A0A096NV78_PAPAN Loading...

DLG associated protein 5

AlphaFold DB , UniProt , Accession A0A096NV78, Species PAPAN (Papio anubis, Olive baboon), Gene DLGAP5, Length 847 aa.

						>A0A096NV78_PAPAN|A0A096NV78|DLGAP5
MSSSHFASRHRKDLSTEMIRTKIAHRKSLSQKENRHKEYERNRHFGLKDVNIPTLEGRILVELDETSQELIPEKAIVKPRAMKTILGDQRKQMLQKYKEEKQLQKLKEQREKAKRGIFKVGRYRPDMPCFLLSNQNAVKAEPKKAIPSSVRITRSKAKDQMEQTKIDNESDVRAIQPGQRQTSEKKVSNKEKKVVQPVMPISLRMTRSATQAAKQVPRTVSSTTARKPVTRAANENEPERKVPSNKGRPAKNVGTKPDKGISCKVDSEENTLNSQTSATSGMDPDGVLSKMENLPEMNTAKIKGKNSFAPKDFMFQPLDGLKTYQVTPMTPRSANAFLTPSYTWTPLKTEVDESQEATKEILAQKCKTYSTKTIQQDSNKLQCPLGPLTVWHEEHVLNKNEATTKNSNGLPIKEVPPLERNEGQITQPHHDVPYFRNILQSETEKLTSHCLEWDRKLELDIPDDAKDLIRTAVGQTRLLMKERFKQFEGLVGDCEYKRGVKETTCSDLDGFWDMISFQIEDVIHKFNNLIKLEESGWQVNNNMNNNMNKNVFRKKVVSGIASKPKQDDAGRIAARNRLAAIKNAMRERIKQEEHAETAASVIPKEVDKIVFDAGFFRVESPIKAFSGISVSSEGPSQRLRTPKSVSKAVSQSRSEMGLPQQTTSPESAGPQNTKSEPVKKTLFLNIPESRNSIVEDAQCPGLPDLIEENHDVNKTNLKVDCLPSEGMSLPLLAGGVADDINTNKKEGISDVVEGMELNSSITSQDVLMSSPEKNTASQNSILEEGETKISQSVLFDKSLTTECHLLDSPGLQCSNPFTQLERRHQEHARHISFGGNLITFSPLQGEF
					

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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	47.3	Very low	54.8	Low	242 Å²	242	153.4 Å²	153.4	100%	1.192	80%	0.799	S	S	*	*				0	137.5	0	-62.4	168.3	78.4	0	0	107.8
2	S	44.4	Very low	56.1	Low	129 Å²	129	155.6 Å²	155.6	90%	0.902	80%	0.798	S	S	*	*			trans	-141.1	126.2	169.7	-63.5	0	0	0	0	108.8
3	S	50.8	Low	57.3	Low	120 Å²	120	149.6 Å²	149.6	84%	0.839	77%	0.769	S	S	*	*			trans	-89.1	144.5	-177.2	-166.7	0	0	0	0	111.7	H5	S3-H5 PolarHBondContact O-N 2.82Å
4	S	60.6	Low	58.9	Low	94 Å²	94	148.7 Å²	148.7	66%	0.657	77%	0.765	S	S	*	*			trans	-78.8	122.8	-171.4	-178.7	0	0	0	0	113	F6	S4-F6 PolarHBondContact O-N 2.89Å; S4-F6 VanDerWaalsContact O-N 3.15Å
5	H	56.5	Low	60.8	Low	173 Å²	173	142.3 Å²	142.3	80%	0.801	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-70.6	-2.7	179.3	-109	-70.5	0	0	0	115.1	S3 S8	S3-H5 PolarHBondContact O-N 2.82Å; H5-S8 PolarHBondContact O-OG 3.08Å
6	F	55.3	Low	62.3	Low	158 Å²	158	139.2 Å²	139.2	69%	0.693	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-77.1	-24.5	-165.5	-125.1	-95.1	0	0	0	115.3	S4 S8	S4-F6 PolarHBondContact O-N 2.89Å; S4-F6 VanDerWaalsContact O-N 3.15Å; F6-S8 PolarHBondContact O-N 2.84Å; F6-S8 VanDerWaalsContact O-N 3.13Å
7	A	57.3	Low	63.8	Low	91 Å²	91	136.3 Å²	136.3	75%	0.752	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-68.7	-12.4	-170	0	0	0	0	0	115.4
8	S	55.5	Low	65.3	Low	74 Å²	74	132.4 Å²	132.4	52%	0.517	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-79.7	-30.1	-177.9	58.3	0	0	0	0	113.9	H5 F6 H10 R11	H5-S8 PolarHBondContact O-OG 3.08Å; F6-S8 PolarHBondContact O-N 2.84Å; F6-S8 VanDerWaalsContact O-N 3.13Å; S8-H10 PolarHBondContact O-N 3.2Å; S8-H10 VanDerWaalsContact O-N 3.1Å; S8-R11 PolarHBondContact O-N 3.48Å; S8-R11 VanDerWaalsContact O-N 3.14Å
9	R	57.4	Low	66.6	Low	209 Å²	209	129.6 Å²	129.6	79%	0.789	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-15.1	-167.4	-69.1	-171	174.7	-135.2	-0.7	115.5
10	H	55.6	Low	67.9	Low	175 Å²	175	129.5 Å²	129.5	81%	0.81	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	4.8	177	-78.7	-72.8	0	0	0	114.9	S8 K12	S8-H10 PolarHBondContact O-N 3.2Å; S8-H10 VanDerWaalsContact O-N 3.1Å; H10-K12 PolarHBondContact O-N 3.38Å
11	R	61.8	Low	69.2	Low	222 Å²	222	126.8 Å²	126.8	84%	0.838	65%	0.654	S	S	*	*			trans	-69	103.4	173	-70.9	-154.1	174.1	-145.9	-0.6	110.1	S8 D13	S8-R11 PolarHBondContact O-N 3.48Å; S8-R11 VanDerWaalsContact O-N 3.14Å; R11-D13 PolarHBondContact O-N 3.5Å
12	K	70.4	Confident	71.3	Confident	180 Å²	180	119.6 Å²	119.6	78%	0.783	62%	0.616	S	S	*	*			trans	-58	108.5	172.2	-66.4	167.2	-175.6	166.9	0	108.3	H10 L14	H10-K12 PolarHBondContact O-N 3.38Å; K12-L14 PolarHBondContact O-N 3.46Å
13	D	72.1	Confident	73.6	Confident	78 Å²	78	117.3 Å²	117.3	42%	0.417	59%	0.592	S	S	.	*			trans	-59.7	126.6	176.7	179.5	22	0	0	0	110.6	R11 S15 M18 K22	R11-D13 PolarHBondContact O-N 3.5Å; D13-S15 WeakPolarHBondContact OD1-CB 3.42Å; D13-S15 PolarHBondContact OD1-N 3.03Å; D13-S15 WeakPolarHBondContact OD2-CB 3.4Å; D13-M18 HydrophobicContact CB-CB 4.32Å; D13-M18 HydrophobicContact CB-CE 4.33Å; D13-M18 HydrophobicContact CB-CG 3.98Å; D13-M18 VanDerWaalsContact O-CG 3.27Å; D13-M18 WeakPolarHBondContact O-CG 3.46Å; D13-M18 VanDerWaalsContact OD2-CB 3.28Å; D13-M18 WeakPolarHBondContact OD2-CB 3.28Å; D13-K22 PolarHBondContact O-NZ 3.2Å; D13-K22 VanDerWaalsContact O-NZ 3.15Å
14	L	79.6	Confident	75.7	Confident	137 Å²	137	114.3 Å²	114.3	72%	0.717	58%	0.575	S	S	*	*			trans	-106.4	4.6	-179.5	-61	-177.1	0	0	0	112.1	K12 T16 I19	K12-L14 PolarHBondContact O-N 3.46Å; L14-T16 PolarHBondContact O-N 2.9Å; L14-I19 WeakPolarHBondContact O-CD1 3.48Å
15	S	86.8	Confident	77.2	Confident	53 Å²	53	115.2 Å²	115.2	37%	0.371	57%	0.569	S	S	.	*			trans	-45.2	139.8	171.1	173.3	0	0	0	0	111.3	D13 E17 M18 I19	D13-S15 WeakPolarHBondContact OD1-CB 3.42Å; D13-S15 PolarHBondContact OD1-N 3.03Å; D13-S15 WeakPolarHBondContact OD2-CB 3.4Å; S15-E17 PolarHBondContact O-N 3.49Å; S15-E17 VanDerWaalsContact O-N 3.13Å; S15-E17 PolarHBondContact OG-N 3.1Å; S15-M18 WeakPolarHBondContact O-CB 3.37Å; S15-M18 PolarHBondContact O-N 2.9Å; S15-I19 WeakPolarHBondContact O-CG1 3.11Å; S15-I19 PolarHBondContact O-N 2.87Å
16	T	86	Confident	79	Confident	92 Å²	92	116 Å²	116	56%	0.564	56%	0.564	S	S	*	*	H	α-helix	trans	-59.7	-26.8	177.9	66.1	0	0	0	0	111.7	L14 I19 R20	L14-T16 PolarHBondContact O-N 2.9Å; T16-I19 PolarHBondContact O-N 2.75Å; T16-R20 VanDerWaalsContact CB-NH1 3.34Å; T16-R20 WeakPolarHBondContact O-CB 3.47Å; T16-R20 WeakPolarHBondContact O-CG 3.43Å; T16-R20 PolarHBondContact O-N 2.88Å; T16-R20 PolarHBondContact OG1-NH1 3.37Å; T16-R20 PolarHBondContact OG1-NH2 3.42Å
17	E	87.5	Confident	80.8	Confident	90 Å²	90	115.4 Å²	115.4	42%	0.421	56%	0.562	S	S	.	*	H	α-helix	trans	-72.7	-42.7	174.1	-168.5	50.2	-111.9	0	0	112.3	S15 I19 R20 T21	S15-E17 PolarHBondContact O-N 3.49Å; S15-E17 VanDerWaalsContact O-N 3.13Å; S15-E17 PolarHBondContact OG-N 3.1Å; E17-I19 PolarHBondContact O-N 3.37Å; E17-R20 PolarHBondContact O-N 3.27Å; E17-R20 IonicContact OE1-NE 3.18Å; E17-R20 IonicContact OE2-CZ 2.61Å; E17-R20 IonicContact OE2-NE 3.39Å; E17-R20 PolarHBondContact OE2-NE 2.88Å; E17-R20 IonicContact OE2-NH2 3.56Å; E17-R20 PolarHBondContact OE2-NH2 3.03Å; E17-T21 VanDerWaalsContact O-CB 3.31Å; E17-T21 WeakPolarHBondContact O-CB 3.28Å; E17-T21 PolarHBondContact O-N 2.94Å; E17-T21 PolarHBondContact O-OG1 3.33Å; E17-T21 VanDerWaalsContact O-OG1 3.12Å; E17-T21 PolarHBondContact OE1-OG1 3.24Å
18	M	91.2	Very high	82.6	Confident	66 Å²	66	114.3 Å²	114.3	33%	0.325	55%	0.549	S	S	.	.	H	α-helix	trans	-62.1	-34.5	173.5	-179.8	59.1	62.5	0	0	111.6	D13 S15 K22	D13-M18 HydrophobicContact CB-CB 4.32Å; D13-M18 HydrophobicContact CB-CE 4.33Å; D13-M18 HydrophobicContact CB-CG 3.98Å; D13-M18 VanDerWaalsContact O-CG 3.27Å; D13-M18 WeakPolarHBondContact O-CG 3.46Å; D13-M18 VanDerWaalsContact OD2-CB 3.28Å; D13-M18 WeakPolarHBondContact OD2-CB 3.28Å; S15-M18 WeakPolarHBondContact O-CB 3.37Å; S15-M18 PolarHBondContact O-N 2.9Å; M18-K22 HydrophobicContact CG-CD 4.08Å; M18-K22 VanDerWaalsContact O-CB 3.32Å; M18-K22 WeakPolarHBondContact O-CB 3.45Å; M18-K22 WeakPolarHBondContact O-CD 3.39Å; M18-K22 WeakPolarHBondContact O-CG 3.39Å; M18-K22 PolarHBondContact O-N 3.5Å; M18-K22 HydrophobicContact SD-CD 4.17Å; M18-K22 WeakPolarHBondContact SD-CE 3.31Å; M18-K22 HydrophobicContact SD-CG 4.36Å
19	I	88.8	Confident	84.4	Confident	79 Å²	79	115.1 Å²	115.1	41%	0.405	55%	0.546	S	S	.	.	H	α-helix	trans	-69.4	-46.8	172.5	-64.9	170.8	0	0	0	111.1	L14 S15 T16 E17 T21 K22 I23	L14-I19 WeakPolarHBondContact O-CD1 3.48Å; S15-I19 WeakPolarHBondContact O-CG1 3.11Å; S15-I19 PolarHBondContact O-N 2.87Å; T16-I19 PolarHBondContact O-N 2.75Å; E17-I19 PolarHBondContact O-N 3.37Å; I19-T21 PolarHBondContact O-N 3.09Å; I19-K22 PolarHBondContact O-N 2.98Å; I19-I23 HydrophobicContact CG2-CD1 3.85Å; I19-I23 VanDerWaalsContact O-CG1 3.31Å; I19-I23 WeakPolarHBondContact O-CG1 3.44Å; I19-I23 PolarHBondContact O-N 3.29Å
20	R	93.9	Very high	86	Confident	127 Å²	127	107.5 Å²	107.5	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-55.7	-48.8	174	-79.6	-174.8	-67.4	-88	4.9	111.3	T16 E17 I23 A24	T16-R20 VanDerWaalsContact CB-NH1 3.34Å; T16-R20 WeakPolarHBondContact O-CB 3.47Å; T16-R20 WeakPolarHBondContact O-CG 3.43Å; T16-R20 PolarHBondContact O-N 2.88Å; T16-R20 PolarHBondContact OG1-NH1 3.37Å; T16-R20 PolarHBondContact OG1-NH2 3.42Å; E17-R20 PolarHBondContact O-N 3.27Å; E17-R20 IonicContact OE1-NE 3.18Å; E17-R20 IonicContact OE2-CZ 2.61Å; E17-R20 IonicContact OE2-NE 3.39Å; E17-R20 PolarHBondContact OE2-NE 2.88Å; E17-R20 IonicContact OE2-NH2 3.56Å; E17-R20 PolarHBondContact OE2-NH2 3.03Å; R20-I23 PolarHBondContact O-N 2.91Å; R20-A24 WeakPolarHBondContact O-CB 3.5Å; R20-A24 PolarHBondContact O-N 2.95Å
21	T	93.5	Very high	87.7	Confident	74 Å²	74	105 Å²	105	45%	0.454	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-45.3	177.8	-67.8	0	0	0	0	112	E17 I19 I23 A24 H25	E17-T21 VanDerWaalsContact O-CB 3.31Å; E17-T21 WeakPolarHBondContact O-CB 3.28Å; E17-T21 PolarHBondContact O-N 2.94Å; E17-T21 PolarHBondContact O-OG1 3.33Å; E17-T21 VanDerWaalsContact O-OG1 3.12Å; E17-T21 PolarHBondContact OE1-OG1 3.24Å; I19-T21 PolarHBondContact O-N 3.09Å; T21-I23 VanDerWaalsContact C-N 3.31Å; T21-I23 PolarHBondContact O-N 3.4Å; T21-A24 PolarHBondContact O-N 3.39Å; T21-H25 WeakPolarHBondContact O-CB 3.35Å; T21-H25 PolarHBondContact O-N 2.96Å
22	K	92.8	Very high	89.2	Confident	91 Å²	91	101.1 Å²	101.1	40%	0.396	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-35.6	174.1	-76	163.8	-178.8	160.6	0	112.5	D13 M18 I19 R26	D13-K22 PolarHBondContact O-NZ 3.2Å; D13-K22 VanDerWaalsContact O-NZ 3.15Å; M18-K22 HydrophobicContact CG-CD 4.08Å; M18-K22 VanDerWaalsContact O-CB 3.32Å; M18-K22 WeakPolarHBondContact O-CB 3.45Å; M18-K22 WeakPolarHBondContact O-CD 3.39Å; M18-K22 WeakPolarHBondContact O-CG 3.39Å; M18-K22 PolarHBondContact O-N 3.5Å; M18-K22 HydrophobicContact SD-CD 4.17Å; M18-K22 WeakPolarHBondContact SD-CE 3.31Å; M18-K22 HydrophobicContact SD-CG 4.36Å; I19-K22 PolarHBondContact O-N 2.98Å; K22-R26 WeakPolarHBondContact O-CB 3.29Å; K22-R26 VanDerWaalsContact O-CG 3.27Å; K22-R26 WeakPolarHBondContact O-CG 3.31Å; K22-R26 PolarHBondContact O-N 2.96Å; K22-R26 VanDerWaalsContact O-N 3.12Å
23	I	92	Very high	90.2	Very high	80 Å²	80	96.9 Å²	96.9	41%	0.41	49%	0.486	S	S	.	.	H	α-helix	trans	-71.5	-43	174.8	-68.9	166.9	0	0	0	111.1	I19 R20 T21 R26 K27	I19-I23 HydrophobicContact CG2-CD1 3.85Å; I19-I23 VanDerWaalsContact O-CG1 3.31Å; I19-I23 WeakPolarHBondContact O-CG1 3.44Å; I19-I23 PolarHBondContact O-N 3.29Å; R20-I23 PolarHBondContact O-N 2.91Å; T21-I23 VanDerWaalsContact C-N 3.31Å; T21-I23 PolarHBondContact O-N 3.4Å; I23-R26 PolarHBondContact O-N 3.25Å; I23-K27 HydrophobicContact CG2-CD 4.27Å; I23-K27 WeakPolarHBondContact O-CG 3.5Å; I23-K27 PolarHBondContact O-N 3.1Å
24	A	94.4	Very high	91	Very high	57 Å²	57	97.4 Å²	97.4	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-44.8	176.3	0	0	0	0	0	111.5	R20 T21 R26 K27 S28	R20-A24 WeakPolarHBondContact O-CB 3.5Å; R20-A24 PolarHBondContact O-N 2.95Å; T21-A24 PolarHBondContact O-N 3.39Å; A24-R26 PolarHBondContact O-N 2.98Å; A24-K27 PolarHBondContact O-N 3.45Å; A24-S28 WeakPolarHBondContact O-CB 3.35Å; A24-S28 PolarHBondContact O-N 3.32Å
25	H	93.8	Very high	91.5	Very high	114 Å²	114	98.5 Å²	98.5	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-44.6	175.4	-171.9	-111.5	0	0	0	112	T21 K27 S28 L29	T21-H25 WeakPolarHBondContact O-CB 3.35Å; T21-H25 PolarHBondContact O-N 2.96Å; H25-K27 PolarHBondContact O-N 2.94Å; H25-S28 PolarHBondContact O-N 3.36Å; H25-L29 WeakPolarHBondContact O-CB 3.4Å; H25-L29 WeakPolarHBondContact O-CG 3.26Å; H25-L29 PolarHBondContact O-N 3.32Å
26	R	93.7	Very high	91.5	Very high	188 Å²	188	101.4 Å²	101.4	71%	0.709	49%	0.491	S	S	*	.	H	α-helix	trans	-61.3	-40.3	174.1	-76.3	171.8	174.4	-177.7	-2.3	112.8	K22 I23 A24 S30	K22-R26 WeakPolarHBondContact O-CB 3.29Å; K22-R26 VanDerWaalsContact O-CG 3.27Å; K22-R26 WeakPolarHBondContact O-CG 3.31Å; K22-R26 PolarHBondContact O-N 2.96Å; K22-R26 VanDerWaalsContact O-N 3.12Å; I23-R26 PolarHBondContact O-N 3.25Å; A24-R26 PolarHBondContact O-N 2.98Å; R26-S30 WeakPolarHBondContact O-CB 3.38Å; R26-S30 PolarHBondContact O-N 3.14Å
27	K	92.9	Very high	91.6	Very high	147 Å²	147	102.2 Å²	102.2	64%	0.639	49%	0.487	S	S	*	.	H	α-helix	trans	-64.7	-44.2	173.9	-74.3	176.3	178.3	-179.5	0	111.6	I23 A24 H25 S30 Q31	I23-K27 HydrophobicContact CG2-CD 4.27Å; I23-K27 WeakPolarHBondContact O-CG 3.5Å; I23-K27 PolarHBondContact O-N 3.1Å; A24-K27 PolarHBondContact O-N 3.45Å; H25-K27 PolarHBondContact O-N 2.94Å; K27-S30 PolarHBondContact O-N 3.04Å; K27-Q31 WeakPolarHBondContact O-CB 3.26Å; K27-Q31 PolarHBondContact O-N 2.99Å
28	S	94.6	Very high	91.2	Very high	68 Å²	68	103.3 Å²	103.3	48%	0.476	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-46.6	177.7	-176.9	0	0	0	0	112.1	A24 H25 S30 Q31 K32	A24-S28 WeakPolarHBondContact O-CB 3.35Å; A24-S28 PolarHBondContact O-N 3.32Å; H25-S28 PolarHBondContact O-N 3.36Å; S28-S30 PolarHBondContact O-N 3.41Å; S28-Q31 CarbonylContact O-C 3.6Å; S28-Q31 PolarHBondContact O-N 2.94Å; S28-K32 PolarHBondContact O-N 2.95Å
29	L	93.1	Very high	90.8	Very high	90 Å²	90	107.4 Å²	107.4	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-47.6	173.5	-74.5	179.2	0	0	0	111.6	H25 Q31 K32 E33	H25-L29 WeakPolarHBondContact O-CB 3.4Å; H25-L29 WeakPolarHBondContact O-CG 3.26Å; H25-L29 PolarHBondContact O-N 3.32Å; L29-Q31 VanDerWaalsContact C-N 3.29Å; L29-Q31 PolarHBondContact O-N 3.5Å; L29-K32 PolarHBondContact O-N 3.36Å; L29-E33 VanDerWaalsContact O-CB 3.31Å; L29-E33 WeakPolarHBondContact O-CB 3.32Å; L29-E33 PolarHBondContact O-N 3.09Å
30	S	91.4	Very high	90.3	Very high	49 Å²	49	107.3 Å²	107.3	34%	0.343	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-32.3	176.8	-171.3	0	0	0	0	112.5	R26 K27 S28 N34	R26-S30 WeakPolarHBondContact O-CB 3.38Å; R26-S30 PolarHBondContact O-N 3.14Å; K27-S30 PolarHBondContact O-N 3.04Å; S28-S30 PolarHBondContact O-N 3.41Å; S30-N34 VanDerWaalsContact O-CB 3.24Å; S30-N34 WeakPolarHBondContact O-CB 3.45Å; S30-N34 PolarHBondContact O-N 2.87Å; S30-N34 PolarHBondContact O-ND2 2.78Å
31	Q	91.2	Very high	89.6	Confident	123 Å²	123	108.1 Å²	108.1	58%	0.575	51%	0.506	S	S	*	.	H	α-helix	trans	-72.8	-33.8	173.6	-170.5	178.2	3.7	0	0	112.5	K27 S28 L29 R35	K27-Q31 WeakPolarHBondContact O-CB 3.26Å; K27-Q31 PolarHBondContact O-N 2.99Å; S28-Q31 CarbonylContact O-C 3.6Å; S28-Q31 PolarHBondContact O-N 2.94Å; L29-Q31 VanDerWaalsContact C-N 3.29Å; L29-Q31 PolarHBondContact O-N 3.5Å; Q31-R35 WeakPolarHBondContact O-CB 2.99Å; Q31-R35 WeakPolarHBondContact O-CG 3.47Å; Q31-R35 PolarHBondContact O-N 2.83Å
32	K	93.9	Very high	88.8	Confident	141 Å²	141	110.7 Å²	110.7	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-67.4	-45.7	170.9	-172	179.6	179.1	-177.9	0	110.6	S28 L29 R35 H36	S28-K32 PolarHBondContact O-N 2.95Å; L29-K32 PolarHBondContact O-N 3.36Å; K32-R35 PolarHBondContact O-N 3.07Å; K32-H36 WeakPolarHBondContact O-CB 3.18Å; K32-H36 PolarHBondContact O-N 2.85Å
33	E	90.5	Very high	88	Confident	90 Å²	90	111.6 Å²	111.6	42%	0.421	52%	0.517	S	S	.	.	H	α-helix	trans	-61.8	-43.4	175.9	-172.2	-162.9	176.1	0	0	112	L29 H36 K37	L29-E33 VanDerWaalsContact O-CB 3.31Å; L29-E33 WeakPolarHBondContact O-CB 3.32Å; L29-E33 PolarHBondContact O-N 3.09Å; E33-H36 WeakPolarHBondContact O-CB 3.44Å; E33-H36 PolarHBondContact O-N 2.73Å; E33-K37 HydrophobicContact CG-CD 4.17Å; E33-K37 WeakPolarHBondContact O-CB 3.33Å; E33-K37 WeakPolarHBondContact O-CG 3.37Å; E33-K37 PolarHBondContact O-N 2.9Å; E33-K37 WeakPolarHBondContact OE1-CE 3.43Å; E33-K37 IonicContact OE1-NZ 2.62Å; E33-K37 PolarHBondContact OE1-NZ 3.39Å
34	N	89.3	Confident	86.2	Confident	89 Å²	89	115 Å²	115	48%	0.476	53%	0.532	S	S	.	.	H	α-helix	trans	-67.1	-42.8	176.8	-74.8	-37	0	0	0	111.5	S30 H36 K37 E38	S30-N34 VanDerWaalsContact O-CB 3.24Å; S30-N34 WeakPolarHBondContact O-CB 3.45Å; S30-N34 PolarHBondContact O-N 2.87Å; S30-N34 PolarHBondContact O-ND2 2.78Å; N34-H36 VanDerWaalsContact C-N 3.3Å; N34-H36 PolarHBondContact O-N 3.4Å; N34-K37 CarbonylContact O-C 3.58Å; N34-K37 PolarHBondContact O-N 3.29Å; N34-E38 WeakPolarHBondContact O-CB 3.34Å; N34-E38 PolarHBondContact O-N 2.97Å
35	R	90.9	Very high	83.9	Confident	160 Å²	160	119.8 Å²	119.8	60%	0.604	54%	0.542	S	S	*	.	H	α-helix	trans	-60.5	-39.1	171.7	-77.5	-172	-65.6	160.5	-2.5	112.1	Q31 K32 E38 Y39	Q31-R35 WeakPolarHBondContact O-CB 2.99Å; Q31-R35 WeakPolarHBondContact O-CG 3.47Å; Q31-R35 PolarHBondContact O-N 2.83Å; K32-R35 PolarHBondContact O-N 3.07Å; R35-E38 PolarHBondContact O-N 3.37Å; R35-Y39 VanDerWaalsContact O-CB 3.3Å; R35-Y39 WeakPolarHBondContact O-CB 3.31Å; R35-Y39 PolarHBondContact O-N 3.3Å
36	H	86.1	Confident	81.3	Confident	115 Å²	115	117.9 Å²	117.9	53%	0.532	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-40.7	174.2	-169.3	-44.9	0	0	0	111.8	K32 E33 N34 E38 Y39 E40	K32-H36 WeakPolarHBondContact O-CB 3.18Å; K32-H36 PolarHBondContact O-N 2.85Å; E33-H36 WeakPolarHBondContact O-CB 3.44Å; E33-H36 PolarHBondContact O-N 2.73Å; N34-H36 VanDerWaalsContact C-N 3.3Å; N34-H36 PolarHBondContact O-N 3.4Å; H36-E38 VanDerWaalsContact C-N 3.28Å; H36-E38 PolarHBondContact O-N 3.45Å; H36-Y39 PolarHBondContact O-N 2.92Å; H36-E40 IonicContact CE1-OE1 2.77Å; H36-E40 WeakPolarHBondContact ND1-CG 3.49Å; H36-E40 WeakPolarHBondContact O-CB 3.26Å; H36-E40 WeakPolarHBondContact O-CG 3.45Å; H36-E40 PolarHBondContact O-N 3.43Å
37	K	87.3	Confident	79.1	Confident	108 Å²	108	114.7 Å²	114.7	47%	0.47	55%	0.55	S	S	.	.	H	α-helix	trans	-74.5	-16.3	176.4	-74.6	173.4	173.7	175.9	0	113.9	E33 N34 R41	E33-K37 HydrophobicContact CG-CD 4.17Å; E33-K37 WeakPolarHBondContact O-CB 3.33Å; E33-K37 WeakPolarHBondContact O-CG 3.37Å; E33-K37 PolarHBondContact O-N 2.9Å; E33-K37 WeakPolarHBondContact OE1-CE 3.43Å; E33-K37 IonicContact OE1-NZ 2.62Å; E33-K37 PolarHBondContact OE1-NZ 3.39Å; N34-K37 CarbonylContact O-C 3.58Å; N34-K37 PolarHBondContact O-N 3.29Å; K37-R41 WeakPolarHBondContact O-CB 3.38Å; K37-R41 PolarHBondContact O-NH1 3.12Å
38	E	80.9	Confident	76.9	Confident	113 Å²	113	116.8 Å²	116.8	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-84.6	-45	170.1	-171	161.2	-140	0	0	109.9	N34 R35 H36 R41 N42	N34-E38 WeakPolarHBondContact O-CB 3.34Å; N34-E38 PolarHBondContact O-N 2.97Å; R35-E38 PolarHBondContact O-N 3.37Å; H36-E38 VanDerWaalsContact C-N 3.28Å; H36-E38 PolarHBondContact O-N 3.45Å; E38-R41 PolarHBondContact O-N 3.44Å; E38-N42 WeakPolarHBondContact O-CB 3.24Å; E38-N42 PolarHBondContact O-N 2.94Å; E38-N42 PolarHBondContact O-OD1 3.08Å
39	Y	81.6	Confident	74.2	Confident	153 Å²	153	119.3 Å²	119.3	60%	0.6	57%	0.567	S	S	*	*	H	α-helix	trans	-56.2	-52.3	171	-178.6	-97.8	0	0	0	112.5	R35 H36 R41 N42 R43	R35-Y39 VanDerWaalsContact O-CB 3.3Å; R35-Y39 WeakPolarHBondContact O-CB 3.31Å; R35-Y39 PolarHBondContact O-N 3.3Å; H36-Y39 PolarHBondContact O-N 2.92Å; Y39-R41 VanDerWaalsContact C-N 3.29Å; Y39-R41 PolarHBondContact O-N 2.95Å; Y39-N42 CarbonylContact O-C 3.59Å; Y39-N42 PolarHBondContact O-N 3.05Å; Y39-R43 WeakPolarHBondContact O-CB 3.48Å; Y39-R43 PolarHBondContact O-N 2.95Å
40	E	79.1	Confident	72.1	Confident	77 Å²	77	121.5 Å²	121.5	36%	0.36	58%	0.584	S	S	.	*	H	α-helix	trans	-64.4	-30.7	177.6	-70.2	-56.3	126.9	0	0	113.3	H36 H44	H36-E40 IonicContact CE1-OE1 2.77Å; H36-E40 WeakPolarHBondContact ND1-CG 3.49Å; H36-E40 WeakPolarHBondContact O-CB 3.26Å; H36-E40 WeakPolarHBondContact O-CG 3.45Å; H36-E40 PolarHBondContact O-N 3.43Å; E40-H44 PolarHBondContact O-N 3.42Å
41	R	79.3	Confident	69.7	Low	144 Å²	144	126.5 Å²	126.5	54%	0.543	61%	0.607	S	S	.	*	H	α-helix	trans	-69.9	-39.9	171.2	178.2	-178	-66.9	86.1	9.9	111.3	K37 E38 Y39 R43 H44	K37-R41 WeakPolarHBondContact O-CB 3.38Å; K37-R41 PolarHBondContact O-NH1 3.12Å; E38-R41 PolarHBondContact O-N 3.44Å; Y39-R41 VanDerWaalsContact C-N 3.29Å; Y39-R41 PolarHBondContact O-N 2.95Å; R41-R43 VanDerWaalsContact C-N 3.29Å; R41-H44 PolarHBondContact O-CD2 3.46Å; R41-H44 PolarHBondContact O-CE1 3.42Å; R41-H44 PolarHBondContact O-ND1 3.16Å; R41-H44 PolarHBondContact O-NE2 3.04Å
42	N	75.6	Confident	67.4	Low	128 Å²	128	126.6 Å²	126.6	68%	0.684	61%	0.61	S	S	*	*	H	α-helix	trans	-73.8	-25.5	179	-64	-6.1	0	0	0	111.5	E38 Y39	E38-N42 WeakPolarHBondContact O-CB 3.24Å; E38-N42 PolarHBondContact O-N 2.94Å; E38-N42 PolarHBondContact O-OD1 3.08Å; Y39-N42 CarbonylContact O-C 3.59Å; Y39-N42 PolarHBondContact O-N 3.05Å
43	R	76.1	Confident	64.7	Low	109 Å²	109	125.9 Å²	125.9	41%	0.411	62%	0.619	S	S	.	*	H	α-helix	trans	-69.8	-44.2	176	-167.7	177.5	-175.2	-149.7	-1.5	112.2	Y39 R41 F45	Y39-R43 WeakPolarHBondContact O-CB 3.48Å; Y39-R43 PolarHBondContact O-N 2.95Å; R41-R43 VanDerWaalsContact C-N 3.29Å; R43-F45 PolarHBondContact O-N 3.5Å
44	H	53.6	Low	61.9	Low	153 Å²	153	127.9 Å²	127.9	71%	0.708	64%	0.638	S	S	*	*			trans	43	7.1	176.9	-93.9	-9.7	0	0	0	119.9	E40 R41	E40-H44 PolarHBondContact O-N 3.42Å; R41-H44 PolarHBondContact O-CD2 3.46Å; R41-H44 PolarHBondContact O-CE1 3.42Å; R41-H44 PolarHBondContact O-ND1 3.16Å; R41-H44 PolarHBondContact O-NE2 3.04Å
45	F	46.2	Very low	59.8	Low	156 Å²	156	131.9 Å²	131.9	68%	0.684	66%	0.658	S	S	*	*			trans	-101.1	113	161.1	-81.3	-94	0	0	0	109.1	R43 L47	R43-F45 PolarHBondContact O-N 3.5Å; F45-L47 PolarHBondContact O-N 3.34Å
46	G	40.7	Very low	57.3	Low	74 Å²	74	133.2 Å²	133.2	76%	0.763	67%	0.671	S	S	*	*			trans	-71.8	107.8	168.6	0	0	0	0	0	109.2	K48	G46-K48 PolarHBondContact O-N 3.13Å; G46-K48 VanDerWaalsContact O-N 3.09Å
47	L	46.4	Very low	54.6	Low	122 Å²	122	131.1 Å²	131.1	64%	0.639	68%	0.681	S	S	*	*			trans	-63	111.7	167.1	-153.5	76	0	0	0	107	F45 D49	F45-L47 PolarHBondContact O-N 3.34Å; L47-D49 PolarHBondContact O-N 3.34Å
48	K	46.3	Very low	52.1	Low	191 Å²	191	138.2 Å²	138.2	83%	0.83	71%	0.705	S	S	*	*			trans	-72.1	108.1	168.3	-73.3	-176.3	177.5	-178.5	0	106.7	G46 V50	G46-K48 PolarHBondContact O-N 3.13Å; G46-K48 VanDerWaalsContact O-N 3.09Å; K48-V50 PolarHBondContact O-N 3.07Å; K48-V50 VanDerWaalsContact O-N 3.1Å
49	D	37.9	Very low	49.9	Very low	120 Å²	120	140.2 Å²	140.2	64%	0.642	72%	0.718	S	S	*	*			trans	-58.7	115.8	169.1	-82.7	-50.4	0	0	0	109	L47 N51	L47-D49 PolarHBondContact O-N 3.34Å; D49-N51 PolarHBondContact O-N 2.95Å; D49-N51 VanDerWaalsContact O-N 3.14Å
50	V	49	Very low	47.5	Very low	137 Å²	137	139.8 Å²	139.8	83%	0.83	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-10.4	-173.7	-176.3	0	0	0	0	111.9	K48 I52	K48-V50 PolarHBondContact O-N 3.07Å; K48-V50 VanDerWaalsContact O-N 3.1Å; V50-I52 PolarHBondContact O-N 3.19Å
51	N	42	Very low	45.2	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	22.1	-175.2	-68.2	-45	0	0	0	115	D49	D49-N51 PolarHBondContact O-N 2.95Å; D49-N51 VanDerWaalsContact O-N 3.14Å
52	I	42.5	Very low	42.7	Very low	125 Å²	125	143.1 Å²	143.1	64%	0.641	76%	0.755	S	S	*	*	S	Bend	trans	-119.2	111.2	168.4	-56.2	-179.3	0	0	0	109.3	V50 T54	V50-I52 PolarHBondContact O-N 3.19Å; I52-T54 PolarHBondContact O-N 3.47Å; I52-T54 VanDerWaalsContact O-N 3.08Å
53	P	38.4	Very low	40.6	Very low	126 Å²	126	144.5 Å²	144.5	82%	0.818	76%	0.761	S	S	*	*			trans	-61	112.7	178.2	-23.9	34.4	0	0	0	111.7	L55	P53-L55 PolarHBondContact O-N 2.98Å
