A0A5K4F1X0_SCHMA Loading...

Cyclic nucleotide-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1X0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,277 aa.

						>A0A5K4F1X0_SCHMA|A0A5K4F1X0
MSKAKQHWRRRANPSFYMITSEEVGDNHGHSSNIGHDRSLGDLINLSEQSDSGGDKNICKQSSEPHLSKSDELIKSESRSSIDQSKPSKYIPHSHTTTTITNQNERIESERITYPKHSLSSNQINYSSNKHKNVSNNNNTPTDSPLINDSQELFTYISNNEHCNVNKPVQDNSGCINSDSNQEVQPPHTGWNNSRNFLTHTPNRVHFTFSKSIDADDDNHTSLRGLFNRTFRPNLRRAISEVKDVYNPDNTEGSLTERNSQQQQQNHSHRSQNKLHRHLQQQLHNIKLISHPASRSHQQSALHLNYHTATNQPYLQPYRINEFTNTFEQVYNTPQKFDSSILEIPVDMYDESMSDDAFSRKNWPSCDFSRIDSEHSIHSGRLHEMTTSDTFKERDLLLNKNITNNNETNIVVHSVPKKSNRLNAVRRMNTTAVEQHHPFSNNDRFNFRKQTKHQPSSSKTENYPCTNKKYTHGTLSQDNINTSACKLLDSSSIELGSDSMQSRPVPATTLYRSSSSGTRNPEFINDIGVDQTFINTGIGVPNSPITLADKSTVTSSINSSTMIILQNNATSTTPTTTAITALANGSVNESTVDPLKQSTSSYLKEQFQAFFQPSDNKLAMKLFGSKNALLKEKRRQVQQGKWVIHPCSNFRFYWDLLMLMLLIANLIILPVAISFFNDDLSIHWIIFNSISDVVFIADIAVKFRTGIVTNDYADEIILNPKEIARHYLKSWFILDFISSIPMDYLYLIFNKKDHYNQFFSAGRTLRILRLAKLLSMLRLLRLTRLVRYVSQWEENADWFQQYTWALFKAMSHMLSIGYGRFPPTSIGEAWITIVSMMSGATCYALFVGHAAALIQSFDTSKRLYREKFKQVEEYMAYRKLPRALRQRIANYYEHRYQGKMFDEAQILNEFSECLREQVINYNCRALVAAVPFFTYADQDFVSEVVTKLKFEVFQPGDLIIKEGTIGNKMYFIQEGIVDIITKDGEVATSLSDGSYFGEITLLTNTRRTASVKAVVYSNLYSLDRESFLSVLENYPLMRRTMESVAAERLNKIGQNPSIVSNREDLKEDLSLVKEIVSSAVTPEDSSSGPDTENEENQAHLNLKQLLKFRKRKPSNRNKLFDNTVTKLSQTNEEDETLHDIERKSSFVEITSVDKLKLPKFMRQKRSSSNVFTNLTQNLPNLSKSKMISDNSGEREINKCRKSDLQPSENDTNPCHNSNTNVTNLQSSNLNPNCTIITITNYNTDDTTNNNNKTINSNTDTNQRLSSSDISDVDSCKH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	35.5	Very low	182 Å²	182	163.6 Å²	163.6	90%	0.897	73%	0.731	S	S	*	*				0	-40.1	0	-72.6	167.5	78.4	0	0	114.8	K3 A4 K5 V205	M1-K3 PolarHBondContact O-N 2.94Å; M1-A4 WeakPolarHBondContact O-CB 3.44Å; M1-A4 PolarHBondContact O-N 3.46Å; M1-K5 PolarHBondContact O-N 3.13Å; M1-V205 HydrophobicContact CE-CG1 4.03Å; M1-V205 HydrophobicContact CE-CG2 4.38Å; M1-V205 HydrophobicContact SD-CG2 4.46Å
2	S	34.4	Very low	35.3	Very low	98 Å²	98	155.6 Å²	155.6	69%	0.685	72%	0.716	S	S	*	*	H	α-helix	trans	-49.8	-52	-174.8	-172.4	0	0	0	0	115.1	A4 K5	S2-A4 PolarHBondContact O-N 2.91Å; S2-A4 VanDerWaalsContact O-N 3.1Å; S2-K5 WeakPolarHBondContact O-CB 3.28Å; S2-K5 PolarHBondContact O-N 3.23Å
3	K	34	Very low	34.8	Very low	184 Å²	184	155.1 Å²	155.1	80%	0.8	72%	0.722	S	S	*	*	H	α-helix	trans	-57.4	-26.9	178.2	-67	-174	176.3	-177.7	0	114.3	M1	M1-K3 PolarHBondContact O-N 2.94Å
4	A	41.8	Very low	34.5	Very low	64 Å²	64	151.8 Å²	151.8	53%	0.529	72%	0.721	S	S	.	*	H	α-helix	trans	-75.1	-31.5	176.1	0	0	0	0	0	113	M1 S2 Q6 H7 W8	M1-A4 WeakPolarHBondContact O-CB 3.44Å; M1-A4 PolarHBondContact O-N 3.46Å; S2-A4 PolarHBondContact O-N 2.91Å; S2-A4 VanDerWaalsContact O-N 3.1Å; A4-Q6 VanDerWaalsContact C-N 3.29Å; A4-Q6 PolarHBondContact O-N 3.28Å; A4-H7 PolarHBondContact O-N 3.03Å; A4-W8 PolarHBondContact O-N 2.91Å
5	K	38.9	Very low	34	Very low	162 Å²	162	149.6 Å²	149.6	70%	0.704	73%	0.728	S	S	*	*	H	α-helix	trans	-65.6	-31.3	175.9	-107	178.9	176.9	177.6	0	112.1	M1 S2 R9	M1-K5 PolarHBondContact O-N 3.13Å; S2-K5 WeakPolarHBondContact O-CB 3.28Å; S2-K5 PolarHBondContact O-N 3.23Å; K5-R9 WeakPolarHBondContact O-CB 3.46Å; K5-R9 WeakPolarHBondContact O-CG 3.39Å; K5-R9 PolarHBondContact O-N 3.36Å
6	Q	38.7	Very low	33.6	Very low	133 Å²	133	150.4 Å²	150.4	62%	0.621	73%	0.728	S	S	*	*	H	α-helix	trans	-71	-37.1	172.5	-76.1	175.9	-38.7	0	0	112.6	A4 W8 R9 R10	A4-Q6 VanDerWaalsContact C-N 3.29Å; A4-Q6 PolarHBondContact O-N 3.28Å; Q6-W8 PolarHBondContact O-N 3.2Å; Q6-R9 PolarHBondContact O-N 2.85Å; Q6-R10 PolarHBondContact O-N 2.69Å
7	H	33.7	Very low	33.3	Very low	129 Å²	129	151.8 Å²	151.8	60%	0.597	73%	0.725	S	S	*	*	H	α-helix	trans	-70.4	-33.1	-176.8	-154.2	-31.8	0	0	0	113.3	A4	A4-H7 PolarHBondContact O-N 3.03Å
8	W	31.6	Very low	33	Very low	207 Å²	207	150.9 Å²	150.9	78%	0.784	72%	0.722	S	S	*	*	H	α-helix	trans	-79.5	-37.7	172.8	-96	83.4	0	0	0	113.3	A4 Q6 R10 R11 A12	A4-W8 PolarHBondContact O-N 2.91Å; Q6-W8 PolarHBondContact O-N 3.2Å; W8-R10 PolarHBondContact O-N 3.02Å; W8-R10 VanDerWaalsContact O-N 3.12Å; W8-R11 PolarHBondContact O-N 3.34Å; W8-A12 PolarHBondContact O-N 3.01Å
9	R	35	Very low	32.6	Very low	198 Å²	198	150.5 Å²	150.5	75%	0.747	72%	0.722	S	S	*	*	H	α-helix	trans	-63.5	-14.9	175.3	-80.4	-172.8	171.3	-164.5	-2.9	114.3	K5 Q6	K5-R9 WeakPolarHBondContact O-CB 3.46Å; K5-R9 WeakPolarHBondContact O-CG 3.39Å; K5-R9 PolarHBondContact O-N 3.36Å; Q6-R9 PolarHBondContact O-N 2.85Å
10	R	33	Very low	32.4	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	0.2	171.4	-74	-173.5	172.8	-175.3	-2.2	115	Q6 W8	Q6-R10 PolarHBondContact O-N 2.69Å; W8-R10 PolarHBondContact O-N 3.02Å; W8-R10 VanDerWaalsContact O-N 3.12Å
11	R	32.1	Very low	32	Very low	216 Å²	216	145.4 Å²	145.4	82%	0.815	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	1.5	174.2	-81.8	-173.4	171.8	171.4	-2.1	114.5	W8	W8-R11 PolarHBondContact O-N 3.34Å
12	A	33.3	Very low	31.6	Very low	67 Å²	67	144.6 Å²	144.6	55%	0.554	71%	0.708	S	S	*	*			trans	-137	82.4	174.5	0	0	0	0	0	109.6	W8	W8-A12 PolarHBondContact O-N 3.01Å
13	N	28.4	Very low	31.2	Very low	149 Å²	149	148.9 Å²	148.9	80%	0.797	72%	0.718	S	S	*	*			trans	-144.2	149.1	168.5	-132.7	28.6	0	0	0	109.1
14	P	30.5	Very low	31	Very low	109 Å²	109	145.2 Å²	145.2	71%	0.708	71%	0.71	S	S	*	*			trans	-108.6	128	-150.7	36.8	-29.7	0	0	0	114.9	F16	P14-F16 PolarHBondContact O-N 3.28Å; P14-F16 VanDerWaalsContact O-N 3.14Å
15	S	27.4	Very low	30.4	Very low	119 Å²	119	145.2 Å²	145.2	83%	0.832	72%	0.716	S	S	*	*			trans	-79.5	88.9	170.5	-55.6	0	0	0	0	111.3
16	F	27.9	Very low	30	Very low	163 Å²	163	143.1 Å²	143.1	72%	0.715	71%	0.713	S	S	*	*			trans	-169.7	62.1	138.8	-109.2	-68.5	0	0	0	111.6	P14 M18	P14-F16 PolarHBondContact O-N 3.28Å; P14-F16 VanDerWaalsContact O-N 3.14Å; F16-M18 HydrophobicContact CD1-CG 4.25Å; F16-M18 HydrophobicContact CE1-CE 4.44Å; F16-M18 HydrophobicContact CE1-CG 4Å
17	Y	28.2	Very low	29.6	Very low	173 Å²	173	144.5 Å²	144.5	68%	0.678	73%	0.725	S	S	*	*			trans	-97.6	111	141.2	-97	-104.6	0	0	0	105.7	Q870	Y17-Q870 PolarHBondContact OH-NE2 3.11Å
18	M	27.7	Very low	29.5	Very low	136 Å²	136	146.5 Å²	146.5	67%	0.67	73%	0.734	S	S	*	*			trans	-104.7	104.8	159.4	-83.1	-132	-65.9	0	0	108.2	F16 T20	F16-M18 HydrophobicContact CD1-CG 4.25Å; F16-M18 HydrophobicContact CE1-CE 4.44Å; F16-M18 HydrophobicContact CE1-CG 4Å; M18-T20 HydrophobicContact CB-CG2 4.42Å; M18-T20 HydrophobicContact CE-CG2 4.08Å; M18-T20 PolarHBondContact O-N 3.04Å; M18-T20 HydrophobicContact SD-CG2 4.36Å
19	I	25.6	Very low	29.4	Very low	143 Å²	143	140.1 Å²	140.1	73%	0.733	73%	0.732	S	S	*	*			trans	-79.1	96.3	154.8	-63.3	168.4	0	0	0	104.7	S21	I19-S21 PolarHBondContact O-N 2.84Å
20	T	28	Very low	29.2	Very low	97 Å²	97	139.5 Å²	139.5	60%	0.595	74%	0.737	S	S	*	*			trans	-80.4	71.3	165.3	48.1	0	0	0	0	108.9	M18 E22	M18-T20 HydrophobicContact CB-CG2 4.42Å; M18-T20 HydrophobicContact CE-CG2 4.08Å; M18-T20 PolarHBondContact O-N 3.04Å; M18-T20 HydrophobicContact SD-CG2 4.36Å; T20-E22 PolarHBondContact O-N 3.21Å; T20-E22 VanDerWaalsContact O-N 3.11Å
21	S	25.4	Very low	29	Very low	98 Å²	98	133 Å²	133	69%	0.685	73%	0.727	S	S	*	*			trans	-74	79.9	148.5	-68.7	0	0	0	0	106.6	I19 E23	I19-S21 PolarHBondContact O-N 2.84Å; S21-E23 PolarHBondContact O-N 3.21Å; S21-E23 VanDerWaalsContact O-N 3.11Å
22	E	27.5	Very low	28.9	Very low	164 Å²	164	127.6 Å²	127.6	77%	0.766	72%	0.722	S	S	*	*			trans	-70	101.5	162.7	-73.3	-173.5	132	0	0	107	T20 V24	T20-E22 PolarHBondContact O-N 3.21Å; T20-E22 VanDerWaalsContact O-N 3.11Å; E22-V24 PolarHBondContact O-N 2.96Å
23	E	27.2	Very low	28.7	Very low	189 Å²	189	130.9 Å²	130.9	88%	0.883	73%	0.73	S	S	*	*			trans	-62.3	105.2	157.8	-72.4	-174.2	135.6	0	0	106.8	S21 G25	S21-E23 PolarHBondContact O-N 3.21Å; S21-E23 VanDerWaalsContact O-N 3.11Å; E23-G25 PolarHBondContact O-N 2.91Å
24	V	29.5	Very low	28.9	Very low	107 Å²	107	131.3 Å²	131.3	65%	0.648	73%	0.731	S	S	*	*			trans	-69.2	85.7	173.4	-178.5	0	0	0	0	107.7	E22 D26	E22-V24 PolarHBondContact O-N 2.96Å; V24-D26 PolarHBondContact O-N 2.76Å
25	G	28.3	Very low	28.9	Very low	63 Å²	63	128.8 Å²	128.8	65%	0.649	72%	0.724	S	S	*	*			trans	-72.7	70.8	172.3	0	0	0	0	0	110.8	E23 N27	E23-G25 PolarHBondContact O-N 2.91Å; G25-N27 PolarHBondContact O-N 2.79Å
26	D	31.2	Very low	29.1	Very low	118 Å²	118	131.2 Å²	131.2	63%	0.631	72%	0.723	S	S	*	*			trans	-60.8	101.9	178.1	-86	-37.5	0	0	0	110.8	V24 H28	V24-D26 PolarHBondContact O-N 2.76Å; D26-H28 PolarHBondContact O-N 3.33Å
27	N	29.8	Very low	29.2	Very low	163 Å²	163	128 Å²	128	87%	0.872	71%	0.713	S	S	*	*			trans	-73.9	66.4	169.5	-88.3	-65.9	0	0	0	110.5	G25 G29	G25-N27 PolarHBondContact O-N 2.79Å; N27-G29 VanDerWaalsContact C-N 3.29Å; N27-G29 PolarHBondContact O-N 3.01Å
28	H	32.3	Very low	29.4	Very low	171 Å²	171	129.7 Å²	129.7	79%	0.792	72%	0.718	S	S	*	*			trans	-72	84.4	170.4	-107.2	-61.1	0	0	0	110.4	D26 H30	D26-H28 PolarHBondContact O-N 3.33Å; H28-H30 PolarHBondContact O-N 3.14Å
29	G	27.9	Very low	29.5	Very low	72 Å²	72	127.5 Å²	127.5	74%	0.742	72%	0.716	S	S	*	*			trans	-72.9	81.1	-179.2	0	0	0	0	0	114	N27	N27-G29 VanDerWaalsContact C-N 3.29Å; N27-G29 PolarHBondContact O-N 3.01Å
30	H	31.9	Very low	29.6	Very low	185 Å²	185	129 Å²	129	86%	0.856	72%	0.724	S	S	*	*			trans	-144.6	149.2	159.7	-91.8	18.6	0	0	0	108.4	H28	H28-H30 PolarHBondContact O-N 3.14Å
31	S	28.3	Very low	29.7	Very low	92 Å²	92	127.3 Å²	127.3	64%	0.643	73%	0.727	S	S	*	*			cis	-179.8	139.3	-18.8	176.7	0	0	0	0	105.4
32	S	31.3	Very low	29.9	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	73%	0.731	S	S	*	*			trans	66.6	159.6	173.3	91.4	0	0	0	0	115
33	N	29.2	Very low	30	Very low	136 Å²	136	129 Å²	129	73%	0.727	73%	0.732	S	S	*	*			cis	-167	146.5	-20.7	-115.9	-7.8	0	0	0	109.5
34	I	31.6	Very low	30.3	Very low	158 Å²	158	125.7 Å²	125.7	81%	0.81	72%	0.72	S	S	*	*			trans	65.8	139.1	158.4	-54.7	156.9	0	0	0	114.7
35	G	29.6	Very low	30.4	Very low	56 Å²	56	126.7 Å²	126.7	58%	0.577	72%	0.721	S	S	*	*			cis	160.9	164.9	-3.9	0	0	0	0	0	110.4
36	H	32.3	Very low	30.5	Very low	171 Å²	171	130 Å²	130	79%	0.792	72%	0.724	S	S	*	*			trans	66.9	151.4	177.4	-60.7	-67.9	0	0	0	116.3
37	D	30.7	Very low	30.5	Very low	96 Å²	96	128.6 Å²	128.6	51%	0.513	72%	0.723	S	S	.	*			cis	-157.1	157.1	-14.9	-118.7	8.5	0	0	0	110.7
38	R	31.4	Very low	30.5	Very low	207 Å²	207	128 Å²	128	78%	0.781	72%	0.715	S	S	*	*			trans	51.7	124.4	150.8	-61.6	170.4	-138.9	-144.2	-0.2	119.4
39	S	29.6	Very low	30.5	Very low	91 Å²	91	127.7 Å²	127.7	64%	0.636	71%	0.714	S	S	*	*			cis	80.3	135.3	42.5	82.5	0	0	0	0	115.8
40	L	29.1	Very low	30.6	Very low	173 Å²	173	128.5 Å²	128.5	91%	0.906	71%	0.708	S	S	*	*			trans	72.6	147.6	-178.5	-57.6	139.9	0	0	0	114.2
41	G	30	Very low	30.5	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	70%	0.703	S	S	*	*			cis	165.5	155.9	-8.9	0	0	0	0	0	113.1
42	D	28.9	Very low	30.5	Very low	144 Å²	144	127.7 Å²	127.7	77%	0.77	71%	0.712	S	S	*	*			trans	60.3	132.5	149.6	-70.5	-7.9	0	0	0	123.4
43	L	29.6	Very low	30.5	Very low	152 Å²	152	126.5 Å²	126.5	80%	0.796	72%	0.716	S	S	*	*			trans	70.2	165.9	147.5	-59.1	164	0	0	0	115.9
44	I	34.4	Very low	30.4	Very low	121 Å²	121	123.7 Å²	123.7	62%	0.621	72%	0.719	S	S	*	*			cis	-155.9	150.3	6	-142.7	161.1	0	0	0	112
45	N	30.6	Very low	30.4	Very low	127 Å²	127	122.2 Å²	122.2	68%	0.679	71%	0.713	S	S	*	*			trans	61.9	163.3	152.4	-68.9	-9.3	0	0	0	120.8
46	L	31.7	Very low	30.4	Very low	134 Å²	134	126.8 Å²	126.8	70%	0.702	72%	0.717	S	S	*	*			cis	-157.6	150.6	-12.2	-118.9	164.7	0	0	0	109.9
47	S	29.8	Very low	30.2	Very low	88 Å²	88	125.3 Å²	125.3	62%	0.615	72%	0.715	S	S	*	*			trans	48	156.6	149.2	64.6	0	0	0	0	120.9
48	E	31.3	Very low	30	Very low	150 Å²	150	127.9 Å²	127.9	70%	0.701	73%	0.727	S	S	*	*			cis	-156	148.4	14.7	-150.3	137.4	-138.2	0	0	112.2
49	Q	31.2	Very low	29.6	Very low	165 Å²	165	123.4 Å²	123.4	77%	0.771	73%	0.726	S	S	*	*			trans	35.5	147.1	143.2	-67.7	168.3	31.5	0	0	122.3
50	S	30.5	Very low	29.5	Very low	88 Å²	88	127.2 Å²	127.2	62%	0.615	73%	0.732	S	S	*	*			cis	-169.3	153.6	-2.8	45.5	0	0	0	0	111.6
51	D	29.9	Very low	29.5	Very low	141 Å²	141	127.5 Å²	127.5	75%	0.754	73%	0.728	S	S	*	*			trans	50	120.3	146.1	-56.9	-15.4	0	0	0	120.6
52	S	28.7	Very low	29.4	Very low	119 Å²	119	129.9 Å²	129.9	83%	0.832	74%	0.735	S	S	*	*				68.1	138.2	76.2	105.1	0	0	0	0	114.6
53	G	30.3	Very low	29.6	Very low	76 Å²	76	128.5 Å²	128.5	78%	0.784	74%	0.736	S	S	*	*			cis	166.2	164.8	-5.3	0	0	0	0	0	111.5
54	G	28.2	Very low	29.6	Very low	78 Å²	78	128.3 Å²	128.3	80%	0.804	73%	0.731	S	S	*	*			trans	100.2	132.6	160.7	0	0	0	0	0	119.8
55	D	29.8	Very low	29.6	Very low	127 Å²	127	127.5 Å²	127.5	68%	0.679	73%	0.734	S	S	*	*			trans	61.1	116.8	137	-85.7	-10.3	0	0	0	125
56	K	30.2	Very low	29.7	Very low	151 Å²	151	128.2 Å²	128.2	66%	0.657	73%	0.733	S	S	*	*				70.5	116.5	122.4	-66.1	166.9	-171.5	143.2	0	122.1
57	N	27.3	Very low	29.6	Very low	140 Å²	140	128.3 Å²	128.3	75%	0.749	73%	0.733	S	S	*	*				83.2	149.1	124.3	-68.5	-12.1	0	0	0	122.4
58	I	27.8	Very low	29.7	Very low	151 Å²	151	128.3 Å²	128.3	77%	0.774	73%	0.734	S	S	*	*			trans	74.6	85	154.8	-63.3	149.8	0	0	0	118.3
59	C	23.7	Very low	29.7	Very low	112 Å²	112	130.2 Å²	130.2	76%	0.757	74%	0.74	S	S	*	*				30.1	124.3	110.8	-173.8	0	0	0	0	120.1
60	K	27.1	Very low	29.7	Very low	172 Å²	172	126.7 Å²	126.7	75%	0.748	73%	0.733	S	S	*	*				-178.2	155.5	123.8	-104	164.9	-174.7	176.9	0	114.3
61	Q	28.8	Very low	29.8	Very low	178 Å²	178	128.5 Å²	128.5	83%	0.832	74%	0.736	S	S	*	*			trans	62.6	151.9	161.3	-69.1	151.4	-53.5	0	0	116.1
62	S	28.3	Very low	29.9	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	74%	0.736	S	S	*	*			cis	-164	163.8	-17.4	46.8	0	0	0	0	106.6
63	S	31.7	Very low	29.9	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	73%	0.725	S	S	*	*			cis	-150.8	167.3	16.5	49.5	0	0	0	0	112.3
64	E	30.7	Very low	30	Very low	148 Å²	148	131.9 Å²	131.9	69%	0.692	72%	0.72	S	S	*	*			trans	-67.6	171.8	172.6	-117.7	-179.2	-129.4	0	0	113	H66	E64-H66 IonicContact OE2-CE1 2.75Å; E64-H66 PolarHBondContact OE2-CE1 2.75Å; E64-H66 IonicContact OE2-ND1 3.76Å; E64-H66 PolarHBondContact OE2-ND1 3.01Å
65	P	34.1	Very low	30.2	Very low	104 Å²	104	136.8 Å²	136.8	68%	0.675	72%	0.719	S	S	*	*				-149	139.9	54.6	35.7	-12.2	0	0	0	120.6
66	H	33	Very low	30.1	Very low	142 Å²	142	135.2 Å²	135.2	66%	0.657	72%	0.718	S	S	*	*				71.4	157.1	129.6	-60.3	-7.8	0	0	0	120.4	E64	E64-H66 IonicContact OE2-CE1 2.75Å; E64-H66 PolarHBondContact OE2-CE1 2.75Å; E64-H66 IonicContact OE2-ND1 3.76Å; E64-H66 PolarHBondContact OE2-ND1 3.01Å
67	L	30.1	Very low	30.2	Very low	136 Å²	136	136.6 Å²	136.6	71%	0.712	73%	0.727	S	S	*	*			cis	-148.8	138.8	2.6	-152.4	73.6	0	0	0	112.1
68	S	31.3	Very low	30.3	Very low	89 Å²	89	134.1 Å²	134.1	62%	0.622	72%	0.72	S	S	*	*			trans	44.4	150.2	140.7	69.4	0	0	0	0	123.3
69	K	31.6	Very low	30.5	Very low	189 Å²	189	137.3 Å²	137.3	82%	0.822	72%	0.722	S	S	*	*			cis	-170.1	150.3	-7.6	-113.5	176.7	-179.9	-179.4	0	108.3
70	S	30.1	Very low	30.7	Very low	91 Å²	91	136.6 Å²	136.6	64%	0.636	72%	0.719	S	S	*	*			trans	58.2	159.5	139.4	81.8	0	0	0	0	119.3
71	D	33.1	Very low	30.8	Very low	127 Å²	127	132.6 Å²	132.6	68%	0.679	71%	0.712	S	S	*	*			cis	-142.2	150.5	13.3	-82.8	-70.3	0	0	0	111.7
72	E	31.2	Very low	31	Very low	159 Å²	159	131.3 Å²	131.3	74%	0.743	71%	0.71	S	S	*	*			trans	47.5	154.3	130.1	-61	-152.2	130.9	0	0	123.2
73	L	30.6	Very low	31.1	Very low	117 Å²	117	131.8 Å²	131.8	61%	0.613	70%	0.704	S	S	*	*			cis	-163.5	164.5	-3.8	-109.8	165.9	0	0	0	108.5
74	I	30.5	Very low	31	Very low	130 Å²	130	134.4 Å²	134.4	67%	0.667	70%	0.703	S	S	*	*			trans	50.7	125.9	146.6	-69.5	165.2	0	0	0	118.2
75	K	32.9	Very low	31	Very low	182 Å²	182	133.4 Å²	133.4	79%	0.791	71%	0.712	S	S	*	*			cis	-162	132.1	44.7	-135	149.7	-170.7	175.7	0	105.9
76	S	27.4	Very low	30.9	Very low	94 Å²	94	137.9 Å²	137.9	66%	0.657	72%	0.721	S	S	*	*				61.7	91.6	50.9	82.2	0	0	0	0	115.4
77	E	33.1	Very low	30.7	Very low	179 Å²	179	137.3 Å²	137.3	84%	0.836	73%	0.73	S	S	*	*				-173	133.7	119.6	-94.8	170.2	157.8	0	0	108.5
78	S	29.7	Very low	30.7	Very low	88 Å²	88	136.3 Å²	136.3	62%	0.615	73%	0.734	S	S	*	*				68.6	132.3	69.2	125.9	0	0	0	0	112.3
79	R	30.7	Very low	30.4	Very low	218 Å²	218	141.4 Å²	141.4	82%	0.823	75%	0.745	S	S	*	*			cis	-141	150.3	6.3	-96.9	150.9	175.9	169.4	-1.1	107.8
80	S	29.5	Very low	30.3	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	75%	0.746	S	S	*	*				45.1	144.8	82.2	98.8	0	0	0	0	113.8
81	S	28.8	Very low	30.4	Very low	88 Å²	88	143.5 Å²	143.5	62%	0.615	74%	0.743	S	S	*	*			cis	-170.3	173.2	16.9	4.5	0	0	0	0	109.2
82	I	32.3	Very low	30.5	Very low	152 Å²	152	143 Å²	143	78%	0.779	75%	0.746	S	S	*	*			trans	71.7	137.5	153.6	-71.7	158.4	0	0	0	115
83	D	30.3	Very low	30.5	Very low	123 Å²	123	143.2 Å²	143.2	66%	0.658	75%	0.747	S	S	*	*			cis	-144.4	176.8	5.9	-139.1	-18	0	0	0	115.7
84	Q	30.4	Very low	30.4	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	74%	0.743	S	S	*	*			trans	-68.8	150.2	-179.9	-54.6	148.1	70.2	0	0	114.6
85	S	31	Very low	30.4	Very low	127 Å²	127	142.3 Å²	142.3	89%	0.888	75%	0.745	S	S	*	*			trans	-170.4	163.4	139.9	37.6	0	0	0	0	112.4
86	K	30.7	Very low	30.2	Very low	199 Å²	199	139.3 Å²	139.3	87%	0.865	74%	0.742	S	S	*	*			trans	-89.4	155.5	-171.3	-73.5	174.9	177.5	173.6	0	113.2
87	P	30.3	Very low	30.3	Very low	130 Å²	130	140 Å²	140	84%	0.844	74%	0.743	S	S	*	*			trans	-77.9	142	179	32.3	-35.9	0	0	0	113.2
88	S	28.6	Very low	30	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	74%	0.739	S	S	*	*			trans	-156	155.5	164.8	64.9	0	0	0	0	112.8
89	K	26.5	Very low	30	Very low	196 Å²	196	139.2 Å²	139.2	85%	0.852	75%	0.746	S	S	*	*			trans	-83.6	135.1	172.9	-58.3	167.9	178.5	172.2	0	110
90	Y	28.6	Very low	29.8	Very low	213 Å²	213	136 Å²	136	84%	0.835	74%	0.744	S	S	*	*			trans	-159.9	139.5	156.1	-107.3	-90.8	0	0	0	109.3
91	I	31.9	Very low	29.7	Very low	112 Å²	112	137.4 Å²	137.4	57%	0.574	75%	0.749	S	S	*	*			cis	-146.2	151.3	-34	-123.3	-175.1	0	0	0	107.7
92	P	34.8	Very low	29.7	Very low	115 Å²	115	139.7 Å²	139.7	75%	0.747	75%	0.754	S	S	*	*			trans	-101.8	144.6	175.4	36.6	-29.7	0	0	0	113.1
93	H	31.8	Very low	29.5	Very low	165 Å²	165	140 Å²	140	76%	0.764	75%	0.752	S	S	*	*			trans	-91.1	114.2	172.5	-72.5	-71.8	0	0	0	109.9
94	S	28.2	Very low	29.4	Very low	75 Å²	75	140.3 Å²	140.3	52%	0.524	75%	0.754	S	S	.	*				71.3	129.5	75.1	75.5	0	0	0	0	111.7
95	H	31.2	Very low	29.3	Very low	153 Å²	153	140.2 Å²	140.2	71%	0.708	75%	0.753	S	S	*	*			cis	-143.4	147.6	44.9	-82.6	-98.2	0	0	0	115.6
96	T	29.3	Very low	29.2	Very low	119 Å²	119	141 Å²	141	73%	0.73	74%	0.737	S	S	*	*			trans	59.6	148.6	138.9	59.9	0	0	0	0	121.1
97	T	27.9	Very low	29.2	Very low	109 Å²	109	139 Å²	139	67%	0.669	73%	0.734	S	S	*	*			cis	-173.3	122.2	-12.7	-93.2	0	0	0	0	107.7
98	T	28.2	Very low	29	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	73%	0.734	S	S	*	*			trans	59.9	159	146.3	-35.5	0	0	0	0	115.9
99	T	29.5	Very low	28.9	Very low	127 Å²	127	141.1 Å²	141.1	78%	0.779	73%	0.732	S	S	*	*			cis	-139.5	156.2	12.5	-37.2	0	0	0	0	111.9
100	I	25.2	Very low	28.9	Very low	149 Å²	149	140.9 Å²	140.9	76%	0.764	73%	0.734	S	S	*	*			trans	-67.4	130.6	165.2	-62.6	149.6	0	0	0	111.2
101	T	29.2	Very low	28.7	Very low	128 Å²	128	141 Å²	141	79%	0.785	73%	0.733	S	S	*	*			trans	-173.3	123.4	134	32.9	0	0	0	0	106.9
102	N	26.9	Very low	28.3	Very low	135 Å²	135	141.6 Å²	141.6	72%	0.722	74%	0.736	S	S	*	*				82	135.4	55.2	-166.9	26.8	0	0	0	112.1
103	Q	29.4	Very low	27.9	Very low	159 Å²	159	139.9 Å²	139.9	74%	0.743	72%	0.724	S	S	*	*			trans	65.2	157.4	-170.8	-54.2	171.1	-8.9	0	0	114
104	N	28.1	Very low	27.7	Very low	130 Å²	130	141.4 Å²	141.4	70%	0.695	72%	0.724	S	S	*	*			cis	-162.1	171.6	-32.9	-103.7	-3.2	0	0	0	106.4
105	E	28.7	Very low	27.5	Very low	167 Å²	167	144.1 Å²	144.1	78%	0.78	74%	0.74	S	S	*	*			trans	65.3	154.3	163.1	-79.6	166.7	-131.1	0	0	117.3
106	R	27.7	Very low	27.3	Very low	143 Å²	143	144.3 Å²	144.3	54%	0.54	74%	0.739	S	S	.	*			cis	-147.6	158.3	-22.8	-156.9	164.6	-147	179.4	6.1	108.9	T408 N409 I410	R106-T408 PolarHBondContact NH2-O 3.36Å; R106-N409 VanDerWaalsContact CZ-O 3.24Å; R106-N409 PolarHBondContact NH1-O 2.8Å; R106-N409 VanDerWaalsContact NH2-C 3.27Å; R106-N409 PolarHBondContact NH2-O 3.11Å; R106-I410 PolarHBondContact NH1-O 2.86Å; R106-I410 VanDerWaalsContact NH1-O 3.07Å
107	I	30.5	Very low	27.2	Very low	156 Å²	156	146.7 Å²	146.7	80%	0.8	74%	0.741	S	S	*	*			trans	-72.9	126.8	168.5	-61.2	167.3	0	0	0	108.7
108	E	27	Very low	27.1	Very low	181 Å²	181	144.8 Å²	144.8	85%	0.846	73%	0.732	S	S	*	*			trans	-140.8	116.4	158.4	-161.7	156.7	-115.1	0	0	109.3
109	S	26	Very low	27	Very low	109 Å²	109	146.6 Å²	146.6	76%	0.762	74%	0.736	S	S	*	*			trans	-109.9	97.2	-173.2	56.7	0	0	0	0	110
110	E	26.9	Very low	26.9	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	74%	0.736	S	S	*	*			trans	-137.8	151	171.1	-132.8	177.6	-146.5	0	0	116
111	R	24.2	Very low	27	Very low	215 Å²	215	143.2 Å²	143.2	81%	0.811	73%	0.732	S	S	*	*			trans	-78.6	165.9	-163.6	-55.1	175.6	-179	-160.7	-1.5	112.9
112	I	24.8	Very low	26.9	Very low	125 Å²	125	144.6 Å²	144.6	64%	0.641	73%	0.734	S	S	*	*			trans	67.4	124.2	149.1	-66.1	151.5	0	0	0	115.4
113	T	25.8	Very low	26.9	Very low	80 Å²	80	146.6 Å²	146.6	49%	0.491	74%	0.739	S	S	.	*				-168.2	130.3	96.3	-49.2	0	0	0	0	112.8	K116	T113-K116 HydrophobicContact CG2-CB 4.36Å; T113-K116 HydrophobicContact CG2-CD 3.52Å; T113-K116 HydrophobicContact CG2-CG 3.56Å; T113-K116 PolarHBondContact OG1-NZ 2.93Å
114	Y	26.3	Very low	26.8	Very low	196 Å²	196	146.2 Å²	146.2	77%	0.769	74%	0.74	S	S	*	*			trans	-43.5	168.8	152	-56.9	-91.4	0	0	0	114.7	K116	Y114-K116 PolarHBondContact O-N 2.91Å
115	P	24.8	Very low	26.7	Very low	133 Å²	133	146.1 Å²	146.1	86%	0.864	74%	0.74	S	S	*	*			trans	-62.6	98.4	164.4	26.4	-35.2	0	0	0	111.9
116	K	26.8	Very low	26.6	Very low	156 Å²	156	147.9 Å²	147.9	68%	0.678	74%	0.741	S	S	*	*			trans	-75.9	121.9	178.4	-98.6	175	-172.8	143.5	0	113.2	T113 Y114	T113-K116 HydrophobicContact CG2-CB 4.36Å; T113-K116 HydrophobicContact CG2-CD 3.52Å; T113-K116 HydrophobicContact CG2-CG 3.56Å; T113-K116 PolarHBondContact OG1-NZ 2.93Å; Y114-K116 PolarHBondContact O-N 2.91Å
117	H	27.3	Very low	26.6	Very low	170 Å²	170	146.5 Å²	146.5	79%	0.787	75%	0.753	S	S	*	*			trans	-143.7	122.6	152.7	-95.8	-126	0	0	0	105.1
118	S	26.2	Very low	26.3	Very low	69 Å²	69	143.7 Å²	143.7	48%	0.483	75%	0.747	S	S	.	*			cis	-146.5	143.1	-9.6	-34.4	0	0	0	0	105.9	K1143	S118-K1143 PolarHBondContact OG-NZ 3.4Å
119	L	26.2	Very low	26.4	Very low	160 Å²	160	141.9 Å²	141.9	84%	0.838	74%	0.743	S	S	*	*				40.7	124	88	-66.1	156.6	0	0	0	113.2
120	S	26.9	Very low	26.3	Very low	111 Å²	111	144.2 Å²	144.2	78%	0.776	74%	0.74	S	S	*	*			cis	-127	172.5	15.5	46.9	0	0	0	0	112.6
121	S	26.6	Very low	26.3	Very low	95 Å²	95	142.1 Å²	142.1	66%	0.664	73%	0.73	S	S	*	*			cis	98	87.5	13	-51.2	0	0	0	0	117.7
122	N	28.1	Very low	26.4	Very low	156 Å²	156	139.9 Å²	139.9	83%	0.834	73%	0.726	S	S	*	*			trans	-148.8	127.3	143.3	-87.1	-23.4	0	0	0	104.6
123	Q	26.7	Very low	26.5	Very low	178 Å²	178	140.7 Å²	140.7	83%	0.832	73%	0.731	S	S	*	*			cis	73.7	155.3	39.9	-73.6	-159	-17.2	0	0	115.7
124	I	27.3	Very low	26.5	Very low	150 Å²	150	142.4 Å²	142.4	77%	0.769	74%	0.741	S	S	*	*			trans	85.7	120	-171.4	-56.3	173.3	0	0	0	113.3
125	N	27	Very low	26.5	Very low	128 Å²	128	137.7 Å²	137.7	68%	0.684	74%	0.737	S	S	*	*			cis	-152.4	162.4	-9.1	-116.2	1.3	0	0	0	114.2
126	Y	25	Very low	26.7	Very low	205 Å²	205	137.8 Å²	137.8	80%	0.804	73%	0.731	S	S	*	*			trans	-24.8	155.8	160.1	-61	-88.1	0	0	0	117.2
127	S	28	Very low	26.9	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	73%	0.73	S	S	*	*			cis	-154.6	153.8	42.3	60.4	0	0	0	0	116.8
128	S	24.2	Very low	26.9	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	73%	0.725	S	S	*	*			trans	-88.6	133.3	153.6	166.9	0	0	0	0	108.1
129	N	29.1	Very low	27.2	Very low	143 Å²	143	138 Å²	138	77%	0.765	74%	0.74	S	S	*	*				-155.2	149.5	123.5	-114.7	-32.3	0	0	0	114.7
130	K	25	Very low	27.2	Very low	159 Å²	159	136 Å²	136	69%	0.691	73%	0.734	S	S	*	*			trans	-49.5	148.6	160.6	-51.5	154.2	-176.5	169.3	0	108.1
131	H	27	Very low	27.5	Very low	145 Å²	145	136.2 Å²	136.2	67%	0.671	73%	0.733	S	S	*	*				-169.3	150.7	60.3	-114.4	-60.5	0	0	0	113.1
132	K	25.3	Very low	27.6	Very low	168 Å²	168	137.7 Å²	137.7	73%	0.73	74%	0.738	S	S	*	*			trans	39.2	144.3	134.1	-86.9	-178.4	179.1	-177.1	0	120.7
133	N	27.2	Very low	27.6	Very low	142 Å²	142	137 Å²	137	76%	0.759	73%	0.734	S	S	*	*			trans	83.4	144.6	153.2	-63.6	-1.5	0	0	0	116.9
134	V	26.4	Very low	27.7	Very low	116 Å²	116	133.1 Å²	133.1	70%	0.703	73%	0.727	S	S	*	*			cis	176	152	-31.5	124.3	0	0	0	0	105
135	S	26.5	Very low	27.6	Very low	97 Å²	97	132 Å²	132	68%	0.678	73%	0.729	S	S	*	*			trans	70.1	154	168.3	88.8	0	0	0	0	115.1
136	N	27.5	Very low	27.7	Very low	136 Å²	136	132.8 Å²	132.8	73%	0.727	73%	0.733	S	S	*	*			cis	-161.5	172.6	-15.5	-121.5	7.7	0	0	0	111.4
137	N	31.1	Very low	27.8	Very low	124 Å²	124	129.5 Å²	129.5	66%	0.663	73%	0.728	S	S	*	*			trans	71	114.4	159.9	-59.7	-14.7	0	0	0	115.5
138	N	27.2	Very low	27.9	Very low	128 Å²	128	130.4 Å²	130.4	68%	0.684	72%	0.724	S	S	*	*				86.5	124.6	53.9	-68.5	-13.3	0	0	0	112.4
139	N	33.1	Very low	28.2	Very low	148 Å²	148	131.9 Å²	131.9	79%	0.791	72%	0.724	S	S	*	*			trans	142.8	94.5	156.5	-73.1	-7.2	0	0	0	106.3
140	T	26.3	Very low	28.1	Very low	117 Å²	117	129.4 Å²	129.4	72%	0.718	72%	0.718	S	S	*	*			cis	68.1	150.6	41.3	89.2	0	0	0	0	113.1
141	P	33	Very low	28.3	Very low	116 Å²	116	130.6 Å²	130.6	75%	0.753	73%	0.726	S	S	*	*				-136.4	155.1	-90.4	34.5	-15.2	0	0	0	115.3
142	T	28.6	Very low	28.4	Very low	126 Å²	126	131.5 Å²	131.5	77%	0.773	73%	0.73	S	S	*	*			trans	-174.6	157.7	170.3	44.3	0	0	0	0	108
143	D	28.4	Very low	28.6	Very low	141 Å²	141	129.5 Å²	129.5	75%	0.754	73%	0.727	S	S	*	*			cis	-169	173.3	-22.7	-101.9	-25.7	0	0	0	107.7
144	S	28.5	Very low	28.6	Very low	97 Å²	97	131.4 Å²	131.4	68%	0.678	73%	0.729	S	S	*	*			trans	66.9	112.8	162.4	-54.1	0	0	0	0	118.7
145	P	25.7	Very low	28.6	Very low	126 Å²	126	131.9 Å²	131.9	82%	0.818	73%	0.732	S	S	*	*			trans	-83.1	127.8	168.3	32.8	-31.4	0	0	0	111.9
146	L	29.5	Very low	28.6	Very low	144 Å²	144	137.1 Å²	137.1	75%	0.754	74%	0.739	S	S	*	*			trans	-118.6	117.2	164.6	-74.1	118.9	0	0	0	107.8
147	I	26.6	Very low	28.4	Very low	137 Å²	137	138.1 Å²	138.1	70%	0.703	74%	0.742	S	S	*	*				69.3	91.4	74.7	-63.9	164.1	0	0	0	110.7
148	N	29.4	Very low	28.1	Very low	132 Å²	132	136.6 Å²	136.6	71%	0.706	74%	0.742	S	S	*	*				-174	129.9	123.1	-95.1	1.7	0	0	0	113.1
149	D	30.4	Very low	28.1	Very low	128 Å²	128	137.7 Å²	137.7	68%	0.684	75%	0.748	S	S	*	*			trans	62.5	108.8	132.7	-52.4	-20.5	0	0	0	123.3
150	S	27.9	Very low	27.8	Very low	91 Å²	91	137.4 Å²	137.4	64%	0.636	75%	0.746	S	S	*	*				74.2	109.3	116.6	-56.3	0	0	0	0	121.6
151	Q	29	Very low	27.8	Very low	183 Å²	183	139.5 Å²	139.5	86%	0.855	75%	0.748	S	S	*	*				49.7	129	112.7	-63.6	168.4	-11.1	0	0	118.1
152	E	29.5	Very low	27.5	Very low	164 Å²	164	142.2 Å²	142.2	77%	0.766	75%	0.75	S	S	*	*			cis	-148.5	148.8	30.3	-74.1	-169.2	123.9	0	0	114.3
153	L	29.3	Very low	27.4	Very low	127 Å²	127	142.7 Å²	142.7	67%	0.665	76%	0.757	S	S	*	*			trans	45.2	126.4	138.8	-52.2	169	0	0	0	120
154	F	26.2	Very low	27.3	Very low	181 Å²	181	142.8 Å²	142.8	79%	0.794	76%	0.757	S	S	*	*			cis	-148.9	118.7	3.6	-124.7	-50.2	0	0	0	110.1
155	T	26.8	Very low	27.4	Very low	127 Å²	127	144.2 Å²	144.2	78%	0.779	76%	0.762	S	S	*	*			trans	-134.5	149.8	163.5	44.6	0	0	0	0	107.1
156	Y	26.2	Very low	27.6	Very low	207 Å²	207	144.2 Å²	144.2	81%	0.812	76%	0.755	S	S	*	*			trans	-156.9	112.9	156.8	-119.1	-75.5	0	0	0	111.3
157	I	24.6	Very low	27.4	Very low	156 Å²	156	146.9 Å²	146.9	80%	0.8	76%	0.76	S	S	*	*			trans	-90.2	148.5	162	-70.5	168.3	0	0	0	106.9
158	S	25	Very low	27.6	Very low	93 Å²	93	145.3 Å²	145.3	65%	0.65	76%	0.759	S	S	*	*			trans	24.2	121.6	162.2	-178.3	0	0	0	0	118.7
159	N	27.1	Very low	27.6	Very low	151 Å²	151	145.6 Å²	145.6	81%	0.807	77%	0.765	S	S	*	*				-152.4	143.4	125.9	-100.6	-23.6	0	0	0	112.5
160	N	25.6	Very low	27.4	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	77%	0.771	S	S	*	*			trans	-82.7	169.8	168.6	-101.4	-15.1	0	0	0	110.5
161	E	26.8	Very low	27.4	Very low	161 Å²	161	149.7 Å²	149.7	75%	0.752	78%	0.775	S	S	*	*			trans	72.3	122.2	157.3	-73.8	167.5	-152.6	0	0	120.5
162	H	27.1	Very low	27.4	Very low	172 Å²	172	147.6 Å²	147.6	80%	0.796	77%	0.769	S	S	*	*			trans	50.2	107.5	137.7	-67.9	79.8	0	0	0	119.8
163	C	26.3	Very low	27.3	Very low	137 Å²	137	145 Å²	145	93%	0.926	77%	0.769	S	S	*	*				-151	144.4	102.5	-126.7	0	0	0	0	113.4
164	N	25.1	Very low	27.2	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	77%	0.771	S	S	*	*			trans	-101.5	127.8	-167.2	178.6	10.6	0	0	0	110.9
165	V	31.3	Very low	27.2	Very low	126 Å²	126	138.9 Å²	138.9	76%	0.764	77%	0.769	S	S	*	*			trans	-136.4	94.1	170.3	-173.6	0	0	0	0	111.4
166	N	30.1	Very low	27.2	Very low	127 Å²	127	139.4 Å²	139.4	68%	0.679	77%	0.765	S	S	*	*			trans	43.9	101.6	143	-53.8	-30.5	0	0	0	118.4
167	K	26	Very low	27.2	Very low	200 Å²	200	136.1 Å²	136.1	87%	0.87	76%	0.762	S	S	*	*				83.1	153.2	78.3	-88	-158.4	169.2	-175.5	0	115
168	P	30.4	Very low	27.2	Very low	104 Å²	104	133.2 Å²	133.2	68%	0.675	76%	0.755	S	S	*	*			trans	-109.1	179.5	-151.9	42.5	-36.8	0	0	0	114.3
169	V	29.7	Very low	27.3	Very low	137 Å²	137	135.3 Å²	135.3	83%	0.83	76%	0.76	S	S	*	*			trans	-123.3	122.4	156.2	178.9	0	0	0	0	108.7
170	Q	24.8	Very low	27.3	Very low	173 Å²	173	132.8 Å²	132.8	81%	0.808	75%	0.753	S	S	*	*			trans	-95.1	152.9	158.4	-63.8	171.1	-93	0	0	107.8
171	D	29.5	Very low	27.3	Very low	133 Å²	133	133.5 Å²	133.5	71%	0.711	76%	0.757	S	S	*	*			trans	-167.3	118.7	149.3	-96.1	-17.1	0	0	0	106.4
172	N	27.6	Very low	27.3	Very low	138 Å²	138	135.2 Å²	135.2	74%	0.738	77%	0.765	S	S	*	*				81.4	141.2	98.3	-67.8	-22.1	0	0	0	114.3
173	S	28.1	Very low	27.2	Very low	109 Å²	109	134.7 Å²	134.7	76%	0.762	76%	0.763	S	S	*	*			cis	-168.5	145.1	-10.9	45.3	0	0	0	0	111.5
174	G	27.1	Very low	27.3	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	76%	0.758	S	S	*	*			trans	69.3	176.4	162.9	0	0	0	0	0	117.3
175	C	26	Very low	27.4	Very low	111 Å²	111	135.3 Å²	135.3	75%	0.75	76%	0.757	S	S	*	*			cis	-157.5	124.9	-14.1	-103.8	0	0	0	0	108.1
176	I	25.8	Very low	27.4	Very low	138 Å²	138	134.9 Å²	134.9	71%	0.708	76%	0.757	S	S	*	*				83.3	131.1	101.9	-70.3	179.5	0	0	0	115.1
177	N	27.2	Very low	27.4	Very low	139 Å²	139	135 Å²	135	74%	0.743	76%	0.764	S	S	*	*			trans	67.4	126.5	167.5	-66.4	-4.1	0	0	0	117.4
178	S	25.1	Very low	27.4	Very low	94 Å²	94	134.3 Å²	134.3	66%	0.657	76%	0.764	S	S	*	*				86.4	147.8	68.1	102.7	0	0	0	0	112.2
179	D	26.1	Very low	27.6	Very low	138 Å²	138	136.3 Å²	136.3	74%	0.738	77%	0.774	S	S	*	*			cis	-155.8	178.5	11.6	-134.9	-45.3	0	0	0	112.7
180	S	28.4	Very low	27.5	Very low	97 Å²	97	132.9 Å²	132.9	68%	0.678	77%	0.766	S	S	*	*			trans	56.3	113.5	154.8	63.7	0	0	0	0	122
181	N	24.4	Very low	27.5	Very low	157 Å²	157	136.2 Å²	136.2	84%	0.84	77%	0.772	S	S	*	*			trans	4.7	129.3	137.4	-52.1	-25.7	0	0	0	120.1
182	Q	27.8	Very low	27.6	Very low	197 Å²	197	135.6 Å²	135.6	92%	0.921	77%	0.769	S	S	*	*				-158.2	147.9	124.3	-115.2	171.7	20.8	0	0	113
183	E	23.6	Very low	27.6	Very low	162 Å²	162	136.3 Å²	136.3	76%	0.757	77%	0.772	S	S	*	*			trans	-110.7	132.3	-175.7	-178.7	-173.7	167.2	0	0	110.1
184	V	29.9	Very low	27.8	Very low	135 Å²	135	137 Å²	137	82%	0.818	78%	0.777	S	S	*	*			trans	-141.4	128.8	176.7	-176.5	0	0	0	0	110.8
185	Q	27.3	Very low	27.7	Very low	158 Å²	158	145 Å²	145	74%	0.738	79%	0.786	S	S	*	*			trans	-101.6	151.4	-179.7	-60.5	178.6	1.7	0	0	113
186	P	30.2	Very low	27.9	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	79%	0.79	S	S	*	*			trans	-105.5	161.5	152.6	33	-22.6	0	0	0	112.4
187	P	30.2	Very low	27.9	Very low	128 Å²	128	149.7 Å²	149.7	83%	0.831	80%	0.796	S	S	*	*				-121.5	175	-129.1	40	-30.4	0	0	0	118.1
188	H	26.5	Very low	27.8	Very low	187 Å²	187	150 Å²	150	87%	0.866	80%	0.797	S	S	*	*			trans	-95.5	141	-177.1	-100.4	-82.7	0	0	0	115.6
189	T	34	Very low	27.8	Very low	146 Å²	146	151.6 Å²	151.6	90%	0.896	80%	0.803	S	S	*	*			trans	-150.5	165	154.5	46.5	0	0	0	0	109.7
190	G	27.1	Very low	28	Very low	64 Å²	64	154.2 Å²	154.2	66%	0.66	81%	0.81	S	S	*	*			cis	163.6	81.9	-13.2	0	0	0	0	0	115.9
191	W	26.5	Very low	28	Very low	243 Å²	243	155.4 Å²	155.4	92%	0.92	81%	0.814	S	S	*	*			trans	69	157.5	160.6	-69.6	18.8	0	0	0	116.9
192	N	30.8	Very low	28.4	Very low	121 Å²	121	154 Å²	154	65%	0.647	81%	0.813	S	S	*	*			cis	-151.3	175.3	-10.4	-127.8	-27.7	0	0	0	113.2
193	N	27.5	Very low	28.6	Very low	152 Å²	152	151.2 Å²	151.2	81%	0.813	81%	0.805	S	S	*	*			trans	-64.4	145	-174.2	-67.2	-64.3	0	0	0	117.9
194	S	32.1	Very low	28.7	Very low	125 Å²	125	148.8 Å²	148.8	87%	0.874	79%	0.789	S	S	*	*				-161.4	162	129.3	56.5	0	0	0	0	111.9
195	R	25	Very low	28.6	Very low	235 Å²	235	146.5 Å²	146.5	89%	0.887	78%	0.775	S	S	*	*			trans	-94.1	141.7	-168.9	-65.9	170.7	171.7	150.9	-6.7	113.1
196	N	31	Very low	28.5	Very low	156 Å²	156	145.1 Å²	145.1	83%	0.834	77%	0.768	S	S	*	*			trans	165.8	94.3	134.8	-83.1	-16.2	0	0	0	109.5
197	F	24.8	Very low	28.4	Very low	193 Å²	193	147.9 Å²	147.9	85%	0.846	77%	0.768	S	S	*	*				67.8	116.3	89.6	-116.9	-94.6	0	0	0	116.7
198	L	24.5	Very low	28.1	Very low	145 Å²	145	146.9 Å²	146.9	76%	0.759	76%	0.76	S	S	*	*			trans	78.7	145.4	163.9	-79.2	164.1	0	0	0	121.9
199	T	26.1	Very low	28.2	Very low	127 Å²	127	148 Å²	148	78%	0.779	76%	0.763	S	S	*	*			trans	56.5	95.1	167.5	52.7	0	0	0	0	119.6
200	H	29.4	Very low	27.8	Very low	193 Å²	193	145.6 Å²	145.6	89%	0.894	75%	0.752	S	S	*	*			trans	-127.9	132.1	146.7	-101.4	-81	0	0	0	110.1
201	T	29	Very low	27.7	Very low	123 Å²	123	152.5 Å²	152.5	76%	0.755	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-85.6	146.6	175.3	41.8	0	0	0	0	111.2
202	P	33.5	Very low	27.6	Very low	126 Å²	126	146.1 Å²	146.1	82%	0.818	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-77.4	134.4	179.4	30.4	-33.9	0	0	0	111.9	R204	P202-R204 PolarHBondContact O-N 3.16Å
203	N	30.8	Very low	27.5	Very low	139 Å²	139	148 Å²	148	74%	0.743	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-67.7	122.1	-171.8	-82	-45.5	0	0	0	114.9	V205	N203-V205 PolarHBondContact O-N 3.03Å
204	R	26.4	Very low	27.8	Very low	112 Å²	112	148.1 Å²	148.1	42%	0.423	77%	0.765	S	S	.	*			trans	21.7	94.1	141	-159.3	177.4	-168.9	-167.8	4.2	117.1	P202 H206	P202-R204 PolarHBondContact O-N 3.16Å; R204-H206 VanDerWaalsContact CD-NE2 3.34Å; R204-H206 WeakPolarHBondContact CD-NE2 3.5Å; R204-H206 PolarHBondContact NE-NE2 3.42Å; R204-H206 VanDerWaalsContact NE-NE2 3.18Å; R204-H206 PolarHBondContact NH1-NE2 2.66Å; R204-H206 PolarHBondContact O-N 3Å
205	V	27.4	Very low	27.6	Very low	87 Å²	87	146.3 Å²	146.3	53%	0.527	76%	0.758	S	S	.	*			trans	-74.7	102	166.4	179.4	0	0	0	0	109.8	M1 N203 F207	M1-V205 HydrophobicContact CE-CG1 4.03Å; M1-V205 HydrophobicContact CE-CG2 4.38Å; M1-V205 HydrophobicContact SD-CG2 4.46Å; N203-V205 PolarHBondContact O-N 3.03Å; V205-F207 HydrophobicContact CG1-CD2 4Å; V205-F207 HydrophobicContact CG1-CE2 3.75Å; V205-F207 HydrophobicContact CG1-CZ 4.44Å; V205-F207 PolarHBondContact O-N 2.85Å
206	H	26.2	Very low	27.9	Very low	129 Å²	129	142.1 Å²	142.1	60%	0.597	75%	0.753	S	S	*	*			trans	-69.3	121	168.6	-94.2	-104.2	0	0	0	110.8	R204	R204-H206 VanDerWaalsContact CD-NE2 3.34Å; R204-H206 WeakPolarHBondContact CD-NE2 3.5Å; R204-H206 PolarHBondContact NE-NE2 3.42Å; R204-H206 VanDerWaalsContact NE-NE2 3.18Å; R204-H206 PolarHBondContact NH1-NE2 2.66Å; R204-H206 PolarHBondContact O-N 3Å
207	F	26.9	Very low	28	Very low	174 Å²	174	141.3 Å²	141.3	76%	0.763	75%	0.748	S	S	*	*			trans	-95.2	81	167.6	-85.7	-88.1	0	0	0	110.1	V205 F209	V205-F207 HydrophobicContact CG1-CD2 4Å; V205-F207 HydrophobicContact CG1-CE2 3.75Å; V205-F207 HydrophobicContact CG1-CZ 4.44Å; V205-F207 PolarHBondContact O-N 2.85Å; F207-F209 PolarHBondContact O-N 3.12Å
208	T	25.6	Very low	28.3	Very low	107 Å²	107	139.4 Å²	139.4	66%	0.656	75%	0.747	S	S	*	*			trans	-72.7	93.9	171.6	38.4	0	0	0	0	111	S210	T208-S210 PolarHBondContact O-N 3.02Å; T208-S210 PolarHBondContact O-OG 3.43Å
209	F	26.9	Very low	28.8	Very low	211 Å²	211	138.9 Å²	138.9	93%	0.925	75%	0.745	S	S	*	*			trans	-68.9	93.6	166.6	-111.9	-86.4	0	0	0	109.2	F207	F207-F209 PolarHBondContact O-N 3.12Å
210	S	25.5	Very low	29.3	Very low	96 Å²	96	138.7 Å²	138.7	67%	0.671	74%	0.735	S	S	*	*			trans	-112.7	130	-173.5	38.2	0	0	0	0	111.7	T208	T208-S210 PolarHBondContact O-N 3.02Å; T208-S210 PolarHBondContact O-OG 3.43Å
211	K	24.8	Very low	29.6	Very low	209 Å²	209	135.2 Å²	135.2	91%	0.909	73%	0.728	S	S	*	*			trans	39.8	109.2	169.1	-71.8	-168.5	171.4	-169.7	0	118.8
212	S	26	Very low	29.9	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	72%	0.72	S	S	*	*			trans	-176.9	64.5	133.1	59.1	0	0	0	0	111.9
213	I	29.1	Very low	30	Very low	160 Å²	160	132.5 Å²	132.5	82%	0.821	71%	0.708	S	S	*	*			trans	-139.4	84.5	161.2	-54.9	-179.7	0	0	0	106.3
214	D	32.3	Very low	30.1	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	71%	0.707	S	S	*	*			trans	-70.6	143.4	161.8	-52.2	-64.9	0	0	0	107.6
215	A	27.4	Very low	30.6	Very low	86 Å²	86	130.8 Å²	130.8	71%	0.711	70%	0.699	S	S	*	*			trans	-131.7	93.8	-156.1	0	0	0	0	0	112.9
216	D	31.4	Very low	31	Very low	148 Å²	148	132 Å²	132	79%	0.791	70%	0.702	S	S	*	*			trans	-127.7	158	171.7	-65.3	-63.2	0	0	0	111.2
217	D	33.9	Very low	31.6	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	70%	0.701	S	S	*	*			trans	66.1	82.2	165.7	-58.5	-18.3	0	0	0	121.6	N219	D217-N219 PolarHBondContact O-N 3.07Å
218	D	31.7	Very low	32.4	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	68%	0.683	S	S	*	*	S	Bend		60.6	12.1	110.8	-80.3	19.1	0	0	0	123.2
219	N	33.7	Very low	33.2	Very low	134 Å²	134	132.5 Å²	132.5	72%	0.717	69%	0.691	S	S	*	*			trans	-122.6	12.8	176.4	-93.3	-86.8	0	0	0	117.3	D217	D217-N219 PolarHBondContact O-N 3.07Å
220	H	37.8	Very low	34.1	Very low	123 Å²	123	126.1 Å²	126.1	57%	0.569	67%	0.669	S	S	*	*			trans	-110	6.3	-175.4	-97.5	-80.2	0	0	0	117	S222 L223 R224	H220-S222 VanDerWaalsContact C-N 3.28Å; H220-S222 PolarHBondContact O-N 3.05Å; H220-L223 PolarHBondContact O-N 3.07Å; H220-R224 VanDerWaalsContact O-CB 3.29Å; H220-R224 WeakPolarHBondContact O-CB 3.31Å; H220-R224 PolarHBondContact O-N 3.15Å
221	T	36.6	Very low	34.6	Very low	120 Å²	120	127.8 Å²	127.8	74%	0.736	67%	0.665	S	S	*	*	H	α-helix	trans	-56.7	-32.3	-178.4	40.8	0	0	0	0	114.6	G225	T221-G225 WeakPolarHBondContact O-CA 2.8Å; T221-G225 PolarHBondContact O-N 3.21Å
222	S	34.6	Very low	35.4	Very low	86 Å²	86	124.8 Å²	124.8	60%	0.601	65%	0.647	S	S	*	*	H	α-helix	trans	-68	-47.7	177.4	60.5	0	0	0	0	113	H220 G225 L226	H220-S222 VanDerWaalsContact C-N 3.28Å; H220-S222 PolarHBondContact O-N 3.05Å; S222-G225 PolarHBondContact O-N 3.02Å; S222-L226 PolarHBondContact O-N 3.38Å
223	L	34.5	Very low	36.1	Very low	106 Å²	106	122.3 Å²	122.3	56%	0.555	63%	0.629	S	S	*	*	H	α-helix	trans	-75	-40.5	178.3	-83.5	166.5	0	0	0	112.3	H220 G225 L226 F227	H220-L223 PolarHBondContact O-N 3.07Å; L223-G225 PolarHBondContact O-N 2.88Å; L223-L226 PolarHBondContact O-N 2.7Å; L223-F227 WeakPolarHBondContact O-CB 3.29Å; L223-F227 PolarHBondContact O-N 2.8Å
224	R	33.6	Very low	36.7	Very low	190 Å²	190	119.3 Å²	119.3	72%	0.717	61%	0.614	S	S	*	*	H	α-helix	trans	-62.4	-36.8	172.7	-146.6	176.8	-165	-169.6	5.4	110	H220 N228	H220-R224 VanDerWaalsContact O-CB 3.29Å; H220-R224 WeakPolarHBondContact O-CB 3.31Å; H220-R224 PolarHBondContact O-N 3.15Å; R224-N228 WeakPolarHBondContact O-CB 3.25Å; R224-N228 PolarHBondContact O-N 2.95Å; R224-N228 PolarHBondContact O-ND2 3.04Å
225	G	37.4	Very low	37.1	Very low	26 Å²	26	116.6 Å²	116.6	27%	0.268	60%	0.599	S	S	.	*	H	α-helix	trans	-65.6	-44.5	172.9	0	0	0	0	0	113.9	T221 S222 L223 N228 R229	T221-G225 WeakPolarHBondContact O-CA 2.8Å; T221-G225 PolarHBondContact O-N 3.21Å; S222-G225 PolarHBondContact O-N 3.02Å; L223-G225 PolarHBondContact O-N 2.88Å; G225-N228 PolarHBondContact O-N 3Å; G225-R229 VanDerWaalsContact O-CB 3.27Å; G225-R229 WeakPolarHBondContact O-CB 3.22Å; G225-R229 WeakPolarHBondContact O-CG 3.37Å; G225-R229 PolarHBondContact O-N 3.2Å
226	L	35.9	Very low	37.7	Very low	111 Å²	111	121.3 Å²	121.3	58%	0.581	60%	0.599	S	S	*	*	H	α-helix	trans	-63.6	-45	174.8	-111.7	156	0	0	0	112	S222 L223 N228 R229 T230	S222-L226 PolarHBondContact O-N 3.38Å; L223-L226 PolarHBondContact O-N 2.7Å; L226-N228 PolarHBondContact O-N 2.74Å; L226-R229 PolarHBondContact O-N 2.91Å; L226-T230 WeakPolarHBondContact O-CB 3.16Å; L226-T230 PolarHBondContact O-N 3.42Å; L226-T230 PolarHBondContact O-OG1 3.49Å
227	F	37.8	Very low	38.2	Very low	133 Å²	133	121.8 Å²	121.8	58%	0.583	59%	0.59	S	S	*	*	I	π-helix	trans	-64.3	-41.5	176.6	-152.1	-96.9	0	0	0	111.5	L223 F231 R232	L223-F227 WeakPolarHBondContact O-CB 3.29Å; L223-F227 PolarHBondContact O-N 2.8Å; F227-F231 HydrophobicContact CD1-CB 4.5Å; F227-F231 HydrophobicContact CD2-CB 4.45Å; F227-F231 HydrophobicContact CE2-CB 4.49Å; F227-F231 HydrophobicContact CE2-CG 4.46Å; F227-F231 HydrophobicContact CG-CB 4.46Å; F227-F231 WeakPolarHBondContact O-CB 3.43Å; F227-F231 PolarHBondContact O-N 2.84Å; F227-F231 VanDerWaalsContact O-N 3.1Å; F227-R232 PolarHBondContact O-N 3.1Å
228	N	44.2	Very low	38.6	Very low	73 Å²	73	117.5 Å²	117.5	39%	0.39	57%	0.573	S	S	.	*	I	π-helix	trans	-72	-31.6	177.2	-74.6	-15.3	0	0	0	114.2	R224 G225 L226 R232 P233	R224-N228 WeakPolarHBondContact O-CB 3.25Å; R224-N228 PolarHBondContact O-N 2.95Å; R224-N228 PolarHBondContact O-ND2 3.04Å; G225-N228 PolarHBondContact O-N 3Å; L226-N228 PolarHBondContact O-N 2.74Å; N228-R232 WeakPolarHBondContact O-CB 3.39Å; N228-R232 WeakPolarHBondContact OD1-CD 3.33Å; N228-P233 WeakPolarHBondContact O-CD 3.26Å
229	R	42.7	Very low	39	Very low	216 Å²	216	114.5 Å²	114.5	82%	0.815	56%	0.557	S	S	*	*	I	π-helix	trans	-84.9	-33.1	178.8	-80.6	-175.7	166.2	178.1	-3.7	113.8	G225 L226 P233	G225-R229 VanDerWaalsContact O-CB 3.27Å; G225-R229 WeakPolarHBondContact O-CB 3.22Å; G225-R229 WeakPolarHBondContact O-CG 3.37Å; G225-R229 PolarHBondContact O-N 3.2Å; L226-R229 PolarHBondContact O-N 2.91Å; R229-P233 WeakPolarHBondContact O-CG 3.5Å
230	T	45.2	Very low	39.2	Very low	77 Å²	77	110.4 Å²	110.4	47%	0.472	54%	0.538	S	S	.	.	I	π-helix	trans	-109.8	-36.1	-170.1	-47.5	0	0	0	0	113.3	L226 N234	L226-T230 WeakPolarHBondContact O-CB 3.16Å; L226-T230 PolarHBondContact O-N 3.42Å; L226-T230 PolarHBondContact O-OG1 3.49Å; T230-N234 PolarHBondContact O-ND2 3.42Å
231	F	36.4	Very low	39.3	Very low	130 Å²	130	110.1 Å²	110.1	57%	0.57	54%	0.537	S	S	*	.	I	π-helix	trans	-93.3	-48.2	179.1	-109.5	-93.6	0	0	0	112.2	F227 N234 L235	F227-F231 HydrophobicContact CD1-CB 4.5Å; F227-F231 HydrophobicContact CD2-CB 4.45Å; F227-F231 HydrophobicContact CE2-CB 4.49Å; F227-F231 HydrophobicContact CE2-CG 4.46Å; F227-F231 HydrophobicContact CG-CB 4.46Å; F227-F231 WeakPolarHBondContact O-CB 3.43Å; F227-F231 PolarHBondContact O-N 2.84Å; F227-F231 VanDerWaalsContact O-N 3.1Å; F231-N234 PolarHBondContact O-N 2.94Å; F231-L235 WeakPolarHBondContact O-CB 3.47Å; F231-L235 PolarHBondContact O-N 3.32Å
232	R	40.5	Very low	39.3	Very low	146 Å²	146	109.4 Å²	109.4	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-60.9	-37.3	-173.8	-149.5	179.4	-163.2	-163.8	5.2	115.9	F227 N228 R236	F227-R232 PolarHBondContact O-N 3.1Å; N228-R232 WeakPolarHBondContact O-CB 3.39Å; N228-R232 WeakPolarHBondContact OD1-CD 3.33Å; R232-R236 WeakPolarHBondContact O-CB 3.37Å; R232-R236 PolarHBondContact O-N 3Å
233	P	41.9	Very low	39.3	Very low	58 Å²	58	112.6 Å²	112.6	38%	0.377	54%	0.535	S	S	.	.	H	α-helix	trans	-74.6	-36	176.4	27.8	-33.6	0	0	0	112.6	N228 R229 R236 R237	N228-P233 WeakPolarHBondContact O-CD 3.26Å; R229-P233 WeakPolarHBondContact O-CG 3.5Å; P233-R236 PolarHBondContact O-N 3.21Å; P233-R237 WeakPolarHBondContact O-CB 3.14Å; P233-R237 PolarHBondContact O-N 3.17Å
234	N	41.2	Very low	39.3	Very low	96 Å²	96	113.6 Å²	113.6	51%	0.513	54%	0.541	S	S	.	.	H	α-helix	trans	-69.1	-37.5	175.3	-70.2	-44.3	0	0	0	111.3	T230 F231 R237 A238	T230-N234 PolarHBondContact O-ND2 3.42Å; F231-N234 PolarHBondContact O-N 2.94Å; N234-R237 PolarHBondContact O-N 3.32Å; N234-A238 WeakPolarHBondContact O-CB 3.33Å; N234-A238 PolarHBondContact O-N 2.97Å
235	L	40.1	Very low	39.5	Very low	98 Å²	98	108.5 Å²	108.5	51%	0.513	53%	0.531	S	S	.	.	H	α-helix	trans	-69.6	-37.8	172.2	-168.9	67	0	0	0	112.1	F231 I239	F231-L235 WeakPolarHBondContact O-CB 3.47Å; F231-L235 PolarHBondContact O-N 3.32Å; L235-I239 HydrophobicContact CD1-CD1 4.26Å; L235-I239 HydrophobicContact CG-CD1 3.91Å; L235-I239 VanDerWaalsContact O-CB 3.28Å; L235-I239 WeakPolarHBondContact O-CB 3.43Å; L235-I239 WeakPolarHBondContact O-CD1 3.44Å; L235-I239 WeakPolarHBondContact O-CG1 3.28Å; L235-I239 PolarHBondContact O-N 2.82Å
236	R	41	Very low	38.9	Very low	186 Å²	186	115.4 Å²	115.4	70%	0.702	55%	0.55	S	S	*	*	H	α-helix	trans	-64.3	-41.5	171.7	-95.8	-167.4	173	-172	-1.9	112.1	R232 P233 I239 S240	R232-R236 WeakPolarHBondContact O-CB 3.37Å; R232-R236 PolarHBondContact O-N 3Å; P233-R236 PolarHBondContact O-N 3.21Å; R236-I239 CarbonylContact O-C 3.56Å; R236-I239 PolarHBondContact O-N 3.05Å; R236-S240 PolarHBondContact O-N 3.11Å; R236-S240 PolarHBondContact O-OG 2.95Å
237	R	41.2	Very low	38.7	Very low	157 Å²	157	116.4 Å²	116.4	59%	0.592	56%	0.556	S	S	*	*	H	α-helix	trans	-64.9	-47.1	176.9	176.4	170.5	-85.5	148	-9.2	111.2	P233 N234 I239 S240 E241	P233-R237 WeakPolarHBondContact O-CB 3.14Å; P233-R237 PolarHBondContact O-N 3.17Å; N234-R237 PolarHBondContact O-N 3.32Å; R237-I239 PolarHBondContact O-N 2.87Å; R237-S240 PolarHBondContact O-N 3.04Å; R237-S240 PolarHBondContact O-OG 3.39Å; R237-E241 WeakPolarHBondContact CD-OE1 3.32Å; R237-E241 VanDerWaalsContact CG-CD 3.48Å; R237-E241 HydrophobicContact CG-CG 4.34Å; R237-E241 WeakPolarHBondContact CG-OE1 3.44Å; R237-E241 VanDerWaalsContact O-CB 3.3Å; R237-E241 WeakPolarHBondContact O-CB 3.42Å; R237-E241 VanDerWaalsContact O-CG 3.25Å; R237-E241 WeakPolarHBondContact O-CG 3.03Å; R237-E241 PolarHBondContact O-N 3.49Å
238	A	42.1	Very low	38.4	Very low	48 Å²	48	115.2 Å²	115.2	40%	0.397	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-15.9	173.1	0	0	0	0	0	114.3	N234 V242	N234-A238 WeakPolarHBondContact O-CB 3.33Å; N234-A238 PolarHBondContact O-N 2.97Å; A238-V242 WeakPolarHBondContact O-CG2 3.47Å
239	I	41.3	Very low	37.6	Very low	91 Å²	91	117.3 Å²	117.3	47%	0.467	57%	0.573	S	S	.	*	H	α-helix	trans	-94.8	-29.4	173.4	-72.2	170.7	0	0	0	111.7	L235 R236 R237 V242 K243	L235-I239 HydrophobicContact CD1-CD1 4.26Å; L235-I239 HydrophobicContact CG-CD1 3.91Å; L235-I239 VanDerWaalsContact O-CB 3.28Å; L235-I239 WeakPolarHBondContact O-CB 3.43Å; L235-I239 WeakPolarHBondContact O-CD1 3.44Å; L235-I239 WeakPolarHBondContact O-CG1 3.28Å; L235-I239 PolarHBondContact O-N 2.82Å; R236-I239 CarbonylContact O-C 3.56Å; R236-I239 PolarHBondContact O-N 3.05Å; R237-I239 PolarHBondContact O-N 2.87Å; I239-V242 PolarHBondContact O-N 3.31Å; I239-K243 WeakPolarHBondContact O-CB 3.43Å; I239-K243 PolarHBondContact O-N 3.29Å
240	S	36.7	Very low	36.9	Very low	47 Å²	47	114.1 Å²	114.1	33%	0.329	57%	0.572	S	S	.	*	H	α-helix	trans	-72	-46.5	170.1	61.8	0	0	0	0	110.4	R236 R237 V242 K243 D244	R236-S240 PolarHBondContact O-N 3.11Å; R236-S240 PolarHBondContact O-OG 2.95Å; R237-S240 PolarHBondContact O-N 3.04Å; R237-S240 PolarHBondContact O-OG 3.39Å; S240-V242 PolarHBondContact O-N 3.2Å; S240-K243 CarbonylContact O-C 3.56Å; S240-K243 PolarHBondContact O-N 3.39Å; S240-D244 WeakPolarHBondContact O-CB 3.49Å; S240-D244 PolarHBondContact O-N 2.74Å; S240-D244 VanDerWaalsContact O-OD2 3.06Å
241	E	39.9	Very low	36.2	Very low	117 Å²	117	117.6 Å²	117.6	55%	0.547	59%	0.593	S	S	.	*	H	α-helix	trans	-58.8	-13.3	173.2	-68.9	163.1	-179.9	0	0	113.4	R237	R237-E241 WeakPolarHBondContact CD-OE1 3.32Å; R237-E241 VanDerWaalsContact CG-CD 3.48Å; R237-E241 HydrophobicContact CG-CG 4.34Å; R237-E241 WeakPolarHBondContact CG-OE1 3.44Å; R237-E241 VanDerWaalsContact O-CB 3.3Å; R237-E241 WeakPolarHBondContact O-CB 3.42Å; R237-E241 VanDerWaalsContact O-CG 3.25Å; R237-E241 WeakPolarHBondContact O-CG 3.03Å; R237-E241 PolarHBondContact O-N 3.49Å
242	V	37	Very low	35.8	Very low	105 Å²	105	121.2 Å²	121.2	64%	0.636	61%	0.612	S	S	*	*	H	α-helix	trans	-105.7	-19.3	172.7	170.5	0	0	0	0	113.1	A238 I239 S240	A238-V242 WeakPolarHBondContact O-CG2 3.47Å; I239-V242 PolarHBondContact O-N 3.31Å; S240-V242 PolarHBondContact O-N 3.2Å
243	K	33.9	Very low	35.2	Very low	153 Å²	153	117.6 Å²	117.6	67%	0.665	62%	0.62	S	S	*	*	H	α-helix	trans	-88.3	-34.6	173.3	-93.6	-161.8	165	-158.1	0	113.3	I239 S240 V245 Y246	I239-K243 WeakPolarHBondContact O-CB 3.43Å; I239-K243 PolarHBondContact O-N 3.29Å; S240-K243 CarbonylContact O-C 3.56Å; S240-K243 PolarHBondContact O-N 3.39Å; K243-V245 PolarHBondContact O-N 3.11Å; K243-V245 VanDerWaalsContact O-N 3.14Å; K243-Y246 CarbonylContact O-C 3.55Å; K243-Y246 PolarHBondContact O-N 3.16Å
244	D	35.6	Very low	34.5	Very low	128 Å²	128	120.1 Å²	120.1	68%	0.684	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-9.9	-178.9	-57.1	-27.3	0	0	0	111.7	S240	S240-D244 WeakPolarHBondContact O-CB 3.49Å; S240-D244 PolarHBondContact O-N 2.74Å; S240-D244 VanDerWaalsContact O-OD2 3.06Å
245	V	37.3	Very low	33.8	Very low	82 Å²	82	124.1 Å²	124.1	50%	0.497	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-3	171.9	-178.1	0	0	0	0	112.2	K243 E328	K243-V245 PolarHBondContact O-N 3.11Å; K243-V245 VanDerWaalsContact O-N 3.14Å; V245-E328 HydrophobicContact CG1-CG 4.46Å
246	Y	25.4	Very low	33.2	Very low	171 Å²	171	124.8 Å²	124.8	67%	0.671	67%	0.668	S	S	*	*			trans	-140.1	69.8	-172.4	-125	-87	0	0	0	113.4	K243	K243-Y246 CarbonylContact O-C 3.55Å; K243-Y246 PolarHBondContact O-N 3.16Å
247	N	32.3	Very low	32.6	Very low	132 Å²	132	124.1 Å²	124.1	71%	0.706	67%	0.673	S	S	*	*			trans	-109.7	104.5	169.5	-168.5	32.3	0	0	0	110.2	D249	N247-D249 VanDerWaalsContact C-N 3.31Å; N247-D249 PolarHBondContact O-N 2.87Å; N247-D249 VanDerWaalsContact O-N 3.16Å
248	P	30.1	Very low	32.2	Very low	108 Å²	108	128.5 Å²	128.5	70%	0.701	69%	0.69	S	S	*	*			trans	-89.7	34.9	-163.3	37.8	-38.7	0	0	0	114.8
249	D	28.7	Very low	31.4	Very low	118 Å²	118	132.9 Å²	132.9	63%	0.631	71%	0.706	S	S	*	*			trans	-132.1	144	-176.8	-81.3	-63	0	0	0	112.7	N247	N247-D249 VanDerWaalsContact C-N 3.31Å; N247-D249 PolarHBondContact O-N 2.87Å; N247-D249 VanDerWaalsContact O-N 3.16Å
250	N	27.6	Very low	30.7	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	72%	0.719	S	S	*	*			trans	79.3	81.2	178.4	-46.9	-79.3	0	0	0	117.7
251	T	30.7	Very low	30.3	Very low	150 Å²	150	139.5 Å²	139.5	92%	0.92	74%	0.741	S	S	*	*			trans	-158.1	44.3	144.7	-3.4	0	0	0	0	115.1	G253	T251-G253 PolarHBondContact O-N 2.83Å
252	E	26.5	Very low	29.8	Very low	206 Å²	206	142.5 Å²	142.5	96%	0.963	76%	0.755	S	S	*	*			trans	-78.7	114.1	160	-72.2	-160.5	144.5	0	0	110
253	G	28.1	Very low	29.3	Very low	70 Å²	70	145.8 Å²	145.8	72%	0.722	76%	0.764	S	S	*	*			trans	163.3	142.1	169.2	0	0	0	0	0	117.2	T251	T251-G253 PolarHBondContact O-N 2.83Å
254	S	28	Very low	29	Very low	112 Å²	112	145.9 Å²	145.9	78%	0.783	77%	0.767	S	S	*	*			trans	59	61.6	156.5	-169.9	0	0	0	0	118.3
255	L	25.7	Very low	28.8	Very low	180 Å²	180	147.4 Å²	147.4	94%	0.942	77%	0.77	S	S	*	*			trans	-104.9	74.3	158.2	-138.2	174.1	0	0	0	110.1
256	T	28.2	Very low	28.3	Very low	111 Å²	111	149.9 Å²	149.9	68%	0.681	78%	0.78	S	S	*	*			trans	-135.6	145.4	-178.6	41.1	0	0	0	0	111.5
257	E	28.3	Very low	28.6	Very low	172 Å²	172	149.8 Å²	149.8	80%	0.804	79%	0.785	S	S	*	*			trans	62.4	94.7	173.2	-55.5	-164.1	158	0	0	118.3
258	R	31.8	Very low	28.4	Very low	250 Å²	250	148.4 Å²	148.4	94%	0.943	79%	0.786	S	S	*	*				-152.9	145.8	102.9	-106	161.9	-166.4	175.1	5.8	112.3
259	N	26.6	Very low	28.3	Very low	140 Å²	140	152.5 Å²	152.5	75%	0.749	80%	0.795	S	S	*	*			trans	-92.1	163.5	-160.2	-74.2	-53.9	0	0	0	114.3
260	S	26.1	Very low	28.1	Very low	104 Å²	104	158 Å²	158	73%	0.727	81%	0.807	S	S	*	*			trans	61.1	123.1	151	61.2	0	0	0	0	117
261	Q	28.5	Very low	28.1	Very low	172 Å²	172	156.2 Å²	156.2	80%	0.804	81%	0.807	S	S	*	*				-153.5	174.4	59.5	-80	177.5	3.6	0	0	113.8
262	Q	30.2	Very low	28.1	Very low	180 Å²	180	156.7 Å²	156.7	84%	0.841	80%	0.798	S	S	*	*			trans	64.9	85.2	164	-71	175.8	1.6	0	0	118
263	Q	24.8	Very low	28.2	Very low	175 Å²	175	154.9 Å²	154.9	82%	0.818	80%	0.795	S	S	*	*			trans	-38.7	144.1	146.3	-52.4	152.1	-38.3	0	0	112.6
264	Q	28	Very low	28.3	Very low	155 Å²	155	159.8 Å²	159.8	72%	0.724	80%	0.797	S	S	*	*				178.7	141.3	100.9	-95.2	178.5	17.3	0	0	113.7
265	Q	31.2	Very low	28.4	Very low	159 Å²	159	161.9 Å²	161.9	74%	0.743	80%	0.799	S	S	*	*			trans	64.8	115.5	160	-58.8	168.1	30	0	0	116.6
266	N	26.8	Very low	28.7	Very low	135 Å²	135	161.5 Å²	161.5	72%	0.722	79%	0.792	S	S	*	*				68.5	133.5	65.5	-67.2	-16.6	0	0	0	112.8
267	H	31.6	Very low	28.9	Very low	168 Å²	168	166.6 Å²	166.6	78%	0.778	80%	0.798	S	S	*	*			cis	-155.7	-177.4	25.2	-117.6	-32.6	0	0	0	115.5
268	S	29.7	Very low	29.1	Very low	103 Å²	103	165.5 Å²	165.5	72%	0.72	79%	0.793	S	S	*	*			trans	65.1	71.2	154.5	58.4	0	0	0	0	121.8
269	H	26.7	Very low	29	Very low	194 Å²	194	161.4 Å²	161.4	90%	0.898	79%	0.789	S	S	*	*				22.2	145.3	106.6	-99.8	-67.8	0	0	0	121.6
270	R	24.3	Very low	29.4	Very low	234 Å²	234	162.7 Å²	162.7	88%	0.883	79%	0.79	S	S	*	*			trans	100.7	84.9	136.2	-155.5	-178.1	-152.3	170.6	5.5	119.1
271	S	28	Very low	29.6	Very low	111 Å²	111	165 Å²	165	78%	0.776	79%	0.79	S	S	*	*			trans	-155.2	127	145.2	-88.2	0	0	0	0	112.5
272	Q	30.7	Very low	29.7	Very low	159 Å²	159	165.3 Å²	165.3	74%	0.743	79%	0.791	S	S	*	*			trans	42.4	111.9	157.6	-48.2	-175.3	29.7	0	0	118.4	K274	Q272-K274 HydrophobicContact CB-CB 4.38Å
273	N	28	Very low	29.7	Very low	169 Å²	169	164.4 Å²	164.4	90%	0.904	79%	0.791	S	S	*	*			cis	54.7	49.5	11.2	-93.8	-7.7	0	0	0	115.5
274	K	30.2	Very low	29.8	Very low	172 Å²	172	163 Å²	163	75%	0.748	78%	0.784	S	S	*	*			trans	-148.7	-6.2	164	-131.4	178.2	-178.2	-175.8	0	118.5	Q272	Q272-K274 HydrophobicContact CB-CB 4.38Å
275	L	30.1	Very low	29.8	Very low	157 Å²	157	163 Å²	163	82%	0.822	79%	0.789	S	S	*	*	S	Bend	trans	-113.5	-0.6	-175.8	-147.6	70	0	0	0	115.7
276	H	33.3	Very low	29.9	Very low	172 Å²	172	163.2 Å²	163.2	80%	0.796	79%	0.794	S	S	*	*	S	Bend	trans	-101.6	25.9	-179.5	-156	80.5	0	0	0	113.3
277	R	32.3	Very low	29.8	Very low	217 Å²	217	164.8 Å²	164.8	82%	0.819	79%	0.794	S	S	*	*	S	Bend	trans	-142.4	24.2	178.1	-62.3	-168.8	-172.1	-175	2.8	113.7
