A0A3Q0KMA9_SCHMA Loading...

Putative thyroid hormone receptor

AlphaFold DB , UniProt , Accession A0A3Q0KMA9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,107 aa.

						>A0A3Q0KMA9_SCHMA|A0A3Q0KMA9
MNLPITTNLTNIWSSVTTTNLSQLPVQQQQQQQQHQQTTDMQQPFIGNYNNSNPPVTELVNLISTPSSSSSLSASSSSSSSSSSSSSSSSSSSGRRINDSQSYWNGITLLRETIPSYYSNSIGSSILCPIINPSIVSQSSINNCTMNYSNVPNSLHGSSSSSSSSGNVSSTTGNGTTKVPRQRKKDPYIPSYMDPANGPEPCVVCGDNATGFHYRAMTCEGCKGFFRRSVQKKLVYTCKYNGRCSVSDKQNRNSCQKCRFDRCIKGGMAKDLVLDEEKRLAKRRLIEANRARKRAESDNAIQQSQINSGPSPPKQTSYLPPTPSSISSAVSPLHRSPLMSQQNVISAQIRQSQIKPPMVTTNQSRSVLHNYPSITAQTGVMNFTNLSPTDGNSTQLHISTNLSPTIQSSTNNLDQHNSTSIQPTIYDPNCAMLPLLQTSPTRNNLIYSDGNSPINQHSHYVSTNHHQPHHHQHHQHHHQQHPTGHPLQVPTTDLMPNNTLHSSSLVNISSSIPLDESNQLYWSNNSTIENTFHHHHPLTTIHSGINPIHQHHQLPLQQHQNNFIQPIVTDQSWNNEQFTQSIIDTGNNISQYCPVSLINDTLSYDQHQRNQHPHHHHQHHHHDHHHQQQQQQQQQQQQQPSSMSHQTHDVNLVMKQTNPMNIFHFDPLIKNDDVSGMKIAKLDERKFTMPITSINTPSTINSFSNTDYSSSLSSSSSSSSCSLSSSSSLSLSSSSSSVTLTKNTEDQLQLNSKNDDTLNVTDELFVWTVDDQNLINSICNAYESTYFDKDSPNNKTIQNQLSGTNNKDVTQSGDNSQQNSGEFVIKSIVDSHLDEVEQEDIQHARTFYMTTFHDLAYLIEPAITRLVKFAKQIQGFDTLEADDQIRLLCGCCIDLITLRAAYCLSKSAKIQGLVDHSLLIRGPITTATTPPTTTSTSRPSNNQSNLTHQYNTITPPYIPNNQYPKLGISDEKCAQLIRGVALKMARLNIDQTDVAMMAAILLMSPDRSDLLDVESIENNQNNLLETFNRYVNRTRGQIKQSGLYPVSSSQCWPRIIMTLTELRSVTMCAQDLFSQTYGMSDNNNNNNQLPWYLHELFLADEKINTME
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	35.5	Very low	241 Å²	241	114.5 Å²	114.5	100%	1.187	63%	0.632	S	S	*	*				0	125.4	0	-65.3	179.5	-171.4	0	0	105.9
2	N	29	Very low	36.1	Very low	159 Å²	159	107.1 Å²	107.1	85%	0.85	59%	0.59	S	S	*	*			trans	-107.9	127.1	-171.7	-64.1	-4.1	0	0	0	110
3	L	30.2	Very low	36.8	Very low	167 Å²	167	101.2 Å²	101.2	87%	0.874	55%	0.554	S	S	*	*			trans	-145.7	147.8	155.2	-92.9	113.2	0	0	0	108.7
4	P	30.2	Very low	37.1	Very low	108 Å²	108	97.4 Å²	97.4	70%	0.701	54%	0.537	S	S	*	.			trans	-85.1	156.4	-163.6	33.7	-36	0	0	0	114.3
5	I	29	Very low	37.3	Very low	121 Å²	121	94.8 Å²	94.8	62%	0.621	53%	0.529	S	S	*	.			trans	-94.6	103	-175.9	-60	164.7	0	0	0	109.2	N8	I5-N8 VanDerWaalsContact CG2-ND2 3.3Å; I5-N8 WeakPolarHBondContact CG2-ND2 3.27Å
6	T	34.8	Very low	37.7	Very low	125 Å²	125	89.1 Å²	89.1	77%	0.767	50%	0.497	S	S	*	.			trans	-143.1	11.4	172.8	53.5	0	0	0	0	113.9
7	T	39.8	Very low	37.9	Very low	93 Å²	93	88.5 Å²	88.5	57%	0.571	50%	0.496	S	S	*	.			trans	-118.3	21.8	-166.1	49.4	0	0	0	0	114	N11	T7-N11 PolarHBondContact O-ND2 3.4Å
8	N	44.4	Very low	37.8	Very low	58 Å²	58	89.1 Å²	89.1	31%	0.31	50%	0.503	S	S	.	.			trans	-76.5	-58.3	-166	-61.9	-19.5	0	0	0	113.7	I5 N11 I12 E860	I5-N8 VanDerWaalsContact CG2-ND2 3.3Å; I5-N8 WeakPolarHBondContact CG2-ND2 3.27Å; N8-N11 PolarHBondContact O-N 2.92Å; N8-I12 PolarHBondContact O-N 2.62Å; N8-E860 PolarHBondContact ND2-OE2 3.34Å
9	L	39.1	Very low	37.7	Very low	13 Å²	13	88.8 Å²	88.8	7%	0.068	50%	0.503	C	S	.	.	H	α-helix	trans	-79.4	-35.4	-155.7	-81.1	165.2	0	0	0	116.4	N11 I12 W13 E860 I863 Y1092	L9-N11 PolarHBondContact O-N 3.34Å; L9-I12 HydrophobicContact CD2-CD1 4.08Å; L9-I12 PolarHBondContact O-N 2.94Å; L9-W13 VanDerWaalsContact O-CD1 3.28Å; L9-W13 PolarHBondContact O-N 3.28Å; L9-E860 HydrophobicContact CD1-CG 3.45Å; L9-E860 VanDerWaalsContact CD1-CG 3.45Å; L9-E860 VanDerWaalsContact CD1-OE1 3.3Å; L9-E860 WeakPolarHBondContact CD1-OE1 3.39Å; L9-E860 HydrophobicContact CD2-CG 4.02Å; L9-E860 HydrophobicContact CG-CG 3.67Å; L9-I863 HydrophobicContact CD2-CD1 4.45Å; L9-Y1092 HydrophobicContact CD1-CD1 3.69Å; L9-Y1092 HydrophobicContact CD1-CD2 3.65Å; L9-Y1092 HydrophobicContact CD1-CE1 3.22Å; L9-Y1092 HydrophobicContact CD1-CE2 3.22Å; L9-Y1092 HydrophobicContact CD1-CG 3.88Å; L9-Y1092 WeakPolarHBondContact CD1-OH 3.5Å
10	T	41.3	Very low	37.6	Very low	83 Å²	83	91.7 Å²	91.7	51%	0.509	52%	0.517	S	S	.	.	H	α-helix	trans	-60.2	-34.3	175.7	44.2	0	0	0	0	111.2	S14	T10-S14 WeakPolarHBondContact O-CB 3.19Å; T10-S14 PolarHBondContact O-N 3.25Å; T10-S14 PolarHBondContact O-OG 3.25Å
11	N	42.3	Very low	37.1	Very low	92 Å²	92	95.7 Å²	95.7	49%	0.492	54%	0.537	S	S	.	.	H	α-helix	trans	-71	-29.8	173.9	-68.4	-47	0	0	0	113.1	T7 N8 L9 S14 S15	T7-N11 PolarHBondContact O-ND2 3.4Å; N8-N11 PolarHBondContact O-N 2.92Å; L9-N11 PolarHBondContact O-N 3.34Å; N11-S14 WeakPolarHBondContact CA-OG 3.18Å; N11-S14 PolarHBondContact O-OG 2.94Å; N11-S15 VanDerWaalsContact O-CB 3.25Å; N11-S15 WeakPolarHBondContact O-CB 3.16Å; N11-S15 PolarHBondContact O-N 3.32Å; N11-S15 PolarHBondContact O-OG 3.29Å
12	I	42.6	Very low	37	Very low	25 Å²	25	89.4 Å²	89.4	13%	0.128	52%	0.516	C	S	.	.	H	α-helix	trans	-72.7	-45.4	176.4	-66.3	163.3	0	0	0	110.1	N8 L9 S15 V16 I863 T864 V867	N8-I12 PolarHBondContact O-N 2.62Å; L9-I12 HydrophobicContact CD2-CD1 4.08Å; L9-I12 PolarHBondContact O-N 2.94Å; I12-S15 WeakPolarHBondContact O-CB 3.3Å; I12-S15 PolarHBondContact O-N 3.29Å; I12-V16 PolarHBondContact O-N 2.86Å; I12-I863 HydrophobicContact CG2-CG2 4.24Å; I12-T864 VanDerWaalsContact CD1-OG1 3.25Å; I12-T864 WeakPolarHBondContact CD1-OG1 3.4Å; I12-V867 HydrophobicContact CG2-CG2 4.2Å
13	W	44.9	Very low	37	Very low	31 Å²	31	90.7 Å²	90.7	12%	0.117	52%	0.517	C	S	.	.	H	α-helix	trans	-66.9	-42	176.4	-71.4	115.3	0	0	0	112.8	L9 S15 V16 T17 I885	L9-W13 VanDerWaalsContact O-CD1 3.28Å; L9-W13 PolarHBondContact O-N 3.28Å; W13-S15 PolarHBondContact O-N 2.98Å; W13-V16 WeakPolarHBondContact O-CB 3.43Å; W13-V16 PolarHBondContact O-N 3Å; W13-T17 PolarHBondContact O-N 2.9Å; W13-T17 PolarHBondContact O-OG1 3.45Å; W13-I885 HydrophobicContact CE3-CG1 4.18Å; W13-I885 HydrophobicContact CH2-CG2 4.36Å; W13-I885 HydrophobicContact CZ3-CB 4.22Å; W13-I885 HydrophobicContact CZ3-CG1 3.91Å; W13-I885 HydrophobicContact CZ3-CG2 3.79Å
14	S	41.1	Very low	36.9	Very low	47 Å²	47	90.6 Å²	90.6	33%	0.329	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-28.4	172.9	63.7	0	0	0	0	112.5	T10 N11 V16 T17 T18	T10-S14 WeakPolarHBondContact O-CB 3.19Å; T10-S14 PolarHBondContact O-N 3.25Å; T10-S14 PolarHBondContact O-OG 3.25Å; N11-S14 WeakPolarHBondContact CA-OG 3.18Å; N11-S14 PolarHBondContact O-OG 2.94Å; S14-V16 VanDerWaalsContact C-N 3.25Å; S14-V16 PolarHBondContact O-N 3.04Å; S14-T17 WeakPolarHBondContact CA-OG1 3.48Å; S14-T17 PolarHBondContact O-N 3.45Å; S14-T17 PolarHBondContact O-OG1 2.8Å; S14-T18 WeakPolarHBondContact O-CB 3.3Å; S14-T18 WeakPolarHBondContact O-CG2 3.25Å; S14-T18 PolarHBondContact O-N 3.21Å; S14-T18 PolarHBondContact O-OG1 2.97Å
15	S	40.1	Very low	36.9	Very low	59 Å²	59	91 Å²	91	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-71.6	-13.1	171	-62.8	0	0	0	0	114.1	N11 I12 W13 K871	N11-S15 VanDerWaalsContact O-CB 3.25Å; N11-S15 WeakPolarHBondContact O-CB 3.16Å; N11-S15 PolarHBondContact O-N 3.32Å; N11-S15 PolarHBondContact O-OG 3.29Å; I12-S15 WeakPolarHBondContact O-CB 3.3Å; I12-S15 PolarHBondContact O-N 3.29Å; W13-S15 PolarHBondContact O-N 2.98Å; S15-K871 PolarHBondContact O-NZ 2.93Å
16	V	44	Very low	36.9	Very low	3 Å²	3	92.4 Å²	92.4	2%	0.018	53%	0.533	C	S	.	.	H	α-helix	trans	-88.5	-37.3	170.9	176.3	0	0	0	0	110.4	I12 W13 S14 V867 Q884 I885 L888	I12-V16 PolarHBondContact O-N 2.86Å; W13-V16 WeakPolarHBondContact O-CB 3.43Å; W13-V16 PolarHBondContact O-N 3Å; S14-V16 VanDerWaalsContact C-N 3.25Å; S14-V16 PolarHBondContact O-N 3.04Å; V16-V867 HydrophobicContact CG2-CG1 4Å; V16-V867 HydrophobicContact CG2-CG2 4.37Å; V16-Q884 HydrophobicContact CG1-CB 4.3Å; V16-I885 HydrophobicContact CG1-CG1 3.9Å; V16-L888 HydrophobicContact CG1-CD1 4.32Å; V16-L888 HydrophobicContact CG2-CD1 4.14Å
17	T	40.6	Very low	36.6	Very low	79 Å²	79	95.4 Å²	95.4	49%	0.485	54%	0.539	S	S	.	.	H	α-helix	trans	-84.4	-16.1	178.4	48.3	0	0	0	0	115.1	W13 S14 A881 I885	W13-T17 PolarHBondContact O-N 2.9Å; W13-T17 PolarHBondContact O-OG1 3.45Å; S14-T17 WeakPolarHBondContact CA-OG1 3.48Å; S14-T17 PolarHBondContact O-N 3.45Å; S14-T17 PolarHBondContact O-OG1 2.8Å; T17-A881 HydrophobicContact CG2-CB 4.42Å; T17-I885 HydrophobicContact CG2-CD1 4.11Å
18	T	36.5	Very low	36.1	Very low	100 Å²	100	99.2 Å²	99.2	61%	0.613	55%	0.55	S	S	*	.			trans	-96	103.9	178.2	51.1	0	0	0	0	113.4	S14	S14-T18 WeakPolarHBondContact O-CB 3.3Å; S14-T18 WeakPolarHBondContact O-CG2 3.25Å; S14-T18 PolarHBondContact O-N 3.21Å; S14-T18 PolarHBondContact O-OG1 2.97Å
19	T	36.2	Very low	35.4	Very low	83 Å²	83	106 Å²	106	51%	0.509	58%	0.58	S	S	.	*			trans	-138.7	162.3	165.6	66.2	0	0	0	0	110.4	L21	T19-L21 PolarHBondContact O-N 3.43Å
20	N	35.3	Very low	34.9	Very low	147 Å²	147	113.4 Å²	113.4	79%	0.786	61%	0.614	S	S	*	*	S	Bend	trans	59.8	-33.6	162.5	-58.5	-22.6	0	0	0	120	S22	N20-S22 PolarHBondContact O-N 3.24Å
21	L	28.1	Very low	34.5	Very low	176 Å²	176	118.3 Å²	118.3	92%	0.921	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	40.7	-175.8	-84.8	163.2	0	0	0	114.2	T19	T19-L21 PolarHBondContact O-N 3.43Å
22	S	27.6	Very low	33.8	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.3	34.1	175.1	54.5	0	0	0	0	113.5	N20	N20-S22 PolarHBondContact O-N 3.24Å
23	Q	28.9	Very low	33.1	Very low	186 Å²	186	130.3 Å²	130.3	87%	0.869	68%	0.684	S	S	*	*			trans	-150.5	62.6	170.7	-119.4	171.8	98.8	0	0	113.6
24	L	28.9	Very low	32.4	Very low	164 Å²	164	137 Å²	137	86%	0.859	72%	0.717	S	S	*	*			trans	-122.3	118.2	165.6	-92.9	160.9	0	0	0	109.2
25	P	30.4	Very low	32.1	Very low	118 Å²	118	143.2 Å²	143.2	77%	0.766	74%	0.74	S	S	*	*			trans	-73.1	138.9	-177.4	29	-33.5	0	0	0	111.6	Q27	P25-Q27 PolarHBondContact O-N 2.97Å
26	V	28.5	Very low	31.4	Very low	149 Å²	149	149.3 Å²	149.3	90%	0.903	76%	0.762	S	S	*	*			trans	-65	99.9	176.4	177.9	0	0	0	0	110.2
27	Q	27.9	Very low	30.9	Very low	189 Å²	189	157.4 Å²	157.4	88%	0.883	80%	0.799	S	S	*	*			trans	-157.4	150.4	161.9	-114.6	166.2	27.2	0	0	112.6	P25	P25-Q27 PolarHBondContact O-N 2.97Å
28	Q	30.5	Very low	30.6	Very low	172 Å²	172	159.6 Å²	159.6	80%	0.804	81%	0.813	S	S	*	*			trans	80.9	44.5	172.3	-143.6	153.2	63.5	0	0	118.5	Q30	Q28-Q30 PolarHBondContact O-N 3.32Å
29	Q	28.4	Very low	30.2	Very low	202 Å²	202	160.7 Å²	160.7	94%	0.944	82%	0.819	S	S	*	*			trans	-66.9	57.8	151.3	-168.7	-175.3	18.5	0	0	111.5
30	Q	29.6	Very low	29.9	Very low	167 Å²	167	163.8 Å²	163.8	78%	0.78	83%	0.833	S	S	*	*			trans	-161.2	67.6	176.6	-133.7	164.3	18.7	0	0	116	Q28	Q28-Q30 PolarHBondContact O-N 3.32Å
31	Q	32.4	Very low	29.8	Very low	187 Å²	187	163 Å²	163	87%	0.874	83%	0.826	S	S	*	*			trans	-158.5	47.5	154.6	-118.6	158.9	72.8	0	0	114.3	Q33	Q31-Q33 PolarHBondContact O-N 3.24Å
32	Q	27.5	Very low	30	Very low	187 Å²	187	162 Å²	162	87%	0.874	82%	0.817	S	S	*	*			trans	-87.6	92.6	159.1	-81.8	-176.4	-9.9	0	0	110.1
33	Q	28.7	Very low	30	Very low	181 Å²	181	165.7 Å²	165.7	85%	0.846	82%	0.822	S	S	*	*			trans	-176.3	144.4	153.8	-105.4	152.7	78.1	0	0	110.5	Q31	Q31-Q33 PolarHBondContact O-N 3.24Å
34	Q	30.1	Very low	30.1	Very low	173 Å²	173	161.2 Å²	161.2	81%	0.808	81%	0.809	S	S	*	*	S	Bend	trans	78.9	68.3	173.3	-49.2	-177.8	20.5	0	0	118.9
35	H	33.4	Very low	30.2	Very low	177 Å²	177	163.5 Å²	163.5	82%	0.819	81%	0.813	S	S	*	*				-171.1	106.2	102.8	-104.1	71.8	0	0	0	112.3
36	Q	26.6	Very low	30	Very low	186 Å²	186	165.1 Å²	165.1	87%	0.869	81%	0.813	S	S	*	*			trans	-126.1	94.1	167.6	-176.1	92.5	49.6	0	0	107.5
37	Q	32.7	Very low	30.1	Very low	174 Å²	174	162 Å²	162	81%	0.813	81%	0.811	S	S	*	*			trans	177.2	129	173.7	-103.2	153.8	73.5	0	0	104.9
38	T	34.6	Very low	29.9	Very low	125 Å²	125	158.5 Å²	158.5	77%	0.767	80%	0.798	S	S	*	*			cis	-140.9	137.6	16.8	43.6	0	0	0	0	111.9
39	T	28	Very low	29.9	Very low	122 Å²	122	160.9 Å²	160.9	75%	0.748	80%	0.801	S	S	*	*			trans	-64	148.4	155.5	43.1	0	0	0	0	110.7
40	D	30.7	Very low	30	Very low	148 Å²	148	156.2 Å²	156.2	79%	0.791	78%	0.783	S	S	*	*				-174.9	139.9	129.8	-102	-17.1	0	0	0	117.1
41	M	32.8	Very low	29.9	Very low	131 Å²	131	155 Å²	155	65%	0.645	78%	0.782	S	S	*	*			trans	77.1	90.3	144.3	-58.3	-70.3	-82.9	0	0	123.2
42	Q	32.4	Very low	30	Very low	156 Å²	156	151.8 Å²	151.8	73%	0.729	78%	0.78	S	S	*	*				69.3	106.8	114.8	-70.3	173.7	5.2	0	0	123.6
43	Q	26.9	Very low	30.1	Very low	185 Å²	185	150 Å²	150	86%	0.864	78%	0.777	S	S	*	*				66.9	157.8	115.6	-78.2	-100.1	-27.2	0	0	121.4
44	P	32.3	Very low	30.6	Very low	93 Å²	93	146.8 Å²	146.8	60%	0.604	77%	0.771	S	S	*	*			trans	-102.3	169.3	-144.6	39.9	-38.1	0	0	0	115.4
45	F	29.8	Very low	30.9	Very low	212 Å²	212	144 Å²	144	93%	0.93	77%	0.769	S	S	*	*			trans	-123.7	128.3	165.7	-111.9	-89.5	0	0	0	113.7
46	I	25.8	Very low	30.8	Very low	152 Å²	152	141.3 Å²	141.3	78%	0.779	76%	0.764	S	S	*	*			trans	-86.3	143.8	178	-66.4	162.5	0	0	0	109.3	N48	I46-N48 HydrophobicContact CG2-CB 4.39Å
47	G	30.9	Very low	30.9	Very low	83 Å²	83	138 Å²	138	86%	0.856	76%	0.757	S	S	*	*			trans	-146.3	71.1	177	0	0	0	0	0	112.7
48	N	25	Very low	30.8	Very low	116 Å²	116	137.8 Å²	137.8	62%	0.62	76%	0.756	S	S	*	*			trans	-100.9	119.8	-173.3	-173.1	40.9	0	0	0	112.3	I46	I46-N48 HydrophobicContact CG2-CB 4.39Å
49	Y	30.5	Very low	30.4	Very low	221 Å²	221	138.4 Å²	138.4	87%	0.867	75%	0.753	S	S	*	*			trans	-149.5	104	163.4	-84.6	-82.9	0	0	0	108.7
50	N	29.6	Very low	30.5	Very low	104 Å²	104	137.4 Å²	137.4	56%	0.556	75%	0.747	S	S	*	*				85.1	118.5	65.9	-77.4	-29.3	0	0	0	114.8
51	N	27.8	Very low	30.4	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	74%	0.742	S	S	*	*			trans	55.6	132.7	149.3	-62.9	-22.7	0	0	0	119
52	S	33.5	Very low	30	Very low	119 Å²	119	137 Å²	137	83%	0.832	75%	0.747	S	S	*	*				-168.3	147.9	72.9	-66.2	0	0	0	0	114.7
53	N	29.6	Very low	29.9	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	75%	0.75	S	S	*	*			trans	-49.2	163.4	-175.7	-65	-35	0	0	0	120.1
54	P	39.4	Very low	30.1	Very low	112 Å²	112	132.2 Å²	132.2	73%	0.727	74%	0.738	S	S	*	*			trans	-84.6	172.8	165.7	38.3	-37.5	0	0	0	113.2
55	P	36.5	Very low	30	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	75%	0.747	S	S	*	*				-135.1	133.5	128.9	35.6	-23.9	0	0	0	113.3
56	V	30.5	Very low	30.5	Very low	120 Å²	120	129.2 Å²	129.2	73%	0.727	74%	0.737	S	S	*	*				64	119.7	82.2	-131.3	0	0	0	0	117.5
57	T	28.8	Very low	30.8	Very low	117 Å²	117	127.2 Å²	127.2	72%	0.718	74%	0.736	S	S	*	*			trans	73.6	147.7	142.6	25.5	0	0	0	0	123.8
58	E	30.6	Very low	31	Very low	169 Å²	169	126.4 Å²	126.4	79%	0.79	72%	0.717	S	S	*	*			trans	71.2	148.3	148.5	-77.3	-166.7	175.9	0	0	118.8
59	L	26.8	Very low	31.6	Very low	137 Å²	137	124.7 Å²	124.7	72%	0.717	72%	0.715	S	S	*	*			cis	-168.7	178.3	-25.6	-127.9	178.9	0	0	0	106
60	V	30	Very low	31.9	Very low	102 Å²	102	116.1 Å²	116.1	62%	0.618	69%	0.687	S	S	*	*			trans	72.4	117.2	147.3	164.6	0	0	0	0	119.4
61	N	29.4	Very low	32.1	Very low	128 Å²	128	114.6 Å²	114.6	68%	0.684	68%	0.684	S	S	*	*			trans	76.8	115.8	145.8	-65.2	2.7	0	0	0	119.8
62	L	25	Very low	32.4	Very low	142 Å²	142	114.8 Å²	114.8	74%	0.743	69%	0.685	S	S	*	*				88.1	146.4	63	-79.6	173.6	0	0	0	112.8
63	I	29.7	Very low	32.3	Very low	154 Å²	154	114 Å²	114	79%	0.79	68%	0.679	S	S	*	*			trans	77.4	140.3	167.9	-55.6	140.9	0	0	0	115.3
64	S	30.1	Very low	32.4	Very low	87 Å²	87	110.7 Å²	110.7	61%	0.608	67%	0.673	S	S	*	*			cis	-171	124.5	-27.8	-91.4	0	0	0	0	111.1
65	T	32	Very low	32	Very low	132 Å²	132	110.5 Å²	110.5	81%	0.81	67%	0.674	S	S	*	*			trans	64.2	-175.9	141.1	76	0	0	0	0	117.8
66	P	38.4	Very low	31.8	Very low	110 Å²	110	109.5 Å²	109.5	71%	0.714	67%	0.67	S	S	*	*				-138.1	-149.5	-113.5	38.7	-13	0	0	0	114.5
67	S	33.7	Very low	31.8	Very low	109 Å²	109	108.6 Å²	108.6	76%	0.762	67%	0.669	S	S	*	*			trans	81	151.2	163.3	80.8	0	0	0	0	118.1
68	S	35.4	Very low	31.9	Very low	66 Å²	66	107.7 Å²	107.7	46%	0.462	67%	0.668	S	S	.	*			cis	-168.3	130.6	-23.4	46.6	0	0	0	0	114.6
69	S	37.3	Very low	31.9	Very low	81 Å²	81	104.3 Å²	104.3	57%	0.566	66%	0.662	S	S	*	*			trans	73.6	177.6	137.7	83.9	0	0	0	0	123.2	T499 L500	S69-T499 WeakPolarHBondContact O-CG2 3.44Å; S69-L500 PolarHBondContact O-N 2.85Å
70	S	36.9	Very low	32.2	Very low	41 Å²	41	102.5 Å²	102.5	29%	0.287	66%	0.661	S	S	.	*			trans	68	152.8	155	34.3	0	0	0	0	120.2	T499 L500 H501	S70-T499 CarbonylContact O-C 3.36Å; S70-T499 WeakPolarHBondContact O-CA 3.41Å; S70-L500 CarbonylContact C-O 3.56Å; S70-L500 PolarHBondContact O-N 2.94Å; S70-H501 VanDerWaalsContact OG-CA 3.25Å; S70-H501 WeakPolarHBondContact OG-CA 3.43Å; S70-H501 PolarHBondContact OG-CD2 3.27Å
71	S	33.2	Very low	32.3	Very low	71 Å²	71	102 Å²	102	50%	0.497	66%	0.662	S	S	.	*			cis	-170.1	173.9	-23.9	51.8	0	0	0	0	112.7	L500	S71-L500 PolarHBondContact N-O 2.84Å; S71-L500 VanDerWaalsContact N-O 3.07Å; S71-L500 PolarHBondContact OG-O 3.21Å
72	L	34	Very low	32.4	Very low	148 Å²	148	101 Å²	101	78%	0.775	67%	0.665	S	S	*	*			trans	77.6	107.9	163	-58.4	171.8	0	0	0	116.2
73	S	31.9	Very low	32.7	Very low	102 Å²	102	98.7 Å²	98.7	71%	0.713	66%	0.661	S	S	*	*				68	126.9	74.5	79	0	0	0	0	112.4
74	A	31.8	Very low	32.8	Very low	81 Å²	81	96.4 Å²	96.4	67%	0.669	66%	0.659	S	S	*	*				-161.4	138.1	67.6	0	0	0	0	0	108.4
75	S	31	Very low	32.9	Very low	107 Å²	107	97 Å²	97	75%	0.748	66%	0.663	S	S	*	*				45.8	130.3	76.8	69.6	0	0	0	0	112.6
76	S	31.1	Very low	32.8	Very low	96 Å²	96	95.3 Å²	95.3	67%	0.671	66%	0.657	S	S	*	*			cis	-175.9	-169.6	12.2	36.6	0	0	0	0	108.1
77	S	31.3	Very low	32.4	Very low	100 Å²	100	95.1 Å²	95.1	70%	0.699	66%	0.658	S	S	*	*			trans	61.3	132.6	138.4	52.8	0	0	0	0	118.8
78	S	31.4	Very low	32.2	Very low	99 Å²	99	94.6 Å²	94.6	69%	0.692	65%	0.654	S	S	*	*			cis	-177	-173.3	2.8	41.3	0	0	0	0	107.6
79	S	30.8	Very low	31.9	Very low	97 Å²	97	96.6 Å²	96.6	68%	0.678	67%	0.668	S	S	*	*			trans	44.9	126.8	138.8	59.6	0	0	0	0	119.6
80	S	31.8	Very low	31.5	Very low	99 Å²	99	98 Å²	98	69%	0.692	68%	0.678	S	S	*	*			cis	179.2	177.3	12.9	41.4	0	0	0	0	110.4
81	S	32	Very low	31.1	Very low	92 Å²	92	101.6 Å²	101.6	64%	0.643	70%	0.703	S	S	*	*			trans	65.3	122.7	139	56.4	0	0	0	0	119.7
82	S	31.9	Very low	30.9	Very low	106 Å²	106	104.2 Å²	104.2	74%	0.741	72%	0.721	S	S	*	*			trans	64.7	142	137.7	56.5	0	0	0	0	118.9
83	S	31.8	Very low	30.6	Very low	94 Å²	94	103.6 Å²	103.6	66%	0.657	73%	0.729	S	S	*	*			cis	-178.7	159	-7.9	43.3	0	0	0	0	106.8
84	S	30.6	Very low	30.4	Very low	107 Å²	107	102.2 Å²	102.2	75%	0.748	73%	0.731	S	S	*	*			trans	59.6	147.1	161.3	40.6	0	0	0	0	116.9
85	S	32.1	Very low	30.1	Very low	100 Å²	100	109.4 Å²	109.4	70%	0.699	74%	0.741	S	S	*	*			cis	-165.8	167.3	-4.7	39.8	0	0	0	0	108.8
86	S	30.3	Very low	29.8	Very low	96 Å²	96	116 Å²	116	67%	0.671	75%	0.749	S	S	*	*			trans	58	116.1	145.1	57	0	0	0	0	120.7
87	S	30.4	Very low	29.8	Very low	105 Å²	105	117.2 Å²	117.2	73%	0.734	75%	0.747	S	S	*	*				88.1	139	125	58.4	0	0	0	0	122.6
88	S	30.3	Very low	29.6	Very low	98 Å²	98	119 Å²	119	69%	0.685	75%	0.749	S	S	*	*			trans	68.1	96.4	149	41.9	0	0	0	0	119.9
89	S	27.9	Very low	29.4	Very low	108 Å²	108	119.1 Å²	119.1	76%	0.755	74%	0.742	S	S	*	*				41	116.4	120.4	59.8	0	0	0	0	119.7
90	S	30.1	Very low	29.4	Very low	112 Å²	112	118 Å²	118	78%	0.783	73%	0.734	S	S	*	*				-174.9	142.4	103.4	38.1	0	0	0	0	113.6
91	S	26.8	Very low	29.3	Very low	116 Å²	116	120.5 Å²	120.5	81%	0.811	74%	0.735	S	S	*	*			trans	32.9	108.4	141.7	-48.4	0	0	0	0	120.1
92	S	30.6	Very low	29.4	Very low	126 Å²	126	120.7 Å²	120.7	88%	0.881	74%	0.736	S	S	*	*			trans	-149.8	114.7	148.1	-81	0	0	0	0	110.9
93	S	26.3	Very low	29.4	Very low	134 Å²	134	124 Å²	124	94%	0.937	73%	0.734	S	S	*	*			trans	-65.3	142.7	-177.4	-52.8	0	0	0	0	112.6
94	G	27.2	Very low	29.4	Very low	73 Å²	73	123.3 Å²	123.3	75%	0.753	72%	0.716	S	S	*	*			trans	-158	63.9	-173.2	0	0	0	0	0	115.4
95	R	26.4	Very low	29.6	Very low	232 Å²	232	122.9 Å²	122.9	88%	0.875	71%	0.706	S	S	*	*			trans	40.7	104	160.5	-58.6	-174.2	-175.8	-154.1	0.3	117.5
96	R	24.6	Very low	29.8	Very low	245 Å²	245	120.3 Å²	120.3	93%	0.925	70%	0.695	S	S	*	*			trans	-68.5	136.2	147	-57.8	-170.8	-152.3	-126.8	9.3	107.5
97	I	31.4	Very low	30.2	Very low	123 Å²	123	117.2 Å²	117.2	63%	0.631	67%	0.671	S	S	*	*			trans	-106.9	111.5	171.5	-63.8	177.6	0	0	0	107.4	D99	I97-D99 HydrophobicContact CG2-CB 4.23Å; I97-D99 VanDerWaalsContact CG2-OD1 3.26Å; I97-D99 WeakPolarHBondContact CG2-OD1 3.22Å; I97-D99 WeakPolarHBondContact CG2-OD2 3.25Å
98	N	26.6	Very low	30.6	Very low	136 Å²	136	115.2 Å²	115.2	73%	0.727	65%	0.654	S	S	*	*			trans	-92.7	83.4	169.7	-79.4	-6.9	0	0	0	108.3	S100	N98-S100 PolarHBondContact O-N 3.21Å
99	D	28.1	Very low	31	Very low	102 Å²	102	114.4 Å²	114.4	55%	0.545	64%	0.641	S	S	.	*			trans	-91.2	74	175.2	-74	-19.5	0	0	0	111.1	I97 Q101 S102	I97-D99 HydrophobicContact CG2-CB 4.23Å; I97-D99 VanDerWaalsContact CG2-OD1 3.26Å; I97-D99 WeakPolarHBondContact CG2-OD1 3.22Å; I97-D99 WeakPolarHBondContact CG2-OD2 3.25Å; D99-Q101 PolarHBondContact O-N 3.32Å; D99-S102 PolarHBondContact O-N 3.48Å; D99-S102 PolarHBondContact O-OG 2.98Å
100	S	29.6	Very low	31.4	Very low	73 Å²	73	112 Å²	112	51%	0.51	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-55.4	-30.1	174.6	-55.7	0	0	0	0	112.6	N98 S102 Y103 W104	N98-S100 PolarHBondContact O-N 3.21Å; S100-S102 PolarHBondContact O-N 3.31Å; S100-Y103 PolarHBondContact O-N 3.26Å; S100-W104 PolarHBondContact O-NE1 3.07Å
101	Q	31.3	Very low	31.7	Very low	153 Å²	153	114.2 Å²	114.2	72%	0.715	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-59.9	-27.1	179.3	-73.6	174.2	-23.3	0	0	113.8	D99 Y103 W104	D99-Q101 PolarHBondContact O-N 3.32Å; Q101-Y103 PolarHBondContact O-N 3.45Å; Q101-W104 PolarHBondContact O-N 3.48Å
102	S	33.4	Very low	32	Very low	95 Å²	95	117 Å²	117	66%	0.664	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-62.4	-18.4	-179.5	-50.8	0	0	0	0	114.4	D99 S100	D99-S102 PolarHBondContact O-N 3.48Å; D99-S102 PolarHBondContact O-OG 2.98Å; S100-S102 PolarHBondContact O-N 3.31Å
103	Y	31.6	Very low	32.1	Very low	177 Å²	177	115.1 Å²	115.1	69%	0.694	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-96.3	-15.6	-176.9	-129.1	-86.3	0	0	0	113.2	S100 Q101 P1053	S100-Y103 PolarHBondContact O-N 3.26Å; Q101-Y103 PolarHBondContact O-N 3.45Å; Y103-P1053 HydrophobicContact CE1-CB 4.17Å
104	W	31.3	Very low	32.2	Very low	78 Å²	78	115.3 Å²	115.3	30%	0.295	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.7	-31.8	-169.7	-66.3	111.8	0	0	0	114	S100 Q101 G106 I107 L1024 W1052	S100-W104 PolarHBondContact O-NE1 3.07Å; Q101-W104 PolarHBondContact O-N 3.48Å; W104-G106 PolarHBondContact O-N 3.19Å; W104-I107 PolarHBondContact O-N 3.37Å; W104-I107 VanDerWaalsContact O-N 3.09Å; W104-L1024 HydrophobicContact CZ3-CB 4.28Å; W104-L1024 HydrophobicContact CZ3-CD1 4.5Å; W104-L1024 HydrophobicContact CZ3-CD2 4.5Å; W104-W1052 AromaticContact CH2-CE2 3.9Å; W104-W1052 AromaticContact CH2-CZ2 3.63Å; W104-W1052 HydrophobicContact CH2-CZ2 3.63Å; W104-W1052 AromaticContact CH2-NE1 3.61Å; W104-W1052 AromaticContact CZ3-CZ2 3.96Å; W104-W1052 HydrophobicContact CZ3-CZ2 3.96Å
105	N	35	Very low	32.2	Very low	99 Å²	99	115.5 Å²	115.5	53%	0.529	57%	0.572	S	S	.	*	H	α-helix	trans	-56.7	-13	174.3	-64.5	15.7	0	0	0	114	I107 L109	N105-I107 VanDerWaalsContact C-N 3.31Å; N105-L109 HydrophobicContact CB-CD1 4.02Å; N105-L109 WeakPolarHBondContact O-CB 3.25Å; N105-L109 WeakPolarHBondContact O-CG 3.35Å; N105-L109 PolarHBondContact O-N 3.06Å
106	G	36.7	Very low	32.3	Very low	46 Å²	46	107.6 Å²	107.6	47%	0.474	55%	0.552	S	S	.	*	H	α-helix	trans	-75.4	-10.3	177	0	0	0	0	0	115.5	W104 L110	W104-G106 PolarHBondContact O-N 3.19Å; G106-L110 WeakPolarHBondContact O-CD2 3.26Å; G106-L110 WeakPolarHBondContact O-CG 3.4Å
107	I	38.4	Very low	32.6	Very low	31 Å²	31	103 Å²	103	16%	0.159	54%	0.536	C	S	.	.	H	α-helix	trans	-93.1	-43.8	173.7	-63.4	-179.7	0	0	0	110.4	W104 N105 L110 L1024 I1056	W104-I107 PolarHBondContact O-N 3.37Å; W104-I107 VanDerWaalsContact O-N 3.09Å; N105-I107 VanDerWaalsContact C-N 3.31Å; I107-L110 VanDerWaalsContact O-CD1 3.28Å; I107-L110 WeakPolarHBondContact O-CD1 3.38Å; I107-L110 VanDerWaalsContact O-CG 3.31Å; I107-L110 WeakPolarHBondContact O-CG 3.48Å; I107-L1024 HydrophobicContact CD1-CD1 3.96Å; I107-L1024 HydrophobicContact CD1-CD2 3.96Å; I107-I1056 HydrophobicContact CD1-CG2 4.06Å; I107-I1056 HydrophobicContact CG1-CG2 4.43Å
108	T	39.2	Very low	32.6	Very low	62 Å²	62	105.5 Å²	105.5	38%	0.38	54%	0.538	S	S	.	.	H	α-helix	trans	-79.4	-27	-176	-5.3	0	0	0	0	114.5	L110 P1005	T108-L110 VanDerWaalsContact C-N 3.33Å; T108-L110 PolarHBondContact O-N 2.82Å; T108-P1005 HydrophobicContact CG2-CG 4.4Å
109	L	38.2	Very low	32.7	Very low	81 Å²	81	101.3 Å²	101.3	42%	0.424	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	17.2	-177.1	-67.8	174.2	0	0	0	115.4	N105 R111 E112 T113	N105-L109 HydrophobicContact CB-CD1 4.02Å; N105-L109 WeakPolarHBondContact O-CB 3.25Å; N105-L109 WeakPolarHBondContact O-CG 3.35Å; N105-L109 PolarHBondContact O-N 3.06Å; L109-R111 VanDerWaalsContact C-N 3.35Å; L109-R111 PolarHBondContact O-N 3.28Å; L109-E112 PolarHBondContact O-N 2.9Å; L109-T113 PolarHBondContact O-N 3.39Å; L109-T113 PolarHBondContact O-OG1 2.85Å; L109-T113 VanDerWaalsContact O-OG1 3.07Å
110	L	37.6	Very low	32.7	Very low	59 Å²	59	101 Å²	101	31%	0.309	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-21.9	-167	-73.5	174.5	0	0	0	115.1	G106 I107 T108 T1060	G106-L110 WeakPolarHBondContact O-CD2 3.26Å; G106-L110 WeakPolarHBondContact O-CG 3.4Å; I107-L110 VanDerWaalsContact O-CD1 3.28Å; I107-L110 WeakPolarHBondContact O-CD1 3.38Å; I107-L110 VanDerWaalsContact O-CG 3.31Å; I107-L110 WeakPolarHBondContact O-CG 3.48Å; T108-L110 VanDerWaalsContact C-N 3.33Å; T108-L110 PolarHBondContact O-N 2.82Å; L110-T1060 HydrophobicContact CD1-CG2 4.29Å; L110-T1060 HydrophobicContact CD2-CG2 3.99Å
111	R	35.6	Very low	32.6	Very low	157 Å²	157	101.5 Å²	101.5	59%	0.592	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-39.5	175.9	-160.6	174.5	-172.3	-173.3	3.8	113.1	L109 D1100	L109-R111 VanDerWaalsContact C-N 3.35Å; L109-R111 PolarHBondContact O-N 3.28Å; R111-D1100 IonicContact CZ-OD1 2.59Å; R111-D1100 IonicContact CZ-OD2 3.25Å; R111-D1100 IonicContact NH2-OD1 2.73Å; R111-D1100 PolarHBondContact NH2-OD1 3.13Å; R111-D1100 IonicContact NH2-OD2 2.96Å; R111-D1100 PolarHBondContact NH2-OD2 3Å
112	E	33.6	Very low	32.5	Very low	174 Å²	174	101.8 Å²	101.8	81%	0.813	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-21.7	-172.6	-65.3	-158	142.6	0	0	114.7	L109	L109-E112 PolarHBondContact O-N 2.9Å
113	T	31.1	Very low	32.1	Very low	88 Å²	88	100.5 Å²	100.5	54%	0.54	53%	0.528	S	S	.	.			trans	-120.4	52.9	-172	55.5	0	0	0	0	114	L109 P115	L109-T113 PolarHBondContact O-N 3.39Å; L109-T113 PolarHBondContact O-OG1 2.85Å; L109-T113 VanDerWaalsContact O-OG1 3.07Å; T113-P115 WeakPolarHBondContact O-CD 3.33Å; T113-P115 WeakPolarHBondContact O-CG 3.49Å
114	I	28.3	Very low	32	Very low	138 Å²	138	95.9 Å²	95.9	71%	0.708	52%	0.522	S	S	*	.			trans	-51	107.5	161.8	-59.1	176.5	0	0	0	108.4	S116	I114-S116 PolarHBondContact O-N 3.45Å; I114-S116 VanDerWaalsContact O-N 3.15Å
115	P	27.2	Very low	31.8	Very low	77 Å²	77	98.2 Å²	98.2	50%	0.5	55%	0.55	S	S	.	*			trans	-71.5	121.5	175.1	-10.6	29.1	0	0	0	105.1	T113 Y117	T113-P115 WeakPolarHBondContact O-CD 3.33Å; T113-P115 WeakPolarHBondContact O-CG 3.49Å; P115-Y117 HydrophobicContact CB-CD2 3.85Å; P115-Y117 PolarHBondContact O-N 2.86Å
116	S	28.7	Very low	31.6	Very low	65 Å²	65	100.2 Å²	100.2	46%	0.455	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-66.5	20.2	-179.9	-18.9	0	0	0	0	113.8	I114 S119 R283	I114-S116 PolarHBondContact O-N 3.45Å; I114-S116 VanDerWaalsContact O-N 3.15Å; S116-S119 WeakPolarHBondContact O-CB 2.89Å; S116-S119 PolarHBondContact O-OG 3.38Å; S116-R283 PolarHBondContact OG-NH2 2.64Å
117	Y	31	Very low	31.2	Very low	148 Å²	148	105.4 Å²	105.4	58%	0.58	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-78.3	-25.7	-179.1	-82.2	-89.1	0	0	0	113.6	P115 S119 N120 R227	P115-Y117 HydrophobicContact CB-CD2 3.85Å; P115-Y117 PolarHBondContact O-N 2.86Å; Y117-S119 PolarHBondContact O-N 2.98Å; Y117-N120 PolarHBondContact O-N 2.9Å; Y117-R227 PolarHBondContact OH-NH2 3.39Å
118	Y	32.2	Very low	30.5	Very low	176 Å²	176	108.1 Å²	108.1	69%	0.69	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-77.1	18.7	173.8	-70.9	-89.2	0	0	0	113.4
119	S	29.2	Very low	29.9	Very low	49 Å²	49	110.2 Å²	110.2	34%	0.343	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-98.2	-18.2	173.5	67.5	0	0	0	0	114.6	S116 Y117	S116-S119 WeakPolarHBondContact O-CB 2.89Å; S116-S119 PolarHBondContact O-OG 3.38Å; Y117-S119 PolarHBondContact O-N 2.98Å
120	N	27.7	Very low	29.4	Very low	96 Å²	96	113.7 Å²	113.7	51%	0.513	63%	0.628	S	S	.	*	S	Bend	trans	-152.9	91.7	-172.8	-108.5	-140.7	0	0	0	109	Y117 K282	Y117-N120 PolarHBondContact O-N 2.9Å; N120-K282 WeakPolarHBondContact OD1-CE 3.46Å; N120-K282 PolarHBondContact OD1-NZ 3.02Å
121	S	27.2	Very low	29	Very low	82 Å²	82	117.5 Å²	117.5	57%	0.573	65%	0.648	S	S	*	*			trans	-151.5	-74.1	-176.3	-179.5	0	0	0	0	113.8	G123	S121-G123 PolarHBondContact O-N 3.09Å
122	I	28.7	Very low	28.6	Very low	159 Å²	159	116.3 Å²	116.3	82%	0.815	65%	0.653	S	S	*	*	S	Bend	trans	-73.5	126	-175.3	-53.7	175.3	0	0	0	109.5
123	G	26.7	Very low	28.3	Very low	68 Å²	68	113.4 Å²	113.4	70%	0.701	65%	0.649	S	S	*	*	S	Bend	trans	95.5	80.4	-165.1	0	0	0	0	0	111.3	S121	S121-G123 PolarHBondContact O-N 3.09Å
124	S	28.6	Very low	28.1	Very low	80 Å²	80	113.3 Å²	113.3	56%	0.559	65%	0.652	S	S	*	*	S	Bend	trans	-155.5	-60.8	171.4	-77.9	0	0	0	0	111.6	I126	S124-I126 PolarHBondContact O-N 3.14Å
125	S	28	Very low	28.1	Very low	128 Å²	128	114.1 Å²	114.1	90%	0.895	66%	0.656	S	S	*	*	S	Bend	trans	-79.7	27.9	-179.6	-54.8	0	0	0	0	115.1
126	I	29.3	Very low	28.2	Very low	140 Å²	140	116.2 Å²	116.2	72%	0.718	67%	0.667	S	S	*	*			trans	-137.9	90.5	149.5	-56.7	-177.7	0	0	0	105.9	S124	S124-I126 PolarHBondContact O-N 3.14Å
127	L	27.9	Very low	28.2	Very low	155 Å²	155	117.8 Å²	117.8	81%	0.812	68%	0.678	S	S	*	*			trans	-125.8	61.7	171.5	-143.5	153.5	0	0	0	108.8
128	C	25.1	Very low	28	Very low	88 Å²	88	119.4 Å²	119.4	60%	0.595	69%	0.691	S	S	*	*			trans	-98	124.6	158.2	49.2	0	0	0	0	108	I130	C128-I130 PolarHBondContact O-N 2.88Å
129	P	25.3	Very low	27.9	Very low	107 Å²	107	116.5 Å²	116.5	70%	0.695	70%	0.696	S	S	*	*			trans	-76.8	112.5	-178.7	30.3	-32.4	0	0	0	109.3	I131	P129-I131 PolarHBondContact O-N 3.37Å
130	I	28.5	Very low	28	Very low	154 Å²	154	118.7 Å²	118.7	79%	0.79	71%	0.712	S	S	*	*			trans	-97.9	78.7	159.3	-55.4	-174.7	0	0	0	107.2	C128 N132	C128-I130 PolarHBondContact O-N 2.88Å; I130-N132 PolarHBondContact O-N 3.16Å
131	I	28.3	Very low	28.1	Very low	139 Å²	139	121 Å²	121	71%	0.713	72%	0.723	S	S	*	*			trans	-55.9	128	158.5	-70.6	170.8	0	0	0	106.8	P129 P133	P129-I131 PolarHBondContact O-N 3.37Å; I131-P133 VanDerWaalsContact O-CD 3.22Å; I131-P133 WeakPolarHBondContact O-CD 3.5Å; I131-P133 VanDerWaalsContact O-N 3.16Å
132	N	27.2	Very low	28.2	Very low	131 Å²	131	123.1 Å²	123.1	70%	0.701	73%	0.728	S	S	*	*			trans	-57.7	111.6	172.2	-172.3	20.8	0	0	0	109.3	I130 S134	I130-N132 PolarHBondContact O-N 3.16Å; N132-S134 VanDerWaalsContact C-N 3.31Å; N132-S134 PolarHBondContact O-N 3.46Å
133	P	27.4	Very low	28.2	Very low	114 Å²	114	122.3 Å²	122.3	74%	0.74	73%	0.725	S	S	*	*			trans	-85.7	75.1	-173.8	34.1	-31.6	0	0	0	109.6	I131	I131-P133 VanDerWaalsContact O-CD 3.22Å; I131-P133 WeakPolarHBondContact O-CD 3.5Å; I131-P133 VanDerWaalsContact O-N 3.16Å
134	S	28.7	Very low	28.2	Very low	86 Å²	86	125.5 Å²	125.5	60%	0.601	74%	0.735	S	S	*	*			trans	-159.3	120.8	172.2	-83.2	0	0	0	0	113.7	N132	N132-S134 VanDerWaalsContact C-N 3.31Å; N132-S134 PolarHBondContact O-N 3.46Å
135	I	28.2	Very low	28.1	Very low	155 Å²	155	127.7 Å²	127.7	80%	0.795	75%	0.745	S	S	*	*			trans	89.5	88.9	149.5	-57.1	166.7	0	0	0	118.5
136	V	27.6	Very low	28.2	Very low	120 Å²	120	129.8 Å²	129.8	73%	0.727	74%	0.743	S	S	*	*				50	132.1	129.1	-157.1	0	0	0	0	121.4
137	S	29.3	Very low	28.1	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	74%	0.738	S	S	*	*			trans	119.3	86.7	145.2	-48	0	0	0	0	113.9
138	Q	26.4	Very low	28.3	Very low	183 Å²	183	132.7 Å²	132.7	86%	0.855	74%	0.744	S	S	*	*				60.1	96.1	98	-66.6	-178.7	13.8	0	0	112.9
139	S	31.3	Very low	28.5	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	74%	0.742	S	S	*	*				168.8	157.2	88.5	41.7	0	0	0	0	107.1
140	S	31.5	Very low	28.9	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	75%	0.746	S	S	*	*			cis	-167.4	148.1	-3.3	-101.2	0	0	0	0	109
141	I	29.9	Very low	29.2	Very low	144 Å²	144	132.6 Å²	132.6	74%	0.738	74%	0.744	S	S	*	*			trans	63.5	139.8	140	-61.3	168.4	0	0	0	118.8
142	N	29.4	Very low	29.6	Very low	126 Å²	126	131.6 Å²	131.6	67%	0.674	75%	0.746	S	S	*	*			cis	-168.9	160.7	-22.5	-96.8	-15.3	0	0	0	109.2
143	N	27.9	Very low	29.9	Very low	143 Å²	143	132.3 Å²	132.3	77%	0.765	75%	0.751	S	S	*	*			trans	55.5	123.8	152.4	-65.3	-11.6	0	0	0	122.5
144	C	25.7	Very low	30.3	Very low	135 Å²	135	132.3 Å²	132.3	91%	0.912	75%	0.753	S	S	*	*			trans	-155.1	35.2	166.7	-91.1	0	0	0	0	113.9
145	T	26.4	Very low	30.5	Very low	125 Å²	125	135.4 Å²	135.4	77%	0.767	76%	0.762	S	S	*	*			trans	-135.6	111.7	-157.5	-41.6	0	0	0	0	116
146	M	31.7	Very low	30.9	Very low	172 Å²	172	136.3 Å²	136.3	85%	0.847	76%	0.762	S	S	*	*			trans	-151.3	132.7	161.7	-70.2	-60.9	162.4	0	0	107.8
147	N	27.5	Very low	31.2	Very low	115 Å²	115	133.9 Å²	133.9	62%	0.615	76%	0.762	S	S	*	*			cis	92	119.1	41.4	-168.6	28.8	0	0	0	113.5	S149	N147-S149 PolarHBondContact OD1-OG 3.37Å
148	Y	31.2	Very low	31.7	Very low	241 Å²	241	134.1 Å²	134.1	95%	0.945	76%	0.764	S	S	*	*			trans	-152.3	117.5	155.2	-97.5	-71.4	0	0	0	110.1
149	S	30.1	Very low	32.3	Very low	79 Å²	79	130.8 Å²	130.8	55%	0.552	76%	0.761	S	S	*	*			trans	-107.6	160.7	179.8	-46.5	0	0	0	0	110.9	N147	N147-S149 PolarHBondContact OD1-OG 3.37Å
150	N	32.5	Very low	32.8	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	76%	0.756	S	S	*	*				164.5	112.7	125.9	-86.4	-25.9	0	0	0	116
151	V	35.5	Very low	33.2	Very low	122 Å²	122	130.8 Å²	130.8	74%	0.739	76%	0.761	S	S	*	*			trans	46.4	158.4	131.4	-75.8	0	0	0	0	123.1
152	P	36.2	Very low	33.7	Very low	118 Å²	118	128.8 Å²	128.8	77%	0.766	76%	0.759	S	S	*	*			cis	-138.5	158.5	15.4	41	-22	0	0	0	121
153	N	33.5	Very low	34.1	Very low	147 Å²	147	127.8 Å²	127.8	79%	0.786	76%	0.762	S	S	*	*			trans	-0.1	143.7	149.7	-59.6	-7.2	0	0	0	125.6
154	S	35.3	Very low	34.8	Very low	113 Å²	113	126 Å²	126	79%	0.79	76%	0.761	S	S	*	*				152.2	144.6	122.8	-74	0	0	0	0	112.7
155	L	33.9	Very low	35.4	Very low	151 Å²	151	125.8 Å²	125.8	79%	0.791	76%	0.761	S	S	*	*			cis	-165	139	-10.6	-159.5	71.5	0	0	0	111.7
156	H	36.7	Very low	36	Very low	174 Å²	174	123.7 Å²	123.7	81%	0.806	76%	0.764	S	S	*	*			trans	49.7	128.8	150.3	-87.8	-102.7	0	0	0	127.3
157	G	33.9	Very low	36.2	Very low	69 Å²	69	123.1 Å²	123.1	71%	0.711	77%	0.765	S	S	*	*				113.2	142.9	123.5	0	0	0	0	0	119
158	S	39.5	Very low	36.8	Very low	104 Å²	104	123.9 Å²	123.9	73%	0.727	77%	0.773	S	S	*	*			cis	-167.9	150.3	-9.1	-68.3	0	0	0	0	111.8
159	S	39.3	Very low	37.2	Very low	113 Å²	113	117 Å²	117	79%	0.79	76%	0.761	S	S	*	*			trans	58.6	150.2	148	43.5	0	0	0	0	122
160	S	40.6	Very low	37.5	Very low	101 Å²	101	118.5 Å²	118.5	71%	0.706	77%	0.771	S	S	*	*			cis	-175.8	157.1	-3	44.7	0	0	0	0	114.1
161	S	40.6	Very low	37.9	Very low	109 Å²	109	118 Å²	118	76%	0.762	77%	0.774	S	S	*	*			trans	61.5	149.5	146.2	51.8	0	0	0	0	121.7
162	S	39.7	Very low	38.1	Very low	102 Å²	102	118.6 Å²	118.6	71%	0.713	78%	0.777	S	S	*	*			cis	-174.2	148.6	-0.3	41.1	0	0	0	0	114.3
163	S	39.5	Very low	38.2	Very low	104 Å²	104	116.5 Å²	116.5	73%	0.727	78%	0.777	S	S	*	*			trans	20.2	144.4	149.7	54.1	0	0	0	0	123
164	S	40.6	Very low	38.4	Very low	106 Å²	106	117.7 Å²	117.7	74%	0.741	78%	0.784	S	S	*	*				-176.7	134.7	64.5	-48.3	0	0	0	0	110.2
165	S	38.9	Very low	38.7	Very low	130 Å²	130	115.1 Å²	115.1	91%	0.909	78%	0.775	S	S	*	*				68.7	117.5	78.4	-58.5	0	0	0	0	118.4
166	G	39.3	Very low	38.8	Very low	82 Å²	82	115 Å²	115	85%	0.845	78%	0.78	S	S	*	*			trans	-178.6	138.6	169.3	0	0	0	0	0	112.9
167	N	36.5	Very low	39.1	Very low	159 Å²	159	113.2 Å²	113.2	85%	0.85	78%	0.782	S	S	*	*			trans	-139	-173.5	-161.4	-130.5	-5.2	0	0	0	113.3
168	V	39.7	Very low	39.6	Very low	131 Å²	131	119.7 Å²	119.7	79%	0.794	79%	0.791	S	S	*	*			trans	70.9	149.8	167.5	-59.2	0	0	0	0	120
169	S	39.6	Very low	39.7	Very low	98 Å²	98	121.1 Å²	121.1	69%	0.685	79%	0.794	S	S	*	*			cis	-171.4	154.1	-22.9	-92	0	0	0	0	111.5
170	S	37.1	Very low	40	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	79%	0.792	S	S	*	*			trans	52.6	135.2	155.5	51.4	0	0	0	0	120.4
171	T	39.3	Very low	40.1	Very low	136 Å²	136	127.9 Å²	127.9	83%	0.834	80%	0.802	S	S	*	*				-165.1	159.4	70.6	-57.1	0	0	0	0	112.9
172	T	39.7	Very low	40.3	Very low	133 Å²	133	131.9 Å²	131.9	82%	0.816	81%	0.809	S	S	*	*			trans	-65.7	148.6	-167.7	-40.1	0	0	0	0	118.2
173	G	38.3	Very low	40.6	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	82%	0.818	S	S	*	*			trans	-173.4	113.2	161	0	0	0	0	0	113.2
174	N	38.2	Very low	41.3	Very low	173 Å²	173	143.3 Å²	143.3	93%	0.925	83%	0.826	S	S	*	*			trans	-82.4	141	-174.6	-85.6	-19.1	0	0	0	113.5
175	G	41	Very low	41.8	Very low	58 Å²	58	148 Å²	148	60%	0.598	83%	0.833	S	S	*	*			trans	-174.5	64.2	177.4	0	0	0	0	0	115.8	T177	G175-T177 PolarHBondContact O-N 3.44Å
176	T	37.2	Very low	42.7	Very low	148 Å²	148	148.7 Å²	148.7	91%	0.908	83%	0.826	S	S	*	*			trans	29.1	71.3	158.7	56.3	0	0	0	0	118.5
177	T	42.1	Very low	44.3	Very low	138 Å²	138	149.8 Å²	149.8	85%	0.847	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.8	124.9	170.8	40.3	0	0	0	0	112.3	G175	G175-T177 PolarHBondContact O-N 3.44Å
178	K	45.8	Very low	46.1	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-69.7	133.3	175.5	-66.3	176.7	-179.9	175.6	0	110.1
179	V	41.6	Very low	47.3	Very low	133 Å²	133	149.6 Å²	149.6	81%	0.806	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-59.8	128.4	-179.2	-175.9	0	0	0	0	110.9	R181	V179-R181 PolarHBondContact O-N 3.28Å
180	P	44.5	Very low	48.6	Very low	114 Å²	114	146.3 Å²	146.3	74%	0.74	78%	0.775	S	S	*	*			trans	-71.3	115.2	175.3	28.2	-32.6	0	0	0	110.2	Q182	P180-Q182 PolarHBondContact O-N 3.05Å
181	R	42.5	Very low	49.8	Very low	243 Å²	243	145.2 Å²	145.2	92%	0.917	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.1	126.3	171.6	-104.1	177.9	161.7	175.1	-6.1	109.7	V179 R183	V179-R181 PolarHBondContact O-N 3.28Å; R181-R183 PolarHBondContact O-N 3.03Å
182	Q	45.8	Very low	51	Low	193 Å²	193	143 Å²	143	90%	0.902	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-57.9	127.9	178.8	-67.5	177.3	-16.1	0	0	110.8	P180	P180-Q182 PolarHBondContact O-N 3.05Å
183	R	45.6	Very low	52.1	Low	240 Å²	240	140.8 Å²	140.8	91%	0.906	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-69.5	131.7	171	-66.3	-179.5	177.5	174.4	-2	108.7	R181 K185	R181-R183 PolarHBondContact O-N 3.03Å; R183-K185 PolarHBondContact O-N 3.41Å
184	K	53.8	Low	53.3	Low	205 Å²	205	140.4 Å²	140.4	89%	0.891	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-56.2	129.7	169.2	-85.1	-179	171	-179.9	0	108.5
185	K	52.3	Low	54.4	Low	204 Å²	204	137 Å²	137	89%	0.887	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69.3	145.5	167.5	-83.3	179.6	171.8	178.6	0	109.7	R183	R183-K185 PolarHBondContact O-N 3.41Å
186	D	57.9	Low	55.4	Low	146 Å²	146	138.1 Å²	138.1	78%	0.781	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-59.5	153	175.2	-54.3	-69.6	0	0	0	111.7	Y188	D186-Y188 PolarHBondContact O-N 3.05Å
187	P	72.1	Confident	56.6	Low	104 Å²	104	136.9 Å²	136.9	68%	0.675	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-58	131.1	175.4	-21.3	32.9	0	0	0	110.9	I189	P187-I189 PolarHBondContact O-N 3.06Å
188	Y	73.9	Confident	57.6	Low	193 Å²	193	132 Å²	132	76%	0.757	66%	0.662	S	S	*	*			trans	-66.1	100.5	173.1	174.6	-103.4	0	0	0	109.8	D186 P190	D186-Y188 PolarHBondContact O-N 3.05Å; Y188-P190 HydrophobicContact CD1-CG 4.31Å; Y188-P190 HydrophobicContact CE1-CB 4.3Å; Y188-P190 HydrophobicContact CE1-CG 3.87Å
189	I	65.2	Low	58.8	Low	94 Å²	94	126.2 Å²	126.2	48%	0.482	65%	0.646	S	S	.	*			trans	-86.2	117.4	165.4	-59.4	176.7	0	0	0	106.5	P187 M193	P187-I189 PolarHBondContact O-N 3.06Å; I189-M193 HydrophobicContact CG2-CB 3.9Å
190	P	67.7	Low	60.8	Low	29 Å²	29	124.2 Å²	124.2	19%	0.188	63%	0.628	C	S	.	*			trans	-59.6	139	172.1	-21.1	32.7	0	0	0	110	Y188 Y192 M193 D194	Y188-P190 HydrophobicContact CD1-CG 4.31Å; Y188-P190 HydrophobicContact CE1-CB 4.3Å; Y188-P190 HydrophobicContact CE1-CG 3.87Å; P190-Y192 HydrophobicContact CB-CD1 3.7Å; P190-Y192 HydrophobicContact CB-CE1 3.23Å; P190-Y192 HydrophobicContact CB-CE2 4.27Å; P190-Y192 HydrophobicContact CB-CG 4.39Å; P190-Y192 HydrophobicContact CG-CE1 4.08Å; P190-Y192 PolarHBondContact O-N 3.32Å; P190-M193 PolarHBondContact O-N 2.92Å; P190-D194 PolarHBondContact O-N 2.77Å
191	S	61.1	Low	63	Low	87 Å²	87	122.4 Å²	122.4	61%	0.608	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-59.8	-22.3	-169.2	65.8	0	0	0	0	115	M193 D194	S191-M193 PolarHBondContact O-N 2.91Å; S191-D194 VanDerWaalsContact O-CB 3.3Å; S191-D194 WeakPolarHBondContact O-CB 3.33Å; S191-D194 PolarHBondContact O-N 2.85Å
192	Y	65	Low	65.6	Low	90 Å²	90	111 Å²	111	35%	0.353	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-75.2	-8.9	174.4	66.7	-103.6	0	0	0	114.2	P190 F212 M217	P190-Y192 HydrophobicContact CB-CD1 3.7Å; P190-Y192 HydrophobicContact CB-CE1 3.23Å; P190-Y192 HydrophobicContact CB-CE2 4.27Å; P190-Y192 HydrophobicContact CB-CG 4.39Å; P190-Y192 HydrophobicContact CG-CE1 4.08Å; P190-Y192 PolarHBondContact O-N 3.32Å; Y192-F212 AromaticContact CD1-CE2 3.76Å; Y192-F212 HydrophobicContact CD1-CE2 3.76Å; Y192-F212 AromaticContact CD2-CD2 3.9Å; Y192-F212 HydrophobicContact CD2-CD2 3.9Å; Y192-F212 AromaticContact CD2-CE2 3.65Å; Y192-F212 HydrophobicContact CD2-CE2 3.65Å; Y192-F212 HydrophobicContact CE1-CD2 4.2Å; Y192-F212 AromaticContact CE1-CE2 3.66Å; Y192-F212 HydrophobicContact CE1-CE2 3.66Å; Y192-F212 AromaticContact CE2-CD2 3.47Å; Y192-F212 HydrophobicContact CE2-CD2 3.47Å; Y192-F212 VanDerWaalsContact CE2-CD2 3.47Å; Y192-F212 AromaticContact CE2-CE2 3.59Å; Y192-F212 HydrophobicContact CE2-CE2 3.59Å; Y192-F212 HydrophobicContact CG-CD2 4.45Å; Y192-F212 AromaticContact CG-CE2 3.75Å; Y192-F212 HydrophobicContact CG-CE2 3.75Å; Y192-F212 AromaticContact CZ-CD2 3.65Å; Y192-F212 AromaticContact CZ-CE2 3.61Å; Y192-M217 HydrophobicContact CD2-CE 3.59Å; Y192-M217 HydrophobicContact CE2-CE 4.47Å; Y192-M217 HydrophobicContact CG-CE 3.89Å
193	M	63.7	Low	67.9	Low	86 Å²	86	105 Å²	105	42%	0.424	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-108.3	0.9	170	-62.3	-89.1	67.8	0	0	111.8	I189 P190 S191 P195	I189-M193 HydrophobicContact CG2-CB 3.9Å; P190-M193 PolarHBondContact O-N 2.92Å; S191-M193 PolarHBondContact O-N 2.91Å; M193-P195 VanDerWaalsContact O-CD 3.28Å; M193-P195 WeakPolarHBondContact O-CD 3.36Å
194	D	62.5	Low	70.4	Confident	65 Å²	65	93.5 Å²	93.5	35%	0.348	51%	0.506	S	S	.	.			trans	-71.8	116.4	180	-168.6	-20.1	0	0	0	109.6	P190 S191 A196 N197	P190-D194 PolarHBondContact O-N 2.77Å; S191-D194 VanDerWaalsContact O-CB 3.3Å; S191-D194 WeakPolarHBondContact O-CB 3.33Å; S191-D194 PolarHBondContact O-N 2.85Å; D194-A196 PolarHBondContact O-N 3Å; D194-A196 VanDerWaalsContact O-N 3.08Å; D194-A196 VanDerWaalsContact OD1-CB 3.26Å; D194-A196 WeakPolarHBondContact OD1-CB 3.45Å; D194-A196 PolarHBondContact OD1-N 3.43Å; D194-N197 PolarHBondContact O-N 3.43Å
195	P	60.6	Low	72.4	Confident	101 Å²	101	83.8 Å²	83.8	66%	0.656	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-58.7	-22.5	179.2	-22.6	34.5	0	0	0	113.3	M193 N197 G198	M193-P195 VanDerWaalsContact O-CD 3.28Å; M193-P195 WeakPolarHBondContact O-CD 3.36Å; P195-N197 VanDerWaalsContact C-N 3.3Å; P195-N197 PolarHBondContact O-N 3.44Å; P195-G198 PolarHBondContact O-N 3.45Å
196	A	62.4	Low	74.4	Confident	83 Å²	83	76.1 Å²	76.1	69%	0.686	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-64.1	-29.5	-176.5	0	0	0	0	0	114.1	D194	D194-A196 PolarHBondContact O-N 3Å; D194-A196 VanDerWaalsContact O-N 3.08Å; D194-A196 VanDerWaalsContact OD1-CB 3.26Å; D194-A196 WeakPolarHBondContact OD1-CB 3.45Å; D194-A196 PolarHBondContact OD1-N 3.43Å
197	N	63.1	Low	76.2	Confident	122 Å²	122	70 Å²	70	65%	0.652	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-90.7	-0.7	-179.8	-63.7	-48.7	0	0	0	113.2	D194 P195	D194-N197 PolarHBondContact O-N 3.43Å; P195-N197 VanDerWaalsContact C-N 3.3Å; P195-N197 PolarHBondContact O-N 3.44Å
198	G	63.1	Low	77.1	Confident	35 Å²	35	69.6 Å²	69.6	36%	0.361	40%	0.402	S	S	.	.			trans	73.5	162.7	-166.8	0	0	0	0	0	112.7	P195 E200	P195-G198 PolarHBondContact O-N 3.45Å; G198-E200 PolarHBondContact O-N 3.22Å
199	P	70.6	Confident	78	Confident	83 Å²	83	61 Å²	61	54%	0.539	37%	0.371	S	S	.	.			trans	-71.5	120	178.7	29.2	-35.2	0	0	0	111.2	N208	P199-N208 HydrophobicContact CB-CB 4.18Å; P199-N208 HydrophobicContact CG-CB 4.04Å; P199-N208 WeakPolarHBondContact CG-ND2 3.26Å
200	E	83.3	Confident	79.2	Confident	92 Å²	92	60 Å²	60	43%	0.43	37%	0.369	S	S	.	.			trans	-44	138.4	171.5	-73.6	-76	-179.2	0	0	112.1	G198 A209 M217	G198-E200 PolarHBondContact O-N 3.22Å; E200-A209 WeakPolarHBondContact O-CA 3.48Å; E200-A209 WeakPolarHBondContact O-CB 3.18Å; E200-A209 PolarHBondContact O-N 3.35Å; E200-M217 HydrophobicContact CB-CE 4.25Å; E200-M217 HydrophobicContact CB-CG 3.76Å; E200-M217 HydrophobicContact CB-SD 3.99Å; E200-M217 HydrophobicContact CG-CE 4.28Å
201	P	91.8	Very high	80.2	Confident	75 Å²	75	58.8 Å²	58.8	49%	0.487	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-72.8	142.7	179.6	29.3	-33.9	0	0	0	111.6	V203	P201-V203 PolarHBondContact O-N 3.49Å; P201-V203 VanDerWaalsContact O-N 3.14Å
202	C	96.3	Very high	81.8	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.02	36%	0.355	C	S	.	.			trans	-62.2	116.3	173.5	172.6	0	0	0	0	110.8	V204 C205 G206 D207 C219	C202-V204 PolarHBondContact O-N 3.01Å; C202-C205 PolarHBondContact O-N 2.94Å; C202-G206 PolarHBondContact O-N 3.25Å; C202-D207 WeakPolarHBondContact CA-O 3.04Å; C202-D207 WeakPolarHBondContact CB-O 3.49Å; C202-D207 PolarHBondContact N-O 3.37Å; C202-C219 HydrophobicContact CB-CB 3.93Å; C202-C219 PolarHBondContact SG-N 3.08Å; C202-C219 VanDerWaalsContact SG-N 3.37Å
203	V	94.5	Very high	83.2	Confident	67 Å²	67	56.7 Å²	56.7	41%	0.406	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-21.7	-179.4	-58	0	0	0	0	113.6	P201 A216 M217 T218	P201-V203 PolarHBondContact O-N 3.49Å; P201-V203 VanDerWaalsContact O-N 3.14Å; V203-A216 HydrophobicContact CG2-CB 4.31Å; V203-M217 HydrophobicContact CG1-CB 4.34Å; V203-M217 PolarHBondContact N-O 2.81Å; V203-M217 VanDerWaalsContact N-O 3.09Å; V203-T218 HydrophobicContact CG2-CG2 4.08Å
204	V	96.9	Very high	84.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-36.6	178.3	-175.5	0	0	0	0	113.4	C202 T218 C222 V246 R259 R262 C263 M268	C202-V204 PolarHBondContact O-N 3.01Å; V204-T218 HydrophobicContact CG2-CG2 3.79Å; V204-C222 HydrophobicContact CB-CB 4.26Å; V204-C222 HydrophobicContact CG1-CB 4.41Å; V204-C222 HydrophobicContact CG2-CB 4.46Å; V204-V246 HydrophobicContact CG1-CG1 4.45Å; V204-V246 WeakPolarHBondContact O-CG1 3.21Å; V204-V246 VanDerWaalsContact O-O 3.08Å; V204-R259 HydrophobicContact CG1-CG 4.27Å; V204-R262 HydrophobicContact CG1-CB 4.26Å; V204-R262 HydrophobicContact CG1-CG 4.35Å; V204-R262 WeakPolarHBondContact O-CD 3.17Å; V204-R262 PolarHBondContact O-NE 3.48Å; V204-C263 HydrophobicContact CG2-CB 4.45Å; V204-M268 HydrophobicContact CG2-SD 4.24Å
