A0A5K4F9W3_SCHMA Loading...

Protein LNK1-like

AlphaFold DB , UniProt , Accession A0A5K4F9W3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,009 aa.

						>A0A5K4F9W3_SCHMA|A0A5K4F9W3
MDDSEKDPDLLNEETFDCAEIGDWENEHDQFVQNFHKVSEESPTADELPKFWNDSGGLSFLWQTDDLGCGVIADDGGEKVVDVEETLQKLVSDETFEDPAILDISRKVSYQQLNEDSFQHLRNAPAYPTAPTDIFDRTRDIWSIDGSYETGYGSGKTSIASDCNMKSKNVMDVLRSLNVCHLSASKTVSTPSEASTEDCLSGKHATESQVSGVDTELYSKASRSPGNLQNIVPVSQHKVYPNPVFPPGNRICQSQTIQNSLSVNNGIHPNHLRTNPFSLDILKGQLPTDVSVFPTLPAVQSVFKNIHPSKWDYSQIHGLALVRNQCILQQNPPVVSPVSSSQHNPLISSPSVRGLMLPNIQPNDLSLSSYLSRFPVQPTNAESKQSVSLSSTIIPCSKQPSGFVASLEEVSTVKESDPNRGGWMTDYEAIGVLLIQLRPLMVSNPYVQDYYFASQWLRRMNAIQAKHISKHKMNTTTSPAIVPLPIPIPLESLSDSNSSYQVTLKHKLVIPFRAVNRNPGSDQNVDESCGSLEKKSVCSETPTSESSNALGRPTRSNVHRPRVVAELSLASAISSTSENSYPMIHIDNHSLNRKVDDEDYIPSRSEPSDVKYNRRRLLILAQMERMFSILLILDEVSLSLKRVVVQNDARSRLLDYQQELINQLISELLQSSSITSETTSKEEFFKSVENGLFSLPENFFSIHKGMRLWCLTLHHLPTKIQTNYLSKFIHDFLRLRQLWPTTMNEAASIFYPHLREIIYQLKHINDFLRLCFPDALKMNYDSQLTIPITDNLKSLLSCKLGLSLIFCLLDACARASNPADPSDFIQFGAYFSYANSFIDRTCINNTTDECDYVMESFPHLASILLLYIKPSKYGLLTNDHLNTFCDLATKTIKTSNNDITKYTTFTTTTTTTSNNNNMDMNQQLSTGIIDSPTAIHTSVSSLSSSSLTQCCTTVSNSHNSTLSNHYHATQQQHLTMDNSAQSTNSQSSENVVSNIAKNSDDLSVSVVVG
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	38.3	Very low	229 Å²	229	146 Å²	146	100%	1.128	77%	0.766	S	S	*	*				0	93.4	0	-90.4	-178	170	0	0	102.9
2	D	34.6	Very low	38.4	Very low	144 Å²	144	138.6 Å²	138.6	77%	0.77	73%	0.727	S	S	*	*			trans	-125.2	110.3	-161.1	-60.3	-99.4	0	0	0	104.8
3	D	38.1	Very low	38.2	Very low	166 Å²	166	138.2 Å²	138.2	89%	0.888	72%	0.719	S	S	*	*			trans	-126	69.2	170.9	-71.5	-59.8	0	0	0	106.4	E5	D3-E5 VanDerWaalsContact C-N 3.34Å; D3-E5 PolarHBondContact O-N 3.33Å
4	S	40.6	Very low	38	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	73%	0.725	S	S	*	*			trans	-97.2	65	172.5	70.9	0	0	0	0	109.5	K6	S4-K6 PolarHBondContact O-N 3.11Å; S4-K6 VanDerWaalsContact O-N 3.1Å
5	E	40.5	Very low	38.6	Very low	194 Å²	194	136 Å²	136	91%	0.907	71%	0.707	S	S	*	*			trans	-62.9	107.9	170	-165.8	159.4	-136.2	0	0	107.7	D3	D3-E5 VanDerWaalsContact C-N 3.34Å; D3-E5 PolarHBondContact O-N 3.33Å
6	K	39.2	Very low	38.5	Very low	185 Å²	185	137.1 Å²	137.1	80%	0.804	70%	0.704	S	S	*	*			trans	-92.3	118	179.1	-80.2	-173.7	173.2	-175.9	0	108.7	S4	S4-K6 PolarHBondContact O-N 3.11Å; S4-K6 VanDerWaalsContact O-N 3.1Å
7	D	36.2	Very low	38.3	Very low	116 Å²	116	135.2 Å²	135.2	62%	0.62	70%	0.696	S	S	*	*			trans	-52.7	127.6	175.1	-75	-55.6	0	0	0	111.3	D9	D7-D9 PolarHBondContact O-N 3.27Å
8	P	42.2	Very low	38.1	Very low	99 Å²	99	133.8 Å²	133.8	64%	0.643	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-72.6	-13.1	176.6	30.6	-35.1	0	0	0	112.8	L10	P8-L10 PolarHBondContact O-N 3.11Å
9	D	40.5	Very low	38	Very low	100 Å²	100	130.6 Å²	130.6	54%	0.535	69%	0.694	S	S	.	*	G	3₁₀ helix	trans	-73.9	-24.5	-172.3	-70.2	-37.4	0	0	0	114.2	D7 L11 N12	D7-D9 PolarHBondContact O-N 3.27Å; D9-L11 PolarHBondContact O-N 2.88Å; D9-N12 PolarHBondContact O-N 2.96Å; D9-N12 PolarHBondContact OD1-ND2 3.27Å
10	L	37.2	Very low	38	Very low	133 Å²	133	132 Å²	132	70%	0.696	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-61.3	-6	175.7	-76.2	168.9	0	0	0	114.5	P8	P8-L10 PolarHBondContact O-N 3.11Å
11	L	35	Very low	38.2	Very low	139 Å²	139	131.9 Å²	131.9	73%	0.728	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-101.9	-6.7	173.1	-83.9	167.3	0	0	0	114.3	D9	D9-L11 PolarHBondContact O-N 2.88Å
12	N	40.1	Very low	38.2	Very low	57 Å²	57	122 Å²	122	31%	0.305	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.6	-47.5	175.5	-69.5	-54.5	0	0	0	111.3	D9 R616	D9-N12 PolarHBondContact O-N 2.96Å; D9-N12 PolarHBondContact OD1-ND2 3.27Å; N12-R616 PolarHBondContact OD1-NH1 3.47Å; N12-R616 PolarHBondContact OD1-NH2 2.64Å
13	E	35.4	Very low	38.9	Very low	133 Å²	133	118.2 Å²	118.2	62%	0.621	63%	0.631	S	S	*	*	H	α-helix	trans	-62.4	-48	-171.6	-59.5	-175.4	159.6	0	0	113.6	T15	E13-T15 VanDerWaalsContact C-N 3.26Å; E13-T15 PolarHBondContact O-N 2.94Å; E13-T15 VanDerWaalsContact O-N 3.13Å
14	E	35.7	Very low	39.2	Very low	171 Å²	171	118.8 Å²	118.8	80%	0.799	62%	0.621	S	S	*	*	H	α-helix	trans	-74.9	-5.3	-166.5	-149.1	-173.4	-150.5	0	0	114.9
15	T	45.9	Very low	39.4	Very low	73 Å²	73	119.4 Å²	119.4	45%	0.448	61%	0.613	S	S	.	*	H	α-helix	trans	-115.3	-21.5	-172.2	-52	0	0	0	0	115	E13	E13-T15 VanDerWaalsContact C-N 3.26Å; E13-T15 PolarHBondContact O-N 2.94Å; E13-T15 VanDerWaalsContact O-N 3.13Å
16	F	37.7	Very low	39.9	Very low	153 Å²	153	114.9 Å²	114.9	67%	0.671	60%	0.595	S	S	*	*	H	α-helix	trans	-135.4	-17.8	-173.4	-73.9	-77.8	0	0	0	116.3
17	D	35.9	Very low	40.4	Very low	106 Å²	106	113 Å²	113	57%	0.567	59%	0.589	S	S	*	*	S	Bend	trans	-94.4	-10.3	-173.3	-62	-42.8	0	0	0	114	A19	D17-A19 VanDerWaalsContact C-N 3.27Å; D17-A19 PolarHBondContact O-N 2.83Å
18	C	33.4	Very low	40.9	Very low	110 Å²	110	112.3 Å²	112.3	74%	0.743	58%	0.582	S	S	*	*			trans	-85.2	31.6	-179.3	-49.8	0	0	0	0	115.1
19	A	36.5	Very low	41.3	Very low	73 Å²	73	112 Å²	112	60%	0.603	58%	0.575	S	S	*	*			trans	-122.3	95.7	175.3	0	0	0	0	0	109.2	D17	D17-A19 VanDerWaalsContact C-N 3.27Å; D17-A19 PolarHBondContact O-N 2.83Å
20	E	37.8	Very low	42.1	Very low	157 Å²	157	113.1 Å²	113.1	73%	0.734	58%	0.577	S	S	*	*			trans	-70	156.2	-172	-158.4	163.6	-144.2	0	0	111	G22 D23	E20-G22 VanDerWaalsContact C-N 3.3Å; E20-G22 PolarHBondContact O-N 3.48Å; E20-D23 WeakPolarHBondContact CB-OD2 3.35Å; E20-D23 PolarHBondContact N-OD2 3.1Å; E20-D23 PolarHBondContact O-N 3.28Å
21	I	41.9	Very low	42.6	Very low	130 Å²	130	112.7 Å²	112.7	67%	0.667	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	86.3	-173.8	-63.7	177.9	0	0	0	109.5
22	G	38.8	Very low	43.2	Very low	23 Å²	23	108.5 Å²	108.5	24%	0.237	55%	0.55	C	S	.	.	T	Hydrogen-bonded Turn	trans	144.3	-19.6	-175.5	0	0	0	0	0	112.9	E20 W24 E25 N26	E20-G22 VanDerWaalsContact C-N 3.3Å; E20-G22 PolarHBondContact O-N 3.48Å; G22-W24 VanDerWaalsContact C-N 3.27Å; G22-W24 PolarHBondContact O-N 3.39Å; G22-E25 PolarHBondContact O-N 2.88Å; G22-N26 PolarHBondContact O-N 3.34Å; G22-N26 VanDerWaalsContact O-N 3.1Å
23	D	47.9	Very low	43.7	Very low	63 Å²	63	110.6 Å²	110.6	34%	0.337	56%	0.558	S	S	.	*	H	α-helix	trans	-61.3	-30.7	-174.5	-88	-27.1	0	0	0	114	E20 E25 N26 E27	E20-D23 WeakPolarHBondContact CB-OD2 3.35Å; E20-D23 PolarHBondContact N-OD2 3.1Å; E20-D23 PolarHBondContact O-N 3.28Å; D23-E25 VanDerWaalsContact C-N 3.34Å; D23-E25 PolarHBondContact O-N 3.48Å; D23-N26 PolarHBondContact O-N 3.06Å; D23-E27 VanDerWaalsContact O-CB 3.3Å; D23-E27 WeakPolarHBondContact O-CB 3.16Å; D23-E27 WeakPolarHBondContact O-CG 3.42Å; D23-E27 PolarHBondContact O-N 3.18Å
24	W	43.9	Very low	44.4	Very low	178 Å²	178	108.3 Å²	108.3	67%	0.674	55%	0.55	S	S	*	.	H	α-helix	trans	-70.9	-30	178.2	81.8	-85.2	0	0	0	112.6	G22 H28	G22-W24 VanDerWaalsContact C-N 3.27Å; G22-W24 PolarHBondContact O-N 3.39Å; W24-H28 WeakPolarHBondContact O-CB 3.31Å; W24-H28 PolarHBondContact O-N 2.86Å
25	E	44.9	Very low	44.6	Very low	115 Å²	115	105.5 Å²	105.5	54%	0.537	54%	0.535	S	S	.	.	H	α-helix	trans	-75.6	-40.9	173.7	-61.2	-173.8	155.8	0	0	109.8	G22 D23 H28 D29	G22-E25 PolarHBondContact O-N 2.88Å; D23-E25 VanDerWaalsContact C-N 3.34Å; D23-E25 PolarHBondContact O-N 3.48Å; E25-H28 PolarHBondContact O-N 3Å; E25-D29 WeakPolarHBondContact O-CB 3.47Å; E25-D29 PolarHBondContact O-N 3.04Å
26	N	50.8	Low	44.5	Very low	99 Å²	99	109 Å²	109	53%	0.529	55%	0.546	S	S	.	.	H	α-helix	trans	-65.9	-40.5	173.3	-79.4	-37.1	0	0	0	113.3	G22 D23 Q30	G22-N26 PolarHBondContact O-N 3.34Å; G22-N26 VanDerWaalsContact O-N 3.1Å; D23-N26 PolarHBondContact O-N 3.06Å; N26-Q30 VanDerWaalsContact O-CB 3.27Å; N26-Q30 WeakPolarHBondContact O-CB 3.47Å; N26-Q30 WeakPolarHBondContact O-CG 3.32Å; N26-Q30 PolarHBondContact O-N 3.05Å
27	E	50.3	Low	44.9	Very low	146 Å²	146	108.4 Å²	108.4	68%	0.682	54%	0.543	S	S	*	.	H	α-helix	trans	-66	-40.2	172.6	-81.6	-158.1	141.8	0	0	110.7	D23 F31	D23-E27 VanDerWaalsContact O-CB 3.3Å; D23-E27 WeakPolarHBondContact O-CB 3.16Å; D23-E27 WeakPolarHBondContact O-CG 3.42Å; D23-E27 PolarHBondContact O-N 3.18Å; E27-F31 WeakPolarHBondContact O-CB 3.29Å; E27-F31 PolarHBondContact O-N 3.2Å
28	H	46.3	Very low	45.2	Very low	101 Å²	101	108.7 Å²	108.7	47%	0.468	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-47	176.1	179.8	-87.7	0	0	0	111.6	W24 E25 F31 V32	W24-H28 WeakPolarHBondContact O-CB 3.31Å; W24-H28 PolarHBondContact O-N 2.86Å; E25-H28 PolarHBondContact O-N 3Å; H28-F31 CarbonylContact O-C 3.32Å; H28-F31 WeakPolarHBondContact O-CB 3.46Å; H28-F31 PolarHBondContact O-N 2.87Å; H28-F31 VanDerWaalsContact O-N 3.15Å; H28-V32 WeakPolarHBondContact O-CB 3.45Å; H28-V32 WeakPolarHBondContact O-CG2 3.28Å; H28-V32 PolarHBondContact O-N 2.9Å
29	D	51.8	Low	45.3	Very low	91 Å²	91	105.4 Å²	105.4	49%	0.487	53%	0.527	S	S	.	.	H	α-helix	trans	-71.9	-33.3	179.1	-88.6	19.4	0	0	0	112.3	E25 Q33	E25-D29 WeakPolarHBondContact O-CB 3.47Å; E25-D29 PolarHBondContact O-N 3.04Å; D29-Q33 VanDerWaalsContact O-CB 3.23Å; D29-Q33 WeakPolarHBondContact O-CB 3.22Å; D29-Q33 WeakPolarHBondContact O-CG 3.28Å; D29-Q33 PolarHBondContact O-N 3.06Å
30	Q	55.9	Low	45.3	Very low	125 Å²	125	111 Å²	111	58%	0.584	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-41.5	166.1	-79.2	-167.8	43.3	0	0	111.5	N26 Q33 N34	N26-Q30 VanDerWaalsContact O-CB 3.27Å; N26-Q30 WeakPolarHBondContact O-CB 3.47Å; N26-Q30 WeakPolarHBondContact O-CG 3.32Å; N26-Q30 PolarHBondContact O-N 3.05Å; Q30-Q33 PolarHBondContact O-N 3.33Å; Q30-N34 WeakPolarHBondContact O-CB 3.29Å; Q30-N34 PolarHBondContact O-N 3.41Å; Q30-N34 PolarHBondContact O-ND2 2.98Å
31	F	47.7	Very low	45.3	Very low	124 Å²	124	112.2 Å²	112.2	54%	0.544	55%	0.546	S	S	.	.	H	α-helix	trans	-63.2	-45.8	177.3	179.4	-92	0	0	0	111.3	E27 H28 N34 F35	E27-F31 WeakPolarHBondContact O-CB 3.29Å; E27-F31 PolarHBondContact O-N 3.2Å; H28-F31 CarbonylContact O-C 3.32Å; H28-F31 WeakPolarHBondContact O-CB 3.46Å; H28-F31 PolarHBondContact O-N 2.87Å; H28-F31 VanDerWaalsContact O-N 3.15Å; F31-N34 PolarHBondContact O-N 2.81Å; F31-F35 HydrophobicContact CD1-CD2 4.17Å; F31-F35 HydrophobicContact CD2-CD2 4.33Å; F31-F35 HydrophobicContact CD2-CE2 4.42Å; F31-F35 AromaticContact CE1-CD2 3.72Å; F31-F35 HydrophobicContact CE1-CD2 3.72Å; F31-F35 AromaticContact CE1-CE2 3.84Å; F31-F35 HydrophobicContact CE1-CE2 3.84Å; F31-F35 AromaticContact CE2-CD2 3.91Å; F31-F35 HydrophobicContact CE2-CD2 3.91Å; F31-F35 AromaticContact CE2-CE2 3.59Å; F31-F35 HydrophobicContact CE2-CE2 3.59Å; F31-F35 HydrophobicContact CG-CD2 4.45Å; F31-F35 AromaticContact CZ-CD2 3.59Å; F31-F35 HydrophobicContact CZ-CD2 3.59Å; F31-F35 AromaticContact CZ-CE2 3.24Å; F31-F35 HydrophobicContact CZ-CE2 3.24Å; F31-F35 HydrophobicContact CZ-CZ 4.11Å; F31-F35 WeakPolarHBondContact O-CB 3.35Å; F31-F35 PolarHBondContact O-N 3.02Å
32	V	48.6	Very low	44.8	Very low	51 Å²	51	110 Å²	110	31%	0.309	54%	0.543	S	S	.	.	H	α-helix	trans	-65	-44.7	176.3	168.7	0	0	0	0	111.5	H28 N34 F35 H36	H28-V32 WeakPolarHBondContact O-CB 3.45Å; H28-V32 WeakPolarHBondContact O-CG2 3.28Å; H28-V32 PolarHBondContact O-N 2.9Å; V32-N34 PolarHBondContact O-N 3.24Å; V32-F35 PolarHBondContact O-N 3.39Å; V32-H36 WeakPolarHBondContact O-CB 3.18Å; V32-H36 PolarHBondContact O-CD2 3.45Å; V32-H36 PolarHBondContact O-N 2.93Å
33	Q	51.2	Low	44.3	Very low	101 Å²	101	114 Å²	114	47%	0.472	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-37	175.4	-75	-178	44.6	0	0	112.6	D29 Q30 K37	D29-Q33 VanDerWaalsContact O-CB 3.23Å; D29-Q33 WeakPolarHBondContact O-CB 3.22Å; D29-Q33 WeakPolarHBondContact O-CG 3.28Å; D29-Q33 PolarHBondContact O-N 3.06Å; Q30-Q33 PolarHBondContact O-N 3.33Å; Q33-K37 WeakPolarHBondContact O-CB 3.23Å; Q33-K37 WeakPolarHBondContact O-CD 3.38Å; Q33-K37 VanDerWaalsContact O-CG 3.23Å; Q33-K37 WeakPolarHBondContact O-CG 3.35Å; Q33-K37 PolarHBondContact O-N 2.83Å
34	N	49.3	Very low	43.5	Very low	85 Å²	85	115.1 Å²	115.1	46%	0.455	57%	0.573	S	S	.	*	H	α-helix	trans	-73.8	-35.1	177	-71.9	-34.4	0	0	0	111.5	Q30 F31 V32 K37 V38	Q30-N34 WeakPolarHBondContact O-CB 3.29Å; Q30-N34 PolarHBondContact O-N 3.41Å; Q30-N34 PolarHBondContact O-ND2 2.98Å; F31-N34 PolarHBondContact O-N 2.81Å; V32-N34 PolarHBondContact O-N 3.24Å; N34-K37 PolarHBondContact O-N 3.15Å; N34-V38 WeakPolarHBondContact O-CB 3.26Å; N34-V38 VanDerWaalsContact O-CG2 3.24Å; N34-V38 WeakPolarHBondContact O-CG2 3.49Å; N34-V38 PolarHBondContact O-N 3.37Å; N34-V38 VanDerWaalsContact O-N 3.12Å
35	F	39.8	Very low	42.9	Very low	112 Å²	112	110.5 Å²	110.5	49%	0.491	57%	0.573	S	S	.	*	H	α-helix	trans	-61.9	-52.4	168.3	-107.2	-97.6	0	0	0	110.7	F31 V32 K37 V38 S39	F31-F35 HydrophobicContact CD1-CD2 4.17Å; F31-F35 HydrophobicContact CD2-CD2 4.33Å; F31-F35 HydrophobicContact CD2-CE2 4.42Å; F31-F35 AromaticContact CE1-CD2 3.72Å; F31-F35 HydrophobicContact CE1-CD2 3.72Å; F31-F35 AromaticContact CE1-CE2 3.84Å; F31-F35 HydrophobicContact CE1-CE2 3.84Å; F31-F35 AromaticContact CE2-CD2 3.91Å; F31-F35 HydrophobicContact CE2-CD2 3.91Å; F31-F35 AromaticContact CE2-CE2 3.59Å; F31-F35 HydrophobicContact CE2-CE2 3.59Å; F31-F35 HydrophobicContact CG-CD2 4.45Å; F31-F35 AromaticContact CZ-CD2 3.59Å; F31-F35 HydrophobicContact CZ-CD2 3.59Å; F31-F35 AromaticContact CZ-CE2 3.24Å; F31-F35 HydrophobicContact CZ-CE2 3.24Å; F31-F35 HydrophobicContact CZ-CZ 4.11Å; F31-F35 WeakPolarHBondContact O-CB 3.35Å; F31-F35 PolarHBondContact O-N 3.02Å; V32-F35 PolarHBondContact O-N 3.39Å; F35-K37 PolarHBondContact O-N 2.79Å; F35-V38 CarbonylContact O-C 3.59Å; F35-V38 PolarHBondContact O-N 3.49Å; F35-S39 WeakPolarHBondContact O-CB 3.49Å; F35-S39 PolarHBondContact O-N 2.75Å; F35-S39 PolarHBondContact O-OG 3.24Å; F35-S39 VanDerWaalsContact O-OG 3.13Å
36	H	43.7	Very low	42.4	Very low	145 Å²	145	111.9 Å²	111.9	67%	0.671	58%	0.584	S	S	*	*	H	α-helix	trans	-61.1	-28.9	178	-82.3	-58	0	0	0	114.1	V32	V32-H36 WeakPolarHBondContact O-CB 3.18Å; V32-H36 PolarHBondContact O-CD2 3.45Å; V32-H36 PolarHBondContact O-N 2.93Å
37	K	46.2	Very low	41.7	Very low	141 Å²	141	114.2 Å²	114.2	61%	0.613	59%	0.592	S	S	*	*	H	α-helix	trans	-79.6	-12.6	172.8	-74.5	166.9	-175.3	158.7	0	114.5	Q33 N34 F35	Q33-K37 WeakPolarHBondContact O-CB 3.23Å; Q33-K37 WeakPolarHBondContact O-CD 3.38Å; Q33-K37 VanDerWaalsContact O-CG 3.23Å; Q33-K37 WeakPolarHBondContact O-CG 3.35Å; Q33-K37 PolarHBondContact O-N 2.83Å; N34-K37 PolarHBondContact O-N 3.15Å; F35-K37 PolarHBondContact O-N 2.79Å
38	V	43.1	Very low	40.8	Very low	113 Å²	113	113 Å²	113	69%	0.685	59%	0.59	S	S	*	*	H	α-helix	trans	-107.2	-21.1	177.6	172.7	0	0	0	0	111.6	N34 F35 E40	N34-V38 WeakPolarHBondContact O-CB 3.26Å; N34-V38 VanDerWaalsContact O-CG2 3.24Å; N34-V38 WeakPolarHBondContact O-CG2 3.49Å; N34-V38 PolarHBondContact O-N 3.37Å; N34-V38 VanDerWaalsContact O-N 3.12Å; F35-V38 CarbonylContact O-C 3.59Å; F35-V38 PolarHBondContact O-N 3.49Å; V38-E40 PolarHBondContact O-N 2.9Å
39	S	36	Very low	40.1	Very low	40 Å²	40	112.2 Å²	112.2	28%	0.28	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	26.1	-177.4	-60.3	0	0	0	0	115.1	F35 E41 S42	F35-S39 WeakPolarHBondContact O-CB 3.49Å; F35-S39 PolarHBondContact O-N 2.75Å; F35-S39 PolarHBondContact O-OG 3.24Å; F35-S39 VanDerWaalsContact O-OG 3.13Å; S39-E41 PolarHBondContact O-N 3.4Å; S39-S42 PolarHBondContact O-N 2.96Å; S39-S42 PolarHBondContact O-OG 2.96Å
40	E	36.2	Very low	39.3	Very low	191 Å²	191	115.4 Å²	115.4	89%	0.893	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-27.9	160.1	-74.4	-164.1	139.5	0	0	111	V38 S42	V38-E40 PolarHBondContact O-N 2.9Å; E40-S42 PolarHBondContact O-N 3.41Å
41	E	36.3	Very low	38.3	Very low	182 Å²	182	117 Å²	117	85%	0.85	61%	0.608	S	S	*	*	S	Bend	trans	-94.1	71.9	159.6	-68.7	-174.9	142.9	0	0	110	S39	S39-E41 PolarHBondContact O-N 3.4Å
42	S	31.3	Very low	37.6	Very low	85 Å²	85	121.6 Å²	121.6	59%	0.594	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-65.8	125.1	161.9	-67.1	0	0	0	0	108.5	S39 E40 T44	S39-S42 PolarHBondContact O-N 2.96Å; S39-S42 PolarHBondContact O-OG 2.96Å; E40-S42 PolarHBondContact O-N 3.41Å; S42-T44 PolarHBondContact O-N 3.14Å
43	P	29.9	Very low	36.8	Very low	107 Å²	107	125.2 Å²	125.2	70%	0.695	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-61.5	127.3	179.8	25.2	-33.4	0	0	0	109.7
44	T	31.1	Very low	35.9	Very low	85 Å²	85	126.2 Å²	126.2	52%	0.521	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-59.2	143.9	173.8	31.9	0	0	0	0	109.7	S42 D46 E47	S42-T44 PolarHBondContact O-N 3.14Å; T44-D46 PolarHBondContact O-N 2.83Å; T44-E47 PolarHBondContact O-N 3.17Å
45	A	30.8	Very low	35.1	Very low	82 Å²	82	128.6 Å²	128.6	68%	0.678	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-57.2	-23.7	-175.5	0	0	0	0	0	113.2	E47	A45-E47 VanDerWaalsContact C-N 3.28Å; A45-E47 PolarHBondContact O-N 2.94Å
46	D	33.8	Very low	34.6	Very low	144 Å²	144	126.2 Å²	126.2	77%	0.77	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-71.5	-13.6	176.8	-47.7	-65.2	0	0	0	114.5	T44	T44-D46 PolarHBondContact O-N 2.83Å
47	E	36.9	Very low	34	Very low	148 Å²	148	121.7 Å²	121.7	69%	0.692	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-93.1	12.3	179.1	-64	-155.7	147.2	0	0	114.2	T44 A45	T44-E47 PolarHBondContact O-N 3.17Å; A45-E47 VanDerWaalsContact C-N 3.28Å; A45-E47 PolarHBondContact O-N 2.94Å
48	L	31.8	Very low	33.3	Very low	121 Å²	121	119.1 Å²	119.1	63%	0.634	66%	0.664	S	S	*	*	S	Bend	trans	-54.4	139.1	169.5	-83.5	168.9	0	0	0	111.4	K50	L48-K50 PolarHBondContact O-N 3.09Å
49	P	31.6	Very low	32.7	Very low	84 Å²	84	117.5 Å²	117.5	55%	0.545	66%	0.657	S	S	.	*			trans	-53.7	126.7	-178.3	-29.2	36.1	0	0	0	112.9	F51	P49-F51 HydrophobicContact CB-CD2 3.97Å; P49-F51 PolarHBondContact O-N 3.1Å
50	K	35.1	Very low	32.7	Very low	158 Å²	158	122.4 Å²	122.4	69%	0.687	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-68.1	16.7	-168.5	-63.4	-176.5	178.7	179.4	0	116.3	L48 W52 N53	L48-K50 PolarHBondContact O-N 3.09Å; K50-W52 PolarHBondContact O-N 3.03Å; K50-W52 VanDerWaalsContact O-N 3.09Å; K50-N53 PolarHBondContact O-N 3.47Å
51	F	33.9	Very low	32.3	Very low	158 Å²	158	118.5 Å²	118.5	69%	0.693	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-52.7	-27.6	173.2	-83.5	-89.4	0	0	0	113.5	P49 N53	P49-F51 HydrophobicContact CB-CD2 3.97Å; P49-F51 PolarHBondContact O-N 3.1Å; F51-N53 VanDerWaalsContact C-N 3.3Å; F51-N53 PolarHBondContact O-N 2.9Å
52	W	34.2	Very low	32.2	Very low	220 Å²	220	119.6 Å²	119.6	83%	0.833	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-76.1	-11.1	177.3	-59.5	104.2	0	0	0	114.6	K50	K50-W52 PolarHBondContact O-N 3.03Å; K50-W52 VanDerWaalsContact O-N 3.09Å
53	N	31.1	Very low	31.9	Very low	128 Å²	128	122.2 Å²	122.2	68%	0.684	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-8.3	-176.6	-73.1	-44.4	0	0	0	114.1	K50 F51 S55	K50-N53 PolarHBondContact O-N 3.47Å; F51-N53 VanDerWaalsContact C-N 3.3Å; F51-N53 PolarHBondContact O-N 2.9Å; N53-S55 PolarHBondContact O-N 2.61Å; N53-S55 VanDerWaalsContact O-N 3.17Å
54	D	32.1	Very low	31.9	Very low	122 Å²	122	123 Å²	123	65%	0.652	66%	0.661	S	S	*	*			trans	-76.5	102.8	174.1	-84.7	-31.4	0	0	0	109.8	G56	D54-G56 PolarHBondContact O-N 2.79Å
55	S	31.7	Very low	31.7	Very low	134 Å²	134	125.1 Å²	125.1	94%	0.937	67%	0.669	S	S	*	*			trans	-70.2	24.8	-179.1	49.9	0	0	0	0	114.7	N53	N53-S55 PolarHBondContact O-N 2.61Å; N53-S55 VanDerWaalsContact O-N 3.17Å
56	G	31	Very low	31.7	Very low	63 Å²	63	128.8 Å²	128.8	65%	0.649	68%	0.677	S	S	*	*	S	Bend	trans	-104.2	84.6	-175.7	0	0	0	0	0	114	D54 L58	D54-G56 PolarHBondContact O-N 2.79Å; G56-L58 PolarHBondContact O-N 3.26Å
57	G	29.6	Very low	31.5	Very low	49 Å²	49	130.1 Å²	130.1	51%	0.505	68%	0.684	S	S	.	*			trans	70.7	31.2	152.2	0	0	0	0	0	117.9	S59	G57-S59 PolarHBondContact O-N 3.13Å
58	L	31.9	Very low	31	Very low	88 Å²	88	127.2 Å²	127.2	46%	0.461	69%	0.693	S	S	.	*	G	3₁₀ helix	trans	-64.2	-1.2	173.4	-67.8	174.3	0	0	0	114.6	G56 F60 L61	G56-L58 PolarHBondContact O-N 3.26Å; L58-F60 PolarHBondContact O-N 3.16Å; L58-L61 HydrophobicContact CD2-CD1 4.1Å; L58-L61 PolarHBondContact O-N 2.9Å; L58-L61 VanDerWaalsContact O-N 3.14Å
59	S	30.3	Very low	30.8	Very low	78 Å²	78	127.2 Å²	127.2	55%	0.545	70%	0.702	S	S	.	*	G	3₁₀ helix	trans	-59	-25.6	176.6	42	0	0	0	0	113.9	G57 L61 W62 Q63	G57-S59 PolarHBondContact O-N 3.13Å; S59-L61 PolarHBondContact O-N 3.29Å; S59-W62 PolarHBondContact O-N 3.04Å; S59-Q63 WeakPolarHBondContact O-CG 3.49Å; S59-Q63 PolarHBondContact O-N 3.09Å
60	F	35.4	Very low	30.5	Very low	143 Å²	143	127 Å²	127	63%	0.627	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-66.3	-23.1	176.8	88.8	-88.3	0	0	0	113.6	L58 W62	L58-F60 PolarHBondContact O-N 3.16Å; F60-W62 VanDerWaalsContact C-N 3.27Å; F60-W62 PolarHBondContact O-N 3.11Å
61	L	29.1	Very low	30.2	Very low	110 Å²	110	126 Å²	126	58%	0.576	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-78.3	-11.6	178.1	-87.6	159.6	0	0	0	113.3	L58 S59	L58-L61 HydrophobicContact CD2-CD1 4.1Å; L58-L61 PolarHBondContact O-N 2.9Å; L58-L61 VanDerWaalsContact O-N 3.14Å; S59-L61 PolarHBondContact O-N 3.29Å
62	W	33	Very low	30	Very low	205 Å²	205	126.1 Å²	126.1	78%	0.777	73%	0.728	S	S	*	*	S	Bend	trans	-128.8	7.5	-174.2	-61.4	100.2	0	0	0	113.4	S59 F60 T64	S59-W62 PolarHBondContact O-N 3.04Å; F60-W62 VanDerWaalsContact C-N 3.27Å; F60-W62 PolarHBondContact O-N 3.11Å; W62-T64 PolarHBondContact O-N 3.46Å
63	Q	26.5	Very low	30	Very low	140 Å²	140	120.4 Å²	120.4	65%	0.654	73%	0.727	S	S	*	*			trans	-75.6	105.3	173.1	-88.4	175.3	-38.5	0	0	110.7	S59 D65	S59-Q63 WeakPolarHBondContact O-CG 3.49Å; S59-Q63 PolarHBondContact O-N 3.09Å; Q63-D65 PolarHBondContact O-N 3.11Å
64	T	29.6	Very low	30.1	Very low	124 Å²	124	121.5 Å²	121.5	76%	0.761	73%	0.734	S	S	*	*			trans	-74.1	-2.1	171.7	39.8	0	0	0	0	113.8	W62 D66	W62-T64 PolarHBondContact O-N 3.46Å; T64-D66 PolarHBondContact O-N 3.32Å
65	D	26.8	Very low	30.3	Very low	128 Å²	128	122.9 Å²	122.9	68%	0.684	74%	0.741	S	S	*	*			trans	-109.6	50.7	-147.5	-56.6	-15.3	0	0	0	113.6	Q63	Q63-D65 PolarHBondContact O-N 3.11Å
66	D	30.1	Very low	30.1	Very low	160 Å²	160	120.2 Å²	120.2	86%	0.856	74%	0.735	S	S	*	*	S	Bend	trans	-143.1	19.2	174.5	-136.9	-2.2	0	0	0	115	T64	T64-D66 PolarHBondContact O-N 3.32Å
67	L	30.2	Very low	30.1	Very low	172 Å²	172	120.8 Å²	120.8	90%	0.901	74%	0.74	S	S	*	*			trans	-121.2	69.9	168.5	-85.4	171	0	0	0	111	C69	L67-C69 PolarHBondContact O-N 2.84Å
68	G	25	Very low	30.1	Very low	87 Å²	87	127 Å²	127	90%	0.897	76%	0.756	S	S	*	*			trans	-65	102.7	-178.4	0	0	0	0	0	113.9
69	C	29	Very low	30.2	Very low	120 Å²	120	132 Å²	132	81%	0.811	77%	0.774	S	S	*	*			trans	-137	73.4	164.4	-167.8	0	0	0	0	109.9	L67 V71	L67-C69 PolarHBondContact O-N 2.84Å; C69-V71 PolarHBondContact O-N 3.25Å
70	G	25	Very low	30.3	Very low	79 Å²	79	134 Å²	134	81%	0.814	78%	0.782	S	S	*	*			trans	-66.3	126.4	-171.4	0	0	0	0	0	114
71	V	29.6	Very low	30.3	Very low	139 Å²	139	132.1 Å²	132.1	84%	0.842	78%	0.783	S	S	*	*			trans	-111.8	110.8	159.8	179.4	0	0	0	0	106.5	C69 A73	C69-V71 PolarHBondContact O-N 3.25Å; V71-A73 PolarHBondContact O-N 3.35Å
72	I	28.2	Very low	30.5	Very low	159 Å²	159	131.4 Å²	131.4	82%	0.815	78%	0.779	S	S	*	*			trans	-75.4	113.1	-175.7	-57.2	171.6	0	0	0	108.5
73	A	35	Very low	30.7	Very low	100 Å²	100	126.4 Å²	126.4	83%	0.826	77%	0.771	S	S	*	*			trans	-82.1	115.5	161.1	0	0	0	0	0	107.9	V71	V71-A73 PolarHBondContact O-N 3.35Å
74	D	32.7	Very low	31.1	Very low	152 Å²	152	125.9 Å²	125.9	81%	0.813	77%	0.769	S	S	*	*			trans	-86.9	153	179.2	-159.8	5.9	0	0	0	111.2
75	D	36.5	Very low	31.5	Very low	151 Å²	151	125 Å²	125	81%	0.807	76%	0.756	S	S	*	*	S	Bend	trans	58.3	99.3	173.4	-151.7	5.8	0	0	0	120
76	G	28.2	Very low	32	Very low	78 Å²	78	121.8 Å²	121.8	80%	0.804	74%	0.741	S	S	*	*				83.4	88.1	124.7	0	0	0	0	0	120.2
77	G	30.9	Very low	32.1	Very low	74 Å²	74	118.9 Å²	118.9	76%	0.763	73%	0.725	S	S	*	*			trans	170.2	50.9	166.1	0	0	0	0	0	118	K79	G77-K79 PolarHBondContact O-N 2.92Å; G77-K79 VanDerWaalsContact O-N 3.14Å
78	E	29	Very low	32.3	Very low	181 Å²	181	116.4 Å²	116.4	85%	0.846	71%	0.709	S	S	*	*			trans	-62.6	113.7	179.6	-171.3	175.7	-149	0	0	112.2	V80	E78-V80 HydrophobicContact CG-CG2 4.04Å
79	K	33.3	Very low	33.1	Very low	192 Å²	192	118.8 Å²	118.8	84%	0.835	70%	0.695	S	S	*	*			trans	-115.2	87.7	167	-81.1	-166.9	174.4	-173.6	0	109.7	G77 V81	G77-K79 PolarHBondContact O-N 2.92Å; G77-K79 VanDerWaalsContact O-N 3.14Å; K79-V81 PolarHBondContact O-N 3.49Å; K79-V81 VanDerWaalsContact O-N 3.11Å
80	V	33.2	Very low	33.3	Very low	119 Å²	119	119.2 Å²	119.2	72%	0.721	69%	0.688	S	S	*	*			trans	-63.2	110.4	163	-175.1	0	0	0	0	107.4	E78	E78-V80 HydrophobicContact CG-CG2 4.04Å
81	V	35.3	Very low	33.8	Very low	105 Å²	105	120.8 Å²	120.8	64%	0.636	68%	0.682	S	S	*	*			trans	-80.4	117.5	168.5	176.2	0	0	0	0	106.6	K79 V83	K79-V81 PolarHBondContact O-N 3.49Å; K79-V81 VanDerWaalsContact O-N 3.11Å; V81-V83 PolarHBondContact O-N 3.42Å; V81-V83 VanDerWaalsContact O-N 3.13Å
82	D	34.2	Very low	33.8	Very low	94 Å²	94	117.5 Å²	117.5	50%	0.503	67%	0.665	S	S	.	*			trans	-68.6	112.7	-179.9	-162.3	-34.6	0	0	0	109.8	E84 E85 T86	D82-E84 PolarHBondContact O-N 2.86Å; D82-E84 WeakPolarHBondContact OD1-CB 3.31Å; D82-E84 PolarHBondContact OD1-N 3.17Å; D82-E85 HydrophobicContact CB-CB 4.07Å; D82-E85 PolarHBondContact O-N 2.95Å; D82-T86 WeakPolarHBondContact O-CB 3.46Å; D82-T86 PolarHBondContact O-N 3.49Å; D82-T86 VanDerWaalsContact O-N 3.08Å; D82-T86 PolarHBondContact O-OG1 3.21Å
83	V	37.3	Very low	34.1	Very low	100 Å²	100	117.8 Å²	117.8	61%	0.606	67%	0.668	S	S	*	*	H	α-helix	trans	-66.4	-29.9	-178.8	-177.7	0	0	0	0	110.2	V81 T86 L87	V81-V83 PolarHBondContact O-N 3.42Å; V81-V83 VanDerWaalsContact O-N 3.13Å; V83-T86 PolarHBondContact O-N 3.02Å; V83-L87 HydrophobicContact CG1-CD1 4.01Å; V83-L87 HydrophobicContact CG1-CG 4.41Å; V83-L87 WeakPolarHBondContact O-CB 3.31Å; V83-L87 VanDerWaalsContact O-CG 3.29Å; V83-L87 WeakPolarHBondContact O-CG 3.25Å; V83-L87 PolarHBondContact O-N 3.41Å
84	E	33.4	Very low	34.1	Very low	130 Å²	130	122.1 Å²	122.1	61%	0.607	67%	0.671	S	S	*	*	H	α-helix	trans	-77.6	-38.4	-179	-159.7	166.5	160.3	0	0	111.6	D82 T86 L87 Q88	D82-E84 PolarHBondContact O-N 2.86Å; D82-E84 WeakPolarHBondContact OD1-CB 3.31Å; D82-E84 PolarHBondContact OD1-N 3.17Å; E84-T86 VanDerWaalsContact C-N 3.28Å; E84-T86 PolarHBondContact O-N 3.47Å; E84-L87 PolarHBondContact O-N 2.92Å; E84-Q88 WeakPolarHBondContact O-CB 3.44Å; E84-Q88 VanDerWaalsContact O-CG 3.29Å; E84-Q88 WeakPolarHBondContact O-CG 3.17Å; E84-Q88 PolarHBondContact O-N 3.14Å
85	E	38.2	Very low	34.2	Very low	104 Å²	104	120.3 Å²	120.3	49%	0.486	67%	0.666	S	S	.	*	H	α-helix	trans	-63.1	-37.6	169.5	-160.6	-159	149.5	0	0	111.3	D82 K89	D82-E85 HydrophobicContact CB-CB 4.07Å; D82-E85 PolarHBondContact O-N 2.95Å; E85-K89 PolarHBondContact O-N 2.86Å; E85-K89 WeakPolarHBondContact OE1-CE 3.47Å; E85-K89 IonicContact OE1-NZ 2.97Å; E85-K89 PolarHBondContact OE1-NZ 3.01Å
86	T	38.1	Very low	33.9	Very low	62 Å²	62	121.4 Å²	121.4	38%	0.38	66%	0.664	S	S	.	*	H	α-helix	trans	-67.6	-42.6	178.4	-54.7	0	0	0	0	111.5	D82 V83 E84 K89 L90	D82-T86 WeakPolarHBondContact O-CB 3.46Å; D82-T86 PolarHBondContact O-N 3.49Å; D82-T86 VanDerWaalsContact O-N 3.08Å; D82-T86 PolarHBondContact O-OG1 3.21Å; V83-T86 PolarHBondContact O-N 3.02Å; E84-T86 VanDerWaalsContact C-N 3.28Å; E84-T86 PolarHBondContact O-N 3.47Å; T86-K89 PolarHBondContact O-N 2.78Å; T86-L90 HydrophobicContact CG2-CD1 4.32Å; T86-L90 WeakPolarHBondContact O-CG 3.5Å; T86-L90 PolarHBondContact O-N 3.24Å; T86-L90 VanDerWaalsContact O-N 3.12Å
87	L	32.1	Very low	34	Very low	98 Å²	98	126.6 Å²	126.6	51%	0.513	67%	0.667	S	S	.	*	H	α-helix	trans	-68.2	-41	175.3	-74.6	168.9	0	0	0	112.2	V83 E84 K89 L90 V91	V83-L87 HydrophobicContact CG1-CD1 4.01Å; V83-L87 HydrophobicContact CG1-CG 4.41Å; V83-L87 WeakPolarHBondContact O-CB 3.31Å; V83-L87 VanDerWaalsContact O-CG 3.29Å; V83-L87 WeakPolarHBondContact O-CG 3.25Å; V83-L87 PolarHBondContact O-N 3.41Å; E84-L87 PolarHBondContact O-N 2.92Å; L87-K89 VanDerWaalsContact C-N 3.27Å; L87-K89 PolarHBondContact O-N 3.49Å; L87-L90 PolarHBondContact O-N 3.24Å; L87-V91 WeakPolarHBondContact O-CB 3.25Å; L87-V91 WeakPolarHBondContact O-CG2 3.41Å; L87-V91 PolarHBondContact O-N 2.81Å
88	Q	34.9	Very low	33.9	Very low	120 Å²	120	126.8 Å²	126.8	56%	0.561	65%	0.651	S	S	*	*	H	α-helix	trans	-62.1	-35.5	175.3	-72.8	177.2	17.2	0	0	112	E84 V91 S92	E84-Q88 WeakPolarHBondContact O-CB 3.44Å; E84-Q88 VanDerWaalsContact O-CG 3.29Å; E84-Q88 WeakPolarHBondContact O-CG 3.17Å; E84-Q88 PolarHBondContact O-N 3.14Å; Q88-V91 PolarHBondContact O-N 3.3Å; Q88-S92 PolarHBondContact O-N 3.13Å; Q88-S92 PolarHBondContact O-OG 3.2Å
89	K	41.1	Very low	34.1	Very low	138 Å²	138	123.5 Å²	123.5	60%	0.6	65%	0.645	S	S	*	*	H	α-helix	trans	-68.1	-30.5	171.4	-82.1	168.6	170.6	165.8	0	114.2	E85 T86 L87	E85-K89 PolarHBondContact O-N 2.86Å; E85-K89 WeakPolarHBondContact OE1-CE 3.47Å; E85-K89 IonicContact OE1-NZ 2.97Å; E85-K89 PolarHBondContact OE1-NZ 3.01Å; T86-K89 PolarHBondContact O-N 2.78Å; L87-K89 VanDerWaalsContact C-N 3.27Å; L87-K89 PolarHBondContact O-N 3.49Å
90	L	32.3	Very low	34.1	Very low	129 Å²	129	118.3 Å²	118.3	68%	0.675	64%	0.638	S	S	*	*	H	α-helix	trans	-81.4	-17	176.2	-72.8	165.6	0	0	0	113.6	T86 L87	T86-L90 HydrophobicContact CG2-CD1 4.32Å; T86-L90 WeakPolarHBondContact O-CG 3.5Å; T86-L90 PolarHBondContact O-N 3.24Å; T86-L90 VanDerWaalsContact O-N 3.12Å; L87-L90 PolarHBondContact O-N 3.24Å
91	V	36.9	Very low	34	Very low	112 Å²	112	118.5 Å²	118.5	68%	0.679	63%	0.633	S	S	*	*	S	Bend	trans	-106.8	6.2	-178.5	178.2	0	0	0	0	112.1	L87 Q88	L87-V91 WeakPolarHBondContact O-CB 3.25Å; L87-V91 WeakPolarHBondContact O-CG2 3.41Å; L87-V91 PolarHBondContact O-N 2.81Å; Q88-V91 PolarHBondContact O-N 3.3Å
92	S	29.5	Very low	33.7	Very low	69 Å²	69	120 Å²	120	48%	0.483	64%	0.637	S	S	.	*			trans	-86	110.9	177	-67.4	0	0	0	0	111.8	Q88 E94	Q88-S92 PolarHBondContact O-N 3.13Å; Q88-S92 PolarHBondContact O-OG 3.2Å; S92-E94 PolarHBondContact O-N 3.14Å
93	D	33.6	Very low	33.6	Very low	166 Å²	166	121.3 Å²	121.3	89%	0.888	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	1.9	-170.7	-74.3	-45.6	0	0	0	117.7
94	E	35.7	Very low	33.1	Very low	191 Å²	191	124.6 Å²	124.6	89%	0.893	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	14.4	-167.1	-63.2	-163	147.2	0	0	116	S92	S92-E94 PolarHBondContact O-N 3.14Å
95	T	34.7	Very low	32.8	Very low	113 Å²	113	123.6 Å²	123.6	69%	0.693	66%	0.664	S	S	*	*			trans	-129.7	0.7	-173.5	53.5	0	0	0	0	117.8	E97	T95-E97 PolarHBondContact O-N 2.81Å; T95-E97 VanDerWaalsContact O-N 3.11Å
96	F	30.7	Very low	32.3	Very low	175 Å²	175	128.8 Å²	128.8	77%	0.768	68%	0.679	S	S	*	*			trans	-87.5	64	180	-85.9	-81.8	0	0	0	114.3
97	E	29.1	Very low	31.8	Very low	186 Å²	186	134.9 Å²	134.9	87%	0.869	70%	0.7	S	S	*	*			trans	-111.8	59.6	164	-70.5	-164.3	131.8	0	0	111.3	T95 P99	T95-E97 PolarHBondContact O-N 2.81Å; T95-E97 VanDerWaalsContact O-N 3.11Å; E97-P99 WeakPolarHBondContact O-CD 3.39Å
98	D	30.2	Very low	31.6	Very low	79 Å²	79	136.9 Å²	136.9	42%	0.422	72%	0.716	S	S	.	*			trans	-84	113.5	169.8	-173.2	-12.4	0	0	0	110.5	A100 I101	D98-A100 PolarHBondContact O-N 2.71Å; D98-A100 VanDerWaalsContact O-N 3.16Å; D98-A100 VanDerWaalsContact OD1-CB 3.26Å; D98-A100 WeakPolarHBondContact OD1-CB 3.37Å; D98-A100 PolarHBondContact OD1-N 3.06Å; D98-I101 HydrophobicContact CB-CD1 4.33Å; D98-I101 PolarHBondContact O-N 3.08Å
99	P	31.7	Very low	31.1	Very low	112 Å²	112	135.1 Å²	135.1	73%	0.727	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-12.8	179.3	28.6	-35.8	0	0	0	114	E97 I101	E97-P99 WeakPolarHBondContact O-CD 3.39Å; P99-I101 PolarHBondContact O-N 3.16Å
100	A	32.8	Very low	30.2	Very low	82 Å²	82	140 Å²	140	68%	0.678	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-12.9	177.5	0	0	0	0	0	114.1	D98	D98-A100 PolarHBondContact O-N 2.71Å; D98-A100 VanDerWaalsContact O-N 3.16Å; D98-A100 VanDerWaalsContact OD1-CB 3.26Å; D98-A100 WeakPolarHBondContact OD1-CB 3.37Å; D98-A100 PolarHBondContact OD1-N 3.06Å
101	I	32	Very low	29.8	Very low	123 Å²	123	140.8 Å²	140.8	63%	0.631	73%	0.734	S	S	*	*	S	Bend	trans	-107.9	-7.3	-170.2	-59.1	-179.6	0	0	0	112.6	D98 P99	D98-I101 HydrophobicContact CB-CD1 4.33Å; D98-I101 PolarHBondContact O-N 3.08Å; P99-I101 PolarHBondContact O-N 3.16Å
102	L	28.6	Very low	29.3	Very low	136 Å²	136	143.8 Å²	143.8	71%	0.712	74%	0.74	S	S	*	*	S	Bend	trans	-123.8	34.6	-167.9	-71.7	176.1	0	0	0	116.3
103	D	31.6	Very low	29.1	Very low	122 Å²	122	148.7 Å²	148.7	65%	0.652	76%	0.76	S	S	*	*	S	Bend	trans	-138.3	34.2	-178.3	-148.1	28.2	0	0	0	116.2
104	I	28.7	Very low	28.7	Very low	170 Å²	170	146.6 Å²	146.6	87%	0.872	75%	0.749	S	S	*	*	S	Bend	trans	-129.7	7.3	176.4	-24.9	180	0	0	0	114.2
105	S	26.5	Very low	28.4	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	74%	0.743	S	S	*	*	S	Bend	trans	-129.5	-14.2	-174.3	66.5	0	0	0	0	116.5
106	R	26.8	Very low	28.1	Very low	214 Å²	214	144.8 Å²	144.8	81%	0.808	74%	0.736	S	S	*	*	S	Bend	trans	-149.9	134.4	175.1	-69.5	-172.2	173.6	161.5	-0.3	111.4
107	K	27.4	Very low	28.1	Very low	189 Å²	189	141.2 Å²	141.2	82%	0.822	73%	0.732	S	S	*	*			trans	74.3	149.2	-164.9	-45.3	154.7	-171.7	166	0	110.8
108	V	28	Very low	27.9	Very low	141 Å²	141	140 Å²	140	86%	0.855	72%	0.724	S	S	*	*			cis	-112.3	142.5	2.3	176.2	0	0	0	0	110.7
109	S	24.4	Very low	28	Very low	82 Å²	82	141.9 Å²	141.9	57%	0.573	73%	0.731	S	S	*	*			trans	-82.1	161.3	178.7	44.8	0	0	0	0	113.7	Q111	S109-Q111 PolarHBondContact O-N 3.44Å
110	Y	23.1	Very low	28	Very low	240 Å²	240	144.5 Å²	144.5	94%	0.941	73%	0.733	S	S	*	*	S	Bend	trans	-50.3	101.2	165	-81.9	-101.5	0	0	0	111.6
111	Q	24.5	Very low	27.8	Very low	147 Å²	147	147.2 Å²	147.2	69%	0.687	74%	0.735	S	S	*	*			trans	-159.7	110.4	171.1	-115.9	158.2	10	0	0	113.8	S109	S109-Q111 PolarHBondContact O-N 3.44Å
112	Q	25.5	Very low	27.6	Very low	175 Å²	175	151.8 Å²	151.8	82%	0.818	75%	0.745	S	S	*	*			trans	39	97.2	141.4	-62.4	171.6	-40.3	0	0	118.9
113	L	25.2	Very low	27.5	Very low	172 Å²	172	152 Å²	152	90%	0.901	75%	0.746	S	S	*	*			trans	-135.9	86.9	160.1	-73.2	176.5	0	0	0	112.4
114	N	25.7	Very low	27.2	Very low	121 Å²	121	149.7 Å²	149.7	65%	0.647	75%	0.745	S	S	*	*			trans	36.6	125.6	156	-59	9.3	0	0	0	121.9	D116	N114-D116 VanDerWaalsContact C-N 3.34Å; N114-D116 PolarHBondContact O-N 3.41Å
115	E	28.9	Very low	27	Very low	167 Å²	167	147.7 Å²	147.7	78%	0.78	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-70.5	-20	175.2	-62.4	178.6	97.9	0	0	114.8	S117 F118	E115-S117 VanDerWaalsContact C-N 3.25Å; E115-S117 PolarHBondContact O-N 3.12Å; E115-S117 VanDerWaalsContact O-N 3.14Å; E115-F118 PolarHBondContact O-N 2.79Å; E115-F118 VanDerWaalsContact O-N 3.08Å
116	D	29.1	Very low	27	Very low	100 Å²	100	146.9 Å²	146.9	54%	0.535	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-61.4	-29.8	-167	-58.7	-49.2	0	0	0	113.9	N114 F118 Q119	N114-D116 VanDerWaalsContact C-N 3.34Å; N114-D116 PolarHBondContact O-N 3.41Å; D116-F118 PolarHBondContact O-N 3.22Å; D116-Q119 PolarHBondContact O-N 3.44Å
117	S	29.5	Very low	26.9	Very low	99 Å²	99	145.5 Å²	145.5	69%	0.692	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-65.7	-19.4	178.5	-59.9	0	0	0	0	114.1	E115	E115-S117 VanDerWaalsContact C-N 3.25Å; E115-S117 PolarHBondContact O-N 3.12Å; E115-S117 VanDerWaalsContact O-N 3.14Å
118	F	26.6	Very low	27	Very low	161 Å²	161	142.6 Å²	142.6	71%	0.706	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-82.3	-16.5	178.7	-88.3	-88.1	0	0	0	114.1	E115 D116 H120 L121	E115-F118 PolarHBondContact O-N 2.79Å; E115-F118 VanDerWaalsContact O-N 3.08Å; D116-F118 PolarHBondContact O-N 3.22Å; F118-H120 PolarHBondContact O-N 3.36Å; F118-L121 PolarHBondContact O-N 3.48Å
119	Q	30.7	Very low	26.9	Very low	118 Å²	118	141.1 Å²	141.1	55%	0.551	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-75.4	-25	-171.2	-60.3	-176.7	23.1	0	0	113	D116 L121 R122	D116-Q119 PolarHBondContact O-N 3.44Å; Q119-L121 PolarHBondContact O-N 3.48Å; Q119-R122 PolarHBondContact O-N 2.94Å
120	H	31.6	Very low	27	Very low	168 Å²	168	140.2 Å²	140.2	78%	0.778	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-77	-14.9	177.3	-73.8	-65.2	0	0	0	114.9	F118	F118-H120 PolarHBondContact O-N 3.36Å
121	L	28.8	Very low	27.2	Very low	139 Å²	139	132.8 Å²	132.8	73%	0.728	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-84.9	-9.1	174.7	-80	164.9	0	0	0	113.4	F118 Q119 N123	F118-L121 PolarHBondContact O-N 3.48Å; Q119-L121 PolarHBondContact O-N 3.48Å; L121-N123 VanDerWaalsContact C-N 3.34Å; L121-N123 PolarHBondContact O-N 3.29Å
122	R	28	Very low	27.4	Very low	218 Å²	218	129.8 Å²	129.8	82%	0.823	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-1.9	-172.3	-120.9	179	-175.6	178.6	2.3	115.7	Q119	Q119-R122 PolarHBondContact O-N 2.94Å
123	N	27.6	Very low	27.6	Very low	140 Å²	140	126.5 Å²	126.5	75%	0.749	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	13	-169.4	-66.4	-12.1	0	0	0	114.7	L121	L121-N123 VanDerWaalsContact C-N 3.34Å; L121-N123 PolarHBondContact O-N 3.29Å
124	A	25	Very low	27.9	Very low	75 Å²	75	122.8 Å²	122.8	62%	0.62	67%	0.669	S	S	*	*	S	Bend	trans	-89.4	144	168.7	0	0	0	0	0	110.4	A126	A124-A126 PolarHBondContact O-N 3.25Å; A124-A126 VanDerWaalsContact O-N 3.14Å
125	P	25	Very low	28.1	Very low	127 Å²	127	123.3 Å²	123.3	83%	0.825	67%	0.666	S	S	*	*			trans	-67.9	113.6	-174.6	26.8	-34.2	0	0	0	111.6
126	A	25.7	Very low	28.2	Very low	92 Å²	92	121.8 Å²	121.8	76%	0.76	66%	0.663	S	S	*	*			trans	-77.3	127.2	177.4	0	0	0	0	0	111.4	A124	A124-A126 PolarHBondContact O-N 3.25Å; A124-A126 VanDerWaalsContact O-N 3.14Å
127	Y	25.4	Very low	28	Very low	185 Å²	185	126.4 Å²	126.4	73%	0.725	67%	0.673	S	S	*	*			trans	-65.1	153.2	155.7	-82.3	-100.8	0	0	0	109.3	T129	Y127-T129 PolarHBondContact O-N 3.25Å
128	P	27.9	Very low	27.9	Very low	127 Å²	127	124.6 Å²	124.6	83%	0.825	66%	0.658	S	S	*	*			trans	-60.6	112.5	-177.5	24.4	-34.2	0	0	0	111.1	A130	P128-A130 PolarHBondContact O-N 2.86Å
129	T	26.7	Very low	28	Very low	111 Å²	111	128.6 Å²	128.6	68%	0.681	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-59.8	128.7	179.7	-38.3	0	0	0	0	110.2	Y127	Y127-T129 PolarHBondContact O-N 3.25Å
130	A	26.4	Very low	27.9	Very low	63 Å²	63	128.4 Å²	128.4	52%	0.521	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-58.3	140.9	166.4	0	0	0	0	0	109.1	P128 T132	P128-A130 PolarHBondContact O-N 2.86Å; A130-T132 PolarHBondContact O-N 3.47Å
131	P	26.6	Very low	28.1	Very low	83 Å²	83	124 Å²	124	54%	0.539	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-56.4	116.1	-166.2	-27	34.2	0	0	0	113.3	D133 I134	P131-D133 VanDerWaalsContact C-N 3.26Å; P131-D133 PolarHBondContact O-N 3.08Å; P131-I134 HydrophobicContact CB-CD1 3.88Å; P131-I134 HydrophobicContact CB-CG1 4.17Å; P131-I134 HydrophobicContact CG-CD1 4.07Å; P131-I134 WeakPolarHBondContact O-CB 3.49Å; P131-I134 PolarHBondContact O-N 3.43Å
132	T	28.9	Very low	28.4	Very low	85 Å²	85	124.7 Å²	124.7	52%	0.521	65%	0.645	S	S	.	*	G	3₁₀ helix	trans	-61.4	-33.4	-170.5	-9	0	0	0	0	112.9	A130 I134 F135 D136	A130-T132 PolarHBondContact O-N 3.47Å; T132-I134 PolarHBondContact O-N 2.92Å; T132-F135 PolarHBondContact O-N 2.93Å; T132-D136 PolarHBondContact O-N 3.48Å; T132-D136 VanDerWaalsContact O-N 3.14Å
133	D	31.3	Very low	28.5	Very low	105 Å²	105	117.6 Å²	117.6	56%	0.561	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-53.9	-19.7	172.8	-100.1	-59.7	0	0	0	114.3	P131 R137	P131-D133 VanDerWaalsContact C-N 3.26Å; P131-D133 PolarHBondContact O-N 3.08Å; D133-R137 IonicContact OD1-CZ 3.64Å; D133-R137 IonicContact OD1-NE 2.76Å; D133-R137 PolarHBondContact OD1-NE 3.41Å; D133-R137 IonicContact OD1-NH2 3.56Å; D133-R137 PolarHBondContact OD1-NH2 3.39Å
134	I	31.1	Very low	28.6	Very low	94 Å²	94	118 Å²	118	48%	0.482	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-78.1	-31.4	178.7	-63.2	174.4	0	0	0	111.8	P131 T132	P131-I134 HydrophobicContact CB-CD1 3.88Å; P131-I134 HydrophobicContact CB-CG1 4.17Å; P131-I134 HydrophobicContact CG-CD1 4.07Å; P131-I134 WeakPolarHBondContact O-CB 3.49Å; P131-I134 PolarHBondContact O-N 3.43Å; T132-I134 PolarHBondContact O-N 2.92Å
135	F	29.7	Very low	28.9	Very low	133 Å²	133	121 Å²	121	58%	0.583	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-34.6	-172.9	-67.7	-77.3	0	0	0	113.3	T132 R137 T138	T132-F135 PolarHBondContact O-N 2.93Å; F135-R137 VanDerWaalsContact C-N 3.26Å; F135-R137 PolarHBondContact O-N 3.03Å; F135-T138 PolarHBondContact O-N 2.94Å; F135-T138 PolarHBondContact O-OG1 2.82Å
136	D	30.2	Very low	29	Very low	135 Å²	135	117.3 Å²	117.3	72%	0.722	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-18.8	-179.6	-71.7	-32.2	0	0	0	113.4	T132	T132-D136 PolarHBondContact O-N 3.48Å; T132-D136 VanDerWaalsContact O-N 3.14Å
137	R	25.1	Very low	29.1	Very low	197 Å²	197	118 Å²	118	74%	0.743	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-12.4	176.7	-66.6	-173.7	-173.9	-133.6	0.9	113.9	D133 F135	D133-R137 IonicContact OD1-CZ 3.64Å; D133-R137 IonicContact OD1-NE 2.76Å; D133-R137 PolarHBondContact OD1-NE 3.41Å; D133-R137 IonicContact OD1-NH2 3.56Å; D133-R137 PolarHBondContact OD1-NH2 3.39Å; F135-R137 VanDerWaalsContact C-N 3.26Å; F135-R137 PolarHBondContact O-N 3.03Å
138	T	27.1	Very low	29.3	Very low	60 Å²	60	118.9 Å²	118.9	37%	0.368	62%	0.623	S	S	.	*			trans	-101.8	85.9	-177	51.4	0	0	0	0	110.9	F135 D140 I141	F135-T138 PolarHBondContact O-N 2.94Å; F135-T138 PolarHBondContact O-OG1 2.82Å; T138-D140 PolarHBondContact O-N 3.02Å; T138-I141 HydrophobicContact CG2-CD1 3.76Å; T138-I141 HydrophobicContact CG2-CG1 3.99Å
139	R	28.3	Very low	29.3	Very low	246 Å²	246	122.1 Å²	122.1	93%	0.928	63%	0.627	S	S	*	*	S	Bend	trans	-52.8	119.9	152.4	-79.9	-177.4	171.6	-175.5	-4.2	107.7	I141	R139-I141 PolarHBondContact O-N 3.25Å; R139-I141 VanDerWaalsContact O-N 3.14Å
140	D	30.5	Very low	29.3	Very low	114 Å²	114	123.7 Å²	123.7	61%	0.61	64%	0.637	S	S	*	*			trans	37.7	63.4	154.3	-93.2	23.3	0	0	0	116.6	T138 W142 S143	T138-D140 PolarHBondContact O-N 3.02Å; D140-W142 PolarHBondContact O-N 3.38Å; D140-S143 WeakPolarHBondContact CB-OG 3.11Å; D140-S143 PolarHBondContact O-N 3.23Å; D140-S143 PolarHBondContact OD2-OG 3.35Å
141	I	34.1	Very low	29.4	Very low	75 Å²	75	124.1 Å²	124.1	39%	0.385	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.7	-19.8	172.7	-38.9	174.7	0	0	0	111.9	T138 R139	T138-I141 HydrophobicContact CG2-CD1 3.76Å; T138-I141 HydrophobicContact CG2-CG1 3.99Å; R139-I141 PolarHBondContact O-N 3.25Å; R139-I141 VanDerWaalsContact O-N 3.14Å
142	W	36.7	Very low	29.3	Very low	153 Å²	153	131.9 Å²	131.9	58%	0.58	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-9.6	-179.8	-56.3	103.4	0	0	0	114	D140 F857	D140-W142 PolarHBondContact O-N 3.38Å; W142-F857 HydrophobicContact CH2-CD1 4.17Å; W142-F857 AromaticContact CH2-CE1 3.96Å; W142-F857 HydrophobicContact CH2-CE1 3.96Å; W142-F857 HydrophobicContact CZ3-CE1 4.06Å
143	S	28.9	Very low	29.3	Very low	70 Å²	70	131.4 Å²	131.4	49%	0.49	68%	0.68	S	S	.	*			trans	-106.9	71.8	178.1	-43.8	0	0	0	0	109	D140 D145	D140-S143 WeakPolarHBondContact CB-OG 3.11Å; D140-S143 PolarHBondContact O-N 3.23Å; D140-S143 PolarHBondContact OD2-OG 3.35Å; S143-D145 PolarHBondContact O-N 2.8Å
144	I	29.8	Very low	29.1	Very low	147 Å²	147	132.4 Å²	132.4	75%	0.754	70%	0.695	S	S	*	*			trans	-85.3	107.6	175.3	-63.8	178.4	0	0	0	108.5	G146	I144-G146 PolarHBondContact O-N 3.13Å
145	D	30.9	Very low	28.9	Very low	140 Å²	140	131.3 Å²	131.3	75%	0.749	71%	0.707	S	S	*	*			trans	-57.8	119.2	169.8	-72.4	-44.4	0	0	0	110.7	S143 S147	S143-D145 PolarHBondContact O-N 2.8Å; D145-S147 PolarHBondContact O-N 3.41Å; D145-S147 PolarHBondContact O-OG 3.48Å
146	G	28.6	Very low	28.8	Very low	48 Å²	48	133.8 Å²	133.8	50%	0.495	72%	0.717	S	S	.	*			trans	-72.8	53.2	-176.1	0	0	0	0	0	115	I144 Y148	I144-G146 PolarHBondContact O-N 3.13Å; G146-Y148 VanDerWaalsContact C-N 3.31Å; G146-Y148 PolarHBondContact O-N 3.2Å
147	S	27.2	Very low	28.6	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	72%	0.722	S	S	*	*			trans	-85.7	59	-175.7	50	0	0	0	0	113.5	D145 E149	D145-S147 PolarHBondContact O-N 3.41Å; D145-S147 PolarHBondContact O-OG 3.48Å; S147-E149 PolarHBondContact O-N 3.5Å
148	Y	28.5	Very low	28.7	Very low	203 Å²	203	128.9 Å²	128.9	80%	0.796	72%	0.718	S	S	*	*			trans	-91.4	60.2	176	30.5	-100.1	0	0	0	113.2	G146 T150	G146-Y148 VanDerWaalsContact C-N 3.31Å; G146-Y148 PolarHBondContact O-N 3.2Å; Y148-T150 PolarHBondContact O-N 3.22Å
149	E	29.1	Very low	28.7	Very low	194 Å²	194	134.1 Å²	134.1	91%	0.907	74%	0.742	S	S	*	*			trans	-65.3	118.5	168.5	-84.3	-156.3	132.4	0	0	111.4	S147	S147-E149 PolarHBondContact O-N 3.5Å
150	T	26.4	Very low	28.6	Very low	144 Å²	144	127.1 Å²	127.1	88%	0.883	74%	0.737	S	S	*	*			trans	-98.5	89.4	179.5	-58.9	0	0	0	0	109.8	Y148	Y148-T150 PolarHBondContact O-N 3.22Å
151	G	27.6	Very low	28.5	Very low	72 Å²	72	126.5 Å²	126.5	74%	0.742	74%	0.741	S	S	*	*			trans	-137.6	124.3	-170.5	0	0	0	0	0	115.9
152	Y	26	Very low	28.1	Very low	247 Å²	247	130.5 Å²	130.5	97%	0.969	76%	0.764	S	S	*	*			trans	-70	141.2	173.4	-73	-111.5	0	0	0	112.4
153	G	28.4	Very low	27.7	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	78%	0.778	S	S	*	*			trans	154.6	92.3	156.9	0	0	0	0	0	119.4	G155	G153-G155 PolarHBondContact O-N 3.3Å
154	S	26.8	Very low	27.5	Very low	126 Å²	126	132.7 Å²	132.7	88%	0.881	79%	0.79	S	S	*	*			trans	-34.2	122.4	164.8	155.5	0	0	0	0	116.5
155	G	26.9	Very low	27.5	Very low	71 Å²	71	134.1 Å²	134.1	73%	0.732	80%	0.796	S	S	*	*			trans	-136.6	-17.3	-173.1	0	0	0	0	0	122.2	G153	G153-G155 PolarHBondContact O-N 3.3Å
156	K	27.3	Very low	27.4	Very low	185 Å²	185	136.2 Å²	136.2	80%	0.804	80%	0.798	S	S	*	*			trans	50.2	136.8	173	-77.9	-176.6	177.6	176.1	0	121.4