278	H	31.9	Very low	29.5	Very low	150 Å²	150	164.2 Å²	164.2	69%	0.694	80%	0.796	S	S	*	*	S	Bend	trans	-133.5	-4.7	-177.2	-140	55.2	0	0	0	115.2
279	L	31.3	Very low	29.5	Very low	163 Å²	163	166.7 Å²	166.7	85%	0.853	80%	0.8	S	S	*	*	S	Bend	trans	-115.9	12.3	172.6	-84.2	163.5	0	0	0	113.4
280	Q	34	Very low	29.7	Very low	167 Å²	167	162.3 Å²	162.3	78%	0.78	79%	0.791	S	S	*	*	S	Bend	trans	-103.5	10	169.6	-115.5	179.4	-3.2	0	0	112.8
281	Q	31.1	Very low	30.1	Very low	154 Å²	154	160 Å²	160	72%	0.72	79%	0.79	S	S	*	*	S	Bend	trans	-133.9	40.2	-179	-72.1	-173.2	-50.1	0	0	112.7
282	Q	30.5	Very low	30.5	Very low	178 Å²	178	159.9 Å²	159.9	83%	0.832	79%	0.786	S	S	*	*			trans	-125.5	29.7	160.2	-76.2	-62.6	-47.1	0	0	111
283	L	29.2	Very low	30.5	Very low	161 Å²	161	156.7 Å²	156.7	84%	0.843	79%	0.787	S	S	*	*			trans	-88.3	151.2	166.5	-141.1	118.5	0	0	0	108.9
284	H	26.9	Very low	30.7	Very low	145 Å²	145	153.5 Å²	153.5	67%	0.671	78%	0.778	S	S	*	*			trans	75.1	80.4	170.4	-162	-64.1	0	0	0	117.5
285	N	28.8	Very low	30.6	Very low	155 Å²	155	156.1 Å²	156.1	83%	0.829	78%	0.783	S	S	*	*			trans	-147.8	152	144.5	-120.8	-22.4	0	0	0	112.6
286	I	32	Very low	30.4	Very low	163 Å²	163	153.2 Å²	153.2	84%	0.836	78%	0.776	S	S	*	*			trans	62.8	91.6	179.4	-47.8	-177.4	0	0	0	116
287	K	24.8	Very low	30.3	Very low	168 Å²	168	152.2 Å²	152.2	73%	0.73	77%	0.772	S	S	*	*			trans	-83.1	153.3	149.7	-57.5	167.6	178.9	172.9	0	108.7
288	L	25.7	Very low	30.1	Very low	156 Å²	156	148.7 Å²	148.7	82%	0.817	76%	0.764	S	S	*	*			trans	172.3	141.1	131.8	-96.6	156.3	0	0	0	112.8
289	I	30.2	Very low	29.8	Very low	155 Å²	155	148.4 Å²	148.4	80%	0.795	76%	0.763	S	S	*	*			trans	66.2	124.8	160.5	-55.3	155.2	0	0	0	116.3
290	S	30.9	Very low	29.5	Very low	103 Å²	103	145.2 Å²	145.2	72%	0.72	75%	0.754	S	S	*	*			cis	-161.3	127.1	-13.2	49.7	0	0	0	0	113.6
291	H	32.2	Very low	29.2	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.856	75%	0.753	S	S	*	*			trans	-2	170.4	140.8	-87	-33.1	0	0	0	123.5
292	P	35.5	Very low	29	Very low	108 Å²	108	141.8 Å²	141.8	70%	0.701	76%	0.758	S	S	*	*			cis	-144.8	-176.4	-11.7	35.3	-13.4	0	0	0	118.2
293	A	32.3	Very low	28.8	Very low	92 Å²	92	140.5 Å²	140.5	76%	0.76	75%	0.752	S	S	*	*			trans	80.5	144.1	143.8	0	0	0	0	0	121.4
294	S	31	Very low	28.8	Very low	102 Å²	102	140.1 Å²	140.1	71%	0.713	75%	0.75	S	S	*	*			cis	-166.5	135.9	-14.5	52.3	0	0	0	0	117.1
295	R	28.2	Very low	28.8	Very low	227 Å²	227	138.7 Å²	138.7	86%	0.857	75%	0.748	S	S	*	*			trans	67.7	115.3	135.5	-74	-174.6	171.9	-176.9	-2.1	124.6
296	S	27.3	Very low	28.7	Very low	96 Å²	96	139.9 Å²	139.9	67%	0.671	74%	0.741	S	S	*	*				69	157.2	127.7	69.9	0	0	0	0	120.4
297	H	31.1	Very low	28.5	Very low	152 Å²	152	139.3 Å²	139.3	70%	0.704	74%	0.735	S	S	*	*			cis	-152.3	159.9	26.4	-114.3	-85.8	0	0	0	112.9
298	Q	27.3	Very low	28.6	Very low	142 Å²	142	136.8 Å²	136.8	66%	0.664	73%	0.734	S	S	*	*			trans	26	153.8	139.2	-82.5	176.7	-57.6	0	0	123.5
299	Q	25.2	Very low	28.8	Very low	145 Å²	145	133 Å²	133	68%	0.678	73%	0.725	S	S	*	*			cis	-173.3	159.2	-15	-138.1	179.3	-30.4	0	0	111.6
300	S	25.6	Very low	28.7	Very low	95 Å²	95	131.3 Å²	131.3	66%	0.664	72%	0.722	S	S	*	*			trans	66.8	141.1	144.2	-60.6	0	0	0	0	124.5
301	A	27.4	Very low	28.5	Very low	92 Å²	92	132.7 Å²	132.7	76%	0.76	72%	0.721	S	S	*	*			trans	74.2	152.6	142.8	0	0	0	0	0	119.4
302	L	27	Very low	28.3	Very low	157 Å²	157	132.3 Å²	132.3	82%	0.822	72%	0.72	S	S	*	*			cis	-151.5	179.1	-0.9	-125.6	163.2	0	0	0	111.6
303	H	26.4	Very low	28.2	Very low	151 Å²	151	131.9 Å²	131.9	70%	0.699	72%	0.717	S	S	*	*			trans	-38.2	158.1	171.3	-84.6	-143.5	0	0	0	116.1
304	L	29	Very low	27.9	Very low	153 Å²	153	137.9 Å²	137.9	80%	0.801	72%	0.722	S	S	*	*				-160.9	155.6	62.3	-163.5	64.6	0	0	0	116.3
305	N	27.5	Very low	27.9	Very low	116 Å²	116	141.1 Å²	141.1	62%	0.62	73%	0.73	S	S	*	*			trans	-81.9	166.4	175.4	-63.3	-32	0	0	0	113.8
306	Y	27	Very low	27.9	Very low	179 Å²	179	139 Å²	139	70%	0.702	73%	0.73	S	S	*	*				151.5	118	123.5	-92.2	-86.1	0	0	0	109.7
307	H	27.8	Very low	28.2	Very low	151 Å²	151	139 Å²	139	70%	0.699	73%	0.728	S	S	*	*				65.3	148.6	103.5	-76.5	-135.6	0	0	0	114.9
308	T	26.9	Very low	27.9	Very low	116 Å²	116	141.2 Å²	141.2	71%	0.712	73%	0.731	S	S	*	*			cis	-154.6	159.8	14.8	-12.1	0	0	0	0	111.8
309	A	28.6	Very low	27.8	Very low	77 Å²	77	144.6 Å²	144.6	64%	0.636	74%	0.738	S	S	*	*				9	155.9	128.6	0	0	0	0	0	120.4
310	T	27.6	Very low	28	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	75%	0.745	S	S	*	*			cis	-169.4	169.4	18.4	-10.5	0	0	0	0	113.5
311	N	26.7	Very low	28.2	Very low	132 Å²	132	147.4 Å²	147.4	71%	0.706	75%	0.749	S	S	*	*			trans	81.7	112.5	139.7	-77.4	-21.1	0	0	0	123.6
312	Q	29.6	Very low	28.2	Very low	178 Å²	178	151.6 Å²	151.6	83%	0.832	75%	0.753	S	S	*	*				100.6	149.4	123.6	-76.1	-167.4	-9.8	0	0	121
313	P	33.7	Very low	28.4	Very low	99 Å²	99	150.1 Å²	150.1	64%	0.643	74%	0.74	S	S	*	*			trans	-117.9	175.9	-156.4	43.5	-32.4	0	0	0	114.1
314	Y	25.4	Very low	28.8	Very low	218 Å²	218	147.6 Å²	147.6	86%	0.855	74%	0.735	S	S	*	*			trans	-171.6	156.6	130.2	-105.6	-67.6	0	0	0	112.4
315	L	29.8	Very low	28.8	Very low	169 Å²	169	145.3 Å²	145.3	89%	0.885	72%	0.724	S	S	*	*			trans	75.5	149.4	164.9	-65.6	157.3	0	0	0	119.4
316	Q	29.7	Very low	29.1	Very low	182 Å²	182	143.3 Å²	143.3	85%	0.85	72%	0.716	S	S	*	*			trans	-117.5	-170.2	-174.4	-42.4	175.2	-40.5	0	0	109.5
317	P	32.6	Very low	29.4	Very low	98 Å²	98	140 Å²	140	64%	0.636	71%	0.705	S	S	*	*			cis	-136.7	-172.1	-8.7	22.4	4.6	0	0	0	115.5
318	Y	25.8	Very low	29.7	Very low	197 Å²	197	137.9 Å²	137.9	77%	0.773	70%	0.696	S	S	*	*			trans	90.4	116.2	156.8	-81.7	-76.5	0	0	0	122.5
319	R	25	Very low	29.8	Very low	213 Å²	213	139.7 Å²	139.7	80%	0.804	70%	0.696	S	S	*	*			trans	42	109.8	142.1	-77.4	177.7	179.2	172.2	-1.5	119.7
320	I	29.3	Very low	30.2	Very low	160 Å²	160	137.5 Å²	137.5	82%	0.821	68%	0.675	S	S	*	*				175.8	115.2	115.1	-85.8	149.3	0	0	0	105.3
321	N	28.8	Very low	30.4	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	68%	0.675	S	S	*	*			trans	173	-6.5	160.4	-94.5	-12.7	0	0	0	116.8	F323	N321-F323 PolarHBondContact O-N 2.92Å; N321-F323 VanDerWaalsContact O-N 3.09Å
322	E	28.3	Very low	30.6	Very low	181 Å²	181	140.7 Å²	140.7	85%	0.846	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-0.9	-172.8	-72.3	179.1	119.4	0	0	116.6	T326	E322-T326 PolarHBondContact O-OG1 2.87Å
323	F	31	Very low	30.6	Very low	126 Å²	126	136.7 Å²	136.7	55%	0.553	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-8.1	-171.2	-117	-87	0	0	0	116.1	N321 Q800	N321-F323 PolarHBondContact O-N 2.92Å; N321-F323 VanDerWaalsContact O-N 3.09Å; F323-Q800 HydrophobicContact CZ-CB 4.45Å
324	T	34.2	Very low	30.4	Very low	97 Å²	97	138.1 Å²	138.1	60%	0.595	67%	0.672	S	S	*	*	S	Bend	trans	-90.4	-46.5	175.5	35.7	0	0	0	0	112.5	T326 F327	T324-T326 PolarHBondContact O-N 2.93Å; T324-F327 PolarHBondContact O-N 3.4Å
325	N	29.6	Very low	30.7	Very low	105 Å²	105	135.4 Å²	135.4	56%	0.561	67%	0.667	S	S	*	*	H	α-helix	trans	-77.1	-8.2	-166.7	-60.3	23.8	0	0	0	113.9
326	T	33.6	Very low	30.5	Very low	74 Å²	74	137.2 Å²	137.2	45%	0.454	67%	0.667	S	S	.	*	H	α-helix	trans	-84.3	-11.1	174.6	38.4	0	0	0	0	113.9	E322 T324	E322-T326 PolarHBondContact O-OG1 2.87Å; T324-T326 PolarHBondContact O-N 2.93Å
327	F	32.7	Very low	30.4	Very low	111 Å²	111	137.4 Å²	137.4	49%	0.487	67%	0.666	S	S	.	*	H	α-helix	trans	-83	-33.1	174.5	-105.8	-95.1	0	0	0	113.2	T324 W804	T324-F327 PolarHBondContact O-N 3.4Å; F327-W804 HydrophobicContact CE2-CZ2 4.32Å; F327-W804 HydrophobicContact CZ-CH2 4.29Å; F327-W804 HydrophobicContact CZ-CZ2 4.41Å
328	E	33.8	Very low	30.2	Very low	106 Å²	106	139.9 Å²	139.9	50%	0.495	67%	0.674	S	S	.	*	H	α-helix	trans	-69.4	-37.8	178.7	-65.2	-177.1	124.9	0	0	112.8	V245 V330 Y331	V245-E328 HydrophobicContact CG1-CG 4.46Å; E328-V330 PolarHBondContact O-N 2.9Å; E328-Y331 PolarHBondContact O-N 3.45Å
329	Q	29.9	Very low	30.2	Very low	153 Å²	153	136.5 Å²	136.5	72%	0.715	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	8.1	-177	-66.2	-168.6	-5.9	0	0	115
330	V	36.6	Very low	30.3	Very low	31 Å²	31	130.7 Å²	130.7	19%	0.188	67%	0.671	C	S	.	*	T	Hydrogen-bonded Turn	trans	-104.6	-28.8	179	-169.2	0	0	0	0	112.5	E328 R820	E328-V330 PolarHBondContact O-N 2.9Å; V330-R820 HydrophobicContact CG1-CG 3.87Å
331	Y	31.9	Very low	30.2	Very low	186 Å²	186	128.2 Å²	128.2	73%	0.729	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-17.3	-175.5	-88	-85.5	0	0	0	114.7	E328 T333	E328-Y331 PolarHBondContact O-N 3.45Å; Y331-T333 PolarHBondContact O-N 3.35Å
332	N	30.4	Very low	30.2	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	65%	0.653	S	S	*	*			trans	-83	39.5	-175.6	-70.3	-25.8	0	0	0	114.6
333	T	31	Very low	30	Very low	94 Å²	94	128 Å²	128	58%	0.577	66%	0.656	S	S	*	*			trans	-117	98.4	176.3	-40.6	0	0	0	0	110.9	Y331 Q335	Y331-T333 PolarHBondContact O-N 3.35Å; T333-Q335 PolarHBondContact O-N 3.34Å
334	P	28	Very low	30	Very low	128 Å²	128	126.9 Å²	126.9	83%	0.831	66%	0.655	S	S	*	*			trans	-79.3	85.1	-172.2	31.3	-35.6	0	0	0	112.5
335	Q	32.2	Very low	29.8	Very low	162 Å²	162	127.8 Å²	127.8	76%	0.757	66%	0.662	S	S	*	*			trans	-80.8	119.5	166.3	-74.1	-163.3	-18.1	0	0	110.9	T333 F337	T333-Q335 PolarHBondContact O-N 3.34Å; Q335-F337 PolarHBondContact O-N 2.89Å
336	K	25.4	Very low	29.7	Very low	206 Å²	206	129.3 Å²	129.3	90%	0.896	68%	0.675	S	S	*	*			trans	-59.3	124.6	170.5	-71.6	179.8	173.8	-178.3	0	110.5
337	F	28.8	Very low	29.4	Very low	186 Å²	186	132.6 Å²	132.6	82%	0.816	69%	0.69	S	S	*	*			trans	-132.4	146.3	156	-95.6	-86	0	0	0	108.8	Q335	Q335-F337 PolarHBondContact O-N 2.89Å
338	D	27.3	Very low	29	Very low	151 Å²	151	134.2 Å²	134.2	81%	0.807	70%	0.701	S	S	*	*			trans	-65.3	140.1	-164.3	-78.7	-60.8	0	0	0	114.5	S340	D338-S340 VanDerWaalsContact C-N 3.32Å; D338-S340 PolarHBondContact O-N 3.41Å
339	S	26.6	Very low	28.7	Very low	126 Å²	126	139 Å²	139	88%	0.881	72%	0.716	S	S	*	*	S	Bend	trans	-73.8	77.5	-178.2	57.2	0	0	0	0	112.2
340	S	27	Very low	28.5	Very low	90 Å²	90	139.1 Å²	139.1	63%	0.629	72%	0.721	S	S	*	*			trans	-153.5	157.2	163.6	62.8	0	0	0	0	111	D338	D338-S340 VanDerWaalsContact C-N 3.32Å; D338-S340 PolarHBondContact O-N 3.41Å
341	I	27.5	Very low	28	Very low	108 Å²	108	146.7 Å²	146.7	55%	0.554	76%	0.755	S	S	*	*	S	Bend	trans	74.5	52.5	174.4	-38.1	164.7	0	0	0	116.1
342	L	27.8	Very low	27.8	Very low	120 Å²	120	142.6 Å²	142.6	63%	0.628	75%	0.753	S	S	*	*			trans	-164.8	45.7	147.2	-113.5	152.5	0	0	0	117.2	I344	L342-I344 HydrophobicContact CD2-CD1 3.62Å; L342-I344 HydrophobicContact CD2-CG1 3.97Å; L342-I344 PolarHBondContact O-N 3.2Å
343	E	25.3	Very low	27.5	Very low	196 Å²	196	145 Å²	145	92%	0.916	76%	0.762	S	S	*	*			trans	-70.6	117	156.3	-72.1	179.8	157.4	0	0	109.4
344	I	30.9	Very low	27.4	Very low	102 Å²	102	145.2 Å²	145.2	52%	0.523	77%	0.767	S	S	.	*			trans	-123.5	120.8	159.9	-67.5	172.5	0	0	0	104.5	L342 V346	L342-I344 HydrophobicContact CD2-CD1 3.62Å; L342-I344 HydrophobicContact CD2-CG1 3.97Å; L342-I344 PolarHBondContact O-N 3.2Å; I344-V346 PolarHBondContact O-N 2.97Å
345	P	30	Very low	27.3	Very low	116 Å²	116	145.6 Å²	145.6	75%	0.753	76%	0.763	S	S	*	*			trans	-65.2	135.1	-177.6	26.5	-33.8	0	0	0	110.6
346	V	27.4	Very low	26.9	Very low	138 Å²	138	145.6 Å²	145.6	84%	0.836	77%	0.768	S	S	*	*			trans	-115.2	82.8	172.5	-179.3	0	0	0	0	106.6	I344	I344-V346 PolarHBondContact O-N 2.97Å
347	D	26.2	Very low	27	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	75%	0.754	S	S	*	*			trans	-142	146.7	179.9	-85.2	-59.4	0	0	0	110.1
348	M	26.3	Very low	27	Very low	146 Å²	146	138.4 Å²	138.4	72%	0.719	75%	0.751	S	S	*	*			trans	61.4	121.7	-179	-57.8	166	55.8	0	0	114.2
349	Y	26.7	Very low	26.9	Very low	205 Å²	205	133.5 Å²	133.5	80%	0.804	73%	0.728	S	S	*	*			cis	-139.8	127.6	27.7	-78.4	-96.8	0	0	0	112.5
350	D	24.4	Very low	26.7	Very low	157 Å²	157	133 Å²	133	84%	0.84	71%	0.707	S	S	*	*			trans	-85.1	138.7	137.9	-87.4	-49.4	0	0	0	108
351	E	27.4	Very low	26.6	Very low	190 Å²	190	134 Å²	134	89%	0.888	70%	0.699	S	S	*	*				-167.7	162.9	112.7	-112.9	-177.1	169.9	0	0	111.5
352	S	27.2	Very low	26.6	Very low	99 Å²	99	133 Å²	133	69%	0.692	70%	0.695	S	S	*	*			trans	-82	141.5	-172.7	48.7	0	0	0	0	113.4	S354	S352-S354 PolarHBondContact O-N 2.97Å
353	M	25	Very low	26.5	Very low	183 Å²	183	139.3 Å²	139.3	90%	0.901	71%	0.711	S	S	*	*			trans	-78.7	116.4	165.6	-161.3	177.6	89.7	0	0	109.1
354	S	27.5	Very low	26.6	Very low	98 Å²	98	135.5 Å²	135.5	69%	0.685	70%	0.703	S	S	*	*			trans	-144.4	143.9	169	56	0	0	0	0	109.4	S352	S352-S354 PolarHBondContact O-N 2.97Å
355	D	25.8	Very low	26.2	Very low	136 Å²	136	136 Å²	136	73%	0.727	72%	0.716	S	S	*	*			trans	-84.1	174.9	-160.4	-51.1	-89.5	0	0	0	115.3
356	D	25	Very low	26	Very low	163 Å²	163	136.8 Å²	136.8	87%	0.872	72%	0.723	S	S	*	*			trans	77.6	146.1	159.8	-65	-32.5	0	0	0	121.7
357	A	27.5	Very low	25.9	Very low	74 Å²	74	137.7 Å²	137.7	61%	0.612	72%	0.723	S	S	*	*			trans	86	109.5	147.4	0	0	0	0	0	121.9
358	F	27.6	Very low	25.8	Very low	167 Å²	167	140.5 Å²	140.5	73%	0.732	73%	0.729	S	S	*	*			trans	75	155	135.9	-82.6	-114.6	0	0	0	118	V1272	F358-V1272 HydrophobicContact CB-CG2 4.28Å; F358-V1272 HydrophobicContact CD1-CG2 3.93Å; F358-V1272 HydrophobicContact CD2-CB 4.48Å; F358-V1272 HydrophobicContact CD2-CG1 4.07Å; F358-V1272 HydrophobicContact CD2-CG2 3.81Å; F358-V1272 HydrophobicContact CE1-CG2 4.11Å; F358-V1272 HydrophobicContact CE2-CG1 4.49Å; F358-V1272 HydrophobicContact CE2-CG2 4Å; F358-V1272 HydrophobicContact CG-CG2 3.74Å; F358-V1272 HydrophobicContact CZ-CG2 4.13Å
359	S	25.1	Very low	25.7	Very low	47 Å²	47	138.6 Å²	138.6	33%	0.329	73%	0.73	S	S	.	*			cis	170.2	116.6	-19.2	-154.4	0	0	0	0	106.9	D1271 V1272	S359-D1271 WeakPolarHBondContact CA-OD2 3.49Å; S359-D1271 PolarHBondContact OG-O 3.36Å; S359-V1272 VanDerWaalsContact CB-CG2 3.46Å; S359-V1272 WeakPolarHBondContact OG-CG2 3.34Å
360	R	23.3	Very low	25.6	Very low	117 Å²	117	139.5 Å²	139.5	44%	0.442	73%	0.732	S	S	.	*			trans	98.5	70.6	144.6	-38.8	-120.6	135.1	-163	-10.8	119.5	I1269 S1270 D1271	R360-I1269 HydrophobicContact CB-CB 3.8Å; R360-I1269 HydrophobicContact CB-CG1 3.79Å; R360-I1269 HydrophobicContact CB-CG2 3.67Å; R360-I1269 HydrophobicContact CG-CB 4.29Å; R360-I1269 HydrophobicContact CG-CG2 3.67Å; R360-I1269 VanDerWaalsContact NH1-C 3.3Å; R360-I1269 PolarHBondContact NH1-O 3.06Å; R360-S1270 WeakPolarHBondContact CA-O 3.49Å; R360-S1270 WeakPolarHBondContact CB-O 3.32Å; R360-S1270 WeakPolarHBondContact CD-O 3.28Å; R360-S1270 WeakPolarHBondContact CG-O 3.21Å; R360-S1270 VanDerWaalsContact CZ-C 3.43Å; R360-S1270 VanDerWaalsContact CZ-N 3.34Å; R360-S1270 PolarHBondContact N-O 3.11Å; R360-S1270 PolarHBondContact NE-O 3.41Å; R360-S1270 VanDerWaalsContact NH1-N 3.13Å; R360-D1271 VanDerWaalsContact N-CG 3.26Å; R360-D1271 PolarHBondContact N-OD2 2.67Å; R360-D1271 PolarHBondContact NE-O 3.15Å; R360-D1271 PolarHBondContact NH2-O 3.25Å
361	K	25.9	Very low	25.9	Very low	109 Å²	109	138.6 Å²	138.6	47%	0.474	73%	0.726	S	S	.	*			trans	79.6	174.6	135.4	-133.9	-171.8	-103.4	-169.3	0	122	D1268 I1269 S1270	K361-D1268 HydrophobicContact CD-CB 3.6Å; K361-D1268 WeakPolarHBondContact CD-OD1 3.29Å; K361-D1268 IonicContact NZ-OD1 3.5Å; K361-D1268 PolarHBondContact NZ-OD1 2.98Å; K361-I1269 VanDerWaalsContact CE-N 3.3Å; K361-S1270 VanDerWaalsContact CB-OG 3.23Å; K361-S1270 WeakPolarHBondContact CB-OG 3.41Å; K361-S1270 WeakPolarHBondContact CE-OG 3.4Å; K361-S1270 WeakPolarHBondContact CG-OG 3.43Å
362	N	26.1	Very low	26	Very low	88 Å²	88	135.8 Å²	135.8	47%	0.471	72%	0.716	S	S	.	*			trans	92.3	106.9	157.2	-77	22.4	0	0	0	120.8	D1268	N362-D1268 WeakPolarHBondContact ND2-CB 3.5Å; N362-D1268 PolarHBondContact ND2-OD2 3.48Å; N362-D1268 WeakPolarHBondContact OD1-CB 3.17Å; N362-D1268 PolarHBondContact OD1-OD1 3.43Å; N362-D1268 PolarHBondContact OD1-OD2 2.99Å; N362-D1268 VanDerWaalsContact OD1-OD2 3.12Å
363	W	27.1	Very low	25.9	Very low	252 Å²	252	135.9 Å²	135.9	96%	0.955	72%	0.717	S	S	*	*			trans	-120.9	110	156.9	-89.3	60.2	0	0	0	109
364	P	25.6	Very low	26.1	Very low	116 Å²	116	135.3 Å²	135.3	75%	0.753	71%	0.712	S	S	*	*			trans	-79.5	160.9	170.5	33.4	-34	0	0	0	111.8
365	S	23.2	Very low	26.4	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	71%	0.714	S	S	*	*			trans	-72	137.9	171.6	-54.7	0	0	0	0	112.4
366	C	25.9	Very low	26.5	Very low	131 Å²	131	136 Å²	136	89%	0.885	71%	0.71	S	S	*	*			trans	-157.5	92.8	154.6	-92.8	0	0	0	0	105.5
367	D	24.5	Very low	26.8	Very low	158 Å²	158	135.4 Å²	135.4	85%	0.845	71%	0.705	S	S	*	*				90.1	143.2	56.8	-147.4	-6.6	0	0	0	112.9
368	F	23.9	Very low	26.9	Very low	200 Å²	200	139.2 Å²	139.2	88%	0.877	71%	0.71	S	S	*	*			trans	-98.4	114.6	-168.6	-123.2	-104.1	0	0	0	109.5
369	S	25.9	Very low	26.9	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	71%	0.707	S	S	*	*			trans	153.6	153.6	137.1	59.2	0	0	0	0	113.7
370	R	23.9	Very low	27.1	Very low	224 Å²	224	136.7 Å²	136.7	85%	0.845	72%	0.724	S	S	*	*			trans	51.7	118.2	148.3	-120.1	172.5	-179.6	153.7	-2	117
371	I	30.7	Very low	27.2	Very low	139 Å²	139	142.1 Å²	142.1	71%	0.713	74%	0.744	S	S	*	*				-165.7	139.8	73.9	-93.4	157.8	0	0	0	109.9
372	D	28.8	Very low	27.2	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	76%	0.755	S	S	*	*			trans	21.9	146.7	136.1	-37.2	-33.2	0	0	0	119.8
373	S	26.4	Very low	27.2	Very low	102 Å²	102	146.2 Å²	146.2	71%	0.713	77%	0.765	S	S	*	*			cis	-169	-175.2	-4.9	42.9	0	0	0	0	109.9
374	E	29.1	Very low	27.1	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	76%	0.757	S	S	*	*			trans	71.7	133.2	177	-51.7	-179.1	173.4	0	0	115.2
375	H	32.4	Very low	27.2	Very low	157 Å²	157	144.4 Å²	144.4	73%	0.727	76%	0.759	S	S	*	*			cis	-122.6	136	-13.5	-90.3	-88.7	0	0	0	108.2
376	S	28.8	Very low	27.3	Very low	90 Å²	90	144.7 Å²	144.7	63%	0.629	76%	0.757	S	S	*	*				57.7	127.2	87.3	127.3	0	0	0	0	114
377	I	30.7	Very low	27.4	Very low	151 Å²	151	144.9 Å²	144.9	77%	0.774	75%	0.754	S	S	*	*			cis	-164.2	153.1	6.4	-109.3	165.2	0	0	0	105.3
378	H	30.2	Very low	27.7	Very low	155 Å²	155	141.9 Å²	141.9	72%	0.718	75%	0.745	S	S	*	*			cis	-139.5	165.1	7.6	-144.1	-120.2	0	0	0	106.6
379	S	27.3	Very low	27.8	Very low	96 Å²	96	139 Å²	139	67%	0.671	74%	0.739	S	S	*	*			cis	78.1	143.3	28.2	-170.1	0	0	0	0	116.6
380	G	30.1	Very low	27.9	Very low	65 Å²	65	140 Å²	140	67%	0.67	74%	0.741	S	S	*	*			trans	113.3	88.8	-172.6	0	0	0	0	0	113.5
381	R	24.8	Very low	28.1	Very low	230 Å²	230	136.7 Å²	136.7	87%	0.868	73%	0.733	S	S	*	*			cis	75.8	133.9	36.1	-153.2	-178.4	-157.4	-163.2	6.6	112.3
382	L	25.1	Very low	28	Very low	136 Å²	136	140.2 Å²	140.2	71%	0.712	74%	0.743	S	S	*	*			cis	-173.3	153.5	-23.2	-168	95.4	0	0	0	107.7
383	H	26.6	Very low	28	Very low	148 Å²	148	140.8 Å²	140.8	69%	0.685	74%	0.742	S	S	*	*			trans	66.6	162.3	155.2	-97	-137.3	0	0	0	121.5
384	E	25.1	Very low	28.1	Very low	166 Å²	166	145.3 Å²	145.3	78%	0.776	74%	0.743	S	S	*	*			trans	51.3	135.2	160.1	-69	159.6	124.7	0	0	118.5
385	M	27.2	Very low	28.1	Very low	163 Å²	163	144.9 Å²	144.9	80%	0.803	75%	0.746	S	S	*	*			cis	-131.1	155.4	20.2	-68.2	171.5	159.4	0	0	109.9
386	T	26.3	Very low	27.8	Very low	121 Å²	121	145.1 Å²	145.1	74%	0.742	75%	0.752	S	S	*	*			cis	55.6	71.8	46.8	63.5	0	0	0	0	116.2
387	T	28.5	Very low	27.8	Very low	135 Å²	135	148.4 Å²	148.4	83%	0.828	76%	0.761	S	S	*	*			trans	-167.8	153.8	147.4	10.1	0	0	0	0	112.8
388	S	29.3	Very low	27.6	Very low	94 Å²	94	149 Å²	149	66%	0.657	77%	0.766	S	S	*	*			trans	51.6	101.5	153.5	-172	0	0	0	0	119.6
389	D	26.1	Very low	27.6	Very low	141 Å²	141	148 Å²	148	75%	0.754	77%	0.766	S	S	*	*				29.5	157.4	110.9	-59.1	-72.7	0	0	0	122.8
390	T	28.3	Very low	27.6	Very low	127 Å²	127	153.3 Å²	153.3	78%	0.779	78%	0.776	S	S	*	*			trans	72.6	133.6	-166.4	78.9	0	0	0	0	112.7
391	F	29.2	Very low	27.5	Very low	153 Å²	153	156.3 Å²	156.3	67%	0.671	78%	0.777	S	S	*	*			cis	-116.7	123.1	13.1	-102.6	-111.6	0	0	0	112.8
392	K	27.8	Very low	27.8	Very low	213 Å²	213	151.7 Å²	151.7	93%	0.926	77%	0.768	S	S	*	*			trans	-125.7	64.9	166	-120.5	-165.7	-175.2	-179.1	0	108.7
393	E	28.8	Very low	28.1	Very low	143 Å²	143	150.3 Å²	150.3	67%	0.668	77%	0.765	S	S	*	*			trans	-162.2	150.9	176.8	-123.2	176.7	-174.2	0	0	111.8
394	R	28	Very low	28.2	Very low	197 Å²	197	149.7 Å²	149.7	74%	0.743	77%	0.767	S	S	*	*	S	Bend	trans	67.8	113	-168.5	-47.7	166.7	-164.3	150.6	6.9	111.4
395	D	28.7	Very low	28.6	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	76%	0.763	S	S	*	*	S	Bend	cis	-124.7	100.9	17.2	-63.6	-47.1	0	0	0	112.5
396	L	27.9	Very low	28.7	Very low	163 Å²	163	146.1 Å²	146.1	85%	0.853	76%	0.757	S	S	*	*			trans	-144.5	37.5	173.3	-138	168.3	0	0	0	111.6
397	L	27.4	Very low	29	Very low	158 Å²	158	148 Å²	148	83%	0.827	76%	0.757	S	S	*	*			trans	-134.7	56.5	-178.9	-74	178.1	0	0	0	112.4
398	L	27.6	Very low	28.9	Very low	165 Å²	165	146 Å²	146	86%	0.864	75%	0.745	S	S	*	*	S	Bend	trans	-172.6	115.7	160	-101	154.2	0	0	0	105.7
399	N	28.7	Very low	28.8	Very low	134 Å²	134	146.9 Å²	146.9	72%	0.717	74%	0.742	S	S	*	*			cis	-144.3	111.6	9.7	-165.4	16.8	0	0	0	110
400	K	27.4	Very low	28.9	Very low	206 Å²	206	146.2 Å²	146.2	90%	0.896	74%	0.737	S	S	*	*			trans	-128.7	64.4	176.3	-162.6	178.7	-177.7	-179.6	0	111.6
401	N	29.7	Very low	28.9	Very low	129 Å²	129	145.7 Å²	145.7	69%	0.69	73%	0.734	S	S	*	*			trans	-153.1	140.2	168.5	-87.8	-31.6	0	0	0	105.1
402	I	31.1	Very low	28.8	Very low	133 Å²	133	143.4 Å²	143.4	68%	0.682	73%	0.732	S	S	*	*			cis	-151.1	132.7	10.5	-114.3	157.2	0	0	0	109.5
403	T	30	Very low	28.7	Very low	106 Å²	106	141.3 Å²	141.3	65%	0.65	73%	0.725	S	S	*	*			trans	44.2	131	149.9	70.8	0	0	0	0	123.8
404	N	29.5	Very low	28.7	Very low	135 Å²	135	139.1 Å²	139.1	72%	0.722	73%	0.726	S	S	*	*				94.2	130.8	122.5	-75.2	15.1	0	0	0	124.2
405	N	33.1	Very low	28.7	Very low	128 Å²	128	136 Å²	136	68%	0.684	73%	0.729	S	S	*	*			trans	85.9	116.2	142.4	-62.2	3.9	0	0	0	121.2
406	N	29.6	Very low	28.9	Very low	127 Å²	127	133.2 Å²	133.2	68%	0.679	72%	0.719	S	S	*	*				40.1	141	110.7	-54.6	33.7	0	0	0	118.1
407	E	31.6	Very low	28.9	Very low	159 Å²	159	134.1 Å²	134.1	74%	0.743	72%	0.716	S	S	*	*			cis	-162.6	173.3	13	-128.1	159.2	-119	0	0	113.6
408	T	27.7	Very low	28.9	Very low	94 Å²	94	136 Å²	136	58%	0.577	72%	0.717	S	S	*	*			trans	-35.2	168.6	-177.6	64.5	0	0	0	0	124.4	R106	R106-T408 PolarHBondContact NH2-O 3.36Å
409	N	27.2	Very low	29	Very low	112 Å²	112	133.1 Å²	133.1	60%	0.599	71%	0.711	S	S	*	*			trans	88.8	119.9	132.5	-81.3	-20.4	0	0	0	125.1	R106	R106-N409 VanDerWaalsContact CZ-O 3.24Å; R106-N409 PolarHBondContact NH1-O 2.8Å; R106-N409 VanDerWaalsContact NH2-C 3.27Å; R106-N409 PolarHBondContact NH2-O 3.11Å
410	I	28.6	Very low	29	Very low	127 Å²	127	133.2 Å²	133.2	65%	0.651	71%	0.712	S	S	*	*			trans	96.5	107.8	132.5	-69.2	169	0	0	0	120.8	R106	R106-I410 PolarHBondContact NH1-O 2.86Å; R106-I410 VanDerWaalsContact NH1-O 3.07Å
411	V	27	Very low	29	Very low	117 Å²	117	133.6 Å²	133.6	71%	0.709	71%	0.708	S	S	*	*				72	106.2	126.3	-177	0	0	0	0	124.5
412	V	26.5	Very low	28.9	Very low	104 Å²	104	133.5 Å²	133.5	63%	0.63	71%	0.707	S	S	*	*				33.9	123.3	123.7	-157.2	0	0	0	0	121.6
413	H	27.6	Very low	28.6	Very low	169 Å²	169	133.9 Å²	133.9	78%	0.782	71%	0.71	S	S	*	*				174.4	140	113.5	-104.6	-82.3	0	0	0	118.1
414	S	28.2	Very low	28.5	Very low	97 Å²	97	133 Å²	133	68%	0.678	71%	0.713	S	S	*	*			trans	47.3	98.2	146.7	61.2	0	0	0	0	124.1
415	V	27.3	Very low	28.3	Very low	133 Å²	133	131.9 Å²	131.9	81%	0.806	71%	0.711	S	S	*	*				19.6	136.9	95.5	171.2	0	0	0	0	116.4
416	P	33.6	Very low	27.9	Very low	101 Å²	101	135.6 Å²	135.6	66%	0.656	72%	0.715	S	S	*	*			cis	-152.9	-179.9	40.1	27.7	-0.4	0	0	0	121.3
417	K	27.9	Very low	27.9	Very low	182 Å²	182	141 Å²	141	79%	0.791	73%	0.726	S	S	*	*			trans	90.7	125.5	137.4	-88.7	158.2	-171.1	171.9	0	123.2
418	K	26.8	Very low	27.7	Very low	197 Å²	197	140.1 Å²	140.1	86%	0.857	72%	0.724	S	S	*	*			trans	60.9	114.1	147.4	-64.7	-179.7	177.5	-179.8	0	120.2
419	S	29.3	Very low	27.8	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	73%	0.729	S	S	*	*				-178.9	131.2	98.1	-164.9	0	0	0	0	114.4
420	N	29.5	Very low	28	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	74%	0.737	S	S	*	*			trans	35.6	122.5	147.1	-71.6	-38.7	0	0	0	124.4
421	R	27.9	Very low	28.1	Very low	213 Å²	213	142.1 Å²	142.1	80%	0.804	74%	0.742	S	S	*	*				78.7	117.3	125.8	-70.4	-176.6	125.2	-180	0.8	121.8
422	L	26.6	Very low	28.2	Very low	128 Å²	128	140.7 Å²	140.7	67%	0.67	74%	0.742	S	S	*	*			trans	75	125.4	132.8	-92.1	68	0	0	0	120.4
423	N	25.9	Very low	28.3	Very low	141 Å²	141	141.7 Å²	141.7	75%	0.754	75%	0.748	S	S	*	*			trans	73.6	105.6	132.9	-65.8	1.3	0	0	0	119.9
424	A	26.8	Very low	28.2	Very low	86 Å²	86	142.2 Å²	142.2	71%	0.711	75%	0.751	S	S	*	*				112	123.7	104	0	0	0	0	0	119.1
425	V	26.6	Very low	28.1	Very low	112 Å²	112	145.9 Å²	145.9	68%	0.679	76%	0.757	S	S	*	*				71.9	116.2	128.5	175.4	0	0	0	0	118.4
426	R	24.8	Very low	28.1	Very low	207 Å²	207	149 Å²	149	78%	0.781	76%	0.763	S	S	*	*			trans	64.9	119.6	160.3	-64.3	163.5	-168.1	151.6	3.3	118
427	R	27.8	Very low	27.9	Very low	240 Å²	240	152.3 Å²	152.3	91%	0.906	77%	0.769	S	S	*	*				-130.6	138.4	99	-82.7	156.7	-162.2	-175.2	3.2	106.8
428	M	28.6	Very low	28	Very low	141 Å²	141	148.5 Å²	148.5	70%	0.695	76%	0.763	S	S	*	*			cis	96.1	133.2	33.5	-82.1	-178.7	142.1	0	0	114.1
429	N	29.1	Very low	28	Very low	127 Å²	127	148.8 Å²	148.8	68%	0.679	77%	0.765	S	S	*	*			trans	77.4	117.1	152.6	-59.1	-3.6	0	0	0	117.3
430	T	31.5	Very low	28	Very low	124 Å²	124	148.2 Å²	148.2	76%	0.761	76%	0.76	S	S	*	*				92.8	141.7	104.7	51.9	0	0	0	0	112.6
431	T	31.5	Very low	27.9	Very low	124 Å²	124	147.9 Å²	147.9	76%	0.761	76%	0.759	S	S	*	*			cis	-153.3	135.5	3.9	1.9	0	0	0	0	106.9
432	A	28.9	Very low	27.9	Very low	86 Å²	86	145 Å²	145	71%	0.711	76%	0.759	S	S	*	*				59.8	125.6	100	0	0	0	0	0	117.4
433	V	28	Very low	27.9	Very low	126 Å²	126	145.6 Å²	145.6	76%	0.764	76%	0.763	S	S	*	*			trans	85	111.6	164.4	-168.9	0	0	0	0	118.2
434	E	24.9	Very low	28.1	Very low	179 Å²	179	150.7 Å²	150.7	84%	0.836	77%	0.772	S	S	*	*			trans	66.6	168.4	155.4	-69.3	179.7	138.5	0	0	121.7
435	Q	26.5	Very low	28.3	Very low	175 Å²	175	153.1 Å²	153.1	82%	0.818	77%	0.767	S	S	*	*			trans	64.7	75.8	179.1	-56.8	-170.1	-2.3	0	0	117.6	H437	Q435-H437 PolarHBondContact O-N 3.38Å
436	H	28	Very low	28.4	Very low	199 Å²	199	155.6 Å²	155.6	92%	0.921	78%	0.776	S	S	*	*			trans	-76.1	97.3	167.1	-87.7	-71.4	0	0	0	112.6
437	H	29.2	Very low	28.6	Very low	169 Å²	169	151.8 Å²	151.8	78%	0.782	77%	0.765	S	S	*	*			trans	-76.6	140.4	161.3	-89.8	-96.5	0	0	0	111.5	Q435	Q435-H437 PolarHBondContact O-N 3.38Å
438	P	29.1	Very low	28.6	Very low	102 Å²	102	150.1 Å²	150.1	66%	0.662	76%	0.759	S	S	*	*			trans	-93.2	154.3	171.6	36.6	-33.5	0	0	0	112.2
439	F	28.2	Very low	28.6	Very low	204 Å²	204	152.9 Å²	152.9	90%	0.895	77%	0.767	S	S	*	*			trans	-178.8	153.5	132.1	-110.4	-72.9	0	0	0	113.8
440	S	28.6	Very low	28.5	Very low	92 Å²	92	155.9 Å²	155.9	64%	0.643	78%	0.777	S	S	*	*			trans	65.1	94.9	152.4	-141.1	0	0	0	0	122.2
441	N	28.1	Very low	28.3	Very low	131 Å²	131	156.3 Å²	156.3	70%	0.701	78%	0.78	S	S	*	*				73.5	143.8	120.2	-64.4	1	0	0	0	124.8
442	N	27.4	Very low	28.1	Very low	152 Å²	152	159.7 Å²	159.7	81%	0.813	78%	0.784	S	S	*	*			trans	83.5	141.5	160.8	-62.1	-3.5	0	0	0	120.6
443	D	27.2	Very low	28.3	Very low	141 Å²	141	164.5 Å²	164.5	75%	0.754	79%	0.791	S	S	*	*			trans	52.2	78.3	170	-68.4	-7.3	0	0	0	119.9
444	R	29.8	Very low	28.2	Very low	247 Å²	247	166.1 Å²	166.1	93%	0.932	79%	0.79	S	S	*	*			trans	-111.2	84	155.7	-150.1	172.3	-161.9	-178.8	6.6	112.7	N446	R444-N446 PolarHBondContact O-N 3.22Å
445	F	29.8	Very low	28.4	Very low	138 Å²	138	162.1 Å²	162.1	61%	0.605	78%	0.78	S	S	*	*			trans	-57	104.7	177.9	-96.8	-77.6	0	0	0	113.3	F447 K621	F445-F447 HydrophobicContact CD1-CD2 4.45Å; F445-F447 PolarHBondContact O-N 3.48Å; F445-K621 VanDerWaalsContact CE1-NZ 3.33Å
446	N	30	Very low	28.3	Very low	164 Å²	164	157.2 Å²	157.2	88%	0.877	77%	0.765	S	S	*	*			trans	-80.5	80.8	173.5	-122.1	-29.2	0	0	0	111	R444 R448	R444-N446 PolarHBondContact O-N 3.22Å; N446-R448 VanDerWaalsContact C-N 3.31Å; N446-R448 PolarHBondContact O-N 3.37Å
447	F	27.5	Very low	28.3	Very low	126 Å²	126	150.7 Å²	150.7	55%	0.553	74%	0.742	S	S	*	*			trans	-78	65.6	-172.4	-131.2	-70.2	0	0	0	113.3	F445 L618 K621	F445-F447 HydrophobicContact CD1-CD2 4.45Å; F445-F447 PolarHBondContact O-N 3.48Å; F447-L618 HydrophobicContact CE1-CD1 4.31Å; F447-L618 HydrophobicContact CE2-CD1 4.1Å; F447-L618 HydrophobicContact CZ-CD1 3.69Å; F447-K621 HydrophobicContact CE2-CD 3.99Å; F447-K621 HydrophobicContact CZ-CD 4.17Å
448	R	28.4	Very low	28.1	Very low	205 Å²	205	146.6 Å²	146.6	77%	0.774	73%	0.732	S	S	*	*			trans	-80.3	127.4	173	-160.5	169.5	-174.5	171.1	1.1	110.9	N446 Q450	N446-R448 VanDerWaalsContact C-N 3.31Å; N446-R448 PolarHBondContact O-N 3.37Å; R448-Q450 PolarHBondContact O-N 2.91Å
449	K	28.2	Very low	28	Very low	199 Å²	199	149.5 Å²	149.5	87%	0.865	74%	0.735	S	S	*	*			trans	-63.3	124.3	-171.4	-61.8	173.7	-179.7	175	0	113.4
450	Q	27.8	Very low	27.8	Very low	190 Å²	190	144.4 Å²	144.4	89%	0.888	72%	0.72	S	S	*	*			trans	-147.8	109.6	151.8	-77.3	-164.2	-5	0	0	111.1	R448	R448-Q450 PolarHBondContact O-N 2.91Å
451	T	27.2	Very low	27.7	Very low	134 Å²	134	147.9 Å²	147.9	82%	0.822	73%	0.726	S	S	*	*			trans	-157.9	137.8	162.1	49	0	0	0	0	110.1
452	K	27.9	Very low	27.5	Very low	195 Å²	195	147.9 Å²	147.9	85%	0.848	73%	0.726	S	S	*	*			trans	70.4	133.6	-170.4	-50.6	-179.3	179.5	-177.2	0	112
453	H	31.6	Very low	27.4	Very low	187 Å²	187	151 Å²	151	87%	0.866	73%	0.728	S	S	*	*			cis	-117.3	158.8	14.5	-77.8	-114	0	0	0	114.8
454	Q	27.1	Very low	27.3	Very low	159 Å²	159	149 Å²	149	74%	0.743	72%	0.723	S	S	*	*			trans	-155.2	148.7	155.2	-149.3	175.5	29.6	0	0	107.3
455	P	29.2	Very low	26.9	Very low	95 Å²	95	143.2 Å²	143.2	62%	0.617	72%	0.719	S	S	*	*				-152.1	163.4	107.8	40.6	-23.8	0	0	0	117.8	S1166 S1168	P455-S1166 CarbonylContact C-O 3.46Å; P455-S1168 PolarHBondContact O-N 3.13Å
456	S	24.9	Very low	26.7	Very low	73 Å²	73	142.2 Å²	142.2	51%	0.51	72%	0.724	S	S	.	*			trans	42.4	115.9	146.1	62	0	0	0	0	122.8	S1166 S1167 S1168	S456-S1166 CarbonylContact C-O 3.56Å; S456-S1166 VanDerWaalsContact C-O 3.26Å; S456-S1166 WeakPolarHBondContact CA-O 3.37Å; S456-S1166 PolarHBondContact N-O 2.77Å; S456-S1167 CarbonylContact O-C 3.54Å; S456-S1167 VanDerWaalsContact O-C 3.26Å; S456-S1168 PolarHBondContact O-N 3.4Å
457	S	27.5	Very low	26.5	Very low	62 Å²	62	141 Å²	141	43%	0.434	72%	0.718	S	S	.	*	B	Isolated β-bridge	trans	145.7	99.2	151.2	166.6	0	0	0	0	111.9	S1166 S1167 S1168	S457-S1166 PolarHBondContact N-O 3.05Å; S457-S1166 VanDerWaalsContact N-O 3.12Å; S457-S1166 CarbonylContact O-C 3.59Å; S457-S1166 WeakPolarHBondContact O-CB 3.49Å; S457-S1167 WeakPolarHBondContact CB-O 3.32Å; S457-S1167 CarbonylContact O-C 3.49Å; S457-S1167 WeakPolarHBondContact O-CA 3.49Å; S457-S1167 PolarHBondContact O-N 3.34Å; S457-S1167 PolarHBondContact O-OG 3.23Å; S457-S1167 PolarHBondContact OG-O 3.46Å; S457-S1168 WeakPolarHBondContact CB-O 3.32Å; S457-S1168 PolarHBondContact OG-O 3.07Å
458	S	24.2	Very low	26.4	Very low	83 Å²	83	145 Å²	145	58%	0.58	74%	0.735	S	S	*	*			trans	-36.9	128.7	180	43	0	0	0	0	117.4	R1165	S458-R1165 PolarHBondContact N-O 3.06Å
459	K	27.4	Very low	26.4	Very low	163 Å²	163	143.9 Å²	143.9	71%	0.709	74%	0.736	S	S	*	*			trans	-126.5	142.3	136.7	-87	-165.3	173.2	-173.7	0	111
460	T	24.6	Very low	26.3	Very low	96 Å²	96	143 Å²	143	59%	0.589	73%	0.728	S	S	*	*			trans	-102.5	89.5	179.7	-24.1	0	0	0	0	107.3	N462	T460-N462 PolarHBondContact O-N 3.17Å
461	E	25.2	Very low	26.1	Very low	165 Å²	165	140 Å²	140	77%	0.771	72%	0.723	S	S	*	*			trans	-78	114.8	161.4	-76.6	176.4	174.9	0	0	107.3	R1165	E461-R1165 PolarHBondContact O-NH2 2.94Å
462	N	24.9	Very low	26.2	Very low	131 Å²	131	143 Å²	143	70%	0.701	73%	0.728	S	S	*	*			trans	-80.6	132.6	171.1	-65.2	-20.9	0	0	0	107.5	T460 P464	T460-N462 PolarHBondContact O-N 3.17Å; N462-P464 WeakPolarHBondContact O-CD 3.44Å
463	Y	25	Very low	26.1	Very low	217 Å²	217	136.8 Å²	136.8	85%	0.851	72%	0.718	S	S	*	*			trans	-67.4	126.3	153.2	-82.6	-84	0	0	0	107.2	C465	Y463-C465 PolarHBondContact O-N 3.41Å; Y463-C465 VanDerWaalsContact O-N 3.08Å
464	P	25.1	Very low	25.9	Very low	101 Å²	101	134 Å²	134	66%	0.656	71%	0.714	S	S	*	*			trans	-65.7	111.4	175.2	-19.1	32.4	0	0	0	109.5	N462 T466	N462-P464 WeakPolarHBondContact O-CD 3.44Å; P464-T466 HydrophobicContact CB-CG2 3.82Å; P464-T466 PolarHBondContact O-N 3.38Å
465	C	22.2	Very low	25.8	Very low	125 Å²	125	134 Å²	134	85%	0.845	72%	0.719	S	S	*	*			trans	-77	70.2	158.2	-63.7	0	0	0	0	107.5	Y463 N467	Y463-C465 PolarHBondContact O-N 3.41Å; Y463-C465 VanDerWaalsContact O-N 3.08Å; C465-N467 PolarHBondContact O-N 3.26Å
466	T	25.1	Very low	25.7	Very low	116 Å²	116	133.8 Å²	133.8	71%	0.712	72%	0.72	S	S	*	*			trans	-73.5	104.4	175.1	41.2	0	0	0	0	109	P464 K468	P464-T466 HydrophobicContact CB-CG2 3.82Å; P464-T466 PolarHBondContact O-N 3.38Å; T466-K468 PolarHBondContact O-N 3.5Å
467	N	24.7	Very low	25.9	Very low	139 Å²	139	137.6 Å²	137.6	74%	0.743	73%	0.729	S	S	*	*			trans	-44.6	123	172.1	-68.1	-43.6	0	0	0	111.4	C465 K469	C465-N467 PolarHBondContact O-N 3.26Å; N467-K469 HydrophobicContact CB-CG 4.47Å; N467-K469 PolarHBondContact O-N 3.38Å
468	K	26.5	Very low	25.9	Very low	210 Å²	210	139.8 Å²	139.8	91%	0.913	74%	0.736	S	S	*	*			trans	-76	70.3	157.4	-76.2	-173.3	173.7	-179.7	0	108.8	T466	T466-K468 PolarHBondContact O-N 3.5Å
469	K	27.6	Very low	26.1	Very low	181 Å²	181	141.5 Å²	141.5	79%	0.787	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-67.8	139.7	167.2	-100.4	-166.9	172.9	-171.4	0	109.2	N467	N467-K469 HydrophobicContact CB-CG 4.47Å; N467-K469 PolarHBondContact O-N 3.38Å
470	Y	26.7	Very low	26.2	Very low	180 Å²	180	139.2 Å²	139.2	71%	0.706	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-63.8	143.6	171.7	-85	-108.2	0	0	0	110.9	V1015	Y470-V1015 HydrophobicContact CE2-CG1 3.97Å; Y470-V1015 VanDerWaalsContact OH-CG1 3.25Å; Y470-V1015 WeakPolarHBondContact OH-CG1 3.34Å
471	T	24.1	Very low	26.4	Very low	127 Å²	127	140.8 Å²	140.8	78%	0.779	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-89.9	123.9	176.4	49.4	0	0	0	0	111.5
472	H	29.1	Very low	26.5	Very low	199 Å²	199	138.7 Å²	138.7	92%	0.921	74%	0.737	S	S	*	*			trans	-137.8	161.6	151.6	-101.4	-95.2	0	0	0	108.1
473	G	26.4	Very low	26.6	Very low	63 Å²	63	137.5 Å²	137.5	65%	0.649	74%	0.739	S	S	*	*			trans	-71.1	-175	-166.7	0	0	0	0	0	116.3
474	T	26.9	Very low	26.6	Very low	128 Å²	128	131.2 Å²	131.2	79%	0.785	73%	0.731	S	S	*	*			cis	-169.8	144	4.9	-3.5	0	0	0	0	110.2
475	L	24.9	Very low	26.6	Very low	159 Å²	159	131.9 Å²	131.9	83%	0.832	74%	0.737	S	S	*	*			trans	61.7	157.4	165.1	-88.7	66.8	0	0	0	116.6
476	S	26.9	Very low	26.7	Very low	91 Å²	91	134.8 Å²	134.8	64%	0.636	74%	0.735	S	S	*	*			cis	-157.2	164.4	-10.1	46.9	0	0	0	0	111.4
477	Q	28.5	Very low	26.7	Very low	153 Å²	153	136.4 Å²	136.4	72%	0.715	74%	0.739	S	S	*	*			trans	-21.9	161.5	159.2	-61.6	131.8	-65.7	0	0	117.9
478	D	27.3	Very low	26.7	Very low	109 Å²	109	136.2 Å²	136.2	58%	0.583	74%	0.737	S	S	*	*			cis	-149.6	-172.2	20	-147.3	40.2	0	0	0	110.1	I480	D478-I480 WeakPolarHBondContact OD1-CD1 3.34Å; D478-I480 WeakPolarHBondContact OD2-CD1 3.34Å
479	N	29.8	Very low	26.6	Very low	119 Å²	119	133 Å²	133	64%	0.636	73%	0.73	S	S	*	*			cis	-144.7	144.4	19.9	-161.2	-107.5	0	0	0	106.7	N481	N479-N481 PolarHBondContact OD1-ND2 3.19Å
480	I	29.1	Very low	26.5	Very low	115 Å²	115	128.9 Å²	128.9	59%	0.59	72%	0.724	S	S	*	*			cis	81.9	143.6	49.6	-64.7	-175.7	0	0	0	114.6	D478	D478-I480 WeakPolarHBondContact OD1-CD1 3.34Å; D478-I480 WeakPolarHBondContact OD2-CD1 3.34Å
481	N	28.5	Very low	26.5	Very low	128 Å²	128	125 Å²	125	68%	0.684	72%	0.724	S	S	*	*			trans	86.6	105.5	-175.4	-56.8	-56	0	0	0	114.6	N479	N479-N481 PolarHBondContact OD1-ND2 3.19Å
482	T	27.8	Very low	26.5	Very low	122 Å²	122	124.5 Å²	124.5	75%	0.748	73%	0.725	S	S	*	*			cis	62.9	116.6	30.7	-27.8	0	0	0	0	110.1
483	S	25.9	Very low	26.4	Very low	106 Å²	106	122 Å²	122	74%	0.741	72%	0.717	S	S	*	*				177.3	176.3	73.7	53.3	0	0	0	0	111.8
484	A	25.5	Very low	26.3	Very low	84 Å²	84	126.8 Å²	126.8	69%	0.694	72%	0.723	S	S	*	*			trans	57.8	116.5	158.5	0	0	0	0	0	118.7
485	C	24.3	Very low	26.2	Very low	116 Å²	116	128.4 Å²	128.4	78%	0.784	73%	0.726	S	S	*	*			cis	87.4	132.3	46.3	-71.4	0	0	0	0	115.4
486	K	24.7	Very low	26.3	Very low	185 Å²	185	124 Å²	124	80%	0.804	72%	0.718	S	S	*	*			trans	77.1	150.3	138.1	-84.9	-178.9	176.8	-179.5	0	119.8
487	L	24.8	Very low	26.2	Very low	150 Å²	150	124.3 Å²	124.3	79%	0.785	72%	0.721	S	S	*	*			trans	71.2	144.9	163	-58.6	156.8	0	0	0	114.8
488	L	25.6	Very low	26.2	Very low	135 Å²	135	123.5 Å²	123.5	71%	0.707	72%	0.721	S	S	*	*			cis	-152.8	132.1	-13.6	-98.3	166.2	0	0	0	105.1
489	D	24.1	Very low	26.1	Very low	142 Å²	142	123.4 Å²	123.4	76%	0.759	73%	0.729	S	S	*	*				86	179.5	85.4	-160.1	8.7	0	0	0	113.5
490	S	26.4	Very low	25.9	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	73%	0.734	S	S	*	*			trans	81.9	85.2	171	-56	0	0	0	0	119.3
491	S	25.5	Very low	25.8	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	74%	0.739	S	S	*	*				62.4	114.1	116.1	68.8	0	0	0	0	123.2
492	S	24.9	Very low	25.7	Very low	115 Å²	115	125.6 Å²	125.6	80%	0.804	74%	0.743	S	S	*	*				70.7	168.3	113	-51.5	0	0	0	0	123.1
493	I	25.8	Very low	25.6	Very low	148 Å²	148	131.1 Å²	131.1	76%	0.759	75%	0.75	S	S	*	*			trans	88.4	82.8	164.6	-47.4	-176.2	0	0	0	117.6
494	E	24.9	Very low	25.9	Very low	163 Å²	163	131.1 Å²	131.1	76%	0.762	75%	0.747	S	S	*	*				53.9	151.6	115.4	-63.5	-169.3	134.1	0	0	125.5
495	L	25	Very low	26	Very low	162 Å²	162	133.6 Å²	133.6	85%	0.848	75%	0.753	S	S	*	*			trans	79.3	150.2	145.1	-78.9	157.2	0	0	0	121.7
496	G	27	Very low	26.3	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	75%	0.753	S	S	*	*			trans	86.4	86.5	176	0	0	0	0	0	114.4
497	S	25.9	Very low	26.4	Very low	99 Å²	99	129.1 Å²	129.1	69%	0.692	75%	0.749	S	S	*	*			cis	85.6	149	47.2	90	0	0	0	0	115.2
498	D	26.6	Very low	26.5	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	75%	0.751	S	S	*	*			trans	62.9	104.2	163	-52.3	-56.2	0	0	0	118.8
499	S	26	Very low	26.5	Very low	106 Å²	106	127 Å²	127	74%	0.741	75%	0.748	S	S	*	*				94.8	158.6	89.7	87.2	0	0	0	0	112.3
500	M	26.1	Very low	26.5	Very low	150 Å²	150	127.9 Å²	127.9	74%	0.739	75%	0.752	S	S	*	*			cis	-154.5	157.5	-3.8	-138.2	-174.6	-166.9	0	0	110.2
501	Q	26.6	Very low	26.4	Very low	149 Å²	149	133.2 Å²	133.2	70%	0.696	76%	0.759	S	S	*	*			trans	51.7	120.5	147.8	-74.9	165.7	12.8	0	0	122.9
502	S	27.1	Very low	26.4	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	77%	0.766	S	S	*	*			trans	78.8	157.2	132.9	86.7	0	0	0	0	118.8
503	R	25.6	Very low	26.3	Very low	237 Å²	237	138 Å²	138	89%	0.894	76%	0.758	S	S	*	*			cis	-152	155.6	-8.8	-131.9	168.5	-174.2	179.2	2.5	108.4
504	P	31.4	Very low	26.3	Very low	107 Å²	107	135.8 Å²	135.8	70%	0.695	76%	0.756	S	S	*	*			trans	-109.3	172.3	-169.3	42.1	-35.5	0	0	0	115
505	V	27.3	Very low	26.4	Very low	135 Å²	135	132.6 Å²	132.6	82%	0.818	75%	0.752	S	S	*	*			trans	73.4	152.6	164.4	-176	0	0	0	0	115.4
506	P	32.2	Very low	26.5	Very low	119 Å²	119	130 Å²	130	77%	0.773	75%	0.747	S	S	*	*			cis	-120.8	-171	-15.6	31.1	-10.9	0	0	0	114.4
507	A	26.1	Very low	26.4	Very low	88 Å²	88	130 Å²	130	73%	0.727	75%	0.747	S	S	*	*			trans	-65.3	165.5	162.7	0	0	0	0	0	114.4
508	T	25.8	Very low	26.4	Very low	134 Å²	134	131.2 Å²	131.2	82%	0.822	75%	0.751	S	S	*	*			trans	-171.6	132.8	131.4	-79.7	0	0	0	0	113.3
509	T	25.4	Very low	26.3	Very low	106 Å²	106	135.3 Å²	135.3	65%	0.65	76%	0.756	S	S	*	*			trans	2.8	128.1	151.1	-46.8	0	0	0	0	121
510	L	26	Very low	26.3	Very low	162 Å²	162	137 Å²	137	85%	0.848	76%	0.756	S	S	*	*				-175.9	118.2	120.1	-93.4	163	0	0	0	106.9
511	Y	23.3	Very low	26.6	Very low	207 Å²	207	134.9 Å²	134.9	81%	0.812	75%	0.754	S	S	*	*				69.3	141.1	52.1	-127.2	-78.8	0	0	0	114.4
512	R	24.6	Very low	26.4	Very low	223 Å²	223	135.6 Å²	135.6	84%	0.842	76%	0.757	S	S	*	*			trans	77.5	92.9	179.8	-137	170.3	-157.6	153.2	5	114.1
513	S	24.6	Very low	26.2	Very low	91 Å²	91	138.3 Å²	138.3	64%	0.636	76%	0.755	S	S	*	*				82.5	154.3	50.4	84.5	0	0	0	0	114.9
514	S	25.8	Very low	26.2	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	75%	0.748	S	S	*	*			trans	64.3	141.8	162.1	36.5	0	0	0	0	117
515	S	26.1	Very low	25.9	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	75%	0.746	S	S	*	*			cis	-168.3	-176.7	-9.2	47.9	0	0	0	0	109.5
516	S	26.5	Very low	25.8	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	74%	0.742	S	S	*	*			trans	40.3	112.5	145.4	56.9	0	0	0	0	119
517	G	26.5	Very low	25.6	Very low	64 Å²	64	136.1 Å²	136.1	66%	0.66	74%	0.742	S	S	*	*			cis	112.9	-177.9	9.7	0	0	0	0	0	112.8
518	T	25.4	Very low	25.8	Very low	126 Å²	126	135 Å²	135	77%	0.773	74%	0.739	S	S	*	*			trans	71.7	142	174.8	77	0	0	0	0	118.3
519	R	24.5	Very low	25.9	Very low	222 Å²	222	133.3 Å²	133.3	84%	0.838	73%	0.728	S	S	*	*			trans	66.8	142.5	157.7	-68.3	169	176.1	175.2	-1.4	117.5
520	N	24.8	Very low	26.1	Very low	141 Å²	141	135 Å²	135	75%	0.754	73%	0.733	S	S	*	*			cis	-150	176	-17	-125.7	23.9	0	0	0	109.1
521	P	32.7	Very low	26.3	Very low	106 Å²	106	134.6 Å²	134.6	69%	0.688	73%	0.727	S	S	*	*			trans	-82.1	-166	-177.4	38.3	-36.9	0	0	0	111.6
522	E	23.3	Very low	26.5	Very low	164 Å²	164	128.3 Å²	128.3	77%	0.766	71%	0.71	S	S	*	*			trans	114.3	130.3	168	-66.4	-161.6	144.7	0	0	115.2
523	F	23.2	Very low	26.7	Very low	166 Å²	166	124.7 Å²	124.7	73%	0.728	70%	0.701	S	S	*	*			trans	37.1	135.4	144.3	-69.6	-90.1	0	0	0	119.5
524	I	25	Very low	26.9	Very low	145 Å²	145	125.7 Å²	125.7	74%	0.744	70%	0.698	S	S	*	*			cis	-145.4	169.4	39.3	-103	113.6	0	0	0	112.4
525	N	24.5	Very low	27	Very low	122 Å²	122	127.5 Å²	127.5	65%	0.652	70%	0.7	S	S	*	*			trans	-56.2	163.6	174.3	-40.5	-43	0	0	0	114.8
526	D	26.4	Very low	27.1	Very low	136 Å²	136	129 Å²	129	73%	0.727	71%	0.705	S	S	*	*				167.9	154.5	118.6	-87.1	-3.3	0	0	0	110.2
527	I	27.3	Very low	27.2	Very low	150 Å²	150	127 Å²	127	77%	0.769	70%	0.701	S	S	*	*			cis	-160.8	156.3	-33.6	-118.1	170.8	0	0	0	105.6
528	G	30.4	Very low	27.2	Very low	64 Å²	64	132 Å²	132	66%	0.66	71%	0.711	S	S	*	*			trans	128.2	87.8	-174	0	0	0	0	0	111.6
529	V	28.3	Very low	27.4	Very low	99 Å²	99	129.9 Å²	129.9	60%	0.6	71%	0.714	S	S	*	*			cis	65.4	126.6	41.7	-171.9	0	0	0	0	109.4	Q531	V529-Q531 HydrophobicContact CG1-CG 4.17Å
530	D	29.8	Very low	27.6	Very low	142 Å²	142	125.5 Å²	125.5	76%	0.759	71%	0.712	S	S	*	*			cis	-91.4	155.1	20.7	-58.3	-61.8	0	0	0	115.5
531	Q	28.5	Very low	28	Very low	152 Å²	152	123.3 Å²	123.3	71%	0.71	71%	0.706	S	S	*	*			cis	89.7	146.6	39.4	-71.8	-173.5	15.4	0	0	114.4	V529	V529-Q531 HydrophobicContact CG1-CG 4.17Å
532	T	29.5	Very low	27.8	Very low	76 Å²	76	124.6 Å²	124.6	47%	0.466	71%	0.707	S	S	.	*			cis	-130.5	-89.6	20.5	-35.3	0	0	0	0	118.8
533	F	28	Very low	28	Very low	147 Å²	147	121.5 Å²	121.5	65%	0.645	70%	0.703	S	S	*	*			trans	-93.1	163.5	-156.2	-64	-77	0	0	0	115.5	E1092	F533-E1092 WeakPolarHBondContact CD2-OE2 3.45Å
534	I	27.7	Very low	28.3	Very low	112 Å²	112	118.5 Å²	118.5	57%	0.574	70%	0.7	S	S	*	*			cis	122.4	104.9	-8.7	-68	165.2	0	0	0	115.5
535	N	29.6	Very low	28.4	Very low	140 Å²	140	118.5 Å²	118.5	75%	0.749	70%	0.7	S	S	*	*			trans	167.9	119.5	130.5	-87.7	-38.7	0	0	0	109.8
536	T	26.8	Very low	28.6	Very low	128 Å²	128	118.8 Å²	118.8	79%	0.785	71%	0.707	S	S	*	*				81.9	141	53.6	75.5	0	0	0	0	114.6
537	G	29	Very low	28.6	Very low	66 Å²	66	120.2 Å²	120.2	68%	0.68	71%	0.713	S	S	*	*			trans	126.3	64.4	-171.2	0	0	0	0	0	112.9
538	I	25.9	Very low	28.8	Very low	167 Å²	167	117.9 Å²	117.9	86%	0.856	72%	0.716	S	S	*	*				66.7	111.1	84.2	-58.4	170.1	0	0	0	112.4
539	G	30.4	Very low	28.7	Very low	82 Å²	82	121.4 Å²	121.4	85%	0.845	72%	0.72	S	S	*	*			trans	-176	56.7	-174.4	0	0	0	0	0	114.5
540	V	28.8	Very low	28.6	Very low	131 Å²	131	125.4 Å²	125.4	79%	0.794	73%	0.73	S	S	*	*			trans	-88.2	-179.8	174.2	-116.9	0	0	0	0	110.1
541	P	32.5	Very low	28.5	Very low	95 Å²	95	124 Å²	124	62%	0.617	73%	0.731	S	S	*	*			cis	-141.7	-161.5	-3.8	27.2	0.2	0	0	0	115.7
542	N	29	Very low	28.5	Very low	133 Å²	133	123.5 Å²	123.5	71%	0.711	74%	0.738	S	S	*	*			trans	82.7	115.1	154.5	-59.2	-28.4	0	0	0	118.6
543	S	27.9	Very low	28.5	Very low	99 Å²	99	125.7 Å²	125.7	69%	0.692	75%	0.751	S	S	*	*				68.8	152.5	56.4	87.8	0	0	0	0	113.5
544	P	30	Very low	28.4	Very low	103 Å²	103	125.6 Å²	125.6	67%	0.669	76%	0.763	S	S	*	*			cis	-142.7	157.8	18.8	37.8	-16.2	0	0	0	120
545	I	26.9	Very low	28.4	Very low	144 Å²	144	125.5 Å²	125.5	74%	0.738	77%	0.772	S	S	*	*			trans	46.7	113.8	132.5	-50.1	163.8	0	0	0	121
546	T	28.4	Very low	28.3	Very low	129 Å²	129	123.6 Å²	123.6	79%	0.791	77%	0.77	S	S	*	*				177.7	118.6	118.9	26.3	0	0	0	0	109.4
547	L	26.1	Very low	28.4	Very low	165 Å²	165	124.4 Å²	124.4	86%	0.864	77%	0.768	S	S	*	*				74.1	81.8	81.6	-92.7	151.9	0	0	0	116.2
548	A	30.7	Very low	28.4	Very low	101 Å²	101	128.4 Å²	128.4	84%	0.835	77%	0.774	S	S	*	*			trans	-161.6	151.8	145.7	0	0	0	0	0	111.8
549	D	29.5	Very low	28.5	Very low	138 Å²	138	126.3 Å²	126.3	74%	0.738	77%	0.774	S	S	*	*			trans	-59.8	131.6	-158.4	-70.7	-70.3	0	0	0	121.7
550	K	26.7	Very low	28.5	Very low	184 Å²	184	128.1 Å²	128.1	80%	0.8	77%	0.773	S	S	*	*				18.6	107.6	124.4	-60.2	164.7	-177.9	160	0	117.6
551	S	27.1	Very low	28.8	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	78%	0.776	S	S	*	*				154.2	129.2	102.7	58.4	0	0	0	0	114
552	T	28.9	Very low	28.7	Very low	141 Å²	141	132 Å²	132	87%	0.865	79%	0.786	S	S	*	*			trans	-162	122	150.4	-75	0	0	0	0	106.7
553	V	29	Very low	28.7	Very low	123 Å²	123	132 Å²	132	75%	0.745	79%	0.785	S	S	*	*			trans	-98.4	135.9	-179	171.3	0	0	0	0	109.8	S555	V553-S555 PolarHBondContact O-N 3.4Å
554	T	25.6	Very low	29	Very low	144 Å²	144	135.3 Å²	135.3	88%	0.883	79%	0.793	S	S	*	*			trans	-71.9	111.1	170.4	50.6	0	0	0	0	111
555	S	28.7	Very low	29	Very low	110 Å²	110	136.9 Å²	136.9	77%	0.769	80%	0.795	S	S	*	*			trans	-145.1	150.4	162	56.5	0	0	0	0	112	V553	V553-S555 PolarHBondContact O-N 3.4Å
556	S	27.4	Very low	29.3	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	79%	0.794	S	S	*	*			trans	-78	-178	175.9	50.7	0	0	0	0	112.2
557	I	28.4	Very low	29.5	Very low	145 Å²	145	137.2 Å²	137.2	74%	0.744	79%	0.789	S	S	*	*			trans	99.3	121.8	164	-55.7	160.8	0	0	0	115.6
558	N	28.4	Very low	29.7	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	79%	0.786	S	S	*	*			trans	45.5	124.4	157.2	-56.9	-9.4	0	0	0	121
559	S	29.1	Very low	29.7	Very low	123 Å²	123	135.8 Å²	135.8	86%	0.86	78%	0.78	S	S	*	*			trans	-126.2	99.3	158.4	-80.9	0	0	0	0	110.7
560	S	29.8	Very low	29.8	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	78%	0.782	S	S	*	*			trans	-164.3	32.9	165.7	-81.8	0	0	0	0	114.7
561	T	35.9	Very low	29.8	Very low	140 Å²	140	131.1 Å²	131.1	86%	0.859	78%	0.776	S	S	*	*			trans	-153.9	157.3	165.2	10.3	0	0	0	0	111.2
562	M	30.2	Very low	30.2	Very low	168 Å²	168	132.3 Å²	132.3	83%	0.828	78%	0.779	S	S	*	*			trans	-109.3	141.4	-172.1	-97.5	-174.4	162.9	0	0	113.3
563	I	28.9	Very low	30.3	Very low	133 Å²	133	131.8 Å²	131.8	68%	0.682	78%	0.776	S	S	*	*			trans	49.9	115.9	135.7	-50.6	168.6	0	0	0	118.4
564	I	33.1	Very low	30.7	Very low	168 Å²	168	131.6 Å²	131.6	86%	0.862	78%	0.777	S	S	*	*				-158.6	162.4	110.1	-97	171.1	0	0	0	108.7
565	L	30.2	Very low	30.9	Very low	136 Å²	136	130.6 Å²	130.6	71%	0.712	77%	0.771	S	S	*	*			trans	-89.1	155.3	-160.2	-74	156.6	0	0	0	115.9
566	Q	33.4	Very low	31	Very low	154 Å²	154	131.5 Å²	131.5	72%	0.72	77%	0.772	S	S	*	*			trans	62	152.1	143.3	-70.2	166.8	-54.8	0	0	119.5
567	N	32.2	Very low	31.1	Very low	127 Å²	127	133.7 Å²	133.7	68%	0.679	78%	0.782	S	S	*	*			cis	-158.1	154.9	-22.3	-117.3	4.5	0	0	0	109.9
568	N	31.8	Very low	31.4	Very low	148 Å²	148	131.4 Å²	131.4	79%	0.791	78%	0.784	S	S	*	*			trans	48.3	132.4	158.3	-70.8	-6.6	0	0	0	123
569	A	29.2	Very low	31.5	Very low	88 Å²	88	132 Å²	132	73%	0.727	79%	0.786	S	S	*	*			trans	-21.5	150.9	150.5	0	0	0	0	0	116.6
570	T	31.5	Very low	31.8	Very low	125 Å²	125	132.7 Å²	132.7	77%	0.767	79%	0.785	S	S	*	*				-153.1	150.2	56.9	45.7	0	0	0	0	116.4
571	S	28.2	Very low	31.9	Very low	98 Å²	98	132.2 Å²	132.2	69%	0.685	79%	0.788	S	S	*	*			trans	41.7	148.4	143.1	66.3	0	0	0	0	123.3
572	T	34	Very low	31.7	Very low	138 Å²	138	133.8 Å²	133.8	85%	0.847	79%	0.79	S	S	*	*			trans	99.9	131.8	160.4	78.2	0	0	0	0	118.6
573	T	31.8	Very low	32	Very low	130 Å²	130	129.9 Å²	129.9	80%	0.798	78%	0.784	S	S	*	*			trans	-98.7	176.2	172.2	53.2	0	0	0	0	109.3
574	P	36.3	Very low	32.4	Very low	119 Å²	119	131.3 Å²	131.3	77%	0.773	79%	0.794	S	S	*	*			cis	-132	-158.1	1.7	35.5	-13.2	0	0	0	113.2
575	T	29.9	Very low	32.4	Very low	123 Å²	123	126.7 Å²	126.7	76%	0.755	79%	0.788	S	S	*	*			trans	-65.4	163.6	173.3	48.5	0	0	0	0	115.6
576	T	30.9	Very low	32.6	Very low	129 Å²	129	126.4 Å²	126.4	79%	0.791	80%	0.797	S	S	*	*			trans	91.3	89.3	154.3	-47.9	0	0	0	0	117.9
577	T	30.6	Very low	32.7	Very low	147 Å²	147	125 Å²	125	90%	0.902	80%	0.799	S	S	*	*			trans	-163.8	-176.1	146.3	-5	0	0	0	0	110.5
578	A	34.4	Very low	32.8	Very low	96 Å²	96	127.1 Å²	127.1	79%	0.793	81%	0.81	S	S	*	*			trans	74.2	46.3	171.4	0	0	0	0	0	118.1
579	I	31.1	Very low	32.7	Very low	164 Å²	164	128.4 Å²	128.4	84%	0.841	81%	0.811	S	S	*	*				-69.2	151.1	128.8	-64.1	173	0	0	0	106.9
580	T	34.1	Very low	32.9	Very low	137 Å²	137	129.3 Å²	129.3	84%	0.84	81%	0.813	S	S	*	*			trans	94.9	78.8	179.8	-42	0	0	0	0	115.3
581	A	33.1	Very low	33.1	Very low	109 Å²	109	130.4 Å²	130.4	90%	0.901	82%	0.819	S	S	*	*			trans	-158.6	60	160.3	0	0	0	0	0	110.9
582	L	30.4	Very low	33.8	Very low	173 Å²	173	131.1 Å²	131.1	91%	0.906	82%	0.819	S	S	*	*			trans	-107.4	152.4	173.2	-101.5	158.1	0	0	0	109.6
583	A	37.3	Very low	34.2	Very low	85 Å²	85	128.5 Å²	128.5	70%	0.702	80%	0.8	S	S	*	*			trans	66.6	120.6	-173.5	0	0	0	0	0	113.5
584	N	36.8	Very low	35	Very low	163 Å²	163	127.2 Å²	127.2	87%	0.872	79%	0.794	S	S	*	*			cis	-149.2	149.9	33.7	-76.6	-56.8	0	0	0	114
585	G	34.2	Very low	35.3	Very low	72 Å²	72	128.5 Å²	128.5	74%	0.742	79%	0.793	S	S	*	*			trans	87.3	104.7	136.4	0	0	0	0	0	120.3
586	S	34.2	Very low	36.2	Very low	130 Å²	130	129.4 Å²	129.4	91%	0.909	79%	0.787	S	S	*	*			trans	65.8	101	157.8	-159.8	0	0	0	0	117.7
587	V	35	Very low	36.9	Very low	125 Å²	125	129.2 Å²	129.2	76%	0.758	78%	0.777	S	S	*	*			trans	-139	133.8	-179.3	168.3	0	0	0	0	110.5
588	N	34.2	Very low	38.2	Very low	171 Å²	171	126 Å²	126	91%	0.914	76%	0.76	S	S	*	*			trans	-117.9	64.7	165.7	-87.3	-10.7	0	0	0	110.9
589	E	30.7	Very low	39.9	Very low	174 Å²	174	125.6 Å²	125.6	81%	0.813	75%	0.748	S	S	*	*			trans	24.8	109.6	142.8	-165	165.5	-134.1	0	0	119.6
590	S	32.8	Very low	41.7	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	73%	0.73	S	S	*	*			trans	-179.7	39.4	144.8	40.5	0	0	0	0	114.6	V592	S590-V592 PolarHBondContact O-N 2.84Å
591	T	34.9	Very low	43.7	Very low	148 Å²	148	116.5 Å²	116.5	91%	0.908	71%	0.705	S	S	*	*			trans	-73.6	110.1	173.4	47.6	0	0	0	0	111.5
592	V	43.9	Very low	45.9	Very low	112 Å²	112	117.9 Å²	117.9	68%	0.679	69%	0.688	S	S	*	*			trans	-87	132.5	-176.1	177.3	0	0	0	0	112.3	S590 P594	S590-V592 PolarHBondContact O-N 2.84Å; V592-P594 WeakPolarHBondContact O-CD 3.46Å
593	D	42.7	Very low	48.3	Very low	84 Å²	84	114.1 Å²	114.1	45%	0.449	67%	0.668	S	S	.	*			trans	-58.4	114.7	176.4	-67.2	-47.3	0	0	0	113.2	L595 K596	D593-L595 PolarHBondContact O-N 3.34Å; D593-K596 HydrophobicContact CB-CB 4.39Å; D593-K596 HydrophobicContact CB-CD 4.13Å; D593-K596 HydrophobicContact CB-CG 4.24Å; D593-K596 PolarHBondContact O-N 3Å; D593-K596 WeakPolarHBondContact OD2-CE 3.26Å; D593-K596 IonicContact OD2-NZ 2.67Å; D593-K596 PolarHBondContact OD2-NZ 3.48Å
594	P	47	Very low	50.4	Low	102 Å²	102	115.3 Å²	115.3	66%	0.662	66%	0.657	S	S	*	*	H	α-helix	trans	-65.3	-25.9	177	25	-33.4	0	0	0	112.9	V592 K596 Q597	V592-P594 WeakPolarHBondContact O-CD 3.46Å; P594-K596 PolarHBondContact O-N 2.7Å; P594-Q597 PolarHBondContact O-N 2.94Å
595	L	43	Very low	52.5	Low	146 Å²	146	112.9 Å²	112.9	76%	0.764	64%	0.641	S	S	*	*	H	α-helix	trans	-68.3	-31	-180	-80.5	164.3	0	0	0	113.8	D593 Q597	D593-L595 PolarHBondContact O-N 3.34Å; L595-Q597 VanDerWaalsContact C-N 3.33Å
596	K	49.4	Very low	54.8	Low	142 Å²	142	114.2 Å²	114.2	62%	0.617	63%	0.628	S	S	*	*	H	α-helix	trans	-73.3	-25.1	175.6	-73.8	173.4	-177.1	148.2	0	112.4	D593 P594 T599 S600	D593-K596 HydrophobicContact CB-CB 4.39Å; D593-K596 HydrophobicContact CB-CD 4.13Å; D593-K596 HydrophobicContact CB-CG 4.24Å; D593-K596 PolarHBondContact O-N 3Å; D593-K596 WeakPolarHBondContact OD2-CE 3.26Å; D593-K596 IonicContact OD2-NZ 2.67Å; D593-K596 PolarHBondContact OD2-NZ 3.48Å; P594-K596 PolarHBondContact O-N 2.7Å; K596-T599 PolarHBondContact O-OG1 3.44Å; K596-S600 PolarHBondContact O-OG 3.3Å
597	Q	45.6	Very low	57.1	Low	125 Å²	125	113.2 Å²	113.2	58%	0.584	61%	0.607	S	S	*	*	H	α-helix	trans	-73.7	-29.9	176.4	-103.6	175.9	-6	0	0	113.1	P594 L595 S600 S601	P594-Q597 PolarHBondContact O-N 2.94Å; L595-Q597 VanDerWaalsContact C-N 3.33Å; Q597-S600 PolarHBondContact O-OG 3.29Å; Q597-S601 VanDerWaalsContact O-CB 3.32Å; Q597-S601 WeakPolarHBondContact O-CB 3.4Å; Q597-S601 PolarHBondContact O-N 3.13Å; Q597-S601 PolarHBondContact O-OG 3.08Å
598	S	58.4	Low	59.3	Low	79 Å²	79	110.6 Å²	110.6	55%	0.552	59%	0.587	S	S	*	*	H	α-helix	trans	-69.4	-52.8	178.4	-179.8	0	0	0	0	112.5	S600 S601 Y602	S598-S600 PolarHBondContact O-N 3.35Å; S598-S601 PolarHBondContact O-N 2.94Å; S598-S601 VanDerWaalsContact O-N 3.16Å; S598-Y602 PolarHBondContact O-N 3.4Å
599	T	68.4	Low	61.6	Low	88 Å²	88	104.8 Å²	104.8	54%	0.54	56%	0.562	S	S	.	*	H	α-helix	trans	-65.1	-39.8	-176.8	54.6	0	0	0	0	112.8	K596 S601 Y602 L603	K596-T599 PolarHBondContact O-OG1 3.44Å; T599-S601 VanDerWaalsContact C-N 3.31Å; T599-S601 PolarHBondContact O-N 3.37Å; T599-Y602 PolarHBondContact O-N 3.07Å; T599-L603 WeakPolarHBondContact O-CG 3.37Å; T599-L603 PolarHBondContact O-N 3.17Å; T599-L603 VanDerWaalsContact O-N 3.1Å
600	S	70.7	Confident	64.3	Low	65 Å²	65	99.9 Å²	99.9	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-67	-30.7	175.4	54.9	0	0	0	0	112.9	K596 Q597 S598 K604	K596-S600 PolarHBondContact O-OG 3.3Å; Q597-S600 PolarHBondContact O-OG 3.29Å; S598-S600 PolarHBondContact O-N 3.35Å; S600-K604 WeakPolarHBondContact O-CB 3.28Å; S600-K604 PolarHBondContact O-N 2.96Å
601	S	75.3	Confident	66.9	Low	46 Å²	46	95.8 Å²	95.8	32%	0.322	51%	0.507	S	S	.	.	H	α-helix	trans	-72.9	-46.1	173.4	-61.2	0	0	0	0	112.1	Q597 S598 T599 L603 K604 E605	Q597-S601 VanDerWaalsContact O-CB 3.32Å; Q597-S601 WeakPolarHBondContact O-CB 3.4Å; Q597-S601 PolarHBondContact O-N 3.13Å; Q597-S601 PolarHBondContact O-OG 3.08Å; S598-S601 PolarHBondContact O-N 2.94Å; S598-S601 VanDerWaalsContact O-N 3.16Å; T599-S601 VanDerWaalsContact C-N 3.31Å; T599-S601 PolarHBondContact O-N 3.37Å; S601-L603 PolarHBondContact O-N 2.91Å; S601-K604 WeakPolarHBondContact O-CB 3.45Å; S601-K604 PolarHBondContact O-N 3.24Å; S601-E605 WeakPolarHBondContact O-CG 3.45Å; S601-E605 PolarHBondContact O-N 3.48Å