205	C	97.1	Very high	86.3	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-156	21.1	-168.7	74.3	0	0	0	0	116.5	C202 D207 C219 V246 S247 D248 R252	C202-C205 PolarHBondContact O-N 2.94Å; C205-D207 PolarHBondContact O-N 3.35Å; C205-C219 VanDerWaalsContact SG-SG 3.66Å; C205-V246 HydrophobicContact CB-CG1 4.06Å; C205-S247 CarbonylContact C-O 3.57Å; C205-S247 VanDerWaalsContact C-O 3.32Å; C205-S247 CarbonylContact O-C 3.04Å; C205-D248 CarbonylContact O-C 3.57Å; C205-D248 WeakPolarHBondContact O-CA 3.34Å; C205-D248 PolarHBondContact O-N 3.2Å; C205-R252 HydrophobicContact CB-CB 3.86Å; C205-R252 VanDerWaalsContact SG-CD 3.54Å; C205-R252 PolarHBondContact SG-NH1 3.29Å
206	G	94.3	Very high	87.9	Confident	43 Å²	43	55.8 Å²	55.8	44%	0.443	32%	0.319	S	S	.	.	S	Bend	trans	71.5	-28.4	173.8	0	0	0	0	0	117.1	C202	C202-G206 PolarHBondContact O-N 3.25Å
207	D	94.7	Very high	89.5	Confident	18 Å²	18	52.8 Å²	52.8	10%	0.096	29%	0.291	C	S	.	.	S	Bend	trans	-51.6	145.3	174.8	-166.6	25.8	0	0	0	111.2	C202 C205 A209 C219 K249 R252	C202-D207 WeakPolarHBondContact CA-O 3.04Å; C202-D207 WeakPolarHBondContact CB-O 3.49Å; C202-D207 PolarHBondContact N-O 3.37Å; C205-D207 PolarHBondContact O-N 3.35Å; D207-A209 PolarHBondContact O-N 3.47Å; D207-C219 HydrophobicContact CB-CB 4.04Å; D207-K249 HydrophobicContact CB-CB 4.15Å; D207-K249 HydrophobicContact CB-CG 4.39Å; D207-K249 WeakPolarHBondContact OD1-CD 3.33Å; D207-K249 WeakPolarHBondContact OD1-CE 3.28Å; D207-K249 IonicContact OD1-NZ 3.77Å; D207-K249 PolarHBondContact OD1-NZ 3.35Å; D207-K249 IonicContact OD2-NZ 3.62Å; D207-R252 IonicContact OD2-CZ 2.69Å; D207-R252 IonicContact OD2-NH1 2.94Å; D207-R252 PolarHBondContact OD2-NH1 3.11Å; D207-R252 IonicContact OD2-NH2 2.81Å; D207-R252 PolarHBondContact OD2-NH2 2.97Å
208	N	92.4	Very high	91	Very high	95 Å²	95	47 Å²	47	51%	0.508	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-55.6	126.6	-173.2	-50.4	81.6	0	0	0	111.3	P199 C219	P199-N208 HydrophobicContact CB-CB 4.18Å; P199-N208 HydrophobicContact CG-CB 4.04Å; P199-N208 WeakPolarHBondContact CG-ND2 3.26Å; N208-C219 WeakPolarHBondContact O-CB 3.28Å
209	A	92.2	Very high	92.6	Very high	11 Å²	11	45.4 Å²	45.4	9%	0.091	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-72.9	146.7	179.6	0	0	0	0	0	111.3	E200 D207 M217 T218	E200-A209 WeakPolarHBondContact O-CA 3.48Å; E200-A209 WeakPolarHBondContact O-CB 3.18Å; E200-A209 PolarHBondContact O-N 3.35Å; D207-A209 PolarHBondContact O-N 3.47Å; A209-M217 HydrophobicContact CB-CG 3.63Å; A209-M217 HydrophobicContact CB-SD 3.48Å; A209-M217 WeakPolarHBondContact CB-SD 3.24Å; A209-T218 WeakPolarHBondContact CA-O 3.42Å
210	T	89.8	Confident	93.8	Very high	73 Å²	73	46.1 Å²	46.1	45%	0.448	24%	0.24	S	C	.	.			trans	-102.4	14.5	174.4	54.4	0	0	0	0	111.9	H213 T218 E220	T210-H213 PolarHBondContact OG1-NE2 3.36Å; T210-T218 PolarHBondContact N-O 3.11Å; T210-E220 HydrophobicContact CG2-CB 4.36Å; T210-E220 PolarHBondContact OG1-N 2.73Å; T210-E220 PolarHBondContact OG1-OE2 3.37Å
211	G	89.5	Confident	94.5	Very high	4 Å²	4	43 Å²	43	4%	0.041	23%	0.232	C	C	.	.	S	Bend	trans	117.2	-166.6	-177.6	0	0	0	0	0	113.6	H213 T218	G211-H213 PolarHBondContact O-CD2 3.35Å; G211-H213 PolarHBondContact O-N 3.05Å; G211-T218 PolarHBondContact O-N 2.87Å
212	F	93.4	Very high	94.8	Very high	106 Å²	106	39.4 Å²	39.4	47%	0.465	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	111.9	176.6	-76.6	-84.5	0	0	0	111.5	Y192 A216 M217	Y192-F212 AromaticContact CD1-CE2 3.76Å; Y192-F212 HydrophobicContact CD1-CE2 3.76Å; Y192-F212 AromaticContact CD2-CD2 3.9Å; Y192-F212 HydrophobicContact CD2-CD2 3.9Å; Y192-F212 AromaticContact CD2-CE2 3.65Å; Y192-F212 HydrophobicContact CD2-CE2 3.65Å; Y192-F212 HydrophobicContact CE1-CD2 4.2Å; Y192-F212 AromaticContact CE1-CE2 3.66Å; Y192-F212 HydrophobicContact CE1-CE2 3.66Å; Y192-F212 AromaticContact CE2-CD2 3.47Å; Y192-F212 HydrophobicContact CE2-CD2 3.47Å; Y192-F212 VanDerWaalsContact CE2-CD2 3.47Å; Y192-F212 AromaticContact CE2-CE2 3.59Å; Y192-F212 HydrophobicContact CE2-CE2 3.59Å; Y192-F212 HydrophobicContact CG-CD2 4.45Å; Y192-F212 AromaticContact CG-CE2 3.75Å; Y192-F212 HydrophobicContact CG-CE2 3.75Å; Y192-F212 AromaticContact CZ-CD2 3.65Å; Y192-F212 AromaticContact CZ-CE2 3.61Å; F212-A216 WeakPolarHBondContact CA-O 3.37Å; F212-M217 HydrophobicContact CD2-CE 3.87Å; F212-M217 HydrophobicContact CE1-CB 4.4Å; F212-M217 HydrophobicContact CE2-CE 3.52Å; F212-M217 HydrophobicContact CZ-CE 3.91Å
213	H	95.6	Very high	94.8	Very high	28 Å²	28	41.8 Å²	41.8	13%	0.13	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.3	170.3	-54.7	-70.9	0	0	0	109.5	T210 G211 R215 A216 T218 K223	T210-H213 PolarHBondContact OG1-NE2 3.36Å; G211-H213 PolarHBondContact O-CD2 3.35Å; G211-H213 PolarHBondContact O-N 3.05Å; H213-R215 PolarHBondContact O-N 3.18Å; H213-A216 PolarHBondContact N-O 3.15Å; H213-A216 PolarHBondContact O-N 2.99Å; H213-T218 PolarHBondContact CD2-O 3.33Å; H213-T218 VanDerWaalsContact CD2-O 3.29Å; H213-T218 PolarHBondContact CD2-OG1 3.19Å; H213-K223 HydrophobicContact CB-CB 3.85Å; H213-K223 HydrophobicContact CB-CD 4.39Å; H213-K223 HydrophobicContact CB-CG 3.77Å; H213-K223 VanDerWaalsContact ND1-CD 3.34Å; H213-K223 WeakPolarHBondContact ND1-CD 3.21Å; H213-K223 WeakPolarHBondContact ND1-CE 3.45Å
214	Y	96.6	Very high	95	Very high	48 Å²	48	39.1 Å²	39.1	19%	0.188	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	42.4	-177.9	-49	-76.3	0	0	0	112.4	A216 K223 F226 R227 M268 A269 L272 V273	Y214-A216 VanDerWaalsContact C-N 3.34Å; Y214-A216 PolarHBondContact O-N 2.99Å; Y214-K223 HydrophobicContact CE2-CG 4.07Å; Y214-F226 HydrophobicContact CD1-CE1 4.47Å; Y214-F226 AromaticContact CD2-CD1 3.65Å; Y214-F226 HydrophobicContact CD2-CD1 3.65Å; Y214-F226 HydrophobicContact CD2-CE1 4.22Å; Y214-F226 HydrophobicContact CE2-CD1 4.15Å; Y214-F226 AromaticContact CG-CD1 3.88Å; Y214-F226 HydrophobicContact CG-CD1 3.88Å; Y214-F226 AromaticContact CG-CE1 3.96Å; Y214-F226 HydrophobicContact CG-CE1 3.96Å; Y214-R227 HydrophobicContact CE2-CB 4.28Å; Y214-R227 WeakPolarHBondContact OH-CB 3.19Å; Y214-R227 WeakPolarHBondContact OH-CD 3.41Å; Y214-R227 WeakPolarHBondContact OH-CG 3.32Å; Y214-M268 HydrophobicContact CD2-CE 3.77Å; Y214-M268 CarbonylContact O-C 3.5Å; Y214-M268 WeakPolarHBondContact O-CA 3.42Å; Y214-A269 WeakPolarHBondContact O-CB 3.36Å; Y214-A269 PolarHBondContact O-N 2.85Å; Y214-L272 HydrophobicContact CD1-CB 3.93Å; Y214-V273 HydrophobicContact CD1-CG2 3.76Å; Y214-V273 HydrophobicContact CE1-CB 4.39Å; Y214-V273 HydrophobicContact CE1-CG2 3.6Å; Y214-V273 HydrophobicContact CG-CG2 4.45Å
215	R	94.1	Very high	95	Very high	181 Å²	181	39.7 Å²	39.7	68%	0.683	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	3.3	-174.9	-59.7	174.1	-178.9	-82.5	2	117.6	H213 A269 L272	H213-R215 PolarHBondContact O-N 3.18Å; R215-A269 HydrophobicContact CG-CB 4.41Å; R215-L272 HydrophobicContact CG-CD1 3.69Å
216	A	94.9	Very high	95.1	Very high	3 Å²	3	39.7 Å²	39.7	3%	0.025	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.1	176.4	0	0	0	0	0	113.6	V203 F212 H213 Y214 T218 G266 M268	V203-A216 HydrophobicContact CG2-CB 4.31Å; F212-A216 WeakPolarHBondContact CA-O 3.37Å; H213-A216 PolarHBondContact N-O 3.15Å; H213-A216 PolarHBondContact O-N 2.99Å; Y214-A216 VanDerWaalsContact C-N 3.34Å; Y214-A216 PolarHBondContact O-N 2.99Å; A216-T218 HydrophobicContact CB-CG2 3.87Å; A216-T218 PolarHBondContact O-N 2.89Å; A216-T218 PolarHBondContact O-OG1 3.5Å; A216-G266 WeakPolarHBondContact CB-O 3.29Å; A216-M268 HydrophobicContact CB-CB 4.49Å; A216-M268 HydrophobicContact CB-CG 3.5Å; A216-M268 VanDerWaalsContact CB-CG 3.5Å
217	M	94.4	Very high	95.2	Very high	20 Å²	20	41.4 Å²	41.4	10%	0.099	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	102.7	172.5	-175.1	58.4	73.8	0	0	110.2	Y192 E200 V203 A209 F212	Y192-M217 HydrophobicContact CD2-CE 3.59Å; Y192-M217 HydrophobicContact CE2-CE 4.47Å; Y192-M217 HydrophobicContact CG-CE 3.89Å; E200-M217 HydrophobicContact CB-CE 4.25Å; E200-M217 HydrophobicContact CB-CG 3.76Å; E200-M217 HydrophobicContact CB-SD 3.99Å; E200-M217 HydrophobicContact CG-CE 4.28Å; V203-M217 HydrophobicContact CG1-CB 4.34Å; V203-M217 PolarHBondContact N-O 2.81Å; V203-M217 VanDerWaalsContact N-O 3.09Å; A209-M217 HydrophobicContact CB-CG 3.63Å; A209-M217 HydrophobicContact CB-SD 3.48Å; A209-M217 WeakPolarHBondContact CB-SD 3.24Å; F212-M217 HydrophobicContact CD2-CE 3.87Å; F212-M217 HydrophobicContact CE1-CB 4.4Å; F212-M217 HydrophobicContact CE2-CE 3.52Å; F212-M217 HydrophobicContact CZ-CE 3.91Å
218	T	96	Very high	95.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.219	C	C	.	.			trans	-143.9	154.7	-167.9	49.1	0	0	0	0	113.8	V203 V204 A209 T210 G211 H213 A216 M268	V203-T218 HydrophobicContact CG2-CG2 4.08Å; V204-T218 HydrophobicContact CG2-CG2 3.79Å; A209-T218 WeakPolarHBondContact CA-O 3.42Å; T210-T218 PolarHBondContact N-O 3.11Å; G211-T218 PolarHBondContact O-N 2.87Å; H213-T218 PolarHBondContact CD2-O 3.33Å; H213-T218 VanDerWaalsContact CD2-O 3.29Å; H213-T218 PolarHBondContact CD2-OG1 3.19Å; A216-T218 HydrophobicContact CB-CG2 3.87Å; A216-T218 PolarHBondContact O-N 2.89Å; A216-T218 PolarHBondContact O-OG1 3.5Å; T218-M268 HydrophobicContact CG2-CE 4.42Å; T218-M268 HydrophobicContact CG2-CG 4.44Å; T218-M268 HydrophobicContact CG2-SD 4.03Å
219	C	96.6	Very high	95.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.014	20%	0.195	C	C	.	.			trans	-77.1	157.2	171.9	67.6	0	0	0	0	111.2	C202 C205 D207 N208 G221 C222 K223 R252	C202-C219 HydrophobicContact CB-CB 3.93Å; C202-C219 PolarHBondContact SG-N 3.08Å; C202-C219 VanDerWaalsContact SG-N 3.37Å; C205-C219 VanDerWaalsContact SG-SG 3.66Å; D207-C219 HydrophobicContact CB-CB 4.04Å; N208-C219 WeakPolarHBondContact O-CB 3.28Å; C219-G221 PolarHBondContact O-N 2.82Å; C219-G221 VanDerWaalsContact O-N 3.11Å; C219-C222 PolarHBondContact O-N 3.38Å; C219-K223 PolarHBondContact O-N 2.8Å; C219-K223 VanDerWaalsContact O-N 3.09Å; C219-R252 PolarHBondContact SG-NH1 3.43Å
220	E	96.1	Very high	95.5	Very high	98 Å²	98	43.1 Å²	43.1	46%	0.458	20%	0.2	S	C	.	.	H	α-helix	trans	-54.7	-34	179.5	-164	63	-158	0	0	112.8	T210 C222 K223 G224	T210-E220 HydrophobicContact CG2-CB 4.36Å; T210-E220 PolarHBondContact OG1-N 2.73Å; T210-E220 PolarHBondContact OG1-OE2 3.37Å; E220-C222 PolarHBondContact O-N 3.41Å; E220-K223 VanDerWaalsContact CD-CD 3.43Å; E220-K223 VanDerWaalsContact OE1-CD 3.26Å; E220-K223 WeakPolarHBondContact OE1-CD 3.41Å; E220-K223 WeakPolarHBondContact OE1-CE 3.19Å; E220-K223 IonicContact OE1-NZ 3.44Å; E220-K223 PolarHBondContact OE1-NZ 2.89Å; E220-K223 WeakPolarHBondContact OE2-CD 3.31Å; E220-K223 IonicContact OE2-NZ 2.68Å; E220-K223 PolarHBondContact OE2-NZ 3.13Å; E220-G224 PolarHBondContact O-N 3.21Å
221	G	97	Very high	95.6	Very high	26 Å²	26	43.5 Å²	43.5	27%	0.268	20%	0.197	S	C	.	.	H	α-helix	trans	-64.1	-36	176.5	0	0	0	0	0	113.8	C219 F225 R259	C219-G221 PolarHBondContact O-N 2.82Å; C219-G221 VanDerWaalsContact O-N 3.11Å; G221-F225 WeakPolarHBondContact O-CB 3.45Å; G221-F225 PolarHBondContact O-N 3.07Å; G221-R259 PolarHBondContact O-NH2 2.88Å
222	C	98.2	Very high	95.8	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-83.1	-37	178.4	-74.7	0	0	0	0	112.3	V204 C219 E220 F225 F226 R259	V204-C222 HydrophobicContact CB-CB 4.26Å; V204-C222 HydrophobicContact CG1-CB 4.41Å; V204-C222 HydrophobicContact CG2-CB 4.46Å; C219-C222 PolarHBondContact O-N 3.38Å; E220-C222 PolarHBondContact O-N 3.41Å; C222-F225 PolarHBondContact O-N 2.92Å; C222-F226 WeakPolarHBondContact O-CB 3.35Å; C222-F226 PolarHBondContact O-N 3.21Å; C222-R259 PolarHBondContact SG-NH2 3.33Å; C222-R259 VanDerWaalsContact SG-NH2 3.36Å
223	K	97.6	Very high	95.7	Very high	53 Å²	53	54.6 Å²	54.6	23%	0.23	24%	0.244	C	C	.	.	H	α-helix	trans	-51.2	-55	166.3	172.7	-157.7	-166.1	-177.3	0	112	H213 Y214 C219 E220 F225 F226 R227	H213-K223 HydrophobicContact CB-CB 3.85Å; H213-K223 HydrophobicContact CB-CD 4.39Å; H213-K223 HydrophobicContact CB-CG 3.77Å; H213-K223 VanDerWaalsContact ND1-CD 3.34Å; H213-K223 WeakPolarHBondContact ND1-CD 3.21Å; H213-K223 WeakPolarHBondContact ND1-CE 3.45Å; Y214-K223 HydrophobicContact CE2-CG 4.07Å; C219-K223 PolarHBondContact O-N 2.8Å; C219-K223 VanDerWaalsContact O-N 3.09Å; E220-K223 VanDerWaalsContact CD-CD 3.43Å; E220-K223 VanDerWaalsContact OE1-CD 3.26Å; E220-K223 WeakPolarHBondContact OE1-CD 3.41Å; E220-K223 WeakPolarHBondContact OE1-CE 3.19Å; E220-K223 IonicContact OE1-NZ 3.44Å; E220-K223 PolarHBondContact OE1-NZ 2.89Å; E220-K223 WeakPolarHBondContact OE2-CD 3.31Å; E220-K223 IonicContact OE2-NZ 2.68Å; E220-K223 PolarHBondContact OE2-NZ 3.13Å; K223-F225 VanDerWaalsContact C-N 3.35Å; K223-F225 PolarHBondContact O-N 3.48Å; K223-F226 PolarHBondContact O-N 2.99Å; K223-R227 WeakPolarHBondContact O-CB 3.37Å; K223-R227 PolarHBondContact O-N 3.2Å
224	G	97.2	Very high	95.7	Very high	12 Å²	12	56.6 Å²	56.6	12%	0.124	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-36.8	-178.9	0	0	0	0	0	113.3	E220 R228	E220-G224 PolarHBondContact O-N 3.21Å; G224-R228 WeakPolarHBondContact O-CG 3.45Å; G224-R228 VanDerWaalsContact O-CZ 3.3Å; G224-R228 PolarHBondContact O-N 3.39Å; G224-R228 PolarHBondContact O-NE 2.88Å
225	F	97.9	Very high	95.6	Very high	12 Å²	12	60.8 Å²	60.8	5%	0.053	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-53.9	174.1	174.1	-103.9	0	0	0	111.6	G221 C222 K223 R227 R228 S229 Y236 Q256 R259 F260	G221-F225 WeakPolarHBondContact O-CB 3.45Å; G221-F225 PolarHBondContact O-N 3.07Å; C222-F225 PolarHBondContact O-N 2.92Å; K223-F225 VanDerWaalsContact C-N 3.35Å; K223-F225 PolarHBondContact O-N 3.48Å; F225-R227 PolarHBondContact O-N 2.97Å; F225-R228 PolarHBondContact O-N 3.01Å; F225-S229 PolarHBondContact O-N 3.43Å; F225-S229 PolarHBondContact O-OG 3.36Å; F225-Y236 HydrophobicContact CE2-CE2 4.1Å; F225-Y236 HydrophobicContact CZ-CD2 4.43Å; F225-Y236 AromaticContact CZ-CE2 3.71Å; F225-Y236 HydrophobicContact CZ-CE2 3.71Å; F225-Q256 HydrophobicContact CE2-CB 4.28Å; F225-Q256 HydrophobicContact CE2-CG 4.31Å; F225-Q256 HydrophobicContact CZ-CB 4.25Å; F225-Q256 WeakPolarHBondContact CZ-O 3.44Å; F225-R259 HydrophobicContact CD1-CG 3.91Å; F225-R259 HydrophobicContact CE1-CB 3.93Å; F225-R259 HydrophobicContact CE1-CG 3.71Å; F225-R259 HydrophobicContact CZ-CB 4.22Å; F225-R259 HydrophobicContact CZ-CG 4.34Å; F225-F260 HydrophobicContact CE1-CB 3.81Å; F225-F260 HydrophobicContact CE1-CD2 4.19Å; F225-F260 HydrophobicContact CZ-CB 4.02Å
226	F	98	Very high	95.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56	-49.1	-179.9	-176.3	-104.3	0	0	0	112.5	Y214 C222 K223 R228 S229 V230 F260 C263 I264 M268 K270 V273	Y214-F226 HydrophobicContact CD1-CE1 4.47Å; Y214-F226 AromaticContact CD2-CD1 3.65Å; Y214-F226 HydrophobicContact CD2-CD1 3.65Å; Y214-F226 HydrophobicContact CD2-CE1 4.22Å; Y214-F226 HydrophobicContact CE2-CD1 4.15Å; Y214-F226 AromaticContact CG-CD1 3.88Å; Y214-F226 HydrophobicContact CG-CD1 3.88Å; Y214-F226 AromaticContact CG-CE1 3.96Å; Y214-F226 HydrophobicContact CG-CE1 3.96Å; C222-F226 WeakPolarHBondContact O-CB 3.35Å; C222-F226 PolarHBondContact O-N 3.21Å; K223-F226 PolarHBondContact O-N 2.99Å; F226-R228 PolarHBondContact O-N 3.37Å; F226-S229 PolarHBondContact O-N 3.36Å; F226-V230 HydrophobicContact CD1-CG2 4.35Å; F226-V230 HydrophobicContact CD2-CG2 4.31Å; F226-V230 HydrophobicContact CE1-CG2 3.98Å; F226-V230 HydrophobicContact CE2-CG2 3.94Å; F226-V230 HydrophobicContact CZ-CG2 3.77Å; F226-V230 WeakPolarHBondContact O-CG2 3.35Å; F226-V230 PolarHBondContact O-N 2.93Å; F226-F260 HydrophobicContact CD2-CD2 4.27Å; F226-F260 AromaticContact CD2-CE2 3.78Å; F226-F260 HydrophobicContact CD2-CE2 3.78Å; F226-F260 AromaticContact CE2-CE2 3.95Å; F226-F260 HydrophobicContact CE2-CE2 3.95Å; F226-F260 HydrophobicContact CE2-CZ 4.45Å; F226-C263 HydrophobicContact CD2-CB 3.66Å; F226-C263 HydrophobicContact CE2-CB 4.31Å; F226-C263 HydrophobicContact CG-CB 4.49Å; F226-I264 HydrophobicContact CE2-CD1 3.74Å; F226-I264 HydrophobicContact CE2-CG1 4.44Å; F226-I264 HydrophobicContact CZ-CD1 4.3Å; F226-M268 HydrophobicContact CB-CE 3.48Å; F226-M268 VanDerWaalsContact CB-CE 3.48Å; F226-M268 HydrophobicContact CB-SD 3.84Å; F226-M268 HydrophobicContact CD1-CB 4.04Å; F226-M268 HydrophobicContact CD1-CE 3.84Å; F226-M268 HydrophobicContact CD1-SD 4.49Å; F226-M268 HydrophobicContact CD2-CB 3.76Å; F226-M268 HydrophobicContact CD2-CE 4.45Å; F226-M268 HydrophobicContact CD2-SD 4.11Å; F226-M268 HydrophobicContact CE1-CB 3.84Å; F226-M268 HydrophobicContact CE2-CB 3.56Å; F226-M268 HydrophobicContact CG-CB 3.99Å; F226-M268 HydrophobicContact CG-CE 3.67Å; F226-M268 HydrophobicContact CG-SD 3.89Å; F226-M268 HydrophobicContact CZ-CB 3.6Å; F226-M268 WeakPolarHBondContact CZ-O 3.29Å; F226-K270 HydrophobicContact CZ-CB 4.18Å; F226-V273 HydrophobicContact CD1-CG2 4.09Å; F226-V273 HydrophobicContact CE1-CG2 3.75Å
227	R	96.5	Very high	95.8	Very high	79 Å²	79	60.2 Å²	60.2	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-53.5	-50.3	177.1	-173.4	-177.9	73.6	-177	3.4	111.7	Y117 Y214 K223 F225 V230 Q231 V273	Y117-R227 PolarHBondContact OH-NH2 3.39Å; Y214-R227 HydrophobicContact CE2-CB 4.28Å; Y214-R227 WeakPolarHBondContact OH-CB 3.19Å; Y214-R227 WeakPolarHBondContact OH-CD 3.41Å; Y214-R227 WeakPolarHBondContact OH-CG 3.32Å; K223-R227 WeakPolarHBondContact O-CB 3.37Å; K223-R227 PolarHBondContact O-N 3.2Å; F225-R227 PolarHBondContact O-N 2.97Å; R227-V230 PolarHBondContact O-N 3.45Å; R227-Q231 HydrophobicContact CG-CG 4.43Å; R227-Q231 WeakPolarHBondContact O-CB 3.38Å; R227-Q231 VanDerWaalsContact O-CG 3.32Å; R227-Q231 WeakPolarHBondContact O-CG 3.38Å; R227-Q231 PolarHBondContact O-N 2.95Å; R227-V273 HydrophobicContact CG-CG1 4.36Å
228	R	95.4	Very high	96	Very high	128 Å²	128	60.5 Å²	60.5	48%	0.483	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-42.1	-179.9	-73.2	-174.3	-60.9	-101.4	2.1	112.1	G224 F225 F226 K232	G224-R228 WeakPolarHBondContact O-CG 3.45Å; G224-R228 VanDerWaalsContact O-CZ 3.3Å; G224-R228 PolarHBondContact O-N 3.39Å; G224-R228 PolarHBondContact O-NE 2.88Å; F225-R228 PolarHBondContact O-N 3.01Å; F226-R228 PolarHBondContact O-N 3.37Å; R228-K232 WeakPolarHBondContact O-CB 3.42Å; R228-K232 PolarHBondContact O-N 3.18Å; R228-K232 VanDerWaalsContact O-N 3.11Å
229	S	96.7	Very high	95.9	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.007	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-44	179.5	-55.2	0	0	0	0	112.1	F225 F226 K233 L234 Y236 F260	F225-S229 PolarHBondContact O-N 3.43Å; F225-S229 PolarHBondContact O-OG 3.36Å; F226-S229 PolarHBondContact O-N 3.36Å; S229-K233 PolarHBondContact O-N 2.69Å; S229-L234 PolarHBondContact O-N 3.04Å; S229-Y236 WeakPolarHBondContact OG-CE2 3.43Å; S229-Y236 PolarHBondContact OG-OH 3.48Å; S229-F260 VanDerWaalsContact CB-CE2 3.44Å
230	V	95	Very high	95.7	Very high	32 Å²	32	77 Å²	77	19%	0.194	37%	0.369	C	S	.	.	H	α-helix	trans	-70.9	-48.9	178.8	177.7	0	0	0	0	111.8	F226 R227 K232 K233 F260 K270 V273	F226-V230 HydrophobicContact CD1-CG2 4.35Å; F226-V230 HydrophobicContact CD2-CG2 4.31Å; F226-V230 HydrophobicContact CE1-CG2 3.98Å; F226-V230 HydrophobicContact CE2-CG2 3.94Å; F226-V230 HydrophobicContact CZ-CG2 3.77Å; F226-V230 WeakPolarHBondContact O-CG2 3.35Å; F226-V230 PolarHBondContact O-N 2.93Å; R227-V230 PolarHBondContact O-N 3.45Å; V230-K232 PolarHBondContact O-N 3.47Å; V230-K233 PolarHBondContact O-N 3.25Å; V230-F260 HydrophobicContact CG2-CE2 4.1Å; V230-F260 HydrophobicContact CG2-CZ 4.18Å; V230-K270 HydrophobicContact CG1-CB 4.18Å; V230-K270 HydrophobicContact CG2-CB 4.12Å; V230-V273 HydrophobicContact CB-CB 4.22Å; V230-V273 HydrophobicContact CB-CG1 4.16Å; V230-V273 HydrophobicContact CB-CG2 4.03Å; V230-V273 HydrophobicContact CG1-CB 3.78Å; V230-V273 HydrophobicContact CG1-CG1 4.01Å; V230-V273 HydrophobicContact CG1-CG2 4Å; V230-V273 HydrophobicContact CG2-CG2 4.29Å
231	Q	91.7	Very high	95.5	Very high	80 Å²	80	78.5 Å²	78.5	37%	0.374	38%	0.381	S	S	.	.	H	α-helix	trans	-61.4	-44.7	-177.7	-72	-176.2	-47.4	0	0	112.7	R227 K233 V273 L274	R227-Q231 HydrophobicContact CG-CG 4.43Å; R227-Q231 WeakPolarHBondContact O-CB 3.38Å; R227-Q231 VanDerWaalsContact O-CG 3.32Å; R227-Q231 WeakPolarHBondContact O-CG 3.38Å; R227-Q231 PolarHBondContact O-N 2.95Å; Q231-K233 PolarHBondContact O-N 2.81Å; Q231-V273 HydrophobicContact CG-CG1 3.42Å; Q231-V273 VanDerWaalsContact CG-CG1 3.42Å; Q231-L274 PolarHBondContact NE2-O 3.32Å
232	K	92.7	Very high	95.3	Very high	161 Å²	161	79 Å²	79	70%	0.7	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	6.8	177.5	-66.5	-170.4	175.6	-163.5	0	113.3	R228 V230 L234	R228-K232 WeakPolarHBondContact O-CB 3.42Å; R228-K232 PolarHBondContact O-N 3.18Å; R228-K232 VanDerWaalsContact O-N 3.11Å; V230-K232 PolarHBondContact O-N 3.47Å; K232-L234 HydrophobicContact CB-CD1 4.12Å; K232-L234 HydrophobicContact CB-CD2 3.83Å; K232-L234 HydrophobicContact CB-CG 3.67Å; K232-L234 PolarHBondContact O-N 3.09Å; K232-L234 VanDerWaalsContact O-N 3.13Å
233	K	92.4	Very high	95	Very high	183 Å²	183	88.5 Å²	88.5	80%	0.796	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	40.1	-177.5	-58.2	179.1	-176.8	175.8	0	113	S229 V230 Q231 V235	S229-K233 PolarHBondContact O-N 2.69Å; V230-K233 PolarHBondContact O-N 3.25Å; Q231-K233 PolarHBondContact O-N 2.81Å; K233-V235 PolarHBondContact O-N 2.98Å
234	L	95	Very high	94.9	Very high	69 Å²	69	87.4 Å²	87.4	36%	0.361	42%	0.42	S	S	.	.			trans	-72.2	125.2	-171.5	-61.6	177.1	0	0	0	111.1	S229 K232 Y236	S229-L234 PolarHBondContact O-N 3.04Å; K232-L234 HydrophobicContact CB-CD1 4.12Å; K232-L234 HydrophobicContact CB-CD2 3.83Å; K232-L234 HydrophobicContact CB-CG 3.67Å; K232-L234 PolarHBondContact O-N 3.09Å; K232-L234 VanDerWaalsContact O-N 3.13Å; L234-Y236 HydrophobicContact CB-CE1 4.04Å; L234-Y236 HydrophobicContact CB-CE2 4.31Å; L234-Y236 HydrophobicContact CD1-CE1 4.31Å; L234-Y236 VanDerWaalsContact CD1-OH 3.28Å; L234-Y236 WeakPolarHBondContact CD1-OH 3.15Å
235	V	94.8	Very high	94.7	Very high	137 Å²	137	90.1 Å²	90.1	83%	0.83	44%	0.438	S	S	*	.			trans	-98.9	124.2	172.6	-177.2	0	0	0	0	108.5	K233	K233-V235 PolarHBondContact O-N 2.98Å
236	Y	96.7	Very high	94.5	Very high	40 Å²	40	89.7 Å²	89.7	16%	0.157	44%	0.436	C	S	.	.			trans	-110.1	140.4	-179.4	-58.1	-61.2	0	0	0	111.6	F225 S229 L234 Q256 K257 F260	F225-Y236 HydrophobicContact CE2-CE2 4.1Å; F225-Y236 HydrophobicContact CZ-CD2 4.43Å; F225-Y236 AromaticContact CZ-CE2 3.71Å; F225-Y236 HydrophobicContact CZ-CE2 3.71Å; S229-Y236 WeakPolarHBondContact OG-CE2 3.43Å; S229-Y236 PolarHBondContact OG-OH 3.48Å; L234-Y236 HydrophobicContact CB-CE1 4.04Å; L234-Y236 HydrophobicContact CB-CE2 4.31Å; L234-Y236 HydrophobicContact CD1-CE1 4.31Å; L234-Y236 VanDerWaalsContact CD1-OH 3.28Å; L234-Y236 WeakPolarHBondContact CD1-OH 3.15Å; Y236-Q256 HydrophobicContact CD1-CB 3.67Å; Y236-Q256 VanDerWaalsContact CD1-OE1 3.31Å; Y236-Q256 HydrophobicContact CD2-CB 4.14Å; Y236-Q256 HydrophobicContact CE1-CB 3.87Å; Y236-Q256 HydrophobicContact CE1-CG 4.43Å; Y236-Q256 HydrophobicContact CE2-CB 4.31Å; Y236-Q256 HydrophobicContact CG-CB 3.82Å; Y236-K257 WeakPolarHBondContact O-CD 3.42Å; Y236-K257 VanDerWaalsContact O-CG 3.26Å; Y236-K257 WeakPolarHBondContact O-CG 3.42Å; Y236-F260 HydrophobicContact CD2-CB 3.9Å; Y236-F260 HydrophobicContact CD2-CG 4.27Å; Y236-F260 HydrophobicContact CE2-CB 4.11Å; Y236-F260 HydrophobicContact CE2-CG 4.3Å
237	T	96.2	Very high	94.1	Very high	131 Å²	131	92.4 Å²	92.4	80%	0.804	46%	0.455	S	S	*	.			trans	-102	154.6	170.2	54.7	0	0	0	0	110.9
238	C	97.4	Very high	93.8	Very high	26 Å²	26	91.1 Å²	91.1	18%	0.176	45%	0.454	C	S	.	.			trans	-116.5	128.8	176	177.8	0	0	0	0	109.3	Y240 G242 K257	C238-Y240 VanDerWaalsContact C-N 3.3Å; C238-Y240 PolarHBondContact O-N 2.95Å; C238-Y240 PolarHBondContact SG-N 3.29Å; C238-G242 PolarHBondContact SG-N 2.68Å; C238-K257 HydrophobicContact CB-CB 4.06Å; C238-K257 HydrophobicContact CB-CD 3.72Å; C238-K257 HydrophobicContact CB-CG 4.44Å
239	K	94.3	Very high	93.7	Very high	190 Å²	190	90.8 Å²	90.8	83%	0.826	46%	0.456	S	S	*	.	S	Bend	trans	-68.6	-28	176.3	-61.6	-173.7	178.2	-174.6	0	113
240	Y	93.3	Very high	93.4	Very high	158 Å²	158	99.3 Å²	99.3	62%	0.62	50%	0.496	S	S	*	.	S	Bend	trans	-116.8	60.6	-174.1	-45.8	-40.9	0	0	0	111.2	C238 G242 R243	C238-Y240 VanDerWaalsContact C-N 3.3Å; C238-Y240 PolarHBondContact O-N 2.95Å; C238-Y240 PolarHBondContact SG-N 3.29Å; Y240-G242 PolarHBondContact O-N 2.83Å; Y240-R243 PolarHBondContact O-N 3.21Å
241	N	92.2	Very high	93.2	Very high	130 Å²	130	99.9 Å²	99.9	70%	0.695	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	20.3	168.4	-41.4	100.9	0	0	0	116.9	R243	N241-R243 HydrophobicContact CB-CG 4.3Å
242	G	91.6	Very high	93.3	Very high	36 Å²	36	97.5 Å²	97.5	37%	0.371	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	18.6	-175.3	0	0	0	0	0	114.8	C238 Y240	C238-G242 PolarHBondContact SG-N 2.68Å; Y240-G242 PolarHBondContact O-N 2.83Å
243	R	92.2	Very high	93.4	Very high	200 Å²	200	95 Å²	95	76%	0.755	48%	0.48	S	S	*	.			trans	-113.3	12.1	-172.2	-49.7	-176	-159.8	159	4.8	114.8	Y240 N241	Y240-R243 PolarHBondContact O-N 3.21Å; N241-R243 HydrophobicContact CB-CG 4.3Å
244	C	95.3	Very high	93.4	Very high	30 Å²	30	90.9 Å²	90.9	20%	0.203	47%	0.474	C	S	.	.			trans	-65	138.7	-180	-56.9	0	0	0	0	111.3	C255 C258	C244-C255 HydrophobicContact CB-CB 3.58Å; C244-C255 VanDerWaalsContact SG-CB 3.52Å; C244-C258 HydrophobicContact CB-CB 3.98Å; C244-C258 PolarHBondContact N-SG 3.4Å
245	S	93.3	Very high	93.5	Very high	70 Å²	70	88.1 Å²	88.1	49%	0.49	46%	0.46	S	S	.	.			trans	-63.5	143.9	171.8	-165.7	0	0	0	0	111.4	S247	S245-S247 WeakPolarHBondContact OG-CB 3.24Å; S245-S247 PolarHBondContact OG-OG 3.35Å
246	V	93.9	Very high	93.6	Very high	2 Å²	2	86.8 Å²	86.8	1%	0.012	45%	0.445	C	S	.	.			trans	-141.2	72	171	-175.1	0	0	0	0	105	V204 C205 R252 C258 R259	V204-V246 HydrophobicContact CG1-CG1 4.45Å; V204-V246 WeakPolarHBondContact O-CG1 3.21Å; V204-V246 VanDerWaalsContact O-O 3.08Å; C205-V246 HydrophobicContact CB-CG1 4.06Å; V246-R252 HydrophobicContact CG1-CB 3.96Å; V246-C258 HydrophobicContact CG2-CB 4.03Å; V246-R259 HydrophobicContact CG1-CB 4.26Å; V246-R259 HydrophobicContact CG1-CG 4.08Å; V246-R259 HydrophobicContact CG2-CB 4.28Å
247	S	90.2	Very high	93.7	Very high	57 Å²	57	88 Å²	88	40%	0.399	45%	0.451	S	S	.	.			trans	-105.9	-26.7	-170.3	40.8	0	0	0	0	113	C205 S245 N251	C205-S247 CarbonylContact C-O 3.57Å; C205-S247 VanDerWaalsContact C-O 3.32Å; C205-S247 CarbonylContact O-C 3.04Å; S245-S247 WeakPolarHBondContact OG-CB 3.24Å; S245-S247 PolarHBondContact OG-OG 3.35Å; S247-N251 PolarHBondContact N-OD1 2.84Å; S247-N251 PolarHBondContact OG-ND2 3Å
248	D	90.2	Very high	93.8	Very high	53 Å²	53	82.1 Å²	82.1	28%	0.283	42%	0.415	S	S	.	.	S	Bend	trans	-147.4	164.7	-165.4	51.8	-88.8	0	0	0	112.7	C205 Q250 N251 R252	C205-D248 CarbonylContact O-C 3.57Å; C205-D248 WeakPolarHBondContact O-CA 3.34Å; C205-D248 PolarHBondContact O-N 3.2Å; D248-Q250 PolarHBondContact O-N 3.25Å; D248-Q250 PolarHBondContact OD2-N 3.35Å; D248-N251 PolarHBondContact N-OD1 3.11Å; D248-N251 PolarHBondContact OD1-ND2 3.4Å; D248-N251 PolarHBondContact OD1-OD1 3.44Å; D248-N251 WeakPolarHBondContact OD2-CB 3.41Å; D248-N251 PolarHBondContact OD2-N 2.8Å; D248-N251 PolarHBondContact OD2-OD1 3.43Å; D248-R252 VanDerWaalsContact O-CB 3.31Å; D248-R252 WeakPolarHBondContact O-CB 3.37Å; D248-R252 PolarHBondContact O-N 3.45Å; D248-R252 VanDerWaalsContact O-N 3.11Å
249	K	92.4	Very high	93.8	Very high	120 Å²	120	81.4 Å²	81.4	52%	0.522	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-32.7	-177.6	-171	-176.8	-160	131.5	0	113.5	D207 R252	D207-K249 HydrophobicContact CB-CB 4.15Å; D207-K249 HydrophobicContact CB-CG 4.39Å; D207-K249 WeakPolarHBondContact OD1-CD 3.33Å; D207-K249 WeakPolarHBondContact OD1-CE 3.28Å; D207-K249 IonicContact OD1-NZ 3.77Å; D207-K249 PolarHBondContact OD1-NZ 3.35Å; D207-K249 IonicContact OD2-NZ 3.62Å; K249-R252 PolarHBondContact O-NE 3.24Å
250	Q	91.1	Very high	94	Very high	181 Å²	181	74.4 Å²	74.4	85%	0.846	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-49.7	-174.3	-67.9	172.8	-21.3	0	0	110.9	D248	D248-Q250 PolarHBondContact O-N 3.25Å; D248-Q250 PolarHBondContact OD2-N 3.35Å
251	N	90.3	Very high	94.2	Very high	43 Å²	43	69 Å²	69	23%	0.23	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-87.6	-10.6	-175.8	79.5	14.3	0	0	0	115.5	S247 D248 N253 S254	S247-N251 PolarHBondContact N-OD1 2.84Å; S247-N251 PolarHBondContact OG-ND2 3Å; D248-N251 PolarHBondContact N-OD1 3.11Å; D248-N251 PolarHBondContact OD1-ND2 3.4Å; D248-N251 PolarHBondContact OD1-OD1 3.44Å; D248-N251 WeakPolarHBondContact OD2-CB 3.41Å; D248-N251 PolarHBondContact OD2-N 2.8Å; D248-N251 PolarHBondContact OD2-OD1 3.43Å; N251-N253 PolarHBondContact O-N 3.35Å; N251-S254 VanDerWaalsContact O-CB 3.24Å; N251-S254 WeakPolarHBondContact O-CB 3.37Å; N251-S254 PolarHBondContact O-N 2.86Å; N251-S254 PolarHBondContact O-OG 3.36Å
252	R	93	Very high	94.4	Very high	30 Å²	30	68.5 Å²	68.5	11%	0.113	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-54.6	-21.3	-176.3	66.3	-173.1	178.6	-169.5	-6.8	115.4	C205 D207 C219 V246 D248 K249 R259	C205-R252 HydrophobicContact CB-CB 3.86Å; C205-R252 VanDerWaalsContact SG-CD 3.54Å; C205-R252 PolarHBondContact SG-NH1 3.29Å; D207-R252 IonicContact OD2-CZ 2.69Å; D207-R252 IonicContact OD2-NH1 2.94Å; D207-R252 PolarHBondContact OD2-NH1 3.11Å; D207-R252 IonicContact OD2-NH2 2.81Å; D207-R252 PolarHBondContact OD2-NH2 2.97Å; C219-R252 PolarHBondContact SG-NH1 3.43Å; V246-R252 HydrophobicContact CG1-CB 3.96Å; D248-R252 VanDerWaalsContact O-CB 3.31Å; D248-R252 WeakPolarHBondContact O-CB 3.37Å; D248-R252 PolarHBondContact O-N 3.45Å; D248-R252 VanDerWaalsContact O-N 3.11Å; K249-R252 PolarHBondContact O-NE 3.24Å; R252-R259 WeakPolarHBondContact O-CD 3.36Å
253	N	94.8	Very high	94.7	Very high	109 Å²	109	66.8 Å²	66.8	58%	0.583	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-83.3	-14	178.5	-68.6	-14.8	0	0	0	113.5	N251 C255 R259	N251-N253 PolarHBondContact O-N 3.35Å; N253-C255 PolarHBondContact O-N 3.4Å; N253-C255 VanDerWaalsContact O-N 3.15Å; N253-R259 PolarHBondContact OD1-NH1 2.99Å
254	S	93.7	Very high	94.9	Very high	97 Å²	97	60.8 Å²	60.8	68%	0.678	31%	0.313	S	S	*	.	S	Bend	trans	-60.9	-24.7	-173.3	-62.4	0	0	0	0	114.7	N251	N251-S254 VanDerWaalsContact O-CB 3.24Å; N251-S254 WeakPolarHBondContact O-CB 3.37Å; N251-S254 PolarHBondContact O-N 2.86Å; N251-S254 PolarHBondContact O-OG 3.36Å
255	C	97.2	Very high	95	Very high	11 Å²	11	67.9 Å²	67.9	7%	0.074	34%	0.341	C	S	.	.			trans	-147.8	109.1	169.4	-173.4	0	0	0	0	112.1	C244 N253 K257 C258 R259	C244-C255 HydrophobicContact CB-CB 3.58Å; C244-C255 VanDerWaalsContact SG-CB 3.52Å; N253-C255 PolarHBondContact O-N 3.4Å; N253-C255 VanDerWaalsContact O-N 3.15Å; C255-K257 VanDerWaalsContact C-N 3.31Å; C255-K257 PolarHBondContact O-N 2.92Å; C255-C258 HydrophobicContact CB-CB 4.09Å; C255-C258 PolarHBondContact O-N 3.46Å; C255-R259 WeakPolarHBondContact O-CB 3.49Å; C255-R259 PolarHBondContact O-N 2.95Å
256	Q	97.3	Very high	95.1	Very high	108 Å²	108	65.7 Å²	65.7	51%	0.505	33%	0.329	S	S	.	.	H	α-helix	trans	-59.2	-39.3	178.5	-65.1	175.7	-8.8	0	0	112.3	F225 Y236 R259 F260	F225-Q256 HydrophobicContact CE2-CB 4.28Å; F225-Q256 HydrophobicContact CE2-CG 4.31Å; F225-Q256 HydrophobicContact CZ-CB 4.25Å; F225-Q256 WeakPolarHBondContact CZ-O 3.44Å; Y236-Q256 HydrophobicContact CD1-CB 3.67Å; Y236-Q256 VanDerWaalsContact CD1-OE1 3.31Å; Y236-Q256 HydrophobicContact CD2-CB 4.14Å; Y236-Q256 HydrophobicContact CE1-CB 3.87Å; Y236-Q256 HydrophobicContact CE1-CG 4.43Å; Y236-Q256 HydrophobicContact CE2-CB 4.31Å; Y236-Q256 HydrophobicContact CG-CB 3.82Å; Q256-R259 PolarHBondContact O-N 2.79Å; Q256-F260 WeakPolarHBondContact O-CB 3.25Å; Q256-F260 PolarHBondContact O-N 2.89Å
257	K	97.7	Very high	95.2	Very high	65 Å²	65	67.5 Å²	67.5	28%	0.283	35%	0.349	S	S	.	.	H	α-helix	trans	-60.8	-54.6	175.3	-169.7	-166.6	-173.5	-52.5	0	111.9	Y236 C238 C255 R259 F260 D261	Y236-K257 WeakPolarHBondContact O-CD 3.42Å; Y236-K257 VanDerWaalsContact O-CG 3.26Å; Y236-K257 WeakPolarHBondContact O-CG 3.42Å; C238-K257 HydrophobicContact CB-CB 4.06Å; C238-K257 HydrophobicContact CB-CD 3.72Å; C238-K257 HydrophobicContact CB-CG 4.44Å; C255-K257 VanDerWaalsContact C-N 3.31Å; C255-K257 PolarHBondContact O-N 2.92Å; K257-R259 PolarHBondContact O-N 2.79Å; K257-F260 PolarHBondContact O-N 2.68Å; K257-D261 IonicContact NZ-OD1 2.62Å; K257-D261 PolarHBondContact NZ-OD1 3.11Å; K257-D261 IonicContact NZ-OD2 3.85Å; K257-D261 PolarHBondContact NZ-OD2 3.13Å; K257-D261 WeakPolarHBondContact O-CB 3.35Å; K257-D261 VanDerWaalsContact O-CG 3.22Å; K257-D261 PolarHBondContact O-N 3.45Å
258	C	97.8	Very high	95.5	Very high	8 Å²	8	65.1 Å²	65.1	5%	0.054	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-34.3	-177	-59.7	0	0	0	0	111.3	C244 V246 C255 R262	C244-C258 HydrophobicContact CB-CB 3.98Å; C244-C258 PolarHBondContact N-SG 3.4Å; V246-C258 HydrophobicContact CG2-CB 4.03Å; C255-C258 HydrophobicContact CB-CB 4.09Å; C255-C258 PolarHBondContact O-N 3.46Å; C258-R262 VanDerWaalsContact O-CB 3.25Å; C258-R262 WeakPolarHBondContact O-CB 3.43Å; C258-R262 PolarHBondContact O-N 2.76Å
259	R	98	Very high	95.8	Very high	11 Å²	11	63.3 Å²	63.3	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-65	-43.7	172.6	-169.8	-171.7	-174.6	172.4	1.2	112.2	V204 G221 C222 F225 V246 R252 N253 C255 Q256 K257 R262 C263	V204-R259 HydrophobicContact CG1-CG 4.27Å; G221-R259 PolarHBondContact O-NH2 2.88Å; C222-R259 PolarHBondContact SG-NH2 3.33Å; C222-R259 VanDerWaalsContact SG-NH2 3.36Å; F225-R259 HydrophobicContact CD1-CG 3.91Å; F225-R259 HydrophobicContact CE1-CB 3.93Å; F225-R259 HydrophobicContact CE1-CG 3.71Å; F225-R259 HydrophobicContact CZ-CB 4.22Å; F225-R259 HydrophobicContact CZ-CG 4.34Å; V246-R259 HydrophobicContact CG1-CB 4.26Å; V246-R259 HydrophobicContact CG1-CG 4.08Å; V246-R259 HydrophobicContact CG2-CB 4.28Å; R252-R259 WeakPolarHBondContact O-CD 3.36Å; N253-R259 PolarHBondContact OD1-NH1 2.99Å; C255-R259 WeakPolarHBondContact O-CB 3.49Å; C255-R259 PolarHBondContact O-N 2.95Å; Q256-R259 PolarHBondContact O-N 2.79Å; K257-R259 PolarHBondContact O-N 2.79Å; R259-R262 CarbonylContact O-C 3.15Å; R259-R262 PolarHBondContact O-N 3.29Å; R259-C263 PolarHBondContact O-N 3.23Å; R259-C263 PolarHBondContact O-SG 3.36Å; R259-C263 VanDerWaalsContact O-SG 3.39Å
260	F	98	Very high	95.9	Very high	43 Å²	43	64.5 Å²	64.5	19%	0.189	33%	0.329	C	S	.	.	H	α-helix	trans	-69.9	-42.9	179.6	-172.5	-107.5	0	0	0	112.2	F225 F226 S229 V230 Y236 Q256 K257 R262 C263 I264	F225-F260 HydrophobicContact CE1-CB 3.81Å; F225-F260 HydrophobicContact CE1-CD2 4.19Å; F225-F260 HydrophobicContact CZ-CB 4.02Å; F226-F260 HydrophobicContact CD2-CD2 4.27Å; F226-F260 AromaticContact CD2-CE2 3.78Å; F226-F260 HydrophobicContact CD2-CE2 3.78Å; F226-F260 AromaticContact CE2-CE2 3.95Å; F226-F260 HydrophobicContact CE2-CE2 3.95Å; F226-F260 HydrophobicContact CE2-CZ 4.45Å; S229-F260 VanDerWaalsContact CB-CE2 3.44Å; V230-F260 HydrophobicContact CG2-CE2 4.1Å; V230-F260 HydrophobicContact CG2-CZ 4.18Å; Y236-F260 HydrophobicContact CD2-CB 3.9Å; Y236-F260 HydrophobicContact CD2-CG 4.27Å; Y236-F260 HydrophobicContact CE2-CB 4.11Å; Y236-F260 HydrophobicContact CE2-CG 4.3Å; Q256-F260 WeakPolarHBondContact O-CB 3.25Å; Q256-F260 PolarHBondContact O-N 2.89Å; K257-F260 PolarHBondContact O-N 2.68Å; F260-R262 PolarHBondContact O-N 3.47Å; F260-C263 WeakPolarHBondContact O-CB 3.36Å; F260-C263 PolarHBondContact O-N 3.45Å; F260-C263 VanDerWaalsContact O-N 3.13Å; F260-I264 HydrophobicContact CE1-CG1 4.18Å; F260-I264 HydrophobicContact CZ-CD1 4.26Å; F260-I264 HydrophobicContact CZ-CG1 4.3Å; F260-I264 WeakPolarHBondContact O-CG1 3.48Å; F260-I264 PolarHBondContact O-N 3.01Å
261	D	97.1	Very high	96	Very high	46 Å²	46	61.5 Å²	61.5	25%	0.246	32%	0.319	C	S	.	.	H	α-helix	trans	-55.9	-39.5	170.8	-63.7	-21	0	0	0	110.6	K257 I264 K265	K257-D261 IonicContact NZ-OD1 2.62Å; K257-D261 PolarHBondContact NZ-OD1 3.11Å; K257-D261 IonicContact NZ-OD2 3.85Å; K257-D261 PolarHBondContact NZ-OD2 3.13Å; K257-D261 WeakPolarHBondContact O-CB 3.35Å; K257-D261 VanDerWaalsContact O-CG 3.22Å; K257-D261 PolarHBondContact O-N 3.45Å; D261-I264 PolarHBondContact O-N 2.78Å; D261-K265 WeakPolarHBondContact O-CB 3.44Å; D261-K265 VanDerWaalsContact O-CG 3.27Å; D261-K265 WeakPolarHBondContact O-CG 3.27Å; D261-K265 PolarHBondContact O-N 3.42Å
262	R	97	Very high	96.1	Very high	118 Å²	118	63.1 Å²	63.1	45%	0.445	33%	0.327	S	S	.	.	H	α-helix	trans	-76.3	-28.4	177.8	-162	170.3	177.3	129.8	0.4	113.6	V204 C258 R259 F260 G266	V204-R262 HydrophobicContact CG1-CB 4.26Å; V204-R262 HydrophobicContact CG1-CG 4.35Å; V204-R262 WeakPolarHBondContact O-CD 3.17Å; V204-R262 PolarHBondContact O-NE 3.48Å; C258-R262 VanDerWaalsContact O-CB 3.25Å; C258-R262 WeakPolarHBondContact O-CB 3.43Å; C258-R262 PolarHBondContact O-N 2.76Å; R259-R262 CarbonylContact O-C 3.15Å; R259-R262 PolarHBondContact O-N 3.29Å; F260-R262 PolarHBondContact O-N 3.47Å; R262-G266 PolarHBondContact O-N 3.49Å
263	C	98.2	Very high	96.1	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-50.4	165.2	-73.8	0	0	0	0	111.1	V204 F226 R259 F260 G266 G267 M268	V204-C263 HydrophobicContact CG2-CB 4.45Å; F226-C263 HydrophobicContact CD2-CB 3.66Å; F226-C263 HydrophobicContact CE2-CB 4.31Å; F226-C263 HydrophobicContact CG-CB 4.49Å; R259-C263 PolarHBondContact O-N 3.23Å; R259-C263 PolarHBondContact O-SG 3.36Å; R259-C263 VanDerWaalsContact O-SG 3.39Å; F260-C263 WeakPolarHBondContact O-CB 3.36Å; F260-C263 PolarHBondContact O-N 3.45Å; F260-C263 VanDerWaalsContact O-N 3.13Å; C263-G266 PolarHBondContact O-N 3.43Å; C263-G267 PolarHBondContact O-N 2.66Å; C263-M268 HydrophobicContact CB-CB 4.34Å; C263-M268 HydrophobicContact CB-CG 4.25Å; C263-M268 HydrophobicContact CB-SD 3.55Å; C263-M268 VanDerWaalsContact CB-SD 3.55Å; C263-M268 VanDerWaalsContact O-CB 3.25Å; C263-M268 WeakPolarHBondContact O-CB 3.26Å; C263-M268 VanDerWaalsContact O-CG 3.3Å; C263-M268 WeakPolarHBondContact O-CG 3.36Å; C263-M268 PolarHBondContact O-N 2.91Å
264	I	97.3	Very high	95.7	Very high	75 Å²	75	61 Å²	61	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-48.9	178.8	-63.7	-72	0	0	0	110.7	F226 F260 D261 G266 G267	F226-I264 HydrophobicContact CE2-CD1 3.74Å; F226-I264 HydrophobicContact CE2-CG1 4.44Å; F226-I264 HydrophobicContact CZ-CD1 4.3Å; F260-I264 HydrophobicContact CE1-CG1 4.18Å; F260-I264 HydrophobicContact CZ-CD1 4.26Å; F260-I264 HydrophobicContact CZ-CG1 4.3Å; F260-I264 WeakPolarHBondContact O-CG1 3.48Å; F260-I264 PolarHBondContact O-N 3.01Å; D261-I264 PolarHBondContact O-N 2.78Å; I264-G266 VanDerWaalsContact C-N 3.25Å; I264-G266 PolarHBondContact O-N 2.88Å; I264-G267 PolarHBondContact O-N 3.25Å
265	K	96.4	Very high	95.4	Very high	178 Å²	178	59.4 Å²	59.4	77%	0.774	30%	0.301	S	S	*	.	H	α-helix	trans	-63	-29.4	176.9	-72.2	174.3	179.1	-175.9	0	113.4	D261 G267	D261-K265 WeakPolarHBondContact O-CB 3.44Å; D261-K265 VanDerWaalsContact O-CG 3.27Å; D261-K265 WeakPolarHBondContact O-CG 3.27Å; D261-K265 PolarHBondContact O-N 3.42Å; K265-G267 PolarHBondContact O-N 3.01Å
266	G	95.1	Very high	94.8	Very high	24 Å²	24	63.3 Å²	63.3	25%	0.247	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	2.5	172.8	0	0	0	0	0	114.5	A216 R262 C263 I264	A216-G266 WeakPolarHBondContact CB-O 3.29Å; R262-G266 PolarHBondContact O-N 3.49Å; C263-G266 PolarHBondContact O-N 3.43Å; I264-G266 VanDerWaalsContact C-N 3.25Å; I264-G266 PolarHBondContact O-N 2.88Å
267	G	96.4	Very high	94.3	Very high	41 Å²	41	65.6 Å²	65.6	42%	0.423	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	13.6	176.6	0	0	0	0	0	115.3	C263 I264 K265 A269	C263-G267 PolarHBondContact O-N 2.66Å; I264-G267 PolarHBondContact O-N 3.25Å; K265-G267 PolarHBondContact O-N 3.01Å; G267-A269 PolarHBondContact O-N 3.23Å
268	M	97.8	Very high	93.7	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.03	34%	0.341	C	S	.	.			trans	-70.8	114	177.8	-62.7	-172.6	85.5	0	0	111.3	V204 Y214 A216 T218 F226 C263	V204-M268 HydrophobicContact CG2-SD 4.24Å; Y214-M268 HydrophobicContact CD2-CE 3.77Å; Y214-M268 CarbonylContact O-C 3.5Å; Y214-M268 WeakPolarHBondContact O-CA 3.42Å; A216-M268 HydrophobicContact CB-CB 4.49Å; A216-M268 HydrophobicContact CB-CG 3.5Å; A216-M268 VanDerWaalsContact CB-CG 3.5Å; T218-M268 HydrophobicContact CG2-CE 4.42Å; T218-M268 HydrophobicContact CG2-CG 4.44Å; T218-M268 HydrophobicContact CG2-SD 4.03Å; F226-M268 HydrophobicContact CB-CE 3.48Å; F226-M268 VanDerWaalsContact CB-CE 3.48Å; F226-M268 HydrophobicContact CB-SD 3.84Å; F226-M268 HydrophobicContact CD1-CB 4.04Å; F226-M268 HydrophobicContact CD1-CE 3.84Å; F226-M268 HydrophobicContact CD1-SD 4.49Å; F226-M268 HydrophobicContact CD2-CB 3.76Å; F226-M268 HydrophobicContact CD2-CE 4.45Å; F226-M268 HydrophobicContact CD2-SD 4.11Å; F226-M268 HydrophobicContact CE1-CB 3.84Å; F226-M268 HydrophobicContact CE2-CB 3.56Å; F226-M268 HydrophobicContact CG-CB 3.99Å; F226-M268 HydrophobicContact CG-CE 3.67Å; F226-M268 HydrophobicContact CG-SD 3.89Å; F226-M268 HydrophobicContact CZ-CB 3.6Å; F226-M268 WeakPolarHBondContact CZ-O 3.29Å; C263-M268 HydrophobicContact CB-CB 4.34Å; C263-M268 HydrophobicContact CB-CG 4.25Å; C263-M268 HydrophobicContact CB-SD 3.55Å; C263-M268 VanDerWaalsContact CB-SD 3.55Å; C263-M268 VanDerWaalsContact O-CB 3.25Å; C263-M268 WeakPolarHBondContact O-CB 3.26Å; C263-M268 VanDerWaalsContact O-CG 3.3Å; C263-M268 WeakPolarHBondContact O-CG 3.36Å; C263-M268 PolarHBondContact O-N 2.91Å
269	A	95.6	Very high	93.1	Very high	15 Å²	15	72.2 Å²	72.2	12%	0.124	36%	0.355	C	S	.	.			trans	-84.7	112.6	-173.6	0	0	0	0	0	111.9	Y214 R215 G267 D271 L272	Y214-A269 WeakPolarHBondContact O-CB 3.36Å; Y214-A269 PolarHBondContact O-N 2.85Å; R215-A269 HydrophobicContact CG-CB 4.41Å; G267-A269 PolarHBondContact O-N 3.23Å; A269-D271 VanDerWaalsContact C-N 3.33Å; A269-D271 WeakPolarHBondContact CB-OD1 3.35Å; A269-D271 PolarHBondContact O-N 2.99Å; A269-L272 HydrophobicContact CB-CD1 4.03Å; A269-L272 HydrophobicContact CB-CG 4.02Å; A269-L272 PolarHBondContact O-N 3.27Å
270	K	94.5	Very high	92.7	Very high	145 Å²	145	75.1 Å²	75.1	63%	0.63	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-67.3	-30.7	-175.5	64.4	-177.6	-179.9	179.6	0	113.4	F226 V230 L272 V273	F226-K270 HydrophobicContact CZ-CB 4.18Å; V230-K270 HydrophobicContact CG1-CB 4.18Å; V230-K270 HydrophobicContact CG2-CB 4.12Å; K270-L272 VanDerWaalsContact C-N 3.29Å; K270-L272 PolarHBondContact O-N 3.45Å; K270-V273 WeakPolarHBondContact O-CB 3.37Å; K270-V273 PolarHBondContact O-N 3Å; K270-V273 VanDerWaalsContact O-N 3.16Å
271	D	93	Very high	92.2	Very high	119 Å²	119	75.5 Å²	75.5	64%	0.636	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-67.4	-25	178.6	54.6	-65	0	0	0	113.3	A269 V273	A269-D271 VanDerWaalsContact C-N 3.33Å; A269-D271 WeakPolarHBondContact CB-OD1 3.35Å; A269-D271 PolarHBondContact O-N 2.99Å; D271-V273 PolarHBondContact O-N 2.87Å
272	L	92.4	Very high	91.8	Very high	76 Å²	76	77.8 Å²	77.8	40%	0.398	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-79.6	-3.6	173.5	-61.8	-173.1	0	0	0	113.2	Y214 R215 A269 K270	Y214-L272 HydrophobicContact CD1-CB 3.93Å; R215-L272 HydrophobicContact CG-CD1 3.69Å; A269-L272 HydrophobicContact CB-CD1 4.03Å; A269-L272 HydrophobicContact CB-CG 4.02Å; A269-L272 PolarHBondContact O-N 3.27Å; K270-L272 VanDerWaalsContact C-N 3.29Å; K270-L272 PolarHBondContact O-N 3.45Å
273	V	91.9	Very high	91.5	Very high	12 Å²	12	77.6 Å²	77.6	7%	0.073	39%	0.389	C	S	.	.	S	Bend	trans	-88	107.4	170.8	-174.8	0	0	0	0	107.9	Y214 F226 R227 V230 Q231 K270 D271 D275	Y214-V273 HydrophobicContact CD1-CG2 3.76Å; Y214-V273 HydrophobicContact CE1-CB 4.39Å; Y214-V273 HydrophobicContact CE1-CG2 3.6Å; Y214-V273 HydrophobicContact CG-CG2 4.45Å; F226-V273 HydrophobicContact CD1-CG2 4.09Å; F226-V273 HydrophobicContact CE1-CG2 3.75Å; R227-V273 HydrophobicContact CG-CG1 4.36Å; V230-V273 HydrophobicContact CB-CB 4.22Å; V230-V273 HydrophobicContact CB-CG1 4.16Å; V230-V273 HydrophobicContact CB-CG2 4.03Å; V230-V273 HydrophobicContact CG1-CB 3.78Å; V230-V273 HydrophobicContact CG1-CG1 4.01Å; V230-V273 HydrophobicContact CG1-CG2 4Å; V230-V273 HydrophobicContact CG2-CG2 4.29Å; Q231-V273 HydrophobicContact CG-CG1 3.42Å; Q231-V273 VanDerWaalsContact CG-CG1 3.42Å; K270-V273 WeakPolarHBondContact O-CB 3.37Å; K270-V273 PolarHBondContact O-N 3Å; K270-V273 VanDerWaalsContact O-N 3.16Å; D271-V273 PolarHBondContact O-N 2.87Å; V273-D275 PolarHBondContact O-N 3.02Å
274	L	88	Confident	91.2	Very high	82 Å²	82	86.1 Å²	86.1	43%	0.429	42%	0.421	S	S	.	.			trans	-53.9	123.9	175.7	-70	163.6	0	0	0	110.5	Q231 K278	Q231-L274 PolarHBondContact NE2-O 3.32Å; L274-K278 HydrophobicContact CD2-CB 3.78Å; L274-K278 HydrophobicContact CD2-CD 4.38Å
275	D	85.9	Confident	90.8	Very high	64 Å²	64	87.5 Å²	87.5	34%	0.342	43%	0.428	S	S	.	.			trans	-64.5	164.5	165.1	51.8	52.4	0	0	0	111.1	V273 E277 K278 R279	V273-D275 PolarHBondContact O-N 3.02Å; D275-E277 VanDerWaalsContact C-N 3.27Å; D275-E277 PolarHBondContact O-N 2.96Å; D275-K278 PolarHBondContact O-N 3.34Å; D275-K278 WeakPolarHBondContact OD1-CB 3.32Å; D275-K278 WeakPolarHBondContact OD1-CD 3.39Å; D275-K278 WeakPolarHBondContact OD1-CG 3.33Å; D275-K278 PolarHBondContact OD1-N 3.18Å; D275-K278 WeakPolarHBondContact OD2-CD 3.49Å; D275-K278 WeakPolarHBondContact OD2-CE 3.43Å; D275-K278 IonicContact OD2-NZ 3.91Å; D275-K278 PolarHBondContact OD2-NZ 3.37Å; D275-R279 WeakPolarHBondContact O-CB 3.36Å; D275-R279 PolarHBondContact O-N 3.02Å
276	E	84.7	Confident	90.5	Very high	94 Å²	94	81 Å²	81	44%	0.439	40%	0.401	S	S	.	.	H	α-helix	trans	-66.2	-32.5	-172.9	-165.9	55.1	-149.6	0	0	111.9	R279 L280	E276-R279 VanDerWaalsContact CD-NE 3.29Å; E276-R279 WeakPolarHBondContact O-CB 3.21Å; E276-R279 PolarHBondContact O-N 2.98Å; E276-R279 IonicContact OE1-CZ 2.77Å; E276-R279 IonicContact OE1-NE 3.61Å; E276-R279 PolarHBondContact OE1-NE 2.95Å; E276-R279 IonicContact OE1-NH2 2.61Å; E276-R279 PolarHBondContact OE1-NH2 3.12Å; E276-R279 IonicContact OE2-CZ 3.5Å; E276-R279 IonicContact OE2-NE 3.34Å; E276-R279 PolarHBondContact OE2-NE 3.15Å; E276-R279 IonicContact OE2-NH2 2.73Å; E276-L280 HydrophobicContact CG-CD1 4.11Å; E276-L280 WeakPolarHBondContact O-CB 3.29Å; E276-L280 WeakPolarHBondContact O-CD1 3.28Å; E276-L280 VanDerWaalsContact O-CG 3.25Å; E276-L280 WeakPolarHBondContact O-CG 3.19Å; E276-L280 PolarHBondContact O-N 3.21Å
277	E	86.9	Confident	90.3	Very high	156 Å²	156	84 Å²	84	73%	0.729	41%	0.409	S	S	*	.	H	α-helix	trans	-64	-51.7	175.6	-174.4	178.8	-171.9	0	0	112	D275 R279 L280 A281	D275-E277 VanDerWaalsContact C-N 3.27Å; D275-E277 PolarHBondContact O-N 2.96Å; E277-R279 VanDerWaalsContact C-N 3.26Å; E277-R279 PolarHBondContact O-N 3.06Å; E277-L280 PolarHBondContact O-N 3.43Å; E277-A281 WeakPolarHBondContact O-CB 3.09Å; E277-A281 PolarHBondContact O-N 3.09Å