157	T	26.6	Very low	27.4	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	82%	0.815	S	S	*	*			trans	68.1	142.6	150.6	48	0	0	0	0	119.9
158	S	27	Very low	27.6	Very low	94 Å²	94	141.9 Å²	141.9	66%	0.657	81%	0.811	S	S	*	*			cis	-168	137.9	-8.5	46.8	0	0	0	0	114.8
159	I	26.3	Very low	27.7	Very low	169 Å²	169	136.5 Å²	136.5	87%	0.867	80%	0.796	S	S	*	*			trans	56.9	108.7	136.8	-53.6	165.5	0	0	0	119.9
160	A	27.6	Very low	27.9	Very low	99 Å²	99	132.2 Å²	132.2	82%	0.818	78%	0.783	S	S	*	*				-179.5	139.8	124.7	0	0	0	0	0	109.1
161	S	28	Very low	28.2	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	76%	0.761	S	S	*	*			cis	-153.1	138.1	-9.7	54.4	0	0	0	0	111.1
162	D	25.2	Very low	28.6	Very low	160 Å²	160	129.5 Å²	129.5	86%	0.856	74%	0.744	S	S	*	*			trans	31.1	96.2	154.8	-57	-34.7	0	0	0	121.3
163	C	28.3	Very low	29.1	Very low	130 Å²	130	120.5 Å²	120.5	88%	0.878	72%	0.715	S	S	*	*			trans	-141.4	85.7	139.5	44.8	0	0	0	0	110.6	M165	C163-M165 PolarHBondContact O-N 3.14Å
164	N	25	Very low	29.4	Very low	139 Å²	139	121.4 Å²	121.4	74%	0.743	70%	0.701	S	S	*	*			trans	-76.4	88.2	-176.2	-180	9.3	0	0	0	112.2
165	M	29.1	Very low	29.8	Very low	176 Å²	176	122.9 Å²	122.9	87%	0.867	69%	0.688	S	S	*	*			trans	-123.3	113.6	160.6	-84.6	-66.8	143.2	0	0	110.1	C163 S167	C163-M165 PolarHBondContact O-N 3.14Å; M165-S167 PolarHBondContact O-N 3.12Å; M165-S167 VanDerWaalsContact O-N 3.16Å
166	K	28.5	Very low	30.2	Very low	184 Å²	184	123.4 Å²	123.4	80%	0.8	68%	0.68	S	S	*	*			trans	-58.8	118	171	-69	177.2	177.4	178.3	0	108.6	K168	K166-K168 PolarHBondContact O-N 2.84Å
167	S	29.2	Very low	30.5	Very low	122 Å²	122	121 Å²	121	85%	0.853	68%	0.675	S	S	*	*			trans	-64.6	84.7	170.6	39.1	0	0	0	0	109.9	M165 N169	M165-S167 PolarHBondContact O-N 3.12Å; M165-S167 VanDerWaalsContact O-N 3.16Å; S167-N169 PolarHBondContact O-N 3.11Å
168	K	31	Very low	30.7	Very low	154 Å²	154	121.6 Å²	121.6	67%	0.67	67%	0.673	S	S	*	*			trans	-56	122.2	164.6	-72.8	-175	176.7	-177.8	0	107.2	K166 V170 V173	K166-K168 PolarHBondContact O-N 2.84Å; K168-V170 PolarHBondContact O-N 3.21Å; K168-V173 HydrophobicContact CB-CG2 4.02Å; K168-V173 HydrophobicContact CD-CG2 4.14Å
169	N	31.1	Very low	30.7	Very low	89 Å²	89	122.4 Å²	122.4	48%	0.476	67%	0.674	S	S	.	*			trans	-56.8	142.5	169.3	-174.8	-30.3	0	0	0	107.8	S167 M171 D172 V173	S167-N169 PolarHBondContact O-N 3.11Å; N169-M171 PolarHBondContact O-N 3.46Å; N169-M171 VanDerWaalsContact O-N 3.16Å; N169-M171 WeakPolarHBondContact OD1-CB 3.37Å; N169-M171 PolarHBondContact OD1-N 2.97Å; N169-D172 HydrophobicContact CB-CB 4.45Å; N169-D172 WeakPolarHBondContact CB-OD2 3.24Å; N169-D172 PolarHBondContact N-OD2 2.82Å; N169-D172 WeakPolarHBondContact O-CA 3.42Å; N169-D172 WeakPolarHBondContact O-CB 3.21Å; N169-D172 PolarHBondContact O-N 3.38Å; N169-V173 PolarHBondContact O-N 3.4Å
170	V	33	Very low	30.6	Very low	104 Å²	104	119.6 Å²	119.6	63%	0.63	67%	0.668	S	S	*	*	H	α-helix	trans	-54.8	-34.2	174.3	178	0	0	0	0	110.1	K168 D172 V173 L174	K168-V170 PolarHBondContact O-N 3.21Å; V170-D172 VanDerWaalsContact C-N 3.29Å; V170-D172 PolarHBondContact O-N 2.8Å; V170-V173 PolarHBondContact O-N 3.44Å; V170-L174 HydrophobicContact CG1-CD1 3.91Å; V170-L174 HydrophobicContact CG1-CG 4.26Å; V170-L174 WeakPolarHBondContact O-CB 3.41Å; V170-L174 WeakPolarHBondContact O-CG 3.35Å; V170-L174 PolarHBondContact O-N 3.5Å
171	M	33.3	Very low	30.6	Very low	89 Å²	89	122.5 Å²	122.5	44%	0.438	66%	0.664	S	S	.	*	H	α-helix	trans	-67.5	-20.2	172.9	-63	-62.3	-92.2	0	0	114.5	N169 L174 R175	N169-M171 PolarHBondContact O-N 3.46Å; N169-M171 VanDerWaalsContact O-N 3.16Å; N169-M171 WeakPolarHBondContact OD1-CB 3.37Å; N169-M171 PolarHBondContact OD1-N 2.97Å; M171-L174 HydrophobicContact SD-CD1 4.36Å; M171-R175 WeakPolarHBondContact O-CB 3.5Å; M171-R175 WeakPolarHBondContact O-CG 3.3Å; M171-R175 PolarHBondContact O-N 2.97Å; M171-R175 PolarHBondContact O-NE 3.21Å
172	D	36.3	Very low	30.4	Very low	70 Å²	70	126.4 Å²	126.4	37%	0.374	68%	0.676	S	S	.	*	H	α-helix	trans	-82.6	-36.2	171.8	-62.5	-27.7	0	0	0	111.3	N169 V170 R175 S176	N169-D172 HydrophobicContact CB-CB 4.45Å; N169-D172 WeakPolarHBondContact CB-OD2 3.24Å; N169-D172 PolarHBondContact N-OD2 2.82Å; N169-D172 WeakPolarHBondContact O-CA 3.42Å; N169-D172 WeakPolarHBondContact O-CB 3.21Å; N169-D172 PolarHBondContact O-N 3.38Å; V170-D172 VanDerWaalsContact C-N 3.29Å; V170-D172 PolarHBondContact O-N 2.8Å; D172-R175 IonicContact OD1-CZ 2.77Å; D172-R175 IonicContact OD1-NE 2.59Å; D172-R175 IonicContact OD1-NH2 3.24Å; D172-R175 PolarHBondContact OD1-NH2 3.45Å; D172-S176 VanDerWaalsContact O-CB 3.29Å; D172-S176 WeakPolarHBondContact O-CB 3.18Å; D172-S176 PolarHBondContact O-N 2.87Å; D172-S176 PolarHBondContact O-OG 3.5Å
173	V	37.1	Very low	30.6	Very low	59 Å²	59	123.4 Å²	123.4	36%	0.358	67%	0.668	S	S	.	*	H	α-helix	trans	-64.4	-49.1	171.3	-177.4	0	0	0	0	109.6	K168 N169 V170 S176 L177	K168-V173 HydrophobicContact CB-CG2 4.02Å; K168-V173 HydrophobicContact CD-CG2 4.14Å; N169-V173 PolarHBondContact O-N 3.4Å; V170-V173 PolarHBondContact O-N 3.44Å; V173-S176 PolarHBondContact O-N 3.13Å; V173-S176 VanDerWaalsContact O-N 3.17Å; V173-S176 PolarHBondContact O-OG 3.45Å; V173-L177 HydrophobicContact CG1-CD1 4.15Å; V173-L177 WeakPolarHBondContact O-CG 3.32Å; V173-L177 PolarHBondContact O-N 2.9Å; V173-L177 VanDerWaalsContact O-N 3.12Å
174	L	33.4	Very low	30.5	Very low	94 Å²	94	122.2 Å²	122.2	49%	0.492	67%	0.667	S	S	.	*	H	α-helix	trans	-64.8	-40.5	177.7	-68.3	174.5	0	0	0	112.5	V170 M171 S176 L177 N178	V170-L174 HydrophobicContact CG1-CD1 3.91Å; V170-L174 HydrophobicContact CG1-CG 4.26Å; V170-L174 WeakPolarHBondContact O-CB 3.41Å; V170-L174 WeakPolarHBondContact O-CG 3.35Å; V170-L174 PolarHBondContact O-N 3.5Å; M171-L174 HydrophobicContact SD-CD1 4.36Å; L174-S176 VanDerWaalsContact C-N 3.33Å; L174-S176 PolarHBondContact O-N 2.79Å; L174-L177 PolarHBondContact O-N 3.21Å; L174-N178 WeakPolarHBondContact O-CB 3.38Å; L174-N178 PolarHBondContact O-N 3.44Å
175	R	36	Very low	30.5	Very low	157 Å²	157	121.2 Å²	121.2	59%	0.592	67%	0.672	S	S	*	*	H	α-helix	trans	-63.9	-35.7	171.7	-77.7	-179.4	-69.1	-162.3	3.5	112.5	M171 D172 L177 N178	M171-R175 WeakPolarHBondContact O-CB 3.5Å; M171-R175 WeakPolarHBondContact O-CG 3.3Å; M171-R175 PolarHBondContact O-N 2.97Å; M171-R175 PolarHBondContact O-NE 3.21Å; D172-R175 IonicContact OD1-CZ 2.77Å; D172-R175 IonicContact OD1-NE 2.59Å; D172-R175 IonicContact OD1-NH2 3.24Å; D172-R175 PolarHBondContact OD1-NH2 3.45Å; R175-L177 PolarHBondContact O-N 2.94Å; R175-N178 PolarHBondContact O-N 3.12Å
176	S	34.8	Very low	30.4	Very low	82 Å²	82	119.9 Å²	119.9	57%	0.573	66%	0.661	S	S	*	*	H	α-helix	trans	-70.2	-17.4	175.5	73.9	0	0	0	0	114.4	D172 V173 L174	D172-S176 VanDerWaalsContact O-CB 3.29Å; D172-S176 WeakPolarHBondContact O-CB 3.18Å; D172-S176 PolarHBondContact O-N 2.87Å; D172-S176 PolarHBondContact O-OG 3.5Å; V173-S176 PolarHBondContact O-N 3.13Å; V173-S176 VanDerWaalsContact O-N 3.17Å; V173-S176 PolarHBondContact O-OG 3.45Å; L174-S176 VanDerWaalsContact C-N 3.33Å; L174-S176 PolarHBondContact O-N 2.79Å
177	L	33	Very low	30.2	Very low	133 Å²	133	116.7 Å²	116.7	70%	0.696	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-3.3	177.2	-71.5	168.9	0	0	0	113.8	V173 L174 R175	V173-L177 HydrophobicContact CG1-CD1 4.15Å; V173-L177 WeakPolarHBondContact O-CG 3.32Å; V173-L177 PolarHBondContact O-N 2.9Å; V173-L177 VanDerWaalsContact O-N 3.12Å; L174-L177 PolarHBondContact O-N 3.21Å; R175-L177 PolarHBondContact O-N 2.94Å
178	N	30.7	Very low	30	Very low	149 Å²	149	117 Å²	117	80%	0.797	65%	0.653	S	S	*	*	S	Bend	trans	-118.2	38.3	-171.1	-143.9	9.9	0	0	0	112.6	L174 R175	L174-N178 WeakPolarHBondContact O-CB 3.38Å; L174-N178 PolarHBondContact O-N 3.44Å; R175-N178 PolarHBondContact O-N 3.12Å
179	V	26.8	Very low	29.8	Very low	111 Å²	111	115.1 Å²	115.1	67%	0.673	66%	0.66	S	S	*	*			trans	-123.3	144.9	177.5	-174.9	0	0	0	0	108.8
180	C	25.1	Very low	29.6	Very low	109 Å²	109	117.4 Å²	117.4	74%	0.736	68%	0.677	S	S	*	*	S	Bend	trans	72.7	124.2	-174.1	-56.6	0	0	0	0	114.8
181	H	28.6	Very low	29.5	Very low	160 Å²	160	117.8 Å²	117.8	74%	0.741	68%	0.682	S	S	*	*			cis	-152.4	116.7	-8.6	-128.1	-81.7	0	0	0	109.2	S183	H181-S183 PolarHBondContact ND1-OG 2.98Å
182	L	23.7	Very low	29.2	Very low	183 Å²	183	118 Å²	118	96%	0.958	69%	0.691	S	S	*	*			trans	-91.5	122.6	166.2	-147.1	82.3	0	0	0	107.6
183	S	28.4	Very low	28.8	Very low	98 Å²	98	123 Å²	123	69%	0.685	71%	0.713	S	S	*	*			trans	-148.2	127.1	179.5	-65.7	0	0	0	0	110.5	H181	H181-S183 PolarHBondContact ND1-OG 2.98Å
184	A	27.4	Very low	28.5	Very low	104 Å²	104	124.6 Å²	124.6	86%	0.86	73%	0.733	S	S	*	*			trans	-80.9	157.1	-152.9	0	0	0	0	0	115.6
185	S	23.6	Very low	28.5	Very low	119 Å²	119	125 Å²	125	83%	0.832	74%	0.743	S	S	*	*			trans	-65.5	142.1	173.9	-37.2	0	0	0	0	113.1
186	K	26.4	Very low	28.3	Very low	148 Å²	148	122.7 Å²	122.7	64%	0.643	75%	0.747	S	S	*	*			trans	-165.5	118.6	138	-111.5	-176.7	176.5	-177.2	0	114.7	N959	K186-N959 PolarHBondContact NZ-OD1 3.36Å
187	T	25.2	Very low	28.2	Very low	117 Å²	117	126.3 Å²	126.3	72%	0.718	76%	0.755	S	S	*	*				60.1	103.3	128.8	-52.6	0	0	0	0	121.4
188	V	24.1	Very low	28.1	Very low	128 Å²	128	126.4 Å²	126.4	78%	0.776	76%	0.756	S	S	*	*			trans	58.8	113.9	133.7	-177.2	0	0	0	0	119.9
189	S	28.5	Very low	27.7	Very low	115 Å²	115	124.3 Å²	124.3	80%	0.804	75%	0.752	S	S	*	*				178.4	138.6	118.9	-74.2	0	0	0	0	112.8
190	T	25.2	Very low	27.9	Very low	137 Å²	137	127.2 Å²	127.2	84%	0.84	76%	0.762	S	S	*	*			trans	-93.7	179.9	162	43.5	0	0	0	0	109.3
191	P	31.2	Very low	27.8	Very low	112 Å²	112	127.7 Å²	127.7	73%	0.727	77%	0.767	S	S	*	*			cis	-145.5	-161.8	18.4	45.6	-24.5	0	0	0	117
192	S	27.8	Very low	27.8	Very low	92 Å²	92	123.5 Å²	123.5	64%	0.643	77%	0.767	S	S	*	*			trans	74.8	142.9	156.9	-75.9	0	0	0	0	119.3
193	E	28.8	Very low	27.9	Very low	175 Å²	175	123.3 Å²	123.3	82%	0.818	76%	0.759	S	S	*	*			cis	-163.3	175.2	-11	-129.4	163.7	127.4	0	0	112.8
194	A	30.1	Very low	27.9	Very low	94 Å²	94	126.5 Å²	126.5	78%	0.777	76%	0.762	S	S	*	*			trans	68.6	145.1	171.1	0	0	0	0	0	117.3
195	S	33.7	Very low	27.8	Very low	102 Å²	102	125.1 Å²	125.1	71%	0.713	75%	0.751	S	S	*	*			cis	-175.7	153.1	-8.8	46	0	0	0	0	108
196	T	31.1	Very low	27.9	Very low	109 Å²	109	125.2 Å²	125.2	67%	0.669	75%	0.747	S	S	*	*			cis	-160.6	-177.2	-4.8	14.9	0	0	0	0	108.4
197	E	32.5	Very low	27.8	Very low	158 Å²	158	127 Å²	127	74%	0.738	76%	0.757	S	S	*	*			trans	56	129.9	151.8	-67.9	139.9	-125.4	0	0	119.3
198	D	30.6	Very low	28	Very low	135 Å²	135	126.7 Å²	126.7	72%	0.722	76%	0.76	S	S	*	*			cis	-150.1	145.6	0.8	-98.4	-28.9	0	0	0	108.6
199	C	23.7	Very low	28.1	Very low	105 Å²	105	128.9 Å²	128.9	71%	0.709	76%	0.762	S	S	*	*				58.8	127.6	73.5	-80.7	0	0	0	0	113.4
200	L	30	Very low	28.2	Very low	172 Å²	172	129.1 Å²	129.1	90%	0.901	76%	0.758	S	S	*	*			cis	-153.1	-178.9	20.9	-102.4	158.5	0	0	0	112.2
201	S	24.1	Very low	28.4	Very low	118 Å²	118	128.2 Å²	128.2	83%	0.825	76%	0.758	S	S	*	*			trans	-117.2	153.4	-172.8	75.8	0	0	0	0	116.6
202	G	27.8	Very low	28.4	Very low	73 Å²	73	125.7 Å²	125.7	75%	0.753	75%	0.752	S	S	*	*			trans	141.3	170.5	155.8	0	0	0	0	0	114.8
203	K	25.7	Very low	28.4	Very low	179 Å²	179	127.8 Å²	127.8	78%	0.778	76%	0.76	S	S	*	*			cis	-178.7	142.8	-25	-149.2	-177.8	-179.9	-170.9	0	107.4
204	H	28.2	Very low	28.7	Very low	164 Å²	164	126 Å²	126	76%	0.759	76%	0.756	S	S	*	*			trans	65.1	167.8	175	-55.6	-81.8	0	0	0	116.5
205	A	26.1	Very low	28.6	Very low	76 Å²	76	126.9 Å²	126.9	63%	0.628	75%	0.752	S	S	*	*			cis	-171.3	155.6	-41.1	0	0	0	0	0	111.5
206	T	25.4	Very low	28.6	Very low	121 Å²	121	130 Å²	130	74%	0.742	76%	0.756	S	S	*	*			trans	60.4	134.3	154.4	31.4	0	0	0	0	122.8
207	E	25	Very low	28.4	Very low	185 Å²	185	130 Å²	130	86%	0.864	75%	0.751	S	S	*	*			trans	61	146.4	148.4	-62.4	177.2	134.3	0	0	118.9
208	S	28.1	Very low	28.3	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	75%	0.752	S	S	*	*			cis	-155.5	-161.1	36.4	-163.5	0	0	0	0	114.6
209	Q	27.6	Very low	28	Very low	175 Å²	175	130 Å²	130	82%	0.818	75%	0.75	S	S	*	*			trans	-82.3	-175	-167.8	-55.5	168.5	2.2	0	0	113.5
210	V	30.3	Very low	28.1	Very low	119 Å²	119	134.3 Å²	134.3	72%	0.721	76%	0.757	S	S	*	*				-174.6	135.9	61.7	167.4	0	0	0	0	113.5
211	S	28.1	Very low	27.9	Very low	119 Å²	119	131 Å²	131	83%	0.832	76%	0.755	S	S	*	*			trans	56.8	158.4	156.4	77.6	0	0	0	0	121.7
212	G	30.9	Very low	27.9	Very low	59 Å²	59	130.6 Å²	130.6	61%	0.608	75%	0.752	S	S	*	*			cis	-159.3	157	-0.3	0	0	0	0	0	111.9
213	V	29.6	Very low	27.7	Very low	136 Å²	136	138.9 Å²	138.9	82%	0.824	76%	0.76	S	S	*	*				74.2	123.8	86.9	175.9	0	0	0	0	111.3
214	D	33.7	Very low	27.6	Very low	136 Å²	136	135.5 Å²	135.5	73%	0.727	76%	0.759	S	S	*	*			cis	-135.9	152.2	30.2	-98.7	-51.8	0	0	0	112.5
215	T	29.2	Very low	27.8	Very low	113 Å²	113	133.8 Å²	133.8	69%	0.693	76%	0.763	S	S	*	*				76.8	119.1	68.6	-47	0	0	0	0	112.1
216	E	32	Very low	27.9	Very low	168 Å²	168	133.6 Å²	133.6	79%	0.785	77%	0.768	S	S	*	*				-152.8	-176.1	53.7	-79.9	-160.6	151	0	0	112.1
217	L	28.7	Very low	27.8	Very low	108 Å²	108	134.9 Å²	134.9	57%	0.565	77%	0.77	S	S	*	*			cis	-166	177.4	-32.6	-96.2	176.3	0	0	0	111.3
218	Y	28.6	Very low	27.9	Very low	196 Å²	196	133.3 Å²	133.3	77%	0.769	77%	0.767	S	S	*	*			trans	28.9	142.4	151	-67.7	-48.4	0	0	0	124.1
219	S	25.5	Very low	27.8	Very low	97 Å²	97	134.8 Å²	134.8	68%	0.678	76%	0.762	S	S	*	*			cis	-167.4	171.3	-14.2	-151.8	0	0	0	0	114.5
220	K	25.1	Very low	27.6	Very low	196 Å²	196	133.2 Å²	133.2	85%	0.852	76%	0.759	S	S	*	*			trans	-53.2	150.4	175.6	-57	155.2	177.1	169.6	0	115.3
221	A	25.8	Very low	27.5	Very low	104 Å²	104	135 Å²	135	86%	0.86	76%	0.763	S	S	*	*				-171.8	148.3	111.2	0	0	0	0	0	114.1
222	S	23.7	Very low	27.4	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	76%	0.759	S	S	*	*			trans	-80.8	154.4	-179.9	48.9	0	0	0	0	114.8
223	R	24.9	Very low	27.2	Very low	247 Å²	247	137.8 Å²	137.8	93%	0.932	77%	0.765	S	S	*	*				179.9	141.2	124.1	-100.4	167.4	-176.1	-165.9	0.9	114.7
224	S	22.3	Very low	27	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	76%	0.757	S	S	*	*			trans	-122.6	-172	149.2	68.9	0	0	0	0	106.8
225	P	32.2	Very low	26.4	Very low	128 Å²	128	135.6 Å²	135.6	83%	0.831	76%	0.762	S	S	*	*			cis	-124.5	-168.9	-20.4	40.4	-25	0	0	0	111.8
226	G	28.3	Very low	26.3	Very low	72 Å²	72	138 Å²	138	74%	0.742	77%	0.765	S	S	*	*			trans	140.4	116	168.5	0	0	0	0	0	111.8
227	N	24.1	Very low	25.9	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	77%	0.769	S	S	*	*			cis	82.3	70.5	28.2	-160.1	17.9	0	0	0	116.2
228	L	27.9	Very low	25.7	Very low	152 Å²	152	142.3 Å²	142.3	80%	0.796	78%	0.779	S	S	*	*			trans	-134.8	108.2	149.3	-73.9	176.5	0	0	0	106.3
229	Q	25.4	Very low	25.5	Very low	142 Å²	142	139 Å²	139	66%	0.664	78%	0.779	S	S	*	*				75.2	115.6	79.8	-76.9	-173.4	12.2	0	0	114.2
230	N	24.4	Very low	25.3	Very low	141 Å²	141	144.6 Å²	144.6	75%	0.754	79%	0.787	S	S	*	*			trans	58	134.3	146.1	-52.1	-25.2	0	0	0	117.3
231	I	27.5	Very low	25.4	Very low	156 Å²	156	140.4 Å²	140.4	80%	0.8	78%	0.78	S	S	*	*				-147.7	144.2	60.7	-78.7	151.8	0	0	0	111.2
232	V	25.8	Very low	25.3	Very low	125 Å²	125	142.3 Å²	142.3	76%	0.758	78%	0.775	S	S	*	*			trans	-112.7	135.7	167.4	172	0	0	0	0	108.6	V234	V232-V234 VanDerWaalsContact CG1-N 3.34Å
233	P	26.1	Very low	25.5	Very low	113 Å²	113	142.5 Å²	142.5	73%	0.734	77%	0.774	S	S	*	*			trans	-116.1	113.6	134.8	-5	25.7	0	0	0	108.9
234	V	25.4	Very low	25.5	Very low	109 Å²	109	136.7 Å²	136.7	66%	0.661	77%	0.766	S	S	*	*				73.8	104.7	78.5	171.3	0	0	0	0	111.2	V232 Q236	V232-V234 VanDerWaalsContact CG1-N 3.34Å; V234-Q236 HydrophobicContact CG1-CG 4.46Å
235	S	21.6	Very low	25.5	Very low	117 Å²	117	140.8 Å²	140.8	82%	0.818	77%	0.77	S	S	*	*			trans	-68.7	143.1	166.4	41.4	0	0	0	0	111.2
236	Q	26.8	Very low	25.2	Very low	163 Å²	163	140.3 Å²	140.3	76%	0.762	77%	0.767	S	S	*	*			trans	-137.6	129.6	161.2	-72.9	-161.6	-3.6	0	0	110.6	V234	V234-Q236 HydrophobicContact CG1-CG 4.46Å
237	H	23	Very low	25	Very low	187 Å²	187	142.5 Å²	142.5	87%	0.866	77%	0.768	S	S	*	*			trans	-65.4	133.2	164.6	-76.7	-86.9	0	0	0	110.7
238	K	25.2	Very low	25.1	Very low	179 Å²	179	139.6 Å²	139.6	78%	0.778	77%	0.773	S	S	*	*			trans	-153.1	108.6	143.5	-100.9	145.9	-174.1	173.9	0	106.1
239	V	24.5	Very low	25	Very low	127 Å²	127	138.9 Å²	138.9	77%	0.77	77%	0.77	S	S	*	*				68.6	116.5	80.6	173.2	0	0	0	0	110.4
240	Y	21.8	Very low	25	Very low	214 Å²	214	143.8 Å²	143.8	84%	0.839	78%	0.783	S	S	*	*			trans	-51.3	149.7	176.8	-84	-97.6	0	0	0	112.6
241	P	27.1	Very low	24.8	Very low	109 Å²	109	143.4 Å²	143.4	71%	0.708	78%	0.779	S	S	*	*				-127	143.2	121.6	35.5	-30.2	0	0	0	112.6	P243	P241-P243 WeakPolarHBondContact O-CD 3.3Å
242	N	23.8	Very low	24.6	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	77%	0.774	S	S	*	*			trans	-75.7	132.8	157.5	-94.3	-21.4	0	0	0	109.6
243	P	27.5	Very low	24.5	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	78%	0.777	S	S	*	*			trans	-118.4	103.3	138.8	32.2	-22.3	0	0	0	108.2	P241	P241-P243 WeakPolarHBondContact O-CD 3.3Å
244	V	24.9	Very low	24.3	Very low	124 Å²	124	143.1 Å²	143.1	75%	0.752	78%	0.779	S	S	*	*				59.4	111.5	80.5	-178.3	0	0	0	0	111.8
245	F	21.5	Very low	24.4	Very low	195 Å²	195	147.3 Å²	147.3	86%	0.855	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-59.2	153.9	-178.9	-62.3	-96.5	0	0	0	114.6
246	P	27.5	Very low	24.4	Very low	117 Å²	117	147.7 Å²	147.7	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-99.4	125.8	135.6	33.1	-26.7	0	0	0	110.8	G248	P246-G248 PolarHBondContact O-N 3.05Å
247	P	24.2	Very low	24.3	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-78.9	118.3	178.8	30	-33.2	0	0	0	112.2	N249	P247-N249 PolarHBondContact O-N 2.77Å
248	G	26.2	Very low	24.4	Very low	87 Å²	87	145.8 Å²	145.8	90%	0.897	78%	0.783	S	S	*	*			trans	-79	40.1	-176.5	0	0	0	0	0	116.2	P246 R250	P246-G248 PolarHBondContact O-N 3.05Å; G248-R250 PolarHBondContact O-N 2.81Å
249	N	24.4	Very low	24.3	Very low	137 Å²	137	144.3 Å²	144.3	73%	0.733	78%	0.784	S	S	*	*			trans	-77.5	120.9	-176	-130.8	0.3	0	0	0	111.4	P247	P247-N249 PolarHBondContact O-N 2.77Å
250	R	25	Very low	24.5	Very low	244 Å²	244	143.7 Å²	143.7	92%	0.921	79%	0.785	S	S	*	*			trans	-132.2	82.7	161.7	-74.4	-160	-172.5	-162.1	5.6	111.2	G248	G248-R250 PolarHBondContact O-N 2.81Å
251	I	21.8	Very low	24.5	Very low	134 Å²	134	141.2 Å²	141.2	69%	0.687	79%	0.786	S	S	*	*			trans	-94.2	160.2	150.3	-61.1	171.7	0	0	0	106.1
252	C	22.2	Very low	24.4	Very low	101 Å²	101	141.3 Å²	141.3	68%	0.682	79%	0.789	S	S	*	*			trans	74.2	149.6	-176.4	-59.6	0	0	0	0	114.5
253	Q	24	Very low	24.4	Very low	178 Å²	178	140.1 Å²	140.1	83%	0.832	79%	0.786	S	S	*	*			cis	-150.4	155.1	3.4	-132.6	154.8	24.3	0	0	111.2
254	S	22	Very low	24.2	Very low	109 Å²	109	140.9 Å²	140.9	76%	0.762	78%	0.784	S	S	*	*			trans	-82.5	133.3	171.6	45	0	0	0	0	111.4
255	Q	26.7	Very low	24.2	Very low	197 Å²	197	142 Å²	142	92%	0.921	79%	0.786	S	S	*	*			trans	-158.7	138.2	157.6	-116.6	163.9	29.4	0	0	112.8
256	T	22.2	Very low	24.4	Very low	125 Å²	125	136.2 Å²	136.2	77%	0.767	78%	0.782	S	S	*	*			trans	-82.1	155	178.8	-38.6	0	0	0	0	111.1
257	I	25.7	Very low	24.4	Very low	153 Å²	153	138.6 Å²	138.6	79%	0.785	79%	0.787	S	S	*	*			trans	175.9	113	130.3	-89.6	153.1	0	0	0	112.5
258	Q	24.3	Very low	24.5	Very low	156 Å²	156	141.1 Å²	141.1	73%	0.729	79%	0.788	S	S	*	*			trans	33.5	129.2	141.9	-62.2	-179.9	-33.5	0	0	124.2
259	N	23.5	Very low	24.8	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	78%	0.776	S	S	*	*			trans	71.6	151.4	136.9	-56.2	-9.2	0	0	0	118.8
260	S	28.1	Very low	24.9	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	78%	0.776	S	S	*	*			cis	-148.6	162.3	11.5	52.3	0	0	0	0	114.1
261	L	22.5	Very low	25.1	Very low	162 Å²	162	137.9 Å²	137.9	85%	0.848	77%	0.768	S	S	*	*			trans	-79.1	147.9	176.8	-82.4	69	0	0	0	115.2
262	S	25	Very low	25.4	Very low	111 Å²	111	138.7 Å²	138.7	78%	0.776	77%	0.773	S	S	*	*			trans	179.4	120	134.6	55.5	0	0	0	0	109.4
263	V	23.1	Very low	25.4	Very low	117 Å²	117	144.6 Å²	144.6	71%	0.709	78%	0.781	S	S	*	*				63.2	112.1	57.8	-176	0	0	0	0	110.3
264	N	23.8	Very low	25.6	Very low	130 Å²	130	141.8 Å²	141.8	70%	0.695	78%	0.776	S	S	*	*				-175.1	169.9	61.9	-145.2	-10.3	0	0	0	115.8
265	N	25.6	Very low	25.7	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	78%	0.781	S	S	*	*			trans	65.7	137.5	153.3	-65.9	-33	0	0	0	122.7
266	G	24.3	Very low	25.9	Very low	75 Å²	75	139.8 Å²	139.8	77%	0.773	77%	0.768	S	S	*	*			trans	-167.1	-2.3	179.4	0	0	0	0	0	122.6
267	I	28.3	Very low	26	Very low	167 Å²	167	142.8 Å²	142.8	86%	0.856	77%	0.771	S	S	*	*			trans	70.3	96.5	168.8	-49.1	174.9	0	0	0	119
268	H	25	Very low	25.9	Very low	170 Å²	170	140.2 Å²	140.2	79%	0.787	77%	0.767	S	S	*	*				37.5	141.1	126.5	-123.3	-101.3	0	0	0	124.6
269	P	33	Very low	25.9	Very low	99 Å²	99	140.2 Å²	140.2	64%	0.643	77%	0.771	S	S	*	*			trans	-104	175.4	179.8	41.9	-38.2	0	0	0	115.4
270	N	26.2	Very low	26	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	77%	0.772	S	S	*	*			trans	-178.4	141.1	141	-99.5	-37.5	0	0	0	113.7
271	H	29.9	Very low	26	Very low	164 Å²	164	142 Å²	142	76%	0.759	77%	0.77	S	S	*	*			trans	150.2	128	130.4	-85.9	-73.1	0	0	0	115.4
272	L	27.5	Very low	26.2	Very low	150 Å²	150	142.1 Å²	142.1	79%	0.785	77%	0.771	S	S	*	*			trans	50.4	108.5	147.4	-54	171.2	0	0	0	118.1
273	R	23	Very low	26.2	Very low	226 Å²	226	145.9 Å²	145.9	85%	0.853	77%	0.773	S	S	*	*			cis	73.6	130.1	46	-155.1	-167.7	-165.9	-160.1	5.9	114.4
274	T	28.1	Very low	26.4	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	77%	0.774	S	S	*	*			trans	106.6	101.8	159.6	74	0	0	0	0	121.3
275	N	23.3	Very low	26.6	Very low	163 Å²	163	147.1 Å²	147.1	87%	0.872	79%	0.786	S	S	*	*			trans	67.9	160.3	131.4	-82.5	25.9	0	0	0	124.3
276	P	32.7	Very low	26.6	Very low	101 Å²	101	147.3 Å²	147.3	66%	0.656	79%	0.786	S	S	*	*			trans	-116	-170.8	-168.3	43.3	-30.8	0	0	0	115.2
277	F	22.9	Very low	26.8	Very low	189 Å²	189	149.5 Å²	149.5	83%	0.829	79%	0.787	S	S	*	*			trans	102.7	127.5	169.6	-74.2	-75.8	0	0	0	119.3
278	S	23.3	Very low	26.6	Very low	98 Å²	98	147 Å²	147	69%	0.685	78%	0.78	S	S	*	*			trans	57.8	131.6	143.5	-55.1	0	0	0	0	122.4
279	L	25.9	Very low	26.6	Very low	157 Å²	157	146.5 Å²	146.5	82%	0.822	78%	0.783	S	S	*	*				-162	136.7	109.4	-131.3	75.8	0	0	0	113.1	I281	L279-I281 HydrophobicContact CD2-CD1 4.35Å
280	D	25.2	Very low	26.1	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	79%	0.786	S	S	*	*			trans	-72.1	154.8	155.7	-76.3	-67.7	0	0	0	110.6
281	I	27.9	Very low	26	Very low	146 Å²	146	145.9 Å²	145.9	75%	0.749	79%	0.786	S	S	*	*			trans	-162.5	140.2	146	-117.2	161	0	0	0	115.5	L279	L279-I281 HydrophobicContact CD2-CD1 4.35Å
282	L	27	Very low	25.9	Very low	166 Å²	166	144.5 Å²	144.5	87%	0.869	79%	0.789	S	S	*	*			trans	74.1	123.7	163.8	-74.8	166.8	0	0	0	122.3
283	K	24.4	Very low	25.6	Very low	190 Å²	190	146.7 Å²	146.7	83%	0.826	79%	0.792	S	S	*	*			trans	-90.8	160.3	167.3	-58.6	168.2	177.4	173.7	0	110.5
284	G	27.1	Very low	26	Very low	71 Å²	71	140.6 Å²	140.6	73%	0.732	78%	0.782	S	S	*	*			trans	-169	55.1	176.8	0	0	0	0	0	119.5
285	Q	27.2	Very low	25.7	Very low	201 Å²	201	140.6 Å²	140.6	94%	0.939	78%	0.782	S	S	*	*			trans	51.3	141.5	155	-71.5	173.9	-49.8	0	0	122.6
286	L	26.4	Very low	25.7	Very low	151 Å²	151	140.3 Å²	140.3	79%	0.791	78%	0.78	S	S	*	*			trans	-80.1	165.6	168.2	-136.6	79.7	0	0	0	110.7	T288	L286-T288 HydrophobicContact CD2-CG2 4.36Å
287	P	28.2	Very low	25.4	Very low	121 Å²	121	140.5 Å²	140.5	79%	0.786	78%	0.781	S	S	*	*				-144.8	171.3	76.8	39.4	-22.1	0	0	0	116.7
288	T	25.2	Very low	25.4	Very low	116 Å²	116	136 Å²	136	71%	0.712	78%	0.779	S	S	*	*			trans	-69.3	148.3	167.5	46.4	0	0	0	0	113.2	L286	L286-T288 HydrophobicContact CD2-CG2 4.36Å
289	D	24.6	Very low	25.5	Very low	159 Å²	159	138.6 Å²	138.6	85%	0.85	79%	0.791	S	S	*	*				-160	176.8	128.7	-131.1	-32.8	0	0	0	115.2
290	V	23.2	Very low	25.4	Very low	118 Å²	118	139.7 Å²	139.7	72%	0.715	79%	0.791	S	S	*	*			trans	-89.4	147.1	-156.1	162	0	0	0	0	117
291	S	23.2	Very low	25.3	Very low	106 Å²	106	137.4 Å²	137.4	74%	0.741	79%	0.788	S	S	*	*			trans	79.8	-179.7	153.9	76.5	0	0	0	0	121.6
292	V	27.1	Very low	25.1	Very low	135 Å²	135	136.1 Å²	136.1	82%	0.818	79%	0.786	S	S	*	*			trans	89.9	80.8	175.4	-165.4	0	0	0	0	118.1
293	F	22.3	Very low	25	Very low	195 Å²	195	137.3 Å²	137.3	86%	0.855	79%	0.785	S	S	*	*			trans	-63.6	175.7	141.4	-98	-83.9	0	0	0	110.8
294	P	29.8	Very low	25	Very low	98 Å²	98	137 Å²	137	64%	0.636	78%	0.783	S	S	*	*			cis	-142.2	-175.3	-2.6	27.6	-1.9	0	0	0	117.1
295	T	22.4	Very low	24.8	Very low	119 Å²	119	141.2 Å²	141.2	73%	0.73	79%	0.789	S	S	*	*			trans	79.5	155	138.8	27.2	0	0	0	0	125.2
296	L	24.5	Very low	24.7	Very low	156 Å²	156	138.8 Å²	138.8	82%	0.817	78%	0.781	S	S	*	*			trans	86.5	150.2	153.5	-74.2	161.3	0	0	0	118.4
297	P	25.2	Very low	24.6	Very low	105 Å²	105	139.2 Å²	139.2	68%	0.682	78%	0.779	S	S	*	*				-141.1	-175.9	-124.7	44.4	-25.5	0	0	0	116.8
298	A	22.8	Very low	24.8	Very low	96 Å²	96	138.4 Å²	138.4	79%	0.793	77%	0.774	S	S	*	*			trans	50.2	97	147.2	0	0	0	0	0	119
299	V	26.3	Very low	24.8	Very low	152 Å²	152	137.2 Å²	137.2	92%	0.921	77%	0.77	S	S	*	*			trans	-121.7	134	148.3	-179.2	0	0	0	0	108.1
300	Q	23.3	Very low	24.9	Very low	179 Å²	179	139 Å²	139	84%	0.836	77%	0.77	S	S	*	*			trans	-116.4	146.2	-172.1	-167.2	-179	23.7	0	0	111
301	S	22.6	Very low	25.1	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	77%	0.771	S	S	*	*			trans	73.2	170.2	174	84.5	0	0	0	0	117
302	V	24.3	Very low	25.1	Very low	119 Å²	119	143.5 Å²	143.5	72%	0.721	77%	0.767	S	S	*	*			trans	63.7	79.3	-173.9	-164.8	0	0	0	0	114.7
303	F	25.6	Very low	25.2	Very low	191 Å²	191	143.6 Å²	143.6	84%	0.838	75%	0.754	S	S	*	*				-163.1	121.5	115.2	-100.5	-67.4	0	0	0	110.3
304	K	23.6	Very low	25.4	Very low	183 Å²	183	138.6 Å²	138.6	80%	0.796	74%	0.743	S	S	*	*			trans	-89.7	156.5	164.5	-75.7	-176.9	173.9	-178.8	0	108.8
305	N	23.6	Very low	25.4	Very low	159 Å²	159	142 Å²	142	85%	0.85	75%	0.751	S	S	*	*			trans	67.6	58.7	163.4	-51.1	-7.2	0	0	0	117
306	I	24.9	Very low	25.7	Very low	150 Å²	150	142.6 Å²	142.6	77%	0.769	75%	0.748	S	S	*	*			trans	-128.9	136.1	155.5	-60	-177.4	0	0	0	109.3
307	H	24.7	Very low	25.9	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.745	74%	0.737	S	S	*	*			trans	-95.2	114.8	-174.5	-171.4	-65.1	0	0	0	110	S309	H307-S309 VanDerWaalsContact C-N 3.32Å; H307-S309 PolarHBondContact O-N 2.86Å
308	P	31.5	Very low	26	Very low	104 Å²	104	138.7 Å²	138.7	68%	0.675	73%	0.729	S	S	*	*			trans	-84	72.1	-176.7	33.9	-34.8	0	0	0	111.8
309	S	25	Very low	26.1	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	73%	0.725	S	S	*	*			trans	-69.4	151.7	154.6	52.6	0	0	0	0	109.6	H307	H307-S309 VanDerWaalsContact C-N 3.32Å; H307-S309 PolarHBondContact O-N 2.86Å
310	K	27.6	Very low	26.2	Very low	197 Å²	197	137.5 Å²	137.5	86%	0.857	72%	0.716	S	S	*	*			trans	73.3	97.6	-164.5	-53.8	-177.5	174.7	-171.1	0	114.4
311	W	26.5	Very low	26.5	Very low	193 Å²	193	133.2 Å²	133.2	73%	0.731	70%	0.698	S	S	*	*			trans	-99	117.7	142.4	-72.2	31	0	0	0	106	Y313	W311-Y313 VanDerWaalsContact C-N 3.33Å; W311-Y313 HydrophobicContact CB-CD2 3.92Å; W311-Y313 HydrophobicContact CB-CE2 3.97Å; W311-Y313 HydrophobicContact CD2-CE2 4.29Å; W311-Y313 AromaticContact CE3-CE2 3.52Å; W311-Y313 HydrophobicContact CE3-CE2 3.52Å; W311-Y313 AromaticContact CE3-CZ 3.73Å; W311-Y313 HydrophobicContact CZ3-CE2 4.33Å; W311-Y313 WeakPolarHBondContact CZ3-OH 3.32Å; W311-Y313 PolarHBondContact O-N 3.5Å
312	D	24.6	Very low	26.7	Very low	124 Å²	124	132.4 Å²	132.4	66%	0.663	69%	0.689	S	S	*	*			trans	-84.8	77.3	-176.4	-159.6	-23.3	0	0	0	110.3	S314	D312-S314 PolarHBondContact O-N 3.09Å; D312-S314 VanDerWaalsContact O-N 3.14Å; D312-S314 WeakPolarHBondContact OD1-CB 3.32Å; D312-S314 PolarHBondContact OD1-OG 3.09Å
313	Y	27.9	Very low	26.8	Very low	138 Å²	138	138 Å²	138	54%	0.541	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-70.1	-1.9	-176.8	-94.3	-70.8	0	0	0	114.6	W311 Q315 I316	W311-Y313 VanDerWaalsContact C-N 3.33Å; W311-Y313 HydrophobicContact CB-CD2 3.92Å; W311-Y313 HydrophobicContact CB-CE2 3.97Å; W311-Y313 HydrophobicContact CD2-CE2 4.29Å; W311-Y313 AromaticContact CE3-CE2 3.52Å; W311-Y313 HydrophobicContact CE3-CE2 3.52Å; W311-Y313 AromaticContact CE3-CZ 3.73Å; W311-Y313 HydrophobicContact CZ3-CE2 4.33Å; W311-Y313 WeakPolarHBondContact CZ3-OH 3.32Å; W311-Y313 PolarHBondContact O-N 3.5Å; Y313-Q315 PolarHBondContact O-N 2.96Å; Y313-I316 PolarHBondContact O-N 2.9Å
314	S	27.8	Very low	26.9	Very low	89 Å²	89	136.2 Å²	136.2	62%	0.622	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-59	-20.6	-175.4	63.6	0	0	0	0	114.8	D312	D312-S314 PolarHBondContact O-N 3.09Å; D312-S314 VanDerWaalsContact O-N 3.14Å; D312-S314 WeakPolarHBondContact OD1-CB 3.32Å; D312-S314 PolarHBondContact OD1-OG 3.09Å
315	Q	28.9	Very low	27.1	Very low	171 Å²	171	136.4 Å²	136.4	80%	0.799	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-102.4	-4.3	-172	-58.5	-170.4	8.6	0	0	115.5	Y313	Y313-Q315 PolarHBondContact O-N 2.96Å
316	I	28.5	Very low	27.1	Very low	130 Å²	130	134.4 Å²	134.4	67%	0.667	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-26.5	-174	-64.6	-179.9	0	0	0	113.5	Y313	Y313-I316 PolarHBondContact O-N 2.9Å
317	H	29.2	Very low	27.1	Very low	129 Å²	129	134.8 Å²	134.8	60%	0.597	70%	0.699	S	S	*	*	S	Bend	trans	-89.1	4.2	-179	-93.3	-108.1	0	0	0	115.9	L319	H317-L319 PolarHBondContact O-N 3.36Å
318	G	25.9	Very low	27.1	Very low	50 Å²	50	134.4 Å²	134.4	52%	0.515	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.4	1.7	-176.3	0	0	0	0	0	117.2
319	L	26.6	Very low	26.8	Very low	136 Å²	136	137.5 Å²	137.5	71%	0.712	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-3.3	-169.5	-72.3	174.7	0	0	0	116.1	H317	H317-L319 PolarHBondContact O-N 3.36Å
320	A	27.5	Very low	26.9	Very low	87 Å²	87	141.9 Å²	141.9	72%	0.719	72%	0.717	S	S	*	*	S	Bend	trans	-95.9	-12.6	179.9	0	0	0	0	0	114.4
321	L	28.9	Very low	26.7	Very low	90 Å²	90	138.6 Å²	138.6	47%	0.471	71%	0.709	S	S	.	*	S	Bend	trans	-130.8	15	-166.4	-98.9	163.9	0	0	0	115.2	L654	L321-L654 HydrophobicContact CD1-CD2 4.27Å
322	V	27.3	Very low	26.9	Very low	89 Å²	89	134.9 Å²	134.9	54%	0.539	71%	0.71	S	S	.	*			trans	-128.8	17.3	-178.6	-160.2	0	0	0	0	111.9
323	R	27.5	Very low	27.1	Very low	236 Å²	236	134.2 Å²	134.2	89%	0.891	71%	0.713	S	S	*	*	S	Bend	trans	-95	14.9	-174	-137.2	173.6	-170.9	179.3	0.5	115.7
324	N	27.6	Very low	26.9	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	72%	0.72	S	S	*	*	S	Bend	trans	-125.4	140.2	156.5	-79.3	-45	0	0	0	107.3
325	Q	26.3	Very low	27	Very low	186 Å²	186	135.9 Å²	135.9	87%	0.869	73%	0.733	S	S	*	*			trans	65.6	79.4	-174.2	-54.5	-174.8	6.3	0	0	116.3
326	C	23.7	Very low	26.9	Very low	117 Å²	117	132.4 Å²	132.4	79%	0.791	73%	0.727	S	S	*	*			trans	-145	70	152.9	-103	0	0	0	0	111.2
327	I	25.8	Very low	27.1	Very low	158 Å²	158	131.8 Å²	131.8	81%	0.81	73%	0.732	S	S	*	*			trans	-90.7	124.8	164.9	-64.2	177.4	0	0	0	107.9	Q329	I327-Q329 PolarHBondContact O-N 3.17Å
328	L	23.8	Very low	27.1	Very low	153 Å²	153	132.7 Å²	132.7	80%	0.801	75%	0.746	S	S	*	*			trans	4.3	106.7	162.7	-65.7	164	0	0	0	117.1
329	Q	26.1	Very low	27.2	Very low	170 Å²	170	135.6 Å²	135.6	79%	0.794	76%	0.758	S	S	*	*			trans	-136	88	150.9	-155.8	175.4	65.9	0	0	111.6	I327 N331	I327-Q329 PolarHBondContact O-N 3.17Å; Q329-N331 PolarHBondContact O-N 2.83Å
330	Q	26.5	Very low	27.2	Very low	182 Å²	182	133.6 Å²	133.6	85%	0.85	76%	0.756	S	S	*	*			trans	-75.7	105.2	167.3	-69.7	178.2	-16.9	0	0	109.5
331	N	24.5	Very low	27.1	Very low	129 Å²	129	134 Å²	134	69%	0.69	75%	0.753	S	S	*	*			trans	-86.9	151.6	152.8	-74	-66.7	0	0	0	107.6	Q329	Q329-N331 PolarHBondContact O-N 2.83Å
332	P	30	Very low	27.2	Very low	115 Å²	115	137.3 Å²	137.3	75%	0.747	77%	0.766	S	S	*	*			cis	-139.7	-159.6	39	45.4	-25.8	0	0	0	112.1
333	P	28.1	Very low	27.3	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	77%	0.773	S	S	*	*			cis	-135.3	153	-0.7	40.3	-21.8	0	0	0	119.1
334	V	24.3	Very low	27.3	Very low	116 Å²	116	136.3 Å²	136.3	70%	0.703	77%	0.771	S	S	*	*			trans	-7.4	123.4	153.7	-173.1	0	0	0	0	119
335	V	30.1	Very low	27.6	Very low	146 Å²	146	134 Å²	134	89%	0.885	76%	0.764	S	S	*	*			trans	-135.4	147.8	139.2	-176.8	0	0	0	0	107.9
336	S	26.2	Very low	27.6	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	76%	0.759	S	S	*	*			trans	-140.5	-169.8	-169.9	61.4	0	0	0	0	112.2
337	P	34.3	Very low	27.8	Very low	117 Å²	117	133.8 Å²	133.8	76%	0.76	76%	0.759	S	S	*	*				-123.7	168.9	-98.8	38.6	-22.3	0	0	0	115.1
338	V	29.4	Very low	28	Very low	147 Å²	147	131.4 Å²	131.4	89%	0.891	76%	0.756	S	S	*	*			trans	-141.4	146.5	167.5	-174.9	0	0	0	0	111.7
339	S	26.1	Very low	28.1	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	75%	0.754	S	S	*	*			trans	-68.7	-173.9	177.5	-37.5	0	0	0	0	113.9
340	S	27.5	Very low	28.5	Very low	95 Å²	95	126.9 Å²	126.9	66%	0.664	75%	0.753	S	S	*	*			cis	-166	168.2	13.7	48.8	0	0	0	0	112.5
341	S	26.2	Very low	28.5	Very low	95 Å²	95	123.6 Å²	123.6	66%	0.664	75%	0.75	S	S	*	*			trans	67.3	153.5	144.1	57.6	0	0	0	0	119
342	Q	29.5	Very low	28.6	Very low	159 Å²	159	123.1 Å²	123.1	74%	0.743	75%	0.752	S	S	*	*			cis	-163.4	166.1	3.3	-128.7	169.2	-2.5	0	0	113
343	H	30.5	Very low	28.3	Very low	148 Å²	148	129.4 Å²	129.4	69%	0.685	76%	0.761	S	S	*	*			trans	61.7	96.2	153.2	-71.7	-61.9	0	0	0	123.5
344	N	26.1	Very low	28.3	Very low	157 Å²	157	127.5 Å²	127.5	84%	0.84	76%	0.761	S	S	*	*				52.2	157.6	107.2	-84.1	23.2	0	0	0	124.7
345	P	35.1	Very low	28.2	Very low	106 Å²	106	130 Å²	130	69%	0.688	77%	0.769	S	S	*	*			trans	-116.5	-172	-158.5	44.7	-33.9	0	0	0	114.6
346	L	25.7	Very low	28	Very low	146 Å²	146	131.6 Å²	131.6	76%	0.764	77%	0.769	S	S	*	*			trans	165.8	149.6	134	-92.5	163.5	0	0	0	113.5
347	I	27.9	Very low	28.3	Very low	152 Å²	152	134.2 Å²	134.2	78%	0.779	78%	0.775	S	S	*	*			trans	68.6	137.8	151.2	-67.2	162.8	0	0	0	115.9
348	S	30	Very low	28	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	77%	0.771	S	S	*	*			cis	-155.8	160	3.8	37.3	0	0	0	0	113.2
349	S	26.1	Very low	27.7	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	77%	0.766	S	S	*	*			trans	-82.5	-166.9	170.5	-35.8	0	0	0	0	112.5
350	P	35	Very low	27.9	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	77%	0.772	S	S	*	*				-134.1	-170.3	-60.6	34.4	-15.3	0	0	0	114.2
351	S	25.3	Very low	27.8	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	78%	0.779	S	S	*	*			trans	99.8	162.7	141.1	-155.2	0	0	0	0	121.7
352	V	27.6	Very low	28	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.715	78%	0.776	S	S	*	*			trans	89.9	98.2	162	-167	0	0	0	0	120.9
353	R	24	Very low	27.9	Very low	248 Å²	248	140 Å²	140	94%	0.936	78%	0.78	S	S	*	*			trans	42.4	136.5	134.9	-60.9	177.3	172.7	168.3	-3.4	123
354	G	26.6	Very low	27.6	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	78%	0.784	S	S	*	*			trans	153.3	85.2	151.3	0	0	0	0	0	113.2
355	L	23.4	Very low	27.8	Very low	168 Å²	168	140.9 Å²	140.9	88%	0.88	79%	0.788	S	S	*	*				42.4	102.1	85.7	-76.6	173.7	0	0	0	115.7
356	M	26.4	Very low	27.2	Very low	179 Å²	179	140.7 Å²	140.7	88%	0.882	79%	0.79	S	S	*	*				174.6	125.5	127.3	-89.7	-89.8	108.4	0	0	111.5
357	L	30.7	Very low	27.4	Very low	154 Å²	154	142.3 Å²	142.3	81%	0.806	80%	0.798	S	S	*	*			trans	-80	167.8	154	-114.5	74.4	0	0	0	108.4
358	P	29.3	Very low	27.2	Very low	105 Å²	105	140.3 Å²	140.3	68%	0.682	80%	0.797	S	S	*	*			cis	-154.3	-174.7	47.8	43.5	-21.9	0	0	0	118.1
359	N	23.3	Very low	27	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	79%	0.791	S	S	*	*			trans	35	124.1	147.7	-73.8	-5	0	0	0	121.6
360	I	29.3	Very low	27	Very low	176 Å²	176	144.8 Å²	144.8	90%	0.903	80%	0.796	S	S	*	*				-148.7	148.1	117.8	-97.2	144.7	0	0	0	108
361	Q	25.5	Very low	26.4	Very low	174 Å²	174	147.1 Å²	147.1	81%	0.813	80%	0.801	S	S	*	*			trans	-127.2	-165.7	-175.3	-154.7	-156.3	-1.6	0	0	110.1
362	P	31.6	Very low	26.4	Very low	92 Å²	92	146.8 Å²	146.8	60%	0.597	80%	0.799	S	S	*	*				-80.9	174.6	-115.3	41	-31.3	0	0	0	114.4
363	N	27.4	Very low	26.3	Very low	153 Å²	153	152.7 Å²	152.7	82%	0.818	81%	0.808	S	S	*	*				-166.6	154.1	128.6	-99	-12.8	0	0	0	113.1
364	D	24.5	Very low	26.3	Very low	145 Å²	145	150 Å²	150	78%	0.775	80%	0.804	S	S	*	*			trans	-58.1	150.9	-177.2	-48.6	-68.9	0	0	0	115.2
365	L	28.6	Very low	26.3	Very low	177 Å²	177	152.6 Å²	152.6	93%	0.927	81%	0.808	S	S	*	*				-155.7	132.5	121.4	-112.2	167	0	0	0	110.7
366	S	23.6	Very low	26.4	Very low	103 Å²	103	150.5 Å²	150.5	72%	0.72	80%	0.802	S	S	*	*			trans	-109	155.3	-171.3	55	0	0	0	0	112.3
367	L	28.6	Very low	26.4	Very low	180 Å²	180	150.4 Å²	150.4	94%	0.942	80%	0.799	S	S	*	*			trans	-149.3	149.5	147.6	-110.2	167.2	0	0	0	108.9
368	S	23.8	Very low	26.2	Very low	109 Å²	109	148.4 Å²	148.4	76%	0.762	80%	0.795	S	S	*	*			trans	-133.8	-175.2	-159.4	-171.1	0	0	0	0	111.9
369	S	25.8	Very low	26.1	Very low	87 Å²	87	149.8 Å²	149.8	61%	0.608	80%	0.802	S	S	*	*			trans	77.8	135.2	-171.5	78.9	0	0	0	0	114.5
370	Y	27.1	Very low	26.1	Very low	222 Å²	222	151 Å²	151	87%	0.871	81%	0.808	S	S	*	*			cis	-121.1	121.7	8.4	-81.7	-98.7	0	0	0	113.7
371	L	22.9	Very low	26.1	Very low	170 Å²	170	147.5 Å²	147.5	89%	0.89	81%	0.806	S	S	*	*			trans	-119.3	126.4	156.5	-87.7	171.3	0	0	0	107.9
372	S	25.6	Very low	26	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	81%	0.811	S	S	*	*			trans	166.5	114.5	142.2	42.1	0	0	0	0	113.1
373	R	25.1	Very low	25.9	Very low	241 Å²	241	149.6 Å²	149.6	91%	0.909	82%	0.82	S	S	*	*			trans	173.3	80.3	130.4	-93.9	176.4	-156.5	-161.7	7.7	110.8
374	F	23.8	Very low	25.8	Very low	191 Å²	191	151.4 Å²	151.4	84%	0.838	82%	0.821	S	S	*	*			trans	-85.1	162.4	140.2	-78.1	-85.6	0	0	0	108.1	V376	F374-V376 HydrophobicContact CD1-CG2 4.46Å
375	P	26.6	Very low	25.9	Very low	126 Å²	126	153.4 Å²	153.4	82%	0.818	83%	0.826	S	S	*	*				-128.2	121.1	116.3	34.2	-28.1	0	0	0	112.1
376	V	25.1	Very low	25.9	Very low	123 Å²	123	150.5 Å²	150.5	75%	0.745	82%	0.82	S	S	*	*			trans	-82.3	132.2	157.5	175.7	0	0	0	0	107.3	F374	F374-V376 HydrophobicContact CD1-CG2 4.46Å
377	Q	26.4	Very low	25.9	Very low	178 Å²	178	151.4 Å²	151.4	83%	0.832	82%	0.821	S	S	*	*			trans	-140.5	112.6	164.5	-161.2	172.3	30.9	0	0	110.8
378	P	25.9	Very low	25.9	Very low	111 Å²	111	148.6 Å²	148.6	72%	0.721	82%	0.816	S	S	*	*			trans	-97.2	139.1	176.6	35.2	-29	0	0	0	111.4
379	T	28.4	Very low	26	Very low	134 Å²	134	150.1 Å²	150.1	82%	0.822	82%	0.815	S	S	*	*			trans	-152.9	128.8	162.9	4.9	0	0	0	0	111
380	N	23.4	Very low	26.1	Very low	171 Å²	171	151.9 Å²	151.9	91%	0.914	83%	0.828	S	S	*	*			trans	-77.6	138.1	172.1	-66.1	-36.7	0	0	0	110.5
381	A	28.4	Very low	26.1	Very low	103 Å²	103	145.9 Å²	145.9	85%	0.851	82%	0.818	S	S	*	*			trans	-151.2	124.1	160.2	0	0	0	0	0	110.1
382	E	24.1	Very low	26.3	Very low	196 Å²	196	144.2 Å²	144.2	92%	0.916	82%	0.815	S	S	*	*			trans	-86.5	135.2	175	-51.6	166.5	99.6	0	0	110.5
383	S	29.2	Very low	26.3	Very low	114 Å²	114	146.2 Å²	146.2	80%	0.797	82%	0.816	S	S	*	*			trans	-174.8	112.1	141	49.3	0	0	0	0	115.1
384	K	25.9	Very low	26.3	Very low	191 Å²	191	142.5 Å²	142.5	83%	0.83	81%	0.812	S	S	*	*			trans	8.8	149.3	137.1	-60.3	167.5	-176.6	168.5	0	120.4
385	Q	26.5	Very low	26.4	Very low	188 Å²	188	138.4 Å²	138.4	88%	0.879	81%	0.805	S	S	*	*			trans	77	147.4	156.2	-76.3	166.1	-26.5	0	0	116.8
386	S	28.1	Very low	26.3	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	81%	0.805	S	S	*	*			cis	-152.3	163	0.1	43.3	0	0	0	0	114
387	V	23.6	Very low	26.3	Very low	122 Å²	122	136.9 Å²	136.9	74%	0.739	80%	0.802	S	S	*	*			trans	-62.6	148.7	174.4	173.6	0	0	0	0	112.8	L389	V387-L389 HydrophobicContact CG1-CD1 4.16Å; V387-L389 HydrophobicContact CG1-CG 4Å
388	S	27.8	Very low	26.6	Very low	121 Å²	121	138.5 Å²	138.5	85%	0.846	81%	0.806	S	S	*	*			trans	-135	152.3	145.6	63.7	0	0	0	0	110.6
389	L	27	Very low	26.5	Very low	141 Å²	141	142 Å²	142	74%	0.738	81%	0.812	S	S	*	*			trans	-134.5	150.1	-170.5	-88.3	162.7	0	0	0	110.7	V387	V387-L389 HydrophobicContact CG1-CD1 4.16Å; V387-L389 HydrophobicContact CG1-CG 4Å
390	S	27.8	Very low	26.6	Very low	125 Å²	125	140.1 Å²	140.1	87%	0.874	80%	0.803	S	S	*	*			trans	-157.5	97.5	159	-76.3	0	0	0	0	107.5
391	S	26.9	Very low	26.7	Very low	95 Å²	95	137.6 Å²	137.6	66%	0.664	80%	0.799	S	S	*	*			cis	84.2	105	42.9	-54.3	0	0	0	0	114
392	T	27.6	Very low	26.7	Very low	135 Å²	135	136.3 Å²	136.3	83%	0.828	80%	0.795	S	S	*	*			trans	-165.7	143.7	133	-77.1	0	0	0	0	109.4
393	I	24	Very low	26.7	Very low	149 Å²	149	137.1 Å²	137.1	76%	0.764	80%	0.796	S	S	*	*			trans	-139	132.4	-173	-68.6	168	0	0	0	108.9	P395	I393-P395 HydrophobicContact CG2-CG 4.39Å
394	I	26.9	Very low	26.7	Very low	163 Å²	163	138.7 Å²	138.7	84%	0.836	80%	0.801	S	S	*	*			trans	-144.5	114.6	166.5	-53.1	-179.8	0	0	0	111.4
395	P	25	Very low	26.7	Very low	106 Å²	106	134.1 Å²	134.1	69%	0.688	80%	0.798	S	S	*	*			trans	-134.8	131.9	166.4	36.6	-20.9	0	0	0	114.6	I393	I393-P395 HydrophobicContact CG2-CG 4.39Å
396	C	25.5	Very low	26.8	Very low	119 Å²	119	130.8 Å²	130.8	80%	0.804	80%	0.796	S	S	*	*			trans	-167.6	122	157.7	-98.6	0	0	0	0	108
397	S	24.3	Very low	26.9	Very low	98 Å²	98	133 Å²	133	69%	0.685	80%	0.798	S	S	*	*				76.3	110.2	56.1	94.5	0	0	0	0	115
398	K	32.6	Very low	27.1	Very low	212 Å²	212	136 Å²	136	92%	0.922	80%	0.804	S	S	*	*			trans	-175.4	147.3	136.1	-100.6	160.3	-172.6	176	0	113.1
399	Q	23.1	Very low	27.1	Very low	183 Å²	183	139.5 Å²	139.5	86%	0.855	81%	0.807	S	S	*	*			trans	-120.5	-173	179.9	-125.2	-171.6	-8.4	0	0	107.2
400	P	30.8	Very low	27.3	Very low	96 Å²	96	139.6 Å²	139.6	62%	0.623	81%	0.813	S	S	*	*			cis	-138.6	-175	-18.7	35.5	-15.5	0	0	0	115
401	S	25.8	Very low	27.5	Very low	118 Å²	118	139 Å²	139	83%	0.825	81%	0.809	S	S	*	*			trans	73.1	128	141.2	64.6	0	0	0	0	122.6
402	G	28.8	Very low	27.7	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	81%	0.814	S	S	*	*			trans	-171.9	122.1	161.6	0	0	0	0	0	109.8
403	F	24.6	Very low	27.9	Very low	212 Å²	212	140.8 Å²	140.8	93%	0.93	82%	0.815	S	S	*	*			trans	-85.5	146	-177	-94.5	-110.8	0	0	0	112.6
404	V	28.4	Very low	28.3	Very low	148 Å²	148	142.3 Å²	142.3	90%	0.897	82%	0.816	S	S	*	*				-175.2	151.1	122.1	150.3	0	0	0	0	106.8
405	A	26.2	Very low	28.5	Very low	94 Å²	94	143.9 Å²	143.9	78%	0.777	82%	0.82	S	S	*	*			trans	-132.5	146.3	-169.5	0	0	0	0	0	113.7
406	S	29	Very low	28.9	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	83%	0.825	S	S	*	*			trans	-163.2	117.3	151.8	59.2	0	0	0	0	113.5
407	L	28.6	Very low	29.2	Very low	162 Å²	162	141.6 Å²	141.6	85%	0.848	80%	0.803	S	S	*	*			trans	75.3	144.1	147.7	-134	68.2	0	0	0	122.1
408	E	29.4	Very low	29.8	Very low	186 Å²	186	141.3 Å²	141.3	87%	0.869	80%	0.799	S	S	*	*			trans	65.1	131.3	168.7	-82.9	169.8	173.8	0	0	121.1
409	E	27.9	Very low	29.8	Very low	193 Å²	193	137.4 Å²	137.4	90%	0.902	79%	0.788	S	S	*	*			trans	-109.6	131.7	-169.3	-56.2	170.4	100.6	0	0	111.4
410	V	31.1	Very low	30.4	Very low	144 Å²	144	139.5 Å²	139.5	87%	0.873	79%	0.788	S	S	*	*			trans	-138.2	135.7	139.3	-177.5	0	0	0	0	108.1
411	S	31.1	Very low	30.3	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-66	141.7	-170.2	59.1	0	0	0	0	114.3
412	T	31.2	Very low	30.7	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-46.7	139.7	178.5	53.2	0	0	0	0	115.2	K414	T412-K414 PolarHBondContact O-N 2.85Å
413	V	31.8	Very low	31.2	Very low	143 Å²	143	138.1 Å²	138.1	87%	0.867	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-50.5	126.2	167	178.5	0	0	0	0	110.3
414	K	33.2	Very low	32.1	Very low	180 Å²	180	130.6 Å²	130.6	78%	0.783	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-91.9	133.7	164.8	-79.6	-173.5	175.1	179.8	0	109.7	T412 S416	T412-K414 PolarHBondContact O-N 2.85Å; K414-S416 PolarHBondContact O-N 3.43Å
415	E	31.4	Very low	33.1	Very low	197 Å²	197	127.1 Å²	127.1	92%	0.921	72%	0.716	S	S	*	*			trans	-54.6	115.9	172.4	-166.6	168.1	-150.6	0	0	110.5	D417	E415-D417 PolarHBondContact O-N 3.08Å
416	S	31.6	Very low	33.8	Very low	111 Å²	111	128.1 Å²	128.1	78%	0.776	71%	0.708	S	S	*	*			trans	-85.8	103.3	-174.8	-75.1	0	0	0	0	111.6	K414 P418	K414-S416 PolarHBondContact O-N 3.43Å; S416-P418 VanDerWaalsContact O-CD 3.28Å; S416-P418 WeakPolarHBondContact O-CD 3.45Å
417	D	32.9	Very low	34.5	Very low	66 Å²	66	130.9 Å²	130.9	35%	0.353	70%	0.701	S	S	.	*			trans	-66.6	113	164.4	173.9	8.7	0	0	0	110	E415 N419 R420 G421	E415-D417 PolarHBondContact O-N 3.08Å; D417-N419 PolarHBondContact O-N 2.9Å; D417-N419 VanDerWaalsContact OD1-CB 3.29Å; D417-N419 WeakPolarHBondContact OD1-CB 3.33Å; D417-N419 PolarHBondContact OD1-N 3.41Å; D417-N419 PolarHBondContact OD1-ND2 2.92Å; D417-R420 HydrophobicContact CB-CB 4.38Å; D417-R420 PolarHBondContact O-N 3.18Å; D417-R420 VanDerWaalsContact O-N 3.1Å; D417-R420 WeakPolarHBondContact OD2-CB 3.29Å; D417-R420 WeakPolarHBondContact OD2-CD 3.47Å; D417-R420 WeakPolarHBondContact OD2-CG 3.45Å; D417-G421 PolarHBondContact O-N 3.48Å
418	P	37.2	Very low	35.2	Very low	92 Å²	92	126.9 Å²	126.9	60%	0.597	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-9.6	-178.1	28.5	-35.4	0	0	0	113.6	S416	S416-P418 VanDerWaalsContact O-CD 3.28Å; S416-P418 WeakPolarHBondContact O-CD 3.45Å
419	N	31.6	Very low	35.8	Very low	130 Å²	130	119.6 Å²	119.6	70%	0.695	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-7.8	178.4	-52.3	-78.6	0	0	0	113.8	D417	D417-N419 PolarHBondContact O-N 2.9Å; D417-N419 VanDerWaalsContact OD1-CB 3.29Å; D417-N419 WeakPolarHBondContact OD1-CB 3.33Å; D417-N419 PolarHBondContact OD1-N 3.41Å; D417-N419 PolarHBondContact OD1-ND2 2.92Å