54	T	31	Very low	38.2	Very low	131 Å²	131	146.5 Å²	146.5	80%	0.804	78%	0.78	S	S	*	*			trans	-90.2	91.3	175.6	-53.1	0	0	0	0	109	I52 E56	I52-T54 PolarHBondContact O-N 3.47Å; I52-T54 VanDerWaalsContact O-N 3.08Å; T54-E56 PolarHBondContact O-N 2.83Å
55	L	45.5	Very low	37.3	Very low	173 Å²	173	147.5 Å²	147.5	91%	0.906	79%	0.785	S	S	*	*			trans	-79.8	76.8	-179.7	-174.3	98.3	0	0	0	111.8	P53	P53-L55 PolarHBondContact O-N 2.98Å
56	E	36.9	Very low	36.4	Very low	188 Å²	188	146.6 Å²	146.6	88%	0.879	79%	0.793	S	S	*	*			trans	-161.6	147.8	158.5	-123.2	169.9	-164.4	0	0	111.8	T54	T54-E56 PolarHBondContact O-N 2.83Å
57	G	31.1	Very low	35.9	Very low	72 Å²	72	147.9 Å²	147.9	74%	0.742	79%	0.79	S	S	*	*			trans	92.9	63	171.9	0	0	0	0	0	116.7	I59	G57-I59 PolarHBondContact O-N 2.85Å
58	R	34	Very low	35	Very low	257 Å²	257	149.9 Å²	149.9	97%	0.97	80%	0.796	S	S	*	*			trans	-67.6	127.8	154.3	-67.1	-169.3	-167.5	-168.1	5.6	108.3
59	I	34.5	Very low	34.2	Very low	155 Å²	155	147.7 Å²	147.7	80%	0.795	79%	0.789	S	S	*	*			trans	-77.3	131	165	-62.8	171	0	0	0	107.4	G57 V61	G57-I59 PolarHBondContact O-N 2.85Å; I59-V61 HydrophobicContact CG2-CG2 4.31Å
60	L	31.4	Very low	33.8	Very low	144 Å²	144	149.9 Å²	149.9	75%	0.754	80%	0.799	S	S	*	*			trans	-127.3	120.1	152.6	-162.7	75.2	0	0	0	107.1	E62	L60-E62 HydrophobicContact CD2-CB 4.47Å
61	V	30.2	Very low	32.9	Very low	121 Å²	121	150.9 Å²	150.9	73%	0.733	80%	0.798	S	S	*	*			trans	-95.9	110.1	158.4	173.6	0	0	0	0	104.6	I59	I59-V61 HydrophobicContact CG2-CG2 4.31Å
62	E	27.4	Very low	33.1	Very low	170 Å²	170	148.2 Å²	148.2	79%	0.794	79%	0.79	S	S	*	*			trans	-87.9	125.7	177.7	-168.3	163.1	-157.5	0	0	108	L60	L60-E62 HydrophobicContact CD2-CB 4.47Å
63	L	31.8	Very low	32.4	Very low	156 Å²	156	151.7 Å²	151.7	82%	0.817	80%	0.803	S	S	*	*			trans	-111	111.2	178.8	-91.3	176	0	0	0	110.2
64	D	26.3	Very low	32.3	Very low	152 Å²	152	154.6 Å²	154.6	81%	0.813	80%	0.803	S	S	*	*			trans	64.6	156.9	155.1	-130.5	-21.9	0	0	0	119.2
65	E	34.6	Very low	32.4	Very low	174 Å²	174	153 Å²	153	81%	0.813	80%	0.803	S	S	*	*			trans	-92.2	142.9	-165.6	-57.7	179.6	154	0	0	112.9
66	T	27.2	Very low	32.1	Very low	137 Å²	137	152.5 Å²	152.5	84%	0.84	80%	0.8	S	S	*	*			trans	-153	101.4	146.1	-15.2	0	0	0	0	112.7
67	S	28.8	Very low	32.4	Very low	100 Å²	100	150 Å²	150	70%	0.699	80%	0.797	S	S	*	*			trans	22	123.4	149.8	60.5	0	0	0	0	120.8
68	Q	28.6	Very low	32.9	Very low	165 Å²	165	155.4 Å²	155.4	77%	0.771	80%	0.8	S	S	*	*				-155	151.5	107.2	-156.1	86.8	34.4	0	0	111
69	E	28.5	Very low	33.3	Very low	145 Å²	145	149.2 Å²	149.2	68%	0.678	79%	0.793	S	S	*	*			trans	-42.2	133.3	-177.7	-57.4	149.6	95	0	0	118.2
70	L	30.6	Very low	34	Very low	165 Å²	165	152.8 Å²	152.8	86%	0.864	80%	0.796	S	S	*	*				177.4	146.9	99.1	-92.3	169.8	0	0	0	113.7
71	I	29.4	Very low	34.8	Very low	158 Å²	158	148.7 Å²	148.7	81%	0.81	78%	0.784	S	S	*	*			trans	-149.8	151.2	-179.1	-68.5	179.8	0	0	0	106.6
72	P	46.3	Very low	36	Very low	99 Å²	99	150.7 Å²	150.7	64%	0.643	79%	0.787	S	S	*	*			cis	-124.7	177.4	-8.7	37.8	-23.3	0	0	0	114.2
73	E	27.9	Very low	37.2	Very low	197 Å²	197	151.5 Å²	151.5	92%	0.921	79%	0.788	S	S	*	*				-135.1	156.9	129	-165	156	-139.3	0	0	110.7
74	K	36.4	Very low	38.5	Very low	188 Å²	188	147.1 Å²	147.1	82%	0.817	77%	0.768	S	S	*	*			trans	-109.3	127.1	-162.9	-62.9	176	-177.8	173.3	0	113.1
75	A	32.4	Very low	40.1	Very low	98 Å²	98	145.1 Å²	145.1	81%	0.81	76%	0.756	S	S	*	*			trans	-142	128.7	157.1	0	0	0	0	0	110.5
76	I	40.4	Very low	41.2	Very low	162 Å²	162	142.7 Å²	142.7	83%	0.831	75%	0.748	S	S	*	*			trans	-97.8	104.8	-175.5	-60	173.5	0	0	0	110.1
77	V	42	Very low	43.2	Very low	134 Å²	134	137.6 Å²	137.6	81%	0.812	72%	0.722	S	S	*	*			trans	-127.5	120.6	163.6	-176.1	0	0	0	0	109.4
78	K	41.9	Very low	45.6	Very low	186 Å²	186	135.7 Å²	135.7	81%	0.809	70%	0.704	S	S	*	*			trans	-65.5	122.5	-177.3	-66.2	172.1	-178.5	170.5	0	110.1	R80	K78-R80 PolarHBondContact O-N 2.6Å; K78-R80 VanDerWaalsContact O-N 3.1Å
79	P	43.1	Very low	48.4	Very low	127 Å²	127	133.1 Å²	133.1	83%	0.825	69%	0.692	S	S	*	*			trans	-65.8	114.1	-179.7	25.2	-33.3	0	0	0	110.6	A81	P79-A81 PolarHBondContact O-N 3.01Å; P79-A81 VanDerWaalsContact O-N 3.14Å
80	R	48.7	Very low	51.2	Low	230 Å²	230	134.8 Å²	134.8	87%	0.868	69%	0.692	S	S	*	*			trans	-66.8	112.7	-179.7	-161.6	178.4	-167	176.5	5.3	109	K78 M82	K78-R80 PolarHBondContact O-N 2.6Å; K78-R80 VanDerWaalsContact O-N 3.1Å; R80-M82 PolarHBondContact O-N 2.86Å
81	A	49.3	Very low	53.9	Low	59 Å²	59	133.1 Å²	133.1	49%	0.488	68%	0.678	S	S	.	*			trans	-50.3	127.6	-162.6	0	0	0	0	0	114.5	P79 K83 T84	P79-A81 PolarHBondContact O-N 3.01Å; P79-A81 VanDerWaalsContact O-N 3.14Å; A81-K83 PolarHBondContact O-N 3.31Å; A81-T84 WeakPolarHBondContact O-CB 3.49Å; A81-T84 PolarHBondContact O-N 3.48Å; A81-T84 PolarHBondContact O-OG1 2.87Å
82	M	53.4	Low	56.9	Low	163 Å²	163	131.2 Å²	131.2	80%	0.803	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-26.4	-178.9	-66	172.9	171.7	0	0	113.9	R80 T84 I85	R80-M82 PolarHBondContact O-N 2.86Å; M82-T84 PolarHBondContact O-N 3.26Å; M82-T84 VanDerWaalsContact O-N 3.1Å; M82-I85 PolarHBondContact O-N 2.88Å; M82-I85 VanDerWaalsContact O-N 3.12Å
83	K	54.5	Low	58.8	Low	187 Å²	187	132.9 Å²	132.9	81%	0.813	67%	0.666	S	S	*	*	H	α-helix	trans	-53.7	-27.1	173.1	-64.6	-179.1	179.6	176.9	0	113.2	A81 G87	A81-K83 PolarHBondContact O-N 3.31Å; K83-G87 PolarHBondContact O-N 2.9Å
84	T	58.4	Low	61.7	Low	64 Å²	64	128 Å²	128	39%	0.393	65%	0.646	S	S	.	*	H	α-helix	trans	-68.3	-46.6	177.9	-34.8	0	0	0	0	111.4	A81 M82 L86 G87 D88	A81-T84 WeakPolarHBondContact O-CB 3.49Å; A81-T84 PolarHBondContact O-N 3.48Å; A81-T84 PolarHBondContact O-OG1 2.87Å; M82-T84 PolarHBondContact O-N 3.26Å; M82-T84 VanDerWaalsContact O-N 3.1Å; T84-L86 PolarHBondContact O-N 3.29Å; T84-G87 CarbonylContact O-C 3.53Å; T84-G87 WeakPolarHBondContact O-CA 3.23Å; T84-G87 PolarHBondContact O-N 3.35Å; T84-G87 VanDerWaalsContact O-N 3.1Å; T84-D88 PolarHBondContact O-N 3.13Å
85	I	60	Low	64.3	Low	109 Å²	109	124.5 Å²	124.5	56%	0.559	63%	0.633	S	S	*	*	H	α-helix	trans	-63.1	-46.3	-175.1	-58.2	172.7	0	0	0	110.7	M82 G87 D88 Q89	M82-I85 PolarHBondContact O-N 2.88Å; M82-I85 VanDerWaalsContact O-N 3.12Å; I85-G87 VanDerWaalsContact C-N 3.3Å; I85-G87 PolarHBondContact O-N 3.07Å; I85-D88 PolarHBondContact O-N 3.1Å; I85-Q89 PolarHBondContact O-N 2.7Å
86	L	57.2	Low	67.1	Low	124 Å²	124	126.5 Å²	126.5	65%	0.649	62%	0.623	S	S	*	*	H	α-helix	trans	-63.8	-36.9	175.4	-164.5	77.1	0	0	0	111.9	T84 R90	T84-L86 PolarHBondContact O-N 3.29Å; L86-R90 WeakPolarHBondContact O-CB 3.45Å; L86-R90 PolarHBondContact O-N 2.85Å; L86-R90 VanDerWaalsContact O-N 3.09Å
87	G	69.2	Low	69.6	Low	29 Å²	29	125 Å²	125	30%	0.299	61%	0.608	S	S	.	*	H	α-helix	trans	-62.4	-40.5	173.6	0	0	0	0	0	112.8	K83 T84 I85 R90 K91	K83-G87 PolarHBondContact O-N 2.9Å; T84-G87 CarbonylContact O-C 3.53Å; T84-G87 WeakPolarHBondContact O-CA 3.23Å; T84-G87 PolarHBondContact O-N 3.35Å; T84-G87 VanDerWaalsContact O-N 3.1Å; I85-G87 VanDerWaalsContact C-N 3.3Å; I85-G87 PolarHBondContact O-N 3.07Å; G87-R90 PolarHBondContact O-N 3.04Å; G87-K91 WeakPolarHBondContact O-CG 3.27Å; G87-K91 PolarHBondContact O-N 2.68Å
88	D	78.3	Confident	72	Confident	60 Å²	60	125.3 Å²	125.3	32%	0.321	60%	0.598	S	S	.	*	H	α-helix	trans	-77.1	-37.3	-178.9	-68.5	-31	0	0	0	112.7	T84 I85 R90 K91 Q92	T84-D88 PolarHBondContact O-N 3.13Å; I85-D88 PolarHBondContact O-N 3.1Å; D88-R90 VanDerWaalsContact C-N 3.29Å; D88-R90 PolarHBondContact O-N 3.27Å; D88-K91 WeakPolarHBondContact O-CB 3.4Å; D88-K91 PolarHBondContact O-N 2.75Å; D88-K91 VanDerWaalsContact O-N 3.17Å; D88-K91 WeakPolarHBondContact OD1-CD 3.48Å; D88-K91 VanDerWaalsContact OD1-CE 3.3Å; D88-K91 WeakPolarHBondContact OD1-CE 3.5Å; D88-K91 IonicContact OD1-NZ 2.6Å; D88-K91 PolarHBondContact OD1-NZ 3.01Å; D88-Q92 WeakPolarHBondContact O-CG 3.06Å; D88-Q92 PolarHBondContact O-N 3.33Å
89	Q	88.9	Confident	74.4	Confident	111 Å²	111	120.8 Å²	120.8	52%	0.519	58%	0.58	S	S	.	*	H	α-helix	trans	-55.9	-44.4	166.4	-75	-176.6	-12.3	0	0	111.5	I85 K91 Q92 M93	I85-Q89 PolarHBondContact O-N 2.7Å; Q89-K91 PolarHBondContact O-N 3.39Å; Q89-Q92 PolarHBondContact O-N 2.87Å; Q89-M93 PolarHBondContact O-N 3.38Å
90	R	86.9	Confident	76.7	Confident	180 Å²	180	120.5 Å²	120.5	68%	0.679	57%	0.568	S	S	*	*	H	α-helix	trans	-63.3	-37.9	176.6	-172.8	175	-179.6	170.5	1	112.3	L86 G87 D88 L94	L86-R90 WeakPolarHBondContact O-CB 3.45Å; L86-R90 PolarHBondContact O-N 2.85Å; L86-R90 VanDerWaalsContact O-N 3.09Å; G87-R90 PolarHBondContact O-N 3.04Å; D88-R90 VanDerWaalsContact C-N 3.29Å; D88-R90 PolarHBondContact O-N 3.27Å; R90-L94 HydrophobicContact CG-CD1 4.22Å; R90-L94 WeakPolarHBondContact O-CB 3.33Å; R90-L94 VanDerWaalsContact O-CG 3.27Å; R90-L94 WeakPolarHBondContact O-CG 3.12Å; R90-L94 PolarHBondContact O-N 2.86Å; R90-L94 VanDerWaalsContact O-N 3.09Å
91	K	88.1	Confident	78.7	Confident	130 Å²	130	113.4 Å²	113.4	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-63	-46.6	172.6	-68.9	169.2	-160.1	166	0	111.4	G87 D88 Q89 M93 L94 Q95	G87-K91 WeakPolarHBondContact O-CG 3.27Å; G87-K91 PolarHBondContact O-N 2.68Å; D88-K91 WeakPolarHBondContact O-CB 3.4Å; D88-K91 PolarHBondContact O-N 2.75Å; D88-K91 VanDerWaalsContact O-N 3.17Å; D88-K91 WeakPolarHBondContact OD1-CD 3.48Å; D88-K91 VanDerWaalsContact OD1-CE 3.3Å; D88-K91 WeakPolarHBondContact OD1-CE 3.5Å; D88-K91 IonicContact OD1-NZ 2.6Å; D88-K91 PolarHBondContact OD1-NZ 3.01Å; Q89-K91 PolarHBondContact O-N 3.39Å; K91-M93 PolarHBondContact O-N 3.38Å; K91-L94 PolarHBondContact O-N 3.33Å; K91-Q95 PolarHBondContact O-N 2.95Å
92	Q	91.3	Very high	80.6	Confident	119 Å²	119	116.9 Å²	116.9	56%	0.556	55%	0.549	S	S	*	.	H	α-helix	trans	-62.2	-43.3	179.7	-70.4	-177.5	15.1	0	0	112.4	D88 Q89 Q95 K96	D88-Q92 WeakPolarHBondContact O-CG 3.06Å; D88-Q92 PolarHBondContact O-N 3.33Å; Q89-Q92 PolarHBondContact O-N 2.87Å; Q92-Q95 PolarHBondContact O-N 2.85Å; Q92-K96 PolarHBondContact O-N 2.96Å
93	M	85.9	Confident	82.3	Confident	133 Å²	133	114.7 Å²	114.7	66%	0.655	54%	0.54	S	S	*	.	H	α-helix	trans	-63.2	-42.2	174.3	-72.1	-160	-73.5	0	0	112.3	Q89 K91 Q95 K96 Y97	Q89-M93 PolarHBondContact O-N 3.38Å; K91-M93 PolarHBondContact O-N 3.38Å; M93-Q95 VanDerWaalsContact C-N 3.25Å; M93-Q95 PolarHBondContact O-N 3.16Å; M93-K96 PolarHBondContact O-N 3.45Å; M93-Y97 WeakPolarHBondContact O-CB 3.26Å; M93-Y97 PolarHBondContact O-N 3.11Å
94	L	89.4	Confident	83.9	Confident	95 Å²	95	110.6 Å²	110.6	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-65.3	-27.1	175.2	-74.5	170.1	0	0	0	113.2	R90 K91 K98	R90-L94 HydrophobicContact CG-CD1 4.22Å; R90-L94 WeakPolarHBondContact O-CB 3.33Å; R90-L94 VanDerWaalsContact O-CG 3.27Å; R90-L94 WeakPolarHBondContact O-CG 3.12Å; R90-L94 PolarHBondContact O-N 2.86Å; R90-L94 VanDerWaalsContact O-N 3.09Å; K91-L94 PolarHBondContact O-N 3.33Å; L94-K98 WeakPolarHBondContact O-CD 3.26Å; L94-K98 VanDerWaalsContact O-CG 3.27Å; L94-K98 WeakPolarHBondContact O-CG 3.29Å; L94-K98 PolarHBondContact O-N 2.96Å
95	Q	90.4	Very high	85.5	Confident	114 Å²	114	114 Å²	114	53%	0.533	53%	0.533	S	S	.	.	H	α-helix	trans	-75.1	-52.1	172.9	176.7	164.1	-15.1	0	0	111.5	K91 Q92 M93 Y97 K98 E99	K91-Q95 PolarHBondContact O-N 2.95Å; Q92-Q95 PolarHBondContact O-N 2.85Å; M93-Q95 VanDerWaalsContact C-N 3.25Å; M93-Q95 PolarHBondContact O-N 3.16Å; Q95-Y97 PolarHBondContact O-N 2.95Å; Q95-K98 WeakPolarHBondContact O-CA 3.39Å; Q95-K98 WeakPolarHBondContact O-CB 3.34Å; Q95-K98 PolarHBondContact O-N 3.06Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.39Å; Q95-E99 PolarHBondContact NE2-OE1 2.7Å; Q95-E99 PolarHBondContact O-N 2.74Å
96	K	91.8	Very high	86.7	Confident	141 Å²	141	112.7 Å²	112.7	61%	0.613	53%	0.527	S	S	*	.	H	α-helix	trans	-53.9	-41.1	176.1	-72.1	-179.4	177.6	-179.9	0	111.9	Q92 M93 K98 E99 E100	Q92-K96 PolarHBondContact O-N 2.96Å; M93-K96 PolarHBondContact O-N 3.45Å; K96-K98 PolarHBondContact O-N 3.43Å; K96-E99 PolarHBondContact O-N 3.37Å; K96-E100 WeakPolarHBondContact O-CB 3.27Å; K96-E100 PolarHBondContact O-N 3.02Å
97	Y	92.4	Very high	88.2	Confident	130 Å²	130	114.4 Å²	114.4	51%	0.51	53%	0.529	S	S	.	.	H	α-helix	trans	-63.5	-36.1	175.3	-177.6	-99.7	0	0	0	113.8	M93 Q95 K101	M93-Y97 WeakPolarHBondContact O-CB 3.26Å; M93-Y97 PolarHBondContact O-N 3.11Å; Q95-Y97 PolarHBondContact O-N 2.95Å; Y97-K101 HydrophobicContact CD1-CG 4.37Å; Y97-K101 HydrophobicContact CE1-CG 3.97Å; Y97-K101 HydrophobicContact CE2-CG 4.45Å; Y97-K101 WeakPolarHBondContact O-CB 3.4Å; Y97-K101 VanDerWaalsContact O-CG 3.29Å; Y97-K101 WeakPolarHBondContact O-CG 3.49Å; Y97-K101 PolarHBondContact O-N 3.15Å; Y97-K101 VanDerWaalsContact OH-CE 3.26Å; Y97-K101 WeakPolarHBondContact OH-CE 3.39Å
98	K	93.4	Very high	89	Confident	140 Å²	140	117.4 Å²	117.4	61%	0.609	54%	0.535	S	S	*	.	H	α-helix	trans	-67.9	-43.3	175.1	-73.5	165.8	-176.8	176.7	0	111.2	L94 Q95 K96 K101 Q102	L94-K98 WeakPolarHBondContact O-CD 3.26Å; L94-K98 VanDerWaalsContact O-CG 3.27Å; L94-K98 WeakPolarHBondContact O-CG 3.29Å; L94-K98 PolarHBondContact O-N 2.96Å; Q95-K98 WeakPolarHBondContact O-CA 3.39Å; Q95-K98 WeakPolarHBondContact O-CB 3.34Å; Q95-K98 PolarHBondContact O-N 3.06Å; K96-K98 PolarHBondContact O-N 3.43Å; K98-K101 PolarHBondContact O-N 2.96Å; K98-Q102 PolarHBondContact O-N 2.96Å; K98-Q102 VanDerWaalsContact O-N 3.11Å
99	E	92.8	Very high	89.3	Confident	91 Å²	91	120.8 Å²	120.8	43%	0.425	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-47.3	178.3	-69.3	163.4	-172.6	0	0	110.8	Q95 K96 K101 Q102 L103	Q95-E99 WeakPolarHBondContact CG-OE1 3.39Å; Q95-E99 PolarHBondContact NE2-OE1 2.7Å; Q95-E99 PolarHBondContact O-N 2.74Å; K96-E99 PolarHBondContact O-N 3.37Å; E99-K101 VanDerWaalsContact C-N 3.31Å; E99-K101 PolarHBondContact O-N 3.23Å; E99-Q102 WeakPolarHBondContact O-CB 3.43Å; E99-Q102 PolarHBondContact O-N 3.28Å; E99-L103 PolarHBondContact O-N 3.2Å
100	E	90.8	Very high	88.9	Confident	122 Å²	122	124.1 Å²	124.1	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-57.9	-42.1	173	-169.4	-170.8	-174.5	0	0	111.6	K96 Q102 L103 Q104	K96-E100 WeakPolarHBondContact O-CB 3.27Å; K96-E100 PolarHBondContact O-N 3.02Å; E100-Q102 VanDerWaalsContact C-N 3.25Å; E100-Q102 PolarHBondContact O-N 3.35Å; E100-L103 PolarHBondContact O-N 2.86Å; E100-Q104 WeakPolarHBondContact O-CB 3.41Å; E100-Q104 PolarHBondContact O-N 3.1Å
101	K	91.3	Very high	88.5	Confident	80 Å²	80	119.7 Å²	119.7	35%	0.348	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-25.6	175.5	-80.3	-72	167.7	-160.5	0	113.9	Y97 K98 E99 K105	Y97-K101 HydrophobicContact CD1-CG 4.37Å; Y97-K101 HydrophobicContact CE1-CG 3.97Å; Y97-K101 HydrophobicContact CE2-CG 4.45Å; Y97-K101 WeakPolarHBondContact O-CB 3.4Å; Y97-K101 VanDerWaalsContact O-CG 3.29Å; Y97-K101 WeakPolarHBondContact O-CG 3.49Å; Y97-K101 PolarHBondContact O-N 3.15Å; Y97-K101 VanDerWaalsContact OH-CE 3.26Å; Y97-K101 WeakPolarHBondContact OH-CE 3.39Å; K98-K101 PolarHBondContact O-N 2.96Å; E99-K101 VanDerWaalsContact C-N 3.31Å; E99-K101 PolarHBondContact O-N 3.23Å; K101-K105 WeakPolarHBondContact O-CG 3.44Å; K101-K105 PolarHBondContact O-N 2.84Å
102	Q	88.8	Confident	87.9	Confident	133 Å²	133	119.6 Å²	119.6	62%	0.621	54%	0.544	S	S	*	.	H	α-helix	trans	-78.5	-44.7	170.9	-67.7	-173	9	0	0	111.4	K98 E99 E100 Q104 K105 L106	K98-Q102 PolarHBondContact O-N 2.96Å; K98-Q102 VanDerWaalsContact O-N 3.11Å; E99-Q102 WeakPolarHBondContact O-CB 3.43Å; E99-Q102 PolarHBondContact O-N 3.28Å; E100-Q102 VanDerWaalsContact C-N 3.25Å; E100-Q102 PolarHBondContact O-N 3.35Å; Q102-Q104 VanDerWaalsContact C-N 3.3Å; Q102-Q104 PolarHBondContact O-N 2.98Å; Q102-K105 PolarHBondContact O-N 2.77Å; Q102-K105 VanDerWaalsContact O-N 3.16Å; Q102-L106 WeakPolarHBondContact O-CG 3.27Å; Q102-L106 PolarHBondContact O-N 3.03Å
103	L	88.3	Confident	87.2	Confident	116 Å²	116	118 Å²	118	61%	0.607	55%	0.551	S	S	*	*	H	α-helix	trans	-59.4	-39.7	175.1	-68.1	173.8	0	0	0	112.1	E99 E100 L106 K107	E99-L103 PolarHBondContact O-N 3.2Å; E100-L103 PolarHBondContact O-N 2.86Å; L103-L106 PolarHBondContact O-N 2.83Å; L103-K107 VanDerWaalsContact O-CB 3.27Å; L103-K107 WeakPolarHBondContact O-CB 3.11Å; L103-K107 PolarHBondContact O-N 2.77Å
104	Q	89.1	Confident	86.5	Confident	102 Å²	102	120.2 Å²	120.2	48%	0.477	56%	0.557	S	S	.	*	H	α-helix	trans	-60.9	-45.3	174.7	-174.1	171.5	52.9	0	0	111.5	E100 Q102 K107 E108	E100-Q104 WeakPolarHBondContact O-CB 3.41Å; E100-Q104 PolarHBondContact O-N 3.1Å; Q102-Q104 VanDerWaalsContact C-N 3.3Å; Q102-Q104 PolarHBondContact O-N 2.98Å; Q104-K107 PolarHBondContact O-N 3.29Å; Q104-E108 WeakPolarHBondContact O-CB 3.33Å; Q104-E108 PolarHBondContact O-N 3.1Å
105	K	90.9	Very high	85.1	Confident	135 Å²	135	124.1 Å²	124.1	59%	0.587	57%	0.565	S	S	*	*	H	α-helix	trans	-63.8	-42.7	176	-74.8	174.3	178.8	-179.3	0	112.5	K101 Q102 E108 Q109	K101-K105 WeakPolarHBondContact O-CG 3.44Å; K101-K105 PolarHBondContact O-N 2.84Å; Q102-K105 PolarHBondContact O-N 2.77Å; Q102-K105 VanDerWaalsContact O-N 3.16Å; K105-E108 PolarHBondContact O-N 3.14Å; K105-Q109 WeakPolarHBondContact O-CG 3.31Å; K105-Q109 PolarHBondContact O-N 2.79Å
106	L	85.9	Confident	83.5	Confident	82 Å²	82	121.3 Å²	121.3	43%	0.429	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-37.9	177.3	-69.8	172.2	0	0	0	111.7	Q102 L103 R110	Q102-L106 WeakPolarHBondContact O-CG 3.27Å; Q102-L106 PolarHBondContact O-N 3.03Å; L103-L106 PolarHBondContact O-N 2.83Å; L106-R110 WeakPolarHBondContact O-CB 3.46Å; L106-R110 VanDerWaalsContact O-CG 3.24Å; L106-R110 WeakPolarHBondContact O-CG 3.49Å; L106-R110 PolarHBondContact O-N 3.23Å
107	K	87.6	Confident	81.6	Confident	160 Å²	160	122.2 Å²	122.2	70%	0.696	58%	0.577	S	S	*	*	H	α-helix	trans	-65.5	-43.6	173.5	-171.4	175.1	-179.4	178.5	0	111.4	L103 Q104 R110 E111	L103-K107 VanDerWaalsContact O-CB 3.27Å; L103-K107 WeakPolarHBondContact O-CB 3.11Å; L103-K107 PolarHBondContact O-N 2.77Å; Q104-K107 PolarHBondContact O-N 3.29Å; K107-R110 PolarHBondContact O-N 3.3Å; K107-E111 WeakPolarHBondContact O-CB 3.41Å; K107-E111 PolarHBondContact O-N 3Å
108	E	87.6	Confident	79.3	Confident	91 Å²	91	125 Å²	125	43%	0.425	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-41.2	175.8	-170.4	-169.8	176.5	0	0	112	Q104 K105 E111 K112	Q104-E108 WeakPolarHBondContact O-CB 3.33Å; Q104-E108 PolarHBondContact O-N 3.1Å; K105-E108 PolarHBondContact O-N 3.14Å; E108-E111 PolarHBondContact O-N 3.08Å; E108-K112 VanDerWaalsContact CD-NZ 3.32Å; E108-K112 HydrophobicContact CG-CD 4.31Å; E108-K112 WeakPolarHBondContact O-CB 3.33Å; E108-K112 WeakPolarHBondContact O-CG 3.38Å; E108-K112 PolarHBondContact O-N 3.41Å; E108-K112 WeakPolarHBondContact OE1-CE 3.48Å; E108-K112 IonicContact OE1-NZ 3.27Å; E108-K112 PolarHBondContact OE1-NZ 3.4Å
109	Q	84.6	Confident	77.5	Confident	132 Å²	132	128 Å²	128	62%	0.617	61%	0.605	S	S	*	*	H	α-helix	trans	-63.6	-45.8	172.8	-77.2	-175.4	-6.1	0	0	111.9	K105 E111 K112 A113	K105-Q109 WeakPolarHBondContact O-CG 3.31Å; K105-Q109 PolarHBondContact O-N 2.79Å; Q109-E111 VanDerWaalsContact C-N 3.25Å; Q109-E111 PolarHBondContact O-N 3.38Å; Q109-K112 PolarHBondContact O-N 2.93Å; Q109-A113 WeakPolarHBondContact O-CB 3.45Å; Q109-A113 PolarHBondContact O-N 2.81Å
110	R	80.4	Confident	75.4	Confident	180 Å²	180	129.4 Å²	129.4	68%	0.679	62%	0.619	S	S	*	*	H	α-helix	trans	-62	-31.5	175.1	-73.8	170.6	177.6	-179.2	-0.5	112.4	L106 K107 K114	L106-R110 WeakPolarHBondContact O-CB 3.46Å; L106-R110 VanDerWaalsContact O-CG 3.24Å; L106-R110 WeakPolarHBondContact O-CG 3.49Å; L106-R110 PolarHBondContact O-N 3.23Å; K107-R110 PolarHBondContact O-N 3.3Å; R110-K114 VanDerWaalsContact O-CG 3.26Å; R110-K114 WeakPolarHBondContact O-CG 3.42Å; R110-K114 PolarHBondContact O-N 3.18Å
111	E	77.3	Confident	73	Confident	88 Å²	88	127.1 Å²	127.1	41%	0.411	63%	0.628	S	S	.	*	H	α-helix	trans	-75.2	-44.1	173.8	-159.8	-161.4	141.8	0	0	111.9	K107 E108 Q109 A113 K114 R115	K107-E111 WeakPolarHBondContact O-CB 3.41Å; K107-E111 PolarHBondContact O-N 3Å; E108-E111 PolarHBondContact O-N 3.08Å; Q109-E111 VanDerWaalsContact C-N 3.25Å; Q109-E111 PolarHBondContact O-N 3.38Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.36Å; E111-K114 CarbonylContact O-C 3.52Å; E111-K114 WeakPolarHBondContact O-CA 3.15Å; E111-K114 WeakPolarHBondContact O-CB 3.38Å; E111-K114 PolarHBondContact O-N 3.33Å; E111-R115 PolarHBondContact O-N 2.94Å; E111-R115 IonicContact OE1-CZ 2.78Å; E111-R115 IonicContact OE1-NE 2.85Å; E111-R115 PolarHBondContact OE1-NE 3.04Å; E111-R115 IonicContact OE1-NH2 2.83Å; E111-R115 PolarHBondContact OE1-NH2 2.69Å
112	K	76.5	Confident	70.7	Confident	128 Å²	128	134.4 Å²	134.4	56%	0.557	65%	0.654	S	S	*	*	H	α-helix	trans	-60.1	-39.3	175.5	-75.3	171.7	-177.3	170.4	0	112.1	E108 Q109 K114 R115	E108-K112 VanDerWaalsContact CD-NZ 3.32Å; E108-K112 HydrophobicContact CG-CD 4.31Å; E108-K112 WeakPolarHBondContact O-CB 3.33Å; E108-K112 WeakPolarHBondContact O-CG 3.38Å; E108-K112 PolarHBondContact O-N 3.41Å; E108-K112 WeakPolarHBondContact OE1-CE 3.48Å; E108-K112 IonicContact OE1-NZ 3.27Å; E108-K112 PolarHBondContact OE1-NZ 3.4Å; Q109-K112 PolarHBondContact O-N 2.93Å; K112-K114 VanDerWaalsContact C-N 3.31Å; K112-K114 PolarHBondContact O-N 3.45Å; K112-R115 PolarHBondContact O-N 2.82Å
113	A	75.4	Confident	68.3	Low	86 Å²	86	137.7 Å²	137.7	71%	0.711	66%	0.662	S	S	*	*	H	α-helix	trans	-65.6	-31.3	172.8	0	0	0	0	0	113	Q109 E111	Q109-A113 WeakPolarHBondContact O-CB 3.45Å; Q109-A113 PolarHBondContact O-N 2.81Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.36Å
114	K	71.9	Confident	66.1	Low	179 Å²	179	142.9 Å²	142.9	78%	0.778	67%	0.673	S	S	*	*	H	α-helix	trans	-78.5	-26.9	174.1	-74.1	173.8	179.9	-172.1	0	113.3	R110 E111 K112 G116	R110-K114 VanDerWaalsContact O-CG 3.26Å; R110-K114 WeakPolarHBondContact O-CG 3.42Å; R110-K114 PolarHBondContact O-N 3.18Å; E111-K114 CarbonylContact O-C 3.52Å; E111-K114 WeakPolarHBondContact O-CA 3.15Å; E111-K114 WeakPolarHBondContact O-CB 3.38Å; E111-K114 PolarHBondContact O-N 3.33Å; K112-K114 VanDerWaalsContact C-N 3.31Å; K112-K114 PolarHBondContact O-N 3.45Å; K114-G116 VanDerWaalsContact C-N 3.25Å; K114-G116 PolarHBondContact O-N 3.36Å
115	R	60.3	Low	64.3	Low	176 Å²	176	142.6 Å²	142.6	66%	0.664	68%	0.68	S	S	*	*	S	Bend	trans	-79.7	70	173.8	-69.8	-170.5	-174.1	-133.6	7.7	111	E111 K112 I117	E111-R115 PolarHBondContact O-N 2.94Å; E111-R115 IonicContact OE1-CZ 2.78Å; E111-R115 IonicContact OE1-NE 2.85Å; E111-R115 PolarHBondContact OE1-NE 3.04Å; E111-R115 IonicContact OE1-NH2 2.83Å; E111-R115 PolarHBondContact OE1-NH2 2.69Å; K112-R115 PolarHBondContact O-N 2.82Å; R115-I117 PolarHBondContact O-N 2.78Å
116	G	56.5	Low	62.1	Low	55 Å²	55	143.8 Å²	143.8	57%	0.567	69%	0.693	S	S	*	*			trans	-52.4	135	171.8	0	0	0	0	0	112	K114 F118	K114-G116 VanDerWaalsContact C-N 3.25Å; K114-G116 PolarHBondContact O-N 3.36Å; G116-F118 PolarHBondContact O-N 3.13Å
117	I	52.3	Low	60.3	Low	160 Å²	160	147.9 Å²	147.9	82%	0.821	71%	0.712	S	S	*	*			trans	-82.5	77.9	-165.7	-52.3	176.9	0	0	0	111.1	R115	R115-I117 PolarHBondContact O-N 2.78Å
118	F	44.4	Very low	58.4	Low	190 Å²	190	144.7 Å²	144.7	83%	0.833	71%	0.708	S	S	*	*			trans	-87.5	106.4	167.1	-81.3	-84.6	0	0	0	110.8	G116 V120	G116-F118 PolarHBondContact O-N 3.13Å; F118-V120 PolarHBondContact O-N 3.3Å
119	K	54.8	Low	56.4	Low	201 Å²	201	146.2 Å²	146.2	87%	0.874	73%	0.727	S	S	*	*			trans	-93.2	61	-170.2	-157.2	178.4	-176	-175.7	0	112.4	G121	K119-G121 PolarHBondContact O-N 2.89Å; K119-G121 VanDerWaalsContact O-N 3.07Å
