trans	-149.6	134.3	168.9	-172.4	0	0	0	0	111.5	Y773 Q776 R777 L780 A801 S802 S817 V819	T771-Y773 PolarHBondContact O-N 3.49Å; T771-Y773 VanDerWaalsContact O-N 3.12Å; T771-Q776 HydrophobicContact CG2-CB 3.91Å; T771-Q776 HydrophobicContact CG2-CG 3.91Å; T771-Q776 WeakPolarHBondContact OG1-CG 3.45Å; T771-R777 HydrophobicContact CG2-CB 3.99Å; T771-L780 HydrophobicContact CG2-CD1 4.09Å; T771-A801 PolarHBondContact N-O 2.86Å; T771-S802 VanDerWaalsContact O-CA 3.31Å; T771-S802 WeakPolarHBondContact O-CA 3.29Å; T771-S817 WeakPolarHBondContact CA-O 3.35Å; T771-S817 WeakPolarHBondContact CB-O 3.45Å; T771-S817 PolarHBondContact OG1-O 3.39Å; T771-V819 VanDerWaalsContact OG1-CG2 3.24Å; T771-V819 WeakPolarHBondContact OG1-CG2 3.33Å
772	P	91	Very high	91.3	Very high	9 Å²	9	23.1 Å²	23.1	6%	0.058	12%	0.121	C	C	.	.	S	Bend	trans	-78.6	11	-174.5	31.2	-33.1	0	0	0	114.3	V803 S817 F829 L830	P772-V803 HydrophobicContact CB-CG2 3.89Å; P772-S817 VanDerWaalsContact CD-O 3.32Å; P772-S817 WeakPolarHBondContact CD-O 3.41Å; P772-F829 HydrophobicContact CB-CB 4.1Å; P772-F829 WeakPolarHBondContact O-CD2 3.12Å; P772-L830 HydrophobicContact CG-CD2 3.68Å; P772-L830 HydrophobicContact CG-CG 3.96Å
773	Y	89.6	Confident	91	Very high	5 Å²	5	25.1 Å²	25.1	2%	0.02	13%	0.128	C	C	.	.			trans	-128.5	120.9	179.2	-64.9	-81.7	0	0	0	110.9	Y741 T771 G775 Q776 R777 V819 R820 I827 G828 F829	Y741-Y773 AromaticContact CD2-CD1 3.75Å; Y741-Y773 HydrophobicContact CD2-CD1 3.75Å; Y741-Y773 AromaticContact CD2-CE1 3.55Å; Y741-Y773 HydrophobicContact CD2-CE1 3.55Å; Y741-Y773 HydrophobicContact CE2-CE1 4.16Å; Y741-Y773 HydrophobicContact CG-CD1 4.31Å; Y741-Y773 HydrophobicContact CG-CE1 4.36Å; Y741-Y773 WeakPolarHBondContact O-CB 3.42Å; T771-Y773 PolarHBondContact O-N 3.49Å; T771-Y773 VanDerWaalsContact O-N 3.12Å; Y773-G775 VanDerWaalsContact C-N 3.26Å; Y773-G775 PolarHBondContact O-N 3.31Å; Y773-Q776 WeakPolarHBondContact O-CB 3.21Å; Y773-Q776 PolarHBondContact O-N 3.25Å; Y773-R777 PolarHBondContact O-N 2.97Å; Y773-V819 HydrophobicContact CD2-CB 3.77Å; Y773-V819 HydrophobicContact CD2-CG1 4.33Å; Y773-V819 HydrophobicContact CD2-CG2 3.78Å; Y773-V819 HydrophobicContact CE2-CB 4.33Å; Y773-V819 HydrophobicContact CG-CG2 4.47Å; Y773-R820 HydrophobicContact CE2-CG 3.56Å; Y773-R820 WeakPolarHBondContact OH-CD 3.46Å; Y773-R820 WeakPolarHBondContact OH-CG 3.34Å; Y773-R820 PolarHBondContact OH-NH1 3.27Å; Y773-I827 PolarHBondContact OH-O 2.78Å; Y773-G828 WeakPolarHBondContact OH-CA 3.4Å; Y773-F829 HydrophobicContact CD1-CD2 4.07Å; Y773-F829 HydrophobicContact CD1-CE2 4.36Å; Y773-F829 AromaticContact CE1-CD2 3.64Å; Y773-F829 HydrophobicContact CE1-CD2 3.64Å; Y773-F829 HydrophobicContact CE1-CE2 4.1Å; Y773-F829 PolarHBondContact OH-N 3.28Å
774	E	82.9	Confident	90.7	Very high	36 Å²	36	20.2 Å²	20.2	17%	0.168	11%	0.105	C	C	.	.	H	α-helix	trans	-59.4	-36.2	-179.1	-179.1	55.4	-160.7	0	0	112.6	S740 Q776 R777 A778	S740-E774 PolarHBondContact OG-N 3.34Å; E774-Q776 VanDerWaalsContact C-N 3.3Å; E774-Q776 PolarHBondContact O-N 2.9Å; E774-R777 WeakPolarHBondContact O-CB 3.43Å; E774-R777 PolarHBondContact O-N 3.03Å; E774-R777 VanDerWaalsContact O-N 3.08Å; E774-R777 IonicContact OE1-CZ 3.43Å; E774-R777 VanDerWaalsContact OE1-CZ 3.22Å; E774-R777 IonicContact OE1-NE 3.42Å; E774-R777 PolarHBondContact OE1-NE 2.98Å; E774-R777 IonicContact OE1-NH2 2.86Å; E774-R777 PolarHBondContact OE1-NH2 2.89Å; E774-R777 VanDerWaalsContact OE2-CD 3.26Å; E774-R777 WeakPolarHBondContact OE2-CD 3.35Å; E774-R777 IonicContact OE2-CZ 3.22Å; E774-R777 IonicContact OE2-NE 2.58Å; E774-R777 PolarHBondContact OE2-NE 3.37Å; E774-R777 IonicContact OE2-NH2 3.15Å; E774-A778 PolarHBondContact O-N 3.42Å
775	G	85.7	Confident	90.1	Very high	5 Å²	5	23.5 Å²	23.5	5%	0.052	12%	0.12	C	C	.	.	H	α-helix	trans	-58	-38.6	172.4	0	0	0	0	0	113.5	S740 Y741 Y773 Y779	S740-G775 PolarHBondContact OG-N 3.04Å; Y741-G775 CarbonylContact O-C 3.58Å; Y773-G775 VanDerWaalsContact C-N 3.26Å; Y773-G775 PolarHBondContact O-N 3.31Å; G775-Y779 WeakPolarHBondContact O-CB 3.42Å; G775-Y779 PolarHBondContact O-N 3.48Å
776	Q	92.6	Very high	89.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-73.7	-37.8	173.2	-175.4	78.7	-28	0	0	111.1	Y741 L742 N743 T771 Y773 E774 Y779 L780 S817 V819	Y741-Q776 PolarHBondContact O-N 2.87Å; L742-Q776 HydrophobicContact CB-CB 4.47Å; N743-Q776 PolarHBondContact O-NE2 2.69Å; N743-Q776 PolarHBondContact O-OE1 2.87Å; T771-Q776 HydrophobicContact CG2-CB 3.91Å; T771-Q776 HydrophobicContact CG2-CG 3.91Å; T771-Q776 WeakPolarHBondContact OG1-CG 3.45Å; Y773-Q776 WeakPolarHBondContact O-CB 3.21Å; Y773-Q776 PolarHBondContact O-N 3.25Å; E774-Q776 VanDerWaalsContact C-N 3.3Å; E774-Q776 PolarHBondContact O-N 2.9Å; Q776-Y779 PolarHBondContact O-N 3.16Å; Q776-L780 HydrophobicContact CG-CD1 3.8Å; Q776-L780 HydrophobicContact CG-CG 4.17Å; Q776-L780 WeakPolarHBondContact O-CB 3.41Å; Q776-L780 WeakPolarHBondContact O-CD1 3.49Å; Q776-L780 WeakPolarHBondContact O-CG 3.46Å; Q776-L780 PolarHBondContact O-N 2.77Å; Q776-S817 PolarHBondContact NE2-OG 3.23Å; Q776-V819 HydrophobicContact CB-CG1 4.47Å; Q776-V819 HydrophobicContact CB-CG2 3.58Å; Q776-V819 HydrophobicContact CG-CG2 3.52Å
777	R	90	Very high	88.9	Confident	62 Å²	62	28.6 Å²	28.6	23%	0.234	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-50.5	177.4	-167.8	-155.8	65.5	77.3	3	111.1	T771 Y773 E774 L780 A781 I800	T771-R777 HydrophobicContact CG2-CB 3.99Å; Y773-R777 PolarHBondContact O-N 2.97Å; E774-R777 WeakPolarHBondContact O-CB 3.43Å; E774-R777 PolarHBondContact O-N 3.03Å; E774-R777 VanDerWaalsContact O-N 3.08Å; E774-R777 IonicContact OE1-CZ 3.43Å; E774-R777 VanDerWaalsContact OE1-CZ 3.22Å; E774-R777 IonicContact OE1-NE 3.42Å; E774-R777 PolarHBondContact OE1-NE 2.98Å; E774-R777 IonicContact OE1-NH2 2.86Å; E774-R777 PolarHBondContact OE1-NH2 2.89Å; E774-R777 VanDerWaalsContact OE2-CD 3.26Å; E774-R777 WeakPolarHBondContact OE2-CD 3.35Å; E774-R777 IonicContact OE2-CZ 3.22Å; E774-R777 IonicContact OE2-NE 2.58Å; E774-R777 PolarHBondContact OE2-NE 3.37Å; E774-R777 IonicContact OE2-NH2 3.15Å; R777-L780 PolarHBondContact O-N 3.45Å; R777-A781 PolarHBondContact O-N 3.25Å; R777-A781 VanDerWaalsContact O-N 3.09Å; R777-I800 WeakPolarHBondContact CD-O 3.42Å; R777-I800 HydrophobicContact CG-CG2 3.88Å; R777-I800 WeakPolarHBondContact CG-O 3.32Å
778	A	83.7	Confident	88	Confident	20 Å²	20	29.6 Å²	29.6	17%	0.165	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-45.8	176.7	0	0	0	0	0	111.7	E774 L780 A781 H782	E774-A778 PolarHBondContact O-N 3.42Å; A778-L780 PolarHBondContact O-N 3.47Å; A778-A781 PolarHBondContact O-N 2.89Å; A778-H782 PolarHBondContact O-N 3.39Å; A778-H782 VanDerWaalsContact O-N 3.08Å
779	Y	87.4	Confident	87.4	Confident	28 Å²	28	33.1 Å²	33.1	11%	0.11	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-39.2	177.1	-174.7	-94.2	0	0	0	112.5	L742 R744 A747 G775 Q776 Y783	L742-Y779 HydrophobicContact CD2-CD2 4.1Å; L742-Y779 HydrophobicContact CD2-CG 4.17Å; R744-Y779 HydrophobicContact CB-CE1 4.47Å; R744-Y779 HydrophobicContact CG-CE1 4.14Å; R744-Y779 HydrophobicContact CG-CE2 4.41Å; A747-Y779 HydrophobicContact CB-CD1 3.66Å; A747-Y779 HydrophobicContact CB-CE1 3.6Å; G775-Y779 WeakPolarHBondContact O-CB 3.42Å; G775-Y779 PolarHBondContact O-N 3.48Å; Q776-Y779 PolarHBondContact O-N 3.16Å; Y779-Y783 AromaticContact CE1-CD2 3.99Å; Y779-Y783 HydrophobicContact CE1-CD2 3.99Å; Y779-Y783 HydrophobicContact CE1-CG 4.18Å; Y779-Y783 AromaticContact CZ-CD2 3.89Å; Y779-Y783 WeakPolarHBondContact O-CB 3.34Å; Y779-Y783 PolarHBondContact O-N 3.39Å; Y779-Y783 WeakPolarHBondContact OH-CD2 3.35Å
780	L	90.7	Very high	86.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-49	175.4	-83.4	166	0	0	0	112	A747 V750 V769 T771 Q776 R777 A778 H782 Y783 L784 I800	A747-L780 HydrophobicContact CB-CD2 3.78Å; A747-L780 HydrophobicContact CB-CG 4.33Å; V750-L780 HydrophobicContact CB-CD2 3.8Å; V750-L780 HydrophobicContact CG1-CD2 3.78Å; V750-L780 HydrophobicContact CG2-CD2 4.2Å; V769-L780 HydrophobicContact CG1-CD1 3.84Å; T771-L780 HydrophobicContact CG2-CD1 4.09Å; Q776-L780 HydrophobicContact CG-CD1 3.8Å; Q776-L780 HydrophobicContact CG-CG 4.17Å; Q776-L780 WeakPolarHBondContact O-CB 3.41Å; Q776-L780 WeakPolarHBondContact O-CD1 3.49Å; Q776-L780 WeakPolarHBondContact O-CG 3.46Å; Q776-L780 PolarHBondContact O-N 2.77Å; R777-L780 PolarHBondContact O-N 3.45Å; A778-L780 PolarHBondContact O-N 3.47Å; L780-H782 PolarHBondContact O-N 3.11Å; L780-Y783 PolarHBondContact O-N 3.22Å; L780-L784 WeakPolarHBondContact O-CB 3.34Å; L780-L784 WeakPolarHBondContact O-CD1 3.31Å; L780-L784 VanDerWaalsContact O-CG 3.27Å; L780-L784 WeakPolarHBondContact O-CG 3.29Å; L780-L784 PolarHBondContact O-N 2.88Å; L780-I800 HydrophobicContact CB-CG2 3.99Å; L780-I800 HydrophobicContact CD1-CG2 4.26Å
781	A	86.5	Confident	86.3	Confident	31 Å²	31	40.5 Å²	40.5	26%	0.256	21%	0.213	S	C	.	.	H	α-helix	trans	-59	-47.2	179.4	0	0	0	0	0	111.4	R777 A778 H785 I800	R777-A781 PolarHBondContact O-N 3.25Å; R777-A781 VanDerWaalsContact O-N 3.09Å; A778-A781 PolarHBondContact O-N 2.89Å; A781-H785 WeakPolarHBondContact O-CB 3.37Å; A781-H785 PolarHBondContact O-N 3.02Å; A781-I800 HydrophobicContact CB-CD1 3.99Å
782	H	83.4	Confident	85.8	Confident	50 Å²	50	42 Å²	42	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-48.7	174.2	-172.7	-70.4	0	0	0	111.8	A778 L780 L784 H785 Y786	A778-H782 PolarHBondContact O-N 3.39Å; A778-H782 VanDerWaalsContact O-N 3.08Å; L780-H782 PolarHBondContact O-N 3.11Å; H782-L784 PolarHBondContact O-N 3.25Å; H782-H785 PolarHBondContact O-N 2.83Å; H782-Y786 AromaticContact CD2-CE2 3.81Å; H782-Y786 AromaticContact CE1-CD2 3.36Å; H782-Y786 WeakPolarHBondContact CE1-CD2 3.42Å; H782-Y786 AromaticContact CE1-CE2 3.56Å; H782-Y786 AromaticContact CG-CD2 3.93Å; H782-Y786 AromaticContact ND1-CD2 3.49Å; H782-Y786 WeakPolarHBondContact ND1-CD2 3.21Å; H782-Y786 AromaticContact ND1-CE2 3.99Å; H782-Y786 AromaticContact NE2-CD2 3.74Å; H782-Y786 AromaticContact NE2-CE2 3.44Å; H782-Y786 WeakPolarHBondContact NE2-CE2 3.33Å; H782-Y786 WeakPolarHBondContact O-CD2 3Å; H782-Y786 PolarHBondContact O-N 2.76Å
783	Y	86.6	Confident	85.5	Confident	53 Å²	53	47.9 Å²	47.9	21%	0.208	25%	0.25	C	C	.	.	H	α-helix	trans	-64.7	-39.3	-175.7	-171.8	-89.6	0	0	0	112.5	A748 E751 Y779 L780 S787	A748-Y783 HydrophobicContact CB-CE1 4.1Å; E751-Y783 HydrophobicContact CB-CD1 4.08Å; E751-Y783 HydrophobicContact CB-CE1 3.83Å; E751-Y783 HydrophobicContact CG-CD1 4.41Å; E751-Y783 HydrophobicContact CG-CE1 4.07Å; Y779-Y783 AromaticContact CE1-CD2 3.99Å; Y779-Y783 HydrophobicContact CE1-CD2 3.99Å; Y779-Y783 HydrophobicContact CE1-CG 4.18Å; Y779-Y783 AromaticContact CZ-CD2 3.89Å; Y779-Y783 WeakPolarHBondContact O-CB 3.34Å; Y779-Y783 PolarHBondContact O-N 3.39Å; Y779-Y783 WeakPolarHBondContact OH-CD2 3.35Å; L780-Y783 PolarHBondContact O-N 3.22Å; Y783-S787 WeakPolarHBondContact CD2-OG 3.48Å; Y783-S787 VanDerWaalsContact CE2-OG 3.27Å; Y783-S787 WeakPolarHBondContact CE2-OG 3.49Å; Y783-S787 WeakPolarHBondContact O-CA 3.45Å; Y783-S787 WeakPolarHBondContact O-CB 3.28Å; Y783-S787 PolarHBondContact O-N 2.98Å; Y783-S787 PolarHBondContact O-OG 3.28Å
784	L	87.8	Confident	85.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-40.9	174.8	-72.2	162.9	0	0	0	111.8	E751 V754 L780 H782 G788 Y795 I800	E751-L784 HydrophobicContact CB-CD2 3.92Å; E751-L784 HydrophobicContact CG-CD2 4.08Å; V754-L784 HydrophobicContact CB-CD2 4.29Å; V754-L784 HydrophobicContact CG1-CD2 4.22Å; L780-L784 WeakPolarHBondContact O-CB 3.34Å; L780-L784 WeakPolarHBondContact O-CD1 3.31Å; L780-L784 VanDerWaalsContact O-CG 3.27Å; L780-L784 WeakPolarHBondContact O-CG 3.29Å; L780-L784 PolarHBondContact O-N 2.88Å; H782-L784 PolarHBondContact O-N 3.25Å; L784-G788 WeakPolarHBondContact O-CA 3.47Å; L784-G788 PolarHBondContact O-N 3.49Å; L784-G788 VanDerWaalsContact O-N 3.17Å; L784-Y795 HydrophobicContact CB-CD1 4.09Å; L784-Y795 HydrophobicContact CB-CG 4.3Å; L784-Y795 HydrophobicContact CD2-CD1 3.89Å; L784-Y795 HydrophobicContact CD2-CE1 4.15Å; L784-I800 HydrophobicContact CD1-CD1 3.51Å; L784-I800 HydrophobicContact CD1-CG1 4.42Å
785	H	83	Confident	85.8	Confident	77 Å²	77	49.2 Å²	49.2	36%	0.356	26%	0.258	S	S	.	.	H	α-helix	trans	-66.5	-40.2	179	-176.2	-90.7	0	0	0	113.3	A781 H782	A781-H785 WeakPolarHBondContact O-CB 3.37Å; A781-H785 PolarHBondContact O-N 3.02Å; H782-H785 PolarHBondContact O-N 2.83Å
786	Y	80.8	Confident	85.8	Confident	166 Å²	166	51.1 Å²	51.1	65%	0.651	27%	0.265	S	S	*	.	H	α-helix	trans	-94.2	-30	-175.5	-77.5	-86.9	0	0	0	114.9	H782	H782-Y786 AromaticContact CD2-CE2 3.81Å; H782-Y786 AromaticContact CE1-CD2 3.36Å; H782-Y786 WeakPolarHBondContact CE1-CD2 3.42Å; H782-Y786 AromaticContact CE1-CE2 3.56Å; H782-Y786 AromaticContact CG-CD2 3.93Å; H782-Y786 AromaticContact ND1-CD2 3.49Å; H782-Y786 WeakPolarHBondContact ND1-CD2 3.21Å; H782-Y786 AromaticContact ND1-CE2 3.99Å; H782-Y786 AromaticContact NE2-CD2 3.74Å; H782-Y786 AromaticContact NE2-CE2 3.44Å; H782-Y786 WeakPolarHBondContact NE2-CE2 3.33Å; H782-Y786 WeakPolarHBondContact O-CD2 3Å; H782-Y786 PolarHBondContact O-N 2.76Å
787	S	81.2	Confident	85.6	Confident	57 Å²	57	54.2 Å²	54.2	40%	0.399	28%	0.28	S	S	.	.	H	α-helix	trans	-103.1	-9.3	-176.6	-49.1	0	0	0	0	113.6	Y783	Y783-S787 WeakPolarHBondContact CD2-OG 3.48Å; Y783-S787 VanDerWaalsContact CE2-OG 3.27Å; Y783-S787 WeakPolarHBondContact CE2-OG 3.49Å; Y783-S787 WeakPolarHBondContact O-CA 3.45Å; Y783-S787 WeakPolarHBondContact O-CB 3.28Å; Y783-S787 PolarHBondContact O-N 2.98Å; Y783-S787 PolarHBondContact O-OG 3.28Å
788	G	79.1	Confident	85.7	Confident	21 Å²	21	51.3 Å²	51.3	22%	0.216	27%	0.269	C	S	.	.			trans	-63.8	134	-177.2	0	0	0	0	0	113.2	L784 L790 Y795	L784-G788 WeakPolarHBondContact O-CA 3.47Å; L784-G788 PolarHBondContact O-N 3.49Å; L784-G788 VanDerWaalsContact O-N 3.17Å; G788-L790 PolarHBondContact O-N 3.34Å; G788-Y795 WeakPolarHBondContact CA-OH 3.4Å
789	S	83.6	Confident	86.1	Confident	74 Å²	74	52.1 Å²	52.1	52%	0.517	27%	0.269	S	S	.	.	S	Bend	trans	-84.9	12.9	179.4	61.5	0	0	0	0	114.7	T755 K759 Y795	T755-S789 VanDerWaalsContact CG2-OG 3.24Å; T755-S789 WeakPolarHBondContact CG2-OG 3.23Å; K759-S789 PolarHBondContact NZ-OG 2.59Å; S789-Y795 PolarHBondContact N-OH 3.31Å; S789-Y795 VanDerWaalsContact N-OH 3.13Å
790	L	87.6	Confident	86.3	Confident	54 Å²	54	51.8 Å²	51.8	28%	0.283	27%	0.269	S	S	.	.	S	Bend	trans	-125.3	178.5	178.4	-61.6	173.6	0	0	0	110	L758 K759 G788 A792 L794 Y795	L758-L790 HydrophobicContact CB-CD1 3.47Å; L758-L790 VanDerWaalsContact CB-CD1 3.47Å; L758-L790 HydrophobicContact CD1-CD1 3.76Å; L758-L790 HydrophobicContact CG-CD1 4.28Å; K759-L790 HydrophobicContact CG-CD1 4.23Å; K759-L790 HydrophobicContact CG-CD2 4.08Å; G788-L790 PolarHBondContact O-N 3.34Å; L790-A792 PolarHBondContact O-N 3.07Å; L790-L794 HydrophobicContact CB-CD1 4.4Å; L790-Y795 HydrophobicContact CB-CE2 3.73Å; L790-Y795 PolarHBondContact N-OH 3.14Å
791	N	84.3	Confident	86.3	Confident	102 Å²	102	52 Å²	52	55%	0.545	27%	0.27	S	S	.	.			trans	-59.3	125.4	174.3	-177	-19.4	0	0	0	110.8	K793 L794	N791-K793 PolarHBondContact O-N 3.41Å; N791-K793 PolarHBondContact OD1-N 3.16Å; N791-K793 VanDerWaalsContact OD1-N 3.11Å; N791-L794 HydrophobicContact CB-CD1 4.39Å; N791-L794 HydrophobicContact CB-CG 4.47Å; N791-L794 WeakPolarHBondContact O-CB 3.36Å; N791-L794 PolarHBondContact O-N 3.48Å
792	A	83.6	Confident	86.3	Confident	30 Å²	30	51.2 Å²	51.2	25%	0.248	26%	0.264	C	S	.	.	H	α-helix	trans	-46.5	-36.4	179.5	0	0	0	0	0	113.9	L790 L794 Y795 Q796	L790-A792 PolarHBondContact O-N 3.07Å; A792-L794 VanDerWaalsContact C-N 3.28Å; A792-L794 PolarHBondContact O-N 3.37Å; A792-Y795 PolarHBondContact O-N 2.83Å; A792-Q796 PolarHBondContact O-N 2.9Å; A792-Q796 VanDerWaalsContact O-N 3.07Å
793	K	85.6	Confident	86.5	Confident	133 Å²	133	49.1 Å²	49.1	58%	0.578	25%	0.254	S	S	*	.	H	α-helix	trans	-59.1	-35.2	177.8	-65.3	-167.2	174.8	-167.2	0	113.7	N791 Y795 Q796 E797	N791-K793 PolarHBondContact O-N 3.41Å; N791-K793 PolarHBondContact OD1-N 3.16Å; N791-K793 VanDerWaalsContact OD1-N 3.11Å; K793-Y795 PolarHBondContact O-N 3.45Å; K793-Q796 WeakPolarHBondContact O-CB 3.14Å; K793-Q796 PolarHBondContact O-N 3.48Å; K793-E797 PolarHBondContact O-N 3.32Å; K793-E797 VanDerWaalsContact O-N 3.14Å
794	L	87.6	Confident	86.5	Confident	63 Å²	63	46.6 Å²	46.6	33%	0.33	24%	0.244	S	C	.	.	H	α-helix	trans	-68	-25.1	177.7	-64.1	173.2	0	0	0	112.3	L758 P764 L790 N791 A792	L758-L794 HydrophobicContact CD1-CB 4.29Å; P764-L794 WeakPolarHBondContact CB-O 3.42Å; P764-L794 HydrophobicContact CG-CD2 4.32Å; L790-L794 HydrophobicContact CB-CD1 4.4Å; N791-L794 HydrophobicContact CB-CD1 4.39Å; N791-L794 HydrophobicContact CB-CG 4.47Å; N791-L794 WeakPolarHBondContact O-CB 3.36Å; N791-L794 PolarHBondContact O-N 3.48Å; A792-L794 VanDerWaalsContact C-N 3.28Å; A792-L794 PolarHBondContact O-N 3.37Å
795	Y	90.1	Very high	86.2	Confident	7 Å²	7	46.8 Å²	46.8	3%	0.027	25%	0.246	C	C	.	.	H	α-helix	trans	-84.4	-31.3	172.9	-59.1	-78.4	0	0	0	111.8	V754 T755 L758 L784 G788 S789 L790 A792 K793 E797 I798	V754-Y795 HydrophobicContact CG1-CD1 3.92Å; V754-Y795 HydrophobicContact CG1-CE1 3.91Å; T755-Y795 PolarHBondContact OG1-OH 3.01Å; L758-Y795 HydrophobicContact CD1-CD1 4.08Å; L758-Y795 HydrophobicContact CD1-CE1 3.87Å; L784-Y795 HydrophobicContact CB-CD1 4.09Å; L784-Y795 HydrophobicContact CB-CG 4.3Å; L784-Y795 HydrophobicContact CD2-CD1 3.89Å; L784-Y795 HydrophobicContact CD2-CE1 4.15Å; G788-Y795 WeakPolarHBondContact CA-OH 3.4Å; S789-Y795 PolarHBondContact N-OH 3.31Å; S789-Y795 VanDerWaalsContact N-OH 3.13Å; L790-Y795 HydrophobicContact CB-CE2 3.73Å; L790-Y795 PolarHBondContact N-OH 3.14Å; A792-Y795 PolarHBondContact O-N 2.83Å; K793-Y795 PolarHBondContact O-N 3.45Å; Y795-E797 VanDerWaalsContact C-N 3.27Å; Y795-E797 PolarHBondContact O-N 2.85Å; Y795-I798 PolarHBondContact O-N 3.35Å; Y795-I798 VanDerWaalsContact O-N 3.14Å
796	Q	85.8	Confident	86.3	Confident	45 Å²	45	43.1 Å²	43.1	21%	0.21	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-28.2	173.1	-70.8	171.6	-29.9	0	0	113	N364 A792 K793 I798	N364-Q796 HydrophobicContact CB-CB 4.14Å; N364-Q796 HydrophobicContact CB-CG 4.43Å; N364-Q796 PolarHBondContact ND2-O 3.25Å; N364-Q796 PolarHBondContact O-NE2 3.26Å; A792-Q796 PolarHBondContact O-N 2.9Å; A792-Q796 VanDerWaalsContact O-N 3.07Å; K793-Q796 WeakPolarHBondContact O-CB 3.14Å; K793-Q796 PolarHBondContact O-N 3.48Å; Q796-I798 PolarHBondContact O-N 2.97Å
797	E	89	Confident	86.4	Confident	64 Å²	64	36 Å²	36	30%	0.299	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	0.1	172.8	-77.5	-177.2	-119.7	0	0	114.3	H763 P764 N765 K793 Y795	H763-E797 IonicContact CE1-OE2 2.82Å; H763-E797 PolarHBondContact CE1-OE2 2.6Å; P764-E797 CarbonylContact C-O 3.55Å; P764-E797 HydrophobicContact CB-CB 3.6Å; P764-E797 HydrophobicContact CG-CB 3.61Å; P764-E797 HydrophobicContact CG-CG 4.4Å; N765-E797 PolarHBondContact N-O 3.12Å; N765-E797 PolarHBondContact ND2-OE2 2.93Å; N765-E797 PolarHBondContact OD1-O 2.98Å; N765-E797 VanDerWaalsContact OD1-O 3.12Å; K793-E797 PolarHBondContact O-N 3.32Å; K793-E797 VanDerWaalsContact O-N 3.14Å; Y795-E797 VanDerWaalsContact C-N 3.27Å; Y795-E797 PolarHBondContact O-N 2.85Å
798	I	92.4	Very high	86.3	Confident	1 Å²	1	35 Å²	35	1%	0.005	20%	0.2	C	C	.	.	S	Bend	trans	-95.3	132.3	178.8	-62.6	177.8	0	0	0	110.2	V754 L758 P764 I767 V769 Y795 Q796 I800	V754-I798 HydrophobicContact CG1-CD1 3.26Å; L758-I798 HydrophobicContact CD1-CD1 4.14Å; L758-I798 HydrophobicContact CD2-CD1 4.37Å; L758-I798 HydrophobicContact CG-CD1 4.48Å; P764-I798 HydrophobicContact CB-CD1 4.3Å; P764-I798 HydrophobicContact CB-CG1 3.59Å; I767-I798 HydrophobicContact CB-CG2 4.36Å; I767-I798 HydrophobicContact CD1-CD1 4.32Å; I767-I798 HydrophobicContact CG2-CG2 4.19Å; V769-I798 HydrophobicContact CG2-CG2 4.1Å; Y795-I798 PolarHBondContact O-N 3.35Å; Y795-I798 VanDerWaalsContact O-N 3.14Å; Q796-I798 PolarHBondContact O-N 2.97Å; I798-I800 HydrophobicContact CG2-CG1 4.33Å; I798-I800 PolarHBondContact O-N 3.03Å
799	E	91.5	Very high	86.7	Confident	38 Å²	38	37.1 Å²	37.1	18%	0.178	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.6	-178.2	-168	173.5	145.7	0	0	110.7	Y37 G768 V769 F806 R809 K811	Y37-E799 PolarHBondContact OH-OE1 3.32Å; G768-E799 CarbonylContact C-O 3.42Å; G768-E799 WeakPolarHBondContact CA-O 3.46Å; V769-E799 PolarHBondContact N-O 3.06Å; E799-F806 HydrophobicContact CG-CE2 4.11Å; E799-F806 HydrophobicContact CG-CZ 4.36Å; E799-R809 VanDerWaalsContact CD-NH1 3.29Å; E799-R809 WeakPolarHBondContact OE1-CD 3.44Å; E799-R809 IonicContact OE1-CZ 3.21Å; E799-R809 IonicContact OE1-NE 3.29Å; E799-R809 IonicContact OE1-NH1 2.72Å; E799-R809 PolarHBondContact OE1-NH1 2.88Å; E799-R809 IonicContact OE2-NH1 2.86Å; E799-K811 WeakPolarHBondContact OE2-CE 3.33Å; E799-K811 IonicContact OE2-NZ 2.83Å; E799-K811 PolarHBondContact OE2-NZ 2.85Å
800	I	92.9	Very high	87.1	Confident	20 Å²	20	37.1 Å²	37.1	10%	0.103	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	112.1	-178	-49.8	165.9	0	0	0	108.5	V769 R777 L780 A781 L784 I798	V769-I800 HydrophobicContact CB-CB 4.46Å; V769-I800 HydrophobicContact CB-CG1 4.2Å; V769-I800 HydrophobicContact CB-CG2 4.2Å; V769-I800 HydrophobicContact CG1-CG2 4.35Å; V769-I800 HydrophobicContact CG2-CG1 4.42Å; V769-I800 WeakPolarHBondContact O-CA 3.43Å; R777-I800 WeakPolarHBondContact CD-O 3.42Å; R777-I800 HydrophobicContact CG-CG2 3.88Å; R777-I800 WeakPolarHBondContact CG-O 3.32Å; L780-I800 HydrophobicContact CB-CG2 3.99Å; L780-I800 HydrophobicContact CD1-CG2 4.26Å; A781-I800 HydrophobicContact CB-CD1 3.99Å; L784-I800 HydrophobicContact CD1-CD1 3.51Å; L784-I800 HydrophobicContact CD1-CG1 4.42Å; I798-I800 HydrophobicContact CG2-CG1 4.33Å; I798-I800 PolarHBondContact O-N 3.03Å
801	A	89.4	Confident	87.6	Confident	4 Å²	4	36 Å²	36	3%	0.033	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	168.4	-165.1	0	0	0	0	0	113.6	Y37 V769 I770 T771 A805 F806	Y37-A801 HydrophobicContact CE1-CB 3.7Å; Y37-A801 WeakPolarHBondContact OH-CB 3.32Å; V769-A801 PolarHBondContact O-N 2.97Å; I770-A801 WeakPolarHBondContact CA-O 3.48Å; T771-A801 PolarHBondContact N-O 2.86Å; A801-A805 HydrophobicContact CB-CB 4.1Å; A801-F806 HydrophobicContact CB-CD2 3.94Å; A801-F806 HydrophobicContact CB-CE2 4.34Å