420	R	36.3	Very low	36.7	Very low	226 Å²	226	113.2 Å²	113.2	85%	0.853	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	-12.5	-173.4	-75.4	-174.1	160.4	-130.7	-3.2	117.4	D417	D417-R420 HydrophobicContact CB-CB 4.38Å; D417-R420 PolarHBondContact O-N 3.18Å; D417-R420 VanDerWaalsContact O-N 3.1Å; D417-R420 WeakPolarHBondContact OD2-CB 3.29Å; D417-R420 WeakPolarHBondContact OD2-CD 3.47Å; D417-R420 WeakPolarHBondContact OD2-CG 3.45Å
421	G	29.4	Very low	37.2	Very low	39 Å²	39	107.4 Å²	107.4	40%	0.402	59%	0.59	S	S	.	*	S	Bend	trans	-111.2	120.4	-168.9	0	0	0	0	0	116.8	D417 W423	D417-G421 PolarHBondContact O-N 3.48Å; G421-W423 VanDerWaalsContact C-N 3.27Å; G421-W423 PolarHBondContact O-N 3.15Å
422	G	33.6	Very low	37.7	Very low	87 Å²	87	102.6 Å²	102.6	90%	0.897	56%	0.556	S	S	*	*			trans	56	-5	130.9	0	0	0	0	0	123.2	M424	G422-M424 VanDerWaalsContact C-N 3.25Å; G422-M424 PolarHBondContact O-N 3.44Å
423	W	39.3	Very low	38.2	Very low	135 Å²	135	99.1 Å²	99.1	51%	0.511	53%	0.533	S	S	.	.	S	Bend	trans	-72	-11.2	-171	69.8	-80.3	0	0	0	115.5	G421 R562 E566	G421-W423 VanDerWaalsContact C-N 3.27Å; G421-W423 PolarHBondContact O-N 3.15Å; W423-R562 HydrophobicContact CH2-CG 4.29Å; W423-R562 HydrophobicContact CZ2-CG 4.24Å; W423-R562 VanDerWaalsContact CZ2-NE 3.33Å; W423-R562 VanDerWaalsContact NE1-NH2 3.17Å; W423-E566 HydrophobicContact CH2-CG 4.3Å; W423-E566 WeakPolarHBondContact CH2-OE1 3.41Å; W423-E566 HydrophobicContact CZ3-CG 4.43Å
424	M	42.1	Very low	38.8	Very low	54 Å²	54	97.3 Å²	97.3	27%	0.266	52%	0.518	S	S	.	.	S	Bend	trans	-143	133.5	-176.3	-172.4	168.4	60.8	0	0	109.3	G422 E428 A429 V432	G422-M424 VanDerWaalsContact C-N 3.25Å; G422-M424 PolarHBondContact O-N 3.44Å; M424-E428 HydrophobicContact CG-CB 3.34Å; M424-E428 HydrophobicContact CG-CG 4.47Å; M424-E428 HydrophobicContact SD-CB 3.99Å; M424-A429 HydrophobicContact CE-CB 3.99Å; M424-V432 HydrophobicContact CE-CG2 4.38Å; M424-V432 HydrophobicContact SD-CG2 3.77Å
425	T	49.5	Very low	39.1	Very low	75 Å²	75	89.8 Å²	89.8	46%	0.46	49%	0.486	S	S	.	.			trans	-74.8	161.8	178.3	63.8	0	0	0	0	112.1	Y427 E428 A429	T425-Y427 PolarHBondContact O-N 3.42Å; T425-Y427 VanDerWaalsContact O-N 3.16Å; T425-E428 VanDerWaalsContact CB-OE2 3.25Å; T425-E428 WeakPolarHBondContact CB-OE2 3.41Å; T425-E428 VanDerWaalsContact CG2-OE2 3.31Å; T425-E428 WeakPolarHBondContact CG2-OE2 3.13Å; T425-E428 PolarHBondContact N-OE2 3Å; T425-E428 PolarHBondContact O-N 3.06Å; T425-E428 VanDerWaalsContact O-N 3.13Å; T425-E428 WeakPolarHBondContact OG1-CG 3.14Å; T425-E428 PolarHBondContact OG1-N 3.46Å; T425-E428 PolarHBondContact OG1-OE2 2.66Å; T425-A429 WeakPolarHBondContact O-CB 3.46Å; T425-A429 PolarHBondContact O-N 3.41Å
426	D	42.3	Very low	39.5	Very low	115 Å²	115	82.7 Å²	82.7	62%	0.615	45%	0.453	S	S	*	.	H	α-helix	trans	-55.5	-32.4	174.1	-59.4	-47.1	0	0	0	112.2	I430	D426-I430 WeakPolarHBondContact O-CD1 3.41Å; D426-I430 VanDerWaalsContact O-CG1 3.25Å; D426-I430 WeakPolarHBondContact O-CG1 3.14Å; D426-I430 PolarHBondContact O-N 3.25Å
427	Y	44.1	Very low	39.7	Very low	176 Å²	176	80.9 Å²	80.9	69%	0.69	43%	0.434	S	S	*	.	H	α-helix	trans	-71	-43.3	176.8	-73.2	-82.7	0	0	0	112.8	T425 A429 I430 G431	T425-Y427 PolarHBondContact O-N 3.42Å; T425-Y427 VanDerWaalsContact O-N 3.16Å; Y427-A429 VanDerWaalsContact C-N 3.33Å; Y427-I430 PolarHBondContact O-N 3Å; Y427-G431 PolarHBondContact O-N 3.24Å
428	E	41.7	Very low	40	Very low	79 Å²	79	85.4 Å²	85.4	37%	0.369	45%	0.446	S	S	.	.	H	α-helix	trans	-68	-36.1	175.5	-70.1	156.3	133.4	0	0	110.7	M424 T425 I430 G431 V432	M424-E428 HydrophobicContact CG-CB 3.34Å; M424-E428 HydrophobicContact CG-CG 4.47Å; M424-E428 HydrophobicContact SD-CB 3.99Å; T425-E428 VanDerWaalsContact CB-OE2 3.25Å; T425-E428 WeakPolarHBondContact CB-OE2 3.41Å; T425-E428 VanDerWaalsContact CG2-OE2 3.31Å; T425-E428 WeakPolarHBondContact CG2-OE2 3.13Å; T425-E428 PolarHBondContact N-OE2 3Å; T425-E428 PolarHBondContact O-N 3.06Å; T425-E428 VanDerWaalsContact O-N 3.13Å; T425-E428 WeakPolarHBondContact OG1-CG 3.14Å; T425-E428 PolarHBondContact OG1-N 3.46Å; T425-E428 PolarHBondContact OG1-OE2 2.66Å; E428-I430 VanDerWaalsContact C-N 3.33Å; E428-I430 PolarHBondContact O-N 3.4Å; E428-G431 PolarHBondContact O-N 3.09Å; E428-V432 WeakPolarHBondContact O-CB 3.4Å; E428-V432 VanDerWaalsContact O-CG2 3.3Å; E428-V432 WeakPolarHBondContact O-CG2 3.21Å; E428-V432 PolarHBondContact O-N 3.08Å
429	A	42.4	Very low	40.1	Very low	33 Å²	33	84.7 Å²	84.7	27%	0.273	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-37	172	0	0	0	0	0	113	M424 T425 Y427 L433	M424-A429 HydrophobicContact CE-CB 3.99Å; T425-A429 WeakPolarHBondContact O-CB 3.46Å; T425-A429 PolarHBondContact O-N 3.41Å; Y427-A429 VanDerWaalsContact C-N 3.33Å; A429-L433 PolarHBondContact O-N 3.06Å; A429-L433 VanDerWaalsContact O-N 3.11Å
430	I	47.9	Very low	40.1	Very low	59 Å²	59	81.6 Å²	81.6	30%	0.303	42%	0.424	S	S	.	.	H	α-helix	trans	-69	-43.5	172.2	-71.9	163	0	0	0	111	D426 Y427 E428 V432 L433 L434 M460	D426-I430 WeakPolarHBondContact O-CD1 3.41Å; D426-I430 VanDerWaalsContact O-CG1 3.25Å; D426-I430 WeakPolarHBondContact O-CG1 3.14Å; D426-I430 PolarHBondContact O-N 3.25Å; Y427-I430 PolarHBondContact O-N 3Å; E428-I430 VanDerWaalsContact C-N 3.33Å; E428-I430 PolarHBondContact O-N 3.4Å; I430-V432 VanDerWaalsContact C-N 3.33Å; I430-V432 PolarHBondContact O-N 2.91Å; I430-L433 PolarHBondContact O-N 3.48Å; I430-L434 HydrophobicContact CG2-CD1 3.93Å; I430-L434 WeakPolarHBondContact O-CG 3.44Å; I430-L434 PolarHBondContact O-N 3.21Å; I430-M460 HydrophobicContact CD1-CE 4.05Å; I430-M460 HydrophobicContact CG1-CE 4.26Å
431	G	40.8	Very low	40	Very low	21 Å²	21	77.9 Å²	77.9	22%	0.216	42%	0.419	C	S	.	.	H	α-helix	trans	-60.1	-42.8	175.2	0	0	0	0	0	112.4	Y427 E428 L434 I435	Y427-G431 PolarHBondContact O-N 3.24Å; E428-G431 PolarHBondContact O-N 3.09Å; G431-L434 PolarHBondContact O-N 3.31Å; G431-I435 VanDerWaalsContact O-CG1 3.29Å; G431-I435 WeakPolarHBondContact O-CG1 3.35Å; G431-I435 PolarHBondContact O-N 3.33Å; G431-I435 VanDerWaalsContact O-N 3.08Å
432	V	40.9	Very low	40.1	Very low	12 Å²	12	79.1 Å²	79.1	7%	0.073	42%	0.418	C	S	.	.	H	α-helix	trans	-56.3	-49.6	172.3	154	0	0	0	0	111.8	M424 E428 I430 L434 I435 Q436 A565	M424-V432 HydrophobicContact CE-CG2 4.38Å; M424-V432 HydrophobicContact SD-CG2 3.77Å; E428-V432 WeakPolarHBondContact O-CB 3.4Å; E428-V432 VanDerWaalsContact O-CG2 3.3Å; E428-V432 WeakPolarHBondContact O-CG2 3.21Å; E428-V432 PolarHBondContact O-N 3.08Å; I430-V432 VanDerWaalsContact C-N 3.33Å; I430-V432 PolarHBondContact O-N 2.91Å; V432-L434 PolarHBondContact O-N 3.17Å; V432-I435 PolarHBondContact O-N 3.19Å; V432-Q436 HydrophobicContact CG1-CG 4.43Å; V432-Q436 WeakPolarHBondContact O-CB 3.23Å; V432-Q436 WeakPolarHBondContact O-CG 3.33Å; V432-Q436 PolarHBondContact O-N 3.22Å; V432-A565 HydrophobicContact CB-CB 4.03Å; V432-A565 HydrophobicContact CG1-CB 3.26Å; V432-A565 HydrophobicContact CG2-CB 3.63Å
433	L	42.7	Very low	40.1	Very low	51 Å²	51	80 Å²	80	27%	0.267	41%	0.41	S	S	.	.	H	α-helix	trans	-63.1	-40.8	177.6	-84.1	160.5	0	0	0	112.2	A429 I430 I435 Q436 L437	A429-L433 PolarHBondContact O-N 3.06Å; A429-L433 VanDerWaalsContact O-N 3.11Å; I430-L433 PolarHBondContact O-N 3.48Å; L433-I435 VanDerWaalsContact C-N 3.25Å; L433-I435 PolarHBondContact O-N 2.95Å; L433-Q436 PolarHBondContact O-N 2.95Å; L433-L437 WeakPolarHBondContact O-CG 3.43Å; L433-L437 PolarHBondContact O-N 3.26Å
434	L	43.9	Very low	39.8	Very low	105 Å²	105	79.4 Å²	79.4	55%	0.55	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-26.8	177.3	-78.6	165.7	0	0	0	113.6	I430 G431 V432	I430-L434 HydrophobicContact CG2-CD1 3.93Å; I430-L434 WeakPolarHBondContact O-CG 3.44Å; I430-L434 PolarHBondContact O-N 3.21Å; G431-L434 PolarHBondContact O-N 3.31Å; V432-L434 PolarHBondContact O-N 3.17Å
435	I	39.2	Very low	39.5	Very low	22 Å²	22	79.8 Å²	79.8	11%	0.113	42%	0.424	C	S	.	.	H	α-helix	trans	-95.2	-27.9	176.8	-47.6	159.7	0	0	0	111.6	G431 V432 L433 L437 R438 P439 S568	G431-I435 VanDerWaalsContact O-CG1 3.29Å; G431-I435 WeakPolarHBondContact O-CG1 3.35Å; G431-I435 PolarHBondContact O-N 3.33Å; G431-I435 VanDerWaalsContact O-N 3.08Å; V432-I435 PolarHBondContact O-N 3.19Å; L433-I435 VanDerWaalsContact C-N 3.25Å; L433-I435 PolarHBondContact O-N 2.95Å; I435-L437 PolarHBondContact O-N 2.73Å; I435-R438 HydrophobicContact CG2-CB 4.34Å; I435-R438 WeakPolarHBondContact O-CB 3.37Å; I435-R438 PolarHBondContact O-N 3.41Å; I435-P439 WeakPolarHBondContact O-CD 3.34Å; I435-S568 WeakPolarHBondContact CG2-OG 3.42Å
436	Q	40.2	Very low	38.9	Very low	48 Å²	48	82.5 Å²	82.5	22%	0.224	43%	0.427	C	S	.	.	H	α-helix	trans	-58.3	-30	168.7	-80.1	173.5	-13.4	0	0	112.8	V432 L433 R438 P439 P561 V564	V432-Q436 HydrophobicContact CG1-CG 4.43Å; V432-Q436 WeakPolarHBondContact O-CB 3.23Å; V432-Q436 WeakPolarHBondContact O-CG 3.33Å; V432-Q436 PolarHBondContact O-N 3.22Å; L433-Q436 PolarHBondContact O-N 2.95Å; Q436-R438 VanDerWaalsContact C-N 3.28Å; Q436-R438 PolarHBondContact O-N 3.5Å; Q436-P439 WeakPolarHBondContact O-CD 3.39Å; Q436-P561 PolarHBondContact NE2-O 3.43Å; Q436-V564 HydrophobicContact CG-CG1 4.1Å
437	L	36.7	Very low	38.5	Very low	73 Å²	73	82.6 Å²	82.6	38%	0.382	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.1	173.9	-68.8	167.3	0	0	0	113.8	L433 I435	L433-L437 WeakPolarHBondContact O-CG 3.43Å; L433-L437 PolarHBondContact O-N 3.26Å; I435-L437 PolarHBondContact O-N 2.73Å
438	R	38.4	Very low	38.1	Very low	161 Å²	161	80 Å²	80	61%	0.608	43%	0.425	S	S	*	.	S	Bend	trans	-73.7	-37.9	-171.5	-164.7	-176.9	-67.2	164.9	-3	114.8	I435 Q436	I435-R438 HydrophobicContact CG2-CB 4.34Å; I435-R438 WeakPolarHBondContact O-CB 3.37Å; I435-R438 PolarHBondContact O-N 3.41Å; Q436-R438 VanDerWaalsContact C-N 3.28Å; Q436-R438 PolarHBondContact O-N 3.5Å
439	P	38.7	Very low	37.9	Very low	78 Å²	78	78.1 Å²	78.1	51%	0.506	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.3	179.5	-14.7	31.7	0	0	0	114.6	I435 Q436 M441	I435-P439 WeakPolarHBondContact O-CD 3.34Å; Q436-P439 WeakPolarHBondContact O-CD 3.39Å; P439-M441 PolarHBondContact O-N 2.97Å
440	L	32.7	Very low	37.7	Very low	64 Å²	64	84.1 Å²	84.1	34%	0.335	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-3.1	-174.6	-67.4	172.3	0	0	0	113.9	V442 F452	L440-V442 PolarHBondContact O-N 3.34Å; L440-F452 HydrophobicContact CD1-CD2 4.33Å
441	M	33.5	Very low	37.4	Very low	148 Å²	148	87.7 Å²	87.7	73%	0.729	45%	0.445	S	S	*	.	S	Bend	trans	-73.5	15.6	-174.8	-61.2	-173.7	66.4	0	0	115.3	P439	P439-M441 PolarHBondContact O-N 2.97Å
442	V	32.2	Very low	37.7	Very low	66 Å²	66	91.1 Å²	91.1	40%	0.4	45%	0.454	S	S	.	.	S	Bend	trans	-136.5	131.1	-177.1	-173.4	0	0	0	0	110.1	L440 E635	L440-V442 PolarHBondContact O-N 3.34Å; V442-E635 VanDerWaalsContact CG1-OE2 3.29Å; V442-E635 WeakPolarHBondContact CG1-OE2 3.32Å
443	S	33.2	Very low	37.9	Very low	104 Å²	104	91.1 Å²	91.1	73%	0.727	46%	0.456	S	S	*	.	S	Bend	trans	66.7	102	-177.8	70.7	0	0	0	0	117.5
444	N	32.5	Very low	38.1	Very low	124 Å²	124	89.6 Å²	89.6	66%	0.663	45%	0.449	S	S	*	.			trans	61.4	71.1	172.1	-157.5	-4.2	0	0	0	118	Y446	N444-Y446 PolarHBondContact O-N 2.8Å
445	P	37.2	Very low	38.4	Very low	61 Å²	61	88 Å²	88	40%	0.396	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	22.8	-165.8	37.7	-39.9	0	0	0	116.2	D449	P445-D449 WeakPolarHBondContact CA-OD2 3.47Å; P445-D449 WeakPolarHBondContact CB-OD2 3.21Å; P445-D449 WeakPolarHBondContact O-CB 3.44Å
446	Y	34.9	Very low	38.9	Very low	133 Å²	133	89 Å²	89	52%	0.522	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-49.2	-172.5	-68.3	-69	0	0	0	115	N444 Y450 P487	N444-Y446 PolarHBondContact O-N 2.8Å; Y446-Y450 WeakPolarHBondContact O-CB 3.25Å; Y446-Y450 PolarHBondContact O-N 2.84Å; Y446-P487 VanDerWaalsContact OH-CB 3.28Å; Y446-P487 WeakPolarHBondContact OH-CB 3.21Å; Y446-P487 WeakPolarHBondContact OH-CG 3.45Å
447	V	35.3	Very low	39.4	Very low	116 Å²	116	89.4 Å²	89.4	70%	0.703	45%	0.445	S	S	*	.	H	α-helix	trans	-81	-42.6	-173.8	-176.8	0	0	0	0	111.6	Y451	V447-Y451 WeakPolarHBondContact O-CB 3.2Å; V447-Y451 PolarHBondContact O-N 3.4Å
448	Q	35.3	Very low	40.1	Very low	123 Å²	123	93.7 Å²	93.7	58%	0.575	46%	0.456	S	S	*	.	H	α-helix	trans	-75.6	-45.5	-178.1	-62	-164.3	19.7	0	0	111.9	Y450 Y451 F452	Q448-Y450 PolarHBondContact O-N 2.85Å; Q448-Y451 WeakPolarHBondContact O-CB 3.38Å; Q448-Y451 PolarHBondContact O-N 3.44Å; Q448-Y451 VanDerWaalsContact O-N 3.11Å; Q448-F452 HydrophobicContact CB-CD2 4.29Å; Q448-F452 HydrophobicContact CB-CE2 4.16Å; Q448-F452 WeakPolarHBondContact O-CD2 3.2Å; Q448-F452 PolarHBondContact O-N 3.42Å
449	D	37.2	Very low	40.7	Very low	39 Å²	39	94.2 Å²	94.2	21%	0.209	46%	0.458	C	S	.	.	H	α-helix	trans	-65.3	-38.9	-179.4	-67.2	-24.2	0	0	0	112.1	P445 Y451 F452 A453	P445-D449 WeakPolarHBondContact CA-OD2 3.47Å; P445-D449 WeakPolarHBondContact CB-OD2 3.21Å; P445-D449 WeakPolarHBondContact O-CB 3.44Å; D449-Y451 VanDerWaalsContact C-N 3.34Å; D449-Y451 PolarHBondContact O-N 2.79Å; D449-F452 PolarHBondContact O-N 3.15Å; D449-A453 WeakPolarHBondContact O-CB 3.49Å; D449-A453 PolarHBondContact O-N 2.99Å
450	Y	37.9	Very low	41.2	Very low	158 Å²	158	92.3 Å²	92.3	62%	0.62	44%	0.443	S	S	*	.	H	α-helix	trans	-64.3	-38.1	172.2	-171	-89.3	0	0	0	112.1	Y446 Q448 S454	Y446-Y450 WeakPolarHBondContact O-CB 3.25Å; Y446-Y450 PolarHBondContact O-N 2.84Å; Q448-Y450 PolarHBondContact O-N 2.85Å; Y450-S454 WeakPolarHBondContact O-CB 3.45Å; Y450-S454 PolarHBondContact O-N 2.88Å; Y450-S454 PolarHBondContact O-OG 3.04Å
451	Y	42.9	Very low	42.2	Very low	134 Å²	134	92.4 Å²	92.4	53%	0.525	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-49.5	174.2	-175.6	-90.8	0	0	0	111.6	V447 Q448 D449 S454 Q455	V447-Y451 WeakPolarHBondContact O-CB 3.2Å; V447-Y451 PolarHBondContact O-N 3.4Å; Q448-Y451 WeakPolarHBondContact O-CB 3.38Å; Q448-Y451 PolarHBondContact O-N 3.44Å; Q448-Y451 VanDerWaalsContact O-N 3.11Å; D449-Y451 VanDerWaalsContact C-N 3.34Å; D449-Y451 PolarHBondContact O-N 2.79Å; Y451-S454 PolarHBondContact O-N 3.47Å; Y451-S454 PolarHBondContact O-OG 3.26Å; Y451-Q455 HydrophobicContact CD1-CG 4.13Å; Y451-Q455 HydrophobicContact CE1-CG 3.78Å; Y451-Q455 HydrophobicContact CE2-CG 4.47Å; Y451-Q455 WeakPolarHBondContact O-CB 3.43Å; Y451-Q455 WeakPolarHBondContact O-CG 3.37Å; Y451-Q455 PolarHBondContact O-N 3.11Å; Y451-Q455 PolarHBondContact OH-NE2 3.29Å
452	F	46.3	Very low	43.5	Very low	93 Å²	93	87.4 Å²	87.4	41%	0.408	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-42.6	-179.6	-70.9	-59.5	0	0	0	112.8	L440 Q448 D449 Q455 W456	L440-F452 HydrophobicContact CD1-CD2 4.33Å; Q448-F452 HydrophobicContact CB-CD2 4.29Å; Q448-F452 HydrophobicContact CB-CE2 4.16Å; Q448-F452 WeakPolarHBondContact O-CD2 3.2Å; Q448-F452 PolarHBondContact O-N 3.42Å; D449-F452 PolarHBondContact O-N 3.15Å; F452-Q455 PolarHBondContact O-N 3.14Å; F452-W456 WeakPolarHBondContact O-CB 3.19Å; F452-W456 PolarHBondContact O-N 3.45Å
453	A	46.1	Very low	44.5	Very low	13 Å²	13	88.2 Å²	88.2	11%	0.107	43%	0.427	C	S	.	.	H	α-helix	trans	-62.2	-44.9	174.9	0	0	0	0	0	111.4	D449 Q455 W456 L457 L484	D449-A453 WeakPolarHBondContact O-CB 3.49Å; D449-A453 PolarHBondContact O-N 2.99Å; A453-Q455 PolarHBondContact O-N 3Å; A453-W456 WeakPolarHBondContact O-CB 3.37Å; A453-W456 PolarHBondContact O-N 2.77Å; A453-L457 WeakPolarHBondContact O-CB 3.42Å; A453-L457 PolarHBondContact O-N 3.31Å; A453-L484 HydrophobicContact CB-CD2 4.17Å
454	S	45.4	Very low	45.4	Very low	19 Å²	19	85 Å²	85	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-68.8	-32.7	177.7	71.4	0	0	0	0	112.8	Y450 Y451 R458	Y450-S454 WeakPolarHBondContact O-CB 3.45Å; Y450-S454 PolarHBondContact O-N 2.88Å; Y450-S454 PolarHBondContact O-OG 3.04Å; Y451-S454 PolarHBondContact O-N 3.47Å; Y451-S454 PolarHBondContact O-OG 3.26Å; S454-R458 WeakPolarHBondContact O-CB 3.34Å; S454-R458 WeakPolarHBondContact O-CG 3.45Å; S454-R458 PolarHBondContact O-N 3.12Å
455	Q	50.9	Low	46.8	Very low	71 Å²	71	81.7 Å²	81.7	33%	0.332	39%	0.391	S	S	.	.	H	α-helix	trans	-70	-35.3	171.2	-72	-76.6	33.6	0	0	112.5	Y451 F452 A453 R459	Y451-Q455 HydrophobicContact CD1-CG 4.13Å; Y451-Q455 HydrophobicContact CE1-CG 3.78Å; Y451-Q455 HydrophobicContact CE2-CG 4.47Å; Y451-Q455 WeakPolarHBondContact O-CB 3.43Å; Y451-Q455 WeakPolarHBondContact O-CG 3.37Å; Y451-Q455 PolarHBondContact O-N 3.11Å; Y451-Q455 PolarHBondContact OH-NE2 3.29Å; F452-Q455 PolarHBondContact O-N 3.14Å; A453-Q455 PolarHBondContact O-N 3Å; Q455-R459 WeakPolarHBondContact O-CB 3.3Å; Q455-R459 WeakPolarHBondContact O-CG 3.14Å; Q455-R459 PolarHBondContact O-N 2.95Å
456	W	49.4	Very low	48	Very low	43 Å²	43	84.9 Å²	84.9	16%	0.163	40%	0.398	C	S	.	.	H	α-helix	trans	-65.1	-47.9	172.6	-175.8	98.7	0	0	0	111.1	F452 A453 R458 R459 M460 A480 V482	F452-W456 WeakPolarHBondContact O-CB 3.19Å; F452-W456 PolarHBondContact O-N 3.45Å; A453-W456 WeakPolarHBondContact O-CB 3.37Å; A453-W456 PolarHBondContact O-N 2.77Å; W456-R458 PolarHBondContact O-N 3.43Å; W456-R459 CarbonylContact O-C 3.57Å; W456-R459 PolarHBondContact O-N 3.32Å; W456-R459 VanDerWaalsContact O-N 3.11Å; W456-M460 HydrophobicContact CD2-CG 3.77Å; W456-M460 HydrophobicContact CE3-CB 4.41Å; W456-M460 HydrophobicContact CE3-CG 3.84Å; W456-M460 HydrophobicContact CH2-CE 3.96Å; W456-M460 HydrophobicContact CH2-CG 3.83Å; W456-M460 HydrophobicContact CZ2-CE 3.66Å; W456-M460 HydrophobicContact CZ2-CG 3.74Å; W456-M460 HydrophobicContact CZ2-SD 4.34Å; W456-M460 HydrophobicContact CZ3-CB 4.34Å; W456-M460 HydrophobicContact CZ3-CG 3.86Å; W456-M460 PolarHBondContact O-N 3.45Å; W456-A480 HydrophobicContact CH2-CB 3.91Å; W456-A480 HydrophobicContact CZ3-CB 3.73Å; W456-V482 HydrophobicContact CD2-CG2 4.45Å; W456-V482 HydrophobicContact CE3-CG2 3.5Å; W456-V482 VanDerWaalsContact CE3-CG2 3.5Å; W456-V482 HydrophobicContact CH2-CG2 4.06Å; W456-V482 HydrophobicContact CZ3-CG2 3.28Å
457	L	51.6	Low	49.1	Very low	56 Å²	56	81.5 Å²	81.5	29%	0.293	39%	0.387	S	S	.	.	H	α-helix	trans	-56.1	-48.3	173.6	-93.7	147.9	0	0	0	111.6	A453 R459 M460 N461 A480 V482	A453-L457 WeakPolarHBondContact O-CB 3.42Å; A453-L457 PolarHBondContact O-N 3.31Å; L457-R459 VanDerWaalsContact C-N 3.33Å; L457-R459 PolarHBondContact O-N 3.19Å; L457-M460 PolarHBondContact O-N 2.94Å; L457-N461 VanDerWaalsContact O-CB 3.31Å; L457-N461 WeakPolarHBondContact O-CB 3.41Å; L457-N461 VanDerWaalsContact O-CG 3.23Å; L457-N461 PolarHBondContact O-N 2.93Å; L457-N461 PolarHBondContact O-ND2 3.31Å; L457-A480 WeakPolarHBondContact CD2-O 3.48Å; L457-V482 HydrophobicContact CD1-CG2 4.46Å; L457-V482 HydrophobicContact CG-CG2 4.45Å
458	R	51.8	Low	50.3	Low	164 Å²	164	79.1 Å²	79.1	62%	0.619	37%	0.369	S	S	*	.	H	α-helix	trans	-57.9	-42.9	174.2	-72.4	169.6	-147.8	-117.1	7.2	111.8	S454 W456 A462	S454-R458 WeakPolarHBondContact O-CB 3.34Å; S454-R458 WeakPolarHBondContact O-CG 3.45Å; S454-R458 PolarHBondContact O-N 3.12Å; W456-R458 PolarHBondContact O-N 3.43Å; R458-A462 WeakPolarHBondContact O-CB 3.32Å; R458-A462 PolarHBondContact O-N 3.44Å
459	R	49.7	Very low	51.7	Low	171 Å²	171	77.5 Å²	77.5	65%	0.645	37%	0.372	S	S	*	.	H	α-helix	trans	-67	-46.9	176.9	-83	-179.3	169.7	168.4	-1.9	112.6	Q455 W456 L457 A462 I463	Q455-R459 WeakPolarHBondContact O-CB 3.3Å; Q455-R459 WeakPolarHBondContact O-CG 3.14Å; Q455-R459 PolarHBondContact O-N 2.95Å; W456-R459 CarbonylContact O-C 3.57Å; W456-R459 PolarHBondContact O-N 3.32Å; W456-R459 VanDerWaalsContact O-N 3.11Å; L457-R459 VanDerWaalsContact C-N 3.33Å; L457-R459 PolarHBondContact O-N 3.19Å; R459-A462 CarbonylContact O-C 3.37Å; R459-A462 PolarHBondContact O-N 3.06Å; R459-I463 WeakPolarHBondContact O-CB 3.27Å; R459-I463 VanDerWaalsContact O-CG1 3.26Å; R459-I463 WeakPolarHBondContact O-CG1 3.21Å; R459-I463 PolarHBondContact O-N 3.43Å
460	M	48.5	Very low	52.8	Low	39 Å²	39	82.7 Å²	82.7	19%	0.192	39%	0.392	C	S	.	.	H	α-helix	trans	-64.8	-43.3	179.9	-72.7	-62.4	-104.4	0	0	111.5	I430 W456 L457 A462 I463 Q464 A480	I430-M460 HydrophobicContact CD1-CE 4.05Å; I430-M460 HydrophobicContact CG1-CE 4.26Å; W456-M460 HydrophobicContact CD2-CG 3.77Å; W456-M460 HydrophobicContact CE3-CB 4.41Å; W456-M460 HydrophobicContact CE3-CG 3.84Å; W456-M460 HydrophobicContact CH2-CE 3.96Å; W456-M460 HydrophobicContact CH2-CG 3.83Å; W456-M460 HydrophobicContact CZ2-CE 3.66Å; W456-M460 HydrophobicContact CZ2-CG 3.74Å; W456-M460 HydrophobicContact CZ2-SD 4.34Å; W456-M460 HydrophobicContact CZ3-CB 4.34Å; W456-M460 HydrophobicContact CZ3-CG 3.86Å; W456-M460 PolarHBondContact O-N 3.45Å; L457-M460 PolarHBondContact O-N 2.94Å; M460-A462 VanDerWaalsContact C-N 3.33Å; M460-A462 PolarHBondContact O-N 3.27Å; M460-I463 PolarHBondContact O-N 3.19Å; M460-I463 VanDerWaalsContact O-N 3.15Å; M460-I463 HydrophobicContact SD-CD1 4.47Å; M460-Q464 PolarHBondContact O-N 3.36Å; M460-A480 HydrophobicContact CB-CB 3.93Å; M460-A480 HydrophobicContact CG-CB 4.45Å
461	N	53.9	Low	53.5	Low	65 Å²	65	83.8 Å²	83.8	35%	0.348	40%	0.403	S	S	.	.	H	α-helix	trans	-65.3	-36.8	174.7	-66.6	-10.7	0	0	0	111.4	L457 A465	L457-N461 VanDerWaalsContact O-CB 3.31Å; L457-N461 WeakPolarHBondContact O-CB 3.41Å; L457-N461 VanDerWaalsContact O-CG 3.23Å; L457-N461 PolarHBondContact O-N 2.93Å; L457-N461 PolarHBondContact O-ND2 3.31Å; N461-A465 VanDerWaalsContact O-CB 3.23Å; N461-A465 WeakPolarHBondContact O-CB 3.23Å; N461-A465 PolarHBondContact O-N 2.94Å
462	A	61.3	Low	54	Low	44 Å²	44	85.3 Å²	85.3	36%	0.364	41%	0.412	S	S	.	.	H	α-helix	trans	-69.6	-28.2	172.9	0	0	0	0	0	113.6	R458 R459 M460 K466	R458-A462 WeakPolarHBondContact O-CB 3.32Å; R458-A462 PolarHBondContact O-N 3.44Å; R459-A462 CarbonylContact O-C 3.37Å; R459-A462 PolarHBondContact O-N 3.06Å; M460-A462 VanDerWaalsContact C-N 3.33Å; M460-A462 PolarHBondContact O-N 3.27Å; A462-K466 WeakPolarHBondContact O-CB 3.46Å; A462-K466 WeakPolarHBondContact O-CD 3.45Å; A462-K466 VanDerWaalsContact O-CG 3.22Å; A462-K466 WeakPolarHBondContact O-CG 3.5Å; A462-K466 PolarHBondContact O-N 3.34Å
463	I	54.1	Low	53.9	Low	83 Å²	83	84.9 Å²	84.9	43%	0.426	41%	0.412	S	S	.	.	H	α-helix	trans	-75.1	-48.3	173.4	-71.2	163.2	0	0	0	110	R459 M460 A465 K466 H467	R459-I463 WeakPolarHBondContact O-CB 3.27Å; R459-I463 VanDerWaalsContact O-CG1 3.26Å; R459-I463 WeakPolarHBondContact O-CG1 3.21Å; R459-I463 PolarHBondContact O-N 3.43Å; M460-I463 PolarHBondContact O-N 3.19Å; M460-I463 VanDerWaalsContact O-N 3.15Å; M460-I463 HydrophobicContact SD-CD1 4.47Å; I463-A465 VanDerWaalsContact C-N 3.34Å; I463-A465 PolarHBondContact O-N 3.42Å; I463-K466 CarbonylContact O-C 3.58Å; I463-K466 WeakPolarHBondContact O-CA 3.35Å; I463-K466 WeakPolarHBondContact O-CB 3.49Å; I463-K466 PolarHBondContact O-N 3.07Å; I463-H467 PolarHBondContact O-CD2 3.32Å; I463-H467 PolarHBondContact O-N 2.65Å
464	Q	51.3	Low	53.9	Low	36 Å²	36	90.4 Å²	90.4	17%	0.168	44%	0.44	C	S	.	.	H	α-helix	trans	-54.5	-49.3	171.9	-76.6	-175.4	-28.3	0	0	110.7	M460 K466 H467 I468 S478	M460-Q464 PolarHBondContact O-N 3.36Å; Q464-K466 VanDerWaalsContact C-N 3.31Å; Q464-K466 PolarHBondContact O-N 3.21Å; Q464-H467 PolarHBondContact O-N 2.72Å; Q464-I468 WeakPolarHBondContact O-CB 3.2Å; Q464-I468 VanDerWaalsContact O-CG1 3.29Å; Q464-I468 WeakPolarHBondContact O-CG1 3.21Å; Q464-I468 PolarHBondContact O-N 2.97Å; Q464-S478 PolarHBondContact NE2-O 3Å
465	A	60.9	Low	54.1	Low	55 Å²	55	95.3 Å²	95.3	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-58.2	-39.8	175	0	0	0	0	0	112.7	N461 I463 H467 S469	N461-A465 VanDerWaalsContact O-CB 3.23Å; N461-A465 WeakPolarHBondContact O-CB 3.23Å; N461-A465 PolarHBondContact O-N 2.94Å; I463-A465 VanDerWaalsContact C-N 3.34Å; I463-A465 PolarHBondContact O-N 3.42Å; A465-H467 VanDerWaalsContact C-N 3.33Å; A465-H467 PolarHBondContact O-N 2.98Å; A465-S469 VanDerWaalsContact O-CB 3.28Å; A465-S469 WeakPolarHBondContact O-CB 3.44Å; A465-S469 PolarHBondContact O-N 3.16Å; A465-S469 PolarHBondContact O-OG 3.19Å
466	K	63.6	Low	53.8	Low	128 Å²	128	97.9 Å²	97.9	56%	0.557	49%	0.49	S	S	*	.	H	α-helix	trans	-70.1	-21.9	173.7	-80.7	171.7	-179.7	173.8	0	114.2	A462 I463 Q464 S469 K470	A462-K466 WeakPolarHBondContact O-CB 3.46Å; A462-K466 WeakPolarHBondContact O-CD 3.45Å; A462-K466 VanDerWaalsContact O-CG 3.22Å; A462-K466 WeakPolarHBondContact O-CG 3.5Å; A462-K466 PolarHBondContact O-N 3.34Å; I463-K466 CarbonylContact O-C 3.58Å; I463-K466 WeakPolarHBondContact O-CA 3.35Å; I463-K466 WeakPolarHBondContact O-CB 3.49Å; I463-K466 PolarHBondContact O-N 3.07Å; Q464-K466 VanDerWaalsContact C-N 3.31Å; Q464-K466 PolarHBondContact O-N 3.21Å; K466-S469 WeakPolarHBondContact CA-OG 3.42Å; K466-K470 WeakPolarHBondContact O-CB 3.3Å; K466-K470 VanDerWaalsContact O-CD 3.31Å; K466-K470 WeakPolarHBondContact O-CD 3.3Å; K466-K470 WeakPolarHBondContact O-CG 3.24Å
467	H	57.5	Low	53.3	Low	62 Å²	62	98.4 Å²	98.4	29%	0.287	50%	0.498	S	S	.	.	H	α-helix	trans	-89.6	-38.1	177.1	-79.7	-130	0	0	0	111.4	I463 Q464 A465 K470 H471 K472 M473	I463-H467 PolarHBondContact O-CD2 3.32Å; I463-H467 PolarHBondContact O-N 2.65Å; Q464-H467 PolarHBondContact O-N 2.72Å; A465-H467 VanDerWaalsContact C-N 3.33Å; A465-H467 PolarHBondContact O-N 2.98Å; H467-K470 CarbonylContact O-C 3.54Å; H467-K470 PolarHBondContact O-N 3Å; H467-H471 PolarHBondContact O-N 2.9Å; H467-K472 PolarHBondContact O-N 3.49Å; H467-M473 HydrophobicContact CB-CB 4.31Å; H467-M473 HydrophobicContact CB-SD 4.22Å
468	I	61.6	Low	52.9	Low	65 Å²	65	99.6 Å²	99.6	33%	0.333	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-51.5	170.5	-66.6	163.7	0	0	0	109.9	Q464 K470 H471 M473 T475	Q464-I468 WeakPolarHBondContact O-CB 3.2Å; Q464-I468 VanDerWaalsContact O-CG1 3.29Å; Q464-I468 WeakPolarHBondContact O-CG1 3.21Å; Q464-I468 PolarHBondContact O-N 2.97Å; I468-K470 PolarHBondContact O-N 2.8Å; I468-K470 VanDerWaalsContact O-N 3.11Å; I468-H471 PolarHBondContact O-N 3.08Å; I468-M473 HydrophobicContact CG1-CB 4.39Å; I468-T475 HydrophobicContact CG2-CG2 4.17Å
469	S	64.6	Low	52.3	Low	89 Å²	89	95.6 Å²	95.6	62%	0.622	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-6.9	176.6	58.2	0	0	0	0	115.1	A465 K466	A465-S469 VanDerWaalsContact O-CB 3.28Å; A465-S469 WeakPolarHBondContact O-CB 3.44Å; A465-S469 PolarHBondContact O-N 3.16Å; A465-S469 PolarHBondContact O-OG 3.19Å; K466-S469 WeakPolarHBondContact CA-OG 3.42Å
470	K	58.7	Low	51.9	Low	148 Å²	148	88.4 Å²	88.4	64%	0.643	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	13.5	170.1	-71.9	179.7	-177.2	-179.7	0	113	K466 H467 I468 K472	K466-K470 WeakPolarHBondContact O-CB 3.3Å; K466-K470 VanDerWaalsContact O-CD 3.31Å; K466-K470 WeakPolarHBondContact O-CD 3.3Å; K466-K470 WeakPolarHBondContact O-CG 3.24Å; H467-K470 CarbonylContact O-C 3.54Å; H467-K470 PolarHBondContact O-N 3Å; I468-K470 PolarHBondContact O-N 2.8Å; I468-K470 VanDerWaalsContact O-N 3.11Å; K470-K472 PolarHBondContact O-N 3.13Å; K470-K472 VanDerWaalsContact O-N 3.11Å
471	H	53.1	Low	51.3	Low	182 Å²	182	93.1 Å²	93.1	84%	0.843	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	29.8	-177.4	-65.7	-77	0	0	0	114.5	H467 I468	H467-H471 PolarHBondContact O-N 2.9Å; I468-H471 PolarHBondContact O-N 3.08Å
472	K	53.6	Low	50.4	Low	166 Å²	166	92.6 Å²	92.6	72%	0.722	51%	0.507	S	S	*	.			trans	-102.5	1.2	179.8	-82.2	-163.3	171.1	-167	0	114.5	H467 K470	H467-K472 PolarHBondContact O-N 3.49Å; K470-K472 PolarHBondContact O-N 3.13Å; K470-K472 VanDerWaalsContact O-N 3.11Å
473	M	44.4	Very low	49.3	Very low	83 Å²	83	96 Å²	96	41%	0.409	53%	0.526	S	S	.	.	S	Bend	trans	-145.3	142.7	175	-104.4	177.5	159.6	0	0	110.4	H467 I468 T477	H467-M473 HydrophobicContact CB-CB 4.31Å; H467-M473 HydrophobicContact CB-SD 4.22Å; I468-M473 HydrophobicContact CG1-CB 4.39Å; M473-T477 HydrophobicContact CE-CG2 4.13Å
474	N	45.6	Very low	48.3	Very low	129 Å²	129	96.6 Å²	96.6	69%	0.69	53%	0.529	S	S	*	.			trans	-72.3	144.8	171.2	-71.5	-4.3	0	0	0	110.2	T476 T477	N474-T476 PolarHBondContact O-N 3.4Å; N474-T477 PolarHBondContact O-N 2.76Å; N474-T477 PolarHBondContact O-OG1 3.06Å
475	T	48.9	Very low	47.7	Very low	122 Å²	122	99.7 Å²	99.7	75%	0.748	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-4.9	-178.7	45.9	0	0	0	0	114.5	I468 T477	I468-T475 HydrophobicContact CG2-CG2 4.17Å; T475-T477 VanDerWaalsContact C-N 3.28Å; T475-T477 PolarHBondContact O-N 3.1Å
476	T	44.9	Very low	46.4	Very low	125 Å²	125	102.8 Å²	102.8	77%	0.767	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	8.9	176.3	57.1	0	0	0	0	113.6	N474	N474-T476 PolarHBondContact O-N 3.4Å
477	T	40.2	Very low	45	Very low	55 Å²	55	100.1 Å²	100.1	34%	0.337	56%	0.556	S	S	.	*			trans	-84	115.6	179.5	-47.2	0	0	0	0	109.5	M473 N474 T475	M473-T477 HydrophobicContact CE-CG2 4.13Å; N474-T477 PolarHBondContact O-N 2.76Å; N474-T477 PolarHBondContact O-OG1 3.06Å; T475-T477 VanDerWaalsContact C-N 3.28Å; T475-T477 PolarHBondContact O-N 3.1Å
478	S	41.9	Very low	44.1	Very low	81 Å²	81	100.9 Å²	100.9	57%	0.566	56%	0.561	S	S	*	*			trans	-58.2	146.8	178.2	-163.6	0	0	0	0	112	Q464	Q464-S478 PolarHBondContact NE2-O 3Å
479	P	40.7	Very low	42.9	Very low	80 Å²	80	101 Å²	101	52%	0.519	57%	0.566	S	S	.	*			trans	-56.6	152.8	169.5	24.5	-35.5	0	0	0	111.9	I481	P479-I481 PolarHBondContact O-N 3.19Å; P479-I481 VanDerWaalsContact O-N 3.09Å
480	A	39.6	Very low	41.7	Very low	20 Å²	20	103.6 Å²	103.6	17%	0.165	57%	0.572	C	S	.	*			trans	-74.5	101.4	-177	0	0	0	0	0	111.4	W456 L457 M460	W456-A480 HydrophobicContact CH2-CB 3.91Å; W456-A480 HydrophobicContact CZ3-CB 3.73Å; L457-A480 WeakPolarHBondContact CD2-O 3.48Å; M460-A480 HydrophobicContact CB-CB 3.93Å; M460-A480 HydrophobicContact CG-CB 4.45Å
481	I	36.2	Very low	41	Very low	138 Å²	138	103 Å²	103	71%	0.708	57%	0.572	S	S	*	*			trans	-78.5	134.3	177.1	-57.8	173.2	0	0	0	110	P479	P479-I481 PolarHBondContact O-N 3.19Å; P479-I481 VanDerWaalsContact O-N 3.09Å
482	V	35.1	Very low	40.6	Very low	54 Å²	54	96 Å²	96	33%	0.327	54%	0.544	S	S	.	.			trans	-114.4	111.8	168.8	-177.9	0	0	0	0	108.3	W456 L457 L484	W456-V482 HydrophobicContact CD2-CG2 4.45Å; W456-V482 HydrophobicContact CE3-CG2 3.5Å; W456-V482 VanDerWaalsContact CE3-CG2 3.5Å; W456-V482 HydrophobicContact CH2-CG2 4.06Å; W456-V482 HydrophobicContact CZ3-CG2 3.28Å; L457-V482 HydrophobicContact CD1-CG2 4.46Å; L457-V482 HydrophobicContact CG-CG2 4.45Å; V482-L484 PolarHBondContact O-N 2.89Å
483	P	38.1	Very low	40.1	Very low	115 Å²	115	91.5 Å²	91.5	75%	0.747	53%	0.527	S	S	*	.			trans	-72.1	110.5	168.5	29.1	-31.3	0	0	0	108.9
484	L	34.5	Very low	40.3	Very low	95 Å²	95	91 Å²	91	50%	0.497	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-77.2	131.3	169.1	-70.9	168.5	0	0	0	108.8	A453 V482 I486	A453-L484 HydrophobicContact CB-CD2 4.17Å; V482-L484 PolarHBondContact O-N 2.89Å; L484-I486 PolarHBondContact O-N 3.41Å
485	P	37.8	Very low	40.4	Very low	102 Å²	102	88.8 Å²	88.8	66%	0.662	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-67.3	123.9	174.4	27.8	-32.6	0	0	0	109.7
486	I	32.9	Very low	40.4	Very low	119 Å²	119	86.4 Å²	86.4	61%	0.61	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-63.5	143.4	172.6	-61.9	172.7	0	0	0	108.5	L484 I488	L484-I486 PolarHBondContact O-N 3.41Å; I486-I488 PolarHBondContact O-N 3.44Å; I486-I488 VanDerWaalsContact O-N 3.16Å
487	P	35	Very low	40.7	Very low	72 Å²	72	87 Å²	87	47%	0.468	51%	0.507	S	S	.	.			trans	-40.9	122.6	169.7	2.8	-19.8	0	0	0	112.2	Y446 P489	Y446-P487 VanDerWaalsContact OH-CB 3.28Å; Y446-P487 WeakPolarHBondContact OH-CB 3.21Å; Y446-P487 WeakPolarHBondContact OH-CG 3.45Å; P487-P489 WeakPolarHBondContact O-CD 3.29Å
488	I	38.4	Very low	41.3	Very low	78 Å²	78	85.2 Å²	85.2	40%	0.4	50%	0.497	S	S	.	.			trans	-68.6	114.7	178.2	-57.5	175.5	0	0	0	107.8	I486 L493 Y500	I486-I488 PolarHBondContact O-N 3.44Å; I486-I488 VanDerWaalsContact O-N 3.16Å; I488-L493 HydrophobicContact CG2-CD1 4.48Å; I488-L493 HydrophobicContact CG2-CD2 4.13Å; I488-L493 HydrophobicContact CG2-CG 3.92Å; I488-Y500 HydrophobicContact CD1-CD1 4.38Å
489	P	37.4	Very low	41.2	Very low	68 Å²	68	85 Å²	85	44%	0.442	50%	0.496	S	S	.	.			trans	-61.8	142.8	173.4	-18.6	32.2	0	0	0	109.5	P487 E491 S492	P487-P489 WeakPolarHBondContact O-CD 3.29Å; P489-E491 WeakPolarHBondContact CB-OE2 3.24Å; P489-E491 PolarHBondContact O-N 3.44Å; P489-E491 VanDerWaalsContact O-N 3.1Å; P489-S492 VanDerWaalsContact O-CB 3.29Å; P489-S492 WeakPolarHBondContact O-CB 3.43Å; P489-S492 PolarHBondContact O-N 2.91Å
490	L	38.3	Very low	41.1	Very low	143 Å²	143	86.2 Å²	86.2	75%	0.749	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-61.4	-28.3	-172.4	-148.9	75.6	0	0	0	112	S492 L493	L490-S492 VanDerWaalsContact C-N 3.28Å; L490-S492 PolarHBondContact O-N 3.26Å; L490-L493 PolarHBondContact O-N 3.31Å
491	E	44.7	Very low	41.1	Very low	135 Å²	135	86.7 Å²	86.7	63%	0.631	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-60.7	-34.6	172.9	-55.2	76.2	-167	0	0	112	P489 L493 S494	P489-E491 WeakPolarHBondContact CB-OE2 3.24Å; P489-E491 PolarHBondContact O-N 3.44Å; P489-E491 VanDerWaalsContact O-N 3.1Å; E491-L493 VanDerWaalsContact C-N 3.27Å; E491-L493 PolarHBondContact O-N 2.81Å; E491-S494 WeakPolarHBondContact O-CB 3.25Å; E491-S494 PolarHBondContact O-N 2.99Å; E491-S494 PolarHBondContact O-OG 2.74Å
492	S	43.4	Very low	41.2	Very low	37 Å²	37	83.3 Å²	83.3	26%	0.259	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-74.1	-16.1	-175.2	-59.2	0	0	0	0	113.9	P489 L490 S498	P489-S492 VanDerWaalsContact O-CB 3.29Å; P489-S492 WeakPolarHBondContact O-CB 3.43Å; P489-S492 PolarHBondContact O-N 2.91Å; L490-S492 VanDerWaalsContact C-N 3.28Å; L490-S492 PolarHBondContact O-N 3.26Å; S492-S498 PolarHBondContact O-OG 3.36Å; S492-S498 VanDerWaalsContact O-OG 3.08Å
493	L	44.5	Very low	41.2	Very low	70 Å²	70	84.6 Å²	84.6	37%	0.366	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-84.8	-17	171.3	-66.2	169.8	0	0	0	112.4	I488 L490 E491 Q501 R652	I488-L493 HydrophobicContact CG2-CD1 4.48Å; I488-L493 HydrophobicContact CG2-CD2 4.13Å; I488-L493 HydrophobicContact CG2-CG 3.92Å; L490-L493 PolarHBondContact O-N 3.31Å; E491-L493 VanDerWaalsContact C-N 3.27Å; E491-L493 PolarHBondContact O-N 2.81Å; L493-Q501 PolarHBondContact O-NE2 3.26Å; L493-R652 PolarHBondContact O-NH1 3.42Å; L493-R652 VanDerWaalsContact O-NH1 3.14Å
494	S	47.5	Very low	41.1	Very low	73 Å²	73	85.5 Å²	85.5	51%	0.51	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-40.4	-178.9	76.9	0	0	0	0	112.4	E491 R652	E491-S494 WeakPolarHBondContact O-CB 3.25Å; E491-S494 PolarHBondContact O-N 2.99Å; E491-S494 PolarHBondContact O-OG 2.74Å; S494-R652 PolarHBondContact O-NH2 2.92Å
495	D	47.5	Very low	41.2	Very low	82 Å²	82	87.5 Å²	87.5	44%	0.439	49%	0.486	S	S	.	.			trans	-72.9	125.7	-177.8	-172.3	-8.5	0	0	0	112.2	N497 Q501	D495-N497 VanDerWaalsContact C-N 3.29Å; D495-N497 PolarHBondContact O-N 3.27Å; D495-N497 PolarHBondContact OD1-N 3.06Å; D495-Q501 VanDerWaalsContact O-CD 3.3Å; D495-Q501 WeakPolarHBondContact O-CG 3.46Å; D495-Q501 PolarHBondContact O-NE2 3.03Å
496	S	50	Low	40.8	Very low	73 Å²	73	88.7 Å²	88.7	51%	0.51	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.1	179.2	48.2	0	0	0	0	114.3
497	N	51.2	Low	40.7	Very low	136 Å²	136	92.2 Å²	92.2	73%	0.727	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	1.2	-178.7	-70.4	-26	0	0	0	113.6	D495	D495-N497 VanDerWaalsContact C-N 3.29Å; D495-N497 PolarHBondContact O-N 3.27Å; D495-N497 PolarHBondContact OD1-N 3.06Å
498	S	51.6	Low	40.2	Very low	18 Å²	18	95 Å²	95	13%	0.126	50%	0.503	C	S	.	.			trans	-62.4	141.7	179.6	79.4	0	0	0	0	111.3	S492 Y500 Q501 V502	S492-S498 PolarHBondContact O-OG 3.36Å; S492-S498 VanDerWaalsContact O-OG 3.08Å; S498-Y500 PolarHBondContact O-N 2.99Å; S498-Y500 VanDerWaalsContact O-N 3.09Å; S498-Q501 PolarHBondContact O-N 3.33Å; S498-Q501 PolarHBondContact OG-N 3.25Å; S498-V502 WeakPolarHBondContact O-CG2 3.13Å; S498-V502 PolarHBondContact O-N 2.71Å
499	S	41	Very low	39.7	Very low	78 Å²	78	97 Å²	97	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-55	-29.8	177.6	50.6	0	0	0	0	112.2	T503	S499-T503 VanDerWaalsContact O-CB 3.32Å; S499-T503 WeakPolarHBondContact O-CB 3.29Å; S499-T503 PolarHBondContact O-N 3.45Å; S499-T503 PolarHBondContact O-OG1 3.27Å
500	Y	39.2	Very low	39.1	Very low	104 Å²	104	99.4 Å²	99.4	41%	0.408	53%	0.527	S	S	.	.	H	α-helix	trans	-68.4	-46.6	172.9	-61.1	-74.2	0	0	0	112.8	I488 S498 V502 T503 L504	I488-Y500 HydrophobicContact CD1-CD1 4.38Å; S498-Y500 PolarHBondContact O-N 2.99Å; S498-Y500 VanDerWaalsContact O-N 3.09Å; Y500-V502 VanDerWaalsContact C-N 3.31Å; Y500-V502 PolarHBondContact O-N 2.79Å; Y500-T503 PolarHBondContact O-N 3.47Å; Y500-L504 WeakPolarHBondContact O-CB 3.41Å; Y500-L504 WeakPolarHBondContact O-CG 3.47Å; Y500-L504 PolarHBondContact O-N 3.09Å
501	Q	38.9	Very low	38.5	Very low	31 Å²	31	97.6 Å²	97.6	15%	0.145	52%	0.524	C	S	.	.	H	α-helix	trans	-62.2	-38.4	172.5	-83.7	-146.7	25.8	0	0	112.2	L493 D495 S498 L504 K505	L493-Q501 PolarHBondContact O-NE2 3.26Å; D495-Q501 VanDerWaalsContact O-CD 3.3Å; D495-Q501 WeakPolarHBondContact O-CG 3.46Å; D495-Q501 PolarHBondContact O-NE2 3.03Å; S498-Q501 PolarHBondContact O-N 3.33Å; S498-Q501 PolarHBondContact OG-N 3.25Å; Q501-L504 PolarHBondContact O-N 3.17Å; Q501-K505 WeakPolarHBondContact O-CB 3.47Å; Q501-K505 WeakPolarHBondContact O-CD 3.47Å; Q501-K505 VanDerWaalsContact O-CG 3.27Å; Q501-K505 WeakPolarHBondContact O-CG 3.28Å; Q501-K505 PolarHBondContact O-N 2.79Å
502	V	38	Very low	37.7	Very low	66 Å²	66	99.7 Å²	99.7	40%	0.4	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-45	175.3	176.9	0	0	0	0	110.6	S498 Y500 L504 K505 H506	S498-V502 WeakPolarHBondContact O-CG2 3.13Å; S498-V502 PolarHBondContact O-N 2.71Å; Y500-V502 VanDerWaalsContact C-N 3.31Å; Y500-V502 PolarHBondContact O-N 2.79Å; V502-L504 PolarHBondContact O-N 2.8Å; V502-K505 PolarHBondContact O-N 2.96Å; V502-H506 WeakPolarHBondContact O-CB 3.29Å; V502-H506 PolarHBondContact O-CD2 2.92Å; V502-H506 VanDerWaalsContact O-CD2 3.29Å; V502-H506 PolarHBondContact O-N 3.21Å
503	T	35.8	Very low	36.9	Very low	81 Å²	81	108.4 Å²	108.4	50%	0.497	56%	0.558	S	S	.	*	H	α-helix	trans	-69.2	-32	179.6	-54.4	0	0	0	0	112.8	S499 Y500 H506	S499-T503 VanDerWaalsContact O-CB 3.32Å; S499-T503 WeakPolarHBondContact O-CB 3.29Å; S499-T503 PolarHBondContact O-N 3.45Å; S499-T503 PolarHBondContact O-OG1 3.27Å; Y500-T503 PolarHBondContact O-N 3.47Å; T503-H506 VanDerWaalsContact O-O 3.1Å
504	L	36.3	Very low	36	Very low	135 Å²	135	109.4 Å²	109.4	71%	0.707	58%	0.576	S	S	*	*	H	α-helix	trans	-72.3	-36.8	172.9	-73.9	166.4	0	0	0	112.5	Y500 Q501 V502	Y500-L504 WeakPolarHBondContact O-CB 3.41Å; Y500-L504 WeakPolarHBondContact O-CG 3.47Å; Y500-L504 PolarHBondContact O-N 3.09Å; Q501-L504 PolarHBondContact O-N 3.17Å; V502-L504 PolarHBondContact O-N 2.8Å
505	K	35.4	Very low	35.1	Very low	137 Å²	137	112.1 Å²	112.1	60%	0.596	59%	0.59	S	S	*	*	H	α-helix	trans	-75.8	-31.3	178.5	-76	165.5	174.2	162	0	113.3	Q501 V502	Q501-K505 WeakPolarHBondContact O-CB 3.47Å; Q501-K505 WeakPolarHBondContact O-CD 3.47Å; Q501-K505 VanDerWaalsContact O-CG 3.27Å; Q501-K505 WeakPolarHBondContact O-CG 3.28Å; Q501-K505 PolarHBondContact O-N 2.79Å; V502-K505 PolarHBondContact O-N 2.96Å
506	H	30.2	Very low	34.1	Very low	127 Å²	127	115.7 Å²	115.7	59%	0.588	61%	0.609	S	S	*	*	S	Bend	trans	-104.8	102.2	178.7	-67.9	-76.3	0	0	0	110.9	V502 T503 L508	V502-H506 WeakPolarHBondContact O-CB 3.29Å; V502-H506 PolarHBondContact O-CD2 2.92Å; V502-H506 VanDerWaalsContact O-CD2 3.29Å; V502-H506 PolarHBondContact O-N 3.21Å; T503-H506 VanDerWaalsContact O-O 3.1Å; H506-L508 PolarHBondContact O-N 3.17Å
507	K	30.3	Very low	33	Very low	192 Å²	192	122.1 Å²	122.1	84%	0.835	62%	0.622	S	S	*	*			trans	-41.9	113.3	166.2	-91.9	-172.9	173.3	-178.5	0	109.2	V509	K507-V509 PolarHBondContact O-N 3.42Å
508	L	25.6	Very low	31.9	Very low	132 Å²	132	123.2 Å²	123.2	69%	0.691	63%	0.628	S	S	*	*			trans	-75.1	78.1	-175.5	-161.8	100.6	0	0	0	110.5	H506 I510	H506-L508 PolarHBondContact O-N 3.17Å; L508-I510 HydrophobicContact CD2-CD1 4.13Å; L508-I510 HydrophobicContact CD2-CG1 4.03Å; L508-I510 PolarHBondContact O-N 3Å; L508-I510 VanDerWaalsContact O-N 3.12Å
509	V	26.1	Very low	30.7	Very low	120 Å²	120	128.5 Å²	128.5	73%	0.727	66%	0.662	S	S	*	*			trans	-67.1	107.8	174.5	178.5	0	0	0	0	108.5	K507 P511	K507-V509 PolarHBondContact O-N 3.42Å; V509-P511 WeakPolarHBondContact O-CD 3.43Å
510	I	26.4	Very low	30.1	Very low	118 Å²	118	127.5 Å²	127.5	61%	0.605	66%	0.664	S	S	*	*			trans	-91.4	103.5	167.7	-58.4	178.9	0	0	0	107.3	L508 F512	L508-I510 HydrophobicContact CD2-CD1 4.13Å; L508-I510 HydrophobicContact CD2-CG1 4.03Å; L508-I510 PolarHBondContact O-N 3Å; L508-I510 VanDerWaalsContact O-N 3.12Å; I510-F512 PolarHBondContact O-N 3.33Å; I510-F512 VanDerWaalsContact O-N 3.17Å
511	P	25.9	Very low	29.5	Very low	105 Å²	105	127.7 Å²	127.7	68%	0.682	68%	0.68	S	S	*	*			trans	-71.9	111.5	178	29	-34.1	0	0	0	109.9	V509 R513	V509-P511 WeakPolarHBondContact O-CD 3.43Å; P511-R513 PolarHBondContact O-N 3.38Å
512	F	26.9	Very low	29.1	Very low	179 Å²	179	132.4 Å²	132.4	79%	0.785	71%	0.706	S	S	*	*			trans	-67.6	83.5	167.6	-84.3	-84	0	0	0	110	I510 A514	I510-F512 PolarHBondContact O-N 3.33Å; I510-F512 VanDerWaalsContact O-N 3.17Å; F512-A514 PolarHBondContact O-N 3.1Å
513	R	25.9	Very low	28.8	Very low	220 Å²	220	136.1 Å²	136.1	83%	0.83	72%	0.719	S	S	*	*			trans	-68.2	104.4	175.9	-161.3	-180	-153.2	165.6	8.1	108.7	P511 V515	P511-R513 PolarHBondContact O-N 3.38Å; R513-V515 PolarHBondContact O-N 3.45Å
514	A	27	Very low	28.4	Very low	91 Å²	91	139 Å²	139	75%	0.752	73%	0.732	S	S	*	*			trans	-54.3	114.3	-179	0	0	0	0	0	111.1	F512 N516	F512-A514 PolarHBondContact O-N 3.1Å; A514-N516 PolarHBondContact O-N 2.77Å; A514-N516 VanDerWaalsContact O-N 3.14Å
515	V	27.7	Very low	28.2	Very low	130 Å²	130	139.1 Å²	139.1	79%	0.788	74%	0.738	S	S	*	*			trans	-77.7	99.8	174.3	178.8	0	0	0	0	107.6	R513 R517	R513-V515 PolarHBondContact O-N 3.45Å; V515-R517 PolarHBondContact O-N 3.24Å
516	N	27	Very low	27.8	Very low	157 Å²	157	139.4 Å²	139.4	84%	0.84	75%	0.746	S	S	*	*			trans	-48.8	110.8	177.7	-97.1	-17.2	0	0	0	111.4	A514	A514-N516 PolarHBondContact O-N 2.77Å; A514-N516 VanDerWaalsContact O-N 3.14Å
517	R	27.5	Very low	27.9	Very low	207 Å²	207	142.5 Å²	142.5	78%	0.781	76%	0.76	S	S	*	*			trans	-103.1	70.8	171.7	-77.8	-171.1	172.1	-179.2	0.4	110.9	V515 P519	V515-R517 PolarHBondContact O-N 3.24Å; R517-P519 VanDerWaalsContact C-CD 3.45Å; R517-P519 WeakPolarHBondContact O-CD 3.41Å
518	N	27.1	Very low	27.8	Very low	160 Å²	160	138.3 Å²	138.3	86%	0.856	76%	0.756	S	S	*	*			trans	-110.6	87.9	159.3	-91.7	2.2	0	0	0	109.5	G520	N518-G520 PolarHBondContact O-N 2.7Å
519	P	27.5	Very low	27.9	Very low	129 Å²	129	138.1 Å²	138.1	84%	0.838	76%	0.764	S	S	*	*			trans	-88.6	83.8	167.4	35	-30.3	0	0	0	109.5	R517	R517-P519 VanDerWaalsContact C-CD 3.45Å; R517-P519 WeakPolarHBondContact O-CD 3.41Å
520	G	28.1	Very low	27.9	Very low	57 Å²	57	135 Å²	135	59%	0.588	76%	0.755	S	S	*	*			trans	-128.2	124.7	173.5	0	0	0	0	0	110.4	N518	N518-G520 PolarHBondContact O-N 2.7Å
521	S	26.8	Very low	28	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	77%	0.765	S	S	*	*			trans	45.5	119.5	168.6	52.2	0	0	0	0	116.8
522	D	29.3	Very low	28.2	Very low	129 Å²	129	136.6 Å²	136.6	69%	0.69	77%	0.768	S	S	*	*			cis	-165.2	156	47.5	-114	-48.5	0	0	0	114.7
523	Q	31.7	Very low	28.1	Very low	144 Å²	144	135.2 Å²	135.2	67%	0.673	76%	0.764	S	S	*	*			trans	51.5	117.9	146.4	-69.9	157.8	57.9	0	0	122.4
524	N	27.1	Very low	28.3	Very low	142 Å²	142	133.9 Å²	133.9	76%	0.759	76%	0.764	S	S	*	*			trans	60.5	138.2	136.2	-50.8	-22.3	0	0	0	118.4
525	V	32.7	Very low	28.2	Very low	138 Å²	138	139 Å²	139	84%	0.836	77%	0.769	S	S	*	*			cis	-144.2	162.1	48.3	162.2	0	0	0	0	111.7
526	D	27.6	Very low	28.1	Very low	142 Å²	142	138 Å²	138	76%	0.759	77%	0.768	S	S	*	*			trans	-63.9	170.3	-174	-66.4	-81.8	0	0	0	118.6
527	E	32.2	Very low	28	Very low	192 Å²	192	136.6 Å²	136.6	90%	0.897	77%	0.765	S	S	*	*			trans	113	138.9	148.4	-61.1	-160.6	137.1	0	0	117.4
528	S	27.7	Very low	27.8	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	77%	0.768	S	S	*	*			cis	-173.1	154.8	-31.3	-169.5	0	0	0	0	107.5
529	C	27.3	Very low	27.5	Very low	128 Å²	128	129.9 Å²	129.9	87%	0.865	76%	0.761	S	S	*	*			trans	65.4	135.4	162.9	-153	0	0	0	0	118.1
530	G	27.4	Very low	27.5	Very low	53 Å²	53	132.9 Å²	132.9	55%	0.546	76%	0.764	S	S	.	*			cis	156.4	119.9	-11.1	0	0	0	0	0	114
531	S	27.3	Very low	27.2	Very low	116 Å²	116	136.6 Å²	136.6	81%	0.811	78%	0.775	S	S	*	*			trans	66	170.7	168.5	81.5	0	0	0	0	116.1
532	L	29.6	Very low	27.4	Very low	141 Å²	141	137 Å²	137	74%	0.738	78%	0.775	S	S	*	*			cis	-143.9	165.6	6.2	-151.8	134.5	0	0	0	111.9
533	E	26.5	Very low	27.3	Very low	150 Å²	150	137.3 Å²	137.3	70%	0.701	78%	0.782	S	S	*	*			trans	-72.4	160.2	-173.5	-41.4	164.9	97.2	0	0	115.7
534	K	29.5	Very low	26.9	Very low	192 Å²	192	135.4 Å²	135.4	84%	0.835	78%	0.784	S	S	*	*				-171.8	163.8	109.3	-101.6	157	-172.6	170.8	0	115.2
535	K	23.8	Very low	26.8	Very low	199 Å²	199	137.4 Å²	137.4	87%	0.865	79%	0.789	S	S	*	*			trans	-115.6	142.9	-177.2	-61	168.2	-179.5	166.5	0	111.6
536	S	27.4	Very low	26.5	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	79%	0.786	S	S	*	*			trans	-160.3	124	147.8	-153.7	0	0	0	0	105.7
537	V	23.3	Very low	26.5	Very low	126 Å²	126	134.1 Å²	134.1	76%	0.764	78%	0.784	S	S	*	*				62.7	99.1	51.7	-173.1	0	0	0	0	111.9
538	C	23.9	Very low	26.2	Very low	124 Å²	124	132.9 Å²	132.9	84%	0.838	78%	0.783	S	S	*	*				-157.4	164.4	117.7	-137.5	0	0	0	0	110.5
539	S	21.3	Very low	26.1	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	78%	0.784	S	S	*	*			trans	-148.2	137.4	-176	55	0	0	0	0	109.9
540	E	27	Very low	26	Very low	191 Å²	191	134 Å²	134	89%	0.893	78%	0.784	S	S	*	*			trans	-154.6	168.6	166.2	-117.3	153.9	-132.3	0	0	111.7