120	V	49.5	Very low	54.5	Low	121 Å²	121	149.1 Å²	149.1	73%	0.733	74%	0.738	S	S	*	*			trans	-74.9	95.3	178.3	-176.5	0	0	0	0	110.3	F118 R122	F118-V120 PolarHBondContact O-N 3.3Å; V120-R122 PolarHBondContact O-N 3.5Å
121	G	39.9	Very low	52.8	Low	74 Å²	74	148.5 Å²	148.5	76%	0.763	75%	0.748	S	S	*	*			trans	-73.8	111.2	172.5	0	0	0	0	0	111.1	K119 Y123	K119-G121 PolarHBondContact O-N 2.89Å; K119-G121 VanDerWaalsContact O-N 3.07Å; G121-Y123 PolarHBondContact O-N 3.19Å
122	R	43.7	Very low	51.1	Low	234 Å²	234	152.1 Å²	152.1	88%	0.883	77%	0.769	S	S	*	*			trans	-80.3	108.8	170.6	-58.7	-164.7	84.1	168.9	6.3	109.4	V120	V120-R122 PolarHBondContact O-N 3.5Å
123	Y	38.4	Very low	49.2	Very low	202 Å²	202	151.9 Å²	151.9	79%	0.792	78%	0.783	S	S	*	*			trans	-58.9	140.8	170	-179.8	-104.7	0	0	0	110.6	G121 P125	G121-Y123 PolarHBondContact O-N 3.19Å; Y123-P125 HydrophobicContact CE1-CB 3.96Å; Y123-P125 HydrophobicContact CE1-CG 4.45Å
124	R	41.8	Very low	47.3	Very low	224 Å²	224	154 Å²	154	85%	0.845	78%	0.782	S	S	*	*			trans	-123.2	123.1	164.8	-77.1	-172.8	173.1	-166.9	-2.8	107.1
125	P	50.5	Low	45.9	Very low	96 Å²	96	155 Å²	155	62%	0.623	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-72.3	153.9	166.6	31.2	-33.2	0	0	0	110.2	Y123	Y123-P125 HydrophobicContact CE1-CB 3.96Å; Y123-P125 HydrophobicContact CE1-CG 4.45Å
126	D	44.7	Very low	44.6	Very low	160 Å²	160	153.4 Å²	153.4	86%	0.856	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-75.1	151.2	173.8	-72.9	-53.4	0	0	0	112
127	M	47.9	Very low	43.4	Very low	168 Å²	168	155.8 Å²	155.8	83%	0.828	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.6	-177	-168.4	87.1	85.9	0	0	111	C129	M127-C129 PolarHBondContact O-N 2.94Å
128	P	47.5	Very low	42.6	Very low	94 Å²	94	154.1 Å²	154.1	61%	0.61	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.4	132.4	-179.8	27.3	-34.2	0	0	0	112.2	F130	P128-F130 VanDerWaalsContact C-N 3.27Å; P128-F130 HydrophobicContact CB-CD2 4.33Å; P128-F130 PolarHBondContact O-N 3.32Å
129	C	45.9	Very low	42.1	Very low	122 Å²	122	154.5 Å²	154.5	82%	0.824	81%	0.807	S	S	*	*	S	Bend	trans	-82.8	37.7	-162.1	-48.8	0	0	0	0	115.9	M127	M127-C129 PolarHBondContact O-N 2.94Å
130	F	44.7	Very low	41	Very low	194 Å²	194	149.3 Å²	149.3	85%	0.851	80%	0.801	S	S	*	*			trans	-100	12.4	-173.6	-67.6	-71.6	0	0	0	115.4	P128	P128-F130 VanDerWaalsContact C-N 3.27Å; P128-F130 HydrophobicContact CB-CD2 4.33Å; P128-F130 PolarHBondContact O-N 3.32Å
131	L	44.1	Very low	40.5	Very low	167 Å²	167	150 Å²	150	87%	0.874	80%	0.797	S	S	*	*			trans	-113.7	18.1	-178.2	-66.2	179.5	0	0	0	115
132	L	42.8	Very low	40.2	Very low	163 Å²	163	152.2 Å²	152.2	85%	0.853	80%	0.798	S	S	*	*			trans	-103.3	102.1	163.6	-95.4	68.6	0	0	0	109.3
133	S	36.3	Very low	39.7	Very low	123 Å²	123	150.4 Å²	150.4	86%	0.86	80%	0.796	S	S	*	*			trans	-80.8	142.4	168.5	-169.5	0	0	0	0	110.3
134	N	35.8	Very low	39.5	Very low	130 Å²	130	149.2 Å²	149.2	70%	0.695	80%	0.795	S	S	*	*			trans	-79.2	143.3	-169.1	-58.2	-68.6	0	0	0	113.1
135	Q	42.1	Very low	38.8	Very low	200 Å²	200	142.9 Å²	142.9	94%	0.935	79%	0.791	S	S	*	*			trans	-121	131.4	141.7	-70.7	-164.5	9.5	0	0	108.7
136	N	33.5	Very low	38.3	Very low	144 Å²	144	146.4 Å²	146.4	77%	0.77	80%	0.802	S	S	*	*			trans	-96.5	122.3	-173.9	-67.3	-49.3	0	0	0	110.8
137	A	31.3	Very low	37.7	Very low	104 Å²	104	143.8 Å²	143.8	86%	0.86	79%	0.794	S	S	*	*			trans	-132.5	131.5	159.7	0	0	0	0	0	108
138	V	35.3	Very low	37.1	Very low	125 Å²	125	141.2 Å²	141.2	76%	0.758	79%	0.793	S	S	*	*			trans	-126.3	149.8	-165.2	-175.4	0	0	0	0	110.9
139	K	33.7	Very low	36.4	Very low	199 Å²	199	141.6 Å²	141.6	87%	0.865	80%	0.798	S	S	*	*			trans	92.6	127.5	178.5	-56.4	177.9	-176.4	177.2	0	113.8
140	A	31.6	Very low	36.2	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	80%	0.797	S	S	*	*			cis	-155.2	148.3	-7.5	0	0	0	0	0	112.6
141	E	38.3	Very low	35.7	Very low	137 Å²	137	143.7 Å²	143.7	64%	0.64	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.5	136.6	166.7	-93.8	-161.3	146.9	0	0	111.2	K144	E141-K144 IonicContact OE1-NZ 3.93Å; E141-K144 PolarHBondContact OE1-NZ 3.33Å
142	P	34.9	Very low	35.4	Very low	119 Å²	119	141.6 Å²	141.6	77%	0.773	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-79	130.8	143	31.8	-28.2	0	0	0	109.6
143	K	32.3	Very low	35.8	Very low	197 Å²	197	138.4 Å²	138.4	86%	0.857	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-59.6	138.2	-168.2	-61.4	168.8	-177.4	173.9	0	113.2	A145	K143-A145 PolarHBondContact O-N 3.45Å
144	K	35.6	Very low	36.1	Very low	176 Å²	176	144.3 Å²	144.3	77%	0.765	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-62.5	123.2	168.6	-61.3	-177.6	179.7	75.1	0	110.6	E141	E141-K144 IonicContact OE1-NZ 3.93Å; E141-K144 PolarHBondContact OE1-NZ 3.33Å
145	A	25.9	Very low	36.4	Very low	91 Å²	91	142.8 Å²	142.8	75%	0.752	78%	0.775	S	S	*	*			trans	-105.9	121.2	166.4	0	0	0	0	0	109.7	K143 P147	K143-A145 PolarHBondContact O-N 3.45Å; A145-P147 WeakPolarHBondContact O-CD 3.17Å
146	I	40.4	Very low	36.5	Very low	170 Å²	170	139.5 Å²	139.5	87%	0.872	76%	0.758	S	S	*	*			trans	-93.6	120.2	161.2	-60.4	173.1	0	0	0	107.1
147	P	32.7	Very low	37	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	76%	0.755	S	S	*	*			trans	-121.5	128.5	147.2	33.8	-25.5	0	0	0	110.8	A145	A145-P147 WeakPolarHBondContact O-CD 3.17Å
148	S	35	Very low	37.4	Very low	113 Å²	113	140.6 Å²	140.6	79%	0.79	75%	0.753	S	S	*	*			trans	-65.9	128.1	163.8	51.7	0	0	0	0	110.7
149	S	32.6	Very low	37.6	Very low	102 Å²	102	140 Å²	140	71%	0.713	75%	0.745	S	S	*	*			trans	-164.9	145.2	144.4	44.6	0	0	0	0	112.1	R151	S149-R151 PolarHBondContact O-N 2.95Å
150	V	40.8	Very low	37.8	Very low	133 Å²	133	139.6 Å²	139.6	81%	0.806	75%	0.746	S	S	*	*			trans	-61.2	126.9	168.9	175.4	0	0	0	0	108.9	I152	V150-I152 HydrophobicContact CG1-CG1 4.12Å
151	R	34.8	Very low	37.9	Very low	227 Å²	227	143.6 Å²	143.6	86%	0.857	75%	0.752	S	S	*	*			trans	-112.4	103.6	168.3	-171.8	160.8	-70.9	176.9	-0.9	110.3	S149	S149-R151 PolarHBondContact O-N 2.95Å
152	I	38.1	Very low	37.9	Very low	124 Å²	124	145.6 Å²	145.6	64%	0.636	76%	0.761	S	S	*	*			trans	-64.7	142.4	179.8	-64.3	162.8	0	0	0	109.9	V150 K156	V150-I152 HydrophobicContact CG1-CG1 4.12Å; I152-K156 HydrophobicContact CG2-CB 4.1Å
153	T	50.2	Low	37.8	Very low	95 Å²	95	148.8 Å²	148.8	58%	0.583	77%	0.766	S	S	*	*			trans	-79	145.1	174.7	46.7	0	0	0	0	111.7	S155 K156	T153-S155 PolarHBondContact O-N 3.5Å; T153-K156 PolarHBondContact O-N 2.82Å
154	R	43.5	Very low	37.7	Very low	248 Å²	248	146 Å²	146	94%	0.936	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-9.9	-172.4	-169.8	171.7	173.4	-128.6	1.9	115.1
155	S	41.2	Very low	37.3	Very low	97 Å²	97	147.1 Å²	147.1	68%	0.678	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	5.9	174.7	51.2	0	0	0	0	114.9	T153	T153-S155 PolarHBondContact O-N 3.5Å
156	K	44.9	Very low	37.5	Very low	131 Å²	131	149.6 Å²	149.6	57%	0.57	77%	0.769	S	S	*	*	S	Bend	trans	-117.3	9.4	172.2	-81.6	-72.3	155.6	-152.4	0	115.3	I152 T153 D159	I152-K156 HydrophobicContact CG2-CB 4.1Å; T153-K156 PolarHBondContact O-N 2.82Å; K156-D159 IonicContact NZ-OD2 2.76Å; K156-D159 PolarHBondContact NZ-OD2 3.49Å
157	A	43	Very low	36.9	Very low	85 Å²	85	148.1 Å²	148.1	70%	0.702	76%	0.763	S	S	*	*	S	Bend	trans	-100.1	29.4	179.9	0	0	0	0	0	114
158	K	40.7	Very low	36.7	Very low	187 Å²	187	150.7 Å²	150.7	81%	0.813	77%	0.771	S	S	*	*	S	Bend	trans	-143.9	-8.9	175	-133.8	-177.2	-179.5	-170.4	0	116.7
159	D	39.9	Very low	36.4	Very low	111 Å²	111	153.9 Å²	153.9	59%	0.594	77%	0.773	S	S	*	*	S	Bend	trans	-98.6	15.6	-179.2	-47.3	-26.1	0	0	0	113.3	K156	K156-D159 IonicContact NZ-OD2 2.76Å; K156-D159 PolarHBondContact NZ-OD2 3.49Å
160	Q	36.6	Very low	36.3	Very low	191 Å²	191	154.5 Å²	154.5	89%	0.893	78%	0.778	S	S	*	*	S	Bend	trans	-140.5	49.3	176.2	-71.4	-163.7	25.8	0	0	111.5
161	M	33.8	Very low	35.9	Very low	176 Å²	176	155.2 Å²	155.2	87%	0.867	78%	0.777	S	S	*	*	S	Bend	trans	-130.4	9	169.5	-164.9	166.4	164	0	0	112.5
162	E	39.3	Very low	35.8	Very low	179 Å²	179	149.2 Å²	149.2	84%	0.836	77%	0.765	S	S	*	*	S	Bend	trans	-133	56	179.9	-68.4	-169.6	152.6	0	0	112.4
163	Q	32.5	Very low	35.4	Very low	186 Å²	186	154.3 Å²	154.3	87%	0.869	78%	0.777	S	S	*	*	S	Bend	trans	-172.5	158.7	153	-104.1	143.3	69.2	0	0	111
164	T	29.8	Very low	34.4	Very low	138 Å²	138	153.5 Å²	153.5	85%	0.847	78%	0.78	S	S	*	*			trans	66.4	61.3	175.8	56.9	0	0	0	0	118.1
165	K	27.2	Very low	33.8	Very low	199 Å²	199	150 Å²	150	87%	0.865	78%	0.777	S	S	*	*				-96	153.8	106.9	-69.6	-174.5	175.9	-173.2	0	106.2
166	I	30.9	Very low	33.1	Very low	143 Å²	143	153.7 Å²	153.7	73%	0.733	78%	0.784	S	S	*	*			cis	-120.4	-175.3	14.5	-16.4	-178.9	0	0	0	107.8
167	D	27.6	Very low	33	Very low	140 Å²	140	152.8 Å²	152.8	75%	0.749	79%	0.792	S	S	*	*			cis	-143.5	151.9	42.3	-76.3	-55.7	0	0	0	113.3
168	N	28.1	Very low	32.2	Very low	160 Å²	160	152.3 Å²	152.3	86%	0.856	80%	0.795	S	S	*	*			trans	-170.9	90.9	147.7	-106.1	-4.9	0	0	0	109.2
169	E	27.9	Very low	31.7	Very low	179 Å²	179	151.4 Å²	151.4	84%	0.836	79%	0.794	S	S	*	*			trans	43.2	134.5	150	-157	159.7	-148.7	0	0	122.9
170	S	32.3	Very low	31.1	Very low	115 Å²	115	155.6 Å²	155.6	80%	0.804	80%	0.801	S	S	*	*			trans	70.9	138.8	164.4	76.4	0	0	0	0	117.9
171	D	31.1	Very low	30.9	Very low	149 Å²	149	153.9 Å²	153.9	80%	0.797	79%	0.793	S	S	*	*			cis	-155	168.5	-10.1	-166.5	10.6	0	0	0	111.1
172	V	32.2	Very low	30.5	Very low	100 Å²	100	151.8 Å²	151.8	61%	0.606	79%	0.79	S	S	*	*			trans	70.6	112	162.2	-168.9	0	0	0	0	119.7
173	R	30.9	Very low	30	Very low	232 Å²	232	148 Å²	148	88%	0.875	78%	0.783	S	S	*	*			trans	29.7	145.2	135.5	-82.8	176.7	-86	-147.9	-7.6	120.9
174	A	29.2	Very low	29.8	Very low	78 Å²	78	146.4 Å²	146.4	65%	0.645	78%	0.776	S	S	*	*			cis	-171.1	167.3	10.3	0	0	0	0	0	114.7
175	I	29.9	Very low	29.8	Very low	173 Å²	173	147.7 Å²	147.7	89%	0.887	77%	0.77	S	S	*	*			trans	79.4	135.8	150.9	-73.1	156	0	0	0	120
176	Q	27.1	Very low	29.9	Very low	176 Å²	176	147.5 Å²	147.5	82%	0.822	77%	0.769	S	S	*	*			trans	-108.2	-166.9	177.7	-113.7	-167.1	33.5	0	0	109.8
177	P	43	Very low	29.6	Very low	112 Å²	112	147.2 Å²	147.2	73%	0.727	77%	0.774	S	S	*	*			cis	-122.8	172.2	-6.7	25.7	-2	0	0	0	113.2
178	G	26.1	Very low	29.6	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	77%	0.767	S	S	*	*				125.1	169.4	82.5	0	0	0	0	0	110.2
179	Q	30.1	Very low	29.5	Very low	168 Å²	168	143.9 Å²	143.9	79%	0.785	76%	0.763	S	S	*	*			cis	-166.9	143	-6.4	159.6	169.7	-56.8	0	0	110.3
180	R	27.8	Very low	29.8	Very low	199 Å²	199	145 Å²	145	75%	0.751	77%	0.765	S	S	*	*			trans	36.8	119.9	157.5	-74.4	-178.8	172.4	131.8	-1.4	121
181	Q	31	Very low	29.8	Very low	154 Å²	154	146.6 Å²	146.6	72%	0.72	76%	0.759	S	S	*	*				76.2	136.2	81.6	-75.7	-178.6	-29.8	0	0	117.2
182	T	26.9	Very low	30	Very low	132 Å²	132	147.4 Å²	147.4	81%	0.81	76%	0.756	S	S	*	*			trans	64.1	158.4	153.6	46.3	0	0	0	0	118.7
183	S	29.3	Very low	30	Very low	99 Å²	99	151.6 Å²	151.6	69%	0.692	77%	0.766	S	S	*	*			cis	-170.4	154.6	-17.6	48.4	0	0	0	0	111.9
184	E	26.9	Very low	29.7	Very low	153 Å²	153	146.1 Å²	146.1	72%	0.715	76%	0.758	S	S	*	*			trans	49.4	143.9	151.3	-68.6	-151.5	155.4	0	0	125.5
185	K	30.5	Very low	29.8	Very low	166 Å²	166	149 Å²	149	72%	0.722	77%	0.767	S	S	*	*			trans	62.4	101.8	144.2	-73.3	171.7	-176.6	136.6	0	122.8
186	K	28.5	Very low	29.7	Very low	195 Å²	195	148.8 Å²	148.8	85%	0.848	76%	0.763	S	S	*	*				42	116.2	107.4	-172	-166.6	-178.1	-175.1	0	119.5
187	V	25.9	Very low	30.5	Very low	137 Å²	137	145.3 Å²	145.3	83%	0.83	76%	0.755	S	S	*	*				-175.8	162.5	124.9	143.1	0	0	0	0	110.4
188	S	26.3	Very low	29.8	Very low	87 Å²	87	146 Å²	146	61%	0.608	76%	0.757	S	S	*	*			trans	-102.4	165.7	-171.2	55.2	0	0	0	0	114.8
189	N	26.5	Very low	29.9	Very low	143 Å²	143	150.1 Å²	150.1	77%	0.765	76%	0.758	S	S	*	*				169.1	167.7	114	-85.9	-20.7	0	0	0	115.2
190	K	35	Very low	30.6	Very low	201 Å²	201	147.2 Å²	147.2	87%	0.874	75%	0.754	S	S	*	*			trans	85.7	137.2	168.4	-56.4	-178.6	-178.2	176.8	0	116.8
191	E	32	Very low	30.7	Very low	149 Å²	149	144.7 Å²	144.7	70%	0.696	75%	0.754	S	S	*	*			cis	168.9	160.9	-45.1	177.1	-125.8	142.2	0	0	108
192	K	34.9	Very low	30.7	Very low	166 Å²	166	142.4 Å²	142.4	72%	0.722	76%	0.755	S	S	*	*			trans	92.1	137.8	173.3	-55.5	172.2	-172.5	177.2	0	114.6
193	K	31.1	Very low	30.9	Very low	188 Å²	188	143.6 Å²	143.6	82%	0.817	76%	0.755	S	S	*	*			cis	-157.7	160.9	6.6	-136.8	-174.8	176.2	-172.6	0	112.9
194	V	26.2	Very low	30.8	Very low	118 Å²	118	148.5 Å²	148.5	72%	0.715	76%	0.759	S	S	*	*			trans	79.1	103.4	154.5	178.7	0	0	0	0	120.4
195	V	31.6	Very low	31	Very low	137 Å²	137	148.2 Å²	148.2	83%	0.83	76%	0.759	S	S	*	*				63.7	132.9	128.8	-175.4	0	0	0	0	122.1
196	Q	27.2	Very low	31.1	Very low	169 Å²	169	145.2 Å²	145.2	79%	0.79	76%	0.755	S	S	*	*			trans	-120.5	-177.7	170.6	-123.3	-163.9	24.3	0	0	108.6
197	P	43.8	Very low	31.6	Very low	103 Å²	103	147 Å²	147	67%	0.669	76%	0.756	S	S	*	*			cis	-104.4	-146	19.3	10.6	15.7	0	0	0	111.6
198	V	28.5	Very low	32.2	Very low	126 Å²	126	145.8 Å²	145.8	76%	0.764	75%	0.754	S	S	*	*			cis	-149.7	163.4	8.3	-146.4	0	0	0	0	110.8
199	M	28.2	Very low	32.4	Very low	163 Å²	163	146.4 Å²	146.4	80%	0.803	76%	0.764	S	S	*	*			trans	-139.1	156.5	169.8	-69.8	-103.7	68.1	0	0	109.3
200	P	43.7	Very low	33.1	Very low	106 Å²	106	146 Å²	146	69%	0.688	77%	0.767	S	S	*	*				-150.3	149.2	92.5	37.4	-18.8	0	0	0	118.2
201	I	31.4	Very low	33.2	Very low	147 Å²	147	145.8 Å²	145.8	75%	0.754	77%	0.769	S	S	*	*			trans	75.8	103.6	135.2	-67.9	172.2	0	0	0	121.3
202	S	30	Very low	33.1	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	78%	0.776	S	S	*	*				84.8	149.5	128.1	-68.7	0	0	0	0	125.3
203	L	31.4	Very low	32.8	Very low	158 Å²	158	139.4 Å²	139.4	83%	0.827	77%	0.773	S	S	*	*			trans	72	155.7	168.3	-52.6	-176.7	0	0	0	118.1
204	R	27.4	Very low	33.1	Very low	202 Å²	202	140.1 Å²	140.1	76%	0.762	78%	0.776	S	S	*	*			cis	-173.2	136.2	-37.6	179.8	174.6	-176.6	160.7	3.2	107.9
205	M	30.9	Very low	33.6	Very low	147 Å²	147	143.2 Å²	143.2	72%	0.724	78%	0.782	S	S	*	*			trans	64.4	160	164.3	-83.3	169.6	69.6	0	0	116.3
206	T	33	Very low	33.7	Very low	103 Å²	103	142.9 Å²	142.9	63%	0.632	78%	0.781	S	S	*	*			cis	-156.6	157.6	-29.8	8.4	0	0	0	0	111.4
207	R	39.3	Very low	34.6	Very low	233 Å²	233	140.2 Å²	140.2	88%	0.879	78%	0.778	S	S	*	*			trans	69.8	128.1	154.8	-68.7	167.9	75.8	176.4	5	118.8
208	S	37.1	Very low	33.9	Very low	111 Å²	111	145.8 Å²	145.8	78%	0.776	79%	0.786	S	S	*	*			trans	-50.4	137.8	163.3	-34.4	0	0	0	0	110.9
209	A	31.3	Very low	33.8	Very low	99 Å²	99	144.9 Å²	144.9	82%	0.818	78%	0.78	S	S	*	*			cis	71.2	100.4	47.7	0	0	0	0	0	112.9
210	T	40.5	Very low	33.8	Very low	136 Å²	136	143.1 Å²	143.1	83%	0.834	78%	0.779	S	S	*	*			trans	-129.1	123.6	171.2	-57	0	0	0	0	107
211	Q	38.4	Very low	33.1	Very low	196 Å²	196	143.1 Å²	143.1	92%	0.916	78%	0.781	S	S	*	*			trans	-179	131.8	151.3	-109.5	171.8	36.8	0	0	114.4
212	A	28.4	Very low	33	Very low	101 Å²	101	140.7 Å²	140.7	84%	0.835	78%	0.777	S	S	*	*			trans	-163.7	134.6	142.8	0	0	0	0	0	106.4
213	A	30.3	Very low	32.9	Very low	80 Å²	80	141.3 Å²	141.3	66%	0.661	78%	0.777	S	S	*	*			cis	-160.7	165.9	-3.1	0	0	0	0	0	111.3
214	K	36.9	Very low	32.8	Very low	202 Å²	202	139.8 Å²	139.8	88%	0.878	77%	0.774	S	S	*	*			trans	69.4	139.8	154.2	-72.7	170.2	-177.2	-177.4	0	116.7
215	Q	35.6	Very low	32.8	Very low	183 Å²	183	134.3 Å²	134.3	86%	0.855	77%	0.772	S	S	*	*			cis	-131.8	-175.9	7.1	-63.5	-167.3	52.5	0	0	112.8
216	V	34.9	Very low	32.8	Very low	131 Å²	131	139.1 Å²	139.1	79%	0.794	78%	0.782	S	S	*	*			trans	-152.3	157.1	-164.7	163.3	0	0	0	0	109
217	P	45.3	Very low	32.7	Very low	113 Å²	113	143.7 Å²	143.7	73%	0.734	79%	0.793	S	S	*	*			cis	-105.3	-132.7	-7	25.4	-2.8	0	0	0	109.7
218	R	29	Very low	33	Very low	219 Å²	219	137.7 Å²	137.7	83%	0.826	79%	0.785	S	S	*	*			cis	-166.9	148.8	-2.2	-138.4	-155.7	166.5	118.9	-0.4	105.8
219	T	26.5	Very low	32.5	Very low	107 Å²	107	138.3 Å²	138.3	66%	0.656	78%	0.783	S	S	*	*			cis	-140.7	-143.9	-9.8	-15.3	0	0	0	0	106.5
220	V	28.7	Very low	32.3	Very low	127 Å²	127	139.7 Å²	139.7	77%	0.77	78%	0.782	S	S	*	*			cis	-149.2	-179.3	4.5	-136.3	0	0	0	0	109.6
221	S	28.1	Very low	31.7	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	79%	0.785	S	S	*	*			trans	-46.6	159.9	158.3	-52.7	0	0	0	0	114.3
222	S	29.1	Very low	31.2	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	78%	0.776	S	S	*	*			cis	-176.2	179.6	-16	53.9	0	0	0	0	110.7
223	T	28.9	Very low	31.2	Very low	119 Å²	119	138.7 Å²	138.7	73%	0.73	77%	0.771	S	S	*	*			trans	64.5	119.8	146	43.2	0	0	0	0	122.9
224	T	29.8	Very low	31.2	Very low	125 Å²	125	141.3 Å²	141.3	77%	0.767	77%	0.773	S	S	*	*				78	100.5	123.4	-50.7	0	0	0	0	122.5
225	A	27.3	Very low	30.8	Very low	88 Å²	88	138.5 Å²	138.5	73%	0.727	76%	0.763	S	S	*	*				58.3	158	127.9	0	0	0	0	0	125
226	R	29.6	Very low	30.5	Very low	248 Å²	248	135.6 Å²	135.6	94%	0.936	75%	0.754	S	S	*	*			trans	90	148.7	162.8	-59.8	-174.8	173.5	-173.8	-2	119.5
227	K	32.2	Very low	30.2	Very low	198 Å²	198	137.4 Å²	137.4	86%	0.861	75%	0.754	S	S	*	*			trans	-82.6	-166.2	163.8	-44.5	179.5	175.8	-177.6	0	109.2
228	P	44.6	Very low	30.3	Very low	108 Å²	108	136.4 Å²	136.4	70%	0.701	75%	0.747	S	S	*	*			cis	-141.6	166.2	-8.6	37.9	-16.9	0	0	0	118.1
229	V	26.7	Very low	30.1	Very low	123 Å²	123	132.3 Å²	132.3	75%	0.745	74%	0.737	S	S	*	*			trans	52.4	143.1	130.3	-178.2	0	0	0	0	123.9
230	T	28.5	Very low	30.3	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	74%	0.741	S	S	*	*			trans	68	163.7	160.5	45	0	0	0	0	121.1
231	R	27.2	Very low	30.2	Very low	237 Å²	237	139.5 Å²	139.5	89%	0.894	74%	0.744	S	S	*	*			cis	176.1	125	-38.6	173.8	179.6	179.3	170.5	1.8	110.1
232	A	28.1	Very low	30.2	Very low	89 Å²	89	140.3 Å²	140.3	74%	0.736	74%	0.744	S	S	*	*			trans	-167.9	132.4	164	0	0	0	0	0	107.8
233	A	28.9	Very low	30.5	Very low	87 Å²	87	141.8 Å²	141.8	72%	0.719	75%	0.752	S	S	*	*				67.9	132.9	67.5	0	0	0	0	0	113.3
234	N	28.8	Very low	30.4	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	75%	0.745	S	S	*	*			cis	-161.1	178.7	-4.2	-105.9	16.4	0	0	0	107.2
235	E	28.3	Very low	30.5	Very low	143 Å²	143	141.2 Å²	141.2	67%	0.668	75%	0.746	S	S	*	*			cis	-165.4	170.2	4.9	-126.6	168.3	-80.1	0	0	112.1
236	N	29.4	Very low	30.6	Very low	123 Å²	123	147 Å²	147	66%	0.658	76%	0.755	S	S	*	*			trans	47	114.8	148.2	-56.9	-19.9	0	0	0	125.9
237	E	29.3	Very low	30.5	Very low	169 Å²	169	138.6 Å²	138.6	79%	0.79	75%	0.745	S	S	*	*				53	160	116.7	-68.9	-77.2	82.5	0	0	122.9
238	P	46.5	Very low	30.5	Very low	92 Å²	92	140 Å²	140	60%	0.597	75%	0.745	S	S	*	*			cis	-137.8	173.4	-34.9	35.4	-17.9	0	0	0	114.9
239	E	26.6	Very low	30.6	Very low	133 Å²	133	140.3 Å²	140.3	62%	0.621	75%	0.747	S	S	*	*				155.1	140.7	125.2	-83.4	-139.7	113.6	0	0	117.9
240	R	30	Very low	30.9	Very low	192 Å²	192	137.6 Å²	137.6	73%	0.725	74%	0.737	S	S	*	*			trans	61.4	105.6	145.4	-66.1	172.8	-166.6	166.9	19.2	123.6
241	K	27.5	Very low	31.2	Very low	192 Å²	192	140.5 Å²	140.5	84%	0.835	74%	0.739	S	S	*	*				53.6	122	119.9	-66.6	-177.1	178.4	179.4	0	122.8
242	V	26.8	Very low	31.5	Very low	124 Å²	124	135 Å²	135	75%	0.752	73%	0.727	S	S	*	*			trans	66.9	117.9	130.4	179.4	0	0	0	0	118.3
243	P	36.6	Very low	31.6	Very low	126 Å²	126	137 Å²	137	82%	0.818	73%	0.73	S	S	*	*				-140.3	166.2	83.2	36	-19.4	0	0	0	114.6
244	S	26	Very low	31.6	Very low	85 Å²	85	136.2 Å²	136.2	59%	0.594	73%	0.731	S	S	*	*			cis	97.9	93.4	14.2	-161.5	0	0	0	0	117.6
245	N	30.9	Very low	31.7	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	73%	0.732	S	S	*	*			trans	79.9	156	136.3	-77.8	-58.1	0	0	0	124.2
246	K	31.1	Very low	31.9	Very low	210 Å²	210	138 Å²	138	91%	0.913	74%	0.74	S	S	*	*			trans	76.2	141.4	166.2	-62.2	170.4	-177.2	173.2	0	118.4
247	G	26.4	Very low	33.1	Very low	71 Å²	71	136.8 Å²	136.8	73%	0.732	74%	0.739	S	S	*	*			cis	136	129.4	-29	0	0	0	0	0	118.9
248	R	31.7	Very low	32.9	Very low	229 Å²	229	134.1 Å²	134.1	86%	0.864	73%	0.73	S	S	*	*			trans	65.8	-176.9	158.9	-113.2	-170.9	-173.2	-134	-0.6	116.1
249	P	47	Very low	32.2	Very low	113 Å²	113	138.2 Å²	138.2	73%	0.734	74%	0.739	S	S	*	*			cis	-123.1	146	20.1	42.7	-27.8	0	0	0	117.1
250	A	32.9	Very low	32.2	Very low	67 Å²	67	135.1 Å²	135.1	55%	0.554	74%	0.743	S	S	*	*				80.2	159.4	109.2	0	0	0	0	0	115.1
251	K	34.8	Very low	32	Very low	189 Å²	189	134.2 Å²	134.2	82%	0.822	75%	0.75	S	S	*	*			cis	-140.7	169.7	21	-77.9	-175.7	174.5	177.6	0	109.7
252	N	33	Very low	31.8	Very low	121 Å²	121	130.2 Å²	130.2	65%	0.647	75%	0.746	S	S	*	*			cis	-157	145.3	-6.1	-111.6	11	0	0	0	109
253	V	31.8	Very low	31.6	Very low	130 Å²	130	129.4 Å²	129.4	79%	0.788	75%	0.745	S	S	*	*				56.2	128.6	110.5	-174.4	0	0	0	0	115.3
254	G	28.5	Very low	31.1	Very low	71 Å²	71	132.8 Å²	132.8	73%	0.732	75%	0.747	S	S	*	*			cis	-176	-155.7	5.6	0	0	0	0	0	108.6
255	T	30.1	Very low	31.1	Very low	122 Å²	122	133.7 Å²	133.7	75%	0.748	75%	0.748	S	S	*	*			cis	-167.1	119.7	-10.1	-59.2	0	0	0	0	105
256	K	33.9	Very low	30.8	Very low	192 Å²	192	133.5 Å²	133.5	84%	0.835	75%	0.747	S	S	*	*				53.6	153.1	88.2	-80.9	-159.2	176.2	-167.6	0	117.3
257	P	53.1	Low	30.7	Very low	99 Å²	99	127.6 Å²	127.6	64%	0.643	73%	0.733	S	S	*	*			cis	-146.9	-167.6	-38.8	42.3	-23	0	0	0	115.3
258	D	26.5	Very low	31	Very low	112 Å²	112	132.3 Å²	132.3	60%	0.599	74%	0.736	S	S	*	*			trans	82.5	129.1	142.3	-81.3	-17	0	0	0	125.3
259	K	31.6	Very low	31	Very low	179 Å²	179	128.7 Å²	128.7	78%	0.778	73%	0.729	S	S	*	*				46.9	142.4	129.9	-56.3	159	-170.4	144	0	121.3
260	G	25.4	Very low	30.1	Very low	68 Å²	68	129.3 Å²	129.3	70%	0.701	73%	0.726	S	S	*	*			cis	149.9	173.1	-6.6	0	0	0	0	0	114.4
261	I	26.1	Very low	29.8	Very low	172 Å²	172	132.1 Å²	132.1	88%	0.882	74%	0.736	S	S	*	*			trans	78.9	147.1	162.6	-54.4	174.2	0	0	0	118.2
262	S	23.2	Very low	29.6	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	73%	0.731	S	S	*	*			trans	82.1	150.6	168.1	-159.1	0	0	0	0	117.6
263	C	23	Very low	29.2	Very low	108 Å²	108	131 Å²	131	73%	0.73	74%	0.739	S	S	*	*				169	147.4	-50.2	-98.6	0	0	0	0	108.7
264	K	25.7	Very low	29.2	Very low	197 Å²	197	130 Å²	130	86%	0.857	74%	0.737	S	S	*	*			trans	64.6	159.6	166.3	-72.7	-164.1	159	-147	0	114.6
265	V	25.5	Very low	29.1	Very low	103 Å²	103	135.3 Å²	135.3	62%	0.624	74%	0.743	S	S	*	*			cis	-179.6	149.6	-4.1	137.5	0	0	0	0	103.8
266	D	24.9	Very low	28.8	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	74%	0.738	S	S	*	*			cis	-136.5	-116.5	-46.3	-83.2	-40.3	0	0	0	106.2
267	S	30.2	Very low	28.6	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	73%	0.734	S	S	*	*			cis	-163.4	-178.8	-13.1	-149.5	0	0	0	0	110.9
268	E	31.4	Very low	27.3	Very low	170 Å²	170	129.9 Å²	129.9	79%	0.794	74%	0.738	S	S	*	*			trans	9.3	153.4	149.1	-67.6	147.8	153.8	0	0	122.3
269	E	31.5	Very low	27.3	Very low	152 Å²	152	130.9 Å²	130.9	71%	0.71	75%	0.748	S	S	*	*			cis	-158.4	146.9	12.7	-139.6	-161	115	0	0	112.8
270	N	28.8	Very low	27.1	Very low	127 Å²	127	128.6 Å²	128.6	68%	0.679	75%	0.754	S	S	*	*			trans	45.7	166.3	141	-71.8	-19.6	0	0	0	122.4
271	T	26.2	Very low	27.1	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	76%	0.756	S	S	*	*			cis	-139.4	142.8	10.9	-36.4	0	0	0	0	113.9
272	L	30.5	Very low	27.3	Very low	137 Å²	137	129.6 Å²	129.6	72%	0.717	76%	0.758	S	S	*	*			trans	-39.2	148.7	158.2	-109.6	151.4	0	0	0	116.5
273	N	24.8	Very low	27.6	Very low	151 Å²	151	131.4 Å²	131.4	81%	0.807	76%	0.759	S	S	*	*				170.4	159.8	117.7	-85.4	-30.6	0	0	0	113.8
274	S	31.6	Very low	29	Very low	107 Å²	107	131.4 Å²	131.4	75%	0.748	76%	0.758	S	S	*	*			trans	-125.8	139.9	-175.1	-54.7	0	0	0	0	112.2