802	S	88.2	Confident	88.1	Confident	16 Å²	16	31.8 Å²	31.8	11%	0.112	16%	0.164	C	C	.	.			trans	-74.6	175.7	171.8	84.2	0	0	0	0	112.2	C39 T771 A805 F806	C39-S802 PolarHBondContact SG-OG 2.86Å; C39-S802 VanDerWaalsContact SG-OG 3.37Å; T771-S802 VanDerWaalsContact O-CA 3.31Å; T771-S802 WeakPolarHBondContact O-CA 3.29Å; S802-A805 WeakPolarHBondContact OG-CB 3.5Å; S802-A805 PolarHBondContact OG-N 2.76Å; S802-F806 PolarHBondContact O-N 2.97Å
803	V	87.6	Confident	88.8	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.03	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-48.2	178.4	177.1	0	0	0	0	111.4	I770 P772 A805 F806 R835 V838 A839	I770-V803 HydrophobicContact CG2-CB 4.26Å; I770-V803 HydrophobicContact CG2-CG2 3.61Å; P772-V803 HydrophobicContact CB-CG2 3.89Å; V803-A805 VanDerWaalsContact C-N 3.35Å; V803-F806 PolarHBondContact O-N 3.14Å; V803-R835 HydrophobicContact CB-CB 4.47Å; V803-R835 HydrophobicContact CB-CG 4.45Å; V803-R835 HydrophobicContact CG1-CB 3.76Å; V803-R835 HydrophobicContact CG1-CG 4.04Å; V803-R835 WeakPolarHBondContact CG1-O 3.45Å; V803-V838 HydrophobicContact CG1-CB 4.26Å; V803-V838 HydrophobicContact CG1-CG1 4.18Å; V803-A839 HydrophobicContact CG1-CB 4.15Å; V803-A839 HydrophobicContact CG2-CB 4.46Å
804	D	85.1	Confident	89.4	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-46.3	-177.3	-39	-26	0	0	0	108.9	D38 C39 L644 F806 Q807 R835	D38-D804 HydrophobicContact CB-CB 4.37Å; C39-D804 PolarHBondContact SG-OD2 2.79Å; L644-D804 HydrophobicContact CD1-CB 3.77Å; D804-F806 VanDerWaalsContact C-N 3.31Å; D804-F806 PolarHBondContact O-N 3.42Å; D804-Q807 WeakPolarHBondContact O-CB 3.34Å; D804-Q807 PolarHBondContact O-N 2.84Å; D804-R835 IonicContact OD1-CZ 3.55Å; D804-R835 IonicContact OD1-NE 3.89Å; D804-R835 IonicContact OD1-NH1 3.5Å; D804-R835 PolarHBondContact OD1-NH1 2.88Å; D804-R835 IonicContact OD2-CZ 2.77Å; D804-R835 IonicContact OD2-NH1 2.82Å; D804-R835 PolarHBondContact OD2-NH1 2.72Å; D804-R835 IonicContact OD2-NH2 3.18Å
805	A	82.1	Confident	89.9	Confident	4 Å²	4	21.2 Å²	21.2	3%	0.033	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41.3	-58.2	167.5	0	0	0	0	0	111.2	Y37 A801 S802 V803 Q807	Y37-A805 HydrophobicContact CD1-CB 3.47Å; Y37-A805 VanDerWaalsContact CD1-CB 3.47Å; Y37-A805 HydrophobicContact CD2-CB 4.33Å; Y37-A805 WeakPolarHBondContact CD2-O 3.2Å; Y37-A805 HydrophobicContact CE1-CB 3.53Å; Y37-A805 HydrophobicContact CE2-CB 4.39Å; Y37-A805 WeakPolarHBondContact CE2-O 3.16Å; Y37-A805 HydrophobicContact CG-CB 3.81Å; Y37-A805 VanDerWaalsContact CZ-C 3.48Å; A801-A805 HydrophobicContact CB-CB 4.1Å; S802-A805 WeakPolarHBondContact OG-CB 3.5Å; S802-A805 PolarHBondContact OG-N 2.76Å; V803-A805 VanDerWaalsContact C-N 3.35Å; A805-Q807 PolarHBondContact O-N 2.91Å
806	F	85.4	Confident	90.3	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	2.5	-178	-122.7	-77.3	0	0	0	116.8	I770 E799 A801 S802 V803 D804 R809 K811 I814 R842	I770-F806 HydrophobicContact CD1-CB 3.9Å; I770-F806 HydrophobicContact CD1-CD1 4.2Å; I770-F806 HydrophobicContact CD1-CD2 3.94Å; I770-F806 HydrophobicContact CD1-CG 3.73Å; I770-F806 HydrophobicContact CG1-CB 4.25Å; I770-F806 HydrophobicContact CG1-CD2 3.55Å; I770-F806 HydrophobicContact CG1-CE2 4.04Å; I770-F806 HydrophobicContact CG1-CG 3.9Å; E799-F806 HydrophobicContact CG-CE2 4.11Å; E799-F806 HydrophobicContact CG-CZ 4.36Å; A801-F806 HydrophobicContact CB-CD2 3.94Å; A801-F806 HydrophobicContact CB-CE2 4.34Å; S802-F806 PolarHBondContact O-N 2.97Å; V803-F806 PolarHBondContact O-N 3.14Å; D804-F806 VanDerWaalsContact C-N 3.31Å; D804-F806 PolarHBondContact O-N 3.42Å; F806-R809 HydrophobicContact CD1-CB 4.03Å; F806-R809 HydrophobicContact CE1-CB 4.06Å; F806-K811 HydrophobicContact CE1-CG 3.84Å; F806-K811 HydrophobicContact CZ-CD 4.5Å; F806-K811 HydrophobicContact CZ-CG 3.61Å; F806-I814 HydrophobicContact CE1-CD1 3.89Å; F806-I814 HydrophobicContact CZ-CD1 3.93Å; F806-R842 HydrophobicContact CB-CG 4.1Å; F806-R842 HydrophobicContact CD1-CB 3.97Å; F806-R842 HydrophobicContact CD1-CG 3.7Å; F806-R842 HydrophobicContact CE1-CB 4.37Å; F806-R842 HydrophobicContact CG-CG 4.17Å; F806-R842 WeakPolarHBondContact O-CD 3.31Å; F806-R842 PolarHBondContact O-NH1 2.88Å
807	Q	82.5	Confident	90.9	Very high	16 Å²	16	18.9 Å²	18.9	8%	0.075	10%	0.099	C	C	.	.	S	Bend	trans	-53.7	150.7	165.1	-169.4	138.6	-68	0	0	112.2	D804 A805 R809	D804-Q807 WeakPolarHBondContact O-CB 3.34Å; D804-Q807 PolarHBondContact O-N 2.84Å; A805-Q807 PolarHBondContact O-N 2.91Å; Q807-R809 PolarHBondContact O-N 2.82Å
808	G	79.6	Confident	91.2	Very high	37 Å²	37	15.8 Å²	15.8	38%	0.381	9%	0.085	S	C	.	.	S	Bend	trans	69.2	-47.3	-171.3	0	0	0	0	0	115.4
809	R	86.5	Confident	91.4	Very high	66 Å²	66	15.8 Å²	15.8	25%	0.249	9%	0.085	C	C	.	.			trans	-74.5	164.2	-173.6	-60.1	-169.7	-172	160.5	6.9	113.5	D36 Y37 E799 F806 Q807	D36-R809 VanDerWaalsContact CB-NH2 3.34Å; D36-R809 VanDerWaalsContact CG-NH2 3.34Å; D36-R809 IonicContact OD1-CZ 3.7Å; D36-R809 IonicContact OD1-NE 2.72Å; D36-R809 IonicContact OD1-NH2 3.45Å; D36-R809 PolarHBondContact OD1-NH2 3.13Å; Y37-R809 VanDerWaalsContact CE2-CD 3.47Å; Y37-R809 HydrophobicContact CE2-CG 4.05Å; Y37-R809 VanDerWaalsContact CE2-NH1 3.31Å; Y37-R809 PolarHBondContact OH-NH1 2.75Å; Y37-R809 VanDerWaalsContact OH-NH1 3.16Å; E799-R809 VanDerWaalsContact CD-NH1 3.29Å; E799-R809 WeakPolarHBondContact OE1-CD 3.44Å; E799-R809 IonicContact OE1-CZ 3.21Å; E799-R809 IonicContact OE1-NE 3.29Å; E799-R809 IonicContact OE1-NH1 2.72Å; E799-R809 PolarHBondContact OE1-NH1 2.88Å; E799-R809 IonicContact OE2-NH1 2.86Å; F806-R809 HydrophobicContact CD1-CB 4.03Å; F806-R809 HydrophobicContact CE1-CB 4.06Å; Q807-R809 PolarHBondContact O-N 2.82Å
810	E	93	Very high	91.4	Very high	74 Å²	74	14.1 Å²	14.1	35%	0.346	8%	0.077	S	C	.	.			trans	-148.2	155.4	173.1	60.9	-177.9	-113.5	0	0	110.4	R681 R842 R844	R681-E810 IonicContact CZ-OE2 3.38Å; R681-E810 IonicContact NE-OE2 3.14Å; R681-E810 PolarHBondContact NE-OE2 2.86Å; R681-E810 IonicContact NH2-OE2 2.76Å; R681-E810 PolarHBondContact NH2-OE2 3.49Å; E810-R842 WeakPolarHBondContact CA-O 3.43Å; E810-R844 HydrophobicContact CB-CG 4.42Å; E810-R844 WeakPolarHBondContact OE1-CD 3.46Å; E810-R844 IonicContact OE1-CZ 3.18Å; E810-R844 IonicContact OE1-NE 2.96Å; E810-R844 PolarHBondContact OE1-NE 2.87Å; E810-R844 IonicContact OE1-NH2 3.99Å
811	K	96.5	Very high	91.3	Very high	29 Å²	29	13.2 Å²	13.2	13%	0.126	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	163.9	175.3	-65.8	-68.2	-172	-173.6	0	110.8	N765 E799 F806 I814 R842 R844	N765-K811 WeakPolarHBondContact O-CD 3.48Å; N765-K811 PolarHBondContact O-NZ 3.47Å; E799-K811 WeakPolarHBondContact OE2-CE 3.33Å; E799-K811 IonicContact OE2-NZ 2.83Å; E799-K811 PolarHBondContact OE2-NZ 2.85Å; F806-K811 HydrophobicContact CE1-CG 3.84Å; F806-K811 HydrophobicContact CZ-CD 4.5Å; F806-K811 HydrophobicContact CZ-CG 3.61Å; K811-I814 HydrophobicContact CB-CD1 3.69Å; K811-I814 HydrophobicContact CB-CG1 4.31Å; K811-I814 HydrophobicContact CG-CD1 3.96Å; K811-R842 PolarHBondContact N-O 3.2Å; K811-R844 VanDerWaalsContact O-CG 3.27Å; K811-R844 WeakPolarHBondContact O-CG 3.25Å; K811-R844 PolarHBondContact O-N 3.49Å
812	D	96.6	Very high	91.1	Very high	14 Å²	14	13.9 Å²	13.9	8%	0.075	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-44	175.3	-68.4	-20.1	0	0	0	111	K710 T766 R844 Y845 G846	K710-D812 IonicContact NZ-OD2 2.73Å; K710-D812 PolarHBondContact NZ-OD2 2.81Å; T766-D812 PolarHBondContact O-N 3.13Å; T766-D812 VanDerWaalsContact O-N 3.08Å; D812-R844 WeakPolarHBondContact OD1-CD 3.26Å; D812-R844 IonicContact OD1-CZ 2.91Å; D812-R844 IonicContact OD1-NE 2.8Å; D812-R844 IonicContact OD1-NH1 2.76Å; D812-R844 PolarHBondContact OD1-NH1 2.81Å; D812-Y845 HydrophobicContact CB-CD2 3.69Å; D812-Y845 HydrophobicContact CB-CE2 4.45Å; D812-Y845 HydrophobicContact CB-CG 4.47Å; D812-Y845 CarbonylContact O-C 3.5Å; D812-Y845 WeakPolarHBondContact O-CA 3.4Å; D812-Y845 WeakPolarHBondContact O-CB 2.97Å; D812-Y845 PolarHBondContact O-N 3.48Å; D812-Y845 VanDerWaalsContact OD1-CD2 3.29Å; D812-Y845 WeakPolarHBondContact OD1-CD2 3.4Å; D812-Y845 WeakPolarHBondContact OD1-CE2 3.31Å; D812-G846 PolarHBondContact O-N 2.82Å
813	Y	97.5	Very high	90.6	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.016	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.9	176.4	-58.3	-73.7	0	0	0	111.1	I712 W716 M757 V762 T766 I767 G768 G846	I712-Y813 HydrophobicContact CD1-CE1 3.96Å; I712-Y813 HydrophobicContact CD1-CE2 4.27Å; I712-Y813 WeakPolarHBondContact CD1-OH 3.18Å; W716-Y813 HydrophobicContact CH2-CD1 4.33Å; W716-Y813 HydrophobicContact CZ2-CD1 4.06Å; W716-Y813 AromaticContact CZ2-CE1 3.92Å; W716-Y813 HydrophobicContact CZ2-CE1 3.92Å; M757-Y813 HydrophobicContact CE-CD1 4.34Å; M757-Y813 HydrophobicContact CE-CG 4.34Å; M757-Y813 HydrophobicContact SD-CG 4.3Å; V762-Y813 HydrophobicContact CG1-CD2 3.63Å; V762-Y813 HydrophobicContact CG1-CE2 3.87Å; V762-Y813 HydrophobicContact CG2-CE2 4.26Å; T766-Y813 PolarHBondContact O-N 2.7Å; T766-Y813 VanDerWaalsContact O-N 3.11Å; I767-Y813 CarbonylContact C-O 3.59Å; I767-Y813 WeakPolarHBondContact CA-O 3.12Å; G768-Y813 PolarHBondContact N-O 3.31Å; Y813-G846 WeakPolarHBondContact CA-O 3.22Å
814	I	98.1	Very high	89.7	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.3	175	-65.3	-69.1	0	0	0	109.9	G768 I770 F806 K811 R842 A843 G846 L847 I848	G768-I814 CarbonylContact O-C 3.41Å; G768-I814 WeakPolarHBondContact O-CA 3.36Å; I770-I814 HydrophobicContact CD1-CD1 4.15Å; I770-I814 HydrophobicContact CD1-CG2 3.7Å; I770-I814 HydrophobicContact CG1-CD1 4.46Å; I770-I814 HydrophobicContact CG1-CG2 4.01Å; F806-I814 HydrophobicContact CE1-CD1 3.89Å; F806-I814 HydrophobicContact CZ-CD1 3.93Å; K811-I814 HydrophobicContact CB-CD1 3.69Å; K811-I814 HydrophobicContact CB-CG1 4.31Å; K811-I814 HydrophobicContact CG-CD1 3.96Å; I814-R842 HydrophobicContact CD1-CB 3.9Å; I814-R842 HydrophobicContact CG1-CB 3.91Å; I814-A843 HydrophobicContact CB-CB 4.05Å; I814-A843 HydrophobicContact CG1-CB 3.87Å; I814-G846 PolarHBondContact N-O 2.87Å; I814-L847 HydrophobicContact CB-CD1 3.88Å; I814-L847 HydrophobicContact CG2-CD1 3.67Å; I814-L847 CarbonylContact O-C 3.45Å; I814-L847 WeakPolarHBondContact O-CA 3.06Å; I814-I848 PolarHBondContact O-N 2.91Å
815	I	98.5	Very high	89	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117	170.2	-52.1	166.8	0	0	0	107.6	V750 I753 V754 I767 G768 V769 I770 I848 V850	V750-I815 HydrophobicContact CG1-CD1 4.5Å; V750-I815 HydrophobicContact CG1-CG2 4.24Å; V750-I815 HydrophobicContact CG2-CG2 3.95Å; I753-I815 HydrophobicContact CB-CD1 4.12Å; I753-I815 HydrophobicContact CD1-CG2 4.37Å; I753-I815 HydrophobicContact CG2-CD1 3.51Å; I753-I815 HydrophobicContact CG2-CG1 4.04Å; V754-I815 HydrophobicContact CG2-CD1 3.57Å; I767-I815 HydrophobicContact CG2-CD1 4.38Å; G768-I815 PolarHBondContact O-N 2.56Å; V769-I815 CarbonylContact C-O 3.37Å; V769-I815 WeakPolarHBondContact CA-O 3.4Å; V769-I815 HydrophobicContact CG2-CB 4.45Å; V769-I815 HydrophobicContact CG2-CD1 4.43Å; I770-I815 PolarHBondContact N-O 3.13Å; I815-I848 CarbonylContact C-O 3.52Å; I815-I848 VanDerWaalsContact CA-O 3.31Å; I815-I848 WeakPolarHBondContact CA-O 3.18Å; I815-V850 HydrophobicContact CG2-CG2 3.98Å
816	L	98.3	Very high	88.9	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.016	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	111.8	179.8	174.3	60.3	0	0	0	109.6	I770 A839 I848 V849 V850 W862	I770-L816 HydrophobicContact CB-CD1 4.03Å; I770-L816 HydrophobicContact CG2-CD1 3.84Å; I770-L816 CarbonylContact O-C 3.55Å; I770-L816 WeakPolarHBondContact O-CA 3.42Å; L816-A839 HydrophobicContact CD1-CB 4.16Å; L816-A839 HydrophobicContact CD2-CB 4.03Å; L816-I848 PolarHBondContact N-O 3.26Å; L816-V849 HydrophobicContact CB-CG1 4.46Å; L816-V849 HydrophobicContact CB-CG2 4.42Å; L816-V849 HydrophobicContact CD2-CG1 4.13Å; L816-V849 HydrophobicContact CD2-CG2 4.31Å; L816-V849 HydrophobicContact CG-CG1 4.34Å; L816-V849 CarbonylContact O-C 3.54Å; L816-V850 PolarHBondContact O-N 3.18Å; L816-W862 HydrophobicContact CD2-CH2 4.43Å
817	S	97.8	Very high	88.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116	173.5	172.5	0	0	0	0	109.9	E746 I770 T771 P772 Q776	E746-S817 PolarHBondContact OE2-OG 3.03Å; I770-S817 PolarHBondContact O-N 2.79Å; T771-S817 WeakPolarHBondContact CA-O 3.35Å; T771-S817 WeakPolarHBondContact CB-O 3.45Å; T771-S817 PolarHBondContact OG1-O 3.39Å; P772-S817 VanDerWaalsContact CD-O 3.32Å; P772-S817 WeakPolarHBondContact CD-O 3.41Å; Q776-S817 PolarHBondContact NE2-OG 3.23Å
818	C	96.7	Very high	89	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.			trans	-78.2	-26.6	-175.9	-69.1	0	0	0	0	113.5	E746 R820 L830 V850 L856 W862	E746-C818 PolarHBondContact OE2-N 3.21Å; C818-R820 PolarHBondContact O-N 3.13Å; C818-L830 HydrophobicContact CB-CD1 4.13Å; C818-L830 HydrophobicContact CB-CD2 4.15Å; C818-L830 WeakPolarHBondContact O-CD1 3.46Å; C818-V850 WeakPolarHBondContact CB-O 3.01Å; C818-V850 PolarHBondContact N-O 2.73Å; C818-L856 HydrophobicContact CB-CD1 4.3Å; C818-W862 VanDerWaalsContact SG-CH2 3.55Å
819	V	94.7	Very high	89	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.			trans	68.7	-46.1	-179.5	-165.2	0	0	0	0	114.9	L742 N743 E746 T771 Y773 Q776 A821	L742-V819 VanDerWaalsContact C-CG1 3.46Å; N743-V819 HydrophobicContact CB-CG1 3.88Å; N743-V819 WeakPolarHBondContact CB-O 3.45Å; N743-V819 PolarHBondContact ND2-O 3.11Å; E746-V819 VanDerWaalsContact OE1-CA 3.23Å; E746-V819 WeakPolarHBondContact OE1-CA 3.32Å; E746-V819 PolarHBondContact OE1-N 3.09Å; E746-V819 PolarHBondContact OE2-N 2.8Å; T771-V819 VanDerWaalsContact OG1-CG2 3.24Å; T771-V819 WeakPolarHBondContact OG1-CG2 3.33Å; Y773-V819 HydrophobicContact CD2-CB 3.77Å; Y773-V819 HydrophobicContact CD2-CG1 4.33Å; Y773-V819 HydrophobicContact CD2-CG2 3.78Å; Y773-V819 HydrophobicContact CE2-CB 4.33Å; Y773-V819 HydrophobicContact CG-CG2 4.47Å; Q776-V819 HydrophobicContact CB-CG1 4.47Å; Q776-V819 HydrophobicContact CB-CG2 3.58Å; Q776-V819 HydrophobicContact CG-CG2 3.52Å; V819-A821 PolarHBondContact O-N 2.85Å
820	R	93.1	Very high	89	Confident	3 Å²	3	25.8 Å²	25.8	1%	0.011	14%	0.136	C	C	.	.			trans	-74.5	123.3	-166.6	-58	-54.7	-58.4	-77.7	-0.8	112.4	E732 Y741 Y773 C818 N822 G826 L830	E732-R820 IonicContact OE1-CZ 3.4Å; E732-R820 IonicContact OE1-NE 2.65Å; E732-R820 PolarHBondContact OE1-NE 2.95Å; E732-R820 VanDerWaalsContact OE1-NE 3.11Å; E732-R820 IonicContact OE1-NH2 2.71Å; E732-R820 PolarHBondContact OE1-NH2 2.84Å; E732-R820 VanDerWaalsContact OE2-CA 3.27Å; E732-R820 WeakPolarHBondContact OE2-CA 3.21Å; E732-R820 IonicContact OE2-CZ 2.76Å; E732-R820 IonicContact OE2-NE 3.07Å; E732-R820 PolarHBondContact OE2-NE 3.14Å; E732-R820 IonicContact OE2-NH2 3.29Å; Y741-R820 VanDerWaalsContact CZ-CZ 3.49Å; Y741-R820 PolarHBondContact OH-NH2 3.07Å; Y773-R820 HydrophobicContact CE2-CG 3.56Å; Y773-R820 WeakPolarHBondContact OH-CD 3.46Å; Y773-R820 WeakPolarHBondContact OH-CG 3.34Å; Y773-R820 PolarHBondContact OH-NH1 3.27Å; C818-R820 PolarHBondContact O-N 3.13Å; R820-N822 PolarHBondContact NH2-ND2 3.18Å; R820-G826 PolarHBondContact NH1-O 3.43Å; R820-G826 VanDerWaalsContact NH1-O 3.07Å; R820-G826 PolarHBondContact NH2-O 3.26Å; R820-G826 VanDerWaalsContact NH2-O 3.09Å; R820-L830 HydrophobicContact CB-CD1 3.9Å; R820-L830 HydrophobicContact CG-CD1 3.78Å
821	A	90.5	Very high	88.8	Confident	2 Å²	2	25.7 Å²	25.7	2%	0.017	14%	0.137	C	C	.	.			trans	-152.8	75.3	-168.9	0	0	0	0	0	109.2	G730 E732 V819 N852	G730-A821 WeakPolarHBondContact O-CB 3.47Å; E732-A821 PolarHBondContact OE2-N 2.79Å; V819-A821 PolarHBondContact O-N 2.85Å; A821-N852 HydrophobicContact CB-CB 3.75Å; A821-N852 WeakPolarHBondContact CB-ND2 3.24Å
822	N	85.7	Confident	88.5	Confident	17 Å²	17	25.1 Å²	25.1	9%	0.091	14%	0.136	C	C	.	.			trans	-140.1	162.5	-176.6	66.2	77.1	0	0	0	112.5	E732 R820 Q825 K858	E732-N822 HydrophobicContact CG-CB 4.37Å; E732-N822 PolarHBondContact OE1-ND2 2.83Å; E732-N822 PolarHBondContact OE2-ND2 3.19Å; R820-N822 PolarHBondContact NH2-ND2 3.18Å; N822-Q825 VanDerWaalsContact OD1-CA 3.28Å; N822-Q825 WeakPolarHBondContact OD1-CA 3.36Å; N822-Q825 WeakPolarHBondContact OD1-CB 3.31Å; N822-Q825 PolarHBondContact OD1-N 2.76Å; N822-Q825 PolarHBondContact OD1-O 2.83Å; N822-K858 PolarHBondContact O-NZ 3.28Å
823	E	76.8	Confident	88.3	Confident	151 Å²	151	25 Å²	25	71%	0.706	14%	0.135	S	C	*	.	S	Bend	trans	-94.3	-41.2	-178.2	-57.6	-162.3	141.6	0	0	112.7	K858	E823-K858 VanDerWaalsContact C-NZ 3.31Å; E823-K858 PolarHBondContact O-NZ 2.98Å
824	N	69.4	Low	88	Confident	133 Å²	133	25.8 Å²	25.8	71%	0.711	14%	0.139	S	C	*	.	S	Bend	trans	-118.8	13.8	-167.9	-61.9	-2.5	0	0	0	114.8
825	Q	70.4	Confident	87.8	Confident	26 Å²	26	26.2 Å²	26.2	12%	0.121	14%	0.14	C	C	.	.	S	Bend	trans	-119.7	171.8	178.4	-53.2	-174.5	-3.5	0	0	112.1	S130 Y741 N822	S130-Q825 PolarHBondContact O-NE2 2.89Å; Y741-Q825 PolarHBondContact OH-OE1 2.99Å; Y741-Q825 VanDerWaalsContact OH-OE1 3.13Å; N822-Q825 VanDerWaalsContact OD1-CA 3.28Å; N822-Q825 WeakPolarHBondContact OD1-CA 3.36Å; N822-Q825 WeakPolarHBondContact OD1-CB 3.31Å; N822-Q825 PolarHBondContact OD1-N 2.76Å; N822-Q825 PolarHBondContact OD1-O 2.83Å
826	G	78.6	Confident	87.6	Confident	19 Å²	19	26.5 Å²	26.5	20%	0.196	14%	0.141	C	C	.	.			trans	-88.8	161.7	171.7	0	0	0	0	0	111	R820 G828	R820-G826 PolarHBondContact NH1-O 3.43Å; R820-G826 VanDerWaalsContact NH1-O 3.07Å; R820-G826 PolarHBondContact NH2-O 3.26Å; R820-G826 VanDerWaalsContact NH2-O 3.09Å; G826-G828 VanDerWaalsContact C-N 3.26Å; G826-G828 PolarHBondContact O-N 3.44Å
827	I	86.5	Confident	87.5	Confident	3 Å²	3	26.3 Å²	26.3	2%	0.015	14%	0.141	C	C	.	.			trans	-83.7	8.4	-171.7	65.7	174.9	0	0	0	114.5	Y773 L830 N831 L856 Q859 W862	Y773-I827 PolarHBondContact OH-O 2.78Å; I827-L830 HydrophobicContact CB-CB 4.03Å; I827-L830 HydrophobicContact CB-CD1 3.99Å; I827-L830 HydrophobicContact CD1-CB 3.64Å; I827-L830 HydrophobicContact CG1-CB 3.78Å; I827-L830 WeakPolarHBondContact O-CB 3.21Å; I827-L830 PolarHBondContact O-N 3.25Å; I827-N831 HydrophobicContact CG1-CB 4.01Å; I827-L856 HydrophobicContact CD1-CD2 4.29Å; I827-L856 HydrophobicContact CG2-CD2 4.33Å; I827-Q859 HydrophobicContact CD1-CB 4.02Å; I827-Q859 HydrophobicContact CD1-CG 3.57Å; I827-Q859 HydrophobicContact CG1-CG 3.88Å; I827-W862 HydrophobicContact CD1-CG 4.11Å
828	G	84.3	Confident	87.4	Confident	19 Å²	19	26.3 Å²	26.3	20%	0.196	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	58.2	-134.9	178.3	0	0	0	0	0	112.4	Y773 G826 L830 N831	Y773-G828 WeakPolarHBondContact OH-CA 3.4Å; G826-G828 VanDerWaalsContact C-N 3.26Å; G826-G828 PolarHBondContact O-N 3.44Å; G828-L830 PolarHBondContact O-N 3.22Å; G828-N831 WeakPolarHBondContact O-CB 3.43Å; G828-N831 PolarHBondContact O-N 2.85Å
829	F	79.9	Confident	87.4	Confident	36 Å²	36	26.4 Å²	26.4	16%	0.158	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-52.7	-27.5	-178.8	-59.7	-61.8	0	0	0	114.6	F20 P772 Y773 N831 D832 R835	F20-F829 HydrophobicContact CE1-CE1 4.23Å; F20-F829 HydrophobicContact CZ-CE1 4.35Å; P772-F829 HydrophobicContact CB-CB 4.1Å; P772-F829 WeakPolarHBondContact O-CD2 3.12Å; Y773-F829 HydrophobicContact CD1-CD2 4.07Å; Y773-F829 HydrophobicContact CD1-CE2 4.36Å; Y773-F829 AromaticContact CE1-CD2 3.64Å; Y773-F829 HydrophobicContact CE1-CD2 3.64Å; Y773-F829 HydrophobicContact CE1-CE2 4.1Å; Y773-F829 PolarHBondContact OH-N 3.28Å; F829-N831 PolarHBondContact O-N 3.2Å; F829-N831 VanDerWaalsContact O-N 3.09Å; F829-D832 PolarHBondContact O-N 2.84Å; F829-R835 VanDerWaalsContact O-CD 3.26Å; F829-R835 WeakPolarHBondContact O-CD 3.29Å
830	L	86.6	Confident	87.5	Confident	9 Å²	9	26.6 Å²	26.6	5%	0.047	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-59.8	-19.7	173.7	-67.6	165.3	0	0	0	113.4	P772 C818 R820 I827 G828 D832 L856 W862	P772-L830 HydrophobicContact CG-CD2 3.68Å; P772-L830 HydrophobicContact CG-CG 3.96Å; C818-L830 HydrophobicContact CB-CD1 4.13Å; C818-L830 HydrophobicContact CB-CD2 4.15Å; C818-L830 WeakPolarHBondContact O-CD1 3.46Å; R820-L830 HydrophobicContact CB-CD1 3.9Å; R820-L830 HydrophobicContact CG-CD1 3.78Å; I827-L830 HydrophobicContact CB-CB 4.03Å; I827-L830 HydrophobicContact CB-CD1 3.99Å; I827-L830 HydrophobicContact CD1-CB 3.64Å; I827-L830 HydrophobicContact CG1-CB 3.78Å; I827-L830 WeakPolarHBondContact O-CB 3.21Å; I827-L830 PolarHBondContact O-N 3.25Å; G828-L830 PolarHBondContact O-N 3.22Å; L830-D832 VanDerWaalsContact C-N 3.26Å; L830-D832 PolarHBondContact O-N 2.85Å; L830-L856 HydrophobicContact CD1-CD2 3.78Å; L830-W862 HydrophobicContact CB-CZ2 4.13Å; L830-W862 HydrophobicContact CD2-CH2 3.92Å; L830-W862 HydrophobicContact CD2-CZ2 3.5Å; L830-W862 VanDerWaalsContact CD2-CZ2 3.5Å; L830-W862 HydrophobicContact CG-CZ2 4.36Å; L830-W862 PolarHBondContact O-NE1 2.88Å
831	N	88.6	Confident	87.6	Confident	72 Å²	72	26.5 Å²	26.5	39%	0.385	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-73.3	-17.1	-176.8	-161.3	60.1	0	0	0	113.4	I827 G828 F829 P833 Q859	I827-N831 HydrophobicContact CG1-CB 4.01Å; G828-N831 WeakPolarHBondContact O-CB 3.43Å; G828-N831 PolarHBondContact O-N 2.85Å; F829-N831 PolarHBondContact O-N 3.2Å; F829-N831 VanDerWaalsContact O-N 3.09Å; N831-P833 WeakPolarHBondContact O-CD 3.22Å; N831-Q859 WeakPolarHBondContact OD1-CG 3.32Å; N831-Q859 PolarHBondContact OD1-OE1 2.86Å
832	D	89	Confident	87.9	Confident	16 Å²	16	26.6 Å²	26.6	9%	0.086	14%	0.142	C	C	.	.			trans	-75.1	120.8	176.3	169.9	33.9	0	0	0	111.4	F829 L830 R834 R835 L836	F829-D832 PolarHBondContact O-N 2.84Å; L830-D832 VanDerWaalsContact C-N 3.26Å; L830-D832 PolarHBondContact O-N 2.85Å; D832-R834 VanDerWaalsContact CG-N 3.35Å; D832-R834 PolarHBondContact O-N 2.86Å; D832-R834 WeakPolarHBondContact OD1-CB 3.36Å; D832-R834 PolarHBondContact OD1-N 3.08Å; D832-R834 VanDerWaalsContact OD2-CB 3.32Å; D832-R834 WeakPolarHBondContact OD2-CB 3.36Å; D832-R834 PolarHBondContact OD2-N 3.14Å; D832-R835 HydrophobicContact CB-CB 4.25Å; D832-R835 HydrophobicContact CB-CG 4.24Å; D832-R835 VanDerWaalsContact OD2-CG 3.26Å; D832-R835 WeakPolarHBondContact OD2-CG 3.5Å; D832-R835 PolarHBondContact OD2-N 2.87Å; D832-L836 PolarHBondContact O-N 3.48Å
833	P	92.7	Very high	88.4	Confident	11 Å²	11	25.8 Å²	25.8	7%	0.071	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-30.2	173	23.5	-34.8	0	0	0	114.3	F694 N831 L836 N837 L861 F899	F694-P833 HydrophobicContact CE1-CB 3.88Å; F694-P833 WeakPolarHBondContact CE1-O 3.13Å; N831-P833 WeakPolarHBondContact O-CD 3.22Å; P833-L836 PolarHBondContact O-N 2.88Å; P833-N837 WeakPolarHBondContact O-CB 3.03Å; P833-N837 PolarHBondContact O-N 3.15Å; P833-L861 HydrophobicContact CB-CD2 3.7Å; P833-F899 HydrophobicContact CB-CD2 3.75Å; P833-F899 HydrophobicContact CB-CE2 3.61Å; P833-F899 HydrophobicContact CG-CD2 3.96Å; P833-F899 HydrophobicContact CG-CE2 3.5Å