541	T	22.7	Very low	26	Very low	135 Å²	135	134.9 Å²	134.9	83%	0.828	79%	0.794	S	S	*	*			trans	-129	168.3	-148.6	25.1	0	0	0	0	114
542	P	29.9	Very low	26	Very low	117 Å²	117	141 Å²	141	76%	0.76	80%	0.799	S	S	*	*			trans	-102.7	164.6	-148.8	39.2	-38.1	0	0	0	116.4
543	T	27.8	Very low	25.9	Very low	136 Å²	136	140 Å²	140	83%	0.834	80%	0.801	S	S	*	*			trans	-140.3	146.1	156	46.7	0	0	0	0	112.1
544	S	23.7	Very low	26	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	79%	0.794	S	S	*	*			trans	-43.5	166.4	163.4	54.9	0	0	0	0	115.5
545	E	24.8	Very low	26.2	Very low	184 Å²	184	139.6 Å²	139.6	86%	0.86	80%	0.798	S	S	*	*			cis	-131.2	-174.8	14.1	-62.9	172.3	145.3	0	0	109.1
546	S	26.7	Very low	26.6	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	78%	0.782	S	S	*	*			cis	-156.9	-167.3	20	63.8	0	0	0	0	112.7
547	S	26.1	Very low	26.8	Very low	100 Å²	100	132.9 Å²	132.9	70%	0.699	77%	0.769	S	S	*	*			trans	-65.3	140.7	-173.2	50.1	0	0	0	0	116.9
548	N	26.5	Very low	27.2	Very low	166 Å²	166	131.7 Å²	131.7	89%	0.888	76%	0.762	S	S	*	*				-163	166.5	120.8	-98.5	-7	0	0	0	111.6
549	A	24.6	Very low	27.5	Very low	92 Å²	92	130.7 Å²	130.7	76%	0.76	75%	0.745	S	S	*	*			trans	-87.8	143.6	-161.1	0	0	0	0	0	115.1
550	L	26.7	Very low	28.2	Very low	165 Å²	165	134 Å²	134	86%	0.864	74%	0.741	S	S	*	*				178.9	130.8	116.5	-95	163.8	0	0	0	111.2
551	G	26.5	Very low	28.4	Very low	72 Å²	72	127.9 Å²	127.9	74%	0.742	72%	0.718	S	S	*	*			trans	50.1	97.6	160.6	0	0	0	0	0	119.3
552	R	26.8	Very low	28.9	Very low	243 Å²	243	125.5 Å²	125.5	92%	0.917	69%	0.694	S	S	*	*			trans	-63.3	136.7	156.8	-75.1	-175.6	175.8	-174	-0	109.2	T554	R552-T554 PolarHBondContact O-N 2.88Å; R552-T554 VanDerWaalsContact O-N 3.14Å
553	P	28.6	Very low	29.3	Very low	121 Å²	121	122.5 Å²	122.5	79%	0.786	67%	0.674	S	S	*	*			trans	-68.8	112.8	179	27.2	-33.7	0	0	0	111.1
554	T	28.8	Very low	29.9	Very low	92 Å²	92	118.6 Å²	118.6	56%	0.564	65%	0.649	S	S	*	*			trans	-66.6	144.8	165	42.1	0	0	0	0	110.2	R552 S556	R552-T554 PolarHBondContact O-N 2.88Å; R552-T554 VanDerWaalsContact O-N 3.14Å; T554-S556 PolarHBondContact O-N 3.36Å
555	R	32.8	Very low	30.5	Very low	242 Å²	242	113.9 Å²	113.9	91%	0.913	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-61.4	-27.4	-169.9	-80.5	176.9	159.9	178.5	-8.9	114.1	N557	R555-N557 PolarHBondContact O-N 3.04Å
556	S	33.2	Very low	30.9	Very low	76 Å²	76	107.9 Å²	107.9	53%	0.531	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-61.8	-37	-175.7	47.9	0	0	0	0	114.6	T554 V558	T554-S556 PolarHBondContact O-N 3.36Å; S556-V558 VanDerWaalsContact C-N 3.33Å; S556-V558 PolarHBondContact O-N 3.28Å
557	N	30.8	Very low	31.6	Very low	91 Å²	91	103.1 Å²	103.1	49%	0.487	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-81.5	-3.5	-170.5	-77.9	-37.2	0	0	0	115.3	R555 R560	R555-N557 PolarHBondContact O-N 3.04Å; N557-R560 PolarHBondContact OD1-NH1 2.83Å; N557-R560 VanDerWaalsContact OD1-NH1 3.12Å
558	V	32.3	Very low	32.4	Very low	102 Å²	102	99 Å²	99	62%	0.618	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-85.5	-22.7	177.8	-175.9	0	0	0	0	112.4	S556	S556-V558 VanDerWaalsContact C-N 3.33Å; S556-V558 PolarHBondContact O-N 3.28Å
559	H	29.6	Very low	33	Very low	103 Å²	103	93.9 Å²	93.9	48%	0.477	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-37.1	-179.3	-78.4	3.5	0	0	0	114	R562 V563	H559-R562 WeakPolarHBondContact O-CB 3.33Å; H559-R562 PolarHBondContact O-N 3.4Å; H559-V563 PolarHBondContact O-N 3.41Å
560	R	35.7	Very low	33.8	Very low	172 Å²	172	89.9 Å²	89.9	65%	0.649	46%	0.464	S	S	*	.	H	α-helix	trans	-47.4	-47.9	-178.7	-77.6	177	170.8	150.7	-7.2	114.1	N557 R562 V563 V564	N557-R560 PolarHBondContact OD1-NH1 2.83Å; N557-R560 VanDerWaalsContact OD1-NH1 3.12Å; R560-R562 VanDerWaalsContact C-N 3.33Å; R560-R562 PolarHBondContact O-N 3.14Å; R560-V563 PolarHBondContact O-N 3.5Å; R560-V564 WeakPolarHBondContact O-CG2 3.48Å; R560-V564 PolarHBondContact O-N 3.01Å
561	P	32.2	Very low	34.6	Very low	63 Å²	63	83.3 Å²	83.3	41%	0.409	43%	0.432	S	S	.	.	H	α-helix	trans	-66.1	-33.5	178.9	-20.6	33.6	0	0	0	113.6	Q436 A565	Q436-P561 PolarHBondContact NE2-O 3.43Å; P561-A565 WeakPolarHBondContact O-CB 3.5Å; P561-A565 PolarHBondContact O-N 2.81Å
562	R	31.9	Very low	35.2	Very low	85 Å²	85	81.5 Å²	81.5	32%	0.321	41%	0.41	S	S	.	.	H	α-helix	trans	-73.7	-36.6	-178	-165.3	179.9	-175.7	167.5	2.8	111.5	W423 H559 R560 A565 E566	W423-R562 HydrophobicContact CH2-CG 4.29Å; W423-R562 HydrophobicContact CZ2-CG 4.24Å; W423-R562 VanDerWaalsContact CZ2-NE 3.33Å; W423-R562 VanDerWaalsContact NE1-NH2 3.17Å; H559-R562 WeakPolarHBondContact O-CB 3.33Å; H559-R562 PolarHBondContact O-N 3.4Å; R560-R562 VanDerWaalsContact C-N 3.33Å; R560-R562 PolarHBondContact O-N 3.14Å; R562-A565 VanDerWaalsContact O-CB 3.32Å; R562-A565 WeakPolarHBondContact O-CB 3.41Å; R562-A565 PolarHBondContact O-N 3.14Å; R562-E566 WeakPolarHBondContact CG-OE1 3.35Å; R562-E566 IonicContact NE-OE1 3.62Å; R562-E566 VanDerWaalsContact O-CG 3.3Å; R562-E566 WeakPolarHBondContact O-CG 3.38Å; R562-E566 PolarHBondContact O-N 2.84Å; R562-E566 VanDerWaalsContact O-N 3.08Å
563	V	38.5	Very low	35.8	Very low	54 Å²	54	74 Å²	74	33%	0.327	39%	0.387	S	S	.	.	H	α-helix	trans	-65.2	-49.8	171.8	177.5	0	0	0	0	110.6	H559 R560 A565 E566 L567	H559-V563 PolarHBondContact O-N 3.41Å; R560-V563 PolarHBondContact O-N 3.5Å; V563-A565 PolarHBondContact O-N 3.23Å; V563-E566 PolarHBondContact O-N 3.22Å; V563-E566 VanDerWaalsContact O-N 3.09Å; V563-L567 HydrophobicContact CG1-CD1 3.81Å; V563-L567 HydrophobicContact CG1-CG 4.19Å; V563-L567 VanDerWaalsContact O-CG 3.25Å; V563-L567 WeakPolarHBondContact O-CG 3.42Å; V563-L567 PolarHBondContact O-N 3.38Å
564	V	41.8	Very low	36.5	Very low	53 Å²	53	70.5 Å²	70.5	32%	0.321	37%	0.366	S	S	.	.	H	α-helix	trans	-56.8	-38.4	176.6	174.1	0	0	0	0	111.7	Q436 R560 S568	Q436-V564 HydrophobicContact CG-CG1 4.1Å; R560-V564 WeakPolarHBondContact O-CG2 3.48Å; R560-V564 PolarHBondContact O-N 3.01Å; V564-S568 WeakPolarHBondContact O-CB 3.32Å; V564-S568 PolarHBondContact O-N 2.93Å; V564-S568 PolarHBondContact O-OG 3.16Å
565	A	34.7	Very low	37	Very low	4 Å²	4	70 Å²	70	3%	0.033	37%	0.367	C	S	.	.	H	α-helix	trans	-60.3	-47.4	174.7	0	0	0	0	0	113.2	V432 P561 R562 V563 S568 L569	V432-A565 HydrophobicContact CB-CB 4.03Å; V432-A565 HydrophobicContact CG1-CB 3.26Å; V432-A565 HydrophobicContact CG2-CB 3.63Å; P561-A565 WeakPolarHBondContact O-CB 3.5Å; P561-A565 PolarHBondContact O-N 2.81Å; R562-A565 VanDerWaalsContact O-CB 3.32Å; R562-A565 WeakPolarHBondContact O-CB 3.41Å; R562-A565 PolarHBondContact O-N 3.14Å; V563-A565 PolarHBondContact O-N 3.23Å; A565-S568 WeakPolarHBondContact O-CB 3.32Å; A565-S568 PolarHBondContact O-N 3.14Å; A565-L569 PolarHBondContact O-N 3.11Å
566	E	33.4	Very low	37.2	Very low	58 Å²	58	62.9 Å²	62.9	27%	0.271	35%	0.35	S	S	.	.	H	α-helix	trans	-71.1	-41.4	-176.7	-70.9	163.6	-169	0	0	111.4	W423 R562 V563 S568 L569 A570 L617	W423-E566 HydrophobicContact CH2-CG 4.3Å; W423-E566 WeakPolarHBondContact CH2-OE1 3.41Å; W423-E566 HydrophobicContact CZ3-CG 4.43Å; R562-E566 WeakPolarHBondContact CG-OE1 3.35Å; R562-E566 IonicContact NE-OE1 3.62Å; R562-E566 VanDerWaalsContact O-CG 3.3Å; R562-E566 WeakPolarHBondContact O-CG 3.38Å; R562-E566 PolarHBondContact O-N 2.84Å; R562-E566 VanDerWaalsContact O-N 3.08Å; V563-E566 PolarHBondContact O-N 3.22Å; V563-E566 VanDerWaalsContact O-N 3.09Å; E566-S568 VanDerWaalsContact C-N 3.29Å; E566-S568 PolarHBondContact O-N 3.33Å; E566-L569 PolarHBondContact O-N 3.14Å; E566-A570 PolarHBondContact O-N 2.59Å; E566-L617 HydrophobicContact CB-CD1 3.84Å; E566-L617 HydrophobicContact CB-CD2 4.06Å; E566-L617 WeakPolarHBondContact O-CD2 3.49Å
567	L	42.1	Very low	37.3	Very low	11 Å²	11	61.9 Å²	61.9	6%	0.058	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-38.2	173.2	-61.4	174.6	0	0	0	112.4	V563 S571 L617 L620 A621 E624	V563-L567 HydrophobicContact CG1-CD1 3.81Å; V563-L567 HydrophobicContact CG1-CG 4.19Å; V563-L567 VanDerWaalsContact O-CG 3.25Å; V563-L567 WeakPolarHBondContact O-CG 3.42Å; V563-L567 PolarHBondContact O-N 3.38Å; L567-S571 PolarHBondContact O-N 3.07Å; L567-S571 PolarHBondContact O-OG 3.23Å; L567-S571 VanDerWaalsContact O-OG 3.07Å; L567-L617 HydrophobicContact CD2-CD1 3.68Å; L567-L617 HydrophobicContact CD2-CG 4.36Å; L567-L617 HydrophobicContact CG-CD1 4.33Å; L567-L620 HydrophobicContact CD2-CB 3.3Å; L567-L620 HydrophobicContact CD2-CD1 4.42Å; L567-L620 HydrophobicContact CD2-CG 4.48Å; L567-A621 HydrophobicContact CB-CB 4Å; L567-A621 HydrophobicContact CD2-CB 4.14Å; L567-A621 VanDerWaalsContact O-CB 3.25Å; L567-A621 WeakPolarHBondContact O-CB 3.47Å; L567-E624 HydrophobicContact CD1-CG 4.35Å
568	S	43.8	Very low	37.5	Very low	13 Å²	13	64.9 Å²	64.9	9%	0.091	35%	0.354	C	S	.	.	H	α-helix	trans	-65.1	-44.2	175.3	-67.4	0	0	0	0	112.1	I435 V564 A565 E566 S571 A572	I435-S568 WeakPolarHBondContact CG2-OG 3.42Å; V564-S568 WeakPolarHBondContact O-CB 3.32Å; V564-S568 PolarHBondContact O-N 2.93Å; V564-S568 PolarHBondContact O-OG 3.16Å; A565-S568 WeakPolarHBondContact O-CB 3.32Å; A565-S568 PolarHBondContact O-N 3.14Å; E566-S568 VanDerWaalsContact C-N 3.29Å; E566-S568 PolarHBondContact O-N 3.33Å; S568-S571 PolarHBondContact O-N 3.14Å; S568-A572 PolarHBondContact O-N 3.05Å; S568-A572 VanDerWaalsContact O-N 3.15Å
569	L	38.8	Very low	37.3	Very low	60 Å²	60	66.9 Å²	66.9	31%	0.314	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-43.6	176.6	-161.6	84.3	0	0	0	111.1	A565 E566 S571 A572 I573	A565-L569 PolarHBondContact O-N 3.11Å; E566-L569 PolarHBondContact O-N 3.14Å; L569-S571 PolarHBondContact O-N 3.12Å; L569-A572 PolarHBondContact O-N 3.42Å; L569-I573 HydrophobicContact CD2-CD1 4.02Å; L569-I573 HydrophobicContact CG-CD1 3.94Å; L569-I573 WeakPolarHBondContact O-CG1 3.49Å; L569-I573 PolarHBondContact O-N 2.81Å
570	A	40	Very low	37.1	Very low	7 Å²	7	67.1 Å²	67.1	6%	0.058	37%	0.374	C	S	.	.	H	α-helix	trans	-59.8	-43.3	176.2	0	0	0	0	0	112.3	E566 A572 I573 S574 L617 L618	E566-A570 PolarHBondContact O-N 2.59Å; A570-A572 VanDerWaalsContact C-N 3.33Å; A570-A572 PolarHBondContact O-N 3.06Å; A570-I573 PolarHBondContact O-N 2.87Å; A570-S574 WeakPolarHBondContact O-CB 3.32Å; A570-S574 PolarHBondContact O-N 2.76Å; A570-L617 HydrophobicContact CB-CB 4.27Å; A570-L617 HydrophobicContact CB-CD2 3.86Å; A570-L617 HydrophobicContact CB-CG 3.73Å; A570-L618 HydrophobicContact CB-CD2 4.13Å; A570-L618 HydrophobicContact CB-CG 4.44Å; A570-L618 VanDerWaalsContact O-CD2 3.3Å; A570-L618 WeakPolarHBondContact O-CD2 3.45Å
571	S	45.2	Very low	36.7	Very low	27 Å²	27	68.2 Å²	68.2	19%	0.189	38%	0.38	C	S	.	.	H	α-helix	trans	-59	-43.2	174.3	-62.8	0	0	0	0	112.3	L567 S568 L569 S574 S575 A621 R625	L567-S571 PolarHBondContact O-N 3.07Å; L567-S571 PolarHBondContact O-OG 3.23Å; L567-S571 VanDerWaalsContact O-OG 3.07Å; S568-S571 PolarHBondContact O-N 3.14Å; L569-S571 PolarHBondContact O-N 3.12Å; S571-S574 PolarHBondContact O-N 3.41Å; S571-S575 PolarHBondContact O-N 2.89Å; S571-S575 PolarHBondContact O-OG 2.85Å; S571-A621 WeakPolarHBondContact OG-CB 3.29Å; S571-R625 PolarHBondContact OG-NH1 3.48Å
572	A	38.5	Very low	36.4	Very low	34 Å²	34	71 Å²	71	28%	0.281	40%	0.398	S	S	.	.	H	α-helix	trans	-67	-42.3	178.5	0	0	0	0	0	112.5	S568 L569 A570 S575 T576	S568-A572 PolarHBondContact O-N 3.05Å; S568-A572 VanDerWaalsContact O-N 3.15Å; L569-A572 PolarHBondContact O-N 3.42Å; A570-A572 VanDerWaalsContact C-N 3.33Å; A570-A572 PolarHBondContact O-N 3.06Å; A572-S575 PolarHBondContact O-N 2.74Å; A572-S575 PolarHBondContact O-OG 2.61Å; A572-T576 PolarHBondContact O-N 3.11Å; A572-T576 PolarHBondContact O-OG1 2.94Å; A572-T576 VanDerWaalsContact O-OG1 3.11Å
573	I	38.1	Very low	36.2	Very low	85 Å²	85	73.4 Å²	73.4	44%	0.436	42%	0.415	S	S	.	.	H	α-helix	trans	-64	-42.9	176.1	-67.1	165.5	0	0	0	110.4	L569 A570 S575 T576 S577	L569-I573 HydrophobicContact CD2-CD1 4.02Å; L569-I573 HydrophobicContact CG-CD1 3.94Å; L569-I573 WeakPolarHBondContact O-CG1 3.49Å; L569-I573 PolarHBondContact O-N 2.81Å; A570-I573 PolarHBondContact O-N 2.87Å; I573-S575 VanDerWaalsContact C-N 3.29Å; I573-S575 PolarHBondContact O-N 2.86Å; I573-T576 PolarHBondContact O-N 2.76Å; I573-T576 PolarHBondContact O-OG1 3.32Å; I573-S577 PolarHBondContact O-N 3.49Å; I573-S577 PolarHBondContact O-OG 3.17Å
574	S	44.6	Very low	35.7	Very low	49 Å²	49	77.1 Å²	77.1	34%	0.343	43%	0.431	S	S	.	.	H	α-helix	trans	-55.5	-44.6	175.4	-155.7	0	0	0	0	112	A570 S571 T576 S577	A570-S574 WeakPolarHBondContact O-CB 3.32Å; A570-S574 PolarHBondContact O-N 2.76Å; S571-S574 PolarHBondContact O-N 3.41Å; S574-T576 PolarHBondContact O-N 3.29Å; S574-T576 VanDerWaalsContact O-N 3.14Å; S574-S577 PolarHBondContact O-N 2.99Å; S574-S577 PolarHBondContact O-OG 3.4Å
575	S	38.7	Very low	34.8	Very low	82 Å²	82	82.3 Å²	82.3	57%	0.573	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	2	178.9	67	0	0	0	0	115	S571 A572 I573	S571-S575 PolarHBondContact O-N 2.89Å; S571-S575 PolarHBondContact O-OG 2.85Å; A572-S575 PolarHBondContact O-N 2.74Å; A572-S575 PolarHBondContact O-OG 2.61Å; I573-S575 VanDerWaalsContact C-N 3.29Å; I573-S575 PolarHBondContact O-N 2.86Å
576	T	36.8	Very low	34.6	Very low	91 Å²	91	88.9 Å²	88.9	56%	0.558	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	-10.3	176.4	48	0	0	0	0	113.6	A572 I573 S574	A572-T576 PolarHBondContact O-N 3.11Å; A572-T576 PolarHBondContact O-OG1 2.94Å; A572-T576 VanDerWaalsContact O-OG1 3.11Å; I573-T576 PolarHBondContact O-N 2.76Å; I573-T576 PolarHBondContact O-OG1 3.32Å; S574-T576 PolarHBondContact O-N 3.29Å; S574-T576 VanDerWaalsContact O-N 3.14Å
577	S	36	Very low	34.3	Very low	55 Å²	55	91.5 Å²	91.5	39%	0.385	50%	0.5	S	S	.	.			trans	-89	4.9	179.2	59.9	0	0	0	0	115.5	I573 S574 N579	I573-S577 PolarHBondContact O-N 3.49Å; I573-S577 PolarHBondContact O-OG 3.17Å; S574-S577 PolarHBondContact O-N 2.99Å; S574-S577 PolarHBondContact O-OG 3.4Å; S577-N579 PolarHBondContact O-N 3.06Å
578	E	35	Very low	33.5	Very low	155 Å²	155	98 Å²	98	72%	0.724	54%	0.535	S	S	*	.			trans	-67	0.8	178.7	-63.4	-175.5	150.4	0	0	114.3
579	N	28.2	Very low	32.7	Very low	143 Å²	143	105.7 Å²	105.7	77%	0.765	57%	0.569	S	S	*	*	S	Bend	trans	-106.3	102.7	175.7	-77.7	-64.5	0	0	0	112.3	S577	S577-N579 PolarHBondContact O-N 3.06Å
580	S	25.8	Very low	32.4	Very low	108 Å²	108	108.6 Å²	108.6	76%	0.755	60%	0.595	S	S	*	*			trans	60.1	88.6	156.4	-161.9	0	0	0	0	118
581	Y	27.3	Very low	31.9	Very low	196 Å²	196	115.5 Å²	115.5	77%	0.769	63%	0.63	S	S	*	*			trans	-126	99.4	157.1	-79.2	-81	0	0	0	110.5	M583	Y581-M583 PolarHBondContact O-N 3.03Å
582	P	24.8	Very low	31.1	Very low	122 Å²	122	121.4 Å²	121.4	79%	0.792	66%	0.66	S	S	*	*			trans	-77.7	106.8	175.5	30.4	-32.1	0	0	0	110
583	M	27.1	Very low	30.8	Very low	135 Å²	135	131 Å²	131	67%	0.665	69%	0.689	S	S	*	*			trans	-141.3	83.4	176.9	-158.6	166.2	-171.7	0	0	115.3	Y581	Y581-M583 PolarHBondContact O-N 3.03Å
584	I	27.9	Very low	30.4	Very low	131 Å²	131	136.3 Å²	136.3	67%	0.672	71%	0.708	S	S	*	*			trans	58.4	108.9	137.9	-55.7	168.1	0	0	0	117.1	I586	I584-I586 HydrophobicContact CG2-CG1 4.34Å; I584-I586 PolarHBondContact O-N 2.98Å
585	H	24.4	Very low	30.1	Very low	163 Å²	163	140 Å²	140	76%	0.755	73%	0.729	S	S	*	*			trans	-59.1	119.9	155.7	-125.7	-102.2	0	0	0	109.1	D587	H585-D587 VanDerWaalsContact C-N 3.31Å; H585-D587 IonicContact CE1-OD1 3.08Å; H585-D587 IonicContact CG-OD1 2.63Å; H585-D587 IonicContact ND1-OD1 2.66Å; H585-D587 PolarHBondContact ND1-OD1 3.48Å; H585-D587 IonicContact ND1-OD2 2.98Å; H585-D587 PolarHBondContact O-N 3.09Å
586	I	30.2	Very low	29.9	Very low	142 Å²	142	142.5 Å²	142.5	73%	0.728	74%	0.735	S	S	*	*			trans	-91.4	73	171.1	-53.4	-178.9	0	0	0	108.2	I584	I584-I586 HydrophobicContact CG2-CG1 4.34Å; I584-I586 PolarHBondContact O-N 2.98Å
587	D	26.7	Very low	29.7	Very low	112 Å²	112	145.2 Å²	145.2	60%	0.599	75%	0.747	S	S	*	*			trans	-76.4	124.2	166.4	-71.7	-8.7	0	0	0	108.5	H585 H589	H585-D587 VanDerWaalsContact C-N 3.31Å; H585-D587 IonicContact CE1-OD1 3.08Å; H585-D587 IonicContact CG-OD1 2.63Å; H585-D587 IonicContact ND1-OD1 2.66Å; H585-D587 PolarHBondContact ND1-OD1 3.48Å; H585-D587 IonicContact ND1-OD2 2.98Å; H585-D587 PolarHBondContact O-N 3.09Å; D587-H589 PolarHBondContact O-N 2.89Å
588	N	25.7	Very low	29.7	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	77%	0.766	S	S	*	*	S	Bend	trans	-75.4	47.9	-174.3	-75.9	-37.8	0	0	0	113.9
589	H	27.6	Very low	29.5	Very low	174 Å²	174	150.8 Å²	150.8	81%	0.806	77%	0.772	S	S	*	*			trans	-146.1	84.7	-178.9	-75.6	-58.3	0	0	0	113.5	D587	D587-H589 PolarHBondContact O-N 2.89Å
590	S	31.8	Very low	29.6	Very low	121 Å²	121	153.5 Å²	153.5	85%	0.846	77%	0.773	S	S	*	*			trans	177.4	63	145.1	40.6	0	0	0	0	114.5
591	L	28.7	Very low	29.8	Very low	152 Å²	152	155.5 Å²	155.5	80%	0.796	77%	0.773	S	S	*	*			trans	-70.1	144.9	154.2	-100.3	163.8	0	0	0	109.6
592	N	28.1	Very low	30	Very low	152 Å²	152	151.5 Å²	151.5	81%	0.813	77%	0.771	S	S	*	*			trans	74.2	82.5	178.8	-54.8	-47.6	0	0	0	118
593	R	33.3	Very low	30.4	Very low	236 Å²	236	150.3 Å²	150.3	89%	0.891	77%	0.766	S	S	*	*			trans	-141.7	124.6	131	-108.9	-178.7	-169.8	178.2	4.3	110.8
594	K	29.8	Very low	30.8	Very low	195 Å²	195	155.9 Å²	155.9	85%	0.848	78%	0.779	S	S	*	*			trans	-78.9	131.9	157	-70.2	-172.2	174.3	-167.7	0	108.1
595	V	37.1	Very low	31.3	Very low	127 Å²	127	154.4 Å²	154.4	77%	0.77	78%	0.781	S	S	*	*			trans	-140.2	131.8	156.9	-177.7	0	0	0	0	104.8
596	D	35.1	Very low	32.1	Very low	134 Å²	134	150.5 Å²	150.5	72%	0.717	76%	0.763	S	S	*	*			trans	-86.7	162.9	-170	-45.4	-83.3	0	0	0	111.9
597	D	33.6	Very low	32.7	Very low	149 Å²	149	147.4 Å²	147.4	80%	0.797	75%	0.752	S	S	*	*			trans	11.2	120.1	169.5	-53.8	-34.3	0	0	0	120.2
598	E	35.3	Very low	33.9	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	75%	0.752	S	S	*	*				175.4	148.7	106.7	-86.6	-62.8	-176.8	0	0	111.7
599	D	30.4	Very low	34.9	Very low	156 Å²	156	144 Å²	144	83%	0.834	74%	0.74	S	S	*	*			trans	16.4	96.5	173.3	-87.5	-26.8	0	0	0	120.2
600	Y	29.9	Very low	36	Very low	200 Å²	200	138.3 Å²	138.3	78%	0.784	72%	0.718	S	S	*	*			trans	-140	116.7	153	-166.2	-92.8	0	0	0	111.8	P602	Y600-P602 WeakPolarHBondContact O-CD 3.43Å
601	I	30.1	Very low	36.9	Very low	150 Å²	150	136 Å²	136	77%	0.769	69%	0.693	S	S	*	*			trans	-70.9	118.2	178.4	-59.7	174.5	0	0	0	109.1	S603	I601-S603 PolarHBondContact O-N 3.28Å; I601-S603 VanDerWaalsContact O-N 3.13Å
602	P	32.1	Very low	38.2	Very low	111 Å²	111	135.7 Å²	135.7	72%	0.721	68%	0.682	S	S	*	*			trans	-68.3	115	178.7	27.4	-33.3	0	0	0	110.1	Y600 R604	Y600-P602 WeakPolarHBondContact O-CD 3.43Å; P602-R604 PolarHBondContact O-N 2.98Å
603	S	34.1	Very low	39.7	Very low	98 Å²	98	132.7 Å²	132.7	69%	0.685	67%	0.666	S	S	*	*			trans	-61.4	120	173.5	47.2	0	0	0	0	109.5	I601 S605	I601-S603 PolarHBondContact O-N 3.28Å; I601-S603 VanDerWaalsContact O-N 3.13Å; S603-S605 PolarHBondContact O-N 3.43Å
604	R	34.9	Very low	40.9	Very low	251 Å²	251	127 Å²	127	95%	0.947	65%	0.645	S	S	*	*			trans	-52.5	93.2	-168.6	-169.5	-176.5	-167.6	-179.7	5	112.2	P602 E606	P602-R604 PolarHBondContact O-N 2.98Å; R604-E606 PolarHBondContact O-N 2.98Å
605	S	38.6	Very low	42.5	Very low	101 Å²	101	126.3 Å²	126.3	71%	0.706	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-67.8	119.6	-176.1	55.2	0	0	0	0	110.9	S603	S603-S605 PolarHBondContact O-N 3.43Å
606	E	40.4	Very low	43.9	Very low	81 Å²	81	124.8 Å²	124.8	38%	0.379	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-58.4	137	167.1	-63.7	-174.2	133	0	0	110.1	R604 K611 R614	R604-E606 PolarHBondContact O-N 2.98Å; E606-K611 HydrophobicContact CB-CG 4.41Å; E606-K611 WeakPolarHBondContact O-CE 3.49Å; E606-R614 IonicContact OE1-CZ 3.3Å; E606-R614 IonicContact OE1-NH1 3.73Å; E606-R614 PolarHBondContact OE1-NH1 3.22Å; E606-R614 IonicContact OE1-NH2 3.7Å; E606-R614 PolarHBondContact OE1-NH2 3.09Å; E606-R614 IonicContact OE2-CZ 3.57Å; E606-R614 IonicContact OE2-NH1 2.81Å; E606-R614 PolarHBondContact OE2-NH1 3.27Å; E606-R614 IonicContact OE2-NH2 2.68Å
607	P	44.3	Very low	45.4	Very low	76 Å²	76	120.6 Å²	120.6	49%	0.494	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-60.1	149.5	179.1	25.3	-33.7	0	0	0	111.3	D609 V610 K611	P607-D609 PolarHBondContact O-N 3.49Å; P607-D609 VanDerWaalsContact O-N 3.08Å; P607-V610 HydrophobicContact CG-CB 4.29Å; P607-V610 HydrophobicContact CG-CG2 3.85Å; P607-V610 PolarHBondContact O-N 2.96Å; P607-V610 VanDerWaalsContact O-N 3.16Å; P607-K611 PolarHBondContact O-N 3.44Å
608	S	50.6	Low	47	Very low	87 Å²	87	116.2 Å²	116.2	61%	0.608	57%	0.571	S	S	*	*	H	α-helix	trans	-42.5	-45.5	179.3	33.9	0	0	0	0	112.6	V610 K611 Y612	S608-V610 PolarHBondContact O-N 3.49Å; S608-K611 WeakPolarHBondContact O-CB 3.39Å; S608-K611 PolarHBondContact O-N 2.88Å; S608-K611 VanDerWaalsContact O-N 3.09Å; S608-Y612 PolarHBondContact O-N 3.26Å
609	D	47.3	Very low	48.7	Very low	101 Å²	101	109 Å²	109	54%	0.54	54%	0.537	S	S	.	.	H	α-helix	trans	-74	-31.6	-166.5	-27.1	-35.5	0	0	0	110.7	P607 Y612 N613	P607-D609 PolarHBondContact O-N 3.49Å; P607-D609 VanDerWaalsContact O-N 3.08Å; D609-Y612 PolarHBondContact O-N 3.25Å; D609-N613 WeakPolarHBondContact O-CB 3.42Å; D609-N613 PolarHBondContact O-N 3.39Å; D609-N613 PolarHBondContact O-ND2 3.49Å; D609-N613 VanDerWaalsContact O-ND2 3.12Å
610	V	49.8	Very low	50.7	Low	56 Å²	56	103.7 Å²	103.7	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-68.6	-38.7	171.7	171.7	0	0	0	0	110.5	P607 S608 R614	P607-V610 HydrophobicContact CG-CB 4.29Å; P607-V610 HydrophobicContact CG-CG2 3.85Å; P607-V610 PolarHBondContact O-N 2.96Å; P607-V610 VanDerWaalsContact O-N 3.16Å; S608-V610 PolarHBondContact O-N 3.49Å; V610-R614 WeakPolarHBondContact O-CB 3.16Å; V610-R614 WeakPolarHBondContact O-CG 3.29Å; V610-R614 PolarHBondContact O-N 3.3Å
611	K	51.2	Low	52.7	Low	73 Å²	73	94.3 Å²	94.3	32%	0.317	47%	0.472	S	S	.	.	H	α-helix	trans	-68.5	-40.8	175.5	-61.5	-174.3	-179.7	-175.5	0	111.6	E606 P607 S608 R615	E606-K611 HydrophobicContact CB-CG 4.41Å; E606-K611 WeakPolarHBondContact O-CE 3.49Å; P607-K611 PolarHBondContact O-N 3.44Å; S608-K611 WeakPolarHBondContact O-CB 3.39Å; S608-K611 PolarHBondContact O-N 2.88Å; S608-K611 VanDerWaalsContact O-N 3.09Å; K611-R615 WeakPolarHBondContact O-CG 3.4Å; K611-R615 PolarHBondContact O-N 2.94Å; K611-R615 VanDerWaalsContact O-N 3.09Å
612	Y	56.8	Low	54.6	Low	145 Å²	145	87.9 Å²	87.9	57%	0.569	44%	0.439	S	S	*	.	H	α-helix	trans	-64	-50.6	174.8	-177.9	-91.8	0	0	0	111.4	S608 D609 R614 R615 R616	S608-Y612 PolarHBondContact O-N 3.26Å; D609-Y612 PolarHBondContact O-N 3.25Å; Y612-R614 PolarHBondContact O-N 3Å; Y612-R615 WeakPolarHBondContact O-CA 3.37Å; Y612-R615 WeakPolarHBondContact O-CB 3.44Å; Y612-R615 PolarHBondContact O-N 3.48Å; Y612-R615 VanDerWaalsContact O-N 3.08Å; Y612-R616 PolarHBondContact O-N 3.08Å
613	N	58.6	Low	56.8	Low	89 Å²	89	82.6 Å²	82.6	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-63.6	-39.6	-179.9	-73.9	-30.9	0	0	0	112.3	D609 R615 R616 L617	D609-N613 WeakPolarHBondContact O-CB 3.42Å; D609-N613 PolarHBondContact O-N 3.39Å; D609-N613 PolarHBondContact O-ND2 3.49Å; D609-N613 VanDerWaalsContact O-ND2 3.12Å; N613-R615 PolarHBondContact O-N 2.81Å; N613-R616 PolarHBondContact O-N 3.12Å; N613-L617 WeakPolarHBondContact O-CB 3.38Å; N613-L617 PolarHBondContact O-N 3.13Å
614	R	59.8	Low	58.8	Low	116 Å²	116	81.2 Å²	81.2	44%	0.438	39%	0.388	S	S	.	.	H	α-helix	trans	-60.5	-42.5	170.9	-76.9	-174.3	-169.7	148.4	9.8	112.1	E606 V610 Y612 L617 L618	E606-R614 IonicContact OE1-CZ 3.3Å; E606-R614 IonicContact OE1-NH1 3.73Å; E606-R614 PolarHBondContact OE1-NH1 3.22Å; E606-R614 IonicContact OE1-NH2 3.7Å; E606-R614 PolarHBondContact OE1-NH2 3.09Å; E606-R614 IonicContact OE2-CZ 3.57Å; E606-R614 IonicContact OE2-NH1 2.81Å; E606-R614 PolarHBondContact OE2-NH1 3.27Å; E606-R614 IonicContact OE2-NH2 2.68Å; V610-R614 WeakPolarHBondContact O-CB 3.16Å; V610-R614 WeakPolarHBondContact O-CG 3.29Å; V610-R614 PolarHBondContact O-N 3.3Å; Y612-R614 PolarHBondContact O-N 3Å; R614-L617 PolarHBondContact O-N 2.93Å; R614-L618 WeakPolarHBondContact O-CB 3.35Å; R614-L618 WeakPolarHBondContact O-CD1 3.41Å; R614-L618 WeakPolarHBondContact O-CG 3.47Å; R614-L618 PolarHBondContact O-N 3.27Å
615	R	62.4	Low	60.8	Low	180 Å²	180	72.9 Å²	72.9	68%	0.679	36%	0.356	S	S	*	.	H	α-helix	trans	-62.1	-50.9	175	-75.4	175.2	174.2	-173.3	-2.5	111.5	K611 Y612 N613 L617 L618 I619	K611-R615 WeakPolarHBondContact O-CG 3.4Å; K611-R615 PolarHBondContact O-N 2.94Å; K611-R615 VanDerWaalsContact O-N 3.09Å; Y612-R615 WeakPolarHBondContact O-CA 3.37Å; Y612-R615 WeakPolarHBondContact O-CB 3.44Å; Y612-R615 PolarHBondContact O-N 3.48Å; Y612-R615 VanDerWaalsContact O-N 3.08Å; N613-R615 PolarHBondContact O-N 2.81Å; R615-L617 VanDerWaalsContact C-N 3.28Å; R615-L617 PolarHBondContact O-N 3.22Å; R615-L618 PolarHBondContact O-N 3.45Å; R615-I619 VanDerWaalsContact O-CD1 3.3Å; R615-I619 WeakPolarHBondContact O-CD1 3.33Å; R615-I619 VanDerWaalsContact O-CG1 3.24Å; R615-I619 WeakPolarHBondContact O-CG1 3.22Å; R615-I619 PolarHBondContact O-N 3.17Å
616	R	66.3	Low	62.8	Low	95 Å²	95	68.1 Å²	68.1	36%	0.358	32%	0.323	S	S	.	.	H	α-helix	trans	-55.1	-43	176.7	-170.7	176.4	-178	178.5	3	111.3	N12 Y612 N613 I619 L620	N12-R616 PolarHBondContact OD1-NH1 3.47Å; N12-R616 PolarHBondContact OD1-NH2 2.64Å; Y612-R616 PolarHBondContact O-N 3.08Å; N613-R616 PolarHBondContact O-N 3.12Å; R616-I619 PolarHBondContact O-N 3.44Å; R616-L620 HydrophobicContact CG-CD1 4.14Å; R616-L620 WeakPolarHBondContact O-CB 3.27Å; R616-L620 VanDerWaalsContact O-CG 3.29Å; R616-L620 WeakPolarHBondContact O-CG 3.32Å; R616-L620 PolarHBondContact O-N 2.86Å
617	L	67.3	Low	64.7	Low	46 Å²	46	66 Å²	66	24%	0.241	31%	0.312	C	S	.	.	H	α-helix	trans	-71.2	-35.7	-180	-164.3	69	0	0	0	113.2	E566 L567 A570 N613 R614 R615 A621	E566-L617 HydrophobicContact CB-CD1 3.84Å; E566-L617 HydrophobicContact CB-CD2 4.06Å; E566-L617 WeakPolarHBondContact O-CD2 3.49Å; L567-L617 HydrophobicContact CD2-CD1 3.68Å; L567-L617 HydrophobicContact CD2-CG 4.36Å; L567-L617 HydrophobicContact CG-CD1 4.33Å; A570-L617 HydrophobicContact CB-CB 4.27Å; A570-L617 HydrophobicContact CB-CD2 3.86Å; A570-L617 HydrophobicContact CB-CG 3.73Å; N613-L617 WeakPolarHBondContact O-CB 3.38Å; N613-L617 PolarHBondContact O-N 3.13Å; R614-L617 PolarHBondContact O-N 2.93Å; R615-L617 VanDerWaalsContact C-N 3.28Å; R615-L617 PolarHBondContact O-N 3.22Å; L617-A621 VanDerWaalsContact O-CB 3.24Å; L617-A621 WeakPolarHBondContact O-CB 3.48Å; L617-A621 PolarHBondContact O-N 3.45Å
618	L	67.8	Low	66.6	Low	58 Å²	58	64.7 Å²	64.7	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-44.8	171.5	-74.4	166.3	0	0	0	111.9	A570 R614 R615 A621 Q622	A570-L618 HydrophobicContact CB-CD2 4.13Å; A570-L618 HydrophobicContact CB-CG 4.44Å; A570-L618 VanDerWaalsContact O-CD2 3.3Å; A570-L618 WeakPolarHBondContact O-CD2 3.45Å; R614-L618 WeakPolarHBondContact O-CB 3.35Å; R614-L618 WeakPolarHBondContact O-CD1 3.41Å; R614-L618 WeakPolarHBondContact O-CG 3.47Å; R614-L618 PolarHBondContact O-N 3.27Å; R615-L618 PolarHBondContact O-N 3.45Å; L618-A621 PolarHBondContact O-N 3.31Å; L618-Q622 WeakPolarHBondContact O-CB 3.43Å; L618-Q622 PolarHBondContact O-N 3.46Å
619	I	69.4	Low	68	Low	19 Å²	19	61.3 Å²	61.3	10%	0.097	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-50.2	177.2	-67	155.8	0	0	0	110.4	R615 R616 A621 Q622 M623 N698 F699 I702	R615-I619 VanDerWaalsContact O-CD1 3.3Å; R615-I619 WeakPolarHBondContact O-CD1 3.33Å; R615-I619 VanDerWaalsContact O-CG1 3.24Å; R615-I619 WeakPolarHBondContact O-CG1 3.22Å; R615-I619 PolarHBondContact O-N 3.17Å; R616-I619 PolarHBondContact O-N 3.44Å; I619-A621 VanDerWaalsContact C-N 3.27Å; I619-A621 PolarHBondContact O-N 2.9Å; I619-Q622 WeakPolarHBondContact O-CB 3.42Å; I619-Q622 PolarHBondContact O-N 3.02Å; I619-Q622 VanDerWaalsContact O-N 3.17Å; I619-M623 HydrophobicContact CG2-CE 3.68Å; I619-M623 HydrophobicContact CG2-SD 4.48Å; I619-M623 WeakPolarHBondContact O-CG 3.42Å; I619-M623 PolarHBondContact O-N 3.03Å; I619-N698 HydrophobicContact CD1-CB 3.67Å; I619-N698 HydrophobicContact CG1-CB 4.17Å; I619-N698 WeakPolarHBondContact CG2-O 3.36Å; I619-F699 HydrophobicContact CG2-CD2 4.36Å; I619-F699 HydrophobicContact CG2-CE2 4.41Å; I619-I702 HydrophobicContact CG2-CD1 4.01Å
620	L	73.6	Confident	69.7	Low	45 Å²	45	56.7 Å²	56.7	24%	0.236	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-38.2	176	-74.2	166.2	0	0	0	111.7	L567 R616 Q622 M623 E624 I702	L567-L620 HydrophobicContact CD2-CB 3.3Å; L567-L620 HydrophobicContact CD2-CD1 4.42Å; L567-L620 HydrophobicContact CD2-CG 4.48Å; R616-L620 HydrophobicContact CG-CD1 4.14Å; R616-L620 WeakPolarHBondContact O-CB 3.27Å; R616-L620 VanDerWaalsContact O-CG 3.29Å; R616-L620 WeakPolarHBondContact O-CG 3.32Å; R616-L620 PolarHBondContact O-N 2.86Å; L620-Q622 VanDerWaalsContact C-N 3.33Å; L620-M623 HydrophobicContact CD2-SD 4.34Å; L620-M623 WeakPolarHBondContact O-CB 3.33Å; L620-M623 PolarHBondContact O-N 3.49Å; L620-E624 PolarHBondContact O-N 3.3Å; L620-I702 HydrophobicContact CD2-CD1 3.83Å; L620-I702 HydrophobicContact CD2-CG2 4.07Å; L620-I702 HydrophobicContact CG-CD1 4.02Å
621	A	70.4	Confident	71.2	Confident	2 Å²	2	59.8 Å²	59.8	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-70.3	-32.3	178.8	0	0	0	0	0	112.3	L567 S571 L617 L618 I619 E624 R625	L567-A621 HydrophobicContact CB-CB 4Å; L567-A621 HydrophobicContact CD2-CB 4.14Å; L567-A621 VanDerWaalsContact O-CB 3.25Å; L567-A621 WeakPolarHBondContact O-CB 3.47Å; S571-A621 WeakPolarHBondContact OG-CB 3.29Å; L617-A621 VanDerWaalsContact O-CB 3.24Å; L617-A621 WeakPolarHBondContact O-CB 3.48Å; L617-A621 PolarHBondContact O-N 3.45Å; L618-A621 PolarHBondContact O-N 3.31Å; I619-A621 VanDerWaalsContact C-N 3.27Å; I619-A621 PolarHBondContact O-N 2.9Å; A621-E624 PolarHBondContact O-N 3.44Å; A621-R625 WeakPolarHBondContact O-CG 3.44Å; A621-R625 PolarHBondContact O-N 3.33Å; A621-R625 VanDerWaalsContact O-N 3.1Å; A621-R625 PolarHBondContact O-NH1 3.26Å
622	Q	71.9	Confident	72.6	Confident	16 Å²	16	58.3 Å²	58.3	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-43.5	172	-169.9	178.2	6.2	0	0	111.4	L618 I619 L620 E624 R625 M626 E667 S671 F699	L618-Q622 WeakPolarHBondContact O-CB 3.43Å; L618-Q622 PolarHBondContact O-N 3.46Å; I619-Q622 WeakPolarHBondContact O-CB 3.42Å; I619-Q622 PolarHBondContact O-N 3.02Å; I619-Q622 VanDerWaalsContact O-N 3.17Å; L620-Q622 VanDerWaalsContact C-N 3.33Å; Q622-E624 VanDerWaalsContact C-N 3.28Å; Q622-E624 PolarHBondContact O-N 3.1Å; Q622-R625 PolarHBondContact O-N 2.84Å; Q622-M626 HydrophobicContact CG-SD 4.44Å; Q622-M626 WeakPolarHBondContact O-CG 3.32Å; Q622-M626 PolarHBondContact O-N 3.41Å; Q622-E667 PolarHBondContact NE2-O 3.06Å; Q622-S671 VanDerWaalsContact NE2-N 3.15Å; Q622-F699 HydrophobicContact CB-CZ 4.32Å; Q622-F699 HydrophobicContact CG-CZ 3.88Å
623	M	76.8	Confident	73.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-43.9	171.2	-68.3	175.5	178.6	0	0	111.7	I619 L620 M626 F627 F699 I702 L708	I619-M623 HydrophobicContact CG2-CE 3.68Å; I619-M623 HydrophobicContact CG2-SD 4.48Å; I619-M623 WeakPolarHBondContact O-CG 3.42Å; I619-M623 PolarHBondContact O-N 3.03Å; L620-M623 HydrophobicContact CD2-SD 4.34Å; L620-M623 WeakPolarHBondContact O-CB 3.33Å; L620-M623 PolarHBondContact O-N 3.49Å; M623-M626 PolarHBondContact O-N 3.43Å; M623-F627 WeakPolarHBondContact O-CD2 3.41Å; M623-F627 PolarHBondContact O-N 3.02Å; M623-F699 VanDerWaalsContact CE-CA 3.43Å; M623-F699 HydrophobicContact CE-CB 3.92Å; M623-F699 HydrophobicContact CE-CD1 3.66Å; M623-F699 HydrophobicContact CE-CD2 4.3Å; M623-F699 HydrophobicContact CE-CE1 4.22Å; M623-F699 HydrophobicContact CE-CG 3.71Å; M623-F699 WeakPolarHBondContact CE-O 3.42Å; M623-F699 HydrophobicContact CG-CD1 4.01Å; M623-F699 HydrophobicContact CG-CE1 3.73Å; M623-F699 HydrophobicContact CG-CZ 4.3Å; M623-I702 HydrophobicContact CE-CB 4.01Å; M623-I702 HydrophobicContact CE-CD1 3.94Å; M623-I702 HydrophobicContact CE-CG1 4.4Å; M623-I702 HydrophobicContact CE-CG2 4.48Å; M623-I702 HydrophobicContact SD-CB 4.27Å; M623-I702 HydrophobicContact SD-CD1 4.16Å; M623-I702 HydrophobicContact SD-CG2 4.08Å; M623-L708 HydrophobicContact CB-CD2 3.77Å; M623-L708 HydrophobicContact CG-CD2 3.79Å
624	E	77	Confident	74.9	Confident	69 Å²	69	50.7 Å²	50.7	32%	0.322	23%	0.234	S	C	.	.	H	α-helix	trans	-68	-38.7	-178.4	-127.4	64.2	162.7	0	0	112.5	L567 L620 A621 Q622 M626 F627 S628 K704	L567-E624 HydrophobicContact CD1-CG 4.35Å; L620-E624 PolarHBondContact O-N 3.3Å; A621-E624 PolarHBondContact O-N 3.44Å; Q622-E624 VanDerWaalsContact C-N 3.28Å; Q622-E624 PolarHBondContact O-N 3.1Å; E624-M626 VanDerWaalsContact C-N 3.35Å; E624-M626 PolarHBondContact O-N 3.11Å; E624-F627 PolarHBondContact O-N 3.23Å; E624-S628 PolarHBondContact O-N 3.45Å; E624-S628 PolarHBondContact O-OG 3Å; E624-K704 IonicContact OE1-NZ 3.42Å; E624-K704 PolarHBondContact OE1-NZ 2.78Å; E624-K704 IonicContact OE2-NZ 3.73Å; E624-K704 PolarHBondContact OE2-NZ 2.9Å
625	R	76.1	Confident	75.8	Confident	75 Å²	75	49.5 Å²	49.5	28%	0.283	23%	0.233	S	C	.	.	H	α-helix	trans	-60.7	-43.7	170.3	-68.2	-169.8	-51.3	-86.4	1.5	111.6	S571 A621 Q622 S628 I629 E667	S571-R625 PolarHBondContact OG-NH1 3.48Å; A621-R625 WeakPolarHBondContact O-CG 3.44Å; A621-R625 PolarHBondContact O-N 3.33Å; A621-R625 VanDerWaalsContact O-N 3.1Å; A621-R625 PolarHBondContact O-NH1 3.26Å; Q622-R625 PolarHBondContact O-N 2.84Å; R625-S628 PolarHBondContact O-N 3.18Å; R625-I629 WeakPolarHBondContact O-CG1 3.35Å; R625-I629 PolarHBondContact O-N 2.75Å; R625-E667 IonicContact CZ-OE1 3.71Å; R625-E667 IonicContact CZ-OE2 2.77Å; R625-E667 VanDerWaalsContact NE-CD 3.35Å; R625-E667 IonicContact NE-OE1 3.98Å; R625-E667 PolarHBondContact NE-OE1 3.47Å; R625-E667 IonicContact NE-OE2 2.65Å; R625-E667 PolarHBondContact NE-OE2 3.02Å; R625-E667 IonicContact NH2-OE1 2.71Å; R625-E667 IonicContact NH2-OE2 3.19Å; R625-E667 PolarHBondContact NH2-OE2 3.45Å
626	M	80.2	Confident	76.6	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-39.8	178.1	-69.5	171.6	53.7	0	0	112.7	Q622 M623 E624 I629 L630 L664 E667 L668 F699 L708 T712	Q622-M626 HydrophobicContact CG-SD 4.44Å; Q622-M626 WeakPolarHBondContact O-CG 3.32Å; Q622-M626 PolarHBondContact O-N 3.41Å; M623-M626 PolarHBondContact O-N 3.43Å; E624-M626 VanDerWaalsContact C-N 3.35Å; E624-M626 PolarHBondContact O-N 3.11Å; M626-I629 PolarHBondContact O-N 3.11Å; M626-L630 WeakPolarHBondContact O-CG 3.33Å; M626-L630 PolarHBondContact O-N 3.21Å; M626-L664 HydrophobicContact CB-CD1 4.09Å; M626-L664 HydrophobicContact CE-CD1 4.35Å; M626-L664 HydrophobicContact CG-CD1 4.16Å; M626-E667 HydrophobicContact CG-CB 3.68Å; M626-E667 HydrophobicContact CG-CG 4.48Å; M626-E667 HydrophobicContact SD-CB 4.18Å; M626-L668 HydrophobicContact CE-CD2 3.46Å; M626-L668 VanDerWaalsContact CE-CD2 3.46Å; M626-L668 HydrophobicContact CE-CG 3.67Å; M626-F699 HydrophobicContact CE-CE1 4Å; M626-F699 HydrophobicContact SD-CE1 3.6Å; M626-F699 HydrophobicContact SD-CZ 3.86Å; M626-L708 HydrophobicContact CB-CD1 3.98Å; M626-L708 HydrophobicContact CB-CD2 4.01Å; M626-L708 HydrophobicContact CB-CG 4.48Å; M626-L708 HydrophobicContact CE-CD1 4.38Å; M626-L708 HydrophobicContact CE-CD2 3.85Å; M626-L708 HydrophobicContact CE-CG 4.03Å; M626-L708 HydrophobicContact SD-CD2 4.3Å; M626-T712 HydrophobicContact CE-CG2 3.86Å
627	F	82.2	Confident	77.2	Confident	36 Å²	36	37.8 Å²	37.8	16%	0.158	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-42.4	172.4	-90.1	-68.1	0	0	0	111.9	M623 E624 I629 L630 L631 K704 L708 L711	M623-F627 WeakPolarHBondContact O-CD2 3.41Å; M623-F627 PolarHBondContact O-N 3.02Å; E624-F627 PolarHBondContact O-N 3.23Å; F627-I629 VanDerWaalsContact C-N 3.34Å; F627-I629 PolarHBondContact O-N 2.69Å; F627-L630 PolarHBondContact O-N 3.4Å; F627-L631 WeakPolarHBondContact O-CG 3.26Å; F627-L631 PolarHBondContact O-N 2.71Å; F627-K704 HydrophobicContact CD2-CD 4.12Å; F627-K704 HydrophobicContact CE2-CD 3.61Å; F627-K704 VanDerWaalsContact CE2-CE 3.45Å; F627-K704 HydrophobicContact CE2-CG 3.62Å; F627-K704 HydrophobicContact CZ-CD 4.32Å; F627-K704 HydrophobicContact CZ-CG 3.95Å; F627-K704 WeakPolarHBondContact CZ-O 3.47Å; F627-L708 HydrophobicContact CD1-CD1 4.06Å; F627-L708 HydrophobicContact CD2-CB 4.44Å; F627-L708 HydrophobicContact CD2-CD1 3.87Å; F627-L708 HydrophobicContact CD2-CD2 4.21Å; F627-L708 HydrophobicContact CD2-CG 4.4Å; F627-L708 HydrophobicContact CE1-CB 4.38Å; F627-L708 HydrophobicContact CE1-CD1 4.08Å; F627-L708 HydrophobicContact CE2-CB 3.63Å; F627-L708 HydrophobicContact CE2-CD1 3.87Å; F627-L708 HydrophobicContact CE2-CD2 4.06Å; F627-L708 HydrophobicContact CE2-CG 4.07Å; F627-L708 HydrophobicContact CG-CD1 3.95Å; F627-L708 HydrophobicContact CZ-CB 3.6Å; F627-L708 HydrophobicContact CZ-CD1 3.99Å; F627-L708 HydrophobicContact CZ-CG 4.31Å; F627-L711 HydrophobicContact CE1-CD1 4.15Å
628	S	82.3	Confident	77.8	Confident	49 Å²	49	39.9 Å²	39.9	34%	0.343	20%	0.204	S	C	.	.	H	α-helix	trans	-61.3	-41.6	173.6	-62.3	0	0	0	0	112.2	E624 R625 L630 L631 I632	E624-S628 PolarHBondContact O-N 3.45Å; E624-S628 PolarHBondContact O-OG 3Å; R625-S628 PolarHBondContact O-N 3.18Å; S628-L630 VanDerWaalsContact C-N 3.35Å; S628-L630 PolarHBondContact O-N 3.31Å; S628-L631 PolarHBondContact O-N 3.16Å; S628-I632 WeakPolarHBondContact O-CD1 3.46Å; S628-I632 VanDerWaalsContact O-CG1 3.26Å; S628-I632 WeakPolarHBondContact O-CG1 3.28Å; S628-I632 PolarHBondContact O-N 3.22Å
629	I	81.6	Confident	78.2	Confident	16 Å²	16	38.8 Å²	38.8	8%	0.082	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-40.2	176.4	-66.7	162.4	0	0	0	111.2	R625 M626 F627 I632 L633 L660 Q663 L664 E667	R625-I629 WeakPolarHBondContact O-CG1 3.35Å; R625-I629 PolarHBondContact O-N 2.75Å; M626-I629 PolarHBondContact O-N 3.11Å; F627-I629 VanDerWaalsContact C-N 3.34Å; F627-I629 PolarHBondContact O-N 2.69Å; I629-I632 PolarHBondContact O-N 3.26Å; I629-L633 HydrophobicContact CG2-CD1 3.97Å; I629-L633 HydrophobicContact CG2-CG 4.44Å; I629-L633 WeakPolarHBondContact O-CB 3.39Å; I629-L633 WeakPolarHBondContact O-CG 3.46Å; I629-L633 PolarHBondContact O-N 2.98Å; I629-L660 HydrophobicContact CG2-CB 4.49Å; I629-L660 HydrophobicContact CG2-CD2 4.4Å; I629-Q663 HydrophobicContact CD1-CB 4.36Å; I629-L664 HydrophobicContact CB-CD1 4.44Å; I629-L664 HydrophobicContact CG2-CB 3.95Å; I629-L664 HydrophobicContact CG2-CD1 4.19Å; I629-E667 HydrophobicContact CD1-CG 4.14Å
630	L	83	Confident	78.7	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-63.6	-46.9	176.1	-73.8	176.2	0	0	0	112.8	M626 F627 S628 I632 L633 D634 L664 L708 L711 T712 H715	M626-L630 WeakPolarHBondContact O-CG 3.33Å; M626-L630 PolarHBondContact O-N 3.21Å; F627-L630 PolarHBondContact O-N 3.4Å; S628-L630 VanDerWaalsContact C-N 3.35Å; S628-L630 PolarHBondContact O-N 3.31Å; L630-I632 VanDerWaalsContact C-N 3.26Å; L630-I632 PolarHBondContact O-N 2.87Å; L630-L633 HydrophobicContact CD2-CD1 4.47Å; L630-L633 CarbonylContact O-C 3.5Å; L630-L633 WeakPolarHBondContact O-CA 3.45Å; L630-L633 WeakPolarHBondContact O-CB 3.44Å; L630-L633 PolarHBondContact O-N 2.9Å; L630-D634 PolarHBondContact O-N 3.44Å; L630-L664 HydrophobicContact CD2-CD2 3.82Å; L630-L664 HydrophobicContact CG-CD1 4.47Å; L630-L708 HydrophobicContact CD1-CD1 3.53Å; L630-L711 HydrophobicContact CD1-CB 3.79Å; L630-T712 HydrophobicContact CD1-CG2 3.99Å; L630-T712 HydrophobicContact CD2-CG2 4.29Å; L630-T712 HydrophobicContact CG-CG2 4.43Å; L630-H715 WeakPolarHBondContact CD2-CD2 3.3Å
631	L	81.6	Confident	78.9	Confident	121 Å²	121	43.5 Å²	43.5	63%	0.634	22%	0.219	S	C	*	.	H	α-helix	trans	-60	-38.1	178.6	-69	169.4	0	0	0	112	F627 S628 D634 E635	F627-L631 WeakPolarHBondContact O-CG 3.26Å; F627-L631 PolarHBondContact O-N 2.71Å; S628-L631 PolarHBondContact O-N 3.16Å; L631-D634 PolarHBondContact O-N 2.9Å; L631-E635 PolarHBondContact O-N 3.12Å
632	I	79.5	Confident	79.1	Confident	42 Å²	42	52.8 Å²	52.8	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-70.2	-38.5	174	-60.1	165	0	0	0	110.8	S628 I629 L630 D634 E635 V636 Y656 L660	S628-I632 WeakPolarHBondContact O-CD1 3.46Å; S628-I632 VanDerWaalsContact O-CG1 3.26Å; S628-I632 WeakPolarHBondContact O-CG1 3.28Å; S628-I632 PolarHBondContact O-N 3.22Å; I629-I632 PolarHBondContact O-N 3.26Å; L630-I632 VanDerWaalsContact C-N 3.26Å; L630-I632 PolarHBondContact O-N 2.87Å; I632-D634 VanDerWaalsContact C-N 3.32Å; I632-D634 PolarHBondContact O-N 3.37Å; I632-E635 PolarHBondContact O-N 2.9Å; I632-V636 HydrophobicContact CG2-CG2 4.3Å; I632-V636 WeakPolarHBondContact O-CB 3.35Å; I632-V636 VanDerWaalsContact O-CG2 3.24Å; I632-V636 WeakPolarHBondContact O-CG2 2.96Å; I632-V636 PolarHBondContact O-N 3.46Å; I632-Y656 HydrophobicContact CG2-CE1 4.13Å; I632-L660 HydrophobicContact CB-CD1 4.44Å; I632-L660 HydrophobicContact CG2-CD1 3.61Å; I632-L660 HydrophobicContact CG2-CD2 4.2Å
633	L	83.3	Confident	78.9	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-36.8	174.1	-80.9	168.5	0	0	0	112.5	I629 L630 S637 Q657 L660 I661 L664 H715	I629-L633 HydrophobicContact CG2-CD1 3.97Å; I629-L633 HydrophobicContact CG2-CG 4.44Å; I629-L633 WeakPolarHBondContact O-CB 3.39Å; I629-L633 WeakPolarHBondContact O-CG 3.46Å; I629-L633 PolarHBondContact O-N 2.98Å; L630-L633 HydrophobicContact CD2-CD1 4.47Å; L630-L633 CarbonylContact O-C 3.5Å; L630-L633 WeakPolarHBondContact O-CA 3.45Å; L630-L633 WeakPolarHBondContact O-CB 3.44Å; L630-L633 PolarHBondContact O-N 2.9Å; L633-S637 VanDerWaalsContact O-CB 3.22Å; L633-S637 WeakPolarHBondContact O-CB 3.29Å; L633-S637 PolarHBondContact O-N 2.9Å; L633-S637 PolarHBondContact O-OG 3.46Å; L633-Q657 HydrophobicContact CD2-CG 3.91Å; L633-L660 HydrophobicContact CD1-CB 4.46Å; L633-L660 HydrophobicContact CD2-CB 3.53Å; L633-L660 HydrophobicContact CD2-CD1 4.1Å; L633-L660 HydrophobicContact CD2-CG 4.49Å; L633-L660 HydrophobicContact CG-CB 3.88Å; L633-L660 HydrophobicContact CG-CD1 4.33Å; L633-I661 HydrophobicContact CD1-CG1 4.41Å; L633-I661 HydrophobicContact CD2-CG1 3.93Å; L633-L664 HydrophobicContact CD1-CD2 4.04Å; L633-H715 HydrophobicContact CD1-CB 4.2Å
634	D	80	Confident	78	Confident	74 Å²	74	60.2 Å²	60.2	40%	0.396	30%	0.3	S	S	.	.	H	α-helix	trans	-69.1	-44.4	173.6	-80.7	-36.1	0	0	0	111.9	L630 L631 I632 V636 S637 L638 H715	L630-D634 PolarHBondContact O-N 3.44Å; L631-D634 PolarHBondContact O-N 2.9Å; I632-D634 VanDerWaalsContact C-N 3.32Å; I632-D634 PolarHBondContact O-N 3.37Å; D634-V636 PolarHBondContact O-N 3.15Å; D634-S637 CarbonylContact O-C 3.48Å; D634-S637 PolarHBondContact O-N 2.96Å; D634-S637 VanDerWaalsContact O-N 3.16Å; D634-L638 WeakPolarHBondContact O-CB 3.36Å; D634-L638 WeakPolarHBondContact O-CG 3.42Å; D634-L638 PolarHBondContact O-N 2.91Å; D634-H715 IonicContact OD1-CE1 2.71Å; D634-H715 PolarHBondContact OD1-CE1 3.28Å; D634-H715 IonicContact OD1-NE2 2.72Å
635	E	78.6	Confident	77	Confident	90 Å²	90	61.7 Å²	61.7	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-42.2	174.9	-174.2	174.7	-147.2	0	0	112.1	V442 L631 I632 S637 L638 S639	V442-E635 VanDerWaalsContact CG1-OE2 3.29Å; V442-E635 WeakPolarHBondContact CG1-OE2 3.32Å; L631-E635 PolarHBondContact O-N 3.12Å; I632-E635 PolarHBondContact O-N 2.9Å; E635-S637 VanDerWaalsContact C-N 3.34Å; E635-L638 PolarHBondContact O-N 3.42Å; E635-S639 VanDerWaalsContact O-CB 3.32Å; E635-S639 WeakPolarHBondContact O-CB 3.13Å; E635-S639 PolarHBondContact O-N 2.9Å; E635-S639 PolarHBondContact O-OG 3.3Å
636	V	80.2	Confident	76.2	Confident	8 Å²	8	67.1 Å²	67.1	5%	0.048	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-39	173.2	170	0	0	0	0	111	I632 D634 S639 L640 L653 Y656 Q657 L660	I632-V636 HydrophobicContact CG2-CG2 4.3Å; I632-V636 WeakPolarHBondContact O-CB 3.35Å; I632-V636 VanDerWaalsContact O-CG2 3.24Å; I632-V636 WeakPolarHBondContact O-CG2 2.96Å; I632-V636 PolarHBondContact O-N 3.46Å; D634-V636 PolarHBondContact O-N 3.15Å; V636-S639 WeakPolarHBondContact O-CB 3.47Å; V636-S639 PolarHBondContact O-N 2.81Å; V636-L640 HydrophobicContact CG1-CD1 3.95Å; V636-L640 HydrophobicContact CG1-CG 4.48Å; V636-L640 WeakPolarHBondContact O-CB 3.5Å; V636-L640 WeakPolarHBondContact O-CG 3.48Å; V636-L640 PolarHBondContact O-N 3.24Å; V636-L653 HydrophobicContact CG1-CD2 4.45Å; V636-Y656 HydrophobicContact CG2-CD1 3.74Å; V636-Y656 HydrophobicContact CG2-CE1 3.78Å; V636-Q657 HydrophobicContact CG1-CB 3.87Å; V636-Q657 HydrophobicContact CG1-CG 4.22Å; V636-L660 HydrophobicContact CG2-CD1 4.14Å
637	S	79	Confident	75.4	Confident	22 Å²	22	71.8 Å²	71.8	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-69.3	-36.7	177.3	-61.6	0	0	0	0	112.6	L633 D634 E635 K641 Q657	L633-S637 VanDerWaalsContact O-CB 3.22Å; L633-S637 WeakPolarHBondContact O-CB 3.29Å; L633-S637 PolarHBondContact O-N 2.9Å; L633-S637 PolarHBondContact O-OG 3.46Å; D634-S637 CarbonylContact O-C 3.48Å; D634-S637 PolarHBondContact O-N 2.96Å; D634-S637 VanDerWaalsContact O-N 3.16Å; E635-S637 VanDerWaalsContact C-N 3.34Å; S637-K641 VanDerWaalsContact O-CG 3.28Å; S637-K641 WeakPolarHBondContact O-CG 3.34Å; S637-K641 PolarHBondContact O-N 2.86Å; S637-K641 VanDerWaalsContact O-N 3.14Å; S637-Q657 PolarHBondContact OG-NE2 2.85Å
638	L	79.4	Confident	75.1	Confident	90 Å²	90	75.5 Å²	75.5	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-66.3	-39.7	170.1	-72.7	167.5	0	0	0	111.3	D634 E635 K641 R642	D634-L638 WeakPolarHBondContact O-CB 3.36Å; D634-L638 WeakPolarHBondContact O-CG 3.42Å; D634-L638 PolarHBondContact O-N 2.91Å; E635-L638 PolarHBondContact O-N 3.42Å; L638-K641 WeakPolarHBondContact O-CB 3.29Å; L638-K641 PolarHBondContact O-N 2.86Å; L638-R642 WeakPolarHBondContact O-CG 3.34Å; L638-R642 PolarHBondContact O-N 3.27Å