278	K	86.3	Confident	90.1	Very high	119 Å²	119	84.5 Å²	84.5	52%	0.517	41%	0.41	S	S	.	.	H	α-helix	trans	-65.7	-30.2	175.9	-68.1	167.4	-170	132.9	0	111.8	L274 D275 K282	L274-K278 HydrophobicContact CD2-CB 3.78Å; L274-K278 HydrophobicContact CD2-CD 4.38Å; D275-K278 PolarHBondContact O-N 3.34Å; D275-K278 WeakPolarHBondContact OD1-CB 3.32Å; D275-K278 WeakPolarHBondContact OD1-CD 3.39Å; D275-K278 WeakPolarHBondContact OD1-CG 3.33Å; D275-K278 PolarHBondContact OD1-N 3.18Å; D275-K278 WeakPolarHBondContact OD2-CD 3.49Å; D275-K278 WeakPolarHBondContact OD2-CE 3.43Å; D275-K278 IonicContact OD2-NZ 3.91Å; D275-K278 PolarHBondContact OD2-NZ 3.37Å; K278-K282 VanDerWaalsContact O-CB 3.27Å; K278-K282 WeakPolarHBondContact O-CB 3.3Å; K278-K282 PolarHBondContact O-N 2.76Å
279	R	85.2	Confident	89.7	Confident	93 Å²	93	87.1 Å²	87.1	35%	0.351	42%	0.424	S	S	.	.	H	α-helix	trans	-65.7	-45.5	173.4	-162.7	-176	81.2	89.6	2.3	111.2	D275 E276 E277 R283	D275-R279 WeakPolarHBondContact O-CB 3.36Å; D275-R279 PolarHBondContact O-N 3.02Å; E276-R279 VanDerWaalsContact CD-NE 3.29Å; E276-R279 WeakPolarHBondContact O-CB 3.21Å; E276-R279 PolarHBondContact O-N 2.98Å; E276-R279 IonicContact OE1-CZ 2.77Å; E276-R279 IonicContact OE1-NE 3.61Å; E276-R279 PolarHBondContact OE1-NE 2.95Å; E276-R279 IonicContact OE1-NH2 2.61Å; E276-R279 PolarHBondContact OE1-NH2 3.12Å; E276-R279 IonicContact OE2-CZ 3.5Å; E276-R279 IonicContact OE2-NE 3.34Å; E276-R279 PolarHBondContact OE2-NE 3.15Å; E276-R279 IonicContact OE2-NH2 2.73Å; E277-R279 VanDerWaalsContact C-N 3.26Å; E277-R279 PolarHBondContact O-N 3.06Å; R279-R283 WeakPolarHBondContact O-CB 3.48Å; R279-R283 PolarHBondContact O-N 2.99Å
280	L	88.8	Confident	89.5	Confident	71 Å²	71	91.8 Å²	91.8	37%	0.372	44%	0.438	S	S	.	.	H	α-helix	trans	-65.6	-43.7	174.7	-75	162.7	0	0	0	111.6	E276 E277 R283 R284	E276-L280 HydrophobicContact CG-CD1 4.11Å; E276-L280 WeakPolarHBondContact O-CB 3.29Å; E276-L280 WeakPolarHBondContact O-CD1 3.28Å; E276-L280 VanDerWaalsContact O-CG 3.25Å; E276-L280 WeakPolarHBondContact O-CG 3.19Å; E276-L280 PolarHBondContact O-N 3.21Å; E277-L280 PolarHBondContact O-N 3.43Å; L280-R283 PolarHBondContact O-N 3.2Å; L280-R284 WeakPolarHBondContact O-CG 3.3Å; L280-R284 PolarHBondContact O-N 2.59Å
281	A	88.3	Confident	89.3	Confident	51 Å²	51	87.4 Å²	87.4	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-62	-45.2	176.1	0	0	0	0	0	111.8	E277 R283 R284 L285	E277-A281 WeakPolarHBondContact O-CB 3.09Å; E277-A281 PolarHBondContact O-N 3.09Å; A281-R283 VanDerWaalsContact C-N 3.34Å; A281-R283 PolarHBondContact O-N 3.01Å; A281-R284 PolarHBondContact O-N 3.2Å; A281-L285 WeakPolarHBondContact O-CB 3.42Å; A281-L285 PolarHBondContact O-N 3.36Å
282	K	87.9	Confident	89.2	Confident	94 Å²	94	88.8 Å²	88.8	41%	0.409	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-41.3	173.7	-177	176.8	173.8	-176.4	0	111.5	N120 K278 L285 I286	N120-K282 WeakPolarHBondContact OD1-CE 3.46Å; N120-K282 PolarHBondContact OD1-NZ 3.02Å; K278-K282 VanDerWaalsContact O-CB 3.27Å; K278-K282 WeakPolarHBondContact O-CB 3.3Å; K278-K282 PolarHBondContact O-N 2.76Å; K282-L285 PolarHBondContact O-N 3.46Å; K282-I286 HydrophobicContact CG-CD1 4.01Å; K282-I286 VanDerWaalsContact O-CG1 3.29Å; K282-I286 WeakPolarHBondContact O-CG1 3.49Å; K282-I286 PolarHBondContact O-N 3.14Å
283	R	90.8	Very high	89	Confident	115 Å²	115	92.3 Å²	92.3	43%	0.434	44%	0.437	S	S	.	.	H	α-helix	trans	-62.3	-48.2	175.4	-179.5	176.6	-79.8	-155.3	-11.1	111.4	S116 R279 L280 A281 L285 I286 E287	S116-R283 PolarHBondContact OG-NH2 2.64Å; R279-R283 WeakPolarHBondContact O-CB 3.48Å; R279-R283 PolarHBondContact O-N 2.99Å; L280-R283 PolarHBondContact O-N 3.2Å; A281-R283 VanDerWaalsContact C-N 3.34Å; A281-R283 PolarHBondContact O-N 3.01Å; R283-L285 PolarHBondContact O-N 2.68Å; R283-I286 PolarHBondContact O-N 3.15Å; R283-E287 PolarHBondContact O-N 2.67Å
284	R	92.4	Very high	88.9	Confident	179 Å²	179	99.4 Å²	99.4	68%	0.675	46%	0.463	S	S	*	.	H	α-helix	trans	-59	-42.4	175.8	-73.3	173.8	178.5	163.7	-0.4	112.3	L280 A281 E287 A288	L280-R284 WeakPolarHBondContact O-CG 3.3Å; L280-R284 PolarHBondContact O-N 2.59Å; A281-R284 PolarHBondContact O-N 3.2Å; R284-E287 PolarHBondContact O-N 3.26Å; R284-A288 WeakPolarHBondContact O-CB 3.47Å; R284-A288 PolarHBondContact O-N 3.37Å
285	L	89.1	Confident	88.9	Confident	103 Å²	103	97.7 Å²	97.7	54%	0.539	46%	0.46	S	S	.	.	H	α-helix	trans	-65.6	-40.5	177.3	-179.2	62	0	0	0	112.3	A281 K282 R283 E287 N289	A281-L285 WeakPolarHBondContact O-CB 3.42Å; A281-L285 PolarHBondContact O-N 3.36Å; K282-L285 PolarHBondContact O-N 3.46Å; R283-L285 PolarHBondContact O-N 2.68Å; L285-E287 VanDerWaalsContact C-N 3.34Å; L285-N289 VanDerWaalsContact O-CB 3.32Å; L285-N289 WeakPolarHBondContact O-CB 3.16Å; L285-N289 PolarHBondContact O-N 3.14Å; L285-N289 PolarHBondContact O-ND2 3.2Å
286	I	89.4	Confident	88.9	Confident	41 Å²	41	100.3 Å²	100.3	21%	0.21	47%	0.471	C	S	.	.	H	α-helix	trans	-62.1	-44.2	174.2	-71.1	165.6	0	0	0	110.3	K282 R283 N289 R290	K282-I286 HydrophobicContact CG-CD1 4.01Å; K282-I286 VanDerWaalsContact O-CG1 3.29Å; K282-I286 WeakPolarHBondContact O-CG1 3.49Å; K282-I286 PolarHBondContact O-N 3.14Å; R283-I286 PolarHBondContact O-N 3.15Å; I286-N289 PolarHBondContact O-N 3.46Å; I286-R290 WeakPolarHBondContact O-CG 3.48Å; I286-R290 PolarHBondContact O-N 3Å
287	E	91.4	Very high	88.8	Confident	88 Å²	88	98.5 Å²	98.5	41%	0.411	47%	0.469	S	S	.	.	H	α-helix	trans	-70.4	-43.1	-178	-152.1	52.2	-126.3	0	0	112.4	R283 R284 L285 N289 R290 A291	R283-E287 PolarHBondContact O-N 2.67Å; R284-E287 PolarHBondContact O-N 3.26Å; L285-E287 VanDerWaalsContact C-N 3.34Å; E287-N289 VanDerWaalsContact C-N 3.27Å; E287-N289 PolarHBondContact O-N 3.25Å; E287-R290 WeakPolarHBondContact O-CB 3.42Å; E287-R290 PolarHBondContact O-N 3.39Å; E287-R290 IonicContact OE2-NH1 3.15Å; E287-R290 PolarHBondContact OE2-NH1 2.99Å; E287-A291 PolarHBondContact O-N 3.01Å
288	A	91.1	Very high	88.6	Confident	52 Å²	52	95.1 Å²	95.1	43%	0.43	46%	0.455	S	S	.	.	H	α-helix	trans	-60.4	-35.5	172.4	0	0	0	0	0	112.6	R284 R292	R284-A288 WeakPolarHBondContact O-CB 3.47Å; R284-A288 PolarHBondContact O-N 3.37Å; A288-R292 WeakPolarHBondContact O-CB 3.49Å; A288-R292 WeakPolarHBondContact O-CG 3.41Å; A288-R292 PolarHBondContact O-N 2.89Å
289	N	89.5	Confident	88.4	Confident	61 Å²	61	94 Å²	94	33%	0.326	46%	0.455	S	S	.	.	H	α-helix	trans	-70.2	-32.7	174.3	-74	-20.9	0	0	0	112.9	L285 I286 E287 R292 K293	L285-N289 VanDerWaalsContact O-CB 3.32Å; L285-N289 WeakPolarHBondContact O-CB 3.16Å; L285-N289 PolarHBondContact O-N 3.14Å; L285-N289 PolarHBondContact O-ND2 3.2Å; I286-N289 PolarHBondContact O-N 3.46Å; E287-N289 VanDerWaalsContact C-N 3.27Å; E287-N289 PolarHBondContact O-N 3.25Å; N289-R292 PolarHBondContact OD1-NH2 2.86Å; N289-K293 WeakPolarHBondContact O-CG 3.37Å; N289-K293 PolarHBondContact O-N 3.08Å
290	R	91.7	Very high	88	Confident	112 Å²	112	92.4 Å²	92.4	42%	0.423	46%	0.462	S	S	.	.	H	α-helix	trans	-70	-45.8	173.1	-72.2	164.2	166.7	-164.3	-12.4	111.2	I286 E287 R292 K293 R294	I286-R290 WeakPolarHBondContact O-CG 3.48Å; I286-R290 PolarHBondContact O-N 3Å; E287-R290 WeakPolarHBondContact O-CB 3.42Å; E287-R290 PolarHBondContact O-N 3.39Å; E287-R290 IonicContact OE2-NH1 3.15Å; E287-R290 PolarHBondContact OE2-NH1 2.99Å; R290-R292 PolarHBondContact O-N 3.03Å; R290-K293 PolarHBondContact O-N 3.24Å; R290-R294 PolarHBondContact O-N 3.44Å
291	A	90.8	Very high	87.4	Confident	54 Å²	54	92 Å²	92	45%	0.446	46%	0.46	S	S	.	.	H	α-helix	trans	-59.5	-44.9	176.1	0	0	0	0	0	112.2	E287 K293 R294 A295	E287-A291 PolarHBondContact O-N 3.01Å; A291-K293 PolarHBondContact O-N 3.27Å; A291-R294 PolarHBondContact O-N 3.07Å; A291-A295 PolarHBondContact O-N 3.38Å
292	R	90.6	Very high	86.6	Confident	147 Å²	147	95.3 Å²	95.3	56%	0.555	47%	0.466	S	S	*	.	H	α-helix	trans	-60.8	-44	174.8	-75.8	-166.6	-64.9	169.9	0.3	112.8	A288 N289 R290 R294 A295 E296	A288-R292 WeakPolarHBondContact O-CB 3.49Å; A288-R292 WeakPolarHBondContact O-CG 3.41Å; A288-R292 PolarHBondContact O-N 2.89Å; N289-R292 PolarHBondContact OD1-NH2 2.86Å; R290-R292 PolarHBondContact O-N 3.03Å; R292-R294 VanDerWaalsContact C-N 3.3Å; R292-R294 PolarHBondContact O-N 2.93Å; R292-A295 PolarHBondContact O-N 3.25Å; R292-E296 WeakPolarHBondContact O-CB 3.45Å; R292-E296 VanDerWaalsContact O-CG 3.28Å; R292-E296 WeakPolarHBondContact O-CG 3.23Å; R292-E296 PolarHBondContact O-N 2.91Å
293	K	89.2	Confident	85.6	Confident	150 Å²	150	98.1 Å²	98.1	65%	0.652	48%	0.481	S	S	*	.	H	α-helix	trans	-62.8	-34.4	177.4	-78.4	-171.7	172.5	-162.5	0	113.5	N289 R290 A291 S297	N289-K293 WeakPolarHBondContact O-CG 3.37Å; N289-K293 PolarHBondContact O-N 3.08Å; R290-K293 PolarHBondContact O-N 3.24Å; A291-K293 PolarHBondContact O-N 3.27Å; K293-S297 PolarHBondContact O-N 3.07Å; K293-S297 VanDerWaalsContact O-N 3.12Å; K293-S297 PolarHBondContact O-OG 3.31Å
294	R	88.1	Confident	84.2	Confident	161 Å²	161	96.4 Å²	96.4	61%	0.608	49%	0.487	S	S	*	.	H	α-helix	trans	-65	-53.1	172	-70.7	174.1	174.1	172.9	-4.7	110.7	R290 A291 R292 E296 S297 D298	R290-R294 PolarHBondContact O-N 3.44Å; A291-R294 PolarHBondContact O-N 3.07Å; R292-R294 VanDerWaalsContact C-N 3.3Å; R292-R294 PolarHBondContact O-N 2.93Å; R294-E296 VanDerWaalsContact C-N 3.26Å; R294-E296 PolarHBondContact O-N 3.49Å; R294-S297 PolarHBondContact O-N 3.08Å; R294-S297 PolarHBondContact O-OG 3.45Å; R294-D298 PolarHBondContact O-N 3.5Å; R294-D298 VanDerWaalsContact O-OD2 3.12Å
295	A	88.5	Confident	82.6	Confident	46 Å²	46	92.4 Å²	92.4	38%	0.38	48%	0.476	S	S	.	.	H	α-helix	trans	-60	-33.7	177.5	0	0	0	0	0	113.4	A291 R292 N299	A291-A295 PolarHBondContact O-N 3.38Å; R292-A295 PolarHBondContact O-N 3.25Å; A295-N299 WeakPolarHBondContact O-CB 3.36Å; A295-N299 PolarHBondContact O-N 3.35Å; A295-N299 VanDerWaalsContact O-N 3.09Å; A295-N299 PolarHBondContact O-ND2 3Å
296	E	85.4	Confident	81.2	Confident	119 Å²	119	94.2 Å²	94.2	56%	0.556	48%	0.484	S	S	*	.	H	α-helix	trans	-67.5	-40.3	174	-75.8	165.4	-170.4	0	0	112.2	R292 R294 A300	R292-E296 WeakPolarHBondContact O-CB 3.45Å; R292-E296 VanDerWaalsContact O-CG 3.28Å; R292-E296 WeakPolarHBondContact O-CG 3.23Å; R292-E296 PolarHBondContact O-N 2.91Å; R294-E296 VanDerWaalsContact C-N 3.26Å; R294-E296 PolarHBondContact O-N 3.49Å; E296-A300 WeakPolarHBondContact O-CB 3.29Å; E296-A300 PolarHBondContact O-N 3.01Å; E296-A300 VanDerWaalsContact O-N 3.16Å
297	S	82.7	Confident	79.7	Confident	57 Å²	57	99.7 Å²	99.7	40%	0.399	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-40.5	172.5	46.4	0	0	0	0	112.3	K293 R294 N299 A300 I301	K293-S297 PolarHBondContact O-N 3.07Å; K293-S297 VanDerWaalsContact O-N 3.12Å; K293-S297 PolarHBondContact O-OG 3.31Å; R294-S297 PolarHBondContact O-N 3.08Å; R294-S297 PolarHBondContact O-OG 3.45Å; S297-N299 PolarHBondContact O-N 3.26Å; S297-A300 PolarHBondContact O-N 2.56Å; S297-I301 WeakPolarHBondContact O-CG1 3.46Å; S297-I301 PolarHBondContact O-N 3.28Å; S297-I301 VanDerWaalsContact O-N 3.15Å
298	D	83.4	Confident	77.5	Confident	84 Å²	84	99.9 Å²	99.9	45%	0.449	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-42.2	-178	-53.8	-23.4	0	0	0	111.3	R294 I301 Q302	R294-D298 PolarHBondContact O-N 3.5Å; R294-D298 VanDerWaalsContact O-OD2 3.12Å; D298-I301 PolarHBondContact O-N 3.48Å; D298-Q302 PolarHBondContact O-N 3.06Å
299	N	81.3	Confident	75.3	Confident	95 Å²	95	100.9 Å²	100.9	51%	0.508	54%	0.54	S	S	.	.	H	α-helix	trans	-67.6	-35.5	175.7	-81.6	-79.9	0	0	0	112.8	A295 S297 I301 Q302 Q303	A295-N299 WeakPolarHBondContact O-CB 3.36Å; A295-N299 PolarHBondContact O-N 3.35Å; A295-N299 VanDerWaalsContact O-N 3.09Å; A295-N299 PolarHBondContact O-ND2 3Å; S297-N299 PolarHBondContact O-N 3.26Å; N299-I301 VanDerWaalsContact C-N 3.32Å; N299-I301 PolarHBondContact O-N 3.01Å; N299-Q302 PolarHBondContact O-N 2.92Å; N299-Q303 PolarHBondContact O-N 3.5Å
300	A	77.6	Confident	73.7	Confident	60 Å²	60	104.4 Å²	104.4	50%	0.496	57%	0.566	S	S	.	*	H	α-helix	trans	-64.9	-37.2	177.2	0	0	0	0	0	112	E296 S297 S304	E296-A300 WeakPolarHBondContact O-CB 3.29Å; E296-A300 PolarHBondContact O-N 3.01Å; E296-A300 VanDerWaalsContact O-N 3.16Å; S297-A300 PolarHBondContact O-N 2.56Å; A300-S304 PolarHBondContact O-N 2.99Å
301	I	76.1	Confident	71.2	Confident	64 Å²	64	104.3 Å²	104.3	33%	0.328	58%	0.583	S	S	.	*	H	α-helix	trans	-64.9	-47	175.1	-65.5	161.5	0	0	0	110.2	S297 D298 N299 Q303 S304 M1079	S297-I301 WeakPolarHBondContact O-CG1 3.46Å; S297-I301 PolarHBondContact O-N 3.28Å; S297-I301 VanDerWaalsContact O-N 3.15Å; D298-I301 PolarHBondContact O-N 3.48Å; N299-I301 VanDerWaalsContact C-N 3.32Å; N299-I301 PolarHBondContact O-N 3.01Å; I301-Q303 PolarHBondContact O-N 3.25Å; I301-S304 PolarHBondContact O-N 3.12Å; I301-S304 VanDerWaalsContact O-N 3.14Å; I301-S304 PolarHBondContact O-OG 3.4Å; I301-M1079 HydrophobicContact CD1-CE 3.46Å; I301-M1079 VanDerWaalsContact CD1-CE 3.46Å
302	Q	71.6	Confident	69.3	Low	119 Å²	119	107.2 Å²	107.2	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-62.5	-40.7	179.4	-68.5	-179	28.7	0	0	113	D298 N299 S304 Q305	D298-Q302 PolarHBondContact O-N 3.06Å; N299-Q302 PolarHBondContact O-N 2.92Å; Q302-S304 VanDerWaalsContact C-N 3.26Å; Q302-S304 PolarHBondContact O-N 2.69Å; Q302-Q305 PolarHBondContact O-N 2.75Å
303	Q	67.8	Low	67.2	Low	153 Å²	153	106.2 Å²	106.2	72%	0.715	61%	0.61	S	S	*	*	H	α-helix	trans	-65	-28.6	175.9	-75.6	-173.7	-0.4	0	0	113.3	N299 I301 Q305	N299-Q303 PolarHBondContact O-N 3.5Å; I301-Q303 PolarHBondContact O-N 3.25Å; Q303-Q305 VanDerWaalsContact C-N 3.32Å; Q303-Q305 PolarHBondContact O-N 3.46Å
304	S	60	Low	65	Low	80 Å²	80	109 Å²	109	56%	0.559	62%	0.622	S	S	*	*	H	α-helix	trans	-69.9	-27.1	177.7	77.2	0	0	0	0	113.6	A300 I301 Q302	A300-S304 PolarHBondContact O-N 2.99Å; I301-S304 PolarHBondContact O-N 3.12Å; I301-S304 VanDerWaalsContact O-N 3.14Å; I301-S304 PolarHBondContact O-OG 3.4Å; Q302-S304 VanDerWaalsContact C-N 3.26Å; Q302-S304 PolarHBondContact O-N 2.69Å
305	Q	59.5	Low	62.6	Low	95 Å²	95	109.5 Å²	109.5	44%	0.444	63%	0.631	S	S	.	*	H	α-helix	trans	-88.4	-20.4	-175.6	-65.6	-177.2	-1.7	0	0	114.5	Q302 Q303	Q302-Q305 PolarHBondContact O-N 2.75Å; Q303-Q305 VanDerWaalsContact C-N 3.32Å; Q303-Q305 PolarHBondContact O-N 3.46Å
306	I	59.6	Low	60.1	Low	141 Å²	141	113.5 Å²	113.5	72%	0.723	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-16.5	-176.1	-62.9	167.5	0	0	0	112.3
307	N	57.6	Low	57.9	Low	155 Å²	155	112.9 Å²	112.9	83%	0.829	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	11.4	-168.9	-130.7	24	0	0	0	115.3
308	S	45.5	Very low	55.7	Low	93 Å²	93	121.1 Å²	121.1	65%	0.65	68%	0.684	S	S	*	*			trans	-123.4	78.8	-179.7	55.5	0	0	0	0	112.3
309	G	45.8	Very low	53.7	Low	72 Å²	72	125.2 Å²	125.2	74%	0.742	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-74.8	142.1	170.9	0	0	0	0	0	112.4
310	P	54.2	Low	51.7	Low	135 Å²	135	126.1 Å²	126.1	88%	0.877	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-77.3	132.8	-172	30.2	-34.9	0	0	0	113
311	S	40.4	Very low	49.9	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-90.6	142.3	170.7	51.2	0	0	0	0	111.4
312	P	51.4	Low	48.3	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.9	145.6	-170.1	30.9	-35.6	0	0	0	113.4
313	P	45.8	Very low	46.7	Very low	126 Å²	126	131.2 Å²	131.2	82%	0.818	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-78.2	143.1	-178.8	32.1	-34.9	0	0	0	112.4
314	K	42.5	Very low	45.4	Very low	209 Å²	209	128.7 Å²	128.7	91%	0.909	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-102.3	139.3	171.9	-73.4	-174.3	176.1	-178.2	0	111.2
315	Q	37.9	Very low	44.4	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.794	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-97.5	169.8	-176.1	-64.3	177.7	-26.4	0	0	113.3
316	T	35.8	Very low	43.4	Very low	130 Å²	130	132.6 Å²	132.6	80%	0.798	78%	0.779	S	S	*	*			trans	73.5	150.2	160.6	76.5	0	0	0	0	117.1
317	S	39.7	Very low	42.3	Very low	107 Å²	107	130.6 Å²	130.6	75%	0.748	78%	0.778	S	S	*	*			cis	-171.3	147	-22.9	48.2	0	0	0	0	108.6
318	Y	35.4	Very low	41.4	Very low	230 Å²	230	128.8 Å²	128.8	90%	0.902	78%	0.777	S	S	*	*			trans	-74.4	135.4	-180	-61.7	-94.4	0	0	0	113.6
319	L	41.8	Very low	41	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	78%	0.778	S	S	*	*			trans	-155.8	153.7	142.9	-84.8	-168.2	0	0	0	110.9
320	P	39.6	Very low	40.8	Very low	114 Å²	114	131.7 Å²	131.7	74%	0.74	79%	0.785	S	S	*	*			trans	-107.6	-167.4	-162.8	48.1	-39.5	0	0	0	112.2
321	P	40.4	Very low	40	Very low	104 Å²	104	130.5 Å²	130.5	68%	0.675	78%	0.78	S	S	*	*				-120.5	137.4	-114.1	29.1	-7.5	0	0	0	116.8
322	T	41.6	Very low	40.3	Very low	135 Å²	135	131.3 Å²	131.3	83%	0.828	78%	0.782	S	S	*	*			trans	67.6	158	149.6	58.8	0	0	0	0	117.8
323	P	39.2	Very low	39.4	Very low	111 Å²	111	133 Å²	133	72%	0.721	78%	0.784	S	S	*	*			cis	-140.4	174.6	23.5	40.6	-20.1	0	0	0	119.8
324	S	39.1	Very low	38.9	Very low	99 Å²	99	135 Å²	135	69%	0.692	78%	0.782	S	S	*	*			trans	66.8	91.4	151.8	41	0	0	0	0	120.8
325	S	39.5	Very low	38.7	Very low	100 Å²	100	136 Å²	136	70%	0.699	78%	0.78	S	S	*	*				58.2	121.5	116.1	67.2	0	0	0	0	121.5
326	I	38.1	Very low	38.6	Very low	157 Å²	157	133 Å²	133	81%	0.805	78%	0.778	S	S	*	*				177.2	130.9	103.5	-87.7	160	0	0	0	111.7
327	S	37.9	Very low	39.2	Very low	99 Å²	99	132 Å²	132	69%	0.692	77%	0.774	S	S	*	*			trans	31.4	130.1	152	-60.9	0	0	0	0	125.1
328	S	38.6	Very low	39	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	77%	0.774	S	S	*	*				73.3	148	128.4	-62.8	0	0	0	0	120.7
329	A	35.6	Very low	39.1	Very low	81 Å²	81	130.3 Å²	130.3	67%	0.669	77%	0.768	S	S	*	*			cis	-172.1	177.6	-16.4	0	0	0	0	0	110
330	V	41.8	Very low	38.9	Very low	146 Å²	146	125.6 Å²	125.6	89%	0.885	75%	0.749	S	S	*	*			trans	86.3	139.1	159.9	-162.9	0	0	0	0	118
331	S	38.9	Very low	38.9	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	75%	0.751	S	S	*	*			trans	-100.8	158.9	-162	-46.8	0	0	0	0	115.8
332	P	45.1	Very low	38.7	Very low	126 Å²	126	130.4 Å²	130.4	82%	0.818	75%	0.753	S	S	*	*			trans	-97.1	175.7	178.7	38.8	-37.1	0	0	0	115.5
333	L	33	Very low	38.5	Very low	153 Å²	153	130.2 Å²	130.2	80%	0.801	75%	0.747	S	S	*	*			trans	-148.2	140	179.5	-93.5	164.8	0	0	0	113.9
334	H	35.7	Very low	38.2	Very low	166 Å²	166	129.6 Å²	129.6	77%	0.769	74%	0.741	S	S	*	*			trans	63.9	155.9	158.3	-78.5	55.9	0	0	0	117.8
335	R	37.7	Very low	38.1	Very low	231 Å²	231	131 Å²	131	87%	0.872	74%	0.739	S	S	*	*			cis	-158.6	153.6	25.3	-148.7	171.2	-158.2	-126.6	6.1	112.2
336	S	36.5	Very low	37.9	Very low	106 Å²	106	129 Å²	129	74%	0.741	73%	0.725	S	S	*	*			trans	-97.8	-156.7	168.4	-34.8	0	0	0	0	110.6
337	P	49.2	Very low	37.8	Very low	110 Å²	110	125 Å²	125	71%	0.714	72%	0.715	S	S	*	*			cis	-133.1	-167.5	-29.5	35.7	-15.8	0	0	0	112.4
338	L	34.4	Very low	37.7	Very low	144 Å²	144	127 Å²	127	75%	0.754	71%	0.714	S	S	*	*			trans	175.9	154.4	134.9	-118.6	64.5	0	0	0	116
339	M	38.7	Very low	37.6	Very low	157 Å²	157	128.5 Å²	128.5	77%	0.773	71%	0.711	S	S	*	*			trans	57.2	168.5	150.4	-70.1	179	69.3	0	0	122.2
340	S	36.9	Very low	37.6	Very low	71 Å²	71	135.1 Å²	135.1	50%	0.497	72%	0.719	S	S	.	*			cis	-168.9	148.5	-47	71.1	0	0	0	0	113.7
341	Q	39	Very low	37.3	Very low	167 Å²	167	133.7 Å²	133.7	78%	0.78	70%	0.703	S	S	*	*			trans	70.6	136.3	154.2	-69	169.5	97.4	0	0	118.4
342	Q	36.3	Very low	37.3	Very low	153 Å²	153	133.3 Å²	133.3	72%	0.715	70%	0.7	S	S	*	*			cis	-164	170.9	-7.9	-151.4	41	37.1	0	0	106.4
343	N	37.6	Very low	36.9	Very low	131 Å²	131	135.2 Å²	135.2	70%	0.701	70%	0.698	S	S	*	*			cis	-149.4	-171.9	11.9	-161.5	19.6	0	0	0	111.3
344	V	32.9	Very low	37.1	Very low	97 Å²	97	136.4 Å²	136.4	59%	0.588	70%	0.703	S	S	*	*			trans	-138.5	149.5	-179.4	-171	0	0	0	0	113	N546 P547	V344-N546 WeakPolarHBondContact CG1-O 3.44Å; V344-P547 HydrophobicContact CG1-CB 4.33Å
345	I	37.4	Very low	36.9	Very low	129 Å²	129	137.6 Å²	137.6	66%	0.662	71%	0.706	S	S	*	*			trans	-152.4	166.1	172.4	-160.5	168.8	0	0	0	111.2	P547 I548	I345-P547 CarbonylContact O-C 3.4Å; I345-P547 VanDerWaalsContact O-CA 3.26Å; I345-P547 WeakPolarHBondContact O-CA 3.38Å; I345-I548 WeakPolarHBondContact CG2-O 3.45Å; I345-I548 PolarHBondContact O-N 3.12Å
346	S	33.8	Very low	37.2	Very low	57 Å²	57	131.9 Å²	131.9	40%	0.399	70%	0.699	S	S	.	*			trans	-163	161.5	179	-87.5	0	0	0	0	115.8	N546 P547 I548	S346-N546 PolarHBondContact OG-O 3.38Å; S346-P547 VanDerWaalsContact OG-CA 3.31Å; S346-P547 WeakPolarHBondContact OG-CA 3.21Å; S346-I548 PolarHBondContact OG-N 3.19Å
347	A	36.9	Very low	37.3	Very low	73 Å²	73	133 Å²	133	60%	0.603	70%	0.704	S	S	*	*			trans	-155	158.6	172.2	0	0	0	0	0	112.4	I548	A347-I548 HydrophobicContact CB-CG2 4.27Å; A347-I548 WeakPolarHBondContact O-CD1 3.4Å
348	Q	35.8	Very low	36.3	Very low	141 Å²	141	135.8 Å²	135.8	66%	0.659	71%	0.709	S	S	*	*			trans	-165.5	124.3	177.5	176.5	-162.1	-130.3	0	0	113.8
349	I	36.9	Very low	36.4	Very low	149 Å²	149	135.2 Å²	135.2	76%	0.764	71%	0.711	S	S	*	*			trans	-147.4	125.2	161.7	-59	-177.3	0	0	0	107.7
350	R	35.1	Very low	36	Very low	220 Å²	220	132.5 Å²	132.5	83%	0.83	70%	0.704	S	S	*	*			cis	-147.4	156.9	7.4	-142.5	173.5	-83.7	-138.5	-1.2	111.5
351	Q	36.7	Very low	35.7	Very low	117 Å²	117	134.9 Å²	134.9	55%	0.547	72%	0.715	S	S	.	*			trans	-91.6	-172.8	178.5	-58.4	176	-4.7	0	0	110.9
352	S	37.1	Very low	35.2	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	72%	0.716	S	S	*	*			cis	-172.7	133.1	33.5	50	0	0	0	0	112.3
353	Q	37.1	Very low	35.1	Very low	166 Å²	166	135.5 Å²	135.5	78%	0.776	72%	0.723	S	S	*	*				77.2	135.5	94	-61.9	-163.3	21.8	0	0	119.9
354	I	37.8	Very low	34.7	Very low	178 Å²	178	134.5 Å²	134.5	91%	0.913	73%	0.726	S	S	*	*			trans	-166.3	150.1	135.3	-94.3	155.4	0	0	0	108.1
355	K	32.1	Very low	34.5	Very low	191 Å²	191	141.5 Å²	141.5	83%	0.83	74%	0.742	S	S	*	*			trans	-148.5	141	-172.8	-179	-176.5	173.9	-174.8	0	114.8
356	P	43	Very low	34.1	Very low	111 Å²	111	139.9 Å²	139.9	72%	0.721	74%	0.742	S	S	*	*			trans	-98.3	170.8	173.3	38.6	-35.7	0	0	0	115.3
357	P	37.9	Very low	34	Very low	129 Å²	129	143.2 Å²	143.2	84%	0.838	76%	0.76	S	S	*	*			trans	-116	173	-177.5	41	-30.9	0	0	0	117
358	M	28.6	Very low	33.6	Very low	169 Å²	169	146.4 Å²	146.4	83%	0.833	77%	0.766	S	S	*	*			trans	-101.6	176.6	177.8	-60.5	163	53.9	0	0	112.9	T360	M358-T360 HydrophobicContact CE-CG2 4.38Å
359	V	36.5	Very low	33.4	Very low	132 Å²	132	147.4 Å²	147.4	80%	0.8	77%	0.77	S	S	*	*			trans	165.2	103.1	143.1	149.6	0	0	0	0	107.5
360	T	29.9	Very low	33.1	Very low	99 Å²	99	147.5 Å²	147.5	61%	0.607	77%	0.772	S	S	*	*				78.6	128.1	71.1	62.8	0	0	0	0	118.2	M358	M358-T360 HydrophobicContact CE-CG2 4.38Å
361	T	32.2	Very low	32.8	Very low	121 Å²	121	147.2 Å²	147.2	74%	0.742	77%	0.773	S	S	*	*			trans	78.8	102.8	146.8	38.4	0	0	0	0	124
362	N	28.2	Very low	32.7	Very low	147 Å²	147	147.2 Å²	147.2	79%	0.786	78%	0.783	S	S	*	*				70.1	145.2	109.6	-85.4	-9.4	0	0	0	125.3
363	Q	33.6	Very low	32.3	Very low	187 Å²	187	147.3 Å²	147.3	87%	0.874	78%	0.784	S	S	*	*			trans	93.3	158.6	155.1	-75.6	178.8	43.2	0	0	120.6
364	S	28.5	Very low	32.1	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	79%	0.785	S	S	*	*			trans	-130.3	137.7	-142.3	-28.1	0	0	0	0	112.7
365	R	29.9	Very low	31.8	Very low	243 Å²	243	144.9 Å²	144.9	92%	0.917	78%	0.781	S	S	*	*			trans	178.4	144.6	131	-104.6	174.2	171.4	-161.4	-2.9	114.3
366	S	29.4	Very low	31.7	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	78%	0.775	S	S	*	*			trans	-36.9	148.9	160	52.4	0	0	0	0	118.2
367	V	30.4	Very low	31.2	Very low	126 Å²	126	144 Å²	144	76%	0.764	79%	0.785	S	S	*	*				168.4	134.3	110.4	155.6	0	0	0	0	112.5
368	L	28.4	Very low	30.8	Very low	140 Å²	140	144.7 Å²	144.7	73%	0.733	79%	0.787	S	S	*	*			trans	30.8	145.8	158.7	-88.3	72.3	0	0	0	125.3
369	H	32.2	Very low	31	Very low	162 Å²	162	140.5 Å²	140.5	75%	0.75	79%	0.787	S	S	*	*			trans	21.9	141.8	139.4	-62.2	-19.5	0	0	0	120.7
370	N	31.4	Very low	30.5	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	79%	0.791	S	S	*	*			cis	-164.7	164.3	44.4	-127	-7.6	0	0	0	112.2
371	Y	27.5	Very low	30.6	Very low	214 Å²	214	144.9 Å²	144.9	84%	0.839	80%	0.804	S	S	*	*			trans	-80.2	159.9	168.7	-101.8	-91.7	0	0	0	112.3
372	P	34.9	Very low	30.5	Very low	118 Å²	118	145.5 Å²	145.5	77%	0.766	80%	0.803	S	S	*	*				-140	160.7	120.6	37.2	-25	0	0	0	115.1
373	S	29.9	Very low	30.6	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	80%	0.8	S	S	*	*			trans	-85.2	167.5	173.5	-49.8	0	0	0	0	112.6
374	I	32.4	Very low	30.4	Very low	156 Å²	156	142.1 Å²	142.1	80%	0.8	79%	0.787	S	S	*	*				172.3	120.1	125.6	-87.6	155.3	0	0	0	112.4
375	T	31.5	Very low	30.4	Very low	137 Å²	137	143.6 Å²	143.6	84%	0.84	79%	0.786	S	S	*	*			trans	41.5	145.2	136.5	-38.4	0	0	0	0	123.8
376	A	29.5	Very low	30.4	Very low	85 Å²	85	140.3 Å²	140.3	70%	0.702	79%	0.786	S	S	*	*			trans	-88.5	169.9	-173.8	0	0	0	0	0	116.3
377	Q	33	Very low	30.6	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	79%	0.786	S	S	*	*			trans	-158.7	165.2	144	-112	166.1	22.7	0	0	113.2
378	T	28.9	Very low	30.9	Very low	144 Å²	144	140 Å²	140	88%	0.883	79%	0.786	S	S	*	*			trans	-97.8	154	-160.9	48.7	0	0	0	0	115.2
379	G	32.4	Very low	31.1	Very low	81 Å²	81	138.1 Å²	138.1	84%	0.835	78%	0.781	S	S	*	*			trans	-151.6	117.7	168.1	0	0	0	0	0	113
380	V	27.4	Very low	31.1	Very low	146 Å²	146	138 Å²	138	89%	0.885	79%	0.786	S	S	*	*			trans	-82	155.2	175.2	-89.1	0	0	0	0	112.1
381	M	31.7	Very low	31.2	Very low	177 Å²	177	134 Å²	134	87%	0.872	78%	0.78	S	S	*	*			trans	-169.7	162.1	134.1	-98.6	-73.7	-133.5	0	0	110.6
382	N	28.8	Very low	31.5	Very low	134 Å²	134	131.3 Å²	131.3	72%	0.717	78%	0.78	S	S	*	*			trans	-114.2	-161.7	-156.2	-158.1	-0.8	0	0	0	112.7
383	F	30.2	Very low	31.3	Very low	168 Å²	168	130.6 Å²	130.6	74%	0.737	78%	0.778	S	S	*	*			trans	91.9	138.2	169.3	-54.1	-67.8	0	0	0	117.1
384	T	31	Very low	31.4	Very low	96 Å²	96	132.3 Å²	132.3	59%	0.589	79%	0.785	S	S	*	*			cis	-176	146.8	-38.7	15.9	0	0	0	0	107.8
385	N	27.2	Very low	31.2	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	78%	0.784	S	S	*	*			trans	54.9	130.7	153.5	-52.9	-27.9	0	0	0	117.9
386	L	30.4	Very low	31.2	Very low	174 Å²	174	134 Å²	134	91%	0.911	78%	0.784	S	S	*	*				-167.5	147.1	69.5	-85.5	162.1	0	0	0	110.7
387	S	34.1	Very low	31.2	Very low	98 Å²	98	136.7 Å²	136.7	69%	0.685	78%	0.781	S	S	*	*			trans	-148.6	142.3	167.5	178.7	0	0	0	0	108.7
388	P	37	Very low	31.1	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	78%	0.778	S	S	*	*			trans	-120.7	126	149.1	12	8.7	0	0	0	109.3
389	T	32.5	Very low	31.1	Very low	102 Å²	102	132.3 Å²	132.3	63%	0.626	76%	0.764	S	S	*	*			cis	87.5	137	41.6	76	0	0	0	0	115.3
390	D	32.5	Very low	31.2	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	76%	0.763	S	S	*	*			trans	67.4	143.8	158	-40.2	-46.3	0	0	0	118.6
391	G	33.2	Very low	31.2	Very low	67 Å²	67	134.8 Å²	134.8	69%	0.691	76%	0.758	S	S	*	*			cis	-164.4	-180	-7.3	0	0	0	0	0	107.3
392	N	32.4	Very low	31.3	Very low	156 Å²	156	134.6 Å²	134.6	83%	0.834	76%	0.76	S	S	*	*			cis	-146.5	163.3	5.4	-84.2	-50.3	0	0	0	107.4
393	S	30.5	Very low	31.5	Very low	104 Å²	104	133.8 Å²	133.8	73%	0.727	76%	0.764	S	S	*	*			cis	78.8	95.9	40.5	-75.8	0	0	0	0	116.9
394	T	33	Very low	32	Very low	139 Å²	139	131.1 Å²	131.1	85%	0.853	76%	0.764	S	S	*	*			trans	177.3	109.4	142.7	32.2	0	0	0	0	105.3
395	Q	28.1	Very low	32	Very low	167 Å²	167	132 Å²	132	78%	0.78	77%	0.77	S	S	*	*			cis	61.8	110.5	41.5	-158.3	-174.3	37.8	0	0	114.3
396	L	31.3	Very low	32.2	Very low	162 Å²	162	132 Å²	132	85%	0.848	77%	0.768	S	S	*	*			trans	175.8	97	143.8	-92.6	175.8	0	0	0	104.8
397	H	29.1	Very low	32.3	Very low	140 Å²	140	131.8 Å²	131.8	65%	0.648	76%	0.763	S	S	*	*				61.8	110.1	59.2	-137.7	-95.8	0	0	0	112.7
398	I	32.2	Very low	32.1	Very low	165 Å²	165	131.9 Å²	131.9	85%	0.846	76%	0.763	S	S	*	*				-166.7	134	127.8	-92.8	148.6	0	0	0	108.4
399	S	27.9	Very low	32	Very low	86 Å²	86	131.3 Å²	131.3	60%	0.601	76%	0.762	S	S	*	*			trans	-120	148.9	-175	-43.3	0	0	0	0	109.7
400	T	34	Very low	32	Very low	131 Å²	131	131.8 Å²	131.8	80%	0.804	77%	0.765	S	S	*	*			trans	-171.5	111.9	146	38.4	0	0	0	0	107.7
401	N	27.6	Very low	32	Very low	148 Å²	148	130.3 Å²	130.3	79%	0.791	76%	0.757	S	S	*	*				53.4	120.8	74.1	-78.1	-28.3	0	0	0	114.8
402	L	34.5	Very low	31.9	Very low	173 Å²	173	133.7 Å²	133.7	91%	0.906	76%	0.759	S	S	*	*			trans	177.4	133.9	141.8	-96.9	157.8	0	0	0	111.2
403	S	33.6	Very low	32	Very low	116 Å²	116	132.6 Å²	132.6	81%	0.811	75%	0.752	S	S	*	*			trans	172	171.8	-177.5	-89.1	0	0	0	0	110.1
404	P	40.4	Very low	32.2	Very low	112 Å²	112	133 Å²	133	73%	0.727	75%	0.747	S	S	*	*			cis	-128.3	-146.8	-20.6	37.4	-18.8	0	0	0	111.2
405	T	29.6	Very low	32.1	Very low	116 Å²	116	133.3 Å²	133.3	71%	0.712	74%	0.738	S	S	*	*			trans	116.1	160.5	145.3	-40.5	0	0	0	0	117.6
406	I	32.9	Very low	32.5	Very low	139 Å²	139	133.2 Å²	133.2	71%	0.713	74%	0.738	S	S	*	*			trans	97.6	98.2	167.5	-54.8	176.8	0	0	0	112.8
407	Q	32.6	Very low	32.5	Very low	170 Å²	170	132.8 Å²	132.8	79%	0.794	74%	0.736	S	S	*	*				66.9	145	81.9	-71	176.8	-23.3	0	0	113.6
408	S	29.7	Very low	32.5	Very low	100 Å²	100	131.1 Å²	131.1	70%	0.699	74%	0.74	S	S	*	*			cis	-174.3	-178.4	-10.9	54.3	0	0	0	0	109.9
409	S	33.5	Very low	32.5	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	74%	0.742	S	S	*	*			trans	78.1	150	164	81	0	0	0	0	119.5
410	T	33.1	Very low	32.5	Very low	113 Å²	113	131.7 Å²	131.7	69%	0.693	75%	0.753	S	S	*	*			cis	-170.7	160.7	-27.8	33.4	0	0	0	0	110.9
411	N	33.2	Very low	32.2	Very low	128 Å²	128	132.9 Å²	132.9	68%	0.684	75%	0.753	S	S	*	*			trans	87.1	121.2	151.9	-58.4	-27.6	0	0	0	122.6
412	N	31.4	Very low	32.2	Very low	138 Å²	138	134.3 Å²	134.3	74%	0.738	76%	0.755	S	S	*	*			trans	62.8	146.8	131.5	-60.2	-12.6	0	0	0	120.5
413	L	33.2	Very low	32	Very low	133 Å²	133	130.7 Å²	130.7	70%	0.696	74%	0.742	S	S	*	*			cis	-156	167.6	-3.2	-145.1	64.2	0	0	0	110.2
414	D	34.4	Very low	31.6	Very low	113 Å²	113	131.2 Å²	131.2	60%	0.604	74%	0.74	S	S	*	*			trans	75.1	106	154	-63.4	-36.3	0	0	0	125.3
415	Q	32.6	Very low	31	Very low	146 Å²	146	132.6 Å²	132.6	68%	0.682	74%	0.74	S	S	*	*				54.9	105.9	118.6	-59.4	176	63.9	0	0	121.2
416	H	35.9	Very low	31	Very low	165 Å²	165	137 Å²	137	76%	0.764	75%	0.745	S	S	*	*				176.2	120.4	93.6	-100.2	-73.1	0	0	0	114.8
417	N	30.5	Very low	30.8	Very low	152 Å²	152	135.5 Å²	135.5	81%	0.813	74%	0.738	S	S	*	*			trans	57.8	151.8	139.6	-143.3	8.9	0	0	0	123.6
418	S	30.8	Very low	30.6	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	74%	0.738	S	S	*	*			trans	93.8	101.5	172.2	-46.3	0	0	0	0	116.8
419	T	31.1	Very low	30.7	Very low	145 Å²	145	135.4 Å²	135.4	89%	0.89	74%	0.742	S	S	*	*			trans	-53.4	134.1	178.1	43.9	0	0	0	0	115.3
420	S	28.3	Very low	30.5	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	75%	0.751	S	S	*	*			trans	-116.3	142.6	162.5	-174.1	0	0	0	0	110.5
421	I	27.6	Very low	30.5	Very low	157 Å²	157	135.3 Å²	135.3	81%	0.805	75%	0.749	S	S	*	*			trans	-86.9	131.6	-172.9	-62.9	165.2	0	0	0	109.8
422	Q	27	Very low	30.3	Very low	178 Å²	178	136.4 Å²	136.4	83%	0.832	75%	0.752	S	S	*	*			trans	-133.2	151.9	169.4	-89	-75.5	-57.1	0	0	111.6
423	P	29.9	Very low	30.2	Very low	97 Å²	97	137.2 Å²	137.2	63%	0.63	76%	0.755	S	S	*	*			trans	-120.5	150.8	-158.5	39.7	-26.5	0	0	0	114.9
424	T	26.8	Very low	30.2	Very low	126 Å²	126	135.6 Å²	135.6	77%	0.773	75%	0.753	S	S	*	*			trans	-155.1	118.7	167.2	41.7	0	0	0	0	116.9
425	I	27.8	Very low	29.9	Very low	141 Å²	141	137.6 Å²	137.6	72%	0.723	76%	0.763	S	S	*	*				71.4	153.1	129.8	-42.3	160	0	0	0	120
426	Y	28.3	Very low	29.7	Very low	209 Å²	209	136.9 Å²	136.9	82%	0.82	76%	0.763	S	S	*	*			trans	83.4	144.2	170.4	-74.3	-91.3	0	0	0	118
427	D	29.3	Very low	29.3	Very low	107 Å²	107	136.8 Å²	136.8	57%	0.572	76%	0.763	S	S	*	*			cis	-175.1	127.6	-28.9	173.3	13	0	0	0	107.4
428	P	28.7	Very low	29.3	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	77%	0.766	S	S	*	*			trans	-105.5	76.3	-179.7	38.2	-30	0	0	0	113.3
429	N	31.1	Very low	29.1	Very low	145 Å²	145	136.7 Å²	136.7	78%	0.775	77%	0.768	S	S	*	*			trans	-142	96.9	163.4	-84.4	-57.6	0	0	0	111.8
430	C	29.8	Very low	29.3	Very low	136 Å²	136	134.9 Å²	134.9	92%	0.919	76%	0.759	S	S	*	*				-172.2	149.8	117.9	-152.6	0	0	0	0	110.6
431	A	32.4	Very low	29.5	Very low	79 Å²	79	134.5 Å²	134.5	65%	0.653	75%	0.752	S	S	*	*			trans	-98.5	147.8	-176	0	0	0	0	0	112.5
432	M	29.4	Very low	29.6	Very low	152 Å²	152	136.9 Å²	136.9	75%	0.749	75%	0.751	S	S	*	*			trans	65.1	127	134.3	-76.5	-69.5	104.3	0	0	121.8
433	L	29.6	Very low	29.8	Very low	154 Å²	154	134.7 Å²	134.7	81%	0.806	75%	0.745	S	S	*	*			trans	92.4	148.6	141.2	-68	167.3	0	0	0	118.5
434	P	32.2	Very low	29.8	Very low	100 Å²	100	136 Å²	136	65%	0.649	75%	0.747	S	S	*	*			trans	-129	173.8	-133	41.2	-26.2	0	0	0	113.8
435	L	28	Very low	30.1	Very low	154 Å²	154	137.8 Å²	137.8	81%	0.806	75%	0.751	S	S	*	*				167.6	160.3	128.3	-92.6	164	0	0	0	112.3
436	L	29.8	Very low	30.1	Very low	131 Å²	131	137.1 Å²	137.1	69%	0.686	75%	0.747	S	S	*	*			trans	69.7	101	155.1	-68.2	152.3	0	0	0	119.6
437	Q	27	Very low	30.3	Very low	164 Å²	164	137.2 Å²	137.2	77%	0.766	75%	0.748	S	S	*	*				35.8	113.6	123.2	-63.3	174.3	-43.6	0	0	118.7
438	T	30.6	Very low	30.4	Very low	144 Å²	144	137 Å²	137	88%	0.883	75%	0.754	S	S	*	*				-179.4	138.1	103.6	27.2	0	0	0	0	111.9
439	S	26.6	Very low	30.5	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	76%	0.755	S	S	*	*			trans	-80.2	-179.5	164.6	-36.8	0	0	0	0	109.7
440	P	35.6	Very low	30.6	Very low	108 Å²	108	135.2 Å²	135.2	70%	0.701	76%	0.756	S	S	*	*			cis	-145.1	-157.4	5.9	37	-12.6	0	0	0	115.4
441	T	31.5	Very low	30.7	Very low	109 Å²	109	134.8 Å²	134.8	67%	0.669	75%	0.745	S	S	*	*			trans	95.7	110.4	141.8	34	0	0	0	0	123.6
442	R	29.3	Very low	30.6	Very low	206 Å²	206	136.2 Å²	136.2	78%	0.777	75%	0.75	S	S	*	*				72.5	115.2	123.3	-91.4	-179.2	170.7	152.1	-3.7	121.8
443	N	33	Very low	31.1	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	75%	0.749	S	S	*	*				170.8	117.1	96.5	-88.1	-28.9	0	0	0	109.1
444	N	29.7	Very low	31.1	Very low	124 Å²	124	133.8 Å²	133.8	66%	0.663	75%	0.746	S	S	*	*				85.3	122.1	76.1	-89.7	9.5	0	0	0	114.5
445	L	31.9	Very low	31	Very low	164 Å²	164	135.4 Å²	135.4	86%	0.859	75%	0.749	S	S	*	*			trans	147.5	84.6	155.5	-83.2	161	0	0	0	107.5
446	I	28.2	Very low	31.2	Very low	126 Å²	126	137.1 Å²	137.1	65%	0.646	75%	0.753	S	S	*	*				74.4	132	64.8	-55.3	173.1	0	0	0	113.5
447	Y	32.5	Very low	31.2	Very low	212 Å²	212	139.6 Å²	139.6	83%	0.831	76%	0.76	S	S	*	*			trans	107.1	124.6	172.2	-77.3	-87.5	0	0	0	115.5
448	S	32.2	Very low	31.5	Very low	101 Å²	101	137.4 Å²	137.4	71%	0.706	76%	0.763	S	S	*	*			cis	-163.8	148.1	-22.8	-95.2	0	0	0	0	109
449	D	29.5	Very low	31.4	Very low	153 Å²	153	139 Å²	139	82%	0.818	76%	0.76	S	S	*	*			trans	-77.6	162.2	-176.7	-60.6	-66.5	0	0	0	115.5
450	G	34	Very low	31.6	Very low	78 Å²	78	143.5 Å²	143.5	80%	0.804	76%	0.762	S	S	*	*			trans	-156	109.3	167.6	0	0	0	0	0	111.2
451	N	31.9	Very low	31.3	Very low	127 Å²	127	143.8 Å²	143.8	68%	0.679	76%	0.761	S	S	*	*			trans	-79	154.5	-160.4	-83.9	-28.3	0	0	0	117.4
452	S	30.7	Very low	31.3	Very low	109 Å²	109	143.3 Å²	143.3	76%	0.762	76%	0.762	S	S	*	*			trans	-72.5	-159.5	165.7	-48.7	0	0	0	0	113
453	P	40.1	Very low	31.4	Very low	112 Å²	112	138.7 Å²	138.7	73%	0.727	76%	0.757	S	S	*	*				-125	-163.8	-79.4	38	-19.8	0	0	0	111.1
454	I	29.6	Very low	31.4	Very low	144 Å²	144	138.8 Å²	138.8	74%	0.738	76%	0.758	S	S	*	*			trans	165.6	136.1	133.4	-88.9	161	0	0	0	113.1
455	N	28.6	Very low	31.7	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	76%	0.756	S	S	*	*			trans	33.4	126.5	157.1	-61.9	-16.8	0	0	0	122
456	Q	32.5	Very low	31.9	Very low	190 Å²	190	139.2 Å²	139.2	89%	0.888	75%	0.751	S	S	*	*				-176.7	161.5	95.8	-107.6	154	38.3	0	0	114.5
457	H	29.9	Very low	32.2	Very low	183 Å²	183	139.2 Å²	139.2	85%	0.847	75%	0.748	S	S	*	*			trans	-60.4	153.9	173.4	-77.5	-110.1	0	0	0	113.7
458	S	32.9	Very low	32.9	Very low	118 Å²	118	135 Å²	135	83%	0.825	75%	0.746	S	S	*	*				169.5	170.5	116.4	48.4	0	0	0	0	113.6
459	H	29.7	Very low	33.3	Very low	178 Å²	178	137.5 Å²	137.5	82%	0.824	75%	0.747	S	S	*	*			trans	-93.4	178.3	-169.7	-79	-113.9	0	0	0	114.7
460	Y	30.5	Very low	33.7	Very low	205 Å²	205	136.6 Å²	136.6	80%	0.804	74%	0.737	S	S	*	*			trans	97	94.5	154.7	-85	-91.4	0	0	0	120.9
461	V	30.2	Very low	34	Very low	115 Å²	115	139.9 Å²	139.9	70%	0.697	73%	0.731	S	S	*	*				56.5	130	111.6	175.6	0	0	0	0	121.7
462	S	29.6	Very low	34.3	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	73%	0.73	S	S	*	*			trans	71.2	150.9	155.1	-70.4	0	0	0	0	119.5
463	T	32.5	Very low	34.7	Very low	108 Å²	108	141.5 Å²	141.5	66%	0.663	72%	0.722	S	S	*	*			cis	-168.9	151	-8.9	22.6	0	0	0	0	110.2
464	N	32	Very low	34.7	Very low	136 Å²	136	142.8 Å²	142.8	73%	0.727	72%	0.718	S	S	*	*			trans	64.9	158.3	152.6	-60.5	-19.2	0	0	0	117.6
465	H	36.7	Very low	35.1	Very low	137 Å²	137	142 Å²	142	63%	0.634	71%	0.712	S	S	*	*			cis	-165	175.1	21	-140.5	-0.5	0	0	0	113.4	Q467	H465-Q467 PolarHBondContact ND1-OE1 3.36Å
466	H	36.9	Very low	35.5	Very low	159 Å²	159	142 Å²	142	74%	0.736	71%	0.707	S	S	*	*			trans	99.6	62.3	161.2	-72.7	42.5	0	0	0	120.6
467	Q	34.8	Very low	35.8	Very low	127 Å²	127	139.3 Å²	139.3	59%	0.593	69%	0.694	S	S	*	*			trans	-0.7	149.2	145.1	-53.1	79.4	-105.1	0	0	122.5	H465	H465-Q467 PolarHBondContact ND1-OE1 3.36Å
468	P	46.4	Very low	36.3	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	68%	0.684	S	S	*	*			trans	-106.9	-176.3	177.5	42.6	-37	0	0	0	116.9
469	H	40.3	Very low	36.4	Very low	155 Å²	155	137.9 Å²	137.9	72%	0.718	68%	0.675	S	S	*	*			trans	-144.1	163.9	-174.3	-72.6	-107	0	0	0	110.1
470	H	38.4	Very low	36.6	Very low	133 Å²	133	136.6 Å²	136.6	62%	0.616	67%	0.669	S	S	*	*			cis	-172.1	171.4	-8.4	-109.2	9.7	0	0	0	111.3
471	H	40.9	Very low	36.8	Very low	148 Å²	148	135.3 Å²	135.3	69%	0.685	67%	0.67	S	S	*	*			trans	69.7	163.2	151.2	-66.9	-12	0	0	0	119.5
472	Q	37.8	Very low	37.5	Very low	137 Å²	137	134.3 Å²	134.3	64%	0.64	67%	0.666	S	S	*	*			cis	-160.6	156.8	-12.8	-115.7	166.8	-58.9	0	0	113.9
473	H	38.8	Very low	37.7	Very low	132 Å²	132	136.5 Å²	136.5	61%	0.611	68%	0.675	S	S	*	*			trans	64.9	-147.6	151.4	-62.7	-49.7	0	0	0	122.7
474	H	38.9	Very low	37.8	Very low	139 Å²	139	135.3 Å²	135.3	64%	0.644	68%	0.684	S	S	*	*				-149.5	165.2	-119.1	-71.9	-40.8	0	0	0	118.1
475	Q	38	Very low	38	Very low	129 Å²	129	137.9 Å²	137.9	60%	0.603	69%	0.692	S	S	*	*			cis	173.7	178.1	-25	-166	159.2	-86.9	0	0	110.2
476	H	38.7	Very low	38.1	Very low	133 Å²	133	136 Å²	136	62%	0.616	69%	0.691	S	S	*	*			trans	74.8	160.6	162.9	-49.8	-71.2	0	0	0	117.5
477	H	38.6	Very low	37.8	Very low	132 Å²	132	135 Å²	135	61%	0.611	69%	0.691	S	S	*	*			cis	-164.8	142	-27.3	-107.8	-50.1	0	0	0	113.2
478	H	39.2	Very low	37.7	Very low	138 Å²	138	136.6 Å²	136.6	64%	0.639	70%	0.699	S	S	*	*			trans	59.5	152.6	134.9	-71.7	-11.2	0	0	0	123.9
479	Q	34.6	Very low	37.1	Very low	134 Å²	134	136.8 Å²	136.8	63%	0.626	70%	0.697	S	S	*	*			cis	-173.4	166.1	-19.3	-122.2	174	-2.6	0	0	113.7
480	Q	34.3	Very low	36.9	Very low	151 Å²	151	134.8 Å²	134.8	71%	0.706	70%	0.698	S	S	*	*			trans	73.9	108.5	146.3	-69.8	173.7	59.9	0	0	124.2
481	H	36.1	Very low	36.4	Very low	177 Å²	177	133.8 Å²	133.8	82%	0.819	70%	0.701	S	S	*	*				38.2	166.4	105	-79.4	-63.7	0	0	0	123.3
482	P	43.6	Very low	36	Very low	95 Å²	95	132.5 Å²	132.5	62%	0.617	70%	0.704	S	S	*	*			cis	-147.3	-169.8	-29.3	41.5	-21.7	0	0	0	117.2
483	T	34.1	Very low	35.6	Very low	144 Å²	144	132.2 Å²	132.2	88%	0.883	71%	0.707	S	S	*	*			trans	75.2	136.3	151.7	50.3	0	0	0	0	123.7
484	G	34.7	Very low	35.3	Very low	83 Å²	83	133.5 Å²	133.5	86%	0.856	72%	0.718	S	S	*	*			trans	159.7	113.9	161.5	0	0	0	0	0	116.7
485	H	35.5	Very low	34.7	Very low	191 Å²	191	134.1 Å²	134.1	88%	0.884	72%	0.723	S	S	*	*			trans	-92.9	-173.4	173.6	-109.5	-73.6	0	0	0	110.8
486	P	38.9	Very low	34.5	Very low	96 Å²	96	133.6 Å²	133.6	62%	0.623	73%	0.73	S	S	*	*			cis	-141.8	-165.7	-23.8	34.6	-11.3	0	0	0	115.6
487	L	30.9	Very low	34	Very low	140 Å²	140	133.2 Å²	133.2	73%	0.733	73%	0.733	S	S	*	*			trans	94	138.6	146.4	-72.3	168.4	0	0	0	124.8
488	Q	32.6	Very low	33.5	Very low	160 Å²	160	133.7 Å²	133.7	75%	0.748	74%	0.74	S	S	*	*			trans	66.4	114	151.8	-70.6	159.4	-26.1	0	0	119.8
489	V	34.8	Very low	33	Very low	125 Å²	125	131.3 Å²	131.3	76%	0.758	74%	0.735	S	S	*	*				68.7	105.5	64.6	-178.7	0	0	0	0	112.3	T491	V489-T491 HydrophobicContact CG1-CG2 4.46Å
490	P	35.5	Very low	32.7	Very low	114 Å²	114	130.5 Å²	130.5	74%	0.74	73%	0.734	S	S	*	*				-126.8	179.7	78.7	14.6	8.4	0	0	0	113.2
491	T	28.8	Very low	32.6	Very low	112 Å²	112	128 Å²	128	69%	0.687	72%	0.722	S	S	*	*			cis	95.3	141.3	5.7	72.1	0	0	0	0	120.6	V489	V489-T491 HydrophobicContact CG1-CG2 4.46Å
492	T	31.8	Very low	32.3	Very low	121 Å²	121	124.3 Å²	124.3	74%	0.742	72%	0.717	S	S	*	*			trans	70.5	144.7	171.8	66.8	0	0	0	0	118.2
493	D	30.2	Very low	31.7	Very low	130 Å²	130	124.8 Å²	124.8	70%	0.695	72%	0.722	S	S	*	*			cis	-163.8	158.1	-14.3	-109.5	-28.1	0	0	0	113
494	L	32	Very low	31.5	Very low	160 Å²	160	122.8 Å²	122.8	84%	0.838	71%	0.714	S	S	*	*			trans	56.4	145.9	144.9	-61.7	165.3	0	0	0	123.9
495	M	26.4	Very low	31.2	Very low	152 Å²	152	125.8 Å²	125.8	75%	0.749	71%	0.71	S	S	*	*			trans	-80	159.6	170.2	-60.4	168.8	57.3	0	0	112.2
496	P	33.9	Very low	30.9	Very low	118 Å²	118	122 Å²	122	77%	0.766	70%	0.7	S	S	*	*				-142.1	157	94.7	36.3	-20.3	0	0	0	112.9
497	N	28.8	Very low	30.4	Very low	124 Å²	124	123.9 Å²	123.9	66%	0.663	71%	0.705	S	S	*	*				64.6	97.2	56	-92	7.3	0	0	0	117.1
498	N	27.2	Very low	30.3	Very low	142 Å²	142	123.2 Å²	123.2	76%	0.759	70%	0.701	S	S	*	*			trans	57.1	151.6	140.4	-66.4	-11.3	0	0	0	124.4
499	T	28.5	Very low	30.1	Very low	89 Å²	89	121 Å²	121	55%	0.546	70%	0.703	S	S	.	*			trans	91.6	151.8	146.2	-3.2	0	0	0	0	119.3	S69 S70	S69-T499 WeakPolarHBondContact O-CG2 3.44Å; S70-T499 CarbonylContact O-C 3.36Å; S70-T499 WeakPolarHBondContact O-CA 3.41Å
500	L	28.6	Very low	29.9	Very low	116 Å²	116	119.5 Å²	119.5	61%	0.607	70%	0.698	S	S	*	*			trans	85.8	151	170.5	-54.5	-177.5	0	0	0	117.5	S69 S70 S71	S69-L500 PolarHBondContact O-N 2.85Å; S70-L500 CarbonylContact C-O 3.56Å; S70-L500 PolarHBondContact O-N 2.94Å; S71-L500 PolarHBondContact N-O 2.84Å; S71-L500 VanDerWaalsContact N-O 3.07Å; S71-L500 PolarHBondContact OG-O 3.21Å
501	H	32.2	Very low	29.7	Very low	98 Å²	98	119.2 Å²	119.2	45%	0.454	70%	0.699	S	S	.	*			cis	-161	168	-41.4	-133.7	-132.8	0	0	0	110.1	S70	S70-H501 VanDerWaalsContact OG-CA 3.25Å; S70-H501 WeakPolarHBondContact OG-CA 3.43Å; S70-H501 PolarHBondContact OG-CD2 3.27Å
502	S	29.8	Very low	29.6	Very low	100 Å²	100	121.2 Å²	121.2	70%	0.699	70%	0.704	S	S	*	*			trans	66.5	143.8	156.7	55.6	0	0	0	0	119.7
503	S	30	Very low	29.6	Very low	105 Å²	105	121.1 Å²	121.1	73%	0.734	71%	0.705	S	S	*	*			cis	-167.1	170.3	-7.1	-101.5	0	0	0	0	111.7
504	S	29.8	Very low	29.6	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	71%	0.712	S	S	*	*			trans	82.9	132.6	150.7	-60.8	0	0	0	0	119.4
505	L	29.4	Very low	29.3	Very low	146 Å²	146	122.2 Å²	122.2	76%	0.764	71%	0.711	S	S	*	*			cis	-164.7	145.4	-4.4	-102.2	170.9	0	0	0	109.4
506	V	29.5	Very low	29.5	Very low	112 Å²	112	123.5 Å²	123.5	68%	0.679	72%	0.715	S	S	*	*			trans	66.6	140.2	134.4	164	0	0	0	0	119.3
507	N	27.7	Very low	29.1	Very low	135 Å²	135	122.8 Å²	122.8	72%	0.722	71%	0.713	S	S	*	*			cis	-168.6	175.8	-8.5	-111.2	-3.4	0	0	0	108.4
508	I	28.8	Very low	29.1	Very low	125 Å²	125	124.3 Å²	124.3	64%	0.641	72%	0.721	S	S	*	*			cis	-145.7	149.6	11.7	-155.7	166.9	0	0	0	111.7
509	S	29.2	Very low	29	Very low	114 Å²	114	125.3 Å²	125.3	80%	0.797	72%	0.721	S	S	*	*			trans	36.5	-133.2	160	-59	0	0	0	0	115
510	S	29.8	Very low	28.8	Very low	93 Å²	93	127.5 Å²	127.5	65%	0.65	73%	0.729	S	S	*	*			cis	-153.7	132.7	-24.2	5.6	0	0	0	0	106.8
511	S	30.6	Very low	28.6	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	74%	0.741	S	S	*	*			cis	-156.8	156	7.1	-68.2	0	0	0	0	112.9
512	I	28.1	Very low	28.3	Very low	154 Å²	154	139.8 Å²	139.8	79%	0.79	77%	0.765	S	S	*	*			trans	19	119.9	152.6	-53.6	172.2	0	0	0	119.1
513	P	30.8	Very low	28.1	Very low	119 Å²	119	139.8 Å²	139.8	77%	0.773	77%	0.765	S	S	*	*			trans	-99.3	174.8	163.7	39.7	-33.9	0	0	0	114.1
514	L	29.5	Very low	28.1	Very low	161 Å²	161	142.6 Å²	142.6	84%	0.843	77%	0.772	S	S	*	*			trans	-140.1	122.3	173.2	-62.4	169.2	0	0	0	105.8
515	D	26.7	Very low	27.9	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	78%	0.775	S	S	*	*				31.9	101.5	72.8	-153	12.6	0	0	0	116.1
516	E	30.2	Very low	28	Very low	179 Å²	179	143 Å²	143	84%	0.836	78%	0.775	S	S	*	*			trans	-172.1	138.5	132.8	-109.9	-178.5	179.8	0	0	110.9
517	S	25.2	Very low	28	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	78%	0.78	S	S	*	*			trans	-67	126.7	171.7	52.1	0	0	0	0	111.9
518	N	29.5	Very low	28.1	Very low	156 Å²	156	144.4 Å²	144.4	83%	0.834	78%	0.782	S	S	*	*			trans	-156.7	160.6	155.4	-111.9	-42.9	0	0	0	115.3
519	Q	25.1	Very low	27.9	Very low	163 Å²	163	146.2 Å²	146.2	76%	0.762	79%	0.788	S	S	*	*			trans	-87.8	176.8	-173.9	-53.8	173	4.4	0	0	112.5
520	L	25.3	Very low	27.8	Very low	134 Å²	134	147 Å²	147	70%	0.702	78%	0.783	S	S	*	*			trans	82.1	115.9	154.2	-67.1	152.8	0	0	0	120.4
521	Y	22.7	Very low	27.6	Very low	221 Å²	221	147.7 Å²	147.7	87%	0.867	78%	0.783	S	S	*	*				24.4	125.4	128.1	-96.1	-91.1	0	0	0	119.8
522	W	25.6	Very low	27.4	Very low	252 Å²	252	150.7 Å²	150.7	96%	0.955	78%	0.783	S	S	*	*			trans	-133	139.1	153.8	-81	79.5	0	0	0	112.6
523	S	27.1	Very low	27.3	Very low	100 Å²	100	150.1 Å²	150.1	70%	0.699	78%	0.777	S	S	*	*			trans	-114.7	161.3	-175.6	48.7	0	0	0	0	111.3
524	N	28.6	Very low	27.2	Very low	164 Å²	164	151 Å²	151	88%	0.877	77%	0.77	S	S	*	*			trans	-91.6	113.1	177.5	-83.3	-26.6	0	0	0	112.6
525	N	27	Very low	27.2	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	76%	0.764	S	S	*	*			trans	11.2	127.9	147.5	-65.1	-23.9	0	0	0	121.2
526	S	31.9	Very low	27.4	Very low	108 Å²	108	151.6 Å²	151.6	76%	0.755	76%	0.763	S	S	*	*				177	103.2	108.5	37.3	0	0	0	0	111.5
527	T	28.6	Very low	27.6	Very low	128 Å²	128	147.3 Å²	147.3	79%	0.785	75%	0.751	S	S	*	*				72.6	124.5	96.1	23.4	0	0	0	0	119.3
528	I	29	Very low	27.7	Very low	149 Å²	149	149.1 Å²	149.1	76%	0.764	75%	0.752	S	S	*	*			trans	92.9	110.5	149.4	-59.2	158.3	0	0	0	120
529	E	24.7	Very low	27.8	Very low	162 Å²	162	147 Å²	147	76%	0.757	75%	0.745	S	S	*	*			trans	-7.1	127	149.3	-52.8	171.8	144.7	0	0	120.3
530	N	29.1	Very low	28	Very low	132 Å²	132	144.6 Å²	144.6	71%	0.706	74%	0.741	S	S	*	*				172.4	120.2	102.9	-93	-73.1	0	0	0	109.7
531	T	25	Very low	28.2	Very low	106 Å²	106	145.7 Å²	145.7	65%	0.65	75%	0.746	S	S	*	*				68.4	134.7	89.1	-29.2	0	0	0	0	115
532	F	26.4	Very low	28.7	Very low	172 Å²	172	142.4 Å²	142.4	75%	0.754	74%	0.738	S	S	*	*			trans	80	102.8	171.2	-75.7	-85.5	0	0	0	120.8
533	H	26.4	Very low	28.9	Very low	142 Å²	142	135.2 Å²	135.2	66%	0.657	73%	0.727	S	S	*	*				59.3	127.7	121	-81.5	-104.4	0	0	0	122.4
534	H	27.6	Very low	28.9	Very low	138 Å²	138	133.4 Å²	133.4	64%	0.639	72%	0.724	S	S	*	*				83.5	137.5	129.8	-83.3	-37.4	0	0	0	123.1
535	H	30.7	Very low	28.9	Very low	152 Å²	152	133.4 Å²	133.4	70%	0.704	72%	0.722	S	S	*	*			trans	61.8	110.6	148.5	-63.6	-57.1	0	0	0	116.8
536	H	30.7	Very low	29	Very low	172 Å²	172	131 Å²	131	80%	0.796	71%	0.709	S	S	*	*				54.4	147.8	58.9	-133.6	6	0	0	0	110.4
537	P	34.5	Very low	29.2	Very low	89 Å²	89	130.2 Å²	130.2	58%	0.578	70%	0.702	S	S	*	*			cis	-151.3	-166.3	18.2	31.6	-3.3	0	0	0	116.9
538	L	27.5	Very low	29.2	Very low	142 Å²	142	127.7 Å²	127.7	74%	0.743	68%	0.683	S	S	*	*			trans	74.5	138.8	156.6	-46.1	-179.1	0	0	0	117.9
539	T	31.4	Very low	29.4	Very low	112 Å²	112	127.8 Å²	127.8	69%	0.687	68%	0.679	S	S	*	*			cis	-158.1	126.6	-3.8	12.6	0	0	0	0	106.2