834	R	92.6	Very high	89.4	Confident	22 Å²	22	21.8 Å²	21.8	8%	0.083	12%	0.116	C	C	.	.	H	α-helix	trans	-71.2	-48.6	-176.5	-62.3	169	161	-155.4	-17.7	110.9	H641 Q643 L644 E664 D832 L836 N837 V838	H641-R834 PolarHBondContact O-NH2 3.49Å; Q643-R834 WeakPolarHBondContact O-CD 3.31Å; Q643-R834 WeakPolarHBondContact O-CG 3.37Å; Q643-R834 PolarHBondContact O-NE 3.43Å; L644-R834 HydrophobicContact CD2-CB 4.2Å; E664-R834 IonicContact OE1-CZ 3.17Å; E664-R834 IonicContact OE1-NH1 2.68Å; E664-R834 PolarHBondContact OE1-NH1 2.88Å; E664-R834 IonicContact OE1-NH2 2.74Å; E664-R834 PolarHBondContact OE1-NH2 3.38Å; D832-R834 VanDerWaalsContact CG-N 3.35Å; D832-R834 PolarHBondContact O-N 2.86Å; D832-R834 WeakPolarHBondContact OD1-CB 3.36Å; D832-R834 PolarHBondContact OD1-N 3.08Å; D832-R834 VanDerWaalsContact OD2-CB 3.32Å; D832-R834 WeakPolarHBondContact OD2-CB 3.36Å; D832-R834 PolarHBondContact OD2-N 3.14Å; R834-L836 VanDerWaalsContact C-N 3.32Å; R834-L836 PolarHBondContact O-N 3.21Å; R834-N837 PolarHBondContact O-N 3.3Å; R834-V838 WeakPolarHBondContact O-CG2 3.41Å; R834-V838 PolarHBondContact O-N 3.49Å
835	R	93	Very high	90.6	Very high	9 Å²	9	17.3 Å²	17.3	3%	0.034	9%	0.089	C	C	.	.	H	α-helix	trans	-50.1	-48.9	167.8	-76.5	174.2	-161.5	-97.3	14.4	111.8	S40 D41 L644 V803 D804 F829 D832 N837 V838 A839	S40-R835 PolarHBondContact OG-NH2 2.96Å; D41-R835 IonicContact OD1-CZ 2.66Å; D41-R835 IonicContact OD1-NE 2.65Å; D41-R835 IonicContact OD1-NH2 3.59Å; D41-R835 PolarHBondContact OD1-NH2 3.13Å; D41-R835 IonicContact OD2-CZ 3.48Å; D41-R835 IonicContact OD2-NE 3.61Å; D41-R835 IonicContact OD2-NH2 3.74Å; D41-R835 PolarHBondContact OD2-NH2 3.19Å; L644-R835 HydrophobicContact CD2-CG 3.94Å; V803-R835 HydrophobicContact CB-CB 4.47Å; V803-R835 HydrophobicContact CB-CG 4.45Å; V803-R835 HydrophobicContact CG1-CB 3.76Å; V803-R835 HydrophobicContact CG1-CG 4.04Å; V803-R835 WeakPolarHBondContact CG1-O 3.45Å; D804-R835 IonicContact OD1-CZ 3.55Å; D804-R835 IonicContact OD1-NE 3.89Å; D804-R835 IonicContact OD1-NH1 3.5Å; D804-R835 PolarHBondContact OD1-NH1 2.88Å; D804-R835 IonicContact OD2-CZ 2.77Å; D804-R835 IonicContact OD2-NH1 2.82Å; D804-R835 PolarHBondContact OD2-NH1 2.72Å; D804-R835 IonicContact OD2-NH2 3.18Å; F829-R835 VanDerWaalsContact O-CD 3.26Å; F829-R835 WeakPolarHBondContact O-CD 3.29Å; D832-R835 HydrophobicContact CB-CB 4.25Å; D832-R835 HydrophobicContact CB-CG 4.24Å; D832-R835 VanDerWaalsContact OD2-CG 3.26Å; D832-R835 WeakPolarHBondContact OD2-CG 3.5Å; D832-R835 PolarHBondContact OD2-N 2.87Å; R835-N837 PolarHBondContact O-N 3.26Å; R835-V838 PolarHBondContact O-N 2.86Å; R835-A839 WeakPolarHBondContact O-CB 3.49Å; R835-A839 PolarHBondContact O-N 3.32Å
836	L	95.4	Very high	91.9	Very high	5 Å²	5	16.1 Å²	16.1	3%	0.026	8%	0.084	C	C	.	.	H	α-helix	trans	-62.2	-44.9	178.9	-177.4	58.3	0	0	0	112	F694 D832 P833 R834 V838 A839 L840 L861 W862 L865	F694-L836 HydrophobicContact CZ-CB 4.48Å; F694-L836 HydrophobicContact CZ-CD2 4.47Å; F694-L836 HydrophobicContact CZ-CG 4.41Å; D832-L836 PolarHBondContact O-N 3.48Å; P833-L836 PolarHBondContact O-N 2.88Å; R834-L836 VanDerWaalsContact C-N 3.32Å; R834-L836 PolarHBondContact O-N 3.21Å; L836-V838 PolarHBondContact O-N 3.26Å; L836-A839 PolarHBondContact O-N 2.86Å; L836-L840 HydrophobicContact CD1-CD1 3.9Å; L836-L840 HydrophobicContact CD1-CD2 4.17Å; L836-L840 HydrophobicContact CD1-CG 3.8Å; L836-L840 HydrophobicContact CG-CD1 3.89Å; L836-L840 HydrophobicContact CG-CG 4.22Å; L836-L840 VanDerWaalsContact O-CG 3.27Å; L836-L840 WeakPolarHBondContact O-CG 3.23Å; L836-L840 PolarHBondContact O-N 3.3Å; L836-L861 HydrophobicContact CD2-CD1 4.14Å; L836-L861 HydrophobicContact CD2-CD2 3.82Å; L836-L861 HydrophobicContact CD2-CG 3.72Å; L836-W862 HydrophobicContact CD1-CH2 3.68Å; L836-W862 HydrophobicContact CD1-CZ2 3.63Å; L836-W862 HydrophobicContact CD1-CZ3 4.37Å; L836-W862 HydrophobicContact CD2-CD2 4.47Å; L836-W862 HydrophobicContact CD2-CZ2 4.27Å; L836-W862 HydrophobicContact CG-CZ2 4.41Å; L836-L865 HydrophobicContact CD1-CD2 4.09Å; L836-L865 HydrophobicContact CD2-CD2 4.23Å
837	N	95.7	Very high	92.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.9	-43.5	176.2	-173.1	25.5	0	0	0	112.1	C642 F694 Y695 P833 R834 R835 T841	C642-N837 PolarHBondContact O-ND2 3.45Å; F694-N837 HydrophobicContact CD1-CB 4.1Å; F694-N837 HydrophobicContact CD2-CB 3.54Å; F694-N837 VanDerWaalsContact CD2-OD1 3.25Å; F694-N837 WeakPolarHBondContact CD2-OD1 3.41Å; F694-N837 HydrophobicContact CE1-CB 4.11Å; F694-N837 HydrophobicContact CE2-CB 3.57Å; F694-N837 HydrophobicContact CG-CB 3.83Å; F694-N837 HydrophobicContact CZ-CB 3.86Å; Y695-N837 PolarHBondContact OH-ND2 3.39Å; P833-N837 WeakPolarHBondContact O-CB 3.03Å; P833-N837 PolarHBondContact O-N 3.15Å; R834-N837 PolarHBondContact O-N 3.3Å; R835-N837 PolarHBondContact O-N 3.26Å; N837-T841 WeakPolarHBondContact O-CB 3.49Å; N837-T841 WeakPolarHBondContact O-CG2 3.31Å; N837-T841 PolarHBondContact O-N 3.23Å; N837-T841 PolarHBondContact O-OG1 3.07Å
838	V	95.3	Very high	93.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-56.9	-56.9	173.6	169.6	0	0	0	0	109.9	Q643 L644 V803 R834 R835 L836 L840 T841 R842	Q643-V838 HydrophobicContact CB-CG2 3.88Å; Q643-V838 HydrophobicContact CG-CG2 3.84Å; L644-V838 HydrophobicContact CD1-CG2 4.2Å; L644-V838 HydrophobicContact CG-CG2 4.14Å; V803-V838 HydrophobicContact CG1-CB 4.26Å; V803-V838 HydrophobicContact CG1-CG1 4.18Å; R834-V838 WeakPolarHBondContact O-CG2 3.41Å; R834-V838 PolarHBondContact O-N 3.49Å; R835-V838 PolarHBondContact O-N 2.86Å; L836-V838 PolarHBondContact O-N 3.26Å; V838-L840 PolarHBondContact O-N 2.93Å; V838-T841 PolarHBondContact O-N 3.28Å; V838-T841 VanDerWaalsContact O-N 3.07Å; V838-T841 PolarHBondContact O-OG1 3.15Å; V838-T841 VanDerWaalsContact O-OG1 3.05Å; V838-R842 WeakPolarHBondContact O-CD 3.47Å; V838-R842 WeakPolarHBondContact O-CG 3.37Å; V838-R842 PolarHBondContact O-N 2.79Å; V838-R842 PolarHBondContact O-NE 2.76Å
839	A	96.3	Very high	94	Very high	2 Å²	2	14.4 Å²	14.4	2%	0.017	7%	0.066	C	C	.	.	H	α-helix	trans	-57.7	-46.7	-176	0	0	0	0	0	113.4	I770 V803 L816 R835 L836 T841	I770-A839 HydrophobicContact CG2-CB 4.42Å; V803-A839 HydrophobicContact CG1-CB 4.15Å; V803-A839 HydrophobicContact CG2-CB 4.46Å; L816-A839 HydrophobicContact CD1-CB 4.16Å; L816-A839 HydrophobicContact CD2-CB 4.03Å; R835-A839 WeakPolarHBondContact O-CB 3.49Å; R835-A839 PolarHBondContact O-N 3.32Å; L836-A839 PolarHBondContact O-N 2.86Å; A839-T841 PolarHBondContact O-N 3.14Å
840	L	96.8	Very high	94.9	Very high	4 Å²	4	12.7 Å²	12.7	2%	0.021	6%	0.058	C	C	.	.	H	α-helix	trans	-64.7	-25.3	179.1	-64.6	177.9	0	0	0	112.9	F689 P690 L836 V838 L847 V849 L865	F689-L840 HydrophobicContact CD1-CD1 3.64Å; F689-L840 HydrophobicContact CE1-CD1 3.82Å; P690-L840 HydrophobicContact CG-CB 4.06Å; P690-L840 HydrophobicContact CG-CD1 4.4Å; L836-L840 HydrophobicContact CD1-CD1 3.9Å; L836-L840 HydrophobicContact CD1-CD2 4.17Å; L836-L840 HydrophobicContact CD1-CG 3.8Å; L836-L840 HydrophobicContact CG-CD1 3.89Å; L836-L840 HydrophobicContact CG-CG 4.22Å; L836-L840 VanDerWaalsContact O-CG 3.27Å; L836-L840 WeakPolarHBondContact O-CG 3.23Å; L836-L840 PolarHBondContact O-N 3.3Å; V838-L840 PolarHBondContact O-N 2.93Å; L840-L847 HydrophobicContact CD2-CD2 3.69Å; L840-V849 HydrophobicContact CD2-CG2 4.47Å; L840-L865 HydrophobicContact CD1-CD1 4.44Å; L840-L865 HydrophobicContact CD1-CD2 4.38Å; L840-L865 HydrophobicContact CD2-CD2 4.33Å
841	T	96.5	Very high	95.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	11.8	-172.6	61.2	0	0	0	0	114.6	P472 R681 M682 P690 N837 V838 A839	P472-T841 HydrophobicContact CB-CG2 4.14Å; P472-T841 HydrophobicContact CG-CG2 3.92Å; P472-T841 WeakPolarHBondContact CG-OG1 3.33Å; R681-T841 VanDerWaalsContact CD-O 3.25Å; R681-T841 WeakPolarHBondContact CD-O 3.49Å; R681-T841 PolarHBondContact NH1-O 3.26Å; M682-T841 HydrophobicContact CE-CG2 4.41Å; M682-T841 HydrophobicContact SD-CG2 3.88Å; P690-T841 HydrophobicContact CB-CG2 3.82Å; P690-T841 HydrophobicContact CG-CG2 3.87Å; N837-T841 WeakPolarHBondContact O-CB 3.49Å; N837-T841 WeakPolarHBondContact O-CG2 3.31Å; N837-T841 PolarHBondContact O-N 3.23Å; N837-T841 PolarHBondContact O-OG1 3.07Å; V838-T841 PolarHBondContact O-N 3.28Å; V838-T841 VanDerWaalsContact O-N 3.07Å; V838-T841 PolarHBondContact O-OG1 3.15Å; V838-T841 VanDerWaalsContact O-OG1 3.05Å; A839-T841 PolarHBondContact O-N 3.14Å
842	R	95.7	Very high	95.7	Very high	4 Å²	4	9.5 Å²	9.5	2%	0.015	4%	0.041	C	C	.	.	S	Bend	trans	-84.1	-22.1	172.7	-54.9	-51.9	86.5	169	12.2	113.5	I770 F806 E810 K811 I814 V838	I770-R842 HydrophobicContact CD1-CB 4.04Å; I770-R842 HydrophobicContact CD1-CG 3.64Å; F806-R842 HydrophobicContact CB-CG 4.1Å; F806-R842 HydrophobicContact CD1-CB 3.97Å; F806-R842 HydrophobicContact CD1-CG 3.7Å; F806-R842 HydrophobicContact CE1-CB 4.37Å; F806-R842 HydrophobicContact CG-CG 4.17Å; F806-R842 WeakPolarHBondContact O-CD 3.31Å; F806-R842 PolarHBondContact O-NH1 2.88Å; E810-R842 WeakPolarHBondContact CA-O 3.43Å; K811-R842 PolarHBondContact N-O 3.2Å; I814-R842 HydrophobicContact CD1-CB 3.9Å; I814-R842 HydrophobicContact CG1-CB 3.91Å; V838-R842 WeakPolarHBondContact O-CD 3.47Å; V838-R842 WeakPolarHBondContact O-CG 3.37Å; V838-R842 PolarHBondContact O-N 2.79Å; V838-R842 PolarHBondContact O-NE 2.76Å
843	A	97.1	Very high	95.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	138.4	-175.7	0	0	0	0	0	112.8	M682 L686 I814 G846 L847	M682-A843 WeakPolarHBondContact CG-O 3.44Å; L686-A843 HydrophobicContact CD1-CB 4.09Å; I814-A843 HydrophobicContact CB-CB 4.05Å; I814-A843 HydrophobicContact CG1-CB 3.87Å; A843-G846 WeakPolarHBondContact CB-O 3.27Å; A843-L847 HydrophobicContact CB-CB 4.03Å
844	R	96.5	Very high	95.8	Very high	68 Å²	68	14 Å²	14	26%	0.257	6%	0.059	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-49.6	174.6	-55.8	162.1	89.8	-130.4	2.8	111.8	R681 H683 E810 K811 D812	R681-R844 HydrophobicContact CG-CG 4.01Å; H683-R844 PolarHBondContact N-O 2.91Å; E810-R844 HydrophobicContact CB-CG 4.42Å; E810-R844 WeakPolarHBondContact OE1-CD 3.46Å; E810-R844 IonicContact OE1-CZ 3.18Å; E810-R844 IonicContact OE1-NE 2.96Å; E810-R844 PolarHBondContact OE1-NE 2.87Å; E810-R844 IonicContact OE1-NH2 3.99Å; K811-R844 VanDerWaalsContact O-CG 3.27Å; K811-R844 WeakPolarHBondContact O-CG 3.25Å; K811-R844 PolarHBondContact O-N 3.49Å; D812-R844 WeakPolarHBondContact OD1-CD 3.26Å; D812-R844 IonicContact OD1-CZ 2.91Å; D812-R844 IonicContact OD1-NE 2.8Å; D812-R844 IonicContact OD1-NH1 2.76Å; D812-R844 PolarHBondContact OD1-NH1 2.81Å
845	Y	96.2	Very high	95.8	Very high	38 Å²	38	13 Å²	13	15%	0.149	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-27.6	-172.7	-68.5	-91	0	0	0	114	R708 K710 P722 D812	R708-Y845 VanDerWaalsContact C-CD1 3.46Å; R708-Y845 HydrophobicContact CB-CD1 4.49Å; R708-Y845 VanDerWaalsContact O-CD1 3.24Å; R708-Y845 WeakPolarHBondContact O-CD1 3.22Å; K710-Y845 HydrophobicContact CD-CD1 4.34Å; K710-Y845 HydrophobicContact CD-CG 4.46Å; K710-Y845 HydrophobicContact CG-CD1 3.66Å; K710-Y845 HydrophobicContact CG-CE1 3.8Å; K710-Y845 HydrophobicContact CG-CG 4.22Å; P722-Y845 WeakPolarHBondContact CB-O 3.27Å; P722-Y845 WeakPolarHBondContact CG-O 3.36Å; D812-Y845 HydrophobicContact CB-CD2 3.69Å; D812-Y845 HydrophobicContact CB-CE2 4.45Å; D812-Y845 HydrophobicContact CB-CG 4.47Å; D812-Y845 CarbonylContact O-C 3.5Å; D812-Y845 WeakPolarHBondContact O-CA 3.4Å; D812-Y845 WeakPolarHBondContact O-CB 2.97Å; D812-Y845 PolarHBondContact O-N 3.48Å; D812-Y845 VanDerWaalsContact OD1-CD2 3.29Å; D812-Y845 WeakPolarHBondContact OD1-CD2 3.4Å; D812-Y845 WeakPolarHBondContact OD1-CE2 3.31Å
846	G	96.4	Very high	95.8	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.01	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	157.4	172.7	0	0	0	0	0	116.1	P722 D812 Y813 I814 A843	P722-G846 CarbonylContact O-C 3.51Å; P722-G846 WeakPolarHBondContact O-CA 3.34Å; D812-G846 PolarHBondContact O-N 2.82Å; Y813-G846 WeakPolarHBondContact CA-O 3.22Å; I814-G846 PolarHBondContact N-O 2.87Å; A843-G846 WeakPolarHBondContact CB-O 3.27Å
847	L	97.9	Very high	95.6	Very high	4 Å²	4	13.2 Å²	13.2	2%	0.021	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	123.2	-172	174.8	64.2	0	0	0	111.7	L686 P722 M723 F724 I814 L840 A843 V849	L686-L847 HydrophobicContact CD2-CB 3.6Å; L686-L847 HydrophobicContact CD2-CD2 4.44Å; P722-L847 PolarHBondContact O-N 2.92Å; P722-L847 VanDerWaalsContact O-N 3.08Å; M723-L847 WeakPolarHBondContact CA-O 3.37Å; M723-L847 HydrophobicContact CB-CB 4.18Å; M723-L847 WeakPolarHBondContact CB-O 3.32Å; F724-L847 PolarHBondContact N-O 2.97Å; I814-L847 HydrophobicContact CB-CD1 3.88Å; I814-L847 HydrophobicContact CG2-CD1 3.67Å; I814-L847 CarbonylContact O-C 3.45Å; I814-L847 WeakPolarHBondContact O-CA 3.06Å; L840-L847 HydrophobicContact CD2-CD2 3.69Å; A843-L847 HydrophobicContact CB-CB 4.03Å; L847-V849 HydrophobicContact CD2-CG2 4.47Å; L847-V849 HydrophobicContact CG-CG2 4.25Å
848	I	98.3	Very high	95.3	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.3	175.9	-57	172	0	0	0	108.5	F714 W716 F724 I753 M757 I814 I815 L816 V850	F714-I848 HydrophobicContact CE1-CD1 3.94Å; F714-I848 HydrophobicContact CZ-CD1 3.71Å; W716-I848 HydrophobicContact CH2-CD1 4.1Å; W716-I848 HydrophobicContact CH2-CG1 4.05Å; W716-I848 HydrophobicContact CZ3-CD1 4.04Å; W716-I848 HydrophobicContact CZ3-CG1 3.74Å; F724-I848 HydrophobicContact CD1-CG1 4.11Å; F724-I848 HydrophobicContact CD2-CG2 4.2Å; F724-I848 HydrophobicContact CE1-CD1 3.63Å; F724-I848 HydrophobicContact CE1-CG1 3.58Å; F724-I848 HydrophobicContact CE1-CG2 4.23Å; F724-I848 HydrophobicContact CE2-CG2 3.76Å; F724-I848 HydrophobicContact CZ-CB 4.48Å; F724-I848 HydrophobicContact CZ-CD1 3.7Å; F724-I848 HydrophobicContact CZ-CG1 3.89Å; F724-I848 HydrophobicContact CZ-CG2 3.77Å; I753-I848 HydrophobicContact CD1-CG2 3.97Å; I753-I848 HydrophobicContact CG2-CD1 3.53Å; M757-I848 HydrophobicContact CE-CD1 3.61Å; I814-I848 PolarHBondContact O-N 2.91Å; I815-I848 CarbonylContact C-O 3.52Å; I815-I848 VanDerWaalsContact CA-O 3.31Å; I815-I848 WeakPolarHBondContact CA-O 3.18Å; L816-I848 PolarHBondContact N-O 3.26Å; I848-V850 HydrophobicContact CG2-CG2 4.26Å
849	V	98.4	Very high	95	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121	176.8	-174	0	0	0	0	108.5	F724 F725 Y726 L816 L840 L847 W862 Y869	F724-V849 PolarHBondContact O-N 2.91Å; F725-V849 CarbonylContact C-O 3.43Å; F725-V849 VanDerWaalsContact CA-O 3.29Å; F725-V849 WeakPolarHBondContact CA-O 3.34Å; F725-V849 HydrophobicContact CD2-CB 3.75Å; F725-V849 HydrophobicContact CD2-CG1 3.58Å; F725-V849 HydrophobicContact CE2-CB 4.18Å; F725-V849 HydrophobicContact CE2-CG1 3.49Å; F725-V849 VanDerWaalsContact CE2-CG1 3.49Å; F725-V849 HydrophobicContact CG-CB 4.41Å; F725-V849 HydrophobicContact CZ-CG1 4.42Å; Y726-V849 PolarHBondContact N-O 2.71Å; L816-V849 HydrophobicContact CB-CG1 4.46Å; L816-V849 HydrophobicContact CB-CG2 4.42Å; L816-V849 HydrophobicContact CD2-CG1 4.13Å; L816-V849 HydrophobicContact CD2-CG2 4.31Å; L816-V849 HydrophobicContact CG-CG1 4.34Å; L816-V849 CarbonylContact O-C 3.54Å; L840-V849 HydrophobicContact CD2-CG2 4.47Å; L847-V849 HydrophobicContact CD2-CG2 4.47Å; L847-V849 HydrophobicContact CG-CG2 4.25Å; V849-W862 HydrophobicContact CG1-CZ3 4.37Å; V849-Y869 HydrophobicContact CG2-CE2 4.32Å
850	V	98.3	Very high	94.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	128.5	-179.9	-169	0	0	0	0	108.3	Y726 T728 E746 T749 V750 I753 I815 L816 C818 I848	Y726-V850 WeakPolarHBondContact O-CA 3.28Å; T728-V850 HydrophobicContact CG2-CG1 3.6Å; E746-V850 HydrophobicContact CB-CG1 4.23Å; E746-V850 HydrophobicContact CG-CG1 4Å; T749-V850 HydrophobicContact CG2-CG1 4.07Å; V750-V850 HydrophobicContact CG2-CG2 4.28Å; I753-V850 HydrophobicContact CD1-CG2 3.86Å; I815-V850 HydrophobicContact CG2-CG2 3.98Å; L816-V850 PolarHBondContact O-N 3.18Å; C818-V850 WeakPolarHBondContact CB-O 3.01Å; C818-V850 PolarHBondContact N-O 2.73Å; I848-V850 HydrophobicContact CG2-CG2 4.26Å
851	G	96.5	Very high	94.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.6	-177.4	178.2	0	0	0	0	0	115.2	F725 Y726 C727 T728 E746 P853	F725-G851 WeakPolarHBondContact CE1-O 3.48Å; Y726-G851 PolarHBondContact O-N 2.95Å; Y726-G851 VanDerWaalsContact O-N 3.14Å; C727-G851 WeakPolarHBondContact CA-O 3.24Å; T728-G851 PolarHBondContact N-O 3.28Å; T728-G851 VanDerWaalsContact OG1-C 3.31Å; T728-G851 PolarHBondContact OG1-O 2.98Å; E746-G851 WeakPolarHBondContact OE1-CA 3.43Å; G851-P853 WeakPolarHBondContact O-CD 3.35Å
852	N	94.9	Very high	94.5	Very high	14 Å²	14	24.5 Å²	24.5	8%	0.075	12%	0.117	C	C	.	.			trans	-100.5	109.1	-178.5	-175	-23.3	0	0	0	112	T728 A821 K854 A855 L856	T728-N852 WeakPolarHBondContact O-CA 3.37Å; T728-N852 WeakPolarHBondContact O-CB 3.47Å; A821-N852 HydrophobicContact CB-CB 3.75Å; A821-N852 WeakPolarHBondContact CB-ND2 3.24Å; N852-K854 PolarHBondContact O-N 3.08Å; N852-K854 WeakPolarHBondContact OD1-CB 3.49Å; N852-K854 PolarHBondContact OD1-N 3.24Å; N852-A855 HydrophobicContact CB-CB 4.48Å; N852-A855 PolarHBondContact O-N 3.48Å; N852-L856 WeakPolarHBondContact O-CG 3.49Å; N852-L856 PolarHBondContact O-N 3.33Å
853	P	93.5	Very high	94.4	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.013	12%	0.119	C	C	.	.	H	α-helix	trans	-58.4	-32.2	180	-24.7	34.2	0	0	0	114	F725 C727 G851 A855 L856 C857 L866 L875 Y886	F725-P853 HydrophobicContact CE1-CG 3.96Å; C727-P853 HydrophobicContact CB-CG 3.97Å; C727-P853 WeakPolarHBondContact SG-CG 3.33Å; G851-P853 WeakPolarHBondContact O-CD 3.35Å; P853-A855 VanDerWaalsContact C-N 3.3Å; P853-A855 PolarHBondContact O-N 3.1Å; P853-L856 PolarHBondContact O-N 3.2Å; P853-C857 VanDerWaalsContact O-CB 3.24Å; P853-C857 WeakPolarHBondContact O-CB 3.33Å; P853-C857 PolarHBondContact O-N 2.84Å; P853-C857 PolarHBondContact O-SG 3.35Å; P853-L866 HydrophobicContact CB-CD1 4.14Å; P853-L866 HydrophobicContact CB-CD2 4.08Å; P853-L866 HydrophobicContact CG-CD2 4.3Å; P853-L875 HydrophobicContact CG-CD1 4.48Å; P853-Y886 HydrophobicContact CB-CE1 3.9Å; P853-Y886 HydrophobicContact CG-CD1 4.36Å; P853-Y886 HydrophobicContact CG-CE1 3.87Å; P853-Y886 HydrophobicContact CG-CE2 4.41Å
854	K	91.2	Very high	94.3	Very high	119 Å²	119	26.8 Å²	26.8	52%	0.517	13%	0.128	S	C	.	.	H	α-helix	trans	-67.5	-29.1	-178.1	-58.7	-177.4	178.6	-178.1	0	112.8	N852 K858	N852-K854 PolarHBondContact O-N 3.08Å; N852-K854 WeakPolarHBondContact OD1-CB 3.49Å; N852-K854 PolarHBondContact OD1-N 3.24Å; K854-K858 WeakPolarHBondContact O-CE 3.19Å
855	A	91.4	Very high	94.3	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.008	12%	0.116	C	C	.	.	H	α-helix	trans	-81.3	-45.8	173.9	0	0	0	0	0	110.7	N852 P853	N852-A855 HydrophobicContact CB-CB 4.48Å; N852-A855 PolarHBondContact O-N 3.48Å; P853-A855 VanDerWaalsContact C-N 3.3Å; P853-A855 PolarHBondContact O-N 3.1Å
856	L	93.1	Very high	94.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-72.4	-35.9	-172.5	-63.6	170.9	0	0	0	113.4	F725 C818 I827 L830 N852 P853 K858 Q859 W862 L866	F725-L856 HydrophobicContact CE2-CD1 3.89Å; F725-L856 HydrophobicContact CZ-CD1 3.57Å; C818-L856 HydrophobicContact CB-CD1 4.3Å; I827-L856 HydrophobicContact CD1-CD2 4.29Å; I827-L856 HydrophobicContact CG2-CD2 4.33Å; L830-L856 HydrophobicContact CD1-CD2 3.78Å; N852-L856 WeakPolarHBondContact O-CG 3.49Å; N852-L856 PolarHBondContact O-N 3.33Å; P853-L856 PolarHBondContact O-N 3.2Å; L856-K858 PolarHBondContact O-N 2.95Å; L856-Q859 PolarHBondContact O-N 3.09Å; L856-Q859 VanDerWaalsContact O-N 3.11Å; L856-W862 HydrophobicContact CB-CB 4.14Å; L856-W862 HydrophobicContact CB-CE3 4.33Å; L856-W862 HydrophobicContact CB-CG 4.48Å; L856-W862 HydrophobicContact CD1-CE3 3.98Å; L856-W862 HydrophobicContact CD1-CZ3 4.14Å; L856-W862 HydrophobicContact CD2-CD2 3.92Å; L856-W862 HydrophobicContact CD2-CE3 3.96Å; L856-W862 HydrophobicContact CD2-CG 4.29Å; L856-W862 HydrophobicContact CD2-CZ3 4.38Å; L856-W862 HydrophobicContact CG-CE3 4.32Å; L856-W862 WeakPolarHBondContact O-CB 3.38Å; L856-L866 HydrophobicContact CB-CD1 4.02Å
857	C	91.9	Very high	94.2	Very high	20 Å²	20	22.4 Å²	22.4	14%	0.135	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.4	-177.5	74.5	0	0	0	0	114.6	P853 N863 L866 F890	P853-C857 VanDerWaalsContact O-CB 3.24Å; P853-C857 WeakPolarHBondContact O-CB 3.33Å; P853-C857 PolarHBondContact O-N 2.84Å; P853-C857 PolarHBondContact O-SG 3.35Å; C857-N863 WeakPolarHBondContact O-CB 3.24Å; C857-N863 PolarHBondContact O-ND2 3.24Å; C857-L866 HydrophobicContact CB-CD1 3.79Å; C857-F890 HydrophobicContact CB-CB 4.04Å; C857-F890 HydrophobicContact CB-CD2 3.82Å; C857-F890 HydrophobicContact CB-CG 4.06Å
858	K	89.2	Confident	94.1	Very high	96 Å²	96	24 Å²	24	42%	0.417	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-28.8	174.5	-62.7	170.2	-170.4	159.1	0	112.2	N822 E823 K854 L856	N822-K858 PolarHBondContact O-NZ 3.28Å; E823-K858 VanDerWaalsContact C-NZ 3.31Å; E823-K858 PolarHBondContact O-NZ 2.98Å; K854-K858 WeakPolarHBondContact O-CE 3.19Å; L856-K858 PolarHBondContact O-N 2.95Å
859	Q	89.8	Confident	94	Very high	57 Å²	57	24.1 Å²	24.1	27%	0.266	12%	0.119	S	C	.	.	S	Bend	trans	-92.7	131.1	178	-64.2	-55.8	-21.6	0	0	111.1	I827 N831 L856 L861 W862 N863	I827-Q859 HydrophobicContact CD1-CB 4.02Å; I827-Q859 HydrophobicContact CD1-CG 3.57Å; I827-Q859 HydrophobicContact CG1-CG 3.88Å; N831-Q859 WeakPolarHBondContact OD1-CG 3.32Å; N831-Q859 PolarHBondContact OD1-OE1 2.86Å; L856-Q859 PolarHBondContact O-N 3.09Å; L856-Q859 VanDerWaalsContact O-N 3.11Å; Q859-L861 PolarHBondContact O-N 3.08Å; Q859-W862 HydrophobicContact CB-CB 4.43Å; Q859-W862 PolarHBondContact O-N 2.97Å; Q859-N863 WeakPolarHBondContact O-CB 3.43Å; Q859-N863 PolarHBondContact O-N 2.9Å
860	P	91.2	Very high	93.8	Very high	77 Å²	77	26.5 Å²	26.5	50%	0.5	13%	0.128	S	C	.	.	H	α-helix	trans	-55.4	-43.3	-171.7	-29.8	36.1	0	0	0	115	N863 Q864 Y897	P860-N863 PolarHBondContact O-N 2.72Å; P860-Q864 PolarHBondContact O-N 2.89Å; P860-Y897 HydrophobicContact CB-CD2 4.09Å