639	S	77.2	Confident	74.5	Confident	34 Å²	34	75.4 Å²	75.4	24%	0.238	39%	0.391	C	S	.	.	H	α-helix	trans	-65.2	-43.8	176.3	-60.7	0	0	0	0	111.6	E635 V636 K641 R642 V643	E635-S639 VanDerWaalsContact O-CB 3.32Å; E635-S639 WeakPolarHBondContact O-CB 3.13Å; E635-S639 PolarHBondContact O-N 2.9Å; E635-S639 PolarHBondContact O-OG 3.3Å; V636-S639 WeakPolarHBondContact O-CB 3.47Å; V636-S639 PolarHBondContact O-N 2.81Å; S639-K641 VanDerWaalsContact C-N 3.26Å; S639-K641 PolarHBondContact O-N 3.45Å; S639-R642 CarbonylContact O-C 3.47Å; S639-R642 PolarHBondContact O-N 3.06Å; S639-V643 WeakPolarHBondContact O-CG2 3.41Å; S639-V643 PolarHBondContact O-N 2.76Å
640	L	79	Confident	74.2	Confident	7 Å²	7	76.7 Å²	76.7	4%	0.037	39%	0.394	C	S	.	.	H	α-helix	trans	-65	-24.6	174.3	-75.9	167.3	0	0	0	113.8	V636 R650 L653 L654 Q657	V636-L640 HydrophobicContact CG1-CD1 3.95Å; V636-L640 HydrophobicContact CG1-CG 4.48Å; V636-L640 WeakPolarHBondContact O-CB 3.5Å; V636-L640 WeakPolarHBondContact O-CG 3.48Å; V636-L640 PolarHBondContact O-N 3.24Å; L640-R650 HydrophobicContact CD2-CG 4.07Å; L640-R650 PolarHBondContact O-NH1 3Å; L640-L653 HydrophobicContact CD2-CB 3.64Å; L640-L653 HydrophobicContact CD2-CD1 4.36Å; L640-L653 HydrophobicContact CG-CB 4.07Å; L640-L654 HydrophobicContact CD1-CD2 3.91Å; L640-L654 HydrophobicContact CD2-CD2 4.07Å; L640-L654 HydrophobicContact CD2-CG 3.95Å; L640-Q657 HydrophobicContact CD1-CB 4.46Å; L640-Q657 VanDerWaalsContact CD1-OE1 3.32Å
641	K	77.8	Confident	73.8	Confident	156 Å²	156	79.5 Å²	79.5	68%	0.678	41%	0.414	S	S	*	.	H	α-helix	trans	-75.9	-34.4	168.8	-71.4	165	-176.3	172.6	0	112.2	S637 L638 S639	S637-K641 VanDerWaalsContact O-CG 3.28Å; S637-K641 WeakPolarHBondContact O-CG 3.34Å; S637-K641 PolarHBondContact O-N 2.86Å; S637-K641 VanDerWaalsContact O-N 3.14Å; L638-K641 WeakPolarHBondContact O-CB 3.29Å; L638-K641 PolarHBondContact O-N 2.86Å; S639-K641 VanDerWaalsContact C-N 3.26Å; S639-K641 PolarHBondContact O-N 3.45Å
642	R	75	Confident	73.7	Confident	198 Å²	198	79.8 Å²	79.8	75%	0.747	41%	0.407	S	S	*	.	H	α-helix	trans	-76.2	-31.4	176.5	-70.3	173.5	180	173.4	0.9	113.5	L638 S639 V644	L638-R642 WeakPolarHBondContact O-CG 3.34Å; L638-R642 PolarHBondContact O-N 3.27Å; S639-R642 CarbonylContact O-C 3.47Å; S639-R642 PolarHBondContact O-N 3.06Å; R642-V644 VanDerWaalsContact C-N 3.35Å; R642-V644 PolarHBondContact O-N 2.81Å
643	V	67.1	Low	73.7	Confident	40 Å²	40	79.8 Å²	79.8	24%	0.242	41%	0.407	C	S	.	.			trans	-78.8	81.5	178.7	179.5	0	0	0	0	110.6	S639 V645 R650 L653	S639-V643 WeakPolarHBondContact O-CG2 3.41Å; S639-V643 PolarHBondContact O-N 2.76Å; V643-V645 VanDerWaalsContact C-N 3.33Å; V643-V645 WeakPolarHBondContact CG1-O 3.43Å; V643-V645 PolarHBondContact O-N 2.92Å; V643-R650 HydrophobicContact CG1-CB 3.91Å; V643-R650 HydrophobicContact CG1-CG 4.3Å; V643-R650 PolarHBondContact O-NH1 3.14Å; V643-L653 HydrophobicContact CG2-CD1 4.18Å
644	V	57.6	Low	73.6	Confident	132 Å²	132	82.8 Å²	82.8	80%	0.8	42%	0.423	S	S	*	.			trans	-64.4	-33.2	-179.7	179.7	0	0	0	0	112.7	R642	R642-V644 VanDerWaalsContact C-N 3.35Å; R642-V644 PolarHBondContact O-N 2.81Å
645	V	55.4	Low	73.7	Confident	100 Å²	100	84.8 Å²	84.8	61%	0.606	43%	0.434	S	S	*	.	S	Bend	trans	-87.7	137.6	-175	-176.1	0	0	0	0	111.3	V643 N647	V643-V645 VanDerWaalsContact C-N 3.33Å; V643-V645 WeakPolarHBondContact CG1-O 3.43Å; V643-V645 PolarHBondContact O-N 2.92Å; V645-N647 HydrophobicContact CG1-CB 4.49Å; V645-N647 PolarHBondContact O-N 3.37Å; V645-N647 VanDerWaalsContact O-N 3.11Å
646	Q	59.7	Low	74	Confident	188 Å²	188	85.7 Å²	85.7	88%	0.879	43%	0.434	S	S	*	.			trans	-68.8	104.6	164.7	-69.7	-173.7	-1	0	0	109.3
647	N	64.8	Low	74.2	Confident	99 Å²	99	87.2 Å²	87.2	53%	0.529	44%	0.441	S	S	.	.			trans	-141.6	157.9	-176.3	-171.4	-7.4	0	0	0	108	V645 A649 R650 S651	V645-N647 HydrophobicContact CG1-CB 4.49Å; V645-N647 PolarHBondContact O-N 3.37Å; V645-N647 VanDerWaalsContact O-N 3.11Å; N647-A649 PolarHBondContact O-N 3.47Å; N647-A649 VanDerWaalsContact O-N 3.07Å; N647-R650 WeakPolarHBondContact O-CA 3.39Å; N647-R650 VanDerWaalsContact O-CB 3.25Å; N647-R650 WeakPolarHBondContact O-CB 3.44Å; N647-R650 PolarHBondContact O-N 3.2Å; N647-S651 PolarHBondContact O-N 3.05Å
648	D	73.9	Confident	74.3	Confident	114 Å²	114	89.4 Å²	89.4	61%	0.61	45%	0.449	S	S	*	.	H	α-helix	trans	-54.7	-31.5	-179.5	-73.1	-17.6	0	0	0	112.6	R650 S651 R652	D648-R650 VanDerWaalsContact C-N 3.28Å; D648-R650 PolarHBondContact O-N 3.3Å; D648-S651 PolarHBondContact O-N 2.83Å; D648-R652 WeakPolarHBondContact O-CG 3.35Å; D648-R652 PolarHBondContact O-N 2.92Å
649	A	70	Confident	74.5	Confident	47 Å²	47	89.4 Å²	89.4	39%	0.388	45%	0.446	S	S	.	.	H	α-helix	trans	-57.8	-37.4	172.4	0	0	0	0	0	113	N647 L653	N647-A649 PolarHBondContact O-N 3.47Å; N647-A649 VanDerWaalsContact O-N 3.07Å; A649-L653 WeakPolarHBondContact O-CB 3.31Å; A649-L653 VanDerWaalsContact O-CG 3.27Å; A649-L653 WeakPolarHBondContact O-CG 3.32Å; A649-L653 PolarHBondContact O-N 3.34Å
650	R	75.2	Confident	74.7	Confident	43 Å²	43	88 Å²	88	16%	0.162	44%	0.436	C	S	.	.	H	α-helix	trans	-68.2	-40.8	176.5	-168.6	177	173.9	81	9.2	111.2	L640 V643 N647 D648 L653 L654	L640-R650 HydrophobicContact CD2-CG 4.07Å; L640-R650 PolarHBondContact O-NH1 3Å; V643-R650 HydrophobicContact CG1-CB 3.91Å; V643-R650 HydrophobicContact CG1-CG 4.3Å; V643-R650 PolarHBondContact O-NH1 3.14Å; N647-R650 WeakPolarHBondContact O-CA 3.39Å; N647-R650 VanDerWaalsContact O-CB 3.25Å; N647-R650 WeakPolarHBondContact O-CB 3.44Å; N647-R650 PolarHBondContact O-N 3.2Å; D648-R650 VanDerWaalsContact C-N 3.28Å; D648-R650 PolarHBondContact O-N 3.3Å; R650-L653 PolarHBondContact O-N 3.24Å; R650-L654 WeakPolarHBondContact O-CG 3.44Å; R650-L654 PolarHBondContact O-N 3.28Å
651	S	75.7	Confident	74.9	Confident	64 Å²	64	88.7 Å²	88.7	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-62.9	-50.6	174.4	-51.4	0	0	0	0	111	N647 D648 L653 L654 D655	N647-S651 PolarHBondContact O-N 3.05Å; D648-S651 PolarHBondContact O-N 2.83Å; S651-L653 VanDerWaalsContact C-N 3.28Å; S651-L653 PolarHBondContact O-N 3.16Å; S651-L654 PolarHBondContact O-N 3.23Å; S651-D655 PolarHBondContact O-N 3.19Å
652	R	78.3	Confident	75	Confident	127 Å²	127	83.5 Å²	83.5	48%	0.479	42%	0.419	S	S	.	.	H	α-helix	trans	-57.3	-37.8	176.1	-68.5	175.9	-174.7	-146.5	3.9	112.6	L493 S494 D648 Y656	L493-R652 PolarHBondContact O-NH1 3.42Å; L493-R652 VanDerWaalsContact O-NH1 3.14Å; S494-R652 PolarHBondContact O-NH2 2.92Å; D648-R652 WeakPolarHBondContact O-CG 3.35Å; D648-R652 PolarHBondContact O-N 2.92Å; R652-Y656 VanDerWaalsContact O-CB 3.31Å; R652-Y656 WeakPolarHBondContact O-CB 3.25Å; R652-Y656 PolarHBondContact O-N 3.14Å
653	L	80	Confident	75.3	Confident	42 Å²	42	77.6 Å²	77.6	22%	0.22	40%	0.4	C	S	.	.	H	α-helix	trans	-70	-35.7	175.5	-77.7	169.6	0	0	0	112.9	V636 L640 V643 A649 R650 S651 Q657	V636-L653 HydrophobicContact CG1-CD2 4.45Å; L640-L653 HydrophobicContact CD2-CB 3.64Å; L640-L653 HydrophobicContact CD2-CD1 4.36Å; L640-L653 HydrophobicContact CG-CB 4.07Å; V643-L653 HydrophobicContact CG2-CD1 4.18Å; A649-L653 WeakPolarHBondContact O-CB 3.31Å; A649-L653 VanDerWaalsContact O-CG 3.27Å; A649-L653 WeakPolarHBondContact O-CG 3.32Å; A649-L653 PolarHBondContact O-N 3.34Å; R650-L653 PolarHBondContact O-N 3.24Å; S651-L653 VanDerWaalsContact C-N 3.28Å; S651-L653 PolarHBondContact O-N 3.16Å; L653-Q657 WeakPolarHBondContact O-CB 3.46Å; L653-Q657 PolarHBondContact O-N 3.37Å
654	L	81.9	Confident	76	Confident	64 Å²	64	75.7 Å²	75.7	34%	0.335	39%	0.388	S	S	.	.	H	α-helix	trans	-69.5	-41.7	174	-71.4	167.1	0	0	0	111.6	L321 L640 R650 S651 Y656 Q657 Q658	L321-L654 HydrophobicContact CD1-CD2 4.27Å; L640-L654 HydrophobicContact CD1-CD2 3.91Å; L640-L654 HydrophobicContact CD2-CD2 4.07Å; L640-L654 HydrophobicContact CD2-CG 3.95Å; R650-L654 WeakPolarHBondContact O-CG 3.44Å; R650-L654 PolarHBondContact O-N 3.28Å; S651-L654 PolarHBondContact O-N 3.23Å; L654-Y656 VanDerWaalsContact C-N 3.32Å; L654-Y656 PolarHBondContact O-N 3.48Å; L654-Q657 PolarHBondContact O-N 3.43Å; L654-Q658 PolarHBondContact O-N 3.35Å
655	D	82.7	Confident	77	Confident	115 Å²	115	69.6 Å²	69.6	62%	0.615	35%	0.351	S	S	*	.	H	α-helix	trans	-60.3	-43.5	173.7	-66.1	-32.5	0	0	0	110.9	S651 Q658 E659	S651-D655 PolarHBondContact O-N 3.19Å; D655-Q658 PolarHBondContact O-N 3.46Å; D655-E659 PolarHBondContact O-N 3.07Å
656	Y	84	Confident	77.9	Confident	109 Å²	109	67.3 Å²	67.3	43%	0.427	34%	0.34	S	S	.	.	H	α-helix	trans	-67.5	-39.7	176.5	-175.8	-124	0	0	0	112.6	I632 V636 R652 L654 Q658 E659 L660	I632-Y656 HydrophobicContact CG2-CE1 4.13Å; V636-Y656 HydrophobicContact CG2-CD1 3.74Å; V636-Y656 HydrophobicContact CG2-CE1 3.78Å; R652-Y656 VanDerWaalsContact O-CB 3.31Å; R652-Y656 WeakPolarHBondContact O-CB 3.25Å; R652-Y656 PolarHBondContact O-N 3.14Å; L654-Y656 VanDerWaalsContact C-N 3.32Å; L654-Y656 PolarHBondContact O-N 3.48Å; Y656-Q658 VanDerWaalsContact C-N 3.33Å; Y656-Q658 PolarHBondContact O-N 3.34Å; Y656-E659 PolarHBondContact O-N 3.34Å; Y656-L660 HydrophobicContact CD1-CD1 3.93Å; Y656-L660 HydrophobicContact CD2-CG 4.49Å; Y656-L660 HydrophobicContact CE1-CD1 3.62Å; Y656-L660 HydrophobicContact CE1-CG 4.36Å; Y656-L660 HydrophobicContact CE2-CD1 4.32Å; Y656-L660 HydrophobicContact CE2-CD2 4.4Å; Y656-L660 HydrophobicContact CE2-CG 4.18Å; Y656-L660 HydrophobicContact CG-CD1 4.41Å; Y656-L660 WeakPolarHBondContact O-CG 3.41Å; Y656-L660 PolarHBondContact O-N 3.44Å
657	Q	84.3	Confident	78.6	Confident	41 Å²	41	59.8 Å²	59.8	19%	0.192	30%	0.304	C	S	.	.	H	α-helix	trans	-59.4	-44	172.8	-168.5	-177.1	27.9	0	0	111.1	L633 V636 S637 L640 L653 L654 L660 I661	L633-Q657 HydrophobicContact CD2-CG 3.91Å; V636-Q657 HydrophobicContact CG1-CB 3.87Å; V636-Q657 HydrophobicContact CG1-CG 4.22Å; S637-Q657 PolarHBondContact OG-NE2 2.85Å; L640-Q657 HydrophobicContact CD1-CB 4.46Å; L640-Q657 VanDerWaalsContact CD1-OE1 3.32Å; L653-Q657 WeakPolarHBondContact O-CB 3.46Å; L653-Q657 PolarHBondContact O-N 3.37Å; L654-Q657 PolarHBondContact O-N 3.43Å; Q657-L660 PolarHBondContact O-N 3.04Å; Q657-I661 HydrophobicContact CG-CD1 4.17Å; Q657-I661 VanDerWaalsContact O-CG1 3.3Å; Q657-I661 WeakPolarHBondContact O-CG1 3.49Å; Q657-I661 PolarHBondContact O-N 3.33Å
658	Q	81.4	Confident	79	Confident	68 Å²	68	55.3 Å²	55.3	32%	0.318	28%	0.28	S	S	.	.	H	α-helix	trans	-66.3	-38.6	178.1	-174.4	57.8	59.6	0	0	112	L654 D655 Y656 I661 N662	L654-Q658 PolarHBondContact O-N 3.35Å; D655-Q658 PolarHBondContact O-N 3.46Å; Y656-Q658 VanDerWaalsContact C-N 3.33Å; Y656-Q658 PolarHBondContact O-N 3.34Å; Q658-I661 PolarHBondContact O-N 3Å; Q658-N662 PolarHBondContact NE2-OD1 2.75Å; Q658-N662 PolarHBondContact O-N 2.95Å; Q658-N662 PolarHBondContact O-ND2 3.3Å; Q658-N662 PolarHBondContact O-OD1 3.49Å
659	E	82.7	Confident	78.5	Confident	90 Å²	90	50.2 Å²	50.2	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-66.6	-39.7	174.8	178.4	54.1	-160	0	0	112.2	D655 Y656 N662 Q663	D655-E659 PolarHBondContact O-N 3.07Å; Y656-E659 PolarHBondContact O-N 3.34Å; E659-N662 WeakPolarHBondContact O-CB 3.49Å; E659-N662 PolarHBondContact O-N 2.63Å; E659-Q663 VanDerWaalsContact O-CG 3.32Å; E659-Q663 WeakPolarHBondContact O-CG 3.37Å; E659-Q663 PolarHBondContact O-N 3.34Å; E659-Q663 PolarHBondContact OE1-NE2 3.47Å
660	L	82.9	Confident	78.2	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-40.3	172.1	-72.9	168.3	0	0	0	112.3	I629 I632 L633 V636 Y656 Q657 Q663 L664	I629-L660 HydrophobicContact CG2-CB 4.49Å; I629-L660 HydrophobicContact CG2-CD2 4.4Å; I632-L660 HydrophobicContact CB-CD1 4.44Å; I632-L660 HydrophobicContact CG2-CD1 3.61Å; I632-L660 HydrophobicContact CG2-CD2 4.2Å; L633-L660 HydrophobicContact CD1-CB 4.46Å; L633-L660 HydrophobicContact CD2-CB 3.53Å; L633-L660 HydrophobicContact CD2-CD1 4.1Å; L633-L660 HydrophobicContact CD2-CG 4.49Å; L633-L660 HydrophobicContact CG-CB 3.88Å; L633-L660 HydrophobicContact CG-CD1 4.33Å; V636-L660 HydrophobicContact CG2-CD1 4.14Å; Y656-L660 HydrophobicContact CD1-CD1 3.93Å; Y656-L660 HydrophobicContact CD2-CG 4.49Å; Y656-L660 HydrophobicContact CE1-CD1 3.62Å; Y656-L660 HydrophobicContact CE1-CG 4.36Å; Y656-L660 HydrophobicContact CE2-CD1 4.32Å; Y656-L660 HydrophobicContact CE2-CD2 4.4Å; Y656-L660 HydrophobicContact CE2-CG 4.18Å; Y656-L660 HydrophobicContact CG-CD1 4.41Å; Y656-L660 WeakPolarHBondContact O-CG 3.41Å; Y656-L660 PolarHBondContact O-N 3.44Å; Q657-L660 PolarHBondContact O-N 3.04Å; L660-Q663 PolarHBondContact O-N 2.8Å; L660-L664 WeakPolarHBondContact O-CB 3.31Å; L660-L664 PolarHBondContact O-N 2.65Å
661	I	83.5	Confident	77.1	Confident	20 Å²	20	51.1 Å²	51.1	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-42.6	172.9	-71	167	0	0	0	110.6	L633 Q657 Q658 Q663 L664 I665 P717	L633-I661 HydrophobicContact CD1-CG1 4.41Å; L633-I661 HydrophobicContact CD2-CG1 3.93Å; Q657-I661 HydrophobicContact CG-CD1 4.17Å; Q657-I661 VanDerWaalsContact O-CG1 3.3Å; Q657-I661 WeakPolarHBondContact O-CG1 3.49Å; Q657-I661 PolarHBondContact O-N 3.33Å; Q658-I661 PolarHBondContact O-N 3Å; I661-Q663 VanDerWaalsContact C-N 3.31Å; I661-Q663 PolarHBondContact O-N 3.16Å; I661-L664 PolarHBondContact O-N 2.89Å; I661-I665 HydrophobicContact CG2-CD1 3.77Å; I661-I665 HydrophobicContact CG2-CG1 4.49Å; I661-I665 WeakPolarHBondContact O-CB 3.48Å; I661-I665 WeakPolarHBondContact O-CD1 3.24Å; I661-I665 VanDerWaalsContact O-CG1 3.26Å; I661-I665 WeakPolarHBondContact O-CG1 3.13Å; I661-I665 PolarHBondContact O-N 2.85Å; I661-P717 HydrophobicContact CG2-CG 4.18Å
662	N	79.8	Confident	75.9	Confident	47 Å²	47	49.2 Å²	49.2	25%	0.251	24%	0.24	S	C	.	.	H	α-helix	trans	-62.1	-38.2	175.6	-63.5	-22.9	0	0	0	111.8	Q658 E659 S666	Q658-N662 PolarHBondContact NE2-OD1 2.75Å; Q658-N662 PolarHBondContact O-N 2.95Å; Q658-N662 PolarHBondContact O-ND2 3.3Å; Q658-N662 PolarHBondContact O-OD1 3.49Å; E659-N662 WeakPolarHBondContact O-CB 3.49Å; E659-N662 PolarHBondContact O-N 2.63Å; N662-S666 WeakPolarHBondContact O-CB 3.39Å; N662-S666 PolarHBondContact O-N 3.27Å; N662-S666 PolarHBondContact O-OG 2.96Å
663	Q	80.9	Confident	74.2	Confident	74 Å²	74	45.2 Å²	45.2	35%	0.346	23%	0.231	S	C	.	.	H	α-helix	trans	-69.7	-41.1	175.8	-71.2	175.4	24.8	0	0	111.7	I629 E659 L660 I661 S666 E667	I629-Q663 HydrophobicContact CD1-CB 4.36Å; E659-Q663 VanDerWaalsContact O-CG 3.32Å; E659-Q663 WeakPolarHBondContact O-CG 3.37Å; E659-Q663 PolarHBondContact O-N 3.34Å; E659-Q663 PolarHBondContact OE1-NE2 3.47Å; L660-Q663 PolarHBondContact O-N 2.8Å; I661-Q663 VanDerWaalsContact C-N 3.31Å; I661-Q663 PolarHBondContact O-N 3.16Å; Q663-S666 WeakPolarHBondContact O-CB 3.36Å; Q663-S666 PolarHBondContact O-N 3.41Å; Q663-S666 VanDerWaalsContact O-N 3.15Å; Q663-E667 PolarHBondContact O-N 2.7Å
664	L	82.4	Confident	72.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-44.5	174.1	-171.8	65.2	0	0	0	111.8	M626 I629 L630 L633 L660 I661 S666 E667 L668 T712 H715	M626-L664 HydrophobicContact CB-CD1 4.09Å; M626-L664 HydrophobicContact CE-CD1 4.35Å; M626-L664 HydrophobicContact CG-CD1 4.16Å; I629-L664 HydrophobicContact CB-CD1 4.44Å; I629-L664 HydrophobicContact CG2-CB 3.95Å; I629-L664 HydrophobicContact CG2-CD1 4.19Å; L630-L664 HydrophobicContact CD2-CD2 3.82Å; L630-L664 HydrophobicContact CG-CD1 4.47Å; L633-L664 HydrophobicContact CD1-CD2 4.04Å; L660-L664 WeakPolarHBondContact O-CB 3.31Å; L660-L664 PolarHBondContact O-N 2.65Å; I661-L664 PolarHBondContact O-N 2.89Å; L664-S666 VanDerWaalsContact C-N 3.3Å; L664-S666 PolarHBondContact O-N 2.76Å; L664-E667 PolarHBondContact O-N 3.37Å; L664-L668 HydrophobicContact CG-CD1 4.26Å; L664-L668 VanDerWaalsContact O-CB 3.31Å; L664-L668 WeakPolarHBondContact O-CB 3.24Å; L664-L668 WeakPolarHBondContact O-CG 3.36Å; L664-L668 PolarHBondContact O-N 3.33Å; L664-T712 HydrophobicContact CD1-CG2 3.96Å; L664-T712 HydrophobicContact CD2-CG2 4.11Å; L664-T712 HydrophobicContact CG-CG2 4.31Å; L664-H715 HydrophobicContact CD2-CB 4.47Å
665	I	78.6	Confident	70.2	Confident	5 Å²	5	52.7 Å²	52.7	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-41.3	173	-70.6	162.9	0	0	0	110.8	I661 L669 F685 L716 P717 I720	I661-I665 HydrophobicContact CG2-CD1 3.77Å; I661-I665 HydrophobicContact CG2-CG1 4.49Å; I661-I665 WeakPolarHBondContact O-CB 3.48Å; I661-I665 WeakPolarHBondContact O-CD1 3.24Å; I661-I665 VanDerWaalsContact O-CG1 3.26Å; I661-I665 WeakPolarHBondContact O-CG1 3.13Å; I661-I665 PolarHBondContact O-N 2.85Å; I665-L669 HydrophobicContact CG2-CD1 3.61Å; I665-L669 WeakPolarHBondContact O-CB 3.33Å; I665-L669 WeakPolarHBondContact O-CD1 3.43Å; I665-L669 VanDerWaalsContact O-CG 3.29Å; I665-L669 WeakPolarHBondContact O-CG 3.09Å; I665-L669 PolarHBondContact O-N 2.87Å; I665-F685 HydrophobicContact CG2-CE1 4.5Å; I665-L716 HydrophobicContact CD1-CD2 4.14Å; I665-L716 HydrophobicContact CG1-CD2 3.44Å; I665-L716 VanDerWaalsContact CG1-CD2 3.44Å; I665-P717 HydrophobicContact CD1-CG 4.36Å; I665-I720 HydrophobicContact CD1-CD1 3.66Å; I665-I720 HydrophobicContact CG1-CD1 4.23Å
666	S	74	Confident	67.8	Low	51 Å²	51	50.7 Å²	50.7	36%	0.357	27%	0.27	S	S	.	.	H	α-helix	trans	-65.2	-47.4	179	-58.9	0	0	0	0	112.1	N662 Q663 L664 L669 Q670	N662-S666 WeakPolarHBondContact O-CB 3.39Å; N662-S666 PolarHBondContact O-N 3.27Å; N662-S666 PolarHBondContact O-OG 2.96Å; Q663-S666 WeakPolarHBondContact O-CB 3.36Å; Q663-S666 PolarHBondContact O-N 3.41Å; Q663-S666 VanDerWaalsContact O-N 3.15Å; L664-S666 VanDerWaalsContact C-N 3.3Å; L664-S666 PolarHBondContact O-N 2.76Å; S666-L669 PolarHBondContact O-N 3.16Å; S666-Q670 WeakPolarHBondContact O-CB 3.33Å; S666-Q670 PolarHBondContact O-N 2.86Å
667	E	73.6	Confident	65.4	Low	30 Å²	30	53.7 Å²	53.7	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-64.6	-42	176.3	-71.3	-79.8	-176.2	0	0	111.5	Q622 R625 M626 I629 Q663 L664 L669 Q670	Q622-E667 PolarHBondContact NE2-O 3.06Å; R625-E667 IonicContact CZ-OE1 3.71Å; R625-E667 IonicContact CZ-OE2 2.77Å; R625-E667 VanDerWaalsContact NE-CD 3.35Å; R625-E667 IonicContact NE-OE1 3.98Å; R625-E667 PolarHBondContact NE-OE1 3.47Å; R625-E667 IonicContact NE-OE2 2.65Å; R625-E667 PolarHBondContact NE-OE2 3.02Å; R625-E667 IonicContact NH2-OE1 2.71Å; R625-E667 IonicContact NH2-OE2 3.19Å; R625-E667 PolarHBondContact NH2-OE2 3.45Å; M626-E667 HydrophobicContact CG-CB 3.68Å; M626-E667 HydrophobicContact CG-CG 4.48Å; M626-E667 HydrophobicContact SD-CB 4.18Å; I629-E667 HydrophobicContact CD1-CG 4.14Å; Q663-E667 PolarHBondContact O-N 2.7Å; L664-E667 PolarHBondContact O-N 3.37Å; E667-L669 VanDerWaalsContact C-N 3.32Å; E667-L669 PolarHBondContact O-N 2.61Å; E667-Q670 PolarHBondContact O-N 3.29Å
668	L	72.4	Confident	63	Low	5 Å²	5	58.6 Å²	58.6	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-55.8	-45.7	172.7	-85.5	165.2	0	0	0	111.8	M626 L664 S671 L716	M626-L668 HydrophobicContact CE-CD2 3.46Å; M626-L668 VanDerWaalsContact CE-CD2 3.46Å; M626-L668 HydrophobicContact CE-CG 3.67Å; L664-L668 HydrophobicContact CG-CD1 4.26Å; L664-L668 VanDerWaalsContact O-CB 3.31Å; L664-L668 WeakPolarHBondContact O-CB 3.24Å; L664-L668 WeakPolarHBondContact O-CG 3.36Å; L664-L668 PolarHBondContact O-N 3.33Å; L668-S671 PolarHBondContact O-OG 3.11Å; L668-L716 HydrophobicContact CD1-CD1 3.98Å; L668-L716 HydrophobicContact CD1-CD2 4.06Å; L668-L716 HydrophobicContact CD1-CG 4.42Å
669	L	64.3	Low	60.8	Low	8 Å²	8	59.3 Å²	59.3	4%	0.042	33%	0.33	C	S	.	.	H	α-helix	trans	-78.9	-29.2	-176.1	-74.7	165.8	0	0	0	113.5	I665 S666 E667 S671 S672 S673 F684 V688 F693	I665-L669 HydrophobicContact CG2-CD1 3.61Å; I665-L669 WeakPolarHBondContact O-CB 3.33Å; I665-L669 WeakPolarHBondContact O-CD1 3.43Å; I665-L669 VanDerWaalsContact O-CG 3.29Å; I665-L669 WeakPolarHBondContact O-CG 3.09Å; I665-L669 PolarHBondContact O-N 2.87Å; S666-L669 PolarHBondContact O-N 3.16Å; E667-L669 VanDerWaalsContact C-N 3.32Å; E667-L669 PolarHBondContact O-N 2.61Å; L669-S671 PolarHBondContact O-N 3.04Å; L669-S671 VanDerWaalsContact O-N 3.11Å; L669-S672 WeakPolarHBondContact O-CA 3.22Å; L669-S672 WeakPolarHBondContact O-CB 3.32Å; L669-S672 PolarHBondContact O-N 2.86Å; L669-S672 PolarHBondContact O-OG 3.39Å; L669-S673 PolarHBondContact O-N 3.02Å; L669-S673 PolarHBondContact O-OG 3.18Å; L669-F684 HydrophobicContact CB-CE1 4.47Å; L669-F684 HydrophobicContact CB-CE2 3.93Å; L669-F684 HydrophobicContact CB-CZ 3.53Å; L669-F684 HydrophobicContact CD1-CD1 4.42Å; L669-F684 HydrophobicContact CD1-CE1 3.54Å; L669-F684 HydrophobicContact CD1-CE2 4.21Å; L669-F684 HydrophobicContact CD1-CZ 3.43Å; L669-F684 VanDerWaalsContact CD1-CZ 3.43Å; L669-F684 HydrophobicContact CG-CZ 4.13Å; L669-V688 HydrophobicContact CD1-CG2 3.34Å; L669-V688 HydrophobicContact CD2-CG2 3.98Å; L669-V688 HydrophobicContact CG-CG2 4.32Å; L669-F693 HydrophobicContact CD2-CD1 3.75Å; L669-F693 HydrophobicContact CD2-CE1 3.79Å
670	Q	62.8	Low	59.1	Low	94 Å²	94	57.6 Å²	57.6	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-18.8	175.3	-162	167.5	23.6	0	0	112.6	S666 E667 I674	S666-Q670 WeakPolarHBondContact O-CB 3.33Å; S666-Q670 PolarHBondContact O-N 2.86Å; E667-Q670 PolarHBondContact O-N 3.29Å; Q670-I674 WeakPolarHBondContact O-CG1 3.48Å
671	S	53.6	Low	57.5	Low	14 Å²	14	65.8 Å²	65.8	10%	0.098	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-28.6	169.4	75.2	0	0	0	0	113.9	Q622 L668 L669 P696	Q622-S671 VanDerWaalsContact NE2-N 3.15Å; L668-S671 PolarHBondContact O-OG 3.11Å; L669-S671 PolarHBondContact O-N 3.04Å; L669-S671 VanDerWaalsContact O-N 3.11Å; S671-P696 VanDerWaalsContact OG-CB 3.22Å; S671-P696 WeakPolarHBondContact OG-CB 3.42Å; S671-P696 WeakPolarHBondContact OG-CG 3.45Å
672	S	49.7	Very low	55.7	Low	25 Å²	25	71.1 Å²	71.1	18%	0.175	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-23.7	-176.4	70.1	0	0	0	0	113.5	L669 S694	L669-S672 WeakPolarHBondContact O-CA 3.22Å; L669-S672 WeakPolarHBondContact O-CB 3.32Å; L669-S672 PolarHBondContact O-N 2.86Å; L669-S672 PolarHBondContact O-OG 3.39Å; S672-S694 WeakPolarHBondContact CB-OG 3.09Å
673	S	42.6	Very low	54.1	Low	43 Å²	43	73.7 Å²	73.7	30%	0.301	40%	0.399	S	S	.	.			trans	-105.9	20.2	-169.4	61.4	0	0	0	0	115.4	L669 T675 S676	L669-S673 PolarHBondContact O-N 3.02Å; L669-S673 PolarHBondContact O-OG 3.18Å; S673-T675 PolarHBondContact O-N 3.2Å; S673-S676 PolarHBondContact O-N 2.73Å
674	I	41.2	Very low	52.5	Low	131 Å²	131	72.5 Å²	72.5	67%	0.672	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-5.4	175.9	-60	177	0	0	0	112.4	Q670	Q670-I674 WeakPolarHBondContact O-CG1 3.48Å
675	T	36.8	Very low	51	Low	131 Å²	131	76.5 Å²	76.5	80%	0.804	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	2.3	-172.3	52.3	0	0	0	0	116.1	S673	S673-T675 PolarHBondContact O-N 3.2Å
676	S	32.8	Very low	49.6	Very low	73 Å²	73	81.4 Å²	81.4	51%	0.51	43%	0.431	S	S	.	.			trans	-148.2	119.1	178.9	63.9	0	0	0	0	115	S673	S673-S676 PolarHBondContact O-N 2.73Å
677	E	32.4	Very low	48.2	Very low	173 Å²	173	81.2 Å²	81.2	81%	0.808	43%	0.43	S	S	*	.			trans	-72.1	155	175.1	-59.3	175.5	130.1	0	0	112.7
678	T	33.8	Very low	47.1	Very low	143 Å²	143	80.3 Å²	80.3	88%	0.877	43%	0.426	S	S	*	.			trans	54.2	61.4	160	55.5	0	0	0	0	117.5
679	T	36.4	Very low	45.9	Very low	83 Å²	83	85.7 Å²	85.7	51%	0.509	45%	0.451	S	S	.	.			trans	-106	141.1	156.4	37.2	0	0	0	0	111	E683	T679-E683 HydrophobicContact CG2-CB 4.22Å
680	S	47.5	Very low	44.9	Very low	54 Å²	54	91.2 Å²	91.2	38%	0.378	48%	0.481	S	S	.	.			trans	-70.7	160.7	177.1	66.2	0	0	0	0	111.8	E682 E683 F684	S680-E682 PolarHBondContact O-N 2.9Å; S680-E682 VanDerWaalsContact O-N 3.11Å; S680-E683 VanDerWaalsContact CB-OE2 3.23Å; S680-E683 WeakPolarHBondContact CB-OE2 3.37Å; S680-E683 PolarHBondContact N-OE2 3.06Å; S680-E683 PolarHBondContact O-N 3.39Å; S680-E683 WeakPolarHBondContact OG-CG 3.3Å; S680-E683 PolarHBondContact OG-N 2.86Å; S680-E683 PolarHBondContact OG-OE2 2.96Å; S680-F684 WeakPolarHBondContact O-CB 3.02Å; S680-F684 PolarHBondContact O-N 2.66Å
681	K	48.6	Very low	44	Very low	178 Å²	178	88.9 Å²	88.9	77%	0.774	48%	0.482	S	S	*	.	H	α-helix	trans	-54.4	-32	175.2	-76.9	-165.5	174.4	-167.7	0	113	F685	K681-F685 VanDerWaalsContact O-CD2 3.28Å; K681-F685 WeakPolarHBondContact O-CD2 3.42Å; K681-F685 PolarHBondContact O-N 3.41Å
682	E	46	Very low	43.3	Very low	132 Å²	132	94.5 Å²	94.5	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-74.2	-39.5	176.3	-67.9	-167.7	-166.8	0	0	113.1	S680 F684 K686	S680-E682 PolarHBondContact O-N 2.9Å; S680-E682 VanDerWaalsContact O-N 3.11Å; E682-F684 VanDerWaalsContact C-N 3.33Å; E682-K686 WeakPolarHBondContact O-CB 3.4Å; E682-K686 WeakPolarHBondContact O-CD 3.26Å; E682-K686 VanDerWaalsContact O-CG 3.23Å; E682-K686 WeakPolarHBondContact O-CG 3.5Å; E682-K686 PolarHBondContact O-N 2.77Å; E682-K686 IonicContact OE2-NZ 3.87Å; E682-K686 PolarHBondContact OE2-NZ 3.32Å; E682-K686 VanDerWaalsContact OE2-NZ 3.08Å
683	E	46.7	Very low	43.3	Very low	101 Å²	101	94 Å²	94	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-69.1	-35	175.4	-71.4	160.1	133.4	0	0	111.3	T679 S680 K686 S687	T679-E683 HydrophobicContact CG2-CB 4.22Å; S680-E683 VanDerWaalsContact CB-OE2 3.23Å; S680-E683 WeakPolarHBondContact CB-OE2 3.37Å; S680-E683 PolarHBondContact N-OE2 3.06Å; S680-E683 PolarHBondContact O-N 3.39Å; S680-E683 WeakPolarHBondContact OG-CG 3.3Å; S680-E683 PolarHBondContact OG-N 2.86Å; S680-E683 PolarHBondContact OG-OE2 2.96Å; E683-K686 CarbonylContact O-C 3.59Å; E683-K686 PolarHBondContact O-N 3.41Å; E683-S687 WeakPolarHBondContact O-CB 3.4Å; E683-S687 PolarHBondContact O-N 3.47Å
684	F	45.8	Very low	43.7	Very low	49 Å²	49	95 Å²	95	22%	0.215	51%	0.512	C	S	.	.	H	α-helix	trans	-57.4	-55	171.7	-176	-98.9	0	0	0	111	L669 S680 E682 K686 S687 V688	L669-F684 HydrophobicContact CB-CE1 4.47Å; L669-F684 HydrophobicContact CB-CE2 3.93Å; L669-F684 HydrophobicContact CB-CZ 3.53Å; L669-F684 HydrophobicContact CD1-CD1 4.42Å; L669-F684 HydrophobicContact CD1-CE1 3.54Å; L669-F684 HydrophobicContact CD1-CE2 4.21Å; L669-F684 HydrophobicContact CD1-CZ 3.43Å; L669-F684 VanDerWaalsContact CD1-CZ 3.43Å; L669-F684 HydrophobicContact CG-CZ 4.13Å; S680-F684 WeakPolarHBondContact O-CB 3.02Å; S680-F684 PolarHBondContact O-N 2.66Å; E682-F684 VanDerWaalsContact C-N 3.33Å; F684-K686 VanDerWaalsContact C-N 3.33Å; F684-K686 PolarHBondContact O-N 3.17Å; F684-S687 PolarHBondContact O-N 3.37Å; F684-V688 VanDerWaalsContact O-CG2 3.27Å; F684-V688 WeakPolarHBondContact O-CG2 3.23Å; F684-V688 PolarHBondContact O-N 3.49Å
685	F	50.4	Low	44.5	Very low	84 Å²	84	89.2 Å²	89.2	37%	0.368	48%	0.482	S	S	.	.	H	α-helix	trans	-65	-32.2	175.9	-80.4	-66.2	0	0	0	113.4	I665 K681 V688 E689	I665-F685 HydrophobicContact CG2-CE1 4.5Å; K681-F685 VanDerWaalsContact O-CD2 3.28Å; K681-F685 WeakPolarHBondContact O-CD2 3.42Å; K681-F685 PolarHBondContact O-N 3.41Å; F685-V688 WeakPolarHBondContact O-CB 3.36Å; F685-V688 PolarHBondContact O-N 2.9Å; F685-E689 PolarHBondContact O-N 2.95Å
686	K	49.7	Very low	45.7	Very low	107 Å²	107	83.6 Å²	83.6	47%	0.465	45%	0.448	S	S	.	.	H	α-helix	trans	-69.2	-35.1	172.7	-72.9	161.5	-172.5	154.6	0	112.4	E682 E683 F684 V688 E689 N690	E682-K686 WeakPolarHBondContact O-CB 3.4Å; E682-K686 WeakPolarHBondContact O-CD 3.26Å; E682-K686 VanDerWaalsContact O-CG 3.23Å; E682-K686 WeakPolarHBondContact O-CG 3.5Å; E682-K686 PolarHBondContact O-N 2.77Å; E682-K686 IonicContact OE2-NZ 3.87Å; E682-K686 PolarHBondContact OE2-NZ 3.32Å; E682-K686 VanDerWaalsContact OE2-NZ 3.08Å; E683-K686 CarbonylContact O-C 3.59Å; E683-K686 PolarHBondContact O-N 3.41Å; F684-K686 VanDerWaalsContact C-N 3.33Å; F684-K686 PolarHBondContact O-N 3.17Å; K686-V688 VanDerWaalsContact C-N 3.34Å; K686-E689 PolarHBondContact O-N 3.17Å; K686-N690 VanDerWaalsContact O-CB 3.24Å; K686-N690 WeakPolarHBondContact O-CB 3.27Å; K686-N690 PolarHBondContact O-N 3.49Å; K686-N690 PolarHBondContact O-ND2 2.9Å; K686-N690 PolarHBondContact O-OD1 2.92Å
687	S	45.1	Very low	47.2	Very low	48 Å²	48	84.3 Å²	84.3	34%	0.336	44%	0.443	S	S	.	.	H	α-helix	trans	-67.4	-37.1	174.4	-157.7	0	0	0	0	111.6	E683 F684 N690 G691 L692	E683-S687 WeakPolarHBondContact O-CB 3.4Å; E683-S687 PolarHBondContact O-N 3.47Å; F684-S687 PolarHBondContact O-N 3.37Å; S687-N690 PolarHBondContact O-N 2.94Å; S687-G691 PolarHBondContact O-N 3.39Å; S687-L692 PolarHBondContact O-N 3.26Å
688	V	50.4	Low	48.6	Very low	10 Å²	10	80 Å²	80	6%	0.061	43%	0.426	C	S	.	.	H	α-helix	trans	-64.2	-38.6	171.1	168	0	0	0	0	112.1	L669 F684 F685 K686 F693 I720	L669-V688 HydrophobicContact CD1-CG2 3.34Å; L669-V688 HydrophobicContact CD2-CG2 3.98Å; L669-V688 HydrophobicContact CG-CG2 4.32Å; F684-V688 VanDerWaalsContact O-CG2 3.27Å; F684-V688 WeakPolarHBondContact O-CG2 3.23Å; F684-V688 PolarHBondContact O-N 3.49Å; F685-V688 WeakPolarHBondContact O-CB 3.36Å; F685-V688 PolarHBondContact O-N 2.9Å; K686-V688 VanDerWaalsContact C-N 3.34Å; V688-F693 HydrophobicContact CB-CE1 4.37Å; V688-F693 HydrophobicContact CB-CZ 4.07Å; V688-F693 HydrophobicContact CG1-CE1 4.1Å; V688-F693 HydrophobicContact CG1-CZ 3.72Å; V688-F693 HydrophobicContact CG2-CE1 4.2Å; V688-F693 HydrophobicContact CG2-CZ 4.4Å; V688-F693 WeakPolarHBondContact O-CE2 3.28Å; V688-F693 WeakPolarHBondContact O-CZ 3.09Å; V688-I720 HydrophobicContact CG1-CD1 4.28Å; V688-I720 HydrophobicContact CG1-CG1 4.26Å
689	E	47.2	Very low	50.4	Low	119 Å²	119	73.6 Å²	73.6	56%	0.556	39%	0.385	S	S	*	.	H	α-helix	trans	-75.1	-29.1	171.6	-69.8	-160.7	123.1	0	0	113	F685 K686 G691 K719	F685-E689 PolarHBondContact O-N 2.95Å; K686-E689 PolarHBondContact O-N 3.17Å; E689-G691 VanDerWaalsContact C-N 3.28Å; E689-G691 PolarHBondContact O-N 2.95Å; E689-K719 IonicContact OE1-NZ 3.37Å; E689-K719 PolarHBondContact OE1-NZ 3.37Å
690	N	44.2	Very low	52	Low	124 Å²	124	69.7 Å²	69.7	66%	0.663	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	2.3	178.8	-70.3	-18.9	0	0	0	114.5	K686 S687 L692	K686-N690 VanDerWaalsContact O-CB 3.24Å; K686-N690 WeakPolarHBondContact O-CB 3.27Å; K686-N690 PolarHBondContact O-N 3.49Å; K686-N690 PolarHBondContact O-ND2 2.9Å; K686-N690 PolarHBondContact O-OD1 2.92Å; S687-N690 PolarHBondContact O-N 2.94Å; N690-L692 PolarHBondContact O-N 2.88Å
691	G	42.8	Very low	53	Low	44 Å²	44	70.9 Å²	70.9	45%	0.454	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	11.1	170.8	0	0	0	0	0	116.3	S687 E689 F693	S687-G691 PolarHBondContact O-N 3.39Å; E689-G691 VanDerWaalsContact C-N 3.28Å; E689-G691 PolarHBondContact O-N 2.95Å; G691-F693 PolarHBondContact O-N 3.24Å
692	L	38.4	Very low	54.1	Low	133 Å²	133	63.7 Å²	63.7	70%	0.696	34%	0.339	S	S	*	.			trans	-79.6	52.8	-178.4	-72.1	171.8	0	0	0	113	S687 N690	S687-L692 PolarHBondContact O-N 3.26Å; N690-L692 PolarHBondContact O-N 2.88Å
693	F	50.3	Low	55.3	Low	15 Å²	15	60.8 Å²	60.8	7%	0.066	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-97.1	120.5	174.9	-50.9	-99.7	0	0	0	110.6	L669 V688 G691 N723 Y724 K727	L669-F693 HydrophobicContact CD2-CD1 3.75Å; L669-F693 HydrophobicContact CD2-CE1 3.79Å; V688-F693 HydrophobicContact CB-CE1 4.37Å; V688-F693 HydrophobicContact CB-CZ 4.07Å; V688-F693 HydrophobicContact CG1-CE1 4.1Å; V688-F693 HydrophobicContact CG1-CZ 3.72Å; V688-F693 HydrophobicContact CG2-CE1 4.2Å; V688-F693 HydrophobicContact CG2-CZ 4.4Å; V688-F693 WeakPolarHBondContact O-CE2 3.28Å; V688-F693 WeakPolarHBondContact O-CZ 3.09Å; G691-F693 PolarHBondContact O-N 3.24Å; F693-N723 HydrophobicContact CD2-CB 4.48Å; F693-N723 HydrophobicContact CE2-CB 3.86Å; F693-N723 HydrophobicContact CZ-CB 4.26Å; F693-Y724 HydrophobicContact CD1-CE2 4.16Å; F693-Y724 AromaticContact CE1-CE2 3.95Å; F693-Y724 HydrophobicContact CE1-CE2 3.95Å; F693-K727 WeakPolarHBondContact O-CE 3.32Å
694	S	51.1	Low	56.6	Low	64 Å²	64	59.7 Å²	59.7	45%	0.448	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-76.6	130.6	149.9	47	0	0	0	0	108.1	S672	S672-S694 WeakPolarHBondContact CB-OG 3.09Å
695	L	58.3	Low	58.1	Low	9 Å²	9	57.4 Å²	57.4	5%	0.047	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-66.4	126.1	164.1	-169.1	71.2	0	0	0	106.4	E697 F700 Y724 K727 L735	L695-E697 PolarHBondContact O-N 2.92Å; L695-F700 HydrophobicContact CD1-CE2 3.57Å; L695-F700 HydrophobicContact CD1-CZ 3.9Å; L695-F700 HydrophobicContact CD2-CD2 4.12Å; L695-F700 HydrophobicContact CD2-CE2 3.76Å; L695-F700 HydrophobicContact CD2-CZ 4.2Å; L695-F700 HydrophobicContact CG-CD2 4.02Å; L695-F700 HydrophobicContact CG-CE2 3.45Å; L695-F700 VanDerWaalsContact CG-CE2 3.45Å; L695-F700 HydrophobicContact CG-CZ 4.16Å; L695-Y724 HydrophobicContact CD1-CD1 4.41Å; L695-K727 HydrophobicContact CB-CG 4.29Å; L695-L735 HydrophobicContact CD2-CD1 3.82Å; L695-L735 HydrophobicContact CD2-CD2 3.89Å; L695-L735 HydrophobicContact CD2-CG 4.16Å
696	P	62.4	Low	59.2	Low	13 Å²	13	53.7 Å²	53.7	8%	0.084	29%	0.293	C	S	.	.			trans	-74.7	91.7	-174.3	29.4	-35.3	0	0	0	109.7	S671 N698 F699 F700	S671-P696 VanDerWaalsContact OG-CB 3.22Å; S671-P696 WeakPolarHBondContact OG-CB 3.42Å; S671-P696 WeakPolarHBondContact OG-CG 3.45Å; P696-N698 PolarHBondContact O-N 3.44Å; P696-F699 HydrophobicContact CB-CD2 3.89Å; P696-F699 HydrophobicContact CB-CG 4.5Å; P696-F699 HydrophobicContact CG-CB 4.21Å; P696-F699 HydrophobicContact CG-CD2 3.99Å; P696-F699 HydrophobicContact CG-CG 4.18Å; P696-F699 WeakPolarHBondContact O-CB 3.3Å; P696-F699 PolarHBondContact O-N 2.92Å; P696-F700 WeakPolarHBondContact O-CD2 3.46Å
697	E	62.7	Low	60.6	Low	87 Å²	87	53.3 Å²	53.3	41%	0.407	29%	0.289	S	S	.	.	H	α-helix	trans	-49.9	-34.9	-179.4	-63.9	171.7	168.2	0	0	111.5	L695 F699 F700 S701 R734 L738	L695-E697 PolarHBondContact O-N 2.92Å; E697-F699 VanDerWaalsContact C-N 3.26Å; E697-F699 PolarHBondContact O-N 2.97Å; E697-F700 PolarHBondContact O-N 3.21Å; E697-F700 VanDerWaalsContact O-N 3.09Å; E697-S701 PolarHBondContact O-N 3.46Å; E697-R734 WeakPolarHBondContact OE1-CD 3.19Å; E697-R734 IonicContact OE1-CZ 2.76Å; E697-R734 IonicContact OE1-NH1 3.38Å; E697-R734 PolarHBondContact OE1-NH1 2.85Å; E697-L738 HydrophobicContact CB-CD1 4.41Å
698	N	63.1	Low	62.3	Low	83 Å²	83	51 Å²	51	44%	0.444	27%	0.273	S	S	.	.	H	α-helix	trans	-52.7	-28.2	170.1	-75.1	-26.4	0	0	0	116.4	I619 P696 S701	I619-N698 HydrophobicContact CD1-CB 3.67Å; I619-N698 HydrophobicContact CG1-CB 4.17Å; I619-N698 WeakPolarHBondContact CG2-O 3.36Å; P696-N698 PolarHBondContact O-N 3.44Å; N698-S701 PolarHBondContact O-OG 3.1Å; N698-S701 VanDerWaalsContact O-OG 3.09Å
699	F	70.6	Confident	63.8	Low	8 Å²	8	51 Å²	51	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-81.7	-34.3	176.7	-87.8	-116.1	0	0	0	111.9	I619 Q622 M623 M626 P696 E697 I702 G705 L708	I619-F699 HydrophobicContact CG2-CD2 4.36Å; I619-F699 HydrophobicContact CG2-CE2 4.41Å; Q622-F699 HydrophobicContact CB-CZ 4.32Å; Q622-F699 HydrophobicContact CG-CZ 3.88Å; M623-F699 VanDerWaalsContact CE-CA 3.43Å; M623-F699 HydrophobicContact CE-CB 3.92Å; M623-F699 HydrophobicContact CE-CD1 3.66Å; M623-F699 HydrophobicContact CE-CD2 4.3Å; M623-F699 HydrophobicContact CE-CE1 4.22Å; M623-F699 HydrophobicContact CE-CG 3.71Å; M623-F699 WeakPolarHBondContact CE-O 3.42Å; M623-F699 HydrophobicContact CG-CD1 4.01Å; M623-F699 HydrophobicContact CG-CE1 3.73Å; M623-F699 HydrophobicContact CG-CZ 4.3Å; M626-F699 HydrophobicContact CE-CE1 4Å; M626-F699 HydrophobicContact SD-CE1 3.6Å; M626-F699 HydrophobicContact SD-CZ 3.86Å; P696-F699 HydrophobicContact CB-CD2 3.89Å; P696-F699 HydrophobicContact CB-CG 4.5Å; P696-F699 HydrophobicContact CG-CB 4.21Å; P696-F699 HydrophobicContact CG-CD2 3.99Å; P696-F699 HydrophobicContact CG-CG 4.18Å; P696-F699 WeakPolarHBondContact O-CB 3.3Å; P696-F699 PolarHBondContact O-N 2.92Å; E697-F699 VanDerWaalsContact C-N 3.26Å; E697-F699 PolarHBondContact O-N 2.97Å; F699-I702 PolarHBondContact O-N 2.99Å; F699-G705 WeakPolarHBondContact O-CA 3.37Å; F699-L708 HydrophobicContact CD1-CD2 4.28Å; F699-L708 HydrophobicContact CE1-CD2 3.99Å
700	F	70.6	Confident	65.3	Low	1 Å²	1	45.4 Å²	45.4	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-82.4	-17.4	-174.6	-70.1	-75.1	0	0	0	112.6	L695 P696 E697 I702 M706 W709 L735 W739	L695-F700 HydrophobicContact CD1-CE2 3.57Å; L695-F700 HydrophobicContact CD1-CZ 3.9Å; L695-F700 HydrophobicContact CD2-CD2 4.12Å; L695-F700 HydrophobicContact CD2-CE2 3.76Å; L695-F700 HydrophobicContact CD2-CZ 4.2Å; L695-F700 HydrophobicContact CG-CD2 4.02Å; L695-F700 HydrophobicContact CG-CE2 3.45Å; L695-F700 VanDerWaalsContact CG-CE2 3.45Å; L695-F700 HydrophobicContact CG-CZ 4.16Å; P696-F700 WeakPolarHBondContact O-CD2 3.46Å; E697-F700 PolarHBondContact O-N 3.21Å; E697-F700 VanDerWaalsContact O-N 3.09Å; F700-I702 PolarHBondContact O-N 2.64Å; F700-M706 HydrophobicContact CD1-CG 4.44Å; F700-W709 HydrophobicContact CE1-CB 3.97Å; F700-W709 AromaticContact CE1-CD2 3.92Å; F700-W709 HydrophobicContact CE1-CD2 3.92Å; F700-W709 HydrophobicContact CE1-CE3 4.19Å; F700-W709 AromaticContact CE1-CG 3.85Å; F700-W709 HydrophobicContact CE1-CG 3.85Å; F700-W709 HydrophobicContact CZ-CB 3.95Å; F700-W709 AromaticContact CZ-CD1 3.63Å; F700-W709 AromaticContact CZ-CD2 3.68Å; F700-W709 HydrophobicContact CZ-CD2 3.68Å; F700-W709 AromaticContact CZ-CE2 3.88Å; F700-W709 HydrophobicContact CZ-CE3 4.36Å; F700-W709 AromaticContact CZ-CG 3.47Å; F700-W709 HydrophobicContact CZ-CG 3.47Å; F700-W709 VanDerWaalsContact CZ-CG 3.47Å; F700-W709 AromaticContact CZ-NE1 3.86Å; F700-L735 HydrophobicContact CB-CD2 3.91Å; F700-L735 HydrophobicContact CD1-CD2 4.23Å; F700-L735 HydrophobicContact CD2-CD2 4.22Å; F700-L735 HydrophobicContact CG-CD2 3.83Å; F700-W739 HydrophobicContact CB-CH2 4.24Å; F700-W739 HydrophobicContact CB-CZ2 3.56Å; F700-W739 AromaticContact CD1-CH2 3.54Å; F700-W739 HydrophobicContact CD1-CH2 3.54Å; F700-W739 AromaticContact CD1-CZ2 3.55Å; F700-W739 HydrophobicContact CD1-CZ2 3.55Å; F700-W739 HydrophobicContact CE1-CH2 4.32Å; F700-W739 HydrophobicContact CG-CH2 4.23Å; F700-W739 AromaticContact CG-CZ2 3.99Å; F700-W739 HydrophobicContact CG-CZ2 3.99Å; F700-W739 PolarHBondContact O-NE1 3.43Å
701	S	68.3	Low	67.1	Low	79 Å²	79	42.7 Å²	42.7	55%	0.552	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-1.2	168.1	61.6	0	0	0	0	114.8	E697 N698	E697-S701 PolarHBondContact O-N 3.46Å; N698-S701 PolarHBondContact O-OG 3.1Å; N698-S701 VanDerWaalsContact O-OG 3.09Å
702	I	71.4	Confident	68.9	Low	27 Å²	27	40.6 Å²	40.6	14%	0.138	21%	0.209	C	C	.	.	S	Bend	trans	-127.8	121.8	-179.9	-57.7	174.2	0	0	0	108.6	I619 L620 M623 F699 F700 K704 G705 M706	I619-I702 HydrophobicContact CG2-CD1 4.01Å; L620-I702 HydrophobicContact CD2-CD1 3.83Å; L620-I702 HydrophobicContact CD2-CG2 4.07Å; L620-I702 HydrophobicContact CG-CD1 4.02Å; M623-I702 HydrophobicContact CE-CB 4.01Å; M623-I702 HydrophobicContact CE-CD1 3.94Å; M623-I702 HydrophobicContact CE-CG1 4.4Å; M623-I702 HydrophobicContact CE-CG2 4.48Å; M623-I702 HydrophobicContact SD-CB 4.27Å; M623-I702 HydrophobicContact SD-CD1 4.16Å; M623-I702 HydrophobicContact SD-CG2 4.08Å; F699-I702 PolarHBondContact O-N 2.99Å; F700-I702 PolarHBondContact O-N 2.64Å; I702-K704 HydrophobicContact CG2-CB 4.19Å; I702-K704 PolarHBondContact O-N 3.46Å; I702-K704 VanDerWaalsContact O-N 3.14Å; I702-G705 WeakPolarHBondContact O-CA 3.39Å; I702-G705 PolarHBondContact O-N 2.94Å; I702-M706 PolarHBondContact O-N 3.47Å; I702-M706 VanDerWaalsContact O-N 3.14Å
703	H	72	Confident	71	Confident	71 Å²	71	34.3 Å²	34.3	33%	0.329	18%	0.177	S	C	.	.	H	α-helix	trans	-54.7	-36.4	-178.2	-177.9	-170.5	0	0	0	113.1	G705 M706 R707	H703-G705 VanDerWaalsContact C-N 3.3Å; H703-G705 PolarHBondContact O-N 3.35Å; H703-M706 WeakPolarHBondContact O-CB 3.26Å; H703-M706 PolarHBondContact O-N 3.36Å; H703-R707 PolarHBondContact CE1-NH2 3.38Å; H703-R707 PolarHBondContact NE2-NE 2.97Å; H703-R707 PolarHBondContact NE2-NH2 2.71Å; H703-R707 VanDerWaalsContact NE2-NH2 3.14Å; H703-R707 PolarHBondContact O-N 2.99Å
704	K	74.6	Confident	72.4	Confident	79 Å²	79	36.5 Å²	36.5	34%	0.343	19%	0.187	S	C	.	.	H	α-helix	trans	-62.6	-36	173.1	-146.9	-161.8	-179.5	-170.7	0	112.8	E624 F627 I702 L708	E624-K704 IonicContact OE1-NZ 3.42Å; E624-K704 PolarHBondContact OE1-NZ 2.78Å; E624-K704 IonicContact OE2-NZ 3.73Å; E624-K704 PolarHBondContact OE2-NZ 2.9Å; F627-K704 HydrophobicContact CD2-CD 4.12Å; F627-K704 HydrophobicContact CE2-CD 3.61Å; F627-K704 VanDerWaalsContact CE2-CE 3.45Å; F627-K704 HydrophobicContact CE2-CG 3.62Å; F627-K704 HydrophobicContact CZ-CD 4.32Å; F627-K704 HydrophobicContact CZ-CG 3.95Å; F627-K704 WeakPolarHBondContact CZ-O 3.47Å; I702-K704 HydrophobicContact CG2-CB 4.19Å; I702-K704 PolarHBondContact O-N 3.46Å; I702-K704 VanDerWaalsContact O-N 3.14Å; K704-L708 VanDerWaalsContact O-CB 3.29Å; K704-L708 WeakPolarHBondContact O-CB 3.47Å; K704-L708 PolarHBondContact O-N 3.05Å
705	G	75.6	Confident	73.7	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.3	-31.3	175.7	0	0	0	0	0	113.9	F699 I702 H703 L708 W709	F699-G705 WeakPolarHBondContact O-CA 3.37Å; I702-G705 WeakPolarHBondContact O-CA 3.39Å; I702-G705 PolarHBondContact O-N 2.94Å; H703-G705 VanDerWaalsContact C-N 3.3Å; H703-G705 PolarHBondContact O-N 3.35Å; G705-L708 WeakPolarHBondContact O-CB 3.47Å; G705-L708 PolarHBondContact O-N 3.25Å; G705-W709 PolarHBondContact O-N 3.23Å
706	M	75.3	Confident	74.8	Confident	7 Å²	7	35 Å²	35	3%	0.034	17%	0.173	C	C	.	.	H	α-helix	trans	-63.3	-51.1	171.7	-59.5	166.5	65.6	0	0	110.9	F700 I702 H703 L708 W709 C710 W739 A746 F750	F700-M706 HydrophobicContact CD1-CG 4.44Å; I702-M706 PolarHBondContact O-N 3.47Å; I702-M706 VanDerWaalsContact O-N 3.14Å; H703-M706 WeakPolarHBondContact O-CB 3.26Å; H703-M706 PolarHBondContact O-N 3.36Å; M706-L708 VanDerWaalsContact C-N 3.34Å; M706-L708 PolarHBondContact O-N 2.93Å; M706-W709 PolarHBondContact O-N 2.9Å; M706-C710 PolarHBondContact O-N 3Å; M706-C710 PolarHBondContact O-SG 2.94Å; M706-W739 HydrophobicContact CE-CD2 3.89Å; M706-W739 VanDerWaalsContact CE-CE2 3.48Å; M706-W739 HydrophobicContact CE-CE3 4.32Å; M706-W739 HydrophobicContact CE-CG 4.42Å; M706-W739 HydrophobicContact CE-CH2 4.06Å; M706-W739 HydrophobicContact CE-CZ2 3.57Å; M706-W739 HydrophobicContact CE-CZ3 4.4Å; M706-W739 HydrophobicContact CG-CH2 4.4Å; M706-W739 HydrophobicContact CG-CZ2 3.62Å; M706-W739 HydrophobicContact SD-CZ2 3.77Å; M706-A746 HydrophobicContact CE-CB 3.42Å; M706-A746 VanDerWaalsContact CE-CB 3.42Å; M706-F750 HydrophobicContact CB-CZ 4.11Å; M706-F750 HydrophobicContact CE-CE2 3.86Å; M706-F750 HydrophobicContact CE-CZ 4.22Å
707	R	77.3	Confident	75.6	Confident	99 Å²	99	36.8 Å²	36.8	37%	0.374	18%	0.184	S	C	.	.	H	α-helix	trans	-60.6	-42.5	175.6	-64.6	-179.5	-175.2	-159.2	-1.8	111.6	H703 W709 C710 L711 I749	H703-R707 PolarHBondContact CE1-NH2 3.38Å; H703-R707 PolarHBondContact NE2-NE 2.97Å; H703-R707 PolarHBondContact NE2-NH2 2.71Å; H703-R707 VanDerWaalsContact NE2-NH2 3.14Å; H703-R707 PolarHBondContact O-N 2.99Å; R707-W709 PolarHBondContact O-N 3.46Å; R707-C710 PolarHBondContact O-N 3.37Å; R707-L711 WeakPolarHBondContact O-CG 3.44Å; R707-L711 PolarHBondContact O-N 3.32Å; R707-I749 HydrophobicContact CG-CD1 4.19Å; R707-I749 HydrophobicContact CG-CG2 4.16Å
708	L	82	Confident	76.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.3	-49.6	175.4	179.5	57.6	0	0	0	111.8	M623 M626 F627 L630 F699 K704 G705 M706 C710 L711 T712	M623-L708 HydrophobicContact CB-CD2 3.77Å; M623-L708 HydrophobicContact CG-CD2 3.79Å; M626-L708 HydrophobicContact CB-CD1 3.98Å; M626-L708 HydrophobicContact CB-CD2 4.01Å; M626-L708 HydrophobicContact CB-CG 4.48Å; M626-L708 HydrophobicContact CE-CD1 4.38Å; M626-L708 HydrophobicContact CE-CD2 3.85Å; M626-L708 HydrophobicContact CE-CG 4.03Å; M626-L708 HydrophobicContact SD-CD2 4.3Å; F627-L708 HydrophobicContact CD1-CD1 4.06Å; F627-L708 HydrophobicContact CD2-CB 4.44Å; F627-L708 HydrophobicContact CD2-CD1 3.87Å; F627-L708 HydrophobicContact CD2-CD2 4.21Å; F627-L708 HydrophobicContact CD2-CG 4.4Å; F627-L708 HydrophobicContact CE1-CB 4.38Å; F627-L708 HydrophobicContact CE1-CD1 4.08Å; F627-L708 HydrophobicContact CE2-CB 3.63Å; F627-L708 HydrophobicContact CE2-CD1 3.87Å; F627-L708 HydrophobicContact CE2-CD2 4.06Å; F627-L708 HydrophobicContact CE2-CG 4.07Å; F627-L708 HydrophobicContact CG-CD1 3.95Å; F627-L708 HydrophobicContact CZ-CB 3.6Å; F627-L708 HydrophobicContact CZ-CD1 3.99Å; F627-L708 HydrophobicContact CZ-CG 4.31Å; L630-L708 HydrophobicContact CD1-CD1 3.53Å; F699-L708 HydrophobicContact CD1-CD2 4.28Å; F699-L708 HydrophobicContact CE1-CD2 3.99Å; K704-L708 VanDerWaalsContact O-CB 3.29Å; K704-L708 WeakPolarHBondContact O-CB 3.47Å; K704-L708 PolarHBondContact O-N 3.05Å; G705-L708 WeakPolarHBondContact O-CB 3.47Å; G705-L708 PolarHBondContact O-N 3.25Å; M706-L708 VanDerWaalsContact C-N 3.34Å; M706-L708 PolarHBondContact O-N 2.93Å; L708-C710 PolarHBondContact O-N 2.86Å; L708-L711 PolarHBondContact O-N 3.47Å; L708-T712 HydrophobicContact CD1-CG2 4.16Å; L708-T712 HydrophobicContact CG-CG2 4.41Å; L708-T712 WeakPolarHBondContact O-CG2 3.43Å; L708-T712 PolarHBondContact O-N 3Å