602	Y	80.1	Confident	69.3	Low	137 Å²	137	90.6 Å²	90.6	54%	0.537	47%	0.473	S	S	.	.	H	α-helix	trans	-59.6	-47.8	178	178.1	-98.2	0	0	0	112.7	S598 T599 K604 E605 Q606	S598-Y602 PolarHBondContact O-N 3.4Å; T599-Y602 PolarHBondContact O-N 3.07Å; Y602-K604 VanDerWaalsContact C-N 3.31Å; Y602-K604 PolarHBondContact O-N 3.48Å; Y602-E605 PolarHBondContact O-N 2.85Å; Y602-Q606 HydrophobicContact CD1-CG 4.29Å; Y602-Q606 HydrophobicContact CE1-CG 3.83Å; Y602-Q606 HydrophobicContact CE2-CG 4.31Å; Y602-Q606 WeakPolarHBondContact O-CG 3.33Å; Y602-Q606 PolarHBondContact O-N 3.25Å; Y602-Q606 PolarHBondContact OH-NE2 3.02Å
603	L	80.8	Confident	71.3	Confident	95 Å²	95	85.3 Å²	85.3	50%	0.497	44%	0.441	S	S	.	.	H	α-helix	trans	-61.2	-41.5	178.2	-71.9	174.5	0	0	0	111.8	T599 S601 Q606 F607	T599-L603 WeakPolarHBondContact O-CG 3.37Å; T599-L603 PolarHBondContact O-N 3.17Å; T599-L603 VanDerWaalsContact O-N 3.1Å; S601-L603 PolarHBondContact O-N 2.91Å; L603-Q606 PolarHBondContact O-N 2.88Å; L603-F607 WeakPolarHBondContact O-CD2 3.47Å; L603-F607 PolarHBondContact O-N 3.3Å
604	K	80.7	Confident	73.1	Confident	109 Å²	109	82 Å²	82	47%	0.474	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-37.8	176.8	169.1	-176.6	163.8	-160.4	0	112.6	S600 S601 Y602 Q608	S600-K604 WeakPolarHBondContact O-CB 3.28Å; S600-K604 PolarHBondContact O-N 2.96Å; S601-K604 WeakPolarHBondContact O-CB 3.45Å; S601-K604 PolarHBondContact O-N 3.24Å; Y602-K604 VanDerWaalsContact C-N 3.31Å; Y602-K604 PolarHBondContact O-N 3.48Å; K604-Q608 VanDerWaalsContact O-CB 3.25Å; K604-Q608 WeakPolarHBondContact O-CB 3.47Å; K604-Q608 PolarHBondContact O-N 2.88Å
605	E	80.6	Confident	74.9	Confident	113 Å²	113	82.1 Å²	82.1	53%	0.528	42%	0.419	S	S	.	.	H	α-helix	trans	-65.7	-43.9	172.1	-74.7	174	-169	0	0	111.9	S601 Y602 Q608 A609	S601-E605 WeakPolarHBondContact O-CG 3.45Å; S601-E605 PolarHBondContact O-N 3.48Å; Y602-E605 PolarHBondContact O-N 2.85Å; E605-Q608 PolarHBondContact O-N 2.63Å; E605-A609 WeakPolarHBondContact O-CB 3.48Å; E605-A609 PolarHBondContact O-N 2.64Å
606	Q	82.3	Confident	76.8	Confident	100 Å²	100	79.5 Å²	79.5	47%	0.467	41%	0.406	S	S	.	.	H	α-helix	trans	-61.6	-44.3	175.5	-66	-61.7	-37.8	0	0	112	Y602 L603 A609 F610	Y602-Q606 HydrophobicContact CD1-CG 4.29Å; Y602-Q606 HydrophobicContact CE1-CG 3.83Å; Y602-Q606 HydrophobicContact CE2-CG 4.31Å; Y602-Q606 WeakPolarHBondContact O-CG 3.33Å; Y602-Q606 PolarHBondContact O-N 3.25Å; Y602-Q606 PolarHBondContact OH-NE2 3.02Å; L603-Q606 PolarHBondContact O-N 2.88Å; Q606-A609 PolarHBondContact O-N 2.98Å; Q606-F610 WeakPolarHBondContact O-CB 3.21Å; Q606-F610 PolarHBondContact O-N 3.4Å
607	F	82.4	Confident	78.4	Confident	108 Å²	108	81.6 Å²	81.6	47%	0.474	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-43	173.2	-76.3	-62.2	0	0	0	112.1	L603 A609 F610 F611	L603-F607 WeakPolarHBondContact O-CD2 3.47Å; L603-F607 PolarHBondContact O-N 3.3Å; F607-A609 VanDerWaalsContact C-N 3.28Å; F607-A609 PolarHBondContact O-N 3Å; F607-F610 PolarHBondContact O-N 2.97Å; F607-F610 VanDerWaalsContact O-N 3.12Å; F607-F611 HydrophobicContact CB-CE2 4.27Å; F607-F611 WeakPolarHBondContact O-CD2 3.39Å; F607-F611 WeakPolarHBondContact O-CG 3.41Å; F607-F611 PolarHBondContact O-N 3.21Å
608	Q	81.4	Confident	79.8	Confident	70 Å²	70	80.9 Å²	80.9	33%	0.327	42%	0.415	S	S	.	.	H	α-helix	trans	-65.5	-29.7	177.1	-174.7	171.9	-31.4	0	0	112.8	K604 E605 Q612	K604-Q608 VanDerWaalsContact O-CB 3.25Å; K604-Q608 WeakPolarHBondContact O-CB 3.47Å; K604-Q608 PolarHBondContact O-N 2.88Å; E605-Q608 PolarHBondContact O-N 2.63Å; Q608-Q612 WeakPolarHBondContact O-CG 3.41Å; Q608-Q612 PolarHBondContact O-NE2 2.75Å
609	A	82.8	Confident	80.8	Confident	49 Å²	49	77.4 Å²	77.4	41%	0.405	39%	0.391	S	S	.	.	H	α-helix	trans	-74	-35.9	170.1	0	0	0	0	0	112.2	E605 Q606 F607 F611 Q612	E605-A609 WeakPolarHBondContact O-CB 3.48Å; E605-A609 PolarHBondContact O-N 2.64Å; Q606-A609 PolarHBondContact O-N 2.98Å; F607-A609 VanDerWaalsContact C-N 3.28Å; F607-A609 PolarHBondContact O-N 3Å; A609-F611 VanDerWaalsContact C-N 3.31Å; A609-F611 PolarHBondContact O-N 3.02Å; A609-Q612 WeakPolarHBondContact O-CB 3.47Å; A609-Q612 PolarHBondContact O-N 2.91Å; A609-Q612 VanDerWaalsContact O-N 3.14Å
610	F	87.4	Confident	81.2	Confident	72 Å²	72	76.9 Å²	76.9	32%	0.316	38%	0.383	S	S	.	.	H	α-helix	trans	-68.1	-29.6	178.4	-166.5	-134	0	0	0	113.2	Q606 F607 N649 F650 Y653	Q606-F610 WeakPolarHBondContact O-CB 3.21Å; Q606-F610 PolarHBondContact O-N 3.4Å; F607-F610 PolarHBondContact O-N 2.97Å; F607-F610 VanDerWaalsContact O-N 3.12Å; F610-N649 HydrophobicContact CD2-CB 3.72Å; F610-N649 HydrophobicContact CE2-CB 3.62Å; F610-F650 HydrophobicContact CD1-CB 3.68Å; F610-F650 AromaticContact CD1-CD2 3.75Å; F610-F650 HydrophobicContact CD1-CD2 3.75Å; F610-F650 HydrophobicContact CD1-CG 4.22Å; F610-F650 HydrophobicContact CE1-CB 3.83Å; F610-F650 AromaticContact CE1-CD2 3.64Å; F610-F650 HydrophobicContact CE1-CD2 3.64Å; F610-F650 HydrophobicContact CE1-CG 4.21Å; F610-F650 HydrophobicContact CG-CB 4.14Å; F610-F650 HydrophobicContact CZ-CB 4.4Å; F610-F650 WeakPolarHBondContact O-CB 3.42Å; F610-F650 PolarHBondContact O-N 2.95Å; F610-Y653 AromaticContact CE2-CD2 3.9Å; F610-Y653 HydrophobicContact CE2-CD2 3.9Å; F610-Y653 HydrophobicContact CE2-CE2 4.29Å; F610-Y653 AromaticContact CZ-CD2 3.81Å; F610-Y653 HydrophobicContact CZ-CD2 3.81Å
611	F	87.5	Confident	81.7	Confident	22 Å²	22	79.9 Å²	79.9	10%	0.096	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.9	171.6	-60.8	-48.2	0	0	0	114.7	F607 A609 Q636 W642 I644 H645 S648 F650	F607-F611 HydrophobicContact CB-CE2 4.27Å; F607-F611 WeakPolarHBondContact O-CD2 3.39Å; F607-F611 WeakPolarHBondContact O-CG 3.41Å; F607-F611 PolarHBondContact O-N 3.21Å; A609-F611 VanDerWaalsContact C-N 3.31Å; A609-F611 PolarHBondContact O-N 3.02Å; F611-Q636 PolarHBondContact O-NE2 2.86Å; F611-W642 AromaticContact CE2-CE3 3.58Å; F611-W642 HydrophobicContact CE2-CE3 3.58Å; F611-W642 AromaticContact CE2-CZ3 3.69Å; F611-W642 HydrophobicContact CE2-CZ3 3.69Å; F611-W642 HydrophobicContact CZ-CE3 4.06Å; F611-W642 HydrophobicContact CZ-CZ3 4.07Å; F611-I644 HydrophobicContact CD1-CB 4.49Å; F611-I644 HydrophobicContact CD1-CD1 4.3Å; F611-I644 HydrophobicContact CD1-CG1 3.74Å; F611-I644 HydrophobicContact CD1-CG2 4.33Å; F611-I644 HydrophobicContact CE1-CD1 4.17Å; F611-I644 HydrophobicContact CE1-CG1 4.05Å; F611-I644 HydrophobicContact CG-CG1 4.3Å; F611-H645 PolarHBondContact O-N 2.97Å; F611-S648 VanDerWaalsContact C-CB 3.48Å; F611-S648 WeakPolarHBondContact O-CB 3.25Å; F611-F650 HydrophobicContact CD1-CB 3.69Å; F611-F650 AromaticContact CD1-CD1 3.93Å; F611-F650 HydrophobicContact CD1-CD1 3.93Å; F611-F650 HydrophobicContact CD1-CD2 4.07Å; F611-F650 AromaticContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CE1-CB 4.11Å; F611-F650 AromaticContact CE1-CD1 3.83Å; F611-F650 HydrophobicContact CE1-CD1 3.83Å; F611-F650 AromaticContact CE1-CD2 3.55Å; F611-F650 HydrophobicContact CE1-CD2 3.55Å; F611-F650 HydrophobicContact CE1-CE1 4.17Å; F611-F650 AromaticContact CE1-CE2 3.91Å; F611-F650 HydrophobicContact CE1-CE2 3.91Å; F611-F650 AromaticContact CE1-CG 3.52Å; F611-F650 HydrophobicContact CE1-CG 3.52Å; F611-F650 HydrophobicContact CE1-CZ 4.21Å
612	Q	85.6	Confident	81.9	Confident	38 Å²	38	81.1 Å²	81.1	18%	0.178	39%	0.391	C	S	.	.	S	Bend	trans	-80.6	156.4	179.1	-83.2	168.6	62	0	0	112.7	Q608 A609 S614 K633 S648	Q608-Q612 WeakPolarHBondContact O-CG 3.41Å; Q608-Q612 PolarHBondContact O-NE2 2.75Å; A609-Q612 WeakPolarHBondContact O-CB 3.47Å; A609-Q612 PolarHBondContact O-N 2.91Å; A609-Q612 VanDerWaalsContact O-N 3.14Å; Q612-S614 PolarHBondContact O-N 3.01Å; Q612-K633 HydrophobicContact CB-CG 4.41Å; Q612-K633 HydrophobicContact CG-CG 4.47Å; Q612-S648 VanDerWaalsContact O-CA 3.24Å; Q612-S648 WeakPolarHBondContact O-CA 3.31Å; Q612-S648 WeakPolarHBondContact O-CB 3.45Å
613	P	84.7	Confident	82	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.013	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-59.2	133.5	172.3	25.1	-34.1	0	0	0	110.9	F623 L629 E632 K633 C647	P613-F623 HydrophobicContact CB-CE2 4.45Å; P613-L629 HydrophobicContact CB-CD1 3.71Å; P613-L629 HydrophobicContact CG-CD1 3.73Å; P613-E632 HydrophobicContact CG-CG 4.38Å; P613-K633 HydrophobicContact CG-CG 3.7Å; P613-K633 WeakPolarHBondContact O-CE 3.18Å; P613-C647 WeakPolarHBondContact CA-O 3.46Å
614	S	82.2	Confident	82.1	Confident	14 Å²	14	74.6 Å²	74.6	10%	0.098	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-79.4	142.2	-172.4	-165.2	0	0	0	0	112.4	Q612 N616 A619 C647 N649	Q612-S614 PolarHBondContact O-N 3.01Å; S614-N616 PolarHBondContact O-N 2.83Å; S614-N616 PolarHBondContact OG-ND2 3.11Å; S614-N616 VanDerWaalsContact OG-ND2 3.11Å; S614-A619 WeakPolarHBondContact O-CB 3.4Å; S614-C647 PolarHBondContact N-O 3.41Å; S614-N649 WeakPolarHBondContact CB-OD1 3.25Å; S614-N649 PolarHBondContact OG-ND2 3.05Å; S614-N649 PolarHBondContact OG-OD1 3.26Å
615	D	83	Confident	82.3	Confident	105 Å²	105	72 Å²	72	56%	0.561	37%	0.374	S	S	*	.			trans	-75.3	36.6	179.8	-57.6	-64.4	0	0	0	113.8	L629 K633	D615-L629 VanDerWaalsContact OD1-CD2 3.3Å; D615-L629 WeakPolarHBondContact OD1-CD2 3.24Å; D615-K633 IonicContact OD1-NZ 3.16Å; D615-K633 PolarHBondContact OD1-NZ 2.69Å; D615-K633 IonicContact OD2-NZ 3.03Å; D615-K633 PolarHBondContact OD2-NZ 3.35Å
616	N	83.6	Confident	82.6	Confident	90 Å²	90	73.2 Å²	73.2	48%	0.481	38%	0.378	S	S	.	.	S	Bend	trans	-81.3	158	-179.3	-76.4	-32.8	0	0	0	112	S614 L618 A619 M620	S614-N616 PolarHBondContact O-N 2.83Å; S614-N616 PolarHBondContact OG-ND2 3.11Å; S614-N616 VanDerWaalsContact OG-ND2 3.11Å; N616-L618 PolarHBondContact O-N 2.69Å; N616-A619 PolarHBondContact O-N 2.6Å; N616-M620 PolarHBondContact O-N 3.37Å
617	K	82.6	Confident	82.8	Confident	186 Å²	186	74.3 Å²	74.3	81%	0.809	39%	0.387	S	S	*	.	H	α-helix	trans	-52	-29.7	172.3	-68.6	-171.2	177.6	-173.7	0	113.4	K621	K617-K621 PolarHBondContact O-N 2.91Å
618	L	75.1	Confident	82.9	Confident	110 Å²	110	70.7 Å²	70.7	58%	0.576	38%	0.377	S	S	*	.	H	α-helix	trans	-66.6	-45	175	-176.4	64.6	0	0	0	112.3	F447 N616 M620 K621 L622	F447-L618 HydrophobicContact CE1-CD1 4.31Å; F447-L618 HydrophobicContact CE2-CD1 4.1Å; F447-L618 HydrophobicContact CZ-CD1 3.69Å; N616-L618 PolarHBondContact O-N 2.69Å; L618-M620 VanDerWaalsContact C-N 3.35Å; L618-K621 PolarHBondContact O-N 2.83Å; L618-L622 WeakPolarHBondContact O-CB 3.42Å; L618-L622 PolarHBondContact O-N 2.81Å
619	A	79.6	Confident	83.1	Confident	6 Å²	6	67.4 Å²	67.4	5%	0.05	36%	0.362	C	S	.	.	H	α-helix	trans	-69.6	-33.8	176.9	0	0	0	0	0	111.8	S614 N616 K621 L622 F623 L629	S614-A619 WeakPolarHBondContact O-CB 3.4Å; N616-A619 PolarHBondContact O-N 2.6Å; A619-K621 VanDerWaalsContact C-N 3.33Å; A619-L622 PolarHBondContact O-N 3Å; A619-F623 HydrophobicContact CB-CD2 4.28Å; A619-F623 HydrophobicContact CB-CE2 4.44Å; A619-F623 WeakPolarHBondContact O-CD2 3.27Å; A619-F623 PolarHBondContact O-N 3.12Å; A619-L629 HydrophobicContact CB-CD1 4.35Å; A619-L629 HydrophobicContact CB-CD2 4.1Å
620	M	77.4	Confident	83.3	Confident	78 Å²	78	69 Å²	69	38%	0.384	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-36.9	170.4	-73.2	-171.3	67	0	0	112.5	N616 L618 G624 K626	N616-M620 PolarHBondContact O-N 3.37Å; L618-M620 VanDerWaalsContact C-N 3.35Å; M620-G624 CarbonylContact O-C 3.45Å; M620-G624 WeakPolarHBondContact O-CA 3.41Å; M620-G624 PolarHBondContact O-N 2.83Å; M620-K626 HydrophobicContact CE-CG 4.34Å
621	K	81.4	Confident	83.3	Confident	127 Å²	127	72.8 Å²	72.8	55%	0.552	38%	0.379	S	S	*	.	H	α-helix	trans	-67.6	-38.3	170.3	-78.7	-168.8	169.2	-162.2	0	112.7	F445 F447 K617 L618 A619	F445-K621 VanDerWaalsContact CE1-NZ 3.33Å; F447-K621 HydrophobicContact CE2-CD 3.99Å; F447-K621 HydrophobicContact CZ-CD 4.17Å; K617-K621 PolarHBondContact O-N 2.91Å; L618-K621 PolarHBondContact O-N 2.83Å; A619-K621 VanDerWaalsContact C-N 3.33Å
622	L	79.4	Confident	83.2	Confident	73 Å²	73	72.6 Å²	72.6	38%	0.382	38%	0.378	S	S	.	.	H	α-helix	trans	-73	-39.4	-175.5	-164.5	72.8	0	0	0	113.3	L618 A619 C647 A713	L618-L622 WeakPolarHBondContact O-CB 3.42Å; L618-L622 PolarHBondContact O-N 2.81Å; A619-L622 PolarHBondContact O-N 3Å; L622-C647 WeakPolarHBondContact CD2-SG 3.25Å; L622-A713 HydrophobicContact CD1-CB 3.6Å; L622-A713 HydrophobicContact CD2-CB 4.33Å; L622-A713 HydrophobicContact CG-CB 3.62Å
623	F	82.4	Confident	83.2	Confident	33 Å²	33	72.2 Å²	72.2	15%	0.145	38%	0.376	C	S	.	.	H	α-helix	trans	-106.4	1.1	-177.8	-59	-67.4	0	0	0	113.6	P613 A619 S625 A628 L629 E632 H645 I716	P613-F623 HydrophobicContact CB-CE2 4.45Å; A619-F623 HydrophobicContact CB-CD2 4.28Å; A619-F623 HydrophobicContact CB-CE2 4.44Å; A619-F623 WeakPolarHBondContact O-CD2 3.27Å; A619-F623 PolarHBondContact O-N 3.12Å; F623-S625 PolarHBondContact O-N 3.03Å; F623-A628 HydrophobicContact CB-CB 4.06Å; F623-A628 WeakPolarHBondContact O-CB 3.43Å; F623-L629 HydrophobicContact CB-CB 4.5Å; F623-L629 HydrophobicContact CD2-CB 4.3Å; F623-L629 HydrophobicContact CD2-CD1 3.81Å; F623-L629 HydrophobicContact CE2-CD1 3.89Å; F623-E632 HydrophobicContact CE1-CB 4.35Å; F623-E632 HydrophobicContact CE1-CG 3.99Å; F623-E632 HydrophobicContact CZ-CB 4.42Å; F623-E632 HydrophobicContact CZ-CG 3.85Å; F623-H645 AromaticContact CZ-CE1 3.9Å; F623-H645 AromaticContact CZ-NE2 3.83Å; F623-I716 HydrophobicContact CE1-CD1 3.91Å; F623-I716 HydrophobicContact CZ-CD1 3.81Å
624	G	82.6	Confident	83.3	Confident	61 Å²	61	79.3 Å²	79.3	63%	0.629	40%	0.403	S	S	*	.	S	Bend	trans	69.5	-49.5	-177.3	0	0	0	0	0	115.3	M620	M620-G624 CarbonylContact O-C 3.45Å; M620-G624 WeakPolarHBondContact O-CA 3.41Å; M620-G624 PolarHBondContact O-N 2.83Å
625	S	84.7	Confident	83.4	Confident	55 Å²	55	82 Å²	82	39%	0.385	41%	0.411	S	S	.	.	S	Bend	trans	-130	153.9	-172.7	74.2	0	0	0	0	113.8	F623 N627 A628 L629	F623-S625 PolarHBondContact O-N 3.03Å; S625-N627 PolarHBondContact O-N 2.81Å; S625-A628 PolarHBondContact O-N 3.47Å; S625-A628 WeakPolarHBondContact OG-CB 3.23Å; S625-A628 PolarHBondContact OG-N 2.86Å; S625-A628 VanDerWaalsContact OG-N 3.08Å; S625-L629 PolarHBondContact O-N 3.22Å
626	K	85.7	Confident	83.5	Confident	138 Å²	138	77.4 Å²	77.4	60%	0.6	39%	0.386	S	S	*	.	H	α-helix	trans	-58.9	-33.5	171.2	-68.2	-176.1	178.2	179.9	0	112.1	M620 L629 L630	M620-K626 HydrophobicContact CE-CG 4.34Å; K626-L629 PolarHBondContact O-N 2.82Å; K626-L630 WeakPolarHBondContact O-CB 3.34Å; K626-L630 VanDerWaalsContact O-CG 3.26Å; K626-L630 WeakPolarHBondContact O-CG 3.36Å; K626-L630 PolarHBondContact O-N 3.43Å
627	N	86.8	Confident	83.4	Confident	123 Å²	123	76.6 Å²	76.6	66%	0.658	38%	0.384	S	S	*	.	H	α-helix	trans	-70.4	-35.8	179.4	-70.9	-9	0	0	0	112.3	S625 L630 K631	S625-N627 PolarHBondContact O-N 2.81Å; N627-L630 PolarHBondContact O-N 2.67Å; N627-K631 WeakPolarHBondContact O-CB 3.17Å; N627-K631 PolarHBondContact O-N 3.46Å
628	A	85.7	Confident	83.3	Confident	33 Å²	33	75.2 Å²	75.2	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-67.4	-44.8	171.2	0	0	0	0	0	111.5	F623 S625 L630 K631 E632	F623-A628 HydrophobicContact CB-CB 4.06Å; F623-A628 WeakPolarHBondContact O-CB 3.43Å; S625-A628 PolarHBondContact O-N 3.47Å; S625-A628 WeakPolarHBondContact OG-CB 3.23Å; S625-A628 PolarHBondContact OG-N 2.86Å; S625-A628 VanDerWaalsContact OG-N 3.08Å; A628-L630 VanDerWaalsContact C-N 3.31Å; A628-L630 PolarHBondContact O-N 3.25Å; A628-K631 CarbonylContact O-C 3.44Å; A628-K631 WeakPolarHBondContact O-CA 3.22Å; A628-K631 VanDerWaalsContact O-CB 3.3Å; A628-K631 WeakPolarHBondContact O-CB 3.22Å; A628-K631 PolarHBondContact O-N 2.97Å; A628-E632 PolarHBondContact O-N 3.25Å
629	L	85.4	Confident	83.2	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-60.1	-38.6	173.6	177.2	56.2	0	0	0	112.5	P613 D615 A619 F623 S625 K626 E632 K633	P613-L629 HydrophobicContact CB-CD1 3.71Å; P613-L629 HydrophobicContact CG-CD1 3.73Å; D615-L629 VanDerWaalsContact OD1-CD2 3.3Å; D615-L629 WeakPolarHBondContact OD1-CD2 3.24Å; A619-L629 HydrophobicContact CB-CD1 4.35Å; A619-L629 HydrophobicContact CB-CD2 4.1Å; F623-L629 HydrophobicContact CB-CB 4.5Å; F623-L629 HydrophobicContact CD2-CB 4.3Å; F623-L629 HydrophobicContact CD2-CD1 3.81Å; F623-L629 HydrophobicContact CE2-CD1 3.89Å; S625-L629 PolarHBondContact O-N 3.22Å; K626-L629 PolarHBondContact O-N 2.82Å; L629-E632 PolarHBondContact O-N 3.22Å; L629-K633 WeakPolarHBondContact O-CG 3.45Å; L629-K633 PolarHBondContact O-N 2.96Å
630	L	86.3	Confident	82.5	Confident	82 Å²	82	74 Å²	74	43%	0.429	38%	0.38	S	S	.	.	H	α-helix	trans	-72	-26.9	173.2	-72.9	167.7	0	0	0	113.2	K626 N627 A628 K633 R634	K626-L630 WeakPolarHBondContact O-CB 3.34Å; K626-L630 VanDerWaalsContact O-CG 3.26Å; K626-L630 WeakPolarHBondContact O-CG 3.36Å; K626-L630 PolarHBondContact O-N 3.43Å; N627-L630 PolarHBondContact O-N 2.67Å; A628-L630 VanDerWaalsContact C-N 3.31Å; A628-L630 PolarHBondContact O-N 3.25Å; L630-K633 HydrophobicContact CD2-CD 4.42Å; L630-R634 WeakPolarHBondContact O-CG 3.49Å; L630-R634 PolarHBondContact O-N 3.45Å; L630-R634 PolarHBondContact O-NE 3.05Å
631	K	87.1	Confident	82.1	Confident	152 Å²	152	77.5 Å²	77.5	66%	0.661	39%	0.392	S	S	*	.	H	α-helix	trans	-67.8	-40.7	168.1	-174.7	-173.1	177	-170.1	0	109.9	N627 A628 R634 R635	N627-K631 WeakPolarHBondContact O-CB 3.17Å; N627-K631 PolarHBondContact O-N 3.46Å; A628-K631 CarbonylContact O-C 3.44Å; A628-K631 WeakPolarHBondContact O-CA 3.22Å; A628-K631 VanDerWaalsContact O-CB 3.3Å; A628-K631 WeakPolarHBondContact O-CB 3.22Å; A628-K631 PolarHBondContact O-N 2.97Å; K631-R634 PolarHBondContact O-N 2.99Å; K631-R635 PolarHBondContact O-N 3.13Å
632	E	85.6	Confident	82	Confident	17 Å²	17	79.2 Å²	79.2	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-69.3	-45.5	179.8	-174.2	57.7	-163.4	0	0	113.3	P613 F623 A628 L629 R634 R635 Q636 H645 L718	P613-E632 HydrophobicContact CG-CG 4.38Å; F623-E632 HydrophobicContact CE1-CB 4.35Å; F623-E632 HydrophobicContact CE1-CG 3.99Å; F623-E632 HydrophobicContact CZ-CB 4.42Å; F623-E632 HydrophobicContact CZ-CG 3.85Å; A628-E632 PolarHBondContact O-N 3.25Å; L629-E632 PolarHBondContact O-N 3.22Å; E632-R634 PolarHBondContact O-N 3.04Å; E632-R635 VanDerWaalsContact CD-NH2 3.27Å; E632-R635 WeakPolarHBondContact O-CB 3.48Å; E632-R635 PolarHBondContact O-N 3.12Å; E632-R635 IonicContact OE1-CZ 2.67Å; E632-R635 IonicContact OE1-NE 2.69Å; E632-R635 IonicContact OE1-NH2 2.64Å; E632-R635 PolarHBondContact OE1-NH2 3Å; E632-R635 IonicContact OE2-CZ 3.48Å; E632-R635 VanDerWaalsContact OE2-CZ 3.28Å; E632-R635 IonicContact OE2-NE 3.12Å; E632-R635 PolarHBondContact OE2-NE 3.45Å; E632-R635 IonicContact OE2-NH2 3.46Å; E632-R635 PolarHBondContact OE2-NH2 3.32Å; E632-Q636 PolarHBondContact O-N 3.44Å; E632-H645 IonicContact OE1-CD2 2.63Å; E632-H645 IonicContact OE1-NE2 3.33Å; E632-H645 PolarHBondContact OE1-NE2 3.04Å; E632-L718 VanDerWaalsContact OE1-CD1 3.31Å; E632-L718 WeakPolarHBondContact OE1-CD1 3.39Å
633	K	86.7	Confident	82.4	Confident	31 Å²	31	76 Å²	76	14%	0.135	38%	0.379	C	S	.	.	H	α-helix	trans	-52.8	-43.6	171	-74.4	177.5	170.8	175.6	0	111.8	Q612 P613 D615 L629 L630 V637	Q612-K633 HydrophobicContact CB-CG 4.41Å; Q612-K633 HydrophobicContact CG-CG 4.47Å; P613-K633 HydrophobicContact CG-CG 3.7Å; P613-K633 WeakPolarHBondContact O-CE 3.18Å; D615-K633 IonicContact OD1-NZ 3.16Å; D615-K633 PolarHBondContact OD1-NZ 2.69Å; D615-K633 IonicContact OD2-NZ 3.03Å; D615-K633 PolarHBondContact OD2-NZ 3.35Å; L629-K633 WeakPolarHBondContact O-CG 3.45Å; L629-K633 PolarHBondContact O-N 2.96Å; L630-K633 HydrophobicContact CD2-CD 4.42Å; K633-V637 WeakPolarHBondContact O-CG2 3.27Å; K633-V637 PolarHBondContact O-N 3.02Å; K633-V637 VanDerWaalsContact O-N 3.09Å
634	R	85.8	Confident	82.8	Confident	151 Å²	151	75 Å²	75	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-65.9	-41.7	175.2	-75.3	178	-71.5	171.6	-2.1	112.4	L630 K631 E632 Q636 V637 Q638	L630-R634 WeakPolarHBondContact O-CG 3.49Å; L630-R634 PolarHBondContact O-N 3.45Å; L630-R634 PolarHBondContact O-NE 3.05Å; K631-R634 PolarHBondContact O-N 2.99Å; E632-R634 PolarHBondContact O-N 3.04Å; R634-Q636 VanDerWaalsContact C-N 3.34Å; R634-Q636 PolarHBondContact O-N 3.46Å; R634-V637 PolarHBondContact O-N 3.43Å; R634-Q638 WeakPolarHBondContact O-CB 3.33Å; R634-Q638 VanDerWaalsContact O-CG 3.27Å; R634-Q638 WeakPolarHBondContact O-CG 3.35Å; R634-Q638 PolarHBondContact O-N 3.2Å
635	R	85.3	Confident	83.2	Confident	70 Å²	70	72 Å²	72	26%	0.264	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-42.2	176.7	-167.8	171.4	71.2	113.3	13	111.9	K631 E632 Q638 Q639 I716 L718	K631-R635 PolarHBondContact O-N 3.13Å; E632-R635 VanDerWaalsContact CD-NH2 3.27Å; E632-R635 WeakPolarHBondContact O-CB 3.48Å; E632-R635 PolarHBondContact O-N 3.12Å; E632-R635 IonicContact OE1-CZ 2.67Å; E632-R635 IonicContact OE1-NE 2.69Å; E632-R635 IonicContact OE1-NH2 2.64Å; E632-R635 PolarHBondContact OE1-NH2 3Å; E632-R635 IonicContact OE2-CZ 3.48Å; E632-R635 VanDerWaalsContact OE2-CZ 3.28Å; E632-R635 IonicContact OE2-NE 3.12Å; E632-R635 PolarHBondContact OE2-NE 3.45Å; E632-R635 IonicContact OE2-NH2 3.46Å; E632-R635 PolarHBondContact OE2-NH2 3.32Å; R635-Q638 PolarHBondContact O-N 2.94Å; R635-Q639 WeakPolarHBondContact O-CG 3.2Å; R635-Q639 PolarHBondContact O-N 3.03Å; R635-I716 VanDerWaalsContact CZ-O 3.29Å; R635-I716 PolarHBondContact NH1-O 2.99Å; R635-I716 PolarHBondContact NH2-O 2.87Å; R635-L718 HydrophobicContact CG-CD1 4.46Å
636	Q	83.3	Confident	83.3	Confident	9 Å²	9	70.9 Å²	70.9	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-48.7	173.7	-176.4	-172.7	1.8	0	0	112.5	F611 E632 R634 Q638 Q639 V643 L718	F611-Q636 PolarHBondContact O-NE2 2.86Å; E632-Q636 PolarHBondContact O-N 3.44Å; R634-Q636 VanDerWaalsContact C-N 3.34Å; R634-Q636 PolarHBondContact O-N 3.46Å; Q636-Q638 PolarHBondContact O-N 2.85Å; Q636-Q639 PolarHBondContact O-N 3.43Å; Q636-Q639 VanDerWaalsContact O-N 3.15Å; Q636-V643 PolarHBondContact NE2-O 3.45Å; Q636-L718 HydrophobicContact CB-CD1 4.06Å; Q636-L718 HydrophobicContact CG-CD2 4.46Å
637	V	82.3	Confident	83.3	Confident	72 Å²	72	66.4 Å²	66.4	44%	0.436	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-33.7	179.4	171.6	0	0	0	0	111.7	K633 R634	K633-V637 WeakPolarHBondContact O-CG2 3.27Å; K633-V637 PolarHBondContact O-N 3.02Å; K633-V637 VanDerWaalsContact O-N 3.09Å; R634-V637 PolarHBondContact O-N 3.43Å
638	Q	80.8	Confident	83.3	Confident	157 Å²	157	60.6 Å²	60.6	73%	0.734	29%	0.291	S	S	*	.	H	α-helix	trans	-69.8	-35	175.8	-74.2	169.7	-13.8	0	0	113.9	R634 R635 Q636 G640	R634-Q638 WeakPolarHBondContact O-CB 3.33Å; R634-Q638 VanDerWaalsContact O-CG 3.27Å; R634-Q638 WeakPolarHBondContact O-CG 3.35Å; R634-Q638 PolarHBondContact O-N 3.2Å; R635-Q638 PolarHBondContact O-N 2.94Å; Q636-Q638 PolarHBondContact O-N 2.85Å; Q638-G640 VanDerWaalsContact C-N 3.31Å; Q638-G640 PolarHBondContact O-N 2.9Å
639	Q	72.3	Confident	83.5	Confident	60 Å²	60	61.5 Å²	61.5	28%	0.28	29%	0.291	S	S	.	.	H	α-helix	trans	-80.5	-7.8	-175.4	-70.9	-169.3	27.8	0	0	114.7	R635 Q636 L718 N719	R635-Q639 WeakPolarHBondContact O-CG 3.2Å; R635-Q639 PolarHBondContact O-N 3.03Å; Q636-Q639 PolarHBondContact O-N 3.43Å; Q636-Q639 VanDerWaalsContact O-N 3.15Å; Q639-L718 PolarHBondContact OE1-O 3.37Å; Q639-N719 VanDerWaalsContact OE1-N 3.08Å; Q639-N719 PolarHBondContact OE1-OD1 2.94Å
640	G	65.7	Low	83.8	Confident	32 Å²	32	63.2 Å²	63.2	33%	0.33	30%	0.298	S	S	.	.			trans	131.8	163.3	162.1	0	0	0	0	0	115.1	Q638	Q638-G640 VanDerWaalsContact C-N 3.31Å; Q638-G640 PolarHBondContact O-N 2.9Å
641	K	68.8	Low	84	Confident	150 Å²	150	61 Å²	61	65%	0.652	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	136.1	178.6	-69.4	162.8	-178.4	159.7	0	110
642	W	79.4	Confident	84.1	Confident	164 Å²	164	60.2 Å²	60.2	62%	0.621	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	36.8	-179.6	-44.6	95.6	0	0	0	116.2	F611 R704	F611-W642 AromaticContact CE2-CE3 3.58Å; F611-W642 HydrophobicContact CE2-CE3 3.58Å; F611-W642 AromaticContact CE2-CZ3 3.69Å; F611-W642 HydrophobicContact CE2-CZ3 3.69Å; F611-W642 HydrophobicContact CZ-CE3 4.06Å; F611-W642 HydrophobicContact CZ-CZ3 4.07Å; W642-R704 WeakPolarHBondContact O-CD 3.43Å
643	V	88.6	Confident	84.4	Confident	6 Å²	6	65.7 Å²	65.7	4%	0.036	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-95.8	132.4	157.9	-177.5	0	0	0	0	109.2	Q636 L718 P720	Q636-V643 PolarHBondContact NE2-O 3.45Å; V643-L718 HydrophobicContact CG1-CB 4.41Å; V643-L718 HydrophobicContact CG1-CD2 3.83Å; V643-P720 HydrophobicContact CG2-CG 3.77Å
644	I	90.9	Very high	84.6	Confident	10 Å²	10	66.2 Å²	66.2	5%	0.051	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-101.1	120.3	-178.2	-56.5	172	0	0	0	108.2	F611 F650 R651 V701 R704 T705 G706	F611-I644 HydrophobicContact CD1-CB 4.49Å; F611-I644 HydrophobicContact CD1-CD1 4.3Å; F611-I644 HydrophobicContact CD1-CG1 3.74Å; F611-I644 HydrophobicContact CD1-CG2 4.33Å; F611-I644 HydrophobicContact CE1-CD1 4.17Å; F611-I644 HydrophobicContact CE1-CG1 4.05Å; F611-I644 HydrophobicContact CG-CG1 4.3Å; I644-F650 HydrophobicContact CD1-CD1 4.02Å; I644-F650 HydrophobicContact CD1-CE1 3.79Å; I644-F650 HydrophobicContact CG2-CD1 3.92Å; I644-R651 HydrophobicContact CG2-CB 4.23Å; I644-V701 HydrophobicContact CD1-CG1 3.99Å; I644-R704 HydrophobicContact CD1-CB 4.13Å; I644-R704 HydrophobicContact CG1-CB 4.28Å; I644-R704 PolarHBondContact N-O 2.91Å; I644-T705 WeakPolarHBondContact O-CA 3.22Å; I644-G706 PolarHBondContact O-N 3.06Å
645	H	89.7	Confident	84.8	Confident	0 Å²	0	62 Å²	62	0%	0	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-73.3	138.4	175.6	-173	-77.4	0	0	0	110	F611 F623 E632 C647 S648 I716	F611-H645 PolarHBondContact O-N 2.97Å; F623-H645 AromaticContact CZ-CE1 3.9Å; F623-H645 AromaticContact CZ-NE2 3.83Å; E632-H645 IonicContact OE1-CD2 2.63Å; E632-H645 IonicContact OE1-NE2 3.33Å; E632-H645 PolarHBondContact OE1-NE2 3.04Å; H645-C647 VanDerWaalsContact C-N 3.33Å; H645-C647 PolarHBondContact ND1-N 3.36Å; H645-C647 PolarHBondContact O-N 2.86Å; H645-S648 WeakPolarHBondContact O-CB 3.39Å; H645-S648 PolarHBondContact O-N 2.86Å; H645-S648 PolarHBondContact O-OG 2.92Å; H645-I716 WeakPolarHBondContact NE2-CD1 3.35Å
646	P	87	Confident	85	Confident	31 Å²	31	62.8 Å²	62.8	20%	0.201	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-42.2	-178.2	20	-31.5	0	0	0	112.5	S648 R651 G706 V708 I716	P646-S648 PolarHBondContact O-N 2.85Å; P646-S648 VanDerWaalsContact O-N 3.16Å; P646-R651 WeakPolarHBondContact O-CB 3.5Å; P646-R651 WeakPolarHBondContact O-CG 3.45Å; P646-G706 WeakPolarHBondContact CB-O 3.23Å; P646-G706 WeakPolarHBondContact CG-O 3.25Å; P646-V708 HydrophobicContact CB-CG2 4.42Å; P646-V708 HydrophobicContact CG-CG2 3.93Å; P646-I716 HydrophobicContact CG-CG2 3.91Å
647	C	85.1	Confident	85.3	Confident	43 Å²	43	66.3 Å²	66.3	29%	0.291	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	24.9	175.4	-42.1	0	0	0	0	114.6	P613 S614 L622 H645	P613-C647 WeakPolarHBondContact CA-O 3.46Å; S614-C647 PolarHBondContact N-O 3.41Å; L622-C647 WeakPolarHBondContact CD2-SG 3.25Å; H645-C647 VanDerWaalsContact C-N 3.33Å; H645-C647 PolarHBondContact ND1-N 3.36Å; H645-C647 PolarHBondContact O-N 2.86Å
648	S	88.2	Confident	85.4	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.014	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-82.6	156.9	177.9	64.1	0	0	0	0	112.9	F611 Q612 H645 P646 F650 R651 F652	F611-S648 VanDerWaalsContact C-CB 3.48Å; F611-S648 WeakPolarHBondContact O-CB 3.25Å; Q612-S648 VanDerWaalsContact O-CA 3.24Å; Q612-S648 WeakPolarHBondContact O-CA 3.31Å; Q612-S648 WeakPolarHBondContact O-CB 3.45Å; H645-S648 WeakPolarHBondContact O-CB 3.39Å; H645-S648 PolarHBondContact O-N 2.86Å; H645-S648 PolarHBondContact O-OG 2.92Å; P646-S648 PolarHBondContact O-N 2.85Å; P646-S648 VanDerWaalsContact O-N 3.16Å; S648-F650 VanDerWaalsContact C-N 3.33Å; S648-R651 PolarHBondContact O-N 2.84Å; S648-R651 WeakPolarHBondContact OG-CB 3.38Å; S648-R651 PolarHBondContact OG-N 2.84Å; S648-R651 VanDerWaalsContact OG-N 3.14Å; S648-F652 PolarHBondContact O-N 3.23Å
649	N	88.7	Confident	85.5	Confident	51 Å²	51	60.2 Å²	60.2	27%	0.273	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-40.9	173	-71.2	-35.3	0	0	0	110.8	F610 S614 R651 F652 Y653	F610-N649 HydrophobicContact CD2-CB 3.72Å; F610-N649 HydrophobicContact CE2-CB 3.62Å; S614-N649 WeakPolarHBondContact CB-OD1 3.25Å; S614-N649 PolarHBondContact OG-ND2 3.05Å; S614-N649 PolarHBondContact OG-OD1 3.26Å; N649-R651 PolarHBondContact O-N 2.94Å; N649-F652 PolarHBondContact O-N 3.44Å; N649-Y653 HydrophobicContact CB-CD2 4.47Å; N649-Y653 HydrophobicContact CB-CE2 4.42Å; N649-Y653 WeakPolarHBondContact O-CD2 3.44Å; N649-Y653 PolarHBondContact O-N 2.9Å
650	F	91.6	Very high	86.1	Confident	37 Å²	37	62.9 Å²	62.9	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-53.5	-52.5	174.2	177.4	-88.4	0	0	0	111.6	F610 F611 I644 S648 F652 Y653 W654 V701	F610-F650 HydrophobicContact CD1-CB 3.68Å; F610-F650 AromaticContact CD1-CD2 3.75Å; F610-F650 HydrophobicContact CD1-CD2 3.75Å; F610-F650 HydrophobicContact CD1-CG 4.22Å; F610-F650 HydrophobicContact CE1-CB 3.83Å; F610-F650 AromaticContact CE1-CD2 3.64Å; F610-F650 HydrophobicContact CE1-CD2 3.64Å; F610-F650 HydrophobicContact CE1-CG 4.21Å; F610-F650 HydrophobicContact CG-CB 4.14Å; F610-F650 HydrophobicContact CZ-CB 4.4Å; F610-F650 WeakPolarHBondContact O-CB 3.42Å; F610-F650 PolarHBondContact O-N 2.95Å; F611-F650 HydrophobicContact CD1-CB 3.69Å; F611-F650 AromaticContact CD1-CD1 3.93Å; F611-F650 HydrophobicContact CD1-CD1 3.93Å; F611-F650 HydrophobicContact CD1-CD2 4.07Å; F611-F650 AromaticContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CD1-CG 3.6Å; F611-F650 HydrophobicContact CE1-CB 4.11Å; F611-F650 AromaticContact CE1-CD1 3.83Å; F611-F650 HydrophobicContact CE1-CD1 3.83Å; F611-F650 AromaticContact CE1-CD2 3.55Å; F611-F650 HydrophobicContact CE1-CD2 3.55Å; F611-F650 HydrophobicContact CE1-CE1 4.17Å; F611-F650 AromaticContact CE1-CE2 3.91Å; F611-F650 HydrophobicContact CE1-CE2 3.91Å; F611-F650 AromaticContact CE1-CG 3.52Å; F611-F650 HydrophobicContact CE1-CG 3.52Å; F611-F650 HydrophobicContact CE1-CZ 4.21Å; I644-F650 HydrophobicContact CD1-CD1 4.02Å; I644-F650 HydrophobicContact CD1-CE1 3.79Å; I644-F650 HydrophobicContact CG2-CD1 3.92Å; S648-F650 VanDerWaalsContact C-N 3.33Å; F650-F652 VanDerWaalsContact C-N 3.32Å; F650-F652 PolarHBondContact O-N 2.94Å; F650-Y653 PolarHBondContact O-N 2.98Å; F650-W654 HydrophobicContact CD1-CB 4.43Å; F650-W654 HydrophobicContact CE1-CB 4.04Å; F650-W654 HydrophobicContact CE1-CD2 4.36Å; F650-W654 HydrophobicContact CE1-CE3 4.42Å; F650-W654 HydrophobicContact CE1-CG 4.19Å; F650-W654 HydrophobicContact CE2-CE3 4.39Å; F650-W654 HydrophobicContact CZ-CB 4.37Å; F650-W654 HydrophobicContact CZ-CD2 4.13Å; F650-W654 AromaticContact CZ-CE3 3.75Å; F650-W654 HydrophobicContact CZ-CE3 3.75Å; F650-W654 HydrophobicContact CZ-CG 4.39Å; F650-W654 HydrophobicContact CZ-CZ3 4.48Å; F650-W654 VanDerWaalsContact O-CB 3.31Å; F650-W654 WeakPolarHBondContact O-CB 3.24Å; F650-W654 PolarHBondContact O-N 2.93Å; F650-V701 HydrophobicContact CE1-CG1 4Å; F650-V701 HydrophobicContact CE1-CG2 4.26Å; F650-V701 HydrophobicContact CZ-CG2 4.3Å
651	R	90.3	Very high	86.9	Confident	36 Å²	36	62.9 Å²	62.9	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-41.7	-177	-176.9	66.8	-162	-174.7	19.9	111.7	I644 P646 S648 N649 W654 D655 T705	I644-R651 HydrophobicContact CG2-CB 4.23Å; P646-R651 WeakPolarHBondContact O-CB 3.5Å; P646-R651 WeakPolarHBondContact O-CG 3.45Å; S648-R651 PolarHBondContact O-N 2.84Å; S648-R651 WeakPolarHBondContact OG-CB 3.38Å; S648-R651 PolarHBondContact OG-N 2.84Å; S648-R651 VanDerWaalsContact OG-N 3.14Å; N649-R651 PolarHBondContact O-N 2.94Å; R651-W654 PolarHBondContact O-N 2.81Å; R651-D655 IonicContact CZ-OD1 2.81Å; R651-D655 IonicContact CZ-OD2 2.95Å; R651-D655 VanDerWaalsContact NE-CG 3.29Å; R651-D655 IonicContact NE-OD1 3.99Å; R651-D655 PolarHBondContact NE-OD1 3.27Å; R651-D655 IonicContact NE-OD2 3.98Å; R651-D655 PolarHBondContact NE-OD2 3.01Å; R651-D655 IonicContact NH2-OD1 3.4Å; R651-D655 PolarHBondContact NH2-OD1 3.18Å; R651-D655 IonicContact NH2-OD2 3.83Å; R651-D655 PolarHBondContact NH2-OD2 2.91Å; R651-D655 WeakPolarHBondContact O-CB 3.4Å; R651-D655 VanDerWaalsContact O-CG 3.29Å; R651-D655 PolarHBondContact O-N 2.61Å; R651-T705 HydrophobicContact CG-CG2 4.38Å; R651-T705 PolarHBondContact NH1-OG1 2.96Å; R651-T705 VanDerWaalsContact NH1-OG1 3.09Å
652	F	89.5	Confident	87.4	Confident	135 Å²	135	59 Å²	59	59%	0.592	28%	0.281	S	S	*	.	H	α-helix	trans	-61	-45.4	176.7	177.2	-95.3	0	0	0	113.1	S648 N649 F650 L656	S648-F652 PolarHBondContact O-N 3.23Å; N649-F652 PolarHBondContact O-N 3.44Å; F650-F652 VanDerWaalsContact C-N 3.32Å; F650-F652 PolarHBondContact O-N 2.94Å; F652-L656 PolarHBondContact O-N 3.02Å; F652-L656 VanDerWaalsContact O-N 3.13Å
653	Y	92.5	Very high	87.3	Confident	133 Å²	133	55 Å²	55	52%	0.522	27%	0.271	S	S	.	.	H	α-helix	trans	-73.5	-33.5	178.9	-73.3	-64.9	0	0	0	112.8	F610 N649 F650 L656 L657	F610-Y653 AromaticContact CE2-CD2 3.9Å; F610-Y653 HydrophobicContact CE2-CD2 3.9Å; F610-Y653 HydrophobicContact CE2-CE2 4.29Å; F610-Y653 AromaticContact CZ-CD2 3.81Å; F610-Y653 HydrophobicContact CZ-CD2 3.81Å; N649-Y653 HydrophobicContact CB-CD2 4.47Å; N649-Y653 HydrophobicContact CB-CE2 4.42Å; N649-Y653 WeakPolarHBondContact O-CD2 3.44Å; N649-Y653 PolarHBondContact O-N 2.9Å; F650-Y653 PolarHBondContact O-N 2.98Å; Y653-L656 PolarHBondContact O-N 3.18Å; Y653-L657 PolarHBondContact O-N 3.34Å
654	W	91.4	Very high	86.9	Confident	41 Å²	41	56.1 Å²	56.1	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-49.3	172.1	-173.3	-94.1	0	0	0	110.9	F650 R651 L656 L657 M658 V694 A697 D698 V701	F650-W654 HydrophobicContact CD1-CB 4.43Å; F650-W654 HydrophobicContact CE1-CB 4.04Å; F650-W654 HydrophobicContact CE1-CD2 4.36Å; F650-W654 HydrophobicContact CE1-CE3 4.42Å; F650-W654 HydrophobicContact CE1-CG 4.19Å; F650-W654 HydrophobicContact CE2-CE3 4.39Å; F650-W654 HydrophobicContact CZ-CB 4.37Å; F650-W654 HydrophobicContact CZ-CD2 4.13Å; F650-W654 AromaticContact CZ-CE3 3.75Å; F650-W654 HydrophobicContact CZ-CE3 3.75Å; F650-W654 HydrophobicContact CZ-CG 4.39Å; F650-W654 HydrophobicContact CZ-CZ3 4.48Å; F650-W654 VanDerWaalsContact O-CB 3.31Å; F650-W654 WeakPolarHBondContact O-CB 3.24Å; F650-W654 PolarHBondContact O-N 2.93Å; R651-W654 PolarHBondContact O-N 2.81Å; W654-L656 VanDerWaalsContact C-N 3.26Å; W654-L656 PolarHBondContact O-N 3.36Å; W654-L657 WeakPolarHBondContact O-CB 3.39Å; W654-L657 PolarHBondContact O-N 3.46Å; W654-M658 HydrophobicContact CZ2-SD 4.02Å; W654-M658 WeakPolarHBondContact O-CG 3.24Å; W654-M658 PolarHBondContact O-N 3Å; W654-V694 HydrophobicContact CH2-CG1 4.43Å; W654-V694 HydrophobicContact CZ2-CG1 4.46Å; W654-A697 HydrophobicContact CH2-CB 3.9Å; W654-A697 HydrophobicContact CZ2-CB 4.11Å; W654-D698 HydrophobicContact CZ2-CB 4.08Å; W654-D698 PolarHBondContact NE1-OD1 2.95Å; W654-V701 HydrophobicContact CD2-CG2 4.31Å; W654-V701 HydrophobicContact CG-CG1 4.36Å; W654-V701 HydrophobicContact CH2-CG2 4.5Å; W654-V701 HydrophobicContact CZ2-CG2 4.05Å
655	D	88.6	Confident	86.2	Confident	64 Å²	64	56.3 Å²	56.3	34%	0.342	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-29.8	179.5	-71.5	-13.5	0	0	0	112.9	R651 L659	R651-D655 IonicContact CZ-OD1 2.81Å; R651-D655 IonicContact CZ-OD2 2.95Å; R651-D655 VanDerWaalsContact NE-CG 3.29Å; R651-D655 IonicContact NE-OD1 3.99Å; R651-D655 PolarHBondContact NE-OD1 3.27Å; R651-D655 IonicContact NE-OD2 3.98Å; R651-D655 PolarHBondContact NE-OD2 3.01Å; R651-D655 IonicContact NH2-OD1 3.4Å; R651-D655 PolarHBondContact NH2-OD1 3.18Å; R651-D655 IonicContact NH2-OD2 3.83Å; R651-D655 PolarHBondContact NH2-OD2 2.91Å; R651-D655 WeakPolarHBondContact O-CB 3.4Å; R651-D655 VanDerWaalsContact O-CG 3.29Å; R651-D655 PolarHBondContact O-N 2.61Å; D655-L659 VanDerWaalsContact O-CB 3.26Å; D655-L659 WeakPolarHBondContact O-CB 3.29Å; D655-L659 PolarHBondContact O-N 2.89Å
656	L	89.8	Confident	85.5	Confident	85 Å²	85	61.4 Å²	61.4	45%	0.445	31%	0.309	S	S	.	.	H	α-helix	trans	-67	-42.1	170.5	-176.9	62.3	0	0	0	112.2	F652 Y653 W654 L659 M660	F652-L656 PolarHBondContact O-N 3.02Å; F652-L656 VanDerWaalsContact O-N 3.13Å; Y653-L656 PolarHBondContact O-N 3.18Å; W654-L656 VanDerWaalsContact C-N 3.26Å; W654-L656 PolarHBondContact O-N 3.36Å; L656-L659 PolarHBondContact O-N 3.29Å; L656-M660 WeakPolarHBondContact O-CG 3.41Å; L656-M660 PolarHBondContact O-N 3.3Å; L656-M660 VanDerWaalsContact O-N 3.08Å
657	L	90.6	Very high	85.1	Confident	83 Å²	83	64.9 Å²	64.9	44%	0.435	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-46.8	174.5	177.2	63.3	0	0	0	111.2	Y653 W654 L659 M660 L661	Y653-L657 PolarHBondContact O-N 3.34Å; W654-L657 WeakPolarHBondContact O-CB 3.39Å; W654-L657 PolarHBondContact O-N 3.46Å; L657-L659 VanDerWaalsContact C-N 3.32Å; L657-L659 PolarHBondContact O-N 2.89Å; L657-M660 PolarHBondContact O-N 2.84Å; L657-L661 HydrophobicContact CD1-CD1 4.2Å; L657-L661 HydrophobicContact CD1-CG 4.44Å; L657-L661 HydrophobicContact CG-CD1 4.16Å; L657-L661 WeakPolarHBondContact O-CG 3.45Å; L657-L661 PolarHBondContact O-N 2.98Å
658	M	84.8	Confident	84.8	Confident	10 Å²	10	65.8 Å²	65.8	5%	0.049	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-41.9	176.6	-62.7	-46.2	-62.1	0	0	111.7	W654 L661 L662 V694 F695 D698	W654-M658 HydrophobicContact CZ2-SD 4.02Å; W654-M658 WeakPolarHBondContact O-CG 3.24Å; W654-M658 PolarHBondContact O-N 3Å; M658-L661 PolarHBondContact O-N 3.27Å; M658-L662 WeakPolarHBondContact O-CB 3.33Å; M658-L662 VanDerWaalsContact O-CG 3.23Å; M658-L662 WeakPolarHBondContact O-CG 3.42Å; M658-L662 PolarHBondContact O-N 2.64Å; M658-V694 HydrophobicContact CE-CG1 4.19Å; M658-V694 HydrophobicContact SD-CG1 3.59Å; M658-V694 VanDerWaalsContact SD-CG1 3.59Å; M658-F695 HydrophobicContact CE-CD1 3.35Å; M658-F695 HydrophobicContact CE-CE1 3.59Å; M658-F695 HydrophobicContact CE-CG 4.33Å; M658-D698 HydrophobicContact CE-CB 3.63Å; M658-D698 HydrophobicContact SD-CB 3.92Å
659	L	82.5	Confident	83.9	Confident	91 Å²	91	68.1 Å²	68.1	48%	0.476	34%	0.338	S	S	.	.	H	α-helix	trans	-61.8	-44.3	176.4	178.9	61.7	0	0	0	112.1	D655 L656 L657 L662 I663	D655-L659 VanDerWaalsContact O-CB 3.26Å; D655-L659 WeakPolarHBondContact O-CB 3.29Å; D655-L659 PolarHBondContact O-N 2.89Å; L656-L659 PolarHBondContact O-N 3.29Å; L657-L659 VanDerWaalsContact C-N 3.32Å; L657-L659 PolarHBondContact O-N 2.89Å; L659-L662 PolarHBondContact O-N 3.27Å; L659-I663 HydrophobicContact CD1-CD1 3.92Å; L659-I663 HydrophobicContact CD1-CG1 4.3Å; L659-I663 HydrophobicContact CG-CD1 3.95Å; L659-I663 VanDerWaalsContact O-CG1 3.29Å; L659-I663 WeakPolarHBondContact O-CG1 3.43Å; L659-I663 PolarHBondContact O-N 2.97Å
660	M	84.8	Confident	83.2	Confident	117 Å²	117	67.5 Å²	67.5	58%	0.576	34%	0.337	S	S	*	.	H	α-helix	trans	-64.2	-42.1	178	-70.1	-60.2	-62.4	0	0	112.1	L656 L657 I663 A664	L656-M660 WeakPolarHBondContact O-CG 3.41Å; L656-M660 PolarHBondContact O-N 3.3Å; L656-M660 VanDerWaalsContact O-N 3.08Å; L657-M660 PolarHBondContact O-N 2.84Å; M660-I663 PolarHBondContact O-N 3.49Å; M660-A664 WeakPolarHBondContact O-CB 3.39Å; M660-A664 PolarHBondContact O-N 2.94Å
661	L	82.4	Confident	82.4	Confident	32 Å²	32	67.1 Å²	67.1	17%	0.168	34%	0.337	C	S	.	.	H	α-helix	trans	-67.3	-39.1	176.1	-70.1	170.2	0	0	0	112.4	L657 M658 A664 N665 V694	L657-L661 HydrophobicContact CD1-CD1 4.2Å; L657-L661 HydrophobicContact CD1-CG 4.44Å; L657-L661 HydrophobicContact CG-CD1 4.16Å; L657-L661 WeakPolarHBondContact O-CG 3.45Å; L657-L661 PolarHBondContact O-N 2.98Å; M658-L661 PolarHBondContact O-N 3.27Å; L661-A664 PolarHBondContact O-N 2.88Å; L661-N665 WeakPolarHBondContact O-CB 3.39Å; L661-N665 PolarHBondContact O-N 3.26Å; L661-N665 PolarHBondContact O-ND2 3.49Å; L661-V694 HydrophobicContact CD1-CB 3.98Å; L661-V694 HydrophobicContact CD1-CG1 3.5Å; L661-V694 VanDerWaalsContact CD1-CG1 3.5Å; L661-V694 HydrophobicContact CD1-CG2 4.34Å
662	L	78.5	Confident	81.5	Confident	69 Å²	69	65.8 Å²	65.8	36%	0.361	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-40.9	174.6	-75.3	168.1	0	0	0	112.1	M658 L659 L666 F695	M658-L662 WeakPolarHBondContact O-CB 3.33Å; M658-L662 VanDerWaalsContact O-CG 3.23Å; M658-L662 WeakPolarHBondContact O-CG 3.42Å; M658-L662 PolarHBondContact O-N 2.64Å; L659-L662 PolarHBondContact O-N 3.27Å; L662-L666 VanDerWaalsContact O-CB 3.22Å; L662-L666 WeakPolarHBondContact O-CB 3.5Å; L662-L666 PolarHBondContact O-N 3.46Å; L662-F695 HydrophobicContact CD2-CE1 3.71Å; L662-F695 HydrophobicContact CD2-CZ 4Å; L662-F695 HydrophobicContact CG-CE1 4.04Å; L662-F695 HydrophobicContact CG-CZ 4.43Å
663	I	78.1	Confident	80.5	Confident	79 Å²	79	61.9 Å²	61.9	41%	0.405	32%	0.319	S	S	.	.	H	α-helix	trans	-66.3	-45.2	175.1	-69	166.1	0	0	0	110.7	L659 M660 N665 L666 I667	L659-I663 HydrophobicContact CD1-CD1 3.92Å; L659-I663 HydrophobicContact CD1-CG1 4.3Å; L659-I663 HydrophobicContact CG-CD1 3.95Å; L659-I663 VanDerWaalsContact O-CG1 3.29Å; L659-I663 WeakPolarHBondContact O-CG1 3.43Å; L659-I663 PolarHBondContact O-N 2.97Å; M660-I663 PolarHBondContact O-N 3.49Å; I663-N665 PolarHBondContact O-N 3Å; I663-L666 PolarHBondContact O-N 2.95Å; I663-I667 HydrophobicContact CG2-CD1 4.07Å; I663-I667 WeakPolarHBondContact O-CG1 3.5Å; I663-I667 PolarHBondContact O-N 3.19Å
664	A	79.5	Confident	79.4	Confident	30 Å²	30	56 Å²	56	25%	0.248	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-49.5	177.1	0	0	0	0	0	111.3	M660 L661 L666 I667 I668	M660-A664 WeakPolarHBondContact O-CB 3.39Å; M660-A664 PolarHBondContact O-N 2.94Å; L661-A664 PolarHBondContact O-N 2.88Å; A664-L666 PolarHBondContact O-N 2.81Å; A664-I667 PolarHBondContact O-N 3.3Å; A664-I668 HydrophobicContact CB-CD1 4.27Å; A664-I668 VanDerWaalsContact O-CB 3.29Å; A664-I668 WeakPolarHBondContact O-CB 3.07Å; A664-I668 WeakPolarHBondContact O-CG1 3.21Å; A664-I668 PolarHBondContact O-N 3.12Å
665	N	76.6	Confident	78.5	Confident	14 Å²	14	55.5 Å²	55.5	8%	0.075	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-37.2	178.4	-68.6	-10.6	0	0	0	112.8	L661 I663 I667 I668 L669 F687 S691 F695	L661-N665 WeakPolarHBondContact O-CB 3.39Å; L661-N665 PolarHBondContact O-N 3.26Å; L661-N665 PolarHBondContact O-ND2 3.49Å; I663-N665 PolarHBondContact O-N 3Å; N665-I667 PolarHBondContact O-N 3.43Å; N665-I668 PolarHBondContact O-N 2.88Å; N665-L669 HydrophobicContact CB-CD1 3.92Å; N665-L669 HydrophobicContact CB-CG 4.25Å; N665-L669 WeakPolarHBondContact O-CB 3.33Å; N665-L669 VanDerWaalsContact O-CG 3.23Å; N665-L669 WeakPolarHBondContact O-CG 3.38Å; N665-L669 PolarHBondContact O-N 3.03Å; N665-F687 WeakPolarHBondContact OD1-CZ 3.26Å; N665-S691 PolarHBondContact ND2-OG 3.48Å; N665-S691 PolarHBondContact OD1-OG 3.34Å; N665-F695 VanDerWaalsContact ND2-CE2 3.25Å; N665-F695 WeakPolarHBondContact ND2-CE2 3.49Å; N665-F695 WeakPolarHBondContact ND2-CZ 3.1Å
666	L	76	Confident	77.7	Confident	107 Å²	107	57 Å²	57	56%	0.56	30%	0.3	S	S	*	.	H	α-helix	trans	-61.6	-31.3	177	179.7	62.3	0	0	0	112.5	L662 I663 A664 P670	L662-L666 VanDerWaalsContact O-CB 3.22Å; L662-L666 WeakPolarHBondContact O-CB 3.5Å; L662-L666 PolarHBondContact O-N 3.46Å; I663-L666 PolarHBondContact O-N 2.95Å; A664-L666 PolarHBondContact O-N 2.81Å; L666-P670 VanDerWaalsContact O-CD 3.22Å; L666-P670 WeakPolarHBondContact O-CD 3.31Å; L666-P670 WeakPolarHBondContact O-CG 3.37Å
667	I	77.7	Confident	76.4	Confident	103 Å²	103	58.8 Å²	58.8	53%	0.528	31%	0.31	S	S	.	.	H	α-helix	trans	-85.9	-47.6	176.1	-62.8	167.4	0	0	0	110.8	I663 A664 N665 P670 V671	I663-I667 HydrophobicContact CG2-CD1 4.07Å; I663-I667 WeakPolarHBondContact O-CG1 3.5Å; I663-I667 PolarHBondContact O-N 3.19Å; A664-I667 PolarHBondContact O-N 3.3Å; N665-I667 PolarHBondContact O-N 3.43Å; I667-P670 WeakPolarHBondContact O-CD 3.35Å; I667-P670 WeakPolarHBondContact O-CG 3.46Å; I667-V671 WeakPolarHBondContact O-CG2 3.35Å
668	I	78.4	Confident	75	Confident	62 Å²	62	61.8 Å²	61.8	32%	0.318	33%	0.326	S	S	.	.	H	α-helix	trans	-75.1	-43.7	-170	-66.7	167.1	0	0	0	112.1	A664 N665 V671 A672 W684 F687	A664-I668 HydrophobicContact CB-CD1 4.27Å; A664-I668 VanDerWaalsContact O-CB 3.29Å; A664-I668 WeakPolarHBondContact O-CB 3.07Å; A664-I668 WeakPolarHBondContact O-CG1 3.21Å; A664-I668 PolarHBondContact O-N 3.12Å; N665-I668 PolarHBondContact O-N 2.88Å; I668-V671 PolarHBondContact O-N 3.29Å; I668-A672 WeakPolarHBondContact O-CB 3.44Å; I668-A672 PolarHBondContact O-N 3.27Å; I668-W684 HydrophobicContact CG2-CH2 4.1Å; I668-W684 HydrophobicContact CG2-CZ3 3.63Å; I668-F687 HydrophobicContact CD1-CE1 4.23Å; I668-F687 HydrophobicContact CD1-CE2 4.34Å; I668-F687 HydrophobicContact CD1-CZ 3.74Å; I668-F687 HydrophobicContact CG2-CE1 4.18Å
669	L	70.6	Confident	73.8	Confident	52 Å²	52	64.6 Å²	64.6	27%	0.272	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-49.1	-176.9	-67.4	172.3	0	0	0	113.9	N665 V671 I673 W684 L779	N665-L669 HydrophobicContact CB-CD1 3.92Å; N665-L669 HydrophobicContact CB-CG 4.25Å; N665-L669 WeakPolarHBondContact O-CB 3.33Å; N665-L669 VanDerWaalsContact O-CG 3.23Å; N665-L669 WeakPolarHBondContact O-CG 3.38Å; N665-L669 PolarHBondContact O-N 3.03Å; L669-V671 VanDerWaalsContact C-N 3.31Å; L669-V671 PolarHBondContact O-N 3.09Å; L669-I673 HydrophobicContact CB-CD1 4.37Å; L669-I673 WeakPolarHBondContact O-CB 3.47Å; L669-I673 WeakPolarHBondContact O-CD1 3.37Å; L669-I673 WeakPolarHBondContact O-CG1 3.49Å; L669-I673 PolarHBondContact O-N 2.99Å; L669-W684 HydrophobicContact CD2-CH2 4.14Å; L669-L779 HydrophobicContact CB-CD1 4.42Å
670	P	73.3	Confident	72.6	Confident	37 Å²	37	65.9 Å²	65.9	24%	0.24	35%	0.348	C	S	.	.	H	α-helix	trans	-61.9	-37.7	177	19.8	-29.6	0	0	0	112.8	L666 I667 S674 L779	L666-P670 VanDerWaalsContact O-CD 3.22Å; L666-P670 WeakPolarHBondContact O-CD 3.31Å; L666-P670 WeakPolarHBondContact O-CG 3.37Å; I667-P670 WeakPolarHBondContact O-CD 3.35Å; I667-P670 WeakPolarHBondContact O-CG 3.46Å; P670-S674 WeakPolarHBondContact O-CB 3.4Å; P670-S674 PolarHBondContact O-N 3.39Å; P670-S674 PolarHBondContact O-OG 3.18Å; P670-L779 HydrophobicContact CB-CD2 3.57Å; P670-L779 HydrophobicContact CG-CD2 3.77Å
671	V	74.2	Confident	72.1	Confident	29 Å²	29	63.2 Å²	63.2	18%	0.176	34%	0.341	C	S	.	.	H	α-helix	trans	-68.6	-49.8	179.3	176.5	0	0	0	0	110.4	I667 I668 L669 I673 S674 F675 F676 W798 Y802	I667-V671 WeakPolarHBondContact O-CG2 3.35Å; I668-V671 PolarHBondContact O-N 3.29Å; L669-V671 VanDerWaalsContact C-N 3.31Å; L669-V671 PolarHBondContact O-N 3.09Å; V671-I673 PolarHBondContact O-N 3.37Å; V671-S674 PolarHBondContact O-N 3.01Å; V671-F675 HydrophobicContact CG1-CD2 4.11Å; V671-F675 WeakPolarHBondContact O-CD2 3.3Å; V671-F675 PolarHBondContact O-N 2.87Å; V671-F676 HydrophobicContact CG1-CE2 4.19Å; V671-W798 HydrophobicContact CG1-CZ3 4.41Å; V671-Y802 HydrophobicContact CG2-CD2 4.19Å; V671-Y802 HydrophobicContact CG2-CE2 3.86Å
672	A	72.3	Confident	71.8	Confident	8 Å²	8	67.6 Å²	67.6	7%	0.066	36%	0.363	C	S	.	.	H	α-helix	trans	-56.8	-53.7	178.1	0	0	0	0	0	112	I668 S674 F676 W684	I668-A672 WeakPolarHBondContact O-CB 3.44Å; I668-A672 PolarHBondContact O-N 3.27Å; A672-S674 PolarHBondContact O-N 3.43Å; A672-S674 VanDerWaalsContact O-N 3.12Å; A672-F676 WeakPolarHBondContact O-CB 3.41Å; A672-F676 PolarHBondContact O-N 2.94Å; A672-F676 VanDerWaalsContact O-N 3.14Å; A672-W684 HydrophobicContact CB-CH2 3.23Å; A672-W684 HydrophobicContact CB-CZ2 3.48Å; A672-W684 VanDerWaalsContact CB-CZ2 3.48Å; A672-W684 HydrophobicContact CB-CZ3 3.88Å
673	I	68.6	Low	72	Confident	54 Å²	54	71.5 Å²	71.5	28%	0.277	38%	0.379	S	S	.	.	H	α-helix	trans	-64	-22.2	-177.2	-62.6	164.9	0	0	0	112.1	L669 V671 T783 R787	L669-I673 HydrophobicContact CB-CD1 4.37Å; L669-I673 WeakPolarHBondContact O-CB 3.47Å; L669-I673 WeakPolarHBondContact O-CD1 3.37Å; L669-I673 WeakPolarHBondContact O-CG1 3.49Å; L669-I673 PolarHBondContact O-N 2.99Å; V671-I673 PolarHBondContact O-N 3.37Å; I673-T783 HydrophobicContact CB-CG2 4.31Å; I673-T783 HydrophobicContact CD1-CG2 4.45Å; I673-T783 HydrophobicContact CG2-CG2 3.64Å; I673-R787 PolarHBondContact O-NE 3.27Å; I673-R787 PolarHBondContact O-NH2 3Å
674	S	69.7	Low	71.9	Confident	10 Å²	10	70.2 Å²	70.2	7%	0.07	37%	0.37	C	S	.	.	H	α-helix	trans	-94.4	-38.5	-175.1	-62.3	0	0	0	0	114.8	P670 V671 A672 V786	P670-S674 WeakPolarHBondContact O-CB 3.4Å; P670-S674 PolarHBondContact O-N 3.39Å; P670-S674 PolarHBondContact O-OG 3.18Å; V671-S674 PolarHBondContact O-N 3.01Å; A672-S674 PolarHBondContact O-N 3.43Å; A672-S674 VanDerWaalsContact O-N 3.12Å; S674-V786 WeakPolarHBondContact OG-CG1 3.43Å
675	F	72.4	Confident	71.7	Confident	29 Å²	29	71.8 Å²	71.8	13%	0.127	37%	0.373	C	S	.	.	H	α-helix	trans	-120	-12.3	-168.5	-56.8	-75.6	0	0	0	114.5	V671 W798 Q801 Y802 A805	V671-F675 HydrophobicContact CG1-CD2 4.11Å; V671-F675 WeakPolarHBondContact O-CD2 3.3Å; V671-F675 PolarHBondContact O-N 2.87Å; F675-W798 HydrophobicContact CB-CB 4.19Å; F675-Q801 HydrophobicContact CD1-CB 3.91Å; F675-Q801 HydrophobicContact CE1-CB 3.68Å; F675-Y802 AromaticContact CE2-CD2 3.82Å; F675-Y802 HydrophobicContact CE2-CD2 3.82Å; F675-Y802 HydrophobicContact CE2-CG 4.42Å; F675-Y802 HydrophobicContact CZ-CD2 4.32Å; F675-A805 HydrophobicContact CZ-CB 4.39Å
676	F	70.7	Confident	72.1	Confident	97 Å²	97	75.3 Å²	75.3	43%	0.425	39%	0.391	S	S	.	.			trans	-107.2	107.9	179.7	-67.2	-100.3	0	0	0	109.4	V671 A672 W798	V671-F676 HydrophobicContact CG1-CE2 4.19Å; A672-F676 WeakPolarHBondContact O-CB 3.41Å; A672-F676 PolarHBondContact O-N 2.94Å; A672-F676 VanDerWaalsContact O-N 3.14Å; F676-W798 HydrophobicContact CE2-CD2 4.35Å; F676-W798 HydrophobicContact CE2-CE3 4.05Å; F676-W798 HydrophobicContact CE2-CZ3 4.45Å; F676-W798 HydrophobicContact CZ-CD2 4.05Å; F676-W798 HydrophobicContact CZ-CE3 4.12Å; F676-W798 HydrophobicContact CZ-CZ3 4.45Å
677	N	62.5	Low	72.3	Confident	122 Å²	122	73.2 Å²	73.2	65%	0.652	38%	0.378	S	S	*	.			trans	-80.6	-28.7	179.5	-70.4	-36.5	0	0	0	112.6	D679	N677-D679 VanDerWaalsContact C-N 3.34Å; N677-D679 PolarHBondContact O-N 3.4Å
678	D	61.6	Low	72.4	Confident	146 Å²	146	69.6 Å²	69.6	78%	0.781	36%	0.359	S	S	*	.			trans	-84.7	71.6	178.7	-67.1	-44.5	0	0	0	112	L680	D678-L680 PolarHBondContact O-N 2.92Å
679	D	58.5	Low	72.6	Confident	68 Å²	68	69 Å²	69	36%	0.364	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	6.3	179.6	-93.2	-46.3	0	0	0	115.1	N677 R787	N677-D679 VanDerWaalsContact C-N 3.34Å; N677-D679 PolarHBondContact O-N 3.4Å; D679-R787 IonicContact OD2-NH2 3.56Å; D679-R787 PolarHBondContact OD2-NH2 3.06Å; D679-R787 VanDerWaalsContact OD2-NH2 3.16Å
680	L	58.1	Low	73.4	Confident	118 Å²	118	71.3 Å²	71.3	62%	0.618	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	6	-169.1	-107	78.8	0	0	0	116.9	D678 I682 I685	D678-L680 PolarHBondContact O-N 2.92Å; L680-I682 PolarHBondContact O-N 3.5Å; L680-I685 HydrophobicContact CG-CD1 4.5Å; L680-I685 WeakPolarHBondContact O-CD1 3.49Å
681	S	73.5	Confident	73.8	Confident	62 Å²	62	69.7 Å²	69.7	43%	0.434	36%	0.362	S	S	.	.			trans	-55.6	133.3	175.6	179.3	0	0	0	0	111.8	H683 W684 I685	S681-H683 PolarHBondContact O-N 3.1Å; S681-H683 VanDerWaalsContact O-N 3.15Å; S681-W684 WeakPolarHBondContact O-CA 3.26Å; S681-W684 WeakPolarHBondContact O-CB 3.35Å; S681-W684 PolarHBondContact O-N 2.98Å; S681-I685 PolarHBondContact O-N 3.44Å
682	I	77.8	Confident	74.2	Confident	123 Å²	123	69.8 Å²	69.8	63%	0.631	36%	0.361	S	S	*	.	H	α-helix	trans	-56.7	-37.5	-175.8	-62.6	173.4	0	0	0	111.1	L680 I685 I686	L680-I682 PolarHBondContact O-N 3.5Å; I682-I685 PolarHBondContact O-N 3.29Å; I682-I686 HydrophobicContact CG2-CD1 3.78Å; I682-I686 HydrophobicContact CG2-CG1 4.4Å; I682-I686 WeakPolarHBondContact O-CB 3.49Å; I682-I686 VanDerWaalsContact O-CG1 3.28Å; I682-I686 WeakPolarHBondContact O-CG1 3.39Å; I682-I686 PolarHBondContact O-N 2.86Å
683	H	81.1	Confident	75	Confident	151 Å²	151	73.8 Å²	73.8	70%	0.699	39%	0.385	S	S	*	.	H	α-helix	trans	-67	-35.2	177.3	-59.6	-67.8	0	0	0	113.1	S681 F687	S681-H683 PolarHBondContact O-N 3.1Å; S681-H683 VanDerWaalsContact O-N 3.15Å; H683-F687 WeakPolarHBondContact O-CB 3.12Å; H683-F687 PolarHBondContact O-N 3.43Å
684	W	76.6	Confident	76	Confident	53 Å²	53	72.6 Å²	72.6	20%	0.201	38%	0.38	C	S	.	.	H	α-helix	trans	-67.4	-43.7	175.3	179	-126	0	0	0	111.4	I668 L669 A672 S681 F687 N688	I668-W684 HydrophobicContact CG2-CH2 4.1Å; I668-W684 HydrophobicContact CG2-CZ3 3.63Å; L669-W684 HydrophobicContact CD2-CH2 4.14Å; A672-W684 HydrophobicContact CB-CH2 3.23Å; A672-W684 HydrophobicContact CB-CZ2 3.48Å; A672-W684 VanDerWaalsContact CB-CZ2 3.48Å; A672-W684 HydrophobicContact CB-CZ3 3.88Å; S681-W684 WeakPolarHBondContact O-CA 3.26Å; S681-W684 WeakPolarHBondContact O-CB 3.35Å; S681-W684 PolarHBondContact O-N 2.98Å; W684-F687 HydrophobicContact CE3-CD1 4.25Å; W684-F687 HydrophobicContact CZ3-CD1 4.01Å; W684-F687 HydrophobicContact CZ3-CE1 4.38Å; W684-F687 PolarHBondContact O-N 3.22Å; W684-N688 WeakPolarHBondContact CZ2-ND2 3.17Å; W684-N688 PolarHBondContact O-N 3.1Å
685	I	76	Confident	76.7	Confident	63 Å²	63	72.5 Å²	72.5	32%	0.323	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-43.7	175.7	-63.1	172	0	0	0	110.9	L680 S681 I682 S689 Y744	L680-I685 HydrophobicContact CG-CD1 4.5Å; L680-I685 WeakPolarHBondContact O-CD1 3.49Å; S681-I685 PolarHBondContact O-N 3.44Å; I682-I685 PolarHBondContact O-N 3.29Å; I685-S689 WeakPolarHBondContact O-CB 3.42Å; I685-S689 PolarHBondContact O-N 3.17Å; I685-Y744 HydrophobicContact CG2-CE1 4.02Å; I685-Y744 PolarHBondContact O-OH 3.21Å
686	I	84	Confident	77.5	Confident	88 Å²	88	75.3 Å²	75.3	45%	0.451	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-45.9	176.2	-71.2	168.9	0	0	0	111.1	I682 I690	I682-I686 HydrophobicContact CG2-CD1 3.78Å; I682-I686 HydrophobicContact CG2-CG1 4.4Å; I682-I686 WeakPolarHBondContact O-CB 3.49Å; I682-I686 VanDerWaalsContact O-CG1 3.28Å; I682-I686 WeakPolarHBondContact O-CG1 3.39Å; I682-I686 PolarHBondContact O-N 2.86Å; I686-I690 HydrophobicContact CG2-CD1 3.69Å; I686-I690 HydrophobicContact CG2-CG1 4.48Å; I686-I690 WeakPolarHBondContact O-CB 3.36Å; I686-I690 VanDerWaalsContact O-CG1 3.27Å; I686-I690 WeakPolarHBondContact O-CG1 3.47Å; I686-I690 PolarHBondContact O-N 2.77Å