861	L	92.6	Very high	93.5	Very high	8 Å²	8	31 Å²	31	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-47.2	179.3	172.5	56.3	0	0	0	112.2	F689 V693 F694 P833 L836 Q859 Q864 L865 Y897	F689-L861 HydrophobicContact CE1-CD1 4.45Å; F689-L861 HydrophobicContact CZ-CD1 4.1Å; V693-L861 HydrophobicContact CG1-CD1 3.74Å; F694-L861 HydrophobicContact CE1-CD1 4.38Å; F694-L861 HydrophobicContact CE1-CD2 4.26Å; F694-L861 HydrophobicContact CZ-CD1 4.17Å; F694-L861 HydrophobicContact CZ-CD2 4.32Å; P833-L861 HydrophobicContact CB-CD2 3.7Å; L836-L861 HydrophobicContact CD2-CD1 4.14Å; L836-L861 HydrophobicContact CD2-CD2 3.82Å; L836-L861 HydrophobicContact CD2-CG 3.72Å; Q859-L861 PolarHBondContact O-N 3.08Å; L861-Q864 PolarHBondContact O-N 3.4Å; L861-L865 PolarHBondContact O-N 2.98Å; L861-Y897 HydrophobicContact CB-CD1 4.2Å; L861-Y897 HydrophobicContact CB-CD2 4.01Å; L861-Y897 HydrophobicContact CB-CE1 4.15Å; L861-Y897 HydrophobicContact CB-CE2 3.95Å; L861-Y897 HydrophobicContact CB-CG 4.13Å; L861-Y897 HydrophobicContact CD1-CD1 3.75Å; L861-Y897 HydrophobicContact CD1-CE1 3.81Å; L861-Y897 HydrophobicContact CD1-CG 4.38Å; L861-Y897 HydrophobicContact CD2-CE1 4.14Å; L861-Y897 HydrophobicContact CG-CD1 4.46Å; L861-Y897 HydrophobicContact CG-CE1 4.26Å
862	W	94.8	Very high	93.4	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-68	-35.8	177.3	-80.1	94.3	0	0	0	112.6	F725 L816 C818 I827 L830 L836 V849 L856 Q859 Q864 L865 L866	F725-W862 HydrophobicContact CE2-CZ3 4.45Å; L816-W862 HydrophobicContact CD2-CH2 4.43Å; C818-W862 VanDerWaalsContact SG-CH2 3.55Å; I827-W862 HydrophobicContact CD1-CG 4.11Å; L830-W862 HydrophobicContact CB-CZ2 4.13Å; L830-W862 HydrophobicContact CD2-CH2 3.92Å; L830-W862 HydrophobicContact CD2-CZ2 3.5Å; L830-W862 VanDerWaalsContact CD2-CZ2 3.5Å; L830-W862 HydrophobicContact CG-CZ2 4.36Å; L830-W862 PolarHBondContact O-NE1 2.88Å; L836-W862 HydrophobicContact CD1-CH2 3.68Å; L836-W862 HydrophobicContact CD1-CZ2 3.63Å; L836-W862 HydrophobicContact CD1-CZ3 4.37Å; L836-W862 HydrophobicContact CD2-CD2 4.47Å; L836-W862 HydrophobicContact CD2-CZ2 4.27Å; L836-W862 HydrophobicContact CG-CZ2 4.41Å; V849-W862 HydrophobicContact CG1-CZ3 4.37Å; L856-W862 HydrophobicContact CB-CB 4.14Å; L856-W862 HydrophobicContact CB-CE3 4.33Å; L856-W862 HydrophobicContact CB-CG 4.48Å; L856-W862 HydrophobicContact CD1-CE3 3.98Å; L856-W862 HydrophobicContact CD1-CZ3 4.14Å; L856-W862 HydrophobicContact CD2-CD2 3.92Å; L856-W862 HydrophobicContact CD2-CE3 3.96Å; L856-W862 HydrophobicContact CD2-CG 4.29Å; L856-W862 HydrophobicContact CD2-CZ3 4.38Å; L856-W862 HydrophobicContact CG-CE3 4.32Å; L856-W862 WeakPolarHBondContact O-CB 3.38Å; Q859-W862 HydrophobicContact CB-CB 4.43Å; Q859-W862 PolarHBondContact O-N 2.97Å; W862-Q864 VanDerWaalsContact C-N 3.3Å; W862-Q864 PolarHBondContact O-N 2.74Å; W862-L865 HydrophobicContact CE3-CD2 4.03Å; W862-L865 HydrophobicContact CZ3-CD2 3.93Å; W862-L865 PolarHBondContact O-N 2.86Å; W862-L866 WeakPolarHBondContact O-CB 3.49Å; W862-L866 VanDerWaalsContact O-CG 3.31Å; W862-L866 WeakPolarHBondContact O-CG 3.35Å; W862-L866 PolarHBondContact O-N 3.26Å
863	N	94	Very high	93.4	Very high	13 Å²	13	37.2 Å²	37.2	7%	0.07	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-40	172.2	-166	5.7	0	0	0	111.4	C857 Q859 P860 L866 H867 F890 P891	C857-N863 WeakPolarHBondContact O-CB 3.24Å; C857-N863 PolarHBondContact O-ND2 3.24Å; Q859-N863 WeakPolarHBondContact O-CB 3.43Å; Q859-N863 PolarHBondContact O-N 2.9Å; P860-N863 PolarHBondContact O-N 2.72Å; N863-L866 PolarHBondContact O-N 3.46Å; N863-H867 WeakPolarHBondContact O-CB 3.29Å; N863-H867 PolarHBondContact O-N 3.49Å; N863-H867 PolarHBondContact O-ND1 3.26Å; N863-H867 PolarHBondContact OD1-CE1 3.26Å; N863-H867 PolarHBondContact OD1-ND1 3.17Å; N863-F890 WeakPolarHBondContact OD1-CD2 3.48Å; N863-P891 PolarHBondContact ND2-O 3.39Å; N863-P891 PolarHBondContact OD1-O 3.22Å
864	Q	94	Very high	93.6	Very high	39 Å²	39	37.1 Å²	37.1	18%	0.182	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-36.1	173.8	-171.8	164.5	-60.2	0	0	112.7	F689 P860 L861 W862 H867 F868	F689-Q864 HydrophobicContact CE2-CG 4.32Å; P860-Q864 PolarHBondContact O-N 2.89Å; L861-Q864 PolarHBondContact O-N 3.4Å; W862-Q864 VanDerWaalsContact C-N 3.3Å; W862-Q864 PolarHBondContact O-N 2.74Å; Q864-H867 PolarHBondContact O-N 2.95Å; Q864-F868 WeakPolarHBondContact O-CB 3.43Å; Q864-F868 PolarHBondContact O-N 2.99Å
865	L	95.9	Very high	93.8	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-67.1	-44.6	173.6	-177.5	59.6	0	0	0	112.3	F689 L836 L840 L861 W862 H867 F868 Y869	F689-L865 HydrophobicContact CD1-CD1 3.89Å; F689-L865 HydrophobicContact CD2-CD1 3.83Å; F689-L865 HydrophobicContact CE1-CB 4.38Å; F689-L865 HydrophobicContact CE1-CD1 3.87Å; F689-L865 HydrophobicContact CE2-CB 3.9Å; F689-L865 HydrophobicContact CE2-CD1 3.81Å; F689-L865 HydrophobicContact CE2-CG 4.48Å; F689-L865 HydrophobicContact CG-CD1 3.87Å; F689-L865 HydrophobicContact CZ-CB 3.69Å; F689-L865 HydrophobicContact CZ-CD1 3.82Å; F689-L865 HydrophobicContact CZ-CG 4.29Å; L836-L865 HydrophobicContact CD1-CD2 4.09Å; L836-L865 HydrophobicContact CD2-CD2 4.23Å; L840-L865 HydrophobicContact CD1-CD1 4.44Å; L840-L865 HydrophobicContact CD1-CD2 4.38Å; L840-L865 HydrophobicContact CD2-CD2 4.33Å; L861-L865 PolarHBondContact O-N 2.98Å; W862-L865 HydrophobicContact CE3-CD2 4.03Å; W862-L865 HydrophobicContact CZ3-CD2 3.93Å; W862-L865 PolarHBondContact O-N 2.86Å; L865-H867 VanDerWaalsContact C-N 3.28Å; L865-H867 PolarHBondContact O-N 3.04Å; L865-F868 HydrophobicContact CD1-CD1 4.46Å; L865-F868 WeakPolarHBondContact O-CB 3.44Å; L865-F868 PolarHBondContact O-N 3.2Å; L865-Y869 HydrophobicContact CD1-CD2 3.94Å; L865-Y869 HydrophobicContact CD1-CE2 3.54Å; L865-Y869 HydrophobicContact CD2-CE2 4.35Å; L865-Y869 HydrophobicContact CG-CD2 4.01Å; L865-Y869 HydrophobicContact CG-CE2 3.8Å; L865-Y869 VanDerWaalsContact O-CD2 3.31Å; L865-Y869 WeakPolarHBondContact O-CD2 3.47Å; L865-Y869 PolarHBondContact O-N 3.39Å
866	L	96.1	Very high	94.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-37.8	174.6	-71.3	168.8	0	0	0	111.7	F725 P853 L856 C857 W862 N863 R870 L875 F890	F725-L866 HydrophobicContact CD1-CD2 4.12Å; F725-L866 HydrophobicContact CD2-CD2 3.87Å; F725-L866 HydrophobicContact CE1-CD2 4.04Å; F725-L866 HydrophobicContact CE2-CD2 3.78Å; F725-L866 HydrophobicContact CG-CD2 4.07Å; F725-L866 HydrophobicContact CZ-CD2 3.89Å; P853-L866 HydrophobicContact CB-CD1 4.14Å; P853-L866 HydrophobicContact CB-CD2 4.08Å; P853-L866 HydrophobicContact CG-CD2 4.3Å; L856-L866 HydrophobicContact CB-CD1 4.02Å; C857-L866 HydrophobicContact CB-CD1 3.79Å; W862-L866 WeakPolarHBondContact O-CB 3.49Å; W862-L866 VanDerWaalsContact O-CG 3.31Å; W862-L866 WeakPolarHBondContact O-CG 3.35Å; W862-L866 PolarHBondContact O-N 3.26Å; N863-L866 PolarHBondContact O-N 3.46Å; L866-R870 VanDerWaalsContact O-CB 3.31Å; L866-R870 WeakPolarHBondContact O-CB 3.34Å; L866-R870 PolarHBondContact O-N 2.77Å; L866-L875 HydrophobicContact CD2-CD1 3.78Å; L866-F890 HydrophobicContact CB-CE2 3.67Å; L866-F890 HydrophobicContact CB-CZ 3.82Å; L866-F890 HydrophobicContact CD1-CE2 4.37Å
867	H	94.6	Very high	94.2	Very high	13 Å²	13	35.4 Å²	35.4	6%	0.06	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-46.3	171.7	-84.6	71.9	0	0	0	112	N863 Q864 L865 Y869 R870 D871 F890 P891	N863-H867 WeakPolarHBondContact O-CB 3.29Å; N863-H867 PolarHBondContact O-N 3.49Å; N863-H867 PolarHBondContact O-ND1 3.26Å; N863-H867 PolarHBondContact OD1-CE1 3.26Å; N863-H867 PolarHBondContact OD1-ND1 3.17Å; Q864-H867 PolarHBondContact O-N 2.95Å; L865-H867 VanDerWaalsContact C-N 3.28Å; L865-H867 PolarHBondContact O-N 3.04Å; H867-Y869 VanDerWaalsContact C-N 3.29Å; H867-Y869 PolarHBondContact O-N 3.22Å; H867-R870 PolarHBondContact CD2-NH2 2.78Å; H867-R870 PolarHBondContact CE1-NH1 3.44Å; H867-R870 PolarHBondContact NE2-NH1 3.41Å; H867-R870 PolarHBondContact NE2-NH2 3.03Å; H867-R870 PolarHBondContact O-N 2.75Å; H867-D871 VanDerWaalsContact O-CB 3.3Å; H867-D871 WeakPolarHBondContact O-CB 3.33Å; H867-D871 PolarHBondContact O-N 3.07Å; H867-F890 AromaticContact CE1-CD2 3.62Å; H867-F890 AromaticContact CE1-CE2 3.46Å; H867-F890 VanDerWaalsContact CE1-CE2 3.46Å; H867-F890 WeakPolarHBondContact CE1-CE2 3.46Å; H867-F890 AromaticContact ND1-CE2 3.52Å; H867-P891 PolarHBondContact CE1-O 2.88Å
868	F	95.3	Very high	94.3	Very high	39 Å²	39	36.4 Å²	36.4	17%	0.171	19%	0.187	C	C	.	.	H	α-helix	trans	-56.8	-40.5	176.4	172.5	-89.2	0	0	0	112.6	A688 F689 M723 Q864 L865 Q872	A688-F868 HydrophobicContact CB-CE2 4.35Å; A688-F868 HydrophobicContact CB-CZ 4.27Å; F689-F868 HydrophobicContact CB-CD1 4.05Å; F689-F868 HydrophobicContact CB-CD2 4.1Å; F689-F868 HydrophobicContact CB-CE1 3.83Å; F689-F868 HydrophobicContact CB-CE2 3.87Å; F689-F868 HydrophobicContact CB-CG 4.18Å; F689-F868 HydrophobicContact CB-CZ 3.74Å; F689-F868 HydrophobicContact CD2-CB 3.75Å; F689-F868 HydrophobicContact CD2-CD1 4.1Å; F689-F868 AromaticContact CD2-CD2 3.94Å; F689-F868 HydrophobicContact CD2-CD2 3.94Å; F689-F868 AromaticContact CD2-CG 3.67Å; F689-F868 HydrophobicContact CD2-CG 3.67Å; F689-F868 HydrophobicContact CE2-CB 4.19Å; F689-F868 HydrophobicContact CG-CD1 4.42Å; F689-F868 HydrophobicContact CG-CG 4.36Å; M723-F868 HydrophobicContact CE-CE1 3.65Å; M723-F868 HydrophobicContact CE-CZ 3.95Å; M723-F868 HydrophobicContact SD-CE1 4.27Å; Q864-F868 WeakPolarHBondContact O-CB 3.43Å; Q864-F868 PolarHBondContact O-N 2.99Å; L865-F868 HydrophobicContact CD1-CD1 4.46Å; L865-F868 WeakPolarHBondContact O-CB 3.44Å; L865-F868 PolarHBondContact O-N 3.2Å; F868-Q872 VanDerWaalsContact CD2-NE2 3.26Å; F868-Q872 VanDerWaalsContact O-CD 3.27Å; F868-Q872 VanDerWaalsContact O-CG 3.28Å; F868-Q872 WeakPolarHBondContact O-CG 3.39Å; F868-Q872 PolarHBondContact O-NE2 3.22Å
869	Y	96.9	Very high	94.4	Very high	3 Å²	3	36 Å²	36	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-71.1	-47.1	173.5	-77.6	-66.6	0	0	0	112.6	M723 F725 V849 L865 H867 Q872 H873 L874	M723-Y869 HydrophobicContact CB-CE1 4.17Å; M723-Y869 HydrophobicContact CG-CE1 4Å; M723-Y869 HydrophobicContact SD-CE1 3.83Å; F725-Y869 HydrophobicContact CB-CD1 4.4Å; F725-Y869 HydrophobicContact CB-CD2 3.75Å; F725-Y869 HydrophobicContact CB-CE2 4.17Å; F725-Y869 HydrophobicContact CB-CG 3.88Å; F725-Y869 HydrophobicContact CD2-CD2 4.31Å; F725-Y869 HydrophobicContact CD2-CE2 4.42Å; F725-Y869 HydrophobicContact CG-CD2 4.5Å; V849-Y869 HydrophobicContact CG2-CE2 4.32Å; L865-Y869 HydrophobicContact CD1-CD2 3.94Å; L865-Y869 HydrophobicContact CD1-CE2 3.54Å; L865-Y869 HydrophobicContact CD2-CE2 4.35Å; L865-Y869 HydrophobicContact CG-CD2 4.01Å; L865-Y869 HydrophobicContact CG-CE2 3.8Å; L865-Y869 VanDerWaalsContact O-CD2 3.31Å; L865-Y869 WeakPolarHBondContact O-CD2 3.47Å; L865-Y869 PolarHBondContact O-N 3.39Å; H867-Y869 VanDerWaalsContact C-N 3.29Å; H867-Y869 PolarHBondContact O-N 3.22Å; Y869-Q872 PolarHBondContact O-N 3Å; Y869-H873 PolarHBondContact O-N 3.23Å; Y869-L874 HydrophobicContact CD1-CB 3.78Å; Y869-L874 HydrophobicContact CD1-CD1 4.46Å; Y869-L874 WeakPolarHBondContact O-CA 3.4Å; Y869-L874 WeakPolarHBondContact O-CB 3.44Å; Y869-L874 PolarHBondContact O-N 3Å
870	R	94.1	Very high	94.4	Very high	50 Å²	50	33.9 Å²	33.9	19%	0.189	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-44.4	-177.1	-167.9	-165.5	65.4	-142	-7.1	112.4	L866 H867 Q872 H873 L875	L866-R870 VanDerWaalsContact O-CB 3.31Å; L866-R870 WeakPolarHBondContact O-CB 3.34Å; L866-R870 PolarHBondContact O-N 2.77Å; H867-R870 PolarHBondContact CD2-NH2 2.78Å; H867-R870 PolarHBondContact CE1-NH1 3.44Å; H867-R870 PolarHBondContact NE2-NH1 3.41Å; H867-R870 PolarHBondContact NE2-NH2 3.03Å; H867-R870 PolarHBondContact O-N 2.75Å; R870-Q872 PolarHBondContact O-N 3.11Å; R870-H873 PolarHBondContact O-N 3.25Å; R870-L875 HydrophobicContact CB-CB 3.97Å; R870-L875 HydrophobicContact CB-CD2 3.81Å; R870-L875 HydrophobicContact CG-CB 4.41Å; R870-L875 HydrophobicContact CG-CD2 4.07Å
871	D	93.2	Very high	94.3	Very high	94 Å²	94	36.8 Å²	36.8	50%	0.503	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	6.5	-178.2	-56.4	-15.9	0	0	0	112	H867	H867-D871 VanDerWaalsContact O-CB 3.3Å; H867-D871 WeakPolarHBondContact O-CB 3.33Å; H867-D871 PolarHBondContact O-N 3.07Å
872	Q	93.8	Very high	94.3	Very high	30 Å²	30	42.5 Å²	42.5	14%	0.14	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	5.7	171.3	-65.4	176.9	50.7	0	0	113.4	F868 Y869 R870 L874	F868-Q872 VanDerWaalsContact CD2-NE2 3.26Å; F868-Q872 VanDerWaalsContact O-CD 3.27Å; F868-Q872 VanDerWaalsContact O-CG 3.28Å; F868-Q872 WeakPolarHBondContact O-CG 3.39Å; F868-Q872 PolarHBondContact O-NE2 3.22Å; Y869-Q872 PolarHBondContact O-N 3Å; R870-Q872 PolarHBondContact O-N 3.11Å; Q872-L874 VanDerWaalsContact C-N 3.29Å; Q872-L874 HydrophobicContact CB-CD1 3.95Å; Q872-L874 HydrophobicContact CB-CG 3.98Å; Q872-L874 PolarHBondContact O-N 3.45Å
873	H	94.9	Very high	94.2	Very high	115 Å²	115	44.2 Å²	44.2	53%	0.532	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	30.1	-173	-50.8	-80.1	0	0	0	114	Y869 R870 E885	Y869-H873 PolarHBondContact O-N 3.23Å; R870-H873 PolarHBondContact O-N 3.25Å; H873-E885 HydrophobicContact CB-CG 4.47Å; H873-E885 IonicContact CE1-OE2 3.82Å; H873-E885 IonicContact CG-OE1 3.71Å; H873-E885 IonicContact CG-OE2 3.61Å; H873-E885 IonicContact ND1-OE1 3Å; H873-E885 PolarHBondContact ND1-OE1 3.38Å; H873-E885 IonicContact ND1-OE2 2.79Å; H873-E885 PolarHBondContact ND1-OE2 2.8Å
874	L	97	Very high	94.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.25	C	S	.	.			trans	-113.4	13.2	-177.2	-60.7	178.7	0	0	0	113.6	P717 N718 R721 M723 F724 F725 Y869 Q872	P717-L874 HydrophobicContact CB-CD2 4.19Å; N718-L874 HydrophobicContact CB-CD2 3.76Å; R721-L874 HydrophobicContact CB-CD1 3.93Å; M723-L874 HydrophobicContact CE-CD1 4.28Å; M723-L874 HydrophobicContact CG-CD1 4.31Å; M723-L874 WeakPolarHBondContact O-CD2 3.29Å; F724-L874 WeakPolarHBondContact CA-O 3.5Å; F724-L874 HydrophobicContact CB-CB 4.4Å; F724-L874 WeakPolarHBondContact CB-O 3.45Å; F725-L874 PolarHBondContact N-O 2.86Å; Y869-L874 HydrophobicContact CD1-CB 3.78Å; Y869-L874 HydrophobicContact CD1-CD1 4.46Å; Y869-L874 WeakPolarHBondContact O-CA 3.4Å; Y869-L874 WeakPolarHBondContact O-CB 3.44Å; Y869-L874 PolarHBondContact O-N 3Å; Q872-L874 VanDerWaalsContact C-N 3.29Å; Q872-L874 HydrophobicContact CB-CD1 3.95Å; Q872-L874 HydrophobicContact CB-CG 3.98Å; Q872-L874 PolarHBondContact O-N 3.45Å
875	L	96.8	Very high	94.2	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	105	172	-176.4	68.4	0	0	0	108.2	F725 C727 P853 L866 R870 Y886 F890	F725-L875 HydrophobicContact CB-CD1 3.67Å; F725-L875 HydrophobicContact CD1-CD1 3.42Å; F725-L875 VanDerWaalsContact CD1-CD1 3.42Å; F725-L875 HydrophobicContact CE1-CD1 4.31Å; F725-L875 HydrophobicContact CG-CD1 3.67Å; C727-L875 WeakPolarHBondContact SG-CD1 3.29Å; P853-L875 HydrophobicContact CG-CD1 4.48Å; L866-L875 HydrophobicContact CD2-CD1 3.78Å; R870-L875 HydrophobicContact CB-CB 3.97Å; R870-L875 HydrophobicContact CB-CD2 3.81Å; R870-L875 HydrophobicContact CG-CB 4.41Å; R870-L875 HydrophobicContact CG-CD2 4.07Å; L875-Y886 HydrophobicContact CD2-CD1 3.89Å; L875-Y886 HydrophobicContact CG-CD1 4.28Å; L875-Y886 HydrophobicContact CG-CG 4.48Å; L875-Y886 PolarHBondContact O-N 3.35Å; L875-F890 HydrophobicContact CD2-CE1 3.73Å; L875-F890 HydrophobicContact CD2-CZ 3.66Å
876	V	96.8	Very high	94	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.9	-161.6	-64.9	0	0	0	0	113.9	P717 F724 F725 Y726 C727 L883 G884	P717-V876 HydrophobicContact CB-CG1 4.25Å; P717-V876 HydrophobicContact CG-CG1 4.11Å; P717-V876 HydrophobicContact CG-CG2 4.15Å; F724-V876 HydrophobicContact CB-CG2 4.19Å; F724-V876 HydrophobicContact CD2-CG2 3.45Å; F724-V876 VanDerWaalsContact CD2-CG2 3.45Å; F724-V876 HydrophobicContact CE2-CG2 4.16Å; F724-V876 HydrophobicContact CG-CG2 4.15Å; F725-V876 PolarHBondContact O-N 3.47Å; Y726-V876 WeakPolarHBondContact CA-O 3.29Å; C727-V876 WeakPolarHBondContact CB-O 3.28Å; C727-V876 PolarHBondContact N-O 3.46Å; V876-L883 HydrophobicContact CB-CB 4.33Å; V876-L883 HydrophobicContact CG2-CB 4.48Å; V876-L883 HydrophobicContact CG2-CD1 4.22Å; V876-L883 HydrophobicContact CG2-CD2 4.34Å; V876-G884 CarbonylContact C-O 3.58Å; V876-G884 WeakPolarHBondContact CA-O 3.45Å; V876-G884 WeakPolarHBondContact CB-O 3.48Å
877	E	95.1	Very high	93.5	Very high	78 Å²	78	56.2 Å²	56.2	36%	0.364	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	-179.4	175.3	71.6	-174.1	140.7	0	0	112.2	C727 L883 G884 Y886	C727-E877 HydrophobicContact CB-CB 4.11Å; E877-L883 WeakPolarHBondContact O-CA 3.41Å; E877-G884 PolarHBondContact N-O 3.27Å; E877-G884 PolarHBondContact O-N 3.12Å; E877-Y886 HydrophobicContact CB-CD2 4.33Å; E877-Y886 HydrophobicContact CG-CD2 4.34Å
878	G	93.1	Very high	93	Very high	41 Å²	41	60 Å²	60	42%	0.423	32%	0.322	S	S	.	.	S	Bend	trans	92.5	-166.5	-178.9	0	0	0	0	0	114.2	Y726	Y726-G878 WeakPolarHBondContact CE1-O 3.46Å; Y726-G878 PolarHBondContact OH-O 2.83Å
879	P	92.2	Very high	92.3	Very high	87 Å²	87	67.1 Å²	67.1	57%	0.565	36%	0.356	S	S	*	.			trans	-74.7	145.3	178.2	-15.3	31.1	0	0	0	112.4	N881 N882 L883	P879-N881 PolarHBondContact O-N 2.83Å; P879-N882 CarbonylContact O-C 3.57Å; P879-N882 WeakPolarHBondContact O-CA 3.5Å; P879-N882 PolarHBondContact O-N 2.93Å; P879-L883 PolarHBondContact O-N 2.8Å
880	L	90.2	Very high	91.7	Very high	14 Å²	14	68 Å²	68	7%	0.073	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.7	-177.2	-177.2	59.1	0	0	0	115.4	F714 P715 F724 Y726 I753 K756 L883	F714-L880 HydrophobicContact CE1-CD1 4.38Å; F714-L880 HydrophobicContact CZ-CD1 3.94Å; F714-L880 HydrophobicContact CZ-CD2 4.43Å; P715-L880 HydrophobicContact CG-CD1 4.1Å; P715-L880 HydrophobicContact CG-CG 4.14Å; P715-L880 VanDerWaalsContact CG-O 3.29Å; P715-L880 WeakPolarHBondContact CG-O 3.45Å; F724-L880 HydrophobicContact CZ-CD1 4.34Å; Y726-L880 HydrophobicContact CE2-CD1 4.35Å; Y726-L880 PolarHBondContact OH-N 3.45Å; I753-L880 HydrophobicContact CG1-CD2 4.26Å; K756-L880 HydrophobicContact CB-CD2 3.73Å; K756-L880 HydrophobicContact CG-CD2 4.02Å; L880-L883 HydrophobicContact CD1-CD1 4.21Å
881	N	88.5	Confident	91.2	Very high	138 Å²	138	70.3 Å²	70.3	74%	0.738	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-5.3	176.3	-66.8	-10.4	0	0	0	113.7	P879	P879-N881 PolarHBondContact O-N 2.83Å
882	N	92	Very high	90.7	Very high	128 Å²	128	75 Å²	75	68%	0.684	39%	0.392	S	S	*	.	S	Bend	trans	-153.7	62.6	-177.5	-172.4	86.5	0	0	0	109.1	P879	P879-N882 CarbonylContact O-C 3.57Å; P879-N882 WeakPolarHBondContact O-CA 3.5Å; P879-N882 PolarHBondContact O-N 2.93Å
883	L	93.7	Very high	89.8	Confident	39 Å²	39	75.7 Å²	75.7	20%	0.204	40%	0.399	C	S	.	.			trans	-72.6	137.8	177.3	-67.3	171.4	0	0	0	110.1	P717 F724 Y726 V876 E877 P879 L880	P717-L883 HydrophobicContact CG-CD1 4.01Å; F724-L883 HydrophobicContact CE2-CD1 3.97Å; F724-L883 HydrophobicContact CZ-CD1 4.16Å; Y726-L883 HydrophobicContact CE1-CD2 4.16Å; Y726-L883 HydrophobicContact CE2-CD2 4.19Å; V876-L883 HydrophobicContact CB-CB 4.33Å; V876-L883 HydrophobicContact CG2-CB 4.48Å; V876-L883 HydrophobicContact CG2-CD1 4.22Å; V876-L883 HydrophobicContact CG2-CD2 4.34Å; E877-L883 WeakPolarHBondContact O-CA 3.41Å; P879-L883 PolarHBondContact O-N 2.8Å; L880-L883 HydrophobicContact CD1-CD1 4.21Å
884	G	93.3	Very high	89	Confident	36 Å²	36	80.3 Å²	80.3	37%	0.371	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	158.1	173.3	0	0	0	0	0	111.5	V876 E877	V876-G884 CarbonylContact C-O 3.58Å; V876-G884 WeakPolarHBondContact CA-O 3.45Å; V876-G884 WeakPolarHBondContact CB-O 3.48Å; E877-G884 PolarHBondContact N-O 3.27Å; E877-G884 PolarHBondContact O-N 3.12Å
885	E	94.1	Very high	87.9	Confident	91 Å²	91	85.6 Å²	85.6	43%	0.425	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	138.8	176.9	-69.3	-173.4	-118	0	0	112.3	H873 M887	H873-E885 HydrophobicContact CB-CG 4.47Å; H873-E885 IonicContact CE1-OE2 3.82Å; H873-E885 IonicContact CG-OE1 3.71Å; H873-E885 IonicContact CG-OE2 3.61Å; H873-E885 IonicContact ND1-OE1 3Å; H873-E885 PolarHBondContact ND1-OE1 3.38Å; H873-E885 IonicContact ND1-OE2 2.79Å; H873-E885 PolarHBondContact ND1-OE2 2.8Å; E885-M887 PolarHBondContact O-N 3.02Å
886	Y	92.4	Very high	86.8	Confident	21 Å²	21	90.1 Å²	90.1	8%	0.082	48%	0.479	C	S	.	.			trans	-77.5	104.4	-179.7	179.3	-100.7	0	0	0	111	C727 P853 L875 E877 L888 F890	C727-Y886 HydrophobicContact CB-CD2 3.59Å; C727-Y886 HydrophobicContact CB-CE2 3.93Å; C727-Y886 HydrophobicContact CB-CG 4.14Å; P853-Y886 HydrophobicContact CB-CE1 3.9Å; P853-Y886 HydrophobicContact CG-CD1 4.36Å; P853-Y886 HydrophobicContact CG-CE1 3.87Å; P853-Y886 HydrophobicContact CG-CE2 4.41Å; L875-Y886 HydrophobicContact CD2-CD1 3.89Å; L875-Y886 HydrophobicContact CG-CD1 4.28Å; L875-Y886 HydrophobicContact CG-CG 4.48Å; L875-Y886 PolarHBondContact O-N 3.35Å; E877-Y886 HydrophobicContact CB-CD2 4.33Å; E877-Y886 HydrophobicContact CG-CD2 4.34Å; Y886-L888 VanDerWaalsContact C-N 3.35Å; Y886-L888 HydrophobicContact CD1-CB 4.27Å; Y886-L888 HydrophobicContact CE1-CB 3.61Å; Y886-L888 HydrophobicContact CE2-CB 4.28Å; Y886-L888 HydrophobicContact CE2-CD1 4.04Å; Y886-L888 PolarHBondContact O-N 3.07Å; Y886-F890 HydrophobicContact CD1-CE1 4.41Å; Y886-F890 HydrophobicContact CE1-CD1 4.49Å; Y886-F890 HydrophobicContact CE1-CE1 4.27Å
887	M	86.4	Confident	86	Confident	159 Å²	159	92.9 Å²	92.9	78%	0.783	49%	0.49	S	S	*	.			trans	-78.5	-11.7	-168.2	-63	-63.4	-74.1	0	0	115.1	E885 Q889	E885-M887 PolarHBondContact O-N 3.02Å; M887-Q889 PolarHBondContact O-N 2.92Å
888	L	82.8	Confident	85.1	Confident	92 Å²	92	94 Å²	94	48%	0.482	50%	0.502	S	S	.	.			trans	-73.4	117.6	-175.7	-84.2	165.3	0	0	0	111.6	Y886 F890	Y886-L888 VanDerWaalsContact C-N 3.35Å; Y886-L888 HydrophobicContact CD1-CB 4.27Å; Y886-L888 HydrophobicContact CE1-CB 3.61Å; Y886-L888 HydrophobicContact CE2-CB 4.28Å; Y886-L888 HydrophobicContact CE2-CD1 4.04Å; Y886-L888 PolarHBondContact O-N 3.07Å; L888-F890 VanDerWaalsContact O-CD1 3.29Å; L888-F890 WeakPolarHBondContact O-CD1 3.28Å
889	Q	81.6	Confident	84.5	Confident	189 Å²	189	93.1 Å²	93.1	88%	0.883	49%	0.486	S	S	*	.			trans	-74.5	145.1	179.3	-61.2	-172.9	12.1	0	0	112.4	M887	M887-Q889 PolarHBondContact O-N 2.92Å