275	Q	27.8	Very low	29.3	Very low	183 Å²	183	129.5 Å²	129.5	86%	0.855	76%	0.758	S	S	*	*			trans	-176.3	145.3	135.5	-109.7	-171.5	-102.4	0	0	117.4
276	T	23.8	Very low	29.5	Very low	105 Å²	105	128 Å²	128	64%	0.644	76%	0.763	S	S	*	*			trans	16.3	140.5	149.1	49.5	0	0	0	0	125.5
277	S	29	Very low	29.7	Very low	109 Å²	109	127.3 Å²	127.3	76%	0.762	76%	0.763	S	S	*	*			trans	81.1	109.9	131.1	64.2	0	0	0	0	124.6
278	A	25.6	Very low	29.7	Very low	86 Å²	86	131 Å²	131	71%	0.711	78%	0.775	S	S	*	*				82	129.1	114	0	0	0	0	0	125.2
279	T	27.2	Very low	29.7	Very low	133 Å²	133	128.2 Å²	128.2	82%	0.816	78%	0.775	S	S	*	*			trans	82.2	143.4	138.2	48.1	0	0	0	0	125.1
280	S	27	Very low	29.6	Very low	130 Å²	130	129.7 Å²	129.7	91%	0.909	78%	0.779	S	S	*	*			trans	67.9	152.1	169.9	73.3	0	0	0	0	117.6
281	G	25	Very low	29.5	Very low	71 Å²	71	131 Å²	131	73%	0.732	78%	0.783	S	S	*	*			cis	-143.8	-166.4	-10.5	0	0	0	0	0	108.9
282	M	29.6	Very low	29.9	Very low	191 Å²	191	133.2 Å²	133.2	94%	0.941	78%	0.784	S	S	*	*			cis	-157.1	163.4	10.5	-161	92.9	78.8	0	0	109.6
283	D	30.4	Very low	30	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	79%	0.79	S	S	*	*			trans	-79.6	167.4	175.4	-118.7	-37.7	0	0	0	112.9
284	P	53.3	Low	30.6	Very low	108 Å²	108	135 Å²	135	70%	0.701	79%	0.794	S	S	*	*				-155.2	155.5	80.2	40.4	-19.7	0	0	0	120.9
285	D	31	Very low	30.6	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	79%	0.794	S	S	*	*			trans	62.9	138	145.5	-69.4	-42.3	0	0	0	123.5
286	G	29.4	Very low	30.6	Very low	72 Å²	72	135 Å²	135	74%	0.742	79%	0.792	S	S	*	*			trans	178.4	-16.6	174.9	0	0	0	0	0	121.2
287	V	30.2	Very low	30.9	Very low	126 Å²	126	137.4 Å²	137.4	76%	0.764	80%	0.798	S	S	*	*			trans	48	107.1	163	-174.6	0	0	0	0	120.7
288	L	29	Very low	31	Very low	165 Å²	165	140 Å²	140	86%	0.864	80%	0.803	S	S	*	*			trans	43.9	126.8	145.1	-81.2	163.1	0	0	0	122.6
289	S	31.4	Very low	31.5	Very low	112 Å²	112	141.2 Å²	141.2	78%	0.783	80%	0.802	S	S	*	*				-172	169	99.7	-158.4	0	0	0	0	114.6
290	K	29	Very low	31.7	Very low	182 Å²	182	138.8 Å²	138.8	79%	0.791	80%	0.796	S	S	*	*			trans	-52.6	169.2	-170.9	-63.3	175.6	173.9	178.7	0	119.3
291	M	28.6	Very low	32.6	Very low	156 Å²	156	142.6 Å²	142.6	77%	0.768	80%	0.796	S	S	*	*			trans	110.3	96.9	136.8	-138.6	79.6	-176.8	0	0	116.9
292	E	33.2	Very low	33.4	Very low	170 Å²	170	146.5 Å²	146.5	79%	0.794	80%	0.798	S	S	*	*			trans	-5.7	116.3	139.9	-179.6	174.6	-136.7	0	0	116.6
293	N	33.6	Very low	34	Very low	156 Å²	156	147 Å²	147	83%	0.834	80%	0.795	S	S	*	*			trans	-166.9	162.6	148.6	-108.3	-73.7	0	0	0	110.7
294	L	36.6	Very low	34.6	Very low	169 Å²	169	143.2 Å²	143.2	89%	0.885	79%	0.791	S	S	*	*			trans	-71.4	143.4	177.4	-82.6	165.5	0	0	0	112.8
295	P	31.7	Very low	34.6	Very low	115 Å²	115	147.7 Å²	147.7	75%	0.747	80%	0.799	S	S	*	*			trans	-111	147.6	154.9	36.1	-28.4	0	0	0	112.4
296	E	28.6	Very low	35.5	Very low	177 Å²	177	148.4 Å²	148.4	83%	0.827	80%	0.803	S	S	*	*			trans	-74.8	138.2	178.3	-70.5	175.7	92.3	0	0	113.8
297	M	28.7	Very low	37.1	Very low	154 Å²	154	149.4 Å²	149.4	76%	0.759	80%	0.799	S	S	*	*			trans	19	100.6	137.1	-169.2	175.8	63.7	0	0	118.3
298	N	32.3	Very low	39.1	Very low	163 Å²	163	153.7 Å²	153.7	87%	0.872	81%	0.807	S	S	*	*			trans	-81	133.5	159.3	-93.1	-77.7	0	0	0	111.3	A300	N298-A300 PolarHBondContact O-N 3.34Å
299	T	34.8	Very low	41.3	Very low	112 Å²	112	148.2 Å²	148.2	69%	0.687	79%	0.786	S	S	*	*			trans	-86.5	102.9	-164.9	50.9	0	0	0	0	114.4	K301	T299-K301 PolarHBondContact O-N 3.45Å
300	A	33.3	Very low	43.5	Very low	83 Å²	83	147.1 Å²	147.1	69%	0.686	78%	0.776	S	S	*	*			trans	-75.9	120.4	165.3	0	0	0	0	0	110.8	N298 I302	N298-A300 PolarHBondContact O-N 3.34Å; A300-I302 VanDerWaalsContact C-N 3.32Å; A300-I302 PolarHBondContact O-N 2.85Å
301	K	45.3	Very low	45.4	Very low	209 Å²	209	147.8 Å²	147.8	91%	0.909	78%	0.779	S	S	*	*			trans	-73.4	74.7	-176.7	-69.6	179.3	179.7	171.9	0	113.1	T299 K303	T299-K301 PolarHBondContact O-N 3.45Å; K301-K303 PolarHBondContact O-N 3.22Å
302	I	42	Very low	47.4	Very low	153 Å²	153	147.8 Å²	147.8	79%	0.785	78%	0.782	S	S	*	*			trans	-75.1	121.5	171.4	-60.9	179.5	0	0	0	109.6	A300 G304	A300-I302 VanDerWaalsContact C-N 3.32Å; A300-I302 PolarHBondContact O-N 2.85Å; I302-G304 PolarHBondContact O-N 3.25Å
303	K	41.9	Very low	49	Very low	202 Å²	202	146 Å²	146	88%	0.878	77%	0.772	S	S	*	*			trans	-74.7	87.9	-176.5	-166.6	173.6	-175.8	176.1	0	110.6	K301	K301-K303 PolarHBondContact O-N 3.22Å
304	G	42.1	Very low	50.9	Low	66 Å²	66	146.7 Å²	146.7	68%	0.68	77%	0.772	S	S	*	*			trans	-53.3	134	-176.2	0	0	0	0	0	113.8	I302	I302-G304 PolarHBondContact O-N 3.25Å
305	K	54	Low	52	Low	201 Å²	201	147.4 Å²	147.4	87%	0.874	77%	0.768	S	S	*	*			trans	-85.3	144.6	172.8	-60.5	173.1	-175.2	173.4	0	108.9	S307	K305-S307 PolarHBondContact O-N 2.82Å
306	N	50	Low	54	Low	173 Å²	173	149.2 Å²	149.2	93%	0.925	77%	0.767	S	S	*	*			trans	-52.8	112	-172.5	-57.2	10.8	0	0	0	112.7
307	S	64	Low	55.9	Low	94 Å²	94	145.8 Å²	145.8	66%	0.657	76%	0.76	S	S	*	*			trans	-78.4	144.4	170.2	53.5	0	0	0	0	111	K305	K305-S307 PolarHBondContact O-N 2.82Å
308	F	71.9	Confident	57.5	Low	215 Å²	215	145.2 Å²	145.2	94%	0.943	76%	0.759	S	S	*	*	S	Bend	trans	-86	-13.6	175.3	-165.6	-98.9	0	0	0	113.4
309	A	75.3	Confident	58.8	Low	50 Å²	50	144.5 Å²	144.5	41%	0.413	76%	0.756	S	S	.	*	S	Bend	trans	-68.3	142.7	171.8	0	0	0	0	0	110.9
310	P	76.9	Confident	60.1	Low	89 Å²	89	143 Å²	143	58%	0.578	76%	0.763	S	S	*	*			trans	-55.4	144.5	165.5	-20.6	32.1	0	0	0	110.4	D312 F313	P310-D312 PolarHBondContact O-N 3.11Å; P310-F313 HydrophobicContact CB-CB 4.12Å; P310-F313 HydrophobicContact CG-CB 4.29Å; P310-F313 PolarHBondContact O-N 3.32Å; P310-F313 VanDerWaalsContact O-N 3.07Å
311	K	69.3	Low	61.4	Low	196 Å²	196	145.7 Å²	145.7	85%	0.852	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-27.7	-169.9	-70	-176.2	176.5	-179.4	0	114.2
312	D	70.9	Confident	62	Low	157 Å²	157	145.6 Å²	145.6	84%	0.84	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	9.1	-172.2	-36.1	-72.4	0	0	0	111.9	P310	P310-D312 PolarHBondContact O-N 3.11Å
313	F	66.3	Low	62.6	Low	132 Å²	132	144.5 Å²	144.5	58%	0.579	76%	0.764	S	S	*	*			trans	-111.9	86.9	-173.9	-147.1	-81.4	0	0	0	112.4	P310	P310-F313 HydrophobicContact CB-CB 4.12Å; P310-F313 HydrophobicContact CG-CB 4.29Å; P310-F313 PolarHBondContact O-N 3.32Å; P310-F313 VanDerWaalsContact O-N 3.07Å
314	M	73.9	Confident	63.1	Low	170 Å²	170	144.9 Å²	144.9	84%	0.837	76%	0.762	S	S	*	*			trans	-86	133.4	171.8	-67.7	-67.3	-76.3	0	0	110.5	Q316	M314-Q316 PolarHBondContact O-N 2.94Å; M314-Q316 VanDerWaalsContact O-N 3.1Å
315	F	59.4	Low	63.5	Low	184 Å²	184	149.8 Å²	149.8	81%	0.807	77%	0.767	S	S	*	*			trans	-75.7	96.2	170.8	-85	-88	0	0	0	110.1
316	Q	73.8	Confident	63.5	Low	154 Å²	154	145.6 Å²	145.6	72%	0.72	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-75.8	126.8	169.3	-172.1	164.7	-16.5	0	0	109.6	M314	M314-Q316 PolarHBondContact O-N 2.94Å; M314-Q316 VanDerWaalsContact O-N 3.1Å
317	P	66.9	Low	63.7	Low	104 Å²	104	142.2 Å²	142.2	68%	0.675	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-60.9	154.8	170.9	-21.6	33.8	0	0	0	111.4	D319	P317-D319 PolarHBondContact O-N 3.23Å
318	L	64	Low	62.7	Low	143 Å²	143	142.5 Å²	142.5	75%	0.749	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-71.1	122	170.8	-66.9	173.1	0	0	0	109.7
319	D	58	Low	61.9	Low	148 Å²	148	140.9 Å²	140.9	79%	0.791	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	136.6	177.9	-65.9	-55.5	0	0	0	111.3	P317	P317-D319 PolarHBondContact O-N 3.23Å
320	G	63.2	Low	61.2	Low	81 Å²	81	143.6 Å²	143.6	84%	0.835	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.7	-12.1	-179.3	0	0	0	0	0	115.7	K322	G320-K322 PolarHBondContact O-N 2.88Å
321	L	60.3	Low	60	Low	138 Å²	138	142.6 Å²	142.6	72%	0.723	75%	0.746	S	S	*	*			trans	-77	114.9	169.9	-69.1	176.8	0	0	0	110.8	T323	L321-T323 PolarHBondContact O-N 2.9Å
322	K	57.5	Low	59.5	Low	208 Å²	208	145.3 Å²	145.3	90%	0.904	75%	0.751	S	S	*	*			trans	-57.1	120.7	170.4	-69.1	-177.3	179.9	178.8	0	109.2	G320 Y324	G320-K322 PolarHBondContact O-N 2.88Å; K322-Y324 PolarHBondContact O-N 3.14Å
323	T	54.4	Low	59.2	Low	129 Å²	129	141.2 Å²	141.2	79%	0.791	74%	0.735	S	S	*	*			trans	-61.4	120.4	175.2	31.8	0	0	0	0	110.1	L321 Q325	L321-T323 PolarHBondContact O-N 2.9Å; T323-Q325 PolarHBondContact O-N 2.89Å
324	Y	53.2	Low	58.7	Low	211 Å²	211	138.4 Å²	138.4	83%	0.827	74%	0.736	S	S	*	*			trans	-67.2	103.6	176.2	-170.7	-89.1	0	0	0	108.9	K322 V326	K322-Y324 PolarHBondContact O-N 3.14Å; Y324-V326 HydrophobicContact CD1-CG2 3.78Å; Y324-V326 HydrophobicContact CE1-CG2 4.1Å; Y324-V326 PolarHBondContact O-N 3.44Å
325	Q	49.9	Very low	57.7	Low	168 Å²	168	136.5 Å²	136.5	79%	0.785	73%	0.729	S	S	*	*			trans	-69.2	94.5	177.5	-74.2	-169.8	-4.5	0	0	109.8	T323 T327	T323-Q325 PolarHBondContact O-N 2.89Å; Q325-T327 VanDerWaalsContact C-N 3.35Å; Q325-T327 PolarHBondContact O-N 2.97Å
326	V	53.3	Low	57.7	Low	114 Å²	114	130.5 Å²	130.5	69%	0.691	71%	0.714	S	S	*	*			trans	-70.5	95.9	162	-176.6	0	0	0	0	107.3	Y324 P328	Y324-V326 HydrophobicContact CD1-CG2 3.78Å; Y324-V326 HydrophobicContact CE1-CG2 4.1Å; Y324-V326 PolarHBondContact O-N 3.44Å; V326-P328 WeakPolarHBondContact O-CD 3.42Å
327	T	55	Low	56.7	Low	101 Å²	101	130.5 Å²	130.5	62%	0.62	71%	0.711	S	S	*	*			trans	-55.7	120.7	166.3	-55.5	0	0	0	0	108.1	Q325 M329	Q325-T327 VanDerWaalsContact C-N 3.35Å; Q325-T327 PolarHBondContact O-N 2.97Å; T327-M329 PolarHBondContact O-N 2.91Å
328	P	43.8	Very low	56.2	Low	101 Å²	101	132.4 Å²	132.4	66%	0.656	72%	0.715	S	S	*	*			trans	-66.6	113.2	-178.7	25.5	-32.7	0	0	0	109.2	V326 T330	V326-P328 WeakPolarHBondContact O-CD 3.42Å; P328-T330 PolarHBondContact O-N 2.71Å
329	M	55.1	Low	55.7	Low	181 Å²	181	130.3 Å²	130.3	89%	0.892	71%	0.709	S	S	*	*			trans	-74.4	59.4	179.4	-72.2	-66.7	-71	0	0	111.6	T327	T327-M329 PolarHBondContact O-N 2.91Å
330	T	59.4	Low	55.1	Low	107 Å²	107	128.9 Å²	128.9	66%	0.656	71%	0.707	S	S	*	*			trans	-97.6	107.9	171	-52.3	0	0	0	0	108.2	P328 R332	P328-T330 PolarHBondContact O-N 2.71Å; T330-R332 PolarHBondContact O-N 3.37Å
331	P	53.2	Low	54	Low	68 Å²	68	129.9 Å²	129.9	44%	0.442	70%	0.701	S	S	.	*			trans	-64.9	110.6	-179.8	25.3	-32.3	0	0	0	109.6	S333 A336 F337	P331-S333 VanDerWaalsContact C-N 3.26Å; P331-S333 PolarHBondContact O-N 3.22Å; P331-A336 HydrophobicContact CB-CB 4.15Å; P331-F337 HydrophobicContact CB-CE2 3.98Å; P331-F337 HydrophobicContact CB-CZ 4.2Å; P331-F337 HydrophobicContact CG-CE1 4.35Å; P331-F337 HydrophobicContact CG-CE2 3.69Å; P331-F337 HydrophobicContact CG-CZ 3.46Å; P331-F337 VanDerWaalsContact CG-CZ 3.46Å
332	R	56.8	Low	53.1	Low	252 Å²	252	133.6 Å²	133.6	95%	0.951	71%	0.707	S	S	*	*			trans	-84.7	6.4	-170.8	-140.5	173.8	-173.7	173.9	1.1	114.1	T330	T330-R332 PolarHBondContact O-N 3.37Å
333	S	65.3	Low	52	Low	72 Å²	72	129.4 Å²	129.4	50%	0.503	70%	0.7	S	S	.	*	S	Bend	trans	-156.2	154.2	172.8	65.4	0	0	0	0	111.1	P331 N335 A336	P331-S333 VanDerWaalsContact C-N 3.26Å; P331-S333 PolarHBondContact O-N 3.22Å; S333-N335 VanDerWaalsContact C-N 3.3Å; S333-N335 PolarHBondContact O-N 3.12Å; S333-A336 PolarHBondContact O-N 3.34Å
334	A	55.1	Low	51	Low	73 Å²	73	133.9 Å²	133.9	60%	0.603	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-65.7	-29.2	-176.4	0	0	0	0	0	113.7	A336 F337	A334-A336 PolarHBondContact O-N 2.73Å; A334-A336 VanDerWaalsContact O-N 3.14Å; A334-F337 WeakPolarHBondContact O-CD2 3.49Å; A334-F337 PolarHBondContact O-N 2.86Å; A334-F337 VanDerWaalsContact O-N 3.14Å
335	N	54	Low	50.1	Low	129 Å²	129	129.5 Å²	129.5	69%	0.69	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-65.7	-20.2	-175.8	-64.8	4.3	0	0	0	113.1	S333 F337 L338	S333-N335 VanDerWaalsContact C-N 3.3Å; S333-N335 PolarHBondContact O-N 3.12Å; N335-F337 PolarHBondContact O-N 3.31Å; N335-L338 PolarHBondContact O-N 3.46Å
336	A	58.4	Low	49.3	Very low	58 Å²	58	126.1 Å²	126.1	48%	0.479	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-65.6	-19.6	175.8	0	0	0	0	0	113.7	P331 S333 A334	P331-A336 HydrophobicContact CB-CB 4.15Å; S333-A336 PolarHBondContact O-N 3.34Å; A334-A336 PolarHBondContact O-N 2.73Å; A334-A336 VanDerWaalsContact O-N 3.14Å
337	F	54.4	Low	48.3	Very low	154 Å²	154	129 Å²	129	68%	0.675	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-80.6	-17.6	178.4	-70.6	-86.1	0	0	0	113.8	P331 A334 N335	P331-F337 HydrophobicContact CB-CE2 3.98Å; P331-F337 HydrophobicContact CB-CZ 4.2Å; P331-F337 HydrophobicContact CG-CE1 4.35Å; P331-F337 HydrophobicContact CG-CE2 3.69Å; P331-F337 HydrophobicContact CG-CZ 3.46Å; P331-F337 VanDerWaalsContact CG-CZ 3.46Å; A334-F337 WeakPolarHBondContact O-CD2 3.49Å; A334-F337 PolarHBondContact O-N 2.86Å; A334-F337 VanDerWaalsContact O-N 3.14Å; N335-F337 PolarHBondContact O-N 3.31Å
338	L	55.4	Low	47.3	Very low	145 Å²	145	133.2 Å²	133.2	76%	0.759	71%	0.71	S	S	*	*	S	Bend	trans	-103.4	5.8	-172	-59.2	-179.8	0	0	0	113.6	N335	N335-L338 PolarHBondContact O-N 3.46Å
339	T	52.8	Low	46.6	Very low	99 Å²	99	134.8 Å²	134.8	61%	0.607	72%	0.719	S	S	*	*			trans	-149.2	83.8	178.3	-49	0	0	0	0	111.1	S341	T339-S341 PolarHBondContact O-N 3.39Å
340	P	46.1	Very low	45.5	Very low	117 Å²	117	135 Å²	135	76%	0.76	72%	0.717	S	S	*	*			trans	-73.9	92.8	177.9	29.7	-34.1	0	0	0	111.5	Y342	P340-Y342 PolarHBondContact O-N 3.24Å
341	S	39.9	Very low	44.3	Very low	102 Å²	102	136.7 Å²	136.7	71%	0.713	73%	0.727	S	S	*	*			trans	-69.1	90.5	177.5	-60.3	0	0	0	0	112.3	T339 T343	T339-S341 PolarHBondContact O-N 3.39Å; S341-T343 PolarHBondContact O-N 3.32Å; S341-T343 VanDerWaalsContact O-N 3.14Å
342	Y	40.9	Very low	43.3	Very low	216 Å²	216	140.2 Å²	140.2	85%	0.847	74%	0.742	S	S	*	*			trans	-87.1	77.6	-173.1	-152.4	-85.9	0	0	0	113.2	P340	P340-Y342 PolarHBondContact O-N 3.24Å
343	T	36.3	Very low	42.1	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	74%	0.737	S	S	*	*			trans	-121.6	85.3	173.9	54.6	0	0	0	0	111.6	S341 T345	S341-T343 PolarHBondContact O-N 3.32Å; S341-T343 VanDerWaalsContact O-N 3.14Å; T343-T345 PolarHBondContact O-N 2.89Å
344	W	32	Very low	40.6	Very low	222 Å²	222	137.7 Å²	137.7	84%	0.841	74%	0.744	S	S	*	*			trans	-86	98.6	171.2	-173.8	-83	0	0	0	110.4
345	T	33.9	Very low	39.5	Very low	119 Å²	119	142.9 Å²	142.9	73%	0.73	76%	0.755	S	S	*	*			trans	-112.5	109.2	178.5	-32.1	0	0	0	0	109.9	T343 L347	T343-T345 PolarHBondContact O-N 2.89Å; T345-L347 PolarHBondContact O-N 2.87Å
346	P	33.3	Very low	38.3	Very low	98 Å²	98	145.2 Å²	145.2	64%	0.636	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-66.7	118.7	172.4	-17.5	31.3	0	0	0	109.8	K348	P346-K348 PolarHBondContact O-N 3.48Å
347	L	33.6	Very low	37	Very low	174 Å²	174	145.8 Å²	145.8	91%	0.911	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-66.2	127.6	175.7	-167.5	69.8	0	0	0	109.4	T345	T345-L347 PolarHBondContact O-N 2.87Å
348	K	32.7	Very low	36	Very low	189 Å²	189	144 Å²	144	82%	0.822	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.8	151.9	176	-70.9	-177.2	178	178.8	0	110.7	P346	P346-K348 PolarHBondContact O-N 3.48Å
349	T	30	Very low	35.4	Very low	135 Å²	135	145.9 Å²	145.9	83%	0.828	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-57.8	137.3	172.3	-36.4	0	0	0	0	111.2
350	E	31.7	Very low	34.5	Very low	186 Å²	186	148.7 Å²	148.7	87%	0.869	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71.4	132.1	168.2	-66.3	175.3	164.9	0	0	110.4
351	V	33.5	Very low	34	Very low	141 Å²	141	149.8 Å²	149.8	86%	0.855	78%	0.775	S	S	*	*			trans	-135.9	131.6	155.9	176.7	0	0	0	0	105.2
352	D	33.4	Very low	33.6	Very low	143 Å²	143	153 Å²	153	77%	0.765	78%	0.784	S	S	*	*			trans	-95.6	142.8	-174.4	-170.8	10.7	0	0	0	110.8
353	E	31.6	Very low	32.9	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	77%	0.774	S	S	*	*			trans	173.7	107.3	144.7	-100.6	175	-176.4	0	0	112.5
354	S	32.5	Very low	32.8	Very low	93 Å²	93	149.2 Å²	149.2	65%	0.65	78%	0.779	S	S	*	*			trans	53.1	139.2	130.4	-58.3	0	0	0	0	124.1
355	Q	32.6	Very low	32.7	Very low	182 Å²	182	148 Å²	148	85%	0.85	78%	0.779	S	S	*	*			trans	72.7	147.1	153.6	-72.8	169	2.3	0	0	117.8
356	E	29.1	Very low	32.4	Very low	177 Å²	177	147.4 Å²	147.4	83%	0.827	78%	0.779	S	S	*	*			cis	-158.4	154.1	-7.4	170.7	165.9	-140	0	0	113
357	A	32.2	Very low	32.1	Very low	71 Å²	71	150.9 Å²	150.9	59%	0.587	78%	0.784	S	S	*	*			trans	19.6	123.3	159.8	0	0	0	0	0	125.8
358	T	31.8	Very low	31.7	Very low	115 Å²	115	147.8 Å²	147.8	71%	0.706	77%	0.772	S	S	*	*				80.7	137.7	126.4	60.2	0	0	0	0	125
359	K	43.4	Very low	31.5	Very low	186 Å²	186	147.5 Å²	147.5	81%	0.809	77%	0.767	S	S	*	*			trans	68.5	165.6	152.9	-67.2	155.3	-176	172.5	0	118.4
360	E	33.6	Very low	31.4	Very low	157 Å²	157	146.1 Å²	146.1	73%	0.734	76%	0.763	S	S	*	*				-170.4	159.4	-51.3	-139.5	-168.4	141.1	0	0	107.4
361	I	34.9	Very low	31.4	Very low	141 Å²	141	142.7 Å²	142.7	72%	0.723	76%	0.755	S	S	*	*			trans	54.7	105.9	160.8	-53.2	159.7	0	0	0	118.2
362	L	32	Very low	31.3	Very low	170 Å²	170	145.8 Å²	145.8	89%	0.89	76%	0.757	S	S	*	*				-154.6	146.1	117.5	-162.7	66.3	0	0	0	110.3
363	A	27.7	Very low	31.2	Very low	79 Å²	79	144.8 Å²	144.8	65%	0.653	76%	0.756	S	S	*	*			trans	-136.1	176.1	-176.6	0	0	0	0	0	112.5
364	Q	34	Very low	31.1	Very low	178 Å²	178	143.5 Å²	143.5	83%	0.832	75%	0.753	S	S	*	*			trans	75.5	133.1	177.7	-47.5	178.7	3.6	0	0	113.8
365	K	29.6	Very low	30.8	Very low	195 Å²	195	147.8 Å²	147.8	85%	0.848	76%	0.763	S	S	*	*			cis	-125.1	136.9	33.4	-68.9	160.7	-176.3	171.9	0	110.6
366	C	26.1	Very low	30.7	Very low	108 Å²	108	147.8 Å²	147.8	73%	0.73	76%	0.763	S	S	*	*				62.8	133.9	73.5	-58.7	0	0	0	0	113
367	K	28	Very low	30.5	Very low	170 Å²	170	146.7 Å²	146.7	74%	0.739	76%	0.763	S	S	*	*			cis	-154.3	163.8	30	-143.5	169.1	-173.5	179.3	0	114.6	Y369	K367-Y369 HydrophobicContact CD-CE2 4.3Å; K367-Y369 WeakPolarHBondContact CE-OH 3.45Å; K367-Y369 HydrophobicContact CG-CE2 4.25Å
368	T	26.2	Very low	30.6	Very low	109 Å²	109	147.3 Å²	147.3	67%	0.669	76%	0.763	S	S	*	*			trans	-64.4	177	170.1	6.2	0	0	0	0	112.9
369	Y	28.3	Very low	30.5	Very low	183 Å²	183	149.3 Å²	149.3	72%	0.718	77%	0.77	S	S	*	*			cis	-157.3	164	48	-63.2	-91.3	0	0	0	114.6	K367	K367-Y369 HydrophobicContact CD-CE2 4.3Å; K367-Y369 WeakPolarHBondContact CE-OH 3.45Å; K367-Y369 HydrophobicContact CG-CE2 4.25Å
370	S	26.5	Very low	29.8	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	77%	0.769	S	S	*	*			trans	-159.7	175.1	162.4	-151.3	0	0	0	0	107.5
371	T	32.9	Very low	29.6	Very low	114 Å²	114	148.5 Å²	148.5	70%	0.699	77%	0.77	S	S	*	*			cis	-151.9	165.6	10.7	-36.9	0	0	0	0	108.8
372	K	31.3	Very low	29.1	Very low	206 Å²	206	150.1 Å²	150.1	90%	0.896	77%	0.774	S	S	*	*			trans	-150.2	161	159.7	-113.7	167.1	-171.8	-177.9	0	113.8
373	T	31.7	Very low	28.7	Very low	122 Å²	122	147.4 Å²	147.4	75%	0.748	77%	0.768	S	S	*	*			trans	-156.3	-177.2	-165.4	-46.1	0	0	0	0	109.3
374	I	29.3	Very low	29.3	Very low	151 Å²	151	148.7 Å²	148.7	77%	0.774	77%	0.77	S	S	*	*			trans	94.4	137.1	-179	-56.5	156.1	0	0	0	111.3
375	Q	25.7	Very low	29	Very low	183 Å²	183	148.6 Å²	148.6	86%	0.855	77%	0.774	S	S	*	*			cis	-144.4	177.5	12	-149.6	157.1	-37	0	0	113.1
376	Q	31.2	Very low	28.8	Very low	182 Å²	182	142.4 Å²	142.4	85%	0.85	77%	0.765	S	S	*	*			trans	-90.7	152.4	160.6	-59.5	172.2	-82	0	0	111.5
377	D	24.1	Very low	29.7	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	77%	0.77	S	S	*	*				-164.2	-166.4	123.4	-144.3	-28.6	0	0	0	111.8
378	S	34.2	Very low	29.4	Very low	83 Å²	83	142.6 Å²	142.6	58%	0.58	77%	0.774	S	S	*	*			trans	-136.2	162.1	-144.4	-41.7	0	0	0	0	116.5
379	N	30.2	Very low	29.4	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	78%	0.775	S	S	*	*			trans	85.3	132.9	151.4	-58.1	-47.8	0	0	0	122.7
380	K	29.2	Very low	29.5	Very low	182 Å²	182	140.1 Å²	140.1	79%	0.791	78%	0.777	S	S	*	*				107.6	98.3	129.8	-157.8	173.6	-176.1	-179	0	120.9
381	L	28.2	Very low	29.4	Very low	144 Å²	144	145.5 Å²	145.5	75%	0.754	78%	0.781	S	S	*	*			trans	68	157.9	156.3	-55.4	170.3	0	0	0	115.7
382	Q	25.7	Very low	29.1	Very low	174 Å²	174	147.6 Å²	147.6	81%	0.813	78%	0.783	S	S	*	*			cis	-149.4	156.7	13.3	-158.9	165.7	-45	0	0	112
383	C	23.6	Very low	28.9	Very low	113 Å²	113	146.6 Å²	146.6	76%	0.764	78%	0.782	S	S	*	*			trans	-90.1	-173.3	172.5	-53.4	0	0	0	0	110.8
384	P	39.1	Very low	28.8	Very low	107 Å²	107	148.8 Å²	148.8	70%	0.695	78%	0.783	S	S	*	*			cis	-149.8	-168.7	13.8	44	-21.6	0	0	0	118.3
385	L	28.1	Very low	28.7	Very low	176 Å²	176	150.8 Å²	150.8	92%	0.921	79%	0.789	S	S	*	*			trans	68	159.3	166.3	-55.8	166.5	0	0	0	116
386	G	24.4	Very low	28.7	Very low	64 Å²	64	147.7 Å²	147.7	66%	0.66	78%	0.782	S	S	*	*			cis	-171.9	165.4	-5.5	0	0	0	0	0	110.2
387	P	44.9	Very low	28.6	Very low	128 Å²	128	146.6 Å²	146.6	83%	0.831	78%	0.781	S	S	*	*			trans	-100.9	178.6	-164.7	39.3	-37.5	0	0	0	116.3
388	L	23.6	Very low	28.8	Very low	155 Å²	155	144.6 Å²	144.6	81%	0.812	77%	0.771	S	S	*	*			trans	90	114.5	158	-167.2	72.2	0	0	0	119
389	T	25.7	Very low	28.7	Very low	113 Å²	113	149.3 Å²	149.3	69%	0.693	78%	0.781	S	S	*	*				-173.9	153	117.4	19.5	0	0	0	0	112.2
390	V	30	Very low	28.8	Very low	127 Å²	127	146.6 Å²	146.6	77%	0.77	77%	0.766	S	S	*	*			trans	-107.1	137.9	164.1	168.9	0	0	0	0	107.2
391	W	25.3	Very low	28.9	Very low	219 Å²	219	146.1 Å²	146.1	83%	0.83	77%	0.767	S	S	*	*			trans	-141	114.7	162.9	-75.4	100.2	0	0	0	110.5
392	H	26.2	Very low	28.9	Very low	157 Å²	157	143 Å²	143	73%	0.727	76%	0.762	S	S	*	*			trans	-79	145.9	145.3	-96.2	-99.6	0	0	0	107.3
393	E	26.2	Very low	29	Very low	186 Å²	186	140.4 Å²	140.4	87%	0.869	76%	0.758	S	S	*	*				-169.1	156.7	102.5	-103.1	-180	141.7	0	0	111.1
394	E	29.6	Very low	29.2	Very low	167 Å²	167	140 Å²	140	78%	0.78	75%	0.752	S	S	*	*			trans	-90.8	157.1	175	-55.7	-180	134.1	0	0	109.6
395	H	26.8	Very low	28.8	Very low	194 Å²	194	143.2 Å²	143.2	90%	0.898	76%	0.755	S	S	*	*			trans	-145.6	123.9	151.4	-114.5	-71.8	0	0	0	114
396	V	27.2	Very low	28.9	Very low	118 Å²	118	141.2 Å²	141.2	72%	0.715	75%	0.745	S	S	*	*			trans	-70.4	137.7	178.5	168.6	0	0	0	0	111.9
397	L	28.2	Very low	29.2	Very low	159 Å²	159	142.8 Å²	142.8	83%	0.832	75%	0.746	S	S	*	*				-154.9	141.1	129.5	-148	63.6	0	0	0	115.4
398	N	28.4	Very low	28.6	Very low	113 Å²	113	144.7 Å²	144.7	60%	0.604	75%	0.749	S	S	*	*			trans	-79.7	150.6	172.4	168.1	40.1	0	0	0	112.5
399	K	31.7	Very low	28.9	Very low	181 Å²	181	140.2 Å²	140.2	79%	0.787	74%	0.741	S	S	*	*			trans	-172.8	117.6	130.7	-102.4	155.6	-173.5	179	0	115.8
400	N	33.3	Very low	29.3	Very low	101 Å²	101	143.1 Å²	143.1	54%	0.54	75%	0.751	S	S	.	*				47.1	129.6	125.8	-62.8	46.7	0	0	0	122.7
401	E	30.3	Very low	30.2	Very low	172 Å²	172	142 Å²	142	80%	0.804	75%	0.747	S	S	*	*			trans	62.8	150.7	131.8	-65.3	174.4	95.6	0	0	121
402	A	29.3	Very low	30.4	Very low	79 Å²	79	139.2 Å²	139.2	65%	0.653	75%	0.746	S	S	*	*			cis	-171.4	-170.2	-19.7	0	0	0	0	0	109.4
403	T	26.4	Very low	30.7	Very low	119 Å²	119	140.2 Å²	140.2	73%	0.73	75%	0.748	S	S	*	*			trans	92.1	74.4	145.8	-51	0	0	0	0	120.3
404	T	28.1	Very low	30.9	Very low	105 Å²	105	140 Å²	140	64%	0.644	75%	0.748	S	S	*	*				78.7	147.6	126.3	66.8	0	0	0	0	124.3
405	K	30.8	Very low	31.2	Very low	175 Å²	175	138.6 Å²	138.6	76%	0.761	75%	0.75	S	S	*	*			trans	74.8	143.9	143.6	-76.5	155.9	-174.2	174.8	0	119.3
406	N	30.2	Very low	32.4	Very low	133 Å²	133	134.2 Å²	134.2	71%	0.711	74%	0.739	S	S	*	*				-178	175	-50.8	55.3	-17.3	0	0	0	108.9
407	S	30.4	Very low	32.8	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	74%	0.741	S	S	*	*			trans	83	147.8	167.5	84.1	0	0	0	0	117.7
408	N	33	Very low	33.1	Very low	168 Å²	168	133.6 Å²	133.6	90%	0.898	74%	0.738	S	S	*	*			cis	-163.2	159.1	-19.1	-105.6	-10.4	0	0	0	110