709	W	81.8	Confident	76.9	Confident	9 Å²	9	39.3 Å²	39.3	3%	0.034	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-45.9	-177.7	-176	80.7	0	0	0	111.8	F700 G705 M706 R707 L711 T712 L713 Y724 F728 F750 L754	F700-W709 HydrophobicContact CE1-CB 3.97Å; F700-W709 AromaticContact CE1-CD2 3.92Å; F700-W709 HydrophobicContact CE1-CD2 3.92Å; F700-W709 HydrophobicContact CE1-CE3 4.19Å; F700-W709 AromaticContact CE1-CG 3.85Å; F700-W709 HydrophobicContact CE1-CG 3.85Å; F700-W709 HydrophobicContact CZ-CB 3.95Å; F700-W709 AromaticContact CZ-CD1 3.63Å; F700-W709 AromaticContact CZ-CD2 3.68Å; F700-W709 HydrophobicContact CZ-CD2 3.68Å; F700-W709 AromaticContact CZ-CE2 3.88Å; F700-W709 HydrophobicContact CZ-CE3 4.36Å; F700-W709 AromaticContact CZ-CG 3.47Å; F700-W709 HydrophobicContact CZ-CG 3.47Å; F700-W709 VanDerWaalsContact CZ-CG 3.47Å; F700-W709 AromaticContact CZ-NE1 3.86Å; G705-W709 PolarHBondContact O-N 3.23Å; M706-W709 PolarHBondContact O-N 2.9Å; R707-W709 PolarHBondContact O-N 3.46Å; W709-L711 VanDerWaalsContact C-N 3.33Å; W709-L711 PolarHBondContact O-N 3.43Å; W709-T712 WeakPolarHBondContact CA-OG1 3.34Å; W709-T712 PolarHBondContact O-N 3.23Å; W709-T712 PolarHBondContact O-OG1 3.28Å; W709-L713 HydrophobicContact CD2-CD1 4.26Å; W709-L713 HydrophobicContact CD2-CG 4.38Å; W709-L713 HydrophobicContact CE3-CD1 3.93Å; W709-L713 HydrophobicContact CE3-CG 4.5Å; W709-L713 HydrophobicContact CH2-CD1 3.69Å; W709-L713 HydrophobicContact CZ2-CD1 3.97Å; W709-L713 HydrophobicContact CZ2-CD2 4.1Å; W709-L713 HydrophobicContact CZ2-CG 4.4Å; W709-L713 HydrophobicContact CZ3-CD1 3.67Å; W709-L713 PolarHBondContact O-N 3.17Å; W709-Y724 AromaticContact NE1-CD1 3.87Å; W709-F728 HydrophobicContact CH2-CB 3.61Å; W709-F728 HydrophobicContact CH2-CD1 4.3Å; W709-F728 AromaticContact CH2-CD2 3.34Å; W709-F728 HydrophobicContact CH2-CD2 3.34Å; W709-F728 HydrophobicContact CH2-CE2 4.04Å; W709-F728 AromaticContact CH2-CG 3.5Å; W709-F728 HydrophobicContact CH2-CG 3.5Å; W709-F728 HydrophobicContact CZ2-CB 3.89Å; W709-F728 HydrophobicContact CZ2-CD2 4.05Å; W709-F728 HydrophobicContact CZ2-CG 4.22Å; W709-F728 AromaticContact CZ3-CD2 3.69Å; W709-F728 HydrophobicContact CZ3-CD2 3.69Å; W709-F728 AromaticContact CZ3-CE2 3.92Å; W709-F728 HydrophobicContact CZ3-CE2 3.92Å; W709-F728 HydrophobicContact CZ3-CG 4.2Å; W709-F750 HydrophobicContact CE3-CD1 4.24Å; W709-F750 AromaticContact CE3-CE1 3.75Å; W709-F750 HydrophobicContact CE3-CE1 3.75Å; W709-F750 HydrophobicContact CZ3-CD1 4.13Å; W709-F750 AromaticContact CZ3-CE1 3.96Å; W709-F750 HydrophobicContact CZ3-CE1 3.96Å; W709-L754 HydrophobicContact CH2-CD2 4.39Å; W709-L754 HydrophobicContact CZ3-CD2 4.15Å
710	C	79.1	Confident	77.1	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-49.2	-54.1	173.4	-66	0	0	0	0	111.7	M706 R707 L708 T712 L713 H714 F750 H753	M706-C710 PolarHBondContact O-N 3Å; M706-C710 PolarHBondContact O-SG 2.94Å; R707-C710 PolarHBondContact O-N 3.37Å; L708-C710 PolarHBondContact O-N 2.86Å; C710-T712 PolarHBondContact O-N 3.34Å; C710-L713 PolarHBondContact O-N 2.83Å; C710-H714 PolarHBondContact O-CD2 3.07Å; C710-F750 WeakPolarHBondContact SG-CD1 3.42Å; C710-F750 VanDerWaalsContact SG-CE1 3.54Å; C710-H753 HydrophobicContact CB-CB 4.22Å
711	L	80.7	Confident	77.6	Confident	68 Å²	68	40.3 Å²	40.3	36%	0.356	20%	0.202	S	C	.	.	H	α-helix	trans	-62.6	-43.7	-178.6	-63.7	170	0	0	0	111.6	F627 L630 R707 L708 W709 L713 H714 H715	F627-L711 HydrophobicContact CE1-CD1 4.15Å; L630-L711 HydrophobicContact CD1-CB 3.79Å; R707-L711 WeakPolarHBondContact O-CG 3.44Å; R707-L711 PolarHBondContact O-N 3.32Å; L708-L711 PolarHBondContact O-N 3.47Å; W709-L711 VanDerWaalsContact C-N 3.33Å; W709-L711 PolarHBondContact O-N 3.43Å; L711-L713 PolarHBondContact O-N 3.27Å; L711-L713 VanDerWaalsContact O-N 3.16Å; L711-H714 PolarHBondContact O-N 3.48Å; L711-H714 VanDerWaalsContact O-N 3.14Å; L711-H715 PolarHBondContact O-CD2 2.91Å
712	T	81.9	Confident	78.1	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.5	-32.8	178.9	60.2	0	0	0	0	113.7	M626 L630 L664 L708 W709 C710 H714 H715 L716	M626-T712 HydrophobicContact CE-CG2 3.86Å; L630-T712 HydrophobicContact CD1-CG2 3.99Å; L630-T712 HydrophobicContact CD2-CG2 4.29Å; L630-T712 HydrophobicContact CG-CG2 4.43Å; L664-T712 HydrophobicContact CD1-CG2 3.96Å; L664-T712 HydrophobicContact CD2-CG2 4.11Å; L664-T712 HydrophobicContact CG-CG2 4.31Å; L708-T712 HydrophobicContact CD1-CG2 4.16Å; L708-T712 HydrophobicContact CG-CG2 4.41Å; L708-T712 WeakPolarHBondContact O-CG2 3.43Å; L708-T712 PolarHBondContact O-N 3Å; W709-T712 WeakPolarHBondContact CA-OG1 3.34Å; W709-T712 PolarHBondContact O-N 3.23Å; W709-T712 PolarHBondContact O-OG1 3.28Å; C710-T712 PolarHBondContact O-N 3.34Å; T712-H714 PolarHBondContact O-N 2.93Å; T712-H715 PolarHBondContact O-N 3.43Å; T712-L716 WeakPolarHBondContact O-CG 3.2Å; T712-L716 PolarHBondContact O-N 3.42Å
713	L	80.9	Confident	78.3	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-26.1	-179.6	-66.4	177.7	0	0	0	113.8	W709 C710 L711 L716 Q721 L754 I757	W709-L713 HydrophobicContact CD2-CD1 4.26Å; W709-L713 HydrophobicContact CD2-CG 4.38Å; W709-L713 HydrophobicContact CE3-CD1 3.93Å; W709-L713 HydrophobicContact CE3-CG 4.5Å; W709-L713 HydrophobicContact CH2-CD1 3.69Å; W709-L713 HydrophobicContact CZ2-CD1 3.97Å; W709-L713 HydrophobicContact CZ2-CD2 4.1Å; W709-L713 HydrophobicContact CZ2-CG 4.4Å; W709-L713 HydrophobicContact CZ3-CD1 3.67Å; W709-L713 PolarHBondContact O-N 3.17Å; C710-L713 PolarHBondContact O-N 2.83Å; L711-L713 PolarHBondContact O-N 3.27Å; L711-L713 VanDerWaalsContact O-N 3.16Å; L713-L716 HydrophobicContact CD2-CD1 4.33Å; L713-Q721 PolarHBondContact O-NE2 3.05Å; L713-L754 HydrophobicContact CD1-CD2 4.06Å; L713-I757 HydrophobicContact CB-CD1 3.46Å; L713-I757 VanDerWaalsContact CB-CD1 3.46Å; L713-I757 HydrophobicContact CD1-CD1 3.81Å; L713-I757 HydrophobicContact CG-CD1 4.3Å
714	H	80.8	Confident	78.5	Confident	61 Å²	61	35.7 Å²	35.7	28%	0.282	18%	0.175	S	C	.	.	H	α-helix	trans	-76.9	-23.6	-179.4	-69.5	-106.9	0	0	0	113	C710 L711 T712 H753 E756	C710-H714 PolarHBondContact O-CD2 3.07Å; L711-H714 PolarHBondContact O-N 3.48Å; L711-H714 VanDerWaalsContact O-N 3.14Å; T712-H714 PolarHBondContact O-N 2.93Å; H714-H753 AromaticContact CD2-CD2 3.92Å; H714-H753 WeakPolarHBondContact NE2-CB 3.42Å; H714-H753 AromaticContact NE2-CD2 3.34Å; H714-H753 PolarHBondContact NE2-CD2 3.4Å; H714-H753 VanDerWaalsContact NE2-CD2 3.34Å; H714-H753 AromaticContact NE2-CG 3.74Å; H714-E756 IonicContact CE1-OE1 2.77Å; H714-E756 IonicContact CE1-OE2 3.39Å; H714-E756 PolarHBondContact CE1-OE2 3.02Å; H714-E756 VanDerWaalsContact CE1-OE2 3.3Å; H714-E756 IonicContact ND1-OE1 3.17Å; H714-E756 IonicContact ND1-OE2 3.63Å
715	H	78.7	Confident	78.9	Confident	33 Å²	33	32 Å²	32	15%	0.153	16%	0.159	C	C	.	.	H	α-helix	trans	-98.6	-7.7	178.9	-51.1	-92.2	0	0	0	113.4	L630 L633 D634 L664 L711 T712	L630-H715 WeakPolarHBondContact CD2-CD2 3.3Å; L633-H715 HydrophobicContact CD1-CB 4.2Å; D634-H715 IonicContact OD1-CE1 2.71Å; D634-H715 PolarHBondContact OD1-CE1 3.28Å; D634-H715 IonicContact OD1-NE2 2.72Å; L664-H715 HydrophobicContact CD2-CB 4.47Å; L711-H715 PolarHBondContact O-CD2 2.91Å; T712-H715 PolarHBondContact O-N 3.43Å
716	L	81.2	Confident	79.2	Confident	9 Å²	9	32.4 Å²	32.4	5%	0.047	16%	0.162	C	C	.	.	S	Bend	trans	-79.3	139.4	-178.6	-78.6	171.8	0	0	0	112.3	I665 L668 T712 L713 I720 Q721 Y724	I665-L716 HydrophobicContact CD1-CD2 4.14Å; I665-L716 HydrophobicContact CG1-CD2 3.44Å; I665-L716 VanDerWaalsContact CG1-CD2 3.44Å; L668-L716 HydrophobicContact CD1-CD1 3.98Å; L668-L716 HydrophobicContact CD1-CD2 4.06Å; L668-L716 HydrophobicContact CD1-CG 4.42Å; T712-L716 WeakPolarHBondContact O-CG 3.2Å; T712-L716 PolarHBondContact O-N 3.42Å; L713-L716 HydrophobicContact CD2-CD1 4.33Å; L716-I720 HydrophobicContact CD1-CG2 4.32Å; L716-I720 HydrophobicContact CD2-CG2 4.02Å; L716-Q721 HydrophobicContact CB-CB 4.42Å; L716-Y724 HydrophobicContact CD1-CD2 4.32Å
717	P	79.6	Confident	79.2	Confident	49 Å²	49	35 Å²	35	32%	0.318	17%	0.173	S	C	.	.			trans	-56.5	139.6	172.4	-24.7	33.9	0	0	0	111.9	I661 I665 K719 I720 Q721	I661-P717 HydrophobicContact CG2-CG 4.18Å; I665-P717 HydrophobicContact CD1-CG 4.36Å; P717-K719 VanDerWaalsContact C-N 3.26Å; P717-K719 PolarHBondContact O-N 2.96Å; P717-I720 HydrophobicContact CG-CD1 4.42Å; P717-I720 WeakPolarHBondContact O-CA 3.49Å; P717-I720 PolarHBondContact O-N 2.97Å; P717-Q721 PolarHBondContact O-N 2.86Å
718	T	77	Confident	79.4	Confident	86 Å²	86	30.3 Å²	30.3	53%	0.528	16%	0.155	S	C	.	.	H	α-helix	trans	-52.6	-36.5	-169.4	-44.2	0	0	0	0	114.3	I720 Q721 T722 L761	T718-I720 VanDerWaalsContact C-N 3.34Å; T718-I720 PolarHBondContact O-N 3.15Å; T718-Q721 PolarHBondContact O-N 3.02Å; T718-T722 PolarHBondContact O-N 2.88Å; T718-T722 PolarHBondContact O-OG1 2.9Å; T718-L761 HydrophobicContact CG2-CD2 4.21Å
719	K	75.4	Confident	79.4	Confident	138 Å²	138	30.4 Å²	30.4	60%	0.6	16%	0.156	S	C	*	.	H	α-helix	trans	-55.6	-45.5	172.9	-79.9	-174.6	167.6	-173.6	0	112.9	E689 P717 T722 N723	E689-K719 IonicContact OE1-NZ 3.37Å; E689-K719 PolarHBondContact OE1-NZ 3.37Å; P717-K719 VanDerWaalsContact C-N 3.26Å; P717-K719 PolarHBondContact O-N 2.96Å; K719-T722 PolarHBondContact O-OG1 3.07Å; K719-N723 VanDerWaalsContact O-CG 3.29Å; K719-N723 PolarHBondContact O-N 3.24Å; K719-N723 PolarHBondContact O-OD1 3.36Å
720	I	75.3	Confident	79.3	Confident	19 Å²	19	33.7 Å²	33.7	10%	0.097	17%	0.171	C	C	.	.	H	α-helix	trans	-76.4	-42.9	-177	-61.7	176.7	0	0	0	108.9	I665 V688 L716 P717 T718 T722 N723 Y724	I665-I720 HydrophobicContact CD1-CD1 3.66Å; I665-I720 HydrophobicContact CG1-CD1 4.23Å; V688-I720 HydrophobicContact CG1-CD1 4.28Å; V688-I720 HydrophobicContact CG1-CG1 4.26Å; L716-I720 HydrophobicContact CD1-CG2 4.32Å; L716-I720 HydrophobicContact CD2-CG2 4.02Å; P717-I720 HydrophobicContact CG-CD1 4.42Å; P717-I720 WeakPolarHBondContact O-CA 3.49Å; P717-I720 PolarHBondContact O-N 2.97Å; T718-I720 VanDerWaalsContact C-N 3.34Å; T718-I720 PolarHBondContact O-N 3.15Å; I720-T722 VanDerWaalsContact C-N 3.35Å; I720-T722 PolarHBondContact O-N 3.44Å; I720-N723 PolarHBondContact O-N 2.86Å; I720-N723 VanDerWaalsContact O-N 3.07Å; I720-Y724 HydrophobicContact CG2-CD2 3.63Å; I720-Y724 HydrophobicContact CG2-CE2 3.62Å; I720-Y724 WeakPolarHBondContact O-CD2 3.35Å; I720-Y724 PolarHBondContact O-N 3.09Å
721	Q	80.8	Confident	79.1	Confident	10 Å²	10	34.7 Å²	34.7	5%	0.047	18%	0.176	C	C	.	.	H	α-helix	trans	-53.8	-46.3	173.2	-171.9	-171	62.4	0	0	112.2	L713 L716 P717 T718 N723 Y724 L725 I757	L713-Q721 PolarHBondContact O-NE2 3.05Å; L716-Q721 HydrophobicContact CB-CB 4.42Å; P717-Q721 PolarHBondContact O-N 2.86Å; T718-Q721 PolarHBondContact O-N 3.02Å; Q721-N723 PolarHBondContact O-N 3.38Å; Q721-Y724 PolarHBondContact O-N 3.32Å; Q721-L725 VanDerWaalsContact O-CB 3.29Å; Q721-L725 WeakPolarHBondContact O-CB 3.46Å; Q721-L725 PolarHBondContact O-N 2.98Å; Q721-I757 HydrophobicContact CG-CG2 3.85Å
722	T	79.4	Confident	79.1	Confident	30 Å²	30	31.6 Å²	31.6	18%	0.184	16%	0.16	C	C	.	.	H	α-helix	trans	-64.8	-35.8	175.1	46.6	0	0	0	0	113	T718 K719 I720 S726 L761 F767	T718-T722 PolarHBondContact O-N 2.88Å; T718-T722 PolarHBondContact O-OG1 2.9Å; K719-T722 PolarHBondContact O-OG1 3.07Å; I720-T722 VanDerWaalsContact C-N 3.35Å; I720-T722 PolarHBondContact O-N 3.44Å; T722-S726 WeakPolarHBondContact O-CB 3.44Å; T722-S726 PolarHBondContact O-N 2.83Å; T722-L761 HydrophobicContact CG2-CD2 3.55Å; T722-F767 HydrophobicContact CG2-CD2 4.03Å; T722-F767 HydrophobicContact CG2-CE2 4.48Å
723	N	75.6	Confident	78.9	Confident	43 Å²	43	34.3 Å²	34.3	23%	0.23	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-45.1	178.5	-71.5	0.5	0	0	0	111.3	F693 K719 I720 Q721 K727	F693-N723 HydrophobicContact CD2-CB 4.48Å; F693-N723 HydrophobicContact CE2-CB 3.86Å; F693-N723 HydrophobicContact CZ-CB 4.26Å; K719-N723 VanDerWaalsContact O-CG 3.29Å; K719-N723 PolarHBondContact O-N 3.24Å; K719-N723 PolarHBondContact O-OD1 3.36Å; I720-N723 PolarHBondContact O-N 2.86Å; I720-N723 VanDerWaalsContact O-N 3.07Å; Q721-N723 PolarHBondContact O-N 3.38Å; N723-K727 VanDerWaalsContact O-CB 3.3Å; N723-K727 WeakPolarHBondContact O-CB 3.44Å; N723-K727 PolarHBondContact O-N 2.83Å
724	Y	75.9	Confident	78.6	Confident	7 Å²	7	40.8 Å²	40.8	3%	0.027	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-40.6	174.8	-85.2	-82.6	0	0	0	112.6	F693 L695 W709 L716 I720 Q721 K727 F728	F693-Y724 HydrophobicContact CD1-CE2 4.16Å; F693-Y724 AromaticContact CE1-CE2 3.95Å; F693-Y724 HydrophobicContact CE1-CE2 3.95Å; L695-Y724 HydrophobicContact CD1-CD1 4.41Å; W709-Y724 AromaticContact NE1-CD1 3.87Å; L716-Y724 HydrophobicContact CD1-CD2 4.32Å; I720-Y724 HydrophobicContact CG2-CD2 3.63Å; I720-Y724 HydrophobicContact CG2-CE2 3.62Å; I720-Y724 WeakPolarHBondContact O-CD2 3.35Å; I720-Y724 PolarHBondContact O-N 3.09Å; Q721-Y724 PolarHBondContact O-N 3.32Å; Y724-K727 PolarHBondContact O-N 3.14Å; Y724-F728 WeakPolarHBondContact O-CB 3.3Å; Y724-F728 PolarHBondContact O-N 2.79Å
725	L	83.1	Confident	78.2	Confident	1 Å²	1	38 Å²	38	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-68.3	-42	178.6	-173.9	63.5	0	0	0	112.2	Q721 K727 F728 I729 L754 I757 I758 L761 F767	Q721-L725 VanDerWaalsContact O-CB 3.29Å; Q721-L725 WeakPolarHBondContact O-CB 3.46Å; Q721-L725 PolarHBondContact O-N 2.98Å; L725-K727 VanDerWaalsContact C-N 3.34Å; L725-F728 PolarHBondContact O-N 2.91Å; L725-I729 WeakPolarHBondContact O-CG1 3.39Å; L725-I729 PolarHBondContact O-N 3.22Å; L725-L754 HydrophobicContact CD1-CD2 3.57Å; L725-I757 HydrophobicContact CD2-CG2 4.22Å; L725-I758 HydrophobicContact CD2-CG1 4Å; L725-L761 HydrophobicContact CD2-CD1 4.31Å; L725-F767 HydrophobicContact CB-CE2 4.22Å; L725-F767 HydrophobicContact CB-CZ 4.06Å; L725-F767 HydrophobicContact CD2-CE1 4.09Å; L725-F767 HydrophobicContact CD2-CE2 4.17Å; L725-F767 HydrophobicContact CD2-CZ 3.6Å; L725-F767 HydrophobicContact CG-CE1 4.44Å; L725-F767 HydrophobicContact CG-CE2 4.26Å; L725-F767 HydrophobicContact CG-CZ 3.63Å
726	S	80.8	Confident	77.9	Confident	10 Å²	10	40 Å²	40	7%	0.07	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-45.2	172.3	176.5	0	0	0	0	110.8	T722 F728 I729 H730	T722-S726 WeakPolarHBondContact O-CB 3.44Å; T722-S726 PolarHBondContact O-N 2.83Å; S726-F728 PolarHBondContact O-N 3.23Å; S726-I729 PolarHBondContact O-N 3.3Å; S726-H730 PolarHBondContact O-CD2 3.02Å; S726-H730 PolarHBondContact O-N 3.26Å; S726-H730 PolarHBondContact OG-CD2 2.89Å
727	K	76.6	Confident	77.5	Confident	62 Å²	62	46.1 Å²	46.1	27%	0.27	22%	0.22	S	C	.	.	H	α-helix	trans	-65	-38.4	178.7	-169.9	51.3	166.5	146.5	0	112.8	F693 L695 N723 Y724 L725 H730 D731	F693-K727 WeakPolarHBondContact O-CE 3.32Å; L695-K727 HydrophobicContact CB-CG 4.29Å; N723-K727 VanDerWaalsContact O-CB 3.3Å; N723-K727 WeakPolarHBondContact O-CB 3.44Å; N723-K727 PolarHBondContact O-N 2.83Å; Y724-K727 PolarHBondContact O-N 3.14Å; L725-K727 VanDerWaalsContact C-N 3.34Å; K727-H730 PolarHBondContact O-N 3.33Å; K727-D731 WeakPolarHBondContact CD-OD2 3.27Å; K727-D731 WeakPolarHBondContact CE-OD2 3.43Å; K727-D731 IonicContact NZ-OD1 3.39Å; K727-D731 PolarHBondContact NZ-OD1 2.98Å; K727-D731 IonicContact NZ-OD2 3.21Å; K727-D731 PolarHBondContact NZ-OD2 2.68Å; K727-D731 WeakPolarHBondContact O-CB 3.28Å; K727-D731 PolarHBondContact O-N 3.03Å
728	F	80.9	Confident	76.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-41.4	171.4	175.1	-88.6	0	0	0	112.4	W709 Y724 L725 S726 F732 L735 F750 L754 L804	W709-F728 HydrophobicContact CH2-CB 3.61Å; W709-F728 HydrophobicContact CH2-CD1 4.3Å; W709-F728 AromaticContact CH2-CD2 3.34Å; W709-F728 HydrophobicContact CH2-CD2 3.34Å; W709-F728 HydrophobicContact CH2-CE2 4.04Å; W709-F728 AromaticContact CH2-CG 3.5Å; W709-F728 HydrophobicContact CH2-CG 3.5Å; W709-F728 HydrophobicContact CZ2-CB 3.89Å; W709-F728 HydrophobicContact CZ2-CD2 4.05Å; W709-F728 HydrophobicContact CZ2-CG 4.22Å; W709-F728 AromaticContact CZ3-CD2 3.69Å; W709-F728 HydrophobicContact CZ3-CD2 3.69Å; W709-F728 AromaticContact CZ3-CE2 3.92Å; W709-F728 HydrophobicContact CZ3-CE2 3.92Å; W709-F728 HydrophobicContact CZ3-CG 4.2Å; Y724-F728 WeakPolarHBondContact O-CB 3.3Å; Y724-F728 PolarHBondContact O-N 2.79Å; L725-F728 PolarHBondContact O-N 2.91Å; S726-F728 PolarHBondContact O-N 3.23Å; F728-F732 HydrophobicContact CE1-CD2 4Å; F728-F732 HydrophobicContact CE1-CE2 4.24Å; F728-F732 HydrophobicContact CZ-CD2 4.25Å; F728-F732 HydrophobicContact CZ-CE2 4.3Å; F728-F732 PolarHBondContact O-N 3.02Å; F728-L735 HydrophobicContact CD2-CD1 3.41Å; F728-L735 VanDerWaalsContact CD2-CD1 3.41Å; F728-L735 HydrophobicContact CE2-CD1 3.55Å; F728-L735 HydrophobicContact CG-CD1 4.2Å; F728-L735 HydrophobicContact CZ-CD1 4.42Å; F728-F750 HydrophobicContact CE2-CE1 4.3Å; F728-F750 HydrophobicContact CE2-CZ 4.43Å; F728-L754 HydrophobicContact CE1-CD1 3.98Å; F728-L754 HydrophobicContact CZ-CD1 4.29Å; F728-L804 HydrophobicContact CE1-CD2 4.35Å
729	I	81.6	Confident	76.4	Confident	1 Å²	1	44 Å²	44	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-41.2	175.9	-68.8	169.3	0	0	0	111	L725 S726 F732 F767 C771 F772 N791 L795 L804 L808	L725-I729 WeakPolarHBondContact O-CG1 3.39Å; L725-I729 PolarHBondContact O-N 3.22Å; S726-I729 PolarHBondContact O-N 3.3Å; I729-F732 WeakPolarHBondContact O-CB 3.34Å; I729-F767 HydrophobicContact CD1-CE1 3.96Å; I729-F767 HydrophobicContact CD1-CZ 3.92Å; I729-C771 HydrophobicContact CG2-CB 4.15Å; I729-F772 HydrophobicContact CG2-CE1 4.29Å; I729-F772 HydrophobicContact CG2-CE2 4.38Å; I729-F772 HydrophobicContact CG2-CZ 3.77Å; I729-N791 PolarHBondContact O-ND2 2.96Å; I729-L795 HydrophobicContact CG2-CD1 4.29Å; I729-L804 HydrophobicContact CD1-CD2 4.29Å; I729-L804 HydrophobicContact CG1-CD2 3.91Å; I729-L808 HydrophobicContact CD1-CD1 4.13Å
730	H	79.5	Confident	75.6	Confident	79 Å²	79	42.5 Å²	42.5	37%	0.366	21%	0.206	S	C	.	.	H	α-helix	trans	-70.2	-34.9	179.2	-79.4	-62.8	0	0	0	113.9	S726 K727 L770 C771 N791	S726-H730 PolarHBondContact O-CD2 3.02Å; S726-H730 PolarHBondContact O-N 3.26Å; S726-H730 PolarHBondContact OG-CD2 2.89Å; K727-H730 PolarHBondContact O-N 3.33Å; H730-L770 PolarHBondContact NE2-O 2.97Å; H730-C771 PolarHBondContact CE1-O 3.39Å; H730-N791 PolarHBondContact O-ND2 3.27Å; H730-N791 PolarHBondContact O-OD1 3.19Å
731	D	76.2	Confident	74.8	Confident	21 Å²	21	47 Å²	47	11%	0.112	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	6.5	179.2	-66.9	-19	0	0	0	113.6	K727 L733 R734 L735	K727-D731 WeakPolarHBondContact CD-OD2 3.27Å; K727-D731 WeakPolarHBondContact CE-OD2 3.43Å; K727-D731 IonicContact NZ-OD1 3.39Å; K727-D731 PolarHBondContact NZ-OD1 2.98Å; K727-D731 IonicContact NZ-OD2 3.21Å; K727-D731 PolarHBondContact NZ-OD2 2.68Å; K727-D731 WeakPolarHBondContact O-CB 3.28Å; K727-D731 PolarHBondContact O-N 3.03Å; D731-L733 VanDerWaalsContact C-N 3.26Å; D731-L733 PolarHBondContact O-N 2.9Å; D731-L733 VanDerWaalsContact O-N 3.12Å; D731-R734 WeakPolarHBondContact O-CB 3.31Å; D731-R734 PolarHBondContact O-N 3.14Å; D731-L735 PolarHBondContact O-N 2.8Å
732	F	79.9	Confident	74	Confident	3 Å²	3	49 Å²	49	1%	0.013	25%	0.247	C	C	.	.	H	α-helix	trans	-54.5	-36.8	-171.7	-169.4	-92.5	0	0	0	113.8	F728 I729 R734 L735 R736 M743 N791 L795 C798 L800	F728-F732 HydrophobicContact CE1-CD2 4Å; F728-F732 HydrophobicContact CE1-CE2 4.24Å; F728-F732 HydrophobicContact CZ-CD2 4.25Å; F728-F732 HydrophobicContact CZ-CE2 4.3Å; F728-F732 PolarHBondContact O-N 3.02Å; I729-F732 WeakPolarHBondContact O-CB 3.34Å; F732-R734 VanDerWaalsContact C-N 3.31Å; F732-R734 PolarHBondContact O-N 3.17Å; F732-L735 PolarHBondContact O-N 3.16Å; F732-R736 WeakPolarHBondContact O-CB 3.32Å; F732-R736 PolarHBondContact O-N 3.02Å; F732-M743 HydrophobicContact CZ-SD 4.24Å; F732-N791 PolarHBondContact N-OD1 3.29Å; F732-L795 HydrophobicContact CB-CD2 4.02Å; F732-L795 HydrophobicContact CB-CG 4.25Å; F732-L795 HydrophobicContact CD1-CD2 3.5Å; F732-L795 VanDerWaalsContact CD1-CD2 3.5Å; F732-L795 HydrophobicContact CD1-CG 3.73Å; F732-L795 HydrophobicContact CD2-CD2 3.77Å; F732-L795 HydrophobicContact CE1-CD2 3.81Å; F732-L795 HydrophobicContact CE1-CG 4.26Å; F732-L795 HydrophobicContact CE2-CD2 4.06Å; F732-L795 HydrophobicContact CG-CD2 3.47Å; F732-L795 VanDerWaalsContact CG-CD2 3.47Å; F732-L795 HydrophobicContact CG-CG 4Å; F732-L795 HydrophobicContact CZ-CD2 4.08Å; F732-C798 HydrophobicContact CE1-CB 4.11Å; F732-C798 HydrophobicContact CZ-CB 4.34Å; F732-L800 HydrophobicContact CE2-CD2 4.28Å; F732-L800 HydrophobicContact CE2-CG 4.42Å
733	L	77.3	Confident	73.3	Confident	57 Å²	57	48.3 Å²	48.3	30%	0.298	24%	0.243	S	C	.	.	H	α-helix	trans	-57.3	-39.8	173.6	176.8	61.2	0	0	0	113	D731 Q737 D790 N791	D731-L733 VanDerWaalsContact C-N 3.26Å; D731-L733 PolarHBondContact O-N 2.9Å; D731-L733 VanDerWaalsContact O-N 3.12Å; L733-Q737 WeakPolarHBondContact O-CG 3.38Å; L733-Q737 PolarHBondContact O-N 3.5Å; L733-Q737 VanDerWaalsContact O-N 3.16Å; L733-D790 HydrophobicContact CD2-CB 4.05Å; L733-N791 HydrophobicContact CB-CB 4.38Å; L733-N791 PolarHBondContact N-OD1 3.16Å
734	R	74.3	Confident	72.7	Confident	138 Å²	138	51.4 Å²	51.4	52%	0.521	26%	0.259	S	S	.	.	H	α-helix	trans	-70.6	-43.9	177	-61.7	-174.5	179.8	-157	0.2	111	E697 D731 F732 R736 Q737 L738	E697-R734 WeakPolarHBondContact OE1-CD 3.19Å; E697-R734 IonicContact OE1-CZ 2.76Å; E697-R734 IonicContact OE1-NH1 3.38Å; E697-R734 PolarHBondContact OE1-NH1 2.85Å; D731-R734 WeakPolarHBondContact O-CB 3.31Å; D731-R734 PolarHBondContact O-N 3.14Å; F732-R734 VanDerWaalsContact C-N 3.31Å; F732-R734 PolarHBondContact O-N 3.17Å; R734-R736 VanDerWaalsContact C-N 3.3Å; R734-R736 PolarHBondContact O-N 3.5Å; R734-Q737 WeakPolarHBondContact O-CB 3.27Å; R734-Q737 PolarHBondContact O-N 3.19Å; R734-L738 WeakPolarHBondContact O-CG 3.34Å; R734-L738 PolarHBondContact O-N 3.42Å
735	L	73.6	Confident	72.3	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-40.5	177	-66.8	175.4	0	0	0	111.6	L695 F700 F728 D731 F732 Q737 L738 W739	L695-L735 HydrophobicContact CD2-CD1 3.82Å; L695-L735 HydrophobicContact CD2-CD2 3.89Å; L695-L735 HydrophobicContact CD2-CG 4.16Å; F700-L735 HydrophobicContact CB-CD2 3.91Å; F700-L735 HydrophobicContact CD1-CD2 4.23Å; F700-L735 HydrophobicContact CD2-CD2 4.22Å; F700-L735 HydrophobicContact CG-CD2 3.83Å; F728-L735 HydrophobicContact CD2-CD1 3.41Å; F728-L735 VanDerWaalsContact CD2-CD1 3.41Å; F728-L735 HydrophobicContact CE2-CD1 3.55Å; F728-L735 HydrophobicContact CG-CD1 4.2Å; F728-L735 HydrophobicContact CZ-CD1 4.42Å; D731-L735 PolarHBondContact O-N 2.8Å; F732-L735 PolarHBondContact O-N 3.16Å; L735-Q737 VanDerWaalsContact C-N 3.33Å; L735-Q737 PolarHBondContact O-N 2.93Å; L735-L738 HydrophobicContact CD2-CD1 4.48Å; L735-L738 PolarHBondContact O-N 3.38Å; L735-L738 VanDerWaalsContact O-N 3.17Å; L735-W739 HydrophobicContact CB-CE3 4.14Å; L735-W739 HydrophobicContact CB-CH2 4.28Å; L735-W739 HydrophobicContact CB-CZ3 3.8Å; L735-W739 HydrophobicContact CD1-CZ3 4.45Å; L735-W739 HydrophobicContact CD2-CH2 3.94Å; L735-W739 HydrophobicContact CD2-CZ2 4.35Å; L735-W739 HydrophobicContact CD2-CZ3 4.33Å; L735-W739 HydrophobicContact CG-CH2 4.48Å; L735-W739 HydrophobicContact CG-CZ3 4.43Å; L735-W739 PolarHBondContact O-N 3.27Å
736	R	72.5	Confident	71.5	Confident	74 Å²	74	56.9 Å²	56.9	28%	0.279	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-33.1	173	-178.9	169.7	-178.6	178.1	1.4	113.3	F732 R734 L738 W739 M743 S794 S797	F732-R736 WeakPolarHBondContact O-CB 3.32Å; F732-R736 PolarHBondContact O-N 3.02Å; R734-R736 VanDerWaalsContact C-N 3.3Å; R734-R736 PolarHBondContact O-N 3.5Å; R736-L738 VanDerWaalsContact C-N 3.34Å; R736-W739 CarbonylContact O-C 3.6Å; R736-W739 PolarHBondContact O-N 2.84Å; R736-M743 HydrophobicContact CB-SD 3.99Å; R736-M743 HydrophobicContact CG-CE 3.74Å; R736-M743 HydrophobicContact CG-SD 3.77Å; R736-S794 PolarHBondContact NH1-O 2.82Å; R736-S797 VanDerWaalsContact CZ-O 3.29Å; R736-S797 VanDerWaalsContact NH1-C 3.31Å; R736-S797 PolarHBondContact NH1-O 3.47Å; R736-S797 PolarHBondContact NH1-OG 3.35Å; R736-S797 PolarHBondContact NH2-O 2.92Å
737	Q	71.6	Confident	71	Confident	137 Å²	137	57 Å²	57	64%	0.64	29%	0.287	S	S	*	.	H	α-helix	trans	-70.9	-29.7	173.2	-73.1	170.4	-12.1	0	0	112.5	L733 R734 L735	L733-Q737 WeakPolarHBondContact O-CG 3.38Å; L733-Q737 PolarHBondContact O-N 3.5Å; L733-Q737 VanDerWaalsContact O-N 3.16Å; R734-Q737 WeakPolarHBondContact O-CB 3.27Å; R734-Q737 PolarHBondContact O-N 3.19Å; L735-Q737 VanDerWaalsContact C-N 3.33Å; L735-Q737 PolarHBondContact O-N 2.93Å
738	L	66.3	Low	70.9	Confident	81 Å²	81	57.8 Å²	57.8	42%	0.424	30%	0.3	S	S	.	.	H	α-helix	trans	-76.2	-21	172.1	-65.4	170.2	0	0	0	113.1	E697 R734 L735 R736	E697-L738 HydrophobicContact CB-CD1 4.41Å; R734-L738 WeakPolarHBondContact O-CG 3.34Å; R734-L738 PolarHBondContact O-N 3.42Å; L735-L738 HydrophobicContact CD2-CD1 4.48Å; L735-L738 PolarHBondContact O-N 3.38Å; L735-L738 VanDerWaalsContact O-N 3.17Å; R736-L738 VanDerWaalsContact C-N 3.34Å
739	W	67.1	Low	70.6	Confident	11 Å²	11	59 Å²	59	4%	0.042	31%	0.306	C	S	.	.			trans	-128.4	67.3	-178.2	-53.5	-38.9	0	0	0	114.3	F700 M706 L735 R736 T741 M743 F750	F700-W739 HydrophobicContact CB-CH2 4.24Å; F700-W739 HydrophobicContact CB-CZ2 3.56Å; F700-W739 AromaticContact CD1-CH2 3.54Å; F700-W739 HydrophobicContact CD1-CH2 3.54Å; F700-W739 AromaticContact CD1-CZ2 3.55Å; F700-W739 HydrophobicContact CD1-CZ2 3.55Å; F700-W739 HydrophobicContact CE1-CH2 4.32Å; F700-W739 HydrophobicContact CG-CH2 4.23Å; F700-W739 AromaticContact CG-CZ2 3.99Å; F700-W739 HydrophobicContact CG-CZ2 3.99Å; F700-W739 PolarHBondContact O-NE1 3.43Å; M706-W739 HydrophobicContact CE-CD2 3.89Å; M706-W739 VanDerWaalsContact CE-CE2 3.48Å; M706-W739 HydrophobicContact CE-CE3 4.32Å; M706-W739 HydrophobicContact CE-CG 4.42Å; M706-W739 HydrophobicContact CE-CH2 4.06Å; M706-W739 HydrophobicContact CE-CZ2 3.57Å; M706-W739 HydrophobicContact CE-CZ3 4.4Å; M706-W739 HydrophobicContact CG-CH2 4.4Å; M706-W739 HydrophobicContact CG-CZ2 3.62Å; M706-W739 HydrophobicContact SD-CZ2 3.77Å; L735-W739 HydrophobicContact CB-CE3 4.14Å; L735-W739 HydrophobicContact CB-CH2 4.28Å; L735-W739 HydrophobicContact CB-CZ3 3.8Å; L735-W739 HydrophobicContact CD1-CZ3 4.45Å; L735-W739 HydrophobicContact CD2-CH2 3.94Å; L735-W739 HydrophobicContact CD2-CZ2 4.35Å; L735-W739 HydrophobicContact CD2-CZ3 4.33Å; L735-W739 HydrophobicContact CG-CH2 4.48Å; L735-W739 HydrophobicContact CG-CZ3 4.43Å; L735-W739 PolarHBondContact O-N 3.27Å; R736-W739 CarbonylContact O-C 3.6Å; R736-W739 PolarHBondContact O-N 2.84Å; W739-T741 VanDerWaalsContact C-N 3.3Å; W739-T741 PolarHBondContact O-N 3.25Å; W739-M743 HydrophobicContact CB-CB 4.08Å; W739-M743 WeakPolarHBondContact O-CB 3.48Å; W739-F750 HydrophobicContact CE3-CE2 4.48Å; W739-F750 AromaticContact CH2-CE2 3.69Å; W739-F750 HydrophobicContact CH2-CE2 3.69Å; W739-F750 AromaticContact CH2-CZ 3.57Å; W739-F750 HydrophobicContact CH2-CZ 3.57Å; W739-F750 HydrophobicContact CZ2-CZ 4.36Å; W739-F750 AromaticContact CZ3-CE2 3.66Å; W739-F750 HydrophobicContact CZ3-CE2 3.66Å; W739-F750 HydrophobicContact CZ3-CZ 4.01Å
740	P	60.4	Low	70.5	Confident	106 Å²	106	59 Å²	59	69%	0.688	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-37	176.3	-22.4	34.4	0	0	0	113.3
741	T	58	Low	70.6	Confident	114 Å²	114	57.3 Å²	57.3	70%	0.699	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-55.7	-174.6	47.9	0	0	0	0	112.5	W739 M743	W739-T741 VanDerWaalsContact C-N 3.3Å; W739-T741 PolarHBondContact O-N 3.25Å; T741-M743 PolarHBondContact O-N 2.77Å; T741-M743 VanDerWaalsContact O-N 3.14Å
742	T	62.9	Low	70.8	Confident	50 Å²	50	59.8 Å²	59.8	31%	0.307	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.2	-170.4	56.5	0	0	0	0	114.7	N744 E745 A746	T742-N744 PolarHBondContact O-N 3.5Å; T742-N744 VanDerWaalsContact O-N 3.13Å; T742-E745 PolarHBondContact O-N 3.21Å; T742-E745 VanDerWaalsContact O-N 3.12Å; T742-A746 VanDerWaalsContact O-CB 3.28Å; T742-A746 WeakPolarHBondContact O-CB 3.31Å; T742-A746 PolarHBondContact O-N 3.31Å
743	M	65.4	Low	70.9	Confident	17 Å²	17	62 Å²	62	8%	0.084	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-24	-175.6	-173.9	175.9	58.2	0	0	113.9	F732 R736 W739 T741 A747 C798	F732-M743 HydrophobicContact CZ-SD 4.24Å; R736-M743 HydrophobicContact CB-SD 3.99Å; R736-M743 HydrophobicContact CG-CE 3.74Å; R736-M743 HydrophobicContact CG-SD 3.77Å; W739-M743 HydrophobicContact CB-CB 4.08Å; W739-M743 WeakPolarHBondContact O-CB 3.48Å; T741-M743 PolarHBondContact O-N 2.77Å; T741-M743 VanDerWaalsContact O-N 3.14Å; M743-A747 WeakPolarHBondContact O-CB 3.38Å; M743-A747 PolarHBondContact O-N 2.94Å; M743-C798 HydrophobicContact CE-CB 4.14Å; M743-C798 WeakPolarHBondContact CE-SG 3.41Å; M743-C798 HydrophobicContact SD-CB 4.48Å; M743-C798 PolarHBondContact SD-SG 3.31Å
744	N	64.1	Low	71.2	Confident	108 Å²	108	59.3 Å²	59.3	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-75.2	-39.1	174.5	-80.1	-34.3	0	0	0	113	T742 A747	T742-N744 PolarHBondContact O-N 3.5Å; T742-N744 VanDerWaalsContact O-N 3.13Å; N744-A747 WeakPolarHBondContact O-CB 3.05Å; N744-A747 PolarHBondContact O-N 3.09Å
745	E	65.8	Low	71.6	Confident	120 Å²	120	57.8 Å²	57.8	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-71	-45.9	172.8	-66.3	159	-158.5	0	0	110.2	T742 A747 S748	T742-E745 PolarHBondContact O-N 3.21Å; T742-E745 VanDerWaalsContact O-N 3.12Å; E745-A747 PolarHBondContact O-N 2.94Å; E745-A747 VanDerWaalsContact O-N 3.11Å; E745-S748 PolarHBondContact O-N 3.27Å; E745-S748 PolarHBondContact O-OG 2.95Å
746	A	67.7	Low	71.9	Confident	3 Å²	3	62.2 Å²	62.2	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-26	174.2	0	0	0	0	0	112.1	M706 T742 S748 I749 F750	M706-A746 HydrophobicContact CE-CB 3.42Å; M706-A746 VanDerWaalsContact CE-CB 3.42Å; T742-A746 VanDerWaalsContact O-CB 3.28Å; T742-A746 WeakPolarHBondContact O-CB 3.31Å; T742-A746 PolarHBondContact O-N 3.31Å; A746-S748 VanDerWaalsContact C-N 3.33Å; A746-S748 PolarHBondContact O-N 3.14Å; A746-I749 PolarHBondContact O-N 3.03Å; A746-F750 HydrophobicContact CB-CD2 3.82Å; A746-F750 HydrophobicContact CB-CE2 3.78Å; A746-F750 WeakPolarHBondContact O-CB 3.35Å; A746-F750 WeakPolarHBondContact O-CD2 3.28Å; A746-F750 PolarHBondContact O-N 3.37Å
747	A	70.6	Confident	72.4	Confident	12 Å²	12	58.8 Å²	58.8	10%	0.099	31%	0.313	C	S	.	.	H	α-helix	trans	-63	-36	174.5	0	0	0	0	0	112.9	M743 N744 E745 I749 Y751 L800	M743-A747 WeakPolarHBondContact O-CB 3.38Å; M743-A747 PolarHBondContact O-N 2.94Å; N744-A747 WeakPolarHBondContact O-CB 3.05Å; N744-A747 PolarHBondContact O-N 3.09Å; E745-A747 PolarHBondContact O-N 2.94Å; E745-A747 VanDerWaalsContact O-N 3.11Å; A747-I749 VanDerWaalsContact C-N 3.33Å; A747-Y751 WeakPolarHBondContact O-CB 3.5Å; A747-Y751 PolarHBondContact O-N 3.18Å; A747-L800 HydrophobicContact CB-CB 3.91Å; A747-L800 HydrophobicContact CB-CD1 4.3Å; A747-L800 HydrophobicContact CB-CG 4.5Å
748	S	73.2	Confident	72.9	Confident	78 Å²	78	52.3 Å²	52.3	55%	0.545	28%	0.282	S	S	.	.	H	α-helix	trans	-72.2	-29.3	175.8	73.6	0	0	0	0	112	E745 A746 P752	E745-S748 PolarHBondContact O-N 3.27Å; E745-S748 PolarHBondContact O-OG 2.95Å; A746-S748 VanDerWaalsContact C-N 3.33Å; A746-S748 PolarHBondContact O-N 3.14Å; S748-P752 WeakPolarHBondContact O-CD 3.39Å; S748-P752 VanDerWaalsContact O-CG 3.3Å; S748-P752 WeakPolarHBondContact O-CG 3.45Å
749	I	74.9	Confident	73.6	Confident	26 Å²	26	52.6 Å²	52.6	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-76.1	-51.8	175.5	-56.9	175.5	0	0	0	110.9	R707 A746 A747 H753	R707-I749 HydrophobicContact CG-CD1 4.19Å; R707-I749 HydrophobicContact CG-CG2 4.16Å; A746-I749 PolarHBondContact O-N 3.03Å; A747-I749 VanDerWaalsContact C-N 3.33Å; I749-H753 PolarHBondContact O-CE1 2.82Å; I749-H753 PolarHBondContact O-ND1 3.42Å
750	F	79.5	Confident	74.3	Confident	1 Å²	1	57.2 Å²	57.2	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-69.9	-47.9	-176.5	-75.4	-60.9	0	0	0	112.3	M706 W709 C710 F728 W739 A746 H753 L754 L800	M706-F750 HydrophobicContact CB-CZ 4.11Å; M706-F750 HydrophobicContact CE-CE2 3.86Å; M706-F750 HydrophobicContact CE-CZ 4.22Å; W709-F750 HydrophobicContact CE3-CD1 4.24Å; W709-F750 AromaticContact CE3-CE1 3.75Å; W709-F750 HydrophobicContact CE3-CE1 3.75Å; W709-F750 HydrophobicContact CZ3-CD1 4.13Å; W709-F750 AromaticContact CZ3-CE1 3.96Å; W709-F750 HydrophobicContact CZ3-CE1 3.96Å; C710-F750 WeakPolarHBondContact SG-CD1 3.42Å; C710-F750 VanDerWaalsContact SG-CE1 3.54Å; F728-F750 HydrophobicContact CE2-CE1 4.3Å; F728-F750 HydrophobicContact CE2-CZ 4.43Å; W739-F750 HydrophobicContact CE3-CE2 4.48Å; W739-F750 AromaticContact CH2-CE2 3.69Å; W739-F750 HydrophobicContact CH2-CE2 3.69Å; W739-F750 AromaticContact CH2-CZ 3.57Å; W739-F750 HydrophobicContact CH2-CZ 3.57Å; W739-F750 HydrophobicContact CZ2-CZ 4.36Å; W739-F750 AromaticContact CZ3-CE2 3.66Å; W739-F750 HydrophobicContact CZ3-CE2 3.66Å; W739-F750 HydrophobicContact CZ3-CZ 4.01Å; A746-F750 HydrophobicContact CB-CD2 3.82Å; A746-F750 HydrophobicContact CB-CE2 3.78Å; A746-F750 WeakPolarHBondContact O-CB 3.35Å; A746-F750 WeakPolarHBondContact O-CD2 3.28Å; A746-F750 PolarHBondContact O-N 3.37Å; F750-H753 PolarHBondContact O-N 3.46Å; F750-L754 HydrophobicContact CB-CD1 3.96Å; F750-L754 HydrophobicContact CB-CG 4.39Å; F750-L754 WeakPolarHBondContact O-CB 3.44Å; F750-L754 VanDerWaalsContact O-CG 3.27Å; F750-L754 WeakPolarHBondContact O-CG 3.4Å; F750-L754 PolarHBondContact O-N 3.19Å; F750-L800 HydrophobicContact CB-CD1 4.14Å; F750-L800 HydrophobicContact CB-CD2 4.07Å; F750-L800 HydrophobicContact CD2-CD2 3.84Å; F750-L800 HydrophobicContact CG-CD2 4.28Å
751	Y	80.9	Confident	75.3	Confident	43 Å²	43	52.9 Å²	52.9	17%	0.169	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-42.7	-165.4	-177.9	-119.5	0	0	0	114.9	A747 R755 S803 C807	A747-Y751 WeakPolarHBondContact O-CB 3.5Å; A747-Y751 PolarHBondContact O-N 3.18Å; Y751-R755 HydrophobicContact CE2-CB 4.36Å; Y751-R755 WeakPolarHBondContact O-CB 3.24Å; Y751-R755 PolarHBondContact O-N 3.36Å; Y751-S803 WeakPolarHBondContact CE2-O 3.46Å; Y751-C807 HydrophobicContact CE2-CB 4.04Å
752	P	80.7	Confident	76.1	Confident	74 Å²	74	55.3 Å²	55.3	48%	0.481	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-48.7	177.5	-24.2	35.3	0	0	0	112.9	S748 R755 E756	S748-P752 WeakPolarHBondContact O-CD 3.39Å; S748-P752 VanDerWaalsContact O-CG 3.3Å; S748-P752 WeakPolarHBondContact O-CG 3.45Å; P752-R755 PolarHBondContact O-N 2.89Å; P752-E756 PolarHBondContact O-N 3.47Å
753	H	82.2	Confident	76.8	Confident	49 Å²	49	59 Å²	59	23%	0.227	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-50.5	179.2	-61.2	86.5	0	0	0	110.9	C710 H714 I749 F750 R755 E756 I757	C710-H753 HydrophobicContact CB-CB 4.22Å; H714-H753 AromaticContact CD2-CD2 3.92Å; H714-H753 WeakPolarHBondContact NE2-CB 3.42Å; H714-H753 AromaticContact NE2-CD2 3.34Å; H714-H753 PolarHBondContact NE2-CD2 3.4Å; H714-H753 VanDerWaalsContact NE2-CD2 3.34Å; H714-H753 AromaticContact NE2-CG 3.74Å; I749-H753 PolarHBondContact O-CE1 2.82Å; I749-H753 PolarHBondContact O-ND1 3.42Å; F750-H753 PolarHBondContact O-N 3.46Å; H753-R755 VanDerWaalsContact C-N 3.32Å; H753-R755 PolarHBondContact O-N 3.23Å; H753-E756 PolarHBondContact O-N 3.07Å; H753-I757 WeakPolarHBondContact O-CD1 3.47Å; H753-I757 VanDerWaalsContact O-CG1 3.31Å; H753-I757 WeakPolarHBondContact O-CG1 3.44Å; H753-I757 PolarHBondContact O-N 3.3Å; H753-I757 VanDerWaalsContact O-N 3.09Å
754	L	83.7	Confident	77.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-40.3	177.9	-65.6	-176.9	0	0	0	112.2	W709 L713 L725 F728 F750 I757 I758 L804	W709-L754 HydrophobicContact CH2-CD2 4.39Å; W709-L754 HydrophobicContact CZ3-CD2 4.15Å; L713-L754 HydrophobicContact CD1-CD2 4.06Å; L725-L754 HydrophobicContact CD1-CD2 3.57Å; F728-L754 HydrophobicContact CE1-CD1 3.98Å; F728-L754 HydrophobicContact CZ-CD1 4.29Å; F750-L754 HydrophobicContact CB-CD1 3.96Å; F750-L754 HydrophobicContact CB-CG 4.39Å; F750-L754 WeakPolarHBondContact O-CB 3.44Å; F750-L754 VanDerWaalsContact O-CG 3.27Å; F750-L754 WeakPolarHBondContact O-CG 3.4Å; F750-L754 PolarHBondContact O-N 3.19Å; L754-I757 PolarHBondContact O-N 3.27Å; L754-I758 WeakPolarHBondContact O-CB 3.16Å; L754-I758 WeakPolarHBondContact O-CD1 3.33Å; L754-I758 VanDerWaalsContact O-CG1 3.24Å; L754-I758 WeakPolarHBondContact O-CG1 3.48Å; L754-I758 PolarHBondContact O-N 3.43Å; L754-L804 HydrophobicContact CB-CD1 4.2Å; L754-L804 HydrophobicContact CD1-CD1 4.02Å
755	R	82.5	Confident	78.1	Confident	107 Å²	107	54.6 Å²	54.6	40%	0.404	26%	0.262	S	S	.	.	H	α-helix	trans	-65	-43.8	178.1	178.2	177.1	-176	-129.5	-5.8	112.1	Y751 P752 H753 I758 Y759	Y751-R755 HydrophobicContact CE2-CB 4.36Å; Y751-R755 WeakPolarHBondContact O-CB 3.24Å; Y751-R755 PolarHBondContact O-N 3.36Å; P752-R755 PolarHBondContact O-N 2.89Å; H753-R755 VanDerWaalsContact C-N 3.32Å; H753-R755 PolarHBondContact O-N 3.23Å; R755-I758 PolarHBondContact O-N 3Å; R755-Y759 HydrophobicContact CG-CD2 3.96Å; R755-Y759 HydrophobicContact CG-CE2 3.48Å; R755-Y759 VanDerWaalsContact CG-CE2 3.48Å; R755-Y759 WeakPolarHBondContact O-CD2 3.4Å; R755-Y759 PolarHBondContact O-N 3.01Å
756	E	81.1	Confident	78.7	Confident	96 Å²	96	52.6 Å²	52.6	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-47.7	176	-163.2	-161.1	132.6	0	0	111	H714 P752 H753 Y759 Q760	H714-E756 IonicContact CE1-OE1 2.77Å; H714-E756 IonicContact CE1-OE2 3.39Å; H714-E756 PolarHBondContact CE1-OE2 3.02Å; H714-E756 VanDerWaalsContact CE1-OE2 3.3Å; H714-E756 IonicContact ND1-OE1 3.17Å; H714-E756 IonicContact ND1-OE2 3.63Å; P752-E756 PolarHBondContact O-N 3.47Å; H753-E756 PolarHBondContact O-N 3.07Å; E756-Y759 PolarHBondContact O-N 3.03Å; E756-Q760 WeakPolarHBondContact O-CG 3.37Å; E756-Q760 PolarHBondContact O-N 3.18Å; E756-Q760 PolarHBondContact OE1-NE2 2.96Å
757	I	81.4	Confident	79.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-47	178.8	-68.1	159.4	0	0	0	111.3	L713 Q721 L725 H753 L754 Y759 Q760 L761	L713-I757 HydrophobicContact CB-CD1 3.46Å; L713-I757 VanDerWaalsContact CB-CD1 3.46Å; L713-I757 HydrophobicContact CD1-CD1 3.81Å; L713-I757 HydrophobicContact CG-CD1 4.3Å; Q721-I757 HydrophobicContact CG-CG2 3.85Å; L725-I757 HydrophobicContact CD2-CG2 4.22Å; H753-I757 WeakPolarHBondContact O-CD1 3.47Å; H753-I757 VanDerWaalsContact O-CG1 3.31Å; H753-I757 WeakPolarHBondContact O-CG1 3.44Å; H753-I757 PolarHBondContact O-N 3.3Å; H753-I757 VanDerWaalsContact O-N 3.09Å; L754-I757 PolarHBondContact O-N 3.27Å; I757-Y759 VanDerWaalsContact C-N 3.32Å; I757-Y759 PolarHBondContact O-N 3.22Å; I757-Q760 WeakPolarHBondContact O-CA 3.23Å; I757-Q760 WeakPolarHBondContact O-CB 3.12Å; I757-Q760 PolarHBondContact O-N 2.91Å; I757-L761 PolarHBondContact O-N 2.88Å
758	I	82.8	Confident	79.8	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-40.5	-178.8	-76.7	164.9	0	0	0	111.8	L725 L754 R755 Q760 L761 I764 L804 L808 A811	L725-I758 HydrophobicContact CD2-CG1 4Å; L754-I758 WeakPolarHBondContact O-CB 3.16Å; L754-I758 WeakPolarHBondContact O-CD1 3.33Å; L754-I758 VanDerWaalsContact O-CG1 3.24Å; L754-I758 WeakPolarHBondContact O-CG1 3.48Å; L754-I758 PolarHBondContact O-N 3.43Å; R755-I758 PolarHBondContact O-N 3Å; I758-Q760 VanDerWaalsContact C-N 3.26Å; I758-Q760 PolarHBondContact O-N 3.1Å; I758-L761 WeakPolarHBondContact O-CB 3.47Å; I758-L761 PolarHBondContact O-N 3.2Å; I758-I764 HydrophobicContact CG2-CD1 4.08Å; I758-L804 HydrophobicContact CD1-CD1 3.51Å; I758-L808 HydrophobicContact CD1-CD2 3.7Å; I758-L808 HydrophobicContact CD1-CG 4.09Å; I758-L808 HydrophobicContact CG1-CD2 3.94Å; I758-L808 HydrophobicContact CG2-CD2 4Å; I758-A811 HydrophobicContact CG2-CB 3.6Å
759	Y	81.8	Confident	80.1	Confident	88 Å²	88	52.7 Å²	52.7	35%	0.345	24%	0.241	S	C	.	.	H	α-helix	trans	-72.1	-15.6	175.1	-66.8	-50.5	0	0	0	114.3	R755 E756 I757 D810 A811	R755-Y759 HydrophobicContact CG-CD2 3.96Å; R755-Y759 HydrophobicContact CG-CE2 3.48Å; R755-Y759 VanDerWaalsContact CG-CE2 3.48Å; R755-Y759 WeakPolarHBondContact O-CD2 3.4Å; R755-Y759 PolarHBondContact O-N 3.01Å; E756-Y759 PolarHBondContact O-N 3.03Å; I757-Y759 VanDerWaalsContact C-N 3.32Å; I757-Y759 PolarHBondContact O-N 3.22Å; Y759-D810 WeakPolarHBondContact CE1-OD2 3.25Å; Y759-D810 VanDerWaalsContact CZ-OD2 3.29Å; Y759-D810 PolarHBondContact OH-OD2 2.92Å; Y759-A811 HydrophobicContact CD1-CB 4Å; Y759-A811 HydrophobicContact CE1-CB 4.17Å
760	Q	80.5	Confident	80.3	Confident	108 Å²	108	55.7 Å²	55.7	51%	0.505	26%	0.257	S	S	.	.	H	α-helix	trans	-85.4	-12	173.2	-67.3	178.1	28.5	0	0	113.1	E756 I757 I758 K762	E756-Q760 WeakPolarHBondContact O-CG 3.37Å; E756-Q760 PolarHBondContact O-N 3.18Å; E756-Q760 PolarHBondContact OE1-NE2 2.96Å; I757-Q760 WeakPolarHBondContact O-CA 3.23Å; I757-Q760 WeakPolarHBondContact O-CB 3.12Å; I757-Q760 PolarHBondContact O-N 2.91Å; I758-Q760 VanDerWaalsContact C-N 3.26Å; I758-Q760 PolarHBondContact O-N 3.1Å; Q760-K762 PolarHBondContact O-N 3.16Å; Q760-K762 VanDerWaalsContact O-N 3.12Å
761	L	80.9	Confident	80.3	Confident	14 Å²	14	55.9 Å²	55.9	7%	0.073	26%	0.258	C	S	.	.			trans	-71.6	103.6	179.8	-63.5	-176.8	0	0	0	112.4	T718 T722 L725 I757 I758 H763 I764 F767	T718-L761 HydrophobicContact CG2-CD2 4.21Å; T722-L761 HydrophobicContact CG2-CD2 3.55Å; L725-L761 HydrophobicContact CD2-CD1 4.31Å; I757-L761 PolarHBondContact O-N 2.88Å; I758-L761 WeakPolarHBondContact O-CB 3.47Å; I758-L761 PolarHBondContact O-N 3.2Å; L761-H763 PolarHBondContact O-N 3.09Å; L761-H763 VanDerWaalsContact O-N 3.12Å; L761-I764 HydrophobicContact CB-CD1 4.48Å; L761-I764 HydrophobicContact CD1-CD1 4.08Å; L761-F767 HydrophobicContact CD1-CB 4.31Å; L761-F767 HydrophobicContact CD1-CD1 3.91Å; L761-F767 HydrophobicContact CD1-CD2 4.13Å; L761-F767 HydrophobicContact CD1-CE1 4.33Å; L761-F767 HydrophobicContact CD1-CG 3.82Å
762	K	75.2	Confident	80.2	Confident	165 Å²	165	54.3 Å²	54.3	72%	0.717	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.7	176.1	-65.6	-178.7	-178.3	176.8	0	114.9	Q760	Q760-K762 PolarHBondContact O-N 3.16Å; Q760-K762 VanDerWaalsContact O-N 3.12Å
763	H	77.1	Confident	79.9	Confident	129 Å²	129	53.4 Å²	53.4	60%	0.597	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.1	50.7	-173.3	-65.4	-88.2	0	0	0	111.1	L761 N765 D766 F767	L761-H763 PolarHBondContact O-N 3.09Å; L761-H763 VanDerWaalsContact O-N 3.12Å; H763-N765 PolarHBondContact O-N 2.92Å; H763-D766 HydrophobicContact CB-CB 4.37Å; H763-D766 IonicContact ND1-OD2 3.73Å; H763-D766 PolarHBondContact O-N 3.45Å; H763-D766 VanDerWaalsContact O-N 3.16Å; H763-F767 PolarHBondContact O-N 3.1Å
764	I	80.8	Confident	79.3	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-32.1	-176.7	-171.7	64	0	0	0	113.4	I758 L761 F767 L768 L808 A811 A815	I758-I764 HydrophobicContact CG2-CD1 4.08Å; L761-I764 HydrophobicContact CB-CD1 4.48Å; L761-I764 HydrophobicContact CD1-CD1 4.08Å; I764-F767 HydrophobicContact CD1-CD1 4.06Å; I764-F767 PolarHBondContact O-N 3.32Å; I764-L768 HydrophobicContact CG1-CD1 4.48Å; I764-L768 WeakPolarHBondContact O-CB 3.29Å; I764-L768 PolarHBondContact O-N 3.36Å; I764-L808 HydrophobicContact CD1-CD2 3.87Å; I764-A811 HydrophobicContact CD1-CB 4.26Å; I764-A811 HydrophobicContact CG1-CB 3.93Å; I764-A815 HydrophobicContact CG2-CB 3.32Å
765	N	76.5	Confident	78.6	Confident	27 Å²	27	52.8 Å²	52.8	14%	0.144	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-43.5	177.7	-64.3	10.9	0	0	0	111.2	H763 F767 L768 R769 C812 D823	H763-N765 PolarHBondContact O-N 2.92Å; N765-F767 VanDerWaalsContact C-N 3.33Å; N765-F767 PolarHBondContact O-N 2.97Å; N765-L768 PolarHBondContact O-N 3.22Å; N765-R769 VanDerWaalsContact O-CG 3.23Å; N765-R769 WeakPolarHBondContact O-CG 3.28Å; N765-R769 PolarHBondContact O-N 3.46Å; N765-C812 PolarHBondContact OD1-SG 2.71Å; N765-D823 HydrophobicContact CB-CB 4.35Å; N765-D823 VanDerWaalsContact ND2-CB 3.28Å; N765-D823 WeakPolarHBondContact ND2-CB 3.27Å; N765-D823 PolarHBondContact ND2-OD2 3.49Å
766	D	78.3	Confident	77.7	Confident	79 Å²	79	51.7 Å²	51.7	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-68.9	-33.3	175.8	-59.2	-45.8	0	0	0	111.8	H763 R769 L770	H763-D766 HydrophobicContact CB-CB 4.37Å; H763-D766 IonicContact ND1-OD2 3.73Å; H763-D766 PolarHBondContact O-N 3.45Å; H763-D766 VanDerWaalsContact O-N 3.16Å; D766-R769 PolarHBondContact O-N 3.37Å; D766-R769 IonicContact OD1-CZ 3.97Å; D766-R769 IonicContact OD1-NH1 2.66Å; D766-R769 PolarHBondContact OD1-NH1 3.01Å; D766-L770 WeakPolarHBondContact O-CB 3.48Å; D766-L770 PolarHBondContact O-N 2.9Å
767	F	82.3	Confident	76.7	Confident	8 Å²	8	53.6 Å²	53.6	4%	0.035	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-42	170.6	-179.4	-96.7	0	0	0	112.5	T722 L725 I729 L761 H763 I764 N765 L770 C771 L808	T722-F767 HydrophobicContact CG2-CD2 4.03Å; T722-F767 HydrophobicContact CG2-CE2 4.48Å; L725-F767 HydrophobicContact CB-CE2 4.22Å; L725-F767 HydrophobicContact CB-CZ 4.06Å; L725-F767 HydrophobicContact CD2-CE1 4.09Å; L725-F767 HydrophobicContact CD2-CE2 4.17Å; L725-F767 HydrophobicContact CD2-CZ 3.6Å; L725-F767 HydrophobicContact CG-CE1 4.44Å; L725-F767 HydrophobicContact CG-CE2 4.26Å; L725-F767 HydrophobicContact CG-CZ 3.63Å; I729-F767 HydrophobicContact CD1-CE1 3.96Å; I729-F767 HydrophobicContact CD1-CZ 3.92Å; L761-F767 HydrophobicContact CD1-CB 4.31Å; L761-F767 HydrophobicContact CD1-CD1 3.91Å; L761-F767 HydrophobicContact CD1-CD2 4.13Å; L761-F767 HydrophobicContact CD1-CE1 4.33Å; L761-F767 HydrophobicContact CD1-CG 3.82Å; H763-F767 PolarHBondContact O-N 3.1Å; I764-F767 HydrophobicContact CD1-CD1 4.06Å; I764-F767 PolarHBondContact O-N 3.32Å; N765-F767 VanDerWaalsContact C-N 3.33Å; N765-F767 PolarHBondContact O-N 2.97Å; F767-L770 WeakPolarHBondContact O-CB 3.26Å; F767-L770 PolarHBondContact O-N 3.42Å; F767-C771 WeakPolarHBondContact CE1-SG 3.24Å; F767-C771 WeakPolarHBondContact CZ-SG 3.46Å; F767-C771 PolarHBondContact O-N 3.28Å; F767-C771 PolarHBondContact O-SG 3.48Å; F767-L808 HydrophobicContact CD1-CD2 4.13Å; F767-L808 HydrophobicContact CE1-CD2 3.86Å