890	F	83.7	Confident	83.3	Confident	22 Å²	22	93.6 Å²	93.6	10%	0.096	48%	0.48	C	S	.	.			trans	-139.5	154.7	173.6	44.9	-85.9	0	0	0	109.4	C857 N863 L866 H867 L875 Y886 L888 R892	C857-F890 HydrophobicContact CB-CB 4.04Å; C857-F890 HydrophobicContact CB-CD2 3.82Å; C857-F890 HydrophobicContact CB-CG 4.06Å; N863-F890 WeakPolarHBondContact OD1-CD2 3.48Å; L866-F890 HydrophobicContact CB-CE2 3.67Å; L866-F890 HydrophobicContact CB-CZ 3.82Å; L866-F890 HydrophobicContact CD1-CE2 4.37Å; H867-F890 AromaticContact CE1-CD2 3.62Å; H867-F890 AromaticContact CE1-CE2 3.46Å; H867-F890 VanDerWaalsContact CE1-CE2 3.46Å; H867-F890 WeakPolarHBondContact CE1-CE2 3.46Å; H867-F890 AromaticContact ND1-CE2 3.52Å; L875-F890 HydrophobicContact CD2-CE1 3.73Å; L875-F890 HydrophobicContact CD2-CZ 3.66Å; Y886-F890 HydrophobicContact CD1-CE1 4.41Å; Y886-F890 HydrophobicContact CE1-CD1 4.49Å; Y886-F890 HydrophobicContact CE1-CE1 4.27Å; L888-F890 VanDerWaalsContact O-CD1 3.29Å; L888-F890 WeakPolarHBondContact O-CD1 3.28Å; F890-R892 PolarHBondContact O-N 2.97Å
891	P	83.9	Confident	81.8	Confident	97 Å²	97	94.2 Å²	94.2	63%	0.63	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-59.5	134.4	-168.3	-25.5	35.1	0	0	0	113.3	N863 H867	N863-P891 PolarHBondContact ND2-O 3.39Å; N863-P891 PolarHBondContact OD1-O 3.22Å; H867-P891 PolarHBondContact CE1-O 2.88Å
892	R	82.4	Confident	80.1	Confident	193 Å²	193	88.1 Å²	88.1	73%	0.728	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-63.2	142.7	172.2	-70	-173.9	172.6	-164	-4.3	110.8	F890 K894	F890-R892 PolarHBondContact O-N 2.97Å; R892-K894 PolarHBondContact O-N 3.19Å; R892-K894 VanDerWaalsContact O-N 3.16Å
893	P	75.9	Confident	78	Confident	44 Å²	44	83.3 Å²	83.3	29%	0.286	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-54.8	119.9	171.4	-25.6	34.4	0	0	0	110.8	V895	P893-V895 VanDerWaalsContact C-N 3.26Å; P893-V895 PolarHBondContact O-N 3.46Å
894	K	76.6	Confident	75.7	Confident	212 Å²	212	86.6 Å²	86.6	92%	0.922	45%	0.45	S	S	*	.	S	Bend	trans	-69.6	-26.8	179.2	-67.6	-177.8	178.6	178.5	0	112.6	R892	R892-K894 PolarHBondContact O-N 3.19Å; R892-K894 VanDerWaalsContact O-N 3.16Å
895	V	74.4	Confident	73.5	Confident	111 Å²	111	85.6 Å²	85.6	67%	0.673	43%	0.434	S	S	*	.	S	Bend	trans	-137.9	138.3	176.9	-175	0	0	0	0	106.5	P893 Y897	P893-V895 VanDerWaalsContact C-N 3.26Å; P893-V895 PolarHBondContact O-N 3.46Å; V895-Y897 PolarHBondContact O-N 2.79Å
896	P	73	Confident	71.1	Confident	97 Å²	97	85.8 Å²	85.8	63%	0.63	44%	0.438	S	S	*	.			trans	-58.3	133.7	171.5	-23.3	34.2	0	0	0	111.1	T898	P896-T898 PolarHBondContact O-N 2.95Å; P896-T898 VanDerWaalsContact O-N 3.12Å
897	Y	80.8	Confident	68.5	Low	62 Å²	62	87 Å²	87	24%	0.243	45%	0.452	C	S	.	.			trans	-67.3	112.4	173.5	-179.7	-90.9	0	0	0	109.4	V693 P860 L861 V895 F899	V693-Y897 HydrophobicContact CG1-CD1 3.94Å; V693-Y897 HydrophobicContact CG1-CE1 4.28Å; P860-Y897 HydrophobicContact CB-CD2 4.09Å; L861-Y897 HydrophobicContact CB-CD1 4.2Å; L861-Y897 HydrophobicContact CB-CD2 4.01Å; L861-Y897 HydrophobicContact CB-CE1 4.15Å; L861-Y897 HydrophobicContact CB-CE2 3.95Å; L861-Y897 HydrophobicContact CB-CG 4.13Å; L861-Y897 HydrophobicContact CD1-CD1 3.75Å; L861-Y897 HydrophobicContact CD1-CE1 3.81Å; L861-Y897 HydrophobicContact CD1-CG 4.38Å; L861-Y897 HydrophobicContact CD2-CE1 4.14Å; L861-Y897 HydrophobicContact CG-CD1 4.46Å; L861-Y897 HydrophobicContact CG-CE1 4.26Å; V895-Y897 PolarHBondContact O-N 2.79Å; Y897-F899 HydrophobicContact CE1-CB 3.96Å; Y897-F899 HydrophobicContact CE1-CD2 4.43Å
898	T	76.3	Confident	66.2	Low	101 Å²	101	81.2 Å²	81.2	62%	0.62	42%	0.423	S	S	*	.			trans	-96.5	112.4	171.3	-56.3	0	0	0	0	107.9	P896 K900	P896-T898 PolarHBondContact O-N 2.95Å; P896-T898 VanDerWaalsContact O-N 3.12Å; T898-K900 HydrophobicContact CG2-CG 4.44Å; T898-K900 PolarHBondContact O-N 2.86Å
899	F	79.7	Confident	63.9	Low	22 Å²	22	79.7 Å²	79.7	10%	0.096	42%	0.415	C	S	.	.			trans	-65.4	124.5	170.4	-179.3	-121.5	0	0	0	109.4	C642 V693 F694 P833 Y897 P901	C642-F899 HydrophobicContact CB-CE1 3.9Å; V693-F899 WeakPolarHBondContact O-CB 3.37Å; F694-F899 HydrophobicContact CB-CD1 4.31Å; F694-F899 HydrophobicContact CD1-CB 4.16Å; F694-F899 AromaticContact CD1-CD1 3.99Å; F694-F899 HydrophobicContact CD1-CD1 3.99Å; F694-F899 HydrophobicContact CD1-CD2 4.17Å; F694-F899 HydrophobicContact CD1-CE1 4.44Å; F694-F899 AromaticContact CD1-CG 3.84Å; F694-F899 HydrophobicContact CD1-CG 3.84Å; P833-F899 HydrophobicContact CB-CD2 3.75Å; P833-F899 HydrophobicContact CB-CE2 3.61Å; P833-F899 HydrophobicContact CG-CD2 3.96Å; P833-F899 HydrophobicContact CG-CE2 3.5Å; Y897-F899 HydrophobicContact CE1-CB 3.96Å; Y897-F899 HydrophobicContact CE1-CD2 4.43Å; F899-P901 HydrophobicContact CD1-CG 4.01Å; F899-P901 HydrophobicContact CE1-CB 4.28Å; F899-P901 HydrophobicContact CE1-CG 3.7Å; F899-P901 HydrophobicContact CZ-CG 4.44Å
900	K	67.8	Low	61.7	Low	97 Å²	97	74.7 Å²	74.7	42%	0.422	40%	0.401	S	S	.	.			trans	-112	100.2	173.3	-68.9	-166.5	171.6	-163.7	0	108.9	T898 G902 G903 F969	T898-K900 HydrophobicContact CG2-CG 4.44Å; T898-K900 PolarHBondContact O-N 2.86Å; K900-G902 PolarHBondContact O-N 3.06Å; K900-G903 PolarHBondContact O-N 2.95Å; K900-F969 PolarHBondContact NZ-O 3.33Å
901	P	59.1	Low	59.3	Low	27 Å²	27	74.9 Å²	74.9	18%	0.175	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	132.1	171.2	-20.7	29.9	0	0	0	109.9	F899 G903	F899-P901 HydrophobicContact CD1-CG 4.01Å; F899-P901 HydrophobicContact CE1-CB 4.28Å; F899-P901 HydrophobicContact CE1-CG 3.7Å; F899-P901 HydrophobicContact CZ-CG 4.44Å; P901-G903 PolarHBondContact O-N 2.96Å
902	G	52.7	Low	56.8	Low	10 Å²	10	73.1 Å²	73.1	10%	0.103	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	71	6.5	-175.7	0	0	0	0	0	115.9	K900 H904 Y905 L906	K900-G902 PolarHBondContact O-N 3.06Å; G902-H904 PolarHBondContact O-N 3Å; G902-Y905 PolarHBondContact O-N 2.84Å; G902-L906 PolarHBondContact O-N 3.41Å
903	G	48.5	Very low	54.3	Low	28 Å²	28	66.1 Å²	66.1	29%	0.289	37%	0.372	S	S	.	.	H	α-helix	trans	-58.2	-29.1	175.1	0	0	0	0	0	113.8	K900 P901 A907	K900-G903 PolarHBondContact O-N 2.95Å; P901-G903 PolarHBondContact O-N 2.96Å; G903-A907 PolarHBondContact O-N 2.89Å
904	H	44.5	Very low	52.4	Low	108 Å²	108	68.3 Å²	68.3	50%	0.5	38%	0.384	S	S	.	.	H	α-helix	trans	-61.5	-40.3	170.1	-92	-99.3	0	0	0	112.8	G902 A907 Q908	G902-H904 PolarHBondContact O-N 3Å; H904-A907 WeakPolarHBondContact O-CB 3.34Å; H904-A907 PolarHBondContact O-N 2.82Å; H904-Q908 WeakPolarHBondContact O-CG 3.49Å; H904-Q908 PolarHBondContact O-N 3.26Å
905	Y	47.4	Very low	50.5	Low	14 Å²	14	61.9 Å²	61.9	6%	0.055	36%	0.359	C	S	.	.	H	α-helix	trans	-71.6	-37.9	178.5	-59.6	-60	0	0	0	112.2	T659 Q660 E664 L668 G902 A907 Q908 L909	T659-Y905 VanDerWaalsContact C-OH 3.29Å; T659-Y905 PolarHBondContact O-OH 2.85Å; T659-Y905 VanDerWaalsContact O-OH 3.13Å; T659-Y905 PolarHBondContact OG1-OH 3.29Å; Q660-Y905 VanDerWaalsContact CA-OH 3.26Å; Q660-Y905 WeakPolarHBondContact CA-OH 3.41Å; Q660-Y905 HydrophobicContact CB-CE1 4.04Å; Q660-Y905 HydrophobicContact CB-CE2 4.27Å; Q660-Y905 HydrophobicContact CG-CD2 4.48Å; Q660-Y905 HydrophobicContact CG-CE1 4.49Å; Q660-Y905 HydrophobicContact CG-CE2 3.95Å; Q660-Y905 PolarHBondContact N-OH 3.41Å; Q660-Y905 VanDerWaalsContact NE2-CD2 3.35Å; Q660-Y905 VanDerWaalsContact NE2-CG 3.3Å; E664-Y905 VanDerWaalsContact OE2-CE2 3.28Å; E664-Y905 WeakPolarHBondContact OE2-CE2 3.47Å; E664-Y905 PolarHBondContact OE2-OH 2.81Å; E664-Y905 VanDerWaalsContact OE2-OH 3.05Å; L668-Y905 HydrophobicContact CD1-CD2 4.1Å; G902-Y905 PolarHBondContact O-N 2.84Å; Y905-A907 VanDerWaalsContact C-N 3.28Å; Y905-A907 PolarHBondContact O-N 3.04Å; Y905-Q908 VanDerWaalsContact CD1-OE1 3.3Å; Y905-Q908 PolarHBondContact O-N 3.01Å; Y905-L909 WeakPolarHBondContact O-CB 3.33Å; Y905-L909 WeakPolarHBondContact O-CG 3.41Å; Y905-L909 PolarHBondContact O-N 3.02Å
906	L	42.6	Very low	48.3	Very low	96 Å²	96	62.5 Å²	62.5	50%	0.503	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-38.2	171.6	-83.1	169.2	0	0	0	111.5	G902 S910	G902-L906 PolarHBondContact O-N 3.41Å; L906-S910 WeakPolarHBondContact O-CB 3.36Å; L906-S910 PolarHBondContact O-N 2.98Å; L906-S910 PolarHBondContact O-OG 3.02Å
907	A	39.4	Very low	46	Very low	45 Å²	45	63.2 Å²	63.2	37%	0.372	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-48.4	172.4	0	0	0	0	0	112.1	G903 H904 Y905 L909 S910 A911	G903-A907 PolarHBondContact O-N 2.89Å; H904-A907 WeakPolarHBondContact O-CB 3.34Å; H904-A907 PolarHBondContact O-N 2.82Å; Y905-A907 VanDerWaalsContact C-N 3.28Å; Y905-A907 PolarHBondContact O-N 3.04Å; A907-L909 PolarHBondContact O-N 3.47Å; A907-S910 WeakPolarHBondContact CA-OG 3.38Å; A907-S910 PolarHBondContact O-N 2.95Å; A907-S910 PolarHBondContact O-OG 2.86Å; A907-A911 WeakPolarHBondContact O-CB 3.39Å; A907-A911 PolarHBondContact O-N 3.05Å
908	Q	37.5	Very low	43.4	Very low	38 Å²	38	65 Å²	65	18%	0.178	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-46.6	176.7	-76.8	174.1	-60.4	0	0	112.8	H904 Y905 S910 A911 N912	H904-Q908 WeakPolarHBondContact O-CG 3.49Å; H904-Q908 PolarHBondContact O-N 3.26Å; Y905-Q908 VanDerWaalsContact CD1-OE1 3.3Å; Y905-Q908 PolarHBondContact O-N 3.01Å; Q908-S910 PolarHBondContact O-N 3.16Å; Q908-A911 PolarHBondContact O-N 2.86Å; Q908-A911 VanDerWaalsContact O-N 3.14Å; Q908-N912 PolarHBondContact O-N 2.89Å
909	L	33.5	Very low	41.2	Very low	60 Å²	60	65 Å²	65	31%	0.314	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-40.1	177.4	-71.3	170.3	0	0	0	111.7	Y905 A907 A911 N912 L915	Y905-L909 WeakPolarHBondContact O-CB 3.33Å; Y905-L909 WeakPolarHBondContact O-CG 3.41Å; Y905-L909 PolarHBondContact O-N 3.02Å; A907-L909 PolarHBondContact O-N 3.47Å; L909-A911 PolarHBondContact O-N 3.12Å; L909-N912 PolarHBondContact O-N 2.95Å; L909-L915 HydrophobicContact CD2-CD1 3.7Å
910	S	35.2	Very low	38.7	Very low	85 Å²	85	72.4 Å²	72.4	59%	0.594	42%	0.417	S	S	*	.	H	α-helix	trans	-68.1	-21.4	175.2	70.3	0	0	0	0	114.2	L906 A907 Q908	L906-S910 WeakPolarHBondContact O-CB 3.36Å; L906-S910 PolarHBondContact O-N 2.98Å; L906-S910 PolarHBondContact O-OG 3.02Å; A907-S910 WeakPolarHBondContact CA-OG 3.38Å; A907-S910 PolarHBondContact O-N 2.95Å; A907-S910 PolarHBondContact O-OG 2.86Å; Q908-S910 PolarHBondContact O-N 3.16Å
911	A	33.9	Very low	36.7	Very low	25 Å²	25	75.5 Å²	75.5	21%	0.207	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	2.9	-179.6	0	0	0	0	0	113.9	P45 A907 Q908 L909 P913	P45-A911 HydrophobicContact CB-CB 3.43Å; P45-A911 VanDerWaalsContact CB-CB 3.43Å; A907-A911 WeakPolarHBondContact O-CB 3.39Å; A907-A911 PolarHBondContact O-N 3.05Å; Q908-A911 PolarHBondContact O-N 2.86Å; Q908-A911 VanDerWaalsContact O-N 3.14Å; L909-A911 PolarHBondContact O-N 3.12Å; A911-P913 WeakPolarHBondContact O-CD 3.33Å
912	N	30.9	Very low	35.2	Very low	60 Å²	60	82.1 Å²	82.1	32%	0.321	47%	0.471	S	S	.	.			trans	-112.3	90.3	176.2	-165.1	-15.6	0	0	0	110.1	Q908 L909 V914 L915	Q908-N912 PolarHBondContact O-N 2.89Å; L909-N912 PolarHBondContact O-N 2.95Å; N912-V914 PolarHBondContact O-N 2.78Å; N912-V914 VanDerWaalsContact O-N 3.07Å; N912-L915 PolarHBondContact O-N 3.37Å
913	P	30.1	Very low	33.8	Very low	47 Å²	47	85 Å²	85	31%	0.305	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-64.9	-17.1	-169.2	27	-36.2	0	0	0	113.9	A911 L915 L916 N917	A911-P913 WeakPolarHBondContact O-CD 3.33Å; P913-L915 PolarHBondContact O-N 3.4Å; P913-L916 PolarHBondContact O-N 2.81Å; P913-N917 PolarHBondContact O-N 2.99Å
914	V	36.3	Very low	32.6	Very low	90 Å²	90	92.8 Å²	92.8	55%	0.545	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-58.4	-36.5	177.4	-175.4	0	0	0	0	111.6	N912 L916 S918	N912-V914 PolarHBondContact O-N 2.78Å; N912-V914 VanDerWaalsContact O-N 3.07Å; V914-L916 VanDerWaalsContact C-N 3.34Å; V914-S918 PolarHBondContact O-N 3.26Å
915	L	36.1	Very low	31.7	Very low	77 Å²	77	96 Å²	96	40%	0.403	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-79.8	-11.6	178.4	-68.1	175.2	0	0	0	114	P267 L269 L909 N912 P913	P267-L915 HydrophobicContact CG-CD1 4.28Å; L269-L915 HydrophobicContact CD2-CD2 4.43Å; L909-L915 HydrophobicContact CD2-CD1 3.7Å; N912-L915 PolarHBondContact O-N 3.37Å; P913-L915 PolarHBondContact O-N 3.4Å
916	L	29.4	Very low	30.5	Very low	124 Å²	124	100.4 Å²	100.4	65%	0.649	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-29.2	174.7	-74.4	166.3	0	0	0	112.3	P913 V914	P913-L916 PolarHBondContact O-N 2.81Å; V914-L916 VanDerWaalsContact C-N 3.34Å
917	N	25.3	Very low	29.4	Very low	112 Å²	112	101.9 Å²	101.9	60%	0.599	60%	0.596	S	S	*	*			trans	-105.5	23.5	-176.8	-73	-15.8	0	0	0	113.9	P913 S919	P913-N917 PolarHBondContact O-N 2.99Å; N917-S919 PolarHBondContact O-N 3.05Å
918	S	25.9	Very low	28.7	Very low	99 Å²	99	108.7 Å²	108.7	69%	0.692	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	20	177.8	72.9	0	0	0	0	114.7	V914	V914-S918 PolarHBondContact O-N 3.26Å
919	S	28.8	Very low	28.2	Very low	102 Å²	102	112.9 Å²	112.9	71%	0.713	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	0.1	179.9	52.9	0	0	0	0	113.9	N917	N917-S919 PolarHBondContact O-N 3.05Å
920	Q	27.9	Very low	27.7	Very low	176 Å²	176	113.6 Å²	113.6	82%	0.822	67%	0.672	S	S	*	*	S	Bend	trans	-115.6	-9.4	178.6	-65.5	-167	-4.2	0	0	115.4	N922	Q920-N922 PolarHBondContact O-N 3.13Å
921	L	26.3	Very low	27.3	Very low	163 Å²	163	116.8 Å²	116.8	85%	0.853	68%	0.683	S	S	*	*	S	Bend	trans	-100.6	59	176.7	-73.9	174.1	0	0	0	112.4
922	N	26.3	Very low	26.7	Very low	165 Å²	165	123.3 Å²	123.3	88%	0.882	71%	0.709	S	S	*	*			trans	-150.5	57.2	166.1	-133.6	-18.5	0	0	0	112	Q920	Q920-N922 PolarHBondContact O-N 3.13Å
923	G	24.3	Very low	26.5	Very low	70 Å²	70	129.8 Å²	129.8	72%	0.722	74%	0.735	S	S	*	*	S	Bend	trans	-129.7	16.1	-175	0	0	0	0	0	114.9
924	Q	23.3	Very low	26	Very low	193 Å²	193	133.9 Å²	133.9	90%	0.902	75%	0.754	S	S	*	*			trans	-161.6	77	-175.5	-121.5	165.9	76.1	0	0	112.8
925	L	24.3	Very low	25.6	Very low	174 Å²	174	140 Å²	140	91%	0.911	77%	0.769	S	S	*	*			trans	-158.2	118	157.8	-114.7	158.8	0	0	0	110.5
926	S	23.2	Very low	24.9	Very low	108 Å²	108	143.2 Å²	143.2	76%	0.755	79%	0.785	S	S	*	*			trans	-86.6	128.4	-167.4	-57.8	0	0	0	0	113
927	T	20.3	Very low	24.6	Very low	127 Å²	127	141.8 Å²	141.8	78%	0.779	79%	0.786	S	S	*	*			trans	4.4	112	147	55.6	0	0	0	0	117.7
928	H	23.4	Very low	24.3	Very low	188 Å²	188	144.6 Å²	144.6	87%	0.87	80%	0.795	S	S	*	*			trans	-145	142.6	136.5	-97.7	-70.2	0	0	0	110.3
929	P	27.8	Very low	24.4	Very low	126 Å²	126	147.3 Å²	147.3	82%	0.818	81%	0.807	S	S	*	*			trans	-102.9	153.1	-166.5	38	-33.9	0	0	0	114
930	G	23	Very low	23.9	Very low	75 Å²	75	146.8 Å²	146.8	77%	0.773	80%	0.803	S	S	*	*			trans	130.2	91.4	148.2	0	0	0	0	0	117
931	N	25.9	Very low	23.7	Very low	152 Å²	152	146 Å²	146	81%	0.813	81%	0.805	S	S	*	*				-151.6	135	112.5	-134.6	-18.9	0	0	0	111
932	Q	22.1	Very low	23.5	Very low	161 Å²	161	143.3 Å²	143.3	75%	0.752	80%	0.799	S	S	*	*			trans	-107.9	123.9	178.4	-70	-179.7	-7	0	0	109.5
933	F	25.7	Very low	23.3	Very low	197 Å²	197	141 Å²	141	86%	0.864	80%	0.797	S	S	*	*			trans	-124.2	99.4	160.4	-99	-85	0	0	0	109.6
934	N	20.4	Very low	23.2	Very low	132 Å²	132	146.2 Å²	146.2	71%	0.706	80%	0.802	S	S	*	*			trans	-75.3	140.1	173.9	-80.5	-46.8	0	0	0	110.6
935	Y	27	Very low	23.3	Very low	219 Å²	219	142.9 Å²	142.9	86%	0.859	80%	0.797	S	S	*	*			trans	-134	140.2	143.1	-109.3	-84.6	0	0	0	111.8
936	L	21.8	Very low	23.2	Very low	144 Å²	144	140.2 Å²	140.2	75%	0.754	79%	0.792	S	S	*	*			trans	-56.6	161.7	-178.7	-70.2	100.1	0	0	0	113.6
937	S	22.7	Very low	23.2	Very low	95 Å²	95	145.1 Å²	145.1	66%	0.664	80%	0.8	S	S	*	*			cis	-169.4	155.2	7.6	29	0	0	0	0	113.8
938	H	20.8	Very low	23.4	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.787	80%	0.804	S	S	*	*			trans	36	106.8	143.5	-68.9	-88.3	0	0	0	121
939	V	26.4	Very low	23.6	Very low	156 Å²	156	143.9 Å²	143.9	95%	0.945	80%	0.795	S	S	*	*				-133.9	146.4	122	-179.1	0	0	0	0	107.4
940	S	19.7	Very low	23.8	Very low	91 Å²	91	143.7 Å²	143.7	64%	0.636	79%	0.794	S	S	*	*			trans	-136.1	124.9	-170.8	55.1	0	0	0	0	113.1
941	N	22	Very low	24.1	Very low	161 Å²	161	146.1 Å²	146.1	86%	0.861	79%	0.789	S	S	*	*			trans	-169.9	161.6	137.7	-117.2	-25	0	0	0	116.2
942	S	24.1	Very low	24.2	Very low	105 Å²	105	140.5 Å²	140.5	73%	0.734	77%	0.767	S	S	*	*			trans	51.1	98.2	155.3	58.3	0	0	0	0	119.7
943	S	21.1	Very low	24.6	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	76%	0.764	S	S	*	*			trans	-53.6	134.7	158.7	51.9	0	0	0	0	116
944	Q	23.2	Very low	24.9	Very low	179 Å²	179	134 Å²	134	84%	0.836	76%	0.756	S	S	*	*				-153.9	149.2	127.1	-111.3	-168.5	-18.6	0	0	109.8
945	P	25.1	Very low	25.3	Very low	122 Å²	122	130.3 Å²	130.3	79%	0.792	74%	0.744	S	S	*	*			trans	-85.9	129.6	-175.6	33	-31.9	0	0	0	111.8
946	C	21.4	Very low	25.6	Very low	118 Å²	118	125.1 Å²	125.1	80%	0.797	73%	0.731	S	S	*	*			trans	-124.5	135.7	169.9	-64	0	0	0	0	108.6
947	F	23.9	Very low	26.2	Very low	212 Å²	212	122.5 Å²	122.5	93%	0.93	72%	0.721	S	S	*	*			trans	-58.8	142.4	-168	-76	-100.7	0	0	0	114	N949	F947-N949 PolarHBondContact O-N 3.49Å
948	D	23.7	Very low	26.9	Very low	163 Å²	163	120.9 Å²	120.9	87%	0.872	71%	0.713	S	S	*	*			trans	-57.2	124.4	169.2	-64.7	-70.3	0	0	0	111.3
949	N	27.3	Very low	27.5	Very low	125 Å²	125	115.6 Å²	115.6	67%	0.668	70%	0.699	S	S	*	*			trans	-105	108.7	167.8	-177.2	-3.4	0	0	0	107.3	F947 N951	F947-N949 PolarHBondContact O-N 3.49Å; N949-N951 PolarHBondContact O-N 3.5Å; N949-N951 PolarHBondContact OD1-ND2 2.83Å
950	P	31.9	Very low	27.8	Very low	123 Å²	123	114 Å²	114	80%	0.799	68%	0.683	S	S	*	*			trans	-71.3	3.1	-165.9	27.9	-35.9	0	0	0	115.1	G952	P950-G952 PolarHBondContact O-N 3.01Å; P950-G952 VanDerWaalsContact O-N 3.12Å
951	N	30.1	Very low	28.7	Very low	125 Å²	125	111.4 Å²	111.4	67%	0.668	67%	0.667	S	S	*	*			trans	-81.3	87.5	176.3	-68.5	-54	0	0	0	111.1	N949	N949-N951 PolarHBondContact O-N 3.5Å; N949-N951 PolarHBondContact OD1-ND2 2.83Å
952	G	27.7	Very low	29.4	Very low	35 Å²	35	106.7 Å²	106.7	36%	0.361	65%	0.65	S	S	.	*			trans	-59.6	160.6	176.2	0	0	0	0	0	114.1	P950 T954 A955	P950-G952 PolarHBondContact O-N 3.01Å; P950-G952 VanDerWaalsContact O-N 3.12Å; G952-T954 PolarHBondContact O-N 3.22Å; G952-A955 PolarHBondContact O-N 2.97Å; G952-A955 VanDerWaalsContact O-N 3.15Å
953	P	31	Very low	29.8	Very low	105 Å²	105	104.4 Å²	104.4	68%	0.682	64%	0.638	S	S	*	*	H	α-helix	trans	-62.4	-21.1	-170.4	24.4	-34.6	0	0	0	114.5	A955 L956 V957	P953-A955 VanDerWaalsContact C-N 3.29Å; P953-A955 PolarHBondContact O-N 3.11Å; P953-L956 PolarHBondContact O-N 2.94Å; P953-V957 WeakPolarHBondContact O-CG2 3.45Å; P953-V957 PolarHBondContact O-N 2.82Å
954	T	31.7	Very low	30.5	Very low	115 Å²	115	101.8 Å²	101.8	71%	0.706	62%	0.623	S	S	*	*	H	α-helix	trans	-56.1	-38.2	174	34.7	0	0	0	0	113.1	G952 V957 A958	G952-T954 PolarHBondContact O-N 3.22Å; T954-V957 PolarHBondContact O-N 3.2Å; T954-A958 VanDerWaalsContact O-CB 3.31Å; T954-A958 WeakPolarHBondContact O-CB 3.42Å; T954-A958 PolarHBondContact O-N 2.65Å
955	A	29.3	Very low	31	Very low	55 Å²	55	95 Å²	95	46%	0.455	60%	0.598	S	S	.	*	H	α-helix	trans	-67.3	-39.8	177.9	0	0	0	0	0	112.2	G952 P953 A959	G952-A955 PolarHBondContact O-N 2.97Å; G952-A955 VanDerWaalsContact O-N 3.15Å; P953-A955 VanDerWaalsContact C-N 3.29Å; P953-A955 PolarHBondContact O-N 3.11Å; A955-A959 WeakPolarHBondContact O-CB 3.16Å; A955-A959 PolarHBondContact O-N 3.28Å
956	L	32.2	Very low	31.5	Very low	110 Å²	110	90.8 Å²	90.8	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-68.3	-41.1	176.2	-176.5	64.4	0	0	0	111.5	P953 A959 M960	P953-L956 PolarHBondContact O-N 2.94Å; L956-A959 PolarHBondContact O-N 2.82Å; L956-M960 HydrophobicContact CD1-CE 4.39Å; L956-M960 HydrophobicContact CG-CE 4.38Å; L956-M960 WeakPolarHBondContact O-CG 3.24Å; L956-M960 PolarHBondContact O-N 3.14Å
957	V	35.3	Very low	31.9	Very low	90 Å²	90	88.9 Å²	88.9	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-66.7	-40.2	176.5	172.2	0	0	0	0	111.3	P953 T954 M960 A961	P953-V957 WeakPolarHBondContact O-CG2 3.45Å; P953-V957 PolarHBondContact O-N 2.82Å; T954-V957 PolarHBondContact O-N 3.2Å; V957-M960 PolarHBondContact O-N 2.76Å; V957-A961 WeakPolarHBondContact O-CB 3.42Å; V957-A961 PolarHBondContact O-N 3.36Å
958	A	36.2	Very low	32.4	Very low	61 Å²	61	84 Å²	84	50%	0.504	54%	0.542	S	S	.	.	H	α-helix	trans	-62.4	-43.3	173.5	0	0	0	0	0	111.7	T954 M960 A961 A962	T954-A958 VanDerWaalsContact O-CB 3.31Å; T954-A958 WeakPolarHBondContact O-CB 3.42Å; T954-A958 PolarHBondContact O-N 2.65Å; A958-M960 PolarHBondContact O-N 2.86Å; A958-A961 PolarHBondContact O-N 2.86Å; A958-A962 WeakPolarHBondContact O-CB 3.26Å; A958-A962 PolarHBondContact O-N 2.97Å
959	A	34.2	Very low	33.2	Very low	59 Å²	59	78.2 Å²	78.2	49%	0.488	51%	0.509	S	S	.	.	H	α-helix	trans	-63.4	-38.4	174.2	0	0	0	0	0	112.5	A955 L956 A963	A955-A959 WeakPolarHBondContact O-CB 3.16Å; A955-A959 PolarHBondContact O-N 3.28Å; L956-A959 PolarHBondContact O-N 2.82Å; A959-A963 VanDerWaalsContact O-CB 3.29Å; A959-A963 WeakPolarHBondContact O-CB 3.49Å; A959-A963 PolarHBondContact O-N 2.97Å
960	M	33.1	Very low	33.2	Very low	122 Å²	122	74.6 Å²	74.6	60%	0.601	50%	0.501	S	S	*	.	H	α-helix	trans	-68.2	-39.3	173.9	-75.5	-173.3	174.9	0	0	112.7	L956 V957 A958 A963 A964	L956-M960 HydrophobicContact CD1-CE 4.39Å; L956-M960 HydrophobicContact CG-CE 4.38Å; L956-M960 WeakPolarHBondContact O-CG 3.24Å; L956-M960 PolarHBondContact O-N 3.14Å; V957-M960 PolarHBondContact O-N 2.76Å; A958-M960 PolarHBondContact O-N 2.86Å; M960-A963 PolarHBondContact O-N 2.91Å; M960-A964 WeakPolarHBondContact O-CB 3.33Å; M960-A964 PolarHBondContact O-N 3.15Å
961	A	37.4	Very low	32.9	Very low	36 Å²	36	70.9 Å²	70.9	30%	0.298	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-42.2	174.5	0	0	0	0	0	111.5	V957 A958 A963 A964 A965	V957-A961 WeakPolarHBondContact O-CB 3.42Å; V957-A961 PolarHBondContact O-N 3.36Å; A958-A961 PolarHBondContact O-N 2.86Å; A961-A963 VanDerWaalsContact C-N 3.34Å; A961-A963 PolarHBondContact O-N 3.32Å; A961-A964 PolarHBondContact O-N 3.01Å; A961-A965 WeakPolarHBondContact O-CB 3.41Å; A961-A965 PolarHBondContact O-N 2.81Å
962	A	36.8	Very low	32.7	Very low	62 Å²	62	71 Å²	71	51%	0.512	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-38.7	172.3	0	0	0	0	0	111.9	A958 A966	A958-A962 WeakPolarHBondContact O-CB 3.26Å; A958-A962 PolarHBondContact O-N 2.97Å; A962-A966 WeakPolarHBondContact O-CB 3.18Å; A962-A966 PolarHBondContact O-N 3.24Å
963	A	33.8	Very low	32.7	Very low	58 Å²	58	72.5 Å²	72.5	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-69.3	-36.6	175.2	0	0	0	0	0	112.9	A959 M960 A961 A966 A967	A959-A963 VanDerWaalsContact O-CB 3.29Å; A959-A963 WeakPolarHBondContact O-CB 3.49Å; A959-A963 PolarHBondContact O-N 2.97Å; M960-A963 PolarHBondContact O-N 2.91Å; A961-A963 VanDerWaalsContact C-N 3.34Å; A961-A963 PolarHBondContact O-N 3.32Å; A963-A966 PolarHBondContact O-N 2.88Å; A963-A967 WeakPolarHBondContact O-CB 3.42Å; A963-A967 PolarHBondContact O-N 2.9Å