409	G	29.5	Very low	33.2	Very low	61 Å²	61	136.1 Å²	136.1	63%	0.629	75%	0.746	S	S	*	*			trans	133.2	76.2	171.9	0	0	0	0	0	113.7
410	L	33.9	Very low	33.3	Very low	174 Å²	174	135.9 Å²	135.9	91%	0.911	74%	0.74	S	S	*	*				90.1	147.2	83.2	-75	171.9	0	0	0	113.4
411	P	48.7	Very low	33	Very low	105 Å²	105	138 Å²	138	68%	0.682	75%	0.751	S	S	*	*			trans	-134.4	-178.6	-142.3	41.9	-24.7	0	0	0	115.6
412	I	31.4	Very low	33.5	Very low	159 Å²	159	137.2 Å²	137.2	82%	0.815	75%	0.748	S	S	*	*			trans	-176	159.5	132.9	-95.7	154.2	0	0	0	111.2
413	K	31.9	Very low	33.9	Very low	178 Å²	178	136.8 Å²	136.8	77%	0.774	75%	0.751	S	S	*	*			trans	-41	160.8	177.4	-42.4	170.3	-179.2	174.7	0	114.8
414	E	30.7	Very low	34.4	Very low	182 Å²	182	139.6 Å²	139.6	85%	0.85	76%	0.756	S	S	*	*			cis	-142.1	-160.6	38.8	-68.3	-172.7	150.5	0	0	114.7
415	V	35.4	Very low	34.9	Very low	137 Å²	137	142.5 Å²	142.5	83%	0.83	77%	0.766	S	S	*	*			trans	-132.1	-165	-156.2	-141.2	0	0	0	0	113.4
416	P	51.8	Low	35.6	Very low	103 Å²	103	139.8 Å²	139.8	67%	0.669	76%	0.764	S	S	*	*				-110.5	-158	-127.6	48	-30.1	0	0	0	112.9	L418	P416-L418 HydrophobicContact CB-CB 4.47Å
417	P	35.1	Very low	36.6	Very low	115 Å²	115	140.9 Å²	140.9	75%	0.747	77%	0.765	S	S	*	*			cis	-118.5	164.7	46.4	40.2	-29.4	0	0	0	113.1
418	L	34.7	Very low	37.9	Very low	149 Å²	149	140.3 Å²	140.3	78%	0.78	76%	0.758	S	S	*	*			cis	66	69.6	13.6	-149	88	0	0	0	119	P416	P416-L418 HydrophobicContact CB-CB 4.47Å
419	E	30.8	Very low	39.7	Very low	166 Å²	166	138.8 Å²	138.8	78%	0.776	75%	0.746	S	S	*	*			trans	-117.4	112.6	140.9	-65.9	-175.1	160	0	0	105.6
420	R	32.6	Very low	42.4	Very low	176 Å²	176	137.9 Å²	137.9	66%	0.664	73%	0.725	S	S	*	*				41.2	89.8	60.5	-173.3	-179.3	-83.4	154.4	-3.9	112.5	E422	R420-E422 HydrophobicContact CG-CB 4.09Å; R420-E422 HydrophobicContact CG-CG 4.05Å; R420-E422 WeakPolarHBondContact CG-OE1 3.08Å; R420-E422 IonicContact CZ-OE1 3.52Å; R420-E422 IonicContact NE-OE1 2.72Å; R420-E422 PolarHBondContact NE-OE1 2.96Å; R420-E422 IonicContact NH2-OE1 3.46Å; R420-E422 PolarHBondContact NH2-OE1 3.26Å
421	N	28.6	Very low	45.1	Very low	144 Å²	144	133.6 Å²	133.6	77%	0.77	70%	0.703	S	S	*	*			trans	-115.9	56.2	153.9	-86.3	-83.6	0	0	0	110	G423	N421-G423 PolarHBondContact O-N 2.83Å
422	E	39.7	Very low	47.1	Very low	157 Å²	157	129.5 Å²	129.5	73%	0.734	68%	0.676	S	S	*	*			trans	-69.1	83.1	161.4	-69	170.1	-115.7	0	0	107.7	R420	R420-E422 HydrophobicContact CG-CB 4.09Å; R420-E422 HydrophobicContact CG-CG 4.05Å; R420-E422 WeakPolarHBondContact CG-OE1 3.08Å; R420-E422 IonicContact CZ-OE1 3.52Å; R420-E422 IonicContact NE-OE1 2.72Å; R420-E422 PolarHBondContact NE-OE1 2.96Å; R420-E422 IonicContact NH2-OE1 3.46Å; R420-E422 PolarHBondContact NH2-OE1 3.26Å
423	G	38.8	Very low	50.1	Low	69 Å²	69	125.7 Å²	125.7	71%	0.711	66%	0.662	S	S	*	*			trans	-173.1	5.9	-167.6	0	0	0	0	0	118.2	N421	N421-G423 PolarHBondContact O-N 2.83Å
424	Q	35.8	Very low	53	Low	179 Å²	179	121.8 Å²	121.8	84%	0.836	64%	0.643	S	S	*	*			trans	-113.6	101.2	166	-71.4	-172.7	1.1	0	0	109.5	T426	Q424-T426 PolarHBondContact O-N 2.83Å
425	I	39.1	Very low	56.1	Low	166 Å²	166	113.1 Å²	113.1	85%	0.851	60%	0.602	S	S	*	*			trans	-69.1	93.9	152.5	-58.6	173	0	0	0	104.6	Q427	I425-Q427 PolarHBondContact O-N 3.35Å; I425-Q427 VanDerWaalsContact O-N 3.17Å
426	T	45.2	Very low	58.9	Low	117 Å²	117	110.3 Å²	110.3	72%	0.718	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-56.3	121.9	169.4	-43.9	0	0	0	0	106.9	Q424	Q424-T426 PolarHBondContact O-N 2.83Å
427	Q	52.1	Low	61	Low	157 Å²	157	110.5 Å²	110.5	73%	0.734	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-49.5	138	167.7	-72.9	-78.4	29.6	0	0	107.9	I425 H429	I425-Q427 PolarHBondContact O-N 3.35Å; I425-Q427 VanDerWaalsContact O-N 3.17Å; Q427-H429 PolarHBondContact O-N 3.37Å
428	P	57.3	Low	63.9	Low	84 Å²	84	106.7 Å²	106.7	55%	0.545	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-52	120.2	171.8	-22.5	33	0	0	0	108	H430	P428-H430 PolarHBondContact O-CD2 3.01Å; P428-H430 PolarHBondContact O-N 3.5Å
429	H	70.9	Confident	66.8	Low	136 Å²	136	100.3 Å²	100.3	63%	0.63	51%	0.512	S	S	*	.			trans	-71.7	100.8	-179.5	-168.1	-88	0	0	0	107.3	Q427 D431	Q427-H429 PolarHBondContact O-N 3.37Å; H429-D431 IonicContact CE1-OD1 2.78Å; H429-D431 PolarHBondContact CE1-OD1 3.19Å; H429-D431 IonicContact CG-OD1 3.95Å; H429-D431 IonicContact ND1-OD1 2.75Å; H429-D431 PolarHBondContact ND1-OD1 2.98Å; H429-D431 PolarHBondContact O-N 2.87Å; H429-D431 VanDerWaalsContact O-N 3.07Å
430	H	85.9	Confident	69.9	Low	43 Å²	43	97.9 Å²	97.9	20%	0.199	50%	0.5	C	S	.	.			trans	-75.9	101.3	-174.7	-70.5	-67.7	0	0	0	109.2	P428 Y434 F435 C505 D509	P428-H430 PolarHBondContact O-CD2 3.01Å; P428-H430 PolarHBondContact O-N 3.5Å; H430-Y434 HydrophobicContact CB-CD1 3.84Å; H430-Y434 HydrophobicContact CB-CE1 4.21Å; H430-Y434 AromaticContact CE1-CE1 3.66Å; H430-Y434 AromaticContact CE1-CZ 3.56Å; H430-Y434 AromaticContact CG-CD1 3.86Å; H430-Y434 AromaticContact CG-CE1 3.79Å; H430-Y434 AromaticContact ND1-CD1 3.25Å; H430-Y434 WeakPolarHBondContact ND1-CD1 3.24Å; H430-Y434 AromaticContact ND1-CD2 3.98Å; H430-Y434 AromaticContact ND1-CE1 3.04Å; H430-Y434 WeakPolarHBondContact ND1-CE1 3.37Å; H430-Y434 AromaticContact ND1-CE2 3.8Å; H430-Y434 AromaticContact ND1-CG 3.74Å; H430-Y434 AromaticContact ND1-CZ 3.35Å; H430-Y434 VanDerWaalsContact ND1-CZ 3.35Å; H430-F435 HydrophobicContact CB-CE1 3.93Å; H430-F435 HydrophobicContact CB-CE2 3.76Å; H430-F435 HydrophobicContact CB-CZ 3.37Å; H430-F435 WeakPolarHBondContact O-CE2 3.48Å; H430-C505 WeakPolarHBondContact O-CB 3.46Å; H430-D509 WeakPolarHBondContact CB-OD1 3.27Å; H430-D509 IonicContact CD2-OD1 2.71Å; H430-D509 PolarHBondContact CD2-OD1 3.17Å; H430-D509 IonicContact CG-OD1 2.69Å
431	D	90.6	Very high	73	Confident	83 Å²	83	91.1 Å²	91.1	44%	0.444	48%	0.48	S	S	.	.			trans	-81.5	160.2	-179.6	-65.5	-30.5	0	0	0	112.2	H429 P433 Y434 F435	H429-D431 IonicContact CE1-OD1 2.78Å; H429-D431 PolarHBondContact CE1-OD1 3.19Å; H429-D431 IonicContact CG-OD1 3.95Å; H429-D431 IonicContact ND1-OD1 2.75Å; H429-D431 PolarHBondContact ND1-OD1 2.98Å; H429-D431 PolarHBondContact O-N 2.87Å; H429-D431 VanDerWaalsContact O-N 3.07Å; D431-P433 VanDerWaalsContact C-CD 3.43Å; D431-P433 VanDerWaalsContact C-N 3.31Å; D431-P433 VanDerWaalsContact O-N 3.15Å; D431-Y434 WeakPolarHBondContact O-CA 3.43Å; D431-Y434 VanDerWaalsContact O-CB 3.32Å; D431-Y434 WeakPolarHBondContact O-CB 3.3Å; D431-Y434 PolarHBondContact O-N 3.33Å; D431-F435 WeakPolarHBondContact O-CD2 3.35Å; D431-F435 PolarHBondContact O-N 3.22Å; D431-F435 VanDerWaalsContact O-N 3.14Å
432	V	91.6	Very high	76.2	Confident	19 Å²	19	85.4 Å²	85.4	12%	0.115	45%	0.449	C	S	.	.	H	α-helix	trans	-44.7	-44.3	175.3	166.1	0	0	0	0	113.9	Y434 F435 R436 V491 C494 E495 L508	V432-Y434 PolarHBondContact O-N 3.22Å; V432-F435 PolarHBondContact O-N 3.43Å; V432-R436 PolarHBondContact O-N 3.36Å; V432-V491 HydrophobicContact CG1-CG1 3.9Å; V432-C494 HydrophobicContact CG2-CB 3.99Å; V432-C494 VanDerWaalsContact CG2-SG 3.54Å; V432-E495 HydrophobicContact CG1-CB 3.83Å; V432-E495 HydrophobicContact CG1-CG 4.01Å; V432-L508 HydrophobicContact CG2-CD1 4.24Å
433	P	92.8	Very high	78.9	Confident	80 Å²	80	80.2 Å²	80.2	52%	0.519	43%	0.428	S	S	.	.	H	α-helix	trans	-66.1	-34.2	177.3	-22.3	35.7	0	0	0	113.7	D431 F435 R436 N437	D431-P433 VanDerWaalsContact C-CD 3.43Å; D431-P433 VanDerWaalsContact C-N 3.31Å; D431-P433 VanDerWaalsContact O-N 3.15Å; P433-F435 VanDerWaalsContact C-N 3.33Å; P433-R436 PolarHBondContact O-N 3.25Å; P433-N437 WeakPolarHBondContact O-CB 3.49Å; P433-N437 PolarHBondContact O-N 2.97Å; P433-N437 PolarHBondContact O-ND2 2.93Å
434	Y	94.4	Very high	81.7	Confident	95 Å²	95	82 Å²	82	37%	0.373	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-45.2	172.7	167.5	-88.4	0	0	0	110.1	H430 D431 V432 R436 N437 I438	H430-Y434 HydrophobicContact CB-CD1 3.84Å; H430-Y434 HydrophobicContact CB-CE1 4.21Å; H430-Y434 AromaticContact CE1-CE1 3.66Å; H430-Y434 AromaticContact CE1-CZ 3.56Å; H430-Y434 AromaticContact CG-CD1 3.86Å; H430-Y434 AromaticContact CG-CE1 3.79Å; H430-Y434 AromaticContact ND1-CD1 3.25Å; H430-Y434 WeakPolarHBondContact ND1-CD1 3.24Å; H430-Y434 AromaticContact ND1-CD2 3.98Å; H430-Y434 AromaticContact ND1-CE1 3.04Å; H430-Y434 WeakPolarHBondContact ND1-CE1 3.37Å; H430-Y434 AromaticContact ND1-CE2 3.8Å; H430-Y434 AromaticContact ND1-CG 3.74Å; H430-Y434 AromaticContact ND1-CZ 3.35Å; H430-Y434 VanDerWaalsContact ND1-CZ 3.35Å; D431-Y434 WeakPolarHBondContact O-CA 3.43Å; D431-Y434 VanDerWaalsContact O-CB 3.32Å; D431-Y434 WeakPolarHBondContact O-CB 3.3Å; D431-Y434 PolarHBondContact O-N 3.33Å; V432-Y434 PolarHBondContact O-N 3.22Å; Y434-R436 PolarHBondContact O-N 3.09Å; Y434-N437 PolarHBondContact O-N 3.25Å; Y434-I438 HydrophobicContact CD1-CG2 4.5Å; Y434-I438 HydrophobicContact CE1-CB 4.46Å; Y434-I438 HydrophobicContact CE1-CG2 4.11Å; Y434-I438 WeakPolarHBondContact O-CG2 3.24Å; Y434-I438 PolarHBondContact O-N 2.91Å
435	F	94.6	Very high	84.6	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-65.4	-35.5	178.6	-68.5	-56.5	0	0	0	113.7	H430 D431 V432 P433 L439 F487 V491 L508 D509 W512	H430-F435 HydrophobicContact CB-CE1 3.93Å; H430-F435 HydrophobicContact CB-CE2 3.76Å; H430-F435 HydrophobicContact CB-CZ 3.37Å; H430-F435 WeakPolarHBondContact O-CE2 3.48Å; D431-F435 WeakPolarHBondContact O-CD2 3.35Å; D431-F435 PolarHBondContact O-N 3.22Å; D431-F435 VanDerWaalsContact O-N 3.14Å; V432-F435 PolarHBondContact O-N 3.43Å; P433-F435 VanDerWaalsContact C-N 3.33Å; F435-L439 WeakPolarHBondContact O-CB 3.44Å; F435-L439 PolarHBondContact O-N 3.17Å; F435-L439 VanDerWaalsContact O-N 3.15Å; F435-F487 HydrophobicContact CB-CE1 4Å; F435-F487 HydrophobicContact CB-CZ 3.86Å; F435-F487 HydrophobicContact CD1-CE1 4.17Å; F435-F487 AromaticContact CD1-CZ 3.54Å; F435-F487 HydrophobicContact CD1-CZ 3.54Å; F435-F487 HydrophobicContact CE1-CZ 4.21Å; F435-F487 HydrophobicContact CG-CE1 4.39Å; F435-F487 AromaticContact CG-CZ 3.81Å; F435-F487 HydrophobicContact CG-CZ 3.81Å; F435-V491 HydrophobicContact CB-CG1 4.34Å; F435-V491 HydrophobicContact CB-CG2 3.86Å; F435-L508 HydrophobicContact CD2-CB 3.73Å; F435-L508 HydrophobicContact CD2-CD1 3.54Å; F435-L508 HydrophobicContact CD2-CG 4.3Å; F435-L508 HydrophobicContact CE1-CB 4.3Å; F435-L508 HydrophobicContact CE2-CB 3.38Å; F435-L508 HydrophobicContact CE2-CD1 3.85Å; F435-L508 HydrophobicContact CE2-CG 4.26Å; F435-L508 HydrophobicContact CG-CB 4.3Å; F435-L508 HydrophobicContact CG-CD1 4.37Å; F435-L508 HydrophobicContact CZ-CB 3.69Å; F435-D509 HydrophobicContact CZ-CB 4.47Å; F435-D509 WeakPolarHBondContact CZ-OD1 3.31Å; F435-W512 HydrophobicContact CD1-CB 4.45Å; F435-W512 HydrophobicContact CD1-CG 4.48Å; F435-W512 HydrophobicContact CE1-CB 4.07Å; F435-W512 HydrophobicContact CE1-CG 4.31Å
436	R	95.4	Very high	87.3	Confident	78 Å²	78	70.4 Å²	70.4	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-64.1	-47.1	170.9	-68.7	-164.1	178.4	-70	0.2	111.7	V432 P433 Y434 L439 Q440 V491 E495	V432-R436 PolarHBondContact O-N 3.36Å; P433-R436 PolarHBondContact O-N 3.25Å; Y434-R436 PolarHBondContact O-N 3.09Å; R436-L439 PolarHBondContact O-N 3.5Å; R436-Q440 WeakPolarHBondContact O-CB 3.46Å; R436-Q440 PolarHBondContact O-N 3.45Å; R436-V491 HydrophobicContact CG-CG1 3.63Å; R436-E495 IonicContact CZ-OE2 3.57Å; R436-E495 IonicContact NE-OE2 3.67Å; R436-E495 PolarHBondContact NE-OE2 3.01Å; R436-E495 IonicContact NH2-OE2 3.18Å; R436-E495 PolarHBondContact NH2-OE2 2.96Å
437	N	95.8	Very high	89.8	Confident	108 Å²	108	67.5 Å²	67.5	58%	0.578	34%	0.34	S	S	*	.	H	α-helix	trans	-65.7	-44.7	-177.6	-68.7	-11.7	0	0	0	112.5	P433 Y434 Q440 S441	P433-N437 WeakPolarHBondContact O-CB 3.49Å; P433-N437 PolarHBondContact O-N 2.97Å; P433-N437 PolarHBondContact O-ND2 2.93Å; Y434-N437 PolarHBondContact O-N 3.25Å; N437-Q440 PolarHBondContact O-N 3.41Å; N437-S441 WeakPolarHBondContact O-CB 3.35Å; N437-S441 PolarHBondContact O-N 3.26Å
438	I	95.7	Very high	91.9	Very high	34 Å²	34	63.6 Å²	63.6	17%	0.174	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-43.5	178.6	-164.2	68.8	0	0	0	110.8	Y434 Q440 S441 E442 W512	Y434-I438 HydrophobicContact CD1-CG2 4.5Å; Y434-I438 HydrophobicContact CE1-CB 4.46Å; Y434-I438 HydrophobicContact CE1-CG2 4.11Å; Y434-I438 WeakPolarHBondContact O-CG2 3.24Å; Y434-I438 PolarHBondContact O-N 2.91Å; I438-Q440 PolarHBondContact O-N 3.12Å; I438-S441 PolarHBondContact O-N 3.37Å; I438-S441 PolarHBondContact O-OG 3.02Å; I438-E442 HydrophobicContact CG1-CG 4.44Å; I438-E442 WeakPolarHBondContact O-CG 3.3Å; I438-E442 PolarHBondContact O-N 2.93Å; I438-W512 HydrophobicContact CB-CZ2 4.25Å; I438-W512 HydrophobicContact CG1-CH2 4.1Å; I438-W512 HydrophobicContact CG1-CZ2 3.43Å; I438-W512 VanDerWaalsContact CG1-CZ2 3.43Å; I438-W512 HydrophobicContact CG2-CD2 4.28Å; I438-W512 HydrophobicContact CG2-CH2 4.06Å; I438-W512 HydrophobicContact CG2-CZ2 3.81Å; I438-W512 HydrophobicContact CG2-CZ3 4.4Å
439	L	95.8	Very high	93.7	Very high	16 Å²	16	62.4 Å²	62.4	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-58	-46.6	176.3	178.8	62.6	0	0	0	111.8	F435 R436 T443 F484 F487 E488 W512	F435-L439 WeakPolarHBondContact O-CB 3.44Å; F435-L439 PolarHBondContact O-N 3.17Å; F435-L439 VanDerWaalsContact O-N 3.15Å; R436-L439 PolarHBondContact O-N 3.5Å; L439-T443 WeakPolarHBondContact O-CB 3.38Å; L439-T443 PolarHBondContact O-N 3.45Å; L439-T443 PolarHBondContact O-OG1 3.12Å; L439-F484 HydrophobicContact CD1-CB 3.73Å; L439-F484 HydrophobicContact CD1-CD1 4.25Å; L439-F484 HydrophobicContact CD1-CD2 3.62Å; L439-F484 HydrophobicContact CD1-CE2 4.25Å; L439-F484 HydrophobicContact CD1-CG 3.6Å; L439-F487 HydrophobicContact CB-CD1 4.32Å; L439-F487 HydrophobicContact CB-CE1 4.47Å; L439-F487 HydrophobicContact CD1-CD1 4.06Å; L439-F487 HydrophobicContact CD2-CD1 3.99Å; L439-F487 HydrophobicContact CG-CD1 4.34Å; L439-E488 HydrophobicContact CD2-CB 4.01Å; L439-W512 HydrophobicContact CD1-CZ3 4.26Å
440	Q	95.8	Very high	94.9	Very high	114 Å²	114	56.1 Å²	56.1	53%	0.533	29%	0.289	S	S	.	.	H	α-helix	trans	-60.6	-50.1	175.1	179.7	174.4	-13.3	0	0	110.8	R436 N437 I438 E442 T443 E444	R436-Q440 WeakPolarHBondContact O-CB 3.46Å; R436-Q440 PolarHBondContact O-N 3.45Å; N437-Q440 PolarHBondContact O-N 3.41Å; I438-Q440 PolarHBondContact O-N 3.12Å; Q440-E442 VanDerWaalsContact C-N 3.34Å; Q440-E442 PolarHBondContact O-N 2.84Å; Q440-T443 WeakPolarHBondContact O-CB 3.46Å; Q440-T443 PolarHBondContact O-N 3.37Å; Q440-T443 VanDerWaalsContact O-N 3.08Å; Q440-E444 HydrophobicContact CG-CG 4.44Å; Q440-E444 VanDerWaalsContact CG-OE1 3.26Å; Q440-E444 WeakPolarHBondContact CG-OE1 3.31Å; Q440-E444 PolarHBondContact NE2-OE1 3.5Å; Q440-E444 WeakPolarHBondContact O-CG 3.4Å; Q440-E444 PolarHBondContact O-N 3.24Å
441	S	96.4	Very high	95.4	Very high	35 Å²	35	58.3 Å²	58.3	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-37.6	-176.8	80.9	0	0	0	0	113.2	N437 I438 K445	N437-S441 WeakPolarHBondContact O-CB 3.35Å; N437-S441 PolarHBondContact O-N 3.26Å; I438-S441 PolarHBondContact O-N 3.37Å; I438-S441 PolarHBondContact O-OG 3.02Å; S441-K445 WeakPolarHBondContact O-CD 3.37Å; S441-K445 WeakPolarHBondContact O-CG 3.27Å; S441-K445 PolarHBondContact O-N 3.03Å
442	E	96.3	Very high	95.6	Very high	24 Å²	24	57.7 Å²	57.7	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-73.6	-32.9	174.8	-66.2	-51.9	136.5	0	0	112	I438 Q440 K445 L446 F484 W512 I519	I438-E442 HydrophobicContact CG1-CG 4.44Å; I438-E442 WeakPolarHBondContact O-CG 3.3Å; I438-E442 PolarHBondContact O-N 2.93Å; Q440-E442 VanDerWaalsContact C-N 3.34Å; Q440-E442 PolarHBondContact O-N 2.84Å; E442-K445 IonicContact OE1-NZ 3.73Å; E442-K445 PolarHBondContact OE1-NZ 3.15Å; E442-L446 VanDerWaalsContact O-CB 3.27Å; E442-L446 WeakPolarHBondContact O-CB 3.32Å; E442-L446 WeakPolarHBondContact O-CG 3.47Å; E442-L446 PolarHBondContact O-N 3.25Å; E442-F484 HydrophobicContact CB-CE2 4.29Å; E442-F484 HydrophobicContact CB-CZ 4.23Å; E442-W512 HydrophobicContact CB-CH2 4.29Å; E442-W512 HydrophobicContact CG-CH2 3.91Å; E442-W512 HydrophobicContact CG-CZ2 4.11Å; E442-I519 HydrophobicContact CB-CD1 4Å; E442-I519 HydrophobicContact CG-CD1 4.01Å
443	T	96.5	Very high	95.8	Very high	47 Å²	47	56.8 Å²	56.8	29%	0.288	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-44.7	172.1	-55.1	0	0	0	0	110.9	L439 Q440 T447 M480 F484	L439-T443 WeakPolarHBondContact O-CB 3.38Å; L439-T443 PolarHBondContact O-N 3.45Å; L439-T443 PolarHBondContact O-OG1 3.12Å; Q440-T443 WeakPolarHBondContact O-CB 3.46Å; Q440-T443 PolarHBondContact O-N 3.37Å; Q440-T443 VanDerWaalsContact O-N 3.08Å; T443-T447 WeakPolarHBondContact O-CB 3.35Å; T443-T447 PolarHBondContact O-N 2.6Å; T443-T447 PolarHBondContact O-OG1 3.4Å; T443-M480 HydrophobicContact CG2-SD 4.21Å; T443-F484 VanDerWaalsContact OG1-CD2 3.24Å; T443-F484 WeakPolarHBondContact OG1-CD2 3.32Å; T443-F484 WeakPolarHBondContact OG1-CE2 3.16Å
444	E	97.4	Very high	95.9	Very high	107 Å²	107	54.7 Å²	54.7	50%	0.5	28%	0.275	S	S	.	.	H	α-helix	trans	-67.1	-44	179.2	-71.6	172.8	-172.3	0	0	111.9	Q440 S448	Q440-E444 HydrophobicContact CG-CG 4.44Å; Q440-E444 VanDerWaalsContact CG-OE1 3.26Å; Q440-E444 WeakPolarHBondContact CG-OE1 3.31Å; Q440-E444 PolarHBondContact NE2-OE1 3.5Å; Q440-E444 WeakPolarHBondContact O-CG 3.4Å; Q440-E444 PolarHBondContact O-N 3.24Å; E444-S448 VanDerWaalsContact O-CB 3.29Å; E444-S448 WeakPolarHBondContact O-CB 3.35Å; E444-S448 PolarHBondContact O-N 2.94Å; E444-S448 PolarHBondContact O-OG 2.65Å
445	K	96.3	Very high	95.8	Very high	101 Å²	101	58.5 Å²	58.5	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-60	-52.4	174.3	-70.2	164	-158.6	171.3	0	112	S441 E442 T447 S448 H449	S441-K445 WeakPolarHBondContact O-CD 3.37Å; S441-K445 WeakPolarHBondContact O-CG 3.27Å; S441-K445 PolarHBondContact O-N 3.03Å; E442-K445 IonicContact OE1-NZ 3.73Å; E442-K445 PolarHBondContact OE1-NZ 3.15Å; K445-T447 PolarHBondContact O-N 2.76Å; K445-S448 WeakPolarHBondContact O-CB 3.19Å; K445-S448 PolarHBondContact O-N 2.79Å; K445-H449 PolarHBondContact O-N 2.96Å
446	L	96.9	Very high	95.6	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-68.3	-34.3	-178.2	-71.9	-176.9	0	0	0	112.7	E442 C450 T476 L479 M480 F484 I519 V522 I523	E442-L446 VanDerWaalsContact O-CB 3.27Å; E442-L446 WeakPolarHBondContact O-CB 3.32Å; E442-L446 WeakPolarHBondContact O-CG 3.47Å; E442-L446 PolarHBondContact O-N 3.25Å; L446-C450 PolarHBondContact O-N 3.04Å; L446-C450 PolarHBondContact O-SG 3.2Å; L446-T476 HydrophobicContact CB-CG2 3.73Å; L446-T476 HydrophobicContact CD1-CG2 4.23Å; L446-T476 HydrophobicContact CD2-CG2 4.02Å; L446-T476 HydrophobicContact CG-CG2 4.22Å; L446-L479 HydrophobicContact CD1-CD2 4.3Å; L446-M480 HydrophobicContact CB-CE 4.46Å; L446-M480 HydrophobicContact CB-CG 4.43Å; L446-M480 HydrophobicContact CB-SD 3.6Å; L446-M480 VanDerWaalsContact CB-SD 3.6Å; L446-M480 HydrophobicContact CD1-CG 4.32Å; L446-F484 HydrophobicContact CD1-CE2 4.23Å; L446-F484 HydrophobicContact CD1-CZ 3.71Å; L446-I519 HydrophobicContact CD1-CG1 4.19Å; L446-I519 HydrophobicContact CD1-CG2 4.28Å; L446-I519 HydrophobicContact CD2-CG2 4.46Å; L446-V522 HydrophobicContact CD2-CG1 3.93Å; L446-I523 HydrophobicContact CD2-CG1 4.08Å
447	T	97.4	Very high	95.3	Very high	56 Å²	56	58 Å²	58	34%	0.344	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-41.3	172.1	-61.2	0	0	0	0	111.1	T443 K445 C450 L451 M480	T443-T447 WeakPolarHBondContact O-CB 3.35Å; T443-T447 PolarHBondContact O-N 2.6Å; T443-T447 PolarHBondContact O-OG1 3.4Å; K445-T447 PolarHBondContact O-N 2.76Å; T447-C450 WeakPolarHBondContact O-CB 3.27Å; T447-C450 PolarHBondContact O-N 2.75Å; T447-L451 HydrophobicContact CG2-CD1 4.16Å; T447-L451 WeakPolarHBondContact O-CG 3.27Å; T447-L451 PolarHBondContact O-N 3.37Å; T447-M480 PolarHBondContact OG1-SD 3.07Å
448	S	96.8	Very high	95	Very high	75 Å²	75	61.1 Å²	61.1	52%	0.524	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-45.5	176.3	-60.4	0	0	0	0	111.7	E444 K445 L451 E452	E444-S448 VanDerWaalsContact O-CB 3.29Å; E444-S448 WeakPolarHBondContact O-CB 3.35Å; E444-S448 PolarHBondContact O-N 2.94Å; E444-S448 PolarHBondContact O-OG 2.65Å; K445-S448 WeakPolarHBondContact O-CB 3.19Å; K445-S448 PolarHBondContact O-N 2.79Å; S448-L451 PolarHBondContact O-N 3.18Å; S448-E452 PolarHBondContact O-N 3.39Å
449	H	94.3	Very high	94.5	Very high	60 Å²	60	64.4 Å²	64.4	28%	0.278	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-42.4	171.9	-82	-45.7	0	0	0	112.4	K445 L451 E452 W453 F526	K445-H449 PolarHBondContact O-N 2.96Å; H449-L451 VanDerWaalsContact C-N 3.34Å; H449-L451 PolarHBondContact O-N 3.33Å; H449-E452 IonicContact ND1-OE2 3.16Å; H449-E452 PolarHBondContact ND1-OE2 3.31Å; H449-E452 PolarHBondContact O-N 3.19Å; H449-W453 WeakPolarHBondContact O-CB 3.28Å; H449-W453 PolarHBondContact O-N 3.27Å; H449-F526 HydrophobicContact CB-CD2 4.27Å; H449-F526 HydrophobicContact CB-CE2 4.1Å; H449-F526 HydrophobicContact CB-CZ 4.34Å
450	C	96.7	Very high	94.1	Very high	4 Å²	4	71.4 Å²	71.4	3%	0.027	36%	0.356	C	S	.	.	H	α-helix	trans	-53.8	-53.4	173.9	-71	0	0	0	0	110.7	L446 T447 E452 W453 D454 V473 T476	L446-C450 PolarHBondContact O-N 3.04Å; L446-C450 PolarHBondContact O-SG 3.2Å; T447-C450 WeakPolarHBondContact O-CB 3.27Å; T447-C450 PolarHBondContact O-N 2.75Å; C450-E452 PolarHBondContact O-N 3.01Å; C450-W453 CarbonylContact O-C 3.54Å; C450-W453 PolarHBondContact O-N 2.99Å; C450-W453 VanDerWaalsContact O-N 3.11Å; C450-D454 WeakPolarHBondContact O-CB 3.43Å; C450-D454 VanDerWaalsContact O-CG 3.24Å; C450-D454 PolarHBondContact O-N 3.4Å; C450-V473 HydrophobicContact CB-CG1 4.12Å; C450-T476 WeakPolarHBondContact SG-CG2 3.34Å
451	L	96.3	Very high	93.8	Very high	88 Å²	88	66.4 Å²	66.4	46%	0.461	33%	0.333	S	S	.	.	H	α-helix	trans	-63.7	-35.2	-177.8	-67.2	171.7	0	0	0	113.5	T447 S448 H449 R455	T447-L451 HydrophobicContact CG2-CD1 4.16Å; T447-L451 WeakPolarHBondContact O-CG 3.27Å; T447-L451 PolarHBondContact O-N 3.37Å; S448-L451 PolarHBondContact O-N 3.18Å; H449-L451 VanDerWaalsContact C-N 3.34Å; H449-L451 PolarHBondContact O-N 3.33Å; L451-R455 VanDerWaalsContact O-CG 3.28Å; L451-R455 WeakPolarHBondContact O-CG 3.42Å; L451-R455 PolarHBondContact O-N 2.92Å
452	E	95	Very high	93.6	Very high	71 Å²	71	67.9 Å²	67.9	33%	0.332	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-49.1	171.3	-169.5	-153.2	155.1	0	0	110.8	S448 H449 C450 R455 K456	S448-E452 PolarHBondContact O-N 3.39Å; H449-E452 IonicContact ND1-OE2 3.16Å; H449-E452 PolarHBondContact ND1-OE2 3.31Å; H449-E452 PolarHBondContact O-N 3.19Å; C450-E452 PolarHBondContact O-N 3.01Å; E452-R455 PolarHBondContact O-N 3.35Å; E452-K456 PolarHBondContact O-N 2.91Å; E452-K456 VanDerWaalsContact OE1-CE 3.27Å; E452-K456 WeakPolarHBondContact OE1-CE 3.36Å; E452-K456 IonicContact OE1-NZ 2.7Å; E452-K456 PolarHBondContact OE1-NZ 3.36Å