687	F	81.7	Confident	78.4	Confident	63 Å²	63	72.5 Å²	72.5	28%	0.276	39%	0.388	S	S	.	.	H	α-helix	trans	-60	-52.8	179.9	174.2	-100.3	0	0	0	112.2	N665 I668 H683 W684 I690 S691	N665-F687 WeakPolarHBondContact OD1-CZ 3.26Å; I668-F687 HydrophobicContact CD1-CE1 4.23Å; I668-F687 HydrophobicContact CD1-CE2 4.34Å; I668-F687 HydrophobicContact CD1-CZ 3.74Å; I668-F687 HydrophobicContact CG2-CE1 4.18Å; H683-F687 WeakPolarHBondContact O-CB 3.12Å; H683-F687 PolarHBondContact O-N 3.43Å; W684-F687 HydrophobicContact CE3-CD1 4.25Å; W684-F687 HydrophobicContact CZ3-CD1 4.01Å; W684-F687 HydrophobicContact CZ3-CE1 4.38Å; W684-F687 PolarHBondContact O-N 3.22Å; F687-I690 PolarHBondContact O-N 3.43Å; F687-S691 PolarHBondContact O-N 3.42Å
688	N	79.7	Confident	79.8	Confident	26 Å²	26	67.1 Å²	67.1	14%	0.139	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-43.8	-179.7	-74.4	-21.1	0	0	0	111.7	W684 I690 S691 D692 Y744	W684-N688 WeakPolarHBondContact CZ2-ND2 3.17Å; W684-N688 PolarHBondContact O-N 3.1Å; N688-I690 VanDerWaalsContact C-N 3.34Å; N688-I690 PolarHBondContact O-N 2.97Å; N688-S691 WeakPolarHBondContact O-CA 3.33Å; N688-S691 VanDerWaalsContact O-CB 3.26Å; N688-S691 WeakPolarHBondContact O-CB 3.49Å; N688-S691 PolarHBondContact O-N 3.39Å; N688-D692 PolarHBondContact O-N 2.94Å; N688-Y744 WeakPolarHBondContact CB-OH 3.19Å
689	S	82	Confident	81.1	Confident	51 Å²	51	61 Å²	61	36%	0.357	33%	0.327	S	S	.	.	H	α-helix	trans	-57.2	-43.1	175.8	-176.7	0	0	0	0	112.9	I685 V693 Y744	I685-S689 WeakPolarHBondContact O-CB 3.42Å; I685-S689 PolarHBondContact O-N 3.17Å; S689-V693 WeakPolarHBondContact O-CB 3.48Å; S689-V693 VanDerWaalsContact O-CG2 3.24Å; S689-V693 WeakPolarHBondContact O-CG2 3.44Å; S689-V693 PolarHBondContact O-N 3.32Å; S689-Y744 PolarHBondContact N-OH 3.17Å
690	I	86.6	Confident	82.7	Confident	99 Å²	99	60.6 Å²	60.6	51%	0.508	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-43.6	173.9	-70	168.3	0	0	0	110.9	I686 F687 N688 V693 V694	I686-I690 HydrophobicContact CG2-CD1 3.69Å; I686-I690 HydrophobicContact CG2-CG1 4.48Å; I686-I690 WeakPolarHBondContact O-CB 3.36Å; I686-I690 VanDerWaalsContact O-CG1 3.27Å; I686-I690 WeakPolarHBondContact O-CG1 3.47Å; I686-I690 PolarHBondContact O-N 2.77Å; F687-I690 PolarHBondContact O-N 3.43Å; N688-I690 VanDerWaalsContact C-N 3.34Å; N688-I690 PolarHBondContact O-N 2.97Å; I690-V693 PolarHBondContact O-N 2.97Å; I690-V694 WeakPolarHBondContact O-CG2 3.29Å; I690-V694 PolarHBondContact O-N 3.04Å; I690-V694 VanDerWaalsContact O-N 3.1Å
691	S	82.3	Confident	84.3	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-57.2	-52.1	177.2	-133.8	0	0	0	0	111.4	N665 F687 N688 V694 F695	N665-S691 PolarHBondContact ND2-OG 3.48Å; N665-S691 PolarHBondContact OD1-OG 3.34Å; F687-S691 PolarHBondContact O-N 3.42Å; N688-S691 WeakPolarHBondContact O-CA 3.33Å; N688-S691 VanDerWaalsContact O-CB 3.26Å; N688-S691 WeakPolarHBondContact O-CB 3.49Å; N688-S691 PolarHBondContact O-N 3.39Å; S691-V694 PolarHBondContact O-N 3.02Å; S691-V694 VanDerWaalsContact O-N 3.17Å; S691-F695 WeakPolarHBondContact O-CD2 3.34Å; S691-F695 PolarHBondContact O-N 3.21Å
692	D	83.2	Confident	85.1	Confident	32 Å²	32	55 Å²	55	17%	0.171	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-41.2	-179.2	-69.4	-36.3	0	0	0	112.3	N688 V694 F695 I696 P741	N688-D692 PolarHBondContact O-N 2.94Å; D692-V694 VanDerWaalsContact C-N 3.27Å; D692-V694 PolarHBondContact O-N 3.21Å; D692-F695 PolarHBondContact O-N 3.15Å; D692-I696 VanDerWaalsContact O-CG1 3.28Å; D692-I696 WeakPolarHBondContact O-CG1 3.21Å; D692-I696 PolarHBondContact O-N 3Å; D692-P741 WeakPolarHBondContact OD2-CB 3.48Å
693	V	88.7	Confident	85.7	Confident	91 Å²	91	51.6 Å²	51.6	55%	0.552	28%	0.278	S	S	*	.	H	α-helix	trans	-59.1	-38.5	173.8	166	0	0	0	0	111.6	S689 I690 A697	S689-V693 WeakPolarHBondContact O-CB 3.48Å; S689-V693 VanDerWaalsContact O-CG2 3.24Å; S689-V693 WeakPolarHBondContact O-CG2 3.44Å; S689-V693 PolarHBondContact O-N 3.32Å; I690-V693 PolarHBondContact O-N 2.97Å; V693-A697 WeakPolarHBondContact O-CB 3.44Å; V693-A697 PolarHBondContact O-N 2.9Å
694	V	88.3	Confident	86.2	Confident	29 Å²	29	50 Å²	50	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-72.5	-36.4	177.2	176.5	0	0	0	0	112.1	W654 M658 L661 I690 S691 D692 A697 D698	W654-V694 HydrophobicContact CH2-CG1 4.43Å; W654-V694 HydrophobicContact CZ2-CG1 4.46Å; M658-V694 HydrophobicContact CE-CG1 4.19Å; M658-V694 HydrophobicContact SD-CG1 3.59Å; M658-V694 VanDerWaalsContact SD-CG1 3.59Å; L661-V694 HydrophobicContact CD1-CB 3.98Å; L661-V694 HydrophobicContact CD1-CG1 3.5Å; L661-V694 VanDerWaalsContact CD1-CG1 3.5Å; L661-V694 HydrophobicContact CD1-CG2 4.34Å; I690-V694 WeakPolarHBondContact O-CG2 3.29Å; I690-V694 PolarHBondContact O-N 3.04Å; I690-V694 VanDerWaalsContact O-N 3.1Å; S691-V694 PolarHBondContact O-N 3.02Å; S691-V694 VanDerWaalsContact O-N 3.17Å; D692-V694 VanDerWaalsContact C-N 3.27Å; D692-V694 PolarHBondContact O-N 3.21Å; V694-A697 PolarHBondContact O-N 2.85Å; V694-D698 PolarHBondContact O-N 3Å
695	F	85.8	Confident	86.9	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.035	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-39.3	172.1	-64.5	-62.3	0	0	0	112.8	M658 L662 N665 S691 D692 A697 D698 I699 S739	M658-F695 HydrophobicContact CE-CD1 3.35Å; M658-F695 HydrophobicContact CE-CE1 3.59Å; M658-F695 HydrophobicContact CE-CG 4.33Å; L662-F695 HydrophobicContact CD2-CE1 3.71Å; L662-F695 HydrophobicContact CD2-CZ 4Å; L662-F695 HydrophobicContact CG-CE1 4.04Å; L662-F695 HydrophobicContact CG-CZ 4.43Å; N665-F695 VanDerWaalsContact ND2-CE2 3.25Å; N665-F695 WeakPolarHBondContact ND2-CE2 3.49Å; N665-F695 WeakPolarHBondContact ND2-CZ 3.1Å; S691-F695 WeakPolarHBondContact O-CD2 3.34Å; S691-F695 PolarHBondContact O-N 3.21Å; D692-F695 PolarHBondContact O-N 3.15Å; F695-A697 VanDerWaalsContact C-N 3.3Å; F695-A697 PolarHBondContact O-N 3.08Å; F695-D698 WeakPolarHBondContact O-CB 3.36Å; F695-D698 PolarHBondContact O-N 3.36Å; F695-I699 PolarHBondContact O-N 3.31Å; F695-I699 VanDerWaalsContact O-N 3.15Å; F695-S739 WeakPolarHBondContact CB-OG 3.31Å
696	I	87.9	Confident	87.5	Confident	89 Å²	89	45.4 Å²	45.4	46%	0.456	25%	0.247	S	C	.	.	H	α-helix	trans	-62.7	-39.4	173.3	-67.1	166.3	0	0	0	110.6	D692 I699 A700	D692-I696 VanDerWaalsContact O-CG1 3.28Å; D692-I696 WeakPolarHBondContact O-CG1 3.21Å; D692-I696 PolarHBondContact O-N 3Å; I696-I699 PolarHBondContact O-N 3.14Å; I696-A700 PolarHBondContact O-N 2.81Å
697	A	91.2	Very high	87.6	Confident	37 Å²	37	43 Å²	43	31%	0.306	24%	0.235	S	C	.	.	H	α-helix	trans	-65	-36.9	173.3	0	0	0	0	0	112.6	W654 V693 V694 F695 I699 A700 V701	W654-A697 HydrophobicContact CH2-CB 3.9Å; W654-A697 HydrophobicContact CZ2-CB 4.11Å; V693-A697 WeakPolarHBondContact O-CB 3.44Å; V693-A697 PolarHBondContact O-N 2.9Å; V694-A697 PolarHBondContact O-N 2.85Å; F695-A697 VanDerWaalsContact C-N 3.3Å; F695-A697 PolarHBondContact O-N 3.08Å; A697-I699 VanDerWaalsContact C-N 3.34Å; A697-I699 PolarHBondContact O-N 3.01Å; A697-A700 WeakPolarHBondContact O-CB 3.41Å; A697-A700 PolarHBondContact O-N 3.32Å; A697-A700 VanDerWaalsContact O-N 3.13Å; A697-V701 WeakPolarHBondContact O-CG2 3.43Å; A697-V701 PolarHBondContact O-N 2.79Å
698	D	90.9	Very high	87.7	Confident	10 Å²	10	43.1 Å²	43.1	5%	0.053	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-36.2	176.4	179.6	57.1	0	0	0	112.5	W654 M658 V694 F695 A700 V701 K702	W654-D698 HydrophobicContact CZ2-CB 4.08Å; W654-D698 PolarHBondContact NE1-OD1 2.95Å; M658-D698 HydrophobicContact CE-CB 3.63Å; M658-D698 HydrophobicContact SD-CB 3.92Å; V694-D698 PolarHBondContact O-N 3Å; F695-D698 WeakPolarHBondContact O-CB 3.36Å; F695-D698 PolarHBondContact O-N 3.36Å; D698-A700 VanDerWaalsContact C-N 3.32Å; D698-A700 PolarHBondContact O-N 2.81Å; D698-V701 PolarHBondContact O-N 3.29Å; D698-K702 WeakPolarHBondContact O-CB 3.49Å; D698-K702 WeakPolarHBondContact O-CG 3.47Å; D698-K702 PolarHBondContact O-N 3.49Å; D698-K702 WeakPolarHBondContact OD2-CE 3.27Å; D698-K702 IonicContact OD2-NZ 2.79Å; D698-K702 PolarHBondContact OD2-NZ 3.48Å
699	I	90	Very high	87.4	Confident	18 Å²	18	43.5 Å²	43.5	9%	0.092	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-45.4	170.9	-65.4	170.2	0	0	0	110.5	F695 I696 A697 V701 K702 F703 Y727 F732 D735 F736	F695-I699 PolarHBondContact O-N 3.31Å; F695-I699 VanDerWaalsContact O-N 3.15Å; I696-I699 PolarHBondContact O-N 3.14Å; A697-I699 VanDerWaalsContact C-N 3.34Å; A697-I699 PolarHBondContact O-N 3.01Å; I699-V701 PolarHBondContact O-N 3.1Å; I699-K702 PolarHBondContact O-N 2.88Å; I699-F703 HydrophobicContact CG2-CD2 3.99Å; I699-F703 HydrophobicContact CG2-CE2 3.78Å; I699-F703 VanDerWaalsContact O-CD2 3.23Å; I699-F703 WeakPolarHBondContact O-CD2 3.42Å; I699-F703 PolarHBondContact O-N 3.33Å; I699-F703 VanDerWaalsContact O-N 3.07Å; I699-Y727 HydrophobicContact CG2-CE1 4.3Å; I699-F732 HydrophobicContact CG2-CD2 4.23Å; I699-F732 HydrophobicContact CG2-CE2 4.05Å; I699-D735 HydrophobicContact CD1-CB 4.4Å; I699-D735 HydrophobicContact CG1-CB 4.1Å; I699-F736 HydrophobicContact CD1-CB 4.47Å
700	A	91.8	Very high	86.7	Confident	58 Å²	58	47.2 Å²	47.2	48%	0.479	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-36.3	177.3	0	0	0	0	0	112.8	I696 A697 D698	I696-A700 PolarHBondContact O-N 2.81Å; A697-A700 WeakPolarHBondContact O-CB 3.41Å; A697-A700 PolarHBondContact O-N 3.32Å; A697-A700 VanDerWaalsContact O-N 3.13Å; D698-A700 VanDerWaalsContact C-N 3.32Å; D698-A700 PolarHBondContact O-N 2.81Å
701	V	91.9	Very high	85.4	Confident	18 Å²	18	50.9 Å²	50.9	11%	0.109	28%	0.28	C	S	.	.	H	α-helix	trans	-67	-41.2	173.2	168.1	0	0	0	0	111.4	I644 F650 W654 A697 D698 I699 F703 R704 T705	I644-V701 HydrophobicContact CD1-CG1 3.99Å; F650-V701 HydrophobicContact CE1-CG1 4Å; F650-V701 HydrophobicContact CE1-CG2 4.26Å; F650-V701 HydrophobicContact CZ-CG2 4.3Å; W654-V701 HydrophobicContact CD2-CG2 4.31Å; W654-V701 HydrophobicContact CG-CG1 4.36Å; W654-V701 HydrophobicContact CH2-CG2 4.5Å; W654-V701 HydrophobicContact CZ2-CG2 4.05Å; A697-V701 WeakPolarHBondContact O-CG2 3.43Å; A697-V701 PolarHBondContact O-N 2.79Å; D698-V701 PolarHBondContact O-N 3.29Å; I699-V701 PolarHBondContact O-N 3.1Å; V701-F703 PolarHBondContact O-N 2.98Å; V701-R704 CarbonylContact O-C 3.57Å; V701-R704 WeakPolarHBondContact O-CA 3.31Å; V701-R704 PolarHBondContact O-N 2.8Å; V701-T705 PolarHBondContact O-N 3.5Å; V701-T705 PolarHBondContact O-OG1 3.17Å
702	K	89	Confident	84.2	Confident	45 Å²	45	59.3 Å²	59.3	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-42.6	175.6	-77.9	166.4	171.9	162.4	0	111.9	D698 I699 R704 T705 Y727 D735	D698-K702 WeakPolarHBondContact O-CB 3.49Å; D698-K702 WeakPolarHBondContact O-CG 3.47Å; D698-K702 PolarHBondContact O-N 3.49Å; D698-K702 WeakPolarHBondContact OD2-CE 3.27Å; D698-K702 IonicContact OD2-NZ 2.79Å; D698-K702 PolarHBondContact OD2-NZ 3.48Å; I699-K702 PolarHBondContact O-N 2.88Å; K702-R704 PolarHBondContact O-N 3.26Å; K702-T705 PolarHBondContact O-N 2.82Å; K702-T705 VanDerWaalsContact O-N 3.16Å; K702-Y727 HydrophobicContact CB-CD1 4.39Å; K702-Y727 HydrophobicContact CB-CE1 3.88Å; K702-Y727 HydrophobicContact CB-CE2 4.15Å; K702-Y727 HydrophobicContact CD-CE2 3.96Å; K702-Y727 WeakPolarHBondContact CD-OH 3.23Å; K702-D735 VanDerWaalsContact CD-OD2 3.28Å; K702-D735 WeakPolarHBondContact CD-OD2 3.46Å; K702-D735 WeakPolarHBondContact CE-OD2 3.45Å; K702-D735 IonicContact NZ-OD1 2.6Å; K702-D735 PolarHBondContact NZ-OD1 3.38Å; K702-D735 IonicContact NZ-OD2 2.99Å; K702-D735 PolarHBondContact NZ-OD2 2.96Å
703	F	91.9	Very high	83.1	Confident	52 Å²	52	58.8 Å²	58.8	23%	0.228	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-14.5	171.7	-84.8	-67.3	0	0	0	114.9	I699 V701 A724 Y727 L728 F732	I699-F703 HydrophobicContact CG2-CD2 3.99Å; I699-F703 HydrophobicContact CG2-CE2 3.78Å; I699-F703 VanDerWaalsContact O-CD2 3.23Å; I699-F703 WeakPolarHBondContact O-CD2 3.42Å; I699-F703 PolarHBondContact O-N 3.33Å; I699-F703 VanDerWaalsContact O-N 3.07Å; V701-F703 PolarHBondContact O-N 2.98Å; F703-A724 HydrophobicContact CD1-CB 3.81Å; F703-A724 HydrophobicContact CE1-CB 4.03Å; F703-Y727 AromaticContact CD1-CD1 3.92Å; F703-Y727 HydrophobicContact CD1-CD1 3.92Å; F703-Y727 HydrophobicContact CD2-CD1 4.12Å; F703-Y727 AromaticContact CD2-CE1 3.92Å; F703-Y727 HydrophobicContact CD2-CE1 3.92Å; F703-Y727 AromaticContact CE1-CD1 3.78Å; F703-Y727 HydrophobicContact CE1-CD1 3.78Å; F703-Y727 HydrophobicContact CE1-CE1 4.39Å; F703-Y727 AromaticContact CE2-CD1 3.98Å; F703-Y727 HydrophobicContact CE2-CD1 3.98Å; F703-Y727 AromaticContact CE2-CE1 3.74Å; F703-Y727 HydrophobicContact CE2-CE1 3.74Å; F703-Y727 HydrophobicContact CG-CD1 4.07Å; F703-Y727 HydrophobicContact CG-CE1 4.3Å; F703-Y727 AromaticContact CZ-CD1 3.8Å; F703-Y727 HydrophobicContact CZ-CD1 3.8Å; F703-Y727 AromaticContact CZ-CE1 3.98Å; F703-Y727 HydrophobicContact CZ-CE1 3.98Å; F703-L728 HydrophobicContact CE1-CD1 4.3Å; F703-L728 HydrophobicContact CE1-CD2 4.18Å; F703-L728 HydrophobicContact CE1-CG 3.9Å; F703-L728 HydrophobicContact CZ-CD2 3.86Å; F703-L728 HydrophobicContact CZ-CG 4.1Å; F703-F732 AromaticContact CE2-CD2 3.78Å; F703-F732 HydrophobicContact CE2-CD2 3.78Å; F703-F732 AromaticContact CE2-CE2 3.78Å; F703-F732 HydrophobicContact CE2-CE2 3.78Å; F703-F732 AromaticContact CZ-CD2 3.72Å; F703-F732 HydrophobicContact CZ-CD2 3.72Å; F703-F732 AromaticContact CZ-CE2 3.9Å; F703-F732 HydrophobicContact CZ-CE2 3.9Å; F703-F732 HydrophobicContact CZ-CG 4.44Å
704	R	91.1	Very high	81.9	Confident	117 Å²	117	61.5 Å²	61.5	44%	0.442	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-3.4	178.3	-61.4	-58.1	-176.4	154.3	-3.9	114.2	W642 I644 V701 K702	W642-R704 WeakPolarHBondContact O-CD 3.43Å; I644-R704 HydrophobicContact CD1-CB 4.13Å; I644-R704 HydrophobicContact CG1-CB 4.28Å; I644-R704 PolarHBondContact N-O 2.91Å; V701-R704 CarbonylContact O-C 3.57Å; V701-R704 WeakPolarHBondContact O-CA 3.31Å; V701-R704 PolarHBondContact O-N 2.8Å; K702-R704 PolarHBondContact O-N 3.26Å
705	T	90.6	Very high	81	Confident	15 Å²	15	66.3 Å²	66.3	9%	0.092	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-88.2	125	-177.9	-58.7	0	0	0	0	110.3	I644 R651 V701 K702 I723	I644-T705 WeakPolarHBondContact O-CA 3.22Å; R651-T705 HydrophobicContact CG-CG2 4.38Å; R651-T705 PolarHBondContact NH1-OG1 2.96Å; R651-T705 VanDerWaalsContact NH1-OG1 3.09Å; V701-T705 PolarHBondContact O-N 3.5Å; V701-T705 PolarHBondContact O-OG1 3.17Å; K702-T705 PolarHBondContact O-N 2.82Å; K702-T705 VanDerWaalsContact O-N 3.16Å; T705-I723 VanDerWaalsContact O-CG2 3.25Å; T705-I723 WeakPolarHBondContact O-CG2 3.35Å
706	G	88.9	Confident	80.8	Confident	4 Å²	4	66 Å²	66	4%	0.041	34%	0.343	C	S	.	.			trans	-62.4	145.3	175.8	0	0	0	0	0	112.8	I644 P646 I717	I644-G706 PolarHBondContact O-N 3.06Å; P646-G706 WeakPolarHBondContact CB-O 3.23Å; P646-G706 WeakPolarHBondContact CG-O 3.25Å; G706-I717 CarbonylContact C-O 3.53Å; G706-I717 VanDerWaalsContact CA-O 3.26Å; G706-I717 WeakPolarHBondContact CA-O 3.42Å
707	I	86.7	Confident	80.7	Confident	39 Å²	39	63.6 Å²	63.6	20%	0.2	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.7	-175.7	-59.4	176.9	0	0	0	108.7	T709 I716 I717 I723 H726	I707-T709 HydrophobicContact CG2-CG2 4.46Å; I707-I716 CarbonylContact O-C 3.49Å; I707-I716 WeakPolarHBondContact O-CA 3.33Å; I707-I717 PolarHBondContact N-O 3.42Å; I707-I717 PolarHBondContact O-N 3.1Å; I707-I723 HydrophobicContact CD1-CB 4.47Å; I707-I723 HydrophobicContact CD1-CG2 4.36Å; I707-I723 HydrophobicContact CG1-CG1 4.37Å; I707-I723 HydrophobicContact CG1-CG2 4.49Å; I707-H726 HydrophobicContact CD1-CB 3.77Å
708	V	84.1	Confident	80.4	Confident	65 Å²	65	61.9 Å²	61.9	39%	0.394	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.2	168.8	-170.3	0	0	0	0	107.6	P646 I716	P646-V708 HydrophobicContact CB-CG2 4.42Å; P646-V708 HydrophobicContact CG-CG2 3.93Å; V708-I716 HydrophobicContact CG1-CG1 4.42Å; V708-I716 HydrophobicContact CG2-CD1 4.46Å; V708-I716 HydrophobicContact CG2-CG1 4.2Å
709	T	72.6	Confident	80.2	Confident	34 Å²	34	65 Å²	65	21%	0.209	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.9	176.1	30.1	0	0	0	0	110.9	I707 E715 I717	I707-T709 HydrophobicContact CG2-CG2 4.46Å; T709-E715 PolarHBondContact N-O 3.48Å; T709-E715 PolarHBondContact OG1-O 3.5Å; T709-I717 HydrophobicContact CG2-CD1 3.71Å; T709-I717 HydrophobicContact CG2-CG1 4.4Å
710	N	66.7	Low	80.1	Confident	129 Å²	129	66.2 Å²	66.2	69%	0.69	34%	0.342	S	S	*	.	S	Bend	trans	67.2	162.5	-165.7	-48.7	-42.3	0	0	0	113.4	Y712	N710-Y712 PolarHBondContact O-N 3.31Å
711	D	59.9	Low	80	Confident	175 Å²	175	72.5 Å²	72.5	94%	0.936	36%	0.359	S	S	*	.	S	Bend	trans	-71.7	-10.8	-179.5	-67.3	-55.4	0	0	0	113.4
712	Y	57.5	Low	79.8	Confident	181 Å²	181	75.8 Å²	75.8	71%	0.71	37%	0.373	S	S	*	.	S	Bend	trans	-97.1	134.7	174.5	-57.8	-80.2	0	0	0	110.3	N710 D714	N710-Y712 PolarHBondContact O-N 3.31Å; Y712-D714 PolarHBondContact O-N 3.12Å; Y712-D714 VanDerWaalsContact O-N 3.09Å
713	A	60.1	Low	79.8	Confident	21 Å²	21	73.7 Å²	73.7	17%	0.174	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	5.5	-165.9	0	0	0	0	0	115.9	L622 E715	L622-A713 HydrophobicContact CD1-CB 3.6Å; L622-A713 HydrophobicContact CD2-CB 4.33Å; L622-A713 HydrophobicContact CG-CB 3.62Å; A713-E715 VanDerWaalsContact C-N 3.3Å; A713-E715 PolarHBondContact O-N 3.22Å
714	D	62.4	Low	79.8	Confident	148 Å²	148	72.2 Å²	72.2	79%	0.791	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-32.1	-170.8	-63.7	-42.8	0	0	0	113.1	Y712	Y712-D714 PolarHBondContact O-N 3.12Å; Y712-D714 VanDerWaalsContact O-N 3.09Å
715	E	70.1	Confident	79.9	Confident	129 Å²	129	75.8 Å²	75.8	60%	0.603	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	83.8	179.3	-62.7	-161.2	155.3	0	0	112	T709 A713	T709-E715 PolarHBondContact N-O 3.48Å; T709-E715 PolarHBondContact OG1-O 3.5Å; A713-E715 VanDerWaalsContact C-N 3.3Å; A713-E715 PolarHBondContact O-N 3.22Å
716	I	82.5	Confident	79.8	Confident	2 Å²	2	79.9 Å²	79.9	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.1	161.3	-51.4	-179.3	0	0	0	108.4	F623 R635 H645 P646 I707 V708 L718	F623-I716 HydrophobicContact CE1-CD1 3.91Å; F623-I716 HydrophobicContact CZ-CD1 3.81Å; R635-I716 VanDerWaalsContact CZ-O 3.29Å; R635-I716 PolarHBondContact NH1-O 2.99Å; R635-I716 PolarHBondContact NH2-O 2.87Å; H645-I716 WeakPolarHBondContact NE2-CD1 3.35Å; P646-I716 HydrophobicContact CG-CG2 3.91Å; I707-I716 CarbonylContact O-C 3.49Å; I707-I716 WeakPolarHBondContact O-CA 3.33Å; V708-I716 HydrophobicContact CG1-CG1 4.42Å; V708-I716 HydrophobicContact CG2-CD1 4.46Å; V708-I716 HydrophobicContact CG2-CG1 4.2Å; I716-L718 HydrophobicContact CG2-CG 4.45Å; I716-L718 PolarHBondContact O-N 3.02Å
717	I	84.2	Confident	79.8	Confident	39 Å²	39	80.5 Å²	80.5	20%	0.2	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.8	175.5	-60.1	-179.8	0	0	0	109.4	G706 I707 T709 N719 E722	G706-I717 CarbonylContact C-O 3.53Å; G706-I717 VanDerWaalsContact CA-O 3.26Å; G706-I717 WeakPolarHBondContact CA-O 3.42Å; I707-I717 PolarHBondContact N-O 3.42Å; I707-I717 PolarHBondContact O-N 3.1Å; T709-I717 HydrophobicContact CG2-CD1 3.71Å; T709-I717 HydrophobicContact CG2-CG1 4.4Å; I717-N719 HydrophobicContact CG2-CB 4.28Å; I717-E722 HydrophobicContact CG2-CB 3.93Å; I717-E722 HydrophobicContact CG2-CG 3.82Å; I717-E722 WeakPolarHBondContact CG2-OE2 3.4Å
718	L	85.2	Confident	80.1	Confident	1 Å²	1	82.5 Å²	82.5	1%	0.005	41%	0.405	C	S	.	.			trans	-101.9	-7.4	177.7	-72.7	167.4	0	0	0	113.2	E632 R635 Q636 Q639 V643 I716 P720 I723	E632-L718 VanDerWaalsContact OE1-CD1 3.31Å; E632-L718 WeakPolarHBondContact OE1-CD1 3.39Å; R635-L718 HydrophobicContact CG-CD1 4.46Å; Q636-L718 HydrophobicContact CB-CD1 4.06Å; Q636-L718 HydrophobicContact CG-CD2 4.46Å; Q639-L718 PolarHBondContact OE1-O 3.37Å; V643-L718 HydrophobicContact CG1-CB 4.41Å; V643-L718 HydrophobicContact CG1-CD2 3.83Å; I716-L718 HydrophobicContact CG2-CG 4.45Å; I716-L718 PolarHBondContact O-N 3.02Å; L718-P720 VanDerWaalsContact O-CD 3.28Å; L718-P720 WeakPolarHBondContact O-CD 3.42Å; L718-I723 WeakPolarHBondContact O-CD1 3.44Å
719	N	87.1	Confident	80.3	Confident	75 Å²	75	88.5 Å²	88.5	40%	0.401	43%	0.426	S	S	.	.			trans	-65.4	114.8	-176.2	-77.5	-39.3	0	0	0	111.7	Q639 I717 K721 E722 I723	Q639-N719 VanDerWaalsContact OE1-N 3.08Å; Q639-N719 PolarHBondContact OE1-OD1 2.94Å; I717-N719 HydrophobicContact CG2-CB 4.28Å; N719-K721 VanDerWaalsContact C-N 3.33Å; N719-K721 PolarHBondContact O-N 3.31Å; N719-E722 HydrophobicContact CB-CB 3.66Å; N719-E722 WeakPolarHBondContact CB-OE2 3.49Å; N719-E722 PolarHBondContact ND2-OE2 2.74Å; N719-E722 WeakPolarHBondContact O-CB 3.44Å; N719-E722 PolarHBondContact O-N 2.87Å; N719-I723 WeakPolarHBondContact O-CG1 3.41Å; N719-I723 PolarHBondContact O-N 3.3Å
720	P	87.9	Confident	80.7	Confident	43 Å²	43	89.1 Å²	89.1	28%	0.279	43%	0.432	S	S	.	.	H	α-helix	trans	-59.8	-36.6	-174.2	-27.6	36.1	0	0	0	114.8	V643 L718 E722 A724	V643-P720 HydrophobicContact CG2-CG 3.77Å; L718-P720 VanDerWaalsContact O-CD 3.28Å; L718-P720 WeakPolarHBondContact O-CD 3.42Å; P720-E722 VanDerWaalsContact C-N 3.26Å; P720-E722 PolarHBondContact O-N 3.37Å; P720-A724 VanDerWaalsContact O-CB 3.26Å; P720-A724 WeakPolarHBondContact O-CB 3.3Å; P720-A724 PolarHBondContact O-N 2.92Å
721	K	88.9	Confident	81.3	Confident	191 Å²	191	90.9 Å²	90.9	83%	0.83	43%	0.428	S	S	*	.	H	α-helix	trans	-67.8	-27.7	177.1	-66.2	-177.6	178.8	179.4	0	112.7	N719 R725	N719-K721 VanDerWaalsContact C-N 3.33Å; N719-K721 PolarHBondContact O-N 3.31Å; K721-R725 WeakPolarHBondContact O-CB 3.29Å; K721-R725 PolarHBondContact O-N 2.96Å
722	E	88.2	Confident	82.6	Confident	86 Å²	86	84.8 Å²	84.8	40%	0.402	39%	0.394	S	S	.	.	H	α-helix	trans	-87.5	-44.7	-176	-163.1	160	-146.2	0	0	110.8	I717 N719 P720 A724 R725 H726	I717-E722 HydrophobicContact CG2-CB 3.93Å; I717-E722 HydrophobicContact CG2-CG 3.82Å; I717-E722 WeakPolarHBondContact CG2-OE2 3.4Å; N719-E722 HydrophobicContact CB-CB 3.66Å; N719-E722 WeakPolarHBondContact CB-OE2 3.49Å; N719-E722 PolarHBondContact ND2-OE2 2.74Å; N719-E722 WeakPolarHBondContact O-CB 3.44Å; N719-E722 PolarHBondContact O-N 2.87Å; P720-E722 VanDerWaalsContact C-N 3.26Å; P720-E722 PolarHBondContact O-N 3.37Å; E722-A724 VanDerWaalsContact C-N 3.33Å; E722-A724 PolarHBondContact O-N 3.43Å; E722-R725 PolarHBondContact O-N 3.38Å; E722-H726 WeakPolarHBondContact O-CB 3.42Å; E722-H726 PolarHBondContact O-N 3.21Å
723	I	90	Very high	83.6	Confident	1 Å²	1	81 Å²	81	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-50	-54.3	166.4	-65.5	163.4	0	0	0	109.8	T705 I707 L718 N719 R725 H726 Y727	T705-I723 VanDerWaalsContact O-CG2 3.25Å; T705-I723 WeakPolarHBondContact O-CG2 3.35Å; I707-I723 HydrophobicContact CD1-CB 4.47Å; I707-I723 HydrophobicContact CD1-CG2 4.36Å; I707-I723 HydrophobicContact CG1-CG1 4.37Å; I707-I723 HydrophobicContact CG1-CG2 4.49Å; L718-I723 WeakPolarHBondContact O-CD1 3.44Å; N719-I723 WeakPolarHBondContact O-CG1 3.41Å; N719-I723 PolarHBondContact O-N 3.3Å; I723-R725 PolarHBondContact O-N 3.42Å; I723-H726 PolarHBondContact O-N 3.13Å; I723-Y727 WeakPolarHBondContact O-CB 3.25Å; I723-Y727 PolarHBondContact O-N 3.03Å
724	A	91.6	Very high	84.2	Confident	22 Å²	22	83.7 Å²	83.7	18%	0.182	40%	0.396	C	S	.	.	H	α-helix	trans	-59.9	-45.5	179.9	0	0	0	0	0	112.5	F703 P720 E722 H726 Y727 L728	F703-A724 HydrophobicContact CD1-CB 3.81Å; F703-A724 HydrophobicContact CE1-CB 4.03Å; P720-A724 VanDerWaalsContact O-CB 3.26Å; P720-A724 WeakPolarHBondContact O-CB 3.3Å; P720-A724 PolarHBondContact O-N 2.92Å; E722-A724 VanDerWaalsContact C-N 3.33Å; E722-A724 PolarHBondContact O-N 3.43Å; A724-H726 PolarHBondContact O-N 2.86Å; A724-Y727 PolarHBondContact O-N 3.05Å; A724-L728 VanDerWaalsContact O-CB 3.24Å; A724-L728 WeakPolarHBondContact O-CB 3.31Å; A724-L728 WeakPolarHBondContact O-CD1 2.92Å; A724-L728 WeakPolarHBondContact O-CG 2.83Å; A724-L728 PolarHBondContact O-N 3.14Å
725	R	92.1	Very high	85	Confident	191 Å²	191	77.7 Å²	77.7	72%	0.721	36%	0.364	S	S	*	.	H	α-helix	trans	-63.2	-40.7	177.9	-179.4	-177.8	-74.4	160.3	-6.6	112.3	K721 E722 I723 K729	K721-R725 WeakPolarHBondContact O-CB 3.29Å; K721-R725 PolarHBondContact O-N 2.96Å; E722-R725 PolarHBondContact O-N 3.38Å; I723-R725 PolarHBondContact O-N 3.42Å; R725-K729 WeakPolarHBondContact O-CB 3.43Å; R725-K729 PolarHBondContact O-N 3.25Å
726	H	89.2	Confident	85.5	Confident	102 Å²	102	76.3 Å²	76.3	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-69	-44.3	179	-171.4	-85.7	0	0	0	111.7	I707 E722 I723 A724 K729 S730	I707-H726 HydrophobicContact CD1-CB 3.77Å; E722-H726 WeakPolarHBondContact O-CB 3.42Å; E722-H726 PolarHBondContact O-N 3.21Å; I723-H726 PolarHBondContact O-N 3.13Å; A724-H726 PolarHBondContact O-N 2.86Å; H726-K729 PolarHBondContact O-N 2.87Å; H726-S730 PolarHBondContact O-N 3.42Å; H726-S730 PolarHBondContact O-OG 3.21Å
727	Y	89.6	Confident	85.1	Confident	16 Å²	16	77.6 Å²	77.6	6%	0.063	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-44.8	178.3	179.6	-129.2	0	0	0	112.5	I699 K702 F703 I723 A724 K729 S730 W731 F732 D735	I699-Y727 HydrophobicContact CG2-CE1 4.3Å; K702-Y727 HydrophobicContact CB-CD1 4.39Å; K702-Y727 HydrophobicContact CB-CE1 3.88Å; K702-Y727 HydrophobicContact CB-CE2 4.15Å; K702-Y727 HydrophobicContact CD-CE2 3.96Å; K702-Y727 WeakPolarHBondContact CD-OH 3.23Å; F703-Y727 AromaticContact CD1-CD1 3.92Å; F703-Y727 HydrophobicContact CD1-CD1 3.92Å; F703-Y727 HydrophobicContact CD2-CD1 4.12Å; F703-Y727 AromaticContact CD2-CE1 3.92Å; F703-Y727 HydrophobicContact CD2-CE1 3.92Å; F703-Y727 AromaticContact CE1-CD1 3.78Å; F703-Y727 HydrophobicContact CE1-CD1 3.78Å; F703-Y727 HydrophobicContact CE1-CE1 4.39Å; F703-Y727 AromaticContact CE2-CD1 3.98Å; F703-Y727 HydrophobicContact CE2-CD1 3.98Å; F703-Y727 AromaticContact CE2-CE1 3.74Å; F703-Y727 HydrophobicContact CE2-CE1 3.74Å; F703-Y727 HydrophobicContact CG-CD1 4.07Å; F703-Y727 HydrophobicContact CG-CE1 4.3Å; F703-Y727 AromaticContact CZ-CD1 3.8Å; F703-Y727 HydrophobicContact CZ-CD1 3.8Å; F703-Y727 AromaticContact CZ-CE1 3.98Å; F703-Y727 HydrophobicContact CZ-CE1 3.98Å; I723-Y727 WeakPolarHBondContact O-CB 3.25Å; I723-Y727 PolarHBondContact O-N 3.03Å; A724-Y727 PolarHBondContact O-N 3.05Å; Y727-K729 VanDerWaalsContact C-N 3.27Å; Y727-K729 PolarHBondContact O-N 3.17Å; Y727-S730 PolarHBondContact O-N 3.42Å; Y727-S730 VanDerWaalsContact O-N 3.1Å; Y727-S730 PolarHBondContact O-OG 3.45Å; Y727-W731 HydrophobicContact CD2-CB 4.19Å; Y727-W731 HydrophobicContact CE2-CB 3.96Å; Y727-W731 PolarHBondContact O-N 3.42Å; Y727-F732 HydrophobicContact CD1-CB 4.22Å; Y727-F732 HydrophobicContact CD1-CD2 4.44Å; Y727-F732 HydrophobicContact CD2-CB 4.46Å; Y727-F732 HydrophobicContact CE1-CB 4.07Å; Y727-F732 AromaticContact CE1-CD2 3.83Å; Y727-F732 HydrophobicContact CE1-CD2 3.83Å; Y727-F732 HydrophobicContact CE1-CG 4.44Å; Y727-F732 HydrophobicContact CE2-CB 4.31Å; Y727-F732 HydrophobicContact CG-CB 4.4Å; Y727-F732 WeakPolarHBondContact O-CB 3.33Å; Y727-F732 PolarHBondContact O-N 3.03Å; Y727-F732 VanDerWaalsContact O-N 3.14Å; Y727-D735 VanDerWaalsContact CE2-OD2 3.29Å; Y727-D735 WeakPolarHBondContact CE2-OD2 3.17Å; Y727-D735 WeakPolarHBondContact OH-CB 3.44Å; Y727-D735 PolarHBondContact OH-OD2 3.4Å
728	L	91.5	Very high	84.4	Confident	82 Å²	82	76.6 Å²	76.6	43%	0.429	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-34.8	174.4	-76.2	167.6	0	0	0	113	F703 A724 S730 F732	F703-L728 HydrophobicContact CE1-CD1 4.3Å; F703-L728 HydrophobicContact CE1-CD2 4.18Å; F703-L728 HydrophobicContact CE1-CG 3.9Å; F703-L728 HydrophobicContact CZ-CD2 3.86Å; F703-L728 HydrophobicContact CZ-CG 4.1Å; A724-L728 VanDerWaalsContact O-CB 3.24Å; A724-L728 WeakPolarHBondContact O-CB 3.31Å; A724-L728 WeakPolarHBondContact O-CD1 2.92Å; A724-L728 WeakPolarHBondContact O-CG 2.83Å; A724-L728 PolarHBondContact O-N 3.14Å; L728-S730 VanDerWaalsContact C-N 3.35Å; L728-F732 HydrophobicContact CD2-CB 4.35Å; L728-F732 HydrophobicContact CD2-CD1 3.61Å; L728-F732 HydrophobicContact CD2-CD2 4.32Å; L728-F732 HydrophobicContact CD2-CE1 3.94Å; L728-F732 HydrophobicContact CD2-CG 3.81Å; L728-F732 HydrophobicContact CD2-CZ 4.43Å
729	K	89.9	Confident	84	Confident	191 Å²	191	76.8 Å²	76.8	83%	0.83	36%	0.36	S	S	*	.	H	α-helix	trans	-77	-19.1	178.2	-172.2	-179.2	174.8	-167.1	0	113.3	R725 H726 Y727	R725-K729 WeakPolarHBondContact O-CB 3.43Å; R725-K729 PolarHBondContact O-N 3.25Å; H726-K729 PolarHBondContact O-N 2.87Å; Y727-K729 VanDerWaalsContact C-N 3.27Å; Y727-K729 PolarHBondContact O-N 3.17Å
730	S	80.5	Confident	83.3	Confident	47 Å²	47	75.6 Å²	75.6	33%	0.329	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-90.2	-170.4	54.2	0	0	0	0	112.5	H726 Y727 L728	H726-S730 PolarHBondContact O-N 3.42Å; H726-S730 PolarHBondContact O-OG 3.21Å; Y727-S730 PolarHBondContact O-N 3.42Å; Y727-S730 VanDerWaalsContact O-N 3.1Å; Y727-S730 PolarHBondContact O-OG 3.45Å; L728-S730 VanDerWaalsContact C-N 3.35Å
731	W	79.6	Confident	82.6	Confident	165 Å²	165	75.5 Å²	75.5	63%	0.625	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-18.4	-165.4	-66.5	97.9	0	0	0	114.8	Y727 I733 L734 D735	Y727-W731 HydrophobicContact CD2-CB 4.19Å; Y727-W731 HydrophobicContact CE2-CB 3.96Å; Y727-W731 PolarHBondContact O-N 3.42Å; W731-I733 VanDerWaalsContact C-N 3.29Å; W731-I733 PolarHBondContact O-N 3.33Å; W731-I733 VanDerWaalsContact O-N 3.15Å; W731-L734 HydrophobicContact CE3-CD1 3.84Å; W731-L734 HydrophobicContact CZ3-CD1 3.9Å; W731-L734 PolarHBondContact O-N 2.75Å; W731-D735 PolarHBondContact O-N 3.3Å
732	F	85.9	Confident	81.4	Confident	47 Å²	47	67.7 Å²	67.7	21%	0.206	32%	0.32	C	S	.	.	H	α-helix	trans	-52	-41.9	-173.9	171.4	-103.4	0	0	0	114.1	I699 F703 Y727 L728 L734 D735 F736	I699-F732 HydrophobicContact CG2-CD2 4.23Å; I699-F732 HydrophobicContact CG2-CE2 4.05Å; F703-F732 AromaticContact CE2-CD2 3.78Å; F703-F732 HydrophobicContact CE2-CD2 3.78Å; F703-F732 AromaticContact CE2-CE2 3.78Å; F703-F732 HydrophobicContact CE2-CE2 3.78Å; F703-F732 AromaticContact CZ-CD2 3.72Å; F703-F732 HydrophobicContact CZ-CD2 3.72Å; F703-F732 AromaticContact CZ-CE2 3.9Å; F703-F732 HydrophobicContact CZ-CE2 3.9Å; F703-F732 HydrophobicContact CZ-CG 4.44Å; Y727-F732 HydrophobicContact CD1-CB 4.22Å; Y727-F732 HydrophobicContact CD1-CD2 4.44Å; Y727-F732 HydrophobicContact CD2-CB 4.46Å; Y727-F732 HydrophobicContact CE1-CB 4.07Å; Y727-F732 AromaticContact CE1-CD2 3.83Å; Y727-F732 HydrophobicContact CE1-CD2 3.83Å; Y727-F732 HydrophobicContact CE1-CG 4.44Å; Y727-F732 HydrophobicContact CE2-CB 4.31Å; Y727-F732 HydrophobicContact CG-CB 4.4Å; Y727-F732 WeakPolarHBondContact O-CB 3.33Å; Y727-F732 PolarHBondContact O-N 3.03Å; Y727-F732 VanDerWaalsContact O-N 3.14Å; L728-F732 HydrophobicContact CD2-CB 4.35Å; L728-F732 HydrophobicContact CD2-CD1 3.61Å; L728-F732 HydrophobicContact CD2-CD2 4.32Å; L728-F732 HydrophobicContact CD2-CE1 3.94Å; L728-F732 HydrophobicContact CD2-CG 3.81Å; L728-F732 HydrophobicContact CD2-CZ 4.43Å; F732-L734 VanDerWaalsContact C-N 3.33Å; F732-L734 PolarHBondContact O-N 2.94Å; F732-D735 PolarHBondContact O-N 3.39Å; F732-F736 HydrophobicContact CE1-CB 4.44Å; F732-F736 HydrophobicContact CE2-CB 4.19Å; F732-F736 HydrophobicContact CZ-CB 4.12Å; F732-F736 HydrophobicContact CZ-CD2 4.33Å; F732-F736 HydrophobicContact CZ-CG 4.16Å; F732-F736 WeakPolarHBondContact O-CB 3.2Å; F732-F736 PolarHBondContact O-N 2.82Å
733	I	79.2	Confident	80.3	Confident	101 Å²	101	68.1 Å²	68.1	52%	0.518	33%	0.325	S	S	.	.	H	α-helix	trans	-65	-38.9	-177.5	-60	175.7	0	0	0	111.2	W731 I737	W731-I733 VanDerWaalsContact C-N 3.29Å; W731-I733 PolarHBondContact O-N 3.33Å; W731-I733 VanDerWaalsContact O-N 3.15Å; I733-I737 HydrophobicContact CG2-CD1 3.91Å; I733-I737 WeakPolarHBondContact O-CD1 3.33Å; I733-I737 VanDerWaalsContact O-CG1 3.3Å; I733-I737 WeakPolarHBondContact O-CG1 3.09Å; I733-I737 PolarHBondContact O-N 3.33Å
734	L	72.4	Confident	79.4	Confident	79 Å²	79	70.9 Å²	70.9	41%	0.414	34%	0.336	S	S	.	.	H	α-helix	trans	-72.4	-45.4	178.4	-65.2	173.4	0	0	0	111.1	W731 F732 S738	W731-L734 HydrophobicContact CE3-CD1 3.84Å; W731-L734 HydrophobicContact CZ3-CD1 3.9Å; W731-L734 PolarHBondContact O-N 2.75Å; F732-L734 VanDerWaalsContact C-N 3.33Å; F732-L734 PolarHBondContact O-N 2.94Å; L734-S738 VanDerWaalsContact O-CB 3.3Å; L734-S738 WeakPolarHBondContact O-CB 3.4Å; L734-S738 PolarHBondContact O-N 3.37Å; L734-S738 VanDerWaalsContact O-N 3.11Å; L734-S738 PolarHBondContact O-OG 3.12Å
735	D	80.6	Confident	78.3	Confident	22 Å²	22	73.1 Å²	73.1	12%	0.118	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-54.1	176.2	-81.9	-33.4	0	0	0	111	I699 K702 Y727 W731 F732 I737 S738 S739	I699-D735 HydrophobicContact CD1-CB 4.4Å; I699-D735 HydrophobicContact CG1-CB 4.1Å; K702-D735 VanDerWaalsContact CD-OD2 3.28Å; K702-D735 WeakPolarHBondContact CD-OD2 3.46Å; K702-D735 WeakPolarHBondContact CE-OD2 3.45Å; K702-D735 IonicContact NZ-OD1 2.6Å; K702-D735 PolarHBondContact NZ-OD1 3.38Å; K702-D735 IonicContact NZ-OD2 2.99Å; K702-D735 PolarHBondContact NZ-OD2 2.96Å; Y727-D735 VanDerWaalsContact CE2-OD2 3.29Å; Y727-D735 WeakPolarHBondContact CE2-OD2 3.17Å; Y727-D735 WeakPolarHBondContact OH-CB 3.44Å; Y727-D735 PolarHBondContact OH-OD2 3.4Å; W731-D735 PolarHBondContact O-N 3.3Å; F732-D735 PolarHBondContact O-N 3.39Å; D735-I737 PolarHBondContact O-N 3.12Å; D735-S738 CarbonylContact O-C 3.57Å; D735-S738 WeakPolarHBondContact O-CA 3.46Å; D735-S738 WeakPolarHBondContact O-CB 3.3Å; D735-S738 PolarHBondContact O-N 2.99Å; D735-S738 PolarHBondContact O-OG 3.48Å; D735-S739 PolarHBondContact O-N 2.79Å; D735-S739 PolarHBondContact O-OG 3.45Å
736	F	80.6	Confident	77	Confident	100 Å²	100	70.5 Å²	70.5	44%	0.439	34%	0.335	S	S	.	.	H	α-helix	trans	-52.6	-52.3	-178.7	178	-116.9	0	0	0	112.1	I699 F732 S738 S739 I740	I699-F736 HydrophobicContact CD1-CB 4.47Å; F732-F736 HydrophobicContact CE1-CB 4.44Å; F732-F736 HydrophobicContact CE2-CB 4.19Å; F732-F736 HydrophobicContact CZ-CB 4.12Å; F732-F736 HydrophobicContact CZ-CD2 4.33Å; F732-F736 HydrophobicContact CZ-CG 4.16Å; F732-F736 WeakPolarHBondContact O-CB 3.2Å; F732-F736 PolarHBondContact O-N 2.82Å; F736-S738 PolarHBondContact O-N 3.14Å; F736-S739 PolarHBondContact O-N 3.5Å; F736-I740 HydrophobicContact CD1-CD1 4.2Å; F736-I740 HydrophobicContact CE1-CD1 3.83Å; F736-I740 HydrophobicContact CE2-CD1 4.41Å; F736-I740 HydrophobicContact CE2-CG1 4.49Å; F736-I740 HydrophobicContact CZ-CD1 3.94Å; F736-I740 HydrophobicContact CZ-CG1 4.46Å; F736-I740 WeakPolarHBondContact O-CG1 3.4Å
737	I	72.1	Confident	76	Confident	29 Å²	29	69.7 Å²	69.7	15%	0.149	33%	0.334	C	S	.	.	H	α-helix	trans	-72.1	-21.8	-177.1	-55.5	167.5	0	0	0	111.7	I733 D735 S739 A771 L774	I733-I737 HydrophobicContact CG2-CD1 3.91Å; I733-I737 WeakPolarHBondContact O-CD1 3.33Å; I733-I737 VanDerWaalsContact O-CG1 3.3Å; I733-I737 WeakPolarHBondContact O-CG1 3.09Å; I733-I737 PolarHBondContact O-N 3.33Å; D735-I737 PolarHBondContact O-N 3.12Å; I737-S739 VanDerWaalsContact C-N 3.26Å; I737-S739 PolarHBondContact O-N 3.42Å; I737-A771 VanDerWaalsContact CG2-O 3.31Å; I737-A771 WeakPolarHBondContact CG2-O 3.34Å; I737-L774 HydrophobicContact CB-CB 4.27Å; I737-L774 HydrophobicContact CD1-CB 4.36Å; I737-L774 HydrophobicContact CD1-CD1 3.65Å; I737-L774 HydrophobicContact CG2-CB 3.59Å
738	S	70.7	Confident	75.1	Confident	17 Å²	17	73.7 Å²	73.7	12%	0.119	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.4	170.8	84.2	0	0	0	0	114.7	L734 D735 F736 R778	L734-S738 VanDerWaalsContact O-CB 3.3Å; L734-S738 WeakPolarHBondContact O-CB 3.4Å; L734-S738 PolarHBondContact O-N 3.37Å; L734-S738 VanDerWaalsContact O-N 3.11Å; L734-S738 PolarHBondContact O-OG 3.12Å; D735-S738 CarbonylContact O-C 3.57Å; D735-S738 WeakPolarHBondContact O-CA 3.46Å; D735-S738 WeakPolarHBondContact O-CB 3.3Å; D735-S738 PolarHBondContact O-N 2.99Å; D735-S738 PolarHBondContact O-OG 3.48Å; F736-S738 PolarHBondContact O-N 3.14Å; S738-R778 PolarHBondContact OG-NH2 2.99Å
739	S	76.9	Confident	74	Confident	5 Å²	5	75.4 Å²	75.4	4%	0.035	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	9.3	-175.8	-48.7	0	0	0	0	113.8	F695 D735 F736 I737 P741	F695-S739 WeakPolarHBondContact CB-OG 3.31Å; D735-S739 PolarHBondContact O-N 2.79Å; D735-S739 PolarHBondContact O-OG 3.45Å; F736-S739 PolarHBondContact O-N 3.5Å; I737-S739 VanDerWaalsContact C-N 3.26Å; I737-S739 PolarHBondContact O-N 3.42Å; S739-P741 WeakPolarHBondContact O-CD 3.31Å
740	I	72.4	Confident	72.8	Confident	50 Å²	50	70.9 Å²	70.9	26%	0.256	34%	0.344	S	S	.	.			trans	-92.4	119.9	176.7	-61.8	165.9	0	0	0	109.3	F736 M742	F736-I740 HydrophobicContact CD1-CD1 4.2Å; F736-I740 HydrophobicContact CE1-CD1 3.83Å; F736-I740 HydrophobicContact CE2-CD1 4.41Å; F736-I740 HydrophobicContact CE2-CG1 4.49Å; F736-I740 HydrophobicContact CZ-CD1 3.94Å; F736-I740 HydrophobicContact CZ-CG1 4.46Å; F736-I740 WeakPolarHBondContact O-CG1 3.4Å; I740-M742 HydrophobicContact CB-CG 4.35Å; I740-M742 HydrophobicContact CB-SD 4.41Å; I740-M742 HydrophobicContact CG2-CG 3.92Å; I740-M742 HydrophobicContact CG2-SD 3.59Å; I740-M742 VanDerWaalsContact CG2-SD 3.59Å; I740-M742 PolarHBondContact O-N 3.25Å
741	P	73.4	Confident	72	Confident	41 Å²	41	76.9 Å²	76.9	27%	0.266	36%	0.364	S	S	.	.			trans	-73.8	74.5	173.6	30.5	-35.4	0	0	0	111.2	D692 S739 D743 Y744 L745	D692-P741 WeakPolarHBondContact OD2-CB 3.48Å; S739-P741 WeakPolarHBondContact O-CD 3.31Å; P741-D743 PolarHBondContact O-N 3.03Å; P741-D743 VanDerWaalsContact O-N 3.09Å; P741-Y744 HydrophobicContact CB-CD2 3.49Å; P741-Y744 VanDerWaalsContact CB-CD2 3.49Å; P741-Y744 HydrophobicContact CB-CE2 3.97Å; P741-Y744 HydrophobicContact CB-CG 4.27Å; P741-Y744 HydrophobicContact CG-CD2 4.14Å; P741-Y744 PolarHBondContact O-N 2.91Å; P741-L745 PolarHBondContact O-N 2.92Å; P741-L745 VanDerWaalsContact O-N 3.11Å
742	M	63.7	Low	70.9	Confident	28 Å²	28	77 Å²	77	14%	0.138	37%	0.369	C	S	.	.	H	α-helix	trans	-60.6	-20.8	-175.5	-72.7	-65	-60.9	0	0	113.7	I740 L745 Y746 L768 A771 K772	I740-M742 HydrophobicContact CB-CG 4.35Å; I740-M742 HydrophobicContact CB-SD 4.41Å; I740-M742 HydrophobicContact CG2-CG 3.92Å; I740-M742 HydrophobicContact CG2-SD 3.59Å; I740-M742 VanDerWaalsContact CG2-SD 3.59Å; I740-M742 PolarHBondContact O-N 3.25Å; M742-L745 HydrophobicContact CE-CD2 4.45Å; M742-L745 HydrophobicContact SD-CD2 4.13Å; M742-Y746 WeakPolarHBondContact O-CB 3.24Å; M742-Y746 PolarHBondContact O-N 2.93Å; M742-L768 HydrophobicContact CE-CD2 4.48Å; M742-A771 HydrophobicContact CE-CB 4.31Å; M742-K772 HydrophobicContact CB-CD 4.24Å; M742-K772 VanDerWaalsContact CB-CE 3.46Å; M742-K772 HydrophobicContact CB-CG 3.76Å; M742-K772 HydrophobicContact CE-CG 4.29Å; M742-K772 HydrophobicContact CG-CG 3.95Å
743	D	65.1	Low	69.2	Low	94 Å²	94	80.4 Å²	80.4	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-78.7	-41.2	178.2	-70.4	-68.1	0	0	0	112.8	P741 L745 Y746 L747 K772	P741-D743 PolarHBondContact O-N 3.03Å; P741-D743 VanDerWaalsContact O-N 3.09Å; D743-L745 VanDerWaalsContact C-N 3.31Å; D743-Y746 PolarHBondContact O-N 3.42Å; D743-L747 PolarHBondContact O-N 3.11Å; D743-K772 IonicContact OD1-NZ 2.96Å; D743-K772 PolarHBondContact OD1-NZ 3Å; D743-K772 IonicContact OD2-NZ 2.85Å; D743-K772 PolarHBondContact OD2-NZ 3.42Å
744	Y	70.3	Confident	67.8	Low	60 Å²	60	83.9 Å²	83.9	24%	0.235	40%	0.404	C	S	.	.	H	α-helix	trans	-66.8	-36.9	169.7	-52.4	-33.1	0	0	0	111	I685 N688 S689 P741 Y746 L747 I748	I685-Y744 HydrophobicContact CG2-CE1 4.02Å; I685-Y744 PolarHBondContact O-OH 3.21Å; N688-Y744 WeakPolarHBondContact CB-OH 3.19Å; S689-Y744 PolarHBondContact N-OH 3.17Å; P741-Y744 HydrophobicContact CB-CD2 3.49Å; P741-Y744 VanDerWaalsContact CB-CD2 3.49Å; P741-Y744 HydrophobicContact CB-CE2 3.97Å; P741-Y744 HydrophobicContact CB-CG 4.27Å; P741-Y744 HydrophobicContact CG-CD2 4.14Å; P741-Y744 PolarHBondContact O-N 2.91Å; Y744-Y746 VanDerWaalsContact C-N 3.35Å; Y744-Y746 PolarHBondContact O-N 3.12Å; Y744-L747 PolarHBondContact O-N 3.36Å; Y744-I748 WeakPolarHBondContact O-CB 3.32Å; Y744-I748 WeakPolarHBondContact O-CD1 3.25Å; Y744-I748 VanDerWaalsContact O-CG1 3.22Å; Y744-I748 WeakPolarHBondContact O-CG1 3.44Å; Y744-I748 PolarHBondContact O-N 3.36Å
745	L	68.7	Low	66.7	Low	69 Å²	69	89.7 Å²	89.7	36%	0.361	42%	0.421	S	S	.	.	H	α-helix	trans	-58.9	-46.9	174.3	-150.7	82	0	0	0	111.2	P741 M742 D743 I748 F749	P741-L745 PolarHBondContact O-N 2.92Å; P741-L745 VanDerWaalsContact O-N 3.11Å; M742-L745 HydrophobicContact CE-CD2 4.45Å; M742-L745 HydrophobicContact SD-CD2 4.13Å; D743-L745 VanDerWaalsContact C-N 3.31Å; L745-I748 PolarHBondContact O-N 2.94Å; L745-F749 HydrophobicContact CD2-CE2 4.15Å; L745-F749 HydrophobicContact CG-CD2 4.24Å; L745-F749 HydrophobicContact CG-CE2 3.92Å; L745-F749 WeakPolarHBondContact O-CD2 3.35Å; L745-F749 PolarHBondContact O-N 2.81Å; L745-F749 VanDerWaalsContact O-N 3.1Å
746	Y	65.2	Low	64.8	Low	136 Å²	136	94.3 Å²	94.3	53%	0.533	45%	0.446	S	S	.	.	H	α-helix	trans	-61.5	-44.1	176.2	176.9	-110.5	0	0	0	112.6	M742 D743 Y744 F749 N750	M742-Y746 WeakPolarHBondContact O-CB 3.24Å; M742-Y746 PolarHBondContact O-N 2.93Å; D743-Y746 PolarHBondContact O-N 3.42Å; Y744-Y746 VanDerWaalsContact C-N 3.35Å; Y744-Y746 PolarHBondContact O-N 3.12Å; Y746-F749 PolarHBondContact O-N 3.13Å; Y746-N750 WeakPolarHBondContact O-CB 3.33Å; Y746-N750 PolarHBondContact O-N 2.79Å; Y746-N750 PolarHBondContact OH-ND2 3.25Å; Y746-N750 VanDerWaalsContact OH-ND2 3.16Å
747	L	67.2	Low	63.1	Low	85 Å²	85	99.2 Å²	99.2	45%	0.445	47%	0.47	S	S	.	.	H	α-helix	trans	-65.8	-37.4	178.2	-169.1	149.5	0	0	0	112.2	D743 Y744 K751	D743-L747 PolarHBondContact O-N 3.11Å; Y744-L747 PolarHBondContact O-N 3.36Å; L747-K751 WeakPolarHBondContact O-CB 3.21Å; L747-K751 PolarHBondContact O-N 3.43Å; L747-K751 VanDerWaalsContact O-N 3.11Å
748	I	71.1	Confident	61.5	Low	100 Å²	100	105.7 Å²	105.7	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-67.3	-41.1	177	-71.1	164.9	0	0	0	111.7	Y744 L745	Y744-I748 WeakPolarHBondContact O-CB 3.32Å; Y744-I748 WeakPolarHBondContact O-CD1 3.25Å; Y744-I748 VanDerWaalsContact O-CG1 3.22Å; Y744-I748 WeakPolarHBondContact O-CG1 3.44Å; Y744-I748 PolarHBondContact O-N 3.36Å; L745-I748 PolarHBondContact O-N 2.94Å
749	F	68.8	Low	60.1	Low	117 Å²	117	113.2 Å²	113.2	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-67.2	-54.8	175.6	-79.6	-64.2	0	0	0	111.5	L745 Y746 K751 K752 D753	L745-F749 HydrophobicContact CD2-CE2 4.15Å; L745-F749 HydrophobicContact CG-CD2 4.24Å; L745-F749 HydrophobicContact CG-CE2 3.92Å; L745-F749 WeakPolarHBondContact O-CD2 3.35Å; L745-F749 PolarHBondContact O-N 2.81Å; L745-F749 VanDerWaalsContact O-N 3.1Å; Y746-F749 PolarHBondContact O-N 3.13Å; F749-K751 PolarHBondContact O-N 3.32Å; F749-K752 PolarHBondContact O-N 2.86Å; F749-D753 PolarHBondContact O-N 3.26Å
750	N	65.3	Low	58.6	Low	97 Å²	97	118.4 Å²	118.4	52%	0.519	57%	0.565	S	S	.	*	H	α-helix	trans	-59.2	-25.5	-179.3	-80.6	19.1	0	0	0	113.7	Y746	Y746-N750 WeakPolarHBondContact O-CB 3.33Å; Y746-N750 PolarHBondContact O-N 2.79Å; Y746-N750 PolarHBondContact OH-ND2 3.25Å; Y746-N750 VanDerWaalsContact OH-ND2 3.16Å
751	K	62.2	Low	57.4	Low	172 Å²	172	117.3 Å²	117.3	75%	0.748	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-7.8	178.5	-167.1	165.3	-178.2	175.3	0	114.2	L747 F749	L747-K751 WeakPolarHBondContact O-CB 3.21Å; L747-K751 PolarHBondContact O-N 3.43Å; L747-K751 VanDerWaalsContact O-N 3.11Å; F749-K751 PolarHBondContact O-N 3.32Å
752	K	56.5	Low	56.3	Low	168 Å²	168	117.7 Å²	117.7	73%	0.73	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-31.2	175.2	-79.9	-171.7	170.9	-174.9	0	114	F749 H754	F749-K752 PolarHBondContact O-N 2.86Å; K752-H754 PolarHBondContact O-N 3.28Å
753	D	50.9	Low	55.6	Low	119 Å²	119	126 Å²	126	64%	0.636	60%	0.604	S	S	*	*			trans	-87.7	45.5	-165.7	-60.2	-16.5	0	0	0	113.5	F749 Y755	F749-D753 PolarHBondContact O-N 3.26Å; D753-Y755 VanDerWaalsContact C-N 3.26Å; D753-Y755 PolarHBondContact O-N 3.32Å
754	H	49.8	Very low	55	Low	174 Å²	174	125.7 Å²	125.7	81%	0.806	61%	0.606	S	S	*	*			trans	-84.8	5.8	178.9	-146.7	-56	0	0	0	113.8	K752	K752-H754 PolarHBondContact O-N 3.28Å
755	Y	49.3	Very low	54.1	Low	201 Å²	201	127.3 Å²	127.3	79%	0.788	62%	0.618	S	S	*	*	S	Bend	trans	-127.2	131.2	175.3	-84.5	-92.9	0	0	0	110.9	D753	D753-Y755 VanDerWaalsContact C-N 3.26Å; D753-Y755 PolarHBondContact O-N 3.32Å
756	N	40.5	Very low	53.2	Low	119 Å²	119	132.5 Å²	132.5	64%	0.636	63%	0.633	S	S	*	*			trans	57.6	91.8	160	-54.7	-15	0	0	0	117.4	F758	N756-F758 HydrophobicContact CB-CD2 4.26Å; N756-F758 PolarHBondContact O-N 3.5Å
757	Q	44.5	Very low	52.5	Low	202 Å²	202	131.9 Å²	131.9	94%	0.944	64%	0.637	S	S	*	*				46	10.6	112.4	-145.2	167.6	9.1	0	0	121
758	F	39.3	Very low	51.8	Low	165 Å²	165	131.8 Å²	131.8	72%	0.724	64%	0.637	S	S	*	*			trans	-113.4	113.5	173	-75	-91.3	0	0	0	106.2	N756	N756-F758 HydrophobicContact CB-CD2 4.26Å; N756-F758 PolarHBondContact O-N 3.5Å
759	F	40.7	Very low	50.6	Low	175 Å²	175	135.2 Å²	135.2	77%	0.768	64%	0.643	S	S	*	*			cis	-149.3	178.1	34.5	-101.4	-96	0	0	0	111.7	A761	F759-A761 HydrophobicContact CB-CB 3.72Å; F759-A761 PolarHBondContact O-N 3.23Å
760	S	45.2	Very low	49.6	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	65%	0.646	S	S	*	*			trans	-65.7	38.6	152.5	-156.4	0	0	0	0	112.9	G762	S760-G762 PolarHBondContact O-N 2.99Å
761	A	47.4	Very low	49	Very low	28 Å²	28	131.5 Å²	131.5	23%	0.231	63%	0.633	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	6.4	-174.1	0	0	0	0	0	113.7	F759 R763 T764 L765	F759-A761 HydrophobicContact CB-CB 3.72Å; F759-A761 PolarHBondContact O-N 3.23Å; A761-R763 PolarHBondContact O-N 2.71Å; A761-T764 PolarHBondContact O-N 3.16Å; A761-L765 WeakPolarHBondContact O-CB 3.36Å; A761-L765 PolarHBondContact O-N 2.68Å
762	G	50.1	Low	48.3	Very low	48 Å²	48	126.9 Å²	126.9	50%	0.495	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.9	-5.6	171.8	0	0	0	0	0	114.8	S760 R766	S760-G762 PolarHBondContact O-N 2.99Å; G762-R766 WeakPolarHBondContact O-CD 3.29Å; G762-R766 WeakPolarHBondContact O-CG 3.32Å; G762-R766 PolarHBondContact O-NE 3.5Å
763	R	48.9	Very low	48	Very low	203 Å²	203	123.7 Å²	123.7	77%	0.766	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-49.2	165.3	-70.3	178.1	172.3	141.6	-2.6	112.1	A761 L765 R766 I767	A761-R763 PolarHBondContact O-N 2.71Å; R763-L765 VanDerWaalsContact C-N 3.34Å; R763-L765 PolarHBondContact O-N 2.96Å; R763-R766 WeakPolarHBondContact O-CB 3.5Å; R763-R766 PolarHBondContact O-N 3.3Å; R763-I767 PolarHBondContact O-N 3.47Å
764	T	53.6	Low	48.1	Very low	87 Å²	87	121.6 Å²	121.6	53%	0.534	59%	0.591	S	S	.	*	H	α-helix	trans	-61.5	-39.3	178.4	-36.2	0	0	0	0	112.5	A761 R766 I767 L768	A761-T764 PolarHBondContact O-N 3.16Å; T764-R766 PolarHBondContact O-N 2.88Å; T764-I767 WeakPolarHBondContact O-CB 3.37Å; T764-I767 PolarHBondContact O-N 3.5Å; T764-L768 PolarHBondContact O-N 2.71Å; T764-L768 VanDerWaalsContact O-N 3.11Å
765	L	51.6	Low	48.2	Very low	94 Å²	94	116 Å²	116	49%	0.492	57%	0.572	S	S	.	*	H	α-helix	trans	-65	-20.4	174	-73.3	166.8	0	0	0	113.4	A761 R763 L768 R769	A761-L765 WeakPolarHBondContact O-CB 3.36Å; A761-L765 PolarHBondContact O-N 2.68Å; R763-L765 VanDerWaalsContact C-N 3.34Å; R763-L765 PolarHBondContact O-N 2.96Å; L765-L768 HydrophobicContact CD2-CD1 4.49Å; L765-R769 VanDerWaalsContact O-CG 3.28Å; L765-R769 WeakPolarHBondContact O-CG 3.25Å; L765-R769 PolarHBondContact O-N 3.25Å
766	R	48.2	Very low	48.4	Very low	179 Å²	179	110.4 Å²	110.4	68%	0.675	55%	0.554	S	S	*	*	H	α-helix	trans	-75.5	-31.6	170.6	-63.4	175.1	-171.2	-151.8	-2.6	111.7	G762 R763 T764 R769 L770	G762-R766 WeakPolarHBondContact O-CD 3.29Å; G762-R766 WeakPolarHBondContact O-CG 3.32Å; G762-R766 PolarHBondContact O-NE 3.5Å; R763-R766 WeakPolarHBondContact O-CB 3.5Å; R763-R766 PolarHBondContact O-N 3.3Å; T764-R766 PolarHBondContact O-N 2.88Å; R766-R769 WeakPolarHBondContact O-CB 3.32Å; R766-R769 PolarHBondContact O-N 3.26Å; R766-L770 PolarHBondContact O-N 3.2Å; R766-L770 VanDerWaalsContact O-N 3.09Å
767	I	52.3	Low	49.1	Very low	122 Å²	122	111 Å²	111	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-73.9	-38	177.2	-62.1	170.9	0	0	0	110.4	R763 T764 R769 L770 A771	R763-I767 PolarHBondContact O-N 3.47Å; T764-I767 WeakPolarHBondContact O-CB 3.37Å; T764-I767 PolarHBondContact O-N 3.5Å; I767-R769 VanDerWaalsContact C-N 3.32Å; I767-R769 PolarHBondContact O-N 3.41Å; I767-L770 WeakPolarHBondContact O-CA 3.42Å; I767-L770 WeakPolarHBondContact O-CB 3.47Å; I767-L770 PolarHBondContact O-N 3.43Å; I767-A771 PolarHBondContact O-N 2.9Å
768	L	51.6	Low	49.3	Very low	83 Å²	83	106.9 Å²	106.9	44%	0.435	53%	0.532	S	S	.	.	H	α-helix	trans	-65.3	-32.1	169.6	-80.4	157.2	0	0	0	113	M742 T764 L765 L770 A771 K772	M742-L768 HydrophobicContact CE-CD2 4.48Å; T764-L768 PolarHBondContact O-N 2.71Å; T764-L768 VanDerWaalsContact O-N 3.11Å; L765-L768 HydrophobicContact CD2-CD1 4.49Å; L768-L770 PolarHBondContact O-N 3.49Å; L768-A771 WeakPolarHBondContact O-CB 3.47Å; L768-A771 PolarHBondContact O-N 3.24Å; L768-K772 PolarHBondContact O-N 2.93Å
769	R	45.8	Very low	49.9	Very low	172 Å²	172	100.4 Å²	100.4	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-67.5	-22.7	167.2	-71.5	170.1	-174.3	-171.6	1.4	112.7	L765 R766 I767 K772 L773	L765-R769 VanDerWaalsContact O-CG 3.28Å; L765-R769 WeakPolarHBondContact O-CG 3.25Å; L765-R769 PolarHBondContact O-N 3.25Å; R766-R769 WeakPolarHBondContact O-CB 3.32Å; R766-R769 PolarHBondContact O-N 3.26Å; I767-R769 VanDerWaalsContact C-N 3.32Å; I767-R769 PolarHBondContact O-N 3.41Å; R769-K772 PolarHBondContact O-N 2.94Å; R769-L773 PolarHBondContact O-N 3.21Å; R769-L773 VanDerWaalsContact O-N 3.15Å
770	L	48.1	Very low	50.4	Low	108 Å²	108	97.7 Å²	97.7	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-72.3	-28.7	172	-129.9	85.5	0	0	0	112.6	R766 I767 L768 L773	R766-L770 PolarHBondContact O-N 3.2Å; R766-L770 VanDerWaalsContact O-N 3.09Å; I767-L770 WeakPolarHBondContact O-CA 3.42Å; I767-L770 WeakPolarHBondContact O-CB 3.47Å; I767-L770 PolarHBondContact O-N 3.43Å; L768-L770 PolarHBondContact O-N 3.49Å; L770-L773 HydrophobicContact CD1-CD1 3.83Å; L770-L773 HydrophobicContact CG-CD1 4.27Å; L770-L773 WeakPolarHBondContact O-CB 3.34Å; L770-L773 PolarHBondContact O-N 3.04Å
771	A	51.8	Low	50.4	Low	29 Å²	29	103.2 Å²	103.2	24%	0.24	50%	0.501	C	S	.	.	H	α-helix	trans	-65.4	-44	169.2	0	0	0	0	0	111.2	I737 M742 I767 L768 L773 L774	I737-A771 VanDerWaalsContact CG2-O 3.31Å; I737-A771 WeakPolarHBondContact CG2-O 3.34Å; M742-A771 HydrophobicContact CE-CB 4.31Å; I767-A771 PolarHBondContact O-N 2.9Å; L768-A771 WeakPolarHBondContact O-CB 3.47Å; L768-A771 PolarHBondContact O-N 3.24Å; A771-L773 PolarHBondContact O-N 3.45Å; A771-L774 PolarHBondContact O-N 2.92Å; A771-L774 VanDerWaalsContact O-N 3.16Å
772	K	48.1	Very low	50.6	Low	75 Å²	75	105.7 Å²	105.7	33%	0.326	51%	0.51	S	S	.	.	H	α-helix	trans	-57.6	-33.5	170.7	-88.3	-162.3	166.3	-159.8	0	112.8	M742 D743 L768 R769 L774 S775 M776	M742-K772 HydrophobicContact CB-CD 4.24Å; M742-K772 VanDerWaalsContact CB-CE 3.46Å; M742-K772 HydrophobicContact CB-CG 3.76Å; M742-K772 HydrophobicContact CE-CG 4.29Å; M742-K772 HydrophobicContact CG-CG 3.95Å; D743-K772 IonicContact OD1-NZ 2.96Å; D743-K772 PolarHBondContact OD1-NZ 3Å; D743-K772 IonicContact OD2-NZ 2.85Å; D743-K772 PolarHBondContact OD2-NZ 3.42Å; L768-K772 PolarHBondContact O-N 2.93Å; R769-K772 PolarHBondContact O-N 2.94Å; K772-L774 PolarHBondContact O-N 2.98Å; K772-S775 PolarHBondContact O-N 3.27Å; K772-M776 VanDerWaalsContact O-CG 3.27Å; K772-M776 WeakPolarHBondContact O-CG 3.36Å; K772-M776 PolarHBondContact O-N 3.36Å
773	L	50.7	Low	50.7	Low	101 Å²	101	104.6 Å²	104.6	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-18.8	177.9	-98.9	157.6	0	0	0	115	R769 L770 A771	R769-L773 PolarHBondContact O-N 3.21Å; R769-L773 VanDerWaalsContact O-N 3.15Å; L770-L773 HydrophobicContact CD1-CD1 3.83Å; L770-L773 HydrophobicContact CG-CD1 4.27Å; L770-L773 WeakPolarHBondContact O-CB 3.34Å; L770-L773 PolarHBondContact O-N 3.04Å; A771-L773 PolarHBondContact O-N 3.45Å
774	L	53.3	Low	50.7	Low	75 Å²	75	104.9 Å²	104.9	39%	0.393	50%	0.495	S	S	.	.	H	α-helix	trans	-87.7	-26.4	175.8	-81.9	158.7	0	0	0	112.7	I737 A771 K772 M776 L777	I737-L774 HydrophobicContact CB-CB 4.27Å; I737-L774 HydrophobicContact CD1-CB 4.36Å; I737-L774 HydrophobicContact CD1-CD1 3.65Å; I737-L774 HydrophobicContact CG2-CB 3.59Å; A771-L774 PolarHBondContact O-N 2.92Å; A771-L774 VanDerWaalsContact O-N 3.16Å; K772-L774 PolarHBondContact O-N 2.98Å; L774-M776 VanDerWaalsContact C-N 3.33Å; L774-L777 HydrophobicContact CD2-CD1 4.12Å
775	S	51.9	Low	50.7	Low	57 Å²	57	103.6 Å²	103.6	40%	0.399	48%	0.484	S	S	.	.	H	α-helix	trans	-66.8	-35.3	164.7	178.8	0	0	0	0	111.7	K772 L777 R778	K772-S775 PolarHBondContact O-N 3.27Å; S775-L777 PolarHBondContact O-N 2.92Å; S775-R778 PolarHBondContact O-N 3.23Å
776	M	53.7	Low	50.8	Low	83 Å²	83	100.5 Å²	100.5	41%	0.409	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-1.9	177.1	-63.4	-84.2	-67.9	0	0	115	K772 L774 R778 L779	K772-M776 VanDerWaalsContact O-CG 3.27Å; K772-M776 WeakPolarHBondContact O-CG 3.36Å; K772-M776 PolarHBondContact O-N 3.36Å; L774-M776 VanDerWaalsContact C-N 3.33Å; M776-R778 VanDerWaalsContact C-N 3.29Å; M776-L779 CarbonylContact O-C 3.57Å; M776-L779 VanDerWaalsContact O-O 3.09Å
777	L	54.8	Low	51	Low	132 Å²	132	96.8 Å²	96.8	69%	0.691	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-19.2	168.5	-82.8	167.6	0	0	0	113.4	L774 S775	L774-L777 HydrophobicContact CD2-CD1 4.12Å; S775-L777 PolarHBondContact O-N 2.92Å
778	R	48.5	Very low	50.9	Low	115 Å²	115	98.3 Å²	98.3	43%	0.434	45%	0.454	S	S	.	.	S	Bend	trans	-80.1	-24.5	173.2	-74.9	-172.8	177.8	149	7.6	113.6	S738 S775 M776	S738-R778 PolarHBondContact OG-NH2 2.99Å; S775-R778 PolarHBondContact O-N 3.23Å; M776-R778 VanDerWaalsContact C-N 3.29Å
779	L	51.5	Low	51.1	Low	29 Å²	29	97.1 Å²	97.1	15%	0.152	45%	0.451	C	S	.	.	S	Bend	trans	-145	114.4	176.1	-90	113.1	0	0	0	112.7	L669 P670 M776	L669-L779 HydrophobicContact CB-CD1 4.42Å; P670-L779 HydrophobicContact CB-CD2 3.57Å; P670-L779 HydrophobicContact CG-CD2 3.77Å; M776-L779 CarbonylContact O-C 3.57Å; M776-L779 VanDerWaalsContact O-O 3.09Å
780	L	50.7	Low	51.4	Low	117 Å²	117	89.6 Å²	89.6	61%	0.613	42%	0.424	S	S	*	.			trans	31.2	121.5	130.5	-65.5	161.3	0	0	0	117.2	L782	L780-L782 HydrophobicContact CB-CB 4.28Å; L780-L782 HydrophobicContact CD2-CD1 4.48Å; L780-L782 PolarHBondContact O-N 3.27Å
781	R	45.1	Very low	51.8	Low	230 Å²	230	90.3 Å²	90.3	87%	0.868	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	14.6	170.3	-58.2	176.4	-176.4	165.3	1	114.4