964	A	34.8	Very low	32.4	Very low	63 Å²	63	72.5 Å²	72.5	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-44.5	174.7	0	0	0	0	0	111.4	M960 A961 A966 A967 Y968	M960-A964 WeakPolarHBondContact O-CB 3.33Å; M960-A964 PolarHBondContact O-N 3.15Å; A961-A964 PolarHBondContact O-N 3.01Å; A964-A966 VanDerWaalsContact C-N 3.35Å; A964-A967 PolarHBondContact O-N 3.42Å; A964-Y968 PolarHBondContact O-N 3.46Å
965	A	34.9	Very low	32	Very low	36 Å²	36	74 Å²	74	30%	0.298	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-43.1	171	0	0	0	0	0	111.3	A961 A967 Y968 F969	A961-A965 WeakPolarHBondContact O-CB 3.41Å; A961-A965 PolarHBondContact O-N 2.81Å; A965-A967 PolarHBondContact O-N 2.94Å; A965-Y968 PolarHBondContact O-N 3.48Å; A965-F969 HydrophobicContact CB-CD2 4.39Å; A965-F969 WeakPolarHBondContact O-CB 3.49Å; A965-F969 WeakPolarHBondContact O-CD2 3.29Å; A965-F969 PolarHBondContact O-N 3.41Å
966	A	33.7	Very low	31.7	Very low	34 Å²	34	77.8 Å²	77.8	28%	0.281	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-35.9	175.5	0	0	0	0	0	112.8	A962 A963 A964 F969 G970 G971	A962-A966 WeakPolarHBondContact O-CB 3.18Å; A962-A966 PolarHBondContact O-N 3.24Å; A963-A966 PolarHBondContact O-N 2.88Å; A964-A966 VanDerWaalsContact C-N 3.35Å; A966-F969 CarbonylContact O-C 3.47Å; A966-F969 PolarHBondContact O-N 2.93Å; A966-G970 CarbonylContact O-C 3.54Å; A966-G970 WeakPolarHBondContact O-CA 3.36Å; A966-G970 PolarHBondContact O-N 3.21Å; A966-G971 PolarHBondContact O-N 3.19Å
967	A	31.6	Very low	31.2	Very low	77 Å²	77	83 Å²	83	64%	0.636	55%	0.547	S	S	*	.	H	α-helix	trans	-67.7	-35.9	174.6	0	0	0	0	0	112	A963 A964 A965	A963-A967 WeakPolarHBondContact O-CB 3.42Å; A963-A967 PolarHBondContact O-N 2.9Å; A964-A967 PolarHBondContact O-N 3.42Å; A965-A967 PolarHBondContact O-N 2.94Å
968	Y	34	Very low	30.6	Very low	110 Å²	110	84.3 Å²	84.3	43%	0.431	56%	0.557	S	S	.	*	H	α-helix	trans	-72.1	-40.1	173.8	-168.4	-100.5	0	0	0	112.3	A964 A965	A964-Y968 PolarHBondContact O-N 3.46Å; A965-Y968 PolarHBondContact O-N 3.48Å
969	F	39	Very low	29.8	Very low	42 Å²	42	88.9 Å²	88.9	18%	0.184	57%	0.573	C	S	.	*	H	α-helix	trans	-103.3	15.1	-174.6	-62.7	-61.7	0	0	0	115.6	L668 K900 A965 A966	L668-F969 HydrophobicContact CD2-CZ 4.46Å; K900-F969 PolarHBondContact NZ-O 3.33Å; A965-F969 HydrophobicContact CB-CD2 4.39Å; A965-F969 WeakPolarHBondContact O-CB 3.49Å; A965-F969 WeakPolarHBondContact O-CD2 3.29Å; A965-F969 PolarHBondContact O-N 3.41Å; A966-F969 CarbonylContact O-C 3.47Å; A966-F969 PolarHBondContact O-N 2.93Å
970	G	27.9	Very low	29.3	Very low	49 Å²	49	92 Å²	92	51%	0.505	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	69.3	43.8	171.1	0	0	0	0	0	116	A966	A966-G970 CarbonylContact O-C 3.54Å; A966-G970 WeakPolarHBondContact O-CA 3.36Å; A966-G970 PolarHBondContact O-N 3.21Å
971	G	25.9	Very low	28.6	Very low	44 Å²	44	91.4 Å²	91.4	45%	0.454	59%	0.594	S	S	.	*			trans	-89.1	127.5	-179.4	0	0	0	0	0	114.5	A966 G973	A966-G971 PolarHBondContact O-N 3.19Å; G971-G973 PolarHBondContact O-N 3.37Å
972	S	26.1	Very low	27.9	Very low	127 Å²	127	95.8 Å²	95.8	89%	0.888	62%	0.617	S	S	*	*			trans	-75.5	97.6	172.5	-62.9	0	0	0	0	111.5	S974	S972-S974 PolarHBondContact O-N 3.2Å
973	G	26.6	Very low	27.1	Very low	67 Å²	67	100.9 Å²	100.9	69%	0.691	64%	0.635	S	S	*	*			trans	-70	110.9	175.5	0	0	0	0	0	112.9	G971 N975	G971-G973 PolarHBondContact O-N 3.37Å; G973-N975 PolarHBondContact O-N 3.39Å
974	S	24.7	Very low	26.4	Very low	106 Å²	106	101.4 Å²	101.4	74%	0.741	65%	0.647	S	S	*	*			trans	-74.1	89.2	173.1	54.3	0	0	0	0	111	S972 T976	S972-S974 PolarHBondContact O-N 3.2Å; S974-T976 VanDerWaalsContact C-N 3.35Å; S974-T976 PolarHBondContact O-N 2.96Å
975	N	24.5	Very low	25.9	Very low	147 Å²	147	106.7 Å²	106.7	79%	0.786	67%	0.665	S	S	*	*			trans	-68.5	84.7	176.7	-90.2	-35.2	0	0	0	112	G973 R977	G973-N975 PolarHBondContact O-N 3.39Å; N975-R977 PolarHBondContact O-N 3.19Å
976	T	22.1	Very low	25.2	Very low	133 Å²	133	114.3 Å²	114.3	82%	0.816	69%	0.694	S	S	*	*			trans	-71.1	76.7	168	49.6	0	0	0	0	110.6	S974	S974-T976 VanDerWaalsContact C-N 3.35Å; S974-T976 PolarHBondContact O-N 2.96Å
977	R	22.1	Very low	24.7	Very low	219 Å²	219	116.1 Å²	116.1	83%	0.826	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-74.7	139.8	169.6	-80.3	-171.6	169.5	-167.9	-3.3	110.5	N975	N975-R977 PolarHBondContact O-N 3.19Å
978	P	23.1	Very low	24.3	Very low	118 Å²	118	118.2 Å²	118.2	77%	0.766	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-63.9	153.6	179.5	-23	34.4	0	0	0	113.7	V980	P978-V980 PolarHBondContact O-N 3.3Å
979	N	19.4	Very low	23.7	Very low	157 Å²	157	118.8 Å²	118.8	84%	0.84	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-69.4	124	-175.7	-142.1	-8.2	0	0	0	111.4
980	V	22.8	Very low	23	Very low	126 Å²	126	121.5 Å²	121.5	76%	0.764	78%	0.776	S	S	*	*			trans	-133.4	115.5	169.3	179.6	0	0	0	0	108.5	P978	P978-V980 PolarHBondContact O-N 3.3Å
981	S	19	Very low	22.7	Very low	109 Å²	109	127 Å²	127	76%	0.762	79%	0.793	S	S	*	*			trans	-84.7	116.7	-166.9	-47.2	0	0	0	0	112.7
982	T	22.9	Very low	22.6	Very low	128 Å²	128	132.4 Å²	132.4	79%	0.785	81%	0.812	S	S	*	*			trans	-148.1	154.9	163.2	-39.1	0	0	0	0	111.8
983	L	20.5	Very low	22.4	Very low	168 Å²	168	134.9 Å²	134.9	88%	0.88	81%	0.809	S	S	*	*			trans	-57	148.9	-166.4	-72.1	62.2	0	0	0	114.4
984	G	19.4	Very low	22.5	Very low	70 Å²	70	137.7 Å²	137.7	72%	0.722	82%	0.815	S	S	*	*			trans	-96.5	-170.4	178.6	0	0	0	0	0	115.1
985	L	23.8	Very low	22.6	Very low	174 Å²	174	136.1 Å²	136.1	91%	0.911	82%	0.816	S	S	*	*			trans	-154.1	169.3	158.2	-135.5	79	0	0	0	109.9
986	H	20.2	Very low	22.7	Very low	195 Å²	195	133.5 Å²	133.5	90%	0.903	82%	0.815	S	S	*	*			trans	-68.4	146.1	-175.1	-69.9	-99	0	0	0	114.4
987	G	23.3	Very low	23.3	Very low	72 Å²	72	130.7 Å²	130.7	74%	0.742	80%	0.8	S	S	*	*			trans	178.3	92.9	167.5	0	0	0	0	0	116
988	S	23.1	Very low	24.1	Very low	121 Å²	121	125.5 Å²	125.5	85%	0.846	79%	0.785	S	S	*	*			trans	19.4	120.6	155.8	-54.2	0	0	0	0	120.7	A990	S988-A990 PolarHBondContact O-N 2.87Å
989	S	21.4	Very low	24.5	Very low	123 Å²	123	123.3 Å²	123.3	86%	0.86	78%	0.777	S	S	*	*			trans	-42.2	115.2	171.1	54.3	0	0	0	0	115.9
990	A	23.8	Very low	25	Very low	98 Å²	98	117.8 Å²	117.8	81%	0.81	75%	0.754	S	S	*	*			trans	-110.8	115.2	159.7	0	0	0	0	0	108.9	S988	S988-A990 PolarHBondContact O-N 2.87Å
991	L	22.8	Very low	25.3	Very low	164 Å²	164	114.1 Å²	114.1	86%	0.859	74%	0.737	S	S	*	*			trans	-76.5	147.3	-176.7	-85.1	159.2	0	0	0	112.3	Q993	L991-Q993 PolarHBondContact O-N 3.32Å
992	N	22.1	Very low	25.9	Very low	158 Å²	158	117 Å²	117	85%	0.845	73%	0.732	S	S	*	*			trans	-50.8	121.6	177.2	-68.8	-35.9	0	0	0	112.6
993	Q	23.3	Very low	26.3	Very low	179 Å²	179	113.9 Å²	113.9	84%	0.836	72%	0.719	S	S	*	*			trans	-129.8	95.3	163	-73.8	-161.7	-6.8	0	0	111	L991	L991-Q993 PolarHBondContact O-N 3.32Å
994	P	27.6	Very low	26.7	Very low	126 Å²	126	110.6 Å²	110.6	82%	0.818	71%	0.706	S	S	*	*			trans	-76.9	130.1	168.5	31.5	-31.9	0	0	0	110
995	G	27.1	Very low	27.2	Very low	74 Å²	74	110.1 Å²	110.1	76%	0.763	70%	0.695	S	S	*	*			trans	167.3	27.8	-178.6	0	0	0	0	0	117.2	S997	G995-S997 PolarHBondContact O-N 3.15Å
996	A	27.7	Very low	27.6	Very low	92 Å²	92	104.8 Å²	104.8	76%	0.76	68%	0.676	S	S	*	*			trans	-71.7	90.8	177.5	0	0	0	0	0	111.1
997	S	33.5	Very low	27.9	Very low	73 Å²	73	98.1 Å²	98.1	51%	0.51	66%	0.655	S	S	.	*			trans	-58.7	156.3	177.3	67.7	0	0	0	0	112.9	G995 A999 A1000	G995-S997 PolarHBondContact O-N 3.15Å; S997-A999 PolarHBondContact O-N 3.44Å; S997-A1000 WeakPolarHBondContact O-CB 3.32Å; S997-A1000 PolarHBondContact O-N 2.81Å
998	H	38.9	Very low	28.1	Very low	110 Å²	110	97 Å²	97	51%	0.509	64%	0.638	S	S	.	*	H	α-helix	trans	-58.4	-16.8	-174.7	-84.8	-100.6	0	0	0	115.3	A1000 A1001 Y1002	H998-A1000 VanDerWaalsContact C-N 3.3Å; H998-A1000 PolarHBondContact O-N 2.96Å; H998-A1001 WeakPolarHBondContact O-CB 3.16Å; H998-A1001 PolarHBondContact O-N 2.81Å; H998-Y1002 PolarHBondContact O-N 2.87Å
999	A	31.3	Very low	28.2	Very low	72 Å²	72	95.1 Å²	95.1	60%	0.595	63%	0.63	S	S	*	*	H	α-helix	trans	-61.8	-38	168.7	0	0	0	0	0	112.2	S997 Y1002 A1003	S997-A999 PolarHBondContact O-N 3.44Å; A999-Y1002 PolarHBondContact O-N 2.86Å; A999-A1003 WeakPolarHBondContact O-CB 3.44Å; A999-A1003 PolarHBondContact O-N 3.23Å
1000	A	30.6	Very low	28.5	Very low	42 Å²	42	93.1 Å²	93.1	35%	0.347	62%	0.621	S	S	.	*	H	α-helix	trans	-68.6	-38.8	171.7	0	0	0	0	0	111.3	S997 H998 Y1002 A1003 V1004	S997-A1000 WeakPolarHBondContact O-CB 3.32Å; S997-A1000 PolarHBondContact O-N 2.81Å; H998-A1000 VanDerWaalsContact C-N 3.3Å; H998-A1000 PolarHBondContact O-N 2.96Å; A1000-Y1002 PolarHBondContact O-N 2.69Å; A1000-A1003 PolarHBondContact O-N 3.38Å; A1000-V1004 WeakPolarHBondContact O-CB 3.26Å; A1000-V1004 VanDerWaalsContact O-CG2 3.27Å; A1000-V1004 WeakPolarHBondContact O-CG2 3.31Å; A1000-V1004 PolarHBondContact O-N 2.83Å
1001	A	30	Very low	28.5	Very low	49 Å²	49	96.4 Å²	96.4	41%	0.405	62%	0.62	S	S	.	*	H	α-helix	trans	-62.4	-41.2	174.4	0	0	0	0	0	112.1	H998 V1004 A1005	H998-A1001 WeakPolarHBondContact O-CB 3.16Å; H998-A1001 PolarHBondContact O-N 2.81Å; A1001-V1004 PolarHBondContact O-N 2.86Å; A1001-A1005 VanDerWaalsContact O-CB 3.23Å; A1001-A1005 WeakPolarHBondContact O-CB 3.3Å; A1001-A1005 PolarHBondContact O-N 3.21Å
1002	Y	30.7	Very low	28.6	Very low	169 Å²	169	96.3 Å²	96.3	66%	0.663	62%	0.615	S	S	*	*	H	α-helix	trans	-64.9	-42.1	175	-127.9	-86.8	0	0	0	112	H998 A999 A1000 A1006	H998-Y1002 PolarHBondContact O-N 2.87Å; A999-Y1002 PolarHBondContact O-N 2.86Å; A1000-Y1002 PolarHBondContact O-N 2.69Å; Y1002-A1006 WeakPolarHBondContact O-CB 3.41Å; Y1002-A1006 PolarHBondContact O-N 2.99Å
1003	A	30.5	Very low	28.7	Very low	62 Å²	62	97.6 Å²	97.6	51%	0.512	62%	0.615	S	S	.	*	H	α-helix	trans	-66.9	-41.1	176.5	0	0	0	0	0	112.6	A999 A1000 A1006 A1007	A999-A1003 WeakPolarHBondContact O-CB 3.44Å; A999-A1003 PolarHBondContact O-N 3.23Å; A1000-A1003 PolarHBondContact O-N 3.38Å; A1003-A1006 PolarHBondContact O-N 3.49Å; A1003-A1007 WeakPolarHBondContact O-CB 3.46Å; A1003-A1007 PolarHBondContact O-N 3.33Å
1004	V	30.6	Very low	28.7	Very low	99 Å²	99	94.8 Å²	94.8	60%	0.6	62%	0.616	S	S	*	*	H	α-helix	trans	-69.2	-39.8	176.4	169.9	0	0	0	0	111.2	A1000 A1001 A1007 A1008	A1000-V1004 WeakPolarHBondContact O-CB 3.26Å; A1000-V1004 VanDerWaalsContact O-CG2 3.27Å; A1000-V1004 WeakPolarHBondContact O-CG2 3.31Å; A1000-V1004 PolarHBondContact O-N 2.83Å; A1001-V1004 PolarHBondContact O-N 2.86Å; V1004-A1007 PolarHBondContact O-N 2.8Å; V1004-A1008 VanDerWaalsContact O-CB 3.29Å; V1004-A1008 WeakPolarHBondContact O-CB 3.5Å; V1004-A1008 PolarHBondContact O-N 3.2Å
1005	A	29.9	Very low	28.6	Very low	61 Å²	61	93.9 Å²	93.9	50%	0.504	61%	0.613	S	S	.	*	H	α-helix	trans	-63.7	-42	173.9	0	0	0	0	0	111.8	A1001 A1008 A1009	A1001-A1005 VanDerWaalsContact O-CB 3.23Å; A1001-A1005 WeakPolarHBondContact O-CB 3.3Å; A1001-A1005 PolarHBondContact O-N 3.21Å; A1005-A1008 PolarHBondContact O-N 3.06Å; A1005-A1009 VanDerWaalsContact O-CB 3.32Å; A1005-A1009 WeakPolarHBondContact O-CB 3.39Å; A1005-A1009 PolarHBondContact O-N 2.84Å
1006	A	30.4	Very low	28.4	Very low	62 Å²	62	99.1 Å²	99.1	51%	0.512	62%	0.617	S	S	.	*	H	α-helix	trans	-64.3	-40.1	173.9	0	0	0	0	0	112.4	Y1002 A1003 A1010	Y1002-A1006 WeakPolarHBondContact O-CB 3.41Å; Y1002-A1006 PolarHBondContact O-N 2.99Å; A1003-A1006 PolarHBondContact O-N 3.49Å; A1006-A1010 WeakPolarHBondContact O-CB 2.91Å; A1006-A1010 PolarHBondContact O-N 3.02Å; A1006-A1010 VanDerWaalsContact O-N 3.13Å
1007	A	27.3	Very low	28.1	Very low	55 Å²	55	99.9 Å²	99.9	46%	0.455	61%	0.614	S	S	.	*	H	α-helix	trans	-68.8	-38.5	176.2	0	0	0	0	0	112.8	A1003 V1004 A1010 Q1011	A1003-A1007 WeakPolarHBondContact O-CB 3.46Å; A1003-A1007 PolarHBondContact O-N 3.33Å; V1004-A1007 PolarHBondContact O-N 2.8Å; A1007-A1010 PolarHBondContact O-N 3.13Å; A1007-Q1011 VanDerWaalsContact O-CG 3.31Å; A1007-Q1011 WeakPolarHBondContact O-CG 3.38Å; A1007-Q1011 PolarHBondContact O-N 3.43Å
1008	A	26.7	Very low	27.5	Very low	48 Å²	48	107.6 Å²	107.6	40%	0.397	63%	0.634	S	S	.	*	H	α-helix	trans	-67.2	-43.7	175.4	0	0	0	0	0	111.5	V1004 A1005 A1010 Q1011	V1004-A1008 VanDerWaalsContact O-CB 3.29Å; V1004-A1008 WeakPolarHBondContact O-CB 3.5Å; V1004-A1008 PolarHBondContact O-N 3.2Å; A1005-A1008 PolarHBondContact O-N 3.06Å; A1008-A1010 PolarHBondContact O-N 2.9Å; A1008-Q1011 PolarHBondContact O-N 2.96Å
1009	A	26.8	Very low	26.7	Very low	81 Å²	81	106.6 Å²	106.6	67%	0.669	64%	0.64	S	S	*	*	H	α-helix	trans	-59.1	-30	172.7	0	0	0	0	0	112.6	A1005 Q1011	A1005-A1009 VanDerWaalsContact O-CB 3.32Å; A1005-A1009 WeakPolarHBondContact O-CB 3.39Å; A1005-A1009 PolarHBondContact O-N 2.84Å; A1009-Q1011 VanDerWaalsContact C-N 3.35Å
1010	A	26.2	Very low	26.2	Very low	82 Å²	82	108.1 Å²	108.1	68%	0.678	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-7.3	175.5	0	0	0	0	0	114.9	A1006 A1007 A1008	A1006-A1010 WeakPolarHBondContact O-CB 2.91Å; A1006-A1010 PolarHBondContact O-N 3.02Å; A1006-A1010 VanDerWaalsContact O-N 3.13Å; A1007-A1010 PolarHBondContact O-N 3.13Å; A1008-A1010 PolarHBondContact O-N 2.9Å
1011	Q	24.3	Very low	25.8	Very low	166 Å²	166	114.3 Å²	114.3	78%	0.776	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	-10.9	-176.3	-72.2	-94.5	-68.4	0	0	114.1	A1007 A1008 A1009 Q1013	A1007-Q1011 VanDerWaalsContact O-CG 3.31Å; A1007-Q1011 WeakPolarHBondContact O-CG 3.38Å; A1007-Q1011 PolarHBondContact O-N 3.43Å; A1008-Q1011 PolarHBondContact O-N 2.96Å; A1009-Q1011 VanDerWaalsContact C-N 3.35Å; Q1011-Q1013 VanDerWaalsContact C-N 3.29Å; Q1011-Q1013 PolarHBondContact O-N 2.83Å
1012	H	25.2	Very low	25.3	Very low	162 Å²	162	117.6 Å²	117.6	75%	0.75	68%	0.683	S	S	*	*			trans	-81.2	67.3	178.1	-83.8	-84.9	0	0	0	113.4
1013	Q	24.1	Very low	25	Very low	185 Å²	185	117.5 Å²	117.5	86%	0.864	69%	0.694	S	S	*	*			trans	-113.1	88.9	155.5	-76.4	-163.6	-9.2	0	0	110.2	Q1011 S1015	Q1011-Q1013 VanDerWaalsContact C-N 3.29Å; Q1011-Q1013 PolarHBondContact O-N 2.83Å; Q1013-S1015 PolarHBondContact O-N 2.87Å
1014	S	24.4	Very low	24.7	Very low	121 Å²	121	117.8 Å²	117.8	85%	0.846	70%	0.703	S	S	*	*			trans	-88.5	98.4	174.1	54.9	0	0	0	0	111
1015	S	24.8	Very low	24.3	Very low	107 Å²	107	118.4 Å²	118.4	75%	0.748	71%	0.711	S	S	*	*			trans	-133	109.7	170.7	57.3	0	0	0	0	111.1	Q1013	Q1013-S1015 PolarHBondContact O-N 2.87Å
1016	Q	22.3	Very low	24	Very low	183 Å²	183	120.4 Å²	120.4	86%	0.855	72%	0.721	S	S	*	*			trans	-63.5	150.9	174.9	-74.8	-87.7	-0.6	0	0	111.6
1017	P	21.5	Very low	23.9	Very low	109 Å²	109	126 Å²	126	71%	0.708	74%	0.737	S	S	*	*			trans	-80.8	133.6	179.4	32.4	-33.1	0	0	0	112.2
1018	Y	21.5	Very low	23.9	Very low	234 Å²	234	129.2 Å²	129.2	92%	0.918	76%	0.756	S	S	*	*			trans	-138.6	163.2	160.7	-116.9	-90.4	0	0	0	111.6
1019	S	21.4	Very low	23.8	Very low	90 Å²	90	134 Å²	134	63%	0.629	77%	0.772	S	S	*	*			trans	-87.5	133.4	-151.4	56.6	0	0	0	0	117.4
1020	S	20.9	Very low	23.7	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	78%	0.776	S	S	*	*			trans	57.4	159	133.3	69	0	0	0	0	123
1021	Q	22.5	Very low	23.7	Very low	172 Å²	172	142.4 Å²	142.4	80%	0.804	78%	0.783	S	S	*	*			trans	71.7	95.2	174.4	-53.3	-171	21.6	0	0	116.2
1022	T	20.5	Very low	23.8	Very low	118 Å²	118	142 Å²	142	72%	0.724	79%	0.785	S	S	*	*				69.3	90.9	73.4	65.8	0	0	0	0	116.5
1023	N	23.7	Very low	23.8	Very low	168 Å²	168	139.7 Å²	139.7	90%	0.898	78%	0.778	S	S	*	*				175.3	160.8	124.4	-92.6	-30.2	0	0	0	112.5
1024	G	23.2	Very low	23.9	Very low	68 Å²	68	136.6 Å²	136.6	70%	0.701	77%	0.767	S	S	*	*			trans	90.7	77.3	151.4	0	0	0	0	0	119
1025	S	22.2	Very low	24.1	Very low	111 Å²	111	138.1 Å²	138.1	78%	0.776	76%	0.761	S	S	*	*			trans	23.2	138.9	137.5	54.5	0	0	0	0	122.8
1026	S	23.9	Very low	24.3	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	75%	0.75	S	S	*	*			trans	68.1	101.4	154.3	60.1	0	0	0	0	120
1027	H	28.7	Very low	24.4	Very low	180 Å²	180	133.2 Å²	133.2	83%	0.833	74%	0.737	S	S	*	*				-159.4	80.5	122	-109.3	-69.4	0	0	0	111.8	M1029	H1027-M1029 VanDerWaalsContact C-N 3.31Å; H1027-M1029 PolarHBondContact O-N 3.47Å
1028	S	27.5	Very low	24.7	Very low	123 Å²	123	136 Å²	136	86%	0.86	74%	0.739	S	S	*	*			trans	-79.2	77.8	174.1	-167.8	0	0	0	0	110.9
1029	M	24.1	Very low	24.9	Very low	149 Å²	149	132.1 Å²	132.1	73%	0.734	73%	0.734	S	S	*	*			trans	-150.8	19.6	178.8	-128	-80	-76.3	0	0	114	H1027	H1027-M1029 VanDerWaalsContact C-N 3.31Å; H1027-M1029 PolarHBondContact O-N 3.47Å
1030	H	25.7	Very low	25.1	Very low	162 Å²	162	136.1 Å²	136.1	75%	0.75	74%	0.743	S	S	*	*	S	Bend	trans	-124.3	-6.3	-178	-110.6	-77.5	0	0	0	116
1031	Q	26.2	Very low	25.3	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.822	74%	0.74	S	S	*	*	S	Bend	trans	-88	-14.7	177.6	-81	-175.7	-32.1	0	0	114.7
1032	L	25.3	Very low	25.4	Very low	158 Å²	158	131.6 Å²	131.6	83%	0.827	74%	0.736	S	S	*	*	S	Bend	trans	-86.7	-9.3	-174.8	-84.6	166.3	0	0	0	115.5
1033	L	26	Very low	25.5	Very low	114 Å²	114	136.1 Å²	136.1	60%	0.597	74%	0.741	S	S	*	*	S	Bend	trans	-89.3	-28.7	-179.3	-75.9	166.5	0	0	0	113.8	Q1035 S1036	L1033-Q1035 VanDerWaalsContact C-N 3.31Å; L1033-Q1035 PolarHBondContact O-N 2.99Å; L1033-S1036 PolarHBondContact O-N 3.41Å; L1033-S1036 PolarHBondContact O-OG 2.82Å
1034	N	26.6	Very low	25.6	Very low	119 Å²	119	134.9 Å²	134.9	64%	0.636	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-6.2	-172.9	-88	13.3	0	0	0	115.9
1035	Q	28.1	Very low	25.7	Very low	153 Å²	153	133 Å²	133	72%	0.715	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-28	173.1	-72.7	-175.2	-16	0	0	112.7	L1033 L1037	L1033-Q1035 VanDerWaalsContact C-N 3.31Å; L1033-Q1035 PolarHBondContact O-N 2.99Å; Q1035-L1037 VanDerWaalsContact C-N 3.28Å; Q1035-L1037 PolarHBondContact O-N 2.91Å
1036	S	29.2	Very low	25.9	Very low	74 Å²	74	133.9 Å²	133.9	52%	0.517	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71	-17.2	-176.2	66.7	0	0	0	0	115.2	L1033	L1033-S1036 PolarHBondContact O-N 3.41Å; L1033-S1036 PolarHBondContact O-OG 2.82Å
1037	L	24.2	Very low	26.1	Very low	113 Å²	113	133.7 Å²	133.7	59%	0.592	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-24.3	-178.9	-99.2	165.1	0	0	0	113.8	Q1035	Q1035-L1037 VanDerWaalsContact C-N 3.28Å; Q1035-L1037 PolarHBondContact O-N 2.91Å
1038	F	27.2	Very low	26.1	Very low	168 Å²	168	134.5 Å²	134.5	74%	0.737	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-31.2	-178.9	-85.6	-86.3	0	0	0	113	Q1040 V1041	F1038-Q1040 VanDerWaalsContact C-N 3.3Å; F1038-Q1040 PolarHBondContact O-N 2.94Å; F1038-V1041 PolarHBondContact O-N 2.9Å
1039	D	26.2	Very low	26.2	Very low	152 Å²	152	135.8 Å²	135.8	81%	0.813	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-13.3	-179.6	-74.1	-25.3	0	0	0	114.1
1040	Q	24.7	Very low	26.6	Very low	175 Å²	175	137 Å²	137	82%	0.818	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-10.1	176.5	-66.5	-165.7	0.5	0	0	114	F1038 G1042	F1038-Q1040 VanDerWaalsContact C-N 3.3Å; F1038-Q1040 PolarHBondContact O-N 2.94Å; Q1040-G1042 PolarHBondContact O-N 3Å
1041	V	24.9	Very low	26.7	Very low	109 Å²	109	131.2 Å²	131.2	66%	0.661	67%	0.673	S	S	*	*	S	Bend	trans	-87.3	98.8	168.5	-177.9	0	0	0	0	107.4	F1038 Y1043	F1038-V1041 PolarHBondContact O-N 2.9Å; V1041-Y1043 PolarHBondContact O-N 2.84Å
1042	G	24.8	Very low	26.9	Very low	70 Å²	70	128.5 Å²	128.5	72%	0.722	66%	0.661	S	S	*	*			trans	-58.3	88.2	-168.4	0	0	0	0	0	115.1	Q1040 I1044	Q1040-G1042 PolarHBondContact O-N 3Å; G1042-I1044 PolarHBondContact O-N 3.21Å; G1042-I1044 VanDerWaalsContact O-N 3.11Å
1043	Y	22.8	Very low	27.3	Very low	214 Å²	214	123.8 Å²	123.8	84%	0.839	64%	0.644	S	S	*	*			trans	-69.2	102.4	168.9	-175.2	-93.6	0	0	0	109	V1041 G1045	V1041-Y1043 PolarHBondContact O-N 2.84Å; Y1043-G1045 PolarHBondContact O-N 3.21Å
1044	I	26.9	Very low	27.5	Very low	141 Å²	141	121.9 Å²	121.9	72%	0.723	64%	0.635	S	S	*	*			trans	-71	93.4	179.6	-57.6	177	0	0	0	108.6	G1042	G1042-I1044 PolarHBondContact O-N 3.21Å; G1042-I1044 VanDerWaalsContact O-N 3.11Å
1045	G	23.8	Very low	27.7	Very low	28 Å²	28	120.3 Å²	120.3	29%	0.289	64%	0.638	S	S	.	*			trans	-59	159.6	165.2	0	0	0	0	0	111.3	Y1043 N1047	Y1043-G1045 PolarHBondContact O-N 3.21Å; G1045-N1047 VanDerWaalsContact C-N 3.32Å; G1045-N1047 PolarHBondContact O-N 2.92Å
1046	P	27.3	Very low	28	Very low	130 Å²	130	118 Å²	118	84%	0.844	64%	0.639	S	S	*	*			trans	-69.9	83.5	-172.5	28.7	-35.8	0	0	0	112.4	R1048	P1046-R1048 PolarHBondContact O-N 3.25Å
1047	N	28.5	Very low	28.2	Very low	99 Å²	99	116.4 Å²	116.4	53%	0.529	63%	0.628	S	S	.	*			trans	-62.4	114.6	174.5	-84.4	-30	0	0	0	110.2	G1045 Q1049 Y1050	G1045-N1047 VanDerWaalsContact C-N 3.32Å; G1045-N1047 PolarHBondContact O-N 2.92Å; N1047-Q1049 PolarHBondContact O-N 3.1Å; N1047-Q1049 VanDerWaalsContact O-N 3.11Å; N1047-Y1050 WeakPolarHBondContact O-CB 3.29Å; N1047-Y1050 PolarHBondContact O-N 3.1Å
1048	R	27.1	Very low	28.6	Very low	198 Å²	198	119.7 Å²	119.7	75%	0.747	65%	0.646	S	S	*	*	H	α-helix	trans	-52.3	-35.4	178.9	-83	-171.9	171.9	-170.4	-2.9	113.5	P1046 Y1050 A1051 E1052	P1046-R1048 PolarHBondContact O-N 3.25Å; R1048-Y1050 PolarHBondContact O-N 3.18Å; R1048-A1051 CarbonylContact O-C 3.57Å; R1048-A1051 WeakPolarHBondContact O-CA 3.32Å; R1048-A1051 WeakPolarHBondContact O-CB 3.3Å; R1048-A1051 PolarHBondContact O-N 3.32Å; R1048-E1052 WeakPolarHBondContact O-CG 3.4Å; R1048-E1052 PolarHBondContact O-N 3.07Å
1049	Q	30	Very low	28.8	Very low	150 Å²	150	117.6 Å²	117.6	70%	0.701	64%	0.642	S	S	*	*	H	α-helix	trans	-57.6	-32.4	177.7	-68.6	173.2	-24.2	0	0	113.2	N1047 A1053	N1047-Q1049 PolarHBondContact O-N 3.1Å; N1047-Q1049 VanDerWaalsContact O-N 3.11Å; Q1049-A1053 WeakPolarHBondContact O-CB 3.49Å; Q1049-A1053 PolarHBondContact O-N 3.07Å
1050	Y	32.4	Very low	28.8	Very low	174 Å²	174	116.3 Å²	116.3	68%	0.682	64%	0.642	S	S	*	*	H	α-helix	trans	-71.8	-34.9	173.5	-104.9	-83.6	0	0	0	112.4	N1047 R1048 N1054	N1047-Y1050 WeakPolarHBondContact O-CB 3.29Å; N1047-Y1050 PolarHBondContact O-N 3.1Å; R1048-Y1050 PolarHBondContact O-N 3.18Å; Y1050-N1054 PolarHBondContact O-N 3.45Å
1051	A	28.6	Very low	29	Very low	40 Å²	40	112.6 Å²	112.6	33%	0.331	63%	0.626	S	S	.	*	H	α-helix	trans	-73.4	-39.7	175.1	0	0	0	0	0	111.7	R1048 N1054 A1055	R1048-A1051 CarbonylContact O-C 3.57Å; R1048-A1051 WeakPolarHBondContact O-CA 3.32Å; R1048-A1051 WeakPolarHBondContact O-CB 3.3Å; R1048-A1051 PolarHBondContact O-N 3.32Å; A1051-N1054 PolarHBondContact O-N 3.05Å; A1051-A1055 VanDerWaalsContact O-CB 3.29Å; A1051-A1055 WeakPolarHBondContact O-CB 3.36Å; A1051-A1055 PolarHBondContact O-N 2.96Å
1052	E	30.5	Very low	29.1	Very low	120 Å²	120	111.2 Å²	111.2	56%	0.561	62%	0.619	S	S	*	*	H	α-helix	trans	-66.6	-41	177.9	-72.7	160.2	-177.8	0	0	111.5	R1048	R1048-E1052 WeakPolarHBondContact O-CG 3.4Å; R1048-E1052 PolarHBondContact O-N 3.07Å