768	L	80	Confident	75.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-38.3	174	-88.1	170.6	0	0	0	112.1	I764 N765 L770 C771 F772 L808 C812 F827	I764-L768 HydrophobicContact CG1-CD1 4.48Å; I764-L768 WeakPolarHBondContact O-CB 3.29Å; I764-L768 PolarHBondContact O-N 3.36Å; N765-L768 PolarHBondContact O-N 3.22Å; L768-L770 VanDerWaalsContact C-N 3.31Å; L768-L770 PolarHBondContact O-N 2.9Å; L768-C771 PolarHBondContact O-N 2.92Å; L768-F772 HydrophobicContact CD2-CD2 3.78Å; L768-F772 HydrophobicContact CD2-CE2 3.99Å; L768-F772 PolarHBondContact O-N 2.91Å; L768-L808 HydrophobicContact CD2-CB 4.08Å; L768-L808 HydrophobicContact CD2-CD1 4.28Å; L768-C812 HydrophobicContact CD1-CB 3.63Å; L768-F827 HydrophobicContact CB-CD1 4.3Å; L768-F827 HydrophobicContact CB-CD2 4.12Å; L768-F827 HydrophobicContact CB-CE1 3.86Å; L768-F827 HydrophobicContact CB-CE2 3.69Å; L768-F827 HydrophobicContact CB-CG 4.44Å; L768-F827 HydrophobicContact CB-CZ 3.56Å; L768-F827 HydrophobicContact CD1-CD2 3.89Å; L768-F827 HydrophobicContact CD1-CE2 4.24Å; L768-F827 HydrophobicContact CD1-CG 4.17Å; L768-F827 HydrophobicContact CD2-CD1 4.44Å
769	R	79.3	Confident	74.1	Confident	87 Å²	87	59.6 Å²	59.6	33%	0.328	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-35	172.5	-68.3	170.6	-176	162.8	-7.1	112.3	N765 D766 P773 L776 D823 F827	N765-R769 VanDerWaalsContact O-CG 3.23Å; N765-R769 WeakPolarHBondContact O-CG 3.28Å; N765-R769 PolarHBondContact O-N 3.46Å; D766-R769 PolarHBondContact O-N 3.37Å; D766-R769 IonicContact OD1-CZ 3.97Å; D766-R769 IonicContact OD1-NH1 2.66Å; D766-R769 PolarHBondContact OD1-NH1 3.01Å; R769-P773 WeakPolarHBondContact O-CA 3.34Å; R769-L776 HydrophobicContact CB-CD1 4.08Å; R769-L776 HydrophobicContact CG-CD1 3.95Å; R769-L776 HydrophobicContact CG-CD2 4.07Å; R769-L776 HydrophobicContact CG-CG 4.22Å; R769-D823 IonicContact CZ-OD1 2.92Å; R769-D823 IonicContact CZ-OD2 3.43Å; R769-D823 IonicContact NE-OD1 3.73Å; R769-D823 PolarHBondContact NE-OD1 3.4Å; R769-D823 IonicContact NH2-OD1 2.88Å; R769-D823 PolarHBondContact NH2-OD1 2.91Å; R769-D823 IonicContact NH2-OD2 2.73Å; R769-D823 PolarHBondContact NH2-OD2 3.25Å; R769-F827 HydrophobicContact CG-CE2 4.48Å; R769-F827 HydrophobicContact CG-CZ 3.89Å
770	L	79	Confident	72.6	Confident	89 Å²	89	61.4 Å²	61.4	47%	0.466	29%	0.292	S	S	.	.	H	α-helix	trans	-71.8	-35.7	174.8	-177.4	68.2	0	0	0	112.9	H730 D766 F767 L768	H730-L770 PolarHBondContact NE2-O 2.97Å; D766-L770 WeakPolarHBondContact O-CB 3.48Å; D766-L770 PolarHBondContact O-N 2.9Å; F767-L770 WeakPolarHBondContact O-CB 3.26Å; F767-L770 PolarHBondContact O-N 3.42Å; L768-L770 VanDerWaalsContact C-N 3.31Å; L768-L770 PolarHBondContact O-N 2.9Å
771	C	78.9	Confident	70.8	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.027	31%	0.305	C	S	.	.	H	α-helix	trans	-81.4	-37.7	179.2	-64.3	0	0	0	0	112.9	I729 H730 F767 L768 P773	I729-C771 HydrophobicContact CG2-CB 4.15Å; H730-C771 PolarHBondContact CE1-O 3.39Å; F767-C771 WeakPolarHBondContact CE1-SG 3.24Å; F767-C771 WeakPolarHBondContact CZ-SG 3.46Å; F767-C771 PolarHBondContact O-N 3.28Å; F767-C771 PolarHBondContact O-SG 3.48Å; L768-C771 PolarHBondContact O-N 2.92Å; C771-P773 VanDerWaalsContact C-CD 3.43Å; C771-P773 WeakPolarHBondContact O-CD 3.43Å
772	F	79.7	Confident	68.8	Low	11 Å²	11	65 Å²	65	5%	0.048	32%	0.319	C	S	.	.			trans	-128.7	62.6	-174.3	-54.5	-74.5	0	0	0	111.6	I729 L768 D774 A775 L792 L795 L808 F827 Y830 F831	I729-F772 HydrophobicContact CG2-CE1 4.29Å; I729-F772 HydrophobicContact CG2-CE2 4.38Å; I729-F772 HydrophobicContact CG2-CZ 3.77Å; L768-F772 HydrophobicContact CD2-CD2 3.78Å; L768-F772 HydrophobicContact CD2-CE2 3.99Å; L768-F772 PolarHBondContact O-N 2.91Å; F772-D774 PolarHBondContact O-N 3.22Å; F772-D774 VanDerWaalsContact O-N 3.08Å; F772-A775 HydrophobicContact CB-CB 4.38Å; F772-A775 WeakPolarHBondContact O-CB 3.49Å; F772-A775 PolarHBondContact O-N 3.39Å; F772-L792 HydrophobicContact CE1-CD1 4.23Å; F772-L795 HydrophobicContact CE1-CD1 4.24Å; F772-L795 HydrophobicContact CZ-CD1 4.37Å; F772-L808 HydrophobicContact CE2-CD1 4.2Å; F772-F827 HydrophobicContact CB-CE1 4.33Å; F772-Y830 HydrophobicContact CB-CE1 4.26Å; F772-Y830 HydrophobicContact CD1-CE1 4.35Å; F772-F831 HydrophobicContact CD1-CE1 4.39Å; F772-F831 HydrophobicContact CD1-CZ 4.37Å; F772-F831 AromaticContact CD2-CZ 3.86Å; F772-F831 HydrophobicContact CD2-CZ 3.86Å; F772-F831 HydrophobicContact CE1-CE1 4.15Å; F772-F831 HydrophobicContact CE1-CZ 4.26Å; F772-F831 HydrophobicContact CE2-CE1 4.4Å; F772-F831 AromaticContact CE2-CZ 3.74Å; F772-F831 HydrophobicContact CE2-CZ 3.74Å; F772-F831 HydrophobicContact CG-CZ 4.17Å; F772-F831 HydrophobicContact CZ-CE1 4.16Å; F772-F831 AromaticContact CZ-CZ 3.95Å; F772-F831 HydrophobicContact CZ-CZ 3.95Å
773	P	73.8	Confident	67.1	Low	54 Å²	54	66.7 Å²	66.7	35%	0.351	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.6	-179.7	27.7	-36.5	0	0	0	113.4	R769 C771	R769-P773 WeakPolarHBondContact O-CA 3.34Å; C771-P773 VanDerWaalsContact C-CD 3.43Å; C771-P773 WeakPolarHBondContact O-CD 3.43Å
774	D	70.2	Confident	65.5	Low	37 Å²	37	67.4 Å²	67.4	20%	0.198	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-22.4	173.7	-64	-55.3	0	0	0	113.5	F772 L776 K777 I786 Y830	F772-D774 PolarHBondContact O-N 3.22Å; F772-D774 VanDerWaalsContact O-N 3.08Å; D774-L776 VanDerWaalsContact C-N 3.27Å; D774-L776 PolarHBondContact O-N 2.93Å; D774-K777 WeakPolarHBondContact O-CB 3.14Å; D774-K777 PolarHBondContact O-N 3.46Å; D774-K777 VanDerWaalsContact O-N 3.08Å; D774-K777 WeakPolarHBondContact OD1-CD 3.26Å; D774-K777 WeakPolarHBondContact OD1-CE 3.43Å; D774-K777 IonicContact OD1-NZ 3.77Å; D774-K777 PolarHBondContact OD1-NZ 2.76Å; D774-I786 HydrophobicContact CB-CG2 4.28Å; D774-Y830 HydrophobicContact CB-CE2 4.29Å
775	A	67.9	Low	64.1	Low	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-63.8	-34.8	172.2	0	0	0	0	0	111.7	F772 K777 M778 Q826 F827 Y830	F772-A775 HydrophobicContact CB-CB 4.38Å; F772-A775 WeakPolarHBondContact O-CB 3.49Å; F772-A775 PolarHBondContact O-N 3.39Å; A775-K777 PolarHBondContact O-N 3.28Å; A775-M778 WeakPolarHBondContact O-CB 3.44Å; A775-M778 PolarHBondContact O-N 2.86Å; A775-Q826 PolarHBondContact O-NE2 3.48Å; A775-F827 HydrophobicContact CB-CD1 3.69Å; A775-F827 HydrophobicContact CB-CE1 3.6Å; A775-Y830 HydrophobicContact CB-CD1 3.74Å; A775-Y830 HydrophobicContact CB-CD2 3.94Å; A775-Y830 HydrophobicContact CB-CE1 4.21Å; A775-Y830 HydrophobicContact CB-CE2 4.4Å; A775-Y830 HydrophobicContact CB-CG 3.57Å
776	L	64.2	Low	63.1	Low	84 Å²	84	72.2 Å²	72.2	44%	0.44	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-65.2	-21.9	174	-68.8	178.4	0	0	0	113.3	R769 D774 M778	R769-L776 HydrophobicContact CB-CD1 4.08Å; R769-L776 HydrophobicContact CG-CD1 3.95Å; R769-L776 HydrophobicContact CG-CD2 4.07Å; R769-L776 HydrophobicContact CG-CG 4.22Å; D774-L776 VanDerWaalsContact C-N 3.27Å; D774-L776 PolarHBondContact O-N 2.93Å; L776-M778 VanDerWaalsContact C-N 3.32Å
777	K	60.1	Low	62.1	Low	135 Å²	135	73.5 Å²	73.5	59%	0.587	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-87.5	-0.9	179.6	-55.8	173.4	-165.7	164.4	0	112.8	D774 A775 N779	D774-K777 WeakPolarHBondContact O-CB 3.14Å; D774-K777 PolarHBondContact O-N 3.46Å; D774-K777 VanDerWaalsContact O-N 3.08Å; D774-K777 WeakPolarHBondContact OD1-CD 3.26Å; D774-K777 WeakPolarHBondContact OD1-CE 3.43Å; D774-K777 IonicContact OD1-NZ 3.77Å; D774-K777 PolarHBondContact OD1-NZ 2.76Å; A775-K777 PolarHBondContact O-N 3.28Å; K777-N779 VanDerWaalsContact C-N 3.32Å; K777-N779 PolarHBondContact O-N 2.81Å
778	M	57.3	Low	61.3	Low	33 Å²	33	73.7 Å²	73.7	16%	0.163	38%	0.38	C	S	.	.			trans	-74.7	81.1	-176.3	-168.9	167.8	178.1	0	0	112.2	A775 L776 Y780 I786 Y830 Y833	A775-M778 WeakPolarHBondContact O-CB 3.44Å; A775-M778 PolarHBondContact O-N 2.86Å; L776-M778 VanDerWaalsContact C-N 3.32Å; M778-Y780 HydrophobicContact CE-CE1 4.39Å; M778-Y780 PolarHBondContact O-N 3.46Å; M778-I786 HydrophobicContact CB-CD1 3.8Å; M778-I786 HydrophobicContact CG-CD1 3.95Å; M778-Y830 HydrophobicContact SD-CD2 4.36Å; M778-Y833 HydrophobicContact CE-CD2 4.45Å; M778-Y833 HydrophobicContact CE-CG 4.18Å
779	N	51.2	Low	61	Low	95 Å²	95	76.5 Å²	76.5	51%	0.508	40%	0.398	S	S	.	.			trans	-82.5	98.4	176.8	-169.9	19.3	0	0	0	110.8	K777 D781 S782	K777-N779 VanDerWaalsContact C-N 3.32Å; K777-N779 PolarHBondContact O-N 2.81Å; N779-D781 PolarHBondContact O-N 3.11Å; N779-S782 PolarHBondContact O-N 3.1Å; N779-S782 PolarHBondContact O-OG 3.47Å
780	Y	52.1	Low	60.5	Low	126 Å²	126	77 Å²	77	49%	0.494	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.7	-170.7	-65.9	-83.6	0	0	0	115.6	M778 S782 A829	M778-Y780 HydrophobicContact CE-CE1 4.39Å; M778-Y780 PolarHBondContact O-N 3.46Å; Y780-S782 PolarHBondContact O-N 2.89Å; Y780-A829 HydrophobicContact CE1-CB 4.14Å
781	D	42.1	Very low	60.5	Low	146 Å²	146	73.8 Å²	73.8	78%	0.781	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	5.9	-173	-68	-42.6	0	0	0	115.2	N779	N779-D781 PolarHBondContact O-N 3.11Å
782	S	38.8	Very low	60.4	Low	53 Å²	53	73.6 Å²	73.6	37%	0.371	39%	0.389	S	S	.	.	S	Bend	trans	-135.1	144.7	-170.4	66.8	0	0	0	0	115.2	N779 Y780 L784	N779-S782 PolarHBondContact O-N 3.1Å; N779-S782 PolarHBondContact O-OG 3.47Å; Y780-S782 PolarHBondContact O-N 2.89Å; S782-L784 PolarHBondContact O-N 3.46Å
783	Q	40.1	Very low	60.1	Low	200 Å²	200	76.1 Å²	76.1	94%	0.935	40%	0.4	S	S	*	.			trans	-74.8	25.1	-175.5	-62.1	177.4	-7.4	0	0	114.2	T785	Q783-T785 PolarHBondContact O-N 2.6Å
784	L	42.4	Very low	60.1	Low	143 Å²	143	73.9 Å²	73.9	75%	0.749	39%	0.385	S	S	*	.			trans	-75.2	106.5	175.5	-109.8	68.4	0	0	0	109.8	S782 I786	S782-L784 PolarHBondContact O-N 3.46Å; L784-I786 PolarHBondContact O-N 3.24Å
785	T	51.9	Low	60.6	Low	109 Å²	109	72.1 Å²	72.1	67%	0.669	38%	0.376	S	S	*	.			trans	-65.6	100.4	164.7	50	0	0	0	0	108.9	Q783 P787	Q783-T785 PolarHBondContact O-N 2.6Å; T785-P787 WeakPolarHBondContact O-CD 3.41Å
786	I	55.5	Low	60.9	Low	23 Å²	23	72.4 Å²	72.4	12%	0.118	38%	0.377	C	S	.	.			trans	-60.3	123.3	171.9	-54.3	174.7	0	0	0	107.1	D774 M778 L784 I788 Y833	D774-I786 HydrophobicContact CB-CG2 4.28Å; M778-I786 HydrophobicContact CB-CD1 3.8Å; M778-I786 HydrophobicContact CG-CD1 3.95Å; L784-I786 PolarHBondContact O-N 3.24Å; I786-I788 PolarHBondContact O-N 3.46Å; I786-Y833 HydrophobicContact CB-CE1 4.48Å
787	P	57.7	Low	61.2	Low	107 Å²	107	71.1 Å²	71.1	70%	0.695	38%	0.376	S	S	*	.			trans	-69.5	101	178.7	28.2	-33.2	0	0	0	109.1	T785 T789	T785-P787 WeakPolarHBondContact O-CD 3.41Å; P787-T789 PolarHBondContact O-N 3.17Å; P787-T789 VanDerWaalsContact O-N 3.09Å
788	I	65.7	Low	61.8	Low	11 Å²	11	64.9 Å²	64.9	6%	0.056	35%	0.349	C	S	.	.			trans	-61.9	114.9	175.6	-65.6	155.5	0	0	0	107.9	I786 L792 K793 Y833 A834 F837	I786-I788 PolarHBondContact O-N 3.46Å; I788-L792 HydrophobicContact CG2-CB 4.23Å; I788-L792 HydrophobicContact CG2-CD2 4.2Å; I788-L792 HydrophobicContact CG2-CG 4.25Å; I788-K793 HydrophobicContact CG2-CG 3.89Å; I788-K793 WeakPolarHBondContact O-CE 3.15Å; I788-K793 PolarHBondContact O-NZ 2.63Å; I788-Y833 HydrophobicContact CD1-CD1 4.31Å; I788-Y833 HydrophobicContact CD1-CE1 4.01Å; I788-Y833 HydrophobicContact CG1-CE1 4.3Å; I788-A834 HydrophobicContact CD1-CB 4.29Å; I788-A834 HydrophobicContact CG1-CB 4.38Å; I788-A834 HydrophobicContact CG2-CB 4.48Å; I788-F837 HydrophobicContact CD1-CB 3.31Å; I788-F837 HydrophobicContact CD1-CD1 3.81Å; I788-F837 HydrophobicContact CD1-CD2 4.04Å; I788-F837 HydrophobicContact CD1-CG 3.46Å; I788-F837 VanDerWaalsContact CD1-CG 3.46Å
789	T	72.3	Confident	62.6	Low	60 Å²	60	69.6 Å²	69.6	37%	0.368	37%	0.368	S	S	.	.			trans	-61.2	144.4	-178.4	61.6	0	0	0	0	110.5	P787 N791 L792 K793	P787-T789 PolarHBondContact O-N 3.17Å; P787-T789 VanDerWaalsContact O-N 3.09Å; T789-N791 PolarHBondContact O-N 2.92Å; T789-N791 VanDerWaalsContact O-N 3.17Å; T789-L792 PolarHBondContact O-N 2.98Å; T789-L792 PolarHBondContact OG1-N 3.36Å; T789-K793 PolarHBondContact O-N 2.84Å
790	D	70.5	Confident	63.9	Low	96 Å²	96	65.1 Å²	65.1	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-24	177.4	-59.3	-59.5	0	0	0	111.9	L733 K793 S794	L733-D790 HydrophobicContact CD2-CB 4.05Å; D790-K793 PolarHBondContact O-N 2.81Å; D790-K793 IonicContact OD1-NZ 3.59Å; D790-K793 PolarHBondContact OD1-NZ 3Å; D790-S794 WeakPolarHBondContact O-CB 3.31Å; D790-S794 PolarHBondContact O-N 3.24Å
791	N	78.2	Confident	65.3	Low	22 Å²	22	59.1 Å²	59.1	12%	0.118	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-47.7	168	-168.3	56	0	0	0	112.6	I729 H730 F732 L733 T789 K793 S794 L795	I729-N791 PolarHBondContact O-ND2 2.96Å; H730-N791 PolarHBondContact O-ND2 3.27Å; H730-N791 PolarHBondContact O-OD1 3.19Å; F732-N791 PolarHBondContact N-OD1 3.29Å; L733-N791 HydrophobicContact CB-CB 4.38Å; L733-N791 PolarHBondContact N-OD1 3.16Å; T789-N791 PolarHBondContact O-N 2.92Å; T789-N791 VanDerWaalsContact O-N 3.17Å; N791-K793 PolarHBondContact O-N 2.97Å; N791-S794 PolarHBondContact O-N 3.08Å; N791-S794 VanDerWaalsContact O-N 3.1Å; N791-S794 PolarHBondContact O-OG 2.97Å; N791-L795 PolarHBondContact O-N 3.32Å
792	L	76.6	Confident	66.8	Low	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-35.8	175.5	-178.8	54.7	0	0	0	112.4	F772 I788 T789 S794 L795 L796 I805 Y830 F831 A834	F772-L792 HydrophobicContact CE1-CD1 4.23Å; I788-L792 HydrophobicContact CG2-CB 4.23Å; I788-L792 HydrophobicContact CG2-CD2 4.2Å; I788-L792 HydrophobicContact CG2-CG 4.25Å; T789-L792 PolarHBondContact O-N 2.98Å; T789-L792 PolarHBondContact OG1-N 3.36Å; L792-S794 VanDerWaalsContact C-N 3.3Å; L792-S794 PolarHBondContact O-N 3Å; L792-L795 PolarHBondContact O-N 3.32Å; L792-L796 HydrophobicContact CD1-CD1 3.9Å; L792-L796 HydrophobicContact CD1-CG 4.07Å; L792-L796 HydrophobicContact CG-CD1 3.98Å; L792-L796 WeakPolarHBondContact O-CB 3.38Å; L792-L796 PolarHBondContact O-N 3.14Å; L792-I805 HydrophobicContact CD1-CD1 4.19Å; L792-Y830 HydrophobicContact CD2-CE1 3.53Å; L792-Y830 WeakPolarHBondContact CD2-OH 3.33Å; L792-F831 HydrophobicContact CD1-CD1 4.06Å; L792-F831 HydrophobicContact CD1-CE1 3.81Å; L792-A834 HydrophobicContact CD2-CB 3.85Å; L792-A834 HydrophobicContact CG-CB 4.37Å
793	K	74	Confident	68.6	Low	64 Å²	64	50.7 Å²	50.7	28%	0.278	27%	0.273	S	S	.	.	H	α-helix	trans	-60.7	-41.2	170	-58.8	175.3	-163.2	150.5	0	111.2	I788 T789 D790 N791 L796 S797 I838	I788-K793 HydrophobicContact CG2-CG 3.89Å; I788-K793 WeakPolarHBondContact O-CE 3.15Å; I788-K793 PolarHBondContact O-NZ 2.63Å; T789-K793 PolarHBondContact O-N 2.84Å; D790-K793 PolarHBondContact O-N 2.81Å; D790-K793 IonicContact OD1-NZ 3.59Å; D790-K793 PolarHBondContact OD1-NZ 3Å; N791-K793 PolarHBondContact O-N 2.97Å; K793-L796 PolarHBondContact O-N 2.98Å; K793-S797 WeakPolarHBondContact O-CB 3.4Å; K793-S797 PolarHBondContact O-N 3.08Å; K793-S797 PolarHBondContact O-OG 2.66Å; K793-I838 HydrophobicContact CG-CG1 4.48Å
794	S	73.9	Confident	70.7	Confident	6 Å²	6	41.3 Å²	41.3	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-70.2	-29.2	-179.8	82.1	0	0	0	0	113.8	R736 D790 N791 L792 C798	R736-S794 PolarHBondContact NH1-O 2.82Å; D790-S794 WeakPolarHBondContact O-CB 3.31Å; D790-S794 PolarHBondContact O-N 3.24Å; N791-S794 PolarHBondContact O-N 3.08Å; N791-S794 VanDerWaalsContact O-N 3.1Å; N791-S794 PolarHBondContact O-OG 2.97Å; L792-S794 VanDerWaalsContact C-N 3.3Å; L792-S794 PolarHBondContact O-N 3Å; S794-C798 VanDerWaalsContact O-CB 3.25Å; S794-C798 WeakPolarHBondContact O-CB 3.25Å
795	L	79.3	Confident	72.5	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-71.2	-50.9	170.8	-75.6	161.2	0	0	0	111.1	I729 F732 F772 N791 L792 S797 C798 G801 L802 I805	I729-L795 HydrophobicContact CG2-CD1 4.29Å; F732-L795 HydrophobicContact CB-CD2 4.02Å; F732-L795 HydrophobicContact CB-CG 4.25Å; F732-L795 HydrophobicContact CD1-CD2 3.5Å; F732-L795 VanDerWaalsContact CD1-CD2 3.5Å; F732-L795 HydrophobicContact CD1-CG 3.73Å; F732-L795 HydrophobicContact CD2-CD2 3.77Å; F732-L795 HydrophobicContact CE1-CD2 3.81Å; F732-L795 HydrophobicContact CE1-CG 4.26Å; F732-L795 HydrophobicContact CE2-CD2 4.06Å; F732-L795 HydrophobicContact CG-CD2 3.47Å; F732-L795 VanDerWaalsContact CG-CD2 3.47Å; F732-L795 HydrophobicContact CG-CG 4Å; F732-L795 HydrophobicContact CZ-CD2 4.08Å; F772-L795 HydrophobicContact CE1-CD1 4.24Å; F772-L795 HydrophobicContact CZ-CD1 4.37Å; N791-L795 PolarHBondContact O-N 3.32Å; L792-L795 PolarHBondContact O-N 3.32Å; L795-S797 VanDerWaalsContact C-N 3.28Å; L795-S797 PolarHBondContact O-N 3.24Å; L795-C798 PolarHBondContact O-N 3.36Å; L795-G801 CarbonylContact O-C 3.6Å; L795-G801 VanDerWaalsContact O-C 3.32Å; L795-G801 VanDerWaalsContact O-CA 3.3Å; L795-G801 WeakPolarHBondContact O-CA 3.33Å; L795-L802 PolarHBondContact O-N 2.98Å; L795-I805 HydrophobicContact CB-CD1 4.01Å
796	L	75	Confident	73.6	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-70.4	-18.8	-177.6	-73.6	169.4	0	0	0	114.2	L792 K793 L802 I805 A834 I838	L792-L796 HydrophobicContact CD1-CD1 3.9Å; L792-L796 HydrophobicContact CD1-CG 4.07Å; L792-L796 HydrophobicContact CG-CD1 3.98Å; L792-L796 WeakPolarHBondContact O-CB 3.38Å; L792-L796 PolarHBondContact O-N 3.14Å; K793-L796 PolarHBondContact O-N 2.98Å; L796-L802 HydrophobicContact CD2-CD2 3.96Å; L796-L802 WeakPolarHBondContact O-CD1 3.35Å; L796-L802 WeakPolarHBondContact O-CD2 3.13Å; L796-L802 WeakPolarHBondContact O-CG 3.46Å; L796-I805 HydrophobicContact CD2-CD1 3.62Å; L796-I805 HydrophobicContact CG-CD1 3.92Å; L796-A834 HydrophobicContact CD1-CB 3.66Å; L796-I838 HydrophobicContact CB-CD1 3.43Å; L796-I838 VanDerWaalsContact CB-CD1 3.43Å; L796-I838 HydrophobicContact CD1-CD1 3.61Å; L796-I838 HydrophobicContact CG-CD1 4.16Å
797	S	71.1	Confident	74.9	Confident	58 Å²	58	30.2 Å²	30.2	41%	0.406	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	26	173.8	59	0	0	0	0	113	R736 K793 L795	R736-S797 VanDerWaalsContact CZ-O 3.29Å; R736-S797 VanDerWaalsContact NH1-C 3.31Å; R736-S797 PolarHBondContact NH1-O 3.47Å; R736-S797 PolarHBondContact NH1-OG 3.35Å; R736-S797 PolarHBondContact NH2-O 2.92Å; K793-S797 WeakPolarHBondContact O-CB 3.4Å; K793-S797 PolarHBondContact O-N 3.08Å; K793-S797 PolarHBondContact O-OG 2.66Å; L795-S797 VanDerWaalsContact C-N 3.28Å; L795-S797 PolarHBondContact O-N 3.24Å
798	C	73	Confident	76.1	Confident	4 Å²	4	25.2 Å²	25.2	3%	0.027	13%	0.132	C	C	.	.	S	Bend	trans	-136.5	134.9	-179.8	171.6	0	0	0	0	111.1	F732 M743 S794 L795 L800 G801 L802	F732-C798 HydrophobicContact CE1-CB 4.11Å; F732-C798 HydrophobicContact CZ-CB 4.34Å; M743-C798 HydrophobicContact CE-CB 4.14Å; M743-C798 WeakPolarHBondContact CE-SG 3.41Å; M743-C798 HydrophobicContact SD-CB 4.48Å; M743-C798 PolarHBondContact SD-SG 3.31Å; S794-C798 VanDerWaalsContact O-CB 3.25Å; S794-C798 WeakPolarHBondContact O-CB 3.25Å; L795-C798 PolarHBondContact O-N 3.36Å; C798-L800 VanDerWaalsContact C-N 3.32Å; C798-L800 PolarHBondContact O-N 2.83Å; C798-L800 PolarHBondContact SG-N 3.5Å; C798-G801 PolarHBondContact O-N 2.75Å; C798-G801 VanDerWaalsContact O-N 3.17Å; C798-L802 WeakPolarHBondContact O-CB 3.29Å; C798-L802 WeakPolarHBondContact O-CD1 3.46Å; C798-L802 VanDerWaalsContact O-CG 3.31Å; C798-L802 WeakPolarHBondContact O-CG 3.45Å; C798-L802 PolarHBondContact O-N 2.98Å
799	K	73.1	Confident	76.6	Confident	131 Å²	131	25.1 Å²	25.1	57%	0.57	13%	0.132	S	C	*	.	H	α-helix	trans	-55.7	-42.7	176.5	-172.4	178	-179.7	-178.5	0	112.9	S803	K799-S803 WeakPolarHBondContact O-CB 3.16Å; K799-S803 PolarHBondContact O-N 3.27Å; K799-S803 VanDerWaalsContact O-N 3.15Å; K799-S803 PolarHBondContact O-OG 3.26Å
800	L	79.3	Confident	76.8	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-68.7	-44.5	175.9	178.6	56.9	0	0	0	111.8	F732 A747 F750 C798 S803 L804	F732-L800 HydrophobicContact CE2-CD2 4.28Å; F732-L800 HydrophobicContact CE2-CG 4.42Å; A747-L800 HydrophobicContact CB-CB 3.91Å; A747-L800 HydrophobicContact CB-CD1 4.3Å; A747-L800 HydrophobicContact CB-CG 4.5Å; F750-L800 HydrophobicContact CB-CD1 4.14Å; F750-L800 HydrophobicContact CB-CD2 4.07Å; F750-L800 HydrophobicContact CD2-CD2 3.84Å; F750-L800 HydrophobicContact CG-CD2 4.28Å; C798-L800 VanDerWaalsContact C-N 3.32Å; C798-L800 PolarHBondContact O-N 2.83Å; C798-L800 PolarHBondContact SG-N 3.5Å; L800-S803 PolarHBondContact O-N 3.12Å; L800-L804 VanDerWaalsContact O-CB 3.28Å; L800-L804 WeakPolarHBondContact O-CB 3.48Å; L800-L804 PolarHBondContact O-N 3.02Å
801	G	80.2	Confident	77.1	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.8	-38.7	-179	0	0	0	0	0	113.2	L795 C798 L804 I805	L795-G801 CarbonylContact O-C 3.6Å; L795-G801 VanDerWaalsContact O-C 3.32Å; L795-G801 VanDerWaalsContact O-CA 3.3Å; L795-G801 WeakPolarHBondContact O-CA 3.33Å; C798-G801 PolarHBondContact O-N 2.75Å; C798-G801 VanDerWaalsContact O-N 3.17Å; G801-L804 PolarHBondContact O-N 2.86Å; G801-I805 VanDerWaalsContact O-CG1 3.32Å; G801-I805 WeakPolarHBondContact O-CG1 3.44Å; G801-I805 PolarHBondContact O-N 3.41Å
802	L	74.3	Confident	77.1	Confident	11 Å²	11	19.2 Å²	19.2	6%	0.058	10%	0.099	C	C	.	.	H	α-helix	trans	-63.2	-53.5	172.2	-73.5	162.5	0	0	0	111.6	L795 L796 C798 L804 I805 F806 V853 F857	L795-L802 PolarHBondContact O-N 2.98Å; L796-L802 HydrophobicContact CD2-CD2 3.96Å; L796-L802 WeakPolarHBondContact O-CD1 3.35Å; L796-L802 WeakPolarHBondContact O-CD2 3.13Å; L796-L802 WeakPolarHBondContact O-CG 3.46Å; C798-L802 WeakPolarHBondContact O-CB 3.29Å; C798-L802 WeakPolarHBondContact O-CD1 3.46Å; C798-L802 VanDerWaalsContact O-CG 3.31Å; C798-L802 WeakPolarHBondContact O-CG 3.45Å; C798-L802 PolarHBondContact O-N 2.98Å; L802-L804 PolarHBondContact O-N 2.88Å; L802-I805 PolarHBondContact O-N 3.39Å; L802-I805 VanDerWaalsContact O-N 3.1Å; L802-F806 HydrophobicContact CB-CE2 3.89Å; L802-F806 HydrophobicContact CB-CZ 3.95Å; L802-F806 HydrophobicContact CD2-CE1 4.3Å; L802-F806 HydrophobicContact CD2-CE2 4.49Å; L802-F806 HydrophobicContact CD2-CZ 3.73Å; L802-F806 HydrophobicContact CG-CZ 4.45Å; L802-F806 WeakPolarHBondContact O-CD1 3.46Å; L802-F806 VanDerWaalsContact O-CD2 3.26Å; L802-F806 WeakPolarHBondContact O-CD2 3.44Å; L802-F806 WeakPolarHBondContact O-CG 3.33Å; L802-F806 PolarHBondContact O-N 2.94Å; L802-V853 HydrophobicContact CD1-CG1 3.69Å; L802-V853 HydrophobicContact CD2-CG1 3.51Å; L802-V853 HydrophobicContact CG-CG1 4.25Å; L802-F857 HydrophobicContact CB-CE2 4.28Å; L802-F857 HydrophobicContact CB-CZ 4.48Å; L802-F857 HydrophobicContact CD1-CE2 4.11Å
803	S	77.3	Confident	76.7	Confident	11 Å²	11	21.3 Å²	21.3	8%	0.077	12%	0.116	C	C	.	.	H	α-helix	trans	-56.7	-36.7	176	-65.5	0	0	0	0	112.4	Y751 K799 L800 F806 C807	Y751-S803 WeakPolarHBondContact CE2-O 3.46Å; K799-S803 WeakPolarHBondContact O-CB 3.16Å; K799-S803 PolarHBondContact O-N 3.27Å; K799-S803 VanDerWaalsContact O-N 3.15Å; K799-S803 PolarHBondContact O-OG 3.26Å; L800-S803 PolarHBondContact O-N 3.12Å; S803-F806 PolarHBondContact O-N 2.9Å; S803-C807 VanDerWaalsContact O-CB 3.31Å; S803-C807 WeakPolarHBondContact O-CB 3.39Å; S803-C807 PolarHBondContact O-N 3.08Å
804	L	83.2	Confident	76.6	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-66.6	-46.9	174.9	-168.3	67.5	0	0	0	111.9	F728 I729 L754 I758 L800 G801 L802 F806 C807 L808	F728-L804 HydrophobicContact CE1-CD2 4.35Å; I729-L804 HydrophobicContact CD1-CD2 4.29Å; I729-L804 HydrophobicContact CG1-CD2 3.91Å; L754-L804 HydrophobicContact CB-CD1 4.2Å; L754-L804 HydrophobicContact CD1-CD1 4.02Å; I758-L804 HydrophobicContact CD1-CD1 3.51Å; L800-L804 VanDerWaalsContact O-CB 3.28Å; L800-L804 WeakPolarHBondContact O-CB 3.48Å; L800-L804 PolarHBondContact O-N 3.02Å; G801-L804 PolarHBondContact O-N 2.86Å; L802-L804 PolarHBondContact O-N 2.88Å; L804-F806 VanDerWaalsContact C-N 3.29Å; L804-F806 PolarHBondContact O-N 3.38Å; L804-C807 PolarHBondContact O-N 3.34Å; L804-L808 HydrophobicContact CG-CD1 4.37Å; L804-L808 WeakPolarHBondContact O-CB 3.49Å; L804-L808 VanDerWaalsContact O-CG 3.26Å; L804-L808 WeakPolarHBondContact O-CG 3.41Å; L804-L808 PolarHBondContact O-N 2.87Å
805	I	80.9	Confident	76.4	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-59.2	-40.9	175.1	-73	167.9	0	0	0	110.9	L792 L795 L796 G801 L802 L808 L809 F831	L792-I805 HydrophobicContact CD1-CD1 4.19Å; L795-I805 HydrophobicContact CB-CD1 4.01Å; L796-I805 HydrophobicContact CD2-CD1 3.62Å; L796-I805 HydrophobicContact CG-CD1 3.92Å; G801-I805 VanDerWaalsContact O-CG1 3.32Å; G801-I805 WeakPolarHBondContact O-CG1 3.44Å; G801-I805 PolarHBondContact O-N 3.41Å; L802-I805 PolarHBondContact O-N 3.39Å; L802-I805 VanDerWaalsContact O-N 3.1Å; I805-L808 PolarHBondContact O-N 3.39Å; I805-L809 HydrophobicContact CG2-CD1 4.06Å; I805-L809 WeakPolarHBondContact O-CB 3.43Å; I805-L809 WeakPolarHBondContact O-CG 3.33Å; I805-L809 PolarHBondContact O-N 2.88Å; I805-F831 HydrophobicContact CD1-CD1 4.05Å; I805-F831 HydrophobicContact CD1-CE1 3.84Å; I805-F831 HydrophobicContact CG1-CD1 4.38Å; I805-F831 HydrophobicContact CG1-CE1 3.89Å; I805-F831 HydrophobicContact CG1-CZ 4.24Å; I805-F831 HydrophobicContact CG2-CB 4.48Å; I805-F831 HydrophobicContact CG2-CD1 3.8Å; I805-F831 HydrophobicContact CG2-CD2 3.95Å; I805-F831 HydrophobicContact CG2-CE1 3.93Å; I805-F831 HydrophobicContact CG2-CE2 4.08Å; I805-F831 HydrophobicContact CG2-CG 3.82Å; I805-F831 HydrophobicContact CG2-CZ 4.07Å
806	F	75.4	Confident	75.9	Confident	38 Å²	38	29.6 Å²	29.6	17%	0.167	16%	0.16	C	C	.	.	H	α-helix	trans	-70.9	-37.6	178.7	-52.9	-24.7	0	0	0	112.3	L802 S803 L804 L809 D810 F857 L860	L802-F806 HydrophobicContact CB-CE2 3.89Å; L802-F806 HydrophobicContact CB-CZ 3.95Å; L802-F806 HydrophobicContact CD2-CE1 4.3Å; L802-F806 HydrophobicContact CD2-CE2 4.49Å; L802-F806 HydrophobicContact CD2-CZ 3.73Å; L802-F806 HydrophobicContact CG-CZ 4.45Å; L802-F806 WeakPolarHBondContact O-CD1 3.46Å; L802-F806 VanDerWaalsContact O-CD2 3.26Å; L802-F806 WeakPolarHBondContact O-CD2 3.44Å; L802-F806 WeakPolarHBondContact O-CG 3.33Å; L802-F806 PolarHBondContact O-N 2.94Å; S803-F806 PolarHBondContact O-N 2.9Å; L804-F806 VanDerWaalsContact C-N 3.29Å; L804-F806 PolarHBondContact O-N 3.38Å; F806-L809 PolarHBondContact O-N 2.76Å; F806-D810 VanDerWaalsContact O-CB 3.31Å; F806-D810 WeakPolarHBondContact O-CB 3.44Å; F806-D810 PolarHBondContact O-N 2.77Å; F806-F857 HydrophobicContact CD2-CD1 4.12Å; F806-F857 HydrophobicContact CD2-CE1 4.32Å; F806-F857 HydrophobicContact CD2-CG 4.35Å; F806-F857 HydrophobicContact CE2-CB 4.1Å; F806-F857 AromaticContact CE2-CD1 3.74Å; F806-F857 HydrophobicContact CE2-CD1 3.74Å; F806-F857 AromaticContact CE2-CD2 3.69Å; F806-F857 HydrophobicContact CE2-CD2 3.69Å; F806-F857 HydrophobicContact CE2-CE1 4Å; F806-F857 AromaticContact CE2-CE2 3.97Å; F806-F857 HydrophobicContact CE2-CE2 3.97Å; F806-F857 AromaticContact CE2-CG 3.56Å; F806-F857 HydrophobicContact CE2-CG 3.56Å; F806-F857 HydrophobicContact CE2-CZ 4.11Å; F806-F857 HydrophobicContact CZ-CD2 4.26Å; F806-F857 HydrophobicContact CZ-CG 4.37Å; F806-L860 HydrophobicContact CD1-CD1 3.44Å; F806-L860 VanDerWaalsContact CD1-CD1 3.44Å; F806-L860 HydrophobicContact CD1-CD2 4.03Å; F806-L860 HydrophobicContact CD1-CG 4.32Å; F806-L860 HydrophobicContact CE1-CD1 3.66Å; F806-L860 HydrophobicContact CE1-CD2 3.3Å; F806-L860 HydrophobicContact CE1-CG 4.06Å; F806-L860 HydrophobicContact CE2-CD2 4.41Å; F806-L860 HydrophobicContact CG-CD1 3.97Å; F806-L860 HydrophobicContact CZ-CD1 4.33Å; F806-L860 HydrophobicContact CZ-CD2 3.53Å; F806-L860 HydrophobicContact CZ-CG 4.39Å
807	C	81.1	Confident	75.3	Confident	2 Å²	2	34 Å²	34	1%	0.014	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-41.8	172.5	178.7	0	0	0	0	111.9	Y751 S803 L804 A811	Y751-C807 HydrophobicContact CE2-CB 4.04Å; S803-C807 VanDerWaalsContact O-CB 3.31Å; S803-C807 WeakPolarHBondContact O-CB 3.39Å; S803-C807 PolarHBondContact O-N 3.08Å; L804-C807 PolarHBondContact O-N 3.34Å; C807-A811 VanDerWaalsContact O-CB 3.27Å; C807-A811 WeakPolarHBondContact O-CB 3.07Å; C807-A811 PolarHBondContact O-N 3.36Å
808	L	83.8	Confident	74.7	Confident	1 Å²	1	36 Å²	36	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-40.6	174.6	-68.8	170	0	0	0	112.3	I729 I758 I764 F767 L768 F772 L804 I805 C812	I729-L808 HydrophobicContact CD1-CD1 4.13Å; I758-L808 HydrophobicContact CD1-CD2 3.7Å; I758-L808 HydrophobicContact CD1-CG 4.09Å; I758-L808 HydrophobicContact CG1-CD2 3.94Å; I758-L808 HydrophobicContact CG2-CD2 4Å; I764-L808 HydrophobicContact CD1-CD2 3.87Å; F767-L808 HydrophobicContact CD1-CD2 4.13Å; F767-L808 HydrophobicContact CE1-CD2 3.86Å; L768-L808 HydrophobicContact CD2-CB 4.08Å; L768-L808 HydrophobicContact CD2-CD1 4.28Å; F772-L808 HydrophobicContact CE2-CD1 4.2Å; L804-L808 HydrophobicContact CG-CD1 4.37Å; L804-L808 WeakPolarHBondContact O-CB 3.49Å; L804-L808 VanDerWaalsContact O-CG 3.26Å; L804-L808 WeakPolarHBondContact O-CG 3.41Å; L804-L808 PolarHBondContact O-N 2.87Å; I805-L808 PolarHBondContact O-N 3.39Å; L808-C812 VanDerWaalsContact O-CB 3.23Å; L808-C812 WeakPolarHBondContact O-CB 3.37Å; L808-C812 PolarHBondContact O-N 3.46Å
809	L	77.3	Confident	73.7	Confident	10 Å²	10	39 Å²	39	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-68.2	-40.9	176.1	-78.7	172.5	0	0	0	112.6	I805 F806 C812 A813 F824 F827 F831	I805-L809 HydrophobicContact CG2-CD1 4.06Å; I805-L809 WeakPolarHBondContact O-CB 3.43Å; I805-L809 WeakPolarHBondContact O-CG 3.33Å; I805-L809 PolarHBondContact O-N 2.88Å; F806-L809 PolarHBondContact O-N 2.76Å; L809-C812 PolarHBondContact O-N 3.21Å; L809-A813 WeakPolarHBondContact O-CB 3.41Å; L809-A813 PolarHBondContact O-N 3.04Å; L809-F824 HydrophobicContact CB-CE2 4.42Å; L809-F824 HydrophobicContact CD2-CD2 4.36Å; L809-F824 HydrophobicContact CD2-CE2 4.27Å; L809-F824 WeakPolarHBondContact O-CE2 3.32Å; L809-F827 HydrophobicContact CD2-CB 4.03Å; L809-F831 HydrophobicContact CD1-CD2 3.93Å; L809-F831 HydrophobicContact CD2-CD2 4.04Å; L809-F831 HydrophobicContact CD2-CE2 4.31Å; L809-F831 HydrophobicContact CG-CD2 4.11Å; L809-F831 HydrophobicContact CG-CE2 4.33Å
810	D	76	Confident	73	Confident	47 Å²	47	36.1 Å²	36.1	25%	0.251	21%	0.21	S	C	.	.	H	α-helix	trans	-67.1	-40.1	175	175.4	71.9	0	0	0	111.7	Y759 F806 A813 R814	Y759-D810 WeakPolarHBondContact CE1-OD2 3.25Å; Y759-D810 VanDerWaalsContact CZ-OD2 3.29Å; Y759-D810 PolarHBondContact OH-OD2 2.92Å; F806-D810 VanDerWaalsContact O-CB 3.31Å; F806-D810 WeakPolarHBondContact O-CB 3.44Å; F806-D810 PolarHBondContact O-N 2.77Å; D810-A813 PolarHBondContact O-N 3Å; D810-R814 VanDerWaalsContact CG-NE 3.28Å; D810-R814 VanDerWaalsContact O-CG 3.24Å; D810-R814 WeakPolarHBondContact O-CG 3.46Å; D810-R814 PolarHBondContact O-N 3.17Å; D810-R814 IonicContact OD1-CZ 3.29Å; D810-R814 IonicContact OD1-NE 3.9Å; D810-R814 PolarHBondContact OD1-NE 2.99Å; D810-R814 IonicContact OD1-NH2 2.71Å; D810-R814 PolarHBondContact OD1-NH2 3.25Å; D810-R814 IonicContact OD2-CZ 2.74Å; D810-R814 IonicContact OD2-NE 2.75Å; D810-R814 PolarHBondContact OD2-NE 3Å; D810-R814 IonicContact OD2-NH2 3.69Å; D810-R814 PolarHBondContact OD2-NH2 3Å; D810-R814 VanDerWaalsContact OD2-NH2 3.17Å
811	A	76.2	Confident	72.4	Confident	6 Å²	6	37.7 Å²	37.7	5%	0.05	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-41.1	172.1	0	0	0	0	0	112.2	I758 Y759 I764 C807 R814 A815	I758-A811 HydrophobicContact CG2-CB 3.6Å; Y759-A811 HydrophobicContact CD1-CB 4Å; Y759-A811 HydrophobicContact CE1-CB 4.17Å; I764-A811 HydrophobicContact CD1-CB 4.26Å; I764-A811 HydrophobicContact CG1-CB 3.93Å; C807-A811 VanDerWaalsContact O-CB 3.27Å; C807-A811 WeakPolarHBondContact O-CB 3.07Å; C807-A811 PolarHBondContact O-N 3.36Å; A811-R814 PolarHBondContact O-N 3.36Å; A811-A815 WeakPolarHBondContact O-CB 3.47Å; A811-A815 PolarHBondContact O-N 3.23Å
812	C	77.8	Confident	71.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-41.2	173.6	-174.3	0	0	0	0	112.1	N765 L768 L808 L809 R814 A815 S816 F824	N765-C812 PolarHBondContact OD1-SG 2.71Å; L768-C812 HydrophobicContact CD1-CB 3.63Å; L808-C812 VanDerWaalsContact O-CB 3.23Å; L808-C812 WeakPolarHBondContact O-CB 3.37Å; L808-C812 PolarHBondContact O-N 3.46Å; L809-C812 PolarHBondContact O-N 3.21Å; C812-R814 VanDerWaalsContact C-N 3.33Å; C812-R814 PolarHBondContact O-N 3.32Å; C812-A815 PolarHBondContact O-N 2.98Å; C812-S816 VanDerWaalsContact O-CB 3.27Å; C812-S816 WeakPolarHBondContact O-CB 3.49Å; C812-S816 PolarHBondContact O-N 3.2Å; C812-S816 PolarHBondContact O-OG 3.12Å; C812-F824 HydrophobicContact CB-CD2 4.49Å
813	A	68.7	Low	71.5	Confident	46 Å²	46	39.6 Å²	39.6	38%	0.38	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-37.6	174.4	0	0	0	0	0	112.5	L809 D810 F824	L809-A813 WeakPolarHBondContact O-CB 3.41Å; L809-A813 PolarHBondContact O-N 3.04Å; D810-A813 PolarHBondContact O-N 3Å; A813-F824 HydrophobicContact CB-CD2 3.84Å; A813-F824 HydrophobicContact CB-CE2 3.77Å; A813-F824 HydrophobicContact CB-CG 4.4Å; A813-F824 HydrophobicContact CB-CZ 4.26Å
814	R	71	Confident	71.3	Confident	172 Å²	172	39.9 Å²	39.9	65%	0.649	23%	0.233	S	C	*	.	H	α-helix	trans	-73	-30.2	176.9	-70.3	168.8	-163.3	-75.8	-15.4	113.8	D810 A811 C812	D810-R814 VanDerWaalsContact CG-NE 3.28Å; D810-R814 VanDerWaalsContact O-CG 3.24Å; D810-R814 WeakPolarHBondContact O-CG 3.46Å; D810-R814 PolarHBondContact O-N 3.17Å; D810-R814 IonicContact OD1-CZ 3.29Å; D810-R814 IonicContact OD1-NE 3.9Å; D810-R814 PolarHBondContact OD1-NE 2.99Å; D810-R814 IonicContact OD1-NH2 2.71Å; D810-R814 PolarHBondContact OD1-NH2 3.25Å; D810-R814 IonicContact OD2-CZ 2.74Å; D810-R814 IonicContact OD2-NE 2.75Å; D810-R814 PolarHBondContact OD2-NE 3Å; D810-R814 IonicContact OD2-NH2 3.69Å; D810-R814 PolarHBondContact OD2-NH2 3Å; D810-R814 VanDerWaalsContact OD2-NH2 3.17Å; A811-R814 PolarHBondContact O-N 3.36Å; C812-R814 VanDerWaalsContact C-N 3.33Å; C812-R814 PolarHBondContact O-N 3.32Å
815	A	71.4	Confident	70.4	Confident	57 Å²	57	41.8 Å²	41.8	47%	0.471	24%	0.243	S	C	.	.	H	α-helix	trans	-92.6	-22.5	-179.2	0	0	0	0	0	113.7	I764 A811 C812	I764-A815 HydrophobicContact CG2-CB 3.32Å; A811-A815 WeakPolarHBondContact O-CB 3.47Å; A811-A815 PolarHBondContact O-N 3.23Å; C812-A815 PolarHBondContact O-N 2.98Å
816	S	67.2	Low	69.9	Low	16 Å²	16	43.6 Å²	43.6	11%	0.112	25%	0.251	C	S	.	.	S	Bend	trans	-64	134.8	176.2	-66.3	0	0	0	0	110.5	C812	C812-S816 VanDerWaalsContact O-CB 3.27Å; C812-S816 WeakPolarHBondContact O-CB 3.49Å; C812-S816 PolarHBondContact O-N 3.2Å; C812-S816 PolarHBondContact O-OG 3.12Å
817	N	62.6	Low	69.7	Low	97 Å²	97	41.8 Å²	41.8	52%	0.519	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-67.3	130.8	175	-177.6	-11.2	0	0	0	108.7	A819 D820	N817-A819 PolarHBondContact O-N 3.21Å; N817-A819 WeakPolarHBondContact OD1-CB 3.23Å; N817-A819 PolarHBondContact OD1-N 2.92Å; N817-D820 CarbonylContact O-C 3.14Å; N817-D820 PolarHBondContact O-N 3.23Å
818	P	58.5	Low	69.1	Low	100 Å²	100	41.9 Å²	41.9	65%	0.649	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.2	175.2	22.6	-34.3	0	0	0	113.9
819	A	51.6	Low	68.2	Low	66 Å²	66	42.9 Å²	42.9	55%	0.545	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.8	172.4	0	0	0	0	0	114.7	N817	N817-A819 PolarHBondContact O-N 3.21Å; N817-A819 WeakPolarHBondContact OD1-CB 3.23Å; N817-A819 PolarHBondContact OD1-N 2.92Å
820	D	59.5	Low	67.8	Low	71 Å²	71	42.5 Å²	42.5	38%	0.38	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-146	82.3	176.8	-171.1	-1.7	0	0	0	111.5	N817 S822	N817-D820 CarbonylContact O-C 3.14Å; N817-D820 PolarHBondContact O-N 3.23Å; D820-S822 PolarHBondContact O-N 3.08Å; D820-S822 WeakPolarHBondContact OD1-CB 3.31Å; D820-S822 PolarHBondContact OD1-N 3.29Å; D820-S822 VanDerWaalsContact OD1-N 3.13Å; D820-S822 PolarHBondContact OD1-OG 3.41Å
821	P	65.9	Low	67.7	Low	35 Å²	35	40.8 Å²	40.8	23%	0.227	24%	0.241	C	C	.	.			trans	-79.2	11.4	175.2	31.2	-35.3	0	0	0	114.4	D823 F824 I825	P821-D823 PolarHBondContact O-N 3.14Å; P821-F824 PolarHBondContact O-N 3.39Å; P821-I825 HydrophobicContact CB-CD1 3.96Å; P821-I825 HydrophobicContact CB-CG1 4.39Å; P821-I825 HydrophobicContact CG-CD1 3.79Å; P821-I825 WeakPolarHBondContact O-CD1 3.21Å; P821-I825 VanDerWaalsContact O-CG1 3.31Å; P821-I825 WeakPolarHBondContact O-CG1 3.39Å; P821-I825 PolarHBondContact O-N 3Å
822	S	67.3	Low	67.1	Low	30 Å²	30	42.6 Å²	42.6	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-56.9	-43.6	-168.1	56.4	0	0	0	0	114.6	D820 I825 Q826	D820-S822 PolarHBondContact O-N 3.08Å; D820-S822 WeakPolarHBondContact OD1-CB 3.31Å; D820-S822 PolarHBondContact OD1-N 3.29Å; D820-S822 VanDerWaalsContact OD1-N 3.13Å; D820-S822 PolarHBondContact OD1-OG 3.41Å; S822-I825 PolarHBondContact O-N 3.16Å; S822-Q826 WeakPolarHBondContact O-CB 3.17Å; S822-Q826 PolarHBondContact O-N 3.21Å
823	D	69.1	Low	66.6	Low	21 Å²	21	45.6 Å²	45.6	11%	0.112	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-50.8	175.8	-82.2	-45.9	0	0	0	111.6	N765 R769 P821 I825 Q826 F827	N765-D823 HydrophobicContact CB-CB 4.35Å; N765-D823 VanDerWaalsContact ND2-CB 3.28Å; N765-D823 WeakPolarHBondContact ND2-CB 3.27Å; N765-D823 PolarHBondContact ND2-OD2 3.49Å; R769-D823 IonicContact CZ-OD1 2.92Å; R769-D823 IonicContact CZ-OD2 3.43Å; R769-D823 IonicContact NE-OD1 3.73Å; R769-D823 PolarHBondContact NE-OD1 3.4Å; R769-D823 IonicContact NH2-OD1 2.88Å; R769-D823 PolarHBondContact NH2-OD1 2.91Å; R769-D823 IonicContact NH2-OD2 2.73Å; R769-D823 PolarHBondContact NH2-OD2 3.25Å; P821-D823 PolarHBondContact O-N 3.14Å; D823-I825 VanDerWaalsContact C-N 3.3Å; D823-I825 PolarHBondContact O-N 3.04Å; D823-Q826 PolarHBondContact O-N 2.9Å; D823-Q826 VanDerWaalsContact O-N 3.13Å; D823-F827 HydrophobicContact CB-CD2 4.47Å; D823-F827 HydrophobicContact CB-CE2 4.36Å; D823-F827 WeakPolarHBondContact O-CD2 3.18Å; D823-F827 PolarHBondContact O-N 3.41Å
824	F	72.4	Confident	66.5	Low	17 Å²	17	43.4 Å²	43.4	8%	0.075	25%	0.247	C	C	.	.	H	α-helix	trans	-59.3	-41.1	179.3	170.8	-104.9	0	0	0	111.9	L809 C812 A813 P821 G828 Y867	L809-F824 HydrophobicContact CB-CE2 4.42Å; L809-F824 HydrophobicContact CD2-CD2 4.36Å; L809-F824 HydrophobicContact CD2-CE2 4.27Å; L809-F824 WeakPolarHBondContact O-CE2 3.32Å; C812-F824 HydrophobicContact CB-CD2 4.49Å; A813-F824 HydrophobicContact CB-CD2 3.84Å; A813-F824 HydrophobicContact CB-CE2 3.77Å; A813-F824 HydrophobicContact CB-CG 4.4Å; A813-F824 HydrophobicContact CB-CZ 4.26Å; P821-F824 PolarHBondContact O-N 3.39Å; F824-G828 PolarHBondContact O-N 3.05Å; F824-Y867 HydrophobicContact CE1-CD1 4.38Å; F824-Y867 AromaticContact CE1-CD2 3.87Å; F824-Y867 HydrophobicContact CE1-CD2 3.87Å; F824-Y867 HydrophobicContact CE1-CE2 4.07Å; F824-Y867 HydrophobicContact CE1-CG 4.05Å; F824-Y867 HydrophobicContact CZ-CD2 4.28Å; F824-Y867 HydrophobicContact CZ-CE2 4.45Å
825	I	65.6	Low	66.3	Low	43 Å²	43	35.9 Å²	35.9	22%	0.221	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-44.1	176.3	-61.1	156.1	0	0	0	110.5	P821 S822 D823 G828 A829 F884	P821-I825 HydrophobicContact CB-CD1 3.96Å; P821-I825 HydrophobicContact CB-CG1 4.39Å; P821-I825 HydrophobicContact CG-CD1 3.79Å; P821-I825 WeakPolarHBondContact O-CD1 3.21Å; P821-I825 VanDerWaalsContact O-CG1 3.31Å; P821-I825 WeakPolarHBondContact O-CG1 3.39Å; P821-I825 PolarHBondContact O-N 3Å; S822-I825 PolarHBondContact O-N 3.16Å; D823-I825 VanDerWaalsContact C-N 3.3Å; D823-I825 PolarHBondContact O-N 3.04Å; I825-G828 PolarHBondContact O-N 2.59Å; I825-A829 WeakPolarHBondContact O-CB 3.24Å; I825-A829 PolarHBondContact O-N 2.81Å; I825-F884 HydrophobicContact CD1-CD2 4.02Å; I825-F884 HydrophobicContact CD1-CE1 4.01Å; I825-F884 HydrophobicContact CD1-CE2 3.28Å; I825-F884 HydrophobicContact CD1-CZ 3.28Å; I825-F884 HydrophobicContact CG1-CE2 3.92Å; I825-F884 HydrophobicContact CG1-CZ 3.68Å; I825-F884 HydrophobicContact CG2-CE1 4.47Å; I825-F884 HydrophobicContact CG2-CZ 4.13Å
826	Q	69.4	Low	65.9	Low	40 Å²	40	35.4 Å²	35.4	19%	0.187	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-45.8	-179.7	-176.2	164.4	19.2	0	0	112.1	A775 S822 D823 Y830	A775-Q826 PolarHBondContact O-NE2 3.48Å; S822-Q826 WeakPolarHBondContact O-CB 3.17Å; S822-Q826 PolarHBondContact O-N 3.21Å; D823-Q826 PolarHBondContact O-N 2.9Å; D823-Q826 VanDerWaalsContact O-N 3.13Å; Q826-Y830 VanDerWaalsContact O-CB 3.31Å; Q826-Y830 WeakPolarHBondContact O-CB 3.44Å; Q826-Y830 PolarHBondContact O-N 2.99Å
827	F	72	Confident	65.7	Low	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.1	-41.9	175.4	-68.9	-65.6	0	0	0	112	L768 R769 F772 A775 L809 D823 A829 Y830 F831	L768-F827 HydrophobicContact CB-CD1 4.3Å; L768-F827 HydrophobicContact CB-CD2 4.12Å; L768-F827 HydrophobicContact CB-CE1 3.86Å; L768-F827 HydrophobicContact CB-CE2 3.69Å; L768-F827 HydrophobicContact CB-CG 4.44Å; L768-F827 HydrophobicContact CB-CZ 3.56Å; L768-F827 HydrophobicContact CD1-CD2 3.89Å; L768-F827 HydrophobicContact CD1-CE2 4.24Å; L768-F827 HydrophobicContact CD1-CG 4.17Å; L768-F827 HydrophobicContact CD2-CD1 4.44Å; R769-F827 HydrophobicContact CG-CE2 4.48Å; R769-F827 HydrophobicContact CG-CZ 3.89Å; F772-F827 HydrophobicContact CB-CE1 4.33Å; A775-F827 HydrophobicContact CB-CD1 3.69Å; A775-F827 HydrophobicContact CB-CE1 3.6Å; L809-F827 HydrophobicContact CD2-CB 4.03Å; D823-F827 HydrophobicContact CB-CD2 4.47Å; D823-F827 HydrophobicContact CB-CE2 4.36Å; D823-F827 WeakPolarHBondContact O-CD2 3.18Å; D823-F827 PolarHBondContact O-N 3.41Å; F827-A829 PolarHBondContact O-N 3.26Å; F827-Y830 PolarHBondContact O-N 3.47Å; F827-F831 HydrophobicContact CB-CD2 4.47Å; F827-F831 HydrophobicContact CB-CE2 4.27Å; F827-F831 WeakPolarHBondContact O-CD2 3.44Å; F827-F831 PolarHBondContact O-N 2.87Å
828	G	67.4	Low	65.5	Low	5 Å²	5	34.5 Å²	34.5	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-42.3	176	0	0	0	0	0	113.3	F824 I825 S832	F824-G828 PolarHBondContact O-N 3.05Å; I825-G828 PolarHBondContact O-N 2.59Å; G828-S832 VanDerWaalsContact O-CB 3.25Å; G828-S832 WeakPolarHBondContact O-CB 3.32Å; G828-S832 PolarHBondContact O-N 2.93Å
829	A	64.4	Low	65.3	Low	21 Å²	21	32.4 Å²	32.4	17%	0.174	19%	0.187	C	C	.	.	H	α-helix	trans	-65.6	-41.2	174.1	0	0	0	0	0	112	Y780 I825 F827 S832 Y833	Y780-A829 HydrophobicContact CE1-CB 4.14Å; I825-A829 WeakPolarHBondContact O-CB 3.24Å; I825-A829 PolarHBondContact O-N 2.81Å; F827-A829 PolarHBondContact O-N 3.26Å; A829-S832 PolarHBondContact O-N 3.13Å; A829-Y833 WeakPolarHBondContact O-CB 3.46Å; A829-Y833 PolarHBondContact O-N 3.35Å
830	Y	70.7	Confident	65.2	Low	3 Å²	3	37.8 Å²	37.8	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-48.7	176.9	176.4	-105.4	0	0	0	112.5	F772 D774 A775 M778 L792 Q826 F827 S832 Y833 A834	F772-Y830 HydrophobicContact CB-CE1 4.26Å; F772-Y830 HydrophobicContact CD1-CE1 4.35Å; D774-Y830 HydrophobicContact CB-CE2 4.29Å; A775-Y830 HydrophobicContact CB-CD1 3.74Å; A775-Y830 HydrophobicContact CB-CD2 3.94Å; A775-Y830 HydrophobicContact CB-CE1 4.21Å; A775-Y830 HydrophobicContact CB-CE2 4.4Å; A775-Y830 HydrophobicContact CB-CG 3.57Å; M778-Y830 HydrophobicContact SD-CD2 4.36Å; L792-Y830 HydrophobicContact CD2-CE1 3.53Å; L792-Y830 WeakPolarHBondContact CD2-OH 3.33Å; Q826-Y830 VanDerWaalsContact O-CB 3.31Å; Q826-Y830 WeakPolarHBondContact O-CB 3.44Å; Q826-Y830 PolarHBondContact O-N 2.99Å; F827-Y830 PolarHBondContact O-N 3.47Å; Y830-S832 PolarHBondContact O-N 2.84Å; Y830-Y833 PolarHBondContact O-N 3.43Å; Y830-A834 WeakPolarHBondContact O-CB 3.34Å; Y830-A834 PolarHBondContact O-N 3.26Å
831	F	72.3	Confident	64.8	Low	10 Å²	10	37.2 Å²	37.2	4%	0.044	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-36.1	176.3	-68.7	-62.9	0	0	0	112.2	F772 L792 I805 L809 F827 A834 N835	F772-F831 HydrophobicContact CD1-CE1 4.39Å; F772-F831 HydrophobicContact CD1-CZ 4.37Å; F772-F831 AromaticContact CD2-CZ 3.86Å; F772-F831 HydrophobicContact CD2-CZ 3.86Å; F772-F831 HydrophobicContact CE1-CE1 4.15Å; F772-F831 HydrophobicContact CE1-CZ 4.26Å; F772-F831 HydrophobicContact CE2-CE1 4.4Å; F772-F831 AromaticContact CE2-CZ 3.74Å; F772-F831 HydrophobicContact CE2-CZ 3.74Å; F772-F831 HydrophobicContact CG-CZ 4.17Å; F772-F831 HydrophobicContact CZ-CE1 4.16Å; F772-F831 AromaticContact CZ-CZ 3.95Å; F772-F831 HydrophobicContact CZ-CZ 3.95Å; L792-F831 HydrophobicContact CD1-CD1 4.06Å; L792-F831 HydrophobicContact CD1-CE1 3.81Å; I805-F831 HydrophobicContact CD1-CD1 4.05Å; I805-F831 HydrophobicContact CD1-CE1 3.84Å; I805-F831 HydrophobicContact CG1-CD1 4.38Å; I805-F831 HydrophobicContact CG1-CE1 3.89Å; I805-F831 HydrophobicContact CG1-CZ 4.24Å; I805-F831 HydrophobicContact CG2-CB 4.48Å; I805-F831 HydrophobicContact CG2-CD1 3.8Å; I805-F831 HydrophobicContact CG2-CD2 3.95Å; I805-F831 HydrophobicContact CG2-CE1 3.93Å; I805-F831 HydrophobicContact CG2-CE2 4.08Å; I805-F831 HydrophobicContact CG2-CG 3.82Å; I805-F831 HydrophobicContact CG2-CZ 4.07Å; L809-F831 HydrophobicContact CD1-CD2 3.93Å; L809-F831 HydrophobicContact CD2-CD2 4.04Å; L809-F831 HydrophobicContact CD2-CE2 4.31Å; L809-F831 HydrophobicContact CG-CD2 4.11Å; L809-F831 HydrophobicContact CG-CE2 4.33Å; F827-F831 HydrophobicContact CB-CD2 4.47Å; F827-F831 HydrophobicContact CB-CE2 4.27Å; F827-F831 WeakPolarHBondContact O-CD2 3.44Å; F827-F831 PolarHBondContact O-N 2.87Å; F831-A834 PolarHBondContact O-N 3.12Å; F831-N835 PolarHBondContact O-N 3.37Å
832	S	65.2	Low	63.9	Low	44 Å²	44	37.8 Å²	37.8	31%	0.308	20%	0.196	S	C	.	.	H	α-helix	trans	-65	-40.8	174.2	-174.9	0	0	0	0	112.5	G828 A829 Y830 S836	G828-S832 VanDerWaalsContact O-CB 3.25Å; G828-S832 WeakPolarHBondContact O-CB 3.32Å; G828-S832 PolarHBondContact O-N 2.93Å; A829-S832 PolarHBondContact O-N 3.13Å; Y830-S832 PolarHBondContact O-N 2.84Å; S832-S836 WeakPolarHBondContact O-CB 3.31Å; S832-S836 PolarHBondContact O-N 3.34Å; S832-S836 VanDerWaalsContact O-N 3.09Å