540	T	28.4	Very low	29.7	Very low	113 Å²	113	127.1 Å²	127.1	69%	0.693	68%	0.676	S	S	*	*				60.9	95.5	65	-55.9	0	0	0	0	111.3
541	I	29.7	Very low	29.7	Very low	156 Å²	156	128 Å²	128	80%	0.8	68%	0.676	S	S	*	*				-171.2	150	99.9	-111.4	138.8	0	0	0	108.7
542	H	31.9	Very low	30	Very low	152 Å²	152	130.1 Å²	130.1	70%	0.704	68%	0.678	S	S	*	*			cis	-170.1	148	-16.3	-155	-109	0	0	0	110.8
543	S	30.4	Very low	30	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	68%	0.679	S	S	*	*			trans	43.8	149.1	149.7	60.1	0	0	0	0	123.1
544	G	28.4	Very low	30.1	Very low	62 Å²	62	130.2 Å²	130.2	64%	0.639	69%	0.685	S	S	*	*			cis	168.1	151.6	3.1	0	0	0	0	0	109
545	I	28.3	Very low	30.2	Very low	163 Å²	163	129.6 Å²	129.6	84%	0.836	69%	0.693	S	S	*	*			cis	79.4	119.5	39.9	-60.6	170.1	0	0	0	112.8
546	N	28.9	Very low	29.9	Very low	99 Å²	99	129.7 Å²	129.7	53%	0.529	70%	0.698	S	S	.	*			cis	-165.1	160.6	-17.6	-119.5	23.3	0	0	0	111.6	V344 S346	V344-N546 WeakPolarHBondContact CG1-O 3.44Å; S346-N546 PolarHBondContact OG-O 3.38Å
547	P	36.3	Very low	29.8	Very low	92 Å²	92	130 Å²	130	60%	0.597	70%	0.7	S	S	*	*			trans	-116.8	145	172	38.5	-28.3	0	0	0	115.5	V344 I345 S346	V344-P547 HydrophobicContact CG1-CB 4.33Å; I345-P547 CarbonylContact O-C 3.4Å; I345-P547 VanDerWaalsContact O-CA 3.26Å; I345-P547 WeakPolarHBondContact O-CA 3.38Å; S346-P547 VanDerWaalsContact OG-CA 3.31Å; S346-P547 WeakPolarHBondContact OG-CA 3.21Å
548	I	28.9	Very low	29.5	Very low	75 Å²	75	133.6 Å²	133.6	39%	0.385	71%	0.709	S	S	.	*			trans	-165	141.9	171.8	-108	160.5	0	0	0	114.9	I345 S346 A347	I345-I548 WeakPolarHBondContact CG2-O 3.45Å; I345-I548 PolarHBondContact O-N 3.12Å; S346-I548 PolarHBondContact OG-N 3.19Å; A347-I548 HydrophobicContact CB-CG2 4.27Å; A347-I548 WeakPolarHBondContact O-CD1 3.4Å
549	H	31.9	Very low	29.7	Very low	151 Å²	151	135.3 Å²	135.3	70%	0.699	71%	0.713	S	S	*	*			trans	59.1	134.4	152.1	-86.4	-42.3	0	0	0	128
550	Q	30.5	Very low	29.5	Very low	147 Å²	147	137.2 Å²	137.2	69%	0.687	71%	0.714	S	S	*	*				108.3	129.3	119.3	-87.4	178.7	29.9	0	0	124.1
551	H	30.7	Very low	29.6	Very low	150 Å²	150	139.2 Å²	139.2	69%	0.694	72%	0.721	S	S	*	*			trans	72.2	127.8	144.3	-94.6	-87.3	0	0	0	124.3
552	H	30	Very low	29.4	Very low	151 Å²	151	138.3 Å²	138.3	70%	0.699	72%	0.717	S	S	*	*			trans	99.6	123.3	139	-87.7	-11.6	0	0	0	123.3
553	Q	27.8	Very low	29.1	Very low	165 Å²	165	140.6 Å²	140.6	77%	0.771	73%	0.726	S	S	*	*			trans	77.6	145.7	145.1	-67.8	-178.9	-1.5	0	0	120
554	L	27.8	Very low	29	Very low	152 Å²	152	142.7 Å²	142.7	80%	0.796	73%	0.727	S	S	*	*			trans	-73.6	153.7	-162.7	-71	77.1	0	0	0	112.9
555	P	29.6	Very low	29	Very low	125 Å²	125	147 Å²	147	81%	0.812	73%	0.731	S	S	*	*				-113.6	172.1	114.4	34.1	-35.8	0	0	0	113.2
556	L	25	Very low	29	Very low	154 Å²	154	145.1 Å²	145.1	81%	0.806	73%	0.729	S	S	*	*			trans	-105.7	134.2	167.2	-78	149.7	0	0	0	108.9
557	Q	28.9	Very low	28.7	Very low	177 Å²	177	147.5 Å²	147.5	83%	0.827	74%	0.74	S	S	*	*				176.5	114.9	129.5	-100.4	170.2	-13.1	0	0	114.2
558	Q	26.3	Very low	28.2	Very low	165 Å²	165	148.7 Å²	148.7	77%	0.771	75%	0.745	S	S	*	*			trans	39.4	106.5	132.2	-65.3	173.5	-24.1	0	0	121
559	H	32.9	Very low	28	Very low	179 Å²	179	150.4 Å²	150.4	83%	0.829	76%	0.76	S	S	*	*				-161.4	98.8	124.7	-111.7	-77.2	0	0	0	107.5
560	Q	26.3	Very low	27.7	Very low	151 Å²	151	150.9 Å²	150.9	71%	0.706	77%	0.767	S	S	*	*				47.7	93.1	94.7	-73.6	-171.2	-16.4	0	0	114.7
561	N	30.9	Very low	27.5	Very low	156 Å²	156	152.2 Å²	152.2	83%	0.834	77%	0.774	S	S	*	*				-161.2	147.3	95.2	-96.6	-23.9	0	0	0	112.1
562	N	26.6	Very low	27.3	Very low	136 Å²	136	150.9 Å²	150.9	73%	0.727	78%	0.781	S	S	*	*			trans	-94.8	135.6	-155.3	-69.8	-21.3	0	0	0	114.2	I564	N562-I564 HydrophobicContact CB-CG1 4.18Å
563	F	24.8	Very low	27.2	Very low	201 Å²	201	152.4 Å²	152.4	88%	0.882	78%	0.781	S	S	*	*			trans	-58.1	131.9	143.3	-117.8	-107.1	0	0	0	108.8
564	I	28.3	Very low	27.3	Very low	146 Å²	146	148.4 Å²	148.4	75%	0.749	77%	0.765	S	S	*	*			trans	-125.6	117.6	166.9	-65.3	-177.8	0	0	0	108.2	N562	N562-I564 HydrophobicContact CB-CG1 4.18Å
565	Q	28.3	Very low	27.5	Very low	153 Å²	153	147.8 Å²	147.8	72%	0.715	76%	0.762	S	S	*	*			trans	-83.4	145.6	161.3	-67.2	-132.8	-0.1	0	0	109.7
566	P	27.5	Very low	27.8	Very low	123 Å²	123	148.9 Å²	148.9	80%	0.799	76%	0.757	S	S	*	*			trans	-92.4	108.3	155.8	32.2	-23.8	0	0	0	110.1
567	I	23	Very low	28.5	Very low	148 Å²	148	148 Å²	148	76%	0.759	75%	0.748	S	S	*	*			trans	-75.8	161.1	145	-57.3	168.2	0	0	0	106.2
568	V	26.2	Very low	28.8	Very low	117 Å²	117	145.3 Å²	145.3	71%	0.709	73%	0.734	S	S	*	*			trans	123.5	96.5	151.7	178.8	0	0	0	0	115.2
569	T	24.8	Very low	29.2	Very low	111 Å²	111	141.1 Å²	141.1	68%	0.681	72%	0.72	S	S	*	*			trans	53.1	118.9	139	67.7	0	0	0	0	121.8
570	D	25	Very low	29.4	Very low	161 Å²	161	137.7 Å²	137.7	86%	0.861	70%	0.704	S	S	*	*				43.3	82.3	112.5	-140.4	-8.9	0	0	0	116.1
571	Q	26.7	Very low	29.8	Very low	176 Å²	176	133.2 Å²	133.2	82%	0.822	69%	0.689	S	S	*	*			trans	-155.9	109.2	160.7	-119.7	164.8	54.5	0	0	110.5	W573	Q571-W573 PolarHBondContact O-N 3.22Å
572	S	26.5	Very low	29.9	Very low	122 Å²	122	130.2 Å²	130.2	85%	0.853	67%	0.673	S	S	*	*			trans	-55	114.9	-177.2	56.6	0	0	0	0	112.9
573	W	27.3	Very low	30.5	Very low	183 Å²	183	127.7 Å²	127.7	69%	0.693	66%	0.658	S	S	*	*			trans	-73.4	131.7	166.9	-84.8	47.4	0	0	0	109.9	Q571 F578	Q571-W573 PolarHBondContact O-N 3.22Å; W573-F578 HydrophobicContact CE3-CB 4.48Å
574	N	30.9	Very low	31	Very low	80 Å²	80	122.9 Å²	122.9	43%	0.428	64%	0.642	S	S	.	*			trans	-86.1	155.4	172.4	82.2	-2.3	0	0	0	110.9	E576 Q577	N574-E576 PolarHBondContact O-N 3.15Å; N574-E576 VanDerWaalsContact O-N 3.09Å; N574-E576 PolarHBondContact OD1-N 3.09Å; N574-Q577 PolarHBondContact O-N 2.78Å; N574-Q577 PolarHBondContact OD1-N 3.18Å; N574-Q577 VanDerWaalsContact OD1-N 3.08Å
575	N	32.7	Very low	31.4	Very low	140 Å²	140	120.1 Å²	120.1	75%	0.749	63%	0.632	S	S	*	*	H	α-helix	trans	-61.4	-21.7	-176.1	-68	-28.3	0	0	0	113.6	T579	N575-T579 PolarHBondContact O-N 3.15Å; N575-T579 PolarHBondContact O-OG1 3.16Å
576	E	34.8	Very low	31.6	Very low	148 Å²	148	115.1 Å²	115.1	69%	0.692	62%	0.621	S	S	*	*	H	α-helix	trans	-73.8	-45	-179.8	-65.5	-178.5	139.6	0	0	112.4	N574 F578 T579 Q580	N574-E576 PolarHBondContact O-N 3.15Å; N574-E576 VanDerWaalsContact O-N 3.09Å; N574-E576 PolarHBondContact OD1-N 3.09Å; E576-F578 PolarHBondContact O-N 2.85Å; E576-T579 PolarHBondContact O-N 3.2Å; E576-Q580 PolarHBondContact O-N 2.73Å; E576-Q580 VanDerWaalsContact O-N 3.12Å
577	Q	39.1	Very low	31.8	Very low	134 Å²	134	115 Å²	115	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-70.6	-32.9	-179.6	-67.7	-158.2	-0.3	0	0	113.1	N574 Q580 S581	N574-Q577 PolarHBondContact O-N 2.78Å; N574-Q577 PolarHBondContact OD1-N 3.18Å; N574-Q577 VanDerWaalsContact OD1-N 3.08Å; Q577-Q580 PolarHBondContact O-N 3.39Å; Q577-S581 PolarHBondContact O-N 2.95Å
578	F	35.4	Very low	32.2	Very low	122 Å²	122	113.7 Å²	113.7	54%	0.535	61%	0.608	S	S	.	*	H	α-helix	trans	-61.9	-45.1	172	-176.7	-106.8	0	0	0	111.7	W573 E576 Q580 S581 I582	W573-F578 HydrophobicContact CE3-CB 4.48Å; E576-F578 PolarHBondContact O-N 2.85Å; F578-Q580 VanDerWaalsContact C-N 3.31Å; F578-Q580 PolarHBondContact O-N 3.23Å; F578-S581 PolarHBondContact O-N 3.33Å; F578-I582 HydrophobicContact CD1-CD1 4.01Å; F578-I582 HydrophobicContact CE1-CD1 3.54Å; F578-I582 HydrophobicContact CE2-CD1 4.44Å; F578-I582 HydrophobicContact CZ-CD1 3.78Å; F578-I582 PolarHBondContact O-N 3.09Å
579	T	36	Very low	32.3	Very low	76 Å²	76	115.3 Å²	115.3	47%	0.466	61%	0.611	S	S	.	*	H	α-helix	trans	-61.6	-39.7	178.2	-56	0	0	0	0	111.7	N575 E576 I582 I583	N575-T579 PolarHBondContact O-N 3.15Å; N575-T579 PolarHBondContact O-OG1 3.16Å; E576-T579 PolarHBondContact O-N 3.2Å; T579-I582 PolarHBondContact O-N 3.38Å; T579-I583 HydrophobicContact CG2-CD1 4.31Å; T579-I583 WeakPolarHBondContact O-CG1 2.97Å; T579-I583 PolarHBondContact O-N 3.17Å
580	Q	37.2	Very low	32.5	Very low	107 Å²	107	114.9 Å²	114.9	50%	0.5	61%	0.613	S	S	.	*	H	α-helix	trans	-68.6	-38.8	-179.5	-149.8	64.5	42	0	0	113	E576 Q577 F578 I582 I583 D584	E576-Q580 PolarHBondContact O-N 2.73Å; E576-Q580 VanDerWaalsContact O-N 3.12Å; Q577-Q580 PolarHBondContact O-N 3.39Å; F578-Q580 VanDerWaalsContact C-N 3.31Å; F578-Q580 PolarHBondContact O-N 3.23Å; Q580-I582 VanDerWaalsContact C-N 3.33Å; Q580-I582 PolarHBondContact O-N 2.99Å; Q580-I583 WeakPolarHBondContact O-CB 3.28Å; Q580-I583 PolarHBondContact O-N 3.06Å; Q580-D584 PolarHBondContact O-N 3.19Å; Q580-D584 VanDerWaalsContact O-N 3.1Å
581	S	33.2	Very low	32.8	Very low	57 Å²	57	114.6 Å²	114.6	40%	0.399	61%	0.607	S	S	.	*	H	α-helix	trans	-62.3	-37.7	176.3	-176.9	0	0	0	0	112.9	Q577 F578 D584 T585	Q577-S581 PolarHBondContact O-N 2.95Å; F578-S581 PolarHBondContact O-N 3.33Å; S581-D584 PolarHBondContact O-N 2.97Å; S581-T585 WeakPolarHBondContact O-CB 3.2Å; S581-T585 PolarHBondContact O-N 3.18Å; S581-T585 PolarHBondContact O-OG1 3.07Å
582	I	34.5	Very low	32.7	Very low	94 Å²	94	116.6 Å²	116.6	48%	0.482	61%	0.608	S	S	.	*	H	α-helix	trans	-66.6	-38.5	176.4	-67.6	175.1	0	0	0	111.1	F578 T579 Q580 T585 G586	F578-I582 HydrophobicContact CD1-CD1 4.01Å; F578-I582 HydrophobicContact CE1-CD1 3.54Å; F578-I582 HydrophobicContact CE2-CD1 4.44Å; F578-I582 HydrophobicContact CZ-CD1 3.78Å; F578-I582 PolarHBondContact O-N 3.09Å; T579-I582 PolarHBondContact O-N 3.38Å; Q580-I582 VanDerWaalsContact C-N 3.33Å; Q580-I582 PolarHBondContact O-N 2.99Å; I582-T585 PolarHBondContact O-N 2.97Å; I582-G586 PolarHBondContact O-N 3.23Å
583	I	38.2	Very low	32.7	Very low	82 Å²	82	116.3 Å²	116.3	42%	0.421	61%	0.605	S	S	.	*	H	α-helix	trans	-63.6	-45.1	176.2	-67	165.5	0	0	0	111	T579 Q580 T585 N587	T579-I583 HydrophobicContact CG2-CD1 4.31Å; T579-I583 WeakPolarHBondContact O-CG1 2.97Å; T579-I583 PolarHBondContact O-N 3.17Å; Q580-I583 WeakPolarHBondContact O-CB 3.28Å; Q580-I583 PolarHBondContact O-N 3.06Å; I583-T585 PolarHBondContact O-N 3.02Å; I583-N587 PolarHBondContact O-ND2 3.17Å
584	D	34.9	Very low	32.7	Very low	100 Å²	100	113.1 Å²	113.1	54%	0.535	61%	0.608	S	S	.	*	H	α-helix	trans	-70.5	-30.7	-179.6	-72.4	-21.8	0	0	0	112.9	Q580 S581 N588	Q580-D584 PolarHBondContact O-N 3.19Å; Q580-D584 VanDerWaalsContact O-N 3.1Å; S581-D584 PolarHBondContact O-N 2.97Å; D584-N588 PolarHBondContact O-ND2 2.99Å
585	T	37.9	Very low	32.4	Very low	89 Å²	89	116.1 Å²	116.1	55%	0.546	63%	0.628	S	S	.	*	H	α-helix	trans	-77	-37.5	177.1	-48	0	0	0	0	112	S581 I582 I583 N587 N588	S581-T585 WeakPolarHBondContact O-CB 3.2Å; S581-T585 PolarHBondContact O-N 3.18Å; S581-T585 PolarHBondContact O-OG1 3.07Å; I582-T585 PolarHBondContact O-N 2.97Å; I583-T585 PolarHBondContact O-N 3.02Å; T585-N587 VanDerWaalsContact C-N 3.25Å; T585-N587 PolarHBondContact O-N 3.07Å; T585-N588 PolarHBondContact O-N 3.49Å
586	G	31.3	Very low	32.1	Very low	47 Å²	47	114.2 Å²	114.2	49%	0.485	63%	0.626	S	S	.	*	H	α-helix	trans	-62.7	-27.2	178.6	0	0	0	0	0	114.4	I582 N588	I582-G586 PolarHBondContact O-N 3.23Å; G586-N588 VanDerWaalsContact C-N 3.27Å; G586-N588 PolarHBondContact O-N 3.09Å
587	N	31.4	Very low	31.9	Very low	121 Å²	121	115.5 Å²	115.5	65%	0.647	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-9.7	-179.2	-76	-44.5	0	0	0	114.8	I583 T585	I583-N587 PolarHBondContact O-ND2 3.17Å; T585-N587 VanDerWaalsContact C-N 3.25Å; T585-N587 PolarHBondContact O-N 3.07Å
588	N	31.6	Very low	31.3	Very low	121 Å²	121	116.3 Å²	116.3	65%	0.647	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-1.3	-177.6	-81.3	-70	0	0	0	115.2	D584 T585 G586 S590	D584-N588 PolarHBondContact O-ND2 2.99Å; T585-N588 PolarHBondContact O-N 3.49Å; G586-N588 VanDerWaalsContact C-N 3.27Å; G586-N588 PolarHBondContact O-N 3.09Å; N588-S590 PolarHBondContact O-N 3.01Å
589	I	29.4	Very low	30.8	Very low	150 Å²	150	117.7 Å²	117.7	77%	0.769	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	41.9	-174.8	-41.2	-177.8	0	0	0	112
590	S	29	Very low	30.4	Very low	103 Å²	103	121.5 Å²	121.5	72%	0.72	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	0.3	-179.2	58.4	0	0	0	0	114.5	N588	N588-S590 PolarHBondContact O-N 3.01Å
591	Q	30.2	Very low	29.9	Very low	155 Å²	155	123.2 Å²	123.2	72%	0.724	69%	0.693	S	S	*	*	S	Bend	trans	-111	-3.8	-171.6	-75.2	-173.1	-14.9	0	0	116.5
592	Y	26.2	Very low	29.7	Very low	217 Å²	217	129.2 Å²	129.2	85%	0.851	72%	0.719	S	S	*	*			trans	-134.9	68.2	-171.5	-70.9	-84.6	0	0	0	114.4
593	C	25.9	Very low	29.3	Very low	116 Å²	116	130.2 Å²	130.2	78%	0.784	73%	0.734	S	S	*	*			trans	-154.4	128.4	157.5	-151.6	0	0	0	0	111.6
594	P	26.6	Very low	28.7	Very low	116 Å²	116	136.9 Å²	136.9	75%	0.753	76%	0.756	S	S	*	*			trans	-78.9	130.6	-175	30.2	-33.8	0	0	0	113.2	S596	P594-S596 PolarHBondContact O-N 3.46Å
595	V	25.7	Very low	28.3	Very low	143 Å²	143	139.1 Å²	139.1	87%	0.867	77%	0.768	S	S	*	*			trans	-77.3	101.2	179.1	178.9	0	0	0	0	111.2
596	S	26.4	Very low	27.9	Very low	100 Å²	100	143.5 Å²	143.5	70%	0.699	78%	0.782	S	S	*	*			trans	-168.9	61.6	165.1	61.1	0	0	0	0	115.1	P594	P594-S596 PolarHBondContact O-N 3.46Å
597	L	28.9	Very low	27.7	Very low	176 Å²	176	150 Å²	150	92%	0.921	80%	0.8	S	S	*	*			trans	-166.3	47.1	160.5	-109.2	149.2	0	0	0	111.9
598	I	26.8	Very low	27.6	Very low	150 Å²	150	153.7 Å²	153.7	77%	0.769	81%	0.813	S	S	*	*			trans	-124.3	94.4	168.3	-57.9	174	0	0	0	106.8
599	N	26.3	Very low	27.4	Very low	152 Å²	152	158.9 Å²	158.9	81%	0.813	82%	0.823	S	S	*	*			trans	179.5	142.7	158.2	-87.3	-27.5	0	0	0	106.7
600	D	26.1	Very low	27.3	Very low	155 Å²	155	159.3 Å²	159.3	83%	0.829	83%	0.827	S	S	*	*	S	Bend	trans	97.7	51.4	178.5	-54.6	-13.7	0	0	0	117.9
601	T	28.3	Very low	27.5	Very low	144 Å²	144	162.9 Å²	162.9	88%	0.883	83%	0.832	S	S	*	*	S	Bend	trans	-170.1	43.6	142.7	13.8	0	0	0	0	113.5
602	L	27.3	Very low	27.8	Very low	182 Å²	182	163.5 Å²	163.5	95%	0.953	84%	0.835	S	S	*	*			trans	-135.9	58.9	172.7	-79.8	176.7	0	0	0	111.6
603	S	26.3	Very low	28.3	Very low	115 Å²	115	157.7 Å²	157.7	80%	0.804	82%	0.824	S	S	*	*			trans	-164	87.8	164.9	-165.2	0	0	0	0	112
604	Y	25.4	Very low	28.6	Very low	222 Å²	222	159.8 Å²	159.8	87%	0.871	82%	0.822	S	S	*	*			trans	-158.4	153.7	151.9	-131	-98.5	0	0	0	109
605	D	27.4	Very low	29	Very low	147 Å²	147	160.7 Å²	160.7	79%	0.786	82%	0.816	S	S	*	*	S	Bend	trans	66.3	50.9	-178.7	-65.7	-32.2	0	0	0	119.1
606	Q	28.8	Very low	29.4	Very low	182 Å²	182	161 Å²	161	85%	0.85	81%	0.807	S	S	*	*				-131.3	95.7	129.9	-78.2	-166.3	-3.1	0	0	110
607	H	28.6	Very low	29.8	Very low	184 Å²	184	162.3 Å²	162.3	85%	0.852	80%	0.802	S	S	*	*			trans	177.7	96.4	149.7	-99.6	32.7	0	0	0	111.3
608	Q	27.9	Very low	29.9	Very low	198 Å²	198	160.3 Å²	160.3	93%	0.925	79%	0.788	S	S	*	*			trans	-177.9	78.7	143.1	-105.7	173.7	84.2	0	0	112.6
609	R	27.2	Very low	30.3	Very low	230 Å²	230	159.7 Å²	159.7	87%	0.868	78%	0.782	S	S	*	*			trans	-161.7	98.5	146.6	-126.1	-174	-76.5	-159.7	0.1	110.9
610	N	29	Very low	30.7	Very low	159 Å²	159	159.1 Å²	159.1	85%	0.85	77%	0.774	S	S	*	*			trans	170.4	121.9	130.8	-84.7	-13.9	0	0	0	110
611	Q	33.2	Very low	31.2	Very low	177 Å²	177	158.1 Å²	158.1	83%	0.827	76%	0.764	S	S	*	*			trans	-123.5	135.8	157.3	-78.3	-167.7	1.7	0	0	108.8
612	H	36.4	Very low	31.5	Very low	169 Å²	169	158 Å²	158	78%	0.782	75%	0.753	S	S	*	*			trans	71.1	151.8	159	-77.6	-58.8	0	0	0	118.8
613	P	36.6	Very low	31.9	Very low	95 Å²	95	154.8 Å²	154.8	62%	0.617	74%	0.737	S	S	*	*				-141.9	-179.9	-61.6	29.7	-8.1	0	0	0	115.1
614	H	31.9	Very low	32.4	Very low	159 Å²	159	156.5 Å²	156.5	74%	0.736	73%	0.732	S	S	*	*			trans	91.7	126.7	150.1	-82.2	-66.9	0	0	0	122.9
615	H	34.3	Very low	33	Very low	136 Å²	136	153.8 Å²	153.8	63%	0.63	73%	0.727	S	S	*	*			trans	82.1	105.5	146.6	-80.4	-67.8	0	0	0	123
616	H	34	Very low	33.5	Very low	149 Å²	149	153.5 Å²	153.5	69%	0.69	72%	0.72	S	S	*	*				67.1	143.2	129.3	-76.9	9.1	0	0	0	119.2
617	H	34.8	Very low	33.7	Very low	127 Å²	127	150.9 Å²	150.9	59%	0.588	71%	0.708	S	S	*	*			cis	-153.9	156.9	-7.8	-137.7	73.7	0	0	0	108.3
618	Q	30.8	Very low	34	Very low	135 Å²	135	149.3 Å²	149.3	63%	0.631	70%	0.701	S	S	*	*			trans	1.3	154.2	147	-71.5	170.6	-1.8	0	0	120.4
619	H	35.5	Very low	34.4	Very low	136 Å²	136	149 Å²	149	63%	0.63	70%	0.7	S	S	*	*			cis	-165.6	163.2	23.7	-118.7	-44.7	0	0	0	111.7
620	H	34.1	Very low	34.8	Very low	141 Å²	141	145.2 Å²	145.2	65%	0.653	69%	0.692	S	S	*	*			trans	20.6	158.5	138.2	-71.3	-35.4	0	0	0	123.1
621	H	36.7	Very low	35.2	Very low	134 Å²	134	144.8 Å²	144.8	62%	0.62	69%	0.685	S	S	*	*			cis	-165.9	157.8	15.8	-125.9	-59.3	0	0	0	112.2
622	H	36	Very low	35.3	Very low	141 Å²	141	142.6 Å²	142.6	65%	0.653	68%	0.675	S	S	*	*			trans	53.2	126.5	139	-81.7	-25.7	0	0	0	127.1
623	D	34.6	Very low	35.4	Very low	114 Å²	114	141.5 Å²	141.5	61%	0.61	67%	0.67	S	S	*	*				97.9	130.2	115.2	-67.5	-6.6	0	0	0	126.6
624	H	36.6	Very low	35.4	Very low	152 Å²	152	143.8 Å²	143.8	70%	0.704	67%	0.672	S	S	*	*			trans	54.4	138.5	143.2	-80	-99.5	0	0	0	121.2
625	H	39.2	Very low	35.6	Very low	165 Å²	165	142.9 Å²	142.9	76%	0.764	67%	0.669	S	S	*	*				-168.5	173.5	65.7	-134.2	-84.5	0	0	0	116
626	H	36.8	Very low	35.7	Very low	140 Å²	140	142.7 Å²	142.7	65%	0.648	67%	0.668	S	S	*	*			trans	-59.6	152.6	178.2	-77.7	-0.5	0	0	0	117
627	Q	33.3	Very low	35.6	Very low	128 Å²	128	142.4 Å²	142.4	60%	0.598	67%	0.667	S	S	*	*			cis	78.6	112.9	37.8	176.8	-83.1	123.1	0	0	116
628	Q	34.8	Very low	35.4	Very low	150 Å²	150	143 Å²	143	70%	0.701	67%	0.67	S	S	*	*			trans	176.4	138.9	134.3	-166.6	137.1	114.3	0	0	113.8
629	Q	37.3	Very low	35.3	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	68%	0.677	S	S	*	*			trans	-167.3	160.1	157.4	-112.5	174.8	10.7	0	0	111.4
630	Q	35.2	Very low	35.4	Very low	151 Å²	151	143.5 Å²	143.5	71%	0.706	68%	0.682	S	S	*	*			trans	-160.3	171.3	-173.6	-65.7	-172	-5.6	0	0	114.9
631	Q	36.3	Very low	35	Very low	151 Å²	151	142.7 Å²	142.7	71%	0.706	69%	0.692	S	S	*	*			trans	79	169.2	160.5	-40.5	-166.2	3.2	0	0	117
632	Q	37	Very low	34.5	Very low	130 Å²	130	141.2 Å²	141.2	61%	0.607	70%	0.697	S	S	*	*			cis	-156.2	171	9.3	-153.3	-179	85.6	0	0	113.8
633	Q	37.7	Very low	34.2	Very low	147 Å²	147	142.6 Å²	142.6	69%	0.687	71%	0.706	S	S	*	*			trans	78.5	96.8	163.5	-55.5	-167.4	15.4	0	0	117.8
634	Q	37	Very low	33.7	Very low	143 Å²	143	140.8 Å²	140.8	67%	0.668	70%	0.702	S	S	*	*				80.5	144.2	70.3	-72.8	177.3	39.8	0	0	112.1
635	Q	35.5	Very low	33.6	Very low	140 Å²	140	141.7 Å²	141.7	65%	0.654	71%	0.706	S	S	*	*			cis	-167.5	179	-5.2	-107.1	177.8	26.6	0	0	106.9
636	Q	36.2	Very low	33	Very low	132 Å²	132	142.3 Å²	142.3	62%	0.617	71%	0.71	S	S	*	*			cis	-156.8	133.7	2.5	-125.1	-172.8	77.4	0	0	107.5
637	Q	31.7	Very low	32.5	Very low	142 Å²	142	141.1 Å²	141.1	66%	0.664	71%	0.713	S	S	*	*				83.1	130.4	98.8	-86.8	-174.4	29.7	0	0	121.2
638	Q	31.5	Very low	32.6	Very low	141 Å²	141	142.8 Å²	142.8	66%	0.659	72%	0.72	S	S	*	*			trans	94.7	103	139.9	-72	-177.2	70.1	0	0	124.4
639	Q	28.9	Very low	32.3	Very low	168 Å²	168	141.4 Å²	141.4	79%	0.785	72%	0.717	S	S	*	*				80.3	145.1	126.2	-63.6	-162.3	57.3	0	0	123.6
640	P	37.6	Very low	32.2	Very low	112 Å²	112	139.4 Å²	139.4	73%	0.727	72%	0.718	S	S	*	*			trans	-108.4	151.7	178.9	40.4	-32.2	0	0	0	114.5
641	S	25.6	Very low	31.9	Very low	124 Å²	124	137.8 Å²	137.8	87%	0.867	71%	0.714	S	S	*	*			trans	-174.2	155.1	146.6	18.8	0	0	0	0	114.2
642	S	26.3	Very low	31.7	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	72%	0.72	S	S	*	*			trans	-52.9	152.3	176.1	52.9	0	0	0	0	117.8
643	M	29.3	Very low	31.3	Very low	170 Å²	170	137.4 Å²	137.4	84%	0.837	72%	0.724	S	S	*	*				-166.7	158.6	128.6	-103	-85.5	87.8	0	0	112.6
644	S	24.7	Very low	30.8	Very low	76 Å²	76	137.6 Å²	137.6	53%	0.531	73%	0.727	S	S	.	*			trans	-103.5	159	-170	52.3	0	0	0	0	114
645	H	33.2	Very low	30.6	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.787	74%	0.735	S	S	*	*			trans	176.6	118.6	140.3	-87.9	-55.7	0	0	0	108.2
646	Q	26.8	Very low	30.2	Very low	178 Å²	178	140.5 Å²	140.5	83%	0.832	74%	0.738	S	S	*	*				46.3	123.6	75.2	-80.6	-175.2	-13.1	0	0	113.2
647	T	27.5	Very low	29.9	Very low	116 Å²	116	141.1 Å²	141.1	71%	0.712	75%	0.75	S	S	*	*			cis	-142.4	-161.2	28.8	53.4	0	0	0	0	109.8
648	H	34.7	Very low	29.7	Very low	163 Å²	163	141.6 Å²	141.6	76%	0.755	76%	0.757	S	S	*	*			cis	-158.8	157.4	7.2	-140.9	-56.7	0	0	0	111.9
649	D	28.6	Very low	29.9	Very low	120 Å²	120	140.9 Å²	140.9	64%	0.642	77%	0.765	S	S	*	*			trans	-67.3	154.8	173.4	-66.5	-93.1	0	0	0	117.4
650	V	34.6	Very low	29.9	Very low	149 Å²	149	140.5 Å²	140.5	90%	0.903	77%	0.765	S	S	*	*			trans	-139.7	120.1	132.8	-170.9	0	0	0	0	110.6
651	N	30	Very low	29.4	Very low	117 Å²	117	140.6 Å²	140.6	63%	0.626	76%	0.76	S	S	*	*			trans	-89.7	161.5	171.7	-81.7	-92.1	0	0	0	111.5
652	L	31.1	Very low	29.4	Very low	158 Å²	158	142.1 Å²	142.1	83%	0.827	76%	0.756	S	S	*	*				176.7	142	115.2	-118.6	65.8	0	0	0	118.2
653	V	29.8	Very low	29.3	Very low	116 Å²	116	145.5 Å²	145.5	70%	0.703	76%	0.758	S	S	*	*			trans	67.9	88	150.1	-163.1	0	0	0	0	123.1
654	M	26.3	Very low	29.1	Very low	151 Å²	151	144.7 Å²	144.7	74%	0.744	75%	0.752	S	S	*	*				52.1	117.2	95.3	-155.6	176.6	-154.5	0	0	123.1
655	K	32.3	Very low	29.3	Very low	190 Å²	190	150.1 Å²	150.1	83%	0.826	77%	0.767	S	S	*	*				172.6	108.8	124.5	-95.6	170	-179.3	179.9	0	110.5
656	Q	27.3	Very low	28.9	Very low	154 Å²	154	148.8 Å²	148.8	72%	0.72	77%	0.765	S	S	*	*				62.7	104.5	85.3	-81.5	-170.7	-16	0	0	116.9
657	T	31.3	Very low	29.3	Very low	144 Å²	144	144.8 Å²	144.8	88%	0.883	76%	0.755	S	S	*	*				-167.2	152.2	125.5	37.2	0	0	0	0	109.3
658	N	27.1	Very low	29.2	Very low	152 Å²	152	146 Å²	146	81%	0.813	76%	0.756	S	S	*	*			trans	-125.2	136.7	-163.7	-64.3	65.9	0	0	0	113.5
659	P	36.1	Very low	28.9	Very low	126 Å²	126	144.8 Å²	144.8	82%	0.818	75%	0.754	S	S	*	*			trans	-92.7	168.9	177	37.6	-36.1	0	0	0	114
660	M	28.1	Very low	29	Very low	160 Å²	160	147.8 Å²	147.8	79%	0.788	76%	0.761	S	S	*	*			trans	-149.1	121.9	172.6	-96.5	-84	-78.4	0	0	111.6
661	N	26.2	Very low	28.8	Very low	114 Å²	114	146.8 Å²	146.8	61%	0.61	75%	0.751	S	S	*	*				44.5	122.5	118.6	-144.6	-3	0	0	0	119.8
662	I	26.4	Very low	29	Very low	156 Å²	156	148.5 Å²	148.5	80%	0.8	76%	0.76	S	S	*	*				171	152.5	123.2	-86.9	156.4	0	0	0	113.3
663	F	24.1	Very low	29.2	Very low	175 Å²	175	147.2 Å²	147.2	77%	0.768	75%	0.754	S	S	*	*			trans	-72.3	167	-171.2	-69.2	-108.9	0	0	0	117.5
664	H	25.4	Very low	29.3	Very low	154 Å²	154	148.2 Å²	148.2	71%	0.713	76%	0.76	S	S	*	*			trans	84.5	132	140.1	-117.5	-80.9	0	0	0	119.8
665	F	28.9	Very low	29.4	Very low	189 Å²	189	146.4 Å²	146.4	83%	0.829	76%	0.762	S	S	*	*				148.8	105.6	128	-87.6	-75.9	0	0	0	114.6
666	D	24	Very low	29.3	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	76%	0.758	S	S	*	*			trans	-71.7	171.3	141	-122.3	-19.7	0	0	0	108.9
667	P	35	Very low	29.4	Very low	95 Å²	95	142.9 Å²	142.9	62%	0.617	77%	0.77	S	S	*	*			cis	-135.3	-166.4	-19.1	26	-1.2	0	0	0	112.8
668	L	26.8	Very low	29.4	Very low	141 Å²	141	145.9 Å²	145.9	74%	0.738	77%	0.771	S	S	*	*			trans	119.1	104.3	141.9	-59.8	174	0	0	0	121.1
669	I	27.8	Very low	29.3	Very low	137 Å²	137	146 Å²	146	70%	0.703	77%	0.77	S	S	*	*				42.5	136.4	129.7	-22	-179.3	0	0	0	122.6
670	K	31	Very low	29.1	Very low	183 Å²	183	144.4 Å²	144.4	80%	0.796	77%	0.768	S	S	*	*			trans	100.3	140.8	152.7	-60.7	-179.3	-172.9	175.2	0	113.9
671	N	29.6	Very low	29.1	Very low	129 Å²	129	145.7 Å²	145.7	69%	0.69	77%	0.769	S	S	*	*			cis	175.3	171.3	-14.5	-112.1	17.5	0	0	0	104.4
672	D	34.1	Very low	29.3	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	78%	0.781	S	S	*	*			trans	75.5	131.4	166	-42.5	-34.2	0	0	0	115.8
673	D	36.7	Very low	29.5	Very low	131 Å²	131	147.6 Å²	147.6	70%	0.701	78%	0.78	S	S	*	*			cis	-127.5	-157.9	-7.4	-172.9	66.5	0	0	0	110.3	S675	D673-S675 PolarHBondContact OD2-N 2.71Å; D673-S675 VanDerWaalsContact OD2-N 3.12Å
674	V	30.5	Very low	29.8	Very low	137 Å²	137	147.5 Å²	147.5	83%	0.83	78%	0.782	S	S	*	*			trans	-144.4	7.1	-168.6	-146.3	0	0	0	0	113.5	G676	V674-G676 PolarHBondContact O-N 3.37Å; V674-G676 VanDerWaalsContact O-N 3.09Å
675	S	29.3	Very low	30.1	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	79%	0.787	S	S	*	*			trans	-74.2	101.9	-167.8	71.8	0	0	0	0	115.9	D673	D673-S675 PolarHBondContact OD2-N 2.71Å; D673-S675 VanDerWaalsContact OD2-N 3.12Å
676	G	28.8	Very low	30.1	Very low	71 Å²	71	150.5 Å²	150.5	73%	0.732	79%	0.786	S	S	*	*			trans	114.7	98.8	137.6	0	0	0	0	0	118.7	V674	V674-G676 PolarHBondContact O-N 3.37Å; V674-G676 VanDerWaalsContact O-N 3.09Å
677	M	30.3	Very low	30.3	Very low	198 Å²	198	153.8 Å²	153.8	98%	0.975	79%	0.794	S	S	*	*			trans	-133.9	121.5	141	-99.5	179.4	-179.1	0	0	110.2
678	K	31.8	Very low	29.9	Very low	207 Å²	207	154.6 Å²	154.6	90%	0.9	80%	0.797	S	S	*	*			trans	-78.7	149.1	-177	-93.7	175.1	175.1	170.7	0	111.3	A680	K678-A680 PolarHBondContact O-N 2.94Å
679	I	25	Very low	29.9	Very low	154 Å²	154	156 Å²	156	79%	0.79	80%	0.802	S	S	*	*			trans	-38	119.1	157.9	-62.5	157.1	0	0	0	111.3	K681	I679-K681 HydrophobicContact CG2-CG 4.11Å
680	A	30.9	Very low	29.9	Very low	94 Å²	94	154.4 Å²	154.4	78%	0.777	80%	0.801	S	S	*	*			trans	-92.8	103.5	157.5	0	0	0	0	0	108.7	K678	K678-A680 PolarHBondContact O-N 2.94Å
681	K	28.2	Very low	29.6	Very low	187 Å²	187	153.3 Å²	153.3	81%	0.813	80%	0.802	S	S	*	*			trans	-86.3	118	160.2	-90.3	-176.6	170.9	-175.1	0	107.8	I679	I679-K681 HydrophobicContact CG2-CG 4.11Å
682	L	31.4	Very low	29.6	Very low	165 Å²	165	153.1 Å²	153.1	86%	0.864	81%	0.806	S	S	*	*			trans	-135.9	78.4	162.4	-86.8	158.2	0	0	0	104.7
683	D	30.6	Very low	29.3	Very low	144 Å²	144	150.8 Å²	150.8	77%	0.77	80%	0.802	S	S	*	*				81.1	120.6	78.9	-159.1	25.1	0	0	0	111.8
684	E	29.3	Very low	29	Very low	173 Å²	173	152.2 Å²	152.2	81%	0.808	81%	0.807	S	S	*	*			trans	-79.9	129.5	-173	-60.6	174	147.6	0	0	110.1
685	R	32.1	Very low	28.8	Very low	221 Å²	221	152.7 Å²	152.7	83%	0.834	81%	0.805	S	S	*	*			trans	-174.8	121.8	141.5	-97	139.2	-152.1	-149.8	8.4	113.3
686	K	28.5	Very low	28.9	Very low	186 Å²	186	153.7 Å²	153.7	81%	0.809	81%	0.807	S	S	*	*			trans	40.8	113.4	137.6	-57.5	179.7	177.5	-173.8	0	118
687	F	29	Very low	29.1	Very low	211 Å²	211	155.9 Å²	155.9	93%	0.925	81%	0.808	S	S	*	*				-154.2	148.8	114.3	-118.3	-81.7	0	0	0	110.7
688	T	26.3	Very low	29.1	Very low	111 Å²	111	151.9 Å²	151.9	68%	0.681	80%	0.8	S	S	*	*			trans	-121.7	150.9	-173.8	-27.3	0	0	0	0	109.6
689	M	27.2	Very low	29.1	Very low	171 Å²	171	147.6 Å²	147.6	84%	0.842	79%	0.791	S	S	*	*			trans	69.4	161.2	177.5	-55.6	-60.6	173.3	0	0	114.3
690	P	27.2	Very low	29.3	Very low	104 Å²	104	146.9 Å²	146.9	68%	0.675	79%	0.787	S	S	*	*			cis	-122.4	-175.1	6.5	43.4	-30.3	0	0	0	115.4
691	I	24.2	Very low	29.3	Very low	160 Å²	160	149.7 Å²	149.7	82%	0.821	79%	0.789	S	S	*	*			trans	-107.7	130.3	154	-64.7	169.5	0	0	0	106.7
692	T	30.4	Very low	29.3	Very low	125 Å²	125	145.6 Å²	145.6	77%	0.767	78%	0.784	S	S	*	*			trans	-144.4	118.7	166.5	45.9	0	0	0	0	111.2
693	S	27.1	Very low	29.3	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	79%	0.787	S	S	*	*			trans	-78.7	150.4	177.5	-33.3	0	0	0	0	112.2
694	I	30.7	Very low	29.2	Very low	161 Å²	161	145.3 Å²	145.3	83%	0.826	78%	0.781	S	S	*	*			trans	-124.8	120.3	158.9	-62.5	178.9	0	0	0	107.4
695	N	27	Very low	29.4	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	78%	0.777	S	S	*	*			trans	-114.3	141.5	173.8	-91.9	-6.6	0	0	0	109.5
696	T	30.9	Very low	29.3	Very low	134 Å²	134	138.1 Å²	138.1	82%	0.822	77%	0.769	S	S	*	*			trans	-140.9	113.7	162	48.9	0	0	0	0	109.7
697	P	33	Very low	29.3	Very low	117 Å²	117	135.6 Å²	135.6	76%	0.76	76%	0.764	S	S	*	*			trans	-112.2	-173.2	-177.4	41	-33.8	0	0	0	114.2
698	S	30.9	Very low	29.4	Very low	114 Å²	114	136.6 Å²	136.6	80%	0.797	76%	0.763	S	S	*	*			trans	93.8	142.1	174.6	78.6	0	0	0	0	115.5
699	T	32.2	Very low	29.6	Very low	116 Å²	116	136 Å²	136	71%	0.712	76%	0.764	S	S	*	*			cis	-150.9	126.9	21.4	-48.2	0	0	0	0	115.2
700	I	29.1	Very low	29.9	Very low	140 Å²	140	133.4 Å²	133.4	72%	0.718	76%	0.762	S	S	*	*			trans	18.2	125.6	139.1	-47.3	166.4	0	0	0	120.4
701	N	31	Very low	30.2	Very low	153 Å²	153	132.8 Å²	132.8	82%	0.818	76%	0.76	S	S	*	*				-170.7	149.9	114.9	-108.2	-33.4	0	0	0	114.7
702	S	27.2	Very low	30.6	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	76%	0.762	S	S	*	*			trans	-144.8	145.1	-175	52.3	0	0	0	0	111.2
703	F	30.8	Very low	30.8	Very low	211 Å²	211	131 Å²	131	93%	0.925	75%	0.754	S	S	*	*			trans	-144.9	149.4	165.4	-103.8	-80.5	0	0	0	112.1
704	S	30.2	Very low	31.1	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	76%	0.755	S	S	*	*			trans	-115.8	171	-168.1	56.5	0	0	0	0	113.4
705	N	31.9	Very low	31.4	Very low	134 Å²	134	128.3 Å²	128.3	72%	0.717	75%	0.749	S	S	*	*			trans	164.2	122.4	136	-79.7	-5.3	0	0	0	108.9
706	T	30.9	Very low	31.7	Very low	108 Å²	108	126.5 Å²	126.5	66%	0.663	75%	0.748	S	S	*	*				55.6	135.7	76.3	61	0	0	0	0	113.8
707	D	29	Very low	31.9	Very low	133 Å²	133	124.9 Å²	124.9	71%	0.711	74%	0.743	S	S	*	*			cis	-160.8	164.3	-4.7	-88.3	-34.4	0	0	0	107.9
708	Y	30.7	Very low	32	Very low	232 Å²	232	124.4 Å²	124.4	91%	0.91	74%	0.742	S	S	*	*				167.8	160.6	124	-108.2	-95.6	0	0	0	114.9
709	S	30.9	Very low	32.3	Very low	100 Å²	100	124 Å²	124	70%	0.699	74%	0.739	S	S	*	*			trans	-121.1	-175.8	-153.4	-43.1	0	0	0	0	115.4
710	S	33.7	Very low	32.3	Very low	115 Å²	115	123.6 Å²	123.6	80%	0.804	74%	0.741	S	S	*	*			trans	95	146.9	155.3	81.2	0	0	0	0	118.6
711	S	32.4	Very low	32.3	Very low	91 Å²	91	122.1 Å²	122.1	64%	0.636	74%	0.742	S	S	*	*			cis	-178.4	161.8	-22	53.9	0	0	0	0	111.9
712	L	33.8	Very low	32.3	Very low	162 Å²	162	119.6 Å²	119.6	85%	0.848	74%	0.736	S	S	*	*			trans	71.5	149.2	157.8	-63.2	153.7	0	0	0	117.9
713	S	34.5	Very low	32.4	Very low	86 Å²	86	122.6 Å²	122.6	60%	0.601	74%	0.743	S	S	*	*			cis	-173.5	154.2	-11	47.2	0	0	0	0	113.4
714	S	33.4	Very low	32.5	Very low	108 Å²	108	117.5 Å²	117.5	76%	0.755	73%	0.734	S	S	*	*			trans	61.7	146.9	148.1	51.8	0	0	0	0	120.8
715	S	35.2	Very low	32.6	Very low	100 Å²	100	118.5 Å²	118.5	70%	0.699	74%	0.741	S	S	*	*			cis	-174.1	158.2	-2.4	41.9	0	0	0	0	112.8
716	S	33.8	Very low	32.5	Very low	109 Å²	109	117.1 Å²	117.1	76%	0.762	74%	0.742	S	S	*	*			trans	63.1	144.4	151.8	45.3	0	0	0	0	119.8
717	S	36	Very low	32.7	Very low	101 Å²	101	118.3 Å²	118.3	71%	0.706	76%	0.755	S	S	*	*			cis	-166.3	148.4	7.1	40	0	0	0	0	113.2
718	S	34.8	Very low	32.6	Very low	106 Å²	106	116.9 Å²	116.9	74%	0.741	76%	0.755	S	S	*	*			trans	49.8	131.5	147.5	61.6	0	0	0	0	120.3
719	S	37.4	Very low	32.6	Very low	106 Å²	106	114.4 Å²	114.4	74%	0.741	76%	0.756	S	S	*	*			cis	-160.4	142.7	46.8	-52.2	0	0	0	0	114.4
720	S	32.6	Very low	32.3	Very low	108 Å²	108	115 Å²	115	76%	0.755	76%	0.76	S	S	*	*			trans	-2.3	147.5	147.3	52.7	0	0	0	0	119.8
721	C	28	Very low	32.2	Very low	109 Å²	109	117.4 Å²	117.4	74%	0.736	76%	0.764	S	S	*	*			cis	-162.4	131.8	31.8	29.5	0	0	0	0	111.1
722	S	30.4	Very low	32.1	Very low	99 Å²	99	117.5 Å²	117.5	69%	0.692	76%	0.764	S	S	*	*				82.6	104.3	96.4	-53.2	0	0	0	0	113.8
723	L	31	Very low	31.8	Very low	165 Å²	165	115.1 Å²	115.1	86%	0.864	76%	0.761	S	S	*	*				73.2	141.3	84.6	-70.4	162	0	0	0	112
724	S	31	Very low	31.5	Very low	103 Å²	103	116.6 Å²	116.6	72%	0.72	77%	0.772	S	S	*	*			cis	-162.9	168.5	13	34.4	0	0	0	0	107.5
725	S	33.3	Very low	31.2	Very low	114 Å²	114	117.6 Å²	117.6	80%	0.797	78%	0.779	S	S	*	*			cis	-160.5	127.6	49.4	-56.2	0	0	0	0	113.8
726	S	30.3	Very low	31	Very low	105 Å²	105	118 Å²	118	73%	0.734	78%	0.781	S	S	*	*			trans	-85.5	160.2	167.7	-33.9	0	0	0	0	111.1
727	S	33.8	Very low	30.6	Very low	133 Å²	133	118.9 Å²	118.9	93%	0.93	79%	0.788	S	S	*	*			trans	-140.8	75.7	155.3	-72.2	0	0	0	0	110.1
728	S	27	Very low	30.3	Very low	103 Å²	103	120.1 Å²	120.1	72%	0.72	79%	0.79	S	S	*	*			trans	-99.6	134.5	163.1	42.3	0	0	0	0	109.1
729	L	30.4	Very low	29.9	Very low	179 Å²	179	120.9 Å²	120.9	94%	0.937	79%	0.791	S	S	*	*			trans	-126.9	105.8	165.2	-77.1	177.4	0	0	0	109
730	S	26.3	Very low	29.3	Very low	112 Å²	112	123.3 Å²	123.3	78%	0.783	79%	0.794	S	S	*	*			trans	-87.9	132	169.7	52	0	0	0	0	110.2
731	L	30.5	Very low	29.2	Very low	167 Å²	167	124.7 Å²	124.7	87%	0.874	80%	0.799	S	S	*	*			trans	-140.2	105.9	161.6	-95.2	167.9	0	0	0	111
732	S	30.1	Very low	29.3	Very low	92 Å²	92	127.9 Å²	127.9	64%	0.643	80%	0.8	S	S	*	*			trans	30.1	107.3	144.2	57.1	0	0	0	0	120.1
733	S	26.9	Very low	29.2	Very low	112 Å²	112	129.9 Å²	129.9	78%	0.783	80%	0.803	S	S	*	*				23	113.4	122.8	58.9	0	0	0	0	118.8
734	S	29.6	Very low	29.3	Very low	118 Å²	118	128.7 Å²	128.7	83%	0.825	80%	0.803	S	S	*	*			trans	-157.2	111.1	146.4	-79.5	0	0	0	0	110.3	S736	S734-S736 PolarHBondContact O-N 3.41Å
735	S	26.9	Very low	29.2	Very low	129 Å²	129	131.9 Å²	131.9	90%	0.902	81%	0.806	S	S	*	*			trans	-70.9	120.6	173.9	-47.3	0	0	0	0	110.2
736	S	31	Very low	29	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	81%	0.805	S	S	*	*			trans	-152	98.5	168.8	-85.5	0	0	0	0	111	S734 V738	S734-S736 PolarHBondContact O-N 3.41Å; S736-V738 PolarHBondContact O-N 3.46Å
737	S	25.4	Very low	28.9	Very low	129 Å²	129	136.7 Å²	136.7	90%	0.902	81%	0.809	S	S	*	*			trans	-70.8	110.9	168.9	-51.7	0	0	0	0	109.7
738	V	29.1	Very low	29	Very low	126 Å²	126	139.4 Å²	139.4	76%	0.764	81%	0.812	S	S	*	*			trans	-133.7	125.7	167.4	-177.2	0	0	0	0	110.9	S736	S736-V738 PolarHBondContact O-N 3.46Å
739	T	27.6	Very low	29.2	Very low	122 Å²	122	141.9 Å²	141.9	75%	0.748	81%	0.813	S	S	*	*			trans	-38.9	150.9	175.8	41.9	0	0	0	0	118
740	L	24.8	Very low	29.2	Very low	157 Å²	157	139.7 Å²	139.7	82%	0.822	80%	0.801	S	S	*	*			trans	-49.8	137.9	163.6	-74	77.8	0	0	0	112.4
741	T	30.3	Very low	29.4	Very low	138 Å²	138	140.9 Å²	140.9	85%	0.847	80%	0.799	S	S	*	*			trans	-126.5	128.9	142.6	46.8	0	0	0	0	109.2
742	K	29.7	Very low	29.5	Very low	176 Å²	176	137.9 Å²	137.9	77%	0.765	79%	0.792	S	S	*	*			trans	-84.2	160.7	163.1	-76.9	-179	171.8	176.5	0	109
743	N	28.7	Very low	29.6	Very low	140 Å²	140	142.2 Å²	142.2	75%	0.749	80%	0.799	S	S	*	*			trans	87.4	88.5	164.9	-51.9	-7.2	0	0	0	117.6
744	T	33.5	Very low	29.8	Very low	141 Å²	141	143.3 Å²	143.3	87%	0.865	80%	0.796	S	S	*	*			trans	-165.6	97.6	132.4	20.9	0	0	0	0	104.5
745	E	27.6	Very low	30	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	80%	0.799	S	S	*	*				47.3	124.4	64.9	-75.3	-172.1	158.4	0	0	114.2
746	D	28.7	Very low	30.2	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	80%	0.795	S	S	*	*			trans	75.7	123.4	164.9	-66.2	-20.3	0	0	0	122.5
747	Q	29.6	Very low	30.2	Very low	175 Å²	175	148.4 Å²	148.4	82%	0.818	80%	0.801	S	S	*	*			trans	66.9	89.1	155.8	-61.4	-177.4	93.1	0	0	118.7
748	L	35.7	Very low	30.6	Very low	190 Å²	190	150.4 Å²	150.4	100%	0.995	80%	0.8	S	S	*	*				-137.1	123	112	-91.8	-179.2	0	0	0	109.6
749	Q	30.5	Very low	30.6	Very low	155 Å²	155	150 Å²	150	72%	0.724	79%	0.794	S	S	*	*			trans	-116.4	156	-165.3	-140.9	-176	56.3	0	0	109.5
750	L	30.2	Very low	30.9	Very low	133 Å²	133	151.3 Å²	151.3	70%	0.696	80%	0.802	S	S	*	*			trans	75.2	138	162.5	-53.8	154.7	0	0	0	115.1
751	N	31.1	Very low	31.5	Very low	137 Å²	137	148.1 Å²	148.1	73%	0.733	79%	0.789	S	S	*	*			cis	-158.1	136.1	14.1	-128.3	-19.6	0	0	0	114.2
752	S	33.1	Very low	31.8	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	78%	0.779	S	S	*	*				55.7	141.9	129.8	-179.6	0	0	0	0	122.1
753	K	32.4	Very low	32.3	Very low	182 Å²	182	147.5 Å²	147.5	79%	0.791	78%	0.783	S	S	*	*			cis	178.8	163.6	-22.8	-141.7	171.9	-174	174.9	0	107.7
754	N	30.5	Very low	33.3	Very low	135 Å²	135	147.7 Å²	147.7	72%	0.722	78%	0.783	S	S	*	*			trans	79.4	102	164.9	-44.3	-18	0	0	0	117.9
755	D	34.2	Very low	34.4	Very low	165 Å²	165	145.6 Å²	145.6	88%	0.882	76%	0.762	S	S	*	*				-162.2	129.4	105.6	-112.2	-18.6	0	0	0	110.3
756	D	29.7	Very low	36.4	Very low	153 Å²	153	142 Å²	142	82%	0.818	75%	0.752	S	S	*	*			trans	-89.8	113.2	-169.5	-69.8	-58.4	0	0	0	112.2
757	T	32.1	Very low	38.9	Very low	143 Å²	143	137.7 Å²	137.7	88%	0.877	73%	0.725	S	S	*	*			trans	173.5	59.1	146.8	27.7	0	0	0	0	112.6
758	L	32.7	Very low	41.6	Very low	171 Å²	171	132 Å²	132	90%	0.895	70%	0.701	S	S	*	*			trans	-78.3	124.4	170.7	-84.8	167.7	0	0	0	111.6	V760	L758-V760 PolarHBondContact O-N 3.28Å
759	N	30.2	Very low	44.1	Very low	117 Å²	117	128 Å²	128	63%	0.626	69%	0.685	S	S	*	*			trans	-67	121.3	179.7	-87.1	-37	0	0	0	111.6	T761	N759-T761 PolarHBondContact O-N 3.03Å
760	V	33.3	Very low	46.8	Very low	151 Å²	151	126.1 Å²	126.1	92%	0.915	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	48.7	170.7	-167	0	0	0	0	110.6	L758	L758-V760 PolarHBondContact O-N 3.28Å
761	T	37.1	Very low	49.7	Very low	89 Å²	89	120 Å²	120	55%	0.546	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.7	-11.4	-179.3	58.3	0	0	0	0	114.7	N759	N759-T761 PolarHBondContact O-N 3.03Å
762	D	38.1	Very low	52.5	Low	121 Å²	121	116.4 Å²	116.4	65%	0.647	63%	0.627	S	S	*	*	S	Bend	trans	-93.2	-13.4	-173.4	-68.1	-34.4	0	0	0	114.5	L764	D762-L764 VanDerWaalsContact C-N 3.33Å; D762-L764 PolarHBondContact O-N 3.08Å
763	E	40.2	Very low	55.3	Low	181 Å²	181	115.7 Å²	115.7	85%	0.846	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-74.7	-14.5	178.9	-69.2	-155.3	144.3	0	0	114.9	F765	E763-F765 VanDerWaalsContact C-N 3.32Å; E763-F765 PolarHBondContact O-N 3.2Å
764	L	50.1	Low	58.2	Low	143 Å²	143	107.8 Å²	107.8	75%	0.749	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-84.5	1.7	178.5	-101.3	91.5	0	0	0	114.6	D762	D762-L764 VanDerWaalsContact C-N 3.33Å; D762-L764 PolarHBondContact O-N 3.08Å
765	F	56.5	Low	61.2	Low	98 Å²	98	101.5 Å²	101.5	43%	0.43	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-132.5	37.8	-176.4	-87.9	-80.8	0	0	0	112.8	E763 W767 R1029 N1032	E763-F765 VanDerWaalsContact C-N 3.32Å; E763-F765 PolarHBondContact O-N 3.2Å; F765-W767 PolarHBondContact O-N 2.82Å; F765-W767 VanDerWaalsContact O-N 3.14Å; F765-R1029 HydrophobicContact CD1-CG 4Å; F765-R1029 HydrophobicContact CE1-CG 4.28Å; F765-N1032 HydrophobicContact CE1-CB 4.29Å; F765-N1032 WeakPolarHBondContact CE1-ND2 3.32Å; F765-N1032 VanDerWaalsContact CZ-ND2 3.34Å; F765-N1032 WeakPolarHBondContact CZ-ND2 3.42Å
766	V	67.8	Low	64	Low	95 Å²	95	97 Å²	97	58%	0.576	52%	0.524	S	S	*	.			trans	-64.6	115.5	172.2	-177.4	0	0	0	0	109.2
767	W	81.4	Confident	67	Low	54 Å²	54	92.5 Å²	92.5	21%	0.205	50%	0.504	C	S	.	.			trans	-77.8	121.9	171.1	176.8	-84.7	0	0	0	109.7	F765 D771 Q772 I775 R1029 Y1030 R1033	F765-W767 PolarHBondContact O-N 2.82Å; F765-W767 VanDerWaalsContact O-N 3.14Å; W767-D771 HydrophobicContact CD2-CB 4.08Å; W767-D771 HydrophobicContact CE3-CB 4.03Å; W767-D771 HydrophobicContact CH2-CB 3.74Å; W767-D771 HydrophobicContact CZ2-CB 3.79Å; W767-D771 HydrophobicContact CZ3-CB 3.84Å; W767-Q772 HydrophobicContact CZ2-CB 3.74Å; W767-Q772 HydrophobicContact CZ2-CG 4.37Å; W767-I775 HydrophobicContact CH2-CD1 4.09Å; W767-R1029 HydrophobicContact CE3-CB 4.11Å; W767-R1029 HydrophobicContact CZ3-CB 4.26Å; W767-Y1030 HydrophobicContact CH2-CD2 4.33Å; W767-R1033 VanDerWaalsContact NE1-NH1 3.16Å
768	T	86.3	Confident	70	Confident	54 Å²	54	85.8 Å²	85.8	33%	0.331	46%	0.463	S	S	.	.			trans	-96.1	167.5	-178.2	66.4	0	0	0	0	112.4	D770 D771	T768-D770 VanDerWaalsContact C-N 3.27Å; T768-D770 PolarHBondContact OG1-N 3.21Å; T768-D771 WeakPolarHBondContact CB-OD2 3.31Å; T768-D771 PolarHBondContact N-OD2 2.81Å; T768-D771 PolarHBondContact OG1-N 3.16Å; T768-D771 PolarHBondContact OG1-OD2 3.1Å
769	V	88	Confident	72.8	Confident	106 Å²	106	78.3 Å²	78.3	64%	0.642	42%	0.424	S	S	*	.	H	α-helix	trans	-68.8	-34.1	169.5	178.2	0	0	0	0	110	Q772 N773	V769-Q772 WeakPolarHBondContact O-CB 3.33Å; V769-Q772 PolarHBondContact O-N 3.5Å; V769-Q772 VanDerWaalsContact O-N 3.13Å; V769-N773 VanDerWaalsContact O-CG 3.31Å; V769-N773 PolarHBondContact O-N 3.33Å; V769-N773 PolarHBondContact O-ND2 2.86Å
770	D	88.2	Confident	75.7	Confident	116 Å²	116	77.5 Å²	77.5	62%	0.62	42%	0.42	S	S	*	.	H	α-helix	trans	-67.2	-38.2	179.9	-54	-47.1	0	0	0	112	T768 Q772 N773 L774	T768-D770 VanDerWaalsContact C-N 3.27Å; T768-D770 PolarHBondContact OG1-N 3.21Å; D770-Q772 VanDerWaalsContact C-N 3.27Å; D770-Q772 PolarHBondContact O-N 2.97Å; D770-N773 PolarHBondContact O-N 3.34Å; D770-L774 WeakPolarHBondContact O-CB 3.39Å; D770-L774 PolarHBondContact O-N 3.3Å
771	D	90.2	Very high	78.5	Confident	4 Å²	4	70.4 Å²	70.4	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-54.4	-43.6	169.3	-70.7	-56.1	0	0	0	112	W767 T768 I775 T1026 R1029	W767-D771 HydrophobicContact CD2-CB 4.08Å; W767-D771 HydrophobicContact CE3-CB 4.03Å; W767-D771 HydrophobicContact CH2-CB 3.74Å; W767-D771 HydrophobicContact CZ2-CB 3.79Å; W767-D771 HydrophobicContact CZ3-CB 3.84Å; T768-D771 WeakPolarHBondContact CB-OD2 3.31Å; T768-D771 PolarHBondContact N-OD2 2.81Å; T768-D771 PolarHBondContact OG1-N 3.16Å; T768-D771 PolarHBondContact OG1-OD2 3.1Å; D771-I775 WeakPolarHBondContact O-CG1 3.49Å; D771-I775 PolarHBondContact O-N 2.89Å; D771-I775 VanDerWaalsContact O-N 3.07Å; D771-T1026 HydrophobicContact CB-CG2 4.18Å; D771-T1026 PolarHBondContact OD1-OG1 3.4Å; D771-R1029 VanDerWaalsContact CG-NE 3.27Å; D771-R1029 IonicContact OD1-CZ 3.29Å; D771-R1029 IonicContact OD1-NE 3.23Å; D771-R1029 PolarHBondContact OD1-NE 2.97Å; D771-R1029 IonicContact OD1-NH2 3.24Å; D771-R1029 PolarHBondContact OD1-NH2 2.79Å; D771-R1029 IonicContact OD2-CZ 2.92Å; D771-R1029 IonicContact OD2-NE 2.99Å; D771-R1029 PolarHBondContact OD2-NE 3.43Å; D771-R1029 VanDerWaalsContact OD2-NE 3.1Å
772	Q	90.5	Very high	81	Confident	63 Å²	63	66.2 Å²	66.2	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-70.1	-40.8	-180	-169.3	66.5	71.9	0	0	111.3	W767 V769 D770 N776 R1033	W767-Q772 HydrophobicContact CZ2-CB 3.74Å; W767-Q772 HydrophobicContact CZ2-CG 4.37Å; V769-Q772 WeakPolarHBondContact O-CB 3.33Å; V769-Q772 PolarHBondContact O-N 3.5Å; V769-Q772 VanDerWaalsContact O-N 3.13Å; D770-Q772 VanDerWaalsContact C-N 3.27Å; D770-Q772 PolarHBondContact O-N 2.97Å; Q772-N776 PolarHBondContact NE2-OD1 2.89Å; Q772-N776 VanDerWaalsContact O-CB 3.25Å; Q772-N776 WeakPolarHBondContact O-CB 3.5Å; Q772-N776 PolarHBondContact O-N 3.37Å; Q772-N776 PolarHBondContact O-ND2 3.45Å; Q772-N776 PolarHBondContact O-OD1 2.95Å; Q772-R1033 VanDerWaalsContact OE1-NH1 3.12Å
773	N	92.4	Very high	83.3	Confident	88 Å²	88	63.8 Å²	63.8	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-44.3	177.1	-68.3	-22.6	0	0	0	111.3	V769 D770 N776 S777	V769-N773 VanDerWaalsContact O-CG 3.31Å; V769-N773 PolarHBondContact O-N 3.33Å; V769-N773 PolarHBondContact O-ND2 2.86Å; D770-N773 PolarHBondContact O-N 3.34Å; N773-N776 PolarHBondContact O-N 2.94Å; N773-S777 VanDerWaalsContact O-CB 3.27Å; N773-S777 WeakPolarHBondContact O-CB 3.44Å; N773-S777 PolarHBondContact O-N 3.4Å
774	L	92.9	Very high	85.4	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.089	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-48.4	178.6	-178.9	55.2	0	0	0	111.5	D770 N776 S777 I778 L1023 T1026	D770-L774 WeakPolarHBondContact O-CB 3.39Å; D770-L774 PolarHBondContact O-N 3.3Å; L774-N776 PolarHBondContact O-N 2.9Å; L774-S777 PolarHBondContact O-N 3.5Å; L774-I778 HydrophobicContact CD1-CD1 3.71Å; L774-I778 HydrophobicContact CD1-CG1 4.21Å; L774-I778 HydrophobicContact CG-CD1 3.87Å; L774-I778 VanDerWaalsContact O-CG1 3.3Å; L774-I778 WeakPolarHBondContact O-CG1 3.26Å; L774-I778 PolarHBondContact O-N 2.91Å; L774-L1023 HydrophobicContact CD2-CD2 4.5Å; L774-T1026 HydrophobicContact CD2-CG2 4.16Å
775	I	93.2	Very high	86.9	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-43	176.2	-68.6	-163.9	0	0	0	111.7	W767 D771 S777 I778 C779 T992 M996 T1026 Y1030	W767-I775 HydrophobicContact CH2-CD1 4.09Å; D771-I775 WeakPolarHBondContact O-CG1 3.49Å; D771-I775 PolarHBondContact O-N 2.89Å; D771-I775 VanDerWaalsContact O-N 3.07Å; I775-S777 VanDerWaalsContact C-N 3.3Å; I775-S777 PolarHBondContact O-N 2.95Å; I775-I778 PolarHBondContact O-N 2.97Å; I775-C779 WeakPolarHBondContact O-CB 3.48Å; I775-C779 PolarHBondContact O-N 3.21Å; I775-C779 PolarHBondContact O-SG 3.29Å; I775-T992 HydrophobicContact CG2-CG2 3.76Å; I775-M996 HydrophobicContact CD1-SD 4.35Å; I775-M996 HydrophobicContact CG1-CE 4.21Å; I775-M996 HydrophobicContact CG1-SD 3.87Å; I775-T1026 HydrophobicContact CD1-CG2 4.02Å; I775-T1026 HydrophobicContact CG1-CG2 3.74Å; I775-Y1030 HydrophobicContact CD1-CD1 4.28Å; I775-Y1030 HydrophobicContact CD1-CD2 3.54Å; I775-Y1030 HydrophobicContact CD1-CE2 4.42Å; I775-Y1030 HydrophobicContact CD1-CG 3.45Å; I775-Y1030 VanDerWaalsContact CD1-CG 3.45Å; I775-Y1030 HydrophobicContact CG2-CD2 4.5Å
776	N	92.9	Very high	87.5	Confident	71 Å²	71	48 Å²	48	38%	0.38	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-41	176.8	-69.4	-4.6	0	0	0	111.2	Q772 N773 L774 N780	Q772-N776 PolarHBondContact NE2-OD1 2.89Å; Q772-N776 VanDerWaalsContact O-CB 3.25Å; Q772-N776 WeakPolarHBondContact O-CB 3.5Å; Q772-N776 PolarHBondContact O-N 3.37Å; Q772-N776 PolarHBondContact O-ND2 3.45Å; Q772-N776 PolarHBondContact O-OD1 2.95Å; N773-N776 PolarHBondContact O-N 2.94Å; L774-N776 PolarHBondContact O-N 2.9Å; N776-N780 VanDerWaalsContact O-CB 3.28Å; N776-N780 WeakPolarHBondContact O-CB 3.49Å; N776-N780 PolarHBondContact O-N 3.4Å; N776-N780 PolarHBondContact O-ND2 3.14Å; N776-N780 PolarHBondContact O-OD1 2.99Å
777	S	93.3	Very high	87.3	Confident	58 Å²	58	45.3 Å²	45.3	41%	0.406	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-48.5	176.9	-178.4	0	0	0	0	111.6	N773 L774 I775 N780 A781	N773-S777 VanDerWaalsContact O-CB 3.27Å; N773-S777 WeakPolarHBondContact O-CB 3.44Å; N773-S777 PolarHBondContact O-N 3.4Å; L774-S777 PolarHBondContact O-N 3.5Å; I775-S777 VanDerWaalsContact C-N 3.3Å; I775-S777 PolarHBondContact O-N 2.95Å; S777-N780 PolarHBondContact O-N 3.14Å; S777-A781 VanDerWaalsContact O-CB 3.31Å; S777-A781 WeakPolarHBondContact O-CB 3.28Å; S777-A781 PolarHBondContact O-N 3.27Å
778	I	94	Very high	85.7	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-41.7	178.6	-64.9	162.5	0	0	0	111.5	L774 I775 A781 Y782 I873 A995 M996 A999 L1023	L774-I778 HydrophobicContact CD1-CD1 3.71Å; L774-I778 HydrophobicContact CD1-CG1 4.21Å; L774-I778 HydrophobicContact CG-CD1 3.87Å; L774-I778 VanDerWaalsContact O-CG1 3.3Å; L774-I778 WeakPolarHBondContact O-CG1 3.26Å; L774-I778 PolarHBondContact O-N 2.91Å; I775-I778 PolarHBondContact O-N 2.97Å; I778-A781 PolarHBondContact O-N 2.98Å; I778-Y782 WeakPolarHBondContact O-CB 3.36Å; I778-Y782 PolarHBondContact O-N 3.41Å; I778-I873 HydrophobicContact CG1-CD1 4.08Å; I778-I873 HydrophobicContact CG2-CD1 4.37Å; I778-A995 HydrophobicContact CG2-CB 4.09Å; I778-A995 WeakPolarHBondContact CG2-O 3.38Å; I778-M996 HydrophobicContact CB-SD 4.2Å; I778-M996 HydrophobicContact CD1-CE 3.98Å; I778-M996 HydrophobicContact CD1-SD 3.6Å; I778-M996 VanDerWaalsContact CD1-SD 3.6Å; I778-M996 HydrophobicContact CG2-SD 4.01Å; I778-A999 HydrophobicContact CD1-CB 4.48Å; I778-A999 HydrophobicContact CG2-CB 4.07Å; I778-L1023 HydrophobicContact CD1-CD2 3.38Å
779	C	92.7	Very high	83.4	Confident	14 Å²	14	52.5 Å²	52.5	10%	0.095	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-47.2	173.6	-73	0	0	0	0	111.7	I775 Y782 E783 T992	I775-C779 WeakPolarHBondContact O-CB 3.48Å; I775-C779 PolarHBondContact O-N 3.21Å; I775-C779 PolarHBondContact O-SG 3.29Å; C779-Y782 PolarHBondContact O-N 2.78Å; C779-E783 WeakPolarHBondContact O-CB 3.15Å; C779-E783 WeakPolarHBondContact O-CG 3.37Å; C779-E783 PolarHBondContact O-N 3.05Å; C779-T992 VanDerWaalsContact SG-CG2 3.58Å; C779-T992 PolarHBondContact SG-OG1 2.87Å