1053	A	33.9	Very low	29.3	Very low	58 Å²	58	113.4 Å²	113.4	48%	0.479	61%	0.614	S	S	.	*	H	α-helix	trans	-61.2	-48	173	0	0	0	0	0	112.1	Q1049 A1055 S1056	Q1049-A1053 WeakPolarHBondContact O-CB 3.49Å; Q1049-A1053 PolarHBondContact O-N 3.07Å; A1053-A1055 PolarHBondContact O-N 3.48Å; A1053-S1056 PolarHBondContact O-OG 3.44Å; A1053-S1056 PolarHBondContact O-N 3.01Å
1054	N	29	Very low	29.8	Very low	74 Å²	74	107.7 Å²	107.7	40%	0.396	61%	0.605	S	S	.	*	H	α-helix	trans	-72.9	-26.4	-178.7	-76.1	0.1	0	0	0	113.7	Y1050 A1051 S1056 S1057 M1061	Y1050-N1054 PolarHBondContact O-N 3.45Å; A1051-N1054 PolarHBondContact O-N 3.05Å; N1054-S1056 PolarHBondContact O-N 3.46Å; N1054-S1056 VanDerWaalsContact O-N 3.13Å; N1054-S1057 PolarHBondContact O-N 3.16Å; N1054-S1057 PolarHBondContact O-OG 3.4Å; N1054-M1061 HydrophobicContact CB-SD 4.19Å
1055	A	31.7	Very low	30	Very low	86 Å²	86	106.4 Å²	106.4	71%	0.711	60%	0.598	S	S	*	*	H	α-helix	trans	-61.2	-20.8	177.8	0	0	0	0	0	113.5	A1051 A1053 S1057	A1051-A1055 VanDerWaalsContact O-CB 3.29Å; A1051-A1055 WeakPolarHBondContact O-CB 3.36Å; A1051-A1055 PolarHBondContact O-N 2.96Å; A1053-A1055 PolarHBondContact O-N 3.48Å; A1055-S1057 VanDerWaalsContact C-N 3.32Å
1056	S	34.6	Very low	30.1	Very low	105 Å²	105	111.4 Å²	111.4	73%	0.734	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	6.4	173.2	67.4	0	0	0	0	114.3	A1053 N1054	A1053-S1056 PolarHBondContact O-OG 3.44Å; A1053-S1056 PolarHBondContact O-N 3.01Å; N1054-S1056 PolarHBondContact O-N 3.46Å; N1054-S1056 VanDerWaalsContact O-N 3.13Å
1057	S	32.7	Very low	29.9	Very low	41 Å²	41	112.2 Å²	112.2	29%	0.287	61%	0.611	S	S	.	*	S	Bend	trans	-124.3	129.2	179.7	71.9	0	0	0	0	111.9	N1054 A1055 L1059	N1054-S1057 PolarHBondContact O-N 3.16Å; N1054-S1057 PolarHBondContact O-OG 3.4Å; A1055-S1057 VanDerWaalsContact C-N 3.32Å; S1057-L1059 PolarHBondContact O-N 3.28Å
1058	N	32.2	Very low	29.8	Very low	181 Å²	181	113.1 Å²	113.1	97%	0.968	62%	0.622	S	S	*	*			trans	-77.6	34.6	175.1	-76	-47.6	0	0	0	112.8
1059	L	32.5	Very low	29.9	Very low	125 Å²	125	108.3 Å²	108.3	65%	0.654	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-88.9	135.6	177.2	-66.5	173.6	0	0	0	109.8	S1057 M1061	S1057-L1059 PolarHBondContact O-N 3.28Å; L1059-M1061 PolarHBondContact O-N 2.78Å
1060	P	26.2	Very low	29.7	Very low	125 Å²	125	104.5 Å²	104.5	81%	0.812	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-66.4	121.6	-178.5	25.8	-33.2	0	0	0	111.5
1061	M	27.8	Very low	29.2	Very low	97 Å²	97	107.9 Å²	107.9	48%	0.478	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-69.7	138.8	179.7	-70	-91.4	-91.1	0	0	111.5	N1054 L1059 M1065	N1054-M1061 HydrophobicContact CB-SD 4.19Å; L1059-M1061 PolarHBondContact O-N 2.78Å; M1061-M1065 HydrophobicContact CE-CE 4.32Å; M1061-M1065 HydrophobicContact CE-SD 3.41Å; M1061-M1065 WeakPolarHBondContact CE-SD 3.25Å; M1061-M1065 HydrophobicContact SD-SD 4.41Å
1062	P	28.2	Very low	29.1	Very low	80 Å²	80	113.9 Å²	113.9	52%	0.519	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-68.8	142.1	-179.1	27.5	-34.2	0	0	0	112.6	S1064 M1065	P1062-S1064 PolarHBondContact O-N 3.33Å; P1062-M1065 VanDerWaalsContact O-N 3.1Å; P1062-M1065 PolarHBondContact O-N 2.79Å
1063	L	27.8	Very low	28.8	Very low	115 Å²	115	113.2 Å²	113.2	60%	0.602	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-59.8	-20.5	-170.5	-168.5	65.7	0	0	0	114.7	M1065 L1066	L1063-M1065 PolarHBondContact O-N 3Å; L1063-M1065 VanDerWaalsContact O-N 3.1Å; L1063-L1066 HydrophobicContact CD1-CB 4.38Å; L1063-L1066 HydrophobicContact CD1-CD1 4.18Å; L1063-L1066 PolarHBondContact O-N 3.22Å
1064	S	32.9	Very low	28.2	Very low	94 Å²	94	117.4 Å²	117.4	66%	0.657	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-57.6	-21.1	174.2	50.1	0	0	0	0	113.8	P1062	P1062-S1064 PolarHBondContact O-N 3.33Å
1065	M	31.3	Very low	28.1	Very low	115 Å²	115	120 Å²	120	57%	0.567	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-87.4	-3.3	179.3	-144.1	166.1	-173.6	0	0	114	M1061 P1062 L1063	M1061-M1065 HydrophobicContact CE-CE 4.32Å; M1061-M1065 HydrophobicContact CE-SD 3.41Å; M1061-M1065 WeakPolarHBondContact CE-SD 3.25Å; M1061-M1065 HydrophobicContact SD-SD 4.41Å; P1062-M1065 VanDerWaalsContact O-N 3.1Å; P1062-M1065 PolarHBondContact O-N 2.79Å; L1063-M1065 PolarHBondContact O-N 3Å; L1063-M1065 VanDerWaalsContact O-N 3.1Å
1066	L	26.5	Very low	27.8	Very low	132 Å²	132	121.4 Å²	121.4	69%	0.691	71%	0.706	S	S	*	*	S	Bend	trans	-108.1	-2.5	-177.1	-83.6	165.5	0	0	0	114.8	L1063 P1068	L1063-L1066 HydrophobicContact CD1-CB 4.38Å; L1063-L1066 HydrophobicContact CD1-CD1 4.18Å; L1063-L1066 PolarHBondContact O-N 3.22Å; L1066-P1068 VanDerWaalsContact O-CD 3.32Å; L1066-P1068 WeakPolarHBondContact O-CD 3.47Å
1067	M	23.5	Very low	27.2	Very low	148 Å²	148	124.1 Å²	124.1	73%	0.729	71%	0.712	S	S	*	*			trans	-81.6	116	178.7	-73.9	-67.9	177.6	0	0	111.5
1068	P	26.8	Very low	26.9	Very low	118 Å²	118	129.3 Å²	129.3	77%	0.766	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-71.9	141.2	177.1	-15.1	31.3	0	0	0	111.3	L1066 G1070	L1066-P1068 VanDerWaalsContact O-CD 3.32Å; L1066-P1068 WeakPolarHBondContact O-CD 3.47Å; P1068-G1070 PolarHBondContact O-N 3.24Å
1069	A	29.5	Very low	26.6	Very low	96 Å²	96	123.7 Å²	123.7	79%	0.793	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-60.4	127.9	177.4	0	0	0	0	0	111.6	R1071	A1069-R1071 PolarHBondContact O-N 3.38Å
1070	G	24.8	Very low	26.2	Very low	70 Å²	70	125.5 Å²	125.5	72%	0.722	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-60.6	129.2	176.2	0	0	0	0	0	111.4	P1068 I1072	P1068-G1070 PolarHBondContact O-N 3.24Å; G1070-I1072 PolarHBondContact O-N 3.4Å
1071	R	22	Very low	26.1	Very low	246 Å²	246	124.6 Å²	124.6	93%	0.928	73%	0.731	S	S	*	*			trans	-65.5	113.9	178.4	-65.2	178.8	180	178.2	-0.4	110.1	A1069	A1069-R1071 PolarHBondContact O-N 3.38Å
1072	I	27.3	Very low	26	Very low	166 Å²	166	129.8 Å²	129.8	85%	0.851	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-94.5	123.1	161.6	-61.2	-179.5	0	0	0	107.6	G1070	G1070-I1072 PolarHBondContact O-N 3.4Å
1073	S	24.4	Very low	25.8	Very low	105 Å²	105	129.4 Å²	129.4	73%	0.734	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-70.4	137.1	-174.5	-53.5	0	0	0	0	112.2	P1075	S1073-P1075 VanDerWaalsContact O-CD 3.26Å; S1073-P1075 WeakPolarHBondContact O-CD 3.48Å
1074	N	21.5	Very low	25.4	Very low	146 Å²	146	129.6 Å²	129.6	78%	0.781	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65.4	121.4	168.1	-82.1	-17.3	0	0	0	110.9	T1076	N1074-T1076 PolarHBondContact O-N 3.34Å
1075	P	26	Very low	25	Very low	130 Å²	130	131.1 Å²	131.1	84%	0.844	78%	0.783	S	S	*	*			trans	-80.6	92.4	161.1	33.3	-30.2	0	0	0	108.9	S1073	S1073-P1075 VanDerWaalsContact O-CD 3.26Å; S1073-P1075 WeakPolarHBondContact O-CD 3.48Å
1076	T	24.5	Very low	24.6	Very low	115 Å²	115	129 Å²	129	71%	0.706	79%	0.792	S	S	*	*			trans	-68.3	135.3	173.5	46.2	0	0	0	0	111.8	N1074	N1074-T1076 PolarHBondContact O-N 3.34Å
1077	N	22.8	Very low	24.3	Very low	161 Å²	161	132 Å²	132	86%	0.861	80%	0.801	S	S	*	*			trans	42.9	93.7	157.9	-68.4	-11.5	0	0	0	117.8
1078	V	26.7	Very low	24.4	Very low	151 Å²	151	135.3 Å²	135.3	92%	0.915	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-103.9	116.7	141.3	-177	0	0	0	0	106.5
1079	G	24.8	Very low	24.1	Very low	62 Å²	62	132.7 Å²	132.7	64%	0.639	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.1	156.3	-173.2	0	0	0	0	0	113.8	P1081	G1079-P1081 WeakPolarHBondContact O-CD 3.38Å
1080	N	24.3	Very low	23.8	Very low	164 Å²	164	136.6 Å²	136.6	88%	0.877	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.1	123.3	170.2	-84	3	0	0	0	111.2
1081	P	25	Very low	23.7	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-88.5	117.4	167.1	33.5	-28.1	0	0	0	110	G1079	G1079-P1081 WeakPolarHBondContact O-CD 3.38Å
1082	F	25.9	Very low	23.7	Very low	205 Å²	205	134.1 Å²	134.1	90%	0.899	81%	0.81	S	S	*	*			trans	65.3	153.8	176.4	-51.9	-83.4	0	0	0	115.8
1083	G	22.7	Very low	23.8	Very low	72 Å²	72	137.5 Å²	137.5	74%	0.742	81%	0.814	S	S	*	*			cis	167.8	136.8	-8.6	0	0	0	0	0	111.4
1084	S	21.2	Very low	23.7	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	81%	0.81	S	S	*	*			trans	-68.8	145.2	-179.3	-45.6	0	0	0	0	112.9
1085	S	23.2	Very low	23.9	Very low	125 Å²	125	134.4 Å²	134.4	87%	0.874	81%	0.809	S	S	*	*			trans	155.7	156.3	130.4	-71.9	0	0	0	0	113.4
1086	G	23	Very low	23.8	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	81%	0.805	S	S	*	*			trans	77.6	108.8	169.2	0	0	0	0	0	113.7
1087	H	20.6	Very low	23.7	Very low	193 Å²	193	137.2 Å²	137.2	89%	0.894	81%	0.812	S	S	*	*			cis	65.8	79.6	34.9	-133.3	70.7	0	0	0	113.2
1088	F	25.4	Very low	23.8	Very low	219 Å²	219	132.9 Å²	132.9	96%	0.961	81%	0.805	S	S	*	*			trans	-141.4	152.2	152.5	-106.3	-79.7	0	0	0	109.1
1089	G	21	Very low	23.8	Very low	62 Å²	62	130.7 Å²	130.7	64%	0.639	80%	0.802	S	S	*	*			trans	-159.9	-173.7	175.3	0	0	0	0	0	110.9
1090	N	22.3	Very low	23.7	Very low	178 Å²	178	132.7 Å²	132.7	95%	0.952	81%	0.813	S	S	*	*			trans	72	148	179.9	-141.4	1.4	0	0	0	114.5
1091	G	22.4	Very low	23.7	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	81%	0.807	S	S	*	*			trans	140.1	84.4	175.6	0	0	0	0	0	115.5
1092	K	22	Very low	24.4	Very low	192 Å²	192	129.7 Å²	129.7	84%	0.835	81%	0.81	S	S	*	*			trans	-72.7	133.5	172	-54.7	167.5	-179.3	174.2	0	110.9
1093	Y	29.7	Very low	24.6	Very low	237 Å²	237	128.5 Å²	128.5	93%	0.929	81%	0.812	S	S	*	*			trans	-168.9	145.2	139.2	-81	-62.6	0	0	0	108.9
1094	G	22.9	Very low	24.6	Very low	63 Å²	63	128 Å²	128	65%	0.649	81%	0.808	S	S	*	*			cis	134.1	50.4	-15.7	0	0	0	0	0	117.4
1095	T	26.1	Very low	24.8	Very low	124 Å²	124	134.1 Å²	134.1	76%	0.761	81%	0.812	S	S	*	*			trans	-169.7	126.8	165.1	17.6	0	0	0	0	107.7
1096	N	24.2	Very low	24.7	Very low	144 Å²	144	133 Å²	133	77%	0.77	81%	0.805	S	S	*	*				81.5	142	73.3	-73.7	1.4	0	0	0	114.6
1097	L	22.7	Very low	25	Very low	160 Å²	160	137.4 Å²	137.4	84%	0.838	81%	0.809	S	S	*	*			cis	-168.6	145	-23.7	-161.3	134.3	0	0	0	110.5
1098	G	23.8	Very low	25	Very low	69 Å²	69	136.7 Å²	136.7	71%	0.711	81%	0.806	S	S	*	*			trans	77.5	161.9	170.3	0	0	0	0	0	115.4
1099	A	26.2	Very low	25	Very low	105 Å²	105	130.3 Å²	130.3	87%	0.868	79%	0.794	S	S	*	*			cis	-166.9	155	-8.3	0	0	0	0	0	107.6
1100	A	22.9	Very low	25.4	Very low	104 Å²	104	135.9 Å²	135.9	86%	0.86	81%	0.808	S	S	*	*			cis	-147.5	-141.7	-0.6	0	0	0	0	0	110.8
1101	A	23.7	Very low	25.4	Very low	91 Å²	91	130.8 Å²	130.8	75%	0.752	80%	0.798	S	S	*	*			trans	-146.7	-167.4	175.6	0	0	0	0	0	108.4
1102	P	41.1	Very low	25.8	Very low	116 Å²	116	133.2 Å²	133.2	75%	0.753	80%	0.801	S	S	*	*			cis	-138.7	179.2	-4.4	43.3	-26.2	0	0	0	115.8
1103	L	29.3	Very low	26	Very low	180 Å²	180	132.4 Å²	132.4	94%	0.942	80%	0.804	S	S	*	*			trans	169.2	137.2	141.1	-94.2	166.4	0	0	0	109.1
1104	G	23	Very low	25.6	Very low	63 Å²	63	128.2 Å²	128.2	65%	0.649	80%	0.798	S	S	*	*			cis	163.4	124.2	-12	0	0	0	0	0	113
1105	R	25.1	Very low	25.8	Very low	247 Å²	247	132.1 Å²	132.1	93%	0.932	81%	0.809	S	S	*	*			trans	75.4	132	-179	-55.4	179	173.4	-173.5	-3	116.3
1106	S	21	Very low	25.7	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	81%	0.811	S	S	*	*			cis	93.2	99.6	1.6	93.6	0	0	0	0	120.2
1107	I	28.8	Very low	26.7	Very low	163 Å²	163	132 Å²	132	84%	0.836	80%	0.803	S	S	*	*			trans	-147.7	117.3	153.2	-68.8	-173.5	0	0	0	103.9
1108	Q	22.3	Very low	26.7	Very low	178 Å²	178	131 Å²	131	83%	0.832	80%	0.798	S	S	*	*			cis	70.5	132.5	49.9	-72.8	-170.1	-18.3	0	0	114.3
1109	A	24.7	Very low	26.8	Very low	85 Å²	85	138 Å²	138	70%	0.702	81%	0.805	S	S	*	*			cis	-160.7	-165.9	-3.8	0	0	0	0	0	110.6
1110	L	28.6	Very low	26.7	Very low	179 Å²	179	137.6 Å²	137.6	94%	0.937	80%	0.795	S	S	*	*			trans	102.8	110.6	168.2	-56.5	175	0	0	0	117.5
1111	G	22.5	Very low	26.7	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	80%	0.798	S	S	*	*			trans	-109.4	-141.1	145.5	0	0	0	0	0	108.2
1112	P	32	Very low	26.7	Very low	124 Å²	124	146.1 Å²	146.1	81%	0.805	81%	0.807	S	S	*	*			cis	-128.7	-177.4	-9	42.5	-28.4	0	0	0	112.8
1113	L	25	Very low	25.9	Very low	174 Å²	174	147.9 Å²	147.9	91%	0.911	81%	0.81	S	S	*	*			trans	-165.5	147.6	142.5	-110.4	168.5	0	0	0	111.5
1114	N	20.8	Very low	25.6	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	81%	0.805	S	S	*	*			trans	-99.1	158.4	-179.7	-67.2	-57.1	0	0	0	111.8
1115	V	28.5	Very low	25.7	Very low	145 Å²	145	146 Å²	146	88%	0.879	81%	0.806	S	S	*	*				-166.4	145.9	129.8	146.1	0	0	0	0	109.5
1116	H	24.3	Very low	25.7	Very low	173 Å²	173	140.1 Å²	140.1	80%	0.801	80%	0.803	S	S	*	*			trans	-99.7	175.7	177.7	-104.5	-118	0	0	0	110.4
1117	P	43.6	Very low	25.9	Very low	91 Å²	91	142 Å²	142	59%	0.591	81%	0.81	S	S	*	*			cis	-138.6	-166.1	-44.6	38.7	-19.5	0	0	0	113.4
1118	N	23.1	Very low	25.6	Very low	140 Å²	140	145.5 Å²	145.5	75%	0.749	81%	0.813	S	S	*	*			trans	97.4	143.5	157	-62.2	-18	0	0	0	120.6
1119	Y	25.4	Very low	25.6	Very low	216 Å²	216	141.5 Å²	141.5	85%	0.847	81%	0.811	S	S	*	*			trans	63.8	80.1	173.5	-72.3	-75.7	0	0	0	120.2
1120	S	24.5	Very low	26.1	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	82%	0.819	S	S	*	*				44.9	113.5	125.6	61.1	0	0	0	0	121.2
1121	Q	24.6	Very low	26.1	Very low	195 Å²	195	139.4 Å²	139.4	91%	0.911	82%	0.816	S	S	*	*			trans	58.8	76.4	143.8	-59.4	-169.3	9.9	0	0	118.1
1122	L	22.7	Very low	26.2	Very low	180 Å²	180	139.5 Å²	139.5	94%	0.942	82%	0.817	S	S	*	*			trans	-87.3	125.8	139.6	-79.5	163.8	0	0	0	108.9
1123	N	24.4	Very low	26.3	Very low	153 Å²	153	139.5 Å²	139.5	82%	0.818	82%	0.817	S	S	*	*			trans	-124.7	135.3	161.5	-167.5	4.7	0	0	0	107.9	G1125	N1123-G1125 VanDerWaalsContact O-N 3.08Å; N1123-G1125 PolarHBondContact O-N 3.28Å
1124	T	23.7	Very low	26.5	Very low	137 Å²	137	139.7 Å²	139.7	84%	0.84	82%	0.818	S	S	*	*			trans	-82.4	92.8	-161	48.5	0	0	0	0	112.6
1125	G	24.4	Very low	26.9	Very low	65 Å²	65	138.1 Å²	138.1	67%	0.67	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-79.3	145.7	164.9	0	0	0	0	0	112.3	N1123 T1127	N1123-G1125 VanDerWaalsContact O-N 3.08Å; N1123-G1125 PolarHBondContact O-N 3.28Å; G1125-T1127 PolarHBondContact O-N 3.43Å
1126	S	25.5	Very low	26.6	Very low	124 Å²	124	134.7 Å²	134.7	87%	0.867	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.5	123	-176.8	-176.9	0	0	0	0	112.9	R1128	S1126-R1128 PolarHBondContact O-N 2.99Å
1127	T	24.9	Very low	26.6	Very low	142 Å²	142	134.4 Å²	134.4	87%	0.871	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.7	118.1	175.7	47.5	0	0	0	0	111.9	G1125	G1125-T1127 PolarHBondContact O-N 3.43Å
1128	R	21.6	Very low	25.7	Very low	237 Å²	237	134.3 Å²	134.3	89%	0.894	82%	0.816	S	S	*	*			trans	-131.1	164.5	168.3	-156.1	-176.5	-167.5	-164.6	5.8	108.4	S1126	S1126-R1128 PolarHBondContact O-N 2.99Å
1129	A	22.6	Very low	25.9	Very low	95 Å²	95	134.1 Å²	134.1	79%	0.785	82%	0.82	S	S	*	*			trans	77.1	161.2	-177.7	0	0	0	0	0	113.9
1130	P	35.5	Very low	26.4	Very low	134 Å²	134	130 Å²	130	87%	0.87	82%	0.819	S	S	*	*			cis	-119.8	164.5	6.8	40.4	-27.4	0	0	0	116.3
1131	G	28.1	Very low	26.3	Very low	85 Å²	85	129 Å²	129	88%	0.876	82%	0.824	S	S	*	*			trans	165.3	58.8	178.3	0	0	0	0	0	112.8
1132	G	24.4	Very low	26.3	Very low	73 Å²	73	125.4 Å²	125.4	75%	0.753	82%	0.821	S	S	*	*			trans	-89.5	168.1	-175.9	0	0	0	0	0	114.9
1133	P	35.2	Very low	26.4	Very low	125 Å²	125	121.2 Å²	121.2	81%	0.812	81%	0.812	S	S	*	*			trans	-93.1	157.8	-172.9	36.9	-35.8	0	0	0	114.5
1134	L	28.4	Very low	26.3	Very low	177 Å²	177	118.2 Å²	118.2	93%	0.927	81%	0.808	S	S	*	*			trans	-139.8	155.1	161.5	-77.2	178.3	0	0	0	111.1
1135	P	29.3	Very low	26.4	Very low	118 Å²	118	117.7 Å²	117.7	77%	0.766	81%	0.807	S	S	*	*			trans	-109.6	152.4	-165.6	39.7	-32.7	0	0	0	116.2
1136	G	21.6	Very low	26.3	Very low	73 Å²	73	125.3 Å²	125.3	75%	0.753	82%	0.816	S	S	*	*			trans	32.1	117.3	149.1	0	0	0	0	0	122.2
1137	N	25.8	Very low	26.3	Very low	167 Å²	167	130.5 Å²	130.5	89%	0.893	82%	0.818	S	S	*	*				-156.4	164.6	118.8	-122.4	-18.4	0	0	0	114.7
1138	S	23.2	Very low	26.2	Very low	88 Å²	88	130.8 Å²	130.8	62%	0.615	81%	0.814	S	S	*	*			trans	-85.1	173.7	-162.8	44.3	0	0	0	0	117.1
1139	V	29	Very low	26.4	Very low	137 Å²	137	122.8 Å²	122.8	83%	0.83	80%	0.804	S	S	*	*			trans	68.5	157.7	163.1	-88.5	0	0	0	0	119.1
1140	P	34.5	Very low	26.6	Very low	128 Å²	128	126.7 Å²	126.7	83%	0.831	81%	0.812	S	S	*	*				-137.2	176.6	-129	44.5	-27.2	0	0	0	117.8
1141	G	23	Very low	26.1	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	80%	0.804	S	S	*	*			trans	142.1	157	146.9	0	0	0	0	0	118
1142	S	24.7	Very low	25.9	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	81%	0.805	S	S	*	*			trans	73.9	100.7	162.3	-147	0	0	0	0	121
1143	A	24.6	Very low	25.9	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	81%	0.811	S	S	*	*				46.6	111.8	129.6	0	0	0	0	0	122.6
1144	A	22.8	Very low	25.4	Very low	91 Å²	91	141 Å²	141	75%	0.752	81%	0.814	S	S	*	*			trans	40.5	106.9	130.1	0	0	0	0	0	119.8	R1146	A1144-R1146 PolarHBondContact O-N 3.07Å
1145	P	26.4	Very low	25.2	Very low	126 Å²	126	139.9 Å²	139.9	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-74.9	117.4	175.8	30.6	-33.8	0	0	0	112.7
1146	R	20.6	Very low	24.9	Very low	225 Å²	225	142.9 Å²	142.9	85%	0.849	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-75.3	124.4	154.8	-76.5	179.4	171.1	171.2	-2.7	108.8	A1144	A1144-R1146 PolarHBondContact O-N 3.07Å
1147	Y	25.8	Very low	25.1	Very low	232 Å²	232	144.1 Å²	144.1	91%	0.91	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-89.7	129	156.8	-109.6	-87.1	0	0	0	110.1
1148	L	23.7	Very low	24.8	Very low	149 Å²	149	141.3 Å²	141.3	78%	0.78	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-102.9	148.3	-172.8	-142.2	85.5	0	0	0	110.8
1149	G	24.6	Very low	24.8	Very low	68 Å²	68	142.1 Å²	142.1	70%	0.701	81%	0.814	S	S	*	*			trans	78.7	110.8	138.3	0	0	0	0	0	118.3
1150	N	27.6	Very low	24.5	Very low	177 Å²	177	143.5 Å²	143.5	95%	0.947	81%	0.811	S	S	*	*				-137.6	142.4	121.9	-136.2	-26	0	0	0	109.3
1151	A	24.2	Very low	23.9	Very low	85 Å²	85	144 Å²	144	70%	0.702	81%	0.807	S	S	*	*			trans	-148.7	129	-162.7	0	0	0	0	0	114.7
1152	R	25	Very low	23.8	Very low	239 Å²	239	147.2 Å²	147.2	90%	0.902	81%	0.811	S	S	*	*			trans	-163.3	116.2	156.6	-100	156	-171.6	-152.9	0.8	106.6
1153	R	23.6	Very low	23.6	Very low	230 Å²	230	146.4 Å²	146.4	87%	0.868	81%	0.806	S	S	*	*				52	110.5	92.3	-68.8	-170.5	-176.8	-179.2	1.3	111.3
1154	N	25	Very low	23.4	Very low	163 Å²	163	149.3 Å²	149.3	87%	0.872	81%	0.814	S	S	*	*				-148.5	-175.6	63.2	-103.3	-4.3	0	0	0	114.9
1155	L	23.3	Very low	23.4	Very low	155 Å²	155	148.5 Å²	148.5	81%	0.812	81%	0.814	S	S	*	*			trans	-130.8	162.1	-169.3	-110.4	154.4	0	0	0	111.4
1156	Q	24.1	Very low	23.2	Very low	180 Å²	180	147.5 Å²	147.5	84%	0.841	82%	0.817	S	S	*	*			trans	75.3	163.6	157.1	-73	172.4	-27.5	0	0	121.1
1157	A	24.8	Very low	23.5	Very low	99 Å²	99	141.1 Å²	141.1	82%	0.818	81%	0.812	S	S	*	*			trans	82.5	81.9	160.7	0	0	0	0	0	119.5
1158	S	20.3	Very low	23.4	Very low	109 Å²	109	140 Å²	140	76%	0.762	81%	0.812	S	S	*	*			trans	-55.4	144.9	146.5	48.6	0	0	0	0	114.1
1159	S	23.3	Very low	23.3	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	81%	0.808	S	S	*	*				151.7	133.7	127.6	-69.3	0	0	0	0	115.1
1160	Q	23.4	Very low	23.4	Very low	166 Å²	166	145.1 Å²	145.1	78%	0.776	82%	0.815	S	S	*	*			trans	49.5	123.4	139.2	-61.2	-171.3	4.4	0	0	123.2
1161	N	21.1	Very low	23.1	Very low	140 Å²	140	144.6 Å²	144.6	75%	0.749	81%	0.807	S	S	*	*				78.4	135.3	125.5	-73.4	-10.1	0	0	0	124.3
1162	V	21.7	Very low	23.2	Very low	141 Å²	141	148.4 Å²	148.4	86%	0.855	81%	0.814	S	S	*	*			trans	83	142	146.5	170.1	0	0	0	0	119.1
1163	S	19.7	Very low	23.2	Very low	105 Å²	105	144 Å²	144	73%	0.734	81%	0.808	S	S	*	*			trans	-98	155.5	-169.2	51.2	0	0	0	0	114.4
1164	V	21.4	Very low	23.1	Very low	152 Å²	152	136.3 Å²	136.3	92%	0.921	80%	0.801	S	S	*	*			trans	-173.6	147.7	142.4	135.2	0	0	0	0	110.8
1165	G	22.7	Very low	23.1	Very low	73 Å²	73	135.3 Å²	135.3	75%	0.753	80%	0.803	S	S	*	*			trans	90.2	121.4	168.2	0	0	0	0	0	115.1
1166	A	21.7	Very low	23	Very low	106 Å²	106	133.6 Å²	133.6	88%	0.876	80%	0.804	S	S	*	*			cis	106.8	101.8	13.5	0	0	0	0	0	115.6
1167	A	25.4	Very low	23.1	Very low	91 Å²	91	130 Å²	130	75%	0.752	80%	0.799	S	S	*	*			trans	-170.9	122.4	149.1	0	0	0	0	0	113.9
1168	K	24.2	Very low	23.1	Very low	209 Å²	209	132.5 Å²	132.5	91%	0.909	80%	0.797	S	S	*	*			trans	51.3	146.9	136.6	-62.9	175.2	-177.1	175.7	0	121.3
1169	S	22.9	Very low	23.1	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	80%	0.797	S	S	*	*			cis	-174.8	168.8	-16.1	-170.6	0	0	0	0	110.2
1170	R	25	Very low	23.1	Very low	224 Å²	224	136.2 Å²	136.2	85%	0.845	81%	0.805	S	S	*	*			trans	72.4	116.4	176.8	-57.9	178.2	174.2	174.1	-3.4	114.7
1171	Q	21.4	Very low	22.9	Very low	166 Å²	166	134.7 Å²	134.7	78%	0.776	81%	0.807	S	S	*	*			cis	78.7	110.1	48.4	-67.5	-177.7	-74.2	0	0	114.8
1172	I	27.7	Very low	22.8	Very low	166 Å²	166	133.9 Å²	133.9	85%	0.851	81%	0.812	S	S	*	*				-153.1	162.3	114.2	-96.9	159.5	0	0	0	107.1
1173	D	25.2	Very low	22.8	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	81%	0.81	S	S	*	*			trans	-80.9	165.1	-153.9	-54.9	-87.3	0	0	0	117
1174	G	20.2	Very low	22.8	Very low	69 Å²	69	137.2 Å²	137.2	71%	0.711	82%	0.816	S	S	*	*			trans	-91.5	-168.3	176.5	0	0	0	0	0	114.2
1175	P	26.5	Very low	22.7	Very low	141 Å²	141	141.3 Å²	141.3	92%	0.916	82%	0.815	S	S	*	*				-128.1	160.6	104.1	37.5	-33.8	0	0	0	113.8
1176	S	20.4	Very low	22.6	Very low	120 Å²	120	141.5 Å²	141.5	84%	0.839	82%	0.817	S	S	*	*			trans	-114.2	149.4	175.7	52.7	0	0	0	0	111.1
1177	S	25.5	Very low	22.7	Very low	105 Å²	105	144 Å²	144	73%	0.734	82%	0.815	S	S	*	*			trans	-165.1	114.2	151.9	-176.6	0	0	0	0	112.8
1178	L	24.6	Very low	23.6	Very low	150 Å²	150	144 Å²	144	79%	0.785	81%	0.808	S	S	*	*			trans	46.5	109.9	142.4	-59.3	173.1	0	0	0	120.3
1179	T	20.3	Very low	23.6	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	80%	0.804	S	S	*	*			trans	-20.1	141	131.3	49.9	0	0	0	0	115.9
1180	N	23.6	Very low	23.7	Very low	169 Å²	169	142.2 Å²	142.2	90%	0.904	81%	0.805	S	S	*	*			trans	-145.8	135.5	149.7	-121.1	-19.3	0	0	0	111.5
1181	V	19	Very low	23.6	Very low	133 Å²	133	135.9 Å²	135.9	81%	0.806	80%	0.795	S	S	*	*			trans	-134	120.2	174.3	174.8	0	0	0	0	107.5
1182	S	20.7	Very low	23.9	Very low	124 Å²	124	135.2 Å²	135.2	87%	0.867	80%	0.797	S	S	*	*			trans	-175.1	165.7	152.5	-88.2	0	0	0	0	112.1
1183	V	19.9	Very low	23.8	Very low	134 Å²	134	132.4 Å²	132.4	81%	0.812	79%	0.792	S	S	*	*			trans	-116.4	126.6	-174.5	172.5	0	0	0	0	110.7
1184	E	21.4	Very low	23.8	Very low	181 Å²	181	129.2 Å²	129.2	85%	0.846	79%	0.793	S	S	*	*			trans	-135.2	132.7	155.7	-67.1	-162.6	117.6	0	0	107.1