453	W	94.9	Very high	93.4	Very high	0 Å²	0	72 Å²	72	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-74.4	-30.9	-176.9	-79.1	104.6	0	0	0	113.7	H449 C450 K456 L457 I469 V473 F526 L529 I530 E533 W537	H449-W453 WeakPolarHBondContact O-CB 3.28Å; H449-W453 PolarHBondContact O-N 3.27Å; C450-W453 CarbonylContact O-C 3.54Å; C450-W453 PolarHBondContact O-N 2.99Å; C450-W453 VanDerWaalsContact O-N 3.11Å; W453-K456 HydrophobicContact CD2-CD 4.23Å; W453-K456 HydrophobicContact CE3-CB 4.21Å; W453-K456 HydrophobicContact CE3-CD 3.71Å; W453-K456 HydrophobicContact CH2-CD 3.97Å; W453-K456 HydrophobicContact CZ2-CD 4.46Å; W453-K456 HydrophobicContact CZ3-CB 4.46Å; W453-K456 HydrophobicContact CZ3-CD 3.57Å; W453-K456 PolarHBondContact O-N 2.68Å; W453-L457 PolarHBondContact O-N 3.13Å; W453-I469 HydrophobicContact CB-CG2 3.97Å; W453-I469 HydrophobicContact CE3-CB 4.49Å; W453-I469 HydrophobicContact CE3-CD1 3.83Å; W453-I469 HydrophobicContact CE3-CG1 3.7Å; W453-I469 HydrophobicContact CE3-CG2 3.98Å; W453-I469 HydrophobicContact CZ3-CD1 3.83Å; W453-I469 HydrophobicContact CZ3-CG1 3.92Å; W453-V473 HydrophobicContact CB-CG2 3.67Å; W453-F526 HydrophobicContact CB-CE1 4.11Å; W453-F526 AromaticContact CD1-CD1 3.22Å; W453-F526 AromaticContact CD1-CE1 3.41Å; W453-F526 VanDerWaalsContact CD1-CE1 3.41Å; W453-F526 HydrophobicContact CD2-CD1 4.28Å; W453-F526 AromaticContact CG-CD1 3.79Å; W453-F526 HydrophobicContact CG-CD1 3.79Å; W453-F526 AromaticContact CG-CE1 3.75Å; W453-F526 HydrophobicContact CG-CE1 3.75Å; W453-F526 AromaticContact NE1-CD1 3.44Å; W453-L529 HydrophobicContact CD2-CD1 4.44Å; W453-L529 HydrophobicContact CE3-CB 4.48Å; W453-L529 HydrophobicContact CE3-CD1 4.43Å; W453-L529 HydrophobicContact CH2-CB 3.55Å; W453-L529 HydrophobicContact CZ2-CB 3.72Å; W453-L529 HydrophobicContact CZ3-CB 3.96Å; W453-I530 HydrophobicContact CZ2-CG1 3.81Å; W453-E533 WeakPolarHBondContact CH2-OE2 3.32Å; W453-W537 HydrophobicContact CH2-CH2 4.4Å; W453-W537 HydrophobicContact CZ3-CH2 4.02Å
454	D	95.1	Very high	93.1	Very high	36 Å²	36	75.5 Å²	75.5	19%	0.193	38%	0.382	C	S	.	.	H	α-helix	trans	-61.6	-46.2	169.3	-73.7	-65.9	0	0	0	110.8	C450 K456 L457 R477	C450-D454 WeakPolarHBondContact O-CB 3.43Å; C450-D454 VanDerWaalsContact O-CG 3.24Å; C450-D454 PolarHBondContact O-N 3.4Å; D454-K456 VanDerWaalsContact C-N 3.28Å; D454-K456 PolarHBondContact O-N 2.7Å; D454-L457 WeakPolarHBondContact O-CB 3.39Å; D454-L457 PolarHBondContact O-N 2.59Å; D454-R477 IonicContact OD1-CZ 2.68Å; D454-R477 IonicContact OD1-NH1 4Å; D454-R477 IonicContact OD1-NH2 3.72Å; D454-R477 PolarHBondContact OD1-NH2 3.24Å; D454-R477 IonicContact OD2-CZ 3.14Å; D454-R477 IonicContact OD2-NH2 2.75Å; D454-R477 PolarHBondContact OD2-NH2 3.34Å
455	R	93.8	Very high	92.8	Very high	175 Å²	175	70.6 Å²	70.6	66%	0.66	36%	0.36	S	S	*	.	H	α-helix	trans	-61.4	-36.8	175.4	-70.7	168.3	-175.5	176.8	3	112	L451 E452 L457 E458	L451-R455 VanDerWaalsContact O-CG 3.28Å; L451-R455 WeakPolarHBondContact O-CG 3.42Å; L451-R455 PolarHBondContact O-N 2.92Å; E452-R455 PolarHBondContact O-N 3.35Å; R455-L457 VanDerWaalsContact C-N 3.28Å; R455-L457 PolarHBondContact O-N 3.18Å; R455-E458 WeakPolarHBondContact O-CB 3.48Å; R455-E458 PolarHBondContact O-N 3.11Å
456	K	90.1	Very high	92.7	Very high	30 Å²	30	67 Å²	67	13%	0.13	34%	0.344	C	S	.	.	H	α-helix	trans	-65.5	-28.5	175.2	-69.4	178.3	-174	179.9	0	112.5	E452 W453 D454 E458 L459 I461 E533	E452-K456 PolarHBondContact O-N 2.91Å; E452-K456 VanDerWaalsContact OE1-CE 3.27Å; E452-K456 WeakPolarHBondContact OE1-CE 3.36Å; E452-K456 IonicContact OE1-NZ 2.7Å; E452-K456 PolarHBondContact OE1-NZ 3.36Å; W453-K456 HydrophobicContact CD2-CD 4.23Å; W453-K456 HydrophobicContact CE3-CB 4.21Å; W453-K456 HydrophobicContact CE3-CD 3.71Å; W453-K456 HydrophobicContact CH2-CD 3.97Å; W453-K456 HydrophobicContact CZ2-CD 4.46Å; W453-K456 HydrophobicContact CZ3-CB 4.46Å; W453-K456 HydrophobicContact CZ3-CD 3.57Å; W453-K456 PolarHBondContact O-N 2.68Å; D454-K456 VanDerWaalsContact C-N 3.28Å; D454-K456 PolarHBondContact O-N 2.7Å; K456-E458 PolarHBondContact O-N 3.08Å; K456-L459 WeakPolarHBondContact O-CB 3.45Å; K456-L459 PolarHBondContact O-N 3.47Å; K456-L459 VanDerWaalsContact O-N 3.11Å; K456-I461 HydrophobicContact CB-CD1 4.17Å; K456-I461 WeakPolarHBondContact O-CD1 3.46Å; K456-E533 WeakPolarHBondContact CD-OE1 3.45Å; K456-E533 VanDerWaalsContact CE-OE1 3.23Å; K456-E533 WeakPolarHBondContact CE-OE1 3.43Å; K456-E533 VanDerWaalsContact NZ-CD 3.32Å; K456-E533 IonicContact NZ-OE1 3.89Å; K456-E533 PolarHBondContact NZ-OE1 3.39Å; K456-E533 VanDerWaalsContact NZ-OE1 3.13Å; K456-E533 IonicContact NZ-OE2 2.74Å; K456-E533 PolarHBondContact NZ-OE2 3.23Å
457	L	89.4	Confident	92.6	Very high	38 Å²	38	71.2 Å²	71.2	20%	0.199	37%	0.366	C	S	.	.	H	α-helix	trans	-64.2	-21.3	174.6	-70.9	174.2	0	0	0	114.1	W453 D454 R455 L459 K466 I469 R470	W453-L457 PolarHBondContact O-N 3.13Å; D454-L457 WeakPolarHBondContact O-CB 3.39Å; D454-L457 PolarHBondContact O-N 2.59Å; R455-L457 VanDerWaalsContact C-N 3.28Å; R455-L457 PolarHBondContact O-N 3.18Å; L457-L459 VanDerWaalsContact C-N 3.28Å; L457-K466 HydrophobicContact CD2-CB 3.9Å; L457-K466 HydrophobicContact CD2-CG 4.02Å; L457-K466 WeakPolarHBondContact CD2-O 3.37Å; L457-I469 HydrophobicContact CD1-CG2 4.12Å; L457-I469 HydrophobicContact CD2-CB 3.77Å; L457-I469 HydrophobicContact CD2-CD1 4.23Å; L457-I469 HydrophobicContact CD2-CG2 3.69Å; L457-I469 HydrophobicContact CG-CB 4.37Å; L457-I469 HydrophobicContact CG-CG2 3.71Å; L457-R470 HydrophobicContact CD1-CG 3.92Å; L457-R470 HydrophobicContact CD2-CG 4.18Å
458	E	87.4	Confident	92.4	Very high	172 Å²	172	72.9 Å²	72.9	80%	0.804	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-15.3	176.3	-56	-176.2	159.6	0	0	112.5	R455 K456	R455-E458 WeakPolarHBondContact O-CB 3.48Å; R455-E458 PolarHBondContact O-N 3.11Å; K456-E458 PolarHBondContact O-N 3.08Å
459	L	86.7	Confident	92.4	Very high	104 Å²	104	69.3 Å²	69.3	55%	0.545	35%	0.348	S	S	.	.	S	Bend	trans	-81.1	160.8	176.4	-55.9	176.8	0	0	0	111.8	K456 L457 I461 K466	K456-L459 WeakPolarHBondContact O-CB 3.45Å; K456-L459 PolarHBondContact O-N 3.47Å; K456-L459 VanDerWaalsContact O-N 3.11Å; L457-L459 VanDerWaalsContact C-N 3.28Å; L459-I461 HydrophobicContact CB-CD1 4.36Å; L459-I461 HydrophobicContact CB-CG1 4.14Å; L459-I461 PolarHBondContact O-N 3.15Å; L459-K466 VanDerWaalsContact O-CE 3.23Å; L459-K466 WeakPolarHBondContact O-CE 3.15Å; L459-K466 PolarHBondContact O-NZ 2.99Å
460	D	86.4	Confident	92.5	Very high	163 Å²	163	72.1 Å²	72.1	87%	0.872	36%	0.356	S	S	*	.			trans	-78.8	65.9	179.4	-161.5	23.7	0	0	0	112.9	K466	D460-K466 IonicContact OD1-NZ 3.22Å
461	I	90.4	Very high	92.5	Very high	8 Å²	8	75.5 Å²	75.5	4%	0.041	38%	0.376	C	S	.	.			trans	-88.2	146.7	176.7	-63.3	177.4	0	0	0	109.8	K456 L459 A465 K466 I469 W537	K456-I461 HydrophobicContact CB-CD1 4.17Å; K456-I461 WeakPolarHBondContact O-CD1 3.46Å; L459-I461 HydrophobicContact CB-CD1 4.36Å; L459-I461 HydrophobicContact CB-CG1 4.14Å; L459-I461 PolarHBondContact O-N 3.15Å; I461-A465 HydrophobicContact CG2-CB 3.53Å; I461-K466 HydrophobicContact CB-CG 4.02Å; I461-K466 HydrophobicContact CG2-CG 4.11Å; I461-K466 VanDerWaalsContact O-CD 3.27Å; I461-K466 WeakPolarHBondContact O-CD 3.49Å; I461-K466 WeakPolarHBondContact O-CE 3.37Å; I461-K466 PolarHBondContact O-NZ 3.23Å; I461-I469 HydrophobicContact CD1-CD1 4.11Å; I461-W537 HydrophobicContact CD1-CH2 4.13Å; I461-W537 HydrophobicContact CD1-CZ2 3.55Å; I461-W537 HydrophobicContact CG1-CZ2 3.98Å; I461-W537 HydrophobicContact CG2-CD2 3.87Å; I461-W537 HydrophobicContact CG2-CE3 4.18Å; I461-W537 HydrophobicContact CG2-CG 4.36Å; I461-W537 HydrophobicContact CG2-CH2 4.38Å; I461-W537 HydrophobicContact CG2-CZ2 4.08Å; I461-W537 HydrophobicContact CG2-CZ3 4.41Å
462	P	91.4	Very high	92.5	Very high	66 Å²	66	71.5 Å²	71.5	43%	0.429	36%	0.356	S	S	.	.			trans	-56.6	144.9	173.1	-26.7	36.2	0	0	0	113.6	D464 A465 K466 W537	P462-D464 VanDerWaalsContact C-N 3.33Å; P462-D464 PolarHBondContact O-N 3.02Å; P462-A465 WeakPolarHBondContact O-CA 3.5Å; P462-A465 WeakPolarHBondContact O-CB 3.37Å; P462-A465 PolarHBondContact O-N 3.17Å; P462-K466 PolarHBondContact O-N 3.01Å; P462-W537 HydrophobicContact CG-CB 3.86Å; P462-W537 HydrophobicContact CG-CG 4.35Å
463	D	91.5	Very high	92.6	Very high	112 Å²	112	68.2 Å²	68.2	60%	0.599	34%	0.341	S	S	*	.	H	α-helix	trans	-59.7	-38.5	-174.9	-70.9	-41	0	0	0	113.6	A465 K466 D467	D463-A465 PolarHBondContact O-N 3.35Å; D463-K466 PolarHBondContact O-N 3.46Å; D463-K466 VanDerWaalsContact O-N 3.15Å; D463-D467 PolarHBondContact O-N 3.25Å
464	D	90.6	Very high	92.8	Very high	120 Å²	120	70.1 Å²	70.1	64%	0.642	36%	0.36	S	S	*	.	H	α-helix	trans	-53.2	-40	173	-73.9	-11.4	0	0	0	112.1	P462 L468	P462-D464 VanDerWaalsContact C-N 3.33Å; P462-D464 PolarHBondContact O-N 3.02Å; D464-L468 WeakPolarHBondContact O-CG 3.16Å; D464-L468 PolarHBondContact O-N 3.06Å
465	A	92.3	Very high	92.8	Very high	4 Å²	4	72 Å²	72	3%	0.033	37%	0.368	C	S	.	.	H	α-helix	trans	-79.9	-38.3	178.9	0	0	0	0	0	111.8	I461 P462 D463 D467 L468 I469 L532 W537	I461-A465 HydrophobicContact CG2-CB 3.53Å; P462-A465 WeakPolarHBondContact O-CA 3.5Å; P462-A465 WeakPolarHBondContact O-CB 3.37Å; P462-A465 PolarHBondContact O-N 3.17Å; D463-A465 PolarHBondContact O-N 3.35Å; A465-D467 VanDerWaalsContact C-N 3.26Å; A465-D467 PolarHBondContact O-N 3.39Å; A465-L468 PolarHBondContact O-N 2.91Å; A465-I469 VanDerWaalsContact O-CG1 3.24Å; A465-I469 WeakPolarHBondContact O-CG1 3.49Å; A465-I469 PolarHBondContact O-N 2.91Å; A465-L532 HydrophobicContact CB-CD2 4.43Å; A465-W537 HydrophobicContact CB-CD2 4.1Å; A465-W537 HydrophobicContact CB-CE3 3.38Å; A465-W537 HydrophobicContact CB-CZ3 3.79Å
466	K	93.4	Very high	93	Very high	26 Å²	26	63.7 Å²	63.7	11%	0.113	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-39.5	170.9	-72.9	169.8	167.2	146.2	0	111.4	L457 L459 D460 I461 P462 D463 I469 R470	L457-K466 HydrophobicContact CD2-CB 3.9Å; L457-K466 HydrophobicContact CD2-CG 4.02Å; L457-K466 WeakPolarHBondContact CD2-O 3.37Å; L459-K466 VanDerWaalsContact O-CE 3.23Å; L459-K466 WeakPolarHBondContact O-CE 3.15Å; L459-K466 PolarHBondContact O-NZ 2.99Å; D460-K466 IonicContact OD1-NZ 3.22Å; I461-K466 HydrophobicContact CB-CG 4.02Å; I461-K466 HydrophobicContact CG2-CG 4.11Å; I461-K466 VanDerWaalsContact O-CD 3.27Å; I461-K466 WeakPolarHBondContact O-CD 3.49Å; I461-K466 WeakPolarHBondContact O-CE 3.37Å; I461-K466 PolarHBondContact O-NZ 3.23Å; P462-K466 PolarHBondContact O-N 3.01Å; D463-K466 PolarHBondContact O-N 3.46Å; D463-K466 VanDerWaalsContact O-N 3.15Å; K466-I469 PolarHBondContact O-N 3.15Å; K466-R470 WeakPolarHBondContact O-CB 3.43Å; K466-R470 WeakPolarHBondContact O-CD 3.36Å; K466-R470 WeakPolarHBondContact O-CG 3.43Å; K466-R470 PolarHBondContact O-N 3.18Å
467	D	94.1	Very high	93.4	Very high	88 Å²	88	68 Å²	68	47%	0.471	35%	0.352	S	S	.	.	H	α-helix	trans	-72.8	-34.7	176.8	-81.9	-5.2	0	0	0	113.6	D463 A465 R470 T471	D463-D467 PolarHBondContact O-N 3.25Å; A465-D467 VanDerWaalsContact C-N 3.26Å; A465-D467 PolarHBondContact O-N 3.39Å; D467-R470 WeakPolarHBondContact OD1-CD 3.43Å; D467-R470 IonicContact OD1-CZ 2.73Å; D467-R470 IonicContact OD1-NE 3.4Å; D467-R470 IonicContact OD1-NH1 2.9Å; D467-R470 PolarHBondContact OD1-NH1 3.14Å; D467-T471 VanDerWaalsContact O-CB 3.3Å; D467-T471 WeakPolarHBondContact O-CB 3.33Å; D467-T471 PolarHBondContact O-N 3.18Å; D467-T471 PolarHBondContact O-OG1 3.25Å
468	L	94.4	Very high	93.8	Very high	90 Å²	90	70.4 Å²	70.4	47%	0.471	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-42.5	169.9	-71.5	169.4	0	0	0	111.6	D464 A465 T471 A472 L529 L532	D464-L468 WeakPolarHBondContact O-CG 3.16Å; D464-L468 PolarHBondContact O-N 3.06Å; A465-L468 PolarHBondContact O-N 2.91Å; L468-T471 PolarHBondContact O-N 3.37Å; L468-A472 PolarHBondContact O-N 3.06Å; L468-L529 HydrophobicContact CB-CD2 3.78Å; L468-L532 HydrophobicContact CD1-CD2 3.98Å
469	I	95.9	Very high	94.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-51.1	176	-64.6	163.4	0	0	0	110.6	W453 L457 I461 A465 K466 T471 A472 V473 L529 W537	W453-I469 HydrophobicContact CB-CG2 3.97Å; W453-I469 HydrophobicContact CE3-CB 4.49Å; W453-I469 HydrophobicContact CE3-CD1 3.83Å; W453-I469 HydrophobicContact CE3-CG1 3.7Å; W453-I469 HydrophobicContact CE3-CG2 3.98Å; W453-I469 HydrophobicContact CZ3-CD1 3.83Å; W453-I469 HydrophobicContact CZ3-CG1 3.92Å; L457-I469 HydrophobicContact CD1-CG2 4.12Å; L457-I469 HydrophobicContact CD2-CB 3.77Å; L457-I469 HydrophobicContact CD2-CD1 4.23Å; L457-I469 HydrophobicContact CD2-CG2 3.69Å; L457-I469 HydrophobicContact CG-CB 4.37Å; L457-I469 HydrophobicContact CG-CG2 3.71Å; I461-I469 HydrophobicContact CD1-CD1 4.11Å; A465-I469 VanDerWaalsContact O-CG1 3.24Å; A465-I469 WeakPolarHBondContact O-CG1 3.49Å; A465-I469 PolarHBondContact O-N 2.91Å; K466-I469 PolarHBondContact O-N 3.15Å; I469-T471 PolarHBondContact O-N 2.97Å; I469-A472 PolarHBondContact O-N 2.95Å; I469-A472 VanDerWaalsContact O-N 3.14Å; I469-V473 HydrophobicContact CG2-CG2 4.17Å; I469-V473 WeakPolarHBondContact O-CB 3.33Å; I469-V473 WeakPolarHBondContact O-CG2 3.41Å; I469-V473 PolarHBondContact O-N 3.24Å; I469-L529 HydrophobicContact CB-CD1 4.44Å; I469-L529 HydrophobicContact CG1-CD1 3.99Å; I469-L529 HydrophobicContact CG1-CD2 3.75Å; I469-L529 HydrophobicContact CG1-CG 4.43Å; I469-W537 HydrophobicContact CD1-CH2 4.16Å; I469-W537 HydrophobicContact CD1-CZ3 4.49Å
470	R	96.4	Very high	94.7	Very high	120 Å²	120	59.1 Å²	59.1	45%	0.453	31%	0.309	S	S	.	.	H	α-helix	trans	-54.2	-38.9	174.8	-72.4	162.3	-173	147.2	3.2	111.9	L457 K466 D467 G474	L457-R470 HydrophobicContact CD1-CG 3.92Å; L457-R470 HydrophobicContact CD2-CG 4.18Å; K466-R470 WeakPolarHBondContact O-CB 3.43Å; K466-R470 WeakPolarHBondContact O-CD 3.36Å; K466-R470 WeakPolarHBondContact O-CG 3.43Å; K466-R470 PolarHBondContact O-N 3.18Å; D467-R470 WeakPolarHBondContact OD1-CD 3.43Å; D467-R470 IonicContact OD1-CZ 2.73Å; D467-R470 IonicContact OD1-NE 3.4Å; D467-R470 IonicContact OD1-NH1 2.9Å; D467-R470 PolarHBondContact OD1-NH1 3.14Å; R470-G474 WeakPolarHBondContact O-CA 3.34Å; R470-G474 PolarHBondContact O-N 2.85Å
471	T	96.6	Very high	95.2	Very high	74 Å²	74	58.6 Å²	58.6	45%	0.454	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-45.9	177.9	-60	0	0	0	0	111.9	D467 L468 I469 Q475	D467-T471 VanDerWaalsContact O-CB 3.3Å; D467-T471 WeakPolarHBondContact O-CB 3.33Å; D467-T471 PolarHBondContact O-N 3.18Å; D467-T471 PolarHBondContact O-OG1 3.25Å; L468-T471 PolarHBondContact O-N 3.37Å; I469-T471 PolarHBondContact O-N 2.97Å; T471-Q475 WeakPolarHBondContact O-CB 3.3Å; T471-Q475 VanDerWaalsContact O-CG 3.27Å; T471-Q475 WeakPolarHBondContact O-CG 3.39Å; T471-Q475 PolarHBondContact O-N 3.12Å
472	A	96.9	Very high	95.5	Very high	4 Å²	4	63 Å²	63	3%	0.033	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-51.1	178.1	0	0	0	0	0	111.8	L468 I469 G474 Q475 T476 K525 F526 L529	L468-A472 PolarHBondContact O-N 3.06Å; I469-A472 PolarHBondContact O-N 2.95Å; I469-A472 VanDerWaalsContact O-N 3.14Å; A472-G474 VanDerWaalsContact C-N 3.32Å; A472-G474 PolarHBondContact O-N 3.43Å; A472-Q475 PolarHBondContact O-N 2.83Å; A472-T476 WeakPolarHBondContact O-CB 3.35Å; A472-T476 PolarHBondContact O-N 3.43Å; A472-T476 PolarHBondContact O-OG1 2.84Å; A472-K525 HydrophobicContact CB-CB 4.25Å; A472-F526 HydrophobicContact CB-CD1 4.22Å; A472-F526 HydrophobicContact CB-CE1 3.95Å; A472-F526 HydrophobicContact CB-CZ 4.41Å; A472-L529 HydrophobicContact CB-CD1 3.71Å
473	V	97.7	Very high	95.7	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-41.5	177.1	175.1	0	0	0	0	111	C450 W453 I469 T476 R477 F526	C450-V473 HydrophobicContact CB-CG1 4.12Å; W453-V473 HydrophobicContact CB-CG2 3.67Å; I469-V473 HydrophobicContact CG2-CG2 4.17Å; I469-V473 WeakPolarHBondContact O-CB 3.33Å; I469-V473 WeakPolarHBondContact O-CG2 3.41Å; I469-V473 PolarHBondContact O-N 3.24Å; V473-T476 PolarHBondContact O-N 3.45Å; V473-R477 HydrophobicContact CG1-CG 4.37Å; V473-R477 WeakPolarHBondContact O-CB 3.49Å; V473-R477 WeakPolarHBondContact O-CG 3.41Å; V473-R477 PolarHBondContact O-N 3.2Å; V473-F526 HydrophobicContact CG2-CE1 3.98Å; V473-F526 HydrophobicContact CG2-CZ 4.28Å
474	G	97.3	Very high	95.9	Very high	39 Å²	39	58.2 Å²	58.2	40%	0.402	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-45.3	175.8	0	0	0	0	0	113.3	R470 A472 L478	R470-G474 WeakPolarHBondContact O-CA 3.34Å; R470-G474 PolarHBondContact O-N 2.85Å; A472-G474 VanDerWaalsContact C-N 3.32Å; A472-G474 PolarHBondContact O-N 3.43Å; G474-L478 WeakPolarHBondContact O-CB 3.31Å; G474-L478 PolarHBondContact O-N 3.45Å
475	Q	96.7	Very high	96.1	Very high	76 Å²	76	58.4 Å²	58.4	36%	0.355	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-39.3	175.9	-73.2	172.9	11.7	0	0	112	T471 A472 L478 L479	T471-Q475 WeakPolarHBondContact O-CB 3.3Å; T471-Q475 VanDerWaalsContact O-CG 3.27Å; T471-Q475 WeakPolarHBondContact O-CG 3.39Å; T471-Q475 PolarHBondContact O-N 3.12Å; A472-Q475 PolarHBondContact O-N 2.83Å; Q475-L478 PolarHBondContact O-N 2.85Å; Q475-L479 WeakPolarHBondContact O-CB 3.4Å; Q475-L479 PolarHBondContact O-N 3.43Å
476	T	97.8	Very high	96.3	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-50.3	176.9	-50.4	0	0	0	0	111.6	L446 C450 A472 V473 L478 L479 M480 V522 F526	L446-T476 HydrophobicContact CB-CG2 3.73Å; L446-T476 HydrophobicContact CD1-CG2 4.23Å; L446-T476 HydrophobicContact CD2-CG2 4.02Å; L446-T476 HydrophobicContact CG-CG2 4.22Å; C450-T476 WeakPolarHBondContact SG-CG2 3.34Å; A472-T476 WeakPolarHBondContact O-CB 3.35Å; A472-T476 PolarHBondContact O-N 3.43Å; A472-T476 PolarHBondContact O-OG1 2.84Å; V473-T476 PolarHBondContact O-N 3.45Å; T476-L478 VanDerWaalsContact C-N 3.27Å; T476-L478 PolarHBondContact O-N 3.33Å; T476-L479 WeakPolarHBondContact O-CB 3.4Å; T476-L479 PolarHBondContact O-N 3.3Å; T476-M480 HydrophobicContact CG2-CE 4.18Å; T476-M480 WeakPolarHBondContact O-CG 3.44Å; T476-M480 PolarHBondContact O-N 3.04Å; T476-V522 HydrophobicContact CG2-CG1 3.88Å; T476-V522 WeakPolarHBondContact OG1-CG1 3.5Å; T476-F526 HydrophobicContact CG2-CE2 4.06Å; T476-F526 HydrophobicContact CG2-CZ 4.36Å; T476-F526 WeakPolarHBondContact OG1-CE2 3.42Å; T476-F526 WeakPolarHBondContact OG1-CZ 3.44Å
477	R	97.6	Very high	96.4	Very high	121 Å²	121	61.8 Å²	61.8	46%	0.457	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-33.5	176.5	-71	172.6	174	174.6	-1.8	112.1	D454 V473 M480 K481	D454-R477 IonicContact OD1-CZ 2.68Å; D454-R477 IonicContact OD1-NH1 4Å; D454-R477 IonicContact OD1-NH2 3.72Å; D454-R477 PolarHBondContact OD1-NH2 3.24Å; D454-R477 IonicContact OD2-CZ 3.14Å; D454-R477 IonicContact OD2-NH2 2.75Å; D454-R477 PolarHBondContact OD2-NH2 3.34Å; V473-R477 HydrophobicContact CG1-CG 4.37Å; V473-R477 WeakPolarHBondContact O-CB 3.49Å; V473-R477 WeakPolarHBondContact O-CG 3.41Å; V473-R477 PolarHBondContact O-N 3.2Å; R477-M480 HydrophobicContact CG-CE 4.47Å; R477-K481 WeakPolarHBondContact O-CB 3.43Å; R477-K481 PolarHBondContact O-N 2.82Å
478	L	97.5	Very high	96.4	Very high	88 Å²	88	62.2 Å²	62.2	46%	0.461	30%	0.295	S	S	.	.	H	α-helix	trans	-69.4	-44.1	174.9	-168.9	67.4	0	0	0	111.7	G474 Q475 T476 M480 K481 E482	G474-L478 WeakPolarHBondContact O-CB 3.31Å; G474-L478 PolarHBondContact O-N 3.45Å; Q475-L478 PolarHBondContact O-N 2.85Å; T476-L478 VanDerWaalsContact C-N 3.27Å; T476-L478 PolarHBondContact O-N 3.33Å; L478-M480 PolarHBondContact O-N 2.87Å; L478-K481 PolarHBondContact O-N 3.17Å; L478-K481 VanDerWaalsContact O-N 3.16Å; L478-E482 HydrophobicContact CD1-CG 3.99Å; L478-E482 WeakPolarHBondContact CD1-OE1 3.46Å; L478-E482 HydrophobicContact CG-CG 4.41Å; L478-E482 WeakPolarHBondContact O-CB 3.41Å; L478-E482 PolarHBondContact O-N 2.82Å
479	L	97	Very high	96.3	Very high	12 Å²	12	59.6 Å²	59.6	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-56.2	-48.5	175.4	-178.6	65.6	0	0	0	111.4	L446 Q475 T476 R483 F484 Q518 I519 V522	L446-L479 HydrophobicContact CD1-CD2 4.3Å; Q475-L479 WeakPolarHBondContact O-CB 3.4Å; Q475-L479 PolarHBondContact O-N 3.43Å; T476-L479 WeakPolarHBondContact O-CB 3.4Å; T476-L479 PolarHBondContact O-N 3.3Å; L479-R483 HydrophobicContact CD1-CB 3.88Å; L479-R483 HydrophobicContact CD1-CG 3.79Å; L479-R483 PolarHBondContact O-N 2.83Å; L479-F484 HydrophobicContact CD2-CE1 4.18Å; L479-F484 HydrophobicContact CG-CD1 4.29Å; L479-F484 HydrophobicContact CG-CE1 3.91Å; L479-F484 PolarHBondContact O-N 3.39Å; L479-Q518 HydrophobicContact CD1-CB 3.68Å; L479-Q518 VanDerWaalsContact CD1-OE1 3.32Å; L479-Q518 HydrophobicContact CD2-CB 4.19Å; L479-I519 HydrophobicContact CD2-CG1 3.98Å; L479-V522 HydrophobicContact CD2-CG2 4.22Å
480	M	97.3	Very high	96.2	Very high	27 Å²	27	62 Å²	62	13%	0.133	30%	0.302	C	S	.	.	H	α-helix	trans	-68.2	-32.7	176.6	-63.4	-172.7	-60.9	0	0	113.2	T443 L446 T447 T476 R477 L478 F484	T443-M480 HydrophobicContact CG2-SD 4.21Å; L446-M480 HydrophobicContact CB-CE 4.46Å; L446-M480 HydrophobicContact CB-CG 4.43Å; L446-M480 HydrophobicContact CB-SD 3.6Å; L446-M480 VanDerWaalsContact CB-SD 3.6Å; L446-M480 HydrophobicContact CD1-CG 4.32Å; T447-M480 PolarHBondContact OG1-SD 3.07Å; T476-M480 HydrophobicContact CG2-CE 4.18Å; T476-M480 WeakPolarHBondContact O-CG 3.44Å; T476-M480 PolarHBondContact O-N 3.04Å; R477-M480 HydrophobicContact CG-CE 4.47Å; L478-M480 PolarHBondContact O-N 2.87Å; M480-F484 HydrophobicContact CB-CD2 4.2Å; M480-F484 HydrophobicContact CG-CD2 3.86Å; M480-F484 HydrophobicContact CG-CE2 3.82Å; M480-F484 HydrophobicContact CG-CG 4.46Å; M480-F484 HydrophobicContact CG-CZ 4.35Å; M480-F484 WeakPolarHBondContact O-CB 3.44Å
481	K	96.3	Very high	96.1	Very high	153 Å²	153	56.2 Å²	56.2	67%	0.665	28%	0.281	S	S	*	.	H	α-helix	trans	-78.8	-30.7	179.8	-173.2	174.7	178.7	-177.2	0	113.3	R477 L478 K485	R477-K481 WeakPolarHBondContact O-CB 3.43Å; R477-K481 PolarHBondContact O-N 2.82Å; L478-K481 PolarHBondContact O-N 3.17Å; L478-K481 VanDerWaalsContact O-N 3.16Å; K481-K485 WeakPolarHBondContact O-CD 3.28Å; K481-K485 WeakPolarHBondContact O-CG 3.38Å
482	E	96.1	Very high	95.8	Very high	101 Å²	101	53.2 Å²	53.2	47%	0.472	26%	0.264	S	S	.	.	H	α-helix	trans	-104.6	-63.2	-176	-63.3	-172.3	163.6	0	0	112.4	L478 Q486	L478-E482 HydrophobicContact CD1-CG 3.99Å; L478-E482 WeakPolarHBondContact CD1-OE1 3.46Å; L478-E482 HydrophobicContact CG-CG 4.41Å; L478-E482 WeakPolarHBondContact O-CB 3.41Å; L478-E482 PolarHBondContact O-N 2.82Å; E482-Q486 VanDerWaalsContact O-CG 3.26Å; E482-Q486 WeakPolarHBondContact O-CG 3.46Å; E482-Q486 PolarHBondContact O-N 3.19Å
483	R	96	Very high	95.5	Very high	70 Å²	70	55.7 Å²	55.7	26%	0.264	28%	0.277	S	S	.	.	H	α-helix	trans	-75	-41.9	-170.1	-59.4	-55.7	-162.4	83.1	-1.5	112.6	L479 K485 Q486 F487 I515	L479-R483 HydrophobicContact CD1-CB 3.88Å; L479-R483 HydrophobicContact CD1-CG 3.79Å; L479-R483 PolarHBondContact O-N 2.83Å; R483-K485 VanDerWaalsContact C-N 3.3Å; R483-K485 PolarHBondContact O-N 2.81Å; R483-Q486 VanDerWaalsContact CD-OE1 3.28Å; R483-Q486 WeakPolarHBondContact O-CB 3.26Å; R483-Q486 PolarHBondContact O-N 3.4Å; R483-F487 PolarHBondContact O-N 3.21Å; R483-I515 HydrophobicContact CB-CD1 4.01Å; R483-I515 HydrophobicContact CB-CG1 4.05Å
484	F	96.6	Very high	95.2	Very high	6 Å²	6	56.5 Å²	56.5	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-37.4	177.8	-75.7	26	0	0	0	110.9	L439 E442 T443 L446 L479 M480 F487 E488 I515 I519	L439-F484 HydrophobicContact CD1-CB 3.73Å; L439-F484 HydrophobicContact CD1-CD1 4.25Å; L439-F484 HydrophobicContact CD1-CD2 3.62Å; L439-F484 HydrophobicContact CD1-CE2 4.25Å; L439-F484 HydrophobicContact CD1-CG 3.6Å; E442-F484 HydrophobicContact CB-CE2 4.29Å; E442-F484 HydrophobicContact CB-CZ 4.23Å; T443-F484 VanDerWaalsContact OG1-CD2 3.24Å; T443-F484 WeakPolarHBondContact OG1-CD2 3.32Å; T443-F484 WeakPolarHBondContact OG1-CE2 3.16Å; L446-F484 HydrophobicContact CD1-CE2 4.23Å; L446-F484 HydrophobicContact CD1-CZ 3.71Å; L479-F484 HydrophobicContact CD2-CE1 4.18Å; L479-F484 HydrophobicContact CG-CD1 4.29Å; L479-F484 HydrophobicContact CG-CE1 3.91Å; L479-F484 PolarHBondContact O-N 3.39Å; M480-F484 HydrophobicContact CB-CD2 4.2Å; M480-F484 HydrophobicContact CG-CD2 3.86Å; M480-F484 HydrophobicContact CG-CE2 3.82Å; M480-F484 HydrophobicContact CG-CG 4.46Å; M480-F484 HydrophobicContact CG-CZ 4.35Å; M480-F484 WeakPolarHBondContact O-CB 3.44Å; F484-F487 PolarHBondContact O-N 2.89Å; F484-E488 WeakPolarHBondContact O-CB 3.5Å; F484-E488 PolarHBondContact O-N 2.86Å; F484-I515 HydrophobicContact CD1-CD1 4.47Å; F484-I515 HydrophobicContact CD1-CG2 4.05Å; F484-I515 HydrophobicContact CE1-CG2 3.62Å; F484-I519 HydrophobicContact CE1-CD1 3.83Å; F484-I519 HydrophobicContact CE1-CG1 3.88Å; F484-I519 HydrophobicContact CZ-CD1 3.63Å; F484-I519 HydrophobicContact CZ-CG1 3.84Å