780	N	91.5	Very high	80.8	Confident	100 Å²	100	53.3 Å²	53.3	54%	0.535	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-38.7	179.3	-69.2	-18.1	0	0	0	112.2	N776 S777 Y782 S784	N776-N780 VanDerWaalsContact O-CB 3.28Å; N776-N780 WeakPolarHBondContact O-CB 3.49Å; N776-N780 PolarHBondContact O-N 3.4Å; N776-N780 PolarHBondContact O-ND2 3.14Å; N776-N780 PolarHBondContact O-OD1 2.99Å; S777-N780 PolarHBondContact O-N 3.14Å; N780-Y782 VanDerWaalsContact C-N 3.34Å; N780-S784 VanDerWaalsContact O-CB 3.28Å; N780-S784 WeakPolarHBondContact O-CB 3.14Å; N780-S784 PolarHBondContact O-N 2.96Å; N780-S784 PolarHBondContact O-OG 3Å
781	A	91.3	Very high	78.3	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-42.5	174	0	0	0	0	0	111.7	S777 I778 S784 T785 F869 Q872	S777-A781 VanDerWaalsContact O-CB 3.31Å; S777-A781 WeakPolarHBondContact O-CB 3.28Å; S777-A781 PolarHBondContact O-N 3.27Å; I778-A781 PolarHBondContact O-N 2.98Å; A781-S784 PolarHBondContact O-OG 3.08Å; A781-S784 VanDerWaalsContact O-OG 3.1Å; A781-T785 VanDerWaalsContact O-CB 3.3Å; A781-T785 WeakPolarHBondContact O-CB 3.35Å; A781-T785 PolarHBondContact O-N 2.85Å; A781-T785 PolarHBondContact O-OG1 2.95Å; A781-F869 HydrophobicContact CB-CD2 4.13Å; A781-F869 HydrophobicContact CB-CE2 4.3Å; A781-Q872 HydrophobicContact CB-CB 3.51Å; A781-Q872 HydrophobicContact CB-CG 4.32Å
782	Y	90.4	Very high	75.5	Confident	1 Å²	1	54.8 Å²	54.8	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-68.6	-48.4	176.1	-166.4	-76.8	0	0	0	111.5	I778 C779 N780 T785 Y786 F787 F869 R899 V994 A995 A998	I778-Y782 WeakPolarHBondContact O-CB 3.36Å; I778-Y782 PolarHBondContact O-N 3.41Å; C779-Y782 PolarHBondContact O-N 2.78Å; N780-Y782 VanDerWaalsContact C-N 3.34Å; Y782-T785 PolarHBondContact O-N 3.05Å; Y782-Y786 AromaticContact CD1-CD2 3.89Å; Y782-Y786 HydrophobicContact CD1-CD2 3.89Å; Y782-Y786 HydrophobicContact CD1-CG 4.44Å; Y782-Y786 HydrophobicContact CD2-CD2 4.12Å; Y782-Y786 HydrophobicContact CD2-CE2 4.23Å; Y782-Y786 AromaticContact CE1-CD2 3.73Å; Y782-Y786 HydrophobicContact CE1-CD2 3.73Å; Y782-Y786 HydrophobicContact CE1-CG 4.01Å; Y782-Y786 HydrophobicContact CE2-CD2 4.01Å; Y782-Y786 HydrophobicContact CE2-CE2 4.01Å; Y782-Y786 HydrophobicContact CG-CD2 4.08Å; Y782-Y786 AromaticContact CZ-CD2 3.83Å; Y782-Y786 WeakPolarHBondContact O-CD2 3.25Å; Y782-Y786 PolarHBondContact O-N 3.37Å; Y782-F787 HydrophobicContact CE1-CE2 4.4Å; Y782-F869 HydrophobicContact CD2-CD2 4.34Å; Y782-F869 AromaticContact CD2-CE2 3.89Å; Y782-F869 HydrophobicContact CD2-CE2 3.89Å; Y782-F869 HydrophobicContact CD2-CZ 4.17Å; Y782-F869 HydrophobicContact CG-CE2 4.36Å; Y782-R899 WeakPolarHBondContact OH-CD 3.39Å; Y782-R899 PolarHBondContact OH-NH1 3.3Å; Y782-V994 HydrophobicContact CE2-CG1 4.13Å; Y782-V994 VanDerWaalsContact OH-CG1 3.28Å; Y782-V994 WeakPolarHBondContact OH-CG1 3.4Å; Y782-A995 HydrophobicContact CD2-CB 3.96Å; Y782-A995 HydrophobicContact CG-CB 3.82Å; Y782-A998 HydrophobicContact CD2-CB 4.2Å; Y782-A998 HydrophobicContact CE2-CB 3.95Å
783	E	85.2	Confident	72.6	Confident	71 Å²	71	56.1 Å²	56.1	33%	0.332	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-47.5	179	-79	-173.4	-153.6	0	0	111.9	C779 T785 Y786 F787 K789	C779-E783 WeakPolarHBondContact O-CB 3.15Å; C779-E783 WeakPolarHBondContact O-CG 3.37Å; C779-E783 PolarHBondContact O-N 3.05Å; E783-T785 PolarHBondContact O-N 2.74Å; E783-Y786 PolarHBondContact O-N 2.97Å; E783-F787 CarbonylContact O-C 3.32Å; E783-F787 VanDerWaalsContact O-CA 3.31Å; E783-F787 WeakPolarHBondContact O-CA 3.47Å; E783-F787 WeakPolarHBondContact O-CB 3.2Å; E783-F787 PolarHBondContact O-N 3.37Å; E783-K789 IonicContact OE2-NZ 3.62Å
784	S	83.8	Confident	69.7	Low	66 Å²	66	55.8 Å²	55.8	46%	0.462	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-27.2	177.2	58.1	0	0	0	0	113.6	N780 A781	N780-S784 VanDerWaalsContact O-CB 3.28Å; N780-S784 WeakPolarHBondContact O-CB 3.14Å; N780-S784 PolarHBondContact O-N 2.96Å; N780-S784 PolarHBondContact O-OG 3Å; A781-S784 PolarHBondContact O-OG 3.08Å; A781-S784 VanDerWaalsContact O-OG 3.1Å
785	T	81.8	Confident	66.7	Low	15 Å²	15	61.3 Å²	61.3	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-82.7	-36.9	179.1	-61.9	0	0	0	0	113	A781 Y782 E783 R865 K868 F869	A781-T785 VanDerWaalsContact O-CB 3.3Å; A781-T785 WeakPolarHBondContact O-CB 3.35Å; A781-T785 PolarHBondContact O-N 2.85Å; A781-T785 PolarHBondContact O-OG1 2.95Å; Y782-T785 PolarHBondContact O-N 3.05Å; E783-T785 PolarHBondContact O-N 2.74Å; T785-R865 HydrophobicContact CG2-CB 3.66Å; T785-R865 HydrophobicContact CG2-CG 4.08Å; T785-R865 WeakPolarHBondContact CG2-O 3.37Å; T785-K868 HydrophobicContact CG2-CB 4.29Å; T785-F869 HydrophobicContact CG2-CB 4.09Å
786	Y	69.9	Low	63.8	Low	8 Å²	8	64.9 Å²	64.9	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-111.3	-5.7	-171.3	-71.1	-82.2	0	0	0	114.5	Y782 E783 V836 D840 R865 L895 R899	Y782-Y786 AromaticContact CD1-CD2 3.89Å; Y782-Y786 HydrophobicContact CD1-CD2 3.89Å; Y782-Y786 HydrophobicContact CD1-CG 4.44Å; Y782-Y786 HydrophobicContact CD2-CD2 4.12Å; Y782-Y786 HydrophobicContact CD2-CE2 4.23Å; Y782-Y786 AromaticContact CE1-CD2 3.73Å; Y782-Y786 HydrophobicContact CE1-CD2 3.73Å; Y782-Y786 HydrophobicContact CE1-CG 4.01Å; Y782-Y786 HydrophobicContact CE2-CD2 4.01Å; Y782-Y786 HydrophobicContact CE2-CE2 4.01Å; Y782-Y786 HydrophobicContact CG-CD2 4.08Å; Y782-Y786 AromaticContact CZ-CD2 3.83Å; Y782-Y786 WeakPolarHBondContact O-CD2 3.25Å; Y782-Y786 PolarHBondContact O-N 3.37Å; E783-Y786 PolarHBondContact O-N 2.97Å; Y786-V836 WeakPolarHBondContact O-CB 2.95Å; Y786-V836 WeakPolarHBondContact O-CG1 3.45Å; Y786-D840 WeakPolarHBondContact CD1-OD2 3.33Å; Y786-R865 HydrophobicContact CE1-CB 4.06Å; Y786-R865 HydrophobicContact CE1-CG 4.46Å; Y786-L895 WeakPolarHBondContact OH-CD2 3.19Å; Y786-R899 HydrophobicContact CE1-CG 4.48Å
787	F	62.5	Low	60.8	Low	39 Å²	39	64.9 Å²	64.9	17%	0.171	35%	0.352	C	S	.	.			trans	-145.3	70.5	-177.2	-61.3	-86.3	0	0	0	110.5	Y782 E783 K789 D834 E837	Y782-F787 HydrophobicContact CE1-CE2 4.4Å; E783-F787 CarbonylContact O-C 3.32Å; E783-F787 VanDerWaalsContact O-CA 3.31Å; E783-F787 WeakPolarHBondContact O-CA 3.47Å; E783-F787 WeakPolarHBondContact O-CB 3.2Å; E783-F787 PolarHBondContact O-N 3.37Å; F787-K789 PolarHBondContact O-N 3.27Å; F787-D834 HydrophobicContact CE1-CB 4.4Å; F787-E837 HydrophobicContact CE1-CG 4.11Å; F787-E837 HydrophobicContact CZ-CG 4.19Å
788	D	47.8	Very low	57.9	Low	108 Å²	108	68.8 Å²	68.8	58%	0.578	36%	0.363	S	S	*	.			trans	-67.3	105	174.5	-163.9	-21.5	0	0	0	110.3	D790 S791	D788-D790 PolarHBondContact O-N 3.46Å; D788-D790 PolarHBondContact OD1-N 2.96Å; D788-S791 PolarHBondContact O-N 2.94Å
789	K	38.4	Very low	54.9	Low	152 Å²	152	75.1 Å²	75.1	66%	0.661	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.2	-175	-71.1	173.3	-176.7	160.7	0	112.8	E783 F787	E783-K789 IonicContact OE2-NZ 3.62Å; F787-K789 PolarHBondContact O-N 3.27Å
790	D	35	Very low	52	Low	122 Å²	122	81.1 Å²	81.1	65%	0.652	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	7.4	-177.1	-76	-54.5	0	0	0	114.6	D788 K795	D788-D790 PolarHBondContact O-N 3.46Å; D788-D790 PolarHBondContact OD1-N 2.96Å; D790-K795 IonicContact OD1-NZ 3.76Å
791	S	34.9	Very low	49.1	Very low	49 Å²	49	83.1 Å²	83.1	34%	0.343	43%	0.434	S	S	.	.			trans	-56.6	124.5	169.6	-178.5	0	0	0	0	111.3	D788 N793 N794	D788-S791 PolarHBondContact O-N 2.94Å; S791-N793 PolarHBondContact O-N 3.49Å; S791-N794 PolarHBondContact O-N 3.43Å
792	P	30.9	Very low	46.1	Very low	103 Å²	103	88.1 Å²	88.1	67%	0.669	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-12.9	-168.6	23.4	-33.5	0	0	0	115.2
793	N	30.6	Very low	43.1	Very low	91 Å²	91	90.8 Å²	90.8	49%	0.487	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-33	178.6	-69.2	-11.5	0	0	0	113.1	S791 K795 T796	S791-N793 PolarHBondContact O-N 3.49Å; N793-K795 VanDerWaalsContact C-N 3.32Å; N793-K795 PolarHBondContact O-N 3.43Å; N793-T796 WeakPolarHBondContact O-CB 3.44Å; N793-T796 PolarHBondContact O-N 3.24Å; N793-T796 VanDerWaalsContact O-N 3.11Å
794	N	31.2	Very low	40.4	Very low	81 Å²	81	94 Å²	94	43%	0.433	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-27.8	-168	-148.2	-16.7	0	0	0	113.2	S791 T796	S791-N794 PolarHBondContact O-N 3.43Å; N794-T796 VanDerWaalsContact C-N 3.27Å; N794-T796 PolarHBondContact O-N 3.15Å
795	K	30.2	Very low	37.7	Very low	132 Å²	132	98.6 Å²	98.6	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-72.3	-15.9	176.4	-73	167.8	-177.8	152.8	0	113.7	D790 N793 N799	D790-K795 IonicContact OD1-NZ 3.76Å; N793-K795 VanDerWaalsContact C-N 3.32Å; N793-K795 PolarHBondContact O-N 3.43Å; K795-N799 PolarHBondContact O-ND2 3.05Å
796	T	31.7	Very low	35.1	Very low	79 Å²	79	104.9 Å²	104.9	49%	0.485	57%	0.574	S	S	.	*	H	α-helix	trans	-86.6	-25.2	-179.5	-57.1	0	0	0	0	112.3	N793 N794 Q800	N793-T796 WeakPolarHBondContact O-CB 3.44Å; N793-T796 PolarHBondContact O-N 3.24Å; N793-T796 VanDerWaalsContact O-N 3.11Å; N794-T796 VanDerWaalsContact C-N 3.27Å; N794-T796 PolarHBondContact O-N 3.15Å; T796-Q800 PolarHBondContact O-NE2 3.28Å
797	I	30.1	Very low	33.1	Very low	70 Å²	70	113.2 Å²	113.2	36%	0.359	61%	0.61	S	S	.	*	H	α-helix	trans	-88.6	-39.4	-171.7	-64.8	173.6	0	0	0	111.9	N799 Q800 L801	I797-N799 PolarHBondContact O-N 3.37Å; I797-Q800 PolarHBondContact O-N 3.34Å; I797-L801 HydrophobicContact CG2-CD1 3.67Å; I797-L801 HydrophobicContact CG2-CG 4.4Å; I797-L801 PolarHBondContact O-N 3.14Å; I797-L801 VanDerWaalsContact O-N 3.1Å
798	Q	31.3	Very low	31.5	Very low	140 Å²	140	118.5 Å²	118.5	65%	0.654	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-31.3	174.8	-74	-169	-20.2	0	0	113.5	S802	Q798-S802 PolarHBondContact O-OG 3.27Å
799	N	31.7	Very low	30.7	Very low	135 Å²	135	120 Å²	120	72%	0.722	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-17.5	177.1	-75.3	-48.3	0	0	0	113.9	K795 I797	K795-N799 PolarHBondContact O-ND2 3.05Å; I797-N799 PolarHBondContact O-N 3.37Å
800	Q	31.5	Very low	30.1	Very low	141 Å²	141	118.2 Å²	118.2	66%	0.659	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-30.3	178	-69.3	-174	60.2	0	0	113	T796 I797 S802	T796-Q800 PolarHBondContact O-NE2 3.28Å; I797-Q800 PolarHBondContact O-N 3.34Å; Q800-S802 PolarHBondContact O-N 3.49Å
801	L	31.5	Very low	29.9	Very low	141 Å²	141	121.1 Å²	121.1	74%	0.738	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-12.9	174.4	-74.5	161.6	0	0	0	113.9	I797 G803	I797-L801 HydrophobicContact CG2-CD1 3.67Å; I797-L801 HydrophobicContact CG2-CG 4.4Å; I797-L801 PolarHBondContact O-N 3.14Å; I797-L801 VanDerWaalsContact O-N 3.1Å; L801-G803 VanDerWaalsContact C-N 3.32Å; L801-G803 PolarHBondContact O-N 2.68Å
802	S	27.9	Very low	29.6	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	9.5	-177.8	-60.9	0	0	0	0	114.3	Q798 Q800	Q798-S802 PolarHBondContact O-OG 3.27Å; Q800-S802 PolarHBondContact O-N 3.49Å
803	G	26.5	Very low	29.4	Very low	57 Å²	57	123.5 Å²	123.5	59%	0.588	70%	0.695	S	S	*	*			trans	-145.9	26.5	-155.3	0	0	0	0	0	120.2	L801	L801-G803 VanDerWaalsContact C-N 3.32Å; L801-G803 PolarHBondContact O-N 2.68Å
804	T	28.3	Very low	29.4	Very low	138 Å²	138	126.5 Å²	126.5	85%	0.847	71%	0.711	S	S	*	*			trans	-137.8	101.6	168.4	44.7	0	0	0	0	113.6
805	N	27.2	Very low	29.3	Very low	163 Å²	163	129.8 Å²	129.8	87%	0.872	73%	0.729	S	S	*	*			trans	-88.3	148.4	166.1	-87.4	-59.5	0	0	0	111
806	N	28.7	Very low	29.3	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	74%	0.744	S	S	*	*			trans	-43.9	134.6	179.9	-59	-82.9	0	0	0	115.5
807	K	28.1	Very low	29.1	Very low	183 Å²	183	134.4 Å²	134.4	80%	0.796	76%	0.761	S	S	*	*				163.1	148	116.7	-88.3	163.3	-174.9	177.2	0	112.8
808	D	27.3	Very low	29	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	78%	0.783	S	S	*	*			trans	63.7	148.8	168.4	-46.4	-40.7	0	0	0	114.3
809	V	31.2	Very low	28.8	Very low	139 Å²	139	137.8 Å²	137.8	84%	0.842	78%	0.779	S	S	*	*			cis	-148.8	157.7	39.4	165.7	0	0	0	0	111.9
810	T	27.2	Very low	28.8	Very low	115 Å²	115	136.7 Å²	136.7	71%	0.706	78%	0.781	S	S	*	*			trans	-82.1	148.7	-179.7	41.9	0	0	0	0	117.1
811	Q	29.2	Very low	28.5	Very low	184 Å²	184	132 Å²	132	86%	0.86	77%	0.771	S	S	*	*			trans	55.4	106.5	141.8	-66.6	-177.7	0.2	0	0	121.4
812	S	28.6	Very low	28.5	Very low	128 Å²	128	129.1 Å²	129.1	90%	0.895	75%	0.754	S	S	*	*				162.6	140.2	125.5	48.3	0	0	0	0	109
813	G	27.2	Very low	28.6	Very low	73 Å²	73	132 Å²	132	75%	0.753	75%	0.753	S	S	*	*			cis	154.1	87.3	-8.6	0	0	0	0	0	111.2
814	D	31.1	Very low	28.6	Very low	155 Å²	155	133.3 Å²	133.3	83%	0.829	75%	0.749	S	S	*	*			trans	-162.4	167.6	152.5	-127.7	-32	0	0	0	114.4
815	N	28.1	Very low	28.8	Very low	150 Å²	150	130.3 Å²	130.3	80%	0.802	73%	0.728	S	S	*	*			trans	-102.5	123.2	-155	-63	-92.6	0	0	0	115.6
816	S	31.2	Very low	29.3	Very low	127 Å²	127	128.4 Å²	128.4	89%	0.888	71%	0.712	S	S	*	*			trans	-156.4	160.3	143.3	55.6	0	0	0	0	111
817	Q	27.5	Very low	29.5	Very low	181 Å²	181	124.9 Å²	124.9	85%	0.846	70%	0.698	S	S	*	*			trans	-97.2	153.6	-157.3	-62.4	167.8	-47.3	0	0	114.3
818	Q	26.8	Very low	29.5	Very low	177 Å²	177	120.3 Å²	120.3	83%	0.827	68%	0.682	S	S	*	*	S	Bend	trans	110.8	126.1	156.2	-58.8	179	-7.8	0	0	118.1
819	N	28.6	Very low	30.1	Very low	104 Å²	104	113.8 Å²	113.8	56%	0.556	65%	0.647	S	S	*	*			trans	60.1	56.7	156.9	-62.8	4.2	0	0	0	121.1	G821 E822	N819-G821 PolarHBondContact O-N 3.48Å; N819-E822 HydrophobicContact CB-CB 3.93Å; N819-E822 WeakPolarHBondContact CB-OE2 3.41Å; N819-E822 PolarHBondContact ND2-OE2 3.4Å; N819-E822 PolarHBondContact O-N 3.26Å
820	S	30.6	Very low	30.7	Very low	111 Å²	111	109.6 Å²	109.6	78%	0.776	62%	0.62	S	S	*	*	H	α-helix	trans	-59.8	-20.8	168	54.2	0	0	0	0	115.8	V824	S820-V824 WeakPolarHBondContact O-CG2 3.43Å
821	G	26.3	Very low	31.4	Very low	42 Å²	42	107.8 Å²	107.8	43%	0.433	61%	0.612	S	S	.	*	H	α-helix	trans	-81.9	-27.2	176.1	0	0	0	0	0	114.5	N819 I825	N819-G821 PolarHBondContact O-N 3.48Å; G821-I825 WeakPolarHBondContact O-CD1 3.48Å; G821-I825 VanDerWaalsContact O-CG1 3.31Å; G821-I825 WeakPolarHBondContact O-CG1 3.32Å; G821-I825 PolarHBondContact O-N 2.9Å; G821-I825 VanDerWaalsContact O-N 3.15Å
822	E	31.3	Very low	32.3	Very low	82 Å²	82	104.5 Å²	104.5	38%	0.383	60%	0.597	S	S	.	*	H	α-helix	trans	-74.3	-35.9	-174.8	-167.7	166.1	-164	0	0	111.2	N819 K826	N819-E822 HydrophobicContact CB-CB 3.93Å; N819-E822 WeakPolarHBondContact CB-OE2 3.41Å; N819-E822 PolarHBondContact ND2-OE2 3.4Å; N819-E822 PolarHBondContact O-N 3.26Å; E822-K826 VanDerWaalsContact O-CB 3.31Å; E822-K826 WeakPolarHBondContact O-CB 3.43Å; E822-K826 PolarHBondContact O-N 3.05Å
823	F	28.7	Very low	33.6	Very low	165 Å²	165	99 Å²	99	72%	0.724	56%	0.557	S	S	*	*	H	α-helix	trans	-68.3	-39.4	175.9	-137.5	-89.8	0	0	0	112.8	S827	F823-S827 WeakPolarHBondContact O-CB 3.48Å; F823-S827 PolarHBondContact O-N 3.12Å
824	V	28.2	Very low	35	Very low	85 Å²	85	99.8 Å²	99.8	52%	0.515	54%	0.544	S	S	.	.	H	α-helix	trans	-68.6	-42.1	177.2	177.9	0	0	0	0	110.9	S820 S827 I828	S820-V824 WeakPolarHBondContact O-CG2 3.43Å; V824-S827 PolarHBondContact O-N 3.23Å; V824-I828 HydrophobicContact CG1-CD1 3.9Å; V824-I828 WeakPolarHBondContact O-CD1 3.41Å; V824-I828 VanDerWaalsContact O-CG1 3.28Å; V824-I828 WeakPolarHBondContact O-CG1 3.35Å; V824-I828 PolarHBondContact O-N 2.83Å
825	I	30.8	Very low	36.1	Very low	76 Å²	76	96.5 Å²	96.5	39%	0.39	52%	0.524	S	S	.	.	H	α-helix	trans	-67	-41.7	177	-67.9	167.3	0	0	0	111.1	G821 I828 V829	G821-I825 WeakPolarHBondContact O-CD1 3.48Å; G821-I825 VanDerWaalsContact O-CG1 3.31Å; G821-I825 WeakPolarHBondContact O-CG1 3.32Å; G821-I825 PolarHBondContact O-N 2.9Å; G821-I825 VanDerWaalsContact O-N 3.15Å; I825-I828 PolarHBondContact O-N 3.19Å; I825-V829 WeakPolarHBondContact O-CG2 3.27Å; I825-V829 PolarHBondContact O-N 3.29Å; I825-V829 VanDerWaalsContact O-N 3.08Å
826	K	38.8	Very low	37.6	Very low	123 Å²	123	91 Å²	91	54%	0.535	50%	0.496	S	S	.	.	H	α-helix	trans	-58.9	-47.6	173.4	-177.5	175.5	179.1	-171.4	0	111.1	E822 I828 V829 D830	E822-K826 VanDerWaalsContact O-CB 3.31Å; E822-K826 WeakPolarHBondContact O-CB 3.43Å; E822-K826 PolarHBondContact O-N 3.05Å; K826-I828 VanDerWaalsContact C-N 3.33Å; K826-I828 PolarHBondContact O-N 3.32Å; K826-V829 PolarHBondContact O-N 3.09Å; K826-D830 WeakPolarHBondContact CE-OD2 3.41Å; K826-D830 WeakPolarHBondContact CG-OD2 3.44Å; K826-D830 VanDerWaalsContact O-CB 3.28Å; K826-D830 WeakPolarHBondContact O-CB 3.34Å; K826-D830 PolarHBondContact O-N 3.48Å
827	S	31.8	Very low	38.9	Very low	73 Å²	73	85.2 Å²	85.2	51%	0.51	46%	0.455	S	S	.	.	H	α-helix	trans	-61.1	-35.6	176.8	178	0	0	0	0	113.6	F823 V824 S831	F823-S827 WeakPolarHBondContact O-CB 3.48Å; F823-S827 PolarHBondContact O-N 3.12Å; V824-S827 PolarHBondContact O-N 3.23Å; S827-S831 WeakPolarHBondContact O-CB 3.25Å; S827-S831 PolarHBondContact O-N 3.35Å; S827-S831 VanDerWaalsContact O-N 3.13Å; S827-S831 PolarHBondContact O-OG 2.9Å
828	I	30	Very low	40.3	Very low	86 Å²	86	78.7 Å²	78.7	44%	0.441	42%	0.424	S	S	.	.	H	α-helix	trans	-71.5	-38.1	177.1	-69	162.9	0	0	0	112	V824 I825 K826 S831 H832	V824-I828 HydrophobicContact CG1-CD1 3.9Å; V824-I828 WeakPolarHBondContact O-CD1 3.41Å; V824-I828 VanDerWaalsContact O-CG1 3.28Å; V824-I828 WeakPolarHBondContact O-CG1 3.35Å; V824-I828 PolarHBondContact O-N 2.83Å; I825-I828 PolarHBondContact O-N 3.19Å; K826-I828 VanDerWaalsContact C-N 3.33Å; K826-I828 PolarHBondContact O-N 3.32Å; I828-S831 WeakPolarHBondContact CA-OG 3.19Å; I828-S831 PolarHBondContact O-OG 3.1Å; I828-S831 VanDerWaalsContact O-OG 3.14Å; I828-H832 PolarHBondContact O-ND1 2.97Å
829	V	39.2	Very low	41.8	Very low	14 Å²	14	75.1 Å²	75.1	9%	0.085	41%	0.407	C	S	.	.	H	α-helix	trans	-71.2	-49.1	176.2	174.1	0	0	0	0	110.7	I825 K826 S831 H832 L833 Q911	I825-V829 WeakPolarHBondContact O-CG2 3.27Å; I825-V829 PolarHBondContact O-N 3.29Å; I825-V829 VanDerWaalsContact O-N 3.08Å; K826-V829 PolarHBondContact O-N 3.09Å; V829-S831 PolarHBondContact O-N 2.86Å; V829-H832 PolarHBondContact O-N 3.04Å; V829-L833 HydrophobicContact CG1-CD1 3.84Å; V829-L833 WeakPolarHBondContact O-CD1 3.27Å; V829-L833 WeakPolarHBondContact O-CG 3.39Å; V829-Q911 HydrophobicContact CG2-CG 4.47Å
830	D	44.5	Very low	43.1	Very low	50 Å²	50	70.6 Å²	70.6	27%	0.267	38%	0.383	S	S	.	.	H	α-helix	trans	-70	-13.8	-177	-64.2	-11.8	0	0	0	112.9	K826 Q838	K826-D830 WeakPolarHBondContact CE-OD2 3.41Å; K826-D830 WeakPolarHBondContact CG-OD2 3.44Å; K826-D830 VanDerWaalsContact O-CB 3.28Å; K826-D830 WeakPolarHBondContact O-CB 3.34Å; K826-D830 PolarHBondContact O-N 3.48Å; D830-Q838 PolarHBondContact OD1-NE2 3.23Å
831	S	39.9	Very low	44.3	Very low	78 Å²	78	66 Å²	66	55%	0.545	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-7	177.5	53.7	0	0	0	0	115.4	S827 I828 V829	S827-S831 WeakPolarHBondContact O-CB 3.25Å; S827-S831 PolarHBondContact O-N 3.35Å; S827-S831 VanDerWaalsContact O-N 3.13Å; S827-S831 PolarHBondContact O-OG 2.9Å; I828-S831 WeakPolarHBondContact CA-OG 3.19Å; I828-S831 PolarHBondContact O-OG 3.1Å; I828-S831 VanDerWaalsContact O-OG 3.14Å; V829-S831 PolarHBondContact O-N 2.86Å
832	H	49.4	Very low	45.7	Very low	114 Å²	114	68.4 Å²	68.4	53%	0.528	35%	0.35	S	S	.	.	S	Bend	trans	-115.4	12.8	179.5	-71.6	79	0	0	0	112.8	I828 V829 K906 I910	I828-H832 PolarHBondContact O-ND1 2.97Å; V829-H832 PolarHBondContact O-N 3.04Å; H832-K906 WeakPolarHBondContact O-CE 3.34Å; H832-K906 PolarHBondContact O-NZ 3.5Å; H832-I910 HydrophobicContact CB-CD1 3.92Å
833	L	55.3	Low	47.1	Very low	14 Å²	14	66 Å²	66	7%	0.073	34%	0.339	C	S	.	.	S	Bend	trans	-120.2	131.8	178.4	-63.6	169.2	0	0	0	107.9	V829 E837 I841 K906	V829-L833 HydrophobicContact CG1-CD1 3.84Å; V829-L833 WeakPolarHBondContact O-CD1 3.27Å; V829-L833 WeakPolarHBondContact O-CG 3.39Å; L833-E837 VanDerWaalsContact CA-OE2 3.26Å; L833-E837 WeakPolarHBondContact CA-OE2 3.41Å; L833-E837 HydrophobicContact CB-CB 4.28Å; L833-E837 HydrophobicContact CD2-CB 4.46Å; L833-E837 WeakPolarHBondContact CD2-OE2 3.47Å; L833-I841 HydrophobicContact CD1-CD1 3.54Å; L833-I841 HydrophobicContact CD2-CD1 4.46Å; L833-K906 HydrophobicContact CD2-CD 3.72Å; L833-K906 HydrophobicContact CD2-CG 4.23Å
834	D	56.2	Low	48.3	Very low	89 Å²	89	58.5 Å²	58.5	48%	0.476	31%	0.307	S	S	.	.			trans	-69.2	155.8	177.8	-63.5	-51.8	0	0	0	110	F787 V836 E837 Q838	F787-D834 HydrophobicContact CE1-CB 4.4Å; D834-V836 PolarHBondContact O-N 2.87Å; D834-E837 HydrophobicContact CB-CG 4.49Å; D834-E837 PolarHBondContact N-OE2 2.72Å; D834-E837 VanDerWaalsContact N-OE2 3.09Å; D834-E837 WeakPolarHBondContact O-CA 3.34Å; D834-E837 WeakPolarHBondContact O-CB 3.46Å; D834-E837 PolarHBondContact O-N 3.46Å; D834-Q838 PolarHBondContact O-N 3.24Å
835	E	55.4	Low	49.5	Very low	85 Å²	85	57.5 Å²	57.5	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-50.5	-39.3	-176.1	-68.1	-174.5	159.5	0	0	112.3	Q838 E839	E835-Q838 PolarHBondContact O-N 3.43Å; E835-E839 WeakPolarHBondContact O-CB 3.36Å; E835-E839 WeakPolarHBondContact O-CG 3.35Å; E835-E839 PolarHBondContact O-N 3.02Å
836	V	58.1	Low	50.5	Low	36 Å²	36	54.9 Å²	54.9	22%	0.218	28%	0.282	C	S	.	.	H	α-helix	trans	-74.9	-29.1	178.5	-164.2	0	0	0	0	113.5	Y786 D834 D840	Y786-V836 WeakPolarHBondContact O-CB 2.95Å; Y786-V836 WeakPolarHBondContact O-CG1 3.45Å; D834-V836 PolarHBondContact O-N 2.87Å; V836-D840 WeakPolarHBondContact O-CB 3.28Å; V836-D840 PolarHBondContact O-N 2.73Å
837	E	60.1	Low	51.1	Low	4 Å²	4	49.2 Å²	49.2	2%	0.019	26%	0.257	C	S	.	.	H	α-helix	trans	-69.1	-39	170.1	-67.2	-178.8	141.1	0	0	110.5	F787 L833 D834 D840 I841 K906	F787-E837 HydrophobicContact CE1-CG 4.11Å; F787-E837 HydrophobicContact CZ-CG 4.19Å; L833-E837 VanDerWaalsContact CA-OE2 3.26Å; L833-E837 WeakPolarHBondContact CA-OE2 3.41Å; L833-E837 HydrophobicContact CB-CB 4.28Å; L833-E837 HydrophobicContact CD2-CB 4.46Å; L833-E837 WeakPolarHBondContact CD2-OE2 3.47Å; D834-E837 HydrophobicContact CB-CG 4.49Å; D834-E837 PolarHBondContact N-OE2 2.72Å; D834-E837 VanDerWaalsContact N-OE2 3.09Å; D834-E837 WeakPolarHBondContact O-CA 3.34Å; D834-E837 WeakPolarHBondContact O-CB 3.46Å; D834-E837 PolarHBondContact O-N 3.46Å; E837-D840 PolarHBondContact O-N 2.84Å; E837-I841 VanDerWaalsContact O-CB 3.3Å; E837-I841 WeakPolarHBondContact O-CB 3.3Å; E837-I841 WeakPolarHBondContact O-CD1 3.39Å; E837-I841 WeakPolarHBondContact O-CG1 3.46Å; E837-I841 PolarHBondContact O-N 3.19Å; E837-K906 WeakPolarHBondContact OE1-CD 3.44Å; E837-K906 IonicContact OE1-NZ 2.7Å; E837-K906 PolarHBondContact OE1-NZ 3.27Å; E837-K906 IonicContact OE2-NZ 2.56Å; E837-K906 PolarHBondContact OE2-NZ 3.44Å
838	Q	56.4	Low	52.2	Low	45 Å²	45	46 Å²	46	21%	0.21	23%	0.234	C	C	.	.	H	α-helix	trans	-69.9	-38.2	176.7	-171.2	69.2	-19.6	0	0	111.6	D830 D834 E835 Q842	D830-Q838 PolarHBondContact OD1-NE2 3.23Å; D834-Q838 PolarHBondContact O-N 3.24Å; E835-Q838 PolarHBondContact O-N 3.43Å; Q838-Q842 VanDerWaalsContact O-CB 3.28Å; Q838-Q842 WeakPolarHBondContact O-CB 3.28Å; Q838-Q842 PolarHBondContact O-N 3.44Å
839	E	59	Low	53.2	Low	101 Å²	101	46.2 Å²	46.2	47%	0.472	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-51	168.9	-81	-173.1	-173	0	0	111.4	E835 I841 Q842 H843	E835-E839 WeakPolarHBondContact O-CB 3.36Å; E835-E839 WeakPolarHBondContact O-CG 3.35Å; E835-E839 PolarHBondContact O-N 3.02Å; E839-I841 VanDerWaalsContact C-N 3.34Å; E839-I841 PolarHBondContact O-N 3.46Å; E839-Q842 CarbonylContact O-C 3.43Å; E839-Q842 WeakPolarHBondContact O-CA 3.44Å; E839-Q842 WeakPolarHBondContact O-CB 3.28Å; E839-Q842 PolarHBondContact O-N 3.32Å; E839-H843 VanDerWaalsContact C-ND1 3.34Å; E839-H843 VanDerWaalsContact O-CG 3.3Å; E839-H843 PolarHBondContact O-N 2.89Å; E839-H843 PolarHBondContact O-ND1 3.04Å
840	D	54.6	Low	53.7	Low	10 Å²	10	46.4 Å²	46.4	5%	0.053	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-31.7	-179.5	-81	-25.1	0	0	0	113.2	Y786 V836 E837 Q842 H843 A844 R865 R899	Y786-D840 WeakPolarHBondContact CD1-OD2 3.33Å; V836-D840 WeakPolarHBondContact O-CB 3.28Å; V836-D840 PolarHBondContact O-N 2.73Å; E837-D840 PolarHBondContact O-N 2.84Å; D840-Q842 VanDerWaalsContact C-N 3.35Å; D840-H843 IonicContact OD1-ND1 3.94Å; D840-H843 PolarHBondContact OD1-ND1 2.75Å; D840-A844 WeakPolarHBondContact O-CB 3.42Å; D840-A844 PolarHBondContact O-N 2.96Å; D840-R865 IonicContact OD1-CZ 3.47Å; D840-R865 IonicContact OD1-NE 3.6Å; D840-R865 IonicContact OD1-NH2 3.39Å; D840-R865 PolarHBondContact OD1-NH2 3.09Å; D840-R899 IonicContact OD2-CZ 2.75Å; D840-R899 IonicContact OD2-NE 3.6Å; D840-R899 PolarHBondContact OD2-NE 3.48Å; D840-R899 IonicContact OD2-NH2 3.19Å; D840-R899 PolarHBondContact OD2-NH2 2.99Å
841	I	55.7	Low	54	Low	13 Å²	13	48.3 Å²	48.3	7%	0.067	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-49.7	164.1	-72.2	163.2	0	0	0	108.8	L833 E837 E839 H843 A844 R845 C903	L833-I841 HydrophobicContact CD1-CD1 3.54Å; L833-I841 HydrophobicContact CD2-CD1 4.46Å; E837-I841 VanDerWaalsContact O-CB 3.3Å; E837-I841 WeakPolarHBondContact O-CB 3.3Å; E837-I841 WeakPolarHBondContact O-CD1 3.39Å; E837-I841 WeakPolarHBondContact O-CG1 3.46Å; E837-I841 PolarHBondContact O-N 3.19Å; E839-I841 VanDerWaalsContact C-N 3.34Å; E839-I841 PolarHBondContact O-N 3.46Å; I841-H843 VanDerWaalsContact C-N 3.35Å; I841-H843 PolarHBondContact O-N 3.01Å; I841-A844 PolarHBondContact O-N 3.23Å; I841-R845 HydrophobicContact CG2-CG 3.92Å; I841-R845 VanDerWaalsContact CG2-NE 3.27Å; I841-R845 VanDerWaalsContact O-CB 3.26Å; I841-R845 WeakPolarHBondContact O-CB 3.16Å; I841-R845 WeakPolarHBondContact O-CG 3.31Å; I841-R845 PolarHBondContact O-N 3.37Å; I841-C903 HydrophobicContact CD1-CB 3.69Å; I841-C903 HydrophobicContact CG1-CB 3.34Å
842	Q	56.2	Low	54.5	Low	94 Å²	94	46.8 Å²	46.8	44%	0.439	23%	0.232	S	C	.	.	H	α-helix	trans	-64.5	-37.1	-179.4	-168.1	57.6	36.5	0	0	112.1	Q838 E839 D840 R845 T846	Q838-Q842 VanDerWaalsContact O-CB 3.28Å; Q838-Q842 WeakPolarHBondContact O-CB 3.28Å; Q838-Q842 PolarHBondContact O-N 3.44Å; E839-Q842 CarbonylContact O-C 3.43Å; E839-Q842 WeakPolarHBondContact O-CA 3.44Å; E839-Q842 WeakPolarHBondContact O-CB 3.28Å; E839-Q842 PolarHBondContact O-N 3.32Å; D840-Q842 VanDerWaalsContact C-N 3.35Å; Q842-R845 PolarHBondContact O-N 2.99Å; Q842-T846 PolarHBondContact NE2-OG1 3.31Å; Q842-T846 WeakPolarHBondContact O-CB 3.5Å; Q842-T846 PolarHBondContact O-N 3.31Å; Q842-T846 PolarHBondContact O-OG1 3.08Å
843	H	59.9	Low	54.5	Low	32 Å²	32	46.3 Å²	46.3	15%	0.148	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-50.6	172.2	-67.1	120.3	0	0	0	110.1	E839 D840 I841 T846 F847 R865	E839-H843 VanDerWaalsContact C-ND1 3.34Å; E839-H843 VanDerWaalsContact O-CG 3.3Å; E839-H843 PolarHBondContact O-N 2.89Å; E839-H843 PolarHBondContact O-ND1 3.04Å; D840-H843 IonicContact OD1-ND1 3.94Å; D840-H843 PolarHBondContact OD1-ND1 2.75Å; I841-H843 VanDerWaalsContact C-N 3.35Å; I841-H843 PolarHBondContact O-N 3.01Å; H843-T846 PolarHBondContact O-N 2.93Å; H843-F847 WeakPolarHBondContact O-CB 3.32Å; H843-F847 PolarHBondContact O-N 3.31Å; H843-R865 PolarHBondContact ND1-NH2 2.79Å
844	A	54.5	Low	54.4	Low	7 Å²	7	49.3 Å²	49.3	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-42.6	176.7	0	0	0	0	0	113	D840 I841 T846 Y848 A900	D840-A844 WeakPolarHBondContact O-CB 3.42Å; D840-A844 PolarHBondContact O-N 2.96Å; I841-A844 PolarHBondContact O-N 3.23Å; A844-T846 VanDerWaalsContact C-N 3.3Å; A844-T846 PolarHBondContact O-N 3.08Å; A844-Y848 WeakPolarHBondContact O-CD2 3.38Å; A844-Y848 PolarHBondContact O-N 3.44Å; A844-Y848 VanDerWaalsContact O-N 3.14Å; A844-A900 HydrophobicContact CB-CB 3.53Å
845	R	52.9	Low	54.5	Low	63 Å²	63	45 Å²	45	24%	0.238	22%	0.223	C	C	.	.	H	α-helix	trans	-55.2	-49	174	-75.9	-177.3	171.3	151.8	4.4	110.3	I841 Q842 M849 P964	I841-R845 HydrophobicContact CG2-CG 3.92Å; I841-R845 VanDerWaalsContact CG2-NE 3.27Å; I841-R845 VanDerWaalsContact O-CB 3.26Å; I841-R845 WeakPolarHBondContact O-CB 3.16Å; I841-R845 WeakPolarHBondContact O-CG 3.31Å; I841-R845 PolarHBondContact O-N 3.37Å; Q842-R845 PolarHBondContact O-N 2.99Å; R845-M849 WeakPolarHBondContact O-CB 3.31Å; R845-M849 PolarHBondContact O-N 3.19Å; R845-M849 VanDerWaalsContact O-N 3.08Å; R845-P964 HydrophobicContact CB-CB 3.97Å; R845-P964 HydrophobicContact CB-CG 4.48Å; R845-P964 HydrophobicContact CG-CB 3.47Å; R845-P964 VanDerWaalsContact CG-CB 3.47Å; R845-P964 HydrophobicContact CG-CG 3.69Å
846	T	53.5	Low	54.5	Low	22 Å²	22	41.7 Å²	41.7	14%	0.135	21%	0.21	C	C	.	.	H	α-helix	trans	-75.9	-46.4	-172.9	-47.7	0	0	0	0	109.8	Q842 H843 A844 Y848 M849 T850 L858	Q842-T846 PolarHBondContact NE2-OG1 3.31Å; Q842-T846 WeakPolarHBondContact O-CB 3.5Å; Q842-T846 PolarHBondContact O-N 3.31Å; Q842-T846 PolarHBondContact O-OG1 3.08Å; H843-T846 PolarHBondContact O-N 2.93Å; A844-T846 VanDerWaalsContact C-N 3.3Å; A844-T846 PolarHBondContact O-N 3.08Å; T846-Y848 VanDerWaalsContact C-N 3.26Å; T846-Y848 PolarHBondContact O-N 3.02Å; T846-Y848 VanDerWaalsContact O-N 3.17Å; T846-M849 WeakPolarHBondContact O-CA 3.47Å; T846-M849 PolarHBondContact O-N 3.04Å; T846-T850 HydrophobicContact CG2-CG2 3.31Å; T846-T850 PolarHBondContact O-N 2.67Å; T846-T850 PolarHBondContact O-OG1 3.09Å; T846-L858 HydrophobicContact CG2-CD1 3.37Å; T846-L858 HydrophobicContact CG2-CD2 3.9Å; T846-L858 HydrophobicContact CG2-CG 4.24Å
847	F	51.5	Low	54.6	Low	3 Å²	3	48.1 Å²	48.1	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-49.9	-41.1	173.5	178.3	-80.9	0	0	0	113.1	H843 L855 I859 I896 F1073 F1097	H843-F847 WeakPolarHBondContact O-CB 3.32Å; H843-F847 PolarHBondContact O-N 3.31Å; F847-L855 HydrophobicContact CB-CD1 4.19Å; F847-L855 HydrophobicContact CD2-CD1 3.39Å; F847-L855 HydrophobicContact CD2-CG 4.48Å; F847-L855 HydrophobicContact CE2-CD1 3.83Å; F847-L855 HydrophobicContact CG-CD1 3.76Å; F847-I859 HydrophobicContact CD2-CD1 4.13Å; F847-I859 HydrophobicContact CD2-CG1 3.85Å; F847-I859 HydrophobicContact CE2-CD1 3.7Å; F847-I859 HydrophobicContact CE2-CG1 3.79Å; F847-I896 HydrophobicContact CD1-CG2 4.49Å; F847-I896 HydrophobicContact CD2-CD1 4.21Å; F847-I896 HydrophobicContact CE2-CD1 3.95Å; F847-I896 HydrophobicContact CG-CG2 4.43Å; F847-F1073 HydrophobicContact CD1-CZ 4.34Å; F847-F1073 AromaticContact CE1-CE2 3.82Å; F847-F1073 HydrophobicContact CE1-CE2 3.82Å; F847-F1073 AromaticContact CE1-CZ 3.55Å; F847-F1073 HydrophobicContact CE1-CZ 3.55Å; F847-F1073 HydrophobicContact CE2-CZ 4.49Å; F847-F1073 AromaticContact CZ-CE2 3.84Å; F847-F1073 HydrophobicContact CZ-CE2 3.84Å; F847-F1073 AromaticContact CZ-CZ 3.64Å; F847-F1073 HydrophobicContact CZ-CZ 3.64Å; F847-F1097 HydrophobicContact CE2-CZ 4.04Å; F847-F1097 HydrophobicContact CZ-CE1 4.18Å; F847-F1097 HydrophobicContact CZ-CZ 4.07Å
848	Y	52.8	Low	54.6	Low	7 Å²	7	48.9 Å²	48.9	3%	0.027	24%	0.236	C	C	.	.	H	α-helix	trans	-90	-8.8	176.9	-68.2	-56.7	0	0	0	114.4	A844 T846 T897 L966 G967 I968 I977	A844-Y848 WeakPolarHBondContact O-CD2 3.38Å; A844-Y848 PolarHBondContact O-N 3.44Å; A844-Y848 VanDerWaalsContact O-N 3.14Å; T846-Y848 VanDerWaalsContact C-N 3.26Å; T846-Y848 PolarHBondContact O-N 3.02Å; T846-Y848 VanDerWaalsContact O-N 3.17Å; Y848-T897 PolarHBondContact OH-OG1 3Å; Y848-L966 HydrophobicContact CG-CD1 4.41Å; Y848-L966 CarbonylContact O-C 3.38Å; Y848-L966 WeakPolarHBondContact O-CA 3.24Å; Y848-G967 PolarHBondContact O-N 3.45Å; Y848-I968 PolarHBondContact O-N 2.79Å; Y848-I977 HydrophobicContact CD2-CD1 4.24Å; Y848-I977 HydrophobicContact CE1-CD1 4.45Å; Y848-I977 HydrophobicContact CE2-CD1 3.62Å
849	M	51.4	Low	55.1	Low	90 Å²	90	46.7 Å²	46.7	44%	0.443	23%	0.226	S	C	.	.	H	α-helix	trans	-94.9	-42.1	179.7	175	168.8	158.6	0	0	113.4	R845 T846 K965	R845-M849 WeakPolarHBondContact O-CB 3.31Å; R845-M849 PolarHBondContact O-N 3.19Å; R845-M849 VanDerWaalsContact O-N 3.08Å; T846-M849 WeakPolarHBondContact O-CA 3.47Å; T846-M849 PolarHBondContact O-N 3.04Å; M849-K965 WeakPolarHBondContact CB-O 3.44Å; M849-K965 WeakPolarHBondContact CG-O 3.39Å; M849-K965 HydrophobicContact SD-CB 4.24Å
850	T	50.1	Low	55.6	Low	17 Å²	17	43.6 Å²	43.6	10%	0.104	21%	0.211	C	C	.	.	S	Bend	trans	-82.9	165.8	-156.7	47.1	0	0	0	0	115.5	T846 D854 I968	T846-T850 HydrophobicContact CG2-CG2 3.31Å; T846-T850 PolarHBondContact O-N 2.67Å; T846-T850 PolarHBondContact O-OG1 3.09Å; T850-D854 WeakPolarHBondContact CB-OD2 3.26Å; T850-D854 HydrophobicContact CG2-CB 3.7Å; T850-I968 WeakPolarHBondContact O-CD1 3.41Å; T850-I968 VanDerWaalsContact O-CG2 3.32Å; T850-I968 WeakPolarHBondContact O-CG2 3.28Å
851	T	51.6	Low	56.4	Low	90 Å²	90	45.1 Å²	45.1	55%	0.552	22%	0.221	S	C	*	.			trans	-65.8	159.9	160.6	64.1	0	0	0	0	110.9	H853 D854	T851-H853 PolarHBondContact O-N 3.23Å; T851-H853 VanDerWaalsContact O-N 3.08Å; T851-D854 PolarHBondContact O-N 3.25Å; T851-D854 PolarHBondContact OG1-OD2 2.98Å
852	F	50.1	Low	57.2	Low	46 Å²	46	45 Å²	45	20%	0.202	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24	-172	-76	-90.3	0	0	0	115.2	L855 I968 F1073 T1076 L1089	F852-L855 VanDerWaalsContact O-CB 3.29Å; F852-L855 WeakPolarHBondContact O-CB 3.19Å; F852-I968 HydrophobicContact CE2-CG2 4.16Å; F852-F1073 AromaticContact CE1-CD1 3.98Å; F852-F1073 HydrophobicContact CE1-CD1 3.98Å; F852-T1076 HydrophobicContact CE2-CG2 3.42Å; F852-T1076 VanDerWaalsContact CE2-CG2 3.42Å; F852-T1076 HydrophobicContact CZ-CG2 3.46Å; F852-T1076 VanDerWaalsContact CZ-CG2 3.46Å; F852-L1089 HydrophobicContact CB-CD1 4.09Å; F852-L1089 HydrophobicContact CD1-CD1 3.72Å; F852-L1089 HydrophobicContact CG-CD1 4.36Å
853	H	48.9	Very low	58.2	Low	104 Å²	104	41 Å²	41	48%	0.481	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-39.5	-179.6	-76.4	-66.5	0	0	0	113.7	T851 L855 N1086 N1087	T851-H853 PolarHBondContact O-N 3.23Å; T851-H853 VanDerWaalsContact O-N 3.08Å; H853-L855 PolarHBondContact O-N 2.88Å; H853-N1086 PolarHBondContact CE1-O 3.28Å; H853-N1086 VanDerWaalsContact NE2-C 3.26Å; H853-N1086 PolarHBondContact NE2-O 3.45Å; H853-N1087 WeakPolarHBondContact NE2-CA 3.46Å; H853-N1087 VanDerWaalsContact NE2-CB 3.27Å; H853-N1087 WeakPolarHBondContact NE2-CB 3.22Å; H853-N1087 PolarHBondContact NE2-N 3.47Å; H853-N1087 PolarHBondContact NE2-OD1 3.07Å
854	D	54.3	Low	59.3	Low	77 Å²	77	41.6 Å²	41.6	41%	0.412	21%	0.21	S	C	.	.	H	α-helix	trans	-70.6	-18.9	-179.7	-42.3	-61.1	0	0	0	111.6	T850 T851 A856 Y857 L858	T850-D854 WeakPolarHBondContact CB-OD2 3.26Å; T850-D854 HydrophobicContact CG2-CB 3.7Å; T851-D854 PolarHBondContact O-N 3.25Å; T851-D854 PolarHBondContact OG1-OD2 2.98Å; D854-A856 VanDerWaalsContact C-N 3.32Å; D854-A856 PolarHBondContact O-N 3.43Å; D854-Y857 PolarHBondContact O-N 2.96Å; D854-L858 VanDerWaalsContact O-CD1 3.23Å; D854-L858 WeakPolarHBondContact O-CD1 3.48Å; D854-L858 WeakPolarHBondContact O-CG 3.41Å
855	L	57.2	Low	60.8	Low	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-39	-177.7	-167.9	66.9	0	0	0	112.5	F847 F852 H853 L858 I859 F1073 L1093 F1097	F847-L855 HydrophobicContact CB-CD1 4.19Å; F847-L855 HydrophobicContact CD2-CD1 3.39Å; F847-L855 HydrophobicContact CD2-CG 4.48Å; F847-L855 HydrophobicContact CE2-CD1 3.83Å; F847-L855 HydrophobicContact CG-CD1 3.76Å; F852-L855 VanDerWaalsContact O-CB 3.29Å; F852-L855 WeakPolarHBondContact O-CB 3.19Å; H853-L855 PolarHBondContact O-N 2.88Å; L855-L858 PolarHBondContact O-N 3.48Å; L855-I859 HydrophobicContact CD1-CD1 4.12Å; L855-I859 HydrophobicContact CD2-CD1 4.12Å; L855-I859 HydrophobicContact CG-CD1 3.64Å; L855-I859 HydrophobicContact CG-CG1 4.36Å; L855-I859 WeakPolarHBondContact O-CG1 3.3Å; L855-I859 PolarHBondContact O-N 3.42Å; L855-I859 VanDerWaalsContact O-N 3.09Å; L855-F1073 HydrophobicContact CD2-CD1 4.37Å; L855-F1073 HydrophobicContact CD2-CE1 3.77Å; L855-L1093 HydrophobicContact CD2-CD1 4.45Å; L855-F1097 HydrophobicContact CD2-CE2 4.1Å; L855-F1097 HydrophobicContact CD2-CZ 4.33Å
856	A	56.1	Low	62.5	Low	15 Å²	15	40 Å²	40	12%	0.124	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-48.8	-178.6	0	0	0	0	0	112.6	D854 L858 I859 E860 P1090 Y1092 L1093	D854-A856 VanDerWaalsContact C-N 3.32Å; D854-A856 PolarHBondContact O-N 3.43Å; A856-L858 PolarHBondContact O-N 2.99Å; A856-L858 VanDerWaalsContact O-N 3.11Å; A856-I859 PolarHBondContact O-N 3.39Å; A856-E860 WeakPolarHBondContact O-CG 3.2Å; A856-E860 PolarHBondContact O-N 3.45Å; A856-P1090 HydrophobicContact CB-CG 4.31Å; A856-Y1092 WeakPolarHBondContact CB-OH 3.34Å; A856-L1093 HydrophobicContact CB-CD1 4.38Å
857	Y	61	Low	64.2	Low	171 Å²	171	39.7 Å²	39.7	67%	0.671	20%	0.201	S	C	*	.	H	α-helix	trans	-61	-23.5	-179.1	-171.8	-97.4	0	0	0	113.3	D854 P861	D854-Y857 PolarHBondContact O-N 2.96Å; Y857-P861 WeakPolarHBondContact O-CD 3.21Å
858	L	59.4	Low	66	Low	19 Å²	19	45.9 Å²	45.9	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-93.6	-32.2	-177.4	-55.2	158.4	0	0	0	112.2	T846 D854 L855 A856	T846-L858 HydrophobicContact CG2-CD1 3.37Å; T846-L858 HydrophobicContact CG2-CD2 3.9Å; T846-L858 HydrophobicContact CG2-CG 4.24Å; D854-L858 VanDerWaalsContact O-CD1 3.23Å; D854-L858 WeakPolarHBondContact O-CD1 3.48Å; D854-L858 WeakPolarHBondContact O-CG 3.41Å; L855-L858 PolarHBondContact O-N 3.48Å; A856-L858 PolarHBondContact O-N 2.99Å; A856-L858 VanDerWaalsContact O-N 3.11Å
859	I	65.9	Low	68	Low	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-76.2	-37	177.8	-70.6	175.7	0	0	0	110.8	F847 L855 A856 A862 I863 L1093 L1096 F1097	F847-I859 HydrophobicContact CD2-CD1 4.13Å; F847-I859 HydrophobicContact CD2-CG1 3.85Å; F847-I859 HydrophobicContact CE2-CD1 3.7Å; F847-I859 HydrophobicContact CE2-CG1 3.79Å; L855-I859 HydrophobicContact CD1-CD1 4.12Å; L855-I859 HydrophobicContact CD2-CD1 4.12Å; L855-I859 HydrophobicContact CG-CD1 3.64Å; L855-I859 HydrophobicContact CG-CG1 4.36Å; L855-I859 WeakPolarHBondContact O-CG1 3.3Å; L855-I859 PolarHBondContact O-N 3.42Å; L855-I859 VanDerWaalsContact O-N 3.09Å; A856-I859 PolarHBondContact O-N 3.39Å; I859-A862 CarbonylContact O-C 3.58Å; I859-A862 WeakPolarHBondContact O-CA 3.37Å; I859-A862 WeakPolarHBondContact O-CB 3.24Å; I859-A862 PolarHBondContact O-N 3.49Å; I859-I863 HydrophobicContact CG2-CD1 3.44Å; I859-I863 VanDerWaalsContact CG2-CD1 3.44Å; I859-I863 HydrophobicContact CG2-CG1 3.7Å; I859-I863 PolarHBondContact O-N 3.06Å; I859-L1093 HydrophobicContact CB-CD2 4.39Å; I859-L1093 HydrophobicContact CD1-CD1 4.34Å; I859-L1093 HydrophobicContact CD1-CD2 3.69Å; I859-L1093 HydrophobicContact CG2-CD2 3.94Å; I859-L1096 HydrophobicContact CG2-CD2 4.15Å; I859-F1097 HydrophobicContact CD1-CE2 3.68Å; I859-F1097 HydrophobicContact CD1-CZ 3.58Å
860	E	70.1	Confident	70	Confident	35 Å²	35	41.2 Å²	41.2	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-52	-50.9	-178.7	-84.4	-176.3	-159.3	0	0	114.2	N8 L9 A856 A862 T864 Y1092	N8-E860 PolarHBondContact ND2-OE2 3.34Å; L9-E860 HydrophobicContact CD1-CG 3.45Å; L9-E860 VanDerWaalsContact CD1-CG 3.45Å; L9-E860 VanDerWaalsContact CD1-OE1 3.3Å; L9-E860 WeakPolarHBondContact CD1-OE1 3.39Å; L9-E860 HydrophobicContact CD2-CG 4.02Å; L9-E860 HydrophobicContact CG-CG 3.67Å; A856-E860 WeakPolarHBondContact O-CG 3.2Å; A856-E860 PolarHBondContact O-N 3.45Å; E860-A862 VanDerWaalsContact C-N 3.31Å; E860-A862 PolarHBondContact O-N 3.09Å; E860-T864 PolarHBondContact O-N 2.94Å; E860-T864 VanDerWaalsContact O-N 3.08Å; E860-T864 PolarHBondContact O-OG1 3.45Å; E860-Y1092 PolarHBondContact OE1-OH 3.31Å
861	P	72.3	Confident	72	Confident	42 Å²	42	44.9 Å²	44.9	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-64.2	-33.9	174.1	-22.3	34.1	0	0	0	113.2	Y857 T864 R865	Y857-P861 WeakPolarHBondContact O-CD 3.21Å; P861-T864 PolarHBondContact O-N 2.91Å; P861-R865 VanDerWaalsContact CB-NH1 3.31Å; P861-R865 WeakPolarHBondContact O-CG 3.24Å; P861-R865 PolarHBondContact O-N 3.23Å; P861-R865 PolarHBondContact O-NH1 2.9Å
862	A	71	Confident	74	Confident	12 Å²	12	44.7 Å²	44.7	10%	0.099	21%	0.213	C	C	.	.	H	α-helix	trans	-70.6	-42	-179.2	0	0	0	0	0	112.4	I859 E860 R865 L866 I896	I859-A862 CarbonylContact O-C 3.58Å; I859-A862 WeakPolarHBondContact O-CA 3.37Å; I859-A862 WeakPolarHBondContact O-CB 3.24Å; I859-A862 PolarHBondContact O-N 3.49Å; E860-A862 VanDerWaalsContact C-N 3.31Å; E860-A862 PolarHBondContact O-N 3.09Å; A862-R865 PolarHBondContact O-N 3.34Å; A862-L866 WeakPolarHBondContact O-CB 3.37Å; A862-L866 PolarHBondContact O-N 2.63Å; A862-I896 HydrophobicContact CB-CD1 4.12Å; A862-I896 HydrophobicContact CB-CG1 4.15Å
863	I	78	Confident	76	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-46.5	170.8	-66.5	176.3	0	0	0	109.7	L9 I12 I859 R865 L866 V867 L1096	L9-I863 HydrophobicContact CD2-CD1 4.45Å; I12-I863 HydrophobicContact CG2-CG2 4.24Å; I859-I863 HydrophobicContact CG2-CD1 3.44Å; I859-I863 VanDerWaalsContact CG2-CD1 3.44Å; I859-I863 HydrophobicContact CG2-CG1 3.7Å; I859-I863 PolarHBondContact O-N 3.06Å; I863-R865 VanDerWaalsContact C-N 3.3Å; I863-R865 PolarHBondContact O-N 2.84Å; I863-L866 PolarHBondContact O-N 3.13Å; I863-L866 VanDerWaalsContact O-N 3.12Å; I863-V867 HydrophobicContact CG2-CG2 4.21Å; I863-V867 WeakPolarHBondContact O-CG2 3.39Å; I863-V867 PolarHBondContact O-N 2.86Å; I863-L1096 HydrophobicContact CD1-CD1 3.92Å; I863-L1096 HydrophobicContact CG1-CD1 4.49Å
864	T	83.1	Confident	77.9	Confident	46 Å²	46	43.5 Å²	43.5	28%	0.282	21%	0.208	S	C	.	.	H	α-helix	trans	-57.8	-42.6	179.2	-53.8	0	0	0	0	111.9	I12 E860 P861 K868	I12-T864 VanDerWaalsContact CD1-OG1 3.25Å; I12-T864 WeakPolarHBondContact CD1-OG1 3.4Å; E860-T864 PolarHBondContact O-N 2.94Å; E860-T864 VanDerWaalsContact O-N 3.08Å; E860-T864 PolarHBondContact O-OG1 3.45Å; P861-T864 PolarHBondContact O-N 2.91Å; T864-K868 WeakPolarHBondContact O-CG 3.5Å; T864-K868 PolarHBondContact O-N 3.41Å
865	R	85.2	Confident	79.6	Confident	32 Å²	32	40.2 Å²	40.2	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-64.5	-49	173.2	-75.3	-168.2	-69	-77.6	7.5	111.3	T785 Y786 D840 H843 P861 A862 I863 V867 K868 F869	T785-R865 HydrophobicContact CG2-CB 3.66Å; T785-R865 HydrophobicContact CG2-CG 4.08Å; T785-R865 WeakPolarHBondContact CG2-O 3.37Å; Y786-R865 HydrophobicContact CE1-CB 4.06Å; Y786-R865 HydrophobicContact CE1-CG 4.46Å; D840-R865 IonicContact OD1-CZ 3.47Å; D840-R865 IonicContact OD1-NE 3.6Å; D840-R865 IonicContact OD1-NH2 3.39Å; D840-R865 PolarHBondContact OD1-NH2 3.09Å; H843-R865 PolarHBondContact ND1-NH2 2.79Å; P861-R865 VanDerWaalsContact CB-NH1 3.31Å; P861-R865 WeakPolarHBondContact O-CG 3.24Å; P861-R865 PolarHBondContact O-N 3.23Å; P861-R865 PolarHBondContact O-NH1 2.9Å; A862-R865 PolarHBondContact O-N 3.34Å; I863-R865 VanDerWaalsContact C-N 3.3Å; I863-R865 PolarHBondContact O-N 2.84Å; R865-V867 PolarHBondContact O-N 3.18Å; R865-K868 WeakPolarHBondContact O-CB 3.32Å; R865-K868 PolarHBondContact O-N 2.71Å; R865-K868 VanDerWaalsContact O-N 3.14Å; R865-F869 PolarHBondContact O-N 3.47Å
866	L	88.3	Confident	81.4	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-56.9	-44.4	178.9	172.5	54.1	0	0	0	112.7	A862 I863 K868 F869 A870 L888 C891 C892 L895 L1002	A862-L866 WeakPolarHBondContact O-CB 3.37Å; A862-L866 PolarHBondContact O-N 2.63Å; I863-L866 PolarHBondContact O-N 3.13Å; I863-L866 VanDerWaalsContact O-N 3.12Å; L866-K868 PolarHBondContact O-N 3.36Å; L866-F869 PolarHBondContact O-N 2.82Å; L866-A870 VanDerWaalsContact O-CB 3.3Å; L866-A870 WeakPolarHBondContact O-CB 3.47Å; L866-A870 PolarHBondContact O-N 3.08Å; L866-L888 HydrophobicContact CD1-CD2 4.19Å; L866-L888 HydrophobicContact CD2-CD2 4.33Å; L866-L888 WeakPolarHBondContact CD2-O 3.35Å; L866-L888 HydrophobicContact CG-CD2 3.73Å; L866-C891 HydrophobicContact CD2-CB 4.34Å; L866-C892 HydrophobicContact CD2-CB 3.99Å; L866-L895 HydrophobicContact CB-CD2 4.2Å; L866-L895 HydrophobicContact CD1-CD2 3.68Å; L866-L895 HydrophobicContact CG-CD2 4.36Å; L866-L1002 HydrophobicContact CD1-CD1 4.25Å
867	V	89.8	Confident	83.1	Confident	16 Å²	16	44.7 Å²	44.7	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-41.9	176.6	175.9	0	0	0	0	111.6	I12 V16 I863 R865 F869 A870 K871 L888	I12-V867 HydrophobicContact CG2-CG2 4.2Å; V16-V867 HydrophobicContact CG2-CG1 4Å; V16-V867 HydrophobicContact CG2-CG2 4.37Å; I863-V867 HydrophobicContact CG2-CG2 4.21Å; I863-V867 WeakPolarHBondContact O-CG2 3.39Å; I863-V867 PolarHBondContact O-N 2.86Å; R865-V867 PolarHBondContact O-N 3.18Å; V867-F869 VanDerWaalsContact C-N 3.33Å; V867-F869 PolarHBondContact O-N 2.85Å; V867-A870 PolarHBondContact O-N 3.14Å; V867-K871 WeakPolarHBondContact O-CG 3.32Å; V867-K871 PolarHBondContact O-N 3.39Å; V867-K871 VanDerWaalsContact O-N 3.16Å; V867-L888 HydrophobicContact CG2-CD1 4.06Å; V867-L888 HydrophobicContact CG2-CD2 4.04Å
868	K	90.4	Very high	84.6	Confident	132 Å²	132	41.6 Å²	41.6	57%	0.574	21%	0.213	S	C	*	.	H	α-helix	trans	-63.5	-35.7	175.3	-76.3	-179.2	176.5	-173.2	0	113.1	T785 T864 R865 L866 Q872	T785-K868 HydrophobicContact CG2-CB 4.29Å; T864-K868 WeakPolarHBondContact O-CG 3.5Å; T864-K868 PolarHBondContact O-N 3.41Å; R865-K868 WeakPolarHBondContact O-CB 3.32Å; R865-K868 PolarHBondContact O-N 2.71Å; R865-K868 VanDerWaalsContact O-N 3.14Å; L866-K868 PolarHBondContact O-N 3.36Å; K868-Q872 PolarHBondContact O-NE2 2.92Å
869	F	93.1	Very high	86.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-71.4	-49.1	174.9	174.3	-113.8	0	0	0	111.2	A781 Y782 T785 R865 L866 V867 K871 Q872 I873 A998 A999	A781-F869 HydrophobicContact CB-CD2 4.13Å; A781-F869 HydrophobicContact CB-CE2 4.3Å; Y782-F869 HydrophobicContact CD2-CD2 4.34Å; Y782-F869 AromaticContact CD2-CE2 3.89Å; Y782-F869 HydrophobicContact CD2-CE2 3.89Å; Y782-F869 HydrophobicContact CD2-CZ 4.17Å; Y782-F869 HydrophobicContact CG-CE2 4.36Å; T785-F869 HydrophobicContact CG2-CB 4.09Å; R865-F869 PolarHBondContact O-N 3.47Å; L866-F869 PolarHBondContact O-N 2.82Å; V867-F869 VanDerWaalsContact C-N 3.33Å; V867-F869 PolarHBondContact O-N 2.85Å; F869-K871 PolarHBondContact O-N 3.24Å; F869-Q872 WeakPolarHBondContact O-CB 3.48Å; F869-Q872 PolarHBondContact O-N 3.45Å; F869-I873 HydrophobicContact CD2-CD1 4.45Å; F869-I873 HydrophobicContact CE1-CD1 4.22Å; F869-I873 HydrophobicContact CE1-CG1 4.27Å; F869-I873 HydrophobicContact CE2-CD1 3.83Å; F869-I873 HydrophobicContact CZ-CD1 3.72Å; F869-I873 HydrophobicContact CZ-CG1 4.26Å; F869-A998 HydrophobicContact CE1-CB 3.82Å; F869-A998 HydrophobicContact CZ-CB 3.91Å; F869-A999 HydrophobicContact CZ-CB 4.27Å
870	A	93.7	Very high	87.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-43.7	-176.4	0	0	0	0	0	112.9	L866 V867 Q872 I873 F876 L888 L1002	L866-A870 VanDerWaalsContact O-CB 3.3Å; L866-A870 WeakPolarHBondContact O-CB 3.47Å; L866-A870 PolarHBondContact O-N 3.08Å; V867-A870 PolarHBondContact O-N 3.14Å; A870-Q872 PolarHBondContact O-N 3.45Å; A870-I873 PolarHBondContact O-N 2.9Å; A870-F876 HydrophobicContact CB-CD1 3.95Å; A870-F876 HydrophobicContact CB-CD2 4.28Å; A870-F876 HydrophobicContact CB-CE1 3.72Å; A870-F876 HydrophobicContact CB-CE2 4.06Å; A870-F876 HydrophobicContact CB-CG 4.24Å; A870-F876 HydrophobicContact CB-CZ 3.77Å; A870-F876 WeakPolarHBondContact O-CB 3.24Å; A870-F876 WeakPolarHBondContact O-CD1 3.49Å; A870-F876 WeakPolarHBondContact O-CG 3.43Å; A870-L888 HydrophobicContact CB-CD2 3.72Å; A870-L1002 HydrophobicContact CB-CD1 4.24Å; A870-L1002 HydrophobicContact CB-CD2 3.54Å
871	K	93	Very high	88.3	Confident	93 Å²	93	47.1 Å²	47.1	40%	0.404	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-6.2	176.3	-70.9	-168.5	176	-161.7	0	115.1	S15 V867 F869	S15-K871 PolarHBondContact O-NZ 2.93Å; V867-K871 WeakPolarHBondContact O-CG 3.32Å; V867-K871 PolarHBondContact O-N 3.39Å; V867-K871 VanDerWaalsContact O-N 3.16Å; F869-K871 PolarHBondContact O-N 3.24Å