1185	R	18.9	Very low	24	Very low	238 Å²	238	131.1 Å²	131.1	90%	0.898	80%	0.802	S	S	*	*				60.6	125.1	63.7	-69.5	-171.8	169.6	-158.6	-1.2	112.4
1186	G	20.5	Very low	23.8	Very low	77 Å²	77	127.8 Å²	127.8	79%	0.794	79%	0.794	S	S	*	*			trans	-160.4	-55.5	-175.4	0	0	0	0	0	117.7
1187	N	23.2	Very low	24	Very low	158 Å²	158	129.9 Å²	129.9	85%	0.845	79%	0.794	S	S	*	*			trans	70.2	-168.7	-179.3	-141.8	20.2	0	0	0	113.8
1188	P	43.9	Very low	23.8	Very low	92 Å²	92	131.8 Å²	131.8	60%	0.597	80%	0.796	S	S	*	*				-130.8	168.3	-116.1	42.1	-24.1	0	0	0	117.2
1189	N	23.8	Very low	23.8	Very low	154 Å²	154	129.7 Å²	129.7	82%	0.824	79%	0.794	S	S	*	*			trans	170.1	153.7	153.1	-90.2	-27.4	0	0	0	108.5
1190	T	26.1	Very low	23.9	Very low	117 Å²	117	132.7 Å²	132.7	72%	0.718	80%	0.799	S	S	*	*			cis	-155.6	143.1	4.6	-2.7	0	0	0	0	112.1
1191	S	23.7	Very low	24	Very low	91 Å²	91	130.7 Å²	130.7	64%	0.636	80%	0.795	S	S	*	*			trans	27.7	118.5	146.4	61.9	0	0	0	0	123.4
1192	N	25.8	Very low	24.1	Very low	151 Å²	151	127.6 Å²	127.6	81%	0.807	79%	0.79	S	S	*	*				158.8	144.2	118.6	-81.7	-11.1	0	0	0	111.5
1193	S	25.5	Very low	24.1	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	79%	0.794	S	S	*	*			cis	-165.4	143.4	-17.5	-89.7	0	0	0	0	110.2
1194	G	26.5	Very low	24.3	Very low	78 Å²	78	128.5 Å²	128.5	80%	0.804	79%	0.787	S	S	*	*			trans	80	113.3	174.6	0	0	0	0	0	114.6
1195	A	23.8	Very low	24.2	Very low	109 Å²	109	128.7 Å²	128.7	90%	0.901	79%	0.788	S	S	*	*			cis	91.4	121.7	20.8	0	0	0	0	0	115.8
1196	G	23.6	Very low	24.5	Very low	72 Å²	72	127.6 Å²	127.6	74%	0.742	79%	0.79	S	S	*	*			trans	100.2	68.6	178.1	0	0	0	0	0	114.5
1197	L	23	Very low	24.4	Very low	163 Å²	163	129.5 Å²	129.5	85%	0.853	79%	0.792	S	S	*	*				63.3	124.3	77.4	-80	172	0	0	0	117.6
1198	L	22.8	Very low	24.4	Very low	145 Å²	145	125.2 Å²	125.2	76%	0.759	79%	0.785	S	S	*	*			trans	92.4	110.6	144.9	-73.4	164.2	0	0	0	123.2
1199	S	23.7	Very low	23.6	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	79%	0.793	S	S	*	*				80.4	137.9	127	61.6	0	0	0	0	122.9
1200	Q	21.6	Very low	23.5	Very low	187 Å²	187	128.7 Å²	128.7	87%	0.874	80%	0.797	S	S	*	*			trans	-64.6	150.8	159.9	-60.7	170.2	-32	0	0	110.8
1201	P	26.5	Very low	23.4	Very low	127 Å²	127	126.1 Å²	126.1	83%	0.825	79%	0.794	S	S	*	*				-134.2	-177.9	94.3	37.6	-26.8	0	0	0	112.1
1202	G	21.1	Very low	23.3	Very low	67 Å²	67	128 Å²	128	69%	0.691	80%	0.802	S	S	*	*			cis	138.3	92.2	-9.2	0	0	0	0	0	114.8
1203	L	21.7	Very low	23.5	Very low	180 Å²	180	127 Å²	127	94%	0.942	81%	0.806	S	S	*	*			trans	69.9	173.3	157	-71.5	170.2	0	0	0	121.1
1204	S	22.5	Very low	23.3	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	81%	0.805	S	S	*	*			trans	70.3	94.6	173.3	43.6	0	0	0	0	119.4
1205	E	19.7	Very low	23.2	Very low	186 Å²	186	129.8 Å²	129.8	87%	0.869	81%	0.81	S	S	*	*				27.8	129.7	116.5	-59.2	175.5	118.2	0	0	119.9
1206	F	25	Very low	23.2	Very low	215 Å²	215	130.1 Å²	130.1	94%	0.943	81%	0.805	S	S	*	*			trans	-134.7	145.6	147.9	-112.7	-89.2	0	0	0	110.4
1207	S	19.8	Very low	23.1	Very low	117 Å²	117	129.8 Å²	129.8	82%	0.818	80%	0.803	S	S	*	*			trans	-143.4	158.9	179.9	62.6	0	0	0	0	111.4
1208	G	22.3	Very low	23.3	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	81%	0.807	S	S	*	*			trans	101.9	154	-174.9	0	0	0	0	0	113.8
1209	T	26.3	Very low	23.2	Very low	125 Å²	125	126.9 Å²	126.9	77%	0.767	80%	0.801	S	S	*	*			cis	-158.5	139.2	-0.6	25.9	0	0	0	0	112.4
1210	Q	22.2	Very low	23.2	Very low	194 Å²	194	128.2 Å²	128.2	91%	0.907	81%	0.805	S	S	*	*			trans	51.5	145.1	137.2	-59.8	179.1	-11.1	0	0	123.4
1211	G	25.2	Very low	23.2	Very low	63 Å²	63	128.9 Å²	128.9	65%	0.649	81%	0.805	S	S	*	*			trans	127	75.4	156.8	0	0	0	0	0	115.7
1212	T	21.6	Very low	23.2	Very low	131 Å²	131	128.9 Å²	128.9	80%	0.804	81%	0.808	S	S	*	*				81.5	131.3	69.7	64.8	0	0	0	0	116.8
1213	S	28.4	Very low	23.2	Very low	129 Å²	129	131.2 Å²	131.2	90%	0.902	81%	0.813	S	S	*	*			trans	72	145.8	177.5	76.2	0	0	0	0	117.3
1214	G	22.4	Very low	23.2	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	81%	0.81	S	S	*	*			cis	168.1	131.9	-13.9	0	0	0	0	0	116.1
1215	L	24.8	Very low	23.1	Very low	173 Å²	173	132.1 Å²	132.1	91%	0.906	82%	0.815	S	S	*	*			trans	80	139.8	164.6	-62.2	172.7	0	0	0	121.8
1216	S	23.2	Very low	23.2	Very low	116 Å²	116	133.7 Å²	133.7	81%	0.811	81%	0.812	S	S	*	*			trans	44.9	119.5	153.7	54.8	0	0	0	0	119.5
1217	G	22	Very low	23.1	Very low	66 Å²	66	132 Å²	132	68%	0.68	81%	0.813	S	S	*	*			cis	133.5	152.5	35.4	0	0	0	0	0	108.8
1218	I	26.4	Very low	23.4	Very low	185 Å²	185	131.5 Å²	131.5	95%	0.949	81%	0.81	S	S	*	*			trans	68.8	130.6	-167.2	-45.3	168	0	0	0	112
1219	G	21.7	Very low	23.4	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	81%	0.813	S	S	*	*			cis	162.9	168.8	-6.5	0	0	0	0	0	111.8
1220	V	23.3	Very low	23.5	Very low	135 Å²	135	134.6 Å²	134.6	82%	0.818	82%	0.822	S	S	*	*			trans	79.5	132.7	168.4	-167.8	0	0	0	0	117.6
1221	F	21.5	Very low	23.6	Very low	200 Å²	200	131 Å²	131	88%	0.877	82%	0.819	S	S	*	*			trans	-3.8	123.8	176.7	-57.7	-67.6	0	0	0	122.7
1222	S	25.3	Very low	23.5	Very low	128 Å²	128	131.4 Å²	131.4	90%	0.895	82%	0.823	S	S	*	*				-159.9	149.7	113	48.8	0	0	0	0	111
1223	S	22.9	Very low	23.7	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	83%	0.827	S	S	*	*			trans	-110.8	101.4	-168.8	54.9	0	0	0	0	112.8
1224	Q	20.3	Very low	23.6	Very low	184 Å²	184	131.9 Å²	131.9	86%	0.86	82%	0.817	S	S	*	*			trans	-144.8	149.7	165.8	-71.7	-163.6	3.2	0	0	112.3
1225	S	21	Very low	23.7	Very low	112 Å²	112	136.4 Å²	136.4	78%	0.783	82%	0.82	S	S	*	*			trans	68.2	151.7	-177.8	86.5	0	0	0	0	114.7
1226	R	21.8	Very low	23.7	Very low	219 Å²	219	135.9 Å²	135.9	83%	0.826	81%	0.812	S	S	*	*			cis	-131.9	136.5	11.9	-64	174.5	176.2	179.6	-3.5	111.7
1227	N	22.1	Very low	23.8	Very low	180 Å²	180	136.4 Å²	136.4	96%	0.963	82%	0.816	S	S	*	*			trans	-87	107.9	153.8	-110.2	6.8	0	0	0	108.6
1228	S	25.8	Very low	24	Very low	106 Å²	106	139.6 Å²	139.6	74%	0.741	82%	0.822	S	S	*	*			trans	-128.8	132	161.2	52.2	0	0	0	0	106.6
1229	G	22.4	Very low	23.7	Very low	75 Å²	75	136 Å²	136	77%	0.773	81%	0.814	S	S	*	*			cis	144.3	93.3	8.8	0	0	0	0	0	107.6
1230	L	30.3	Very low	23.8	Very low	183 Å²	183	140.9 Å²	140.9	96%	0.958	83%	0.825	S	S	*	*			trans	-123.7	139.8	176.8	-82.7	172.7	0	0	0	109.9
1231	S	23.9	Very low	23.7	Very low	120 Å²	120	141.4 Å²	141.4	84%	0.839	82%	0.823	S	S	*	*			trans	-113	140.9	-161.7	54.1	0	0	0	0	112.8
1232	G	21.9	Very low	23.7	Very low	71 Å²	71	141.8 Å²	141.8	73%	0.732	83%	0.825	S	S	*	*			trans	100.9	114.9	149.6	0	0	0	0	0	116.5
1233	L	26.7	Very low	23.5	Very low	168 Å²	168	146.8 Å²	146.8	88%	0.88	82%	0.824	S	S	*	*				-165.3	149.7	110	-96.7	166	0	0	0	109.4
1234	S	26.5	Very low	23.5	Very low	101 Å²	101	150.2 Å²	150.2	71%	0.706	83%	0.832	S	S	*	*			trans	26.3	100.2	169.3	56.1	0	0	0	0	118
1235	Q	24	Very low	23.7	Very low	167 Å²	167	145 Å²	145	78%	0.78	83%	0.827	S	S	*	*				63.4	122.6	83.4	-75.3	-174.2	-86.8	0	0	116.6
1236	E	23.9	Very low	23.8	Very low	161 Å²	161	149.6 Å²	149.6	75%	0.752	84%	0.837	S	S	*	*			trans	65.4	87.1	141.5	-69	163.6	-129.6	0	0	119.6
1237	S	26.3	Very low	23.8	Very low	128 Å²	128	142.7 Å²	142.7	90%	0.895	83%	0.833	S	S	*	*			trans	-140.9	136.2	130.6	-76.5	0	0	0	0	108.9
1238	T	25.5	Very low	24.1	Very low	132 Å²	132	138.8 Å²	138.8	81%	0.81	83%	0.826	S	S	*	*			trans	-73.5	133.2	-161.1	47	0	0	0	0	114.2	L1240	T1238-L1240 PolarHBondContact O-N 3.15Å
1239	S	21.1	Very low	24.2	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	83%	0.83	S	S	*	*			trans	-60.9	124.7	162.5	50.4	0	0	0	0	111.3
1240	L	23.8	Very low	24.3	Very low	164 Å²	164	145 Å²	145	86%	0.859	84%	0.836	S	S	*	*			trans	-103.8	95.6	162.3	-82.2	170	0	0	0	108.9	T1238	T1238-L1240 PolarHBondContact O-N 3.15Å
1241	D	20.2	Very low	24.1	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	83%	0.83	S	S	*	*			trans	-64.3	128.8	162.7	-90	-45.3	0	0	0	109.5
1242	F	22.1	Very low	24.4	Very low	209 Å²	209	144.7 Å²	144.7	92%	0.917	82%	0.823	S	S	*	*			trans	-138.8	130.7	150.8	-117.8	-84.1	0	0	0	110.5
1243	R	21.2	Very low	24.5	Very low	232 Å²	232	149.4 Å²	149.4	88%	0.875	83%	0.831	S	S	*	*			trans	-83.7	159.3	-173.4	-69.7	-178.1	175.5	-177	-1.8	112.2	G1245	R1243-G1245 PolarHBondContact O-N 3.1Å
1244	L	22.3	Very low	24.3	Very low	188 Å²	188	148.3 Å²	148.3	98%	0.984	83%	0.826	S	S	*	*			trans	-32.2	122.9	168.9	-71.7	154.4	0	0	0	114
1245	G	24.1	Very low	24.4	Very low	73 Å²	73	151.8 Å²	151.8	75%	0.753	84%	0.836	S	S	*	*			trans	-138.3	143.1	164.1	0	0	0	0	0	109.1	R1243	R1243-G1245 PolarHBondContact O-N 3.1Å
1246	Q	23.2	Very low	24.4	Very low	210 Å²	210	152 Å²	152	98%	0.981	84%	0.841	S	S	*	*			trans	-71.4	130.7	-177.2	-67.8	169.9	-43.3	0	0	111
1247	G	23.7	Very low	24.6	Very low	73 Å²	73	149.7 Å²	149.7	75%	0.753	84%	0.842	S	S	*	*			trans	-157.6	101.3	175.3	0	0	0	0	0	111.3
1248	A	27.2	Very low	24.6	Very low	98 Å²	98	151.7 Å²	151.7	81%	0.81	84%	0.838	S	S	*	*			trans	-69.3	136.4	169.9	0	0	0	0	0	109.6	Q1250	A1248-Q1250 PolarHBondContact O-N 2.99Å
1249	S	28.8	Very low	24.5	Very low	119 Å²	119	152.5 Å²	152.5	83%	0.832	84%	0.837	S	S	*	*			trans	-70.1	100.9	-172.6	52.1	0	0	0	0	112.5	M1251	S1249-M1251 PolarHBondContact O-N 2.75Å
1250	Q	23.9	Very low	24.8	Very low	192 Å²	192	152.6 Å²	152.6	90%	0.897	84%	0.838	S	S	*	*			trans	-85.7	95.1	166.5	-69.9	-173.9	-7.7	0	0	110.4	A1248	A1248-Q1250 PolarHBondContact O-N 2.99Å
1251	M	25.6	Very low	24.8	Very low	167 Å²	167	151.1 Å²	151.1	82%	0.823	84%	0.836	S	S	*	*			trans	-143.5	129.7	161.7	-79	179	170.8	0	0	106.4	S1249	S1249-M1251 PolarHBondContact O-N 2.75Å
1252	D	30.1	Very low	25.1	Very low	130 Å²	130	153.7 Å²	153.7	70%	0.695	84%	0.841	S	S	*	*			cis	-135.5	148.2	-4.1	-78.6	-54.6	0	0	0	110.8
1253	N	23.7	Very low	25	Very low	171 Å²	171	152.4 Å²	152.4	91%	0.914	84%	0.837	S	S	*	*			trans	-144.2	67.3	172.4	-113.1	-43.1	0	0	0	110.1
1254	L	23.6	Very low	25	Very low	144 Å²	144	144.4 Å²	144.4	75%	0.754	83%	0.827	S	S	*	*			trans	-128.8	62.6	-176.4	-82.6	174.1	0	0	0	112.9
1255	L	27.7	Very low	25.1	Very low	175 Å²	175	140.2 Å²	140.2	92%	0.916	82%	0.819	S	S	*	*			trans	-132.1	84.9	154	-80.3	-179.1	0	0	0	110.1
1256	L	24	Very low	24.9	Very low	171 Å²	171	143.8 Å²	143.8	90%	0.895	83%	0.827	S	S	*	*			trans	-78.5	113.8	164.3	-80.3	165.4	0	0	0	109.2
1257	S	29.6	Very low	24.9	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	82%	0.818	S	S	*	*			trans	-118.9	116.9	153.8	59.6	0	0	0	0	109.4
1258	Q	24.8	Very low	24.8	Very low	170 Å²	170	142.3 Å²	142.3	79%	0.794	82%	0.819	S	S	*	*			trans	-58.2	153	161.7	-66.9	147.9	-14.2	0	0	107.9
1259	D	24.3	Very low	24.5	Very low	149 Å²	149	142.2 Å²	142.2	80%	0.797	82%	0.818	S	S	*	*				-164.3	-173.2	50.8	-125.1	-43.3	0	0	0	113.2
1260	S	27.8	Very low	24.2	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	82%	0.818	S	S	*	*			trans	89.3	89	165.7	-50.7	0	0	0	0	117.8
1261	T	23.7	Very low	24.1	Very low	133 Å²	133	142.3 Å²	142.3	82%	0.816	82%	0.816	S	S	*	*			trans	-60.6	137.3	162.4	48.2	0	0	0	0	113.5
1262	F	25.3	Very low	24	Very low	200 Å²	200	140.5 Å²	140.5	88%	0.877	81%	0.814	S	S	*	*			trans	-133	108.4	149.8	-167.4	-97.4	0	0	0	109.9
1263	Q	21.2	Very low	23.5	Very low	182 Å²	182	140.9 Å²	140.9	85%	0.85	82%	0.816	S	S	*	*			trans	-87.1	129.3	176.7	-69.4	-179.8	-19.2	0	0	109.9
1264	G	21.5	Very low	23.6	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	81%	0.81	S	S	*	*			trans	-147.7	95.7	-176.4	0	0	0	0	0	114.2
1265	A	23.4	Very low	23.4	Very low	99 Å²	99	140.3 Å²	140.3	82%	0.818	82%	0.816	S	S	*	*			trans	47.5	89.7	158.4	0	0	0	0	0	119.2
1266	T	19	Very low	23.2	Very low	148 Å²	148	143.9 Å²	143.9	91%	0.908	82%	0.817	S	S	*	*			trans	-76.2	128.1	152.5	47.2	0	0	0	0	111.2
1267	V	24.7	Very low	23.1	Very low	133 Å²	133	138.7 Å²	138.7	81%	0.806	81%	0.805	S	S	*	*			trans	-132.9	137.5	166.3	179.3	0	0	0	0	107.7
1268	P	21.7	Very low	22.8	Very low	120 Å²	120	138.6 Å²	138.6	78%	0.779	81%	0.805	S	S	*	*			trans	-92.8	169.3	-148.4	35.5	-38.1	0	0	0	116.6
1269	A	20.5	Very low	22.6	Very low	95 Å²	95	138.3 Å²	138.3	79%	0.785	81%	0.809	S	S	*	*			trans	-63.7	135	-175.7	0	0	0	0	0	114.7
1270	S	22.3	Very low	22.5	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	81%	0.805	S	S	*	*			trans	-92.4	102.6	165.6	-68.5	0	0	0	0	110.5	V1272	S1270-V1272 PolarHBondContact O-N 3.11Å
1271	K	21	Very low	22.4	Very low	197 Å²	197	140.7 Å²	140.7	86%	0.857	80%	0.804	S	S	*	*			trans	-74.8	105.5	171.7	-73.8	-177.1	177.1	179.8	0	110.4
1272	V	24.3	Very low	22.2	Very low	129 Å²	129	138.6 Å²	138.6	78%	0.782	80%	0.8	S	S	*	*			trans	-94.4	96.4	164	-178.6	0	0	0	0	108.8	S1270	S1270-V1272 PolarHBondContact O-N 3.11Å
1273	N	20.4	Very low	22	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	80%	0.795	S	S	*	*			trans	-71	132.1	164.4	-91.3	-1.8	0	0	0	109.4
1274	S	24.4	Very low	22	Very low	114 Å²	114	136.9 Å²	136.9	80%	0.797	79%	0.794	S	S	*	*			trans	-147.5	95.8	155.8	-84.6	0	0	0	0	109.8	R1276	S1274-R1276 PolarHBondContact O-N 3.45Å
1275	Q	20.8	Very low	22	Very low	189 Å²	189	139.6 Å²	139.6	88%	0.883	80%	0.803	S	S	*	*			trans	-75.8	99.5	175.1	-68.9	170.9	-49.9	0	0	110.1
1276	R	22.7	Very low	21.8	Very low	249 Å²	249	142.2 Å²	142.2	94%	0.94	80%	0.798	S	S	*	*			trans	-142	135.2	146.8	-75.4	-170.8	175.1	177.7	-2.3	107.9	S1274	S1274-R1276 PolarHBondContact O-N 3.45Å
1277	G	21.6	Very low	22	Very low	62 Å²	62	141.6 Å²	141.6	64%	0.639	79%	0.789	S	S	*	*			cis	143.6	118.5	-3.3	0	0	0	0	0	110.9
1278	S	22.8	Very low	21.9	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	79%	0.785	S	S	*	*			trans	52.6	110.8	169.6	53	0	0	0	0	118.3
1279	N	21.3	Very low	22.1	Very low	164 Å²	164	142.2 Å²	142.2	88%	0.877	78%	0.781	S	S	*	*			trans	-31.7	139.5	152.1	-49.7	-14.7	0	0	0	113.5
1280	L	23.1	Very low	22.1	Very low	137 Å²	137	145.3 Å²	145.3	72%	0.717	78%	0.784	S	S	*	*			trans	-138.4	119.2	165.7	-124.4	78	0	0	0	108.7
1281	F	24.2	Very low	22.2	Very low	174 Å²	174	145.9 Å²	145.9	76%	0.763	78%	0.777	S	S	*	*			trans	49.8	124.9	168.5	-50.6	-76.5	0	0	0	118.4
1282	A	20.3	Very low	22.2	Very low	88 Å²	88	143.8 Å²	143.8	73%	0.727	78%	0.775	S	S	*	*			cis	57.6	77.6	2.4	0	0	0	0	0	116.4
1283	T	21.4	Very low	22.3	Very low	127 Å²	127	146.8 Å²	146.8	78%	0.779	78%	0.777	S	S	*	*				175.7	162.3	123.6	29.4	0	0	0	0	112.6
1284	R	21.3	Very low	22.4	Very low	220 Å²	220	147.4 Å²	147.4	83%	0.83	78%	0.781	S	S	*	*			trans	81.3	78	169.4	-58.7	-164	172.2	-178.6	-5.7	118
1285	S	19.8	Very low	22.5	Very low	120 Å²	120	147.2 Å²	147.2	84%	0.839	78%	0.779	S	S	*	*			trans	-88.6	102	146.5	52.8	0	0	0	0	110
1286	E	20.5	Very low	22.6	Very low	155 Å²	155	141.4 Å²	141.4	72%	0.724	77%	0.77	S	S	*	*			trans	-140	148.9	165.9	-69.3	-176.5	125.3	0	0	108
1287	D	22.1	Very low	22.7	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	77%	0.766	S	S	*	*			trans	57.1	123.7	168.4	-62.1	-27.2	0	0	0	118.6
1288	H	24.1	Very low	23	Very low	153 Å²	153	141 Å²	141	71%	0.708	78%	0.776	S	S	*	*			cis	-178.8	169	28.3	-117.3	14	0	0	0	111.5
1289	T	24.6	Very low	23.1	Very low	113 Å²	113	142.4 Å²	142.4	69%	0.693	78%	0.775	S	S	*	*			trans	58	110.9	156	51.4	0	0	0	0	120.8	I1291	T1289-I1291 PolarHBondContact O-N 2.86Å
1290	N	20.7	Very low	23.3	Very low	161 Å²	161	138.3 Å²	138.3	86%	0.861	77%	0.772	S	S	*	*			trans	-54.9	130.8	149.9	-65.2	-35.5	0	0	0	110.2
1291	I	25.4	Very low	23.4	Very low	129 Å²	129	138.1 Å²	138.1	66%	0.662	78%	0.776	S	S	*	*			trans	-123.4	105.5	163.1	-61.8	-179.5	0	0	0	107.3	T1289 F1293	T1289-I1291 PolarHBondContact O-N 2.86Å; I1291-F1293 HydrophobicContact CG2-CD2 4.25Å; I1291-F1293 HydrophobicContact CG2-CE2 4.13Å; I1291-F1293 PolarHBondContact O-N 3.28Å
1292	N	21.5	Very low	23.5	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	78%	0.78	S	S	*	*			trans	-67	112.2	171.1	-72.6	-6.3	0	0	0	108.7	D1294	N1292-D1294 PolarHBondContact O-N 3.14Å
1293	F	25	Very low	23.9	Very low	192 Å²	192	140.6 Å²	140.6	84%	0.842	78%	0.784	S	S	*	*			trans	-79.6	92.6	161.4	-94.1	-87.5	0	0	0	108.7	I1291	I1291-F1293 HydrophobicContact CG2-CD2 4.25Å; I1291-F1293 HydrophobicContact CG2-CE2 4.13Å; I1291-F1293 PolarHBondContact O-N 3.28Å
1294	D	23.6	Very low	24.1	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	79%	0.79	S	S	*	*			trans	-67.4	149.7	175.9	-153.5	-16.1	0	0	0	111	N1292 G1296	N1292-D1294 PolarHBondContact O-N 3.14Å; D1294-G1296 VanDerWaalsContact C-N 3.31Å; D1294-G1296 PolarHBondContact O-N 3.13Å
1295	S	24.9	Very low	24.2	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	79%	0.789	S	S	*	*			trans	-85.3	65.7	-162.5	-64.8	0	0	0	0	113.1	L1297	S1295-L1297 PolarHBondContact O-N 3.18Å; S1295-L1297 VanDerWaalsContact O-N 3.09Å
1296	G	24.1	Very low	24.7	Very low	67 Å²	67	141.9 Å²	141.9	69%	0.691	79%	0.786	S	S	*	*			trans	-66	100.8	175.6	0	0	0	0	0	113.1	D1294 V1298	D1294-G1296 VanDerWaalsContact C-N 3.31Å; D1294-G1296 PolarHBondContact O-N 3.13Å; G1296-V1298 PolarHBondContact O-N 3.19Å
1297	L	24.9	Very low	24.8	Very low	161 Å²	161	137.7 Å²	137.7	84%	0.843	79%	0.785	S	S	*	*			trans	-62.8	101.5	171.1	-80.5	157.9	0	0	0	111.3	S1295 N1299	S1295-L1297 PolarHBondContact O-N 3.18Å; S1295-L1297 VanDerWaalsContact O-N 3.09Å; L1297-N1299 PolarHBondContact O-N 3.23Å
1298	V	27	Very low	24.9	Very low	141 Å²	141	137.7 Å²	137.7	86%	0.855	79%	0.789	S	S	*	*			trans	-83	102.2	169.1	-178.4	0	0	0	0	109.1	G1296	G1296-V1298 PolarHBondContact O-N 3.19Å
1299	N	25.4	Very low	24.9	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	79%	0.789	S	S	*	*			trans	-65.3	146.5	171.5	-78.1	-38.4	0	0	0	111.2	L1297 T1301	L1297-N1299 PolarHBondContact O-N 3.23Å; N1299-T1301 PolarHBondContact O-N 2.83Å
1300	G	24.9	Very low	24.8	Very low	79 Å²	79	138.6 Å²	138.6	81%	0.814	80%	0.797	S	S	*	*	S	Bend	trans	-84.4	99.1	-171	0	0	0	0	0	114.8
1301	T	26.4	Very low	25	Very low	133 Å²	133	137.8 Å²	137.8	82%	0.816	79%	0.793	S	S	*	*			trans	-144.8	60.3	159.6	54.7	0	0	0	0	111.4	N1299	N1299-T1301 PolarHBondContact O-N 2.83Å
1302	D	25.4	Very low	24.8	Very low	157 Å²	157	136.4 Å²	136.4	84%	0.84	80%	0.801	S	S	*	*			trans	-155.7	61.8	175.9	-114.4	-30.4	0	0	0	112.4
1303	L	29.4	Very low	25	Very low	156 Å²	156	134.9 Å²	134.9	82%	0.817	80%	0.796	S	S	*	*			trans	-135.9	17.7	177.5	-110	168.4	0	0	0	114.8
1304	E	24.7	Very low	24.7	Very low	190 Å²	190	131.4 Å²	131.4	89%	0.888	80%	0.796	S	S	*	*	S	Bend	trans	-104.8	40.8	172.4	-65.5	-159.2	136.9	0	0	112.8
1305	N	24.8	Very low	24.8	Very low	153 Å²	153	129.5 Å²	129.5	82%	0.818	79%	0.794	S	S	*	*			trans	-149.1	60.9	175.9	-100.8	-50.6	0	0	0	114.2
1306	I	29.1	Very low	24.7	Very low	151 Å²	151	128.9 Å²	128.9	77%	0.774	80%	0.795	S	S	*	*			trans	-122.1	85	161.3	-56.5	-177	0	0	0	108.7
1307	G	23.8	Very low	24.6	Very low	68 Å²	68	131.6 Å²	131.6	70%	0.701	80%	0.804	S	S	*	*			trans	-65.5	135.5	179.8	0	0	0	0	0	112.8	S1309	G1307-S1309 PolarHBondContact O-N 3.33Å; G1307-S1309 VanDerWaalsContact O-N 3.1Å
1308	V	23.2	Very low	24.7	Very low	134 Å²	134	129.4 Å²	129.4	81%	0.812	80%	0.802	S	S	*	*			trans	-72.9	101.8	178.3	178.7	0	0	0	0	110.2	Q1310	V1308-Q1310 PolarHBondContact O-N 2.78Å; V1308-Q1310 VanDerWaalsContact O-N 3.14Å
1309	S	24.7	Very low	24.6	Very low	101 Å²	101	126.9 Å²	126.9	71%	0.706	80%	0.804	S	S	*	*			trans	-73.2	101.7	172.7	54.3	0	0	0	0	111.1	G1307 N1311	G1307-S1309 PolarHBondContact O-N 3.33Å; G1307-S1309 VanDerWaalsContact O-N 3.1Å; S1309-N1311 VanDerWaalsContact C-N 3.33Å; S1309-N1311 PolarHBondContact O-N 3.47Å
1310	Q	22.2	Very low	24.7	Very low	184 Å²	184	124.8 Å²	124.8	86%	0.86	81%	0.806	S	S	*	*			trans	-71.7	78.6	175.7	-66.1	-176.9	-4.1	0	0	112.2	V1308	V1308-Q1310 PolarHBondContact O-N 2.78Å; V1308-Q1310 VanDerWaalsContact O-N 3.14Å
1311	N	24.3	Very low	24.9	Very low	143 Å²	143	126.7 Å²	126.7	77%	0.765	80%	0.804	S	S	*	*			trans	-98	93.1	168	-87.9	-21.6	0	0	0	110.7	S1309 V1313	S1309-N1311 VanDerWaalsContact C-N 3.33Å; S1309-N1311 PolarHBondContact O-N 3.47Å; N1311-V1313 PolarHBondContact O-N 3.19Å; N1311-V1313 VanDerWaalsContact O-N 3.13Å
1312	A	22.1	Very low	24.8	Very low	101 Å²	101	129.1 Å²	129.1	84%	0.835	81%	0.811	S	S	*	*			trans	-72.8	98.2	173.2	0	0	0	0	0	110.8	S1314	A1312-S1314 PolarHBondContact O-N 3.48Å
1313	V	25	Very low	24.6	Very low	119 Å²	119	126.3 Å²	126.3	72%	0.721	80%	0.804	S	S	*	*			trans	-92.8	94.2	172	-178.7	0	0	0	0	109.4	N1311 C1315	N1311-V1313 PolarHBondContact O-N 3.19Å; N1311-V1313 VanDerWaalsContact O-N 3.13Å; V1313-C1315 PolarHBondContact O-N 3.09Å; V1313-C1315 VanDerWaalsContact O-N 3.07Å
1314	S	19.4	Very low	24.3	Very low	120 Å²	120	127.6 Å²	127.6	84%	0.839	81%	0.806	S	S	*	*			trans	-77.6	80.5	174.9	46.1	0	0	0	0	111.8	A1312	A1312-S1314 PolarHBondContact O-N 3.48Å
1315	C	24.5	Very low	24.4	Very low	112 Å²	112	132 Å²	132	76%	0.757	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-87.2	136.4	166.5	-72.9	0	0	0	0	111.1	V1313	V1313-C1315 PolarHBondContact O-N 3.09Å; V1313-C1315 VanDerWaalsContact O-N 3.07Å
1316	A	24.4	Very low	24.4	Very low	95 Å²	95	131 Å²	131	79%	0.785	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77	159.1	-163.1	0	0	0	0	0	114.8	S1318	A1316-S1318 PolarHBondContact O-N 3.17Å
1317	S	21.6	Very low	24.1	Very low	125 Å²	125	129.9 Å²	129.9	87%	0.874	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-61.8	120.1	169.3	51.8	0	0	0	0	112.4
1318	S	26.9	Very low	24.2	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	83%	0.832	S	S	*	*			trans	-133.4	107.9	160.4	60.5	0	0	0	0	109.3	A1316	A1316-S1318 PolarHBondContact O-N 3.17Å
1319	G	23.7	Very low	24.2	Very low	88 Å²	88	133.3 Å²	133.3	91%	0.907	83%	0.833	S	S	*	*			trans	-90.7	126.2	-179.1	0	0	0	0	0	112.6
1320	A	28.5	Very low	24.2	Very low	96 Å²	96	135.3 Å²	135.3	79%	0.793	84%	0.841	S	S	*	*			trans	-140	139.6	158.4	0	0	0	0	0	107.8
1321	P	29.8	Very low	24.3	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	84%	0.84	S	S	*	*			trans	-86.8	151.7	-160	33	-36.4	0	0	0	114.6	S1323	P1321-S1323 PolarHBondContact O-N 3.27Å
1322	L	23	Very low	24.3	Very low	184 Å²	184	131.3 Å²	131.3	96%	0.963	85%	0.845	S	S	*	*			trans	-65.9	113.5	160.6	-84.8	141.4	0	0	0	110.3
1323	S	22.4	Very low	24.5	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	85%	0.846	S	S	*	*			trans	-151	132	158.4	63.3	0	0	0	0	109.1	P1321	P1321-S1323 PolarHBondContact O-N 3.27Å
1324	Q	22.7	Very low	24.5	Very low	183 Å²	183	134.8 Å²	134.8	86%	0.855	86%	0.856	S	S	*	*			trans	68.8	83.9	-172.7	-53.1	-178.5	-8.5	0	0	115
1325	F	26.5	Very low	24.9	Very low	283 Å²	283	136.2 Å²	136.2	100%	1.241	86%	0.858	S	S	*	*				-155.1	0	112.5	-104.2	-66.8	0	0	0	110.7

Retrieved 1,325 of 1,325 residues in 2444 ms (Link to these results)

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