782	L	52.9	Low	52	Low	80 Å²	80	99.1 Å²	99.1	42%	0.419	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-26.7	178.5	-100.8	67.2	0	0	0	113.5	L780 R784 L785 V786	L780-L782 HydrophobicContact CB-CB 4.28Å; L780-L782 HydrophobicContact CD2-CD1 4.48Å; L780-L782 PolarHBondContact O-N 3.27Å; L782-R784 VanDerWaalsContact C-N 3.33Å; L782-R784 PolarHBondContact O-N 2.95Å; L782-L785 CarbonylContact O-C 3.55Å; L782-L785 WeakPolarHBondContact O-CA 3.5Å; L782-L785 WeakPolarHBondContact O-CB 3.13Å; L782-L785 PolarHBondContact O-N 3.4Å; L782-V786 HydrophobicContact CB-CG2 4.13Å; L782-V786 HydrophobicContact CD2-CG2 4.36Å; L782-V786 HydrophobicContact CG-CG2 4.41Å; L782-V786 PolarHBondContact O-N 3.17Å
783	T	51.3	Low	52.4	Low	26 Å²	26	99.6 Å²	99.6	16%	0.16	46%	0.455	C	S	.	.	H	α-helix	trans	-61.2	-33.6	-167.8	47.5	0	0	0	0	114.9	I673 L785 R787	I673-T783 HydrophobicContact CB-CG2 4.31Å; I673-T783 HydrophobicContact CD1-CG2 4.45Å; I673-T783 HydrophobicContact CG2-CG2 3.64Å; T783-L785 PolarHBondContact O-N 2.85Å; T783-R787 WeakPolarHBondContact O-CG 3.5Å; T783-R787 PolarHBondContact O-N 3.12Å
784	R	48.5	Very low	52.7	Low	209 Å²	209	101.4 Å²	101.4	79%	0.789	46%	0.461	S	S	*	.	H	α-helix	trans	-73.6	-17.1	172.5	177.3	173	-79.9	-173.9	-7.2	113.4	L782	L782-R784 VanDerWaalsContact C-N 3.33Å; L782-R784 PolarHBondContact O-N 2.95Å
785	L	54.1	Low	53.1	Low	59 Å²	59	106 Å²	106	31%	0.309	49%	0.486	S	S	.	.	H	α-helix	trans	-104.8	-34.3	-168.8	175.3	164.8	0	0	0	111	L782 T783 Y788 V789 I831	L782-L785 CarbonylContact O-C 3.55Å; L782-L785 WeakPolarHBondContact O-CA 3.5Å; L782-L785 WeakPolarHBondContact O-CB 3.13Å; L782-L785 PolarHBondContact O-N 3.4Å; T783-L785 PolarHBondContact O-N 2.85Å; L785-Y788 VanDerWaalsContact O-CB 3.27Å; L785-Y788 WeakPolarHBondContact O-CB 3.36Å; L785-Y788 PolarHBondContact O-N 2.96Å; L785-V789 PolarHBondContact O-N 3.25Å; L785-V789 VanDerWaalsContact O-N 3.08Å; L785-I831 HydrophobicContact CD1-CD1 3.69Å; L785-I831 HydrophobicContact CD1-CG1 3.67Å; L785-I831 HydrophobicContact CD2-CD1 3.33Å; L785-I831 HydrophobicContact CD2-CG1 3.87Å; L785-I831 HydrophobicContact CG-CD1 3.68Å; L785-I831 HydrophobicContact CG-CG1 4.19Å
786	V	53.6	Low	53.8	Low	30 Å²	30	104.8 Å²	104.8	18%	0.182	48%	0.479	C	S	.	.	H	α-helix	trans	-69.5	-37.6	167.4	-174.1	0	0	0	0	111.1	S674 L782 Y788 V789 S790	S674-V786 WeakPolarHBondContact OG-CG1 3.43Å; L782-V786 HydrophobicContact CB-CG2 4.13Å; L782-V786 HydrophobicContact CD2-CG2 4.36Å; L782-V786 HydrophobicContact CG-CG2 4.41Å; L782-V786 PolarHBondContact O-N 3.17Å; V786-Y788 PolarHBondContact O-N 2.93Å; V786-V789 PolarHBondContact O-N 3.27Å; V786-S790 PolarHBondContact O-N 3.04Å
787	R	52.7	Low	55	Low	100 Å²	100	105.2 Å²	105.2	38%	0.377	48%	0.483	S	S	.	.	H	α-helix	trans	-58.7	-33	169.2	-75.8	-174.7	177.5	-157.2	-6.8	112.5	I673 D679 T783 Q791	I673-R787 PolarHBondContact O-NE 3.27Å; I673-R787 PolarHBondContact O-NH2 3Å; D679-R787 IonicContact OD2-NH2 3.56Å; D679-R787 PolarHBondContact OD2-NH2 3.06Å; D679-R787 VanDerWaalsContact OD2-NH2 3.16Å; T783-R787 WeakPolarHBondContact O-CG 3.5Å; T783-R787 PolarHBondContact O-N 3.12Å; R787-Q791 WeakPolarHBondContact O-CB 3.32Å; R787-Q791 PolarHBondContact O-N 2.95Å
788	Y	50.1	Low	56	Low	155 Å²	155	104.1 Å²	104.1	61%	0.608	47%	0.47	S	S	*	.	H	α-helix	trans	-67.4	-41.5	171.5	-117.8	-70.9	0	0	0	111.9	L785 V786	L785-Y788 VanDerWaalsContact O-CB 3.27Å; L785-Y788 WeakPolarHBondContact O-CB 3.36Å; L785-Y788 PolarHBondContact O-N 2.96Å; V786-Y788 PolarHBondContact O-N 2.93Å
789	V	55.2	Low	57.6	Low	58 Å²	58	103.4 Å²	103.4	35%	0.352	47%	0.47	S	S	.	.	H	α-helix	trans	-69.7	-42.5	178.9	173	0	0	0	0	112.3	L785 V786 Q791 W792	L785-V789 PolarHBondContact O-N 3.25Å; L785-V789 VanDerWaalsContact O-N 3.08Å; V786-V789 PolarHBondContact O-N 3.27Å; V789-Q791 PolarHBondContact O-N 3.18Å; V789-W792 WeakPolarHBondContact O-CB 3.47Å; V789-W792 PolarHBondContact O-N 3.25Å
790	S	53.2	Low	59.2	Low	13 Å²	13	105.1 Å²	105.1	9%	0.091	48%	0.477	C	S	.	.	H	α-helix	trans	-61.5	-33.9	176.3	-174.8	0	0	0	0	111.6	V786 W792 E793 E794 Q801	V786-S790 PolarHBondContact O-N 3.04Å; S790-W792 PolarHBondContact O-N 3.08Å; S790-W792 VanDerWaalsContact O-N 3.17Å; S790-E793 PolarHBondContact O-N 3Å; S790-E794 PolarHBondContact O-N 3.48Å; S790-Q801 PolarHBondContact OG-OE1 2.68Å
791	Q	56.8	Low	60.5	Low	123 Å²	123	100.3 Å²	100.3	58%	0.575	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-7.1	172.1	-164.8	166.5	21.8	0	0	114.4	R787 V789	R787-Q791 WeakPolarHBondContact O-CB 3.32Å; R787-Q791 PolarHBondContact O-N 2.95Å; V789-Q791 PolarHBondContact O-N 3.18Å
792	W	54.6	Low	62.4	Low	215 Å²	215	93 Å²	93	81%	0.814	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-7.8	168.6	-68.9	100	0	0	0	113.5	V789 S790	V789-W792 WeakPolarHBondContact O-CB 3.47Å; V789-W792 PolarHBondContact O-N 3.25Å; S790-W792 PolarHBondContact O-N 3.08Å; S790-W792 VanDerWaalsContact O-N 3.17Å
793	E	58.1	Low	64	Low	85 Å²	85	91.8 Å²	91.8	40%	0.397	42%	0.42	S	S	.	.			trans	-119.3	23.5	-177.5	-64.9	-168.4	163.7	0	0	113.1	S790 N795 A796 Q801	S790-E793 PolarHBondContact O-N 3Å; E793-N795 PolarHBondContact O-N 3.04Å; E793-A796 PolarHBondContact O-N 3.49Å; E793-A796 VanDerWaalsContact O-N 3.1Å; E793-Q801 HydrophobicContact CB-CG 4.25Å; E793-Q801 PolarHBondContact O-NE2 2.97Å
794	E	56.9	Low	65.7	Low	139 Å²	139	93.7 Å²	93.7	65%	0.65	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-7.4	-168.1	-64.9	-172.2	139.4	0	0	117.2	S790	S790-E794 PolarHBondContact O-N 3.48Å
795	N	61.2	Low	67.4	Low	172 Å²	172	86 Å²	86	92%	0.92	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-4.1	-179.8	-65.2	-39.3	0	0	0	114.8	E793	E793-N795 PolarHBondContact O-N 3.04Å
796	A	65.8	Low	69	Low	30 Å²	30	86.5 Å²	86.5	25%	0.248	41%	0.408	C	S	.	.	S	Bend	trans	-106.7	148.2	-177.3	0	0	0	0	0	112.9	E793 Q800 Q801	E793-A796 PolarHBondContact O-N 3.49Å; E793-A796 VanDerWaalsContact O-N 3.1Å; A796-Q800 HydrophobicContact CB-CG 4.5Å; A796-Q801 HydrophobicContact CB-CG 4.13Å; A796-Q801 PolarHBondContact O-NE2 3.3Å
797	D	78.4	Confident	70.7	Confident	93 Å²	93	88.8 Å²	88.8	50%	0.497	42%	0.416	S	S	.	.			trans	-60.6	146.9	176.2	-178.8	47.6	0	0	0	112.1	F799 Q800 Q801	D797-F799 PolarHBondContact O-N 3.09Å; D797-F799 VanDerWaalsContact O-N 3.15Å; D797-F799 WeakPolarHBondContact OD2-CB 3.47Å; D797-F799 PolarHBondContact OD2-N 3.14Å; D797-Q800 WeakPolarHBondContact O-CA 3.42Å; D797-Q800 WeakPolarHBondContact O-CB 3.11Å; D797-Q800 PolarHBondContact O-N 3.27Å; D797-Q801 PolarHBondContact O-N 3.45Å
798	W	76.9	Confident	72.4	Confident	108 Å²	108	87.1 Å²	87.1	41%	0.409	41%	0.412	S	S	.	.	H	α-helix	trans	-57.7	-34.5	-174.7	72.8	-84.6	0	0	0	112.3	V671 F675 F676 Y802	V671-W798 HydrophobicContact CG1-CZ3 4.41Å; F675-W798 HydrophobicContact CB-CB 4.19Å; F676-W798 HydrophobicContact CE2-CD2 4.35Å; F676-W798 HydrophobicContact CE2-CE3 4.05Å; F676-W798 HydrophobicContact CE2-CZ3 4.45Å; F676-W798 HydrophobicContact CZ-CD2 4.05Å; F676-W798 HydrophobicContact CZ-CE3 4.12Å; F676-W798 HydrophobicContact CZ-CZ3 4.45Å; W798-Y802 VanDerWaalsContact O-CB 3.31Å; W798-Y802 WeakPolarHBondContact O-CB 3.22Å; W798-Y802 PolarHBondContact O-N 2.94Å
799	F	82.9	Confident	74.3	Confident	100 Å²	100	81.9 Å²	81.9	44%	0.439	40%	0.401	S	S	.	.	H	α-helix	trans	-69	-35.3	177.6	179.9	-99	0	0	0	111.9	D797 T803	D797-F799 PolarHBondContact O-N 3.09Å; D797-F799 VanDerWaalsContact O-N 3.15Å; D797-F799 WeakPolarHBondContact OD2-CB 3.47Å; D797-F799 PolarHBondContact OD2-N 3.14Å; F799-T803 VanDerWaalsContact O-CB 3.3Å; F799-T803 WeakPolarHBondContact O-CB 3.17Å; F799-T803 PolarHBondContact O-N 3.24Å; F799-T803 PolarHBondContact O-OG1 3.42Å
800	Q	83.8	Confident	76	Confident	65 Å²	65	83 Å²	83	30%	0.304	40%	0.403	S	S	.	.	H	α-helix	trans	-70.1	-46.4	175.4	-178.9	174.6	-13.8	0	0	111	F323 A796 D797 Y802 T803 W804	F323-Q800 HydrophobicContact CZ-CB 4.45Å; A796-Q800 HydrophobicContact CB-CG 4.5Å; D797-Q800 WeakPolarHBondContact O-CA 3.42Å; D797-Q800 WeakPolarHBondContact O-CB 3.11Å; D797-Q800 PolarHBondContact O-N 3.27Å; Q800-Y802 PolarHBondContact O-N 3.4Å; Q800-T803 PolarHBondContact O-N 2.92Å; Q800-W804 PolarHBondContact O-N 3.18Å
801	Q	79.4	Confident	77.9	Confident	16 Å²	16	82.7 Å²	82.7	8%	0.075	40%	0.401	C	S	.	.	H	α-helix	trans	-57.4	-47.8	173.9	-62.2	-177.2	29.4	0	0	111	F675 S790 E793 A796 D797 T803 W804 A805	F675-Q801 HydrophobicContact CD1-CB 3.91Å; F675-Q801 HydrophobicContact CE1-CB 3.68Å; S790-Q801 PolarHBondContact OG-OE1 2.68Å; E793-Q801 HydrophobicContact CB-CG 4.25Å; E793-Q801 PolarHBondContact O-NE2 2.97Å; A796-Q801 HydrophobicContact CB-CG 4.13Å; A796-Q801 PolarHBondContact O-NE2 3.3Å; D797-Q801 PolarHBondContact O-N 3.45Å; Q801-T803 PolarHBondContact O-N 3.48Å; Q801-W804 PolarHBondContact O-N 3.47Å; Q801-A805 VanDerWaalsContact O-CB 3.31Å; Q801-A805 WeakPolarHBondContact O-CB 3.34Å; Q801-A805 PolarHBondContact O-N 3.37Å
802	Y	84.3	Confident	79.6	Confident	76 Å²	76	77.3 Å²	77.3	30%	0.298	38%	0.375	S	S	.	.	H	α-helix	trans	-58.7	-44	175.9	171.8	-103.3	0	0	0	112.5	V671 F675 W798 Q800 A805 L806	V671-Y802 HydrophobicContact CG2-CD2 4.19Å; V671-Y802 HydrophobicContact CG2-CE2 3.86Å; F675-Y802 AromaticContact CE2-CD2 3.82Å; F675-Y802 HydrophobicContact CE2-CD2 3.82Å; F675-Y802 HydrophobicContact CE2-CG 4.42Å; F675-Y802 HydrophobicContact CZ-CD2 4.32Å; W798-Y802 VanDerWaalsContact O-CB 3.31Å; W798-Y802 WeakPolarHBondContact O-CB 3.22Å; W798-Y802 PolarHBondContact O-N 2.94Å; Q800-Y802 PolarHBondContact O-N 3.4Å; Y802-A805 PolarHBondContact O-N 3.46Å; Y802-L806 HydrophobicContact CE1-CD2 4.11Å; Y802-L806 VanDerWaalsContact O-CB 3.25Å; Y802-L806 WeakPolarHBondContact O-CB 3.38Å; Y802-L806 PolarHBondContact O-N 3.33Å
803	T	86.7	Confident	81.4	Confident	55 Å²	55	71 Å²	71	34%	0.337	36%	0.356	S	S	.	.	H	α-helix	trans	-65.3	-43.4	-179.2	-61	0	0	0	0	111.8	F799 Q800 Q801 L806 F807	F799-T803 VanDerWaalsContact O-CB 3.3Å; F799-T803 WeakPolarHBondContact O-CB 3.17Å; F799-T803 PolarHBondContact O-N 3.24Å; F799-T803 PolarHBondContact O-OG1 3.42Å; Q800-T803 PolarHBondContact O-N 2.92Å; Q801-T803 PolarHBondContact O-N 3.48Å; T803-L806 PolarHBondContact O-N 2.79Å; T803-F807 WeakPolarHBondContact O-CB 3.41Å; T803-F807 PolarHBondContact O-N 3.09Å
804	W	85.6	Confident	83.1	Confident	66 Å²	66	70.9 Å²	70.9	25%	0.25	36%	0.358	C	S	.	.	H	α-helix	trans	-67.9	-40	175.5	-80.6	106.2	0	0	0	112.8	F327 Q800 Q801 F807 K808	F327-W804 HydrophobicContact CE2-CZ2 4.32Å; F327-W804 HydrophobicContact CZ-CH2 4.29Å; F327-W804 HydrophobicContact CZ-CZ2 4.41Å; Q800-W804 PolarHBondContact O-N 3.18Å; Q801-W804 PolarHBondContact O-N 3.47Å; W804-F807 AromaticContact CE3-CD1 3.97Å; W804-F807 HydrophobicContact CE3-CD1 3.97Å; W804-F807 AromaticContact CZ3-CD1 3.92Å; W804-F807 HydrophobicContact CZ3-CD1 3.92Å; W804-F807 HydrophobicContact CZ3-CE1 4.11Å; W804-F807 PolarHBondContact O-N 3Å; W804-K808 WeakPolarHBondContact O-CB 3.45Å; W804-K808 PolarHBondContact O-N 3.29Å
805	A	86.1	Confident	84.7	Confident	47 Å²	47	68.2 Å²	68.2	39%	0.388	35%	0.354	S	S	.	.	H	α-helix	trans	-63.3	-43	174.9	0	0	0	0	0	112	F675 Q801 Y802 K808 A809	F675-A805 HydrophobicContact CZ-CB 4.39Å; Q801-A805 VanDerWaalsContact O-CB 3.31Å; Q801-A805 WeakPolarHBondContact O-CB 3.34Å; Q801-A805 PolarHBondContact O-N 3.37Å; Y802-A805 PolarHBondContact O-N 3.46Å; A805-K808 PolarHBondContact O-N 2.88Å; A805-A809 WeakPolarHBondContact O-CB 3.17Å; A805-A809 PolarHBondContact O-N 3.18Å
806	L	87.6	Confident	86.2	Confident	70 Å²	70	66 Å²	66	37%	0.366	34%	0.341	S	S	.	.	H	α-helix	trans	-64.6	-43.4	175	-178.8	63.1	0	0	0	111.3	Y802 T803 A809 M810	Y802-L806 HydrophobicContact CE1-CD2 4.11Å; Y802-L806 VanDerWaalsContact O-CB 3.25Å; Y802-L806 WeakPolarHBondContact O-CB 3.38Å; Y802-L806 PolarHBondContact O-N 3.33Å; T803-L806 PolarHBondContact O-N 2.79Å; L806-A809 PolarHBondContact O-N 2.97Å; L806-M810 HydrophobicContact CD1-CG 4.24Å; L806-M810 HydrophobicContact CD1-SD 4.35Å; L806-M810 HydrophobicContact CG-CE 4.01Å; L806-M810 HydrophobicContact CG-CG 4.44Å; L806-M810 HydrophobicContact CG-SD 4.22Å; L806-M810 WeakPolarHBondContact O-CB 3.47Å; L806-M810 VanDerWaalsContact O-CG 3.31Å; L806-M810 WeakPolarHBondContact O-CG 3.43Å; L806-M810 PolarHBondContact O-N 3.17Å
807	F	89.4	Confident	87.2	Confident	79 Å²	79	65.9 Å²	65.9	35%	0.346	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-46.4	175.1	176.7	-107.4	0	0	0	112.3	T803 W804 A809 M810 S811	T803-F807 WeakPolarHBondContact O-CB 3.41Å; T803-F807 PolarHBondContact O-N 3.09Å; W804-F807 AromaticContact CE3-CD1 3.97Å; W804-F807 HydrophobicContact CE3-CD1 3.97Å; W804-F807 AromaticContact CZ3-CD1 3.92Å; W804-F807 HydrophobicContact CZ3-CD1 3.92Å; W804-F807 HydrophobicContact CZ3-CE1 4.11Å; W804-F807 PolarHBondContact O-N 3Å; F807-A809 PolarHBondContact O-N 3.01Å; F807-M810 PolarHBondContact O-N 2.93Å; F807-S811 WeakPolarHBondContact O-CB 3Å; F807-S811 PolarHBondContact O-N 3.27Å; F807-S811 PolarHBondContact O-OG 3.28Å
808	K	88.2	Confident	87.6	Confident	64 Å²	64	66.5 Å²	66.5	28%	0.278	34%	0.339	S	S	.	.	H	α-helix	trans	-59.5	-44.9	176.2	-171.6	169.3	-174.8	178.2	0	111	W804 A805 S811 H812 E828	W804-K808 WeakPolarHBondContact O-CB 3.45Å; W804-K808 PolarHBondContact O-N 3.29Å; A805-K808 PolarHBondContact O-N 2.88Å; K808-S811 PolarHBondContact O-N 3.31Å; K808-H812 PolarHBondContact O-N 2.7Å; K808-H812 VanDerWaalsContact O-N 3.17Å; K808-H812 PolarHBondContact O-ND1 3.45Å; K808-E828 IonicContact NZ-OE1 3.16Å; K808-E828 PolarHBondContact NZ-OE1 3.3Å; K808-E828 VanDerWaalsContact NZ-OE1 3.16Å
809	A	90	Very high	87.8	Confident	46 Å²	46	62.7 Å²	62.7	38%	0.38	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-42.7	176.9	0	0	0	0	0	113.2	A805 L806 F807 H812 M813	A805-A809 WeakPolarHBondContact O-CB 3.17Å; A805-A809 PolarHBondContact O-N 3.18Å; L806-A809 PolarHBondContact O-N 2.97Å; F807-A809 PolarHBondContact O-N 3.01Å; A809-H812 PolarHBondContact O-N 2.91Å; A809-M813 WeakPolarHBondContact O-CB 3.32Å; A809-M813 PolarHBondContact O-N 3.39Å
810	M	91.1	Very high	87.6	Confident	82 Å²	82	64.2 Å²	64.2	40%	0.404	34%	0.336	S	S	.	.	H	α-helix	trans	-67.1	-36.6	176.1	-70.6	-172	-54	0	0	112.3	L806 F807 H812 M813 L814	L806-M810 HydrophobicContact CD1-CG 4.24Å; L806-M810 HydrophobicContact CD1-SD 4.35Å; L806-M810 HydrophobicContact CG-CE 4.01Å; L806-M810 HydrophobicContact CG-CG 4.44Å; L806-M810 HydrophobicContact CG-SD 4.22Å; L806-M810 WeakPolarHBondContact O-CB 3.47Å; L806-M810 VanDerWaalsContact O-CG 3.31Å; L806-M810 WeakPolarHBondContact O-CG 3.43Å; L806-M810 PolarHBondContact O-N 3.17Å; F807-M810 PolarHBondContact O-N 2.93Å; M810-H812 VanDerWaalsContact C-N 3.35Å; M810-H812 PolarHBondContact O-N 3.03Å; M810-M813 PolarHBondContact O-N 2.92Å; M810-L814 WeakPolarHBondContact O-CB 3.16Å; M810-L814 WeakPolarHBondContact O-CG 3.43Å; M810-L814 PolarHBondContact O-N 2.98Å
811	S	92.6	Very high	87.4	Confident	5 Å²	5	67.6 Å²	67.6	4%	0.035	35%	0.35	C	S	.	.	H	α-helix	trans	-63.4	-39.7	176.3	-58.8	0	0	0	0	111.9	F807 K808 S815 I816 G817	F807-S811 WeakPolarHBondContact O-CB 3Å; F807-S811 PolarHBondContact O-N 3.27Å; F807-S811 PolarHBondContact O-OG 3.28Å; K808-S811 PolarHBondContact O-N 3.31Å; S811-S815 PolarHBondContact O-N 3.49Å; S811-I816 PolarHBondContact O-N 3.23Å; S811-G817 CarbonylContact C-O 3.54Å; S811-G817 WeakPolarHBondContact CB-O 3.48Å; S811-G817 PolarHBondContact O-N 2.95Å
812	H	92.5	Very high	87.8	Confident	10 Å²	10	70.8 Å²	70.8	5%	0.046	37%	0.372	C	S	.	.	H	α-helix	trans	-68.2	-39.5	170.9	-59.4	158.6	0	0	0	112.3	K808 A809 M810 S815 G817 Y818 S835 M836	K808-H812 PolarHBondContact O-N 2.7Å; K808-H812 VanDerWaalsContact O-N 3.17Å; K808-H812 PolarHBondContact O-ND1 3.45Å; A809-H812 PolarHBondContact O-N 2.91Å; M810-H812 VanDerWaalsContact C-N 3.35Å; M810-H812 PolarHBondContact O-N 3.03Å; H812-S815 PolarHBondContact O-N 2.93Å; H812-G817 PolarHBondContact CD2-O 3.42Å; H812-G817 VanDerWaalsContact CD2-O 3.24Å; H812-Y818 AromaticContact NE2-CD1 3.87Å; H812-S835 WeakPolarHBondContact CB-OG 3.29Å; H812-S835 WeakPolarHBondContact ND1-CB 3.4Å; H812-S835 PolarHBondContact ND1-OG 3.05Å; H812-M836 HydrophobicContact CB-CG 4.18Å
813	M	93	Very high	88	Confident	82 Å²	82	68.9 Å²	68.9	40%	0.404	37%	0.369	S	S	.	.	H	α-helix	trans	-64.8	-44.3	179.8	-174.7	-178.2	68.4	0	0	113	A809 M810 S815	A809-M813 WeakPolarHBondContact O-CB 3.32Å; A809-M813 PolarHBondContact O-N 3.39Å; M810-M813 PolarHBondContact O-N 2.92Å; M813-S815 VanDerWaalsContact C-N 3.27Å; M813-S815 PolarHBondContact O-N 3.49Å
814	L	92.5	Very high	88.1	Confident	84 Å²	84	72.6 Å²	72.6	44%	0.44	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	4.5	-180	-61.8	176.6	0	0	0	112.9	M810 I816 Y843	M810-L814 WeakPolarHBondContact O-CB 3.16Å; M810-L814 WeakPolarHBondContact O-CG 3.43Å; M810-L814 PolarHBondContact O-N 2.98Å; L814-I816 VanDerWaalsContact C-N 3.29Å; L814-I816 HydrophobicContact CB-CD1 3.72Å; L814-I816 HydrophobicContact CB-CG1 3.83Å; L814-I816 HydrophobicContact CD1-CD1 4.07Å; L814-I816 PolarHBondContact O-N 3.44Å; L814-Y843 HydrophobicContact CD2-CD2 4.4Å
815	S	91.7	Very high	88.2	Confident	82 Å²	82	72.4 Å²	72.4	57%	0.573	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	35.7	-179.2	-52.9	0	0	0	0	114.3	S811 H812 M813	S811-S815 PolarHBondContact O-N 3.49Å; H812-S815 PolarHBondContact O-N 2.93Å; M813-S815 VanDerWaalsContact C-N 3.27Å; M813-S815 PolarHBondContact O-N 3.49Å
816	I	91.4	Very high	88.4	Confident	127 Å²	127	76.2 Å²	76.2	65%	0.651	41%	0.413	S	S	*	.			trans	-88.4	-47	-177.5	-59.7	171.9	0	0	0	111.7	S811 L814	S811-I816 PolarHBondContact O-N 3.23Å; L814-I816 VanDerWaalsContact C-N 3.29Å; L814-I816 HydrophobicContact CB-CD1 3.72Å; L814-I816 HydrophobicContact CB-CG1 3.83Å; L814-I816 HydrophobicContact CD1-CD1 4.07Å; L814-I816 PolarHBondContact O-N 3.44Å
817	G	87.4	Confident	88.4	Confident	27 Å²	27	74.5 Å²	74.5	28%	0.278	41%	0.413	S	S	.	.			trans	167.5	-169.3	-172.8	0	0	0	0	0	114.2	S811 H812	S811-G817 CarbonylContact C-O 3.54Å; S811-G817 WeakPolarHBondContact CB-O 3.48Å; S811-G817 PolarHBondContact O-N 2.95Å; H812-G817 PolarHBondContact CD2-O 3.42Å; H812-G817 VanDerWaalsContact CD2-O 3.24Å
818	Y	85.8	Confident	88.3	Confident	105 Å²	105	73.3 Å²	73.3	41%	0.412	41%	0.408	S	S	.	.			trans	-99.2	-0	-168.8	-56.5	-70.1	0	0	0	115.7	H812 P822 T832 M836	H812-Y818 AromaticContact NE2-CD1 3.87Å; Y818-P822 HydrophobicContact CD2-CB 4.45Å; Y818-T832 HydrophobicContact CD1-CG2 3.72Å; Y818-T832 HydrophobicContact CE1-CG2 3.83Å; Y818-M836 HydrophobicContact CE1-CE 4.05Å; Y818-M836 HydrophobicContact CE1-SD 3.73Å
819	G	81.9	Confident	88.3	Confident	29 Å²	29	71.6 Å²	71.6	30%	0.299	41%	0.406	S	S	.	.	S	Bend	trans	86.3	-146.6	-164.9	0	0	0	0	0	111.7	F821	G819-F821 PolarHBondContact O-N 2.92Å
820	R	77.9	Confident	88.4	Confident	131 Å²	131	77.1 Å²	77.1	49%	0.494	42%	0.417	S	S	.	.	S	Bend	trans	-62.8	-39.5	-173.1	-174	174.5	-175.9	130.6	10.8	114.3	V330	V330-R820 HydrophobicContact CG1-CG 3.87Å
821	F	80.3	Confident	88.2	Confident	137 Å²	137	76 Å²	76	60%	0.601	41%	0.412	S	S	*	.	S	Bend	trans	-143.6	151.8	-176.9	-61.3	-57.2	0	0	0	110.3	G819	G819-F821 PolarHBondContact O-N 2.92Å
822	P	87.4	Confident	88.1	Confident	83 Å²	83	76 Å²	76	54%	0.539	41%	0.412	S	S	.	.			trans	-64.9	153.9	169.6	29.6	-35.4	0	0	0	111.1	Y818 T824	Y818-P822 HydrophobicContact CD2-CB 4.45Å; P822-T824 PolarHBondContact O-N 2.94Å
823	P	88.5	Confident	88.1	Confident	36 Å²	36	79.2 Å²	79.2	23%	0.234	43%	0.429	C	S	.	.			trans	-64.8	123.5	-179.3	27.6	-35.7	0	0	0	111.5	E828 T832	P823-E828 HydrophobicContact CB-CB 3.59Å; P823-T832 HydrophobicContact CG-CG2 4.11Å
824	T	88.3	Confident	88	Confident	133 Å²	133	79.6 Å²	79.6	82%	0.816	44%	0.436	S	S	*	.			trans	-96.8	-30.7	-179.5	58.2	0	0	0	0	112.5	P822	P822-T824 PolarHBondContact O-N 2.94Å
825	S	89	Confident	87.8	Confident	61 Å²	61	77 Å²	77	43%	0.427	42%	0.424	S	S	.	.	S	Bend	trans	-83.6	141.7	177	175.8	0	0	0	0	112	G827 E828 A829	S825-G827 PolarHBondContact O-N 3.37Å; S825-G827 PolarHBondContact OG-N 2.86Å; S825-E828 WeakPolarHBondContact O-CB 3.34Å; S825-E828 PolarHBondContact O-N 2.88Å; S825-A829 PolarHBondContact O-N 3.46Å
826	I	90.2	Very high	87.9	Confident	127 Å²	127	76.6 Å²	76.6	65%	0.651	41%	0.414	S	S	*	.	H	α-helix	trans	-57.5	-31.5	174.8	-173.3	58.1	0	0	0	112.5	W830	I826-W830 VanDerWaalsContact O-CD1 3.22Å; I826-W830 PolarHBondContact O-N 3.24Å
827	G	87.9	Confident	88	Confident	35 Å²	35	76.7 Å²	76.7	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-66.1	-48	173.4	0	0	0	0	0	111.8	S825 A829 W830 I831	S825-G827 PolarHBondContact O-N 3.37Å; S825-G827 PolarHBondContact OG-N 2.86Å; G827-A829 VanDerWaalsContact C-N 3.32Å; G827-A829 PolarHBondContact O-N 3.49Å; G827-W830 PolarHBondContact O-N 3.08Å; G827-I831 WeakPolarHBondContact O-CD1 3.17Å; G827-I831 VanDerWaalsContact O-CG1 3.23Å; G827-I831 WeakPolarHBondContact O-CG1 3.18Å; G827-I831 PolarHBondContact O-N 2.9Å
828	E	86	Confident	88.2	Confident	53 Å²	53	78.3 Å²	78.3	25%	0.248	42%	0.42	C	S	.	.	H	α-helix	trans	-63.1	-35.1	176.2	-70	-165.1	104.6	0	0	113.5	K808 P823 S825 I831 T832	K808-E828 IonicContact NZ-OE1 3.16Å; K808-E828 PolarHBondContact NZ-OE1 3.3Å; K808-E828 VanDerWaalsContact NZ-OE1 3.16Å; P823-E828 HydrophobicContact CB-CB 3.59Å; S825-E828 WeakPolarHBondContact O-CB 3.34Å; S825-E828 PolarHBondContact O-N 2.88Å; E828-I831 PolarHBondContact O-N 3.3Å; E828-T832 WeakPolarHBondContact O-CB 3.42Å; E828-T832 PolarHBondContact O-N 2.9Å; E828-T832 PolarHBondContact O-OG1 3.5Å
829	A	89.7	Confident	88.5	Confident	28 Å²	28	73.5 Å²	73.5	23%	0.231	40%	0.403	C	S	.	.	H	α-helix	trans	-60.3	-48.8	174.7	0	0	0	0	0	110.6	S825 G827 I831 T832 I833	S825-A829 PolarHBondContact O-N 3.46Å; G827-A829 VanDerWaalsContact C-N 3.32Å; G827-A829 PolarHBondContact O-N 3.49Å; A829-I831 PolarHBondContact O-N 2.75Å; A829-T832 PolarHBondContact O-N 2.88Å; A829-I833 WeakPolarHBondContact O-CB 3.37Å; A829-I833 WeakPolarHBondContact O-CD1 3.49Å; A829-I833 WeakPolarHBondContact O-CG1 3.32Å; A829-I833 PolarHBondContact O-N 2.72Å
830	W	91.2	Very high	89	Confident	163 Å²	163	74.3 Å²	74.3	62%	0.617	41%	0.407	S	S	*	.	H	α-helix	trans	-64.5	-39.6	176.5	-78.7	112.5	0	0	0	113.4	I826 G827 V834	I826-W830 VanDerWaalsContact O-CD1 3.22Å; I826-W830 PolarHBondContact O-N 3.24Å; G827-W830 PolarHBondContact O-N 3.08Å; W830-V834 WeakPolarHBondContact O-CG2 3.4Å; W830-V834 PolarHBondContact O-N 3.5Å
831	I	87.8	Confident	89.9	Confident	58 Å²	58	72 Å²	72	30%	0.297	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-48.2	174.8	-63.3	155.9	0	0	0	110.3	L785 G827 E828 A829 V834 S835	L785-I831 HydrophobicContact CD1-CD1 3.69Å; L785-I831 HydrophobicContact CD1-CG1 3.67Å; L785-I831 HydrophobicContact CD2-CD1 3.33Å; L785-I831 HydrophobicContact CD2-CG1 3.87Å; L785-I831 HydrophobicContact CG-CD1 3.68Å; L785-I831 HydrophobicContact CG-CG1 4.19Å; G827-I831 WeakPolarHBondContact O-CD1 3.17Å; G827-I831 VanDerWaalsContact O-CG1 3.23Å; G827-I831 WeakPolarHBondContact O-CG1 3.18Å; G827-I831 PolarHBondContact O-N 2.9Å; E828-I831 PolarHBondContact O-N 3.3Å; A829-I831 PolarHBondContact O-N 2.75Å; I831-V834 PolarHBondContact O-N 3.41Å; I831-S835 VanDerWaalsContact O-CB 3.22Å; I831-S835 WeakPolarHBondContact O-CB 3.41Å; I831-S835 PolarHBondContact O-N 3.39Å
832	T	90.3	Very high	90.4	Very high	6 Å²	6	69 Å²	69	4%	0.037	40%	0.402	C	S	.	.	H	α-helix	trans	-62.2	-46.7	179.8	-63.7	0	0	0	0	111.1	Y818 P823 E828 A829 V834 S835 M836	Y818-T832 HydrophobicContact CD1-CG2 3.72Å; Y818-T832 HydrophobicContact CE1-CG2 3.83Å; P823-T832 HydrophobicContact CG-CG2 4.11Å; E828-T832 WeakPolarHBondContact O-CB 3.42Å; E828-T832 PolarHBondContact O-N 2.9Å; E828-T832 PolarHBondContact O-OG1 3.5Å; A829-T832 PolarHBondContact O-N 2.88Å; T832-V834 PolarHBondContact O-N 3.06Å; T832-S835 WeakPolarHBondContact O-CB 3.29Å; T832-S835 PolarHBondContact O-N 2.79Å; T832-M836 HydrophobicContact CG2-CG 4.32Å; T832-M836 HydrophobicContact CG2-SD 3.71Å; T832-M836 WeakPolarHBondContact O-CB 3.46Å; T832-M836 VanDerWaalsContact O-CG 3.25Å; T832-M836 WeakPolarHBondContact O-CG 3.35Å; T832-M836 PolarHBondContact O-N 2.92Å
833	I	91.8	Very high	90.8	Very high	76 Å²	76	70.4 Å²	70.4	39%	0.39	40%	0.398	S	S	.	.	H	α-helix	trans	-57.6	-48.2	176.1	-70.4	162	0	0	0	111.1	A829 S835 M836 M837	A829-I833 WeakPolarHBondContact O-CB 3.37Å; A829-I833 WeakPolarHBondContact O-CD1 3.49Å; A829-I833 WeakPolarHBondContact O-CG1 3.32Å; A829-I833 PolarHBondContact O-N 2.72Å; I833-S835 VanDerWaalsContact C-N 3.34Å; I833-S835 PolarHBondContact O-N 2.77Å; I833-M836 PolarHBondContact O-N 3.05Å; I833-M837 HydrophobicContact CG2-SD 4.06Å; I833-M837 WeakPolarHBondContact O-CB 3.3Å; I833-M837 VanDerWaalsContact O-CG 3.31Å; I833-M837 WeakPolarHBondContact O-CG 3.44Å; I833-M837 PolarHBondContact O-N 2.72Å
834	V	90	Very high	91.1	Very high	91 Å²	91	71.6 Å²	71.6	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-65.5	-38	178.4	172.3	0	0	0	0	111.5	W830 I831 T832 S838	W830-V834 WeakPolarHBondContact O-CG2 3.4Å; W830-V834 PolarHBondContact O-N 3.5Å; I831-V834 PolarHBondContact O-N 3.41Å; T832-V834 PolarHBondContact O-N 3.06Å; V834-S838 WeakPolarHBondContact O-CB 3.45Å; V834-S838 PolarHBondContact O-N 2.93Å; V834-S838 PolarHBondContact O-OG 3.44Å
835	S	90.1	Very high	91.5	Very high	29 Å²	29	70.2 Å²	70.2	20%	0.203	40%	0.398	C	S	.	.	H	α-helix	trans	-65.5	-41.5	176.5	-174.7	0	0	0	0	112.1	H812 I831 T832 I833 S838 G839	H812-S835 WeakPolarHBondContact CB-OG 3.29Å; H812-S835 WeakPolarHBondContact ND1-CB 3.4Å; H812-S835 PolarHBondContact ND1-OG 3.05Å; I831-S835 VanDerWaalsContact O-CB 3.22Å; I831-S835 WeakPolarHBondContact O-CB 3.41Å; I831-S835 PolarHBondContact O-N 3.39Å; T832-S835 WeakPolarHBondContact O-CB 3.29Å; T832-S835 PolarHBondContact O-N 2.79Å; I833-S835 VanDerWaalsContact C-N 3.34Å; I833-S835 PolarHBondContact O-N 2.77Å; S835-S838 PolarHBondContact O-OG 3.38Å; S835-G839 WeakPolarHBondContact O-CA 3.47Å; S835-G839 PolarHBondContact O-N 3.39Å
836	M	93	Very high	91.7	Very high	73 Å²	73	74 Å²	74	36%	0.36	41%	0.407	S	S	.	.	H	α-helix	trans	-68.5	-44	174.7	-67.8	167.6	79.1	0	0	112.1	H812 Y818 T832 I833 G839 A840	H812-M836 HydrophobicContact CB-CG 4.18Å; Y818-M836 HydrophobicContact CE1-CE 4.05Å; Y818-M836 HydrophobicContact CE1-SD 3.73Å; T832-M836 HydrophobicContact CG2-CG 4.32Å; T832-M836 HydrophobicContact CG2-SD 3.71Å; T832-M836 WeakPolarHBondContact O-CB 3.46Å; T832-M836 VanDerWaalsContact O-CG 3.25Å; T832-M836 WeakPolarHBondContact O-CG 3.35Å; T832-M836 PolarHBondContact O-N 2.92Å; I833-M836 PolarHBondContact O-N 3.05Å; M836-G839 PolarHBondContact O-N 3.29Å; M836-A840 VanDerWaalsContact O-CB 3.29Å; M836-A840 WeakPolarHBondContact O-CB 3.48Å; M836-A840 PolarHBondContact O-N 3.22Å
837	M	93.3	Very high	92	Very high	129 Å²	129	71.2 Å²	71.2	64%	0.635	40%	0.396	S	S	*	.	H	α-helix	trans	-63.1	-45.5	178.4	-73.6	-179	70.7	0	0	112	I833 T841	I833-M837 HydrophobicContact CG2-SD 4.06Å; I833-M837 WeakPolarHBondContact O-CB 3.3Å; I833-M837 VanDerWaalsContact O-CG 3.31Å; I833-M837 WeakPolarHBondContact O-CG 3.44Å; I833-M837 PolarHBondContact O-N 2.72Å; M837-T841 WeakPolarHBondContact O-CB 3.4Å; M837-T841 PolarHBondContact O-N 3.39Å; M837-T841 PolarHBondContact O-OG1 3.14Å
838	S	90.9	Very high	92.3	Very high	61 Å²	61	71.6 Å²	71.6	43%	0.427	40%	0.399	S	S	.	.	H	α-helix	trans	-67.8	-42	175.2	51.1	0	0	0	0	111.8	V834 S835 T841 C842	V834-S838 WeakPolarHBondContact O-CB 3.45Å; V834-S838 PolarHBondContact O-N 2.93Å; V834-S838 PolarHBondContact O-OG 3.44Å; S835-S838 PolarHBondContact O-OG 3.38Å; S838-T841 PolarHBondContact O-N 3.23Å; S838-C842 PolarHBondContact O-N 3.03Å; S838-C842 PolarHBondContact O-SG 3.06Å; S838-C842 VanDerWaalsContact O-SG 3.39Å
839	G	92.8	Very high	92.7	Very high	5 Å²	5	75.6 Å²	75.6	5%	0.052	42%	0.418	C	S	.	.	H	α-helix	trans	-56.3	-56.8	175.7	0	0	0	0	0	113.8	S835 M836 T841 C842 Y843	S835-G839 WeakPolarHBondContact O-CA 3.47Å; S835-G839 PolarHBondContact O-N 3.39Å; M836-G839 PolarHBondContact O-N 3.29Å; G839-T841 VanDerWaalsContact C-N 3.25Å; G839-T841 PolarHBondContact O-N 2.94Å; G839-C842 PolarHBondContact O-N 3.27Å; G839-C842 VanDerWaalsContact O-N 3.14Å; G839-Y843 PolarHBondContact O-N 2.93Å
840	A	93.6	Very high	93	Very high	45 Å²	45	75.9 Å²	75.9	37%	0.372	42%	0.42	S	S	.	.	H	α-helix	trans	-59.6	-35.1	177.2	0	0	0	0	0	112.5	M836 A844	M836-A840 VanDerWaalsContact O-CB 3.29Å; M836-A840 WeakPolarHBondContact O-CB 3.48Å; M836-A840 PolarHBondContact O-N 3.22Å; A840-A844 VanDerWaalsContact O-CB 3.32Å; A840-A844 WeakPolarHBondContact O-CB 3.43Å; A840-A844 PolarHBondContact O-N 3.49Å
841	T	94.9	Very high	93	Very high	84 Å²	84	70.3 Å²	70.3	52%	0.515	41%	0.409	S	S	.	.	H	α-helix	trans	-65.4	-47.3	174.5	-56.9	0	0	0	0	111.4	M837 S838 G839 Y843 A844 L845	M837-T841 WeakPolarHBondContact O-CB 3.4Å; M837-T841 PolarHBondContact O-N 3.39Å; M837-T841 PolarHBondContact O-OG1 3.14Å; S838-T841 PolarHBondContact O-N 3.23Å; G839-T841 VanDerWaalsContact C-N 3.25Å; G839-T841 PolarHBondContact O-N 2.94Å; T841-Y843 PolarHBondContact O-N 2.88Å; T841-A844 PolarHBondContact O-N 3.2Å; T841-L845 HydrophobicContact CG2-CD1 4.28Å; T841-L845 WeakPolarHBondContact O-CG 3.45Å; T841-L845 PolarHBondContact O-N 3.47Å
842	C	92.6	Very high	93.3	Very high	72 Å²	72	70.1 Å²	70.1	49%	0.486	42%	0.416	S	S	.	.	H	α-helix	trans	-61.8	-41.6	175.9	-72	0	0	0	0	112.2	S838 G839 L845 F846	S838-C842 PolarHBondContact O-N 3.03Å; S838-C842 PolarHBondContact O-SG 3.06Å; S838-C842 VanDerWaalsContact O-SG 3.39Å; G839-C842 PolarHBondContact O-N 3.27Å; G839-C842 VanDerWaalsContact O-N 3.14Å; C842-L845 PolarHBondContact O-N 3.38Å; C842-F846 WeakPolarHBondContact O-CB 3.48Å; C842-F846 PolarHBondContact O-N 3.3Å
843	Y	94.8	Very high	93.4	Very high	113 Å²	113	73.2 Å²	73.2	44%	0.443	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-43.5	177	-175	-103.8	0	0	0	112.1	L814 G839 T841 L845 F846 V847	L814-Y843 HydrophobicContact CD2-CD2 4.4Å; G839-Y843 PolarHBondContact O-N 2.93Å; T841-Y843 PolarHBondContact O-N 2.88Å; Y843-L845 PolarHBondContact O-N 2.91Å; Y843-F846 WeakPolarHBondContact O-CB 3.48Å; Y843-F846 PolarHBondContact O-N 3.38Å; Y843-V847 HydrophobicContact CD1-CG2 4.31Å; Y843-V847 HydrophobicContact CE1-CG2 3.92Å; Y843-V847 HydrophobicContact CE2-CG2 4.41Å; Y843-V847 WeakPolarHBondContact O-CG2 3.33Å; Y843-V847 PolarHBondContact O-N 2.85Å
844	A	95.5	Very high	93.3	Very high	62 Å²	62	75.3 Å²	75.3	51%	0.512	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-40.9	175.5	0	0	0	0	0	112.5	A840 T841 V847 G848	A840-A844 VanDerWaalsContact O-CB 3.32Å; A840-A844 WeakPolarHBondContact O-CB 3.43Å; A840-A844 PolarHBondContact O-N 3.49Å; T841-A844 PolarHBondContact O-N 3.2Å; A844-V847 PolarHBondContact O-N 2.98Å; A844-G848 PolarHBondContact O-N 2.85Å
845	L	95.2	Very high	93.2	Very high	103 Å²	103	77.5 Å²	77.5	54%	0.539	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-41.8	173.8	-71.2	170.7	0	0	0	111.9	T841 C842 Y843 G848 H849	T841-L845 HydrophobicContact CG2-CD1 4.28Å; T841-L845 WeakPolarHBondContact O-CG 3.45Å; T841-L845 PolarHBondContact O-N 3.47Å; C842-L845 PolarHBondContact O-N 3.38Å; Y843-L845 PolarHBondContact O-N 2.91Å; L845-G848 PolarHBondContact O-N 3.18Å; L845-H849 PolarHBondContact O-CD2 3.3Å; L845-H849 PolarHBondContact O-N 2.82Å
846	F	94.8	Very high	93	Very high	142 Å²	142	79.3 Å²	79.3	62%	0.623	46%	0.459	S	S	*	.	H	α-helix	trans	-60.2	-47.7	175.2	174.7	-97.4	0	0	0	111.9	C842 Y843 G848 H849 A850	C842-F846 WeakPolarHBondContact O-CB 3.48Å; C842-F846 PolarHBondContact O-N 3.3Å; Y843-F846 WeakPolarHBondContact O-CB 3.48Å; Y843-F846 PolarHBondContact O-N 3.38Å; F846-G848 VanDerWaalsContact C-N 3.33Å; F846-G848 PolarHBondContact O-N 3.49Å; F846-H849 PolarHBondContact O-N 2.91Å; F846-A850 WeakPolarHBondContact O-CB 3.45Å; F846-A850 PolarHBondContact O-N 2.93Å
847	V	95.2	Very high	92.6	Very high	68 Å²	68	82.3 Å²	82.3	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-61	-41.2	176.2	172.2	0	0	0	0	111.2	Y843 A844 A850 A851	Y843-V847 HydrophobicContact CD1-CG2 4.31Å; Y843-V847 HydrophobicContact CE1-CG2 3.92Å; Y843-V847 HydrophobicContact CE2-CG2 4.41Å; Y843-V847 WeakPolarHBondContact O-CG2 3.33Å; Y843-V847 PolarHBondContact O-N 2.85Å; A844-V847 PolarHBondContact O-N 2.98Å; V847-A850 PolarHBondContact O-N 3.37Å; V847-A851 WeakPolarHBondContact O-CB 3.31Å; V847-A851 PolarHBondContact O-N 3.2Å
848	G	94.8	Very high	92.1	Very high	42 Å²	42	79.3 Å²	79.3	43%	0.433	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-45.4	174.6	0	0	0	0	0	113.2	A844 L845 F846 A851 A852	A844-G848 PolarHBondContact O-N 2.85Å; L845-G848 PolarHBondContact O-N 3.18Å; F846-G848 VanDerWaalsContact C-N 3.33Å; F846-G848 PolarHBondContact O-N 3.49Å; G848-A851 PolarHBondContact O-N 3.42Å; G848-A852 WeakPolarHBondContact O-CB 3.46Å; G848-A852 PolarHBondContact O-N 3.44Å
849	H	95.2	Very high	91.9	Very high	137 Å²	137	79.3 Å²	79.3	63%	0.634	46%	0.455	S	S	*	.	H	α-helix	trans	-67.5	-37.2	176	-75.5	-56.6	0	0	0	112.9	L845 F846 A852 L853	L845-H849 PolarHBondContact O-CD2 3.3Å; L845-H849 PolarHBondContact O-N 2.82Å; F846-H849 PolarHBondContact O-N 2.91Å; H849-A852 PolarHBondContact O-N 2.87Å; H849-L853 WeakPolarHBondContact O-CB 3.4Å; H849-L853 PolarHBondContact O-N 3.35Å
850	A	94.4	Very high	91.6	Very high	35 Å²	35	81.1 Å²	81.1	29%	0.289	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-45.7	174.9	0	0	0	0	0	111.4	F846 V847 L853 I854	F846-A850 WeakPolarHBondContact O-CB 3.45Å; F846-A850 PolarHBondContact O-N 2.93Å; V847-A850 PolarHBondContact O-N 3.37Å; A850-L853 PolarHBondContact O-N 3.27Å; A850-I854 VanDerWaalsContact O-CG1 3.29Å; A850-I854 WeakPolarHBondContact O-CG1 3.44Å; A850-I854 PolarHBondContact O-N 3.49Å
851	A	92.6	Very high	91.4	Very high	45 Å²	45	83.4 Å²	83.4	37%	0.372	47%	0.468	S	S	.	.	H	α-helix	trans	-61.3	-44.8	176.2	0	0	0	0	0	112.3	V847 G848 L853 I854 Q855	V847-A851 WeakPolarHBondContact O-CB 3.31Å; V847-A851 PolarHBondContact O-N 3.2Å; G848-A851 PolarHBondContact O-N 3.42Å; A851-L853 VanDerWaalsContact C-N 3.34Å; A851-L853 PolarHBondContact O-N 3.38Å; A851-I854 PolarHBondContact O-N 3.45Å; A851-Q855 WeakPolarHBondContact O-CG 3.45Å; A851-Q855 PolarHBondContact O-N 2.93Å
852	A	93.2	Very high	91	Very high	54 Å²	54	83.9 Å²	83.9	45%	0.446	46%	0.461	S	S	.	.	H	α-helix	trans	-63.9	-37.2	176.3	0	0	0	0	0	112.5	G848 H849 Q855 S856	G848-A852 WeakPolarHBondContact O-CB 3.46Å; G848-A852 PolarHBondContact O-N 3.44Å; H849-A852 PolarHBondContact O-N 2.87Å; A852-Q855 PolarHBondContact O-N 3.45Å; A852-S856 PolarHBondContact O-N 2.91Å; A852-S856 VanDerWaalsContact O-N 3.14Å
853	L	92.8	Very high	90.9	Very high	71 Å²	71	84.1 Å²	84.1	37%	0.372	46%	0.456	S	S	.	.	H	α-helix	trans	-65.6	-44.6	174.6	-174.9	67	0	0	0	111.2	H849 A850 A851 Q855 S856 F857	H849-L853 WeakPolarHBondContact O-CB 3.4Å; H849-L853 PolarHBondContact O-N 3.35Å; A850-L853 PolarHBondContact O-N 3.27Å; A851-L853 VanDerWaalsContact C-N 3.34Å; A851-L853 PolarHBondContact O-N 3.38Å; L853-Q855 VanDerWaalsContact C-N 3.34Å; L853-Q855 PolarHBondContact O-N 3.22Å; L853-S856 PolarHBondContact O-N 2.98Å; L853-S856 VanDerWaalsContact O-N 3.09Å; L853-S856 PolarHBondContact O-OG 3.27Å; L853-F857 HydrophobicContact CD1-CE2 4.4Å; L853-F857 HydrophobicContact CD2-CE2 4.47Å; L853-F857 HydrophobicContact CG-CE2 3.93Å; L853-F857 HydrophobicContact CG-CZ 4.47Å; L853-F857 VanDerWaalsContact O-CD2 3.32Å; L853-F857 WeakPolarHBondContact O-CD2 3.29Å; L853-F857 PolarHBondContact O-N 2.81Å
854	I	89.8	Confident	90.9	Very high	120 Å²	120	80.4 Å²	80.4	62%	0.615	44%	0.442	S	S	*	.	H	α-helix	trans	-58.6	-45	175.7	-69.3	163.9	0	0	0	110.8	A850 A851 S856 F857	A850-I854 VanDerWaalsContact O-CG1 3.29Å; A850-I854 WeakPolarHBondContact O-CG1 3.44Å; A850-I854 PolarHBondContact O-N 3.49Å; A851-I854 PolarHBondContact O-N 3.45Å; I854-S856 PolarHBondContact O-N 3.28Å; I854-F857 PolarHBondContact O-N 3.36Å
855	Q	87.2	Confident	90.7	Very high	137 Å²	137	83.4 Å²	83.4	64%	0.64	44%	0.44	S	S	*	.	H	α-helix	trans	-67.2	-17.3	176.8	-71.9	177.1	-15	0	0	114.6	A851 A852 L853 R862	A851-Q855 WeakPolarHBondContact O-CG 3.45Å; A851-Q855 PolarHBondContact O-N 2.93Å; A852-Q855 PolarHBondContact O-N 3.45Å; L853-Q855 VanDerWaalsContact C-N 3.34Å; L853-Q855 PolarHBondContact O-N 3.22Å; Q855-R862 PolarHBondContact O-NH1 3.04Å; Q855-R862 VanDerWaalsContact O-NH1 3.12Å
856	S	87.2	Confident	90.6	Very high	67 Å²	67	81.9 Å²	81.9	47%	0.469	43%	0.43	S	S	.	.	H	α-helix	trans	-85.6	-18	175.7	76.4	0	0	0	0	113.8	A852 L853 I854	A852-S856 PolarHBondContact O-N 2.91Å; A852-S856 VanDerWaalsContact O-N 3.14Å; L853-S856 PolarHBondContact O-N 2.98Å; L853-S856 VanDerWaalsContact O-N 3.09Å; L853-S856 PolarHBondContact O-OG 3.27Å; I854-S856 PolarHBondContact O-N 3.28Å
857	F	84.6	Confident	90.6	Very high	136 Å²	136	79.2 Å²	79.2	60%	0.596	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	153.2	169.1	-67.3	-65	0	0	0	110.9	L853 I854 T859	L853-F857 HydrophobicContact CD1-CE2 4.4Å; L853-F857 HydrophobicContact CD2-CE2 4.47Å; L853-F857 HydrophobicContact CG-CE2 3.93Å; L853-F857 HydrophobicContact CG-CZ 4.47Å; L853-F857 VanDerWaalsContact O-CD2 3.32Å; L853-F857 WeakPolarHBondContact O-CD2 3.29Å; L853-F857 PolarHBondContact O-N 2.81Å; I854-F857 PolarHBondContact O-N 3.36Å; F857-T859 VanDerWaalsContact C-N 3.33Å; F857-T859 PolarHBondContact O-N 3.27Å
858	D	82.7	Confident	90.6	Very high	66 Å²	66	77.8 Å²	77.8	35%	0.353	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	29.6	170.6	-158.9	47	0	0	0	116.8	S860 K861 R862 R865	D858-S860 VanDerWaalsContact C-N 3.34Å; D858-S860 PolarHBondContact O-N 3.37Å; D858-K861 PolarHBondContact O-N 3.19Å; D858-K861 WeakPolarHBondContact OD1-CB 3.21Å; D858-K861 WeakPolarHBondContact OD1-CD 3.15Å; D858-K861 WeakPolarHBondContact OD1-CE 3.43Å; D858-K861 WeakPolarHBondContact OD1-CG 3.34Å; D858-K861 WeakPolarHBondContact OD2-CB 3.46Å; D858-R862 WeakPolarHBondContact O-CB 3.46Å; D858-R862 PolarHBondContact O-N 3.19Å; D858-R865 IonicContact OD2-CZ 2.85Å; D858-R865 IonicContact OD2-NH1 2.68Å; D858-R865 PolarHBondContact OD2-NH1 3.36Å; D858-R865 IonicContact OD2-NH2 2.85Å; D858-R865 PolarHBondContact OD2-NH2 2.87Å
859	T	87.1	Confident	90.6	Very high	62 Å²	62	81.2 Å²	81.2	38%	0.38	41%	0.41	S	S	.	.	H	α-helix	trans	-54.8	-42.4	-178.2	-62.2	0	0	0	0	113.3	F857 R862 L863	F857-T859 VanDerWaalsContact C-N 3.33Å; F857-T859 PolarHBondContact O-N 3.27Å; T859-R862 PolarHBondContact O-N 3.05Å; T859-L863 HydrophobicContact CG2-CD1 4.09Å; T859-L863 HydrophobicContact CG2-CG 4.44Å; T859-L863 WeakPolarHBondContact O-CG 3.34Å; T859-L863 PolarHBondContact O-N 2.86Å
860	S	86.5	Confident	90.7	Very high	42 Å²	42	78 Å²	78	29%	0.294	40%	0.395	S	S	.	.	H	α-helix	trans	-70.7	-36.8	-175.8	51.9	0	0	0	0	114.2	D858 Y864 M900	D858-S860 VanDerWaalsContact C-N 3.34Å; D858-S860 PolarHBondContact O-N 3.37Å; S860-Y864 PolarHBondContact O-N 3.42Å; S860-Y864 VanDerWaalsContact O-N 3.11Å; S860-M900 PolarHBondContact O-N 2.95Å
861	K	87.8	Confident	90.7	Very high	94 Å²	94	77.2 Å²	77.2	41%	0.409	39%	0.387	S	S	.	.	H	α-helix	trans	-76.1	-29	170.7	-53.2	-172.9	-161.9	177.8	0	111.6	D858 Y864 R865	D858-K861 PolarHBondContact O-N 3.19Å; D858-K861 WeakPolarHBondContact OD1-CB 3.21Å; D858-K861 WeakPolarHBondContact OD1-CD 3.15Å; D858-K861 WeakPolarHBondContact OD1-CE 3.43Å; D858-K861 WeakPolarHBondContact OD1-CG 3.34Å; D858-K861 WeakPolarHBondContact OD2-CB 3.46Å; K861-Y864 PolarHBondContact O-N 2.93Å; K861-R865 WeakPolarHBondContact O-CG 3.48Å; K861-R865 PolarHBondContact O-N 2.73Å
862	R	88	Confident	90.9	Very high	94 Å²	94	79.5 Å²	79.5	36%	0.355	39%	0.389	S	S	.	.	H	α-helix	trans	-62.6	-45.7	172.4	-158.9	-172.6	72.7	-127.6	-2.6	110.7	Q855 D858 T859 Y864 R865 E866	Q855-R862 PolarHBondContact O-NH1 3.04Å; Q855-R862 VanDerWaalsContact O-NH1 3.12Å; D858-R862 WeakPolarHBondContact O-CB 3.46Å; D858-R862 PolarHBondContact O-N 3.19Å; T859-R862 PolarHBondContact O-N 3.05Å; R862-Y864 VanDerWaalsContact C-N 3.32Å; R862-Y864 PolarHBondContact O-N 2.96Å; R862-R865 PolarHBondContact O-N 3.45Å; R862-E866 WeakPolarHBondContact CD-OE1 3.37Å; R862-E866 HydrophobicContact CG-CG 4.48Å; R862-E866 VanDerWaalsContact CG-OE1 3.32Å; R862-E866 WeakPolarHBondContact CG-OE1 3.26Å; R862-E866 IonicContact CZ-OE1 3.05Å; R862-E866 IonicContact NE-OE1 2.82Å; R862-E866 PolarHBondContact NE-OE1 3.48Å; R862-E866 IonicContact NH2-OE1 2.69Å; R862-E866 WeakPolarHBondContact O-CB 3.48Å; R862-E866 VanDerWaalsContact O-CG 3.29Å; R862-E866 WeakPolarHBondContact O-CG 3.45Å; R862-E866 PolarHBondContact O-N 3.28Å
863	L	90.4	Very high	91	Very high	76 Å²	76	81.9 Å²	81.9	40%	0.398	39%	0.391	S	S	.	.	H	α-helix	trans	-60.1	-39.1	172.6	-70.1	169.7	0	0	0	112.3	T859 K867 M900	T859-L863 HydrophobicContact CG2-CD1 4.09Å; T859-L863 HydrophobicContact CG2-CG 4.44Å; T859-L863 WeakPolarHBondContact O-CG 3.34Å; T859-L863 PolarHBondContact O-N 2.86Å; L863-K867 VanDerWaalsContact O-CB 3.3Å; L863-K867 WeakPolarHBondContact O-CB 3.34Å; L863-K867 PolarHBondContact O-N 3.23Å; L863-M900 HydrophobicContact CB-CB 3.98Å
864	Y	93.1	Very high	91.2	Very high	35 Å²	35	84.7 Å²	84.7	14%	0.137	40%	0.398	C	S	.	.	H	α-helix	trans	-61.7	-49.9	172.6	179.3	-96.7	0	0	0	112.2	S860 K861 R862 E866 K867 F868	S860-Y864 PolarHBondContact O-N 3.42Å; S860-Y864 VanDerWaalsContact O-N 3.11Å; K861-Y864 PolarHBondContact O-N 2.93Å; R862-Y864 VanDerWaalsContact C-N 3.32Å; R862-Y864 PolarHBondContact O-N 2.96Å; Y864-E866 PolarHBondContact O-N 2.86Å; Y864-K867 PolarHBondContact O-N 3.44Å; Y864-F868 VanDerWaalsContact O-CB 3.31Å; Y864-F868 WeakPolarHBondContact O-CB 3.38Å; Y864-F868 PolarHBondContact O-N 2.9Å
865	R	91.9	Very high	91.5	Very high	125 Å²	125	79.4 Å²	79.4	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-43	177.8	-69.2	-177.1	-62	-98.7	0.6	112.1	D858 K861 R862 K869	D858-R865 IonicContact OD2-CZ 2.85Å; D858-R865 IonicContact OD2-NH1 2.68Å; D858-R865 PolarHBondContact OD2-NH1 3.36Å; D858-R865 IonicContact OD2-NH2 2.85Å; D858-R865 PolarHBondContact OD2-NH2 2.87Å; K861-R865 WeakPolarHBondContact O-CG 3.48Å; K861-R865 PolarHBondContact O-N 2.73Å; R862-R865 PolarHBondContact O-N 3.45Å; R865-K869 WeakPolarHBondContact O-CB 3.44Å; R865-K869 PolarHBondContact O-N 3.44Å
866	E	93.4	Very high	91.9	Very high	72 Å²	72	75.3 Å²	75.3	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-60.9	-43	175	-74.6	170.8	-159.1	0	0	111.3	R862 Y864 Q870	R862-E866 WeakPolarHBondContact CD-OE1 3.37Å; R862-E866 HydrophobicContact CG-CG 4.48Å; R862-E866 VanDerWaalsContact CG-OE1 3.32Å; R862-E866 WeakPolarHBondContact CG-OE1 3.26Å; R862-E866 IonicContact CZ-OE1 3.05Å; R862-E866 IonicContact NE-OE1 2.82Å; R862-E866 PolarHBondContact NE-OE1 3.48Å; R862-E866 IonicContact NH2-OE1 2.69Å; R862-E866 WeakPolarHBondContact O-CB 3.48Å; R862-E866 VanDerWaalsContact O-CG 3.29Å; R862-E866 WeakPolarHBondContact O-CG 3.45Å; R862-E866 PolarHBondContact O-N 3.28Å; Y864-E866 PolarHBondContact O-N 2.86Å; E866-Q870 WeakPolarHBondContact O-CG 3.31Å; E866-Q870 PolarHBondContact O-N 2.96Å
867	K	94.1	Very high	92.3	Very high	86 Å²	86	80.4 Å²	80.4	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-72.4	-42.5	178.7	-168.9	66.9	-171	169.1	0	112.7	L863 Y864 K869 Q870 V871 M900	L863-K867 VanDerWaalsContact O-CB 3.3Å; L863-K867 WeakPolarHBondContact O-CB 3.34Å; L863-K867 PolarHBondContact O-N 3.23Å; Y864-K867 PolarHBondContact O-N 3.44Å; K867-K869 VanDerWaalsContact C-N 3.32Å; K867-K869 PolarHBondContact O-N 3.24Å; K867-Q870 WeakPolarHBondContact O-CB 3.39Å; K867-Q870 PolarHBondContact O-N 3.01Å; K867-V871 PolarHBondContact O-N 2.82Å; K867-M900 HydrophobicContact CB-SD 4.27Å; K867-M900 HydrophobicContact CG-CE 4.1Å; K867-M900 HydrophobicContact CG-SD 4.14Å
868	F	94.9	Very high	92.9	Very high	37 Å²	37	80.7 Å²	80.7	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-40.8	177.9	-168	-99.2	0	0	0	111.2	Y864 Q870 V871 E872 A889 Y892	Y864-F868 VanDerWaalsContact O-CB 3.31Å; Y864-F868 WeakPolarHBondContact O-CB 3.38Å; Y864-F868 PolarHBondContact O-N 2.9Å; F868-Q870 VanDerWaalsContact C-N 3.32Å; F868-Q870 PolarHBondContact O-N 2.94Å; F868-V871 CarbonylContact O-C 3.56Å; F868-V871 WeakPolarHBondContact O-CA 3.3Å; F868-V871 VanDerWaalsContact O-CB 3.3Å; F868-V871 WeakPolarHBondContact O-CB 3.47Å; F868-V871 PolarHBondContact O-N 3.32Å; F868-E872 HydrophobicContact CD1-CG 3.91Å; F868-E872 HydrophobicContact CE1-CG 3.72Å; F868-E872 HydrophobicContact CZ-CG 4.48Å; F868-E872 PolarHBondContact O-N 3.43Å; F868-A889 HydrophobicContact CE2-CB 4.41Å; F868-A889 HydrophobicContact CZ-CB 3.9Å; F868-Y892 HydrophobicContact CD2-CG 4.23Å; F868-Y892 HydrophobicContact CE2-CG 4.36Å
869	K	95.9	Very high	93.5	Very high	115 Å²	115	86 Å²	86	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-60.3	-36.5	174.1	-172.9	168.5	-172	-79.6	0	113.4	R865 K867 V871 E872 E873	R865-K869 WeakPolarHBondContact O-CB 3.44Å; R865-K869 PolarHBondContact O-N 3.44Å; K867-K869 VanDerWaalsContact C-N 3.32Å; K867-K869 PolarHBondContact O-N 3.24Å; K869-V871 VanDerWaalsContact C-N 3.28Å; K869-V871 PolarHBondContact O-N 3.36Å; K869-E872 PolarHBondContact O-N 2.7Å; K869-E873 IonicContact NZ-OE1 2.65Å; K869-E873 PolarHBondContact NZ-OE1 3.25Å; K869-E873 WeakPolarHBondContact O-CB 3.26Å; K869-E873 WeakPolarHBondContact O-CG 3.48Å; K869-E873 PolarHBondContact O-N 3.1Å
870	Q	96.5	Very high	93.9	Very high	70 Å²	70	84.9 Å²	84.9	33%	0.327	38%	0.379	S	S	.	.	H	α-helix	trans	-62.8	-36	171.6	-66.7	171	7.2	0	0	111.8	Y17 E866 K867 F868 Y874	Y17-Q870 PolarHBondContact OH-NE2 3.11Å; E866-Q870 WeakPolarHBondContact O-CG 3.31Å; E866-Q870 PolarHBondContact O-N 2.96Å; K867-Q870 WeakPolarHBondContact O-CB 3.39Å; K867-Q870 PolarHBondContact O-N 3.01Å; F868-Q870 VanDerWaalsContact C-N 3.32Å; F868-Q870 PolarHBondContact O-N 2.94Å; Q870-Y874 WeakPolarHBondContact O-CB 3.42Å; Q870-Y874 PolarHBondContact O-N 3.03Å
871	V	95.8	Very high	94.4	Very high	18 Å²	18	87 Å²	87	11%	0.109	39%	0.392	C	S	.	.	H	α-helix	trans	-68.5	-42.7	174.7	-178	0	0	0	0	110.3	K867 F868 K869 Y874 M875 I888 Y892	K867-V871 PolarHBondContact O-N 2.82Å; F868-V871 CarbonylContact O-C 3.56Å; F868-V871 WeakPolarHBondContact O-CA 3.3Å; F868-V871 VanDerWaalsContact O-CB 3.3Å; F868-V871 WeakPolarHBondContact O-CB 3.47Å; F868-V871 PolarHBondContact O-N 3.32Å; K869-V871 VanDerWaalsContact C-N 3.28Å; K869-V871 PolarHBondContact O-N 3.36Å; V871-Y874 WeakPolarHBondContact O-CB 3.05Å; V871-Y874 PolarHBondContact O-N 3.14Å; V871-M875 HydrophobicContact CG1-CE 4.25Å; V871-M875 HydrophobicContact CG1-CG 4.33Å; V871-M875 HydrophobicContact CG1-SD 4.45Å; V871-M875 WeakPolarHBondContact O-CB 3.4Å; V871-M875 VanDerWaalsContact O-CG 3.24Å; V871-M875 WeakPolarHBondContact O-CG 3.39Å; V871-M875 PolarHBondContact O-N 3.21Å; V871-I888 HydrophobicContact CG1-CG2 3.71Å; V871-Y892 HydrophobicContact CG1-CE2 4.03Å; V871-Y892 HydrophobicContact CG2-CE1 4.19Å; V871-Y892 HydrophobicContact CG2-CE2 4.02Å
872	E	95.3	Very high	94.7	Very high	92 Å²	92	93 Å²	93	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-61.5	-45	174.9	-66	-179.1	123.4	0	0	112.9	F868 K869 Y874 M875 A876	F868-E872 HydrophobicContact CD1-CG 3.91Å; F868-E872 HydrophobicContact CE1-CG 3.72Å; F868-E872 HydrophobicContact CZ-CG 4.48Å; F868-E872 PolarHBondContact O-N 3.43Å; K869-E872 PolarHBondContact O-N 2.7Å; E872-Y874 VanDerWaalsContact C-N 3.3Å; E872-Y874 PolarHBondContact O-N 3.23Å; E872-M875 HydrophobicContact CB-CE 4.41Å; E872-M875 HydrophobicContact CG-CE 3.98Å; E872-M875 PolarHBondContact O-N 2.69Å; E872-A876 WeakPolarHBondContact O-CB 3.33Å; E872-A876 PolarHBondContact O-N 3.18Å
873	E	96	Very high	95.1	Very high	105 Å²	105	92.2 Å²	92.2	49%	0.491	43%	0.426	S	S	.	.	H	α-helix	trans	-59.9	-40.7	174.4	-74.2	172.6	-173.8	0	0	111.1	K869 A876 Y877	K869-E873 IonicContact NZ-OE1 2.65Å; K869-E873 PolarHBondContact NZ-OE1 3.25Å; K869-E873 WeakPolarHBondContact O-CB 3.26Å; K869-E873 WeakPolarHBondContact O-CG 3.48Å; K869-E873 PolarHBondContact O-N 3.1Å; E873-A876 PolarHBondContact O-N 3.38Å; E873-Y877 VanDerWaalsContact O-CB 3.28Å; E873-Y877 WeakPolarHBondContact O-CB 3.42Å; E873-Y877 PolarHBondContact O-N 2.81Å
874	Y	96.8	Very high	95.3	Very high	129 Å²	129	92 Å²	92	51%	0.506	43%	0.425	S	S	.	.	H	α-helix	trans	-65.1	-44.7	172.8	179.1	-99.2	0	0	0	112.9	Q870 V871 E872 A876 Y877 R878	Q870-Y874 WeakPolarHBondContact O-CB 3.42Å; Q870-Y874 PolarHBondContact O-N 3.03Å; V871-Y874 WeakPolarHBondContact O-CB 3.05Å; V871-Y874 PolarHBondContact O-N 3.14Å; E872-Y874 VanDerWaalsContact C-N 3.3Å; E872-Y874 PolarHBondContact O-N 3.23Å; Y874-A876 VanDerWaalsContact C-N 3.29Å; Y874-A876 PolarHBondContact O-N 3.19Å; Y874-Y877 PolarHBondContact O-N 2.94Å; Y874-R878 HydrophobicContact CD1-CG 4.49Å; Y874-R878 HydrophobicContact CD2-CG 4.22Å; Y874-R878 HydrophobicContact CE1-CG 4.04Å; Y874-R878 HydrophobicContact CE2-CG 3.73Å; Y874-R878 WeakPolarHBondContact O-CB 3.36Å; Y874-R878 PolarHBondContact O-N 2.99Å
875	M	96.4	Very high	95.4	Very high	9 Å²	9	94.8 Å²	94.8	4%	0.044	44%	0.435	C	S	.	.	H	α-helix	trans	-62.9	-35.3	177.2	-70.5	-168	-68.4	0	0	112.2	V871 E872 K879 L880 R885 I888	V871-M875 HydrophobicContact CG1-CE 4.25Å; V871-M875 HydrophobicContact CG1-CG 4.33Å; V871-M875 HydrophobicContact CG1-SD 4.45Å; V871-M875 WeakPolarHBondContact O-CB 3.4Å; V871-M875 VanDerWaalsContact O-CG 3.24Å; V871-M875 WeakPolarHBondContact O-CG 3.39Å; V871-M875 PolarHBondContact O-N 3.21Å; E872-M875 HydrophobicContact CB-CE 4.41Å; E872-M875 HydrophobicContact CG-CE 3.98Å; E872-M875 PolarHBondContact O-N 2.69Å; M875-K879 PolarHBondContact O-N 3.05Å; M875-L880 HydrophobicContact CB-CD1 4.34Å; M875-L880 HydrophobicContact CG-CD1 3.99Å; M875-L880 PolarHBondContact O-N 2.86Å; M875-R885 HydrophobicContact CB-CG 4.15Å; M875-R885 HydrophobicContact CE-CB 4.33Å; M875-R885 HydrophobicContact CG-CG 4.45Å; M875-R885 HydrophobicContact SD-CB 3.77Å; M875-R885 HydrophobicContact SD-CG 3.76Å; M875-I888 HydrophobicContact CE-CG2 4.43Å; M875-I888 HydrophobicContact CG-CD1 4.15Å; M875-I888 HydrophobicContact SD-CB 3.84Å; M875-I888 HydrophobicContact SD-CD1 3.71Å; M875-I888 HydrophobicContact SD-CG1 4.38Å; M875-I888 HydrophobicContact SD-CG2 3.77Å
876	A	94.8	Very high	95.6	Very high	52 Å²	52	93.8 Å²	93.8	43%	0.43	44%	0.435	S	S	.	.	H	α-helix	trans	-71.4	-48	174.1	0	0	0	0	0	111.7	E872 E873 Y874 R878 K879	E872-A876 WeakPolarHBondContact O-CB 3.33Å; E872-A876 PolarHBondContact O-N 3.18Å; E873-A876 PolarHBondContact O-N 3.38Å; Y874-A876 VanDerWaalsContact C-N 3.29Å; Y874-A876 PolarHBondContact O-N 3.19Å; A876-R878 PolarHBondContact O-N 3.17Å; A876-K879 WeakPolarHBondContact O-CA 3.41Å; A876-K879 PolarHBondContact O-N 3.42Å
877	Y	96.4	Very high	95.7	Very high	173 Å²	173	95.6 Å²	95.6	68%	0.678	44%	0.439	S	S	*	.	H	α-helix	trans	-58.7	-44.6	177.6	173.7	-104	0	0	0	112.5	E873 Y874 K879	E873-Y877 VanDerWaalsContact O-CB 3.28Å; E873-Y877 WeakPolarHBondContact O-CB 3.42Å; E873-Y877 PolarHBondContact O-N 2.81Å; Y874-Y877 PolarHBondContact O-N 2.94Å; Y877-K879 PolarHBondContact O-N 2.85Å
878	R	97	Very high	95.8	Very high	142 Å²	142	93.3 Å²	93.3	54%	0.536	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2.4	174.3	-64.4	-57.7	-165	-172.5	2	114.1	Y874 A876 L880	Y874-R878 HydrophobicContact CD1-CG 4.49Å; Y874-R878 HydrophobicContact CD2-CG 4.22Å; Y874-R878 HydrophobicContact CE1-CG 4.04Å; Y874-R878 HydrophobicContact CE2-CG 3.73Å; Y874-R878 WeakPolarHBondContact O-CB 3.36Å; Y874-R878 PolarHBondContact O-N 2.99Å; A876-R878 PolarHBondContact O-N 3.17Å; R878-L880 HydrophobicContact CB-CD2 3.81Å; R878-L880 HydrophobicContact CB-CG 4.06Å; R878-L880 PolarHBondContact O-N 3.1Å
879	K	95.4	Very high	95.7	Very high	178 Å²	178	92.6 Å²	92.6	77%	0.774	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	37.4	179.7	-58.2	-177	-179.5	179.9	0	114.1	M875 A876 Y877	M875-K879 PolarHBondContact O-N 3.05Å; A876-K879 WeakPolarHBondContact O-CA 3.41Å; A876-K879 PolarHBondContact O-N 3.42Å; Y877-K879 PolarHBondContact O-N 2.85Å
880	L	96.3	Very high	95.7	Very high	38 Å²	38	89.6 Å²	89.6	20%	0.199	42%	0.421	C	S	.	.			trans	-62.3	146.2	-173.7	-58.9	-171.1	0	0	0	112.2	M875 R878 L884 R885 I888	M875-L880 HydrophobicContact CB-CD1 4.34Å; M875-L880 HydrophobicContact CG-CD1 3.99Å; M875-L880 PolarHBondContact O-N 2.86Å; R878-L880 HydrophobicContact CB-CD2 3.81Å; R878-L880 HydrophobicContact CB-CG 4.06Å; R878-L880 PolarHBondContact O-N 3.1Å; L880-L884 HydrophobicContact CB-CD2 4.35Å; L880-L884 HydrophobicContact CD1-CD2 4.04Å; L880-L884 HydrophobicContact CD1-CG 4.42Å; L880-L884 HydrophobicContact CD2-CD2 4.33Å; L880-L884 HydrophobicContact CG-CD2 4.48Å; L880-R885 HydrophobicContact CB-CG 4.25Å; L880-R885 PolarHBondContact O-NE 2.95Å; L880-R885 PolarHBondContact O-NH2 2.99Å; L880-I888 HydrophobicContact CD1-CD1 3.92Å
881	P	97	Very high	95.7	Very high	88 Å²	88	90 Å²	90	57%	0.571	42%	0.42	S	S	*	.			trans	-61.2	147.9	177.4	-24.1	34.4	0	0	0	113.4	A883 L884 R885	P881-A883 VanDerWaalsContact C-N 3.28Å; P881-A883 PolarHBondContact O-N 3.35Å; P881-L884 PolarHBondContact O-N 2.81Å; P881-R885 PolarHBondContact O-N 2.87Å
882	R	94.5	Very high	95.6	Very high	219 Å²	219	91.5 Å²	91.5	83%	0.826	42%	0.424	S	S	*	.	H	α-helix	trans	-53.4	-41.7	-177.7	-174.9	178.1	178.5	-179.3	-0	113.1	L884 R885 Q886	R882-L884 PolarHBondContact O-N 3.43Å; R882-R885 PolarHBondContact O-N 3.34Å; R882-Q886 PolarHBondContact O-N 3.24Å
883	A	95.1	Very high	95.5	Very high	77 Å²	77	93 Å²	93	64%	0.636	43%	0.432	S	S	*	.	H	α-helix	trans	-60.1	-42.4	177.2	0	0	0	0	0	112.5	P881 Q886 R887	P881-A883 VanDerWaalsContact C-N 3.28Å; P881-A883 PolarHBondContact O-N 3.35Å; A883-Q886 PolarHBondContact O-N 3.42Å; A883-R887 WeakPolarHBondContact O-CG 3.22Å; A883-R887 PolarHBondContact O-N 3.5Å
884	L	95.4	Very high	95.3	Very high	73 Å²	73	91 Å²	91	38%	0.382	42%	0.422	S	S	.	.	H	α-helix	trans	-68.9	-36.4	176.6	-176.8	57.7	0	0	0	111.7	L880 P881 R882 R887 I888	L880-L884 HydrophobicContact CB-CD2 4.35Å; L880-L884 HydrophobicContact CD1-CD2 4.04Å; L880-L884 HydrophobicContact CD1-CG 4.42Å; L880-L884 HydrophobicContact CD2-CD2 4.33Å; L880-L884 HydrophobicContact CG-CD2 4.48Å; P881-L884 PolarHBondContact O-N 2.81Å; R882-L884 PolarHBondContact O-N 3.43Å; L884-R887 PolarHBondContact O-N 3.29Å; L884-I888 HydrophobicContact CD1-CD1 4.33Å; L884-I888 HydrophobicContact CD1-CG1 4.48Å; L884-I888 HydrophobicContact CG-CD1 4.06Å; L884-I888 VanDerWaalsContact O-CG1 3.31Å; L884-I888 WeakPolarHBondContact O-CG1 3.44Å; L884-I888 PolarHBondContact O-N 3.29Å