872	Q	92.4	Very high	89.1	Confident	86 Å²	86	48.9 Å²	48.9	40%	0.402	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-0.1	175	-63.5	178.6	77.3	0	0	112.8	A781 K868 F869 A870	A781-Q872 HydrophobicContact CB-CB 3.51Å; A781-Q872 HydrophobicContact CB-CG 4.32Å; K868-Q872 PolarHBondContact O-NE2 2.92Å; F869-Q872 WeakPolarHBondContact O-CB 3.48Å; F869-Q872 PolarHBondContact O-N 3.45Å; A870-Q872 PolarHBondContact O-N 3.45Å
873	I	93.2	Very high	90.1	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	25%	0.247	C	C	.	.	S	Bend	trans	-87.7	125.9	175.8	-59.3	-55.9	0	0	0	109.4	I778 F869 A870 G875 F876 A999 L1002 M1003	I778-I873 HydrophobicContact CG1-CD1 4.08Å; I778-I873 HydrophobicContact CG2-CD1 4.37Å; F869-I873 HydrophobicContact CD2-CD1 4.45Å; F869-I873 HydrophobicContact CE1-CD1 4.22Å; F869-I873 HydrophobicContact CE1-CG1 4.27Å; F869-I873 HydrophobicContact CE2-CD1 3.83Å; F869-I873 HydrophobicContact CZ-CD1 3.72Å; F869-I873 HydrophobicContact CZ-CG1 4.26Å; A870-I873 PolarHBondContact O-N 2.9Å; I873-G875 PolarHBondContact O-N 3.48Å; I873-F876 HydrophobicContact CB-CB 4.33Å; I873-F876 WeakPolarHBondContact O-CB 3.35Å; I873-F876 PolarHBondContact O-N 3.32Å; I873-F876 VanDerWaalsContact O-N 3.16Å; I873-A999 HydrophobicContact CD1-CB 4.05Å; I873-L1002 HydrophobicContact CB-CD2 4.45Å; I873-L1002 HydrophobicContact CG1-CD2 4.05Å; I873-M1003 HydrophobicContact CG2-CG 4.22Å
874	Q	89.6	Confident	90.8	Very high	122 Å²	122	48.8 Å²	48.8	57%	0.57	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	126.9	177.3	-178.6	179.6	6.4	0	0	111	F876	Q874-F876 VanDerWaalsContact C-N 3.32Å
875	G	89.9	Confident	91	Very high	8 Å²	8	48 Å²	48	8%	0.082	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	1.7	175.9	0	0	0	0	0	114.8	I873 T878 L879	I873-G875 PolarHBondContact O-N 3.48Å; G875-T878 WeakPolarHBondContact CA-OG1 3.34Å; G875-T878 PolarHBondContact O-OG1 2.9Å; G875-T878 VanDerWaalsContact O-OG1 3.07Å; G875-L879 WeakPolarHBondContact O-CG 3.43Å
876	F	94.1	Very high	91.1	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.009	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-40.3	170.3	-178.9	-90.5	0	0	0	111.5	A870 I873 Q874 T878 L879 Q884 L887 L888 L1002 M1003	A870-F876 HydrophobicContact CB-CD1 3.95Å; A870-F876 HydrophobicContact CB-CD2 4.28Å; A870-F876 HydrophobicContact CB-CE1 3.72Å; A870-F876 HydrophobicContact CB-CE2 4.06Å; A870-F876 HydrophobicContact CB-CG 4.24Å; A870-F876 HydrophobicContact CB-CZ 3.77Å; A870-F876 WeakPolarHBondContact O-CB 3.24Å; A870-F876 WeakPolarHBondContact O-CD1 3.49Å; A870-F876 WeakPolarHBondContact O-CG 3.43Å; I873-F876 HydrophobicContact CB-CB 4.33Å; I873-F876 WeakPolarHBondContact O-CB 3.35Å; I873-F876 PolarHBondContact O-N 3.32Å; I873-F876 VanDerWaalsContact O-N 3.16Å; Q874-F876 VanDerWaalsContact C-N 3.32Å; F876-T878 PolarHBondContact O-N 3.34Å; F876-L879 PolarHBondContact O-N 2.93Å; F876-Q884 HydrophobicContact CD1-CG 4.33Å; F876-Q884 HydrophobicContact CE1-CB 3.96Å; F876-Q884 HydrophobicContact CE1-CG 3.8Å; F876-Q884 HydrophobicContact CE2-CB 4.25Å; F876-Q884 HydrophobicContact CE2-CG 4.33Å; F876-Q884 HydrophobicContact CZ-CB 3.57Å; F876-Q884 HydrophobicContact CZ-CG 3.8Å; F876-Q884 PolarHBondContact O-NE2 3.36Å; F876-L887 HydrophobicContact CD2-CD1 4.36Å; F876-L887 HydrophobicContact CE2-CB 4.22Å; F876-L887 HydrophobicContact CE2-CD1 4.27Å; F876-L888 HydrophobicContact CE2-CG 4.42Å; F876-L888 HydrophobicContact CZ-CD1 3.99Å; F876-L888 HydrophobicContact CZ-CD2 4.19Å; F876-L888 HydrophobicContact CZ-CG 3.85Å; F876-L1002 HydrophobicContact CD2-CD1 4.37Å; F876-L1002 HydrophobicContact CD2-CD2 4.07Å; F876-L1002 HydrophobicContact CD2-CG 4.26Å; F876-L1002 HydrophobicContact CE2-CD1 3.99Å; F876-L1002 HydrophobicContact CE2-CD2 4.4Å; F876-L1002 HydrophobicContact CE2-CG 4.38Å; F876-M1003 HydrophobicContact CB-SD 4.26Å; F876-M1003 HydrophobicContact CD2-SD 4.07Å
877	D	91.9	Very high	91.3	Very high	106 Å²	106	49.3 Å²	49.3	57%	0.567	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.3	179.5	62.9	-35.9	0	0	0	113.9
878	T	91.5	Very high	91.3	Very high	107 Å²	107	48.9 Å²	48.9	66%	0.656	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-12.1	176.1	54.6	0	0	0	0	114.3	G875 F876	G875-T878 WeakPolarHBondContact CA-OG1 3.34Å; G875-T878 PolarHBondContact O-OG1 2.9Å; G875-T878 VanDerWaalsContact O-OG1 3.07Å; F876-T878 PolarHBondContact O-N 3.34Å
879	L	92.7	Very high	91	Very high	9 Å²	9	43.2 Å²	43.2	5%	0.047	22%	0.221	C	C	.	.	S	Bend	trans	-77.8	155.7	179.2	-60.2	173.5	0	0	0	111.4	G875 F876 D883 Q884 L887 M1003 I1016	G875-L879 WeakPolarHBondContact O-CG 3.43Å; F876-L879 PolarHBondContact O-N 2.93Å; L879-D883 HydrophobicContact CB-CB 4.43Å; L879-Q884 HydrophobicContact CB-CG 4.04Å; L879-Q884 PolarHBondContact O-NE2 2.7Å; L879-L887 HydrophobicContact CD1-CD1 3.56Å; L879-M1003 HydrophobicContact CD1-CE 4.22Å; L879-I1016 HydrophobicContact CD1-CD1 4.2Å; L879-I1016 HydrophobicContact CD1-CG1 3.81Å; L879-I1016 HydrophobicContact CD2-CD1 4.4Å; L879-I1016 HydrophobicContact CD2-CG1 3.79Å; L879-I1016 HydrophobicContact CG-CG1 4.48Å
880	E	90.3	Very high	90.4	Very high	126 Å²	126	43.7 Å²	43.7	59%	0.589	23%	0.227	S	C	*	.			trans	-62.2	150.2	170.5	-62.3	-166.8	160.4	0	0	111.4	D882 D883 Q884 L1011	E880-D882 PolarHBondContact O-N 3.36Å; E880-D883 PolarHBondContact O-N 2.96Å; E880-Q884 PolarHBondContact O-N 3.33Å; E880-L1011 WeakPolarHBondContact OE2-CD1 3.38Å
881	A	90.8	Very high	90.2	Very high	34 Å²	34	43.7 Å²	43.7	28%	0.281	23%	0.227	S	C	.	.	H	α-helix	trans	-58.1	-37	-173	0	0	0	0	0	112.6	T17 D883 Q884 I885	T17-A881 HydrophobicContact CG2-CB 4.42Å; A881-D883 PolarHBondContact O-N 2.99Å; A881-Q884 WeakPolarHBondContact O-CB 3.3Å; A881-Q884 PolarHBondContact O-N 3.45Å; A881-I885 WeakPolarHBondContact O-CD1 3.48Å; A881-I885 VanDerWaalsContact O-CG1 3.22Å; A881-I885 WeakPolarHBondContact O-CG1 3.39Å; A881-I885 PolarHBondContact O-N 3.04Å
882	D	88.2	Confident	89.8	Confident	80 Å²	80	39.4 Å²	39.4	43%	0.428	21%	0.208	S	C	.	.	H	α-helix	trans	-65	-38.3	178.7	-61.4	-9.3	0	0	0	112	E880 I885 R886 L1011	E880-D882 PolarHBondContact O-N 3.36Å; D882-I885 WeakPolarHBondContact O-CB 3.32Å; D882-I885 PolarHBondContact O-N 2.9Å; D882-R886 VanDerWaalsContact O-CG 3.3Å; D882-R886 WeakPolarHBondContact O-CG 3.5Å; D882-R886 PolarHBondContact O-N 3.26Å; D882-R886 IonicContact OD2-NH2 2.7Å; D882-L1011 HydrophobicContact CB-CD1 4.45Å
883	D	92.5	Very high	89.2	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-72.3	-38.4	176	-81.3	1.1	0	0	0	111.6	L879 E880 A881 I885 R886 L887 L1010 L1011 D1012 I1016	L879-D883 HydrophobicContact CB-CB 4.43Å; E880-D883 PolarHBondContact O-N 2.96Å; A881-D883 PolarHBondContact O-N 2.99Å; D883-I885 VanDerWaalsContact C-N 3.28Å; D883-I885 PolarHBondContact O-N 3.49Å; D883-R886 PolarHBondContact O-N 2.95Å; D883-R886 IonicContact OD1-CZ 2.8Å; D883-R886 IonicContact OD1-NH1 3.98Å; D883-R886 PolarHBondContact OD1-NH1 3.36Å; D883-L887 WeakPolarHBondContact O-CB 3.49Å; D883-L887 VanDerWaalsContact O-CG 3.26Å; D883-L887 WeakPolarHBondContact O-CG 3.46Å; D883-L887 PolarHBondContact O-N 3.02Å; D883-L1010 HydrophobicContact CB-CD2 4.21Å; D883-L1010 WeakPolarHBondContact OD1-CA 3.33Å; D883-L1011 VanDerWaalsContact CG-N 3.31Å; D883-L1011 PolarHBondContact OD1-N 2.89Å; D883-L1011 WeakPolarHBondContact OD2-CA 3.42Å; D883-L1011 PolarHBondContact OD2-N 3.47Å; D883-D1012 PolarHBondContact OD2-N 3.4Å; D883-I1016 HydrophobicContact CB-CD1 4.49Å
884	Q	92.9	Very high	89	Confident	18 Å²	18	35.2 Å²	35.2	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-55.4	-45.8	169.6	-66.1	-175.9	35.6	0	0	110.8	V16 F876 L879 E880 A881 L888	V16-Q884 HydrophobicContact CG1-CB 4.3Å; F876-Q884 HydrophobicContact CD1-CG 4.33Å; F876-Q884 HydrophobicContact CE1-CB 3.96Å; F876-Q884 HydrophobicContact CE1-CG 3.8Å; F876-Q884 HydrophobicContact CE2-CB 4.25Å; F876-Q884 HydrophobicContact CE2-CG 4.33Å; F876-Q884 HydrophobicContact CZ-CB 3.57Å; F876-Q884 HydrophobicContact CZ-CG 3.8Å; F876-Q884 PolarHBondContact O-NE2 3.36Å; L879-Q884 HydrophobicContact CB-CG 4.04Å; L879-Q884 PolarHBondContact O-NE2 2.7Å; E880-Q884 PolarHBondContact O-N 3.33Å; A881-Q884 WeakPolarHBondContact O-CB 3.3Å; A881-Q884 PolarHBondContact O-N 3.45Å; Q884-L888 WeakPolarHBondContact O-CB 3.35Å; Q884-L888 WeakPolarHBondContact O-CD1 3.34Å; Q884-L888 WeakPolarHBondContact O-CG 3.2Å; Q884-L888 PolarHBondContact O-N 3.37Å
885	I	88.2	Confident	88.9	Confident	30 Å²	30	29.6 Å²	29.6	15%	0.154	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-50.9	177.1	-70.6	163.8	0	0	0	111.1	W13 V16 T17 A881 D882 D883 L887 L888 C889	W13-I885 HydrophobicContact CE3-CG1 4.18Å; W13-I885 HydrophobicContact CH2-CG2 4.36Å; W13-I885 HydrophobicContact CZ3-CB 4.22Å; W13-I885 HydrophobicContact CZ3-CG1 3.91Å; W13-I885 HydrophobicContact CZ3-CG2 3.79Å; V16-I885 HydrophobicContact CG1-CG1 3.9Å; T17-I885 HydrophobicContact CG2-CD1 4.11Å; A881-I885 WeakPolarHBondContact O-CD1 3.48Å; A881-I885 VanDerWaalsContact O-CG1 3.22Å; A881-I885 WeakPolarHBondContact O-CG1 3.39Å; A881-I885 PolarHBondContact O-N 3.04Å; D882-I885 WeakPolarHBondContact O-CB 3.32Å; D882-I885 PolarHBondContact O-N 2.9Å; D883-I885 VanDerWaalsContact C-N 3.28Å; D883-I885 PolarHBondContact O-N 3.49Å; I885-L887 PolarHBondContact O-N 3.5Å; I885-L888 PolarHBondContact O-N 3.38Å; I885-C889 PolarHBondContact O-N 2.73Å; I885-C889 PolarHBondContact O-SG 2.57Å
886	R	87.5	Confident	88.4	Confident	63 Å²	63	30.2 Å²	30.2	24%	0.238	16%	0.164	C	C	.	.	H	α-helix	trans	-60.1	-42.9	179.8	-70.9	171.4	-166	115.3	5.7	112.6	D882 D883 G890 D1009 L1010	D882-R886 VanDerWaalsContact O-CG 3.3Å; D882-R886 WeakPolarHBondContact O-CG 3.5Å; D882-R886 PolarHBondContact O-N 3.26Å; D882-R886 IonicContact OD2-NH2 2.7Å; D883-R886 PolarHBondContact O-N 2.95Å; D883-R886 IonicContact OD1-CZ 2.8Å; D883-R886 IonicContact OD1-NH1 3.98Å; D883-R886 PolarHBondContact OD1-NH1 3.36Å; R886-G890 PolarHBondContact O-N 3.28Å; R886-D1009 VanDerWaalsContact CD-O 3.24Å; R886-D1009 WeakPolarHBondContact CD-O 3.48Å; R886-D1009 PolarHBondContact NE-O 3.48Å; R886-D1009 PolarHBondContact NH1-O 3.2Å; R886-L1010 HydrophobicContact CB-CD2 3.83Å
887	L	91.2	Very high	87.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-42.6	176.2	-68.1	-179	0	0	0	112	F876 L879 D883 I885 C891 L1002 M1003 S1004 R1007 L1010 I1016	F876-L887 HydrophobicContact CD2-CD1 4.36Å; F876-L887 HydrophobicContact CE2-CB 4.22Å; F876-L887 HydrophobicContact CE2-CD1 4.27Å; L879-L887 HydrophobicContact CD1-CD1 3.56Å; D883-L887 WeakPolarHBondContact O-CB 3.49Å; D883-L887 VanDerWaalsContact O-CG 3.26Å; D883-L887 WeakPolarHBondContact O-CG 3.46Å; D883-L887 PolarHBondContact O-N 3.02Å; I885-L887 PolarHBondContact O-N 3.5Å; L887-C891 WeakPolarHBondContact O-CB 3.11Å; L887-C891 PolarHBondContact O-N 3.19Å; L887-L1002 HydrophobicContact CB-CD1 4.33Å; L887-L1002 WeakPolarHBondContact CD2-O 3.4Å; L887-M1003 HydrophobicContact CD1-SD 4.3Å; L887-S1004 WeakPolarHBondContact CD2-O 3.33Å; L887-R1007 HydrophobicContact CD2-CG 4.04Å; L887-L1010 HydrophobicContact CD2-CD1 4.13Å; L887-L1010 HydrophobicContact CD2-CD2 3.97Å; L887-L1010 HydrophobicContact CG-CD2 4.12Å; L887-I1016 HydrophobicContact CD1-CD1 4Å; L887-I1016 HydrophobicContact CD1-CG1 4.19Å; L887-I1016 HydrophobicContact CD1-CG2 4.47Å; L887-I1016 HydrophobicContact CD2-CD1 4.33Å; L887-I1016 HydrophobicContact CD2-CG2 4.29Å; L887-I1016 HydrophobicContact CG-CD1 4.39Å
888	L	90.7	Very high	87.8	Confident	7 Å²	7	25.2 Å²	25.2	4%	0.037	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-48.3	176.5	-72.7	165.2	0	0	0	112	V16 L866 V867 A870 F876 Q884 I885 C891 C892 L1002	V16-L888 HydrophobicContact CG1-CD1 4.32Å; V16-L888 HydrophobicContact CG2-CD1 4.14Å; L866-L888 HydrophobicContact CD1-CD2 4.19Å; L866-L888 HydrophobicContact CD2-CD2 4.33Å; L866-L888 WeakPolarHBondContact CD2-O 3.35Å; L866-L888 HydrophobicContact CG-CD2 3.73Å; V867-L888 HydrophobicContact CG2-CD1 4.06Å; V867-L888 HydrophobicContact CG2-CD2 4.04Å; A870-L888 HydrophobicContact CB-CD2 3.72Å; F876-L888 HydrophobicContact CE2-CG 4.42Å; F876-L888 HydrophobicContact CZ-CD1 3.99Å; F876-L888 HydrophobicContact CZ-CD2 4.19Å; F876-L888 HydrophobicContact CZ-CG 3.85Å; Q884-L888 WeakPolarHBondContact O-CB 3.35Å; Q884-L888 WeakPolarHBondContact O-CD1 3.34Å; Q884-L888 WeakPolarHBondContact O-CG 3.2Å; Q884-L888 PolarHBondContact O-N 3.37Å; I885-L888 PolarHBondContact O-N 3.38Å; L888-C891 PolarHBondContact O-N 3.19Å; L888-C892 PolarHBondContact O-N 2.93Å; L888-C892 VanDerWaalsContact O-N 3.15Å; L888-L1002 HydrophobicContact CD2-CD1 4.42Å
889	C	83.2	Confident	87.5	Confident	12 Å²	12	20.4 Å²	20.4	8%	0.081	11%	0.107	C	C	.	.	H	α-helix	trans	-56.6	-53.1	176.3	-76	0	0	0	0	111.2	I885 C891 C892	I885-C889 PolarHBondContact O-N 2.73Å; I885-C889 PolarHBondContact O-SG 2.57Å; C889-C891 VanDerWaalsContact C-N 3.34Å; C889-C891 PolarHBondContact O-N 3.43Å; C889-C892 PolarHBondContact O-N 3.34Å
890	G	81.2	Confident	86.7	Confident	11 Å²	11	20.3 Å²	20.3	11%	0.113	11%	0.107	C	C	.	.	H	α-helix	trans	-62.5	-37.3	-179.7	0	0	0	0	0	113.8	R886 R1007	R886-G890 PolarHBondContact O-N 3.28Å; G890-R1007 PolarHBondContact O-NH1 2.82Å; G890-R1007 PolarHBondContact O-NH2 2.95Å
891	C	89.4	Confident	86.5	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-79.7	-20	-175.9	-172	0	0	0	0	114.1	L866 L887 L888 C889 I893 D894 L895 L1002	L866-C891 HydrophobicContact CD2-CB 4.34Å; L887-C891 WeakPolarHBondContact O-CB 3.11Å; L887-C891 PolarHBondContact O-N 3.19Å; L888-C891 PolarHBondContact O-N 3.19Å; C889-C891 VanDerWaalsContact C-N 3.34Å; C889-C891 PolarHBondContact O-N 3.43Å; C891-I893 PolarHBondContact O-N 3.07Å; C891-D894 WeakPolarHBondContact O-CB 3.36Å; C891-D894 PolarHBondContact O-N 2.85Å; C891-L895 WeakPolarHBondContact O-CB 3.4Å; C891-L895 PolarHBondContact O-N 3.49Å; C891-L1002 HydrophobicContact CB-CD1 4.1Å; C891-L1002 VanDerWaalsContact SG-CA 3.57Å
892	C	84.1	Confident	86.3	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.014	7%	0.07	C	C	.	.	H	α-helix	trans	-54.9	-48.3	-172.9	-170.7	0	0	0	0	113.1	L866 L888 C889 L895 I896 L1096	L866-C892 HydrophobicContact CD2-CB 3.99Å; L888-C892 PolarHBondContact O-N 2.93Å; L888-C892 VanDerWaalsContact O-N 3.15Å; C889-C892 PolarHBondContact O-N 3.34Å; C892-L895 PolarHBondContact O-N 3.29Å; C892-I896 WeakPolarHBondContact O-CG1 3.39Å; C892-I896 PolarHBondContact O-N 3.44Å; C892-L1096 HydrophobicContact CB-CD1 4.12Å; C892-L1096 HydrophobicContact CB-CD2 4.18Å; C892-L1096 HydrophobicContact CB-CG 4.38Å
893	I	80.9	Confident	85.8	Confident	1 Å²	1	9.9 Å²	9.9	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-72.3	-38.7	-178.3	-54.8	167.3	0	0	0	111	C891 L895 T897 T1066 Q1070 F1097	C891-I893 PolarHBondContact O-N 3.07Å; I893-L895 VanDerWaalsContact C-N 3.3Å; I893-L895 PolarHBondContact O-N 2.7Å; I893-T897 WeakPolarHBondContact O-CB 3.09Å; I893-T897 PolarHBondContact O-N 2.94Å; I893-T897 PolarHBondContact O-OG1 3.35Å; I893-T1066 HydrophobicContact CG2-CG2 4.28Å; I893-Q1070 HydrophobicContact CD1-CG 3.33Å; I893-F1097 HydrophobicContact CD1-CD1 3.43Å; I893-F1097 VanDerWaalsContact CD1-CD1 3.43Å; I893-F1097 HydrophobicContact CD1-CE1 3.37Å; I893-F1097 HydrophobicContact CG1-CD1 4.25Å; I893-F1097 HydrophobicContact CG1-CE1 3.71Å
894	D	88.6	Confident	85	Confident	1 Å²	1	12 Å²	12	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-57.5	-45	174.4	-74	-34.7	0	0	0	110.9	C891 T897 L898 L1001 R1007 R1063 T1066	C891-D894 WeakPolarHBondContact O-CB 3.36Å; C891-D894 PolarHBondContact O-N 2.85Å; D894-T897 PolarHBondContact O-N 3.41Å; D894-L898 VanDerWaalsContact O-CB 3.3Å; D894-L898 WeakPolarHBondContact O-CB 3.26Å; D894-L898 PolarHBondContact O-N 3.22Å; D894-L1001 HydrophobicContact CB-CB 4.29Å; D894-L1001 HydrophobicContact CB-CD1 4.17Å; D894-L1001 HydrophobicContact CB-CD2 4.2Å; D894-L1001 HydrophobicContact CB-CG 4.45Å; D894-R1007 IonicContact OD2-CZ 3.14Å; D894-R1007 IonicContact OD2-NH1 2.74Å; D894-R1007 PolarHBondContact OD2-NH1 2.96Å; D894-R1007 IonicContact OD2-NH2 2.73Å; D894-R1007 PolarHBondContact OD2-NH2 2.93Å; D894-R1063 IonicContact OD2-NH1 3Å; D894-T1066 WeakPolarHBondContact OD1-CB 3.49Å; D894-T1066 VanDerWaalsContact OD1-CG2 3.24Å; D894-T1066 WeakPolarHBondContact OD1-CG2 3.17Å; D894-T1066 PolarHBondContact OD1-OG1 3.44Å
895	L	87.2	Confident	84.5	Confident	5 Å²	5	11.1 Å²	11.1	3%	0.026	6%	0.056	C	C	.	.	H	α-helix	trans	-73	-41.1	-177.7	-172.3	50.9	0	0	0	113	Y786 L866 C891 C892 I893 T897 L898 R899 A998	Y786-L895 WeakPolarHBondContact OH-CD2 3.19Å; L866-L895 HydrophobicContact CB-CD2 4.2Å; L866-L895 HydrophobicContact CD1-CD2 3.68Å; L866-L895 HydrophobicContact CG-CD2 4.36Å; C891-L895 WeakPolarHBondContact O-CB 3.4Å; C891-L895 PolarHBondContact O-N 3.49Å; C892-L895 PolarHBondContact O-N 3.29Å; I893-L895 VanDerWaalsContact C-N 3.3Å; I893-L895 PolarHBondContact O-N 2.7Å; L895-T897 VanDerWaalsContact C-N 3.29Å; L895-T897 PolarHBondContact O-N 3.06Å; L895-L898 HydrophobicContact CD1-CD2 4.34Å; L895-L898 PolarHBondContact O-N 2.77Å; L895-R899 WeakPolarHBondContact O-CG 3.5Å; L895-R899 PolarHBondContact O-N 2.61Å; L895-A998 HydrophobicContact CD1-CB 3.74Å
896	I	80.1	Confident	84	Confident	21 Å²	21	12.1 Å²	12.1	11%	0.108	6%	0.06	C	C	.	.	H	α-helix	trans	-58.5	-44.3	171.6	-69	166.6	0	0	0	110.1	F847 A862 C892 R899 A900	F847-I896 HydrophobicContact CD1-CG2 4.49Å; F847-I896 HydrophobicContact CD2-CD1 4.21Å; F847-I896 HydrophobicContact CE2-CD1 3.95Å; F847-I896 HydrophobicContact CG-CG2 4.43Å; A862-I896 HydrophobicContact CB-CD1 4.12Å; A862-I896 HydrophobicContact CB-CG1 4.15Å; C892-I896 WeakPolarHBondContact O-CG1 3.39Å; C892-I896 PolarHBondContact O-N 3.44Å; I896-R899 PolarHBondContact O-N 3.09Å; I896-A900 WeakPolarHBondContact O-CB 3.47Å; I896-A900 PolarHBondContact O-N 3.1Å
897	T	83	Confident	83.1	Confident	2 Å²	2	9.8 Å²	9.8	1%	0.012	5%	0.053	C	C	.	.	H	α-helix	trans	-68.3	-37.1	179.2	-51.5	0	0	0	0	112	Y848 I893 D894 L895 A900 A901 I977 L1062 T1066	Y848-T897 PolarHBondContact OH-OG1 3Å; I893-T897 WeakPolarHBondContact O-CB 3.09Å; I893-T897 PolarHBondContact O-N 2.94Å; I893-T897 PolarHBondContact O-OG1 3.35Å; D894-T897 PolarHBondContact O-N 3.41Å; L895-T897 VanDerWaalsContact C-N 3.29Å; L895-T897 PolarHBondContact O-N 3.06Å; T897-A900 PolarHBondContact O-N 3.48Å; T897-A901 VanDerWaalsContact O-CB 3.32Å; T897-A901 WeakPolarHBondContact O-CB 3.04Å; T897-A901 PolarHBondContact O-N 3.44Å; T897-I977 HydrophobicContact CG2-CD1 4.49Å; T897-I977 HydrophobicContact CG2-CG1 4.33Å; T897-L1062 HydrophobicContact CG2-CD1 4.33Å; T897-L1062 HydrophobicContact CG2-CG 4.15Å; T897-T1066 HydrophobicContact CG2-CG2 3.92Å; T897-T1066 VanDerWaalsContact OG1-CG2 3.29Å; T897-T1066 WeakPolarHBondContact OG1-CG2 3.42Å
898	L	90.1	Very high	82.1	Confident	0 Å²	0	10 Å²	10	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-64.9	-47.1	175.3	175.4	59.7	0	0	0	111.8	D894 L895 A900 A901 Y902 M984 V994 M997 A998 L1001 L1062	D894-L898 VanDerWaalsContact O-CB 3.3Å; D894-L898 WeakPolarHBondContact O-CB 3.26Å; D894-L898 PolarHBondContact O-N 3.22Å; L895-L898 HydrophobicContact CD1-CD2 4.34Å; L895-L898 PolarHBondContact O-N 2.77Å; L898-A900 VanDerWaalsContact C-N 3.35Å; L898-A900 PolarHBondContact O-N 3.01Å; L898-A901 PolarHBondContact O-N 2.83Å; L898-Y902 VanDerWaalsContact O-CB 3.3Å; L898-Y902 WeakPolarHBondContact O-CB 3.46Å; L898-Y902 PolarHBondContact O-N 3.32Å; L898-M984 HydrophobicContact CD1-CE 3.55Å; L898-V994 HydrophobicContact CD1-CG1 4.44Å; L898-V994 HydrophobicContact CD2-CG1 4.16Å; L898-V994 HydrophobicContact CG-CG1 4.12Å; L898-M997 HydrophobicContact CD1-CB 4.35Å; L898-M997 HydrophobicContact CD1-SD 3.95Å; L898-M997 HydrophobicContact CD2-CB 3.8Å; L898-A998 HydrophobicContact CD2-CB 4.06Å; L898-L1001 HydrophobicContact CB-CD1 4.45Å; L898-L1001 HydrophobicContact CD2-CD1 3.85Å; L898-L1062 HydrophobicContact CB-CD1 3.98Å; L898-L1062 HydrophobicContact CD1-CD1 4.15Å
899	R	85	Confident	81.3	Confident	6 Å²	6	13.1 Å²	13.1	2%	0.023	7%	0.068	C	C	.	.	H	α-helix	trans	-56.4	-49.8	172.7	-70.2	-69.3	-69.4	158.6	-6.3	110.6	Y782 Y786 D840 L895 I896 A901 Y902 C903	Y782-R899 WeakPolarHBondContact OH-CD 3.39Å; Y782-R899 PolarHBondContact OH-NH1 3.3Å; Y786-R899 HydrophobicContact CE1-CG 4.48Å; D840-R899 IonicContact OD2-CZ 2.75Å; D840-R899 IonicContact OD2-NE 3.6Å; D840-R899 PolarHBondContact OD2-NE 3.48Å; D840-R899 IonicContact OD2-NH2 3.19Å; D840-R899 PolarHBondContact OD2-NH2 2.99Å; L895-R899 WeakPolarHBondContact O-CG 3.5Å; L895-R899 PolarHBondContact O-N 2.61Å; I896-R899 PolarHBondContact O-N 3.09Å; R899-A901 PolarHBondContact O-N 2.91Å; R899-Y902 PolarHBondContact O-N 2.95Å; R899-C903 WeakPolarHBondContact O-CB 3.16Å; R899-C903 PolarHBondContact O-N 3.04Å; R899-C903 PolarHBondContact O-SG 3.02Å; R899-C903 VanDerWaalsContact O-SG 3.35Å
900	A	76.6	Confident	80.5	Confident	7 Å²	7	15.8 Å²	15.8	6%	0.058	8%	0.081	C	C	.	.	H	α-helix	trans	-57	-52.2	179	0	0	0	0	0	112.2	A844 I896 T897 L898 Y902 C903 L904	A844-A900 HydrophobicContact CB-CB 3.53Å; I896-A900 WeakPolarHBondContact O-CB 3.47Å; I896-A900 PolarHBondContact O-N 3.1Å; T897-A900 PolarHBondContact O-N 3.48Å; L898-A900 VanDerWaalsContact C-N 3.35Å; L898-A900 PolarHBondContact O-N 3.01Å; A900-Y902 PolarHBondContact O-N 3.47Å; A900-C903 PolarHBondContact O-N 2.87Å; A900-L904 WeakPolarHBondContact O-CB 3.32Å; A900-L904 WeakPolarHBondContact O-CD1 3.1Å; A900-L904 WeakPolarHBondContact O-CG 3.11Å; A900-L904 PolarHBondContact O-N 3.44Å
901	A	84.9	Confident	79.8	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63.5	-39.2	-179.2	0	0	0	0	0	112.2	T897 L898 R899 S905 V980 A981 M984 L1062	T897-A901 VanDerWaalsContact O-CB 3.32Å; T897-A901 WeakPolarHBondContact O-CB 3.04Å; T897-A901 PolarHBondContact O-N 3.44Å; L898-A901 PolarHBondContact O-N 2.83Å; R899-A901 PolarHBondContact O-N 2.91Å; A901-S905 WeakPolarHBondContact O-CB 3.4Å; A901-S905 PolarHBondContact O-N 3.39Å; A901-V980 HydrophobicContact CB-CG1 4.05Å; A901-A981 VanDerWaalsContact O-CB 3.25Å; A901-A981 WeakPolarHBondContact O-CB 3.28Å; A901-M984 HydrophobicContact CB-CE 4.25Å; A901-M984 HydrophobicContact CB-SD 3.75Å; A901-L1062 HydrophobicContact CB-CD1 4.41Å
902	Y	87.9	Confident	78.7	Confident	22 Å²	22	20.4 Å²	20.4	9%	0.086	11%	0.108	C	C	.	.	H	α-helix	trans	-66.3	-48.4	176.7	174.8	-112.8	0	0	0	112.4	L898 R899 A900 L904 S905 K906 I989 Q991 V994	L898-Y902 VanDerWaalsContact O-CB 3.3Å; L898-Y902 WeakPolarHBondContact O-CB 3.46Å; L898-Y902 PolarHBondContact O-N 3.32Å; R899-Y902 PolarHBondContact O-N 2.95Å; A900-Y902 PolarHBondContact O-N 3.47Å; Y902-L904 VanDerWaalsContact C-N 3.31Å; Y902-L904 PolarHBondContact O-N 3.43Å; Y902-S905 CarbonylContact O-C 3.58Å; Y902-S905 WeakPolarHBondContact O-CA 3.4Å; Y902-S905 VanDerWaalsContact O-CB 3.27Å; Y902-S905 WeakPolarHBondContact O-CB 3.44Å; Y902-S905 PolarHBondContact O-N 3.2Å; Y902-S905 PolarHBondContact O-OG 3.17Å; Y902-K906 PolarHBondContact O-N 3.14Å; Y902-I989 HydrophobicContact CD2-CG2 4.22Å; Y902-I989 HydrophobicContact CE2-CG2 4.48Å; Y902-Q991 PolarHBondContact OH-N 2.7Å; Y902-Q991 PolarHBondContact OH-OE1 3.46Å; Y902-V994 HydrophobicContact CD1-CG2 4.18Å; Y902-V994 HydrophobicContact CD2-CG2 3.34Å; Y902-V994 HydrophobicContact CE2-CG2 3.72Å; Y902-V994 HydrophobicContact CG-CG2 3.57Å
903	C	77	Confident	77.7	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.3	-38.2	177.7	-71.2	0	0	0	0	112.5	I841 R899 A900 S905 K906 S907	I841-C903 HydrophobicContact CD1-CB 3.69Å; I841-C903 HydrophobicContact CG1-CB 3.34Å; R899-C903 WeakPolarHBondContact O-CB 3.16Å; R899-C903 PolarHBondContact O-N 3.04Å; R899-C903 PolarHBondContact O-SG 3.02Å; R899-C903 VanDerWaalsContact O-SG 3.35Å; A900-C903 PolarHBondContact O-N 2.87Å; C903-S905 VanDerWaalsContact C-N 3.31Å; C903-S905 PolarHBondContact O-N 3.32Å; C903-K906 PolarHBondContact O-N 2.77Å; C903-S907 WeakPolarHBondContact O-CB 3.15Å; C903-S907 PolarHBondContact O-N 3.29Å; C903-S907 PolarHBondContact O-OG 3.33Å
904	L	76	Confident	76.7	Confident	43 Å²	43	22.4 Å²	22.4	23%	0.225	12%	0.119	C	C	.	.	H	α-helix	trans	-64.1	-35.1	170.1	-72.5	165.1	0	0	0	112	A900 Y902 A908 Y963 I977 A981	A900-L904 WeakPolarHBondContact O-CB 3.32Å; A900-L904 WeakPolarHBondContact O-CD1 3.1Å; A900-L904 WeakPolarHBondContact O-CG 3.11Å; A900-L904 PolarHBondContact O-N 3.44Å; Y902-L904 VanDerWaalsContact C-N 3.31Å; Y902-L904 PolarHBondContact O-N 3.43Å; L904-A908 WeakPolarHBondContact O-CB 3.24Å; L904-A908 PolarHBondContact O-N 2.83Å; L904-Y963 HydrophobicContact CD1-CE1 4.17Å; L904-Y963 VanDerWaalsContact CD1-OH 3.28Å; L904-Y963 WeakPolarHBondContact CD1-OH 3.5Å; L904-Y963 HydrophobicContact CD2-CE1 4.21Å; L904-Y963 HydrophobicContact CD2-CE2 4.32Å; L904-Y963 WeakPolarHBondContact CD2-OH 3.23Å; L904-I977 HydrophobicContact CD1-CG2 3.78Å; L904-A981 HydrophobicContact CB-CB 3.59Å
905	S	83	Confident	74.7	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.9	-42	175.2	90.8	0	0	0	0	112.1	A901 Y902 C903 A908 K909 A981	A901-S905 WeakPolarHBondContact O-CB 3.4Å; A901-S905 PolarHBondContact O-N 3.39Å; Y902-S905 CarbonylContact O-C 3.58Å; Y902-S905 WeakPolarHBondContact O-CA 3.4Å; Y902-S905 VanDerWaalsContact O-CB 3.27Å; Y902-S905 WeakPolarHBondContact O-CB 3.44Å; Y902-S905 PolarHBondContact O-N 3.2Å; Y902-S905 PolarHBondContact O-OG 3.17Å; C903-S905 VanDerWaalsContact C-N 3.31Å; C903-S905 PolarHBondContact O-N 3.32Å; S905-A908 PolarHBondContact O-N 3.44Å; S905-K909 WeakPolarHBondContact O-CG 3.45Å; S905-K909 PolarHBondContact O-N 3.44Å; S905-A981 WeakPolarHBondContact CB-O 3.36Å
906	K	77.1	Confident	72.8	Confident	51 Å²	51	29.8 Å²	29.8	22%	0.222	16%	0.156	C	C	.	.	H	α-helix	trans	-61.6	-46.7	174.4	-173.3	175.6	178.3	-175.3	0	110.4	H832 L833 E837 Y902 C903 A908 K909 I910	H832-K906 WeakPolarHBondContact O-CE 3.34Å; H832-K906 PolarHBondContact O-NZ 3.5Å; L833-K906 HydrophobicContact CD2-CD 3.72Å; L833-K906 HydrophobicContact CD2-CG 4.23Å; E837-K906 WeakPolarHBondContact OE1-CD 3.44Å; E837-K906 IonicContact OE1-NZ 2.7Å; E837-K906 PolarHBondContact OE1-NZ 3.27Å; E837-K906 IonicContact OE2-NZ 2.56Å; E837-K906 PolarHBondContact OE2-NZ 3.44Å; Y902-K906 PolarHBondContact O-N 3.14Å; C903-K906 PolarHBondContact O-N 2.77Å; K906-A908 VanDerWaalsContact C-N 3.35Å; K906-A908 PolarHBondContact O-N 2.74Å; K906-K909 PolarHBondContact O-N 2.68Å; K906-I910 HydrophobicContact CG-CD1 4.03Å; K906-I910 WeakPolarHBondContact O-CG1 3.36Å; K906-I910 PolarHBondContact O-N 2.95Å
907	S	68.7	Low	70.7	Confident	15 Å²	15	32.6 Å²	32.6	11%	0.105	18%	0.177	C	C	.	.	H	α-helix	trans	-56.9	-44.7	174	-57.8	0	0	0	0	112.5	C903 I910 Q911	C903-S907 WeakPolarHBondContact O-CB 3.15Å; C903-S907 PolarHBondContact O-N 3.29Å; C903-S907 PolarHBondContact O-OG 3.33Å; S907-I910 PolarHBondContact O-N 2.83Å; S907-Q911 WeakPolarHBondContact O-CB 3.28Å; S907-Q911 VanDerWaalsContact O-CG 3.32Å; S907-Q911 WeakPolarHBondContact O-CG 3.31Å; S907-Q911 PolarHBondContact O-N 3.1Å
908	A	70.1	Confident	68.6	Low	5 Å²	5	36.3 Å²	36.3	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-35.3	178.3	0	0	0	0	0	113.3	L904 S905 K906 G912 L913 V914 L982 A985	L904-A908 WeakPolarHBondContact O-CB 3.24Å; L904-A908 PolarHBondContact O-N 2.83Å; S905-A908 PolarHBondContact O-N 3.44Å; K906-A908 VanDerWaalsContact C-N 3.35Å; K906-A908 PolarHBondContact O-N 2.74Å; A908-G912 PolarHBondContact O-N 3.27Å; A908-L913 PolarHBondContact O-N 2.91Å; A908-L913 VanDerWaalsContact O-N 3.08Å; A908-V914 HydrophobicContact CB-CG2 4.18Å; A908-L982 HydrophobicContact CB-CD2 4.17Å; A908-A985 HydrophobicContact CB-CB 4.47Å
909	K	72.7	Confident	66	Low	71 Å²	71	43.9 Å²	43.9	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-64	-50.1	172	-69.3	178.6	-167.7	173.1	0	110.9	S905 K906 Q911 G912 A985 N988 I989	S905-K909 WeakPolarHBondContact O-CG 3.45Å; S905-K909 PolarHBondContact O-N 3.44Å; K906-K909 PolarHBondContact O-N 2.68Å; K909-Q911 VanDerWaalsContact C-N 3.31Å; K909-Q911 PolarHBondContact O-N 2.97Å; K909-G912 PolarHBondContact O-N 3.04Å; K909-G912 VanDerWaalsContact O-N 3.07Å; K909-A985 HydrophobicContact CG-CB 4.1Å; K909-N988 WeakPolarHBondContact CE-OD1 3.2Å; K909-I989 PolarHBondContact NZ-O 2.58Å
910	I	68.1	Low	63.6	Low	69 Å²	69	49.5 Å²	49.5	35%	0.354	27%	0.265	S	S	.	.	H	α-helix	trans	-58.9	-42.5	-179.5	-68.3	163.8	0	0	0	111.3	H832 K906 S907 G912	H832-I910 HydrophobicContact CB-CD1 3.92Å; K906-I910 HydrophobicContact CG-CD1 4.03Å; K906-I910 WeakPolarHBondContact O-CG1 3.36Å; K906-I910 PolarHBondContact O-N 2.95Å; S907-I910 PolarHBondContact O-N 2.83Å; I910-G912 PolarHBondContact O-N 3.28Å
911	Q	65.2	Low	61.3	Low	78 Å²	78	57.7 Å²	57.7	36%	0.364	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	3.8	179.7	-67.8	174.7	6.7	0	0	114	V829 S907 K909 L913	V829-Q911 HydrophobicContact CG2-CG 4.47Å; S907-Q911 WeakPolarHBondContact O-CB 3.28Å; S907-Q911 VanDerWaalsContact O-CG 3.32Å; S907-Q911 WeakPolarHBondContact O-CG 3.31Å; S907-Q911 PolarHBondContact O-N 3.1Å; K909-Q911 VanDerWaalsContact C-N 3.31Å; K909-Q911 PolarHBondContact O-N 2.97Å; Q911-L913 HydrophobicContact CB-CD1 3.25Å; Q911-L913 HydrophobicContact CG-CD1 4.32Å; Q911-L913 PolarHBondContact O-N 2.86Å; Q911-L913 VanDerWaalsContact OE1-CD1 3.3Å
912	G	66.4	Low	58.7	Low	30 Å²	30	60 Å²	60	31%	0.309	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	11	178	0	0	0	0	0	115.3	A908 K909 I910 V914 D915	A908-G912 PolarHBondContact O-N 3.27Å; K909-G912 PolarHBondContact O-N 3.04Å; K909-G912 VanDerWaalsContact O-N 3.07Å; I910-G912 PolarHBondContact O-N 3.28Å; G912-V914 PolarHBondContact O-N 3.08Å; G912-D915 PolarHBondContact O-N 2.91Å
913	L	62.4	Low	55.8	Low	28 Å²	28	65 Å²	65	15%	0.147	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-5.9	179.8	-76.5	101.6	0	0	0	114.2	A908 Q911 P956 I958	A908-L913 PolarHBondContact O-N 2.91Å; A908-L913 VanDerWaalsContact O-N 3.08Å; Q911-L913 HydrophobicContact CB-CD1 3.25Å; Q911-L913 HydrophobicContact CG-CD1 4.32Å; Q911-L913 PolarHBondContact O-N 2.86Å; Q911-L913 VanDerWaalsContact OE1-CD1 3.3Å; L913-P956 HydrophobicContact CB-CG 3.96Å; L913-P956 HydrophobicContact CD2-CB 3.89Å; L913-P956 HydrophobicContact CD2-CG 3.83Å; L913-P956 WeakPolarHBondContact CD2-O 3.26Å; L913-P956 HydrophobicContact CG-CB 3.96Å; L913-P956 HydrophobicContact CG-CG 3.57Å; L913-I958 HydrophobicContact CD2-CD1 3.83Å; L913-I958 HydrophobicContact CD2-CG1 3.24Å
914	V	61.6	Low	53.6	Low	17 Å²	17	69.9 Å²	69.9	10%	0.103	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	51	-177.1	-158.6	0	0	0	0	108.8	A908 G912 H916 A985 R986	A908-V914 HydrophobicContact CB-CG2 4.18Å; G912-V914 PolarHBondContact O-N 3.08Å; V914-H916 PolarHBondContact O-CD2 3.34Å; V914-H916 PolarHBondContact O-N 2.97Å; V914-A985 HydrophobicContact CG1-CB 4.44Å; V914-A985 HydrophobicContact CG2-CB 3.67Å; V914-R986 HydrophobicContact CG1-CB 4.31Å; V914-R986 HydrophobicContact CG1-CG 3.59Å
915	D	46.4	Very low	51.3	Low	93 Å²	93	74.4 Å²	74.4	50%	0.497	41%	0.408	S	S	.	.			trans	-64.8	96	-175.5	-111.7	-31.4	0	0	0	111.9	G912 S917 L918	G912-D915 PolarHBondContact O-N 2.91Å; D915-S917 PolarHBondContact O-N 3.1Å; D915-L918 HydrophobicContact CB-CB 4.45Å; D915-L918 HydrophobicContact CB-CD1 3.75Å; D915-L918 HydrophobicContact CB-CG 3.94Å; D915-L918 VanDerWaalsContact OD2-CD1 3.29Å; D915-L918 WeakPolarHBondContact OD2-CD1 3.39Å
916	H	45.6	Very low	48.9	Very low	68 Å²	68	79.6 Å²	79.6	32%	0.315	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.1	174.9	-70.9	-83.8	0	0	0	112.9	V914 N988	V914-H916 PolarHBondContact O-CD2 3.34Å; V914-H916 PolarHBondContact O-N 2.97Å; H916-N988 PolarHBondContact CE1-ND2 2.73Å; H916-N988 PolarHBondContact NE2-ND2 2.71Å
917	S	37.1	Very low	46.7	Very low	79 Å²	79	81.7 Å²	81.7	55%	0.552	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-33.8	-175.6	-175.2	0	0	0	0	113.6	D915 L919 I920	D915-S917 PolarHBondContact O-N 3.1Å; S917-L919 VanDerWaalsContact C-N 3.25Å; S917-L919 PolarHBondContact O-N 2.77Å; S917-L919 VanDerWaalsContact O-N 3.11Å; S917-I920 PolarHBondContact O-N 2.7Å
918	L	37.8	Very low	45.1	Very low	80 Å²	80	85.9 Å²	85.9	42%	0.419	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	15	-162.6	-59.2	179.8	0	0	0	114.9	D915 I953	D915-L918 HydrophobicContact CB-CB 4.45Å; D915-L918 HydrophobicContact CB-CD1 3.75Å; D915-L918 HydrophobicContact CB-CG 3.94Å; D915-L918 VanDerWaalsContact OD2-CD1 3.29Å; D915-L918 WeakPolarHBondContact OD2-CD1 3.39Å; L918-I953 HydrophobicContact CB-CG1 4.29Å; L918-I953 HydrophobicContact CB-CG2 4.15Å; L918-I953 HydrophobicContact CD1-CB 4.47Å; L918-I953 HydrophobicContact CD1-CG1 3.91Å; L918-I953 HydrophobicContact CD1-CG2 3.63Å; L918-I953 HydrophobicContact CD2-CG1 4.41Å; L918-I953 HydrophobicContact CG-CG1 4.43Å
919	L	37.3	Very low	43.5	Very low	160 Å²	160	91.4 Å²	91.4	84%	0.838	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.4	-0.7	174.6	-71.5	175.1	0	0	0	114.4	S917	S917-L919 VanDerWaalsContact C-N 3.25Å; S917-L919 PolarHBondContact O-N 2.77Å; S917-L919 VanDerWaalsContact O-N 3.11Å
920	I	34.5	Very low	42	Very low	123 Å²	123	93.5 Å²	93.5	63%	0.631	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-17.1	-177.3	-65.6	-178.4	0	0	0	112.6	S917	S917-I920 PolarHBondContact O-N 2.7Å
921	R	28	Very low	40.6	Very low	180 Å²	180	96.5 Å²	96.5	68%	0.679	57%	0.57	S	S	*	*			trans	-109.4	84	173.6	-155	170	-170.1	179.3	2.5	111.7	I924	R921-I924 HydrophobicContact CG-CD1 4.03Å; R921-I924 HydrophobicContact CG-CG1 4.05Å
922	G	28.8	Very low	39	Very low	49 Å²	49	99 Å²	99	51%	0.505	59%	0.592	S	S	.	*			trans	-53.9	158.7	149.2	0	0	0	0	0	109.6	I924	G922-I924 PolarHBondContact O-N 2.82Å
923	P	27.7	Very low	37.7	Very low	126 Å²	126	104.1 Å²	104.1	82%	0.818	62%	0.617	S	S	*	*			trans	-62.4	97.9	-172.5	25.7	-34.2	0	0	0	110.8	T925	P923-T925 VanDerWaalsContact C-N 3.32Å; P923-T925 PolarHBondContact O-N 3.39Å
924	I	31.2	Very low	36.3	Very low	103 Å²	103	109 Å²	109	53%	0.528	65%	0.648	S	S	.	*			trans	-71.4	95.4	173.2	-63.1	-178	0	0	0	106.8	R921 G922 T926	R921-I924 HydrophobicContact CG-CD1 4.03Å; R921-I924 HydrophobicContact CG-CG1 4.05Å; G922-I924 PolarHBondContact O-N 2.82Å; I924-T926 VanDerWaalsContact C-N 3.32Å; I924-T926 HydrophobicContact CG2-CG2 3.69Å; I924-T926 PolarHBondContact O-N 2.96Å
925	T	28.5	Very low	35.1	Very low	137 Å²	137	113.3 Å²	113.3	84%	0.84	68%	0.679	S	S	*	*			trans	-66.3	89.6	165.2	48.5	0	0	0	0	109.2	P923	P923-T925 VanDerWaalsContact C-N 3.32Å; P923-T925 PolarHBondContact O-N 3.39Å
926	T	32.6	Very low	34.4	Very low	109 Å²	109	115.1 Å²	115.1	67%	0.669	69%	0.694	S	S	*	*			trans	-115.1	99.8	164.3	43.5	0	0	0	0	108.7	I924	I924-T926 VanDerWaalsContact C-N 3.32Å; I924-T926 HydrophobicContact CG2-CG2 3.69Å; I924-T926 PolarHBondContact O-N 2.96Å
927	A	29.9	Very low	34	Very low	95 Å²	95	117.3 Å²	117.3	79%	0.785	72%	0.716	S	S	*	*			trans	-83.9	127.8	170.8	0	0	0	0	0	109.7
928	T	34.7	Very low	33.9	Very low	104 Å²	104	125.2 Å²	125.2	64%	0.638	73%	0.734	S	S	*	*			trans	-155	152.5	153.5	-24.9	0	0	0	0	110.1
929	T	36.6	Very low	33.8	Very low	121 Å²	121	126.3 Å²	126.3	74%	0.742	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-81.6	151.4	-159.2	49.1	0	0	0	0	116.2
930	P	40.6	Very low	33.4	Very low	115 Å²	115	123.4 Å²	123.4	75%	0.747	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-85.4	150.9	168.1	35.6	-33.7	0	0	0	112.6
931	P	39.3	Very low	33.4	Very low	131 Å²	131	124.7 Å²	124.7	85%	0.851	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-84.7	145.7	177.8	33.4	-34.1	0	0	0	113.5
932	T	32	Very low	33.7	Very low	132 Å²	132	123.7 Å²	123.7	81%	0.81	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-90.6	130.1	175.8	43	0	0	0	0	113.3
933	T	38.2	Very low	33.7	Very low	136 Å²	136	130.7 Å²	130.7	83%	0.834	78%	0.775	S	S	*	*			trans	-153.6	104.5	144.5	44.6	0	0	0	0	113.1
934	T	34	Very low	33.9	Very low	130 Å²	130	130 Å²	130	80%	0.798	77%	0.773	S	S	*	*			trans	13.2	117.7	139.8	-28.5	0	0	0	0	121.3
935	S	35.4	Very low	33.8	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	79%	0.789	S	S	*	*			trans	159.6	93	131.8	49.9	0	0	0	0	110.5
936	T	33.8	Very low	33.9	Very low	131 Å²	131	133.7 Å²	133.7	80%	0.804	79%	0.788	S	S	*	*				57.6	83.1	85.7	-43.6	0	0	0	0	115.6
937	S	36.9	Very low	33.5	Very low	113 Å²	113	134.5 Å²	134.5	79%	0.79	79%	0.793	S	S	*	*				178.3	105.8	125.4	40.4	0	0	0	0	115.9
938	R	33.4	Very low	33.4	Very low	246 Å²	246	138 Å²	138	93%	0.928	79%	0.792	S	S	*	*			trans	61.7	156.8	137.4	-86.6	-162.7	162.7	-173.9	-4.6	121.7
939	P	36.2	Very low	33.2	Very low	103 Å²	103	141.8 Å²	141.8	67%	0.669	80%	0.803	S	S	*	*				-139.4	-168.7	-127.4	41.9	-21.5	0	0	0	116.1
940	S	30	Very low	32.6	Very low	98 Å²	98	146.4 Å²	146.4	69%	0.685	81%	0.808	S	S	*	*			trans	66.4	137.3	159.3	41.5	0	0	0	0	117
941	N	33.1	Very low	32.1	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	81%	0.808	S	S	*	*			cis	-150.8	176.4	18	-105.2	-18.7	0	0	0	112.2
942	N	34.1	Very low	31.6	Very low	160 Å²	160	147 Å²	147	86%	0.856	80%	0.803	S	S	*	*			trans	77.7	68.5	172	-61	-5.7	0	0	0	117
943	Q	29.6	Very low	31.5	Very low	196 Å²	196	146.4 Å²	146.4	92%	0.916	79%	0.793	S	S	*	*			trans	-102.8	131.5	154.5	-76.8	-179.8	-17.9	0	0	110.5
944	S	31.5	Very low	31.3	Very low	111 Å²	111	145 Å²	145	78%	0.776	78%	0.784	S	S	*	*			trans	-132	107.7	155.4	50	0	0	0	0	109.7
945	N	28.7	Very low	31.2	Very low	161 Å²	161	143.5 Å²	143.5	86%	0.861	78%	0.777	S	S	*	*			trans	58.8	73.4	159.5	-56.2	-13.9	0	0	0	118.1
946	L	30.8	Very low	31.1	Very low	157 Å²	157	141.6 Å²	141.6	82%	0.822	76%	0.762	S	S	*	*				-74.2	167.7	127.9	-88.4	151.7	0	0	0	109.8
947	T	25.4	Very low	31.2	Very low	125 Å²	125	144.1 Å²	144.1	77%	0.767	76%	0.758	S	S	*	*			trans	95.5	134.3	165.6	77.5	0	0	0	0	119.3
948	H	28.1	Very low	31.4	Very low	168 Å²	168	140.7 Å²	140.7	78%	0.778	73%	0.73	S	S	*	*			trans	55.2	93.3	162.9	-63.3	-68.1	0	0	0	120.1
949	Q	28.9	Very low	31.8	Very low	185 Å²	185	130.9 Å²	130.9	86%	0.864	70%	0.699	S	S	*	*			trans	-133	50.1	154.2	-151	168.1	2.2	0	0	112.5	N951	Q949-N951 PolarHBondContact O-N 3.49Å
950	Y	24.9	Very low	32	Very low	218 Å²	218	129.1 Å²	129.1	86%	0.855	68%	0.684	S	S	*	*			trans	-76.1	101.4	156.1	-84.1	-91.5	0	0	0	107.6
951	N	30.5	Very low	32.7	Very low	139 Å²	139	129.7 Å²	129.7	74%	0.743	68%	0.679	S	S	*	*			trans	-155	127	173.7	-104	-24.4	0	0	0	113	Q949	Q949-N951 PolarHBondContact O-N 3.49Å
952	T	27.8	Very low	33.2	Very low	120 Å²	120	126.2 Å²	126.2	74%	0.736	66%	0.658	S	S	*	*			trans	54.6	108.1	158.6	37.9	0	0	0	0	118.9	T954	T952-T954 PolarHBondContact O-N 3.13Å
953	I	31.3	Very low	33.3	Very low	118 Å²	118	119.8 Å²	119.8	61%	0.605	62%	0.622	S	S	*	*			trans	-89.6	78.9	-178.5	-49.5	80	0	0	0	110.7	L918	L918-I953 HydrophobicContact CB-CG1 4.29Å; L918-I953 HydrophobicContact CB-CG2 4.15Å; L918-I953 HydrophobicContact CD1-CB 4.47Å; L918-I953 HydrophobicContact CD1-CG1 3.91Å; L918-I953 HydrophobicContact CD1-CG2 3.63Å; L918-I953 HydrophobicContact CD2-CG1 4.41Å; L918-I953 HydrophobicContact CG-CG1 4.43Å
954	T	32.9	Very low	33.7	Very low	106 Å²	106	112.1 Å²	112.1	65%	0.65	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-70.6	135.8	151.2	43.8	0	0	0	0	108.5	T952	T952-T954 PolarHBondContact O-N 3.13Å
955	P	32.3	Very low	34	Very low	99 Å²	99	115 Å²	115	64%	0.643	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-57.5	129.8	172.3	25.5	-33.3	0	0	0	108.5	Y957	P955-Y957 PolarHBondContact O-N 3.48Å; P955-Y957 VanDerWaalsContact O-N 3.13Å
956	P	32.7	Very low	34.7	Very low	70 Å²	70	109.5 Å²	109.5	46%	0.455	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-55.9	122.2	-175.3	17.1	-29.9	0	0	0	110.9	L913 I958	L913-P956 HydrophobicContact CB-CG 3.96Å; L913-P956 HydrophobicContact CD2-CB 3.89Å; L913-P956 HydrophobicContact CD2-CG 3.83Å; L913-P956 WeakPolarHBondContact CD2-O 3.26Å; L913-P956 HydrophobicContact CG-CB 3.96Å; L913-P956 HydrophobicContact CG-CG 3.57Å; P956-I958 PolarHBondContact O-N 3.27Å
957	Y	36.5	Very low	35.1	Very low	183 Å²	183	104.7 Å²	104.7	72%	0.718	55%	0.546	S	S	*	.			trans	-77.7	110.5	176.2	169.4	-105.5	0	0	0	108.2	P955 P959	P955-Y957 PolarHBondContact O-N 3.48Å; P955-Y957 VanDerWaalsContact O-N 3.13Å; Y957-P959 HydrophobicContact CD1-CB 4.05Å; Y957-P959 VanDerWaalsContact CE1-CA 3.47Å; Y957-P959 HydrophobicContact CE1-CB 3.62Å; Y957-P959 WeakPolarHBondContact O-CD 3.22Å
958	I	41.1	Very low	35.9	Very low	41 Å²	41	100.5 Å²	100.5	21%	0.21	52%	0.518	C	S	.	.			trans	-67.6	113.1	162.8	-54	180	0	0	0	106.1	L913 P956 Q962 Y963	L913-I958 HydrophobicContact CD2-CD1 3.83Å; L913-I958 HydrophobicContact CD2-CG1 3.24Å; P956-I958 PolarHBondContact O-N 3.27Å; I958-Q962 HydrophobicContact CG2-CB 3.79Å; I958-Q962 HydrophobicContact CG2-CG 4.45Å; I958-Y963 HydrophobicContact CG2-CD2 4.24Å; I958-Y963 HydrophobicContact CG2-CE2 4.5Å
959	P	42.4	Very low	36.9	Very low	41 Å²	41	93 Å²	93	27%	0.266	49%	0.485	S	S	.	.			trans	-72.6	143.4	177.6	34.9	-36.2	0	0	0	109.3	Y957 N961 Q962	Y957-P959 HydrophobicContact CD1-CB 4.05Å; Y957-P959 VanDerWaalsContact CE1-CA 3.47Å; Y957-P959 HydrophobicContact CE1-CB 3.62Å; Y957-P959 WeakPolarHBondContact O-CD 3.22Å; P959-N961 WeakPolarHBondContact CB-OD1 3.38Å; P959-N961 VanDerWaalsContact CG-OD1 3.29Å; P959-N961 WeakPolarHBondContact CG-OD1 3.44Å; P959-N961 PolarHBondContact O-N 2.84Å; P959-Q962 HydrophobicContact CG-CB 4.22Å; P959-Q962 WeakPolarHBondContact O-CB 3.3Å; P959-Q962 PolarHBondContact O-N 3.11Å
960	N	40.4	Very low	38.1	Very low	66 Å²	66	87.1 Å²	87.1	35%	0.353	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-56	-19.6	-174.1	-84.3	12.1	0	0	0	114.9	Y963 E971 Q975 R978	N960-Y963 WeakPolarHBondContact O-CB 3.47Å; N960-Y963 PolarHBondContact O-N 3.35Å; N960-E971 VanDerWaalsContact ND2-CD 3.29Å; N960-E971 PolarHBondContact ND2-OE1 2.98Å; N960-E971 PolarHBondContact ND2-OE2 3.25Å; N960-Q975 PolarHBondContact OD1-NE2 2.69Å; N960-R978 PolarHBondContact OD1-NH2 3.35Å
961	N	43.5	Very low	39.8	Very low	110 Å²	110	80.9 Å²	80.9	59%	0.588	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-78.6	-18.8	174.7	67.7	-54.9	0	0	0	114	P959 Y963	P959-N961 WeakPolarHBondContact CB-OD1 3.38Å; P959-N961 VanDerWaalsContact CG-OD1 3.29Å; P959-N961 WeakPolarHBondContact CG-OD1 3.44Å; P959-N961 PolarHBondContact O-N 2.84Å; N961-Y963 PolarHBondContact O-N 3.49Å
962	Q	43.7	Very low	41.5	Very low	77 Å²	77	80.9 Å²	80.9	36%	0.36	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-73.6	-13.8	169.4	-146	76.6	27	0	0	111.3	I958 P959	I958-Q962 HydrophobicContact CG2-CB 3.79Å; I958-Q962 HydrophobicContact CG2-CG 4.45Å; P959-Q962 HydrophobicContact CG-CB 4.22Å; P959-Q962 WeakPolarHBondContact O-CB 3.3Å; P959-Q962 PolarHBondContact O-N 3.11Å
963	Y	37.3	Very low	43.3	Very low	25 Å²	25	75.6 Å²	75.6	10%	0.098	40%	0.4	C	S	.	.	S	Bend	trans	-81.8	145.2	170.8	-110	-106.7	0	0	0	110.8	L904 I958 N960 N961 K965 R978	L904-Y963 HydrophobicContact CD1-CE1 4.17Å; L904-Y963 VanDerWaalsContact CD1-OH 3.28Å; L904-Y963 WeakPolarHBondContact CD1-OH 3.5Å; L904-Y963 HydrophobicContact CD2-CE1 4.21Å; L904-Y963 HydrophobicContact CD2-CE2 4.32Å; L904-Y963 WeakPolarHBondContact CD2-OH 3.23Å; I958-Y963 HydrophobicContact CG2-CD2 4.24Å; I958-Y963 HydrophobicContact CG2-CE2 4.5Å; N960-Y963 WeakPolarHBondContact O-CB 3.47Å; N960-Y963 PolarHBondContact O-N 3.35Å; N961-Y963 PolarHBondContact O-N 3.49Å; Y963-K965 PolarHBondContact O-N 3.36Å; Y963-R978 HydrophobicContact CE1-CG 4.12Å; Y963-R978 VanDerWaalsContact CE1-NH1 3.26Å; Y963-R978 HydrophobicContact CE2-CB 4.3Å; Y963-R978 HydrophobicContact CE2-CG 3.94Å; Y963-R978 WeakPolarHBondContact OH-CB 3.35Å; Y963-R978 VanDerWaalsContact OH-CG 3.28Å; Y963-R978 WeakPolarHBondContact OH-CG 3.46Å
964	P	37.4	Very low	44.9	Very low	34 Å²	34	70.1 Å²	70.1	22%	0.221	37%	0.372	C	S	.	.			trans	-49	138.5	161.1	27.2	-40.6	0	0	0	111	R845 L966	R845-P964 HydrophobicContact CB-CB 3.97Å; R845-P964 HydrophobicContact CB-CG 4.48Å; R845-P964 HydrophobicContact CG-CB 3.47Å; R845-P964 VanDerWaalsContact CG-CB 3.47Å; R845-P964 HydrophobicContact CG-CG 3.69Å; P964-L966 HydrophobicContact CB-CD2 4.02Å; P964-L966 HydrophobicContact CG-CD2 3.88Å; P964-L966 WeakPolarHBondContact O-CD2 3.3Å; P964-L966 WeakPolarHBondContact O-CG 3.49Å; P964-L966 PolarHBondContact O-N 3.45Å
965	K	38.3	Very low	46.6	Very low	173 Å²	173	68.8 Å²	68.8	75%	0.752	36%	0.358	S	S	*	.			trans	-58.9	102.4	173.8	-71.3	179.3	179.1	177.2	0	109	M849 Y963	M849-K965 WeakPolarHBondContact CB-O 3.44Å; M849-K965 WeakPolarHBondContact CG-O 3.39Å; M849-K965 HydrophobicContact SD-CB 4.24Å; Y963-K965 PolarHBondContact O-N 3.36Å
966	L	42.7	Very low	48.8	Very low	45 Å²	45	67.1 Å²	67.1	24%	0.236	34%	0.343	C	S	.	.			trans	-90.5	138.7	171.3	-49	-167.8	0	0	0	108.7	Y848 P964 S969 A974	Y848-L966 HydrophobicContact CG-CD1 4.41Å; Y848-L966 CarbonylContact O-C 3.38Å; Y848-L966 WeakPolarHBondContact O-CA 3.24Å; P964-L966 HydrophobicContact CB-CD2 4.02Å; P964-L966 HydrophobicContact CG-CD2 3.88Å; P964-L966 WeakPolarHBondContact O-CD2 3.3Å; P964-L966 WeakPolarHBondContact O-CG 3.49Å; P964-L966 PolarHBondContact O-N 3.45Å; L966-S969 VanDerWaalsContact CB-OG 3.3Å; L966-S969 WeakPolarHBondContact CB-OG 3.18Å; L966-A974 HydrophobicContact CD1-CB 3.81Å
967	G	38.7	Very low	51	Low	55 Å²	55	64 Å²	64	57%	0.567	32%	0.323	S	S	*	.	S	Bend	trans	-121.7	-60.2	-165.6	0	0	0	0	0	112.3	Y848	Y848-G967 PolarHBondContact O-N 3.45Å
968	I	43.6	Very low	52.7	Low	37 Å²	37	56.1 Å²	56.1	19%	0.19	29%	0.292	C	S	.	.	S	Bend	trans	-82.9	-18.7	175.8	58.4	171.7	0	0	0	113.3	Y848 T850 F852 L1072 F1073	Y848-I968 PolarHBondContact O-N 2.79Å; T850-I968 WeakPolarHBondContact O-CD1 3.41Å; T850-I968 VanDerWaalsContact O-CG2 3.32Å; T850-I968 WeakPolarHBondContact O-CG2 3.28Å; F852-I968 HydrophobicContact CE2-CG2 4.16Å; I968-L1072 WeakPolarHBondContact O-CD2 3.37Å; I968-F1073 HydrophobicContact CD1-CE1 3.66Å; I968-F1073 HydrophobicContact CD1-CZ 4.24Å
969	S	47.5	Very low	54.7	Low	10 Å²	10	55.6 Å²	55.6	7%	0.07	30%	0.297	C	S	.	.	S	Bend	trans	-84.7	127	166.5	82.1	0	0	0	0	111.1	L966	L966-S969 VanDerWaalsContact CB-OG 3.3Å; L966-S969 WeakPolarHBondContact CB-OG 3.18Å
970	D	55.5	Low	56.8	Low	63 Å²	63	53.9 Å²	53.9	34%	0.337	29%	0.285	S	S	.	.			trans	-47.7	140.6	169.1	-175.5	-8.8	0	0	0	110.8	K972 C973 A974 L1072	D970-K972 HydrophobicContact CB-CB 4.44Å; D970-K972 CarbonylContact O-C 3.55Å; D970-K972 PolarHBondContact O-N 2.95Å; D970-K972 WeakPolarHBondContact OD1-CG 3.4Å; D970-K972 PolarHBondContact OD1-N 3.33Å; D970-K972 IonicContact OD1-NZ 3.75Å; D970-K972 PolarHBondContact OD1-NZ 2.91Å; D970-K972 WeakPolarHBondContact OD2-CD 3.29Å; D970-K972 IonicContact OD2-NZ 3.79Å; D970-K972 PolarHBondContact OD2-NZ 3.43Å; D970-C973 HydrophobicContact CB-CB 4.46Å; D970-C973 WeakPolarHBondContact O-CA 3.32Å; D970-C973 WeakPolarHBondContact O-CB 3.41Å; D970-C973 PolarHBondContact O-N 2.89Å; D970-A974 PolarHBondContact O-N 3.25Å; D970-L1072 HydrophobicContact CB-CD2 4.26Å