833	Y	65.5	Low	62.7	Low	63 Å²	63	42.6 Å²	42.6	25%	0.247	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-48.7	172	173.5	-97.5	0	0	0	111	M778 I786 I788 A829 Y830 N835 S836 F837	M778-Y833 HydrophobicContact CE-CD2 4.45Å; M778-Y833 HydrophobicContact CE-CG 4.18Å; I786-Y833 HydrophobicContact CB-CE1 4.48Å; I788-Y833 HydrophobicContact CD1-CD1 4.31Å; I788-Y833 HydrophobicContact CD1-CE1 4.01Å; I788-Y833 HydrophobicContact CG1-CE1 4.3Å; A829-Y833 WeakPolarHBondContact O-CB 3.46Å; A829-Y833 PolarHBondContact O-N 3.35Å; Y830-Y833 PolarHBondContact O-N 3.43Å; Y833-N835 PolarHBondContact O-N 3.38Å; Y833-S836 PolarHBondContact O-N 2.98Å; Y833-S836 PolarHBondContact O-OG 2.7Å; Y833-F837 PolarHBondContact O-N 2.85Å; Y833-F837 VanDerWaalsContact O-N 3.16Å
834	A	68.5	Low	61.6	Low	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-44.7	179.8	0	0	0	0	0	112.6	I788 L792 L796 Y830 F831 F837 I838	I788-A834 HydrophobicContact CD1-CB 4.29Å; I788-A834 HydrophobicContact CG1-CB 4.38Å; I788-A834 HydrophobicContact CG2-CB 4.48Å; L792-A834 HydrophobicContact CD2-CB 3.85Å; L792-A834 HydrophobicContact CG-CB 4.37Å; L796-A834 HydrophobicContact CD1-CB 3.66Å; Y830-A834 WeakPolarHBondContact O-CB 3.34Å; Y830-A834 PolarHBondContact O-N 3.26Å; F831-A834 PolarHBondContact O-N 3.12Å; A834-F837 PolarHBondContact O-N 2.84Å; A834-I838 PolarHBondContact O-N 3.34Å
835	N	66.3	Low	60.1	Low	14 Å²	14	53.3 Å²	53.3	8%	0.075	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-44.7	175.4	-159.8	92.2	0	0	0	111.6	F831 Y833 F837 I838 D839	F831-N835 PolarHBondContact O-N 3.37Å; Y833-N835 PolarHBondContact O-N 3.38Å; N835-F837 PolarHBondContact O-N 3.45Å; N835-F837 VanDerWaalsContact O-N 3.1Å; N835-I838 WeakPolarHBondContact O-CA 3.23Å; N835-I838 WeakPolarHBondContact O-CB 3.32Å; N835-I838 PolarHBondContact O-N 3.33Å; N835-D839 PolarHBondContact ND2-OD1 2.88Å; N835-D839 PolarHBondContact ND2-OD2 3.46Å; N835-D839 VanDerWaalsContact O-CG 3.29Å; N835-D839 PolarHBondContact O-N 3.4Å
836	S	62.4	Low	58.6	Low	48 Å²	48	57.2 Å²	57.2	34%	0.336	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-20.5	179.9	79.6	0	0	0	0	114.3	S832 Y833 R840	S832-S836 WeakPolarHBondContact O-CB 3.31Å; S832-S836 PolarHBondContact O-N 3.34Å; S832-S836 VanDerWaalsContact O-N 3.09Å; Y833-S836 PolarHBondContact O-N 2.98Å; Y833-S836 PolarHBondContact O-OG 2.7Å; S836-R840 WeakPolarHBondContact O-CD 3.35Å; S836-R840 VanDerWaalsContact O-CG 3.28Å; S836-R840 WeakPolarHBondContact O-CG 3.1Å
837	F	62.5	Low	56.8	Low	76 Å²	76	61 Å²	61	33%	0.333	33%	0.328	S	S	.	.	H	α-helix	trans	-82	-39.5	171.5	-169.8	-83.4	0	0	0	111.6	I788 Y833 A834 N835 R840 T841	I788-F837 HydrophobicContact CD1-CB 3.31Å; I788-F837 HydrophobicContact CD1-CD1 3.81Å; I788-F837 HydrophobicContact CD1-CD2 4.04Å; I788-F837 HydrophobicContact CD1-CG 3.46Å; I788-F837 VanDerWaalsContact CD1-CG 3.46Å; Y833-F837 PolarHBondContact O-N 2.85Å; Y833-F837 VanDerWaalsContact O-N 3.16Å; A834-F837 PolarHBondContact O-N 2.84Å; N835-F837 PolarHBondContact O-N 3.45Å; N835-F837 VanDerWaalsContact O-N 3.1Å; F837-R840 PolarHBondContact O-N 3.3Å; F837-T841 HydrophobicContact CD1-CG2 3.97Å; F837-T841 HydrophobicContact CE1-CG2 3.64Å; F837-T841 HydrophobicContact CZ-CG2 4.39Å; F837-T841 PolarHBondContact O-N 3.32Å; F837-T841 PolarHBondContact O-OG1 3.07Å
838	I	59.4	Low	54.9	Low	18 Å²	18	68 Å²	68	9%	0.092	37%	0.366	C	S	.	.	H	α-helix	trans	-60.3	-49.8	174.6	-66.6	170.7	0	0	0	109.9	K793 L796 A834 N835 R840 T841 C842	K793-I838 HydrophobicContact CG-CG1 4.48Å; L796-I838 HydrophobicContact CB-CD1 3.43Å; L796-I838 VanDerWaalsContact CB-CD1 3.43Å; L796-I838 HydrophobicContact CD1-CD1 3.61Å; L796-I838 HydrophobicContact CG-CD1 4.16Å; A834-I838 PolarHBondContact O-N 3.34Å; N835-I838 WeakPolarHBondContact O-CA 3.23Å; N835-I838 WeakPolarHBondContact O-CB 3.32Å; N835-I838 PolarHBondContact O-N 3.33Å; I838-R840 PolarHBondContact O-N 3.13Å; I838-T841 WeakPolarHBondContact CA-OG1 3.22Å; I838-T841 PolarHBondContact O-N 3.21Å; I838-T841 PolarHBondContact O-OG1 3.08Å; I838-C842 PolarHBondContact O-N 3.14Å; I838-C842 PolarHBondContact O-SG 3.26Å
839	D	53.4	Low	53.2	Low	55 Å²	55	77 Å²	77	29%	0.294	41%	0.407	S	S	.	.	H	α-helix	trans	-49.8	-47	174.4	-61	-38.1	0	0	0	110.9	N835 C842 I843	N835-D839 PolarHBondContact ND2-OD1 2.88Å; N835-D839 PolarHBondContact ND2-OD2 3.46Å; N835-D839 VanDerWaalsContact O-CG 3.29Å; N835-D839 PolarHBondContact O-N 3.4Å; D839-C842 PolarHBondContact O-N 3.41Å; D839-I843 WeakPolarHBondContact O-CB 3.5Å; D839-I843 WeakPolarHBondContact O-CD1 3.22Å; D839-I843 WeakPolarHBondContact O-CG1 3.4Å; D839-I843 PolarHBondContact O-N 3.28Å; D839-I843 VanDerWaalsContact O-N 3.07Å
840	R	50.9	Low	51.7	Low	179 Å²	179	80 Å²	80	68%	0.675	43%	0.425	S	S	*	.	H	α-helix	trans	-68.8	-31.4	178.1	-74.4	176.1	-176.8	-156.8	2.9	114.2	S836 F837 I838 N844	S836-R840 WeakPolarHBondContact O-CD 3.35Å; S836-R840 VanDerWaalsContact O-CG 3.28Å; S836-R840 WeakPolarHBondContact O-CG 3.1Å; F837-R840 PolarHBondContact O-N 3.3Å; I838-R840 PolarHBondContact O-N 3.13Å; R840-N844 PolarHBondContact O-ND2 3.5Å
841	T	50.5	Low	50.1	Low	59 Å²	59	86.4 Å²	86.4	36%	0.362	46%	0.46	S	S	.	.	H	α-helix	trans	-76.2	-36.6	175.6	45.9	0	0	0	0	112.3	F837 I838 N844	F837-T841 HydrophobicContact CD1-CG2 3.97Å; F837-T841 HydrophobicContact CE1-CG2 3.64Å; F837-T841 HydrophobicContact CZ-CG2 4.39Å; F837-T841 PolarHBondContact O-N 3.32Å; F837-T841 PolarHBondContact O-OG1 3.07Å; I838-T841 WeakPolarHBondContact CA-OG1 3.22Å; I838-T841 PolarHBondContact O-N 3.21Å; I838-T841 PolarHBondContact O-OG1 3.08Å; T841-N844 PolarHBondContact O-N 3.39Å
842	C	45.8	Very low	48.8	Very low	47 Å²	47	93.2 Å²	93.2	32%	0.318	49%	0.487	S	S	.	.	H	α-helix	trans	-65.8	-43.8	175.2	-68	0	0	0	0	111.7	I838 D839 N844 N845 C850	I838-C842 PolarHBondContact O-N 3.14Å; I838-C842 PolarHBondContact O-SG 3.26Å; D839-C842 PolarHBondContact O-N 3.41Å; C842-N844 PolarHBondContact O-N 3.22Å; C842-N845 PolarHBondContact O-N 3.01Å; C842-N845 VanDerWaalsContact O-O 3.13Å; C842-C850 HydrophobicContact CB-CB 4.32Å
843	I	43.5	Very low	48	Very low	132 Å²	132	92.5 Å²	92.5	68%	0.677	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.2	179	-73.9	165	0	0	0	113.7	D839	D839-I843 WeakPolarHBondContact O-CB 3.5Å; D839-I843 WeakPolarHBondContact O-CD1 3.22Å; D839-I843 WeakPolarHBondContact O-CG1 3.4Å; D839-I843 PolarHBondContact O-N 3.28Å; D839-I843 VanDerWaalsContact O-N 3.07Å
844	N	46.3	Very low	46.8	Very low	130 Å²	130	92.4 Å²	92.4	70%	0.695	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-13.4	-179.6	-69.4	-43	0	0	0	114.2	R840 T841 C842	R840-N844 PolarHBondContact O-ND2 3.5Å; T841-N844 PolarHBondContact O-N 3.39Å; C842-N844 PolarHBondContact O-N 3.22Å
845	N	41.2	Very low	45.5	Very low	132 Å²	132	98.4 Å²	98.4	71%	0.706	51%	0.511	S	S	*	.	S	Bend	trans	-109.3	120.9	-179.3	-74.1	-6.8	0	0	0	110	C842	C842-N845 PolarHBondContact O-N 3.01Å; C842-N845 VanDerWaalsContact O-O 3.13Å
846	T	32.3	Very low	44.3	Very low	125 Å²	125	101.3 Å²	101.3	77%	0.767	53%	0.532	S	S	*	.			trans	-43.3	136.2	-173.2	48	0	0	0	0	117.3
847	T	32.8	Very low	43.3	Very low	119 Å²	119	100.2 Å²	100.2	73%	0.73	52%	0.521	S	S	*	.	S	Bend	trans	61.8	111.9	148.8	52.5	0	0	0	0	119.2
848	D	30.9	Very low	42.3	Very low	148 Å²	148	100.6 Å²	100.6	79%	0.791	53%	0.531	S	S	*	.	S	Bend	trans	67.6	161.5	158.1	-54.6	-37.1	0	0	0	118.6	C850	D848-C850 VanDerWaalsContact C-N 3.3Å; D848-C850 PolarHBondContact O-N 2.88Å
849	E	33.2	Very low	41.6	Very low	194 Å²	194	104.2 Å²	104.2	91%	0.907	55%	0.548	S	S	*	.			trans	59	9	175.2	-56.9	-165.1	157	0	0	119.8	D851	E849-D851 VanDerWaalsContact C-N 3.26Å; E849-D851 PolarHBondContact O-N 2.71Å
850	C	31.6	Very low	41.1	Very low	83 Å²	83	102.7 Å²	102.7	56%	0.561	54%	0.539	S	S	*	.			trans	-80.1	72.4	160.8	-74.7	0	0	0	0	111.6	C842 D848 Y852	C842-C850 HydrophobicContact CB-CB 4.32Å; D848-C850 VanDerWaalsContact C-N 3.3Å; D848-C850 PolarHBondContact O-N 2.88Å; C850-Y852 PolarHBondContact O-N 3.3Å
851	D	36.8	Very low	40.7	Very low	139 Å²	139	95.5 Å²	95.5	74%	0.743	52%	0.519	S	S	*	.			trans	-52.9	132.9	168.1	-93	-15.8	0	0	0	110.5	E849 V853	E849-D851 VanDerWaalsContact C-N 3.26Å; E849-D851 PolarHBondContact O-N 2.71Å; D851-V853 PolarHBondContact O-N 2.92Å
852	Y	44.9	Very low	40.4	Very low	153 Å²	153	95.8 Å²	95.8	60%	0.6	52%	0.523	S	S	*	.			trans	-65.1	107.5	-178.4	-72.8	-79.9	0	0	0	110.3	C850 M854 E855	C850-Y852 PolarHBondContact O-N 3.3Å; Y852-M854 PolarHBondContact O-N 3.29Å; Y852-E855 PolarHBondContact O-N 2.88Å
853	V	48.5	Very low	40.5	Very low	29 Å²	29	97.4 Å²	97.4	18%	0.176	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-26.1	-177.3	173.9	0	0	0	0	113.7	L802 D851	L802-V853 HydrophobicContact CD1-CG1 3.69Å; L802-V853 HydrophobicContact CD2-CG1 3.51Å; L802-V853 HydrophobicContact CG-CG1 4.25Å; D851-V853 PolarHBondContact O-N 2.92Å
854	M	41.2	Very low	40.5	Very low	60 Å²	60	92.1 Å²	92.1	30%	0.296	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-30.8	175.3	-66.8	-67.4	-57.9	0	0	114.3	Y852 S856 F857 L860 A861 L864	Y852-M854 PolarHBondContact O-N 3.29Å; M854-S856 VanDerWaalsContact C-N 3.35Å; M854-F857 CarbonylContact O-C 3.56Å; M854-F857 PolarHBondContact O-N 2.92Å; M854-L860 HydrophobicContact CE-CD2 4.05Å; M854-L860 HydrophobicContact SD-CD2 3.8Å; M854-A861 HydrophobicContact CE-CB 4.28Å; M854-L864 HydrophobicContact CE-CD1 4.46Å
855	E	41.4	Very low	40.2	Very low	127 Å²	127	88.9 Å²	88.9	59%	0.593	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-28.8	-177.6	-67.3	-168.3	140.6	0	0	111.8	Y852 F857	Y852-E855 PolarHBondContact O-N 2.88Å; E855-F857 PolarHBondContact O-N 3.36Å
856	S	40.5	Very low	40.3	Very low	74 Å²	74	85.8 Å²	85.8	52%	0.517	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.4	170.9	-42.1	0	0	0	0	113.8	M854	M854-S856 VanDerWaalsContact C-N 3.35Å
857	F	41.3	Very low	40.6	Very low	26 Å²	26	85.6 Å²	85.6	11%	0.114	45%	0.452	C	S	.	.			trans	-136.7	69.6	-173.2	-64.2	-81.5	0	0	0	112.6	W142 L802 F806 M854 E855 H859 L860 A861	W142-F857 HydrophobicContact CH2-CD1 4.17Å; W142-F857 AromaticContact CH2-CE1 3.96Å; W142-F857 HydrophobicContact CH2-CE1 3.96Å; W142-F857 HydrophobicContact CZ3-CE1 4.06Å; L802-F857 HydrophobicContact CB-CE2 4.28Å; L802-F857 HydrophobicContact CB-CZ 4.48Å; L802-F857 HydrophobicContact CD1-CE2 4.11Å; F806-F857 HydrophobicContact CD2-CD1 4.12Å; F806-F857 HydrophobicContact CD2-CE1 4.32Å; F806-F857 HydrophobicContact CD2-CG 4.35Å; F806-F857 HydrophobicContact CE2-CB 4.1Å; F806-F857 AromaticContact CE2-CD1 3.74Å; F806-F857 HydrophobicContact CE2-CD1 3.74Å; F806-F857 AromaticContact CE2-CD2 3.69Å; F806-F857 HydrophobicContact CE2-CD2 3.69Å; F806-F857 HydrophobicContact CE2-CE1 4Å; F806-F857 AromaticContact CE2-CE2 3.97Å; F806-F857 HydrophobicContact CE2-CE2 3.97Å; F806-F857 AromaticContact CE2-CG 3.56Å; F806-F857 HydrophobicContact CE2-CG 3.56Å; F806-F857 HydrophobicContact CE2-CZ 4.11Å; F806-F857 HydrophobicContact CZ-CD2 4.26Å; F806-F857 HydrophobicContact CZ-CG 4.37Å; M854-F857 CarbonylContact O-C 3.56Å; M854-F857 PolarHBondContact O-N 2.92Å; E855-F857 PolarHBondContact O-N 3.36Å; F857-H859 PolarHBondContact O-N 3.07Å; F857-H859 VanDerWaalsContact O-N 3.1Å; F857-L860 HydrophobicContact CB-CB 4.16Å; F857-L860 WeakPolarHBondContact O-CB 3.4Å; F857-L860 PolarHBondContact O-N 3.18Å; F857-A861 PolarHBondContact O-N 3.31Å
858	P	42.8	Very low	41.1	Very low	84 Å²	84	83.2 Å²	83.2	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-59.6	-26.5	-175.8	23	-34.4	0	0	0	114.5	L860 A861 S862	P858-L860 VanDerWaalsContact C-N 3.3Å; P858-L860 PolarHBondContact O-N 3.09Å; P858-A861 PolarHBondContact O-N 3.06Å; P858-S862 PolarHBondContact O-N 2.78Å
859	H	44.8	Very low	41.5	Very low	93 Å²	93	81.4 Å²	81.4	43%	0.431	42%	0.419	S	S	.	.	H	α-helix	trans	-66.4	-29.6	173.3	-56.6	-73.6	0	0	0	113.1	F857 S862 I863	F857-H859 PolarHBondContact O-N 3.07Å; F857-H859 VanDerWaalsContact O-N 3.1Å; H859-S862 PolarHBondContact O-OG 3.02Å; H859-I863 WeakPolarHBondContact O-CG1 3.33Å; H859-I863 PolarHBondContact O-N 3.47Å
860	L	42.1	Very low	41.6	Very low	23 Å²	23	73.4 Å²	73.4	12%	0.12	38%	0.384	C	S	.	.	H	α-helix	trans	-74	-37.8	175.4	-165.3	81.5	0	0	0	110.9	F806 M854 F857 P858 S862 I863 L864	F806-L860 HydrophobicContact CD1-CD1 3.44Å; F806-L860 VanDerWaalsContact CD1-CD1 3.44Å; F806-L860 HydrophobicContact CD1-CD2 4.03Å; F806-L860 HydrophobicContact CD1-CG 4.32Å; F806-L860 HydrophobicContact CE1-CD1 3.66Å; F806-L860 HydrophobicContact CE1-CD2 3.3Å; F806-L860 HydrophobicContact CE1-CG 4.06Å; F806-L860 HydrophobicContact CE2-CD2 4.41Å; F806-L860 HydrophobicContact CG-CD1 3.97Å; F806-L860 HydrophobicContact CZ-CD1 4.33Å; F806-L860 HydrophobicContact CZ-CD2 3.53Å; F806-L860 HydrophobicContact CZ-CG 4.39Å; M854-L860 HydrophobicContact CE-CD2 4.05Å; M854-L860 HydrophobicContact SD-CD2 3.8Å; F857-L860 HydrophobicContact CB-CB 4.16Å; F857-L860 WeakPolarHBondContact O-CB 3.4Å; F857-L860 PolarHBondContact O-N 3.18Å; P858-L860 VanDerWaalsContact C-N 3.3Å; P858-L860 PolarHBondContact O-N 3.09Å; L860-S862 VanDerWaalsContact C-N 3.34Å; L860-S862 PolarHBondContact O-N 2.91Å; L860-I863 PolarHBondContact O-N 2.79Å; L860-L864 HydrophobicContact CD1-CD1 4.16Å; L860-L864 HydrophobicContact CD1-CG 4.28Å; L860-L864 HydrophobicContact CD2-CD1 3.7Å; L860-L864 HydrophobicContact CG-CD1 3.65Å; L860-L864 HydrophobicContact CG-CG 4.01Å; L860-L864 WeakPolarHBondContact O-CB 3.4Å; L860-L864 PolarHBondContact O-N 3.13Å
861	A	42.2	Very low	42.1	Very low	29 Å²	29	74.8 Å²	74.8	24%	0.24	39%	0.394	C	S	.	.	H	α-helix	trans	-58.5	-45.4	175.1	0	0	0	0	0	111.2	M854 F857 P858 L865	M854-A861 HydrophobicContact CE-CB 4.28Å; F857-A861 PolarHBondContact O-N 3.31Å; P858-A861 PolarHBondContact O-N 3.06Å; A861-L865 WeakPolarHBondContact O-CB 3.27Å; A861-L865 WeakPolarHBondContact O-CD1 3.28Å; A861-L865 WeakPolarHBondContact O-CG 3.31Å; A861-L865 PolarHBondContact O-N 3.47Å; A861-L865 VanDerWaalsContact O-N 3.08Å
862	S	44.5	Very low	42.3	Very low	65 Å²	65	75.8 Å²	75.8	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-65.8	-43.7	178	60.9	0	0	0	0	113	P858 H859 L860 L866	P858-S862 PolarHBondContact O-N 2.78Å; H859-S862 PolarHBondContact O-OG 3.02Å; L860-S862 VanDerWaalsContact C-N 3.34Å; L860-S862 PolarHBondContact O-N 2.91Å; S862-L866 WeakPolarHBondContact O-CD1 3.31Å; S862-L866 WeakPolarHBondContact O-CG 3.39Å; S862-L866 PolarHBondContact O-N 3.23Å
863	I	47.6	Very low	42.1	Very low	80 Å²	80	73.3 Å²	73.3	41%	0.41	38%	0.382	S	S	.	.	H	α-helix	trans	-67.3	-54.2	179.6	-65.5	169.7	0	0	0	111.2	H859 L860 L865 L866 Y867	H859-I863 WeakPolarHBondContact O-CG1 3.33Å; H859-I863 PolarHBondContact O-N 3.47Å; L860-I863 PolarHBondContact O-N 2.79Å; I863-L865 PolarHBondContact O-N 3.44Å; I863-L866 PolarHBondContact O-N 3.15Å; I863-Y867 HydrophobicContact CG2-CD2 4.14Å; I863-Y867 HydrophobicContact CG2-CE2 4.24Å; I863-Y867 VanDerWaalsContact O-CD2 3.31Å; I863-Y867 WeakPolarHBondContact O-CD2 3.43Å; I863-Y867 PolarHBondContact O-N 3.41Å
864	L	43.6	Very low	41.3	Very low	22 Å²	22	75.8 Å²	75.8	12%	0.115	41%	0.414	C	S	.	.	H	α-helix	trans	-66.5	-34.4	-176.3	-70.1	179.9	0	0	0	112.6	M854 L860 Y867 I868	M854-L864 HydrophobicContact CE-CD1 4.46Å; L860-L864 HydrophobicContact CD1-CD1 4.16Å; L860-L864 HydrophobicContact CD1-CG 4.28Å; L860-L864 HydrophobicContact CD2-CD1 3.7Å; L860-L864 HydrophobicContact CG-CD1 3.65Å; L860-L864 HydrophobicContact CG-CG 4.01Å; L860-L864 WeakPolarHBondContact O-CB 3.4Å; L860-L864 PolarHBondContact O-N 3.13Å; L864-Y867 PolarHBondContact O-N 3.49Å; L864-I868 HydrophobicContact CB-CD1 4.3Å; L864-I868 HydrophobicContact CD2-CD1 4.03Å; L864-I868 WeakPolarHBondContact O-CB 3.49Å; L864-I868 WeakPolarHBondContact O-CG1 3.44Å; L864-I868 PolarHBondContact O-N 3.43Å
865	L	41.2	Very low	41.3	Very low	62 Å²	62	80.1 Å²	80.1	33%	0.325	44%	0.438	S	S	.	.	H	α-helix	trans	-69.8	-34.1	178.3	-73.1	167	0	0	0	112.9	A861 I863 K869 Y873	A861-L865 WeakPolarHBondContact O-CB 3.27Å; A861-L865 WeakPolarHBondContact O-CD1 3.28Å; A861-L865 WeakPolarHBondContact O-CG 3.31Å; A861-L865 PolarHBondContact O-N 3.47Å; A861-L865 VanDerWaalsContact O-N 3.08Å; I863-L865 PolarHBondContact O-N 3.44Å; L865-K869 CarbonylContact O-C 3.58Å; L865-K869 PolarHBondContact O-N 3.29Å; L865-K869 VanDerWaalsContact O-N 3.13Å; L865-Y873 HydrophobicContact CB-CD2 4.13Å; L865-Y873 HydrophobicContact CB-CE2 3.74Å; L865-Y873 HydrophobicContact CD1-CE2 4.44Å; L865-Y873 HydrophobicContact CD2-CE2 4.04Å; L865-Y873 HydrophobicContact CG-CE2 4.29Å
866	L	41.4	Very low	41.2	Very low	67 Å²	67	77.3 Å²	77.3	35%	0.351	43%	0.427	S	S	.	.	H	α-helix	trans	-63.4	-42.6	173.9	-79.1	167.8	0	0	0	112.3	S862 I863 L875	S862-L866 WeakPolarHBondContact O-CD1 3.31Å; S862-L866 WeakPolarHBondContact O-CG 3.39Å; S862-L866 PolarHBondContact O-N 3.23Å; I863-L866 PolarHBondContact O-N 3.15Å; L866-L875 HydrophobicContact CD2-CD1 4.42Å
867	Y	40.1	Very low	41.5	Very low	121 Å²	121	77.1 Å²	77.1	48%	0.475	42%	0.422	S	S	.	.	H	α-helix	trans	-85.6	-31.4	-178	-71.5	-71	0	0	0	114.6	F824 I863 L864	F824-Y867 HydrophobicContact CE1-CD1 4.38Å; F824-Y867 AromaticContact CE1-CD2 3.87Å; F824-Y867 HydrophobicContact CE1-CD2 3.87Å; F824-Y867 HydrophobicContact CE1-CE2 4.07Å; F824-Y867 HydrophobicContact CE1-CG 4.05Å; F824-Y867 HydrophobicContact CZ-CD2 4.28Å; F824-Y867 HydrophobicContact CZ-CE2 4.45Å; I863-Y867 HydrophobicContact CG2-CD2 4.14Å; I863-Y867 HydrophobicContact CG2-CE2 4.24Å; I863-Y867 VanDerWaalsContact O-CD2 3.31Å; I863-Y867 WeakPolarHBondContact O-CD2 3.43Å; I863-Y867 PolarHBondContact O-N 3.41Å; L864-Y867 PolarHBondContact O-N 3.49Å
868	I	41.9	Very low	41.5	Very low	69 Å²	69	81.6 Å²	81.6	35%	0.354	45%	0.448	S	S	.	.	H	α-helix	trans	-95.2	-24.1	-173.5	-59.6	-179.2	0	0	0	112.6	L864	L864-I868 HydrophobicContact CB-CD1 4.3Å; L864-I868 HydrophobicContact CD2-CD1 4.03Å; L864-I868 WeakPolarHBondContact O-CB 3.49Å; L864-I868 WeakPolarHBondContact O-CG1 3.44Å; L864-I868 PolarHBondContact O-N 3.43Å
869	K	40.5	Very low	41.6	Very low	110 Å²	110	82.9 Å²	82.9	48%	0.478	45%	0.45	S	S	.	.			trans	-135.3	59.7	179	-69.4	179.5	-178.7	156.4	0	113.4	L865 S871 K872 Y873	L865-K869 CarbonylContact O-C 3.58Å; L865-K869 PolarHBondContact O-N 3.29Å; L865-K869 VanDerWaalsContact O-N 3.13Å; K869-S871 PolarHBondContact O-N 3.03Å; K869-S871 VanDerWaalsContact O-N 3.09Å; K869-K872 PolarHBondContact O-N 3.15Å; K869-Y873 WeakPolarHBondContact O-CD2 3.42Å
870	P	36.1	Very low	41.6	Very low	26 Å²	26	83.9 Å²	83.9	17%	0.169	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-53.4	-31.9	176.3	21.1	-33.5	0	0	0	113.6	K872 Y873 L876 L881	P870-K872 PolarHBondContact O-N 2.6Å; P870-Y873 CarbonylContact O-C 3.54Å; P870-Y873 PolarHBondContact O-N 3.13Å; P870-Y873 VanDerWaalsContact O-N 3.13Å; P870-L876 HydrophobicContact CB-CB 4.07Å; P870-L876 HydrophobicContact CB-CD1 3.9Å; P870-L881 HydrophobicContact CB-CD1 3.99Å; P870-L881 HydrophobicContact CB-CG 4.43Å; P870-L881 HydrophobicContact CG-CD1 3.81Å; P870-L881 HydrophobicContact CG-CG 4.01Å
871	S	40.8	Very low	41.8	Very low	111 Å²	111	85 Å²	85	78%	0.776	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-65.4	-4.4	175.1	56.9	0	0	0	0	115.6	K869	K869-S871 PolarHBondContact O-N 3.03Å; K869-S871 VanDerWaalsContact O-N 3.09Å
872	K	41.8	Very low	42	Very low	161 Å²	161	88.2 Å²	88.2	70%	0.7	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-114.1	-11.1	171.4	-73.5	-161.1	170.5	-160.1	0	114.5	K869 P870	K869-K872 PolarHBondContact O-N 3.15Å; P870-K872 PolarHBondContact O-N 2.6Å
873	Y	39.2	Very low	42.1	Very low	100 Å²	100	89 Å²	89	39%	0.392	48%	0.475	S	S	.	.	S	Bend	trans	-134.3	91.9	-173.7	-60.9	-82.2	0	0	0	109	L865 K869 P870 L875	L865-Y873 HydrophobicContact CB-CD2 4.13Å; L865-Y873 HydrophobicContact CB-CE2 3.74Å; L865-Y873 HydrophobicContact CD1-CE2 4.44Å; L865-Y873 HydrophobicContact CD2-CE2 4.04Å; L865-Y873 HydrophobicContact CG-CE2 4.29Å; K869-Y873 WeakPolarHBondContact O-CD2 3.42Å; P870-Y873 CarbonylContact O-C 3.54Å; P870-Y873 PolarHBondContact O-N 3.13Å; P870-Y873 VanDerWaalsContact O-N 3.13Å; Y873-L875 PolarHBondContact O-N 3.33Å
874	G	32.2	Very low	41.7	Very low	82 Å²	82	88.3 Å²	88.3	85%	0.845	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	56.1	-163.5	0	0	0	0	0	116.6
875	L	40.9	Very low	41.7	Very low	151 Å²	151	90.1 Å²	90.1	79%	0.791	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-6.8	174.1	-84.9	157.6	0	0	0	113.4	L866 Y873	L866-L875 HydrophobicContact CD2-CD1 4.42Å; Y873-L875 PolarHBondContact O-N 3.33Å
876	L	40.1	Very low	42.1	Very low	68 Å²	68	91.4 Å²	91.4	36%	0.356	49%	0.491	S	S	.	.	S	Bend	trans	-108.5	123.6	170.9	-79.2	159.6	0	0	0	109.3	P870 H880	P870-L876 HydrophobicContact CB-CB 4.07Å; P870-L876 HydrophobicContact CB-CD1 3.9Å; L876-H880 HydrophobicContact CD2-CB 4.05Å
877	T	46.3	Very low	42	Very low	69 Å²	69	91.3 Å²	91.3	42%	0.423	49%	0.49	S	S	.	.			trans	-69.2	154.4	174.7	56.2	0	0	0	0	110.6	D879 H880 L881	T877-D879 PolarHBondContact O-N 3.03Å; T877-D879 VanDerWaalsContact O-N 3.15Å; T877-H880 PolarHBondContact O-N 3.14Å; T877-H880 VanDerWaalsContact OG1-CG 3.22Å; T877-H880 PolarHBondContact OG1-N 3.16Å; T877-H880 PolarHBondContact OG1-ND1 2.86Å; T877-L881 PolarHBondContact O-N 3.32Å
878	N	40.7	Very low	42	Very low	121 Å²	121	87.7 Å²	87.7	65%	0.647	49%	0.486	S	S	*	.	H	α-helix	trans	-56.7	-29.1	173.4	-83.5	-24.6	0	0	0	112.1	L881 N882	N878-L881 WeakPolarHBondContact O-CB 3.11Å; N878-L881 PolarHBondContact O-N 2.93Å; N878-N882 WeakPolarHBondContact O-CB 3.13Å; N878-N882 PolarHBondContact O-N 3.24Å; N878-N882 PolarHBondContact O-ND2 3.03Å
879	D	45.6	Very low	41.8	Very low	111 Å²	111	87.4 Å²	87.4	59%	0.594	49%	0.487	S	S	*	.	H	α-helix	trans	-73.4	-38.5	179.4	-51.8	-54.8	0	0	0	112.3	T877 L881 T883	T877-D879 PolarHBondContact O-N 3.03Å; T877-D879 VanDerWaalsContact O-N 3.15Å; D879-L881 VanDerWaalsContact C-N 3.32Å; D879-T883 VanDerWaalsContact O-CB 3.31Å; D879-T883 WeakPolarHBondContact O-CB 3.48Å; D879-T883 PolarHBondContact O-N 3.02Å; D879-T883 PolarHBondContact O-OG1 3.32Å
880	H	45.8	Very low	41.7	Very low	113 Å²	113	88.3 Å²	88.3	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-42.2	168.4	-64.1	167.1	0	0	0	110.6	L876 T877 T883 F884	L876-H880 HydrophobicContact CD2-CB 4.05Å; T877-H880 PolarHBondContact O-N 3.14Å; T877-H880 VanDerWaalsContact OG1-CG 3.22Å; T877-H880 PolarHBondContact OG1-N 3.16Å; T877-H880 PolarHBondContact OG1-ND1 2.86Å; H880-T883 PolarHBondContact O-N 3.03Å; H880-F884 WeakPolarHBondContact O-CB 3.49Å; H880-F884 PolarHBondContact O-N 2.82Å
881	L	44.4	Very low	41.7	Very low	46 Å²	46	90.1 Å²	90.1	24%	0.241	50%	0.502	C	S	.	.	H	α-helix	trans	-63.3	-44.2	179.4	-143	170.2	0	0	0	111.8	P870 T877 N878 D879 F884 C885	P870-L881 HydrophobicContact CB-CD1 3.99Å; P870-L881 HydrophobicContact CB-CG 4.43Å; P870-L881 HydrophobicContact CG-CD1 3.81Å; P870-L881 HydrophobicContact CG-CG 4.01Å; T877-L881 PolarHBondContact O-N 3.32Å; N878-L881 WeakPolarHBondContact O-CB 3.11Å; N878-L881 PolarHBondContact O-N 2.93Å; D879-L881 VanDerWaalsContact C-N 3.32Å; L881-F884 WeakPolarHBondContact O-CB 3.41Å; L881-F884 PolarHBondContact O-N 3.43Å; L881-C885 PolarHBondContact O-N 3.49Å; L881-C885 PolarHBondContact O-SG 2.93Å; L881-C885 VanDerWaalsContact O-SG 3.37Å
882	N	46.5	Very low	41.5	Very low	97 Å²	97	88.4 Å²	88.4	52%	0.519	48%	0.483	S	S	.	.	H	α-helix	trans	-65.7	-45.3	175	-72.3	-28.7	0	0	0	111.3	N878 F884 C885 D886	N878-N882 WeakPolarHBondContact O-CB 3.13Å; N878-N882 PolarHBondContact O-N 3.24Å; N878-N882 PolarHBondContact O-ND2 3.03Å; N882-F884 VanDerWaalsContact C-N 3.28Å; N882-F884 PolarHBondContact O-N 3.12Å; N882-C885 PolarHBondContact O-N 2.84Å; N882-D886 WeakPolarHBondContact O-CB 3.45Å; N882-D886 PolarHBondContact O-N 3.26Å
883	T	47.8	Very low	41.2	Very low	81 Å²	81	88.7 Å²	88.7	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-39.3	176.9	-54.7	0	0	0	0	111.4	D879 H880 D886 L887	D879-T883 VanDerWaalsContact O-CB 3.31Å; D879-T883 WeakPolarHBondContact O-CB 3.48Å; D879-T883 PolarHBondContact O-N 3.02Å; D879-T883 PolarHBondContact O-OG1 3.32Å; H880-T883 PolarHBondContact O-N 3.03Å; T883-D886 PolarHBondContact O-N 2.98Å; T883-L887 HydrophobicContact CG2-CD1 4.29Å; T883-L887 WeakPolarHBondContact O-CB 3.45Å; T883-L887 WeakPolarHBondContact O-CG 3.36Å; T883-L887 PolarHBondContact O-N 3.45Å
884	F	39.7	Very low	41	Very low	66 Å²	66	89.6 Å²	89.6	29%	0.289	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-42.9	176.1	-178.7	-78.5	0	0	0	111.9	I825 H880 L881 N882 L887 A888	I825-F884 HydrophobicContact CD1-CD2 4.02Å; I825-F884 HydrophobicContact CD1-CE1 4.01Å; I825-F884 HydrophobicContact CD1-CE2 3.28Å; I825-F884 HydrophobicContact CD1-CZ 3.28Å; I825-F884 HydrophobicContact CG1-CE2 3.92Å; I825-F884 HydrophobicContact CG1-CZ 3.68Å; I825-F884 HydrophobicContact CG2-CE1 4.47Å; I825-F884 HydrophobicContact CG2-CZ 4.13Å; H880-F884 WeakPolarHBondContact O-CB 3.49Å; H880-F884 PolarHBondContact O-N 2.82Å; L881-F884 WeakPolarHBondContact O-CB 3.41Å; L881-F884 PolarHBondContact O-N 3.43Å; N882-F884 VanDerWaalsContact C-N 3.28Å; N882-F884 PolarHBondContact O-N 3.12Å; F884-L887 PolarHBondContact O-N 2.88Å; F884-A888 WeakPolarHBondContact O-CB 3.19Å; F884-A888 PolarHBondContact O-N 3.37Å
885	C	43.1	Very low	41.1	Very low	60 Å²	60	88.6 Å²	88.6	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-66.1	-38	172.2	-71.5	0	0	0	0	113	L881 N882 T889	L881-C885 PolarHBondContact O-N 3.49Å; L881-C885 PolarHBondContact O-SG 2.93Å; L881-C885 VanDerWaalsContact O-SG 3.37Å; N882-C885 PolarHBondContact O-N 2.84Å; C885-T889 WeakPolarHBondContact O-CB 3.33Å; C885-T889 WeakPolarHBondContact O-CG2 3.31Å; C885-T889 PolarHBondContact O-N 3.39Å; C885-T889 PolarHBondContact O-OG1 2.96Å
886	D	48.6	Very low	40.9	Very low	90 Å²	90	87 Å²	87	48%	0.481	47%	0.472	S	S	.	.	H	α-helix	trans	-67.4	-36.6	175.3	-102.8	19.9	0	0	0	112.4	N882 T883 T889 K890	N882-D886 WeakPolarHBondContact O-CB 3.45Å; N882-D886 PolarHBondContact O-N 3.26Å; T883-D886 PolarHBondContact O-N 2.98Å; D886-T889 PolarHBondContact O-OG1 2.93Å; D886-K890 WeakPolarHBondContact O-CB 3.45Å; D886-K890 WeakPolarHBondContact O-CD 3.33Å; D886-K890 WeakPolarHBondContact O-CG 3.48Å; D886-K890 PolarHBondContact O-N 3.38Å
887	L	40.7	Very low	40.7	Very low	64 Å²	64	90.9 Å²	90.9	34%	0.335	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-53.5	171.9	-78.2	165.2	0	0	0	110.3	T883 F884 T889 K890 T891	T883-L887 HydrophobicContact CG2-CD1 4.29Å; T883-L887 WeakPolarHBondContact O-CB 3.45Å; T883-L887 WeakPolarHBondContact O-CG 3.36Å; T883-L887 PolarHBondContact O-N 3.45Å; F884-L887 PolarHBondContact O-N 2.88Å; L887-T889 VanDerWaalsContact C-N 3.29Å; L887-T889 PolarHBondContact O-N 3.23Å; L887-K890 WeakPolarHBondContact O-CB 3.41Å; L887-K890 PolarHBondContact O-N 3.37Å; L887-T891 PolarHBondContact O-N 3.42Å; L887-T891 VanDerWaalsContact O-N 3.12Å; L887-T891 PolarHBondContact O-OG1 2.88Å
888	A	38.5	Very low	40.2	Very low	46 Å²	46	92.7 Å²	92.7	38%	0.38	50%	0.501	S	S	.	.	H	α-helix	trans	-56.1	-41.2	178.9	0	0	0	0	0	112.8	F884 I892	F884-A888 WeakPolarHBondContact O-CB 3.19Å; F884-A888 PolarHBondContact O-N 3.37Å; A888-I892 WeakPolarHBondContact O-CG1 3.33Å
889	T	39.4	Very low	40	Very low	62 Å²	62	92.5 Å²	92.5	38%	0.38	50%	0.498	S	S	.	.	H	α-helix	trans	-81	-13.3	177.8	57.5	0	0	0	0	114.7	C885 D886 L887	C885-T889 WeakPolarHBondContact O-CB 3.33Å; C885-T889 WeakPolarHBondContact O-CG2 3.31Å; C885-T889 PolarHBondContact O-N 3.39Å; C885-T889 PolarHBondContact O-OG1 2.96Å; D886-T889 PolarHBondContact O-OG1 2.93Å; L887-T889 VanDerWaalsContact C-N 3.29Å; L887-T889 PolarHBondContact O-N 3.23Å
890	K	38	Very low	39.4	Very low	129 Å²	129	93.5 Å²	93.5	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-75.8	-43.7	167.4	-83.7	165.5	-175.6	154.4	0	111.4	D886 L887 I892 K893 T894	D886-K890 WeakPolarHBondContact O-CB 3.45Å; D886-K890 WeakPolarHBondContact O-CD 3.33Å; D886-K890 WeakPolarHBondContact O-CG 3.48Å; D886-K890 PolarHBondContact O-N 3.38Å; L887-K890 WeakPolarHBondContact O-CB 3.41Å; L887-K890 PolarHBondContact O-N 3.37Å; K890-I892 PolarHBondContact O-N 2.78Å; K890-K893 PolarHBondContact O-N 3.33Å; K890-T894 PolarHBondContact O-OG1 3.17Å
891	T	35.7	Very low	38.9	Very low	65 Å²	65	95.5 Å²	95.5	40%	0.399	52%	0.516	S	S	.	.	H	α-helix	trans	-60.3	-32.4	178.8	-41.8	0	0	0	0	112.4	L887 K893	L887-T891 PolarHBondContact O-N 3.42Å; L887-T891 VanDerWaalsContact O-N 3.12Å; L887-T891 PolarHBondContact O-OG1 2.88Å; T891-K893 PolarHBondContact O-N 3Å
892	I	36.5	Very low	38.2	Very low	74 Å²	74	103.7 Å²	103.7	38%	0.379	55%	0.545	S	S	.	.	H	α-helix	trans	-66	-21.6	174.6	-67	169.4	0	0	0	112.9	A888 K890 N896	A888-I892 WeakPolarHBondContact O-CG1 3.33Å; K890-I892 PolarHBondContact O-N 2.78Å; I892-N896 PolarHBondContact O-ND2 2.69Å; I892-N896 VanDerWaalsContact O-ND2 3.16Å
893	K	35.7	Very low	37.4	Very low	168 Å²	168	104.9 Å²	104.9	73%	0.73	56%	0.556	S	S	*	*	H	α-helix	trans	-95.1	-11.4	-175.1	-71	172.6	-177.6	165.7	0	114.7	K890 T891	K890-K893 PolarHBondContact O-N 3.33Å; T891-K893 PolarHBondContact O-N 3Å
894	T	34.5	Very low	36.3	Very low	119 Å²	119	107 Å²	107	73%	0.73	57%	0.569	S	S	*	*	H	α-helix	trans	-106.9	-13.5	-176.3	30.3	0	0	0	0	115.4	K890	K890-T894 PolarHBondContact O-OG1 3.17Å
895	S	35.3	Very low	35.7	Very low	60 Å²	60	113.7 Å²	113.7	42%	0.42	60%	0.598	S	S	.	*	S	Bend	trans	-90.9	-20.5	-174.1	55.4	0	0	0	0	115.8	N897	S895-N897 PolarHBondContact O-N 3.32Å
896	N	35.9	Very low	35	Very low	118 Å²	118	115.6 Å²	115.6	63%	0.631	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-1.8	-166.4	-76.5	-47.4	0	0	0	116.8	I892	I892-N896 PolarHBondContact O-ND2 2.69Å; I892-N896 VanDerWaalsContact O-ND2 3.16Å
897	N	36.9	Very low	34	Very low	149 Å²	149	118 Å²	118	80%	0.797	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-15.1	-174.9	-79.5	-17.9	0	0	0	116	S895	S895-N897 PolarHBondContact O-N 3.32Å
898	D	35.5	Very low	33.3	Very low	108 Å²	108	120.7 Å²	120.7	58%	0.578	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-1.9	-174.9	-85.7	-59.5	0	0	0	115.2	T900 K901	D898-T900 PolarHBondContact O-N 3.18Å; D898-T900 VanDerWaalsContact O-N 3.15Å; D898-K901 IonicContact OD1-NZ 3.96Å
899	I	35.5	Very low	32.9	Very low	116 Å²	116	124.9 Å²	124.9	60%	0.595	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-66.3	-17.5	-176.2	-67	171.3	0	0	0	113	K901	I899-K901 VanDerWaalsContact C-N 3.29Å; I899-K901 PolarHBondContact O-N 3.15Å
900	T	34.3	Very low	32.3	Very low	132 Å²	132	127.8 Å²	127.8	81%	0.81	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-79.8	9.2	-175.6	46.9	0	0	0	0	116	D898	D898-T900 PolarHBondContact O-N 3.18Å; D898-T900 VanDerWaalsContact O-N 3.15Å
901	K	33.7	Very low	32	Very low	155 Å²	155	128.4 Å²	128.4	67%	0.674	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-115.8	-7.4	-174.7	-75.6	175.9	-173.3	152.9	0	117.4	D898 I899	D898-K901 IonicContact OD1-NZ 3.96Å; I899-K901 VanDerWaalsContact C-N 3.29Å; I899-K901 PolarHBondContact O-N 3.15Å
902	Y	29.8	Very low	31.7	Very low	219 Å²	219	131.2 Å²	131.2	86%	0.859	72%	0.716	S	S	*	*	S	Bend	trans	-118.9	25.4	-171.8	-76.9	-76	0	0	0	114.8
903	T	29.6	Very low	31.4	Very low	121 Å²	121	131.6 Å²	131.6	74%	0.742	73%	0.726	S	S	*	*			trans	-131	45.8	-174.1	-35.8	0	0	0	0	112.9
904	T	26.5	Very low	31.3	Very low	126 Å²	126	130.1 Å²	130.1	77%	0.773	73%	0.726	S	S	*	*			trans	-152.9	83.5	173.4	-52.1	0	0	0	0	113
905	F	26.7	Very low	31.2	Very low	206 Å²	206	130.6 Å²	130.6	90%	0.904	72%	0.724	S	S	*	*			trans	178	133.3	158	-84.5	-51.8	0	0	0	106.7
906	T	27.8	Very low	31.2	Very low	100 Å²	100	134.6 Å²	134.6	61%	0.613	74%	0.741	S	S	*	*			cis	-152.7	122.6	-8.2	-59.7	0	0	0	0	109.7
907	T	27.9	Very low	31.1	Very low	140 Å²	140	135.9 Å²	135.9	86%	0.859	75%	0.747	S	S	*	*			trans	-144.2	88.4	161.3	-35.1	0	0	0	0	110
908	T	25.9	Very low	31	Very low	122 Å²	122	136.3 Å²	136.3	75%	0.748	75%	0.747	S	S	*	*			trans	-104.2	110.9	-178.5	47	0	0	0	0	111.8
909	T	28.8	Very low	30.7	Very low	134 Å²	134	138.2 Å²	138.2	82%	0.822	76%	0.757	S	S	*	*			trans	-143.2	117.1	160.4	-9.1	0	0	0	0	111.2
910	T	27.8	Very low	30.6	Very low	123 Å²	123	141.1 Å²	141.1	76%	0.755	77%	0.77	S	S	*	*			trans	-63.3	134.2	-172.4	45.8	0	0	0	0	116.3
911	T	31.2	Very low	30.3	Very low	142 Å²	142	141.2 Å²	141.2	87%	0.871	77%	0.766	S	S	*	*			trans	-151.1	69.7	145.2	14.5	0	0	0	0	113.6
912	T	29.9	Very low	30.3	Very low	123 Å²	123	143.3 Å²	143.3	76%	0.755	78%	0.778	S	S	*	*				34.6	105.9	125.2	-41.9	0	0	0	0	121.3
913	S	30	Very low	30.2	Very low	83 Å²	83	141.1 Å²	141.1	58%	0.58	78%	0.776	S	S	*	*			trans	64.3	106.6	132.6	-164.9	0	0	0	0	121.5
914	N	33.4	Very low	30.1	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	78%	0.777	S	S	*	*				171.3	112.4	106.3	-91.6	-68	0	0	0	108.5
915	N	33.5	Very low	30.1	Very low	128 Å²	128	140.9 Å²	140.9	68%	0.684	77%	0.771	S	S	*	*				92.2	127.2	70.9	-85.4	-28.7	0	0	0	114.2
916	N	35.3	Very low	30.4	Very low	144 Å²	144	138 Å²	138	77%	0.77	77%	0.771	S	S	*	*			trans	89.9	81.8	151.8	-57.8	-17.3	0	0	0	122.2
917	N	32.3	Very low	30.3	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	78%	0.775	S	S	*	*				83.6	158.1	105.2	-151.8	21.9	0	0	0	121.5
918	M	34.7	Very low	30.3	Very low	158 Å²	158	137.1 Å²	137.1	78%	0.778	77%	0.772	S	S	*	*			trans	85.2	112.4	167.4	-58.6	-72.4	-76.9	0	0	118.5
919	D	29	Very low	30.4	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	77%	0.771	S	S	*	*			trans	-55.1	152.9	163.9	-63.5	-85.3	0	0	0	114.1
920	M	34.2	Very low	30.4	Very low	177 Å²	177	138.8 Å²	138.8	87%	0.872	77%	0.769	S	S	*	*				-165.4	150.7	113.6	-106.8	-62.5	-174.9	0	0	112.8
921	N	28.4	Very low	30.4	Very low	134 Å²	134	137.8 Å²	137.8	72%	0.717	77%	0.768	S	S	*	*			trans	-75	138.5	-179.3	-66.8	-85.6	0	0	0	112.7
922	Q	32.8	Very low	30.5	Very low	199 Å²	199	136.4 Å²	136.4	93%	0.93	76%	0.761	S	S	*	*				-165.2	167.5	119.9	-107.6	151.9	110.2	0	0	113.7
923	Q	28.6	Very low	30.5	Very low	174 Å²	174	137.4 Å²	137.4	81%	0.813	77%	0.767	S	S	*	*			trans	-101.7	-179.8	-166.4	-58.1	175	-40.1	0	0	112.9
924	L	27.7	Very low	30.4	Very low	146 Å²	146	137 Å²	137	76%	0.764	77%	0.769	S	S	*	*			trans	82.6	83.5	154.1	-67.1	150.6	0	0	0	118.7
925	S	26.9	Very low	30.2	Very low	95 Å²	95	137.4 Å²	137.4	66%	0.664	77%	0.769	S	S	*	*				84.1	151.6	111.4	-65.5	0	0	0	0	122.1
926	T	31.1	Very low	30	Very low	146 Å²	146	139.2 Å²	139.2	90%	0.896	77%	0.773	S	S	*	*			trans	60.4	104.2	160.2	47.1	0	0	0	0	119
927	G	27.6	Very low	29.6	Very low	67 Å²	67	137.4 Å²	137.4	69%	0.691	77%	0.768	S	S	*	*				133.2	107	109.5	0	0	0	0	0	118.6
928	I	26.9	Very low	29.4	Very low	155 Å²	155	135.4 Å²	135.4	80%	0.795	77%	0.765	S	S	*	*				63.4	111.1	124.6	-66.8	171.9	0	0	0	118.3
929	I	27.4	Very low	29.1	Very low	145 Å²	145	133.6 Å²	133.6	74%	0.744	76%	0.763	S	S	*	*			trans	59	119	139.8	-58.1	177	0	0	0	116.1
930	D	30.1	Very low	29.1	Very low	146 Å²	146	131.1 Å²	131.1	78%	0.781	76%	0.757	S	S	*	*				-161.7	179.9	63.5	-139.3	-32.9	0	0	0	115.3
931	S	26.2	Very low	28.9	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	75%	0.754	S	S	*	*			trans	-94.6	-167.6	177.1	-51.7	0	0	0	0	111.3
932	P	33.4	Very low	28.9	Very low	112 Å²	112	128.9 Å²	128.9	73%	0.727	76%	0.757	S	S	*	*			cis	-136.9	-179.4	-6.9	43.6	-27.1	0	0	0	115.6
933	T	31.6	Very low	28.7	Very low	144 Å²	144	124.8 Å²	124.8	88%	0.883	75%	0.75	S	S	*	*			trans	179.6	162	141.7	-78.1	0	0	0	0	109.7
934	A	27.8	Very low	28.6	Very low	75 Å²	75	121.6 Å²	121.6	62%	0.62	75%	0.747	S	S	*	*				-168.7	161.9	-87.4	0	0	0	0	0	110.8
935	I	28.5	Very low	28.8	Very low	145 Å²	145	119.4 Å²	119.4	74%	0.744	74%	0.744	S	S	*	*			trans	69.3	136.6	165.5	-64.2	166.5	0	0	0	115.3
936	H	29.7	Very low	28.9	Very low	166 Å²	166	120 Å²	120	77%	0.769	75%	0.748	S	S	*	*			cis	-118	159.7	-11.2	-82.9	-65.3	0	0	0	108.5
937	T	26	Very low	28.8	Very low	107 Å²	107	120.7 Å²	120.7	66%	0.656	75%	0.745	S	S	*	*			cis	91.4	78.2	12.2	79.8	0	0	0	0	119.1
938	S	28.5	Very low	28.7	Very low	102 Å²	102	123.1 Å²	123.1	71%	0.713	75%	0.747	S	S	*	*			trans	-144.6	100.7	150	55.7	0	0	0	0	108.7
939	V	28.1	Very low	28.8	Very low	121 Å²	121	124.2 Å²	124.2	73%	0.733	75%	0.749	S	S	*	*				68.6	133.1	50.7	-170.3	0	0	0	0	110.9
940	S	29.3	Very low	28.7	Very low	96 Å²	96	122.8 Å²	122.8	67%	0.671	75%	0.75	S	S	*	*			cis	-90.5	-162.2	0.9	-60.4	0	0	0	0	111.6
941	S	31	Very low	28.5	Very low	115 Å²	115	120.7 Å²	120.7	80%	0.804	75%	0.746	S	S	*	*			cis	-156.8	-169.2	2.2	-14.4	0	0	0	0	110.2
942	L	26.8	Very low	28.4	Very low	149 Å²	149	121.6 Å²	121.6	78%	0.78	75%	0.747	S	S	*	*				-173.2	112.1	-90.8	-111.8	166.6	0	0	0	110.6
943	S	29.7	Very low	28.1	Very low	113 Å²	113	122.3 Å²	122.3	79%	0.79	75%	0.75	S	S	*	*			trans	-175.4	84	159.6	-78.9	0	0	0	0	107.7
944	S	26.8	Very low	27.8	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	75%	0.745	S	S	*	*				53	130.2	83.5	77.9	0	0	0	0	113.8
945	S	30.9	Very low	27.8	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	75%	0.752	S	S	*	*			cis	-166.1	148.7	33.1	54.2	0	0	0	0	116.2
946	S	29.2	Very low	27.7	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	76%	0.759	S	S	*	*			trans	64.5	161.6	151.7	75.2	0	0	0	0	119.2
947	L	28.9	Very low	27.7	Very low	161 Å²	161	122.1 Å²	122.1	84%	0.843	76%	0.762	S	S	*	*			cis	-144	179.6	4.4	-137.4	146.4	0	0	0	110.3
948	T	25.7	Very low	27.9	Very low	119 Å²	119	125.2 Å²	125.2	73%	0.73	77%	0.769	S	S	*	*			trans	-121.8	171.3	-163.4	-38.7	0	0	0	0	113.1
949	Q	28.4	Very low	27.9	Very low	178 Å²	178	125.7 Å²	125.7	83%	0.832	76%	0.764	S	S	*	*			trans	81.9	152.6	170	-57.3	-179.6	-19.4	0	0	115.7
950	C	26.4	Very low	28	Very low	115 Å²	115	124.7 Å²	124.7	78%	0.777	76%	0.762	S	S	*	*			cis	-146	-173.8	1.3	-136.1	0	0	0	0	114
951	C	25.6	Very low	28	Very low	102 Å²	102	125.6 Å²	125.6	69%	0.689	76%	0.764	S	S	*	*			trans	-94	152.9	-155.9	-52	0	0	0	0	117.2
952	T	25.2	Very low	27.9	Very low	120 Å²	120	128.2 Å²	128.2	74%	0.736	77%	0.768	S	S	*	*			trans	68.7	147.4	136	48.4	0	0	0	0	123.8
953	T	26.7	Very low	27.9	Very low	128 Å²	128	125 Å²	125	79%	0.785	76%	0.758	S	S	*	*			trans	71.1	144.4	148.9	47.6	0	0	0	0	120.3
954	V	25.5	Very low	27.8	Very low	128 Å²	128	126.2 Å²	126.2	78%	0.776	76%	0.756	S	S	*	*			cis	-168.7	169	-27.5	102.3	0	0	0	0	110.1
955	S	28	Very low	28	Very low	112 Å²	112	127.7 Å²	127.7	78%	0.783	75%	0.751	S	S	*	*			trans	96	136.9	165	-61.3	0	0	0	0	120.4
956	N	24.5	Very low	28	Very low	164 Å²	164	132 Å²	132	88%	0.877	75%	0.753	S	S	*	*			trans	-91.4	148.2	163.6	-64	-49.8	0	0	0	110.8
957	S	29.8	Very low	28	Very low	121 Å²	121	135.1 Å²	135.1	85%	0.846	76%	0.755	S	S	*	*			trans	-165.2	150.1	143.9	54.1	0	0	0	0	114.2
958	H	32	Very low	28.2	Very low	172 Å²	172	131 Å²	131	80%	0.796	75%	0.745	S	S	*	*			trans	-72.4	154.8	-165.3	-55.1	-89.6	0	0	0	119.1
959	N	28	Very low	28.5	Very low	113 Å²	113	130.8 Å²	130.8	60%	0.604	74%	0.743	S	S	*	*			trans	73.9	163.5	136.2	-86.6	-43.2	0	0	0	122	K186	K186-N959 PolarHBondContact NZ-OD1 3.36Å
960	S	30.4	Very low	28.8	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	74%	0.738	S	S	*	*			trans	62.8	114.3	178.2	34.8	0	0	0	0	116.3
961	T	28.1	Very low	29.1	Very low	115 Å²	115	130.9 Å²	130.9	71%	0.706	73%	0.732	S	S	*	*			cis	82.2	140	49.4	65.5	0	0	0	0	115.2
962	L	30.2	Very low	29.6	Very low	169 Å²	169	133.7 Å²	133.7	89%	0.885	74%	0.735	S	S	*	*			trans	75.2	154.8	-172.3	-74.5	70.8	0	0	0	115
963	S	26.1	Very low	30	Very low	83 Å²	83	135.3 Å²	135.3	58%	0.58	73%	0.734	S	S	*	*			cis	176.8	118.7	-29.6	175.6	0	0	0	0	108.1
964	N	26.8	Very low	30.3	Very low	137 Å²	137	135.5 Å²	135.5	73%	0.733	73%	0.73	S	S	*	*			trans	62.1	176.3	169	-54.8	-22.8	0	0	0	114
965	H	30.8	Very low	30.7	Very low	138 Å²	138	135 Å²	135	64%	0.639	73%	0.727	S	S	*	*			cis	-161.9	157.4	19	-140.2	-4.6	0	0	0	112.2
966	Y	31.4	Very low	30.8	Very low	190 Å²	190	136.6 Å²	136.6	75%	0.745	72%	0.724	S	S	*	*			trans	65.5	159.6	166.2	-59.6	-68	0	0	0	119.1
967	H	29.5	Very low	31.2	Very low	172 Å²	172	134.8 Å²	134.8	80%	0.796	71%	0.714	S	S	*	*			cis	-171.7	179	-44	-142.6	-101.3	0	0	0	110.3
968	A	32.4	Very low	31.4	Very low	76 Å²	76	135.4 Å²	135.4	63%	0.628	71%	0.708	S	S	*	*			trans	79.8	141.7	154.6	0	0	0	0	0	117.3
969	T	33.3	Very low	31.4	Very low	113 Å²	113	131.9 Å²	131.9	69%	0.693	70%	0.703	S	S	*	*			cis	-160.4	150.6	-4.7	3.9	0	0	0	0	113.5
970	Q	33.5	Very low	31.5	Very low	155 Å²	155	131 Å²	131	72%	0.724	71%	0.711	S	S	*	*			trans	69.1	156.7	154.5	-66.3	-178.7	43	0	0	117
971	Q	33.7	Very low	31.6	Very low	140 Å²	140	134.9 Å²	134.9	65%	0.654	72%	0.718	S	S	*	*			cis	-151.6	129	16.7	-151.5	163.9	70	0	0	113.6
972	Q	35.7	Very low	31.6	Very low	161 Å²	161	133.8 Å²	133.8	75%	0.752	72%	0.715	S	S	*	*			trans	60.6	156.2	152.6	-66.8	169.4	12.2	0	0	119.1
973	H	34.1	Very low	31.7	Very low	154 Å²	154	131 Å²	131	71%	0.713	71%	0.705	S	S	*	*			cis	-145.2	162.1	7.1	-151.2	-96.4	0	0	0	112.6
974	L	32.5	Very low	31.8	Very low	132 Å²	132	134.1 Å²	134.1	69%	0.691	72%	0.716	S	S	*	*			trans	-49.3	166.7	-174.8	-63	150.2	0	0	0	117.2
975	T	33.5	Very low	32	Very low	118 Å²	118	131.5 Å²	131.5	72%	0.724	71%	0.708	S	S	*	*			cis	-160.2	176.7	33.5	-28	0	0	0	0	114.6
976	M	30.6	Very low	32.1	Very low	145 Å²	145	133.3 Å²	133.3	71%	0.714	72%	0.717	S	S	*	*			trans	-65.3	175.7	-177.5	-57.5	170.9	-69.3	0	0	114.7
977	D	33.9	Very low	32	Very low	127 Å²	127	129 Å²	129	68%	0.679	71%	0.714	S	S	*	*			cis	-147.4	146.1	30.8	-94.7	-64.7	0	0	0	111.8
978	N	32.7	Very low	32.2	Very low	133 Å²	133	126.1 Å²	126.1	71%	0.711	71%	0.714	S	S	*	*				56.3	140.1	86.3	-67.5	-47.4	0	0	0	116
979	S	32.7	Very low	32.2	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	72%	0.722	S	S	*	*			cis	-174.2	151.6	-7.2	52	0	0	0	0	112.7
980	A	30.1	Very low	32.1	Very low	93 Å²	93	131.4 Å²	131.4	77%	0.769	72%	0.722	S	S	*	*			trans	64.5	171	161	0	0	0	0	0	117.2
981	Q	32.2	Very low	32.1	Very low	182 Å²	182	129.4 Å²	129.4	85%	0.85	72%	0.72	S	S	*	*			cis	-148.2	166.8	3.8	-156.3	159.6	-2.5	0	0	112.1
982	S	28	Very low	32	Very low	93 Å²	93	128.4 Å²	128.4	65%	0.65	72%	0.723	S	S	*	*			trans	-71.8	159.5	176.5	49.2	0	0	0	0	113.2
983	T	32.8	Very low	31.7	Very low	109 Å²	109	124.6 Å²	124.6	67%	0.669	71%	0.714	S	S	*	*				177.7	157.7	72.9	49.3	0	0	0	0	112
984	N	28.3	Very low	31.4	Very low	150 Å²	150	124.4 Å²	124.4	80%	0.802	72%	0.718	S	S	*	*			trans	52.4	152.8	136.7	-67.2	5.4	0	0	0	121.7
985	S	30.4	Very low	31.3	Very low	82 Å²	82	126.1 Å²	126.1	57%	0.573	73%	0.727	S	S	*	*			cis	-174.4	174	-10.2	48.3	0	0	0	0	110.5
986	Q	33.1	Very low	31	Very low	175 Å²	175	124.5 Å²	124.5	82%	0.818	73%	0.725	S	S	*	*			trans	69.6	163.9	158.2	-70.5	171.9	-54	0	0	118.4
987	S	28.2	Very low	31.1	Very low	100 Å²	100	126.7 Å²	126.7	70%	0.699	73%	0.73	S	S	*	*				174.9	118.6	-54.3	51.8	0	0	0	0	110.7
988	S	34.1	Very low	30.9	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	74%	0.735	S	S	*	*			trans	-171.2	135.9	161.1	35.8	0	0	0	0	107.9
989	E	31.9	Very low	30.7	Very low	173 Å²	173	125 Å²	125	81%	0.808	73%	0.728	S	S	*	*				63.6	137	62.7	-70.7	-164.2	-144.3	0	0	112.8
990	N	32.3	Very low	30.5	Very low	127 Å²	127	127.2 Å²	127.2	68%	0.679	73%	0.732	S	S	*	*			cis	-161	-175.7	-1.3	-127.4	-42.2	0	0	0	107.5
991	V	32.7	Very low	30.4	Very low	112 Å²	112	130.1 Å²	130.1	68%	0.679	73%	0.734	S	S	*	*			cis	-164.4	156.7	12	88.9	0	0	0	0	110
992	V	32.3	Very low	30.3	Very low	119 Å²	119	129.7 Å²	129.7	72%	0.721	74%	0.737	S	S	*	*			trans	55.5	132.2	156.1	172.6	0	0	0	0	120.4
993	S	28.6	Very low	30.1	Very low	82 Å²	82	130.3 Å²	130.3	57%	0.573	74%	0.742	S	S	*	*			cis	102.5	132.3	12.7	87.4	0	0	0	0	118.8
994	N	28.3	Very low	29.9	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	75%	0.748	S	S	*	*			trans	69.7	151.6	170.3	-46.1	-39.1	0	0	0	115.6
995	I	31.3	Very low	29.6	Very low	169 Å²	169	129.7 Å²	129.7	87%	0.867	75%	0.747	S	S	*	*			cis	-140.4	159.9	29.8	-73.8	171.7	0	0	0	110.8
996	A	27.6	Very low	29.5	Very low	83 Å²	83	131.6 Å²	131.6	69%	0.686	76%	0.755	S	S	*	*			trans	-103.7	154.2	-179.9	0	0	0	0	0	114.7
997	K	31.9	Very low	29.2	Very low	191 Å²	191	130 Å²	130	83%	0.83	76%	0.757	S	S	*	*			trans	159	134.6	133.3	-91.4	171.3	-179	-177.7	0	113.1
998	N	30.6	Very low	29.2	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	76%	0.763	S	S	*	*			trans	57.2	164.8	148.2	-60.6	32.8	0	0	0	118.8
999	S	27.8	Very low	29.1	Very low	79 Å²	79	133.4 Å²	133.4	55%	0.552	80%	0.798	S	S	*	*			cis	-159.5	156.8	-44.6	58.6	0	0	0	0	107.4
1000	D	29	Very low	29	Very low	144 Å²	144	131.5 Å²	131.5	77%	0.77	80%	0.798	S	S	*	*			trans	69.3	143.1	162.3	-39.6	-51.4	0	0	0	118.5
1001	D	28.2	Very low	28.8	Very low	154 Å²	154	131.7 Å²	131.7	82%	0.824	80%	0.804	S	S	*	*			trans	-1.2	122.9	169.6	-55.9	-31	0	0	0	120.6
1002	L	28.8	Very low	28.6	Very low	173 Å²	173	132.8 Å²	132.8	91%	0.906	81%	0.811	S	S	*	*				-165.7	147.3	119.9	-106.4	162.2	0	0	0	113.2
1003	S	23.7	Very low	28.4	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	82%	0.816	S	S	*	*			trans	-80.5	129	-175.9	55.3	0	0	0	0	113.9
1004	V	28	Very low	28.3	Very low	134 Å²	134	136.8 Å²	136.8	81%	0.812	83%	0.831	S	S	*	*			trans	-140.8	133	157.2	-179.2	0	0	0	0	109.6
1005	S	23.7	Very low	28.3	Very low	112 Å²	112	136 Å²	136	78%	0.783	83%	0.834	S	S	*	*			trans	-81.7	137.8	172.3	48.2	0	0	0	0	111.6
1006	V	28.3	Very low	28.1	Very low	122 Å²	122	133.6 Å²	133.6	74%	0.739	83%	0.831	S	S	*	*			trans	-129.8	116.6	169.8	178.5	0	0	0	0	108.8	V1008	V1006-V1008 HydrophobicContact CG1-CG2 4.01Å
1007	V	25.2	Very low	28.2	Very low	141 Å²	141	137.5 Å²	137.5	86%	0.855	84%	0.842	S	S	*	*			trans	-105.1	112.6	170.9	175.6	0	0	0	0	107.8
1008	V	30.1	Very low	27.9	Very low	137 Å²	137	133.1 Å²	133.1	83%	0.83	84%	0.843	S	S	*	*			trans	-147.4	120.1	167.6	-176.8	0	0	0	0	107.6	V1006	V1006-V1008 HydrophobicContact CG1-CG2 4.01Å
1009	G	31	Very low	27.6	Very low	147 Å²	147	131.8 Å²	131.8	100%	1.515	85%	0.849	S	S	*	*			trans	143.9	0	-175.9	0	0	0	0	0	111

Retrieved 1,009 of 1,009 residues in 425.4 ms (Link to these results)

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