885	R	95.1	Very high	95.1	Very high	93 Å²	93	87.2 Å²	87.2	35%	0.351	41%	0.407	S	S	.	.	H	α-helix	trans	-62.8	-44.1	174	-58.1	-168.3	-160.4	-176.3	6.3	112.2	M875 L880 P881 R882 R887 I888 A889	M875-R885 HydrophobicContact CB-CG 4.15Å; M875-R885 HydrophobicContact CE-CB 4.33Å; M875-R885 HydrophobicContact CG-CG 4.45Å; M875-R885 HydrophobicContact SD-CB 3.77Å; M875-R885 HydrophobicContact SD-CG 3.76Å; L880-R885 HydrophobicContact CB-CG 4.25Å; L880-R885 PolarHBondContact O-NE 2.95Å; L880-R885 PolarHBondContact O-NH2 2.99Å; P881-R885 PolarHBondContact O-N 2.87Å; R882-R885 PolarHBondContact O-N 3.34Å; R885-R887 VanDerWaalsContact C-N 3.34Å; R885-R887 PolarHBondContact O-N 2.85Å; R885-I888 PolarHBondContact O-N 3.47Å; R885-A889 WeakPolarHBondContact O-CB 3.43Å; R885-A889 PolarHBondContact O-N 3.15Å
886	Q	95.1	Very high	94.9	Very high	103 Å²	103	89.7 Å²	89.7	48%	0.481	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-41.6	176.3	-166.3	66.4	52	0	0	111.4	R882 A883 I888 A889 N890	R882-Q886 PolarHBondContact O-N 3.24Å; A883-Q886 PolarHBondContact O-N 3.42Å; Q886-I888 PolarHBondContact O-N 2.86Å; Q886-A889 PolarHBondContact O-N 3.28Å; Q886-N890 PolarHBondContact NE2-OD1 3.04Å; Q886-N890 WeakPolarHBondContact O-CB 3.35Å; Q886-N890 PolarHBondContact O-N 3.09Å; Q886-N890 PolarHBondContact O-OD1 2.84Å
887	R	95.8	Very high	94.7	Very high	110 Å²	110	94.1 Å²	94.1	42%	0.415	43%	0.428	S	S	.	.	H	α-helix	trans	-58.3	-46	173.7	-77.7	-165	60.5	-175.5	-8.5	112.3	A883 L884 R885 Y891 Q954 D957	A883-R887 WeakPolarHBondContact O-CG 3.22Å; A883-R887 PolarHBondContact O-N 3.5Å; L884-R887 PolarHBondContact O-N 3.29Å; R885-R887 VanDerWaalsContact C-N 3.34Å; R885-R887 PolarHBondContact O-N 2.85Å; R887-Y891 WeakPolarHBondContact O-CB 3.48Å; R887-Y891 PolarHBondContact O-N 2.83Å; R887-Q954 PolarHBondContact O-NE2 3.31Å; R887-D957 IonicContact CZ-OD1 2.64Å; R887-D957 IonicContact NH1-OD1 3.62Å; R887-D957 PolarHBondContact NH1-OD1 3.49Å; R887-D957 VanDerWaalsContact NH2-CG 3.26Å; R887-D957 IonicContact NH2-OD1 3.02Å; R887-D957 PolarHBondContact NH2-OD1 3.17Å; R887-D957 IonicContact NH2-OD2 2.73Å; R887-D957 PolarHBondContact NH2-OD2 3.22Å; R887-D957 VanDerWaalsContact NH2-OD2 3.12Å
888	I	95.9	Very high	94.2	Very high	38 Å²	38	87 Å²	87	20%	0.195	41%	0.408	C	S	.	.	H	α-helix	trans	-62.7	-43.3	176.2	-68.4	164	0	0	0	110.9	V871 M875 L880 L884 R885 Q886 Y891 Y892	V871-I888 HydrophobicContact CG1-CG2 3.71Å; M875-I888 HydrophobicContact CE-CG2 4.43Å; M875-I888 HydrophobicContact CG-CD1 4.15Å; M875-I888 HydrophobicContact SD-CB 3.84Å; M875-I888 HydrophobicContact SD-CD1 3.71Å; M875-I888 HydrophobicContact SD-CG1 4.38Å; M875-I888 HydrophobicContact SD-CG2 3.77Å; L880-I888 HydrophobicContact CD1-CD1 3.92Å; L884-I888 HydrophobicContact CD1-CD1 4.33Å; L884-I888 HydrophobicContact CD1-CG1 4.48Å; L884-I888 HydrophobicContact CG-CD1 4.06Å; L884-I888 VanDerWaalsContact O-CG1 3.31Å; L884-I888 WeakPolarHBondContact O-CG1 3.44Å; L884-I888 PolarHBondContact O-N 3.29Å; R885-I888 PolarHBondContact O-N 3.47Å; Q886-I888 PolarHBondContact O-N 2.86Å; I888-Y891 PolarHBondContact O-N 3.34Å; I888-Y892 HydrophobicContact CG2-CD2 3.89Å; I888-Y892 HydrophobicContact CG2-CE2 4.05Å; I888-Y892 WeakPolarHBondContact O-CD2 3.49Å; I888-Y892 PolarHBondContact O-N 3.43Å
889	A	94.3	Very high	93.8	Very high	22 Å²	22	85.2 Å²	85.2	18%	0.182	40%	0.403	C	S	.	.	H	α-helix	trans	-58.1	-54.5	176.9	0	0	0	0	0	111.8	F868 R885 Q886 Y891 Y892 E893	F868-A889 HydrophobicContact CE2-CB 4.41Å; F868-A889 HydrophobicContact CZ-CB 3.9Å; R885-A889 WeakPolarHBondContact O-CB 3.43Å; R885-A889 PolarHBondContact O-N 3.15Å; Q886-A889 PolarHBondContact O-N 3.28Å; A889-Y891 PolarHBondContact O-N 2.82Å; A889-Y892 PolarHBondContact O-N 3.48Å; A889-Y892 VanDerWaalsContact O-N 3.17Å; A889-E893 PolarHBondContact O-N 2.87Å
890	N	95.2	Very high	93.4	Very high	53 Å²	53	78.7 Å²	78.7	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-33.7	178.8	-61.7	12.3	0	0	0	112.2	Q886 H894	Q886-N890 PolarHBondContact NE2-OD1 3.04Å; Q886-N890 WeakPolarHBondContact O-CB 3.35Å; Q886-N890 PolarHBondContact O-N 3.09Å; Q886-N890 PolarHBondContact O-OD1 2.84Å; N890-H894 WeakPolarHBondContact O-CB 3.39Å; N890-H894 PolarHBondContact O-N 2.97Å
891	Y	95.7	Very high	93	Very high	77 Å²	77	82.6 Å²	82.6	30%	0.302	39%	0.392	S	S	.	.	H	α-helix	trans	-66.4	-48.4	174.8	169.6	-93.3	0	0	0	112	R887 I888 A889 E893 H894 R895 V952	R887-Y891 WeakPolarHBondContact O-CB 3.48Å; R887-Y891 PolarHBondContact O-N 2.83Å; I888-Y891 PolarHBondContact O-N 3.34Å; A889-Y891 PolarHBondContact O-N 2.82Å; Y891-E893 VanDerWaalsContact C-N 3.33Å; Y891-E893 PolarHBondContact O-N 2.65Å; Y891-H894 PolarHBondContact O-N 2.91Å; Y891-R895 HydrophobicContact CE1-CB 4.43Å; Y891-R895 VanDerWaalsContact O-CB 3.29Å; Y891-R895 WeakPolarHBondContact O-CB 3.45Å; Y891-R895 PolarHBondContact O-N 3.16Å; Y891-V952 HydrophobicContact CE2-CB 4.37Å; Y891-V952 WeakPolarHBondContact CE2-O 3.46Å
892	Y	94.1	Very high	92.6	Very high	50 Å²	50	82.8 Å²	82.8	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-63.8	-39.7	178.3	-93.5	-89.5	0	0	0	111.9	F868 V871 I888 A889 Y896	F868-Y892 HydrophobicContact CD2-CG 4.23Å; F868-Y892 HydrophobicContact CE2-CG 4.36Å; V871-Y892 HydrophobicContact CG1-CE2 4.03Å; V871-Y892 HydrophobicContact CG2-CE1 4.19Å; V871-Y892 HydrophobicContact CG2-CE2 4.02Å; I888-Y892 HydrophobicContact CG2-CD2 3.89Å; I888-Y892 HydrophobicContact CG2-CE2 4.05Å; I888-Y892 WeakPolarHBondContact O-CD2 3.49Å; I888-Y892 PolarHBondContact O-N 3.43Å; A889-Y892 PolarHBondContact O-N 3.48Å; A889-Y892 VanDerWaalsContact O-N 3.17Å; Y892-Y896 AromaticContact CD1-CD2 3.7Å; Y892-Y896 HydrophobicContact CD1-CD2 3.7Å; Y892-Y896 AromaticContact CD1-CE2 3.73Å; Y892-Y896 HydrophobicContact CD1-CE2 3.73Å; Y892-Y896 HydrophobicContact CE1-CD2 4.24Å; Y892-Y896 AromaticContact CE1-CE2 3.79Å; Y892-Y896 HydrophobicContact CE1-CE2 3.79Å; Y892-Y896 HydrophobicContact CG-CD2 4.49Å; Y892-Y896 WeakPolarHBondContact O-CB 3.27Å; Y892-Y896 PolarHBondContact O-N 2.83Å; Y892-Y896 VanDerWaalsContact O-N 3.1Å
893	E	93.1	Very high	92.4	Very high	125 Å²	125	76.8 Å²	76.8	58%	0.584	37%	0.369	S	S	*	.	H	α-helix	trans	-59.2	-50.1	174.1	-168.7	-166.8	163.7	0	0	111.3	A889 Y891 Q897	A889-E893 PolarHBondContact O-N 2.87Å; Y891-E893 VanDerWaalsContact C-N 3.33Å; Y891-E893 PolarHBondContact O-N 2.65Å; E893-Q897 VanDerWaalsContact O-CA 3.25Å; E893-Q897 WeakPolarHBondContact O-CA 3.25Å; E893-Q897 PolarHBondContact O-N 3.33Å
894	H	92.5	Very high	92	Very high	61 Å²	61	76 Å²	76	28%	0.282	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-44	-179.3	-159.3	105.3	0	0	0	112.7	N890 Y891 Y896 Y1016	N890-H894 WeakPolarHBondContact O-CB 3.39Å; N890-H894 PolarHBondContact O-N 2.97Å; Y891-H894 PolarHBondContact O-N 2.91Å; H894-Y896 PolarHBondContact O-N 2.69Å; H894-Y1016 HydrophobicContact CB-CD1 4.23Å; H894-Y1016 HydrophobicContact CB-CE1 4.14Å; H894-Y1016 VanDerWaalsContact CE1-CB 3.49Å; H894-Y1016 WeakPolarHBondContact CE1-CB 3.34Å; H894-Y1016 AromaticContact CE1-CD1 3.76Å; H894-Y1016 AromaticContact CE1-CG 3.59Å; H894-Y1016 AromaticContact CG-CD1 3.69Å; H894-Y1016 AromaticContact ND1-CD1 3.44Å; H894-Y1016 WeakPolarHBondContact ND1-CD1 3.4Å; H894-Y1016 AromaticContact ND1-CE1 3.88Å; H894-Y1016 AromaticContact ND1-CG 3.62Å
895	R	93.3	Very high	91.9	Very high	51 Å²	51	77.7 Å²	77.7	19%	0.192	37%	0.369	C	S	.	.	H	α-helix	trans	-72.3	-26.6	-175.6	178.9	58.6	-173.6	86.4	-9.9	114	Y891 E903	Y891-R895 HydrophobicContact CE1-CB 4.43Å; Y891-R895 VanDerWaalsContact O-CB 3.29Å; Y891-R895 WeakPolarHBondContact O-CB 3.45Å; Y891-R895 PolarHBondContact O-N 3.16Å; R895-E903 IonicContact NH2-OE2 3.05Å
896	Y	91.5	Very high	91.8	Very high	60 Å²	60	76.5 Å²	76.5	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-124.7	-13.2	-173	-65.4	-77.9	0	0	0	114.9	Y892 H894 G898 K899 M900	Y892-Y896 AromaticContact CD1-CD2 3.7Å; Y892-Y896 HydrophobicContact CD1-CD2 3.7Å; Y892-Y896 AromaticContact CD1-CE2 3.73Å; Y892-Y896 HydrophobicContact CD1-CE2 3.73Å; Y892-Y896 HydrophobicContact CE1-CD2 4.24Å; Y892-Y896 AromaticContact CE1-CE2 3.79Å; Y892-Y896 HydrophobicContact CE1-CE2 3.79Å; Y892-Y896 HydrophobicContact CG-CD2 4.49Å; Y892-Y896 WeakPolarHBondContact O-CB 3.27Å; Y892-Y896 PolarHBondContact O-N 2.83Å; Y892-Y896 VanDerWaalsContact O-N 3.1Å; H894-Y896 PolarHBondContact O-N 2.69Å; Y896-G898 PolarHBondContact O-N 3.14Å; Y896-G898 VanDerWaalsContact O-N 3.13Å; Y896-K899 PolarHBondContact O-N 3.03Å; Y896-K899 VanDerWaalsContact O-O 3.08Å; Y896-M900 HydrophobicContact CD1-CE 4.46Å; Y896-M900 HydrophobicContact CD1-SD 4.06Å; Y896-M900 HydrophobicContact CE1-CE 3.87Å; Y896-M900 HydrophobicContact CE1-SD 4.07Å; Y896-M900 HydrophobicContact CG-SD 4.48Å
897	Q	90.1	Very high	91.6	Very high	145 Å²	145	73.1 Å²	73.1	68%	0.678	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	41.3	174	-55.7	178.7	0.5	0	0	113.2	E893 K899	E893-Q897 VanDerWaalsContact O-CA 3.25Å; E893-Q897 WeakPolarHBondContact O-CA 3.25Å; E893-Q897 PolarHBondContact O-N 3.33Å; Q897-K899 VanDerWaalsContact C-N 3.3Å; Q897-K899 PolarHBondContact O-N 3.18Å
898	G	85.5	Confident	91.3	Very high	25 Å²	25	73 Å²	73	26%	0.258	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	12.1	-179.2	0	0	0	0	0	116	Y896	Y896-G898 PolarHBondContact O-N 3.14Å; Y896-G898 VanDerWaalsContact O-N 3.13Å
899	K	88.7	Confident	91.2	Very high	103 Å²	103	77.7 Å²	77.7	45%	0.448	38%	0.383	S	S	.	.			trans	-129	126.1	-177.5	-58.4	164.5	-167.6	153.8	0	110.6	Y896 Q897 F901	Y896-K899 PolarHBondContact O-N 3.03Å; Y896-K899 VanDerWaalsContact O-O 3.08Å; Q897-K899 VanDerWaalsContact C-N 3.3Å; Q897-K899 PolarHBondContact O-N 3.18Å; K899-F901 HydrophobicContact CB-CD2 4.24Å; K899-F901 HydrophobicContact CB-CE2 3.55Å; K899-F901 HydrophobicContact CB-CZ 3.99Å; K899-F901 HydrophobicContact CD-CE2 4.05Å; K899-F901 HydrophobicContact CD-CZ 4.32Å; K899-F901 HydrophobicContact CG-CE2 4.36Å
900	M	87.4	Confident	91.1	Very high	41 Å²	41	80.3 Å²	80.3	20%	0.202	39%	0.39	C	S	.	.			trans	-97.7	129.7	174.2	-157.6	73.3	-163.1	0	0	110.7	S860 L863 K867 Y896	S860-M900 PolarHBondContact O-N 2.95Å; L863-M900 HydrophobicContact CB-CB 3.98Å; K867-M900 HydrophobicContact CB-SD 4.27Å; K867-M900 HydrophobicContact CG-CE 4.1Å; K867-M900 HydrophobicContact CG-SD 4.14Å; Y896-M900 HydrophobicContact CD1-CE 4.46Å; Y896-M900 HydrophobicContact CD1-SD 4.06Å; Y896-M900 HydrophobicContact CE1-CE 3.87Å; Y896-M900 HydrophobicContact CE1-SD 4.07Å; Y896-M900 HydrophobicContact CG-SD 4.48Å
901	F	88.5	Confident	90.9	Very high	120 Å²	120	81.2 Å²	81.2	53%	0.526	40%	0.4	S	S	.	.			trans	-141.5	149.2	173.2	-56.6	-67.5	0	0	0	109.4	K899 I906	K899-F901 HydrophobicContact CB-CD2 4.24Å; K899-F901 HydrophobicContact CB-CE2 3.55Å; K899-F901 HydrophobicContact CB-CZ 3.99Å; K899-F901 HydrophobicContact CD-CE2 4.05Å; K899-F901 HydrophobicContact CD-CZ 4.32Å; K899-F901 HydrophobicContact CG-CE2 4.36Å; F901-I906 HydrophobicContact CB-CD1 4.16Å
902	D	89.1	Confident	90.5	Very high	92 Å²	92	84.9 Å²	84.9	49%	0.492	42%	0.42	S	S	.	.			trans	-94.1	99.5	162.4	-167.9	-43.6	0	0	0	108.4	A904 Q905 I906	D902-A904 VanDerWaalsContact C-N 3.31Å; D902-A904 PolarHBondContact OD1-N 3.16Å; D902-A904 VanDerWaalsContact OD1-N 3.08Å; D902-Q905 HydrophobicContact CB-CB 4Å; D902-Q905 PolarHBondContact OD1-N 3.41Å; D902-I906 WeakPolarHBondContact O-CB 3.19Å; D902-I906 WeakPolarHBondContact O-CD1 3.35Å; D902-I906 WeakPolarHBondContact O-CG1 3.33Å; D902-I906 PolarHBondContact O-N 3.14Å; D902-I906 VanDerWaalsContact O-N 3.14Å
903	E	88.5	Confident	90.3	Very high	93 Å²	93	86.3 Å²	86.3	44%	0.435	44%	0.437	S	S	.	.	H	α-helix	trans	-67.3	-33.2	-177.4	-174.5	165.5	-158.1	0	0	112	R895 L907	R895-E903 IonicContact NH2-OE2 3.05Å; E903-L907 HydrophobicContact CG-CD1 3.99Å; E903-L907 WeakPolarHBondContact O-CB 3.47Å; E903-L907 VanDerWaalsContact O-CG 3.24Å; E903-L907 WeakPolarHBondContact O-CG 3.46Å; E903-L907 PolarHBondContact O-N 3.03Å
904	A	88.2	Confident	90.2	Very high	60 Å²	60	84.6 Å²	84.6	50%	0.496	43%	0.431	S	S	.	.	H	α-helix	trans	-71.5	-43.4	179.4	0	0	0	0	0	111.5	D902 N908	D902-A904 VanDerWaalsContact C-N 3.31Å; D902-A904 PolarHBondContact OD1-N 3.16Å; D902-A904 VanDerWaalsContact OD1-N 3.08Å; A904-N908 VanDerWaalsContact O-CB 3.31Å; A904-N908 WeakPolarHBondContact O-CB 3.27Å; A904-N908 VanDerWaalsContact O-CG 3.26Å; A904-N908 PolarHBondContact O-N 3.24Å; A904-N908 PolarHBondContact O-ND2 2.82Å; A904-N908 VanDerWaalsContact O-ND2 3.15Å
905	Q	91.7	Very high	90.1	Very high	110 Å²	110	85 Å²	85	51%	0.514	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-49.3	173.7	-172.4	-172.1	-27	0	0	110.9	D902 L907 N908 E909	D902-Q905 HydrophobicContact CB-CB 4Å; D902-Q905 PolarHBondContact OD1-N 3.41Å; Q905-L907 PolarHBondContact O-N 2.71Å; Q905-N908 PolarHBondContact O-N 3.09Å; Q905-N908 VanDerWaalsContact O-N 3.12Å; Q905-E909 PolarHBondContact NE2-OE1 3.33Å; Q905-E909 PolarHBondContact O-N 3.05Å
906	I	93.3	Very high	89.8	Confident	68 Å²	68	86.5 Å²	86.5	35%	0.349	44%	0.439	S	S	.	.	H	α-helix	trans	-61.3	-43.6	-177.8	-68.7	165.9	0	0	0	111.4	F901 D902 N908 E909 F910	F901-I906 HydrophobicContact CB-CD1 4.16Å; D902-I906 WeakPolarHBondContact O-CB 3.19Å; D902-I906 WeakPolarHBondContact O-CD1 3.35Å; D902-I906 WeakPolarHBondContact O-CG1 3.33Å; D902-I906 PolarHBondContact O-N 3.14Å; D902-I906 VanDerWaalsContact O-N 3.14Å; I906-N908 VanDerWaalsContact C-N 3.33Å; I906-N908 PolarHBondContact O-N 2.75Å; I906-E909 PolarHBondContact O-N 3.18Å; I906-F910 HydrophobicContact CG2-CE1 4.11Å; I906-F910 HydrophobicContact CG2-CE2 4.12Å; I906-F910 HydrophobicContact CG2-CZ 3.63Å; I906-F910 WeakPolarHBondContact O-CD1 3.45Å; I906-F910 PolarHBondContact O-N 3.37Å
907	L	90.6	Very high	89.6	Confident	32 Å²	32	89.7 Å²	89.7	17%	0.168	46%	0.456	C	S	.	.	H	α-helix	trans	-66	-35.9	176.3	-72.6	172.7	0	0	0	111.9	E903 Q905 F910 R915 V918 I919	E903-L907 HydrophobicContact CG-CD1 3.99Å; E903-L907 WeakPolarHBondContact O-CB 3.47Å; E903-L907 VanDerWaalsContact O-CG 3.24Å; E903-L907 WeakPolarHBondContact O-CG 3.46Å; E903-L907 PolarHBondContact O-N 3.03Å; Q905-L907 PolarHBondContact O-N 2.71Å; L907-F910 HydrophobicContact CD2-CD2 4.15Å; L907-F910 HydrophobicContact CD2-CE2 4.32Å; L907-F910 WeakPolarHBondContact O-CB 3.35Å; L907-F910 PolarHBondContact O-N 3.4Å; L907-R915 HydrophobicContact CB-CG 4.15Å; L907-R915 HydrophobicContact CD2-CG 4.2Å; L907-R915 PolarHBondContact O-NE 3.11Å; L907-R915 PolarHBondContact O-NH2 3.43Å; L907-V918 HydrophobicContact CD2-CG1 4.06Å; L907-I919 HydrophobicContact CD1-CD1 4.49Å
908	N	90.9	Very high	89.7	Confident	107 Å²	107	85.3 Å²	85.3	57%	0.572	44%	0.439	S	S	*	.	H	α-helix	trans	-69.5	-30.5	176.6	-78.1	-29.6	0	0	0	113.7	A904 Q905 I906 F910 R915	A904-N908 VanDerWaalsContact O-CB 3.31Å; A904-N908 WeakPolarHBondContact O-CB 3.27Å; A904-N908 VanDerWaalsContact O-CG 3.26Å; A904-N908 PolarHBondContact O-N 3.24Å; A904-N908 PolarHBondContact O-ND2 2.82Å; A904-N908 VanDerWaalsContact O-ND2 3.15Å; Q905-N908 PolarHBondContact O-N 3.09Å; Q905-N908 VanDerWaalsContact O-N 3.12Å; I906-N908 VanDerWaalsContact C-N 3.33Å; I906-N908 PolarHBondContact O-N 2.75Å; N908-F910 PolarHBondContact O-N 3.15Å; N908-R915 PolarHBondContact O-NH2 3.28Å; N908-R915 VanDerWaalsContact O-NH2 3.17Å; N908-R915 PolarHBondContact OD1-NH1 2.91Å
909	E	93.3	Very high	89.9	Confident	137 Å²	137	85.4 Å²	85.4	64%	0.64	43%	0.434	S	S	*	.	H	α-helix	trans	-69.9	-17.6	171.4	-72.7	177.8	-158.2	0	0	113.1	Q905 I906	Q905-E909 PolarHBondContact NE2-OE1 3.33Å; Q905-E909 PolarHBondContact O-N 3.05Å; I906-E909 PolarHBondContact O-N 3.18Å
910	F	92	Very high	89.8	Confident	77 Å²	77	82.6 Å²	82.6	34%	0.338	42%	0.423	S	S	.	.	S	Bend	trans	-82.1	144.2	173.6	-60.5	-16.4	0	0	0	112.1	I906 L907 N908 L914 R915 V918	I906-F910 HydrophobicContact CG2-CE1 4.11Å; I906-F910 HydrophobicContact CG2-CE2 4.12Å; I906-F910 HydrophobicContact CG2-CZ 3.63Å; I906-F910 WeakPolarHBondContact O-CD1 3.45Å; I906-F910 PolarHBondContact O-N 3.37Å; L907-F910 HydrophobicContact CD2-CD2 4.15Å; L907-F910 HydrophobicContact CD2-CE2 4.32Å; L907-F910 WeakPolarHBondContact O-CB 3.35Å; L907-F910 PolarHBondContact O-N 3.4Å; N908-F910 PolarHBondContact O-N 3.15Å; F910-L914 HydrophobicContact CB-CB 4.23Å; F910-R915 HydrophobicContact CB-CB 4.38Å; F910-R915 PolarHBondContact O-NH2 3.44Å; F910-V918 HydrophobicContact CE2-CG2 4.27Å
911	S	91.5	Very high	89.9	Confident	72 Å²	72	86.9 Å²	86.9	50%	0.503	44%	0.438	S	S	.	.			trans	-61.5	150.6	166	57.9	0	0	0	0	111	C913 L914 R915	S911-C913 PolarHBondContact O-N 3.02Å; S911-L914 WeakPolarHBondContact O-CA 3.26Å; S911-L914 WeakPolarHBondContact O-CB 3.46Å; S911-L914 PolarHBondContact O-N 2.85Å; S911-R915 PolarHBondContact O-N 3.33Å
912	E	88.1	Confident	89.9	Confident	153 Å²	153	84.5 Å²	84.5	72%	0.715	43%	0.431	S	S	*	.	H	α-helix	trans	-51.3	-50	-171.5	-64.9	166.3	159.9	0	0	112.5	L914 R915 E916	E912-L914 VanDerWaalsContact C-N 3.26Å; E912-L914 PolarHBondContact O-N 2.84Å; E912-R915 WeakPolarHBondContact O-CB 3.49Å; E912-R915 PolarHBondContact O-N 3.44Å; E912-R915 VanDerWaalsContact O-N 3.13Å; E912-E916 WeakPolarHBondContact O-CB 3.33Å; E912-E916 PolarHBondContact O-N 3.43Å
913	C	88.1	Confident	89.9	Confident	80 Å²	80	80.4 Å²	80.4	54%	0.541	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-27.3	178.6	-44.8	0	0	0	0	114.1	S911 Q917	S911-C913 PolarHBondContact O-N 3.02Å; C913-Q917 WeakPolarHBondContact O-CB 3.28Å; C913-Q917 VanDerWaalsContact O-CD 3.31Å; C913-Q917 WeakPolarHBondContact O-CG 3.18Å; C913-Q917 PolarHBondContact O-N 3.05Å; C913-Q917 PolarHBondContact O-NE2 2.68Å
914	L	91.5	Very high	89.8	Confident	89 Å²	89	82.7 Å²	82.7	47%	0.466	41%	0.414	S	S	.	.	H	α-helix	trans	-81.5	-39.2	174.6	-72.8	177.8	0	0	0	111.2	F910 S911 E912 Q917 V918	F910-L914 HydrophobicContact CB-CB 4.23Å; S911-L914 WeakPolarHBondContact O-CA 3.26Å; S911-L914 WeakPolarHBondContact O-CB 3.46Å; S911-L914 PolarHBondContact O-N 2.85Å; E912-L914 VanDerWaalsContact C-N 3.26Å; E912-L914 PolarHBondContact O-N 2.84Å; L914-Q917 PolarHBondContact O-N 2.85Å; L914-V918 WeakPolarHBondContact O-CB 3.43Å; L914-V918 VanDerWaalsContact O-CG2 3.32Å; L914-V918 WeakPolarHBondContact O-CG2 3.45Å; L914-V918 PolarHBondContact O-N 2.68Å
915	R	90.7	Very high	89.7	Confident	70 Å²	70	82.6 Å²	82.6	26%	0.264	41%	0.413	S	S	.	.	H	α-helix	trans	-58.2	-50.6	174.3	-169.4	-175.2	-55.1	168.9	8.7	110.4	L907 N908 F910 S911 E912 V918 I919	L907-R915 HydrophobicContact CB-CG 4.15Å; L907-R915 HydrophobicContact CD2-CG 4.2Å; L907-R915 PolarHBondContact O-NE 3.11Å; L907-R915 PolarHBondContact O-NH2 3.43Å; N908-R915 PolarHBondContact O-NH2 3.28Å; N908-R915 VanDerWaalsContact O-NH2 3.17Å; N908-R915 PolarHBondContact OD1-NH1 2.91Å; F910-R915 HydrophobicContact CB-CB 4.38Å; F910-R915 PolarHBondContact O-NH2 3.44Å; S911-R915 PolarHBondContact O-N 3.33Å; E912-R915 WeakPolarHBondContact O-CB 3.49Å; E912-R915 PolarHBondContact O-N 3.44Å; E912-R915 VanDerWaalsContact O-N 3.13Å; R915-V918 PolarHBondContact O-N 2.63Å; R915-I919 HydrophobicContact CG-CD1 3.94Å; R915-I919 VanDerWaalsContact O-CB 3.31Å; R915-I919 WeakPolarHBondContact O-CB 3.24Å; R915-I919 VanDerWaalsContact O-CG1 3.3Å; R915-I919 WeakPolarHBondContact O-CG1 3.25Å; R915-I919 PolarHBondContact O-N 3.32Å
916	E	86.1	Confident	89.5	Confident	83 Å²	83	77.4 Å²	77.4	39%	0.388	39%	0.389	S	S	.	.	H	α-helix	trans	-57.1	-49.5	174.5	-171	-158.9	152.8	0	0	111.9	E912 V918 I919 N920	E912-E916 WeakPolarHBondContact O-CB 3.33Å; E912-E916 PolarHBondContact O-N 3.43Å; E916-V918 VanDerWaalsContact C-N 3.35Å; E916-V918 PolarHBondContact O-N 3.11Å; E916-I919 PolarHBondContact O-N 3.19Å; E916-N920 VanDerWaalsContact O-CB 3.31Å; E916-N920 WeakPolarHBondContact O-CB 2.99Å; E916-N920 PolarHBondContact O-N 2.96Å
917	Q	88.6	Confident	89.1	Confident	126 Å²	126	75.8 Å²	75.8	59%	0.589	38%	0.382	S	S	*	.	H	α-helix	trans	-63.3	-35.9	178.9	-77.8	171.8	26.7	0	0	113.5	C913 L914 Y921	C913-Q917 WeakPolarHBondContact O-CB 3.28Å; C913-Q917 VanDerWaalsContact O-CD 3.31Å; C913-Q917 WeakPolarHBondContact O-CG 3.18Å; C913-Q917 PolarHBondContact O-N 3.05Å; C913-Q917 PolarHBondContact O-NE2 2.68Å; L914-Q917 PolarHBondContact O-N 2.85Å; Q917-Y921 WeakPolarHBondContact O-CB 3.42Å; Q917-Y921 PolarHBondContact O-N 3.12Å
918	V	91.6	Very high	88.9	Confident	53 Å²	53	77.7 Å²	77.7	32%	0.321	40%	0.402	S	S	.	.	H	α-helix	trans	-69.2	-46.9	174.8	168.7	0	0	0	0	110.7	L907 F910 L914 R915 E916 Y921 N922	L907-V918 HydrophobicContact CD2-CG1 4.06Å; F910-V918 HydrophobicContact CE2-CG2 4.27Å; L914-V918 WeakPolarHBondContact O-CB 3.43Å; L914-V918 VanDerWaalsContact O-CG2 3.32Å; L914-V918 WeakPolarHBondContact O-CG2 3.45Å; L914-V918 PolarHBondContact O-N 2.68Å; R915-V918 PolarHBondContact O-N 2.63Å; E916-V918 VanDerWaalsContact C-N 3.35Å; E916-V918 PolarHBondContact O-N 3.11Å; V918-Y921 PolarHBondContact O-N 3.4Å; V918-N922 PolarHBondContact O-N 2.97Å; V918-N922 PolarHBondContact O-OD1 3.33Å
919	I	89.4	Confident	88.6	Confident	27 Å²	27	75 Å²	75	14%	0.138	40%	0.396	C	S	.	.	H	α-helix	trans	-60.8	-49.2	178.8	-78	172.6	0	0	0	111.3	L907 R915 E916 Y921 N922 C923 V945 T946	L907-I919 HydrophobicContact CD1-CD1 4.49Å; R915-I919 HydrophobicContact CG-CD1 3.94Å; R915-I919 VanDerWaalsContact O-CB 3.31Å; R915-I919 WeakPolarHBondContact O-CB 3.24Å; R915-I919 VanDerWaalsContact O-CG1 3.3Å; R915-I919 WeakPolarHBondContact O-CG1 3.25Å; R915-I919 PolarHBondContact O-N 3.32Å; E916-I919 PolarHBondContact O-N 3.19Å; I919-Y921 VanDerWaalsContact C-N 3.32Å; I919-Y921 PolarHBondContact O-N 3.04Å; I919-N922 PolarHBondContact O-N 2.65Å; I919-C923 PolarHBondContact O-N 3.44Å; I919-C923 PolarHBondContact O-SG 3.33Å; I919-V945 HydrophobicContact CG2-CG1 3.66Å; I919-V945 WeakPolarHBondContact CG2-O 3.46Å; I919-T946 HydrophobicContact CG2-CG2 4.15Å
920	N	87.5	Confident	88.2	Confident	44 Å²	44	68.5 Å²	68.5	24%	0.235	37%	0.365	C	S	.	.	H	α-helix	trans	-65.3	-32.6	175.6	-77.7	-17.5	0	0	0	112.1	E916 R924 S942	E916-N920 VanDerWaalsContact O-CB 3.31Å; E916-N920 WeakPolarHBondContact O-CB 2.99Å; E916-N920 PolarHBondContact O-N 2.96Å; N920-R924 WeakPolarHBondContact O-CB 3.43Å; N920-R924 PolarHBondContact O-N 3.5Å; N920-S942 PolarHBondContact ND2-OG 3.38Å
921	Y	89.8	Confident	87.5	Confident	132 Å²	132	69 Å²	69	52%	0.518	38%	0.376	S	S	.	.	H	α-helix	trans	-69.7	-36	173.8	179.9	-92.8	0	0	0	113.3	Q917 V918 I919 R924	Q917-Y921 WeakPolarHBondContact O-CB 3.42Å; Q917-Y921 PolarHBondContact O-N 3.12Å; V918-Y921 PolarHBondContact O-N 3.4Å; I919-Y921 VanDerWaalsContact C-N 3.32Å; I919-Y921 PolarHBondContact O-N 3.04Å; Y921-R924 WeakPolarHBondContact O-CD 3.12Å; Y921-R924 WeakPolarHBondContact O-CG 3.36Å; Y921-R924 PolarHBondContact O-NE 3.5Å; Y921-R924 PolarHBondContact OH-NH2 3.4Å
922	N	88.5	Confident	86.6	Confident	69 Å²	69	66.5 Å²	66.5	37%	0.369	36%	0.356	S	S	.	.	H	α-helix	trans	-68.9	-47.6	176.1	-71	-5.5	0	0	0	110.4	V918 I919 R924	V918-N922 PolarHBondContact O-N 2.97Å; V918-N922 PolarHBondContact O-OD1 3.33Å; I919-N922 PolarHBondContact O-N 2.65Å; N922-R924 PolarHBondContact O-N 2.85Å
923	C	87.7	Confident	86.2	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-84	-4.3	-174.6	-58	0	0	0	0	114.5	I919 A925 L926 V927 V945	I919-C923 PolarHBondContact O-N 3.44Å; I919-C923 PolarHBondContact O-SG 3.33Å; C923-A925 PolarHBondContact O-N 2.87Å; C923-L926 WeakPolarHBondContact O-CA 3.21Å; C923-L926 VanDerWaalsContact O-CB 3.32Å; C923-L926 WeakPolarHBondContact O-CB 3.24Å; C923-L926 PolarHBondContact O-N 3.39Å; C923-V927 PolarHBondContact O-N 3.18Å; C923-V945 HydrophobicContact CB-CG1 3.44Å; C923-V945 VanDerWaalsContact CB-CG1 3.44Å; C923-V945 HydrophobicContact CB-CG2 4.45Å
924	R	87.3	Confident	85.7	Confident	142 Å²	142	59.4 Å²	59.4	54%	0.536	32%	0.32	S	S	.	.	H	α-helix	trans	-52.1	-30.8	-179.4	70.7	-165.8	164.7	99.6	10	114.9	N920 Y921 N922 A928	N920-R924 WeakPolarHBondContact O-CB 3.43Å; N920-R924 PolarHBondContact O-N 3.5Å; Y921-R924 WeakPolarHBondContact O-CD 3.12Å; Y921-R924 WeakPolarHBondContact O-CG 3.36Å; Y921-R924 PolarHBondContact O-NE 3.5Å; Y921-R924 PolarHBondContact OH-NH2 3.4Å; N922-R924 PolarHBondContact O-N 2.85Å; R924-A928 WeakPolarHBondContact O-CB 3.21Å; R924-A928 PolarHBondContact O-N 3.44Å; R924-A928 VanDerWaalsContact O-N 3.12Å
925	A	85.8	Confident	84.9	Confident	57 Å²	57	63.3 Å²	63.3	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-70.2	-44.7	176.2	0	0	0	0	0	111	C923 A928 A929	C923-A925 PolarHBondContact O-N 2.87Å; A925-A928 PolarHBondContact O-N 2.89Å; A925-A929 VanDerWaalsContact O-CB 3.25Å; A925-A929 WeakPolarHBondContact O-CB 3.14Å; A925-A929 PolarHBondContact O-N 2.81Å
926	L	86.7	Confident	84.5	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-46.5	174.3	-169.4	79.4	0	0	0	111.5	C923 A928 A929 V930 L948 F971 I972 Q973 Y1020	C923-L926 WeakPolarHBondContact O-CA 3.21Å; C923-L926 VanDerWaalsContact O-CB 3.32Å; C923-L926 WeakPolarHBondContact O-CB 3.24Å; C923-L926 PolarHBondContact O-N 3.39Å; L926-A928 VanDerWaalsContact C-N 3.26Å; L926-A928 PolarHBondContact O-N 3.03Å; L926-A929 PolarHBondContact O-N 3.49Å; L926-V930 HydrophobicContact CD1-CG2 4.06Å; L926-V930 HydrophobicContact CG-CG2 3.98Å; L926-V930 WeakPolarHBondContact O-CB 3.32Å; L926-V930 VanDerWaalsContact O-CG2 3.23Å; L926-V930 WeakPolarHBondContact O-CG2 3.41Å; L926-V930 PolarHBondContact O-N 2.8Å; L926-L948 HydrophobicContact CD2-CD1 3.93Å; L926-F971 HydrophobicContact CD1-CB 3.94Å; L926-F971 HydrophobicContact CD2-CB 3.84Å; L926-F971 HydrophobicContact CD2-CG 4.36Å; L926-F971 HydrophobicContact CG-CB 4.34Å; L926-I972 VanDerWaalsContact CD1-O 3.22Å; L926-I972 WeakPolarHBondContact CD1-O 3.47Å; L926-Q973 HydrophobicContact CD1-CB 4.3Å; L926-Y1020 HydrophobicContact CD2-CD2 3.77Å; L926-Y1020 HydrophobicContact CD2-CE2 4.41Å; L926-Y1020 HydrophobicContact CD2-CG 4.38Å
927	V	86.5	Confident	84.3	Confident	34 Å²	34	61.5 Å²	61.5	21%	0.206	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-33.6	178.8	172.2	0	0	0	0	112.2	C923 F933 V941 V945	C923-V927 PolarHBondContact O-N 3.18Å; V927-F933 HydrophobicContact CG1-CB 4.25Å; V927-F933 HydrophobicContact CG2-CD2 4.48Å; V927-V941 HydrophobicContact CB-CG1 4.49Å; V927-V941 HydrophobicContact CG1-CG1 3.81Å; V927-V941 HydrophobicContact CG2-CG1 3.77Å; V927-V945 HydrophobicContact CG2-CG2 3.83Å
928	A	85	Confident	84.1	Confident	72 Å²	72	63 Å²	63	60%	0.595	34%	0.338	S	S	*	.	H	α-helix	trans	-80.7	-32.4	175.5	0	0	0	0	0	113.4	R924 A925 L926	R924-A928 WeakPolarHBondContact O-CB 3.21Å; R924-A928 PolarHBondContact O-N 3.44Å; R924-A928 VanDerWaalsContact O-N 3.12Å; A925-A928 PolarHBondContact O-N 2.89Å; L926-A928 VanDerWaalsContact C-N 3.26Å; L926-A928 PolarHBondContact O-N 3.03Å
929	A	84.7	Confident	83.8	Confident	52 Å²	52	65.8 Å²	65.8	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-83.8	-29	-176.9	0	0	0	0	0	113.7	A925 L926 P931	A925-A929 VanDerWaalsContact O-CB 3.25Å; A925-A929 WeakPolarHBondContact O-CB 3.14Å; A925-A929 PolarHBondContact O-N 2.81Å; L926-A929 PolarHBondContact O-N 3.49Å; A929-P931 VanDerWaalsContact O-CD 3.27Å; A929-P931 WeakPolarHBondContact O-CD 3.44Å
930	V	84.5	Confident	83.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.345	C	S	.	.			trans	-82.9	110.1	179	172.3	0	0	0	0	109.8	L926 F932 F933 F971 G993 Y995	L926-V930 HydrophobicContact CD1-CG2 4.06Å; L926-V930 HydrophobicContact CG-CG2 3.98Å; L926-V930 WeakPolarHBondContact O-CB 3.32Å; L926-V930 VanDerWaalsContact O-CG2 3.23Å; L926-V930 WeakPolarHBondContact O-CG2 3.41Å; L926-V930 PolarHBondContact O-N 2.8Å; V930-F932 HydrophobicContact CG1-CB 3.81Å; V930-F932 HydrophobicContact CG1-CD1 4.41Å; V930-F932 PolarHBondContact O-N 3.42Å; V930-F933 HydrophobicContact CB-CD2 3.67Å; V930-F933 HydrophobicContact CB-CE2 4.24Å; V930-F933 HydrophobicContact CB-CG 4.46Å; V930-F933 HydrophobicContact CG1-CD2 3.6Å; V930-F933 HydrophobicContact CG1-CE2 3.98Å; V930-F933 HydrophobicContact CG1-CG 4.16Å; V930-F933 HydrophobicContact CG2-CD2 4.21Å; V930-F933 HydrophobicContact CG2-CE2 4.36Å; V930-F933 PolarHBondContact O-N 3.46Å; V930-F971 HydrophobicContact CG2-CD1 4.35Å; V930-G993 WeakPolarHBondContact CA-O 3.29Å; V930-G993 VanDerWaalsContact CG2-O 3.25Å; V930-G993 WeakPolarHBondContact CG2-O 3.42Å; V930-Y995 HydrophobicContact CG1-CD1 4.14Å
931	P	77.3	Confident	83.7	Confident	86 Å²	86	63.3 Å²	63.3	56%	0.558	34%	0.338	S	S	*	.	H	α-helix	trans	-65.4	-16.8	-176	-21.2	34.5	0	0	0	113.8	A929 F933 T934 Y935	A929-P931 VanDerWaalsContact O-CD 3.27Å; A929-P931 WeakPolarHBondContact O-CD 3.44Å; P931-F933 VanDerWaalsContact C-N 3.35Å; P931-T934 PolarHBondContact O-OG1 2.85Å; P931-Y935 WeakPolarHBondContact O-CD2 3.34Å
932	F	72.8	Confident	83.5	Confident	20 Å²	20	58.4 Å²	58.4	9%	0.088	32%	0.323	C	S	.	.	H	α-helix	trans	-69.4	-28.8	173.5	166.6	-99.5	0	0	0	113	V930 F940 Y995 M1037 M1041	V930-F932 HydrophobicContact CG1-CB 3.81Å; V930-F932 HydrophobicContact CG1-CD1 4.41Å; V930-F932 PolarHBondContact O-N 3.42Å; F932-F940 AromaticContact CE1-CE1 3.8Å; F932-F940 HydrophobicContact CE1-CE1 3.8Å; F932-F940 AromaticContact CE1-CZ 3.79Å; F932-F940 HydrophobicContact CE1-CZ 3.79Å; F932-F940 AromaticContact CZ-CE1 3.98Å; F932-F940 HydrophobicContact CZ-CE1 3.98Å; F932-F940 AromaticContact CZ-CZ 3.69Å; F932-F940 HydrophobicContact CZ-CZ 3.69Å; F932-Y995 HydrophobicContact CB-CE1 3.95Å; F932-Y995 HydrophobicContact CG-CE1 4.47Å; F932-M1037 HydrophobicContact CD2-SD 3.9Å; F932-M1037 HydrophobicContact CE2-CG 3.55Å; F932-M1037 HydrophobicContact CE2-SD 3.24Å; F932-M1037 WeakPolarHBondContact CE2-SD 3.5Å; F932-M1037 HydrophobicContact CZ-CG 3.46Å; F932-M1037 VanDerWaalsContact CZ-CG 3.46Å; F932-M1037 HydrophobicContact CZ-SD 3.69Å; F932-M1041 HydrophobicContact CD2-CG 4.21Å; F932-M1041 HydrophobicContact CE1-CE 4.49Å; F932-M1041 HydrophobicContact CE1-SD 4.22Å; F932-M1041 HydrophobicContact CE2-CE 4.41Å; F932-M1041 HydrophobicContact CE2-CG 3.28Å; F932-M1041 HydrophobicContact CE2-SD 3.77Å; F932-M1041 HydrophobicContact CZ-CE 4.11Å; F932-M1041 HydrophobicContact CZ-CG 3.61Å; F932-M1041 HydrophobicContact CZ-SD 3.39Å; F932-M1041 WeakPolarHBondContact CZ-SD 3.38Å
933	F	80.7	Confident	83.4	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-89.9	-22.1	178.6	-66.8	-46.6	0	0	0	113.6	V927 V930 P931 Y935 A936 F940 V941 V944 F971	V927-F933 HydrophobicContact CG1-CB 4.25Å; V927-F933 HydrophobicContact CG2-CD2 4.48Å; V930-F933 HydrophobicContact CB-CD2 3.67Å; V930-F933 HydrophobicContact CB-CE2 4.24Å; V930-F933 HydrophobicContact CB-CG 4.46Å; V930-F933 HydrophobicContact CG1-CD2 3.6Å; V930-F933 HydrophobicContact CG1-CE2 3.98Å; V930-F933 HydrophobicContact CG1-CG 4.16Å; V930-F933 HydrophobicContact CG2-CD2 4.21Å; V930-F933 HydrophobicContact CG2-CE2 4.36Å; V930-F933 PolarHBondContact O-N 3.46Å; P931-F933 VanDerWaalsContact C-N 3.35Å; F933-Y935 VanDerWaalsContact C-N 3.33Å; F933-Y935 PolarHBondContact O-N 2.92Å; F933-A936 WeakPolarHBondContact O-CB 3.14Å; F933-A936 PolarHBondContact O-N 2.86Å; F933-F940 AromaticContact CD1-CE1 3.96Å; F933-F940 HydrophobicContact CD1-CE1 3.96Å; F933-F940 AromaticContact CE1-CE1 3.84Å; F933-F940 HydrophobicContact CE1-CE1 3.84Å; F933-F940 HydrophobicContact CE1-CZ 4.49Å; F933-V941 HydrophobicContact CB-CG2 4.16Å; F933-V941 HydrophobicContact CD1-CG2 4Å; F933-V941 HydrophobicContact CG-CG2 4.39Å; F933-V944 HydrophobicContact CE1-CB 4.38Å; F933-V944 HydrophobicContact CE1-CG1 4.08Å; F933-V944 HydrophobicContact CE1-CG2 4.5Å; F933-V944 HydrophobicContact CZ-CG1 3.87Å; F933-F971 AromaticContact CE2-CD1 3.98Å; F933-F971 HydrophobicContact CE2-CD1 3.98Å; F933-F971 AromaticContact CE2-CE1 3.74Å; F933-F971 HydrophobicContact CE2-CE1 3.74Å; F933-F971 HydrophobicContact CE2-CZ 4.39Å; F933-F971 HydrophobicContact CZ-CD1 4.21Å; F933-F971 AromaticContact CZ-CE1 3.53Å; F933-F971 HydrophobicContact CZ-CE1 3.53Å; F933-F971 AromaticContact CZ-CZ 3.8Å; F933-F971 HydrophobicContact CZ-CZ 3.8Å
934	T	77.3	Confident	83.5	Confident	78 Å²	78	57.6 Å²	57.6	48%	0.479	32%	0.317	S	S	.	.	H	α-helix	trans	-69.5	-27.7	-176.7	56.7	0	0	0	0	113.8	P931	P931-T934 PolarHBondContact O-OG1 2.85Å
935	Y	75.3	Confident	83.6	Confident	172 Å²	172	51 Å²	51	68%	0.675	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	3.1	174.1	-55.2	-78.9	0	0	0	113.5	P931 F933	P931-Y935 WeakPolarHBondContact O-CD2 3.34Å; F933-Y935 VanDerWaalsContact C-N 3.33Å; F933-Y935 PolarHBondContact O-N 2.92Å
936	A	80.5	Confident	83.6	Confident	19 Å²	19	51.3 Å²	51.3	16%	0.157	29%	0.289	C	S	.	.	S	Bend	trans	-81.9	165.2	-177.1	0	0	0	0	0	113.1	F933 F940 V941 M1037	F933-A936 WeakPolarHBondContact O-CB 3.14Å; F933-A936 PolarHBondContact O-N 2.86Å; A936-F940 HydrophobicContact CB-CD1 3.79Å; A936-F940 HydrophobicContact CB-CE1 4.22Å; A936-V941 HydrophobicContact CB-CG2 3.87Å; A936-M1037 HydrophobicContact CB-CE 3.48Å; A936-M1037 VanDerWaalsContact CB-CE 3.48Å
937	D	83.4	Confident	83.7	Confident	96 Å²	96	55.5 Å²	55.5	51%	0.513	31%	0.307	S	S	.	.			trans	-72.7	144.3	171	-147.7	-23.2	0	0	0	110.5	D939 F940 V941	D937-D939 VanDerWaalsContact C-N 3.28Å; D937-D939 PolarHBondContact O-N 2.91Å; D937-F940 HydrophobicContact CB-CB 4.29Å; D937-F940 WeakPolarHBondContact O-CB 3.28Å; D937-F940 PolarHBondContact O-N 3.37Å; D937-V941 WeakPolarHBondContact O-CG2 3.4Å; D937-V941 PolarHBondContact O-N 3.47Å
938	Q	84.4	Confident	84	Confident	158 Å²	158	55 Å²	55	74%	0.738	30%	0.303	S	S	*	.	H	α-helix	trans	-69.8	-29.9	-174.9	-66.4	-171.6	-2.6	0	0	112.1	V941 S942	Q938-V941 PolarHBondContact O-N 3.31Å; Q938-S942 PolarHBondContact O-N 3.21Å; Q938-S942 PolarHBondContact O-OG 2.78Å
939	D	85.5	Confident	84.3	Confident	111 Å²	111	56.9 Å²	56.9	59%	0.594	30%	0.298	S	S	*	.	H	α-helix	trans	-68.6	-42.2	175.1	-62.3	-17.9	0	0	0	110.7	D937 S942 E943 Y1034	D937-D939 VanDerWaalsContact C-N 3.28Å; D937-D939 PolarHBondContact O-N 2.91Å; D939-S942 PolarHBondContact O-N 3.3Å; D939-E943 WeakPolarHBondContact O-CB 3.42Å; D939-E943 PolarHBondContact O-N 2.84Å; D939-Y1034 WeakPolarHBondContact CB-OH 3.38Å
940	F	87.5	Confident	84.7	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-60.1	-46.4	171.4	167	-94.1	0	0	0	111.8	F932 F933 A936 D937 S942 E943 V944 V1030 L1031 Y1034 M1037	F932-F940 AromaticContact CE1-CE1 3.8Å; F932-F940 HydrophobicContact CE1-CE1 3.8Å; F932-F940 AromaticContact CE1-CZ 3.79Å; F932-F940 HydrophobicContact CE1-CZ 3.79Å; F932-F940 AromaticContact CZ-CE1 3.98Å; F932-F940 HydrophobicContact CZ-CE1 3.98Å; F932-F940 AromaticContact CZ-CZ 3.69Å; F932-F940 HydrophobicContact CZ-CZ 3.69Å; F933-F940 AromaticContact CD1-CE1 3.96Å; F933-F940 HydrophobicContact CD1-CE1 3.96Å; F933-F940 AromaticContact CE1-CE1 3.84Å; F933-F940 HydrophobicContact CE1-CE1 3.84Å; F933-F940 HydrophobicContact CE1-CZ 4.49Å; A936-F940 HydrophobicContact CB-CD1 3.79Å; A936-F940 HydrophobicContact CB-CE1 4.22Å; D937-F940 HydrophobicContact CB-CB 4.29Å; D937-F940 WeakPolarHBondContact O-CB 3.28Å; D937-F940 PolarHBondContact O-N 3.37Å; F940-S942 VanDerWaalsContact C-N 3.33Å; F940-S942 PolarHBondContact O-N 2.98Å; F940-E943 PolarHBondContact O-N 2.85Å; F940-V944 HydrophobicContact CD1-CG2 4.39Å; F940-V944 HydrophobicContact CD2-CG2 4.17Å; F940-V944 HydrophobicContact CE1-CG2 3.95Å; F940-V944 HydrophobicContact CE2-CG2 3.69Å; F940-V944 HydrophobicContact CZ-CG2 3.56Å; F940-V944 WeakPolarHBondContact O-CG2 3.15Å; F940-V944 PolarHBondContact O-N 3.48Å; F940-V1030 HydrophobicContact CD2-CG1 3.49Å; F940-V1030 VanDerWaalsContact CD2-CG1 3.49Å; F940-V1030 HydrophobicContact CE2-CG1 3.55Å; F940-L1031 HydrophobicContact CE2-CD2 4.39Å; F940-Y1034 HydrophobicContact CB-CD1 3.93Å; F940-Y1034 HydrophobicContact CB-CD2 3.97Å; F940-Y1034 HydrophobicContact CB-CE1 3.88Å; F940-Y1034 HydrophobicContact CB-CE2 3.92Å; F940-Y1034 HydrophobicContact CB-CG 3.97Å; F940-Y1034 AromaticContact CD2-CD2 3.59Å; F940-Y1034 HydrophobicContact CD2-CD2 3.59Å; F940-Y1034 HydrophobicContact CD2-CE2 4.24Å; F940-Y1034 AromaticContact CD2-CG 3.76Å; F940-Y1034 HydrophobicContact CD2-CG 3.76Å; F940-Y1034 HydrophobicContact CG-CD2 4.27Å; F940-Y1034 HydrophobicContact CG-CG 4.28Å; F940-Y1034 PolarHBondContact N-OH 3.46Å; F940-M1037 HydrophobicContact CD1-CE 4.39Å; F940-M1037 HydrophobicContact CD1-CG 4.47Å; F940-M1037 HydrophobicContact CD2-CG 4.42Å; F940-M1037 HydrophobicContact CE1-CE 4.41Å; F940-M1037 HydrophobicContact CE1-CG 3.88Å; F940-M1037 HydrophobicContact CE2-CB 4.25Å; F940-M1037 HydrophobicContact CE2-CG 3.84Å; F940-M1037 HydrophobicContact CZ-CB 4.44Å; F940-M1037 HydrophobicContact CZ-CG 3.55Å
941	V	87.5	Confident	85.2	Confident	15 Å²	15	59.4 Å²	59.4	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-45	179	173.4	0	0	0	0	110.4	V927 F933 A936 D937 Q938 E943 V944 V945	V927-V941 HydrophobicContact CB-CG1 4.49Å; V927-V941 HydrophobicContact CG1-CG1 3.81Å; V927-V941 HydrophobicContact CG2-CG1 3.77Å; F933-V941 HydrophobicContact CB-CG2 4.16Å; F933-V941 HydrophobicContact CD1-CG2 4Å; F933-V941 HydrophobicContact CG-CG2 4.39Å; A936-V941 HydrophobicContact CB-CG2 3.87Å; D937-V941 WeakPolarHBondContact O-CG2 3.4Å; D937-V941 PolarHBondContact O-N 3.47Å; Q938-V941 PolarHBondContact O-N 3.31Å; V941-E943 PolarHBondContact O-N 2.93Å; V941-V944 PolarHBondContact O-N 2.96Å; V941-V945 HydrophobicContact CG1-CG2 3.97Å; V941-V945 WeakPolarHBondContact O-CB 2.97Å; V941-V945 WeakPolarHBondContact O-CG2 3.4Å; V941-V945 PolarHBondContact O-N 3.45Å
942	S	85	Confident	86.1	Confident	29 Å²	29	55.8 Å²	55.8	20%	0.203	28%	0.276	C	S	.	.	H	α-helix	trans	-66.1	-37.7	178.5	-59.1	0	0	0	0	112.6	N920 Q938 D939 F940 T946	N920-S942 PolarHBondContact ND2-OG 3.38Å; Q938-S942 PolarHBondContact O-N 3.21Å; Q938-S942 PolarHBondContact O-OG 2.78Å; D939-S942 PolarHBondContact O-N 3.3Å; F940-S942 VanDerWaalsContact C-N 3.33Å; F940-S942 PolarHBondContact O-N 2.98Å; S942-T946 WeakPolarHBondContact O-CB 3.47Å; S942-T946 WeakPolarHBondContact O-CG2 3.3Å; S942-T946 PolarHBondContact O-N 3.19Å; S942-T946 VanDerWaalsContact O-N 3.1Å; S942-T946 PolarHBondContact O-OG1 2.97Å
943	E	86.8	Confident	87.2	Confident	52 Å²	52	56.5 Å²	56.5	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-41.9	175.7	-156.7	-173.7	158.9	0	0	112	D939 F940 V941 T946 K947 V1030 N1033 Y1034	D939-E943 WeakPolarHBondContact O-CB 3.42Å; D939-E943 PolarHBondContact O-N 2.84Å; F940-E943 PolarHBondContact O-N 2.85Å; V941-E943 PolarHBondContact O-N 2.93Å; E943-T946 PolarHBondContact O-OG1 3.38Å; E943-K947 VanDerWaalsContact O-CG 3.29Å; E943-K947 WeakPolarHBondContact O-CG 3.3Å; E943-V1030 HydrophobicContact CB-CG1 4.43Å; E943-V1030 HydrophobicContact CB-CG2 4.4Å; E943-V1030 HydrophobicContact CG-CG2 3.89Å; E943-N1033 PolarHBondContact OE1-ND2 3.26Å; E943-N1033 VanDerWaalsContact OE1-ND2 3.12Å; E943-N1033 PolarHBondContact OE2-ND2 3.46Å; E943-N1033 VanDerWaalsContact OE2-ND2 3.13Å; E943-Y1034 WeakPolarHBondContact OE2-CE2 3.49Å
944	V	89.3	Confident	88	Confident	6 Å²	6	56.8 Å²	56.8	4%	0.036	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-50.2	173.5	174.2	0	0	0	0	111.2	F933 F940 V941 T946 K947 L948 L1022 V1030	F933-V944 HydrophobicContact CE1-CB 4.38Å; F933-V944 HydrophobicContact CE1-CG1 4.08Å; F933-V944 HydrophobicContact CE1-CG2 4.5Å; F933-V944 HydrophobicContact CZ-CG1 3.87Å; F940-V944 HydrophobicContact CD1-CG2 4.39Å; F940-V944 HydrophobicContact CD2-CG2 4.17Å; F940-V944 HydrophobicContact CE1-CG2 3.95Å; F940-V944 HydrophobicContact CE2-CG2 3.69Å; F940-V944 HydrophobicContact CZ-CG2 3.56Å; F940-V944 WeakPolarHBondContact O-CG2 3.15Å; F940-V944 PolarHBondContact O-N 3.48Å; V941-V944 PolarHBondContact O-N 2.96Å; V944-T946 VanDerWaalsContact C-N 3.29Å; V944-T946 PolarHBondContact O-N 3.32Å; V944-K947 WeakPolarHBondContact O-CA 3.19Å; V944-K947 WeakPolarHBondContact O-CB 3.11Å; V944-K947 PolarHBondContact O-N 3.32Å; V944-L948 HydrophobicContact CG1-CD2 4.25Å; V944-L948 HydrophobicContact CG1-CG 4.49Å; V944-L948 PolarHBondContact O-N 3.04Å; V944-L1022 HydrophobicContact CG1-CD2 4.1Å; V944-V1030 HydrophobicContact CG2-CG1 3.88Å
945	V	88.5	Confident	88.9	Confident	2 Å²	2	56 Å²	56	1%	0.012	28%	0.277	C	S	.	.	H	α-helix	trans	-67.4	-29.9	-170	174.1	0	0	0	0	111.8	I919 C923 V927 V941 K947 L948	I919-V945 HydrophobicContact CG2-CG1 3.66Å; I919-V945 WeakPolarHBondContact CG2-O 3.46Å; C923-V945 HydrophobicContact CB-CG1 3.44Å; C923-V945 VanDerWaalsContact CB-CG1 3.44Å; C923-V945 HydrophobicContact CB-CG2 4.45Å; V927-V945 HydrophobicContact CG2-CG2 3.83Å; V941-V945 HydrophobicContact CG1-CG2 3.97Å; V941-V945 WeakPolarHBondContact O-CB 2.97Å; V941-V945 WeakPolarHBondContact O-CG2 3.4Å; V941-V945 PolarHBondContact O-N 3.45Å; V945-K947 PolarHBondContact O-N 2.84Å; V945-L948 HydrophobicContact CB-CD1 4.46Å; V945-L948 HydrophobicContact CG2-CD1 4.19Å; V945-L948 PolarHBondContact O-N 3Å
946	T	87	Confident	89.7	Confident	65 Å²	65	50 Å²	50	40%	0.399	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-7.9	171.3	53.6	0	0	0	0	114.9	I919 S942 E943 V944	I919-T946 HydrophobicContact CG2-CG2 4.15Å; S942-T946 WeakPolarHBondContact O-CB 3.47Å; S942-T946 WeakPolarHBondContact O-CG2 3.3Å; S942-T946 PolarHBondContact O-N 3.19Å; S942-T946 VanDerWaalsContact O-N 3.1Å; S942-T946 PolarHBondContact O-OG1 2.97Å; E943-T946 PolarHBondContact O-OG1 3.38Å; V944-T946 VanDerWaalsContact C-N 3.29Å; V944-T946 PolarHBondContact O-N 3.32Å
947	K	89.2	Confident	90.5	Very high	89 Å²	89	50.8 Å²	50.8	39%	0.387	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-7.7	175.3	-57.8	-70.7	-178.1	169.2	0	113.7	E943 V944 V945 L1022	E943-K947 VanDerWaalsContact O-CG 3.29Å; E943-K947 WeakPolarHBondContact O-CG 3.3Å; V944-K947 WeakPolarHBondContact O-CA 3.19Å; V944-K947 WeakPolarHBondContact O-CB 3.11Å; V944-K947 PolarHBondContact O-N 3.32Å; V945-K947 PolarHBondContact O-N 2.84Å; K947-L1022 HydrophobicContact CB-CD1 3.6Å
948	L	91.7	Very high	91	Very high	23 Å²	23	50.7 Å²	50.7	12%	0.12	27%	0.267	C	S	.	.			trans	-71.1	140.6	-179.5	-66.5	-177.9	0	0	0	112.2	L926 V944 V945 F971 Y1020 S1021 L1022	L926-L948 HydrophobicContact CD2-CD1 3.93Å; V944-L948 HydrophobicContact CG1-CD2 4.25Å; V944-L948 HydrophobicContact CG1-CG 4.49Å; V944-L948 PolarHBondContact O-N 3.04Å; V945-L948 HydrophobicContact CB-CD1 4.46Å; V945-L948 HydrophobicContact CG2-CD1 4.19Å; V945-L948 PolarHBondContact O-N 3Å; L948-F971 HydrophobicContact CD2-CD2 3.85Å; L948-F971 HydrophobicContact CD2-CE2 3.82Å; L948-Y1020 HydrophobicContact CB-CD1 3.78Å; L948-Y1020 HydrophobicContact CB-CG 4.19Å; L948-Y1020 HydrophobicContact CD1-CD1 4.41Å; L948-Y1020 HydrophobicContact CD1-CG 4.16Å; L948-S1021 WeakPolarHBondContact CA-O 3Å; L948-L1022 HydrophobicContact CD2-CB 3.98Å; L948-L1022 HydrophobicContact CD2-CD1 4.35Å
949	K	92.3	Very high	91.6	Very high	111 Å²	111	43.8 Å²	43.8	48%	0.483	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.7	177.1	-66.8	169.7	179.8	170.8	0	110.7	Y1020 S1021 D1023	K949-Y1020 CarbonylContact O-C 3.46Å; K949-Y1020 VanDerWaalsContact O-CA 3.31Å; K949-Y1020 WeakPolarHBondContact O-CA 3.25Å; K949-S1021 PolarHBondContact N-O 3.48Å; K949-S1021 PolarHBondContact O-N 2.87Å; K949-S1021 PolarHBondContact O-OG 3.02Å; K949-D1023 WeakPolarHBondContact CE-OD2 3.25Å; K949-D1023 IonicContact NZ-OD2 3.45Å; K949-D1023 PolarHBondContact NZ-OD2 3.36Å
950	F	92.6	Very high	92.1	Very high	59 Å²	59	38.9 Å²	38.9	26%	0.259	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.8	-176.5	-176	-99.6	0	0	0	112.8	V952 N1018 Y1020	F950-V952 HydrophobicContact CD1-CG2 4.3Å; F950-V952 HydrophobicContact CE1-CG2 3.47Å; F950-V952 VanDerWaalsContact CE1-CG2 3.47Å; F950-V952 HydrophobicContact CZ-CG2 3.82Å; F950-N1018 HydrophobicContact CE2-CB 3.94Å; F950-N1018 HydrophobicContact CZ-CB 3.97Å; F950-Y1020 HydrophobicContact CB-CD1 4.23Å; F950-Y1020 HydrophobicContact CB-CE1 3.89Å; F950-Y1020 HydrophobicContact CD2-CD1 4.43Å; F950-Y1020 AromaticContact CD2-CE1 3.92Å; F950-Y1020 HydrophobicContact CD2-CE1 3.92Å; F950-Y1020 HydrophobicContact CD2-CE2 4.26Å; F950-Y1020 AromaticContact CD2-CZ 3.8Å; F950-Y1020 HydrophobicContact CG-CE1 4.39Å
951	E	94.4	Very high	92.4	Very high	47 Å²	47	44.9 Å²	44.9	22%	0.22	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	154.3	179.5	-68.4	-178.4	-152.8	0	0	111.3	F953 K968 L1019 S1021	E951-F953 HydrophobicContact CB-CE2 3.9Å; E951-F953 WeakPolarHBondContact OE2-CZ 3.34Å; E951-K968 IonicContact OE1-NZ 2.63Å; E951-K968 PolarHBondContact OE1-NZ 3.41Å; E951-K968 IonicContact OE2-NZ 3.96Å; E951-K968 PolarHBondContact OE2-NZ 3.15Å; E951-L1019 PolarHBondContact N-O 3.2Å; E951-L1019 PolarHBondContact O-N 3.43Å; E951-L1019 VanDerWaalsContact O-O 3.06Å; E951-S1021 VanDerWaalsContact OE1-CB 3.22Å; E951-S1021 WeakPolarHBondContact OE1-CB 3.33Å; E951-S1021 PolarHBondContact OE1-OG 3.03Å
952	V	95.7	Very high	92.5	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.055	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	133.9	-177.9	177.6	0	0	0	0	109.1	Y891 F950 S1017 N1018	Y891-V952 HydrophobicContact CE2-CB 4.37Å; Y891-V952 WeakPolarHBondContact CE2-O 3.46Å; F950-V952 HydrophobicContact CD1-CG2 4.3Å; F950-V952 HydrophobicContact CE1-CG2 3.47Å; F950-V952 VanDerWaalsContact CE1-CG2 3.47Å; F950-V952 HydrophobicContact CZ-CG2 3.82Å; V952-S1017 WeakPolarHBondContact CA-O 3.23Å; V952-N1018 WeakPolarHBondContact CG2-OD1 3.27Å
953	F	96.9	Very high	92.7	Very high	35 Å²	35	46.4 Å²	46.4	15%	0.154	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	147.1	178.6	-66	-92.9	0	0	0	111.1	E951 D957 I959 Y970 A1013 Y1016 S1017 L1019	E951-F953 HydrophobicContact CB-CE2 3.9Å; E951-F953 WeakPolarHBondContact OE2-CZ 3.34Å; F953-D957 HydrophobicContact CB-CB 4.45Å; F953-D957 HydrophobicContact CD1-CB 4.43Å; F953-I959 HydrophobicContact CB-CG1 4.17Å; F953-I959 HydrophobicContact CD1-CB 4.48Å; F953-I959 HydrophobicContact CD1-CG1 3.77Å; F953-I959 HydrophobicContact CD2-CG1 4.22Å; F953-I959 HydrophobicContact CE1-CB 4.45Å; F953-I959 HydrophobicContact CE1-CG1 4.21Å; F953-I959 HydrophobicContact CE1-CG2 4.17Å; F953-I959 HydrophobicContact CE2-CG2 4.19Å; F953-I959 HydrophobicContact CG-CD1 4.5Å; F953-I959 HydrophobicContact CG-CG1 3.78Å; F953-I959 HydrophobicContact CZ-CG2 3.99Å; F953-Y970 HydrophobicContact CE2-CE1 4.13Å; F953-Y970 HydrophobicContact CZ-CE1 4.11Å; F953-A1013 HydrophobicContact CB-CB 4.39Å; F953-Y1016 WeakPolarHBondContact O-CA 3.45Å; F953-S1017 PolarHBondContact N-O 3.46Å; F953-S1017 PolarHBondContact O-N 3.07Å; F953-L1019 HydrophobicContact CD2-CD1 3.63Å; F953-L1019 HydrophobicContact CD2-CG 4.13Å; F953-L1019 HydrophobicContact CE2-CD1 3.79Å; F953-L1019 HydrophobicContact CE2-CG 4.45Å
954	Q	96.4	Very high	93	Very high	13 Å²	13	46.4 Å²	46.4	6%	0.061	25%	0.251	C	S	.	.			trans	-88.2	154.4	179.3	-52.7	-168	-66.2	0	0	110.9	R887 G956 D957 A1013 Y1016	R887-Q954 PolarHBondContact O-NE2 3.31Å; Q954-G956 PolarHBondContact O-N 3.49Å; Q954-D957 VanDerWaalsContact CB-OD2 3.27Å; Q954-D957 WeakPolarHBondContact CB-OD2 3.47Å; Q954-D957 PolarHBondContact N-OD2 2.92Å; Q954-D957 WeakPolarHBondContact O-CB 3.45Å; Q954-D957 PolarHBondContact O-N 2.79Å; Q954-A1013 WeakPolarHBondContact O-CB 3.31Å; Q954-Y1016 HydrophobicContact CB-CE1 4.28Å; Q954-Y1016 HydrophobicContact CG-CE1 4.04Å
955	P	96.4	Very high	93.1	Very high	61 Å²	61	51.9 Å²	51.9	40%	0.396	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	129.3	171	23.9	-35.3	0	0	0	110.9	V1014 Y1016	P955-V1014 VanDerWaalsContact CB-O 3.26Å; P955-V1014 WeakPolarHBondContact CB-O 3.22Å; P955-Y1016 HydrophobicContact CG-CD2 4.14Å; P955-Y1016 HydrophobicContact CG-CE2 3.96Å
956	G	93.7	Very high	93.1	Very high	45 Å²	45	51.9 Å²	51.9	46%	0.464	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-11.6	-175.1	0	0	0	0	0	115.6	Q954 A1013	Q954-G956 PolarHBondContact O-N 3.49Å; G956-A1013 PolarHBondContact N-O 3.26Å
957	D	95.8	Very high	93.3	Very high	36 Å²	36	53.8 Å²	53.8	19%	0.193	29%	0.287	C	S	.	.			trans	-73	139.3	-178.6	-78.9	-32.5	0	0	0	113.5	R887 F953 Q954 I959 K1012 A1013	R887-D957 IonicContact CZ-OD1 2.64Å; R887-D957 IonicContact NH1-OD1 3.62Å; R887-D957 PolarHBondContact NH1-OD1 3.49Å; R887-D957 VanDerWaalsContact NH2-CG 3.26Å; R887-D957 IonicContact NH2-OD1 3.02Å; R887-D957 PolarHBondContact NH2-OD1 3.17Å; R887-D957 IonicContact NH2-OD2 2.73Å; R887-D957 PolarHBondContact NH2-OD2 3.22Å; R887-D957 VanDerWaalsContact NH2-OD2 3.12Å; F953-D957 HydrophobicContact CB-CB 4.45Å; F953-D957 HydrophobicContact CD1-CB 4.43Å; Q954-D957 VanDerWaalsContact CB-OD2 3.27Å; Q954-D957 WeakPolarHBondContact CB-OD2 3.47Å; Q954-D957 PolarHBondContact N-OD2 2.92Å; Q954-D957 WeakPolarHBondContact O-CB 3.45Å; Q954-D957 PolarHBondContact O-N 2.79Å; D957-I959 PolarHBondContact O-N 3.43Å; D957-K1012 CarbonylContact O-C 3.54Å; D957-K1012 WeakPolarHBondContact O-CA 3.22Å; D957-A1013 PolarHBondContact O-N 3.49Å
958	L	95.2	Very high	93.6	Very high	94 Å²	94	52 Å²	52	49%	0.492	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	92.8	177.7	-171.4	68	0	0	0	110	I960 K961 V1011 K1012	L958-I960 VanDerWaalsContact C-N 3.32Å; L958-I960 VanDerWaalsContact CD1-O 3.26Å; L958-I960 WeakPolarHBondContact CD1-O 3.37Å; L958-I960 WeakPolarHBondContact CG-O 3.45Å; L958-K961 HydrophobicContact CD2-CB 3.71Å; L958-K961 HydrophobicContact CD2-CD 4.43Å; L958-K961 HydrophobicContact CD2-CG 3.97Å; L958-K961 HydrophobicContact CG-CB 4.34Å; L958-V1011 CarbonylContact C-O 3.54Å; L958-K1012 HydrophobicContact CD1-CB 4.44Å
959	I	96	Very high	93.7	Very high	14 Å²	14	50.9 Å²	50.9	7%	0.072	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	-34.7	-177	-55.1	154.2	0	0	0	111.3	F953 D957 Y970 V977 F996 V1011 A1013 L1019	F953-I959 HydrophobicContact CB-CG1 4.17Å; F953-I959 HydrophobicContact CD1-CB 4.48Å; F953-I959 HydrophobicContact CD1-CG1 3.77Å; F953-I959 HydrophobicContact CD2-CG1 4.22Å; F953-I959 HydrophobicContact CE1-CB 4.45Å; F953-I959 HydrophobicContact CE1-CG1 4.21Å; F953-I959 HydrophobicContact CE1-CG2 4.17Å; F953-I959 HydrophobicContact CE2-CG2 4.19Å; F953-I959 HydrophobicContact CG-CD1 4.5Å; F953-I959 HydrophobicContact CG-CG1 3.78Å; F953-I959 HydrophobicContact CZ-CG2 3.99Å; D957-I959 PolarHBondContact O-N 3.43Å; I959-Y970 HydrophobicContact CG2-CD2 3.93Å; I959-Y970 HydrophobicContact CG2-CE1 4.22Å; I959-Y970 HydrophobicContact CG2-CE2 3.54Å; I959-Y970 HydrophobicContact CG2-CG 4.39Å; I959-V977 HydrophobicContact CD1-CB 4.27Å; I959-V977 HydrophobicContact CD1-CG1 3.56Å; I959-F996 HydrophobicContact CD1-CZ 4.2Å; I959-F996 HydrophobicContact CG2-CE2 3.92Å; I959-F996 HydrophobicContact CG2-CZ 3.95Å; I959-V1011 HydrophobicContact CD1-CG1 4.47Å; I959-V1011 PolarHBondContact N-O 3.4Å; I959-A1013 HydrophobicContact CD1-CB 4.03Å; I959-L1019 HydrophobicContact CD1-CD1 4.04Å; I959-L1019 HydrophobicContact CG2-CD1 4.09Å
960	I	95.7	Very high	93.8	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.1	172.7	-65.9	-179	0	0	0	108.6	L958 Y970 F996 R1007 S1010 V1011	L958-I960 VanDerWaalsContact C-N 3.32Å; L958-I960 VanDerWaalsContact CD1-O 3.26Å; L958-I960 WeakPolarHBondContact CD1-O 3.37Å; L958-I960 WeakPolarHBondContact CG-O 3.45Å; I960-Y970 HydrophobicContact CD1-CD2 4.28Å; I960-Y970 HydrophobicContact CD1-CE2 4.29Å; I960-Y970 HydrophobicContact CG1-CD2 4.46Å; I960-Y970 HydrophobicContact CG1-CE2 4.04Å; I960-F996 HydrophobicContact CD1-CD2 3.63Å; I960-F996 HydrophobicContact CD1-CE2 3.81Å; I960-F996 HydrophobicContact CG1-CD2 4.5Å; I960-F996 HydrophobicContact CG1-CE2 4.22Å; I960-R1007 HydrophobicContact CG2-CB 3.88Å; I960-R1007 HydrophobicContact CG2-CG 3.64Å; I960-S1010 CarbonylContact O-C 3.59Å; I960-S1010 WeakPolarHBondContact O-CA 3.4Å; I960-V1011 HydrophobicContact CB-CB 4.01Å; I960-V1011 HydrophobicContact CB-CG2 4.09Å; I960-V1011 HydrophobicContact CD1-CG2 4.24Å; I960-V1011 HydrophobicContact CG1-CB 4.49Å; I960-V1011 PolarHBondContact N-O 3.13Å; I960-V1011 VanDerWaalsContact N-O 3.16Å; I960-V1011 PolarHBondContact O-N 2.94Å
961	K	93.4	Very high	93.9	Very high	130 Å²	130	43.5 Å²	43.5	57%	0.565	24%	0.241	S	C	*	.			trans	-102.1	133.3	167.6	-176.2	-178.6	176.2	-176	0	109.8	L958 T964 R1007	L958-K961 HydrophobicContact CD2-CB 3.71Å; L958-K961 HydrophobicContact CD2-CD 4.43Å; L958-K961 HydrophobicContact CD2-CG 3.97Å; L958-K961 HydrophobicContact CG-CB 4.34Å; K961-T964 HydrophobicContact CB-CG2 3.83Å; K961-T964 HydrophobicContact CD-CG2 4.18Å; K961-T964 HydrophobicContact CG-CG2 4.13Å; K961-T964 PolarHBondContact O-OG1 3.26Å; K961-R1007 WeakPolarHBondContact O-CB 3.33Å
962	E	91	Very high	93.9	Very high	42 Å²	42	41.3 Å²	41.3	20%	0.196	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	151.3	173.8	-159.2	-170.9	137.6	0	0	112.1	T964 K982 R1007 S1010	E962-T964 PolarHBondContact O-N 3.44Å; E962-K982 WeakPolarHBondContact OE1-CE 3.14Å; E962-K982 WeakPolarHBondContact OE1-CG 3.12Å; E962-K982 VanDerWaalsContact OE2-CG 3.29Å; E962-K982 WeakPolarHBondContact OE2-CG 3.31Å; E962-K982 PolarHBondContact OE2-N 2.97Å; E962-R1007 VanDerWaalsContact CG-O 3.28Å; E962-R1007 WeakPolarHBondContact CG-O 3.27Å; E962-S1010 WeakPolarHBondContact CB-OG 3.42Å; E962-S1010 PolarHBondContact N-OG 2.97Å
963	G	89.2	Confident	93.7	Very high	33 Å²	33	43.7 Å²	43.7	34%	0.34	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	-12.1	177.2	0	0	0	0	0	115.1	R1006 R1007	G963-R1006 VanDerWaalsContact O-CD 3.25Å; G963-R1006 WeakPolarHBondContact O-CD 3.49Å; G963-R1006 WeakPolarHBondContact O-CG 3.48Å; G963-R1006 PolarHBondContact O-NH1 3.16Å; G963-R1007 PolarHBondContact N-O 3.39Å
964	T	92.9	Very high	93.5	Very high	53 Å²	53	47.1 Å²	47.1	33%	0.325	26%	0.258	S	S	.	.	S	Bend	trans	-74	165.7	173.4	65.4	0	0	0	0	112.1	K961 E962 R1006 R1007	K961-T964 HydrophobicContact CB-CG2 3.83Å; K961-T964 HydrophobicContact CD-CG2 4.18Å; K961-T964 HydrophobicContact CG-CG2 4.13Å; K961-T964 PolarHBondContact O-OG1 3.26Å; E962-T964 PolarHBondContact O-N 3.44Å; T964-R1006 CarbonylContact O-C 3.35Å; T964-R1006 VanDerWaalsContact O-CA 3.31Å; T964-R1006 WeakPolarHBondContact O-CA 3.11Å; T964-R1006 WeakPolarHBondContact O-CB 3.34Å; T964-R1007 WeakPolarHBondContact O-CG 3.22Å; T964-R1007 PolarHBondContact O-N 2.85Å; T964-R1007 WeakPolarHBondContact OG1-CG 3.29Å
965	I	91.5	Very high	93.4	Very high	120 Å²	120	46.8 Å²	46.8	62%	0.615	26%	0.257	S	S	*	.			trans	-89.2	137.4	172	-59	174.4	0	0	0	108.2	R1006	I965-R1006 HydrophobicContact CG1-CG 4.41Å
966	G	88.1	Confident	93.4	Very high	2 Å²	2	47.4 Å²	47.4	2%	0.021	26%	0.256	C	S	.	.			trans	-115.5	111.8	-172.5	0	0	0	0	0	113.5	T1000	G966-T1000 WeakPolarHBondContact O-CG2 3.45Å
967	N	91.8	Very high	93.5	Very high	105 Å²	105	45.2 Å²	45.2	56%	0.561	23%	0.234	S	C	*	.			trans	-100	3.5	-177.2	-63.7	2.1	0	0	0	114	R1024	N967-R1024 VanDerWaalsContact O-CB 3.29Å; N967-R1024 WeakPolarHBondContact O-CB 3.3Å; N967-R1024 PolarHBondContact O-N 2.89Å