971	E	60.7	Low	58.9	Low	87 Å²	87	50.9 Å²	50.9	41%	0.407	27%	0.27	S	S	.	.	H	α-helix	trans	-50.8	-29.5	170.6	167.4	59.8	-160.2	0	0	110.9	N960 Q975 R978	N960-E971 VanDerWaalsContact ND2-CD 3.29Å; N960-E971 PolarHBondContact ND2-OE1 2.98Å; N960-E971 PolarHBondContact ND2-OE2 3.25Å; E971-Q975 WeakPolarHBondContact O-CB 3.26Å; E971-Q975 WeakPolarHBondContact O-CG 3.38Å; E971-Q975 PolarHBondContact O-N 3.39Å; E971-Q975 WeakPolarHBondContact OE1-CG 3.43Å; E971-Q975 PolarHBondContact OE1-NE2 2.87Å; E971-R978 VanDerWaalsContact CD-NH2 3.32Å; E971-R978 IonicContact OE1-NH2 2.73Å; E971-R978 PolarHBondContact OE1-NH2 3.09Å; E971-R978 IonicContact OE2-NH2 3.66Å; E971-R978 PolarHBondContact OE2-NH2 3.07Å; E971-R978 VanDerWaalsContact OE2-NH2 3.12Å
972	K	64.4	Low	60.9	Low	138 Å²	138	48 Å²	48	60%	0.6	25%	0.254	S	S	*	.	H	α-helix	trans	-62.6	-46.2	170	-60.1	-179.7	-145.9	69.1	0	113.2	D970 A974 Q975 L976	D970-K972 HydrophobicContact CB-CB 4.44Å; D970-K972 CarbonylContact O-C 3.55Å; D970-K972 PolarHBondContact O-N 2.95Å; D970-K972 WeakPolarHBondContact OD1-CG 3.4Å; D970-K972 PolarHBondContact OD1-N 3.33Å; D970-K972 IonicContact OD1-NZ 3.75Å; D970-K972 PolarHBondContact OD1-NZ 2.91Å; D970-K972 WeakPolarHBondContact OD2-CD 3.29Å; D970-K972 IonicContact OD2-NZ 3.79Å; D970-K972 PolarHBondContact OD2-NZ 3.43Å; K972-A974 VanDerWaalsContact C-N 3.35Å; K972-Q975 PolarHBondContact O-N 3.27Å; K972-L976 VanDerWaalsContact O-CG 3.27Å; K972-L976 WeakPolarHBondContact O-CG 3.1Å; K972-L976 PolarHBondContact O-N 2.85Å
973	C	65.7	Low	63.1	Low	10 Å²	10	47.5 Å²	47.5	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-46.3	176.8	-175.7	0	0	0	0	110.2	D970 Q975 L976 I977	D970-C973 HydrophobicContact CB-CB 4.46Å; D970-C973 WeakPolarHBondContact O-CA 3.32Å; D970-C973 WeakPolarHBondContact O-CB 3.41Å; D970-C973 PolarHBondContact O-N 2.89Å; C973-Q975 VanDerWaalsContact C-N 3.34Å; C973-Q975 PolarHBondContact O-N 2.88Å; C973-L976 PolarHBondContact O-N 2.93Å; C973-L976 VanDerWaalsContact O-N 3.08Å; C973-I977 WeakPolarHBondContact O-CG1 3.41Å; C973-I977 PolarHBondContact O-N 3.37Å
974	A	65.2	Low	65.7	Low	2 Å²	2	46.3 Å²	46.3	2%	0.017	25%	0.246	C	C	.	.	H	α-helix	trans	-54.2	-48.1	173.1	0	0	0	0	0	112.1	L966 D970 K972 L976 I977 R978	L966-A974 HydrophobicContact CD1-CB 3.81Å; D970-A974 PolarHBondContact O-N 3.25Å; K972-A974 VanDerWaalsContact C-N 3.35Å; A974-L976 VanDerWaalsContact C-N 3.35Å; A974-L976 PolarHBondContact O-N 3.13Å; A974-I977 PolarHBondContact O-N 3.01Å; A974-R978 WeakPolarHBondContact O-CG 3.08Å; A974-R978 PolarHBondContact O-N 3.35Å; A974-R978 VanDerWaalsContact O-N 3.14Å
975	Q	69.5	Low	68	Low	78 Å²	78	44.7 Å²	44.7	36%	0.364	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-38.4	176	-71.3	-66.2	-6	0	0	113.1	N960 E971 K972 C973 R978 G979	N960-Q975 PolarHBondContact OD1-NE2 2.69Å; E971-Q975 WeakPolarHBondContact O-CB 3.26Å; E971-Q975 WeakPolarHBondContact O-CG 3.38Å; E971-Q975 PolarHBondContact O-N 3.39Å; E971-Q975 WeakPolarHBondContact OE1-CG 3.43Å; E971-Q975 PolarHBondContact OE1-NE2 2.87Å; K972-Q975 PolarHBondContact O-N 3.27Å; C973-Q975 VanDerWaalsContact C-N 3.34Å; C973-Q975 PolarHBondContact O-N 2.88Å; Q975-R978 VanDerWaalsContact CD-NH2 3.33Å; Q975-R978 PolarHBondContact O-N 3.1Å; Q975-G979 PolarHBondContact O-N 3.09Å
976	L	79.1	Confident	70.3	Confident	64 Å²	64	43.1 Å²	43.1	34%	0.335	23%	0.225	S	C	.	.	H	α-helix	trans	-68	-42.6	177.6	-66.8	167	0	0	0	111.7	K972 C973 A974 R978 G979 V980 V1065	K972-L976 VanDerWaalsContact O-CG 3.27Å; K972-L976 WeakPolarHBondContact O-CG 3.1Å; K972-L976 PolarHBondContact O-N 2.85Å; C973-L976 PolarHBondContact O-N 2.93Å; C973-L976 VanDerWaalsContact O-N 3.08Å; A974-L976 VanDerWaalsContact C-N 3.35Å; A974-L976 PolarHBondContact O-N 3.13Å; L976-R978 PolarHBondContact O-N 2.88Å; L976-G979 WeakPolarHBondContact O-CA 3.16Å; L976-G979 PolarHBondContact O-N 3.43Å; L976-V980 PolarHBondContact O-N 2.98Å; L976-V1065 HydrophobicContact CB-CG1 4.45Å; L976-V1065 HydrophobicContact CB-CG2 3.5Å; L976-V1065 HydrophobicContact CD1-CG2 4.2Å; L976-V1065 HydrophobicContact CG-CG2 4.38Å
977	I	77.6	Confident	72.5	Confident	6 Å²	6	41.8 Å²	41.8	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-43.9	175.3	-62.6	172.6	0	0	0	110.8	Y848 T897 L904 C973 A974 G979 V980 A981 V1065	Y848-I977 HydrophobicContact CD2-CD1 4.24Å; Y848-I977 HydrophobicContact CE1-CD1 4.45Å; Y848-I977 HydrophobicContact CE2-CD1 3.62Å; T897-I977 HydrophobicContact CG2-CD1 4.49Å; T897-I977 HydrophobicContact CG2-CG1 4.33Å; L904-I977 HydrophobicContact CD1-CG2 3.78Å; C973-I977 WeakPolarHBondContact O-CG1 3.41Å; C973-I977 PolarHBondContact O-N 3.37Å; A974-I977 PolarHBondContact O-N 3.01Å; I977-G979 VanDerWaalsContact C-N 3.28Å; I977-G979 PolarHBondContact O-N 2.87Å; I977-V980 PolarHBondContact O-N 2.69Å; I977-A981 WeakPolarHBondContact O-CB 3.4Å; I977-A981 PolarHBondContact O-N 3.07Å; I977-V1065 HydrophobicContact CD1-CG1 4.42Å; I977-V1065 HydrophobicContact CG1-CG1 3.76Å
978	R	72.9	Confident	74.8	Confident	17 Å²	17	40.5 Å²	40.5	6%	0.064	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-36.1	172.8	-2.6	-178.5	-159.5	-80.2	1.4	111.9	N960 Y963 E971 A974 Q975 L976 A981 L982	N960-R978 PolarHBondContact OD1-NH2 3.35Å; Y963-R978 HydrophobicContact CE1-CG 4.12Å; Y963-R978 VanDerWaalsContact CE1-NH1 3.26Å; Y963-R978 HydrophobicContact CE2-CB 4.3Å; Y963-R978 HydrophobicContact CE2-CG 3.94Å; Y963-R978 WeakPolarHBondContact OH-CB 3.35Å; Y963-R978 VanDerWaalsContact OH-CG 3.28Å; Y963-R978 WeakPolarHBondContact OH-CG 3.46Å; E971-R978 VanDerWaalsContact CD-NH2 3.32Å; E971-R978 IonicContact OE1-NH2 2.73Å; E971-R978 PolarHBondContact OE1-NH2 3.09Å; E971-R978 IonicContact OE2-NH2 3.66Å; E971-R978 PolarHBondContact OE2-NH2 3.07Å; E971-R978 VanDerWaalsContact OE2-NH2 3.12Å; A974-R978 WeakPolarHBondContact O-CG 3.08Å; A974-R978 PolarHBondContact O-N 3.35Å; A974-R978 VanDerWaalsContact O-N 3.14Å; Q975-R978 VanDerWaalsContact CD-NH2 3.33Å; Q975-R978 PolarHBondContact O-N 3.1Å; L976-R978 PolarHBondContact O-N 2.88Å; R978-A981 PolarHBondContact O-N 3.05Å; R978-L982 WeakPolarHBondContact O-CB 3.3Å; R978-L982 VanDerWaalsContact O-CG 3.29Å; R978-L982 WeakPolarHBondContact O-CG 3.44Å; R978-L982 PolarHBondContact O-N 3.49Å
979	G	81.5	Confident	77.1	Confident	30 Å²	30	38.8 Å²	38.8	31%	0.309	19%	0.189	S	C	.	.	H	α-helix	trans	-58.8	-45	175.4	0	0	0	0	0	112.9	Q975 L976 I977 K983	Q975-G979 PolarHBondContact O-N 3.09Å; L976-G979 WeakPolarHBondContact O-CA 3.16Å; L976-G979 PolarHBondContact O-N 3.43Å; I977-G979 VanDerWaalsContact C-N 3.28Å; I977-G979 PolarHBondContact O-N 2.87Å; G979-K983 WeakPolarHBondContact O-CG 3.33Å; G979-K983 PolarHBondContact O-N 3.35Å
980	V	87.9	Confident	79.1	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-66.5	-48.5	173.7	176.6	0	0	0	0	110.7	A901 L976 I977 L982 K983 M984 T1058 E1061 L1062	A901-V980 HydrophobicContact CB-CG1 4.05Å; L976-V980 PolarHBondContact O-N 2.98Å; I977-V980 PolarHBondContact O-N 2.69Å; V980-L982 VanDerWaalsContact C-N 3.34Å; V980-L982 PolarHBondContact O-N 2.75Å; V980-K983 WeakPolarHBondContact O-CA 3.37Å; V980-K983 WeakPolarHBondContact O-CB 3.47Å; V980-K983 PolarHBondContact O-N 3.05Å; V980-M984 HydrophobicContact CG1-CE 3.81Å; V980-M984 HydrophobicContact CG1-CG 4.34Å; V980-M984 HydrophobicContact CG1-SD 4.12Å; V980-M984 WeakPolarHBondContact O-CG 3.45Å; V980-M984 PolarHBondContact O-N 3.32Å; V980-T1058 HydrophobicContact CG1-CG2 3.91Å; V980-E1061 HydrophobicContact CG2-CB 4.18Å; V980-L1062 HydrophobicContact CG1-CB 4.23Å; V980-L1062 HydrophobicContact CG1-CD1 4.25Å
981	A	85	Confident	80.7	Confident	3 Å²	3	39.4 Å²	39.4	3%	0.025	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-42.7	179	0	0	0	0	0	113	A901 L904 S905 I977 R978 K983 M984 A985	A901-A981 VanDerWaalsContact O-CB 3.25Å; A901-A981 WeakPolarHBondContact O-CB 3.28Å; L904-A981 HydrophobicContact CB-CB 3.59Å; S905-A981 WeakPolarHBondContact CB-O 3.36Å; I977-A981 WeakPolarHBondContact O-CB 3.4Å; I977-A981 PolarHBondContact O-N 3.07Å; R978-A981 PolarHBondContact O-N 3.05Å; A981-K983 VanDerWaalsContact C-N 3.32Å; A981-K983 PolarHBondContact O-N 3.44Å; A981-M984 PolarHBondContact O-N 3.04Å; A981-A985 WeakPolarHBondContact O-CB 3.47Å; A981-A985 PolarHBondContact O-N 3.38Å
982	L	84.9	Confident	82.2	Confident	50 Å²	50	36.9 Å²	36.9	26%	0.262	18%	0.181	S	C	.	.	H	α-helix	trans	-68.1	-29	175.9	-71.2	172	0	0	0	112.7	A908 R978 V980 R986	A908-L982 HydrophobicContact CB-CD2 4.17Å; R978-L982 WeakPolarHBondContact O-CB 3.3Å; R978-L982 VanDerWaalsContact O-CG 3.29Å; R978-L982 WeakPolarHBondContact O-CG 3.44Å; R978-L982 PolarHBondContact O-N 3.49Å; V980-L982 VanDerWaalsContact C-N 3.34Å; V980-L982 PolarHBondContact O-N 2.75Å; L982-R986 WeakPolarHBondContact O-CB 3.26Å; L982-R986 WeakPolarHBondContact O-CD 3.35Å; L982-R986 VanDerWaalsContact O-CG 3.23Å; L982-R986 WeakPolarHBondContact O-CG 3.43Å; L982-R986 PolarHBondContact O-N 3.45Å; L982-R986 VanDerWaalsContact O-N 3.14Å
983	K	89.9	Confident	83.6	Confident	66 Å²	66	30.3 Å²	30.3	29%	0.287	15%	0.153	S	C	.	.	H	α-helix	trans	-72.6	-46.5	172.1	-75.7	173.2	-179.9	174.2	0	111.3	G979 V980 A981 A985 R986 L987 T1058 E1061	G979-K983 WeakPolarHBondContact O-CG 3.33Å; G979-K983 PolarHBondContact O-N 3.35Å; V980-K983 WeakPolarHBondContact O-CA 3.37Å; V980-K983 WeakPolarHBondContact O-CB 3.47Å; V980-K983 PolarHBondContact O-N 3.05Å; A981-K983 VanDerWaalsContact C-N 3.32Å; A981-K983 PolarHBondContact O-N 3.44Å; K983-A985 VanDerWaalsContact C-N 3.25Å; K983-A985 PolarHBondContact O-N 3.37Å; K983-R986 PolarHBondContact O-N 3.41Å; K983-L987 WeakPolarHBondContact O-CB 3.05Å; K983-L987 WeakPolarHBondContact O-CG 3.48Å; K983-L987 PolarHBondContact O-N 2.92Å; K983-T1058 HydrophobicContact CB-CG2 3.93Å; K983-E1061 WeakPolarHBondContact CD-OE2 3.34Å; K983-E1061 IonicContact NZ-OE1 3.9Å; K983-E1061 PolarHBondContact NZ-OE1 3.01Å; K983-E1061 IonicContact NZ-OE2 3.43Å; K983-E1061 PolarHBondContact NZ-OE2 3.22Å
984	M	91.7	Very high	84.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-55.2	-43.7	173.2	-70.6	179	165.8	0	0	111.3	L898 A901 V980 A981 L987 N988 I989 M997 T1058 L1062	L898-M984 HydrophobicContact CD1-CE 3.55Å; A901-M984 HydrophobicContact CB-CE 4.25Å; A901-M984 HydrophobicContact CB-SD 3.75Å; V980-M984 HydrophobicContact CG1-CE 3.81Å; V980-M984 HydrophobicContact CG1-CG 4.34Å; V980-M984 HydrophobicContact CG1-SD 4.12Å; V980-M984 WeakPolarHBondContact O-CG 3.45Å; V980-M984 PolarHBondContact O-N 3.32Å; A981-M984 PolarHBondContact O-N 3.04Å; M984-L987 PolarHBondContact O-N 3.29Å; M984-N988 PolarHBondContact O-N 2.73Å; M984-I989 HydrophobicContact CB-CB 4.05Å; M984-I989 HydrophobicContact CB-CG1 3.85Å; M984-I989 HydrophobicContact CG-CG1 4.05Å; M984-I989 WeakPolarHBondContact O-CG1 3.49Å; M984-I989 PolarHBondContact O-N 3.47Å; M984-M997 HydrophobicContact CE-SD 4.2Å; M984-T1058 HydrophobicContact CE-CG2 4.43Å; M984-T1058 HydrophobicContact CG-CG2 3.81Å; M984-L1062 HydrophobicContact CE-CD1 3.97Å
985	A	86.2	Confident	86.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-46	178.4	0	0	0	0	0	112	A908 K909 V914 A981 K983 L987 N988	A908-A985 HydrophobicContact CB-CB 4.47Å; K909-A985 HydrophobicContact CG-CB 4.1Å; V914-A985 HydrophobicContact CG1-CB 4.44Å; V914-A985 HydrophobicContact CG2-CB 3.67Å; A981-A985 WeakPolarHBondContact O-CB 3.47Å; A981-A985 PolarHBondContact O-N 3.38Å; K983-A985 VanDerWaalsContact C-N 3.25Å; K983-A985 PolarHBondContact O-N 3.37Å; A985-L987 VanDerWaalsContact C-N 3.33Å; A985-L987 PolarHBondContact O-N 3.15Å; A985-N988 PolarHBondContact O-N 2.74Å; A985-N988 VanDerWaalsContact O-N 3.08Å; A985-N988 PolarHBondContact O-OD1 2.87Å
986	R	86.5	Confident	87.6	Confident	140 Å²	140	26.1 Å²	26.1	53%	0.528	13%	0.132	S	C	.	.	H	α-helix	trans	-65.8	-29.2	177.2	-75.4	170.6	178.6	163.1	1.7	114.7	V914 L982 K983	V914-R986 HydrophobicContact CG1-CB 4.31Å; V914-R986 HydrophobicContact CG1-CG 3.59Å; L982-R986 WeakPolarHBondContact O-CB 3.26Å; L982-R986 WeakPolarHBondContact O-CD 3.35Å; L982-R986 VanDerWaalsContact O-CG 3.23Å; L982-R986 WeakPolarHBondContact O-CG 3.43Å; L982-R986 PolarHBondContact O-N 3.45Å; L982-R986 VanDerWaalsContact O-N 3.14Å; K983-R986 PolarHBondContact O-N 3.41Å
987	L	88.5	Confident	88.4	Confident	18 Å²	18	23 Å²	23	9%	0.094	12%	0.116	C	C	.	.	H	α-helix	trans	-81.8	-6.9	175.3	-68.1	171.5	0	0	0	112.4	K983 M984 A985 I989 R1054 I1055 T1058	K983-L987 WeakPolarHBondContact O-CB 3.05Å; K983-L987 WeakPolarHBondContact O-CG 3.48Å; K983-L987 PolarHBondContact O-N 2.92Å; M984-L987 PolarHBondContact O-N 3.29Å; A985-L987 VanDerWaalsContact C-N 3.33Å; A985-L987 PolarHBondContact O-N 3.15Å; L987-I989 VanDerWaalsContact C-N 3.27Å; L987-I989 HydrophobicContact CB-CD1 4.17Å; L987-I989 HydrophobicContact CB-CG1 4.14Å; L987-I989 PolarHBondContact O-N 3.41Å; L987-R1054 HydrophobicContact CD1-CB 4.06Å; L987-R1054 HydrophobicContact CD2-CB 3.65Å; L987-R1054 HydrophobicContact CD2-CG 4.48Å; L987-I1055 HydrophobicContact CD1-CG1 4.21Å; L987-T1058 WeakPolarHBondContact CD1-OG1 3.47Å
988	N	87.8	Confident	89.2	Confident	28 Å²	28	22.8 Å²	22.8	15%	0.15	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	49.2	-169	-70.7	-52.1	0	0	0	112.6	K909 H916 M984 A985 D990 Y1044	K909-N988 WeakPolarHBondContact CE-OD1 3.2Å; H916-N988 PolarHBondContact CE1-ND2 2.73Å; H916-N988 PolarHBondContact NE2-ND2 2.71Å; M984-N988 PolarHBondContact O-N 2.73Å; A985-N988 PolarHBondContact O-N 2.74Å; A985-N988 VanDerWaalsContact O-N 3.08Å; A985-N988 PolarHBondContact O-OD1 2.87Å; N988-D990 PolarHBondContact O-N 2.95Å; N988-Y1044 HydrophobicContact CB-CE1 3.79Å; N988-Y1044 WeakPolarHBondContact CB-OH 3.48Å; N988-Y1044 WeakPolarHBondContact ND2-CE1 3.26Å; N988-Y1044 PolarHBondContact ND2-OH 3.01Å
989	I	90.6	Very high	90.3	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.			trans	-53.4	130.9	165	-62.8	-54.9	0	0	0	108.7	Y902 K909 M984 L987 D993 V994 M997 I1055	Y902-I989 HydrophobicContact CD2-CG2 4.22Å; Y902-I989 HydrophobicContact CE2-CG2 4.48Å; K909-I989 PolarHBondContact NZ-O 2.58Å; M984-I989 HydrophobicContact CB-CB 4.05Å; M984-I989 HydrophobicContact CB-CG1 3.85Å; M984-I989 HydrophobicContact CG-CG1 4.05Å; M984-I989 WeakPolarHBondContact O-CG1 3.49Å; M984-I989 PolarHBondContact O-N 3.47Å; L987-I989 VanDerWaalsContact C-N 3.27Å; L987-I989 HydrophobicContact CB-CD1 4.17Å; L987-I989 HydrophobicContact CB-CG1 4.14Å; L987-I989 PolarHBondContact O-N 3.41Å; I989-D993 WeakPolarHBondContact CA-OD2 3.44Å; I989-D993 HydrophobicContact CD1-CB 4.15Å; I989-D993 HydrophobicContact CG2-CB 3.86Å; I989-V994 HydrophobicContact CG2-CG2 3.79Å; I989-M997 HydrophobicContact CD1-CE 3.66Å; I989-M997 HydrophobicContact CG1-CE 4.29Å; I989-M997 HydrophobicContact CG2-CE 4.45Å; I989-I1055 HydrophobicContact CD1-CD1 4.11Å; I989-I1055 HydrophobicContact CD1-CG1 3.92Å; I989-I1055 HydrophobicContact CD1-CG2 4.37Å
990	D	89.2	Confident	91	Very high	49 Å²	49	20.8 Å²	20.8	26%	0.262	10%	0.098	S	C	.	.			trans	-118.8	-177.3	177.8	61.3	35.6	0	0	0	111.9	N988 T992 D993 V994 R1035	N988-D990 PolarHBondContact O-N 2.95Å; D990-T992 VanDerWaalsContact C-N 3.29Å; D990-T992 PolarHBondContact O-N 3.47Å; D990-T992 PolarHBondContact OD1-N 2.88Å; D990-D993 PolarHBondContact N-OD2 3.42Å; D990-D993 PolarHBondContact O-N 3.22Å; D990-D993 PolarHBondContact OD1-N 3.09Å; D990-V994 WeakPolarHBondContact O-CG2 3.36Å; D990-V994 PolarHBondContact O-N 3.39Å; D990-R1035 VanDerWaalsContact CG-NH2 3.27Å; D990-R1035 IonicContact OD1-NH2 2.79Å; D990-R1035 PolarHBondContact OD1-NH2 2.67Å; D990-R1035 IonicContact OD2-CZ 3.84Å; D990-R1035 IonicContact OD2-NH1 2.66Å; D990-R1035 PolarHBondContact OD2-NH1 3.35Å; D990-R1035 IonicContact OD2-NH2 2.68Å; D990-R1035 PolarHBondContact OD2-NH2 3.26Å
991	Q	89.2	Confident	91.3	Very high	37 Å²	37	20.6 Å²	20.6	17%	0.173	10%	0.097	C	C	.	.	H	α-helix	trans	-65	-32.7	-174.1	-164.4	54.5	64.7	0	0	113	Y902 V994 A995	Y902-Q991 PolarHBondContact OH-N 2.7Å; Y902-Q991 PolarHBondContact OH-OE1 3.46Å; Q991-V994 PolarHBondContact O-N 3.25Å; Q991-A995 PolarHBondContact O-N 2.9Å
992	T	92.3	Very high	91.8	Very high	35 Å²	35	20.5 Å²	20.5	22%	0.215	10%	0.096	C	C	.	.	H	α-helix	trans	-70.5	-43.5	175.3	-61.9	0	0	0	0	111.1	I775 C779 D990 V994 A995 M996 Y1030	I775-T992 HydrophobicContact CG2-CG2 3.76Å; C779-T992 VanDerWaalsContact SG-CG2 3.58Å; C779-T992 PolarHBondContact SG-OG1 2.87Å; D990-T992 VanDerWaalsContact C-N 3.29Å; D990-T992 PolarHBondContact O-N 3.47Å; D990-T992 PolarHBondContact OD1-N 2.88Å; T992-V994 VanDerWaalsContact C-N 3.26Å; T992-V994 PolarHBondContact O-N 3.49Å; T992-A995 PolarHBondContact O-N 2.53Å; T992-M996 WeakPolarHBondContact O-CG 3.48Å; T992-M996 PolarHBondContact O-N 2.8Å; T992-Y1030 WeakPolarHBondContact CB-OH 3.39Å; T992-Y1030 HydrophobicContact CG2-CE1 3.81Å; T992-Y1030 HydrophobicContact CG2-CE2 3.94Å; T992-Y1030 VanDerWaalsContact CG2-CZ 3.41Å; T992-Y1030 VanDerWaalsContact CG2-OH 3.3Å; T992-Y1030 WeakPolarHBondContact CG2-OH 3.46Å
993	D	94.6	Very high	92.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.4	-42	173.1	-67.8	-32.9	0	0	0	111.2	I989 D990 M996 M997 F1027 R1035	I989-D993 WeakPolarHBondContact CA-OD2 3.44Å; I989-D993 HydrophobicContact CD1-CB 4.15Å; I989-D993 HydrophobicContact CG2-CB 3.86Å; D990-D993 PolarHBondContact N-OD2 3.42Å; D990-D993 PolarHBondContact O-N 3.22Å; D990-D993 PolarHBondContact OD1-N 3.09Å; D993-M996 PolarHBondContact O-N 3.27Å; D993-M997 WeakPolarHBondContact O-CB 3.15Å; D993-M997 VanDerWaalsContact O-CG 3.22Å; D993-M997 WeakPolarHBondContact O-CG 3.45Å; D993-M997 PolarHBondContact O-N 1.99Å; D993-F1027 HydrophobicContact CB-CE2 4.27Å; D993-F1027 HydrophobicContact CB-CZ 3.99Å; D993-F1027 VanDerWaalsContact OD1-CE2 3.32Å; D993-F1027 WeakPolarHBondContact OD1-CE2 3.28Å; D993-R1035 IonicContact OD1-CZ 2.71Å; D993-R1035 VanDerWaalsContact OD1-CZ 3.29Å; D993-R1035 IonicContact OD1-NE 2.77Å; D993-R1035 PolarHBondContact OD1-NE 2.92Å; D993-R1035 IonicContact OD1-NH2 3.1Å; D993-R1035 PolarHBondContact OD1-NH2 3.03Å; D993-R1035 IonicContact OD2-CZ 2.92Å; D993-R1035 IonicContact OD2-NE 2.64Å; D993-R1035 PolarHBondContact OD2-NE 3.35Å; D993-R1035 IonicContact OD2-NH1 2.91Å; D993-R1035 IonicContact OD2-NH2 3.19Å; D993-R1035 PolarHBondContact OD2-NH2 2.61Å
994	V	93.7	Very high	92.3	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-66.3	-41.5	177.9	173.5	0	0	0	0	112.3	Y782 L898 Y902 I989 D990 Q991 T992 M997 A998	Y782-V994 HydrophobicContact CE2-CG1 4.13Å; Y782-V994 VanDerWaalsContact OH-CG1 3.28Å; Y782-V994 WeakPolarHBondContact OH-CG1 3.4Å; L898-V994 HydrophobicContact CD1-CG1 4.44Å; L898-V994 HydrophobicContact CD2-CG1 4.16Å; L898-V994 HydrophobicContact CG-CG1 4.12Å; Y902-V994 HydrophobicContact CD1-CG2 4.18Å; Y902-V994 HydrophobicContact CD2-CG2 3.34Å; Y902-V994 HydrophobicContact CE2-CG2 3.72Å; Y902-V994 HydrophobicContact CG-CG2 3.57Å; I989-V994 HydrophobicContact CG2-CG2 3.79Å; D990-V994 WeakPolarHBondContact O-CG2 3.36Å; D990-V994 PolarHBondContact O-N 3.39Å; Q991-V994 PolarHBondContact O-N 3.25Å; T992-V994 VanDerWaalsContact C-N 3.26Å; T992-V994 PolarHBondContact O-N 3.49Å; V994-M997 PolarHBondContact O-N 3.48Å; V994-A998 WeakPolarHBondContact O-CB 3.34Å; V994-A998 PolarHBondContact O-N 2.95Å
995	A	94.7	Very high	92.2	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.008	7%	0.074	C	C	.	.	H	α-helix	trans	-62.8	-43	177.2	0	0	0	0	0	111.5	I778 Y782 Q991 T992 A998 A999	I778-A995 HydrophobicContact CG2-CB 4.09Å; I778-A995 WeakPolarHBondContact CG2-O 3.38Å; Y782-A995 HydrophobicContact CD2-CB 3.96Å; Y782-A995 HydrophobicContact CG-CB 3.82Å; Q991-A995 PolarHBondContact O-N 2.9Å; T992-A995 PolarHBondContact O-N 2.53Å; A995-A998 PolarHBondContact O-N 3.13Å; A995-A999 PolarHBondContact O-N 2.91Å; A995-A999 VanDerWaalsContact O-N 3.09Å
996	M	95.9	Very high	92.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.9	-43.1	173.8	-66.6	-56.4	-66	0	0	112.2	I775 I778 T992 D993 A998 A999 I1000 L1023 T1026 F1027	I775-M996 HydrophobicContact CD1-SD 4.35Å; I775-M996 HydrophobicContact CG1-CE 4.21Å; I775-M996 HydrophobicContact CG1-SD 3.87Å; I778-M996 HydrophobicContact CB-SD 4.2Å; I778-M996 HydrophobicContact CD1-CE 3.98Å; I778-M996 HydrophobicContact CD1-SD 3.6Å; I778-M996 VanDerWaalsContact CD1-SD 3.6Å; I778-M996 HydrophobicContact CG2-SD 4.01Å; T992-M996 WeakPolarHBondContact O-CG 3.48Å; T992-M996 PolarHBondContact O-N 2.8Å; D993-M996 PolarHBondContact O-N 3.27Å; M996-A998 VanDerWaalsContact C-N 3.32Å; M996-A998 PolarHBondContact O-N 3.01Å; M996-A999 PolarHBondContact O-N 2.92Å; M996-I1000 WeakPolarHBondContact O-CD1 3.12Å; M996-I1000 VanDerWaalsContact O-CG1 3.28Å; M996-I1000 WeakPolarHBondContact O-CG1 3.47Å; M996-I1000 PolarHBondContact O-N 3.46Å; M996-L1023 HydrophobicContact CE-CD2 4.42Å; M996-T1026 HydrophobicContact CE-CG2 4.48Å; M996-F1027 HydrophobicContact CB-CB 4.36Å; M996-F1027 HydrophobicContact CB-CD1 3.92Å; M996-F1027 HydrophobicContact CB-CD2 3.69Å; M996-F1027 HydrophobicContact CB-CE1 4.11Å; M996-F1027 HydrophobicContact CB-CE2 3.88Å; M996-F1027 HydrophobicContact CB-CG 3.73Å; M996-F1027 HydrophobicContact CB-CZ 4.1Å; M996-F1027 HydrophobicContact CE-CB 3.81Å; M996-F1027 HydrophobicContact CE-CG 4.42Å; M996-F1027 HydrophobicContact CG-CD2 3.79Å; M996-F1027 HydrophobicContact CG-CE2 4.19Å; M996-F1027 HydrophobicContact CG-CG 4.15Å
997	M	96.4	Very high	92	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-58.7	-42.6	173.9	-75.2	176.7	-173	0	0	112.1	L898 M984 I989 D993 V994 I1000 L1001 F1027 I1055 L1059	L898-M997 HydrophobicContact CD1-CB 4.35Å; L898-M997 HydrophobicContact CD1-SD 3.95Å; L898-M997 HydrophobicContact CD2-CB 3.8Å; M984-M997 HydrophobicContact CE-SD 4.2Å; I989-M997 HydrophobicContact CD1-CE 3.66Å; I989-M997 HydrophobicContact CG1-CE 4.29Å; I989-M997 HydrophobicContact CG2-CE 4.45Å; D993-M997 WeakPolarHBondContact O-CB 3.15Å; D993-M997 VanDerWaalsContact O-CG 3.22Å; D993-M997 WeakPolarHBondContact O-CG 3.45Å; D993-M997 PolarHBondContact O-N 1.99Å; V994-M997 PolarHBondContact O-N 3.48Å; M997-I1000 PolarHBondContact O-N 2.93Å; M997-L1001 WeakPolarHBondContact O-CB 3.49Å; M997-L1001 WeakPolarHBondContact O-CD1 3.32Å; M997-L1001 VanDerWaalsContact O-CG 3.23Å; M997-L1001 WeakPolarHBondContact O-CG 2.99Å; M997-L1001 PolarHBondContact O-N 3.43Å; M997-F1027 HydrophobicContact CG-CE1 4.22Å; M997-I1055 HydrophobicContact CE-CG2 3.51Å; M997-L1059 HydrophobicContact CB-CD1 3.92Å; M997-L1059 HydrophobicContact CG-CD1 3.89Å; M997-L1059 HydrophobicContact CG-CD2 4.36Å; M997-L1059 HydrophobicContact SD-CD1 4.19Å
998	A	94.8	Very high	91.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.3	-43.6	178.6	0	0	0	0	0	111.9	Y782 F869 L895 L898 V994 A995 M996 I1000 L1001 L1002	Y782-A998 HydrophobicContact CD2-CB 4.2Å; Y782-A998 HydrophobicContact CE2-CB 3.95Å; F869-A998 HydrophobicContact CE1-CB 3.82Å; F869-A998 HydrophobicContact CZ-CB 3.91Å; L895-A998 HydrophobicContact CD1-CB 3.74Å; L898-A998 HydrophobicContact CD2-CB 4.06Å; V994-A998 WeakPolarHBondContact O-CB 3.34Å; V994-A998 PolarHBondContact O-N 2.95Å; A995-A998 PolarHBondContact O-N 3.13Å; M996-A998 VanDerWaalsContact C-N 3.32Å; M996-A998 PolarHBondContact O-N 3.01Å; A998-I1000 PolarHBondContact O-N 3.46Å; A998-L1001 PolarHBondContact O-N 3.42Å; A998-L1002 WeakPolarHBondContact O-CB 3.21Å; A998-L1002 PolarHBondContact O-N 3.02Å
999	A	96.1	Very high	91.3	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-40	175.7	0	0	0	0	0	112.5	I778 F869 I873 A995 M996 L1002 M1003 L1023	I778-A999 HydrophobicContact CD1-CB 4.48Å; I778-A999 HydrophobicContact CG2-CB 4.07Å; F869-A999 HydrophobicContact CZ-CB 4.27Å; I873-A999 HydrophobicContact CD1-CB 4.05Å; A995-A999 PolarHBondContact O-N 2.91Å; A995-A999 VanDerWaalsContact O-N 3.09Å; M996-A999 PolarHBondContact O-N 2.92Å; A999-L1002 PolarHBondContact O-N 2.83Å; A999-M1003 PolarHBondContact O-N 3.21Å; A999-L1023 HydrophobicContact CB-CD1 4.08Å; A999-L1023 HydrophobicContact CB-CD2 4.26Å
1000	I	95.6	Very high	91.2	Very high	5 Å²	5	18.1 Å²	18.1	3%	0.026	10%	0.098	C	C	.	.	H	α-helix	trans	-68.3	-36.3	177.4	-67.6	161.3	0	0	0	112	M996 M997 A998 S1004 Q1020 L1023 L1024 F1027 L1059	M996-I1000 WeakPolarHBondContact O-CD1 3.12Å; M996-I1000 VanDerWaalsContact O-CG1 3.28Å; M996-I1000 WeakPolarHBondContact O-CG1 3.47Å; M996-I1000 PolarHBondContact O-N 3.46Å; M997-I1000 PolarHBondContact O-N 2.93Å; A998-I1000 PolarHBondContact O-N 3.46Å; I1000-S1004 PolarHBondContact O-OG 3.25Å; I1000-S1004 VanDerWaalsContact O-OG 3.13Å; I1000-Q1020 HydrophobicContact CG2-CG 4.33Å; I1000-Q1020 PolarHBondContact O-NE2 3.25Å; I1000-Q1020 VanDerWaalsContact O-NE2 3.1Å; I1000-L1023 HydrophobicContact CG1-CB 3.89Å; I1000-L1024 HydrophobicContact CD1-CD2 3.93Å; I1000-L1024 HydrophobicContact CD1-CG 4.34Å; I1000-L1024 HydrophobicContact CG1-CD2 4.42Å; I1000-L1024 HydrophobicContact CG1-CG 4.43Å; I1000-L1024 HydrophobicContact CG2-CD2 4.04Å; I1000-L1024 HydrophobicContact CG2-CG 4.33Å; I1000-F1027 HydrophobicContact CD1-CB 4.37Å; I1000-F1027 HydrophobicContact CD1-CD1 3.69Å; I1000-F1027 HydrophobicContact CD1-CE1 4.48Å; I1000-F1027 HydrophobicContact CD1-CG 4.44Å; I1000-L1059 HydrophobicContact CG2-CD2 4.06Å
1001	L	94.5	Very high	91.3	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-72	-28.9	175.5	-70.7	166.1	0	0	0	113	D894 L898 M997 A998 S1004 R1007 L1059 L1062 R1063	D894-L1001 HydrophobicContact CB-CB 4.29Å; D894-L1001 HydrophobicContact CB-CD1 4.17Å; D894-L1001 HydrophobicContact CB-CD2 4.2Å; D894-L1001 HydrophobicContact CB-CG 4.45Å; L898-L1001 HydrophobicContact CB-CD1 4.45Å; L898-L1001 HydrophobicContact CD2-CD1 3.85Å; M997-L1001 WeakPolarHBondContact O-CB 3.49Å; M997-L1001 WeakPolarHBondContact O-CD1 3.32Å; M997-L1001 VanDerWaalsContact O-CG 3.23Å; M997-L1001 WeakPolarHBondContact O-CG 2.99Å; M997-L1001 PolarHBondContact O-N 3.43Å; A998-L1001 PolarHBondContact O-N 3.42Å; L1001-S1004 PolarHBondContact O-OG 3.34Å; L1001-R1007 PolarHBondContact O-NH2 3.26Å; L1001-R1007 VanDerWaalsContact O-NH2 3.07Å; L1001-L1059 HydrophobicContact CD1-CD1 3.77Å; L1001-L1059 HydrophobicContact CD2-CD1 3.99Å; L1001-L1059 HydrophobicContact CD2-CG 4.32Å; L1001-L1059 HydrophobicContact CG-CD1 3.91Å; L1001-L1062 HydrophobicContact CD1-CD2 4.21Å; L1001-R1063 HydrophobicContact CD2-CG 3.59Å
1002	L	94.4	Very high	91.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-71.9	-56.9	172.6	176.4	64.8	0	0	0	111	L866 A870 I873 F876 L887 L888 C891 A998 A999 S1004	L866-L1002 HydrophobicContact CD1-CD1 4.25Å; A870-L1002 HydrophobicContact CB-CD1 4.24Å; A870-L1002 HydrophobicContact CB-CD2 3.54Å; I873-L1002 HydrophobicContact CB-CD2 4.45Å; I873-L1002 HydrophobicContact CG1-CD2 4.05Å; F876-L1002 HydrophobicContact CD2-CD1 4.37Å; F876-L1002 HydrophobicContact CD2-CD2 4.07Å; F876-L1002 HydrophobicContact CD2-CG 4.26Å; F876-L1002 HydrophobicContact CE2-CD1 3.99Å; F876-L1002 HydrophobicContact CE2-CD2 4.4Å; F876-L1002 HydrophobicContact CE2-CG 4.38Å; L887-L1002 HydrophobicContact CB-CD1 4.33Å; L887-L1002 WeakPolarHBondContact CD2-O 3.4Å; L888-L1002 HydrophobicContact CD2-CD1 4.42Å; C891-L1002 HydrophobicContact CB-CD1 4.1Å; C891-L1002 VanDerWaalsContact SG-CA 3.57Å; A998-L1002 WeakPolarHBondContact O-CB 3.21Å; A998-L1002 PolarHBondContact O-N 3.02Å; A999-L1002 PolarHBondContact O-N 2.83Å; L1002-S1004 PolarHBondContact O-N 2.96Å
1003	M	94	Very high	91.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-78.6	70.4	178.7	-59.6	-56.1	-75.8	0	0	109.8	I873 F876 L879 L887 A999 N1019 Q1020 L1023	I873-M1003 HydrophobicContact CG2-CG 4.22Å; F876-M1003 HydrophobicContact CB-SD 4.26Å; F876-M1003 HydrophobicContact CD2-SD 4.07Å; L879-M1003 HydrophobicContact CD1-CE 4.22Å; L887-M1003 HydrophobicContact CD1-SD 4.3Å; A999-M1003 PolarHBondContact O-N 3.21Å; M1003-N1019 HydrophobicContact CE-CB 3.53Å; M1003-Q1020 HydrophobicContact CB-CB 4.37Å; M1003-Q1020 WeakPolarHBondContact O-CB 3.27Å; M1003-Q1020 WeakPolarHBondContact O-CG 3.31Å; M1003-Q1020 PolarHBondContact O-NE2 3.26Å; M1003-L1023 HydrophobicContact CB-CD1 4.07Å; M1003-L1023 HydrophobicContact CG-CD1 3.88Å
1004	S	91.4	Very high	91.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.			trans	-114.9	110.4	-174.6	-79.1	0	0	0	0	111.2	L887 I1000 L1001 L1002 D1006 R1063	L887-S1004 WeakPolarHBondContact CD2-O 3.33Å; I1000-S1004 PolarHBondContact O-OG 3.25Å; I1000-S1004 VanDerWaalsContact O-OG 3.13Å; L1001-S1004 PolarHBondContact O-OG 3.34Å; L1002-S1004 PolarHBondContact O-N 2.96Å; S1004-D1006 WeakPolarHBondContact CB-OD1 3.25Å; S1004-D1006 PolarHBondContact O-N 2.87Å; S1004-R1063 PolarHBondContact OG-NH1 3.33Å
1005	P	91	Very high	91.4	Very high	14 Å²	14	31.8 Å²	31.8	9%	0.091	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-4	-176	31	-35.8	0	0	0	114.1	T108 R1007 V1013 I1016 E1017	T108-P1005 HydrophobicContact CG2-CG 4.4Å; P1005-R1007 VanDerWaalsContact C-N 3.35Å; P1005-V1013 HydrophobicContact CB-CG1 3.91Å; P1005-I1016 HydrophobicContact CB-CG2 4.11Å; P1005-E1017 HydrophobicContact CB-CB 4.14Å; P1005-E1017 HydrophobicContact CG-CB 4.15Å
1006	D	84	Confident	91.3	Very high	52 Å²	52	31.7 Å²	31.7	28%	0.278	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	12.2	-179.5	66.9	-42.2	0	0	0	114.1	S1004 R1063	S1004-D1006 WeakPolarHBondContact CB-OD1 3.25Å; S1004-D1006 PolarHBondContact O-N 2.87Å; D1006-R1063 IonicContact OD1-CZ 3.56Å; D1006-R1063 IonicContact OD1-NH2 3.74Å; D1006-R1063 PolarHBondContact OD1-NH2 3.42Å; D1006-R1063 IonicContact OD2-CZ 2.69Å; D1006-R1063 IonicContact OD2-NE 2.75Å; D1006-R1063 IonicContact OD2-NH2 2.69Å; D1006-R1063 PolarHBondContact OD2-NH2 3.26Å
1007	R	84.2	Confident	91.3	Very high	31 Å²	31	34.8 Å²	34.8	12%	0.117	19%	0.185	C	C	.	.	S	Bend	trans	-74.5	151.3	169.6	-51.3	-53.7	179	178.7	-3.7	110.4	L887 G890 D894 L1001 P1005 L1010	L887-R1007 HydrophobicContact CD2-CG 4.04Å; G890-R1007 PolarHBondContact O-NH1 2.82Å; G890-R1007 PolarHBondContact O-NH2 2.95Å; D894-R1007 IonicContact OD2-CZ 3.14Å; D894-R1007 IonicContact OD2-NH1 2.74Å; D894-R1007 PolarHBondContact OD2-NH1 2.96Å; D894-R1007 IonicContact OD2-NH2 2.73Å; D894-R1007 PolarHBondContact OD2-NH2 2.93Å; L1001-R1007 PolarHBondContact O-NH2 3.26Å; L1001-R1007 VanDerWaalsContact O-NH2 3.07Å; P1005-R1007 VanDerWaalsContact C-N 3.35Å; R1007-L1010 HydrophobicContact CB-CD1 3.9Å; R1007-L1010 HydrophobicContact CB-CD2 4.4Å; R1007-L1010 HydrophobicContact CB-CG 4.02Å; R1007-L1010 HydrophobicContact CG-CD1 4.45Å
1008	S	78.4	Confident	91.1	Very high	32 Å²	32	39.2 Å²	39.2	22%	0.224	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	149.5	172.7	48	0	0	0	0	111.2	L1010	S1008-L1010 PolarHBondContact O-N 2.84Å; S1008-L1010 VanDerWaalsContact O-N 3.08Å
1009	D	83.5	Confident	91	Very high	103 Å²	103	40.8 Å²	40.8	55%	0.551	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	21.2	165.9	-44.4	-45.9	0	0	0	116.8	R886	R886-D1009 VanDerWaalsContact CD-O 3.24Å; R886-D1009 WeakPolarHBondContact CD-O 3.48Å; R886-D1009 PolarHBondContact NE-O 3.48Å; R886-D1009 PolarHBondContact NH1-O 3.2Å
1010	L	88.2	Confident	91	Very high	20 Å²	20	41.2 Å²	41.2	11%	0.105	22%	0.219	C	C	.	.			trans	-65.2	138.8	170.9	-67.4	174.1	0	0	0	111.6	D883 R886 L887 R1007 S1008 V1013 I1016	D883-L1010 HydrophobicContact CB-CD2 4.21Å; D883-L1010 WeakPolarHBondContact OD1-CA 3.33Å; R886-L1010 HydrophobicContact CB-CD2 3.83Å; L887-L1010 HydrophobicContact CD2-CD1 4.13Å; L887-L1010 HydrophobicContact CD2-CD2 3.97Å; L887-L1010 HydrophobicContact CG-CD2 4.12Å; R1007-L1010 HydrophobicContact CB-CD1 3.9Å; R1007-L1010 HydrophobicContact CB-CD2 4.4Å; R1007-L1010 HydrophobicContact CB-CG 4.02Å; R1007-L1010 HydrophobicContact CG-CD1 4.45Å; S1008-L1010 PolarHBondContact O-N 2.84Å; S1008-L1010 VanDerWaalsContact O-N 3.08Å; L1010-V1013 HydrophobicContact CB-CG2 3.87Å; L1010-I1016 HydrophobicContact CB-CD1 4.43Å; L1010-I1016 HydrophobicContact CD1-CD1 3.88Å; L1010-I1016 HydrophobicContact CD2-CD1 3.87Å; L1010-I1016 HydrophobicContact CG-CD1 4.28Å
1011	L	90.9	Very high	90.9	Very high	99 Å²	99	44.2 Å²	44.2	52%	0.518	24%	0.235	S	C	.	.	S	Bend	trans	-88.9	-49.2	-178.9	-57.7	172.6	0	0	0	111.5	E880 D882 D883	E880-L1011 WeakPolarHBondContact OE2-CD1 3.38Å; D882-L1011 HydrophobicContact CB-CD1 4.45Å; D883-L1011 VanDerWaalsContact CG-N 3.31Å; D883-L1011 PolarHBondContact OD1-N 2.89Å; D883-L1011 WeakPolarHBondContact OD2-CA 3.42Å; D883-L1011 PolarHBondContact OD2-N 3.47Å
1012	D	91.5	Very high	90.8	Very high	62 Å²	62	47.1 Å²	47.1	33%	0.332	25%	0.25	S	S	.	.			trans	-107.5	67.2	179.9	-169.7	-2.4	0	0	0	112.3	D883 E1014 S1015 I1016	D883-D1012 PolarHBondContact OD2-N 3.4Å; D1012-E1014 PolarHBondContact O-N 3.48Å; D1012-S1015 WeakPolarHBondContact OD1-CB 3.48Å; D1012-S1015 PolarHBondContact OD1-N 2.78Å; D1012-S1015 PolarHBondContact OD1-OG 3.01Å; D1012-S1015 WeakPolarHBondContact OD2-CB 3.32Å; D1012-S1015 PolarHBondContact OD2-OG 3.23Å; D1012-I1016 WeakPolarHBondContact O-CD1 3.46Å; D1012-I1016 VanDerWaalsContact O-CG1 3.24Å; D1012-I1016 WeakPolarHBondContact O-CG1 3.35Å; D1012-I1016 PolarHBondContact O-N 2.95Å
1013	V	93.1	Very high	90.8	Very high	60 Å²	60	47.4 Å²	47.4	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-34.2	177.3	-176.3	0	0	0	0	112	P1005 L1010 I1016 E1017	P1005-V1013 HydrophobicContact CB-CG1 3.91Å; L1010-V1013 HydrophobicContact CB-CG2 3.87Å; V1013-I1016 PolarHBondContact O-N 3.08Å; V1013-E1017 WeakPolarHBondContact O-CB 3.29Å; V1013-E1017 PolarHBondContact O-N 2.96Å
1014	E	92.9	Very high	90.8	Very high	146 Å²	146	47.6 Å²	47.6	68%	0.682	25%	0.253	S	S	*	.	H	α-helix	trans	-70	-45.5	-176	-177	171.4	-176.9	0	0	111.8	D1012 I1016 E1017 N1018	D1012-E1014 PolarHBondContact O-N 3.48Å; E1014-I1016 VanDerWaalsContact C-N 3.32Å; E1014-I1016 PolarHBondContact O-N 2.85Å; E1014-E1017 PolarHBondContact O-N 3.29Å; E1014-N1018 VanDerWaalsContact O-CB 3.31Å; E1014-N1018 WeakPolarHBondContact O-CB 3.35Å; E1014-N1018 VanDerWaalsContact O-CG 3.27Å; E1014-N1018 PolarHBondContact O-N 2.84Å; E1014-N1018 PolarHBondContact O-ND2 3.48Å
1015	S	93.3	Very high	90.8	Very high	41 Å²	41	52.3 Å²	52.3	29%	0.287	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-37.8	173.9	-65.3	0	0	0	0	112	D1012 N1019	D1012-S1015 WeakPolarHBondContact OD1-CB 3.48Å; D1012-S1015 PolarHBondContact OD1-N 2.78Å; D1012-S1015 PolarHBondContact OD1-OG 3.01Å; D1012-S1015 WeakPolarHBondContact OD2-CB 3.32Å; D1012-S1015 PolarHBondContact OD2-OG 3.23Å; S1015-N1019 WeakPolarHBondContact O-CB 3.17Å; S1015-N1019 PolarHBondContact O-N 3.26Å; S1015-N1019 PolarHBondContact O-ND2 3.28Å
1016	I	94.2	Very high	90.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-46.5	178	-65	165.8	0	0	0	110.6	L879 D883 L887 P1005 L1010 D1012 V1013 E1014 N1019 Q1020	L879-I1016 HydrophobicContact CD1-CD1 4.2Å; L879-I1016 HydrophobicContact CD1-CG1 3.81Å; L879-I1016 HydrophobicContact CD2-CD1 4.4Å; L879-I1016 HydrophobicContact CD2-CG1 3.79Å; L879-I1016 HydrophobicContact CG-CG1 4.48Å; D883-I1016 HydrophobicContact CB-CD1 4.49Å; L887-I1016 HydrophobicContact CD1-CD1 4Å; L887-I1016 HydrophobicContact CD1-CG1 4.19Å; L887-I1016 HydrophobicContact CD1-CG2 4.47Å; L887-I1016 HydrophobicContact CD2-CD1 4.33Å; L887-I1016 HydrophobicContact CD2-CG2 4.29Å; L887-I1016 HydrophobicContact CG-CD1 4.39Å; P1005-I1016 HydrophobicContact CB-CG2 4.11Å; L1010-I1016 HydrophobicContact CB-CD1 4.43Å; L1010-I1016 HydrophobicContact CD1-CD1 3.88Å; L1010-I1016 HydrophobicContact CD2-CD1 3.87Å; L1010-I1016 HydrophobicContact CG-CD1 4.28Å; D1012-I1016 WeakPolarHBondContact O-CD1 3.46Å; D1012-I1016 VanDerWaalsContact O-CG1 3.24Å; D1012-I1016 WeakPolarHBondContact O-CG1 3.35Å; D1012-I1016 PolarHBondContact O-N 2.95Å; V1013-I1016 PolarHBondContact O-N 3.08Å; E1014-I1016 VanDerWaalsContact C-N 3.32Å; E1014-I1016 PolarHBondContact O-N 2.85Å; I1016-N1019 PolarHBondContact O-N 2.73Å; I1016-Q1020 WeakPolarHBondContact O-CB 2.96Å; I1016-Q1020 PolarHBondContact O-N 3.1Å
1017	E	94	Very high	91.4	Very high	65 Å²	65	49.2 Å²	49.2	30%	0.304	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-42	176.7	178.1	165.3	-158.6	0	0	111.9	P1005 V1013 E1014 N1019 Q1020 N1021	P1005-E1017 HydrophobicContact CB-CB 4.14Å; P1005-E1017 HydrophobicContact CG-CB 4.15Å; V1013-E1017 WeakPolarHBondContact O-CB 3.29Å; V1013-E1017 PolarHBondContact O-N 2.96Å; E1014-E1017 PolarHBondContact O-N 3.29Å; E1017-N1019 PolarHBondContact O-N 2.93Å; E1017-Q1020 PolarHBondContact O-N 3.42Å; E1017-N1021 VanDerWaalsContact CG-ND2 3.33Å; E1017-N1021 WeakPolarHBondContact CG-ND2 3.33Å; E1017-N1021 WeakPolarHBondContact O-CB 3.23Å; E1017-N1021 VanDerWaalsContact O-CG 3.31Å; E1017-N1021 PolarHBondContact O-N 3.03Å; E1017-N1021 PolarHBondContact O-ND2 3.37Å; E1017-N1021 VanDerWaalsContact O-ND2 3.13Å
1018	N	93.3	Very high	91.8	Very high	93 Å²	93	48.6 Å²	48.6	50%	0.497	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-44.3	176.3	-78.8	-40.8	0	0	0	112.3	E1014 N1021 N1022	E1014-N1018 VanDerWaalsContact O-CB 3.31Å; E1014-N1018 WeakPolarHBondContact O-CB 3.35Å; E1014-N1018 VanDerWaalsContact O-CG 3.27Å; E1014-N1018 PolarHBondContact O-N 2.84Å; E1014-N1018 PolarHBondContact O-ND2 3.48Å; N1018-N1021 PolarHBondContact O-N 3.21Å; N1018-N1022 PolarHBondContact O-N 2.96Å; N1018-N1022 VanDerWaalsContact O-N 3.11Å
1019	N	92.9	Very high	92.4	Very high	33 Å²	33	48.8 Å²	48.8	18%	0.176	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-43	174.1	-77.7	-61.6	0	0	0	111.8	M1003 S1015 I1016 E1017 N1021 N1022 L1023	M1003-N1019 HydrophobicContact CE-CB 3.53Å; S1015-N1019 WeakPolarHBondContact O-CB 3.17Å; S1015-N1019 PolarHBondContact O-N 3.26Å; S1015-N1019 PolarHBondContact O-ND2 3.28Å; I1016-N1019 PolarHBondContact O-N 2.73Å; E1017-N1019 PolarHBondContact O-N 2.93Å; N1019-N1021 VanDerWaalsContact C-N 3.35Å; N1019-N1021 PolarHBondContact O-N 2.87Å; N1019-N1022 PolarHBondContact O-N 2.79Å; N1019-L1023 WeakPolarHBondContact O-CG 3.25Å; N1019-L1023 PolarHBondContact O-N 2.9Å; N1019-L1023 VanDerWaalsContact O-N 3.09Å
1020	Q	94.8	Very high	92.7	Very high	9 Å²	9	45.1 Å²	45.1	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-43.1	176.3	-164.8	-175.8	57.7	0	0	112	I1000 M1003 I1016 E1017 N1022 L1023 L1024	I1000-Q1020 HydrophobicContact CG2-CG 4.33Å; I1000-Q1020 PolarHBondContact O-NE2 3.25Å; I1000-Q1020 VanDerWaalsContact O-NE2 3.1Å; M1003-Q1020 HydrophobicContact CB-CB 4.37Å; M1003-Q1020 WeakPolarHBondContact O-CB 3.27Å; M1003-Q1020 WeakPolarHBondContact O-CG 3.31Å; M1003-Q1020 PolarHBondContact O-NE2 3.26Å; I1016-Q1020 WeakPolarHBondContact O-CB 2.96Å; I1016-Q1020 PolarHBondContact O-N 3.1Å; E1017-Q1020 PolarHBondContact O-N 3.42Å; Q1020-N1022 PolarHBondContact O-N 3.48Å; Q1020-L1023 WeakPolarHBondContact O-CB 3.42Å; Q1020-L1023 PolarHBondContact O-N 3.12Å; Q1020-L1024 HydrophobicContact CG-CD1 4.02Å; Q1020-L1024 HydrophobicContact CG-CG 4.43Å; Q1020-L1024 WeakPolarHBondContact O-CB 3.24Å; Q1020-L1024 WeakPolarHBondContact O-CG 3.3Å; Q1020-L1024 PolarHBondContact O-N 2.9Å
1021	N	93.7	Very high	92.8	Very high	68 Å²	68	44.2 Å²	44.2	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-41.5	179.2	-79.1	-38.8	0	0	0	111.7	E1017 N1018 N1019 L1024 E1025	E1017-N1021 VanDerWaalsContact CG-ND2 3.33Å; E1017-N1021 WeakPolarHBondContact CG-ND2 3.33Å; E1017-N1021 WeakPolarHBondContact O-CB 3.23Å; E1017-N1021 VanDerWaalsContact O-CG 3.31Å; E1017-N1021 PolarHBondContact O-N 3.03Å; E1017-N1021 PolarHBondContact O-ND2 3.37Å; E1017-N1021 VanDerWaalsContact O-ND2 3.13Å; N1018-N1021 PolarHBondContact O-N 3.21Å; N1019-N1021 VanDerWaalsContact C-N 3.35Å; N1019-N1021 PolarHBondContact O-N 2.87Å; N1021-L1024 PolarHBondContact O-N 2.77Å; N1021-E1025 WeakPolarHBondContact O-CB 3.27Å; N1021-E1025 PolarHBondContact O-N 3.14Å
1022	N	92.6	Very high	92.6	Very high	61 Å²	61	41.4 Å²	41.4	33%	0.326	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-43.8	173.7	-175.4	31.7	0	0	0	112.2	N1018 N1019 Q1020 E1025 T1026	N1018-N1022 PolarHBondContact O-N 2.96Å; N1018-N1022 VanDerWaalsContact O-N 3.11Å; N1019-N1022 PolarHBondContact O-N 2.79Å; Q1020-N1022 PolarHBondContact O-N 3.48Å; N1022-E1025 PolarHBondContact O-N 3.36Å; N1022-T1026 VanDerWaalsContact O-CB 3.26Å; N1022-T1026 WeakPolarHBondContact O-CB 3.28Å; N1022-T1026 PolarHBondContact O-N 2.96Å; N1022-T1026 PolarHBondContact O-OG1 3.07Å
1023	L	94.9	Very high	92.2	Very high	7 Å²	7	43 Å²	43	4%	0.037	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-45.6	175.4	-68.3	169.9	0	0	0	112	L774 I778 M996 A999 I1000 M1003 N1019 Q1020 F1027	L774-L1023 HydrophobicContact CD2-CD2 4.5Å; I778-L1023 HydrophobicContact CD1-CD2 3.38Å; M996-L1023 HydrophobicContact CE-CD2 4.42Å; A999-L1023 HydrophobicContact CB-CD1 4.08Å; A999-L1023 HydrophobicContact CB-CD2 4.26Å; I1000-L1023 HydrophobicContact CG1-CB 3.89Å; M1003-L1023 HydrophobicContact CB-CD1 4.07Å; M1003-L1023 HydrophobicContact CG-CD1 3.88Å; N1019-L1023 WeakPolarHBondContact O-CG 3.25Å; N1019-L1023 PolarHBondContact O-N 2.9Å; N1019-L1023 VanDerWaalsContact O-N 3.09Å; Q1020-L1023 WeakPolarHBondContact O-CB 3.42Å; Q1020-L1023 PolarHBondContact O-N 3.12Å; L1023-F1027 VanDerWaalsContact O-CB 3.26Å; L1023-F1027 WeakPolarHBondContact O-CB 3.35Å; L1023-F1027 PolarHBondContact O-N 3.44Å
1024	L	94.2	Very high	91.8	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-44.1	177.7	-79	166.2	0	0	0	112.1	W104 I107 I1000 Q1020 N1021 F1027 N1028 W1052 I1056	W104-L1024 HydrophobicContact CZ3-CB 4.28Å; W104-L1024 HydrophobicContact CZ3-CD1 4.5Å; W104-L1024 HydrophobicContact CZ3-CD2 4.5Å; I107-L1024 HydrophobicContact CD1-CD1 3.96Å; I107-L1024 HydrophobicContact CD1-CD2 3.96Å; I1000-L1024 HydrophobicContact CD1-CD2 3.93Å; I1000-L1024 HydrophobicContact CD1-CG 4.34Å; I1000-L1024 HydrophobicContact CG1-CD2 4.42Å; I1000-L1024 HydrophobicContact CG1-CG 4.43Å; I1000-L1024 HydrophobicContact CG2-CD2 4.04Å; I1000-L1024 HydrophobicContact CG2-CG 4.33Å; Q1020-L1024 HydrophobicContact CG-CD1 4.02Å; Q1020-L1024 HydrophobicContact CG-CG 4.43Å; Q1020-L1024 WeakPolarHBondContact O-CB 3.24Å; Q1020-L1024 WeakPolarHBondContact O-CG 3.3Å; Q1020-L1024 PolarHBondContact O-N 2.9Å; N1021-L1024 PolarHBondContact O-N 2.77Å; L1024-F1027 PolarHBondContact O-N 3.21Å; L1024-N1028 WeakPolarHBondContact O-CB 3.26Å; L1024-N1028 PolarHBondContact O-N 2.95Å; L1024-W1052 HydrophobicContact CD2-CH2 4.16Å; L1024-W1052 HydrophobicContact CD2-CZ2 4.27Å; L1024-W1052 VanDerWaalsContact O-CH2 3.24Å; L1024-W1052 WeakPolarHBondContact O-CH2 3.46Å; L1024-I1056 HydrophobicContact CD2-CD1 3.82Å
1025	E	91.7	Very high	91.3	Very high	100 Å²	100	36 Å²	36	47%	0.467	18%	0.178	S	C	.	.	H	α-helix	trans	-69.7	-43.7	-178.7	-154.5	-166.9	-163.2	0	0	111.6	N1021 N1022 F1027 N1028 R1029	N1021-E1025 WeakPolarHBondContact O-CB 3.27Å; N1021-E1025 PolarHBondContact O-N 3.14Å; N1022-E1025 PolarHBondContact O-N 3.36Å; E1025-F1027 VanDerWaalsContact C-N 3.33Å; E1025-F1027 PolarHBondContact O-N 3.02Å; E1025-N1028 WeakPolarHBondContact O-CB 3.31Å; E1025-N1028 PolarHBondContact O-N 3.32Å; E1025-R1029 VanDerWaalsContact CG-NH1 3.35Å; E1025-R1029 PolarHBondContact O-N 3.32Å; E1025-R1029 IonicContact OE1-NH1 3.66Å; E1025-R1029 PolarHBondContact OE1-NH1 3.4Å; E1025-R1029 IonicContact OE2-CZ 3.12Å; E1025-R1029 IonicContact OE2-NH1 3.17Å; E1025-R1029 PolarHBondContact OE2-NH1 3.36Å; E1025-R1029 IonicContact OE2-NH2 2.72Å
1026	T	93.3	Very high	90	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-44.4	173.3	-59.8	0	0	0	0	111.1	D771 L774 I775 M996 N1022 R1029 Y1030	D771-T1026 HydrophobicContact CB-CG2 4.18Å; D771-T1026 PolarHBondContact OD1-OG1 3.4Å; L774-T1026 HydrophobicContact CD2-CG2 4.16Å; I775-T1026 HydrophobicContact CD1-CG2 4.02Å; I775-T1026 HydrophobicContact CG1-CG2 3.74Å; M996-T1026 HydrophobicContact CE-CG2 4.48Å; N1022-T1026 VanDerWaalsContact O-CB 3.26Å; N1022-T1026 WeakPolarHBondContact O-CB 3.28Å; N1022-T1026 PolarHBondContact O-N 2.96Å; N1022-T1026 PolarHBondContact O-OG1 3.07Å; T1026-R1029 PolarHBondContact O-N 3.42Å; T1026-R1029 PolarHBondContact OG1-NH2 3.08Å; T1026-Y1030 WeakPolarHBondContact O-CB 3.35Å; T1026-Y1030 PolarHBondContact O-N 3.29Å
1027	F	94.6	Very high	88.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.6	-38.1	177.9	-169.7	-153.7	0	0	0	112.1	D993 M996 M997 I1000 L1023 L1024 E1025 Y1030 V1031 W1052 I1055	D993-F1027 HydrophobicContact CB-CE2 4.27Å; D993-F1027 HydrophobicContact CB-CZ 3.99Å; D993-F1027 VanDerWaalsContact OD1-CE2 3.32Å; D993-F1027 WeakPolarHBondContact OD1-CE2 3.28Å; M996-F1027 HydrophobicContact CB-CB 4.36Å; M996-F1027 HydrophobicContact CB-CD1 3.92Å; M996-F1027 HydrophobicContact CB-CD2 3.69Å; M996-F1027 HydrophobicContact CB-CE1 4.11Å; M996-F1027 HydrophobicContact CB-CE2 3.88Å; M996-F1027 HydrophobicContact CB-CG 3.73Å; M996-F1027 HydrophobicContact CB-CZ 4.1Å; M996-F1027 HydrophobicContact CE-CB 3.81Å; M996-F1027 HydrophobicContact CE-CG 4.42Å; M996-F1027 HydrophobicContact CG-CD2 3.79Å; M996-F1027 HydrophobicContact CG-CE2 4.19Å; M996-F1027 HydrophobicContact CG-CG 4.15Å; M997-F1027 HydrophobicContact CG-CE1 4.22Å; I1000-F1027 HydrophobicContact CD1-CB 4.37Å; I1000-F1027 HydrophobicContact CD1-CD1 3.69Å; I1000-F1027 HydrophobicContact CD1-CE1 4.48Å; I1000-F1027 HydrophobicContact CD1-CG 4.44Å; L1023-F1027 VanDerWaalsContact O-CB 3.26Å; L1023-F1027 WeakPolarHBondContact O-CB 3.35Å; L1023-F1027 PolarHBondContact O-N 3.44Å; L1024-F1027 PolarHBondContact O-N 3.21Å; E1025-F1027 VanDerWaalsContact C-N 3.33Å; E1025-F1027 PolarHBondContact O-N 3.02Å; F1027-Y1030 AromaticContact CD2-CD1 3.97Å; F1027-Y1030 HydrophobicContact CD2-CD1 3.97Å; F1027-Y1030 HydrophobicContact CE2-CD1 4.09Å; F1027-Y1030 HydrophobicContact CE2-CE1 4.44Å; F1027-Y1030 PolarHBondContact O-N 3.03Å; F1027-V1031 HydrophobicContact CD2-CG2 3.82Å; F1027-V1031 HydrophobicContact CE2-CG2 3.54Å; F1027-V1031 HydrophobicContact CZ-CG2 4.1Å; F1027-V1031 WeakPolarHBondContact O-CB 3.42Å; F1027-V1031 WeakPolarHBondContact O-CG2 3.49Å; F1027-V1031 PolarHBondContact O-N 3.18Å; F1027-W1052 HydrophobicContact CB-CH2 4.08Å; F1027-W1052 HydrophobicContact CB-CZ3 3.89Å; F1027-W1052 AromaticContact CD1-CH2 3.9Å; F1027-W1052 HydrophobicContact CD1-CH2 3.9Å; F1027-W1052 AromaticContact CD1-CZ3 3.46Å; F1027-W1052 HydrophobicContact CD1-CZ3 3.46Å; F1027-W1052 VanDerWaalsContact CD1-CZ3 3.46Å; F1027-W1052 HydrophobicContact CD2-CZ3 4.47Å; F1027-W1052 HydrophobicContact CE1-CZ3 4.06Å; F1027-W1052 HydrophobicContact CG-CH2 4.24Å; F1027-W1052 AromaticContact CG-CZ3 3.68Å; F1027-W1052 HydrophobicContact CG-CZ3 3.68Å; F1027-I1055 HydrophobicContact CE1-CG2 3.85Å; F1027-I1055 HydrophobicContact CZ-CG2 3.94Å
1028	N	92.7	Very high	86.3	Confident	18 Å²	18	40.7 Å²	40.7	10%	0.096	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-46.2	173.4	-178.4	28.2	0	0	0	111.9	L1024 E1025 Y1030 V1031 N1032 W1052	L1024-N1028 WeakPolarHBondContact O-CB 3.26Å; L1024-N1028 PolarHBondContact O-N 2.95Å; E1025-N1028 WeakPolarHBondContact O-CB 3.31Å; E1025-N1028 PolarHBondContact O-N 3.32Å; N1028-Y1030 VanDerWaalsContact C-N 3.33Å; N1028-Y1030 PolarHBondContact O-N 2.85Å; N1028-V1031 PolarHBondContact O-N 3.27Å; N1028-N1032 WeakPolarHBondContact O-CB 3.3Å; N1028-N1032 PolarHBondContact O-N 3.07Å; N1028-N1032 PolarHBondContact O-ND2 3.36Å; N1028-N1032 VanDerWaalsContact O-ND2 3.12Å; N1028-N1032 PolarHBondContact OD1-ND2 3.07Å; N1028-W1052 HydrophobicContact CB-CD2 3.8Å; N1028-W1052 HydrophobicContact CB-CE3 4.01Å; N1028-W1052 HydrophobicContact CB-CG 4.42Å; N1028-W1052 HydrophobicContact CB-CH2 3.92Å; N1028-W1052 HydrophobicContact CB-CZ2 3.76Å; N1028-W1052 HydrophobicContact CB-CZ3 4.05Å; N1028-W1052 VanDerWaalsContact OD1-CG 3.27Å