485	K	95	Very high	94.8	Very high	125 Å²	125	58.5 Å²	58.5	54%	0.543	28%	0.282	S	S	.	.	H	α-helix	trans	-68.8	-35.1	173.2	-69.3	-163.9	175.9	-74.2	0	113.6	K481 R483 F487 G489	K481-K485 WeakPolarHBondContact O-CD 3.28Å; K481-K485 WeakPolarHBondContact O-CG 3.38Å; R483-K485 VanDerWaalsContact C-N 3.3Å; R483-K485 PolarHBondContact O-N 2.81Å; K485-F487 VanDerWaalsContact C-N 3.33Å; K485-G489 PolarHBondContact O-N 2.61Å; K485-G489 VanDerWaalsContact O-N 3.13Å
486	Q	95.1	Very high	94.4	Very high	100 Å²	100	61.1 Å²	61.1	47%	0.467	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-42.5	170.5	-74.8	165.8	-5.1	0	0	110.7	E482 R483 G489 L490 F511	E482-Q486 VanDerWaalsContact O-CG 3.26Å; E482-Q486 WeakPolarHBondContact O-CG 3.46Å; E482-Q486 PolarHBondContact O-N 3.19Å; R483-Q486 VanDerWaalsContact CD-OE1 3.28Å; R483-Q486 WeakPolarHBondContact O-CB 3.26Å; R483-Q486 PolarHBondContact O-N 3.4Å; Q486-G489 PolarHBondContact O-N 3.09Å; Q486-L490 WeakPolarHBondContact O-CG 3.47Å; Q486-L490 PolarHBondContact O-N 2.95Å; Q486-F511 HydrophobicContact CB-CE1 4.19Å; Q486-F511 HydrophobicContact CB-CZ 3.93Å
487	F	95.7	Very high	93.6	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.7	-43.9	177.4	-168.4	-124.4	0	0	0	112.8	F435 L439 R483 F484 K485 G489 L490 V491 L508 F511 W512 I515	F435-F487 HydrophobicContact CB-CE1 4Å; F435-F487 HydrophobicContact CB-CZ 3.86Å; F435-F487 HydrophobicContact CD1-CE1 4.17Å; F435-F487 AromaticContact CD1-CZ 3.54Å; F435-F487 HydrophobicContact CD1-CZ 3.54Å; F435-F487 HydrophobicContact CE1-CZ 4.21Å; F435-F487 HydrophobicContact CG-CE1 4.39Å; F435-F487 AromaticContact CG-CZ 3.81Å; F435-F487 HydrophobicContact CG-CZ 3.81Å; L439-F487 HydrophobicContact CB-CD1 4.32Å; L439-F487 HydrophobicContact CB-CE1 4.47Å; L439-F487 HydrophobicContact CD1-CD1 4.06Å; L439-F487 HydrophobicContact CD2-CD1 3.99Å; L439-F487 HydrophobicContact CG-CD1 4.34Å; R483-F487 PolarHBondContact O-N 3.21Å; F484-F487 PolarHBondContact O-N 2.89Å; K485-F487 VanDerWaalsContact C-N 3.33Å; F487-G489 PolarHBondContact O-N 3.1Å; F487-L490 PolarHBondContact O-N 3.47Å; F487-V491 HydrophobicContact CD1-CG2 4.01Å; F487-V491 HydrophobicContact CD2-CG2 4.13Å; F487-V491 HydrophobicContact CE1-CG2 3.78Å; F487-V491 HydrophobicContact CE2-CG2 3.92Å; F487-V491 HydrophobicContact CG-CG2 4.19Å; F487-V491 HydrophobicContact CZ-CG2 3.75Å; F487-V491 WeakPolarHBondContact O-CB 3.45Å; F487-V491 VanDerWaalsContact O-CG2 3.25Å; F487-V491 WeakPolarHBondContact O-CG2 3.47Å; F487-V491 PolarHBondContact O-N 3.12Å; F487-L508 HydrophobicContact CD2-CD2 4.45Å; F487-L508 HydrophobicContact CE2-CB 3.98Å; F487-L508 HydrophobicContact CE2-CD2 3.96Å; F487-L508 WeakPolarHBondContact CE2-O 3.43Å; F487-L508 HydrophobicContact CZ-CB 4.35Å; F487-F511 HydrophobicContact CB-CD1 4.03Å; F487-F511 HydrophobicContact CB-CE1 3.98Å; F487-F511 HydrophobicContact CD2-CB 4.33Å; F487-F511 AromaticContact CD2-CD1 3.56Å; F487-F511 HydrophobicContact CD2-CD1 3.56Å; F487-F511 HydrophobicContact CD2-CE1 4.34Å; F487-F511 HydrophobicContact CD2-CG 4.35Å; F487-F511 HydrophobicContact CE2-CB 4.44Å; F487-F511 HydrophobicContact CE2-CD1 4.42Å; F487-F511 HydrophobicContact CG-CD1 4.17Å; F487-W512 AromaticContact CD1-CE3 3.82Å; F487-W512 HydrophobicContact CD1-CE3 3.82Å; F487-W512 HydrophobicContact CD1-CZ3 4.15Å; F487-W512 HydrophobicContact CE1-CD2 4.24Å; F487-W512 AromaticContact CE1-CE3 3.43Å; F487-W512 HydrophobicContact CE1-CE3 3.43Å; F487-W512 VanDerWaalsContact CE1-CE3 3.43Å; F487-W512 HydrophobicContact CE1-CZ3 4.02Å; F487-W512 HydrophobicContact CE2-CB 4.25Å; F487-W512 HydrophobicContact CZ-CB 3.94Å; F487-W512 HydrophobicContact CZ-CD2 4.39Å; F487-W512 AromaticContact CZ-CE3 3.92Å; F487-W512 HydrophobicContact CZ-CE3 3.92Å; F487-W512 HydrophobicContact CZ-CG 4.42Å; F487-I515 HydrophobicContact CB-CD1 3.7Å; F487-I515 HydrophobicContact CG-CD1 4.14Å
488	E	94.7	Very high	92.5	Very high	97 Å²	97	70.9 Å²	70.9	45%	0.453	33%	0.33	S	S	.	.	H	α-helix	trans	-51.9	-41.9	172.6	-175.6	-179.1	-160.5	0	0	111.7	L439 F484 G492	L439-E488 HydrophobicContact CD2-CB 4.01Å; F484-E488 WeakPolarHBondContact O-CB 3.5Å; F484-E488 PolarHBondContact O-N 2.86Å; E488-G492 PolarHBondContact O-N 3.44Å
489	G	92.9	Very high	91	Very high	36 Å²	36	67.8 Å²	67.8	37%	0.371	32%	0.32	S	S	.	.	H	α-helix	trans	-63	-52	172.1	0	0	0	0	0	113.1	K485 Q486 F487 V491 G492 D493	K485-G489 PolarHBondContact O-N 2.61Å; K485-G489 VanDerWaalsContact O-N 3.13Å; Q486-G489 PolarHBondContact O-N 3.09Å; F487-G489 PolarHBondContact O-N 3.1Å; G489-V491 VanDerWaalsContact C-N 3.34Å; G489-V491 PolarHBondContact O-N 3.1Å; G489-G492 CarbonylContact O-C 3.55Å; G489-G492 WeakPolarHBondContact O-CA 3.46Å; G489-G492 PolarHBondContact O-N 3.24Å; G489-G492 VanDerWaalsContact O-N 3.12Å; G489-D493 PolarHBondContact O-N 2.92Å
490	L	93.4	Very high	89.5	Confident	49 Å²	49	74.9 Å²	74.9	26%	0.257	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-40.5	178.8	-68.1	168.9	0	0	0	112.7	Q486 F487 G492 D493 C494 T503 L508 F511	Q486-L490 WeakPolarHBondContact O-CG 3.47Å; Q486-L490 PolarHBondContact O-N 2.95Å; F487-L490 PolarHBondContact O-N 3.47Å; L490-G492 VanDerWaalsContact C-N 3.33Å; L490-D493 PolarHBondContact O-N 2.75Å; L490-C494 WeakPolarHBondContact O-CB 3.27Å; L490-C494 PolarHBondContact O-N 2.97Å; L490-T503 HydrophobicContact CD2-CG2 3.92Å; L490-L508 HydrophobicContact CB-CD2 3.73Å; L490-F511 HydrophobicContact CD1-CB 4.36Å; L490-F511 HydrophobicContact CD1-CD1 3.86Å; L490-F511 HydrophobicContact CD1-CD2 3.76Å; L490-F511 HydrophobicContact CD1-CE1 3.96Å; L490-F511 HydrophobicContact CD1-CE2 3.9Å; L490-F511 HydrophobicContact CD1-CG 3.74Å; L490-F511 HydrophobicContact CD1-CZ 3.99Å
491	V	93.1	Very high	88.3	Confident	0 Å²	0	82.3 Å²	82.3	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-64.3	-39	175.5	176.1	0	0	0	0	110.3	V432 F435 R436 F487 G489 C494 E495 L508	V432-V491 HydrophobicContact CG1-CG1 3.9Å; F435-V491 HydrophobicContact CB-CG1 4.34Å; F435-V491 HydrophobicContact CB-CG2 3.86Å; R436-V491 HydrophobicContact CG-CG1 3.63Å; F487-V491 HydrophobicContact CD1-CG2 4.01Å; F487-V491 HydrophobicContact CD2-CG2 4.13Å; F487-V491 HydrophobicContact CE1-CG2 3.78Å; F487-V491 HydrophobicContact CE2-CG2 3.92Å; F487-V491 HydrophobicContact CG-CG2 4.19Å; F487-V491 HydrophobicContact CZ-CG2 3.75Å; F487-V491 WeakPolarHBondContact O-CB 3.45Å; F487-V491 VanDerWaalsContact O-CG2 3.25Å; F487-V491 WeakPolarHBondContact O-CG2 3.47Å; F487-V491 PolarHBondContact O-N 3.12Å; G489-V491 VanDerWaalsContact C-N 3.34Å; G489-V491 PolarHBondContact O-N 3.1Å; V491-C494 PolarHBondContact O-N 3.14Å; V491-E495 WeakPolarHBondContact O-CB 3.23Å; V491-E495 PolarHBondContact O-N 3.41Å; V491-L508 HydrophobicContact CG2-CD1 4.15Å; V491-L508 HydrophobicContact CG2-CD2 3.99Å
492	G	91.8	Very high	87.4	Confident	11 Å²	11	80.8 Å²	80.8	11%	0.113	39%	0.39	C	S	.	.	H	α-helix	trans	-68.5	-39.1	172.6	0	0	0	0	0	114.5	E488 G489 L490 C494 E495 Y496	E488-G492 PolarHBondContact O-N 3.44Å; G489-G492 CarbonylContact O-C 3.55Å; G489-G492 WeakPolarHBondContact O-CA 3.46Å; G489-G492 PolarHBondContact O-N 3.24Å; G489-G492 VanDerWaalsContact O-N 3.12Å; L490-G492 VanDerWaalsContact C-N 3.33Å; G492-C494 VanDerWaalsContact C-N 3.3Å; G492-C494 PolarHBondContact O-N 3.1Å; G492-E495 PolarHBondContact O-N 2.96Å; G492-Y496 WeakPolarHBondContact O-CD2 3.38Å; G492-Y496 PolarHBondContact O-N 2.87Å
493	D	90.8	Very high	86.7	Confident	56 Å²	56	77.4 Å²	77.4	30%	0.299	38%	0.376	S	S	.	.	H	α-helix	trans	-66.9	-32.8	175	-79.2	-26.6	0	0	0	111.7	G489 L490 K497 R498	G489-D493 PolarHBondContact O-N 2.92Å; L490-D493 PolarHBondContact O-N 2.75Å; D493-K497 CarbonylContact O-C 3.58Å; D493-K497 WeakPolarHBondContact O-CA 3.22Å; D493-K497 PolarHBondContact O-N 3.16Å; D493-R498 PolarHBondContact O-N 2.96Å; D493-R498 VanDerWaalsContact O-N 3.12Å
494	C	89.6	Confident	86.4	Confident	20 Å²	20	77.8 Å²	77.8	14%	0.135	39%	0.386	C	S	.	.	H	α-helix	trans	-69.8	-43.3	172.1	-170.7	0	0	0	0	112.2	V432 L490 V491 G492 T503 L508	V432-C494 HydrophobicContact CG2-CB 3.99Å; V432-C494 VanDerWaalsContact CG2-SG 3.54Å; L490-C494 WeakPolarHBondContact O-CB 3.27Å; L490-C494 PolarHBondContact O-N 2.97Å; V491-C494 PolarHBondContact O-N 3.14Å; G492-C494 VanDerWaalsContact C-N 3.3Å; G492-C494 PolarHBondContact O-N 3.1Å; C494-T503 VanDerWaalsContact CA-OG1 3.3Å; C494-T503 WeakPolarHBondContact CA-OG1 3.09Å; C494-T503 WeakPolarHBondContact CB-OG1 3.48Å; C494-T503 PolarHBondContact N-OG1 3.3Å; C494-T503 VanDerWaalsContact N-OG1 3.1Å; C494-T503 PolarHBondContact SG-O 3.04Å; C494-L508 HydrophobicContact CB-CD1 3.84Å; C494-L508 HydrophobicContact CB-CG 4.46Å
495	E	89.8	Confident	86	Confident	81 Å²	81	78.5 Å²	78.5	38%	0.379	39%	0.392	S	S	.	.	H	α-helix	trans	-64.3	-46.9	178.1	-165.9	179.6	138.5	0	0	112	V432 R436 V491 G492	V432-E495 HydrophobicContact CG1-CB 3.83Å; V432-E495 HydrophobicContact CG1-CG 4.01Å; R436-E495 IonicContact CZ-OE2 3.57Å; R436-E495 IonicContact NE-OE2 3.67Å; R436-E495 PolarHBondContact NE-OE2 3.01Å; R436-E495 IonicContact NH2-OE2 3.18Å; R436-E495 PolarHBondContact NH2-OE2 2.96Å; V491-E495 WeakPolarHBondContact O-CB 3.23Å; V491-E495 PolarHBondContact O-N 3.41Å; G492-E495 PolarHBondContact O-N 2.96Å
496	Y	87.4	Confident	85.8	Confident	131 Å²	131	76.4 Å²	76.4	51%	0.514	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	4.4	-173.9	-55.6	-48.9	0	0	0	114.1	G492 R498	G492-Y496 WeakPolarHBondContact O-CD2 3.38Å; G492-Y496 PolarHBondContact O-N 2.87Å; Y496-R498 PolarHBondContact O-N 3.17Å; Y496-R498 VanDerWaalsContact O-N 3.1Å
497	K	82.6	Confident	85.7	Confident	141 Å²	141	75.9 Å²	75.9	61%	0.613	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	38.6	-175.5	-69	170.1	163.4	-95.2	0	112.7	D493 E502	D493-K497 CarbonylContact O-C 3.58Å; D493-K497 WeakPolarHBondContact O-CA 3.22Å; D493-K497 PolarHBondContact O-N 3.16Å; K497-E502 IonicContact NZ-OE1 3.41Å; K497-E502 PolarHBondContact NZ-OE1 3.44Å
498	R	73	Confident	85.6	Confident	184 Å²	184	76 Å²	76	69%	0.694	39%	0.394	S	S	*	.			trans	-90	-16.1	-166.7	-168.9	179.6	-65.3	-118.5	2.5	113.3	D493 Y496	D493-R498 PolarHBondContact O-N 2.96Å; D493-R498 VanDerWaalsContact O-N 3.12Å; Y496-R498 PolarHBondContact O-N 3.17Å; Y496-R498 VanDerWaalsContact O-N 3.1Å
499	G	67.4	Low	85.5	Confident	24 Å²	24	73.6 Å²	73.6	25%	0.247	38%	0.384	C	S	.	.	S	Bend	trans	-68.1	147.9	-178.5	0	0	0	0	0	114	K501	G499-K501 CarbonylContact C-O 3.57Å; G499-K501 WeakPolarHBondContact CA-O 3.15Å; G499-K501 CarbonylContact O-C 3.55Å; G499-K501 PolarHBondContact O-N 2.9Å; G499-K501 VanDerWaalsContact O-N 3.14Å
500	V	64.5	Low	85.6	Confident	160 Å²	160	74 Å²	74	97%	0.97	39%	0.389	S	S	*	.	S	Bend	trans	-62.4	-16.8	170.8	179.8	0	0	0	0	112
501	K	72.9	Confident	85.6	Confident	183 Å²	183	74.2 Å²	74.2	80%	0.796	39%	0.388	S	S	*	.	S	Bend	trans	-127.2	139.5	157.6	-60.5	179.9	-179.6	-177.5	0	106.2	G499 T503	G499-K501 CarbonylContact C-O 3.57Å; G499-K501 WeakPolarHBondContact CA-O 3.15Å; G499-K501 CarbonylContact O-C 3.55Å; G499-K501 PolarHBondContact O-N 2.9Å; G499-K501 VanDerWaalsContact O-N 3.14Å; K501-T503 PolarHBondContact O-N 3.25Å
502	E	76.3	Confident	85.7	Confident	121 Å²	121	75.4 Å²	75.4	57%	0.565	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-64.6	121.5	171.6	-63.7	-170.8	117	0	0	108.9	K497	K497-E502 IonicContact NZ-OE1 3.41Å; K497-E502 PolarHBondContact NZ-OE1 3.44Å
503	T	82.8	Confident	85.9	Confident	30 Å²	30	79.3 Å²	79.3	18%	0.184	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-77.7	129.3	167.5	42.1	0	0	0	0	108.8	L490 C494 K501	L490-T503 HydrophobicContact CD2-CG2 3.92Å; C494-T503 VanDerWaalsContact CA-OG1 3.3Å; C494-T503 WeakPolarHBondContact CA-OG1 3.09Å; C494-T503 WeakPolarHBondContact CB-OG1 3.48Å; C494-T503 PolarHBondContact N-OG1 3.3Å; C494-T503 VanDerWaalsContact N-OG1 3.1Å; C494-T503 PolarHBondContact SG-O 3.04Å; K501-T503 PolarHBondContact O-N 3.25Å
504	T	88.6	Confident	86.2	Confident	78 Å²	78	81.7 Å²	81.7	48%	0.479	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-94.6	157.7	-179.3	-39.5	0	0	0	0	110.2	S506 D507 L508	T504-S506 PolarHBondContact O-N 3.15Å; T504-S506 VanDerWaalsContact O-N 3.16Å; T504-D507 VanDerWaalsContact CB-OD2 3.23Å; T504-D507 WeakPolarHBondContact CB-OD2 3.39Å; T504-D507 PolarHBondContact N-OD2 3.39Å; T504-D507 WeakPolarHBondContact O-CA 3.39Å; T504-D507 WeakPolarHBondContact O-CB 3.41Å; T504-D507 PolarHBondContact O-N 3.11Å; T504-D507 PolarHBondContact OG1-OD2 3.34Å; T504-L508 PolarHBondContact O-N 2.93Å; T504-L508 VanDerWaalsContact O-N 3.15Å
505	C	89	Confident	86.5	Confident	21 Å²	21	80.7 Å²	80.7	14%	0.142	41%	0.414	C	S	.	.	H	α-helix	trans	-51.3	-38.2	170.4	-63.2	0	0	0	0	112.5	H430 D507 L508 D509	H430-C505 WeakPolarHBondContact O-CB 3.46Å; C505-D507 VanDerWaalsContact C-N 3.31Å; C505-D507 PolarHBondContact O-N 2.98Å; C505-L508 CarbonylContact O-C 3.55Å; C505-L508 WeakPolarHBondContact O-CA 3.38Å; C505-L508 VanDerWaalsContact O-CB 3.3Å; C505-L508 WeakPolarHBondContact O-CB 3.43Å; C505-L508 PolarHBondContact O-N 3.39Å; C505-D509 PolarHBondContact O-N 3.19Å
506	S	91.1	Very high	86.7	Confident	81 Å²	81	78.1 Å²	78.1	57%	0.566	41%	0.405	S	S	*	.	H	α-helix	trans	-69	-22.7	175.9	-48.6	0	0	0	0	114.8	T504 G510	T504-S506 PolarHBondContact O-N 3.15Å; T504-S506 VanDerWaalsContact O-N 3.16Å; S506-G510 PolarHBondContact O-N 2.93Å
507	D	91.8	Very high	87.1	Confident	90 Å²	90	77.4 Å²	77.4	48%	0.481	41%	0.405	S	S	.	.	H	α-helix	trans	-74.8	-34.1	169.3	-60.7	-62.4	0	0	0	110.4	T504 C505 F511	T504-D507 VanDerWaalsContact CB-OD2 3.23Å; T504-D507 WeakPolarHBondContact CB-OD2 3.39Å; T504-D507 PolarHBondContact N-OD2 3.39Å; T504-D507 WeakPolarHBondContact O-CA 3.39Å; T504-D507 WeakPolarHBondContact O-CB 3.41Å; T504-D507 PolarHBondContact O-N 3.11Å; T504-D507 PolarHBondContact OG1-OD2 3.34Å; C505-D507 VanDerWaalsContact C-N 3.31Å; C505-D507 PolarHBondContact O-N 2.98Å; D507-F511 WeakPolarHBondContact O-CB 3.34Å; D507-F511 PolarHBondContact O-N 2.81Å; D507-F511 VanDerWaalsContact O-N 3.1Å
508	L	93.4	Very high	87.8	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-68.2	-42.5	173	-58.6	179.4	0	0	0	111.3	V432 F435 F487 L490 V491 C494 T504 C505 G510 F511 W512	V432-L508 HydrophobicContact CG2-CD1 4.24Å; F435-L508 HydrophobicContact CD2-CB 3.73Å; F435-L508 HydrophobicContact CD2-CD1 3.54Å; F435-L508 HydrophobicContact CD2-CG 4.3Å; F435-L508 HydrophobicContact CE1-CB 4.3Å; F435-L508 HydrophobicContact CE2-CB 3.38Å; F435-L508 HydrophobicContact CE2-CD1 3.85Å; F435-L508 HydrophobicContact CE2-CG 4.26Å; F435-L508 HydrophobicContact CG-CB 4.3Å; F435-L508 HydrophobicContact CG-CD1 4.37Å; F435-L508 HydrophobicContact CZ-CB 3.69Å; F487-L508 HydrophobicContact CD2-CD2 4.45Å; F487-L508 HydrophobicContact CE2-CB 3.98Å; F487-L508 HydrophobicContact CE2-CD2 3.96Å; F487-L508 WeakPolarHBondContact CE2-O 3.43Å; F487-L508 HydrophobicContact CZ-CB 4.35Å; L490-L508 HydrophobicContact CB-CD2 3.73Å; V491-L508 HydrophobicContact CG2-CD1 4.15Å; V491-L508 HydrophobicContact CG2-CD2 3.99Å; C494-L508 HydrophobicContact CB-CD1 3.84Å; C494-L508 HydrophobicContact CB-CG 4.46Å; T504-L508 PolarHBondContact O-N 2.93Å; T504-L508 VanDerWaalsContact O-N 3.15Å; C505-L508 CarbonylContact O-C 3.55Å; C505-L508 WeakPolarHBondContact O-CA 3.38Å; C505-L508 VanDerWaalsContact O-CB 3.3Å; C505-L508 WeakPolarHBondContact O-CB 3.43Å; C505-L508 PolarHBondContact O-N 3.39Å; L508-G510 PolarHBondContact O-N 2.74Å; L508-F511 PolarHBondContact O-N 3.12Å; L508-W512 VanDerWaalsContact O-CB 3.24Å; L508-W512 WeakPolarHBondContact O-CB 3.25Å; L508-W512 PolarHBondContact O-N 2.89Å
509	D	93.8	Very high	88.9	Confident	47 Å²	47	65 Å²	65	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-53.2	-54.5	171.7	-76.9	-50.7	0	0	0	111	H430 F435 C505 F511 W512 D513	H430-D509 WeakPolarHBondContact CB-OD1 3.27Å; H430-D509 IonicContact CD2-OD1 2.71Å; H430-D509 PolarHBondContact CD2-OD1 3.17Å; H430-D509 IonicContact CG-OD1 2.69Å; F435-D509 HydrophobicContact CZ-CB 4.47Å; F435-D509 WeakPolarHBondContact CZ-OD1 3.31Å; C505-D509 PolarHBondContact O-N 3.19Å; D509-F511 VanDerWaalsContact C-N 3.27Å; D509-F511 PolarHBondContact O-N 2.86Å; D509-W512 PolarHBondContact O-N 3.37Å; D509-W512 VanDerWaalsContact O-N 3.08Å; D509-D513 PolarHBondContact O-N 2.8Å
510	G	93.6	Very high	90.3	Very high	46 Å²	46	69.3 Å²	69.3	47%	0.474	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-27.7	-178.3	0	0	0	0	0	114.3	S506 L508	S506-G510 PolarHBondContact O-N 2.93Å; L508-G510 PolarHBondContact O-N 2.74Å
511	F	94.8	Very high	91.8	Very high	53 Å²	53	65.5 Å²	65.5	23%	0.232	35%	0.345	C	S	.	.	H	α-helix	trans	-81.8	-32.3	172.4	-158.9	-91.5	0	0	0	112.3	Q486 F487 L490 D507 L508 D509 M514 I515	Q486-F511 HydrophobicContact CB-CE1 4.19Å; Q486-F511 HydrophobicContact CB-CZ 3.93Å; F487-F511 HydrophobicContact CB-CD1 4.03Å; F487-F511 HydrophobicContact CB-CE1 3.98Å; F487-F511 HydrophobicContact CD2-CB 4.33Å; F487-F511 AromaticContact CD2-CD1 3.56Å; F487-F511 HydrophobicContact CD2-CD1 3.56Å; F487-F511 HydrophobicContact CD2-CE1 4.34Å; F487-F511 HydrophobicContact CD2-CG 4.35Å; F487-F511 HydrophobicContact CE2-CB 4.44Å; F487-F511 HydrophobicContact CE2-CD1 4.42Å; F487-F511 HydrophobicContact CG-CD1 4.17Å; L490-F511 HydrophobicContact CD1-CB 4.36Å; L490-F511 HydrophobicContact CD1-CD1 3.86Å; L490-F511 HydrophobicContact CD1-CD2 3.76Å; L490-F511 HydrophobicContact CD1-CE1 3.96Å; L490-F511 HydrophobicContact CD1-CE2 3.9Å; L490-F511 HydrophobicContact CD1-CG 3.74Å; L490-F511 HydrophobicContact CD1-CZ 3.99Å; D507-F511 WeakPolarHBondContact O-CB 3.34Å; D507-F511 PolarHBondContact O-N 2.81Å; D507-F511 VanDerWaalsContact O-N 3.1Å; L508-F511 PolarHBondContact O-N 3.12Å; D509-F511 VanDerWaalsContact C-N 3.27Å; D509-F511 PolarHBondContact O-N 2.86Å; F511-M514 WeakPolarHBondContact O-CB 3.3Å; F511-M514 PolarHBondContact O-N 3.16Å; F511-I515 HydrophobicContact CD1-CD1 3.76Å; F511-I515 HydrophobicContact CD1-CG1 4.33Å; F511-I515 HydrophobicContact CE1-CD1 3.65Å; F511-I515 HydrophobicContact CE1-CG1 4.31Å; F511-I515 PolarHBondContact O-N 3.21Å; F511-I515 VanDerWaalsContact O-N 3.11Å
512	W	95.8	Very high	92.9	Very high	25 Å²	25	57.1 Å²	57.1	10%	0.095	31%	0.309	C	S	.	.	H	α-helix	trans	-68.6	-42.1	175.3	-176.2	-111.1	0	0	0	111.4	F435 I438 L439 E442 F487 L508 D509 M514 I515 S516 I519	F435-W512 HydrophobicContact CD1-CB 4.45Å; F435-W512 HydrophobicContact CD1-CG 4.48Å; F435-W512 HydrophobicContact CE1-CB 4.07Å; F435-W512 HydrophobicContact CE1-CG 4.31Å; I438-W512 HydrophobicContact CB-CZ2 4.25Å; I438-W512 HydrophobicContact CG1-CH2 4.1Å; I438-W512 HydrophobicContact CG1-CZ2 3.43Å; I438-W512 VanDerWaalsContact CG1-CZ2 3.43Å; I438-W512 HydrophobicContact CG2-CD2 4.28Å; I438-W512 HydrophobicContact CG2-CH2 4.06Å; I438-W512 HydrophobicContact CG2-CZ2 3.81Å; I438-W512 HydrophobicContact CG2-CZ3 4.4Å; L439-W512 HydrophobicContact CD1-CZ3 4.26Å; E442-W512 HydrophobicContact CB-CH2 4.29Å; E442-W512 HydrophobicContact CG-CH2 3.91Å; E442-W512 HydrophobicContact CG-CZ2 4.11Å; F487-W512 AromaticContact CD1-CE3 3.82Å; F487-W512 HydrophobicContact CD1-CE3 3.82Å; F487-W512 HydrophobicContact CD1-CZ3 4.15Å; F487-W512 HydrophobicContact CE1-CD2 4.24Å; F487-W512 AromaticContact CE1-CE3 3.43Å; F487-W512 HydrophobicContact CE1-CE3 3.43Å; F487-W512 VanDerWaalsContact CE1-CE3 3.43Å; F487-W512 HydrophobicContact CE1-CZ3 4.02Å; F487-W512 HydrophobicContact CE2-CB 4.25Å; F487-W512 HydrophobicContact CZ-CB 3.94Å; F487-W512 HydrophobicContact CZ-CD2 4.39Å; F487-W512 AromaticContact CZ-CE3 3.92Å; F487-W512 HydrophobicContact CZ-CE3 3.92Å; F487-W512 HydrophobicContact CZ-CG 4.42Å; L508-W512 VanDerWaalsContact O-CB 3.24Å; L508-W512 WeakPolarHBondContact O-CB 3.25Å; L508-W512 PolarHBondContact O-N 2.89Å; D509-W512 PolarHBondContact O-N 3.37Å; D509-W512 VanDerWaalsContact O-N 3.08Å; W512-M514 VanDerWaalsContact C-N 3.31Å; W512-M514 PolarHBondContact O-N 2.77Å; W512-I515 HydrophobicContact CE3-CB 4.3Å; W512-I515 HydrophobicContact CE3-CG2 3.96Å; W512-I515 HydrophobicContact CH2-CG2 4.29Å; W512-I515 HydrophobicContact CZ3-CG2 3.72Å; W512-I515 CarbonylContact O-C 3.42Å; W512-I515 WeakPolarHBondContact O-CA 3.36Å; W512-I515 WeakPolarHBondContact O-CB 3.46Å; W512-I515 PolarHBondContact O-N 3.44Å; W512-S516 PolarHBondContact O-N 2.86Å; W512-S516 PolarHBondContact O-OG 3.35Å; W512-I519 HydrophobicContact CH2-CD1 3.85Å; W512-I519 HydrophobicContact CZ2-CD1 4.32Å; W512-I519 HydrophobicContact CZ3-CD1 4.48Å
513	D	95.5	Very high	93.8	Very high	92 Å²	92	54 Å²	54	49%	0.492	30%	0.296	S	S	.	.	H	α-helix	trans	-55.2	-45.5	170	-88	-7.1	0	0	0	111.8	D509 I515 S516 F517	D509-D513 PolarHBondContact O-N 2.8Å; D513-I515 PolarHBondContact O-N 3.23Å; D513-S516 WeakPolarHBondContact CA-OG 3.28Å; D513-S516 PolarHBondContact O-N 3.38Å; D513-S516 PolarHBondContact O-OG 3.29Å; D513-S516 VanDerWaalsContact O-OG 3.04Å; D513-F517 WeakPolarHBondContact O-CD2 3.3Å; D513-F517 PolarHBondContact O-N 2.7Å
514	M	95.6	Very high	94.4	Very high	106 Å²	106	57.4 Å²	57.4	52%	0.522	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-25.5	176.5	-176.5	60.9	56.8	0	0	112.8	F511 W512 Q518	F511-M514 WeakPolarHBondContact O-CB 3.3Å; F511-M514 PolarHBondContact O-N 3.16Å; W512-M514 VanDerWaalsContact C-N 3.31Å; W512-M514 PolarHBondContact O-N 2.77Å; M514-Q518 WeakPolarHBondContact O-CG 3.42Å
515	I	96.2	Very high	94.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-86	-43.3	174.9	-79	179.3	0	0	0	111.6	R483 F484 F487 F511 W512 D513 F517 Q518 I519	R483-I515 HydrophobicContact CB-CD1 4.01Å; R483-I515 HydrophobicContact CB-CG1 4.05Å; F484-I515 HydrophobicContact CD1-CD1 4.47Å; F484-I515 HydrophobicContact CD1-CG2 4.05Å; F484-I515 HydrophobicContact CE1-CG2 3.62Å; F487-I515 HydrophobicContact CB-CD1 3.7Å; F487-I515 HydrophobicContact CG-CD1 4.14Å; F511-I515 HydrophobicContact CD1-CD1 3.76Å; F511-I515 HydrophobicContact CD1-CG1 4.33Å; F511-I515 HydrophobicContact CE1-CD1 3.65Å; F511-I515 HydrophobicContact CE1-CG1 4.31Å; F511-I515 PolarHBondContact O-N 3.21Å; F511-I515 VanDerWaalsContact O-N 3.11Å; W512-I515 HydrophobicContact CE3-CB 4.3Å; W512-I515 HydrophobicContact CE3-CG2 3.96Å; W512-I515 HydrophobicContact CH2-CG2 4.29Å; W512-I515 HydrophobicContact CZ3-CG2 3.72Å; W512-I515 CarbonylContact O-C 3.42Å; W512-I515 WeakPolarHBondContact O-CA 3.36Å; W512-I515 WeakPolarHBondContact O-CB 3.46Å; W512-I515 PolarHBondContact O-N 3.44Å; D513-I515 PolarHBondContact O-N 3.23Å; I515-F517 VanDerWaalsContact C-N 3.35Å; I515-F517 PolarHBondContact O-N 2.96Å; I515-Q518 CarbonylContact O-C 3.56Å; I515-Q518 WeakPolarHBondContact O-CA 3.44Å; I515-Q518 WeakPolarHBondContact O-CB 3.45Å; I515-Q518 PolarHBondContact O-N 2.81Å; I515-I519 HydrophobicContact CG2-CD1 3.63Å; I515-I519 HydrophobicContact CG2-CG1 4.03Å; I515-I519 WeakPolarHBondContact O-CG1 3.13Å; I515-I519 PolarHBondContact O-N 3.33Å