968	K	94.4	Very high	93.5	Very high	52 Å²	52	45 Å²	45	23%	0.226	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	157.5	175.9	49	167.6	161.7	170.1	0	112.6	E951 Y970 R1007 L1022	E951-K968 IonicContact OE1-NZ 2.63Å; E951-K968 PolarHBondContact OE1-NZ 3.41Å; E951-K968 IonicContact OE2-NZ 3.96Å; E951-K968 PolarHBondContact OE2-NZ 3.15Å; K968-Y970 HydrophobicContact CD-CE1 3.9Å; K968-Y970 WeakPolarHBondContact CE-OH 3.17Å; K968-Y970 PolarHBondContact NZ-OH 2.88Å; K968-R1007 PolarHBondContact O-NH1 3.22Å; K968-R1007 PolarHBondContact O-NH2 3.06Å; K968-L1022 CarbonylContact C-O 3.55Å; K968-L1022 WeakPolarHBondContact CA-O 3.33Å; K968-L1022 VanDerWaalsContact CB-O 3.24Å; K968-L1022 WeakPolarHBondContact CB-O 3.41Å
969	M	93.4	Very high	93.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	168.7	164.3	65.6	175.3	-67.2	0	0	110.4	F971 Y995 E998 L1001 S1021 L1022 F1027 M1041	M969-F971 HydrophobicContact CE-CD1 4.45Å; M969-F971 HydrophobicContact CE-CD2 4.36Å; M969-F971 HydrophobicContact CE-CE1 3.81Å; M969-F971 HydrophobicContact CE-CE2 3.71Å; M969-F971 HydrophobicContact CE-CZ 3.39Å; M969-F971 HydrophobicContact CG-CE2 4.25Å; M969-F971 HydrophobicContact SD-CE2 4.06Å; M969-F971 HydrophobicContact SD-CZ 3.97Å; M969-Y995 HydrophobicContact CE-CD2 3.76Å; M969-Y995 HydrophobicContact CE-CG 4.24Å; M969-E998 HydrophobicContact CE-CB 4.23Å; M969-E998 HydrophobicContact SD-CB 4.42Å; M969-L1001 HydrophobicContact CB-CD1 3.7Å; M969-L1001 HydrophobicContact CG-CD1 3.78Å; M969-L1001 HydrophobicContact SD-CD1 4.24Å; M969-S1021 WeakPolarHBondContact O-CA 3.32Å; M969-L1022 HydrophobicContact CG-CB 4Å; M969-L1022 PolarHBondContact N-O 3.16Å; M969-L1022 PolarHBondContact O-N 3.46Å; M969-L1022 HydrophobicContact SD-CD2 4.37Å; M969-F1027 HydrophobicContact SD-CD2 3.73Å; M969-F1027 HydrophobicContact SD-CE2 3.52Å; M969-F1027 VanDerWaalsContact SD-CE2 3.52Å; M969-F1027 HydrophobicContact SD-CZ 4.15Å; M969-M1041 HydrophobicContact CE-CE 4.16Å; M969-M1041 HydrophobicContact SD-CE 4.31Å
970	Y	95.4	Very high	93.2	Very high	12 Å²	12	42.3 Å²	42.3	5%	0.047	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.5	179.8	-59.1	-84.6	0	0	0	112	F953 I959 I960 K968 Y995 F996 L1019 Y1020	F953-Y970 HydrophobicContact CE2-CE1 4.13Å; F953-Y970 HydrophobicContact CZ-CE1 4.11Å; I959-Y970 HydrophobicContact CG2-CD2 3.93Å; I959-Y970 HydrophobicContact CG2-CE1 4.22Å; I959-Y970 HydrophobicContact CG2-CE2 3.54Å; I959-Y970 HydrophobicContact CG2-CG 4.39Å; I960-Y970 HydrophobicContact CD1-CD2 4.28Å; I960-Y970 HydrophobicContact CD1-CE2 4.29Å; I960-Y970 HydrophobicContact CG1-CD2 4.46Å; I960-Y970 HydrophobicContact CG1-CE2 4.04Å; K968-Y970 HydrophobicContact CD-CE1 3.9Å; K968-Y970 WeakPolarHBondContact CE-OH 3.17Å; K968-Y970 PolarHBondContact NZ-OH 2.88Å; Y970-Y995 CarbonylContact O-C 3.41Å; Y970-Y995 VanDerWaalsContact O-CA 3.26Å; Y970-Y995 WeakPolarHBondContact O-CA 3.31Å; Y970-Y995 WeakPolarHBondContact O-CB 3.37Å; Y970-F996 HydrophobicContact CD2-CD2 4.12Å; Y970-F996 AromaticContact CD2-CE2 3.45Å; Y970-F996 HydrophobicContact CD2-CE2 3.45Å; Y970-F996 VanDerWaalsContact CD2-CE2 3.45Å; Y970-F996 AromaticContact CD2-CZ 3.97Å; Y970-F996 HydrophobicContact CD2-CZ 3.97Å; Y970-F996 HydrophobicContact CE2-CE2 4.27Å; Y970-F996 AromaticContact CG-CE2 3.98Å; Y970-F996 HydrophobicContact CG-CE2 3.98Å; Y970-F996 HydrophobicContact CG-CZ 4.03Å; Y970-F996 PolarHBondContact N-O 2.9Å; Y970-F996 PolarHBondContact O-N 3.27Å; Y970-L1019 HydrophobicContact CD1-CB 4.36Å; Y970-L1019 HydrophobicContact CD1-CD1 4.11Å; Y970-L1019 HydrophobicContact CG-CD1 4.3Å; Y970-Y1020 CarbonylContact C-O 3.59Å; Y970-Y1020 WeakPolarHBondContact CA-O 3.19Å
971	F	93.6	Very high	92.7	Very high	3 Å²	3	43.3 Å²	43.3	1%	0.013	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.9	169.6	-58.3	-97.3	0	0	0	109.4	L926 V930 F933 L948 M969 Y995 L1019 Y1020 L1022	L926-F971 HydrophobicContact CD1-CB 3.94Å; L926-F971 HydrophobicContact CD2-CB 3.84Å; L926-F971 HydrophobicContact CD2-CG 4.36Å; L926-F971 HydrophobicContact CG-CB 4.34Å; V930-F971 HydrophobicContact CG2-CD1 4.35Å; F933-F971 AromaticContact CE2-CD1 3.98Å; F933-F971 HydrophobicContact CE2-CD1 3.98Å; F933-F971 AromaticContact CE2-CE1 3.74Å; F933-F971 HydrophobicContact CE2-CE1 3.74Å; F933-F971 HydrophobicContact CE2-CZ 4.39Å; F933-F971 HydrophobicContact CZ-CD1 4.21Å; F933-F971 AromaticContact CZ-CE1 3.53Å; F933-F971 HydrophobicContact CZ-CE1 3.53Å; F933-F971 AromaticContact CZ-CZ 3.8Å; F933-F971 HydrophobicContact CZ-CZ 3.8Å; L948-F971 HydrophobicContact CD2-CD2 3.85Å; L948-F971 HydrophobicContact CD2-CE2 3.82Å; M969-F971 HydrophobicContact CE-CD1 4.45Å; M969-F971 HydrophobicContact CE-CD2 4.36Å; M969-F971 HydrophobicContact CE-CE1 3.81Å; M969-F971 HydrophobicContact CE-CE2 3.71Å; M969-F971 HydrophobicContact CE-CZ 3.39Å; M969-F971 HydrophobicContact CG-CE2 4.25Å; M969-F971 HydrophobicContact SD-CE2 4.06Å; M969-F971 HydrophobicContact SD-CZ 3.97Å; F971-Y995 HydrophobicContact CD1-CG 4.28Å; F971-Y995 HydrophobicContact CE1-CG 4.33Å; F971-L1019 WeakPolarHBondContact O-CA 3.31Å; F971-Y1020 PolarHBondContact N-O 3.08Å; F971-Y1020 PolarHBondContact O-N 2.8Å; F971-L1022 HydrophobicContact CE2-CB 4.15Å; F971-L1022 HydrophobicContact CE2-CD2 4.14Å
972	I	94.4	Very high	92.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	112.3	-177.9	-50.1	-176.3	0	0	0	109.8	L926 V977 L990 G993 S994 F996 L1019	L926-I972 VanDerWaalsContact CD1-O 3.22Å; L926-I972 WeakPolarHBondContact CD1-O 3.47Å; I972-V977 HydrophobicContact CD1-CG1 4.44Å; I972-V977 HydrophobicContact CD1-CG2 3.7Å; I972-L990 HydrophobicContact CD1-CB 3.84Å; I972-G993 PolarHBondContact O-N 3.45Å; I972-S994 PolarHBondContact N-O 3.08Å; I972-F996 HydrophobicContact CD1-CD1 4.15Å; I972-F996 HydrophobicContact CD1-CE1 3.98Å; I972-F996 HydrophobicContact CG1-CD1 4.15Å; I972-F996 HydrophobicContact CG1-CE1 3.83Å; I972-L1019 HydrophobicContact CB-CD2 4.06Å; I972-L1019 HydrophobicContact CG1-CD2 3.83Å; I972-L1019 HydrophobicContact CG2-CD2 4.02Å
973	Q	91.8	Very high	91.6	Very high	60 Å²	60	49.2 Å²	49.2	28%	0.28	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-46.2	171.5	-177.2	-174.4	-18.4	0	0	111	L926 N1018 Y1020	L926-Q973 HydrophobicContact CD1-CB 4.3Å; Q973-N1018 WeakPolarHBondContact CB-O 3.28Å; Q973-N1018 PolarHBondContact N-O 3.05Å; Q973-Y1020 HydrophobicContact CB-CD2 4.22Å; Q973-Y1020 HydrophobicContact CB-CE2 4Å; Q973-Y1020 HydrophobicContact CG-CE2 4.24Å; Q973-Y1020 PolarHBondContact OE1-OH 3.23Å; Q973-Y1020 VanDerWaalsContact OE1-OH 3.12Å
974	E	92.9	Very high	91.2	Very high	107 Å²	107	50 Å²	50	50%	0.5	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	121	-178	173.4	-172.8	-161.3	0	0	107.6	D992 N1018	E974-D992 WeakPolarHBondContact CA-OD1 3.41Å; E974-N1018 HydrophobicContact CB-CB 4.2Å; E974-N1018 PolarHBondContact N-O 3.44Å; E974-N1018 PolarHBondContact O-N 2.78Å; E974-N1018 PolarHBondContact OE2-ND2 2.81Å
975	G	93.6	Very high	90.7	Very high	5 Å²	5	54 Å²	54	5%	0.052	28%	0.28	C	S	.	.			trans	144.1	171.8	177.9	0	0	0	0	0	114.4	S991 D992	G975-S991 CarbonylContact O-C 3.26Å; G975-S991 WeakPolarHBondContact O-CA 3.37Å; G975-D992 PolarHBondContact N-OD1 3.42Å; G975-D992 PolarHBondContact O-N 2.89Å
976	I	96.5	Very high	90.6	Very high	74 Å²	74	51.6 Å²	51.6	38%	0.379	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.1	177.6	-55.7	175.5	0	0	0	108.3	L990 V1014 V1015	I976-L990 WeakPolarHBondContact CA-O 3.37Å; I976-V1014 HydrophobicContact CB-CB 4.36Å; I976-V1014 HydrophobicContact CG2-CB 4.34Å; I976-V1014 HydrophobicContact CG2-CG2 4.16Å; I976-V1014 WeakPolarHBondContact O-CB 3.43Å; I976-V1014 PolarHBondContact O-N 3.32Å; I976-V1015 HydrophobicContact CB-CG2 4.03Å; I976-V1015 HydrophobicContact CG1-CG2 4.33Å
977	V	96.7	Very high	90.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.9	178.4	-51.8	0	0	0	0	110.9	I959 I972 S989 L990 F996 V1011 K1012	I959-V977 HydrophobicContact CD1-CB 4.27Å; I959-V977 HydrophobicContact CD1-CG1 3.56Å; I972-V977 HydrophobicContact CD1-CG1 4.44Å; I972-V977 HydrophobicContact CD1-CG2 3.7Å; V977-S989 CarbonylContact O-C 3.26Å; V977-S989 WeakPolarHBondContact O-CA 3.25Å; V977-L990 HydrophobicContact CG2-CB 3.95Å; V977-L990 PolarHBondContact N-O 3.22Å; V977-L990 PolarHBondContact O-N 3.04Å; V977-F996 HydrophobicContact CG2-CD1 4.13Å; V977-F996 HydrophobicContact CG2-CE1 3.81Å; V977-F996 HydrophobicContact CG2-CZ 4.39Å; V977-V1011 HydrophobicContact CB-CG1 3.83Å; V977-V1011 HydrophobicContact CG2-CG1 3.64Å; V977-K1012 CarbonylContact C-O 3.57Å; V977-K1012 WeakPolarHBondContact CA-O 3.08Å
978	D	95.7	Very high	90.3	Very high	30 Å²	30	52.7 Å²	52.7	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	133.7	176.9	-68.2	-25.8	0	0	0	110.5	I980 V986 S989 V1011 K1012 V1014	D978-I980 HydrophobicContact CB-CG1 4.37Å; D978-V986 HydrophobicContact CB-CG1 3.89Å; D978-V986 HydrophobicContact CB-CG2 4.25Å; D978-S989 WeakPolarHBondContact OD1-CB 3.49Å; D978-S989 PolarHBondContact OD1-OG 3.03Å; D978-V1011 WeakPolarHBondContact O-CA 3.2Å; D978-K1012 PolarHBondContact N-O 3.3Å; D978-K1012 PolarHBondContact O-N 3.19Å; D978-V1014 HydrophobicContact CB-CG2 4.3Å; D978-V1014 WeakPolarHBondContact OD1-CG2 3.42Å; D978-V1014 WeakPolarHBondContact OD2-CG2 3.48Å
979	I	93.7	Very high	90.2	Very high	22 Å²	22	53.3 Å²	53.3	11%	0.113	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.2	167.9	-54	-169.6	0	0	0	108.5	V986 A987 T988 L990 A1009 S1010 V1011	I979-V986 CarbonylContact O-C 3.56Å; I979-V986 WeakPolarHBondContact O-CA 3.23Å; I979-A987 PolarHBondContact O-N 3.45Å; I979-T988 HydrophobicContact CB-CG2 4.07Å; I979-T988 WeakPolarHBondContact CB-O 3.43Å; I979-T988 HydrophobicContact CD1-CG2 3.74Å; I979-T988 HydrophobicContact CG1-CG2 4.01Å; I979-T988 PolarHBondContact N-O 3.07Å; I979-L990 HydrophobicContact CD1-CD1 3.91Å; I979-L990 HydrophobicContact CD1-CG 4.12Å; I979-L990 HydrophobicContact CG1-CD1 4.48Å; I979-L990 HydrophobicContact CG1-CG 4.44Å; I979-A1009 HydrophobicContact CG2-CB 3.62Å; I979-S1010 WeakPolarHBondContact CA-O 3.45Å; I979-V1011 HydrophobicContact CG1-CG2 4.38Å
980	I	91.6	Very high	90.2	Very high	31 Å²	31	54.4 Å²	54.4	16%	0.159	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129.6	-174.4	-57.8	170.9	0	0	0	109.2	D978 E985 V986 S1010 K1012	D978-I980 HydrophobicContact CB-CG1 4.37Å; I980-E985 WeakPolarHBondContact CA-O 3.46Å; I980-V986 HydrophobicContact CG1-CG2 4.32Å; I980-S1010 PolarHBondContact N-O 3.43Å; I980-S1010 PolarHBondContact O-N 2.92Å; I980-K1012 HydrophobicContact CD1-CB 3.82Å; I980-K1012 HydrophobicContact CD1-CD 3.75Å; I980-K1012 HydrophobicContact CD1-CG 4.46Å
981	T	84.8	Confident	90.1	Very high	29 Å²	29	56.8 Å²	56.8	18%	0.178	32%	0.322	C	S	.	.			trans	-86.5	176.6	177	66.5	0	0	0	0	112.2	D983 G984 E985 A987	T981-D983 PolarHBondContact O-N 3.46Å; T981-D983 VanDerWaalsContact O-N 3.15Å; T981-D983 PolarHBondContact OG1-OD2 2.96Å; T981-G984 PolarHBondContact O-N 3.36Å; T981-E985 PolarHBondContact N-O 3.13Å; T981-A987 HydrophobicContact CG2-CB 3.79Å
982	K	81.8	Confident	90	Very high	160 Å²	160	60.7 Å²	60.7	70%	0.696	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-34.5	173.5	-67.8	-178.5	179.2	176.7	0	113.8	E962 G984	E962-K982 WeakPolarHBondContact OE1-CE 3.14Å; E962-K982 WeakPolarHBondContact OE1-CG 3.12Å; E962-K982 VanDerWaalsContact OE2-CG 3.29Å; E962-K982 WeakPolarHBondContact OE2-CG 3.31Å; E962-K982 PolarHBondContact OE2-N 2.97Å; K982-G984 PolarHBondContact O-N 2.69Å
983	D	79.5	Confident	89.7	Confident	135 Å²	135	61 Å²	61	72%	0.722	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.8	-174.1	-39.3	-76.1	0	0	0	112.2	T981 E985	T981-D983 PolarHBondContact O-N 3.46Å; T981-D983 VanDerWaalsContact O-N 3.15Å; T981-D983 PolarHBondContact OG1-OD2 2.96Å; D983-E985 VanDerWaalsContact C-N 3.28Å
984	G	80	Confident	89.7	Confident	51 Å²	51	59.4 Å²	59.4	53%	0.526	34%	0.342	S	S	.	.	S	Bend	trans	87.4	-9.2	-175.9	0	0	0	0	0	114.1	T981 K982	T981-G984 PolarHBondContact O-N 3.36Å; K982-G984 PolarHBondContact O-N 2.69Å
985	E	84.2	Confident	89.7	Confident	137 Å²	137	55 Å²	55	64%	0.64	32%	0.321	S	S	*	.			trans	-71.2	146.6	178.9	-67.6	-60.1	158.8	0	0	112.7	I980 T981 D983 A987	I980-E985 WeakPolarHBondContact CA-O 3.46Å; T981-E985 PolarHBondContact N-O 3.13Å; D983-E985 VanDerWaalsContact C-N 3.28Å; E985-A987 PolarHBondContact O-N 3.32Å
986	V	87.6	Confident	89.6	Confident	68 Å²	68	55 Å²	55	41%	0.412	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	102.3	173.8	179.1	0	0	0	0	108.7	D978 I979 I980	D978-V986 HydrophobicContact CB-CG1 3.89Å; D978-V986 HydrophobicContact CB-CG2 4.25Å; I979-V986 CarbonylContact O-C 3.56Å; I979-V986 WeakPolarHBondContact O-CA 3.23Å; I980-V986 HydrophobicContact CG1-CG2 4.32Å
987	A	84.7	Confident	89.4	Confident	60 Å²	60	52.2 Å²	52.2	50%	0.496	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-33.2	-179.4	0	0	0	0	0	112.9	I979 T981 E985	I979-A987 PolarHBondContact O-N 3.45Å; T981-A987 HydrophobicContact CG2-CB 3.79Å; E985-A987 PolarHBondContact O-N 3.32Å
988	T	89.7	Confident	89.1	Confident	70 Å²	70	52.3 Å²	52.3	43%	0.429	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	152.1	174.8	-170.5	0	0	0	0	110.9	I979	I979-T988 HydrophobicContact CB-CG2 4.07Å; I979-T988 WeakPolarHBondContact CB-O 3.43Å; I979-T988 HydrophobicContact CD1-CG2 3.74Å; I979-T988 HydrophobicContact CG1-CG2 4.01Å; I979-T988 PolarHBondContact N-O 3.07Å
989	S	93	Very high	88.8	Confident	66 Å²	66	51.4 Å²	51.4	46%	0.462	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.5	170.9	-51.7	0	0	0	0	109.8	V977 D978	V977-S989 CarbonylContact O-C 3.26Å; V977-S989 WeakPolarHBondContact O-CA 3.25Å; D978-S989 WeakPolarHBondContact OD1-CB 3.49Å; D978-S989 PolarHBondContact OD1-OG 3.03Å
990	L	93.4	Very high	88.6	Confident	23 Å²	23	50.7 Å²	50.7	12%	0.12	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.9	177.6	-63.6	-176.3	0	0	0	111	I972 I976 V977 I979 F996	I972-L990 HydrophobicContact CD1-CB 3.84Å; I976-L990 WeakPolarHBondContact CA-O 3.37Å; V977-L990 HydrophobicContact CG2-CB 3.95Å; V977-L990 PolarHBondContact N-O 3.22Å; V977-L990 PolarHBondContact O-N 3.04Å; I979-L990 HydrophobicContact CD1-CD1 3.91Å; I979-L990 HydrophobicContact CD1-CG 4.12Å; I979-L990 HydrophobicContact CG1-CD1 4.48Å; I979-L990 HydrophobicContact CG1-CG 4.44Å; L990-F996 HydrophobicContact CD1-CB 3.91Å; L990-F996 HydrophobicContact CD1-CD1 4.16Å; L990-F996 HydrophobicContact CD1-CG 4.43Å
991	S	93	Very high	88.5	Confident	62 Å²	62	49.2 Å²	49.2	43%	0.434	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	177	177.3	62.2	0	0	0	0	112.8	G975 S994	G975-S991 CarbonylContact O-C 3.26Å; G975-S991 WeakPolarHBondContact O-CA 3.37Å; S991-S994 WeakPolarHBondContact O-CB 3.44Å; S991-S994 PolarHBondContact O-N 2.93Å; S991-S994 PolarHBondContact O-OG 3.46Å
992	D	91.4	Very high	88.5	Confident	85 Å²	85	48.5 Å²	48.5	46%	0.455	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-26.5	131.3	163	-58.6	20.8	0	0	0	113.5	E974 G975 S994	E974-D992 WeakPolarHBondContact CA-OD1 3.41Å; G975-D992 PolarHBondContact N-OD1 3.42Å; G975-D992 PolarHBondContact O-N 2.89Å; D992-S994 PolarHBondContact O-N 3.42Å
993	G	88	Confident	88.6	Confident	6 Å²	6	42 Å²	42	6%	0.062	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	-10.5	-176.6	0	0	0	0	0	115	V930 I972	V930-G993 WeakPolarHBondContact CA-O 3.29Å; V930-G993 VanDerWaalsContact CG2-O 3.25Å; V930-G993 WeakPolarHBondContact CG2-O 3.42Å; I972-G993 PolarHBondContact O-N 3.45Å
994	S	91.5	Very high	88.7	Confident	27 Å²	27	40.7 Å²	40.7	19%	0.189	26%	0.255	C	S	.	.			trans	-79.3	162.3	170.4	-54.3	0	0	0	0	112.1	I972 S991 D992	I972-S994 PolarHBondContact N-O 3.08Å; S991-S994 WeakPolarHBondContact O-CB 3.44Å; S991-S994 PolarHBondContact O-N 2.93Å; S991-S994 PolarHBondContact O-OG 3.46Å; D992-S994 PolarHBondContact O-N 3.42Å
995	Y	92.4	Very high	89	Confident	15 Å²	15	40.7 Å²	40.7	6%	0.059	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.4	170.2	65.6	-93.8	0	0	0	110.7	V930 F932 M969 Y970 F971 E998 M1041 R1048	V930-Y995 HydrophobicContact CG1-CD1 4.14Å; F932-Y995 HydrophobicContact CB-CE1 3.95Å; F932-Y995 HydrophobicContact CG-CE1 4.47Å; M969-Y995 HydrophobicContact CE-CD2 3.76Å; M969-Y995 HydrophobicContact CE-CG 4.24Å; Y970-Y995 CarbonylContact O-C 3.41Å; Y970-Y995 VanDerWaalsContact O-CA 3.26Å; Y970-Y995 WeakPolarHBondContact O-CA 3.31Å; Y970-Y995 WeakPolarHBondContact O-CB 3.37Å; F971-Y995 HydrophobicContact CD1-CG 4.28Å; F971-Y995 HydrophobicContact CE1-CG 4.33Å; Y995-E998 HydrophobicContact CD2-CG 4.45Å; Y995-E998 HydrophobicContact CE2-CB 4.48Å; Y995-E998 HydrophobicContact CE2-CG 4Å; Y995-M1041 HydrophobicContact CE2-CE 4.21Å; Y995-R1048 PolarHBondContact O-NH1 2.78Å; Y995-R1048 PolarHBondContact O-NH2 3.28Å
996	F	93.4	Very high	89.3	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.018	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.8	-176.9	62.5	-92.7	0	0	0	113.5	I959 I960 Y970 I972 V977 L990 E998 V1011 L1019	I959-F996 HydrophobicContact CD1-CZ 4.2Å; I959-F996 HydrophobicContact CG2-CE2 3.92Å; I959-F996 HydrophobicContact CG2-CZ 3.95Å; I960-F996 HydrophobicContact CD1-CD2 3.63Å; I960-F996 HydrophobicContact CD1-CE2 3.81Å; I960-F996 HydrophobicContact CG1-CD2 4.5Å; I960-F996 HydrophobicContact CG1-CE2 4.22Å; Y970-F996 HydrophobicContact CD2-CD2 4.12Å; Y970-F996 AromaticContact CD2-CE2 3.45Å; Y970-F996 HydrophobicContact CD2-CE2 3.45Å; Y970-F996 VanDerWaalsContact CD2-CE2 3.45Å; Y970-F996 AromaticContact CD2-CZ 3.97Å; Y970-F996 HydrophobicContact CD2-CZ 3.97Å; Y970-F996 HydrophobicContact CE2-CE2 4.27Å; Y970-F996 AromaticContact CG-CE2 3.98Å; Y970-F996 HydrophobicContact CG-CE2 3.98Å; Y970-F996 HydrophobicContact CG-CZ 4.03Å; Y970-F996 PolarHBondContact N-O 2.9Å; Y970-F996 PolarHBondContact O-N 3.27Å; I972-F996 HydrophobicContact CD1-CD1 4.15Å; I972-F996 HydrophobicContact CD1-CE1 3.98Å; I972-F996 HydrophobicContact CG1-CD1 4.15Å; I972-F996 HydrophobicContact CG1-CE1 3.83Å; V977-F996 HydrophobicContact CG2-CD1 4.13Å; V977-F996 HydrophobicContact CG2-CE1 3.81Å; V977-F996 HydrophobicContact CG2-CZ 4.39Å; L990-F996 HydrophobicContact CD1-CB 3.91Å; L990-F996 HydrophobicContact CD1-CD1 4.16Å; L990-F996 HydrophobicContact CD1-CG 4.43Å; F996-E998 VanDerWaalsContact CA-OE2 3.22Å; F996-E998 WeakPolarHBondContact CA-OE2 3.44Å; F996-V1011 HydrophobicContact CD2-CB 4.29Å; F996-V1011 HydrophobicContact CD2-CG1 4.01Å; F996-V1011 HydrophobicContact CD2-CG2 3.98Å; F996-V1011 HydrophobicContact CE1-CG1 4.39Å; F996-V1011 HydrophobicContact CE2-CB 4.12Å; F996-V1011 HydrophobicContact CE2-CG1 3.73Å; F996-V1011 HydrophobicContact CE2-CG2 4.32Å; F996-V1011 HydrophobicContact CG-CG1 4.44Å; F996-V1011 HydrophobicContact CZ-CG1 3.95Å; F996-L1019 HydrophobicContact CE1-CD1 4.4Å; F996-L1019 HydrophobicContact CZ-CD1 3.92Å
997	G	91.8	Very high	89.5	Confident	15 Å²	15	39.1 Å²	39.1	16%	0.155	23%	0.226	C	C	.	.			trans	89.5	5	177.8	0	0	0	0	0	114.9	R1007	G997-R1007 PolarHBondContact O-NH1 3.07Å
998	E	89.6	Confident	89.7	Confident	3 Å²	3	37.3 Å²	37.3	1%	0.014	21%	0.209	C	C	.	.			trans	-65.2	-35.1	177.9	70.7	-66.6	159	0	0	113.7	M969 Y995 F996 T1000 L1001 L1002 M1041 R1048	M969-E998 HydrophobicContact CE-CB 4.23Å; M969-E998 HydrophobicContact SD-CB 4.42Å; Y995-E998 HydrophobicContact CD2-CG 4.45Å; Y995-E998 HydrophobicContact CE2-CB 4.48Å; Y995-E998 HydrophobicContact CE2-CG 4Å; F996-E998 VanDerWaalsContact CA-OE2 3.22Å; F996-E998 WeakPolarHBondContact CA-OE2 3.44Å; E998-T1000 PolarHBondContact O-N 2.93Å; E998-L1001 WeakPolarHBondContact O-CB 3.34Å; E998-L1001 PolarHBondContact O-N 3.46Å; E998-L1002 PolarHBondContact O-N 3.09Å; E998-M1041 HydrophobicContact CB-CE 4.13Å; E998-R1048 WeakPolarHBondContact OE1-CD 3.48Å; E998-R1048 IonicContact OE1-CZ 3.26Å; E998-R1048 IonicContact OE1-NE 2.74Å; E998-R1048 IonicContact OE1-NH1 2.88Å; E998-R1048 PolarHBondContact OE1-NH1 3Å; E998-R1048 IonicContact OE2-NH1 3.56Å; E998-R1048 PolarHBondContact OE2-NH1 3.01Å
999	I	89.6	Confident	89.7	Confident	11 Å²	11	34.4 Å²	34.4	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-51.4	-55.8	-175.6	-62	166.8	0	0	0	110.5	L1001 L1002 T1003 T1008 A1045 R1048 L1049	I999-L1001 PolarHBondContact O-N 3.37Å; I999-L1001 VanDerWaalsContact O-N 3.17Å; I999-L1002 PolarHBondContact O-N 3.24Å; I999-T1003 HydrophobicContact CG2-CG2 3.79Å; I999-T1003 WeakPolarHBondContact O-CG2 3.26Å; I999-T1003 PolarHBondContact O-N 3.15Å; I999-T1003 PolarHBondContact O-OG1 3.26Å; I999-T1008 HydrophobicContact CG2-CG2 4.25Å; I999-A1045 HydrophobicContact CG1-CB 4.01Å; I999-R1048 HydrophobicContact CD1-CB 4.26Å; I999-L1049 HydrophobicContact CD1-CD2 4.34Å; I999-L1049 HydrophobicContact CD1-CG 4.19Å; I999-L1049 HydrophobicContact CG2-CD1 4.12Å; I999-L1049 HydrophobicContact CG2-CD2 4.16Å; I999-L1049 HydrophobicContact CG2-CG 4.22Å
1000	T	89.2	Confident	89.7	Confident	6 Å²	6	32.2 Å²	32.2	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-58.6	-26.9	178.7	-70	0	0	0	0	114.3	G966 E998 N1004 T1005	G966-T1000 WeakPolarHBondContact O-CG2 3.45Å; E998-T1000 PolarHBondContact O-N 2.93Å; T1000-N1004 WeakPolarHBondContact O-CA 3.36Å; T1000-N1004 PolarHBondContact O-N 3.42Å; T1000-T1005 WeakPolarHBondContact CB-O 3.45Å; T1000-T1005 WeakPolarHBondContact CG2-O 3.23Å; T1000-T1005 PolarHBondContact OG1-O 3.24Å
1001	L	89.1	Confident	89.9	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-75.7	-30.6	175.9	-58.3	-172.4	0	0	0	112.2	M969 E998 I999 R1024 F1027	M969-L1001 HydrophobicContact CB-CD1 3.7Å; M969-L1001 HydrophobicContact CG-CD1 3.78Å; M969-L1001 HydrophobicContact SD-CD1 4.24Å; E998-L1001 WeakPolarHBondContact O-CB 3.34Å; E998-L1001 PolarHBondContact O-N 3.46Å; I999-L1001 PolarHBondContact O-N 3.37Å; I999-L1001 VanDerWaalsContact O-N 3.17Å; L1001-R1024 HydrophobicContact CD2-CB 3.82Å; L1001-R1024 HydrophobicContact CD2-CG 4.11Å; L1001-F1027 HydrophobicContact CB-CD1 3.66Å; L1001-F1027 HydrophobicContact CB-CE1 3.61Å; L1001-F1027 HydrophobicContact CD1-CB 4.14Å; L1001-F1027 HydrophobicContact CD1-CD1 3.53Å; L1001-F1027 HydrophobicContact CD1-CD2 4.46Å; L1001-F1027 HydrophobicContact CD1-CE1 3.93Å; L1001-F1027 HydrophobicContact CD1-CG 3.8Å; L1001-F1027 HydrophobicContact CG-CD1 4.25Å; L1001-F1027 HydrophobicContact CG-CE1 4.44Å
1002	L	86.1	Confident	90	Very high	14 Å²	14	32.6 Å²	32.6	7%	0.073	17%	0.17	C	C	.	.	H	α-helix	trans	-87.7	-44.1	-179.8	-63	170.5	0	0	0	112.4	E998 I999 F1027 L1031 M1041 E1042 A1045	E998-L1002 PolarHBondContact O-N 3.09Å; I999-L1002 PolarHBondContact O-N 3.24Å; L1002-F1027 HydrophobicContact CD2-CE1 3.89Å; L1002-F1027 HydrophobicContact CD2-CZ 4.2Å; L1002-F1027 HydrophobicContact CG-CE1 4.25Å; L1002-L1031 HydrophobicContact CD2-CD1 3.91Å; L1002-M1041 HydrophobicContact CD1-CB 4.01Å; L1002-E1042 HydrophobicContact CD1-CG 4.18Å; L1002-E1042 HydrophobicContact CD2-CG 4.22Å; L1002-A1045 HydrophobicContact CD1-CB 3.97Å
1003	T	83.6	Confident	90.3	Very high	22 Å²	22	28.6 Å²	28.6	14%	0.135	15%	0.149	C	C	.	.	H	α-helix	trans	-86.8	-16.7	-172.9	65.1	0	0	0	0	114.1	I999 T1005 I1058 V1059	I999-T1003 HydrophobicContact CG2-CG2 3.79Å; I999-T1003 WeakPolarHBondContact O-CG2 3.26Å; I999-T1003 PolarHBondContact O-N 3.15Å; I999-T1003 PolarHBondContact O-OG1 3.26Å; T1003-T1005 PolarHBondContact O-N 3.24Å; T1003-T1005 VanDerWaalsContact O-N 3.14Å; T1003-T1005 PolarHBondContact OG1-N 3.43Å; T1003-T1005 PolarHBondContact OG1-OG1 3.45Å; T1003-I1058 HydrophobicContact CG2-CG2 4.07Å; T1003-V1059 HydrophobicContact CG2-CB 4.38Å; T1003-V1059 HydrophobicContact CG2-CG1 4.48Å; T1003-V1059 HydrophobicContact CG2-CG2 4.02Å
1004	N	82.5	Confident	90.7	Very high	108 Å²	108	30.9 Å²	30.9	58%	0.578	16%	0.161	S	C	*	.			trans	57.8	10.5	-164.3	-57.3	-38.3	0	0	0	115.1	T1000 R1024	T1000-N1004 WeakPolarHBondContact O-CA 3.36Å; T1000-N1004 PolarHBondContact O-N 3.42Å; N1004-R1024 VanDerWaalsContact OD1-CZ 3.23Å; N1004-R1024 PolarHBondContact OD1-NH1 2.85Å; N1004-R1024 PolarHBondContact OD1-NH2 3Å
1005	T	84.7	Confident	90.9	Very high	52 Å²	52	31 Å²	31	32%	0.319	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-83.1	155.6	177.1	64.8	0	0	0	0	112.4	T1000 T1003 I1058	T1000-T1005 WeakPolarHBondContact CB-O 3.45Å; T1000-T1005 WeakPolarHBondContact CG2-O 3.23Å; T1000-T1005 PolarHBondContact OG1-O 3.24Å; T1003-T1005 PolarHBondContact O-N 3.24Å; T1003-T1005 VanDerWaalsContact O-N 3.14Å; T1003-T1005 PolarHBondContact OG1-N 3.43Å; T1003-T1005 PolarHBondContact OG1-OG1 3.45Å; T1005-I1058 HydrophobicContact CG2-CG2 3.77Å
1006	R	90.8	Very high	91	Very high	155 Å²	155	33.6 Å²	33.6	59%	0.585	17%	0.171	S	C	*	.	P	Polyproline II helix	trans	-51.6	156	168.2	-70.5	168.5	179	-86.4	1.5	111.6	G963 T964 I965 T1008	G963-R1006 VanDerWaalsContact O-CD 3.25Å; G963-R1006 WeakPolarHBondContact O-CD 3.49Å; G963-R1006 WeakPolarHBondContact O-CG 3.48Å; G963-R1006 PolarHBondContact O-NH1 3.16Å; T964-R1006 CarbonylContact O-C 3.35Å; T964-R1006 VanDerWaalsContact O-CA 3.31Å; T964-R1006 WeakPolarHBondContact O-CA 3.11Å; T964-R1006 WeakPolarHBondContact O-CB 3.34Å; I965-R1006 HydrophobicContact CG1-CG 4.41Å; R1006-T1008 PolarHBondContact O-N 3.24Å
1007	R	91.8	Very high	91.2	Very high	17 Å²	17	33.4 Å²	33.4	6%	0.064	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-55.3	127.1	180	-66	-66.4	-156.4	-164.1	5.6	110.6	I960 K961 E962 G963 T964 K968 G997	I960-R1007 HydrophobicContact CG2-CB 3.88Å; I960-R1007 HydrophobicContact CG2-CG 3.64Å; K961-R1007 WeakPolarHBondContact O-CB 3.33Å; E962-R1007 VanDerWaalsContact CG-O 3.28Å; E962-R1007 WeakPolarHBondContact CG-O 3.27Å; G963-R1007 PolarHBondContact N-O 3.39Å; T964-R1007 WeakPolarHBondContact O-CG 3.22Å; T964-R1007 PolarHBondContact O-N 2.85Å; T964-R1007 WeakPolarHBondContact OG1-CG 3.29Å; K968-R1007 PolarHBondContact O-NH1 3.22Å; K968-R1007 PolarHBondContact O-NH2 3.06Å; G997-R1007 PolarHBondContact O-NH1 3.07Å
1008	T	88.7	Confident	91.3	Very high	22 Å²	22	33.5 Å²	33.5	14%	0.135	17%	0.167	C	C	.	.	S	Bend	trans	-90	-14.6	-168.5	50.7	0	0	0	0	114.9	I999 R1006 L1049 Q1054	I999-T1008 HydrophobicContact CG2-CG2 4.25Å; R1006-T1008 PolarHBondContact O-N 3.24Å; T1008-L1049 HydrophobicContact CG2-CD2 4.02Å; T1008-Q1054 PolarHBondContact O-NE2 2.92Å; T1008-Q1054 VanDerWaalsContact O-NE2 3.12Å
1009	A	90.1	Very high	91.6	Very high	9 Å²	9	33.3 Å²	33.3	7%	0.074	17%	0.166	C	C	.	.	S	Bend	trans	-149.8	167.7	170.8	0	0	0	0	0	109.5	I979	I979-A1009 HydrophobicContact CG2-CB 3.62Å
1010	S	93.9	Very high	91.8	Very high	20 Å²	20	33.9 Å²	33.9	14%	0.14	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	151.4	169.3	-68.9	0	0	0	0	110.9	I960 E962 I979 I980	I960-S1010 CarbonylContact O-C 3.59Å; I960-S1010 WeakPolarHBondContact O-CA 3.4Å; E962-S1010 WeakPolarHBondContact CB-OG 3.42Å; E962-S1010 PolarHBondContact N-OG 2.97Å; I979-S1010 WeakPolarHBondContact CA-O 3.45Å; I980-S1010 PolarHBondContact N-O 3.43Å; I980-S1010 PolarHBondContact O-N 2.92Å
1011	V	96	Very high	92.1	Very high	8 Å²	8	33.6 Å²	33.6	5%	0.048	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.8	176.3	-173.6	0	0	0	0	110.2	L958 I959 I960 V977 D978 I979 F996	L958-V1011 CarbonylContact C-O 3.54Å; I959-V1011 HydrophobicContact CD1-CG1 4.47Å; I959-V1011 PolarHBondContact N-O 3.4Å; I960-V1011 HydrophobicContact CB-CB 4.01Å; I960-V1011 HydrophobicContact CB-CG2 4.09Å; I960-V1011 HydrophobicContact CD1-CG2 4.24Å; I960-V1011 HydrophobicContact CG1-CB 4.49Å; I960-V1011 PolarHBondContact N-O 3.13Å; I960-V1011 VanDerWaalsContact N-O 3.16Å; I960-V1011 PolarHBondContact O-N 2.94Å; V977-V1011 HydrophobicContact CB-CG1 3.83Å; V977-V1011 HydrophobicContact CG2-CG1 3.64Å; D978-V1011 WeakPolarHBondContact O-CA 3.2Å; I979-V1011 HydrophobicContact CG1-CG2 4.38Å; F996-V1011 HydrophobicContact CD2-CB 4.29Å; F996-V1011 HydrophobicContact CD2-CG1 4.01Å; F996-V1011 HydrophobicContact CD2-CG2 3.98Å; F996-V1011 HydrophobicContact CE1-CG1 4.39Å; F996-V1011 HydrophobicContact CE2-CB 4.12Å; F996-V1011 HydrophobicContact CE2-CG1 3.73Å; F996-V1011 HydrophobicContact CE2-CG2 4.32Å; F996-V1011 HydrophobicContact CG-CG1 4.44Å; F996-V1011 HydrophobicContact CZ-CG1 3.95Å
1012	K	96.3	Very high	92.3	Very high	84 Å²	84	33.7 Å²	33.7	37%	0.365	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134.4	-171.5	-179	-170.2	173.5	-166.3	0	111.2	D957 L958 V977 D978 I980	D957-K1012 CarbonylContact O-C 3.54Å; D957-K1012 WeakPolarHBondContact O-CA 3.22Å; L958-K1012 HydrophobicContact CD1-CB 4.44Å; V977-K1012 CarbonylContact C-O 3.57Å; V977-K1012 WeakPolarHBondContact CA-O 3.08Å; D978-K1012 PolarHBondContact N-O 3.3Å; D978-K1012 PolarHBondContact O-N 3.19Å; I980-K1012 HydrophobicContact CD1-CB 3.82Å; I980-K1012 HydrophobicContact CD1-CD 3.75Å; I980-K1012 HydrophobicContact CD1-CG 4.46Å
1013	A	97.4	Very high	92.7	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	130.9	175	0	0	0	0	0	111.8	F953 Q954 G956 D957 I959	F953-A1013 HydrophobicContact CB-CB 4.39Å; Q954-A1013 WeakPolarHBondContact O-CB 3.31Å; G956-A1013 PolarHBondContact N-O 3.26Å; D957-A1013 PolarHBondContact O-N 3.49Å; I959-A1013 HydrophobicContact CD1-CB 4.03Å
1014	V	95.7	Very high	93.1	Very high	54 Å²	54	37.9 Å²	37.9	33%	0.327	18%	0.183	S	C	.	.	S	Bend	trans	-91	-40.7	173.6	-174	0	0	0	0	110.7	P955 I976 D978	P955-V1014 VanDerWaalsContact CB-O 3.26Å; P955-V1014 WeakPolarHBondContact CB-O 3.22Å; I976-V1014 HydrophobicContact CB-CB 4.36Å; I976-V1014 HydrophobicContact CG2-CB 4.34Å; I976-V1014 HydrophobicContact CG2-CG2 4.16Å; I976-V1014 WeakPolarHBondContact O-CB 3.43Å; I976-V1014 PolarHBondContact O-N 3.32Å; D978-V1014 HydrophobicContact CB-CG2 4.3Å; D978-V1014 WeakPolarHBondContact OD1-CG2 3.42Å; D978-V1014 WeakPolarHBondContact OD2-CG2 3.48Å
1015	V	96	Very high	93.6	Very high	29 Å²	29	40.6 Å²	40.6	18%	0.176	19%	0.192	C	C	.	.	S	Bend	trans	-117.4	174.7	176.7	-71.4	0	0	0	0	110.4	Y470 I976 S1017	Y470-V1015 HydrophobicContact CE2-CG1 3.97Å; Y470-V1015 VanDerWaalsContact OH-CG1 3.25Å; Y470-V1015 WeakPolarHBondContact OH-CG1 3.34Å; I976-V1015 HydrophobicContact CB-CG2 4.03Å; I976-V1015 HydrophobicContact CG1-CG2 4.33Å; V1015-S1017 PolarHBondContact O-N 3.3Å; V1015-S1017 PolarHBondContact O-OG 3.48Å
1016	Y	95.9	Very high	93.9	Very high	71 Å²	71	39.3 Å²	39.3	28%	0.278	19%	0.185	S	C	.	.			trans	-55.2	123.9	161.2	-79	-88	0	0	0	108.8	H894 F953 Q954 P955	H894-Y1016 HydrophobicContact CB-CD1 4.23Å; H894-Y1016 HydrophobicContact CB-CE1 4.14Å; H894-Y1016 VanDerWaalsContact CE1-CB 3.49Å; H894-Y1016 WeakPolarHBondContact CE1-CB 3.34Å; H894-Y1016 AromaticContact CE1-CD1 3.76Å; H894-Y1016 AromaticContact CE1-CG 3.59Å; H894-Y1016 AromaticContact CG-CD1 3.69Å; H894-Y1016 AromaticContact ND1-CD1 3.44Å; H894-Y1016 WeakPolarHBondContact ND1-CD1 3.4Å; H894-Y1016 AromaticContact ND1-CE1 3.88Å; H894-Y1016 AromaticContact ND1-CG 3.62Å; F953-Y1016 WeakPolarHBondContact O-CA 3.45Å; Q954-Y1016 HydrophobicContact CB-CE1 4.28Å; Q954-Y1016 HydrophobicContact CG-CE1 4.04Å; P955-Y1016 HydrophobicContact CG-CD2 4.14Å; P955-Y1016 HydrophobicContact CG-CE2 3.96Å
1017	S	95.7	Very high	93.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.1	-170.1	-59.6	0	0	0	0	109.9	V952 F953 V1015	V952-S1017 WeakPolarHBondContact CA-O 3.23Å; F953-S1017 PolarHBondContact N-O 3.46Å; F953-S1017 PolarHBondContact O-N 3.07Å; V1015-S1017 PolarHBondContact O-N 3.3Å; V1015-S1017 PolarHBondContact O-OG 3.48Å
1018	N	94.9	Very high	93.8	Very high	16 Å²	16	33.3 Å²	33.3	9%	0.086	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	108.9	177.2	-68.4	-35.1	0	0	0	108.2	F950 V952 Q973 E974	F950-N1018 HydrophobicContact CE2-CB 3.94Å; F950-N1018 HydrophobicContact CZ-CB 3.97Å; V952-N1018 WeakPolarHBondContact CG2-OD1 3.27Å; Q973-N1018 WeakPolarHBondContact CB-O 3.28Å; Q973-N1018 PolarHBondContact N-O 3.05Å; E974-N1018 HydrophobicContact CB-CB 4.2Å; E974-N1018 PolarHBondContact N-O 3.44Å; E974-N1018 PolarHBondContact O-N 2.78Å; E974-N1018 PolarHBondContact OE2-ND2 2.81Å
1019	L	95.3	Very high	93.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	148.3	-171.1	-55.4	-173.5	0	0	0	111.1	E951 F953 I959 Y970 F971 I972 F996	E951-L1019 PolarHBondContact N-O 3.2Å; E951-L1019 PolarHBondContact O-N 3.43Å; E951-L1019 VanDerWaalsContact O-O 3.06Å; F953-L1019 HydrophobicContact CD2-CD1 3.63Å; F953-L1019 HydrophobicContact CD2-CG 4.13Å; F953-L1019 HydrophobicContact CE2-CD1 3.79Å; F953-L1019 HydrophobicContact CE2-CG 4.45Å; I959-L1019 HydrophobicContact CD1-CD1 4.04Å; I959-L1019 HydrophobicContact CG2-CD1 4.09Å; Y970-L1019 HydrophobicContact CD1-CB 4.36Å; Y970-L1019 HydrophobicContact CD1-CD1 4.11Å; Y970-L1019 HydrophobicContact CG-CD1 4.3Å; F971-L1019 WeakPolarHBondContact O-CA 3.31Å; I972-L1019 HydrophobicContact CB-CD2 4.06Å; I972-L1019 HydrophobicContact CG1-CD2 3.83Å; I972-L1019 HydrophobicContact CG2-CD2 4.02Å; F996-L1019 HydrophobicContact CE1-CD1 4.4Å; F996-L1019 HydrophobicContact CZ-CD1 3.92Å
1020	Y	94.5	Very high	94	Very high	22 Å²	22	34.1 Å²	34.1	9%	0.086	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.6	161.5	-71.8	-83.1	0	0	0	110.1	L926 L948 K949 F950 Y970 F971 Q973	L926-Y1020 HydrophobicContact CD2-CD2 3.77Å; L926-Y1020 HydrophobicContact CD2-CE2 4.41Å; L926-Y1020 HydrophobicContact CD2-CG 4.38Å; L948-Y1020 HydrophobicContact CB-CD1 3.78Å; L948-Y1020 HydrophobicContact CB-CG 4.19Å; L948-Y1020 HydrophobicContact CD1-CD1 4.41Å; L948-Y1020 HydrophobicContact CD1-CG 4.16Å; K949-Y1020 CarbonylContact O-C 3.46Å; K949-Y1020 VanDerWaalsContact O-CA 3.31Å; K949-Y1020 WeakPolarHBondContact O-CA 3.25Å; F950-Y1020 HydrophobicContact CB-CD1 4.23Å; F950-Y1020 HydrophobicContact CB-CE1 3.89Å; F950-Y1020 HydrophobicContact CD2-CD1 4.43Å; F950-Y1020 AromaticContact CD2-CE1 3.92Å; F950-Y1020 HydrophobicContact CD2-CE1 3.92Å; F950-Y1020 HydrophobicContact CD2-CE2 4.26Å; F950-Y1020 AromaticContact CD2-CZ 3.8Å; F950-Y1020 HydrophobicContact CG-CE1 4.39Å; Y970-Y1020 CarbonylContact C-O 3.59Å; Y970-Y1020 WeakPolarHBondContact CA-O 3.19Å; F971-Y1020 PolarHBondContact N-O 3.08Å; F971-Y1020 PolarHBondContact O-N 2.8Å; Q973-Y1020 HydrophobicContact CB-CD2 4.22Å; Q973-Y1020 HydrophobicContact CB-CE2 4Å; Q973-Y1020 HydrophobicContact CG-CE2 4.24Å; Q973-Y1020 PolarHBondContact OE1-OH 3.23Å; Q973-Y1020 VanDerWaalsContact OE1-OH 3.12Å
1021	S	95.3	Very high	93.7	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	148.7	169.9	61.1	0	0	0	0	111.6	L948 K949 E951 M969	L948-S1021 WeakPolarHBondContact CA-O 3Å; K949-S1021 PolarHBondContact N-O 3.48Å; K949-S1021 PolarHBondContact O-N 2.87Å; K949-S1021 PolarHBondContact O-OG 3.02Å; E951-S1021 VanDerWaalsContact OE1-CB 3.22Å; E951-S1021 WeakPolarHBondContact OE1-CB 3.33Å; E951-S1021 PolarHBondContact OE1-OG 3.03Å; M969-S1021 WeakPolarHBondContact O-CA 3.32Å
1022	L	94	Very high	93.4	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.5	172.4	-177.7	63.7	0	0	0	109.3	V944 K947 L948 K968 M969 F971 F1027	V944-L1022 HydrophobicContact CG1-CD2 4.1Å; K947-L1022 HydrophobicContact CB-CD1 3.6Å; L948-L1022 HydrophobicContact CD2-CB 3.98Å; L948-L1022 HydrophobicContact CD2-CD1 4.35Å; K968-L1022 CarbonylContact C-O 3.55Å; K968-L1022 WeakPolarHBondContact CA-O 3.33Å; K968-L1022 VanDerWaalsContact CB-O 3.24Å; K968-L1022 WeakPolarHBondContact CB-O 3.41Å; M969-L1022 HydrophobicContact CG-CB 4Å; M969-L1022 PolarHBondContact N-O 3.16Å; M969-L1022 PolarHBondContact O-N 3.46Å; M969-L1022 HydrophobicContact SD-CD2 4.37Å; F971-L1022 HydrophobicContact CE2-CB 4.15Å; F971-L1022 HydrophobicContact CE2-CD2 4.14Å; L1022-F1027 HydrophobicContact CD2-CB 4.09Å; L1022-F1027 HydrophobicContact CD2-CD2 3.8Å; L1022-F1027 HydrophobicContact CD2-CG 4.43Å; L1022-F1027 HydrophobicContact CG-CB 4.22Å
1023	D	94.2	Very high	93	Very high	47 Å²	47	40.5 Å²	40.5	25%	0.251	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	147.7	-178	-59.3	-52.5	0	0	0	112.3	K949 E1025 S1026 F1027	K949-D1023 WeakPolarHBondContact CE-OD2 3.25Å; K949-D1023 IonicContact NZ-OD2 3.45Å; K949-D1023 PolarHBondContact NZ-OD2 3.36Å; D1023-E1025 VanDerWaalsContact C-N 3.29Å; D1023-E1025 PolarHBondContact O-N 3.2Å; D1023-S1026 PolarHBondContact O-N 2.78Å; D1023-F1027 WeakPolarHBondContact O-CB 3.5Å; D1023-F1027 PolarHBondContact O-N 2.99Å
1024	R	91.9	Very high	92.6	Very high	77 Å²	77	43.2 Å²	43.2	29%	0.291	21%	0.213	S	C	.	.	H	α-helix	trans	-48.3	-44.9	-179.1	176.6	-179.1	167.9	92.5	7.5	113.8	N967 L1001 N1004 F1027 L1028	N967-R1024 VanDerWaalsContact O-CB 3.29Å; N967-R1024 WeakPolarHBondContact O-CB 3.3Å; N967-R1024 PolarHBondContact O-N 2.89Å; L1001-R1024 HydrophobicContact CD2-CB 3.82Å; L1001-R1024 HydrophobicContact CD2-CG 4.11Å; N1004-R1024 VanDerWaalsContact OD1-CZ 3.23Å; N1004-R1024 PolarHBondContact OD1-NH1 2.85Å; N1004-R1024 PolarHBondContact OD1-NH2 3Å; R1024-F1027 PolarHBondContact O-N 2.93Å; R1024-L1028 HydrophobicContact CG-CD1 4.01Å; R1024-L1028 WeakPolarHBondContact O-CB 3.44Å; R1024-L1028 VanDerWaalsContact O-CG 3.32Å; R1024-L1028 WeakPolarHBondContact O-CG 3.42Å; R1024-L1028 PolarHBondContact O-N 3.38Å
1025	E	92.1	Very high	92.2	Very high	164 Å²	164	44.5 Å²	44.5	77%	0.766	22%	0.222	S	C	*	.	H	α-helix	trans	-67.5	-49.4	-177.3	-68.4	166.5	-166.6	0	0	111.2	D1023 F1027 L1028 S1029	D1023-E1025 VanDerWaalsContact C-N 3.29Å; D1023-E1025 PolarHBondContact O-N 3.2Å; E1025-F1027 VanDerWaalsContact C-N 3.27Å; E1025-F1027 PolarHBondContact O-N 2.92Å; E1025-L1028 PolarHBondContact O-N 2.91Å; E1025-S1029 PolarHBondContact O-N 3.24Å; E1025-S1029 PolarHBondContact O-OG 2.9Å
1026	S	92.3	Very high	91.7	Very high	25 Å²	25	49.5 Å²	49.5	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-36.4	174.1	-61.7	0	0	0	0	112.3	D1023 S1029 V1030	D1023-S1026 PolarHBondContact O-N 2.78Å; S1026-S1029 PolarHBondContact O-OG 3.07Å; S1026-V1030 VanDerWaalsContact O-CG2 3.25Å; S1026-V1030 WeakPolarHBondContact O-CG2 3.39Å; S1026-V1030 PolarHBondContact O-N 3.12Å
1027	F	90.6	Very high	91.1	Very high	9 Å²	9	47.2 Å²	47.2	4%	0.039	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-47.7	176.4	178.8	-111.8	0	0	0	111.9	M969 L1001 L1002 L1022 D1023 R1024 E1025 L1031 M1041	M969-F1027 HydrophobicContact SD-CD2 3.73Å; M969-F1027 HydrophobicContact SD-CE2 3.52Å; M969-F1027 VanDerWaalsContact SD-CE2 3.52Å; M969-F1027 HydrophobicContact SD-CZ 4.15Å; L1001-F1027 HydrophobicContact CB-CD1 3.66Å; L1001-F1027 HydrophobicContact CB-CE1 3.61Å; L1001-F1027 HydrophobicContact CD1-CB 4.14Å; L1001-F1027 HydrophobicContact CD1-CD1 3.53Å; L1001-F1027 HydrophobicContact CD1-CD2 4.46Å; L1001-F1027 HydrophobicContact CD1-CE1 3.93Å; L1001-F1027 HydrophobicContact CD1-CG 3.8Å; L1001-F1027 HydrophobicContact CG-CD1 4.25Å; L1001-F1027 HydrophobicContact CG-CE1 4.44Å; L1002-F1027 HydrophobicContact CD2-CE1 3.89Å; L1002-F1027 HydrophobicContact CD2-CZ 4.2Å; L1002-F1027 HydrophobicContact CG-CE1 4.25Å; L1022-F1027 HydrophobicContact CD2-CB 4.09Å; L1022-F1027 HydrophobicContact CD2-CD2 3.8Å; L1022-F1027 HydrophobicContact CD2-CG 4.43Å; L1022-F1027 HydrophobicContact CG-CB 4.22Å; D1023-F1027 WeakPolarHBondContact O-CB 3.5Å; D1023-F1027 PolarHBondContact O-N 2.99Å; R1024-F1027 PolarHBondContact O-N 2.93Å; E1025-F1027 VanDerWaalsContact C-N 3.27Å; E1025-F1027 PolarHBondContact O-N 2.92Å; F1027-L1031 HydrophobicContact CD1-CD1 4.14Å; F1027-L1031 HydrophobicContact CD2-CD1 4.44Å; F1027-L1031 HydrophobicContact CE1-CD1 3.56Å; F1027-L1031 HydrophobicContact CE2-CD1 3.9Å; F1027-L1031 HydrophobicContact CE2-CG 4.29Å; F1027-L1031 HydrophobicContact CZ-CD1 3.44Å; F1027-L1031 VanDerWaalsContact CZ-CD1 3.44Å; F1027-L1031 HydrophobicContact CZ-CG 4.31Å; F1027-L1031 WeakPolarHBondContact O-CG 3.42Å; F1027-L1031 PolarHBondContact O-N 2.9Å; F1027-L1031 VanDerWaalsContact O-N 3.07Å; F1027-M1041 HydrophobicContact CE2-CE 3.69Å; F1027-M1041 HydrophobicContact CE2-SD 3.47Å; F1027-M1041 WeakPolarHBondContact CE2-SD 3.4Å; F1027-M1041 HydrophobicContact CZ-CE 3.77Å; F1027-M1041 HydrophobicContact CZ-SD 3.57Å; F1027-M1041 VanDerWaalsContact CZ-SD 3.57Å
1028	L	90.1	Very high	90.7	Very high	37 Å²	37	50.8 Å²	50.8	19%	0.194	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-41.6	-179.8	-70.5	172.9	0	0	0	112	R1024 E1025 V1030 L1031 E1032	R1024-L1028 HydrophobicContact CG-CD1 4.01Å; R1024-L1028 WeakPolarHBondContact O-CB 3.44Å; R1024-L1028 VanDerWaalsContact O-CG 3.32Å; R1024-L1028 WeakPolarHBondContact O-CG 3.42Å; R1024-L1028 PolarHBondContact O-N 3.38Å; E1025-L1028 PolarHBondContact O-N 2.91Å; L1028-V1030 VanDerWaalsContact C-N 3.32Å; L1028-V1030 PolarHBondContact O-N 3.14Å; L1028-L1031 PolarHBondContact O-N 3.16Å; L1028-L1031 VanDerWaalsContact O-N 3.13Å; L1028-E1032 WeakPolarHBondContact O-CG 3.44Å; L1028-E1032 PolarHBondContact O-N 2.94Å
1029	S	90.9	Very high	90.2	Very high	45 Å²	45	55.9 Å²	55.9	32%	0.315	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-38.9	179	68.8	0	0	0	0	112.6	E1025 S1026 E1032 N1033	E1025-S1029 PolarHBondContact O-N 3.24Å; E1025-S1029 PolarHBondContact O-OG 2.9Å; S1026-S1029 PolarHBondContact O-OG 3.07Å; S1029-E1032 PolarHBondContact O-N 3.25Å; S1029-N1033 PolarHBondContact O-N 3.47Å
1030	V	90.5	Very high	89.7	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-71.6	-37.4	175.5	-175.9	0	0	0	0	111	F940 E943 V944 S1026 L1028 E1032 N1033 Y1034	F940-V1030 HydrophobicContact CD2-CG1 3.49Å; F940-V1030 VanDerWaalsContact CD2-CG1 3.49Å; F940-V1030 HydrophobicContact CE2-CG1 3.55Å; E943-V1030 HydrophobicContact CB-CG1 4.43Å; E943-V1030 HydrophobicContact CB-CG2 4.4Å; E943-V1030 HydrophobicContact CG-CG2 3.89Å; V944-V1030 HydrophobicContact CG2-CG1 3.88Å; S1026-V1030 VanDerWaalsContact O-CG2 3.25Å; S1026-V1030 WeakPolarHBondContact O-CG2 3.39Å; S1026-V1030 PolarHBondContact O-N 3.12Å; L1028-V1030 VanDerWaalsContact C-N 3.32Å; L1028-V1030 PolarHBondContact O-N 3.14Å; V1030-E1032 VanDerWaalsContact C-N 3.29Å; V1030-E1032 PolarHBondContact O-N 2.91Å; V1030-N1033 PolarHBondContact O-N 3.01Å; V1030-Y1034 HydrophobicContact CG1-CD2 3.96Å; V1030-Y1034 HydrophobicContact CG1-CE2 4.35Å; V1030-Y1034 WeakPolarHBondContact O-CD2 3.42Å; V1030-Y1034 PolarHBondContact O-N 3.17Å
1031	L	88.2	Confident	89.2	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-70.4	-21.3	176.4	-72.3	-168.8	0	0	0	114.2	F940 L1002 F1027 L1028 Y1034 M1037 R1038 M1041	F940-L1031 HydrophobicContact CE2-CD2 4.39Å; L1002-L1031 HydrophobicContact CD2-CD1 3.91Å; F1027-L1031 HydrophobicContact CD1-CD1 4.14Å; F1027-L1031 HydrophobicContact CD2-CD1 4.44Å; F1027-L1031 HydrophobicContact CE1-CD1 3.56Å; F1027-L1031 HydrophobicContact CE2-CD1 3.9Å; F1027-L1031 HydrophobicContact CE2-CG 4.29Å; F1027-L1031 HydrophobicContact CZ-CD1 3.44Å; F1027-L1031 VanDerWaalsContact CZ-CD1 3.44Å; F1027-L1031 HydrophobicContact CZ-CG 4.31Å; F1027-L1031 WeakPolarHBondContact O-CG 3.42Å; F1027-L1031 PolarHBondContact O-N 2.9Å; F1027-L1031 VanDerWaalsContact O-N 3.07Å; L1028-L1031 PolarHBondContact O-N 3.16Å; L1028-L1031 VanDerWaalsContact O-N 3.13Å; L1031-Y1034 CarbonylContact O-C 3.43Å; L1031-M1037 HydrophobicContact CD2-CB 4.46Å; L1031-R1038 HydrophobicContact CB-CB 4.23Å; L1031-R1038 HydrophobicContact CD1-CB 4.29Å; L1031-R1038 HydrophobicContact CD1-CG 4.22Å; L1031-R1038 HydrophobicContact CD2-CB 4.13Å; L1031-R1038 HydrophobicContact CG-CB 4.46Å; L1031-M1041 HydrophobicContact CD1-SD 4.36Å; L1031-M1041 HydrophobicContact CD2-SD 4.25Å
1032	E	89.4	Confident	88.7	Confident	145 Å²	145	58.2 Å²	58.2	68%	0.678	29%	0.286	S	S	*	.	H	α-helix	trans	-69.7	-40.9	168.7	-75.3	169.9	-166.5	0	0	111.5	L1028 S1029 V1030	L1028-E1032 WeakPolarHBondContact O-CG 3.44Å; L1028-E1032 PolarHBondContact O-N 2.94Å; S1029-E1032 PolarHBondContact O-N 3.25Å; V1030-E1032 VanDerWaalsContact C-N 3.29Å; V1030-E1032 PolarHBondContact O-N 2.91Å
1033	N	88.9	Confident	88.2	Confident	98 Å²	98	58.1 Å²	58.1	52%	0.524	29%	0.286	S	S	.	.	H	α-helix	trans	-66.3	-37.3	173.8	-69.3	-19.8	0	0	0	112.5	E943 S1029 V1030 P1035	E943-N1033 PolarHBondContact OE1-ND2 3.26Å; E943-N1033 VanDerWaalsContact OE1-ND2 3.12Å; E943-N1033 PolarHBondContact OE2-ND2 3.46Å; E943-N1033 VanDerWaalsContact OE2-ND2 3.13Å; S1029-N1033 PolarHBondContact O-N 3.47Å; V1030-N1033 PolarHBondContact O-N 3.01Å; N1033-P1035 VanDerWaalsContact C-CD 3.43Å; N1033-P1035 WeakPolarHBondContact O-CD 3.25Å
1034	Y	88.9	Confident	87.7	Confident	59 Å²	59	57.2 Å²	57.2	23%	0.231	28%	0.282	C	S	.	.			trans	-119.9	69	-173.3	-60.5	-86.9	0	0	0	113.2	D939 F940 E943 V1030 L1031 L1036 M1037 R1038	D939-Y1034 WeakPolarHBondContact CB-OH 3.38Å; F940-Y1034 HydrophobicContact CB-CD1 3.93Å; F940-Y1034 HydrophobicContact CB-CD2 3.97Å; F940-Y1034 HydrophobicContact CB-CE1 3.88Å; F940-Y1034 HydrophobicContact CB-CE2 3.92Å; F940-Y1034 HydrophobicContact CB-CG 3.97Å; F940-Y1034 AromaticContact CD2-CD2 3.59Å; F940-Y1034 HydrophobicContact CD2-CD2 3.59Å; F940-Y1034 HydrophobicContact CD2-CE2 4.24Å; F940-Y1034 AromaticContact CD2-CG 3.76Å; F940-Y1034 HydrophobicContact CD2-CG 3.76Å; F940-Y1034 HydrophobicContact CG-CD2 4.27Å; F940-Y1034 HydrophobicContact CG-CG 4.28Å; F940-Y1034 PolarHBondContact N-OH 3.46Å; E943-Y1034 WeakPolarHBondContact OE2-CE2 3.49Å; V1030-Y1034 HydrophobicContact CG1-CD2 3.96Å; V1030-Y1034 HydrophobicContact CG1-CE2 4.35Å; V1030-Y1034 WeakPolarHBondContact O-CD2 3.42Å; V1030-Y1034 PolarHBondContact O-N 3.17Å; L1031-Y1034 CarbonylContact O-C 3.43Å; Y1034-L1036 PolarHBondContact O-N 2.97Å; Y1034-L1036 VanDerWaalsContact O-N 3.11Å; Y1034-M1037 WeakPolarHBondContact O-CB 3.28Å; Y1034-M1037 PolarHBondContact O-N 2.92Å; Y1034-R1038 PolarHBondContact O-N 2.81Å
1035	P	86.4	Confident	87.4	Confident	80 Å²	80	53.6 Å²	53.6	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-67.6	-15.2	-173.4	27.4	-36.7	0	0	0	114.7	N1033	N1033-P1035 VanDerWaalsContact C-CD 3.43Å; N1033-P1035 WeakPolarHBondContact O-CD 3.25Å
1036	L	85.2	Confident	87	Confident	135 Å²	135	45.8 Å²	45.8	71%	0.707	23%	0.232	S	C	*	.	H	α-helix	trans	-67.7	-46.1	167.9	176.7	61.7	0	0	0	110.6	Y1034 R1038 R1039 T1040	Y1034-L1036 PolarHBondContact O-N 2.97Å; Y1034-L1036 VanDerWaalsContact O-N 3.11Å; L1036-R1038 VanDerWaalsContact C-N 3.29Å; L1036-R1038 PolarHBondContact O-N 3.22Å; L1036-R1039 PolarHBondContact O-N 3.25Å; L1036-R1039 VanDerWaalsContact O-N 3.17Å; L1036-T1040 PolarHBondContact O-N 3.39Å; L1036-T1040 PolarHBondContact O-OG1 3.31Å
1037	M	84.5	Confident	86.6	Confident	23 Å²	23	47.6 Å²	47.6	11%	0.113	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-34.9	-177.7	-162.6	57.6	68.5	0	0	111.7	F932 A936 F940 L1031 Y1034 R1039 T1040 M1041	F932-M1037 HydrophobicContact CD2-SD 3.9Å; F932-M1037 HydrophobicContact CE2-CG 3.55Å; F932-M1037 HydrophobicContact CE2-SD 3.24Å; F932-M1037 WeakPolarHBondContact CE2-SD 3.5Å; F932-M1037 HydrophobicContact CZ-CG 3.46Å; F932-M1037 VanDerWaalsContact CZ-CG 3.46Å; F932-M1037 HydrophobicContact CZ-SD 3.69Å; A936-M1037 HydrophobicContact CB-CE 3.48Å; A936-M1037 VanDerWaalsContact CB-CE 3.48Å; F940-M1037 HydrophobicContact CD1-CE 4.39Å; F940-M1037 HydrophobicContact CD1-CG 4.47Å; F940-M1037 HydrophobicContact CD2-CG 4.42Å; F940-M1037 HydrophobicContact CE1-CE 4.41Å; F940-M1037 HydrophobicContact CE1-CG 3.88Å; F940-M1037 HydrophobicContact CE2-CB 4.25Å; F940-M1037 HydrophobicContact CE2-CG 3.84Å; F940-M1037 HydrophobicContact CZ-CB 4.44Å; F940-M1037 HydrophobicContact CZ-CG 3.55Å; L1031-M1037 HydrophobicContact CD2-CB 4.46Å; Y1034-M1037 WeakPolarHBondContact O-CB 3.28Å; Y1034-M1037 PolarHBondContact O-N 2.92Å; M1037-R1039 VanDerWaalsContact C-N 3.32Å; M1037-R1039 PolarHBondContact O-N 3Å; M1037-T1040 WeakPolarHBondContact O-CB 3.04Å; M1037-T1040 PolarHBondContact O-N 2.88Å; M1037-M1041 PolarHBondContact O-N 2.9Å; M1037-M1041 VanDerWaalsContact O-N 3.08Å
1038	R	86.7	Confident	86.3	Confident	75 Å²	75	49.9 Å²	49.9	28%	0.283	25%	0.246	S	C	.	.	H	α-helix	trans	-53.4	-45.7	171.4	-179.7	170.5	175.5	121.6	20	112.4	L1031 Y1034 L1036 T1040 M1041 E1042	L1031-R1038 HydrophobicContact CB-CB 4.23Å; L1031-R1038 HydrophobicContact CD1-CB 4.29Å; L1031-R1038 HydrophobicContact CD1-CG 4.22Å; L1031-R1038 HydrophobicContact CD2-CB 4.13Å; L1031-R1038 HydrophobicContact CG-CB 4.46Å; Y1034-R1038 PolarHBondContact O-N 2.81Å; L1036-R1038 VanDerWaalsContact C-N 3.29Å; L1036-R1038 PolarHBondContact O-N 3.22Å; R1038-T1040 PolarHBondContact O-N 3.11Å; R1038-M1041 PolarHBondContact O-N 3.04Å; R1038-E1042 HydrophobicContact CG-CG 4.45Å; R1038-E1042 IonicContact CZ-OE1 3.18Å; R1038-E1042 VanDerWaalsContact CZ-OE1 3.26Å; R1038-E1042 IonicContact NE-OE1 3.05Å; R1038-E1042 PolarHBondContact NE-OE1 3.48Å; R1038-E1042 IonicContact NH2-OE1 2.7Å; R1038-E1042 PolarHBondContact NH2-OE1 3.25Å; R1038-E1042 WeakPolarHBondContact O-CG 3.23Å; R1038-E1042 PolarHBondContact O-N 3.02Å
1039	R	84.1	Confident	85.9	Confident	122 Å²	122	48.2 Å²	48.2	46%	0.46	24%	0.237	S	C	.	.	H	α-helix	trans	-64.2	-40.6	178	-62.3	-176.7	-165.9	-159.3	2.5	112.3	L1036 M1037 M1041 E1042 S1043 D1068	L1036-R1039 PolarHBondContact O-N 3.25Å; L1036-R1039 VanDerWaalsContact O-N 3.17Å; M1037-R1039 VanDerWaalsContact C-N 3.32Å; M1037-R1039 PolarHBondContact O-N 3Å; R1039-M1041 VanDerWaalsContact C-N 3.28Å; R1039-M1041 PolarHBondContact O-N 3Å; R1039-E1042 PolarHBondContact O-N 3.17Å; R1039-S1043 WeakPolarHBondContact O-CB 3.34Å; R1039-S1043 PolarHBondContact O-N 2.91Å; R1039-D1068 IonicContact NH1-OD2 2.8Å
1040	T	84.4	Confident	85.5	Confident	50 Å²	50	50.9 Å²	50.9	31%	0.307	25%	0.248	S	C	.	.	H	α-helix	trans	-57.9	-43.5	175.2	-49.3	0	0	0	0	110.8	L1036 M1037 R1038 S1043 V1044	L1036-T1040 PolarHBondContact O-N 3.39Å; L1036-T1040 PolarHBondContact O-OG1 3.31Å; M1037-T1040 WeakPolarHBondContact O-CB 3.04Å; M1037-T1040 PolarHBondContact O-N 2.88Å; R1038-T1040 PolarHBondContact O-N 3.11Å; T1040-S1043 PolarHBondContact O-N 3.4Å; T1040-V1044 WeakPolarHBondContact O-CG2 3.28Å; T1040-V1044 PolarHBondContact O-N 3.46Å
1041	M	84	Confident	85	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-39.5	176.5	-59.8	-163.1	80.5	0	0	113.1	F932 M969 Y995 E998 L1002 F1027 L1031 M1037 R1038 R1039 S1043 V1044 A1045	F932-M1041 HydrophobicContact CD2-CG 4.21Å; F932-M1041 HydrophobicContact CE1-CE 4.49Å; F932-M1041 HydrophobicContact CE1-SD 4.22Å; F932-M1041 HydrophobicContact CE2-CE 4.41Å; F932-M1041 HydrophobicContact CE2-CG 3.28Å; F932-M1041 HydrophobicContact CE2-SD 3.77Å; F932-M1041 HydrophobicContact CZ-CE 4.11Å; F932-M1041 HydrophobicContact CZ-CG 3.61Å; F932-M1041 HydrophobicContact CZ-SD 3.39Å; F932-M1041 WeakPolarHBondContact CZ-SD 3.38Å; M969-M1041 HydrophobicContact CE-CE 4.16Å; M969-M1041 HydrophobicContact SD-CE 4.31Å; Y995-M1041 HydrophobicContact CE2-CE 4.21Å; E998-M1041 HydrophobicContact CB-CE 4.13Å; L1002-M1041 HydrophobicContact CD1-CB 4.01Å; F1027-M1041 HydrophobicContact CE2-CE 3.69Å; F1027-M1041 HydrophobicContact CE2-SD 3.47Å; F1027-M1041 WeakPolarHBondContact CE2-SD 3.4Å; F1027-M1041 HydrophobicContact CZ-CE 3.77Å; F1027-M1041 HydrophobicContact CZ-SD 3.57Å; F1027-M1041 VanDerWaalsContact CZ-SD 3.57Å; L1031-M1041 HydrophobicContact CD1-SD 4.36Å; L1031-M1041 HydrophobicContact CD2-SD 4.25Å; M1037-M1041 PolarHBondContact O-N 2.9Å; M1037-M1041 VanDerWaalsContact O-N 3.08Å; R1038-M1041 PolarHBondContact O-N 3.04Å; R1039-M1041 VanDerWaalsContact C-N 3.28Å; R1039-M1041 PolarHBondContact O-N 3Å; M1041-S1043 VanDerWaalsContact C-N 3.33Å; M1041-S1043 PolarHBondContact O-N 2.94Å; M1041-V1044 PolarHBondContact O-N 2.85Å; M1041-A1045 VanDerWaalsContact O-CB 3.25Å; M1041-A1045 WeakPolarHBondContact O-CB 3.49Å; M1041-A1045 PolarHBondContact O-N 3.17Å
1042	E	85.3	Confident	84.4	Confident	21 Å²	21	60.6 Å²	60.6	10%	0.098	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-39.3	174.6	-72.6	175	-178.9	0	0	111.5	L1002 R1038 R1039 A1046 V1059	L1002-E1042 HydrophobicContact CD1-CG 4.18Å; L1002-E1042 HydrophobicContact CD2-CG 4.22Å; R1038-E1042 HydrophobicContact CG-CG 4.45Å; R1038-E1042 IonicContact CZ-OE1 3.18Å; R1038-E1042 VanDerWaalsContact CZ-OE1 3.26Å; R1038-E1042 IonicContact NE-OE1 3.05Å; R1038-E1042 PolarHBondContact NE-OE1 3.48Å; R1038-E1042 IonicContact NH2-OE1 2.7Å; R1038-E1042 PolarHBondContact NH2-OE1 3.25Å; R1038-E1042 WeakPolarHBondContact O-CG 3.23Å; R1038-E1042 PolarHBondContact O-N 3.02Å; R1039-E1042 PolarHBondContact O-N 3.17Å; E1042-A1046 WeakPolarHBondContact O-CB 3.34Å; E1042-A1046 PolarHBondContact O-N 2.87Å; E1042-V1059 HydrophobicContact CB-CG1 3.88Å; E1042-V1059 HydrophobicContact CG-CG1 3.99Å
1043	S	83.2	Confident	83.5	Confident	1 Å²	1	57 Å²	57	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-47.2	174.4	-173.3	0	0	0	0	112.5	R1039 T1040 M1041 A1046 E1047	R1039-S1043 WeakPolarHBondContact O-CB 3.34Å; R1039-S1043 PolarHBondContact O-N 2.91Å; T1040-S1043 PolarHBondContact O-N 3.4Å; M1041-S1043 VanDerWaalsContact C-N 3.33Å; M1041-S1043 PolarHBondContact O-N 2.94Å; S1043-A1046 PolarHBondContact O-N 3.03Å; S1043-E1047 PolarHBondContact O-N 2.93Å
1044	V	84.1	Confident	82.6	Confident	29 Å²	29	54.9 Å²	54.9	18%	0.176	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-37	178.4	173.9	0	0	0	0	111.4	T1040 M1041 E1047 R1048	T1040-V1044 WeakPolarHBondContact O-CG2 3.28Å; T1040-V1044 PolarHBondContact O-N 3.46Å; M1041-V1044 PolarHBondContact O-N 2.85Å; V1044-E1047 PolarHBondContact O-N 2.86Å; V1044-R1048 HydrophobicContact CG1-CG 4.38Å; V1044-R1048 WeakPolarHBondContact O-CB 3.2Å; V1044-R1048 VanDerWaalsContact O-CG 3.27Å; V1044-R1048 WeakPolarHBondContact O-CG 3.22Å; V1044-R1048 PolarHBondContact O-N 3.22Å
1045	A	85.4	Confident	81.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-40.4	173.7	0	0	0	0	0	112.1	I999 L1002 M1041 R1048 L1049 V1059	I999-A1045 HydrophobicContact CG1-CB 4.01Å; L1002-A1045 HydrophobicContact CD1-CB 3.97Å; M1041-A1045 VanDerWaalsContact O-CB 3.25Å; M1041-A1045 WeakPolarHBondContact O-CB 3.49Å; M1041-A1045 PolarHBondContact O-N 3.17Å; A1045-R1048 PolarHBondContact O-N 3.41Å; A1045-L1049 WeakPolarHBondContact O-CG 3.42Å; A1045-L1049 PolarHBondContact O-N 3.26Å; A1045-V1059 HydrophobicContact CB-CG1 4.16Å; A1045-V1059 HydrophobicContact CB-CG2 4.16Å
1046	A	83.8	Confident	80.6	Confident	1 Å²	1	56 Å²	56	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-66.4	-40.5	175.9	0	0	0	0	0	112.2	E1042 S1043 L1049 N1050 P1056 V1059 L1065	E1042-A1046 WeakPolarHBondContact O-CB 3.34Å; E1042-A1046 PolarHBondContact O-N 2.87Å; S1043-A1046 PolarHBondContact O-N 3.03Å; A1046-L1049 PolarHBondContact O-N 3Å; A1046-N1050 PolarHBondContact O-N 2.94Å; A1046-N1050 VanDerWaalsContact O-N 3.11Å; A1046-P1056 HydrophobicContact CB-CB 4.14Å; A1046-V1059 HydrophobicContact CB-CB 4.48Å; A1046-V1059 HydrophobicContact CB-CG2 4.17Å; A1046-L1065 HydrophobicContact CB-CD2 4.18Å