1029	R	89.5	Confident	84.2	Confident	35 Å²	35	43.6 Å²	43.6	13%	0.132	21%	0.209	C	C	.	.	H	α-helix	trans	-57.4	-45.9	173.1	-74	-169.6	-74.1	-94	-2.9	111	F765 W767 D771 E1025 T1026 R1033	F765-R1029 HydrophobicContact CD1-CG 4Å; F765-R1029 HydrophobicContact CE1-CG 4.28Å; W767-R1029 HydrophobicContact CE3-CB 4.11Å; W767-R1029 HydrophobicContact CZ3-CB 4.26Å; D771-R1029 VanDerWaalsContact CG-NE 3.27Å; D771-R1029 IonicContact OD1-CZ 3.29Å; D771-R1029 IonicContact OD1-NE 3.23Å; D771-R1029 PolarHBondContact OD1-NE 2.97Å; D771-R1029 IonicContact OD1-NH2 3.24Å; D771-R1029 PolarHBondContact OD1-NH2 2.79Å; D771-R1029 IonicContact OD2-CZ 2.92Å; D771-R1029 IonicContact OD2-NE 2.99Å; D771-R1029 PolarHBondContact OD2-NE 3.43Å; D771-R1029 VanDerWaalsContact OD2-NE 3.1Å; E1025-R1029 VanDerWaalsContact CG-NH1 3.35Å; E1025-R1029 PolarHBondContact O-N 3.32Å; E1025-R1029 IonicContact OE1-NH1 3.66Å; E1025-R1029 PolarHBondContact OE1-NH1 3.4Å; E1025-R1029 IonicContact OE2-CZ 3.12Å; E1025-R1029 IonicContact OE2-NH1 3.17Å; E1025-R1029 PolarHBondContact OE2-NH1 3.36Å; E1025-R1029 IonicContact OE2-NH2 2.72Å; T1026-R1029 PolarHBondContact O-N 3.42Å; T1026-R1029 PolarHBondContact OG1-NH2 3.08Å; R1029-R1033 VanDerWaalsContact O-CB 3.3Å; R1029-R1033 WeakPolarHBondContact O-CB 3.31Å; R1029-R1033 PolarHBondContact O-N 3.06Å
1030	Y	91.3	Very high	81.9	Confident	27 Å²	27	51.3 Å²	51.3	11%	0.106	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-51.9	178.2	169.8	-95.3	0	0	0	113.1	W767 I775 T992 T1026 F1027 N1028 N1032 R1033 T1034 R1035	W767-Y1030 HydrophobicContact CH2-CD2 4.33Å; I775-Y1030 HydrophobicContact CD1-CD1 4.28Å; I775-Y1030 HydrophobicContact CD1-CD2 3.54Å; I775-Y1030 HydrophobicContact CD1-CE2 4.42Å; I775-Y1030 HydrophobicContact CD1-CG 3.45Å; I775-Y1030 VanDerWaalsContact CD1-CG 3.45Å; I775-Y1030 HydrophobicContact CG2-CD2 4.5Å; T992-Y1030 WeakPolarHBondContact CB-OH 3.39Å; T992-Y1030 HydrophobicContact CG2-CE1 3.81Å; T992-Y1030 HydrophobicContact CG2-CE2 3.94Å; T992-Y1030 VanDerWaalsContact CG2-CZ 3.41Å; T992-Y1030 VanDerWaalsContact CG2-OH 3.3Å; T992-Y1030 WeakPolarHBondContact CG2-OH 3.46Å; T1026-Y1030 WeakPolarHBondContact O-CB 3.35Å; T1026-Y1030 PolarHBondContact O-N 3.29Å; F1027-Y1030 AromaticContact CD2-CD1 3.97Å; F1027-Y1030 HydrophobicContact CD2-CD1 3.97Å; F1027-Y1030 HydrophobicContact CE2-CD1 4.09Å; F1027-Y1030 HydrophobicContact CE2-CE1 4.44Å; F1027-Y1030 PolarHBondContact O-N 3.03Å; N1028-Y1030 VanDerWaalsContact C-N 3.33Å; N1028-Y1030 PolarHBondContact O-N 2.85Å; Y1030-N1032 VanDerWaalsContact C-N 3.3Å; Y1030-N1032 PolarHBondContact O-N 3.27Å; Y1030-R1033 WeakPolarHBondContact O-CB 3.4Å; Y1030-R1033 PolarHBondContact O-N 3.23Å; Y1030-R1033 VanDerWaalsContact O-N 3.1Å; Y1030-T1034 HydrophobicContact CD2-CG2 3.88Å; Y1030-T1034 HydrophobicContact CE1-CG2 4.42Å; Y1030-T1034 HydrophobicContact CE2-CG2 3.52Å; Y1030-T1034 HydrophobicContact CG-CG2 4.48Å; Y1030-T1034 PolarHBondContact O-N 3.11Å; Y1030-T1034 PolarHBondContact O-OG1 3.11Å; Y1030-R1035 PolarHBondContact OH-NH2 3.17Å
1031	V	89.9	Confident	79.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.9	-41	179.9	167.9	0	0	0	0	111.2	F1027 N1028 R1033 R1035 C1051 W1052 I1055	F1027-V1031 HydrophobicContact CD2-CG2 3.82Å; F1027-V1031 HydrophobicContact CE2-CG2 3.54Å; F1027-V1031 HydrophobicContact CZ-CG2 4.1Å; F1027-V1031 WeakPolarHBondContact O-CB 3.42Å; F1027-V1031 WeakPolarHBondContact O-CG2 3.49Å; F1027-V1031 PolarHBondContact O-N 3.18Å; N1028-V1031 PolarHBondContact O-N 3.27Å; V1031-R1033 VanDerWaalsContact C-N 3.34Å; V1031-R1035 HydrophobicContact CG1-CB 4.44Å; V1031-R1035 HydrophobicContact CG1-CG 4.43Å; V1031-R1035 CarbonylContact O-C 3.57Å; V1031-R1035 VanDerWaalsContact O-CA 3.28Å; V1031-R1035 WeakPolarHBondContact O-CA 3.46Å; V1031-R1035 VanDerWaalsContact O-CB 3.24Å; V1031-R1035 WeakPolarHBondContact O-CB 3.3Å; V1031-R1035 PolarHBondContact O-N 3.36Å; V1031-C1051 HydrophobicContact CG1-CB 3.94Å; V1031-W1052 HydrophobicContact CB-CE3 4.26Å; V1031-W1052 HydrophobicContact CG1-CB 4.23Å; V1031-W1052 HydrophobicContact CG2-CE3 4.18Å; V1031-I1055 HydrophobicContact CG1-CD1 3.81Å; V1031-I1055 HydrophobicContact CG2-CD1 3.81Å
1032	N	85.9	Confident	77.3	Confident	41 Å²	41	54.3 Å²	54.3	22%	0.219	28%	0.281	C	S	.	.	H	α-helix	trans	-71.8	-29.3	178.1	-68.5	-33.9	0	0	0	112.6	F765 N1028 Y1030 G1036	F765-N1032 HydrophobicContact CE1-CB 4.29Å; F765-N1032 WeakPolarHBondContact CE1-ND2 3.32Å; F765-N1032 VanDerWaalsContact CZ-ND2 3.34Å; F765-N1032 WeakPolarHBondContact CZ-ND2 3.42Å; N1028-N1032 WeakPolarHBondContact O-CB 3.3Å; N1028-N1032 PolarHBondContact O-N 3.07Å; N1028-N1032 PolarHBondContact O-ND2 3.36Å; N1028-N1032 VanDerWaalsContact O-ND2 3.12Å; N1028-N1032 PolarHBondContact OD1-ND2 3.07Å; Y1030-N1032 VanDerWaalsContact C-N 3.3Å; Y1030-N1032 PolarHBondContact O-N 3.27Å; N1032-G1036 VanDerWaalsContact O-CA 3.24Å; N1032-G1036 WeakPolarHBondContact O-CA 3.39Å; N1032-G1036 PolarHBondContact O-N 2.8Å
1033	R	84.4	Confident	75.4	Confident	94 Å²	94	57.5 Å²	57.5	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-71.1	-62.7	172.7	-172.7	177.8	-177	-139.3	2.4	111.1	W767 Q772 R1029 Y1030 V1031 Q1037	W767-R1033 VanDerWaalsContact NE1-NH1 3.16Å; Q772-R1033 VanDerWaalsContact OE1-NH1 3.12Å; R1029-R1033 VanDerWaalsContact O-CB 3.3Å; R1029-R1033 WeakPolarHBondContact O-CB 3.31Å; R1029-R1033 PolarHBondContact O-N 3.06Å; Y1030-R1033 WeakPolarHBondContact O-CB 3.4Å; Y1030-R1033 PolarHBondContact O-N 3.23Å; Y1030-R1033 VanDerWaalsContact O-N 3.1Å; V1031-R1033 VanDerWaalsContact C-N 3.34Å; R1033-Q1037 WeakPolarHBondContact O-CB 3.38Å; R1033-Q1037 WeakPolarHBondContact O-CG 3.49Å; R1033-Q1037 PolarHBondContact O-N 3.29Å
1034	T	84.8	Confident	73.1	Confident	38 Å²	38	60.6 Å²	60.6	23%	0.233	31%	0.309	C	S	.	.	H	α-helix	trans	-66.7	-56.3	-175.9	56.7	0	0	0	0	111.5	Y1030 G1036 I1038	Y1030-T1034 HydrophobicContact CD2-CG2 3.88Å; Y1030-T1034 HydrophobicContact CE1-CG2 4.42Å; Y1030-T1034 HydrophobicContact CE2-CG2 3.52Å; Y1030-T1034 HydrophobicContact CG-CG2 4.48Å; Y1030-T1034 PolarHBondContact O-N 3.11Å; Y1030-T1034 PolarHBondContact O-OG1 3.11Å; T1034-G1036 PolarHBondContact O-N 2.83Å; T1034-G1036 VanDerWaalsContact O-N 3.17Å; T1034-I1038 WeakPolarHBondContact O-CD1 3.28Å; T1034-I1038 WeakPolarHBondContact O-CG1 3.08Å
1035	R	82.2	Confident	71.2	Confident	21 Å²	21	64.5 Å²	64.5	8%	0.079	34%	0.335	C	S	.	.	H	α-helix	trans	-84	13.3	-176	-34.8	-166.8	-167.4	-74	-23.7	111.9	D990 D993 Y1030 V1031 S1048	D990-R1035 VanDerWaalsContact CG-NH2 3.27Å; D990-R1035 IonicContact OD1-NH2 2.79Å; D990-R1035 PolarHBondContact OD1-NH2 2.67Å; D990-R1035 IonicContact OD2-CZ 3.84Å; D990-R1035 IonicContact OD2-NH1 2.66Å; D990-R1035 PolarHBondContact OD2-NH1 3.35Å; D990-R1035 IonicContact OD2-NH2 2.68Å; D990-R1035 PolarHBondContact OD2-NH2 3.26Å; D993-R1035 IonicContact OD1-CZ 2.71Å; D993-R1035 VanDerWaalsContact OD1-CZ 3.29Å; D993-R1035 IonicContact OD1-NE 2.77Å; D993-R1035 PolarHBondContact OD1-NE 2.92Å; D993-R1035 IonicContact OD1-NH2 3.1Å; D993-R1035 PolarHBondContact OD1-NH2 3.03Å; D993-R1035 IonicContact OD2-CZ 2.92Å; D993-R1035 IonicContact OD2-NE 2.64Å; D993-R1035 PolarHBondContact OD2-NE 3.35Å; D993-R1035 IonicContact OD2-NH1 2.91Å; D993-R1035 IonicContact OD2-NH2 3.19Å; D993-R1035 PolarHBondContact OD2-NH2 2.61Å; Y1030-R1035 PolarHBondContact OH-NH2 3.17Å; V1031-R1035 HydrophobicContact CG1-CB 4.44Å; V1031-R1035 HydrophobicContact CG1-CG 4.43Å; V1031-R1035 CarbonylContact O-C 3.57Å; V1031-R1035 VanDerWaalsContact O-CA 3.28Å; V1031-R1035 WeakPolarHBondContact O-CA 3.46Å; V1031-R1035 VanDerWaalsContact O-CB 3.24Å; V1031-R1035 WeakPolarHBondContact O-CB 3.3Å; V1031-R1035 PolarHBondContact O-N 3.36Å; R1035-S1048 WeakPolarHBondContact O-CB 3.38Å
1036	G	65.2	Low	69.6	Low	12 Å²	12	60.6 Å²	60.6	12%	0.124	32%	0.318	C	S	.	.	H	α-helix	trans	-117.3	-32	168.6	0	0	0	0	0	115.7	N1032 T1034 I1038 K1039	N1032-G1036 VanDerWaalsContact O-CA 3.24Å; N1032-G1036 WeakPolarHBondContact O-CA 3.39Å; N1032-G1036 PolarHBondContact O-N 2.8Å; T1034-G1036 PolarHBondContact O-N 2.83Å; T1034-G1036 VanDerWaalsContact O-N 3.17Å; G1036-I1038 PolarHBondContact O-N 3.16Å; G1036-K1039 WeakPolarHBondContact O-CB 3.34Å; G1036-K1039 VanDerWaalsContact O-CG 3.3Å; G1036-K1039 WeakPolarHBondContact O-CG 3.45Å; G1036-K1039 PolarHBondContact O-N 3.07Å
1037	Q	56.1	Low	67.9	Low	137 Å²	137	63.3 Å²	63.3	64%	0.64	34%	0.337	S	S	*	.	H	α-helix	trans	-63	-29.3	168.9	-76.2	172.3	-0.9	0	0	112.1	R1033 K1039	R1033-Q1037 WeakPolarHBondContact O-CB 3.38Å; R1033-Q1037 WeakPolarHBondContact O-CG 3.49Å; R1033-Q1037 PolarHBondContact O-N 3.29Å; Q1037-K1039 PolarHBondContact O-N 2.96Å
1038	I	54.1	Low	66.3	Low	56 Å²	56	64 Å²	64	29%	0.287	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-61.7	-7.4	176.7	-70.8	169.6	0	0	0	113.9	T1034 G1036 Q1040 S1041 Y1044	T1034-I1038 WeakPolarHBondContact O-CD1 3.28Å; T1034-I1038 WeakPolarHBondContact O-CG1 3.08Å; G1036-I1038 PolarHBondContact O-N 3.16Å; I1038-Q1040 PolarHBondContact O-N 3.48Å; I1038-S1041 PolarHBondContact O-N 2.89Å; I1038-S1041 VanDerWaalsContact O-N 3.09Å; I1038-S1041 PolarHBondContact O-OG 2.98Å; I1038-Y1044 HydrophobicContact CD1-CE2 4.45Å; I1038-Y1044 HydrophobicContact CG2-CD2 3.5Å; I1038-Y1044 HydrophobicContact CG2-CE2 3.95Å; I1038-Y1044 HydrophobicContact CG2-CG 4.16Å
1039	K	49.7	Very low	65	Low	155 Å²	155	67.3 Å²	67.3	67%	0.674	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-53	-21.4	174.5	-81.2	174.4	-179.1	163.3	0	115.1	G1036 Q1037 S1048	G1036-K1039 WeakPolarHBondContact O-CB 3.34Å; G1036-K1039 VanDerWaalsContact O-CG 3.3Å; G1036-K1039 WeakPolarHBondContact O-CG 3.45Å; G1036-K1039 PolarHBondContact O-N 3.07Å; Q1037-K1039 PolarHBondContact O-N 2.96Å; K1039-S1048 WeakPolarHBondContact CE-OG 3.44Å; K1039-S1048 PolarHBondContact NZ-OG 2.8Å; K1039-S1048 VanDerWaalsContact NZ-OG 3.15Å
1040	Q	43.4	Very low	64.2	Low	195 Å²	195	70 Å²	70	91%	0.911	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-85.5	-12.6	-179.3	-65	-177.7	0.1	0	0	114.7	I1038	I1038-Q1040 PolarHBondContact O-N 3.48Å
1041	S	46.1	Very low	63.9	Low	72 Å²	72	69 Å²	69	50%	0.503	38%	0.377	S	S	.	.	S	Bend	trans	-102.2	-3.2	-174.7	67.4	0	0	0	0	115.6	I1038 L1043	I1038-S1041 PolarHBondContact O-N 2.89Å; I1038-S1041 VanDerWaalsContact O-N 3.09Å; I1038-S1041 PolarHBondContact O-OG 2.98Å; S1041-L1043 PolarHBondContact O-N 3.32Å
1042	G	46.8	Very low	63.9	Low	67 Å²	67	70.1 Å²	70.1	69%	0.691	38%	0.382	S	S	*	.			trans	65	5	175.8	0	0	0	0	0	116.1	Y1044	G1042-Y1044 PolarHBondContact O-N 3.01Å
1043	L	53.5	Low	64.1	Low	128 Å²	128	70.1 Å²	70.1	67%	0.67	38%	0.383	S	S	*	.			trans	-91.5	3.5	-163.4	-140.6	72.6	0	0	0	115.1	S1041	S1041-L1043 PolarHBondContact O-N 3.32Å
1044	Y	45	Very low	64.3	Low	73 Å²	73	70 Å²	70	29%	0.286	38%	0.383	S	S	.	.			trans	-129.4	123.2	-171.1	-88.6	-104.2	0	0	0	113	N988 I1038 G1042 V1046	N988-Y1044 HydrophobicContact CB-CE1 3.79Å; N988-Y1044 WeakPolarHBondContact CB-OH 3.48Å; N988-Y1044 WeakPolarHBondContact ND2-CE1 3.26Å; N988-Y1044 PolarHBondContact ND2-OH 3.01Å; I1038-Y1044 HydrophobicContact CD1-CE2 4.45Å; I1038-Y1044 HydrophobicContact CG2-CD2 3.5Å; I1038-Y1044 HydrophobicContact CG2-CE2 3.95Å; I1038-Y1044 HydrophobicContact CG2-CG 4.16Å; G1042-Y1044 PolarHBondContact O-N 3.01Å; Y1044-V1046 PolarHBondContact O-N 3.2Å
1045	P	54.6	Low	64.7	Low	85 Å²	85	68.3 Å²	68.3	55%	0.552	37%	0.373	S	S	*	.	S	Bend	trans	-82.2	14.1	-178.6	34.5	-36.9	0	0	0	114.1
1046	V	58.4	Low	65.2	Low	18 Å²	18	68.4 Å²	68.4	11%	0.109	37%	0.374	C	S	.	.	S	Bend	trans	-123.9	121.8	178.5	-171.8	0	0	0	0	108.3	Y1044 S1048 Q1050	Y1044-V1046 PolarHBondContact O-N 3.2Å; V1046-S1048 PolarHBondContact O-N 3Å; V1046-Q1050 HydrophobicContact CG1-CB 3.85Å
1047	S	58.9	Low	66.3	Low	57 Å²	57	72.3 Å²	72.3	40%	0.399	39%	0.39	S	S	.	.			trans	-58.7	133.4	170.3	56	0	0	0	0	109.4	S1049 Q1050	S1047-S1049 PolarHBondContact O-N 3.48Å; S1047-Q1050 WeakPolarHBondContact O-CA 3.49Å; S1047-Q1050 WeakPolarHBondContact O-CB 3.2Å; S1047-Q1050 PolarHBondContact O-N 2.92Å; S1047-Q1050 WeakPolarHBondContact OG-CG 3.48Å; S1047-Q1050 PolarHBondContact OG-NE2 3.31Å
1048	S	60.1	Low	68	Low	14 Å²	14	65.8 Å²	65.8	10%	0.098	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-48.5	-38.7	-174.6	73.7	0	0	0	0	114.3	R1035 K1039 V1046 Q1050 C1051	R1035-S1048 WeakPolarHBondContact O-CB 3.38Å; K1039-S1048 WeakPolarHBondContact CE-OG 3.44Å; K1039-S1048 PolarHBondContact NZ-OG 2.8Å; K1039-S1048 VanDerWaalsContact NZ-OG 3.15Å; V1046-S1048 PolarHBondContact O-N 3Å; S1048-Q1050 PolarHBondContact O-N 3.34Å; S1048-C1051 WeakPolarHBondContact O-CB 3.44Å; S1048-C1051 PolarHBondContact O-N 3.38Å
1049	S	65.3	Low	69.9	Low	88 Å²	88	63.7 Å²	63.7	62%	0.615	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-63.2	-8	175.9	53.7	0	0	0	0	115.5	S1047	S1047-S1049 PolarHBondContact O-N 3.48Å
1050	Q	73.5	Confident	71.8	Confident	91 Å²	91	58.1 Å²	58.1	43%	0.425	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-113.8	-2.4	173.6	-66.4	-176.9	39.5	0	0	112.7	V1046 S1047 S1048 R1054	V1046-Q1050 HydrophobicContact CG1-CB 3.85Å; S1047-Q1050 WeakPolarHBondContact O-CA 3.49Å; S1047-Q1050 WeakPolarHBondContact O-CB 3.2Å; S1047-Q1050 PolarHBondContact O-N 2.92Å; S1047-Q1050 WeakPolarHBondContact OG-CG 3.48Å; S1047-Q1050 PolarHBondContact OG-NE2 3.31Å; S1048-Q1050 PolarHBondContact O-N 3.34Å; Q1050-R1054 WeakPolarHBondContact O-CB 3.46Å; Q1050-R1054 VanDerWaalsContact O-CD 3.3Å; Q1050-R1054 WeakPolarHBondContact O-CD 3.48Å; Q1050-R1054 WeakPolarHBondContact O-CG 3.35Å
1051	C	84.5	Confident	74.1	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.054	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-59.9	175	-65.9	0	0	0	0	109.6	V1031 S1048 R1054 I1055	V1031-C1051 HydrophobicContact CG1-CB 3.94Å; S1048-C1051 WeakPolarHBondContact O-CB 3.44Å; S1048-C1051 PolarHBondContact O-N 3.38Å; C1051-R1054 PolarHBondContact O-N 3.37Å; C1051-I1055 WeakPolarHBondContact O-CG1 3.07Å; C1051-I1055 PolarHBondContact O-N 3.44Å
1052	W	89.4	Confident	76.2	Confident	23 Å²	23	47 Å²	47	9%	0.087	27%	0.269	C	S	.	.	H	α-helix	trans	-50.5	-53.5	-178.6	173.2	-107.9	0	0	0	114.3	W104 L1024 F1027 N1028 V1031 R1054 I1055 I1056	W104-W1052 AromaticContact CH2-CE2 3.9Å; W104-W1052 AromaticContact CH2-CZ2 3.63Å; W104-W1052 HydrophobicContact CH2-CZ2 3.63Å; W104-W1052 AromaticContact CH2-NE1 3.61Å; W104-W1052 AromaticContact CZ3-CZ2 3.96Å; W104-W1052 HydrophobicContact CZ3-CZ2 3.96Å; L1024-W1052 HydrophobicContact CD2-CH2 4.16Å; L1024-W1052 HydrophobicContact CD2-CZ2 4.27Å; L1024-W1052 VanDerWaalsContact O-CH2 3.24Å; L1024-W1052 WeakPolarHBondContact O-CH2 3.46Å; F1027-W1052 HydrophobicContact CB-CH2 4.08Å; F1027-W1052 HydrophobicContact CB-CZ3 3.89Å; F1027-W1052 AromaticContact CD1-CH2 3.9Å; F1027-W1052 HydrophobicContact CD1-CH2 3.9Å; F1027-W1052 AromaticContact CD1-CZ3 3.46Å; F1027-W1052 HydrophobicContact CD1-CZ3 3.46Å; F1027-W1052 VanDerWaalsContact CD1-CZ3 3.46Å; F1027-W1052 HydrophobicContact CD2-CZ3 4.47Å; F1027-W1052 HydrophobicContact CE1-CZ3 4.06Å; F1027-W1052 HydrophobicContact CG-CH2 4.24Å; F1027-W1052 AromaticContact CG-CZ3 3.68Å; F1027-W1052 HydrophobicContact CG-CZ3 3.68Å; N1028-W1052 HydrophobicContact CB-CD2 3.8Å; N1028-W1052 HydrophobicContact CB-CE3 4.01Å; N1028-W1052 HydrophobicContact CB-CG 4.42Å; N1028-W1052 HydrophobicContact CB-CH2 3.92Å; N1028-W1052 HydrophobicContact CB-CZ2 3.76Å; N1028-W1052 HydrophobicContact CB-CZ3 4.05Å; N1028-W1052 VanDerWaalsContact OD1-CG 3.27Å; V1031-W1052 HydrophobicContact CB-CE3 4.26Å; V1031-W1052 HydrophobicContact CG1-CB 4.23Å; V1031-W1052 HydrophobicContact CG2-CE3 4.18Å; W1052-R1054 PolarHBondContact O-N 3.16Å; W1052-I1055 PolarHBondContact O-N 3.47Å; W1052-I1055 VanDerWaalsContact O-N 3.17Å; W1052-I1056 HydrophobicContact CD2-CG1 4.1Å; W1052-I1056 HydrophobicContact CE3-CG1 4.36Å; W1052-I1056 HydrophobicContact CH2-CD1 3.59Å; W1052-I1056 HydrophobicContact CH2-CG1 3.86Å; W1052-I1056 HydrophobicContact CZ2-CD1 3.64Å; W1052-I1056 HydrophobicContact CZ2-CG1 3.5Å; W1052-I1056 HydrophobicContact CZ3-CD1 4.16Å; W1052-I1056 HydrophobicContact CZ3-CG1 4.26Å; W1052-I1056 PolarHBondContact O-N 2.93Å
1053	P	89.8	Confident	78.3	Confident	40 Å²	40	44.9 Å²	44.9	26%	0.26	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-29	178.8	-25.2	35.3	0	0	0	114.5	Y103 M1057	Y103-P1053 HydrophobicContact CE1-CB 4.17Å; P1053-M1057 VanDerWaalsContact O-CB 3.25Å; P1053-M1057 WeakPolarHBondContact O-CB 3.37Å; P1053-M1057 PolarHBondContact O-N 3.33Å
1054	R	89.2	Confident	79.8	Confident	93 Å²	93	41.5 Å²	41.5	35%	0.351	23%	0.227	S	C	.	.	H	α-helix	trans	-80.7	-33	178.2	-68	175.4	-171.8	-157.5	6.7	112.3	L987 Q1050 C1051 W1052 T1058	L987-R1054 HydrophobicContact CD1-CB 4.06Å; L987-R1054 HydrophobicContact CD2-CB 3.65Å; L987-R1054 HydrophobicContact CD2-CG 4.48Å; Q1050-R1054 WeakPolarHBondContact O-CB 3.46Å; Q1050-R1054 VanDerWaalsContact O-CD 3.3Å; Q1050-R1054 WeakPolarHBondContact O-CD 3.48Å; Q1050-R1054 WeakPolarHBondContact O-CG 3.35Å; C1051-R1054 PolarHBondContact O-N 3.37Å; W1052-R1054 PolarHBondContact O-N 3.16Å; R1054-T1058 WeakPolarHBondContact O-CB 3.5Å; R1054-T1058 PolarHBondContact O-N 3.16Å; R1054-T1058 PolarHBondContact O-OG1 3.22Å
1055	I	92.4	Very high	81.5	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-52.8	172.7	-68.6	-178.9	0	0	0	109	L987 I989 M997 F1027 V1031 C1051 W1052 M1057 T1058 L1059	L987-I1055 HydrophobicContact CD1-CG1 4.21Å; I989-I1055 HydrophobicContact CD1-CD1 4.11Å; I989-I1055 HydrophobicContact CD1-CG1 3.92Å; I989-I1055 HydrophobicContact CD1-CG2 4.37Å; M997-I1055 HydrophobicContact CE-CG2 3.51Å; F1027-I1055 HydrophobicContact CE1-CG2 3.85Å; F1027-I1055 HydrophobicContact CZ-CG2 3.94Å; V1031-I1055 HydrophobicContact CG1-CD1 3.81Å; V1031-I1055 HydrophobicContact CG2-CD1 3.81Å; C1051-I1055 WeakPolarHBondContact O-CG1 3.07Å; C1051-I1055 PolarHBondContact O-N 3.44Å; W1052-I1055 PolarHBondContact O-N 3.47Å; W1052-I1055 VanDerWaalsContact O-N 3.17Å; I1055-M1057 PolarHBondContact O-N 2.94Å; I1055-T1058 WeakPolarHBondContact O-CB 3.36Å; I1055-T1058 PolarHBondContact O-N 3.24Å; I1055-T1058 VanDerWaalsContact O-N 3.09Å; I1055-L1059 PolarHBondContact O-N 2.73Å
1056	I	93.1	Very high	82.9	Confident	22 Å²	22	34.2 Å²	34.2	11%	0.113	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-45.9	176.3	-67.3	-57.8	0	0	0	112	I107 L1024 W1052 T1058 L1059 T1060	I107-I1056 HydrophobicContact CD1-CG2 4.06Å; I107-I1056 HydrophobicContact CG1-CG2 4.43Å; L1024-I1056 HydrophobicContact CD2-CD1 3.82Å; W1052-I1056 HydrophobicContact CD2-CG1 4.1Å; W1052-I1056 HydrophobicContact CE3-CG1 4.36Å; W1052-I1056 HydrophobicContact CH2-CD1 3.59Å; W1052-I1056 HydrophobicContact CH2-CG1 3.86Å; W1052-I1056 HydrophobicContact CZ2-CD1 3.64Å; W1052-I1056 HydrophobicContact CZ2-CG1 3.5Å; W1052-I1056 HydrophobicContact CZ3-CD1 4.16Å; W1052-I1056 HydrophobicContact CZ3-CG1 4.26Å; W1052-I1056 PolarHBondContact O-N 2.93Å; I1056-T1058 PolarHBondContact O-N 2.87Å; I1056-L1059 WeakPolarHBondContact O-CA 3.4Å; I1056-L1059 WeakPolarHBondContact O-CB 3.45Å; I1056-L1059 PolarHBondContact O-N 3.37Å; I1056-T1060 PolarHBondContact O-N 3.37Å; I1056-T1060 PolarHBondContact O-OG1 3.21Å; I1056-T1060 VanDerWaalsContact O-OG1 3.08Å
1057	M	89.3	Confident	83.8	Confident	94 Å²	94	36.9 Å²	36.9	46%	0.463	20%	0.2	S	C	.	.	H	α-helix	trans	-58.6	-34.5	175.6	-174.8	-175.9	73.1	0	0	112.8	P1053 I1055 E1061	P1053-M1057 VanDerWaalsContact O-CB 3.25Å; P1053-M1057 WeakPolarHBondContact O-CB 3.37Å; P1053-M1057 PolarHBondContact O-N 3.33Å; I1055-M1057 PolarHBondContact O-N 2.94Å; M1057-E1061 WeakPolarHBondContact O-CG 3.41Å; M1057-E1061 PolarHBondContact O-N 2.94Å
1058	T	91.6	Very high	84.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-70.4	-34.7	176	-55.2	0	0	0	0	111.5	V980 K983 M984 L987 R1054 I1055 I1056 L1062	V980-T1058 HydrophobicContact CG1-CG2 3.91Å; K983-T1058 HydrophobicContact CB-CG2 3.93Å; M984-T1058 HydrophobicContact CE-CG2 4.43Å; M984-T1058 HydrophobicContact CG-CG2 3.81Å; L987-T1058 WeakPolarHBondContact CD1-OG1 3.47Å; R1054-T1058 WeakPolarHBondContact O-CB 3.5Å; R1054-T1058 PolarHBondContact O-N 3.16Å; R1054-T1058 PolarHBondContact O-OG1 3.22Å; I1055-T1058 WeakPolarHBondContact O-CB 3.36Å; I1055-T1058 PolarHBondContact O-N 3.24Å; I1055-T1058 VanDerWaalsContact O-N 3.09Å; I1056-T1058 PolarHBondContact O-N 2.87Å; T1058-L1062 PolarHBondContact O-N 3.27Å
1059	L	93.4	Very high	84.6	Confident	11 Å²	11	36.9 Å²	36.9	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-69.4	-41.2	173.8	-166.8	63.7	0	0	0	112.1	M997 I1000 L1001 I1055 I1056 E1061 L1062 R1063	M997-L1059 HydrophobicContact CB-CD1 3.92Å; M997-L1059 HydrophobicContact CG-CD1 3.89Å; M997-L1059 HydrophobicContact CG-CD2 4.36Å; M997-L1059 HydrophobicContact SD-CD1 4.19Å; I1000-L1059 HydrophobicContact CG2-CD2 4.06Å; L1001-L1059 HydrophobicContact CD1-CD1 3.77Å; L1001-L1059 HydrophobicContact CD2-CD1 3.99Å; L1001-L1059 HydrophobicContact CD2-CG 4.32Å; L1001-L1059 HydrophobicContact CG-CD1 3.91Å; I1055-L1059 PolarHBondContact O-N 2.73Å; I1056-L1059 WeakPolarHBondContact O-CA 3.4Å; I1056-L1059 WeakPolarHBondContact O-CB 3.45Å; I1056-L1059 PolarHBondContact O-N 3.37Å; L1059-E1061 VanDerWaalsContact C-N 3.35Å; L1059-E1061 PolarHBondContact O-N 3.07Å; L1059-L1062 WeakPolarHBondContact O-CB 3.24Å; L1059-L1062 PolarHBondContact O-N 3.39Å; L1059-R1063 PolarHBondContact O-N 3.36Å
1060	T	90.8	Very high	84.7	Confident	38 Å²	38	34.5 Å²	34.5	23%	0.233	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-39.8	173.5	-48.2	0	0	0	0	112	L110 I1056 L1062 R1063 S1064	L110-T1060 HydrophobicContact CD1-CG2 4.29Å; L110-T1060 HydrophobicContact CD2-CG2 3.99Å; I1056-T1060 PolarHBondContact O-N 3.37Å; I1056-T1060 PolarHBondContact O-OG1 3.21Å; I1056-T1060 VanDerWaalsContact O-OG1 3.08Å; T1060-L1062 VanDerWaalsContact C-N 3.34Å; T1060-R1063 PolarHBondContact O-N 3.02Å; T1060-S1064 PolarHBondContact O-N 3.01Å; T1060-S1064 PolarHBondContact O-OG 3.4Å
1061	E	90.5	Very high	84.3	Confident	34 Å²	34	34.9 Å²	34.9	16%	0.159	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-38.5	173.1	-76.3	178.2	-156.8	0	0	111.9	V980 K983 M1057 L1059 S1064 V1065	V980-E1061 HydrophobicContact CG2-CB 4.18Å; K983-E1061 WeakPolarHBondContact CD-OE2 3.34Å; K983-E1061 IonicContact NZ-OE1 3.9Å; K983-E1061 PolarHBondContact NZ-OE1 3.01Å; K983-E1061 IonicContact NZ-OE2 3.43Å; K983-E1061 PolarHBondContact NZ-OE2 3.22Å; M1057-E1061 WeakPolarHBondContact O-CG 3.41Å; M1057-E1061 PolarHBondContact O-N 2.94Å; L1059-E1061 VanDerWaalsContact C-N 3.35Å; L1059-E1061 PolarHBondContact O-N 3.07Å; E1061-S1064 WeakPolarHBondContact O-CB 3.38Å; E1061-S1064 PolarHBondContact O-N 2.84Å; E1061-V1065 WeakPolarHBondContact O-CG2 3.5Å; E1061-V1065 PolarHBondContact O-N 2.69Å; E1061-V1065 VanDerWaalsContact O-N 3.16Å
1062	L	90.9	Very high	83	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-48.1	174.6	-176.8	144.5	0	0	0	111.8	T897 L898 A901 V980 M984 L1001 T1058 L1059 T1060 S1064 V1065 T1066	T897-L1062 HydrophobicContact CG2-CD1 4.33Å; T897-L1062 HydrophobicContact CG2-CG 4.15Å; L898-L1062 HydrophobicContact CB-CD1 3.98Å; L898-L1062 HydrophobicContact CD1-CD1 4.15Å; A901-L1062 HydrophobicContact CB-CD1 4.41Å; V980-L1062 HydrophobicContact CG1-CB 4.23Å; V980-L1062 HydrophobicContact CG1-CD1 4.25Å; M984-L1062 HydrophobicContact CE-CD1 3.97Å; L1001-L1062 HydrophobicContact CD1-CD2 4.21Å; T1058-L1062 PolarHBondContact O-N 3.27Å; L1059-L1062 WeakPolarHBondContact O-CB 3.24Å; L1059-L1062 PolarHBondContact O-N 3.39Å; T1060-L1062 VanDerWaalsContact C-N 3.34Å; L1062-S1064 PolarHBondContact O-N 3.01Å; L1062-V1065 WeakPolarHBondContact O-CA 3.13Å; L1062-V1065 WeakPolarHBondContact O-CB 3.46Å; L1062-V1065 PolarHBondContact O-N 3.24Å; L1062-T1066 HydrophobicContact CD2-CG2 4.08Å; L1062-T1066 WeakPolarHBondContact O-CG2 3.3Å; L1062-T1066 PolarHBondContact O-N 3.29Å; L1062-T1066 VanDerWaalsContact O-N 3.07Å
1063	R	89.8	Confident	81.5	Confident	22 Å²	22	36.6 Å²	36.6	8%	0.083	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-35.5	173.9	-69.1	-174	76	105.8	-12.9	112.4	D894 L1001 S1004 D1006 L1059 T1060 V1065 T1066 M1067	D894-R1063 IonicContact OD2-NH1 3Å; L1001-R1063 HydrophobicContact CD2-CG 3.59Å; S1004-R1063 PolarHBondContact OG-NH1 3.33Å; D1006-R1063 IonicContact OD1-CZ 3.56Å; D1006-R1063 IonicContact OD1-NH2 3.74Å; D1006-R1063 PolarHBondContact OD1-NH2 3.42Å; D1006-R1063 IonicContact OD2-CZ 2.69Å; D1006-R1063 IonicContact OD2-NE 2.75Å; D1006-R1063 IonicContact OD2-NH2 2.69Å; D1006-R1063 PolarHBondContact OD2-NH2 3.26Å; L1059-R1063 PolarHBondContact O-N 3.36Å; T1060-R1063 PolarHBondContact O-N 3.02Å; R1063-V1065 PolarHBondContact O-N 3.32Å; R1063-T1066 WeakPolarHBondContact CA-OG1 3.48Å; R1063-T1066 PolarHBondContact O-N 3.2Å; R1063-T1066 PolarHBondContact O-OG1 3.24Å; R1063-M1067 VanDerWaalsContact O-CG 3.24Å; R1063-M1067 WeakPolarHBondContact O-CG 3.34Å; R1063-M1067 PolarHBondContact O-N 2.97Å; R1063-M1067 VanDerWaalsContact O-N 3.08Å
1064	S	85.4	Confident	79.9	Confident	57 Å²	57	36.7 Å²	36.7	40%	0.399	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-30.8	175.3	-54.2	0	0	0	0	112.4	T1060 E1061 L1062 C1068	T1060-S1064 PolarHBondContact O-N 3.01Å; T1060-S1064 PolarHBondContact O-OG 3.4Å; E1061-S1064 WeakPolarHBondContact O-CB 3.38Å; E1061-S1064 PolarHBondContact O-N 2.84Å; L1062-S1064 PolarHBondContact O-N 3.01Å; S1064-C1068 PolarHBondContact O-N 3.36Å; S1064-C1068 PolarHBondContact O-SG 2.89Å
1065	V	81.4	Confident	78.2	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-76.8	-40.6	176	177.5	0	0	0	0	111.7	L976 I977 E1061 L1062 R1063 C1068 A1069	L976-V1065 HydrophobicContact CB-CG1 4.45Å; L976-V1065 HydrophobicContact CB-CG2 3.5Å; L976-V1065 HydrophobicContact CD1-CG2 4.2Å; L976-V1065 HydrophobicContact CG-CG2 4.38Å; I977-V1065 HydrophobicContact CD1-CG1 4.42Å; I977-V1065 HydrophobicContact CG1-CG1 3.76Å; E1061-V1065 WeakPolarHBondContact O-CG2 3.5Å; E1061-V1065 PolarHBondContact O-N 2.69Å; E1061-V1065 VanDerWaalsContact O-N 3.16Å; L1062-V1065 WeakPolarHBondContact O-CA 3.13Å; L1062-V1065 WeakPolarHBondContact O-CB 3.46Å; L1062-V1065 PolarHBondContact O-N 3.24Å; R1063-V1065 PolarHBondContact O-N 3.32Å; V1065-C1068 PolarHBondContact O-N 3.39Å; V1065-A1069 PolarHBondContact O-N 2.99Å
1066	T	82.9	Confident	76.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-41.2	-177.4	57.9	0	0	0	0	111.6	I893 D894 T897 L1062 R1063 C1068 A1069 Q1070	I893-T1066 HydrophobicContact CG2-CG2 4.28Å; D894-T1066 WeakPolarHBondContact OD1-CB 3.49Å; D894-T1066 VanDerWaalsContact OD1-CG2 3.24Å; D894-T1066 WeakPolarHBondContact OD1-CG2 3.17Å; D894-T1066 PolarHBondContact OD1-OG1 3.44Å; T897-T1066 HydrophobicContact CG2-CG2 3.92Å; T897-T1066 VanDerWaalsContact OG1-CG2 3.29Å; T897-T1066 WeakPolarHBondContact OG1-CG2 3.42Å; L1062-T1066 HydrophobicContact CD2-CG2 4.08Å; L1062-T1066 WeakPolarHBondContact O-CG2 3.3Å; L1062-T1066 PolarHBondContact O-N 3.29Å; L1062-T1066 VanDerWaalsContact O-N 3.07Å; R1063-T1066 WeakPolarHBondContact CA-OG1 3.48Å; R1063-T1066 PolarHBondContact O-N 3.2Å; R1063-T1066 PolarHBondContact O-OG1 3.24Å; T1066-C1068 PolarHBondContact O-N 2.63Å; T1066-A1069 WeakPolarHBondContact O-CB 3.48Å; T1066-A1069 PolarHBondContact O-N 3.45Å; T1066-Q1070 PolarHBondContact O-N 2.89Å
1067	M	77.2	Confident	74	Confident	74 Å²	74	41.5 Å²	41.5	37%	0.365	22%	0.222	S	C	.	.	H	α-helix	trans	-58.1	-46	170	-61.6	-65.1	109.7	0	0	111.6	R1063 A1069 Q1070 D1071	R1063-M1067 VanDerWaalsContact O-CG 3.24Å; R1063-M1067 WeakPolarHBondContact O-CG 3.34Å; R1063-M1067 PolarHBondContact O-N 2.97Å; R1063-M1067 VanDerWaalsContact O-N 3.08Å; M1067-A1069 PolarHBondContact O-N 2.99Å; M1067-Q1070 PolarHBondContact O-N 3.33Å; M1067-Q1070 PolarHBondContact SD-OE1 2.98Å; M1067-D1071 PolarHBondContact O-N 3.46Å; M1067-D1071 VanDerWaalsContact O-N 3.09Å
1068	C	69.6	Low	71.8	Confident	69 Å²	69	39.7 Å²	39.7	47%	0.466	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-25.5	175.9	-69.7	0	0	0	0	113.3	S1064 V1065 T1066	S1064-C1068 PolarHBondContact O-N 3.36Å; S1064-C1068 PolarHBondContact O-SG 2.89Å; V1065-C1068 PolarHBondContact O-N 3.39Å; T1066-C1068 PolarHBondContact O-N 2.63Å
1069	A	67.3	Low	69.4	Low	3 Å²	3	45.8 Å²	45.8	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-77.5	-42.9	174.8	0	0	0	0	0	111.1	V1065 T1066 M1067 D1071 L1072 F1073	V1065-A1069 PolarHBondContact O-N 2.99Å; T1066-A1069 WeakPolarHBondContact O-CB 3.48Å; T1066-A1069 PolarHBondContact O-N 3.45Å; M1067-A1069 PolarHBondContact O-N 2.99Å; A1069-D1071 PolarHBondContact O-N 3.46Å; A1069-L1072 WeakPolarHBondContact O-CB 3.41Å; A1069-L1072 PolarHBondContact O-N 3.33Å; A1069-F1073 HydrophobicContact CB-CE2 4.45Å; A1069-F1073 WeakPolarHBondContact O-CD2 3.33Å; A1069-F1073 PolarHBondContact O-N 3.03Å
1070	Q	67.8	Low	66.8	Low	37 Å²	37	48.3 Å²	48.3	17%	0.173	28%	0.276	C	S	.	.	H	α-helix	trans	-54.3	-51	173.4	-75.8	171.8	-46.6	0	0	111.4	I893 T1066 M1067 L1072 F1073 S1074	I893-Q1070 HydrophobicContact CD1-CG 3.33Å; T1066-Q1070 PolarHBondContact O-N 2.89Å; M1067-Q1070 PolarHBondContact O-N 3.33Å; M1067-Q1070 PolarHBondContact SD-OE1 2.98Å; Q1070-L1072 PolarHBondContact O-N 3.27Å; Q1070-L1072 VanDerWaalsContact O-N 3.09Å; Q1070-F1073 PolarHBondContact O-N 2.65Å; Q1070-F1073 VanDerWaalsContact O-N 3.1Å; Q1070-S1074 PolarHBondContact O-N 2.76Å; Q1070-S1074 PolarHBondContact O-OG 2.73Å
1071	D	63.8	Low	64.3	Low	100 Å²	100	52.4 Å²	52.4	54%	0.535	30%	0.297	S	S	.	.	H	α-helix	trans	-52.1	-35.5	175.3	-79.9	-20.3	0	0	0	113.3	M1067 A1069 Q1075	M1067-D1071 PolarHBondContact O-N 3.46Å; M1067-D1071 VanDerWaalsContact O-N 3.09Å; A1069-D1071 PolarHBondContact O-N 3.46Å; D1071-Q1075 WeakPolarHBondContact O-CG 3.3Å; D1071-Q1075 PolarHBondContact O-N 3.5Å; D1071-Q1075 VanDerWaalsContact O-N 3.09Å; D1071-Q1075 PolarHBondContact O-NE2 3.34Å
1072	L	57.6	Low	61.8	Low	49 Å²	49	56.8 Å²	56.8	26%	0.257	32%	0.321	S	S	.	.	H	α-helix	trans	-78.4	-37.7	-177.9	-172.5	60.9	0	0	0	112	I968 D970 A1069 Q1070 S1074 T1076	I968-L1072 WeakPolarHBondContact O-CD2 3.37Å; D970-L1072 HydrophobicContact CB-CD2 4.26Å; A1069-L1072 WeakPolarHBondContact O-CB 3.41Å; A1069-L1072 PolarHBondContact O-N 3.33Å; Q1070-L1072 PolarHBondContact O-N 3.27Å; Q1070-L1072 VanDerWaalsContact O-N 3.09Å; L1072-S1074 VanDerWaalsContact C-N 3.33Å; L1072-T1076 WeakPolarHBondContact O-CB 3.25Å; L1072-T1076 PolarHBondContact O-N 3.31Å; L1072-T1076 PolarHBondContact O-OG1 2.72Å
1073	F	57	Low	59	Low	17 Å²	17	62.6 Å²	62.6	8%	0.075	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-45.7	169.1	-74.6	-71.9	0	0	0	110.4	F847 F852 L855 I968 A1069 Q1070 T1076 Y1077 F1097	F847-F1073 HydrophobicContact CD1-CZ 4.34Å; F847-F1073 AromaticContact CE1-CE2 3.82Å; F847-F1073 HydrophobicContact CE1-CE2 3.82Å; F847-F1073 AromaticContact CE1-CZ 3.55Å; F847-F1073 HydrophobicContact CE1-CZ 3.55Å; F847-F1073 HydrophobicContact CE2-CZ 4.49Å; F847-F1073 AromaticContact CZ-CE2 3.84Å; F847-F1073 HydrophobicContact CZ-CE2 3.84Å; F847-F1073 AromaticContact CZ-CZ 3.64Å; F847-F1073 HydrophobicContact CZ-CZ 3.64Å; F852-F1073 AromaticContact CE1-CD1 3.98Å; F852-F1073 HydrophobicContact CE1-CD1 3.98Å; L855-F1073 HydrophobicContact CD2-CD1 4.37Å; L855-F1073 HydrophobicContact CD2-CE1 3.77Å; I968-F1073 HydrophobicContact CD1-CE1 3.66Å; I968-F1073 HydrophobicContact CD1-CZ 4.24Å; A1069-F1073 HydrophobicContact CB-CE2 4.45Å; A1069-F1073 WeakPolarHBondContact O-CD2 3.33Å; A1069-F1073 PolarHBondContact O-N 3.03Å; Q1070-F1073 PolarHBondContact O-N 2.65Å; Q1070-F1073 VanDerWaalsContact O-N 3.1Å; F1073-T1076 PolarHBondContact O-N 3.2Å; F1073-Y1077 PolarHBondContact O-N 3.31Å; F1073-F1097 HydrophobicContact CB-CD1 4.31Å; F1073-F1097 HydrophobicContact CB-CG 4.49Å; F1073-F1097 AromaticContact CD2-CD1 3.97Å; F1073-F1097 HydrophobicContact CD2-CD1 3.97Å; F1073-F1097 AromaticContact CD2-CE1 3.85Å; F1073-F1097 HydrophobicContact CD2-CE1 3.85Å; F1073-F1097 AromaticContact CE2-CE1 3.97Å; F1073-F1097 HydrophobicContact CE2-CE1 3.97Å; F1073-F1097 HydrophobicContact CG-CD1 4.11Å; F1073-F1097 HydrophobicContact CG-CE1 4.2Å; F1073-F1097 HydrophobicContact CZ-CE1 4.39Å
1074	S	57	Low	56.5	Low	43 Å²	43	68.3 Å²	68.3	30%	0.301	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-47.6	178.6	-49	0	0	0	0	113.5	Q1070 L1072 T1076 G1078 L1098	Q1070-S1074 PolarHBondContact O-N 2.76Å; Q1070-S1074 PolarHBondContact O-OG 2.73Å; L1072-S1074 VanDerWaalsContact C-N 3.33Å; S1074-T1076 VanDerWaalsContact C-N 3.31Å; S1074-T1076 PolarHBondContact O-N 3.32Å; S1074-G1078 PolarHBondContact O-N 3.5Å; S1074-L1098 WeakPolarHBondContact OG-CD2 3.3Å
1075	Q	52.8	Low	54	Low	118 Å²	118	73.5 Å²	73.5	55%	0.551	41%	0.408	S	S	*	.	H	α-helix	trans	-63.2	-36	179.2	-79.6	164.1	77.2	0	0	112.9	D1071 M1079	D1071-Q1075 WeakPolarHBondContact O-CG 3.3Å; D1071-Q1075 PolarHBondContact O-N 3.5Å; D1071-Q1075 VanDerWaalsContact O-N 3.09Å; D1071-Q1075 PolarHBondContact O-NE2 3.34Å; Q1075-M1079 WeakPolarHBondContact O-CG 3.37Å
1076	T	51	Low	52	Low	43 Å²	43	79.4 Å²	79.4	26%	0.264	44%	0.439	S	S	.	.	H	α-helix	trans	-78.9	-28.9	-174.4	-47	0	0	0	0	112.1	F852 L1072 F1073 S1074	F852-T1076 HydrophobicContact CE2-CG2 3.42Å; F852-T1076 VanDerWaalsContact CE2-CG2 3.42Å; F852-T1076 HydrophobicContact CZ-CG2 3.46Å; F852-T1076 VanDerWaalsContact CZ-CG2 3.46Å; L1072-T1076 WeakPolarHBondContact O-CB 3.25Å; L1072-T1076 PolarHBondContact O-N 3.31Å; L1072-T1076 PolarHBondContact O-OG1 2.72Å; F1073-T1076 PolarHBondContact O-N 3.2Å; S1074-T1076 VanDerWaalsContact C-N 3.31Å; S1074-T1076 PolarHBondContact O-N 3.32Å
1077	Y	46.2	Very low	50	Low	56 Å²	56	84.4 Å²	84.4	22%	0.22	47%	0.466	C	S	.	.	H	α-helix	trans	-63.6	-50.3	171.9	-169.2	-108.7	0	0	0	111.2	F1073 M1079 S1080 L1089 L1098	F1073-Y1077 PolarHBondContact O-N 3.31Å; Y1077-M1079 PolarHBondContact O-N 3.37Å; Y1077-S1080 PolarHBondContact O-N 3.09Å; Y1077-L1089 HydrophobicContact CD2-CB 4.13Å; Y1077-L1089 HydrophobicContact CE2-CB 3.67Å; Y1077-L1098 HydrophobicContact CD1-CD1 4.09Å; Y1077-L1098 HydrophobicContact CE1-CD1 4.42Å
1078	G	43.6	Very low	48.5	Very low	56 Å²	56	88.4 Å²	88.4	58%	0.577	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.7	-179.8	0	0	0	0	0	116.4	S1074	S1074-G1078 PolarHBondContact O-N 3.5Å
1079	M	40.9	Very low	47.4	Very low	130 Å²	130	85.8 Å²	85.8	64%	0.64	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-6.3	173.7	-67.2	-178.2	76.6	0	0	113.7	I301 Q1075 Y1077	I301-M1079 HydrophobicContact CD1-CE 3.46Å; I301-M1079 VanDerWaalsContact CD1-CE 3.46Å; Q1075-M1079 WeakPolarHBondContact O-CG 3.37Å; Y1077-M1079 PolarHBondContact O-N 3.37Å
1080	S	40.2	Very low	46.5	Very low	63 Å²	63	87.5 Å²	87.5	44%	0.441	48%	0.476	S	S	.	.			trans	-96.1	-13.7	-172	-62.6	0	0	0	0	115.3	Y1077 N1082	Y1077-S1080 PolarHBondContact O-N 3.09Å; S1080-N1082 PolarHBondContact O-N 3.19Å
1081	D	38.2	Very low	45.6	Very low	125 Å²	125	93.2 Å²	93.2	67%	0.668	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	16.6	-169.7	-77.5	-28.9	0	0	0	116.9
1082	N	36.7	Very low	44.9	Very low	125 Å²	125	89.5 Å²	89.5	67%	0.668	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	-0.8	-175.3	-90.1	-57.9	0	0	0	116.6	S1080	S1080-N1082 PolarHBondContact O-N 3.19Å
1083	N	32.6	Very low	44.5	Very low	124 Å²	124	87.2 Å²	87.2	66%	0.663	46%	0.462	S	S	*	.	S	Bend	trans	-160	123.8	169.2	-91.4	-60.3	0	0	0	114
1084	N	36.5	Very low	44.4	Very low	141 Å²	141	90.6 Å²	90.6	75%	0.754	48%	0.478	S	S	*	.			trans	73.4	123.2	167.7	-63.5	-35.1	0	0	0	119.4	N1086	N1084-N1086 VanDerWaalsContact C-N 3.29Å; N1084-N1086 PolarHBondContact O-N 3.34Å
1085	N	33.4	Very low	44.3	Very low	167 Å²	167	91.6 Å²	91.6	89%	0.893	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	29	-165.2	-59.5	-10.9	0	0	0	117.4
1086	N	38.9	Very low	44.4	Very low	128 Å²	128	86.3 Å²	86.3	68%	0.684	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	-2.6	-169.5	-71.7	1.5	0	0	0	115.9	H853 N1084	H853-N1086 PolarHBondContact CE1-O 3.28Å; H853-N1086 VanDerWaalsContact NE2-C 3.26Å; H853-N1086 PolarHBondContact NE2-O 3.45Å; N1084-N1086 VanDerWaalsContact C-N 3.29Å; N1084-N1086 PolarHBondContact O-N 3.34Å
1087	N	42.4	Very low	44.5	Very low	105 Å²	105	84.8 Å²	84.8	56%	0.561	44%	0.443	S	S	*	.			trans	-117.1	34.9	-171	-69.8	2.6	0	0	0	114.4	H853 L1089	H853-N1087 WeakPolarHBondContact NE2-CA 3.46Å; H853-N1087 VanDerWaalsContact NE2-CB 3.27Å; H853-N1087 WeakPolarHBondContact NE2-CB 3.22Å; H853-N1087 PolarHBondContact NE2-N 3.47Å; H853-N1087 PolarHBondContact NE2-OD1 3.07Å; N1087-L1089 PolarHBondContact O-N 3.4Å
1088	Q	45.6	Very low	44.8	Very low	157 Å²	157	83.9 Å²	83.9	73%	0.734	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-70.9	123.3	174.3	-166.3	167.9	14.4	0	0	110
1089	L	45.5	Very low	44.9	Very low	14 Å²	14	83.1 Å²	83.1	7%	0.073	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-62.8	133.4	171.8	-154	76.4	0	0	0	107.8	F852 Y1077 N1087 W1091 L1093 F1097	F852-L1089 HydrophobicContact CB-CD1 4.09Å; F852-L1089 HydrophobicContact CD1-CD1 3.72Å; F852-L1089 HydrophobicContact CG-CD1 4.36Å; Y1077-L1089 HydrophobicContact CD2-CB 4.13Å; Y1077-L1089 HydrophobicContact CE2-CB 3.67Å; N1087-L1089 PolarHBondContact O-N 3.4Å; L1089-W1091 PolarHBondContact O-N 3.4Å; L1089-L1093 HydrophobicContact CD1-CD1 4.2Å; L1089-L1093 HydrophobicContact CD2-CB 3.58Å; L1089-L1093 HydrophobicContact CG-CB 3.74Å; L1089-L1093 HydrophobicContact CG-CD1 4.11Å; L1089-F1097 HydrophobicContact CD2-CD2 4.43Å
1090	P	47.7	Very low	45	Very low	40 Å²	40	82.2 Å²	82.2	26%	0.26	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-52.1	136.3	175.3	-27.3	33.9	0	0	0	111	A856 Y1092 L1093 H1094	A856-P1090 HydrophobicContact CB-CG 4.31Å; P1090-Y1092 HydrophobicContact CB-CD1 3.76Å; P1090-Y1092 HydrophobicContact CB-CE1 3.19Å; P1090-Y1092 HydrophobicContact CB-CE2 4.1Å; P1090-Y1092 HydrophobicContact CB-CG 4.43Å; P1090-Y1092 HydrophobicContact CG-CE1 4.17Å; P1090-Y1092 PolarHBondContact O-N 3.22Å; P1090-L1093 WeakPolarHBondContact O-CA 3.5Å; P1090-L1093 WeakPolarHBondContact O-CB 3.41Å; P1090-L1093 PolarHBondContact O-N 3.43Å; P1090-H1094 PolarHBondContact O-N 3.1Å
1091	W	50.8	Low	45	Very low	157 Å²	157	85.4 Å²	85.4	60%	0.595	44%	0.436	S	S	*	.	H	α-helix	trans	-54.9	-34.2	-169.7	65.8	-92.8	0	0	0	113.4	L1089 L1093 H1094 E1095	L1089-W1091 PolarHBondContact O-N 3.4Å; W1091-L1093 VanDerWaalsContact C-N 3.28Å; W1091-L1093 PolarHBondContact O-N 3.45Å; W1091-H1094 WeakPolarHBondContact O-CA 3.25Å; W1091-H1094 VanDerWaalsContact O-CB 3.26Å; W1091-H1094 WeakPolarHBondContact O-CB 3.39Å; W1091-H1094 PolarHBondContact O-N 3.48Å; W1091-E1095 WeakPolarHBondContact CZ3-OE2 3.45Å; W1091-E1095 PolarHBondContact O-N 3.03Å
1092	Y	48.4	Very low	44.7	Very low	22 Å²	22	85.9 Å²	85.9	9%	0.086	43%	0.432	C	S	.	.	H	α-helix	trans	-67.2	-26.1	176.3	62	-99.7	0	0	0	112.9	L9 A856 E860 P1090 L1096	L9-Y1092 HydrophobicContact CD1-CD1 3.69Å; L9-Y1092 HydrophobicContact CD1-CD2 3.65Å; L9-Y1092 HydrophobicContact CD1-CE1 3.22Å; L9-Y1092 HydrophobicContact CD1-CE2 3.22Å; L9-Y1092 HydrophobicContact CD1-CG 3.88Å; L9-Y1092 WeakPolarHBondContact CD1-OH 3.5Å; A856-Y1092 WeakPolarHBondContact CB-OH 3.34Å; E860-Y1092 PolarHBondContact OE1-OH 3.31Å; P1090-Y1092 HydrophobicContact CB-CD1 3.76Å; P1090-Y1092 HydrophobicContact CB-CE1 3.19Å; P1090-Y1092 HydrophobicContact CB-CE2 4.1Å; P1090-Y1092 HydrophobicContact CB-CG 4.43Å; P1090-Y1092 HydrophobicContact CG-CE1 4.17Å; P1090-Y1092 PolarHBondContact O-N 3.22Å; Y1092-L1096 WeakPolarHBondContact O-CB 3.35Å; Y1092-L1096 PolarHBondContact O-N 3.43Å
1093	L	50	Low	44.7	Very low	0 Å²	0	85.3 Å²	85.3	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-77.9	-30.9	170.4	-65.1	-168.6	0	0	0	111.3	L855 A856 I859 L1089 P1090 W1091 E1095 L1096 F1097	L855-L1093 HydrophobicContact CD2-CD1 4.45Å; A856-L1093 HydrophobicContact CB-CD1 4.38Å; I859-L1093 HydrophobicContact CB-CD2 4.39Å; I859-L1093 HydrophobicContact CD1-CD1 4.34Å; I859-L1093 HydrophobicContact CD1-CD2 3.69Å; I859-L1093 HydrophobicContact CG2-CD2 3.94Å; L1089-L1093 HydrophobicContact CD1-CD1 4.2Å; L1089-L1093 HydrophobicContact CD2-CB 3.58Å; L1089-L1093 HydrophobicContact CG-CB 3.74Å; L1089-L1093 HydrophobicContact CG-CD1 4.11Å; P1090-L1093 WeakPolarHBondContact O-CA 3.5Å; P1090-L1093 WeakPolarHBondContact O-CB 3.41Å; P1090-L1093 PolarHBondContact O-N 3.43Å; W1091-L1093 VanDerWaalsContact C-N 3.28Å; W1091-L1093 PolarHBondContact O-N 3.45Å; L1093-E1095 VanDerWaalsContact C-N 3.3Å; L1093-L1096 HydrophobicContact CD2-CD2 4.29Å; L1093-L1096 PolarHBondContact O-N 3.03Å; L1093-F1097 HydrophobicContact CB-CD2 4.01Å; L1093-F1097 HydrophobicContact CB-CE2 4.2Å; L1093-F1097 HydrophobicContact CD1-CE2 4.43Å; L1093-F1097 HydrophobicContact CD2-CE2 4Å; L1093-F1097 HydrophobicContact CG-CE2 4.44Å; L1093-F1097 WeakPolarHBondContact O-CB 3.44Å; L1093-F1097 WeakPolarHBondContact O-CD2 3.35Å; L1093-F1097 PolarHBondContact O-N 2.84Å
1094	H	54	Low	44.6	Very low	88 Å²	88	86.6 Å²	86.6	41%	0.407	44%	0.435	S	S	.	.	H	α-helix	trans	-59.8	-46.4	169.4	-176.2	-67	0	0	0	109.6	P1090 W1091 F1097 L1098	P1090-H1094 PolarHBondContact O-N 3.1Å; W1091-H1094 WeakPolarHBondContact O-CA 3.25Å; W1091-H1094 VanDerWaalsContact O-CB 3.26Å; W1091-H1094 WeakPolarHBondContact O-CB 3.39Å; W1091-H1094 PolarHBondContact O-N 3.48Å; H1094-F1097 PolarHBondContact O-N 3.08Å; H1094-L1098 HydrophobicContact CB-CD1 4.28Å; H1094-L1098 WeakPolarHBondContact CD2-CD1 3.41Å; H1094-L1098 WeakPolarHBondContact O-CA 3.46Å; H1094-L1098 VanDerWaalsContact O-CB 3.25Å; H1094-L1098 WeakPolarHBondContact O-CB 3.5Å; H1094-L1098 PolarHBondContact O-N 3.41Å
1095	E	54.2	Low	44.3	Very low	65 Å²	65	85.6 Å²	85.6	30%	0.304	43%	0.434	S	S	.	.	H	α-helix	trans	-63.5	-39.2	174.2	-165.4	172.8	-164.1	0	0	113.1	W1091 L1093 F1097	W1091-E1095 WeakPolarHBondContact CZ3-OE2 3.45Å; W1091-E1095 PolarHBondContact O-N 3.03Å; L1093-E1095 VanDerWaalsContact C-N 3.3Å; E1095-F1097 PolarHBondContact O-N 3.12Å
1096	L	54.8	Low	43.9	Very low	7 Å²	7	86.9 Å²	86.9	4%	0.037	44%	0.437	C	S	.	.	H	α-helix	trans	-68.6	-29.7	177.9	-155.1	94.4	0	0	0	114.1	I859 I863 C892 Y1092 L1093	I859-L1096 HydrophobicContact CG2-CD2 4.15Å; I863-L1096 HydrophobicContact CD1-CD1 3.92Å; I863-L1096 HydrophobicContact CG1-CD1 4.49Å; C892-L1096 HydrophobicContact CB-CD1 4.12Å; C892-L1096 HydrophobicContact CB-CD2 4.18Å; C892-L1096 HydrophobicContact CB-CG 4.38Å; Y1092-L1096 WeakPolarHBondContact O-CB 3.35Å; Y1092-L1096 PolarHBondContact O-N 3.43Å; L1093-L1096 HydrophobicContact CD2-CD2 4.29Å; L1093-L1096 PolarHBondContact O-N 3.03Å
1097	F	54.6	Low	43.4	Very low	10 Å²	10	93.8 Å²	93.8	4%	0.044	47%	0.465	C	S	.	.	H	α-helix	trans	-115.4	-20.2	-169.5	-69.4	-65.9	0	0	0	115.6	F847 L855 I859 I893 F1073 L1089 L1093 H1094 E1095	F847-F1097 HydrophobicContact CE2-CZ 4.04Å; F847-F1097 HydrophobicContact CZ-CE1 4.18Å; F847-F1097 HydrophobicContact CZ-CZ 4.07Å; L855-F1097 HydrophobicContact CD2-CE2 4.1Å; L855-F1097 HydrophobicContact CD2-CZ 4.33Å; I859-F1097 HydrophobicContact CD1-CE2 3.68Å; I859-F1097 HydrophobicContact CD1-CZ 3.58Å; I893-F1097 HydrophobicContact CD1-CD1 3.43Å; I893-F1097 VanDerWaalsContact CD1-CD1 3.43Å; I893-F1097 HydrophobicContact CD1-CE1 3.37Å; I893-F1097 HydrophobicContact CG1-CD1 4.25Å; I893-F1097 HydrophobicContact CG1-CE1 3.71Å; F1073-F1097 HydrophobicContact CB-CD1 4.31Å; F1073-F1097 HydrophobicContact CB-CG 4.49Å; F1073-F1097 AromaticContact CD2-CD1 3.97Å; F1073-F1097 HydrophobicContact CD2-CD1 3.97Å; F1073-F1097 AromaticContact CD2-CE1 3.85Å; F1073-F1097 HydrophobicContact CD2-CE1 3.85Å; F1073-F1097 AromaticContact CE2-CE1 3.97Å; F1073-F1097 HydrophobicContact CE2-CE1 3.97Å; F1073-F1097 HydrophobicContact CG-CD1 4.11Å; F1073-F1097 HydrophobicContact CG-CE1 4.2Å; F1073-F1097 HydrophobicContact CZ-CE1 4.39Å; L1089-F1097 HydrophobicContact CD2-CD2 4.43Å; L1093-F1097 HydrophobicContact CB-CD2 4.01Å; L1093-F1097 HydrophobicContact CB-CE2 4.2Å; L1093-F1097 HydrophobicContact CD1-CE2 4.43Å; L1093-F1097 HydrophobicContact CD2-CE2 4Å; L1093-F1097 HydrophobicContact CG-CE2 4.44Å; L1093-F1097 WeakPolarHBondContact O-CB 3.44Å; L1093-F1097 WeakPolarHBondContact O-CD2 3.35Å; L1093-F1097 PolarHBondContact O-N 2.84Å; H1094-F1097 PolarHBondContact O-N 3.08Å; E1095-F1097 PolarHBondContact O-N 3.12Å
1098	L	50.9	Low	43.4	Very low	38 Å²	38	93.2 Å²	93.2	20%	0.199	46%	0.46	C	S	.	.			trans	-120	15.7	-168.8	-62.2	166.1	0	0	0	114.5	S1074 Y1077 H1094 D1100	S1074-L1098 WeakPolarHBondContact OG-CD2 3.3Å; Y1077-L1098 HydrophobicContact CD1-CD1 4.09Å; Y1077-L1098 HydrophobicContact CE1-CD1 4.42Å; H1094-L1098 HydrophobicContact CB-CD1 4.28Å; H1094-L1098 WeakPolarHBondContact CD2-CD1 3.41Å; H1094-L1098 WeakPolarHBondContact O-CA 3.46Å; H1094-L1098 VanDerWaalsContact O-CB 3.25Å; H1094-L1098 WeakPolarHBondContact O-CB 3.5Å; H1094-L1098 PolarHBondContact O-N 3.41Å; L1098-D1100 VanDerWaalsContact C-N 3.31Å; L1098-D1100 PolarHBondContact O-N 3.01Å
1099	A	47.3	Very low	43.3	Very low	40 Å²	40	89.8 Å²	89.8	33%	0.331	45%	0.446	S	S	.	.			trans	-64.5	-7.5	-165	0	0	0	0	0	118.8	E1101	A1099-E1101 PolarHBondContact O-N 3.46Å
1100	D	42.4	Very low	43.2	Very low	111 Å²	111	94.1 Å²	94.1	59%	0.594	47%	0.467	S	S	*	.	S	Bend	trans	-86.1	24	-177	-152.2	23	0	0	0	113.3	R111 L1098	R111-D1100 IonicContact CZ-OD1 2.59Å; R111-D1100 IonicContact CZ-OD2 3.25Å; R111-D1100 IonicContact NH2-OD1 2.73Å; R111-D1100 PolarHBondContact NH2-OD1 3.13Å; R111-D1100 IonicContact NH2-OD2 2.96Å; R111-D1100 PolarHBondContact NH2-OD2 3Å; L1098-D1100 VanDerWaalsContact C-N 3.31Å; L1098-D1100 PolarHBondContact O-N 3.01Å
1101	E	39.5	Very low	42.9	Very low	129 Å²	129	97.2 Å²	97.2	60%	0.603	48%	0.479	S	S	*	.	S	Bend	trans	-153.8	130.6	175	-117.9	-87.6	-79.8	0	0	111.6	A1099	A1099-E1101 PolarHBondContact O-N 3.46Å
1102	K	33.1	Very low	42.4	Very low	135 Å²	135	93.5 Å²	93.5	59%	0.587	47%	0.472	S	S	*	.			trans	47.7	59.9	166.4	-67.1	179.7	-173.9	65	0	118.6	N1104	K1102-N1104 PolarHBondContact O-N 2.87Å; K1102-N1104 VanDerWaalsContact O-N 3.16Å
1103	I	36.3	Very low	42	Very low	113 Å²	113	98.3 Å²	98.3	58%	0.579	50%	0.497	S	S	*	.			trans	-81.1	76.2	143	-54.4	179.5	0	0	0	107.7
1104	N	30.9	Very low	41.4	Very low	152 Å²	152	105.3 Å²	105.3	81%	0.813	53%	0.533	S	S	*	.			trans	-147.7	19.3	179.1	-108.2	-25.2	0	0	0	112.3	K1102	K1102-N1104 PolarHBondContact O-N 2.87Å; K1102-N1104 VanDerWaalsContact O-N 3.16Å
1105	T	29.1	Very low	40.5	Very low	120 Å²	120	106.6 Å²	106.6	74%	0.736	54%	0.542	S	S	*	.			trans	-140.9	71	-175.8	52.9	0	0	0	0	111.9
1106	M	25.9	Very low	39.3	Very low	193 Å²	193	110.1 Å²	110.1	95%	0.951	56%	0.562	S	S	*	*			trans	-136.4	123.9	157.7	-67.8	-175.1	70	0	0	106.8
1107	E	27.2	Very low	37.9	Very low	273 Å²	273	119.5 Å²	119.5	100%	1.276	61%	0.61	S	S	*	*			trans	-154.6	0	-168.2	-171.3	175.2	-110.6	0	0	108.6

Retrieved 1,107 of 1,107 residues in 1335.4 ms (Link to these results)

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