1047	E	83.5	Confident	79.6	Confident	62 Å²	62	52.5 Å²	52.5	29%	0.29	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-43.9	173.9	-163.9	-155.5	133.6	0	0	111.9	S1043 V1044 N1050 K1051 L1069	S1043-E1047 PolarHBondContact O-N 2.93Å; V1044-E1047 PolarHBondContact O-N 2.86Å; E1047-N1050 WeakPolarHBondContact O-CB 3.29Å; E1047-N1050 PolarHBondContact O-N 3.22Å; E1047-K1051 PolarHBondContact O-N 3.47Å; E1047-K1051 VanDerWaalsContact OE1-CE 3.23Å; E1047-K1051 WeakPolarHBondContact OE1-CE 3.37Å; E1047-K1051 IonicContact OE1-NZ 2.72Å; E1047-K1051 PolarHBondContact OE1-NZ 2.63Å; E1047-L1069 HydrophobicContact CB-CD1 4.31Å
1048	R	84.6	Confident	78.6	Confident	58 Å²	58	55.1 Å²	55.1	22%	0.219	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-40	178.1	-74.5	171.9	171	-152.4	-6.7	112.6	Y995 E998 I999 V1044 A1045 K1051 I1052	Y995-R1048 PolarHBondContact O-NH1 2.78Å; Y995-R1048 PolarHBondContact O-NH2 3.28Å; E998-R1048 WeakPolarHBondContact OE1-CD 3.48Å; E998-R1048 IonicContact OE1-CZ 3.26Å; E998-R1048 IonicContact OE1-NE 2.74Å; E998-R1048 IonicContact OE1-NH1 2.88Å; E998-R1048 PolarHBondContact OE1-NH1 3Å; E998-R1048 IonicContact OE2-NH1 3.56Å; E998-R1048 PolarHBondContact OE2-NH1 3.01Å; I999-R1048 HydrophobicContact CD1-CB 4.26Å; V1044-R1048 HydrophobicContact CG1-CG 4.38Å; V1044-R1048 WeakPolarHBondContact O-CB 3.2Å; V1044-R1048 VanDerWaalsContact O-CG 3.27Å; V1044-R1048 WeakPolarHBondContact O-CG 3.22Å; V1044-R1048 PolarHBondContact O-N 3.22Å; A1045-R1048 PolarHBondContact O-N 3.41Å; R1048-K1051 PolarHBondContact O-N 3.26Å; R1048-I1052 WeakPolarHBondContact O-CD1 3.36Å; R1048-I1052 WeakPolarHBondContact O-CG1 3.19Å; R1048-I1052 PolarHBondContact O-N 3.42Å
1049	L	81.9	Confident	77.4	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-44.1	173.3	-78.7	166.5	0	0	0	112.2	I999 T1008 A1045 A1046 K1051 I1052 G1053 Q1054 I1058 V1059	I999-L1049 HydrophobicContact CD1-CD2 4.34Å; I999-L1049 HydrophobicContact CD1-CG 4.19Å; I999-L1049 HydrophobicContact CG2-CD1 4.12Å; I999-L1049 HydrophobicContact CG2-CD2 4.16Å; I999-L1049 HydrophobicContact CG2-CG 4.22Å; T1008-L1049 HydrophobicContact CG2-CD2 4.02Å; A1045-L1049 WeakPolarHBondContact O-CG 3.42Å; A1045-L1049 PolarHBondContact O-N 3.26Å; A1046-L1049 PolarHBondContact O-N 3Å; L1049-K1051 VanDerWaalsContact C-N 3.32Å; L1049-K1051 PolarHBondContact O-N 3.31Å; L1049-I1052 CarbonylContact O-C 3.4Å; L1049-I1052 WeakPolarHBondContact O-CA 3.33Å; L1049-I1052 PolarHBondContact O-N 2.83Å; L1049-G1053 PolarHBondContact O-N 2.93Å; L1049-G1053 VanDerWaalsContact O-N 3.16Å; L1049-Q1054 CarbonylContact C-O 3.53Å; L1049-Q1054 HydrophobicContact CB-CB 4.38Å; L1049-Q1054 HydrophobicContact CD2-CB 3.81Å; L1049-Q1054 PolarHBondContact O-N 2.72Å; L1049-I1058 HydrophobicContact CD1-CB 4.49Å; L1049-V1059 HydrophobicContact CD1-CG2 3.33Å
1050	N	82	Confident	76.2	Confident	102 Å²	102	47.4 Å²	47.4	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-60.4	-41.8	177.6	-167	18.3	0	0	0	111.4	A1046 E1047 I1052 G1053	A1046-N1050 PolarHBondContact O-N 2.94Å; A1046-N1050 VanDerWaalsContact O-N 3.11Å; E1047-N1050 WeakPolarHBondContact O-CB 3.29Å; E1047-N1050 PolarHBondContact O-N 3.22Å; N1050-I1052 PolarHBondContact O-N 3.42Å; N1050-G1053 PolarHBondContact O-N 3.47Å
1051	K	79.5	Confident	74.7	Confident	159 Å²	159	52.5 Å²	52.5	69%	0.691	29%	0.291	S	S	*	.	H	α-helix	trans	-62.8	-23.8	172.9	-76.7	172.4	167	171.2	0	114.3	E1047 R1048 L1049	E1047-K1051 PolarHBondContact O-N 3.47Å; E1047-K1051 VanDerWaalsContact OE1-CE 3.23Å; E1047-K1051 WeakPolarHBondContact OE1-CE 3.37Å; E1047-K1051 IonicContact OE1-NZ 2.72Å; E1047-K1051 PolarHBondContact OE1-NZ 2.63Å; R1048-K1051 PolarHBondContact O-N 3.26Å; L1049-K1051 VanDerWaalsContact C-N 3.32Å; L1049-K1051 PolarHBondContact O-N 3.31Å
1052	I	76	Confident	73.4	Confident	50 Å²	50	58.5 Å²	58.5	26%	0.256	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	6.3	176.5	-60.5	163.9	0	0	0	110.9	R1048 L1049 N1050 Q1054	R1048-I1052 WeakPolarHBondContact O-CD1 3.36Å; R1048-I1052 WeakPolarHBondContact O-CG1 3.19Å; R1048-I1052 PolarHBondContact O-N 3.42Å; L1049-I1052 CarbonylContact O-C 3.4Å; L1049-I1052 WeakPolarHBondContact O-CA 3.33Å; L1049-I1052 PolarHBondContact O-N 2.83Å; N1050-I1052 PolarHBondContact O-N 3.42Å; I1052-Q1054 VanDerWaalsContact C-N 3.28Å; I1052-Q1054 HydrophobicContact CG2-CG 4.33Å; I1052-Q1054 PolarHBondContact O-N 3.32Å
1053	G	71	Confident	71.7	Confident	71 Å²	71	66.2 Å²	66.2	73%	0.732	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	19.4	-179.7	0	0	0	0	0	114.3	L1049 N1050	L1049-G1053 PolarHBondContact O-N 2.93Å; L1049-G1053 VanDerWaalsContact O-N 3.16Å; N1050-G1053 PolarHBondContact O-N 3.47Å
1054	Q	70.7	Confident	70.4	Confident	52 Å²	52	69 Å²	69	24%	0.243	36%	0.364	C	S	.	.			trans	-104.1	145.9	179.1	-64.6	-177	24.1	0	0	111.2	T1008 L1049 I1052 P1056	T1008-Q1054 PolarHBondContact O-NE2 2.92Å; T1008-Q1054 VanDerWaalsContact O-NE2 3.12Å; L1049-Q1054 CarbonylContact C-O 3.53Å; L1049-Q1054 HydrophobicContact CB-CB 4.38Å; L1049-Q1054 HydrophobicContact CD2-CB 3.81Å; L1049-Q1054 PolarHBondContact O-N 2.72Å; I1052-Q1054 VanDerWaalsContact C-N 3.28Å; I1052-Q1054 HydrophobicContact CG2-CG 4.33Å; I1052-Q1054 PolarHBondContact O-N 3.32Å; Q1054-P1056 WeakPolarHBondContact O-CD 3.46Å
1055	N	66.2	Low	69.1	Low	116 Å²	116	69 Å²	69	62%	0.62	36%	0.363	S	S	*	.			trans	-59.4	117.3	-174.8	-74	-25.9	0	0	0	111.8	S1057 I1058	N1055-S1057 PolarHBondContact O-N 3.41Å; N1055-I1058 HydrophobicContact CB-CD1 4.19Å; N1055-I1058 HydrophobicContact CB-CG1 4.34Å; N1055-I1058 WeakPolarHBondContact O-CB 3.5Å; N1055-I1058 WeakPolarHBondContact O-CD1 3.14Å; N1055-I1058 VanDerWaalsContact O-CG1 3.28Å; N1055-I1058 WeakPolarHBondContact O-CG1 3.38Å; N1055-I1058 PolarHBondContact O-N 3.18Å
1056	P	67.2	Low	67.8	Low	48 Å²	48	77.6 Å²	77.6	31%	0.312	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-68.9	-18.9	-175.6	26.5	-34.6	0	0	0	113.6	A1046 Q1054 I1058 V1059	A1046-P1056 HydrophobicContact CB-CB 4.14Å; Q1054-P1056 WeakPolarHBondContact O-CD 3.46Å; P1056-I1058 PolarHBondContact O-N 2.93Å; P1056-I1058 VanDerWaalsContact O-N 3.13Å; P1056-V1059 PolarHBondContact O-N 3.47Å
1057	S	62.7	Low	66.5	Low	61 Å²	61	83.9 Å²	83.9	43%	0.427	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-60.4	-17.5	174	48.3	0	0	0	0	114	N1055 V1059 S1060 N1061	N1055-S1057 PolarHBondContact O-N 3.41Å; S1057-V1059 PolarHBondContact O-N 2.99Å; S1057-S1060 CarbonylContact O-C 3.59Å; S1057-S1060 PolarHBondContact O-N 3.25Å; S1057-N1061 PolarHBondContact O-OD1 2.73Å
1058	I	64.5	Low	65.4	Low	78 Å²	78	83.2 Å²	83.2	40%	0.4	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-61.1	-23.8	175.7	-63.9	169.9	0	0	0	112	T1003 T1005 L1049 N1055 P1056	T1003-I1058 HydrophobicContact CG2-CG2 4.07Å; T1005-I1058 HydrophobicContact CG2-CG2 3.77Å; L1049-I1058 HydrophobicContact CD1-CB 4.49Å; N1055-I1058 HydrophobicContact CB-CD1 4.19Å; N1055-I1058 HydrophobicContact CB-CG1 4.34Å; N1055-I1058 WeakPolarHBondContact O-CB 3.5Å; N1055-I1058 WeakPolarHBondContact O-CD1 3.14Å; N1055-I1058 VanDerWaalsContact O-CG1 3.28Å; N1055-I1058 WeakPolarHBondContact O-CG1 3.38Å; N1055-I1058 PolarHBondContact O-N 3.18Å; P1056-I1058 PolarHBondContact O-N 2.93Å; P1056-I1058 VanDerWaalsContact O-N 3.13Å
1059	V	61.7	Low	64.1	Low	16 Å²	16	83.1 Å²	83.1	10%	0.097	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-38.8	176.8	-163.1	0	0	0	0	112.8	T1003 E1042 A1045 A1046 L1049 P1056 S1057	T1003-V1059 HydrophobicContact CG2-CB 4.38Å; T1003-V1059 HydrophobicContact CG2-CG1 4.48Å; T1003-V1059 HydrophobicContact CG2-CG2 4.02Å; E1042-V1059 HydrophobicContact CB-CG1 3.88Å; E1042-V1059 HydrophobicContact CG-CG1 3.99Å; A1045-V1059 HydrophobicContact CB-CG1 4.16Å; A1045-V1059 HydrophobicContact CB-CG2 4.16Å; A1046-V1059 HydrophobicContact CB-CB 4.48Å; A1046-V1059 HydrophobicContact CB-CG2 4.17Å; L1049-V1059 HydrophobicContact CD1-CG2 3.33Å; P1056-V1059 PolarHBondContact O-N 3.47Å; S1057-V1059 PolarHBondContact O-N 2.99Å
1060	S	59.3	Low	63	Low	18 Å²	18	86.5 Å²	86.5	13%	0.126	46%	0.455	C	S	.	.			trans	-158.7	120.5	-174.6	-137.5	0	0	0	0	111.1	S1057 R1062	S1057-S1060 CarbonylContact O-C 3.59Å; S1057-S1060 PolarHBondContact O-N 3.25Å; S1060-R1062 PolarHBondContact O-N 3.27Å; S1060-R1062 VanDerWaalsContact O-N 3.11Å; S1060-R1062 VanDerWaalsContact OG-CD 3.26Å; S1060-R1062 WeakPolarHBondContact OG-CD 3.49Å; S1060-R1062 WeakPolarHBondContact OG-CG 3.31Å
1061	N	51.8	Low	62.1	Low	158 Å²	158	84.3 Å²	84.3	85%	0.845	44%	0.443	S	S	*	.			trans	-80	30	170.7	-74.2	-32.3	0	0	0	112.3	S1057	S1057-N1061 PolarHBondContact O-OD1 2.73Å
1062	R	56.5	Low	61.1	Low	127 Å²	127	78 Å²	78	48%	0.479	42%	0.418	S	S	.	.			trans	-94.3	128.7	-175.9	-60.9	178.8	77.5	112.1	10.8	109.9	S1060 D1064 L1065	S1060-R1062 PolarHBondContact O-N 3.27Å; S1060-R1062 VanDerWaalsContact O-N 3.11Å; S1060-R1062 VanDerWaalsContact OG-CD 3.26Å; S1060-R1062 WeakPolarHBondContact OG-CD 3.49Å; S1060-R1062 WeakPolarHBondContact OG-CG 3.31Å; R1062-D1064 HydrophobicContact CB-CB 4.04Å; R1062-D1064 IonicContact CZ-OD2 2.72Å; R1062-D1064 IonicContact NE-OD2 3.56Å; R1062-D1064 PolarHBondContact NE-OD2 3.35Å; R1062-D1064 IonicContact NH2-OD2 3.28Å; R1062-D1064 PolarHBondContact NH2-OD2 3.17Å; R1062-D1064 PolarHBondContact O-N 3.34Å; R1062-L1065 WeakPolarHBondContact O-CB 3.48Å; R1062-L1065 PolarHBondContact O-N 3.47Å
1063	E	50	Low	60.1	Low	182 Å²	182	83.2 Å²	83.2	85%	0.85	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-35	170.7	-60.7	-178.2	141.7	0	0	110.3	L1065 K1066	E1063-L1065 PolarHBondContact O-N 3.48Å; E1063-K1066 PolarHBondContact O-N 3.16Å
1064	D	57	Low	59.2	Low	61 Å²	61	86 Å²	86	33%	0.326	43%	0.433	S	S	.	.	H	α-helix	trans	-44.5	-33.2	169.5	-34.6	6.7	0	0	0	113.4	R1062 K1066 E1067 D1068	R1062-D1064 HydrophobicContact CB-CB 4.04Å; R1062-D1064 IonicContact CZ-OD2 2.72Å; R1062-D1064 IonicContact NE-OD2 3.56Å; R1062-D1064 PolarHBondContact NE-OD2 3.35Å; R1062-D1064 IonicContact NH2-OD2 3.28Å; R1062-D1064 PolarHBondContact NH2-OD2 3.17Å; R1062-D1064 PolarHBondContact O-N 3.34Å; D1064-K1066 PolarHBondContact O-N 2.98Å; D1064-E1067 PolarHBondContact O-N 3.46Å; D1064-D1068 PolarHBondContact O-N 3.39Å
1065	L	56.4	Low	58.5	Low	27 Å²	27	86.7 Å²	86.7	14%	0.141	44%	0.437	C	S	.	.	H	α-helix	trans	-63.6	-28.4	-171.2	-167.7	72.1	0	0	0	112.1	A1046 R1062 E1063 L1069	A1046-L1065 HydrophobicContact CB-CD2 4.18Å; R1062-L1065 WeakPolarHBondContact O-CB 3.48Å; R1062-L1065 PolarHBondContact O-N 3.47Å; E1063-L1065 PolarHBondContact O-N 3.48Å; L1065-L1069 WeakPolarHBondContact O-CB 3.45Å; L1065-L1069 PolarHBondContact O-N 3.1Å
1066	K	56.9	Low	57.9	Low	181 Å²	181	84.8 Å²	84.8	79%	0.787	43%	0.43	S	S	*	.	H	α-helix	trans	-68.8	-39.1	173.9	-87.1	-174.5	174.3	179.1	0	112.3	E1063 D1064 S1070	E1063-K1066 PolarHBondContact O-N 3.16Å; D1064-K1066 PolarHBondContact O-N 2.98Å; K1066-S1070 WeakPolarHBondContact O-CB 3.17Å; K1066-S1070 PolarHBondContact O-N 3Å; K1066-S1070 VanDerWaalsContact O-N 3.1Å; K1066-S1070 PolarHBondContact O-OG 3.47Å
1067	E	58.2	Low	56.7	Low	134 Å²	134	86.1 Å²	86.1	63%	0.626	44%	0.44	S	S	*	.	H	α-helix	trans	-70	-51	177.4	-62.2	-170.1	174.7	0	0	110.4	D1064 L1069 S1070 L1071	D1064-E1067 PolarHBondContact O-N 3.46Å; E1067-L1069 VanDerWaalsContact C-N 3.34Å; E1067-L1069 PolarHBondContact O-N 3.36Å; E1067-S1070 PolarHBondContact O-N 3.06Å; E1067-S1070 VanDerWaalsContact O-N 3.13Å; E1067-S1070 PolarHBondContact O-OG 2.95Å; E1067-L1071 WeakPolarHBondContact O-CB 3.1Å; E1067-L1071 PolarHBondContact O-N 3.48Å
1068	D	59.7	Low	55.8	Low	47 Å²	47	87 Å²	87	25%	0.251	45%	0.446	S	S	.	.	H	α-helix	trans	-61.3	-40	178.7	-84.2	-9.1	0	0	0	111.2	R1039 D1064 S1070 L1071 V1072	R1039-D1068 IonicContact NH1-OD2 2.8Å; D1064-D1068 PolarHBondContact O-N 3.39Å; D1068-S1070 PolarHBondContact O-N 2.84Å; D1068-L1071 PolarHBondContact O-N 3.37Å; D1068-V1072 WeakPolarHBondContact O-CB 3.24Å; D1068-V1072 WeakPolarHBondContact O-CG2 3.4Å; D1068-V1072 PolarHBondContact O-N 2.99Å
1069	L	57.5	Low	54.8	Low	56 Å²	56	85.8 Å²	85.8	29%	0.293	45%	0.448	S	S	.	.	H	α-helix	trans	-66.3	-36.2	175.5	-169.2	76.8	0	0	0	112.1	E1047 L1065 E1067 K1073	E1047-L1069 HydrophobicContact CB-CD1 4.31Å; L1065-L1069 WeakPolarHBondContact O-CB 3.45Å; L1065-L1069 PolarHBondContact O-N 3.1Å; E1067-L1069 VanDerWaalsContact C-N 3.34Å; E1067-L1069 PolarHBondContact O-N 3.36Å; L1069-K1073 VanDerWaalsContact O-CB 3.25Å; L1069-K1073 WeakPolarHBondContact O-CB 3.45Å; L1069-K1073 PolarHBondContact O-N 3Å
1070	S	58.8	Low	53.6	Low	73 Å²	73	89.7 Å²	89.7	51%	0.51	47%	0.471	S	S	.	.	H	α-helix	trans	-66.5	-40.2	175.4	73.2	0	0	0	0	112	K1066 E1067 D1068 K1073 E1074	K1066-S1070 WeakPolarHBondContact O-CB 3.17Å; K1066-S1070 PolarHBondContact O-N 3Å; K1066-S1070 VanDerWaalsContact O-N 3.1Å; K1066-S1070 PolarHBondContact O-OG 3.47Å; E1067-S1070 PolarHBondContact O-N 3.06Å; E1067-S1070 VanDerWaalsContact O-N 3.13Å; E1067-S1070 PolarHBondContact O-OG 2.95Å; D1068-S1070 PolarHBondContact O-N 2.84Å; S1070-K1073 WeakPolarHBondContact O-CB 3.5Å; S1070-K1073 PolarHBondContact O-N 2.79Å; S1070-E1074 PolarHBondContact O-N 3.2Å
1071	L	62.9	Low	52.3	Low	55 Å²	55	94.5 Å²	94.5	29%	0.288	50%	0.5	S	S	.	.	H	α-helix	trans	-76.8	-35	-177.8	-163.3	150.9	0	0	0	111.8	E1067 D1068 K1073 E1074 I1075	E1067-L1071 WeakPolarHBondContact O-CB 3.1Å; E1067-L1071 PolarHBondContact O-N 3.48Å; D1068-L1071 PolarHBondContact O-N 3.37Å; L1071-K1073 VanDerWaalsContact C-N 3.34Å; L1071-E1074 PolarHBondContact O-N 3.36Å; L1071-I1075 HydrophobicContact CD2-CD1 3.66Å; L1071-I1075 HydrophobicContact CD2-CG1 4.39Å; L1071-I1075 WeakPolarHBondContact O-CG1 3.38Å; L1071-I1075 PolarHBondContact O-N 3.44Å
1072	V	57.7	Low	51.4	Low	27 Å²	27	92.7 Å²	92.7	16%	0.164	50%	0.497	C	S	.	.	H	α-helix	trans	-64.7	-40.2	167.5	169.8	0	0	0	0	110.5	D1068 E1074 I1075 V1076	D1068-V1072 WeakPolarHBondContact O-CB 3.24Å; D1068-V1072 WeakPolarHBondContact O-CG2 3.4Å; D1068-V1072 PolarHBondContact O-N 2.99Å; V1072-E1074 VanDerWaalsContact C-N 3.34Å; V1072-E1074 PolarHBondContact O-N 2.99Å; V1072-I1075 PolarHBondContact O-N 3.02Å; V1072-V1076 HydrophobicContact CG1-CG2 4.22Å; V1072-V1076 WeakPolarHBondContact O-CB 3.37Å; V1072-V1076 VanDerWaalsContact O-CG2 3.29Å; V1072-V1076 WeakPolarHBondContact O-CG2 3.26Å; V1072-V1076 PolarHBondContact O-N 3.03Å
1073	K	54.5	Low	50.1	Low	160 Å²	160	95.7 Å²	95.7	70%	0.696	52%	0.517	S	S	*	.	H	α-helix	trans	-63.8	-39	176.4	-162.7	176	-172.8	-176.1	0	111.9	L1069 S1070 L1071 V1076 S1077	L1069-K1073 VanDerWaalsContact O-CB 3.25Å; L1069-K1073 WeakPolarHBondContact O-CB 3.45Å; L1069-K1073 PolarHBondContact O-N 3Å; S1070-K1073 WeakPolarHBondContact O-CB 3.5Å; S1070-K1073 PolarHBondContact O-N 2.79Å; L1071-K1073 VanDerWaalsContact C-N 3.34Å; K1073-V1076 PolarHBondContact O-N 3.09Å; K1073-S1077 WeakPolarHBondContact O-CB 3.48Å; K1073-S1077 PolarHBondContact O-N 3.11Å; K1073-S1077 PolarHBondContact O-OG 3.23Å
1074	E	53.4	Low	49.1	Very low	129 Å²	129	94.6 Å²	94.6	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-62.3	-47.2	173.2	-173.3	178.4	-157.6	0	0	112	S1070 L1071 V1072 S1077 S1078	S1070-E1074 PolarHBondContact O-N 3.2Å; L1071-E1074 PolarHBondContact O-N 3.36Å; V1072-E1074 VanDerWaalsContact C-N 3.34Å; V1072-E1074 PolarHBondContact O-N 2.99Å; E1074-S1077 WeakPolarHBondContact CA-OG 3.49Å; E1074-S1077 PolarHBondContact O-N 2.99Å; E1074-S1077 PolarHBondContact O-OG 2.6Å; E1074-S1078 WeakPolarHBondContact O-CB 3.37Å; E1074-S1078 PolarHBondContact O-N 3.16Å; E1074-S1078 PolarHBondContact O-OG 3.14Å
1075	I	56.6	Low	48.1	Very low	67 Å²	67	97.9 Å²	97.9	34%	0.344	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-41.6	175.5	-70	170.6	0	0	0	111.6	L1071 V1072 S1078 A1079	L1071-I1075 HydrophobicContact CD2-CD1 3.66Å; L1071-I1075 HydrophobicContact CD2-CG1 4.39Å; L1071-I1075 WeakPolarHBondContact O-CG1 3.38Å; L1071-I1075 PolarHBondContact O-N 3.44Å; V1072-I1075 PolarHBondContact O-N 3.02Å; I1075-S1078 WeakPolarHBondContact CA-OG 3.18Å; I1075-S1078 PolarHBondContact O-N 3.36Å; I1075-S1078 PolarHBondContact O-OG 3.12Å; I1075-A1079 WeakPolarHBondContact O-CB 3.48Å; I1075-A1079 PolarHBondContact O-N 3.02Å; I1075-A1079 VanDerWaalsContact O-N 3.1Å
1076	V	52.6	Low	46.8	Very low	75 Å²	75	101.9 Å²	101.9	46%	0.455	58%	0.575	S	S	.	*	H	α-helix	trans	-70.3	-39.7	178.3	172	0	0	0	0	111	V1072 K1073 S1078 A1079 V1080	V1072-V1076 HydrophobicContact CG1-CG2 4.22Å; V1072-V1076 WeakPolarHBondContact O-CB 3.37Å; V1072-V1076 VanDerWaalsContact O-CG2 3.29Å; V1072-V1076 WeakPolarHBondContact O-CG2 3.26Å; V1072-V1076 PolarHBondContact O-N 3.03Å; K1073-V1076 PolarHBondContact O-N 3.09Å; V1076-S1078 VanDerWaalsContact C-N 3.3Å; V1076-S1078 PolarHBondContact O-N 3.5Å; V1076-A1079 PolarHBondContact O-N 2.83Å; V1076-V1080 WeakPolarHBondContact O-CG2 3.3Å; V1076-V1080 PolarHBondContact O-N 3.49Å
1077	S	41.9	Very low	45.7	Very low	76 Å²	76	99.1 Å²	99.1	53%	0.531	58%	0.578	S	S	.	*	H	α-helix	trans	-67.2	-29	174.9	58.6	0	0	0	0	113.6	K1073 E1074 A1079	K1073-S1077 WeakPolarHBondContact O-CB 3.48Å; K1073-S1077 PolarHBondContact O-N 3.11Å; K1073-S1077 PolarHBondContact O-OG 3.23Å; E1074-S1077 WeakPolarHBondContact CA-OG 3.49Å; E1074-S1077 PolarHBondContact O-N 2.99Å; E1074-S1077 PolarHBondContact O-OG 2.6Å; S1077-A1079 VanDerWaalsContact C-N 3.34Å
1078	S	43.3	Very low	44.5	Very low	79 Å²	79	96.3 Å²	96.3	55%	0.552	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-4.4	174.2	50.7	0	0	0	0	113.8	E1074 I1075 V1076	E1074-S1078 WeakPolarHBondContact O-CB 3.37Å; E1074-S1078 PolarHBondContact O-N 3.16Å; E1074-S1078 PolarHBondContact O-OG 3.14Å; I1075-S1078 WeakPolarHBondContact CA-OG 3.18Å; I1075-S1078 PolarHBondContact O-N 3.36Å; I1075-S1078 PolarHBondContact O-OG 3.12Å; V1076-S1078 VanDerWaalsContact C-N 3.3Å; V1076-S1078 PolarHBondContact O-N 3.5Å
1079	A	43.7	Very low	43.2	Very low	53 Å²	53	99.4 Å²	99.4	44%	0.438	61%	0.608	S	S	.	*	S	Bend	trans	-102	-4.1	170	0	0	0	0	0	113.5	I1075 V1076 S1077	I1075-A1079 WeakPolarHBondContact O-CB 3.48Å; I1075-A1079 PolarHBondContact O-N 3.02Å; I1075-A1079 VanDerWaalsContact O-N 3.1Å; V1076-A1079 PolarHBondContact O-N 2.83Å; S1077-A1079 VanDerWaalsContact C-N 3.34Å
1080	V	37.9	Very low	41.7	Very low	98 Å²	98	103.4 Å²	103.4	59%	0.594	63%	0.63	S	S	*	*			trans	-131.4	73.2	-176.5	-172.8	0	0	0	0	110.8	V1076	V1076-V1080 WeakPolarHBondContact O-CG2 3.3Å; V1076-V1080 PolarHBondContact O-N 3.49Å
1081	T	30.1	Very low	40.4	Very low	119 Å²	119	106 Å²	106	73%	0.73	64%	0.643	S	S	*	*			trans	-115.7	104	160.6	50.2	0	0	0	0	108.5
1082	P	34.7	Very low	38.9	Very low	121 Å²	121	109.4 Å²	109.4	79%	0.786	66%	0.657	S	S	*	*			trans	-67.3	131.7	173.5	-17.2	31.3	0	0	0	110.7	D1084	P1082-D1084 PolarHBondContact O-N 3.15Å
1083	E	28.5	Very low	37.8	Very low	189 Å²	189	113.3 Å²	113.3	88%	0.883	68%	0.677	S	S	*	*			trans	-74.3	113.7	164.8	-71.3	177.3	-140.5	0	0	109.3
1084	D	29.7	Very low	37	Very low	160 Å²	160	112.9 Å²	112.9	86%	0.856	68%	0.678	S	S	*	*			trans	-169.8	86.2	159.4	-110.8	-29.2	0	0	0	111.8	P1082	P1082-D1084 PolarHBondContact O-N 3.15Å
1085	S	34.3	Very low	36.1	Very low	129 Å²	129	115 Å²	115	90%	0.902	69%	0.687	S	S	*	*			trans	174.2	146.6	143.1	38.8	0	0	0	0	112
1086	S	30.4	Very low	35.2	Very low	112 Å²	112	118 Å²	118	78%	0.783	70%	0.704	S	S	*	*			trans	-104.8	140.2	-165	58.9	0	0	0	0	115
1087	S	33.3	Very low	34.4	Very low	123 Å²	123	120.4 Å²	120.4	86%	0.86	71%	0.71	S	S	*	*				164.3	149.1	117.4	52.2	0	0	0	0	113.4
1088	G	33.5	Very low	34.2	Very low	75 Å²	75	120 Å²	120	77%	0.773	71%	0.712	S	S	*	*			trans	101.3	142.7	169.6	0	0	0	0	0	114.8
1089	P	31.7	Very low	34.1	Very low	111 Å²	111	122.1 Å²	122.1	72%	0.721	71%	0.713	S	S	*	*			trans	-100.8	-172.5	-173.8	40.9	-37.4	0	0	0	114.5
1090	D	26.8	Very low	33.9	Very low	141 Å²	141	124.2 Å²	124.2	75%	0.754	72%	0.716	S	S	*	*			trans	79.4	79.7	160.1	-52.6	-27.1	0	0	0	119.2
1091	T	31.7	Very low	34.1	Very low	128 Å²	128	123.5 Å²	123.5	79%	0.785	71%	0.709	S	S	*	*			trans	180	99.8	130.9	22.1	0	0	0	0	114.2	N1093	T1091-N1093 PolarHBondContact O-N 3.17Å
1092	E	29.7	Very low	34.8	Very low	125 Å²	125	121.6 Å²	121.6	58%	0.584	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	20.1	-177.4	-59.7	-170	123.7	0	0	116.6	F533	F533-E1092 WeakPolarHBondContact CD2-OE2 3.45Å
1093	N	35.9	Very low	35.3	Very low	110 Å²	110	122 Å²	122	59%	0.588	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-12.2	-161.7	-91.2	-56.5	0	0	0	118.9	T1091	T1091-N1093 PolarHBondContact O-N 3.17Å
1094	E	36.8	Very low	36	Very low	151 Å²	151	117 Å²	117	71%	0.706	66%	0.66	S	S	*	*	S	Bend	trans	-99.1	-34.3	-170.8	-62.2	-157.9	137.4	0	0	115.6	N1096 Q1097	E1094-N1096 VanDerWaalsContact C-N 3.26Å; E1094-N1096 PolarHBondContact O-N 3.48Å; E1094-Q1097 WeakPolarHBondContact O-CB 3.38Å; E1094-Q1097 PolarHBondContact O-N 3.01Å
1095	E	36.1	Very low	36.6	Very low	173 Å²	173	115.3 Å²	115.3	81%	0.808	65%	0.65	S	S	*	*	H	α-helix	trans	-57.9	-37.2	-176.5	-61	-171.3	130.9	0	0	113.3	Q1097 A1098 H1099	E1095-Q1097 PolarHBondContact O-N 3.41Å; E1095-A1098 PolarHBondContact O-N 2.78Å; E1095-H1099 PolarHBondContact O-N 3.01Å
1096	N	36.1	Very low	37.3	Very low	130 Å²	130	114.7 Å²	114.7	70%	0.695	64%	0.636	S	S	*	*	H	α-helix	trans	-65.5	-22	177.7	-79.8	-66.6	0	0	0	113.2	E1094 L1100	E1094-N1096 VanDerWaalsContact C-N 3.26Å; E1094-N1096 PolarHBondContact O-N 3.48Å; N1096-L1100 WeakPolarHBondContact O-CB 3.46Å; N1096-L1100 PolarHBondContact O-N 2.93Å
1097	Q	36.4	Very low	37.8	Very low	126 Å²	126	117.4 Å²	117.4	59%	0.589	63%	0.634	S	S	*	*	H	α-helix	trans	-81	-40.9	176.9	-65.9	-165.3	6.9	0	0	112.4	E1094 E1095 H1099 L1100 N1101	E1094-Q1097 WeakPolarHBondContact O-CB 3.38Å; E1094-Q1097 PolarHBondContact O-N 3.01Å; E1095-Q1097 PolarHBondContact O-N 3.41Å; Q1097-H1099 PolarHBondContact O-N 2.89Å; Q1097-L1100 PolarHBondContact O-N 3.5Å; Q1097-N1101 WeakPolarHBondContact O-CB 3.32Å; Q1097-N1101 PolarHBondContact O-N 3.23Å; Q1097-N1101 PolarHBondContact O-ND2 3.1Å
1098	A	37.3	Very low	37.9	Very low	68 Å²	68	119.6 Å²	119.6	56%	0.562	63%	0.628	S	S	*	*	H	α-helix	trans	-58.8	-49.3	177.9	0	0	0	0	0	111.5	E1095 L1100 N1101 L1102	E1095-A1098 PolarHBondContact O-N 2.78Å; A1098-L1100 PolarHBondContact O-N 3.09Å; A1098-N1101 PolarHBondContact O-N 3.23Å; A1098-L1102 PolarHBondContact O-N 3.28Å
1099	H	42.1	Very low	38	Very low	123 Å²	123	124.8 Å²	124.8	57%	0.569	62%	0.624	S	S	*	*	H	α-helix	trans	-69.3	-20.2	-179.2	-153.3	-31.9	0	0	0	113.2	E1095 Q1097	E1095-H1099 PolarHBondContact O-N 3.01Å; Q1097-H1099 PolarHBondContact O-N 2.89Å
1100	L	38.3	Very low	38.2	Very low	97 Å²	97	128.6 Å²	128.6	51%	0.508	63%	0.63	S	S	.	*	H	α-helix	trans	-81.9	-44.6	173.1	-162.9	75.1	0	0	0	111.8	N1096 Q1097 A1098 L1102 K1103 Q1104	N1096-L1100 WeakPolarHBondContact O-CB 3.46Å; N1096-L1100 PolarHBondContact O-N 2.93Å; Q1097-L1100 PolarHBondContact O-N 3.5Å; A1098-L1100 PolarHBondContact O-N 3.09Å; L1100-L1102 PolarHBondContact O-N 2.74Å; L1100-K1103 PolarHBondContact O-N 3.42Å; L1100-K1103 VanDerWaalsContact O-N 3.14Å; L1100-Q1104 WeakPolarHBondContact O-CG 3.47Å; L1100-Q1104 PolarHBondContact O-N 3.1Å
1101	N	43.8	Very low	38.3	Very low	82 Å²	82	132.7 Å²	132.7	44%	0.439	63%	0.634	S	S	.	*	H	α-helix	trans	-60.7	-41.6	-178.9	-79.2	-22.1	0	0	0	112.3	Q1097 A1098 K1103 Q1104 L1105	Q1097-N1101 WeakPolarHBondContact O-CB 3.32Å; Q1097-N1101 PolarHBondContact O-N 3.23Å; Q1097-N1101 PolarHBondContact O-ND2 3.1Å; A1098-N1101 PolarHBondContact O-N 3.23Å; N1101-K1103 VanDerWaalsContact C-N 3.32Å; N1101-K1103 PolarHBondContact O-N 3.49Å; N1101-Q1104 PolarHBondContact O-N 2.65Å; N1101-L1105 PolarHBondContact O-N 3.1Å
1102	L	44.3	Very low	38.1	Very low	80 Å²	80	136.2 Å²	136.2	42%	0.419	64%	0.639	S	S	.	*	H	α-helix	trans	-60.3	-40.7	175.2	-173.5	62.2	0	0	0	112.1	A1098 L1100 Q1104 L1106	A1098-L1102 PolarHBondContact O-N 3.28Å; L1100-L1102 PolarHBondContact O-N 2.74Å; L1102-Q1104 VanDerWaalsContact C-N 3.3Å; L1102-Q1104 PolarHBondContact O-N 3Å; L1102-L1106 HydrophobicContact CD1-CD1 4.34Å; L1102-L1106 HydrophobicContact CG-CD1 4.21Å; L1102-L1106 WeakPolarHBondContact O-CB 3.19Å; L1102-L1106 WeakPolarHBondContact O-CG 3.42Å; L1102-L1106 PolarHBondContact O-N 2.91Å; L1102-L1106 VanDerWaalsContact O-N 3.09Å
1103	K	43.7	Very low	38.1	Very low	129 Å²	129	136.7 Å²	136.7	56%	0.561	65%	0.653	S	S	*	*	H	α-helix	trans	-70.2	-21.7	174.9	-81	175.7	176.4	164.3	0	113.6	L1100 N1101 K1107	L1100-K1103 PolarHBondContact O-N 3.42Å; L1100-K1103 VanDerWaalsContact O-N 3.14Å; N1101-K1103 VanDerWaalsContact C-N 3.32Å; N1101-K1103 PolarHBondContact O-N 3.49Å; K1103-K1107 WeakPolarHBondContact O-CG 3.08Å
1104	Q	44.3	Very low	37.8	Very low	85 Å²	85	136.6 Å²	136.6	40%	0.397	66%	0.66	S	S	.	*	H	α-helix	trans	-81.7	-47.5	172.4	-66.8	-174.1	30.3	0	0	111.2	L1100 N1101 L1102 L1106 K1107 F1108	L1100-Q1104 WeakPolarHBondContact O-CG 3.47Å; L1100-Q1104 PolarHBondContact O-N 3.1Å; N1101-Q1104 PolarHBondContact O-N 2.65Å; L1102-Q1104 VanDerWaalsContact C-N 3.3Å; L1102-Q1104 PolarHBondContact O-N 3Å; Q1104-L1106 VanDerWaalsContact C-N 3.34Å; Q1104-L1106 PolarHBondContact O-N 3.43Å; Q1104-K1107 WeakPolarHBondContact O-CA 3.46Å; Q1104-K1107 WeakPolarHBondContact O-CB 3.22Å; Q1104-K1107 PolarHBondContact O-N 3.32Å; Q1104-F1108 WeakPolarHBondContact O-CD2 3.27Å; Q1104-F1108 PolarHBondContact O-N 3.03Å
1105	L	42.8	Very low	37.4	Very low	124 Å²	124	135.3 Å²	135.3	65%	0.649	66%	0.659	S	S	*	*	H	α-helix	trans	-54.6	-47.1	176.2	-79	161.9	0	0	0	112.1	N1101 K1107 F1108	N1101-L1105 PolarHBondContact O-N 3.1Å; L1105-K1107 PolarHBondContact O-N 3.39Å; L1105-F1108 PolarHBondContact O-N 2.93Å
1106	L	48	Very low	37	Very low	115 Å²	115	139.2 Å²	139.2	60%	0.602	67%	0.666	S	S	*	*	H	α-helix	trans	-67	-20.4	176.6	-68.3	170.9	0	0	0	113.8	L1102 Q1104	L1102-L1106 HydrophobicContact CD1-CD1 4.34Å; L1102-L1106 HydrophobicContact CG-CD1 4.21Å; L1102-L1106 WeakPolarHBondContact O-CB 3.19Å; L1102-L1106 WeakPolarHBondContact O-CG 3.42Å; L1102-L1106 PolarHBondContact O-N 2.91Å; L1102-L1106 VanDerWaalsContact O-N 3.09Å; Q1104-L1106 VanDerWaalsContact C-N 3.34Å; Q1104-L1106 PolarHBondContact O-N 3.43Å
1107	K	41.5	Very low	36.6	Very low	170 Å²	170	138.9 Å²	138.9	74%	0.739	66%	0.664	S	S	*	*	H	α-helix	trans	-83.3	-35.9	172.3	-82.8	-178.9	174.7	-178.5	0	113.1	K1103 Q1104 L1105 R1109	K1103-K1107 WeakPolarHBondContact O-CG 3.08Å; Q1104-K1107 WeakPolarHBondContact O-CA 3.46Å; Q1104-K1107 WeakPolarHBondContact O-CB 3.22Å; Q1104-K1107 PolarHBondContact O-N 3.32Å; L1105-K1107 PolarHBondContact O-N 3.39Å; K1107-R1109 PolarHBondContact O-N 2.99Å
1108	F	36.1	Very low	36.3	Very low	169 Å²	169	142.5 Å²	142.5	74%	0.741	68%	0.678	S	S	*	*	H	α-helix	trans	-70.8	-25.3	-174.9	-88.6	-72.2	0	0	0	114.3	Q1104 L1105 K1110	Q1104-F1108 WeakPolarHBondContact O-CD2 3.27Å; Q1104-F1108 PolarHBondContact O-N 3.03Å; L1105-F1108 PolarHBondContact O-N 2.93Å; F1108-K1110 VanDerWaalsContact C-N 3.32Å; F1108-K1110 PolarHBondContact O-N 2.95Å
1109	R	34.6	Very low	35.9	Very low	184 Å²	184	146.7 Å²	146.7	69%	0.694	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-4.4	-174.9	-150.7	166.3	-179.3	168.7	-3.1	115.2	K1107 R1111	K1107-R1109 PolarHBondContact O-N 2.99Å; R1109-R1111 VanDerWaalsContact C-N 3.25Å; R1109-R1111 PolarHBondContact O-N 3.37Å
1110	K	36.8	Very low	35.3	Very low	191 Å²	191	149.2 Å²	149.2	83%	0.83	70%	0.7	S	S	*	*			trans	-76.3	25.8	-178.7	-80.4	-163.4	174.3	-172.5	0	116	F1108	F1108-K1110 VanDerWaalsContact C-N 3.32Å; F1108-K1110 PolarHBondContact O-N 2.95Å
1111	R	27.6	Very low	34.7	Very low	226 Å²	226	151.8 Å²	151.8	85%	0.853	71%	0.714	S	S	*	*			trans	-144.7	98	-178.7	-75.2	-173.8	171.2	175.5	-3.1	115.2	R1109	R1109-R1111 VanDerWaalsContact C-N 3.25Å; R1109-R1111 PolarHBondContact O-N 3.37Å
1112	K	27.6	Very low	34	Very low	203 Å²	203	155.1 Å²	155.1	88%	0.883	73%	0.732	S	S	*	*			trans	169.5	105.5	139.2	-98.8	173.2	-179.6	179.2	0	111.8
1113	P	29.3	Very low	33.4	Very low	134 Å²	134	156.8 Å²	156.8	87%	0.87	75%	0.746	S	S	*	*			trans	-82.2	130.8	148.7	32.4	-27.9	0	0	0	108.7
1114	S	30	Very low	32.8	Very low	108 Å²	108	157.5 Å²	157.5	76%	0.755	76%	0.76	S	S	*	*			trans	-111.4	121.4	-178	-167.6	0	0	0	0	112
1115	N	27.9	Very low	32	Very low	125 Å²	125	159.6 Å²	159.6	67%	0.668	78%	0.779	S	S	*	*			trans	25.7	101.1	157.7	-66.7	-14.3	0	0	0	118.7
1116	R	28.6	Very low	31.4	Very low	255 Å²	255	163.1 Å²	163.1	96%	0.962	79%	0.789	S	S	*	*			trans	-119.6	104.8	132.7	-77.3	-166.5	177.7	-168.1	0.9	108.7
1117	N	28.5	Very low	30.5	Very low	123 Å²	123	165.5 Å²	165.5	66%	0.658	80%	0.802	S	S	*	*			trans	-87.7	164.5	179.5	-68.2	-36.7	0	0	0	111.4
1118	K	28.1	Very low	29.7	Very low	201 Å²	201	162.7 Å²	162.7	87%	0.874	80%	0.803	S	S	*	*			trans	68.5	69.7	162.2	-59.9	177.9	177.5	-179.3	0	117.5
1119	L	29.4	Very low	29.3	Very low	157 Å²	157	162.8 Å²	162.8	82%	0.822	81%	0.806	S	S	*	*	S	Bend	trans	-155.2	150.9	130.2	-140.9	69.1	0	0	0	109.7
1120	F	29	Very low	29.1	Very low	176 Å²	176	160 Å²	160	77%	0.772	81%	0.81	S	S	*	*			trans	66.6	35.5	179.1	-75.4	-83.8	0	0	0	118.7
1121	D	26.5	Very low	28.6	Very low	150 Å²	150	156.5 Å²	156.5	80%	0.802	80%	0.8	S	S	*	*			trans	-77.1	125.7	132.4	-81.1	-54.5	0	0	0	107.9
1122	N	30.1	Very low	28.9	Very low	153 Å²	153	152.8 Å²	152.8	82%	0.818	79%	0.793	S	S	*	*			trans	142.2	41.1	164.2	-76.1	-34.6	0	0	0	116
1123	T	31.4	Very low	29	Very low	115 Å²	115	150.6 Å²	150.6	71%	0.706	79%	0.785	S	S	*	*	S	Bend	trans	-138.4	2.1	173	-19	0	0	0	0	116.7
1124	V	30.7	Very low	29.1	Very low	143 Å²	143	150.7 Å²	150.7	87%	0.867	78%	0.779	S	S	*	*	S	Bend	trans	-128.5	49.9	-179.7	-162.8	0	0	0	0	111.3
1125	T	27.4	Very low	29.2	Very low	129 Å²	129	152.8 Å²	152.8	79%	0.791	78%	0.777	S	S	*	*	S	Bend	trans	-148.9	44	179.2	-1.1	0	0	0	0	112.7
1126	K	29.9	Very low	29.4	Very low	198 Å²	198	152.1 Å²	152.1	86%	0.861	78%	0.777	S	S	*	*	S	Bend	trans	-153.2	153.1	167.4	-112.1	169.4	-174.4	176.5	0	110.3
1127	L	29.1	Very low	29.4	Very low	166 Å²	166	147 Å²	147	87%	0.869	77%	0.768	S	S	*	*			trans	65.8	39.5	176.6	-52.9	178.5	0	0	0	116
1128	S	24.2	Very low	29.4	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	77%	0.769	S	S	*	*			trans	-78	95.2	134.8	54.5	0	0	0	0	109
1129	Q	29	Very low	29.5	Very low	171 Å²	171	144.6 Å²	144.6	80%	0.799	76%	0.759	S	S	*	*			trans	179.9	143.7	160	-106.7	158.8	13.3	0	0	110.6
1130	T	30.1	Very low	29.6	Very low	127 Å²	127	143.6 Å²	143.6	78%	0.779	75%	0.754	S	S	*	*			trans	60.8	145.7	165	54.4	0	0	0	0	119.3
1131	N	27	Very low	29.5	Very low	117 Å²	117	143 Å²	143	63%	0.626	75%	0.754	S	S	*	*			cis	179.1	167.6	-35.4	-115.2	32.6	0	0	0	107.2
1132	E	32.1	Very low	29.5	Very low	148 Å²	148	147.5 Å²	147.5	69%	0.692	76%	0.759	S	S	*	*			trans	61.5	147.5	163.6	-70.1	115.4	-133.5	0	0	116.4
1133	E	31.6	Very low	29.3	Very low	156 Å²	156	147.5 Å²	147.5	73%	0.729	75%	0.752	S	S	*	*			cis	-155.9	152.6	-8	-117.1	161.5	-175.4	0	0	108.6
1134	D	30.3	Very low	29.2	Very low	137 Å²	137	147.8 Å²	147.8	73%	0.733	76%	0.758	S	S	*	*			trans	59.2	151	148.5	-64.4	-8.8	0	0	0	122.2
1135	E	31.4	Very low	29	Very low	152 Å²	152	146 Å²	146	71%	0.71	75%	0.752	S	S	*	*			cis	-152.1	153.4	-4.2	-129.4	-157.8	140.2	0	0	110.9
1136	T	33.8	Very low	28.9	Very low	111 Å²	111	149.8 Å²	149.8	68%	0.681	76%	0.758	S	S	*	*			trans	31.4	156.2	148	58.8	0	0	0	0	123.8
1137	L	27.4	Very low	28.8	Very low	146 Å²	146	146.5 Å²	146.5	76%	0.764	75%	0.754	S	S	*	*			cis	-171.8	163.2	-27.6	-170.8	62.1	0	0	0	108.1
1138	H	29.5	Very low	28.5	Very low	147 Å²	147	147 Å²	147	68%	0.681	75%	0.752	S	S	*	*			trans	81.3	143.9	160.3	-95.6	-73.5	0	0	0	122.7
1139	D	30.1	Very low	28.7	Very low	127 Å²	127	149.5 Å²	149.5	68%	0.679	76%	0.755	S	S	*	*			trans	66	95.7	160	-57.2	-8.6	0	0	0	119.1
1140	I	31.3	Very low	28.6	Very low	136 Å²	136	147.5 Å²	147.5	70%	0.697	76%	0.755	S	S	*	*			cis	83	126.6	47.9	-53.9	168.1	0	0	0	113.8
1141	E	27.9	Very low	28.4	Very low	165 Å²	165	146.6 Å²	146.6	77%	0.771	75%	0.753	S	S	*	*			trans	54.8	81.4	164.4	-72.1	179.3	-174.6	0	0	121.2
1142	R	25.7	Very low	28.5	Very low	243 Å²	243	147 Å²	147	92%	0.917	76%	0.76	S	S	*	*				-179.6	101.9	113.4	-101.8	165.6	-74.5	-176.1	-7.7	114
1143	K	26.1	Very low	28.2	Very low	154 Å²	154	146 Å²	146	67%	0.67	76%	0.76	S	S	*	*			trans	-172.4	59.9	150.6	-111.6	177.2	-174.6	-172.1	0	114.2	S118	S118-K1143 PolarHBondContact OG-NZ 3.4Å
1144	S	28.2	Very low	28	Very low	120 Å²	120	146.9 Å²	146.9	84%	0.839	76%	0.761	S	S	*	*			trans	-89.2	153	145	55.5	0	0	0	0	108
1145	S	26.3	Very low	27.8	Very low	105 Å²	105	148.1 Å²	148.1	73%	0.734	77%	0.767	S	S	*	*			cis	-148.9	134.1	6.2	53.1	0	0	0	0	111.7
1146	F	25.7	Very low	27.6	Very low	210 Å²	210	150.2 Å²	150.2	92%	0.921	77%	0.773	S	S	*	*			trans	-154.5	118.2	132.5	-154.6	-99.3	0	0	0	107.6
1147	V	28	Very low	27.3	Very low	128 Å²	128	152.9 Å²	152.9	78%	0.776	78%	0.782	S	S	*	*			trans	-137.4	142.7	-174.8	173	0	0	0	0	106.9
1148	E	23.7	Very low	27.4	Very low	176 Å²	176	151.6 Å²	151.6	82%	0.822	78%	0.783	S	S	*	*			trans	-62.4	155.2	175.2	-60	164.8	100.6	0	0	111.4
1149	I	27.9	Very low	27.1	Very low	164 Å²	164	154.2 Å²	154.2	84%	0.841	79%	0.792	S	S	*	*			trans	-163.6	132.3	134.4	-102.4	149.9	0	0	0	108
1150	T	26.2	Very low	27	Very low	129 Å²	129	157.2 Å²	157.2	79%	0.791	80%	0.8	S	S	*	*			trans	-80.3	130.5	170.1	42.6	0	0	0	0	109.7
1151	S	26.3	Very low	26.7	Very low	107 Å²	107	157.8 Å²	157.8	75%	0.748	80%	0.801	S	S	*	*			trans	176.4	126.6	139.1	-85.2	0	0	0	0	115
1152	V	28.8	Very low	26.6	Very low	125 Å²	125	161.5 Å²	161.5	76%	0.758	81%	0.808	S	S	*	*			trans	62.5	104.4	130.8	-175.1	0	0	0	0	119.6
1153	D	26.7	Very low	26.6	Very low	129 Å²	129	157.4 Å²	157.4	69%	0.69	80%	0.799	S	S	*	*			trans	81.7	142.7	139.2	-85.8	15.5	0	0	0	124.3
1154	K	26	Very low	26.6	Very low	174 Å²	174	159.2 Å²	159.2	76%	0.757	81%	0.808	S	S	*	*			trans	61.2	87.1	155.9	-64	157.4	-168.9	166.1	0	117
1155	L	27.5	Very low	26.4	Very low	163 Å²	163	160.3 Å²	160.3	85%	0.853	79%	0.793	S	S	*	*				-160.9	144.2	101.4	-127.8	74.2	0	0	0	115.2
1156	K	27.4	Very low	26.3	Very low	195 Å²	195	157.3 Å²	157.3	85%	0.848	77%	0.772	S	S	*	*			trans	-28.3	118.5	171.6	-60.1	166.8	178.4	177.6	0	116.2
1157	L	25.9	Very low	26.3	Very low	167 Å²	167	150 Å²	150	87%	0.874	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-68.6	129.8	149.6	-104.3	77.5	0	0	0	109.1
1158	P	30.1	Very low	26.2	Very low	120 Å²	120	147.2 Å²	147.2	78%	0.779	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-77.5	127.7	173.8	29.9	-32.5	0	0	0	111.5	F1160	P1158-F1160 PolarHBondContact O-N 3.16Å
1159	K	24.5	Very low	26.4	Very low	201 Å²	201	145.5 Å²	145.5	87%	0.874	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-66.7	119.4	162.4	-63.6	176.2	-179.9	178.1	0	109
1160	F	27.4	Very low	26.3	Very low	191 Å²	191	143.6 Å²	143.6	84%	0.838	73%	0.725	S	S	*	*			trans	-159.3	105	151	-118.8	-85.7	0	0	0	107.9	P1158	P1158-F1160 PolarHBondContact O-N 3.16Å
1161	M	25.5	Very low	26.2	Very low	147 Å²	147	146.1 Å²	146.1	72%	0.724	73%	0.726	S	S	*	*				45.1	110.9	90.6	-70.8	-166.4	165.5	0	0	112.5
1162	R	24.5	Very low	26.2	Very low	243 Å²	243	145.7 Å²	145.7	92%	0.917	72%	0.719	S	S	*	*			cis	68.5	34.6	33.3	-144.9	-170.2	-164.9	-177.3	8	115.1
1163	Q	25.7	Very low	26.1	Very low	157 Å²	157	146.4 Å²	146.4	73%	0.734	72%	0.718	S	S	*	*			trans	-149.4	116.5	162.4	-98.8	-166.8	11.8	0	0	112.6
1164	K	26.3	Very low	26	Very low	193 Å²	193	146.5 Å²	146.5	84%	0.839	72%	0.718	S	S	*	*				-169.9	138	95.9	-103.9	177.1	-179.3	177.8	0	111.9
1165	R	23.7	Very low	26	Very low	143 Å²	143	143.2 Å²	143.2	54%	0.54	71%	0.713	S	S	.	*			trans	-102.9	151.7	-176.6	-158.9	174.7	177	171.3	-7.6	109.2	S458 E461	S458-R1165 PolarHBondContact N-O 3.06Å; E461-R1165 PolarHBondContact O-NH2 2.94Å
1166	S	24.2	Very low	26	Very low	41 Å²	41	143.1 Å²	143.1	29%	0.287	71%	0.708	S	S	.	*	B	Isolated β-bridge	trans	60.7	-149.3	159.1	-140.5	0	0	0	0	117.9	P455 S456 S457	P455-S1166 CarbonylContact C-O 3.46Å; S456-S1166 CarbonylContact C-O 3.56Å; S456-S1166 VanDerWaalsContact C-O 3.26Å; S456-S1166 WeakPolarHBondContact CA-O 3.37Å; S456-S1166 PolarHBondContact N-O 2.77Å; S457-S1166 PolarHBondContact N-O 3.05Å; S457-S1166 VanDerWaalsContact N-O 3.12Å; S457-S1166 CarbonylContact O-C 3.59Å; S457-S1166 WeakPolarHBondContact O-CB 3.49Å
1167	S	27.2	Very low	26.1	Very low	58 Å²	58	140.8 Å²	140.8	41%	0.406	71%	0.705	S	S	.	*				-138.5	132.6	-124.6	48	0	0	0	0	117.4	S456 S457	S456-S1167 CarbonylContact O-C 3.54Å; S456-S1167 VanDerWaalsContact O-C 3.26Å; S457-S1167 WeakPolarHBondContact CB-O 3.32Å; S457-S1167 CarbonylContact O-C 3.49Å; S457-S1167 WeakPolarHBondContact O-CA 3.49Å; S457-S1167 PolarHBondContact O-N 3.34Å; S457-S1167 PolarHBondContact O-OG 3.23Å; S457-S1167 PolarHBondContact OG-O 3.46Å
1168	S	25.3	Very low	26.3	Very low	69 Å²	69	139 Å²	139	48%	0.483	70%	0.695	S	S	.	*			trans	74.1	160.7	146.4	-149.7	0	0	0	0	120.4	P455 S456 S457	P455-S1168 PolarHBondContact O-N 3.13Å; S456-S1168 PolarHBondContact O-N 3.4Å; S457-S1168 WeakPolarHBondContact CB-O 3.32Å; S457-S1168 PolarHBondContact OG-O 3.07Å
1169	N	28.2	Very low	26.4	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	69%	0.692	S	S	*	*			trans	74.4	147.2	164.2	-59.5	3.8	0	0	0	117.3
1170	V	25.6	Very low	26.5	Very low	123 Å²	123	134.8 Å²	134.8	75%	0.745	68%	0.682	S	S	*	*			cis	-176.4	141.3	-36	123.8	0	0	0	0	105.2
1171	F	24.6	Very low	26.5	Very low	183 Å²	183	133.2 Å²	133.2	80%	0.803	68%	0.682	S	S	*	*			trans	42.2	139.1	164.3	-99.6	-119.1	0	0	0	121.7
1172	T	26	Very low	26.6	Very low	98 Å²	98	130.2 Å²	130.2	60%	0.601	68%	0.675	S	S	*	*			trans	31.8	125.8	144.3	60.1	0	0	0	0	119
1173	N	26.1	Very low	26.8	Very low	139 Å²	139	127.3 Å²	127.3	74%	0.743	67%	0.669	S	S	*	*				-167.3	165.9	76.8	-108.2	-34.8	0	0	0	116.7
1174	L	23.8	Very low	26.8	Very low	132 Å²	132	124.9 Å²	124.9	69%	0.691	67%	0.669	S	S	*	*			trans	57.5	92.5	153.6	-88.2	70.3	0	0	0	120.8
1175	T	27.9	Very low	26.9	Very low	105 Å²	105	123.5 Å²	123.5	64%	0.644	66%	0.663	S	S	*	*				51.4	157.7	105.2	62.3	0	0	0	0	123.5
1176	Q	26.3	Very low	27	Very low	161 Å²	161	123.3 Å²	123.3	75%	0.752	67%	0.67	S	S	*	*			trans	73.6	129.3	153.7	-75.5	158.3	3.7	0	0	115.5
1177	N	28.8	Very low	27.3	Very low	146 Å²	146	128 Å²	128	78%	0.781	69%	0.69	S	S	*	*			cis	-142.4	164.9	29.2	-93.8	-52	0	0	0	117.2
1178	L	31.4	Very low	27.3	Very low	129 Å²	129	129 Å²	129	68%	0.675	70%	0.698	S	S	*	*			trans	-51.5	169.1	171.2	-97.1	81.2	0	0	0	115.4
1179	P	32.7	Very low	27.7	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	71%	0.709	S	S	*	*			cis	-146.2	152.9	41	40.4	-19.5	0	0	0	121.6
1180	N	26.5	Very low	27.7	Very low	122 Å²	122	132.3 Å²	132.3	65%	0.652	71%	0.71	S	S	*	*			trans	38.7	125.3	133.2	-52	-27.7	0	0	0	120.6
1181	L	27	Very low	28	Very low	159 Å²	159	132.3 Å²	132.3	83%	0.832	72%	0.715	S	S	*	*				-159.8	132.6	88.4	-128.2	87.1	0	0	0	113.1
1182	S	26.6	Very low	28.2	Very low	83 Å²	83	126.3 Å²	126.3	58%	0.58	71%	0.705	S	S	*	*			trans	35.4	134.7	139.8	117.2	0	0	0	0	119.8
1183	K	28.8	Very low	28.7	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.796	72%	0.718	S	S	*	*			cis	-172.5	151.6	38.1	-125	158.2	-163.2	168.4	0	111.3
1184	S	26.6	Very low	28.7	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	72%	0.718	S	S	*	*			trans	68.1	142	154.4	-68.8	0	0	0	0	118.3
1185	K	27.7	Very low	28.8	Very low	164 Å²	164	132.7 Å²	132.7	71%	0.713	71%	0.712	S	S	*	*			cis	-157.9	149.7	-1.1	-137.5	-176.7	172	-166.3	0	113.8
1186	M	26.1	Very low	28.8	Very low	139 Å²	139	134.5 Å²	134.5	69%	0.685	72%	0.716	S	S	*	*			trans	74.6	134.3	143.5	-96.6	161.5	140.1	0	0	121.6
1187	I	31.5	Very low	28.7	Very low	140 Å²	140	133.3 Å²	133.3	72%	0.718	72%	0.715	S	S	*	*			trans	69.9	99.1	155.1	-58.4	157.3	0	0	0	113.3
1188	S	26.9	Very low	28.6	Very low	80 Å²	80	135.8 Å²	135.8	56%	0.559	72%	0.718	S	S	*	*				72.6	141.3	53.8	94	0	0	0	0	112.6
1189	D	33.6	Very low	28.2	Very low	133 Å²	133	134.9 Å²	134.9	71%	0.711	72%	0.722	S	S	*	*			cis	-127.4	155.4	13	-79.3	-76.1	0	0	0	111.5
1190	N	27.3	Very low	28	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	73%	0.732	S	S	*	*			cis	79.7	61.9	44.1	-75.9	-29.5	0	0	0	116.5
1191	S	32.1	Very low	27.9	Very low	122 Å²	122	144.3 Å²	144.3	85%	0.853	74%	0.739	S	S	*	*			trans	-148.9	140.9	134.7	48.7	0	0	0	0	106.5
1192	G	29.5	Very low	27.8	Very low	58 Å²	58	141.2 Å²	141.2	60%	0.598	73%	0.731	S	S	*	*			cis	118.9	127.3	28.1	0	0	0	0	0	105.7
1193	E	35.6	Very low	27.8	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.874	74%	0.742	S	S	*	*			cis	-111.4	156.2	19.4	-67.7	156.5	130.2	0	0	111.8
1194	R	26.5	Very low	27.5	Very low	197 Å²	197	142.6 Å²	142.6	74%	0.743	74%	0.74	S	S	*	*			cis	68.8	149.2	36.5	-62.9	173.3	175.3	-125.9	14.2	112
1195	E	25.9	Very low	27.7	Very low	119 Å²	119	145.6 Å²	145.6	56%	0.556	74%	0.742	S	S	*	*			cis	-140.8	146.9	-13.1	-111.1	149.8	-157.1	0	0	106.3
1196	I	26.8	Very low	27.7	Very low	142 Å²	142	142.7 Å²	142.7	73%	0.728	74%	0.74	S	S	*	*				53	144.4	84.6	-48.9	-178.9	0	0	0	112.8
1197	N	25.8	Very low	27.6	Very low	137 Å²	137	139.6 Å²	139.6	73%	0.733	73%	0.732	S	S	*	*			trans	79.6	132.4	-167.5	-44.4	-62.7	0	0	0	112.2
1198	K	26.6	Very low	27.2	Very low	197 Å²	197	140.4 Å²	140.4	86%	0.857	73%	0.733	S	S	*	*			cis	-123.8	146.7	2.3	-70.2	173.7	-177.7	170.5	0	108.9
1199	C	23	Very low	27	Very low	111 Å²	111	142.4 Å²	142.4	75%	0.75	74%	0.737	S	S	*	*				64.7	80.4	59.5	-69.9	0	0	0	0	115.4
1200	R	28.4	Very low	26.6	Very low	243 Å²	243	142.1 Å²	142.1	92%	0.917	74%	0.735	S	S	*	*	S	Bend		37.8	124.7	127.4	-159.5	-178.5	-162	174.3	5.6	118.8
1201	K	24.1	Very low	26.4	Very low	187 Å²	187	140.9 Å²	140.9	81%	0.813	73%	0.734	S	S	*	*			trans	75.3	144.1	-179	-65.8	-173.2	171.1	-171.9	0	114.9
1202	S	23.8	Very low	26.5	Very low	93 Å²	93	142.1 Å²	142.1	65%	0.65	73%	0.73	S	S	*	*			trans	59	136.9	166.4	34.5	0	0	0	0	115.9
1203	D	26.2	Very low	26.4	Very low	154 Å²	154	145 Å²	145	82%	0.824	74%	0.739	S	S	*	*			cis	-97.8	125.2	10.9	-63.9	-51.1	0	0	0	111.9
1204	L	24	Very low	25.7	Very low	142 Å²	142	140.8 Å²	140.8	74%	0.743	73%	0.729	S	S	*	*				82.4	106.4	72.5	-106.4	91	0	0	0	113.1
1205	Q	30.8	Very low	25.7	Very low	168 Å²	168	138.9 Å²	138.9	79%	0.785	73%	0.728	S	S	*	*				-23.6	150.3	125.6	-86.8	-177.9	-65.2	0	0	113.5
1206	P	28.1	Very low	25.6	Very low	103 Å²	103	139.6 Å²	139.6	67%	0.669	74%	0.736	S	S	*	*			cis	-137.4	158.1	43.1	49.6	-33.9	0	0	0	112.4
1207	S	22.4	Very low	25.6	Very low	73 Å²	73	138 Å²	138	51%	0.51	74%	0.737	S	S	.	*				70.9	171.5	97.8	79	0	0	0	0	114.2
1208	E	23.1	Very low	25.6	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	74%	0.739	S	S	*	*			trans	64	123.7	153.7	-67.2	154.2	-118.4	0	0	117.9
1209	N	23.7	Very low	25.7	Very low	123 Å²	123	135.7 Å²	135.7	66%	0.658	74%	0.739	S	S	*	*			cis	-146.9	139.2	-6.8	-108.5	-19	0	0	0	111.5
1210	D	24.1	Very low	25.8	Very low	126 Å²	126	136.8 Å²	136.8	67%	0.674	74%	0.738	S	S	*	*				27.8	126.8	113.5	-78.3	-19.2	0	0	0	118.4
1211	T	24.1	Very low	26	Very low	120 Å²	120	132 Å²	132	74%	0.736	74%	0.735	S	S	*	*			trans	70.2	135.9	144.4	62.1	0	0	0	0	119.6
1212	N	34.9	Very low	26.1	Very low	147 Å²	147	127.6 Å²	127.6	79%	0.786	72%	0.724	S	S	*	*				13.1	128	126.1	-53.5	-20.5	0	0	0	115.5
1213	P	26.9	Very low	26.2	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	73%	0.728	S	S	*	*				-141.5	164.8	73.1	39.4	-25.9	0	0	0	117.1
1214	C	21.5	Very low	26.5	Very low	98 Å²	98	130.1 Å²	130.1	66%	0.662	73%	0.729	S	S	*	*			trans	-29.7	135.3	149.1	-44.1	0	0	0	0	113.6
1215	H	25.4	Very low	26.6	Very low	158 Å²	158	130.7 Å²	130.7	73%	0.731	73%	0.728	S	S	*	*				-178.8	150.5	90.4	-98.7	-65.7	0	0	0	115
1216	N	24.8	Very low	26.4	Very low	134 Å²	134	127.9 Å²	127.9	72%	0.717	73%	0.727	S	S	*	*			trans	21.6	108.3	139.9	-49.9	5.1	0	0	0	119.1
1217	S	26.7	Very low	26.4	Very low	107 Å²	107	127.3 Å²	127.3	75%	0.748	73%	0.726	S	S	*	*				-174.7	129	107.7	31.2	0	0	0	0	109.1
1218	N	24.2	Very low	26.6	Very low	145 Å²	145	130.2 Å²	130.2	78%	0.775	74%	0.735	S	S	*	*				64.3	79.1	59.4	-74.6	-0.2	0	0	0	114.5
1219	T	30	Very low	27	Very low	142 Å²	142	129 Å²	129	87%	0.871	73%	0.733	S	S	*	*			trans	-146.2	78.8	152.4	11.3	0	0	0	0	112.1
1220	N	25	Very low	27.2	Very low	134 Å²	134	130.3 Å²	130.3	72%	0.717	74%	0.74	S	S	*	*			trans	-1.6	126.1	151.8	-45.6	-27.2	0	0	0	118.5
1221	V	31.6	Very low	27.9	Very low	141 Å²	141	129.4 Å²	129.4	86%	0.855	74%	0.741	S	S	*	*				-139	76.1	119.3	-173.2	0	0	0	0	109.7
1222	T	27.5	Very low	28.2	Very low	95 Å²	95	131.5 Å²	131.5	58%	0.583	75%	0.748	S	S	*	*			trans	39.3	120.2	140.1	58.4	0	0	0	0	122.2
1223	N	26.1	Very low	27.7	Very low	136 Å²	136	130 Å²	130	73%	0.727	75%	0.748	S	S	*	*				63.6	128.9	125.6	-49.3	-10	0	0	0	118.3
1224	L	31.1	Very low	27.8	Very low	164 Å²	164	129.9 Å²	129.9	86%	0.859	75%	0.745	S	S	*	*			cis	-138.2	145.3	47.7	-100.7	153.9	0	0	0	114.5
1225	Q	27.3	Very low	28	Very low	154 Å²	154	132.7 Å²	132.7	72%	0.72	75%	0.752	S	S	*	*			trans	-63.6	164.9	165.2	-56.1	135.8	-72.1	0	0	109.3
1226	S	27	Very low	28.2	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	75%	0.753	S	S	*	*			cis	175.2	163.9	45.9	21.6	0	0	0	0	108.2
1227	S	26.9	Very low	28.1	Very low	92 Å²	92	131 Å²	131	64%	0.643	75%	0.751	S	S	*	*			cis	-172.3	176.4	-20.7	56.9	0	0	0	0	109.6
1228	N	27.3	Very low	28.1	Very low	133 Å²	133	133 Å²	133	71%	0.711	75%	0.751	S	S	*	*			trans	78.3	110	145.4	-73	-0.6	0	0	0	122.4
1229	L	30.2	Very low	28.2	Very low	132 Å²	132	131.3 Å²	131.3	69%	0.691	75%	0.747	S	S	*	*				99.6	87.7	116.6	-71.3	171.7	0	0	0	120.6
1230	N	29.7	Very low	28	Very low	151 Å²	151	131.9 Å²	131.9	81%	0.807	74%	0.744	S	S	*	*				78.8	156.8	115.5	-89.7	11.3	0	0	0	120.7
1231	P	37.5	Very low	28.3	Very low	107 Å²	107	135.9 Å²	135.9	70%	0.695	75%	0.751	S	S	*	*			trans	-116.6	-178	-153.1	43.1	-32.7	0	0	0	113.3
1232	N	30.9	Very low	28	Very low	164 Å²	164	136 Å²	136	88%	0.877	75%	0.747	S	S	*	*			trans	-146.2	147.6	143.2	-109.1	-36.8	0	0	0	111.6
1233	C	24.8	Very low	28.1	Very low	115 Å²	115	137 Å²	137	78%	0.777	75%	0.753	S	S	*	*			trans	-74.8	169.9	166.7	-59.6	0	0	0	0	109.8
1234	T	27.9	Very low	28.2	Very low	117 Å²	117	137.1 Å²	137.1	72%	0.718	75%	0.754	S	S	*	*				-171.6	134.7	105.5	-67.8	0	0	0	0	109.7	I1236	T1234-I1236 HydrophobicContact CG2-CD1 4.2Å; T1234-I1236 HydrophobicContact CG2-CG1 3.75Å
1235	I	26.5	Very low	28	Very low	156 Å²	156	136 Å²	136	80%	0.8	75%	0.748	S	S	*	*			trans	-88.8	127.3	169.3	-63.1	165.7	0	0	0	107.5
1236	I	29.1	Very low	28.1	Very low	150 Å²	150	133.8 Å²	133.8	77%	0.769	75%	0.746	S	S	*	*			trans	-129.1	92	168.4	-55.3	-171.2	0	0	0	110.1	T1234	T1234-I1236 HydrophobicContact CG2-CD1 4.2Å; T1234-I1236 HydrophobicContact CG2-CG1 3.75Å
1237	T	23.5	Very low	28.2	Very low	108 Å²	108	134.2 Å²	134.2	66%	0.663	74%	0.744	S	S	*	*			trans	-59.9	151.3	147.6	-40.9	0	0	0	0	109.3
1238	I	26.5	Very low	28.4	Very low	147 Å²	147	135.9 Å²	135.9	75%	0.754	75%	0.745	S	S	*	*			trans	172.1	115.6	133	-90.6	157.4	0	0	0	113.9
1239	T	26.6	Very low	28.7	Very low	111 Å²	111	135.3 Å²	135.3	68%	0.681	74%	0.743	S	S	*	*			trans	49.3	137.7	144.3	70.4	0	0	0	0	124.8
1240	N	26.1	Very low	28.8	Very low	154 Å²	154	134.9 Å²	134.9	82%	0.824	74%	0.741	S	S	*	*			trans	-41.3	150.3	142.4	-70.8	-30	0	0	0	113.5
1241	Y	29.8	Very low	28.9	Very low	217 Å²	217	133.6 Å²	133.6	85%	0.851	73%	0.734	S	S	*	*			trans	-157.2	129.9	133.9	-107.1	-73.7	0	0	0	110.9
1242	N	26.5	Very low	28.7	Very low	145 Å²	145	136.8 Å²	136.8	78%	0.775	74%	0.737	S	S	*	*			trans	-84.1	141.1	153.5	-77	-25.9	0	0	0	107.5
1243	T	28.9	Very low	28.6	Very low	115 Å²	115	134.3 Å²	134.3	71%	0.706	73%	0.728	S	S	*	*				170.8	132.7	112.5	39.1	0	0	0	0	111.6
1244	D	27.5	Very low	29	Very low	139 Å²	139	136 Å²	136	74%	0.743	73%	0.728	S	S	*	*			trans	70.5	132.5	138	-50.7	-12.9	0	0	0	123.2
1245	D	28.3	Very low	29.1	Very low	139 Å²	139	137.5 Å²	137.5	74%	0.743	73%	0.731	S	S	*	*			trans	78.2	104.6	136.4	-75.9	-1.6	0	0	0	124.4
1246	T	28.1	Very low	29.5	Very low	109 Å²	109	134.9 Å²	134.9	67%	0.669	73%	0.727	S	S	*	*				94.2	104.7	121.8	60.6	0	0	0	0	121.8
1247	T	29.4	Very low	29.5	Very low	118 Å²	118	134.6 Å²	134.6	72%	0.724	73%	0.727	S	S	*	*				83.1	135.6	126.5	63.1	0	0	0	0	122.4
1248	N	31.5	Very low	30	Very low	126 Å²	126	135.9 Å²	135.9	67%	0.674	74%	0.735	S	S	*	*			trans	73.4	97.9	138.2	-73.8	-14.7	0	0	0	120.7
1249	N	32.6	Very low	30.2	Very low	122 Å²	122	135.6 Å²	135.6	65%	0.652	74%	0.735	S	S	*	*				106.7	129.9	101.4	-83.5	-18.7	0	0	0	120.5
1250	N	33.1	Very low	30.5	Very low	122 Å²	122	136.1 Å²	136.1	65%	0.652	74%	0.738	S	S	*	*			trans	84.2	113.5	134	-74.1	-22.7	0	0	0	121
1251	N	32.1	Very low	30.6	Very low	125 Å²	125	135.3 Å²	135.3	67%	0.668	73%	0.734	S	S	*	*			trans	72.9	138.7	131.6	-63.3	-37.6	0	0	0	117.5
1252	K	32	Very low	30.7	Very low	173 Å²	173	133.6 Å²	133.6	75%	0.752	73%	0.733	S	S	*	*			cis	-165.6	160.3	11.9	-125.4	168.9	-174	178.3	0	111.3
1253	T	29.8	Very low	30.7	Very low	112 Å²	112	137.8 Å²	137.8	69%	0.687	74%	0.738	S	S	*	*			trans	1.8	147.9	143.8	59.9	0	0	0	0	118.8
1254	I	32.8	Very low	30.7	Very low	151 Å²	151	140 Å²	140	77%	0.774	75%	0.745	S	S	*	*				-160.1	131.9	55.9	-70	173.6	0	0	0	107.1
1255	N	30.2	Very low	30.7	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	74%	0.737	S	S	*	*				86	153.5	60.3	-135.1	18.6	0	0	0	116
1256	S	34.2	Very low	30.7	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	74%	0.74	S	S	*	*			trans	80.1	119	-176.6	70	0	0	0	0	116.6
1257	N	30.1	Very low	30.8	Very low	144 Å²	144	135.2 Å²	135.2	77%	0.77	74%	0.738	S	S	*	*				81.3	124.8	53.5	-63.1	7.6	0	0	0	111.6
1258	T	34.6	Very low	30.7	Very low	135 Å²	135	133.2 Å²	133.2	83%	0.828	72%	0.723	S	S	*	*				-162.4	161.6	72.2	41.7	0	0	0	0	114.6
1259	D	30.3	Very low	30.8	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	72%	0.718	S	S	*	*			trans	-70.1	165.5	174.4	-44.5	-104.2	0	0	0	115
1260	T	32.9	Very low	30.6	Very low	123 Å²	123	128.5 Å²	128.5	76%	0.755	70%	0.699	S	S	*	*				172.6	128.7	105.5	34.4	0	0	0	0	116.6
1261	N	28.9	Very low	30.4	Very low	137 Å²	137	126.9 Å²	126.9	73%	0.733	69%	0.69	S	S	*	*			trans	69.7	150.7	133.1	-69.6	-38.7	0	0	0	125.7
1262	Q	31.9	Very low	30.5	Very low	180 Å²	180	123.3 Å²	123.3	84%	0.841	67%	0.673	S	S	*	*			trans	66.3	114	160.3	-68.7	160.8	24.2	0	0	116.9
1263	R	24.9	Very low	30.4	Very low	233 Å²	233	121.7 Å²	121.7	88%	0.879	67%	0.673	S	S	*	*			cis	84.5	140	24.6	-151	-173.8	-157.4	-170.8	8.4	114
1264	L	30.5	Very low	30.3	Very low	162 Å²	162	121.4 Å²	121.4	85%	0.848	68%	0.676	S	S	*	*			trans	88	148.6	-169.6	-57.4	161.1	0	0	0	113.8
1265	S	26.5	Very low	30.2	Very low	83 Å²	83	119.7 Å²	119.7	58%	0.58	68%	0.675	S	S	*	*			cis	172.9	146	-49	46	0	0	0	0	108.8
1266	S	27.5	Very low	30.1	Very low	115 Å²	115	122.4 Å²	122.4	80%	0.804	68%	0.68	S	S	*	*			trans	61.2	157.2	176.7	24.4	0	0	0	0	115
1267	S	31.1	Very low	29.9	Very low	89 Å²	89	128.9 Å²	128.9	62%	0.622	70%	0.699	S	S	*	*			cis	-157.4	137.2	-8.6	37.4	0	0	0	0	110.1
1268	D	27.1	Very low	29.9	Very low	76 Å²	76	128.2 Å²	128.2	41%	0.406	70%	0.695	S	S	.	*			trans	69.9	144.5	134.5	-59.6	-30.4	0	0	0	123.6	K361 N362	K361-D1268 HydrophobicContact CD-CB 3.6Å; K361-D1268 WeakPolarHBondContact CD-OD1 3.29Å; K361-D1268 IonicContact NZ-OD1 3.5Å; K361-D1268 PolarHBondContact NZ-OD1 2.98Å; N362-D1268 WeakPolarHBondContact ND2-CB 3.5Å; N362-D1268 PolarHBondContact ND2-OD2 3.48Å; N362-D1268 WeakPolarHBondContact OD1-CB 3.17Å; N362-D1268 PolarHBondContact OD1-OD1 3.43Å; N362-D1268 PolarHBondContact OD1-OD2 2.99Å; N362-D1268 VanDerWaalsContact OD1-OD2 3.12Å
1269	I	32.7	Very low	29.7	Very low	111 Å²	111	127.8 Å²	127.8	57%	0.569	69%	0.689	S	S	*	*			trans	98.9	99.9	-177.2	-63.6	161.6	0	0	0	114.4	R360 K361	R360-I1269 HydrophobicContact CB-CB 3.8Å; R360-I1269 HydrophobicContact CB-CG1 3.79Å; R360-I1269 HydrophobicContact CB-CG2 3.67Å; R360-I1269 HydrophobicContact CG-CB 4.29Å; R360-I1269 HydrophobicContact CG-CG2 3.67Å; R360-I1269 VanDerWaalsContact NH1-C 3.3Å; R360-I1269 PolarHBondContact NH1-O 3.06Å; K361-I1269 VanDerWaalsContact CE-N 3.3Å
1270	S	29.1	Very low	29.7	Very low	38 Å²	38	127.1 Å²	127.1	27%	0.266	69%	0.685	S	S	.	*			cis	76.7	141.7	8	87.9	0	0	0	0	126.2	R360 K361	R360-S1270 WeakPolarHBondContact CA-O 3.49Å; R360-S1270 WeakPolarHBondContact CB-O 3.32Å; R360-S1270 WeakPolarHBondContact CD-O 3.28Å; R360-S1270 WeakPolarHBondContact CG-O 3.21Å; R360-S1270 VanDerWaalsContact CZ-C 3.43Å; R360-S1270 VanDerWaalsContact CZ-N 3.34Å; R360-S1270 PolarHBondContact N-O 3.11Å; R360-S1270 PolarHBondContact NE-O 3.41Å; R360-S1270 VanDerWaalsContact NH1-N 3.13Å; K361-S1270 VanDerWaalsContact CB-OG 3.23Å; K361-S1270 WeakPolarHBondContact CB-OG 3.41Å; K361-S1270 WeakPolarHBondContact CE-OG 3.4Å; K361-S1270 WeakPolarHBondContact CG-OG 3.43Å
1271	D	29.5	Very low	29.5	Very low	87 Å²	87	127.3 Å²	127.3	47%	0.465	68%	0.681	S	S	.	*			trans	62.5	139.2	-178	29.8	-49.5	0	0	0	115	S359 R360	S359-D1271 WeakPolarHBondContact CA-OD2 3.49Å; S359-D1271 PolarHBondContact OG-O 3.36Å; R360-D1271 VanDerWaalsContact N-CG 3.26Å; R360-D1271 PolarHBondContact N-OD2 2.67Å; R360-D1271 PolarHBondContact NE-O 3.15Å; R360-D1271 PolarHBondContact NH2-O 3.25Å
1272	V	33.1	Very low	29.5	Very low	51 Å²	51	126.7 Å²	126.7	31%	0.309	68%	0.678	S	S	.	*				-142.3	170.5	62.1	-156.7	0	0	0	0	109.2	F358 S359	F358-V1272 HydrophobicContact CB-CG2 4.28Å; F358-V1272 HydrophobicContact CD1-CG2 3.93Å; F358-V1272 HydrophobicContact CD2-CB 4.48Å; F358-V1272 HydrophobicContact CD2-CG1 4.07Å; F358-V1272 HydrophobicContact CD2-CG2 3.81Å; F358-V1272 HydrophobicContact CE1-CG2 4.11Å; F358-V1272 HydrophobicContact CE2-CG1 4.49Å; F358-V1272 HydrophobicContact CE2-CG2 4Å; F358-V1272 HydrophobicContact CG-CG2 3.74Å; F358-V1272 HydrophobicContact CZ-CG2 4.13Å; S359-V1272 VanDerWaalsContact CB-CG2 3.46Å; S359-V1272 WeakPolarHBondContact OG-CG2 3.34Å
1273	D	29.9	Very low	29.3	Very low	138 Å²	138	123.1 Å²	123.1	74%	0.738	67%	0.667	S	S	*	*			trans	-47.7	165.2	155.4	-37	-89	0	0	0	112.6
1274	S	29.1	Very low	29.7	Very low	107 Å²	107	115.3 Å²	115.3	75%	0.748	65%	0.651	S	S	*	*			cis	-157.1	-163	17.5	-158.4	0	0	0	0	112.1
1275	C	29.9	Very low	29.6	Very low	114 Å²	114	111.7 Å²	111.7	77%	0.77	64%	0.636	S	S	*	*			trans	71.2	85.6	164.6	-65.1	0	0	0	0	117.4
1276	K	28.2	Very low	29.8	Very low	207 Å²	207	114.1 Å²	114.1	90%	0.9	64%	0.641	S	S	*	*			trans	-7.1	140.5	136.5	-59.6	166.4	-179.7	168	0	116.2
1277	H	31.2	Very low	30.1	Very low	236 Å²	236	114 Å²	114	100%	1.093	63%	0.626	S	S	*	*				-132.3	0	124.8	-148.3	-43	0	0	0	110.2

Retrieved 1,277 of 1,277 residues in 1190 ms (Link to these results)

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