516	S	95.6	Very high	95.1	Very high	26 Å²	26	55.7 Å²	55.7	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-42.5	-176.7	67.3	0	0	0	0	111.1	W512 D513 Q518 I519 E520	W512-S516 PolarHBondContact O-N 2.86Å; W512-S516 PolarHBondContact O-OG 3.35Å; D513-S516 WeakPolarHBondContact CA-OG 3.28Å; D513-S516 PolarHBondContact O-N 3.38Å; D513-S516 PolarHBondContact O-OG 3.29Å; D513-S516 VanDerWaalsContact O-OG 3.04Å; S516-Q518 PolarHBondContact O-N 2.87Å; S516-I519 CarbonylContact O-C 3.49Å; S516-I519 WeakPolarHBondContact O-CB 3.47Å; S516-I519 PolarHBondContact O-N 3.14Å; S516-I519 VanDerWaalsContact O-N 3.12Å; S516-E520 WeakPolarHBondContact O-CG 3.21Å; S516-E520 PolarHBondContact O-N 3.1Å
517	F	95.7	Very high	95.3	Very high	116 Å²	116	55 Å²	55	51%	0.509	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-27.9	171.7	-67.7	-53.9	0	0	0	113.8	D513 I515 D521	D513-F517 WeakPolarHBondContact O-CD2 3.3Å; D513-F517 PolarHBondContact O-N 2.7Å; I515-F517 VanDerWaalsContact C-N 3.35Å; I515-F517 PolarHBondContact O-N 2.96Å; F517-D521 PolarHBondContact O-N 3.47Å
518	Q	96	Very high	95.4	Very high	56 Å²	56	53.7 Å²	53.7	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-82.2	-32.6	175.3	-64.5	-172	-20.6	0	0	112.3	L479 M514 I515 S516 V522	L479-Q518 HydrophobicContact CD1-CB 3.68Å; L479-Q518 VanDerWaalsContact CD1-OE1 3.32Å; L479-Q518 HydrophobicContact CD2-CB 4.19Å; M514-Q518 WeakPolarHBondContact O-CG 3.42Å; I515-Q518 CarbonylContact O-C 3.56Å; I515-Q518 WeakPolarHBondContact O-CA 3.44Å; I515-Q518 WeakPolarHBondContact O-CB 3.45Å; I515-Q518 PolarHBondContact O-N 2.81Å; S516-Q518 PolarHBondContact O-N 2.87Å; Q518-V522 WeakPolarHBondContact O-CB 3.35Å; Q518-V522 WeakPolarHBondContact O-CG2 3.27Å; Q518-V522 PolarHBondContact O-N 2.99Å; Q518-V522 VanDerWaalsContact O-N 3.16Å
519	I	96.3	Very high	95.4	Very high	8 Å²	8	54 Å²	54	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-46.5	168.2	-63.5	172	0	0	0	109.3	E442 L446 L479 F484 W512 I515 S516 V522 I523	E442-I519 HydrophobicContact CB-CD1 4Å; E442-I519 HydrophobicContact CG-CD1 4.01Å; L446-I519 HydrophobicContact CD1-CG1 4.19Å; L446-I519 HydrophobicContact CD1-CG2 4.28Å; L446-I519 HydrophobicContact CD2-CG2 4.46Å; L479-I519 HydrophobicContact CD2-CG1 3.98Å; F484-I519 HydrophobicContact CE1-CD1 3.83Å; F484-I519 HydrophobicContact CE1-CG1 3.88Å; F484-I519 HydrophobicContact CZ-CD1 3.63Å; F484-I519 HydrophobicContact CZ-CG1 3.84Å; W512-I519 HydrophobicContact CH2-CD1 3.85Å; W512-I519 HydrophobicContact CZ2-CD1 4.32Å; W512-I519 HydrophobicContact CZ3-CD1 4.48Å; I515-I519 HydrophobicContact CG2-CD1 3.63Å; I515-I519 HydrophobicContact CG2-CG1 4.03Å; I515-I519 WeakPolarHBondContact O-CG1 3.13Å; I515-I519 PolarHBondContact O-N 3.33Å; S516-I519 CarbonylContact O-C 3.49Å; S516-I519 WeakPolarHBondContact O-CB 3.47Å; S516-I519 PolarHBondContact O-N 3.14Å; S516-I519 VanDerWaalsContact O-N 3.12Å; I519-V522 WeakPolarHBondContact O-CB 3.24Å; I519-V522 PolarHBondContact O-N 3.13Å; I519-I523 HydrophobicContact CG2-CD1 3.6Å; I519-I523 HydrophobicContact CG2-CG1 4.24Å; I519-I523 WeakPolarHBondContact O-CB 3.48Å; I519-I523 WeakPolarHBondContact O-CG1 3.41Å; I519-I523 PolarHBondContact O-N 2.71Å
520	E	96.7	Very high	95.4	Very high	116 Å²	116	54 Å²	54	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-44.9	178	-75.3	-174.3	173.4	0	0	113.2	S516 V522 I523 H524	S516-E520 WeakPolarHBondContact O-CG 3.21Å; S516-E520 PolarHBondContact O-N 3.1Å; E520-V522 VanDerWaalsContact C-N 3.31Å; E520-V522 PolarHBondContact O-N 3.15Å; E520-I523 PolarHBondContact O-N 3.49Å; E520-H524 VanDerWaalsContact O-CB 3.25Å; E520-H524 WeakPolarHBondContact O-CB 3.37Å; E520-H524 PolarHBondContact O-N 3.22Å
521	D	96.1	Very high	95.4	Very high	80 Å²	80	57 Å²	57	43%	0.428	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-37.7	175.3	168.8	56	0	0	0	112.1	F517 K525	F517-D521 PolarHBondContact O-N 3.47Å; D521-K525 WeakPolarHBondContact O-CD 3.42Å; D521-K525 WeakPolarHBondContact O-CG 3.33Å; D521-K525 PolarHBondContact O-N 3.22Å; D521-K525 VanDerWaalsContact O-N 3.11Å; D521-K525 WeakPolarHBondContact OD1-CE 3.48Å; D521-K525 IonicContact OD1-NZ 2.7Å; D521-K525 PolarHBondContact OD1-NZ 3.49Å; D521-K525 WeakPolarHBondContact OD2-CE 3.46Å; D521-K525 IonicContact OD2-NZ 3.8Å; D521-K525 PolarHBondContact OD2-NZ 2.88Å
522	V	96.4	Very high	95.3	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-48	173.5	161.3	0	0	0	0	112	L446 T476 L479 Q518 I519 E520 H524 K525 F526	L446-V522 HydrophobicContact CD2-CG1 3.93Å; T476-V522 HydrophobicContact CG2-CG1 3.88Å; T476-V522 WeakPolarHBondContact OG1-CG1 3.5Å; L479-V522 HydrophobicContact CD2-CG2 4.22Å; Q518-V522 WeakPolarHBondContact O-CB 3.35Å; Q518-V522 WeakPolarHBondContact O-CG2 3.27Å; Q518-V522 PolarHBondContact O-N 2.99Å; Q518-V522 VanDerWaalsContact O-N 3.16Å; I519-V522 WeakPolarHBondContact O-CB 3.24Å; I519-V522 PolarHBondContact O-N 3.13Å; E520-V522 VanDerWaalsContact C-N 3.31Å; E520-V522 PolarHBondContact O-N 3.15Å; V522-H524 VanDerWaalsContact C-N 3.26Å; V522-H524 PolarHBondContact O-N 3.04Å; V522-K525 WeakPolarHBondContact O-CB 3.29Å; V522-K525 PolarHBondContact O-N 3.13Å; V522-K525 VanDerWaalsContact O-N 3.08Å; V522-F526 HydrophobicContact CG1-CD2 3.96Å; V522-F526 HydrophobicContact CG1-CE2 3.63Å; V522-F526 WeakPolarHBondContact O-CD2 3.46Å; V522-F526 PolarHBondContact O-N 2.93Å
523	I	95.7	Very high	95	Very high	54 Å²	54	58 Å²	58	28%	0.277	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-36.7	175.3	-72.5	175.3	0	0	0	110.5	L446 I519 E520 K525 F526 N527	L446-I523 HydrophobicContact CD2-CG1 4.08Å; I519-I523 HydrophobicContact CG2-CD1 3.6Å; I519-I523 HydrophobicContact CG2-CG1 4.24Å; I519-I523 WeakPolarHBondContact O-CB 3.48Å; I519-I523 WeakPolarHBondContact O-CG1 3.41Å; I519-I523 PolarHBondContact O-N 2.71Å; E520-I523 PolarHBondContact O-N 3.49Å; I523-K525 VanDerWaalsContact C-N 3.33Å; I523-K525 PolarHBondContact O-N 3.44Å; I523-F526 PolarHBondContact O-N 2.96Å; I523-N527 VanDerWaalsContact CG2-ND2 3.3Å; I523-N527 WeakPolarHBondContact CG2-ND2 3.49Å; I523-N527 WeakPolarHBondContact O-CB 3.44Å; I523-N527 PolarHBondContact O-N 3.24Å; I523-N527 PolarHBondContact O-ND2 2.71Å
524	H	95.7	Very high	94.8	Very high	103 Å²	103	60.6 Å²	60.6	48%	0.477	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-37	174.7	-171.8	76.1	0	0	0	112.1	E520 V522 N527 N528	E520-H524 VanDerWaalsContact O-CB 3.25Å; E520-H524 WeakPolarHBondContact O-CB 3.37Å; E520-H524 PolarHBondContact O-N 3.22Å; V522-H524 VanDerWaalsContact C-N 3.26Å; V522-H524 PolarHBondContact O-N 3.04Å; H524-N527 PolarHBondContact O-N 3.41Å; H524-N528 PolarHBondContact CD2-ND2 2.9Å; H524-N528 PolarHBondContact NE2-ND2 3.22Å; H524-N528 WeakPolarHBondContact O-CB 3.49Å; H524-N528 PolarHBondContact O-N 2.9Å; H524-N528 PolarHBondContact O-ND2 3.28Å; H524-N528 VanDerWaalsContact O-ND2 3.15Å
525	K	94.9	Very high	94.5	Very high	60 Å²	60	57.2 Å²	57.2	26%	0.261	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-45	173.7	-70.9	156.6	-173.2	166.1	0	111.7	A472 D521 V522 I523 N528 L529	A472-K525 HydrophobicContact CB-CB 4.25Å; D521-K525 WeakPolarHBondContact O-CD 3.42Å; D521-K525 WeakPolarHBondContact O-CG 3.33Å; D521-K525 PolarHBondContact O-N 3.22Å; D521-K525 VanDerWaalsContact O-N 3.11Å; D521-K525 WeakPolarHBondContact OD1-CE 3.48Å; D521-K525 IonicContact OD1-NZ 2.7Å; D521-K525 PolarHBondContact OD1-NZ 3.49Å; D521-K525 WeakPolarHBondContact OD2-CE 3.46Å; D521-K525 IonicContact OD2-NZ 3.8Å; D521-K525 PolarHBondContact OD2-NZ 2.88Å; V522-K525 WeakPolarHBondContact O-CB 3.29Å; V522-K525 PolarHBondContact O-N 3.13Å; V522-K525 VanDerWaalsContact O-N 3.08Å; I523-K525 VanDerWaalsContact C-N 3.33Å; I523-K525 PolarHBondContact O-N 3.44Å; K525-N528 PolarHBondContact O-N 2.92Å; K525-N528 VanDerWaalsContact O-N 3.15Å; K525-L529 WeakPolarHBondContact O-CG 3.13Å; K525-L529 PolarHBondContact O-N 2.8Å
526	F	95.8	Very high	94	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-44.6	173	-70	-57.6	0	0	0	112.2	H449 W453 A472 V473 T476 V522 I523 N528 L529 I530	H449-F526 HydrophobicContact CB-CD2 4.27Å; H449-F526 HydrophobicContact CB-CE2 4.1Å; H449-F526 HydrophobicContact CB-CZ 4.34Å; W453-F526 HydrophobicContact CB-CE1 4.11Å; W453-F526 AromaticContact CD1-CD1 3.22Å; W453-F526 AromaticContact CD1-CE1 3.41Å; W453-F526 VanDerWaalsContact CD1-CE1 3.41Å; W453-F526 HydrophobicContact CD2-CD1 4.28Å; W453-F526 AromaticContact CG-CD1 3.79Å; W453-F526 HydrophobicContact CG-CD1 3.79Å; W453-F526 AromaticContact CG-CE1 3.75Å; W453-F526 HydrophobicContact CG-CE1 3.75Å; W453-F526 AromaticContact NE1-CD1 3.44Å; A472-F526 HydrophobicContact CB-CD1 4.22Å; A472-F526 HydrophobicContact CB-CE1 3.95Å; A472-F526 HydrophobicContact CB-CZ 4.41Å; V473-F526 HydrophobicContact CG2-CE1 3.98Å; V473-F526 HydrophobicContact CG2-CZ 4.28Å; T476-F526 HydrophobicContact CG2-CE2 4.06Å; T476-F526 HydrophobicContact CG2-CZ 4.36Å; T476-F526 WeakPolarHBondContact OG1-CE2 3.42Å; T476-F526 WeakPolarHBondContact OG1-CZ 3.44Å; V522-F526 HydrophobicContact CG1-CD2 3.96Å; V522-F526 HydrophobicContact CG1-CE2 3.63Å; V522-F526 WeakPolarHBondContact O-CD2 3.46Å; V522-F526 PolarHBondContact O-N 2.93Å; I523-F526 PolarHBondContact O-N 2.96Å; F526-N528 PolarHBondContact O-N 3Å; F526-N528 VanDerWaalsContact O-N 3.17Å; F526-L529 HydrophobicContact CD1-CD1 4.09Å; F526-L529 WeakPolarHBondContact O-CA 3.46Å; F526-L529 WeakPolarHBondContact O-CB 3.25Å; F526-L529 PolarHBondContact O-N 3.11Å; F526-I530 WeakPolarHBondContact O-CG1 3.48Å; F526-I530 PolarHBondContact O-N 3.27Å
527	N	95.5	Very high	93.6	Very high	67 Å²	67	60.6 Å²	60.6	36%	0.358	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-23.8	174.6	-78.9	-51	0	0	0	114	I523 H524 K531	I523-N527 VanDerWaalsContact CG2-ND2 3.3Å; I523-N527 WeakPolarHBondContact CG2-ND2 3.49Å; I523-N527 WeakPolarHBondContact O-CB 3.44Å; I523-N527 PolarHBondContact O-N 3.24Å; I523-N527 PolarHBondContact O-ND2 2.71Å; H524-N527 PolarHBondContact O-N 3.41Å; N527-K531 VanDerWaalsContact O-CD 3.28Å; N527-K531 WeakPolarHBondContact O-CD 3.46Å; N527-K531 WeakPolarHBondContact O-CE 3.41Å; N527-K531 VanDerWaalsContact O-CG 3.3Å; N527-K531 WeakPolarHBondContact O-CG 3.04Å
528	N	94.1	Very high	92.5	Very high	63 Å²	63	61.6 Å²	61.6	34%	0.337	31%	0.311	S	S	.	.	H	α-helix	trans	-86.2	-23.3	172.8	-68.6	-26.8	0	0	0	112.6	H524 K525 F526 K531 L532	H524-N528 PolarHBondContact CD2-ND2 2.9Å; H524-N528 PolarHBondContact NE2-ND2 3.22Å; H524-N528 WeakPolarHBondContact O-CB 3.49Å; H524-N528 PolarHBondContact O-N 2.9Å; H524-N528 PolarHBondContact O-ND2 3.28Å; H524-N528 VanDerWaalsContact O-ND2 3.15Å; K525-N528 PolarHBondContact O-N 2.92Å; K525-N528 VanDerWaalsContact O-N 3.15Å; F526-N528 PolarHBondContact O-N 3Å; F526-N528 VanDerWaalsContact O-N 3.17Å; N528-K531 PolarHBondContact OD1-NZ 3.38Å; N528-L532 PolarHBondContact O-N 2.73Å
529	L	94.2	Very high	90.8	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-72	-43	168.5	-71	169.2	0	0	0	111.7	W453 L468 I469 A472 K525 F526 K531 L532 E533	W453-L529 HydrophobicContact CD2-CD1 4.44Å; W453-L529 HydrophobicContact CE3-CB 4.48Å; W453-L529 HydrophobicContact CE3-CD1 4.43Å; W453-L529 HydrophobicContact CH2-CB 3.55Å; W453-L529 HydrophobicContact CZ2-CB 3.72Å; W453-L529 HydrophobicContact CZ3-CB 3.96Å; L468-L529 HydrophobicContact CB-CD2 3.78Å; I469-L529 HydrophobicContact CB-CD1 4.44Å; I469-L529 HydrophobicContact CG1-CD1 3.99Å; I469-L529 HydrophobicContact CG1-CD2 3.75Å; I469-L529 HydrophobicContact CG1-CG 4.43Å; A472-L529 HydrophobicContact CB-CD1 3.71Å; K525-L529 WeakPolarHBondContact O-CG 3.13Å; K525-L529 PolarHBondContact O-N 2.8Å; F526-L529 HydrophobicContact CD1-CD1 4.09Å; F526-L529 WeakPolarHBondContact O-CA 3.46Å; F526-L529 WeakPolarHBondContact O-CB 3.25Å; F526-L529 PolarHBondContact O-N 3.11Å; L529-K531 VanDerWaalsContact C-N 3.32Å; L529-K531 PolarHBondContact O-N 3.1Å; L529-L532 WeakPolarHBondContact O-CA 3.38Å; L529-L532 WeakPolarHBondContact O-CB 3.46Å; L529-L532 PolarHBondContact O-N 3.35Å; L529-E533 PolarHBondContact O-N 3.27Å
530	I	94.1	Very high	88.7	Confident	48 Å²	48	66.3 Å²	66.3	25%	0.246	34%	0.34	C	S	.	.	H	α-helix	trans	-53.1	-50.3	172.5	-63.1	172.8	0	0	0	109.9	W453 F526 L532 E533 E534	W453-I530 HydrophobicContact CZ2-CG1 3.81Å; F526-I530 WeakPolarHBondContact O-CG1 3.48Å; F526-I530 PolarHBondContact O-N 3.27Å; I530-L532 PolarHBondContact O-N 3.39Å; I530-E533 WeakPolarHBondContact O-CB 3.4Å; I530-E533 PolarHBondContact O-N 3.48Å; I530-E533 VanDerWaalsContact O-N 3.14Å; I530-E534 HydrophobicContact CG2-CG 4.3Å; I530-E534 WeakPolarHBondContact O-CG 3.37Å; I530-E534 PolarHBondContact O-N 3.04Å
531	K	93.4	Very high	86.5	Confident	107 Å²	107	66 Å²	66	47%	0.465	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-27	177.5	-66.1	163.6	-160.9	157.2	0	113.8	N527 N528 L529 S535	N527-K531 VanDerWaalsContact O-CD 3.28Å; N527-K531 WeakPolarHBondContact O-CD 3.46Å; N527-K531 WeakPolarHBondContact O-CE 3.41Å; N527-K531 VanDerWaalsContact O-CG 3.3Å; N527-K531 WeakPolarHBondContact O-CG 3.04Å; N528-K531 PolarHBondContact OD1-NZ 3.38Å; L529-K531 VanDerWaalsContact C-N 3.32Å; L529-K531 PolarHBondContact O-N 3.1Å; K531-S535 VanDerWaalsContact O-CB 3.31Å; K531-S535 WeakPolarHBondContact O-CB 3.18Å; K531-S535 PolarHBondContact O-N 3.21Å; K531-S535 PolarHBondContact O-OG 3.5Å
532	L	91.1	Very high	84.1	Confident	35 Å²	35	69.4 Å²	69.4	18%	0.183	36%	0.36	C	S	.	.	H	α-helix	trans	-74	-42.9	174.7	-130	77.6	0	0	0	110.4	A465 L468 N528 L529 I530 S535 G536 W537	A465-L532 HydrophobicContact CB-CD2 4.43Å; L468-L532 HydrophobicContact CD1-CD2 3.98Å; N528-L532 PolarHBondContact O-N 2.73Å; L529-L532 WeakPolarHBondContact O-CA 3.38Å; L529-L532 WeakPolarHBondContact O-CB 3.46Å; L529-L532 PolarHBondContact O-N 3.35Å; I530-L532 PolarHBondContact O-N 3.39Å; L532-S535 WeakPolarHBondContact CA-OG 3.47Å; L532-S535 CarbonylContact O-C 3.58Å; L532-S535 PolarHBondContact O-N 2.98Å; L532-S535 PolarHBondContact O-OG 3.05Å; L532-G536 PolarHBondContact O-N 3.25Å; L532-W537 HydrophobicContact CB-CE3 3.99Å; L532-W537 HydrophobicContact CB-CZ3 3.96Å; L532-W537 HydrophobicContact CD2-CE3 4.14Å; L532-W537 HydrophobicContact CD2-CZ3 4.44Å; L532-W537 HydrophobicContact CG-CE3 4.36Å; L532-W537 WeakPolarHBondContact O-CA 3.34Å; L532-W537 PolarHBondContact O-N 3.34Å
533	E	90.3	Very high	81.9	Confident	64 Å²	64	76.4 Å²	76.4	30%	0.299	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-50.6	174.3	-173.7	175.4	-169.2	0	0	111.4	W453 K456 L529 I530 S535 G536 W537	W453-E533 WeakPolarHBondContact CH2-OE2 3.32Å; K456-E533 WeakPolarHBondContact CD-OE1 3.45Å; K456-E533 VanDerWaalsContact CE-OE1 3.23Å; K456-E533 WeakPolarHBondContact CE-OE1 3.43Å; K456-E533 VanDerWaalsContact NZ-CD 3.32Å; K456-E533 IonicContact NZ-OE1 3.89Å; K456-E533 PolarHBondContact NZ-OE1 3.39Å; K456-E533 VanDerWaalsContact NZ-OE1 3.13Å; K456-E533 IonicContact NZ-OE2 2.74Å; K456-E533 PolarHBondContact NZ-OE2 3.23Å; L529-E533 PolarHBondContact O-N 3.27Å; I530-E533 WeakPolarHBondContact O-CB 3.4Å; I530-E533 PolarHBondContact O-N 3.48Å; I530-E533 VanDerWaalsContact O-N 3.14Å; E533-S535 PolarHBondContact O-N 3.09Å; E533-G536 WeakPolarHBondContact O-CA 3.3Å; E533-G536 PolarHBondContact O-N 3.14Å; E533-W537 HydrophobicContact CB-CH2 3.58Å; E533-W537 HydrophobicContact CB-CZ2 3.63Å; E533-W537 HydrophobicContact CB-CZ3 4.22Å; E533-W537 HydrophobicContact CG-CH2 4.05Å; E533-W537 HydrophobicContact CG-CZ2 3.65Å
534	E	91.9	Very high	79.6	Confident	147 Å²	147	77.5 Å²	77.5	69%	0.687	40%	0.401	S	S	*	.	H	α-helix	trans	-56	-35.3	173.2	-72	172.3	165.8	0	0	112.6	I530 G536	I530-E534 HydrophobicContact CG2-CG 4.3Å; I530-E534 WeakPolarHBondContact O-CG 3.37Å; I530-E534 PolarHBondContact O-N 3.04Å; E534-G536 PolarHBondContact O-N 2.82Å
535	S	89.3	Confident	77.1	Confident	36 Å²	36	77 Å²	77	25%	0.252	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	4.9	176.1	78.1	0	0	0	0	114.1	K531 L532 E533 Q538	K531-S535 VanDerWaalsContact O-CB 3.31Å; K531-S535 WeakPolarHBondContact O-CB 3.18Å; K531-S535 PolarHBondContact O-N 3.21Å; K531-S535 PolarHBondContact O-OG 3.5Å; L532-S535 WeakPolarHBondContact CA-OG 3.47Å; L532-S535 CarbonylContact O-C 3.58Å; L532-S535 PolarHBondContact O-N 2.98Å; L532-S535 PolarHBondContact O-OG 3.05Å; E533-S535 PolarHBondContact O-N 3.09Å; S535-Q538 VanDerWaalsContact O-CB 3.26Å; S535-Q538 WeakPolarHBondContact O-CB 3.49Å; S535-Q538 WeakPolarHBondContact O-CG 3.49Å; S535-Q538 PolarHBondContact O-N 3.41Å; S535-Q538 PolarHBondContact OG-O 2.8Å
536	G	85.5	Confident	74.6	Confident	49 Å²	49	79.9 Å²	79.9	51%	0.505	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	36.7	-176.5	0	0	0	0	0	112.9	L532 E533 E534 Q538	L532-G536 PolarHBondContact O-N 3.25Å; E533-G536 WeakPolarHBondContact O-CA 3.3Å; E533-G536 PolarHBondContact O-N 3.14Å; E534-G536 PolarHBondContact O-N 2.82Å; G536-Q538 PolarHBondContact O-N 2.81Å; G536-Q538 VanDerWaalsContact O-N 3.12Å
537	W	87.1	Confident	72.4	Confident	47 Å²	47	87.1 Å²	87.1	18%	0.178	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	16.3	-174.8	-50.1	107.2	0	0	0	115	W453 I461 P462 A465 I469 L532 E533 V539	W453-W537 HydrophobicContact CH2-CH2 4.4Å; W453-W537 HydrophobicContact CZ3-CH2 4.02Å; I461-W537 HydrophobicContact CD1-CH2 4.13Å; I461-W537 HydrophobicContact CD1-CZ2 3.55Å; I461-W537 HydrophobicContact CG1-CZ2 3.98Å; I461-W537 HydrophobicContact CG2-CD2 3.87Å; I461-W537 HydrophobicContact CG2-CE3 4.18Å; I461-W537 HydrophobicContact CG2-CG 4.36Å; I461-W537 HydrophobicContact CG2-CH2 4.38Å; I461-W537 HydrophobicContact CG2-CZ2 4.08Å; I461-W537 HydrophobicContact CG2-CZ3 4.41Å; P462-W537 HydrophobicContact CG-CB 3.86Å; P462-W537 HydrophobicContact CG-CG 4.35Å; A465-W537 HydrophobicContact CB-CD2 4.1Å; A465-W537 HydrophobicContact CB-CE3 3.38Å; A465-W537 HydrophobicContact CB-CZ3 3.79Å; I469-W537 HydrophobicContact CD1-CH2 4.16Å; I469-W537 HydrophobicContact CD1-CZ3 4.49Å; L532-W537 HydrophobicContact CB-CE3 3.99Å; L532-W537 HydrophobicContact CB-CZ3 3.96Å; L532-W537 HydrophobicContact CD2-CE3 4.14Å; L532-W537 HydrophobicContact CD2-CZ3 4.44Å; L532-W537 HydrophobicContact CG-CE3 4.36Å; L532-W537 WeakPolarHBondContact O-CA 3.34Å; L532-W537 PolarHBondContact O-N 3.34Å; E533-W537 HydrophobicContact CB-CH2 3.58Å; E533-W537 HydrophobicContact CB-CZ2 3.63Å; E533-W537 HydrophobicContact CB-CZ3 4.22Å; E533-W537 HydrophobicContact CG-CH2 4.05Å; E533-W537 HydrophobicContact CG-CZ2 3.65Å; W537-V539 PolarHBondContact O-N 3.06Å
538	Q	71.9	Confident	69.9	Low	137 Å²	137	89.6 Å²	89.6	64%	0.64	47%	0.469	S	S	*	.			trans	-68.5	97.8	174.5	-66.3	-75.5	-28.3	0	0	110	S535 G536 N540	S535-Q538 VanDerWaalsContact O-CB 3.26Å; S535-Q538 WeakPolarHBondContact O-CB 3.49Å; S535-Q538 WeakPolarHBondContact O-CG 3.49Å; S535-Q538 PolarHBondContact O-N 3.41Å; S535-Q538 PolarHBondContact OG-O 2.8Å; G536-Q538 PolarHBondContact O-N 2.81Å; G536-Q538 VanDerWaalsContact O-N 3.12Å; Q538-N540 VanDerWaalsContact C-N 3.35Å; Q538-N540 PolarHBondContact O-N 3.12Å; Q538-N540 PolarHBondContact O-ND2 2.66Å
539	V	60.4	Low	67.7	Low	55 Å²	55	92 Å²	92	33%	0.333	48%	0.476	S	S	.	.			trans	-59.9	97.3	174.2	-179.3	0	0	0	0	109.3	W537 N541	W537-V539 PolarHBondContact O-N 3.06Å; V539-N541 PolarHBondContact O-N 3.08Å; V539-N541 PolarHBondContact O-ND2 2.97Å; V539-N541 VanDerWaalsContact O-ND2 3.13Å
540	N	52.3	Low	65.4	Low	108 Å²	108	99.1 Å²	99.1	58%	0.578	51%	0.514	S	S	*	.			trans	-70.8	81	-179	-95.6	-62.9	0	0	0	110.2	Q538 N542 M543	Q538-N540 VanDerWaalsContact C-N 3.35Å; Q538-N540 PolarHBondContact O-N 3.12Å; Q538-N540 PolarHBondContact O-ND2 2.66Å; N540-N542 PolarHBondContact O-N 3.24Å; N540-M543 PolarHBondContact O-N 3.06Å
541	N	51.2	Low	62.8	Low	111 Å²	111	102.5 Å²	102.5	59%	0.594	54%	0.537	S	S	*	.	H	α-helix	trans	-55.8	-10.1	-170.2	-82.8	-59.2	0	0	0	115.7	V539 N545	V539-N541 PolarHBondContact O-N 3.08Å; V539-N541 PolarHBondContact O-ND2 2.97Å; V539-N541 VanDerWaalsContact O-ND2 3.13Å; N541-N545 PolarHBondContact O-ND2 3.34Å
542	N	45.1	Very low	60.2	Low	150 Å²	150	106.6 Å²	106.6	80%	0.802	56%	0.555	S	S	*	*	H	α-helix	trans	-72.2	-28.3	172.8	-76.5	-45.3	0	0	0	114	N540	N540-N542 PolarHBondContact O-N 3.24Å
543	M	49.8	Very low	57.9	Low	155 Å²	155	116 Å²	116	76%	0.764	59%	0.588	S	S	*	*	H	α-helix	trans	-89.3	-50	-173.7	-154.9	65.7	167.3	0	0	112.9	N540 N545 N546	N540-M543 PolarHBondContact O-N 3.06Å; M543-N545 PolarHBondContact O-N 2.97Å; M543-N545 VanDerWaalsContact O-N 3.08Å; M543-N546 PolarHBondContact O-N 2.91Å; M543-N546 VanDerWaalsContact O-N 3.14Å
544	N	47	Very low	55.8	Low	77 Å²	77	122 Å²	122	41%	0.412	61%	0.613	S	S	.	*	H	α-helix	trans	-61.8	-22.7	-177.8	-157.9	-5.7	0	0	0	112.5	N546 N548	N544-N546 PolarHBondContact O-N 3.48Å; N544-N546 VanDerWaalsContact O-N 3.1Å; N544-N548 PolarHBondContact O-ND2 3.44Å; N544-N548 PolarHBondContact OD1-ND2 2.98Å
545	N	44.4	Very low	53.1	Low	92 Å²	92	124.2 Å²	124.2	49%	0.492	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.1	-7.4	175.8	-101.9	-71.8	0	0	0	115.3	N541 M543 K549	N541-N545 PolarHBondContact O-ND2 3.34Å; M543-N545 PolarHBondContact O-N 2.97Å; M543-N545 VanDerWaalsContact O-N 3.08Å; N545-K549 VanDerWaalsContact O-CD 3.31Å; N545-K549 WeakPolarHBondContact O-CD 3.23Å; N545-K549 WeakPolarHBondContact O-CE 3.37Å; N545-K549 PolarHBondContact O-NZ 3.19Å
546	N	42.7	Very low	50.3	Low	121 Å²	121	129 Å²	129	65%	0.647	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-20	178.3	-85.7	-14.1	0	0	0	115.8	M543 N544 K549	M543-N546 PolarHBondContact O-N 2.91Å; M543-N546 VanDerWaalsContact O-N 3.14Å; N544-N546 PolarHBondContact O-N 3.48Å; N544-N546 VanDerWaalsContact O-N 3.1Å; N546-K549 PolarHBondContact OD1-NZ 3.04Å
547	M	48.3	Very low	48.3	Very low	153 Å²	153	133.4 Å²	133.4	75%	0.754	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-33.9	176.3	-61.7	-165	-69.6	0	0	112	K549	M547-K549 VanDerWaalsContact C-N 3.27Å; M547-K549 PolarHBondContact O-N 3.03Å; M547-K549 VanDerWaalsContact O-N 3.1Å
548	N	43.5	Very low	45.7	Very low	119 Å²	119	136.6 Å²	136.6	64%	0.636	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	21.1	-168.4	-55.4	-24.4	0	0	0	114.9	N544	N544-N548 PolarHBondContact O-ND2 3.44Å; N544-N548 PolarHBondContact OD1-ND2 2.98Å
549	K	48.1	Very low	43.9	Very low	113 Å²	113	132.9 Å²	132.9	49%	0.491	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.8	0.6	-170.2	-83.3	174.4	177.5	144.5	0	116.3	N545 N546 M547	N545-K549 VanDerWaalsContact O-CD 3.31Å; N545-K549 WeakPolarHBondContact O-CD 3.23Å; N545-K549 WeakPolarHBondContact O-CE 3.37Å; N545-K549 PolarHBondContact O-NZ 3.19Å; N546-K549 PolarHBondContact OD1-NZ 3.04Å; M547-K549 VanDerWaalsContact C-N 3.27Å; M547-K549 PolarHBondContact O-N 3.03Å; M547-K549 VanDerWaalsContact O-N 3.1Å
550	N	46	Very low	42.9	Very low	157 Å²	157	138.4 Å²	138.4	84%	0.84	72%	0.719	S	S	*	*			trans	-98.2	33.7	-179.1	-81.5	-11.9	0	0	0	115.4
551	V	39.6	Very low	42.3	Very low	120 Å²	120	137.8 Å²	137.8	73%	0.727	73%	0.728	S	S	*	*			trans	-126	88.5	161.3	-174.8	0	0	0	0	110.5	R553	V551-R553 HydrophobicContact CG1-CG 3.79Å; V551-R553 PolarHBondContact O-N 3.27Å
552	F	38	Very low	41.8	Very low	193 Å²	193	137.3 Å²	137.3	85%	0.846	73%	0.734	S	S	*	*			trans	-75	63.1	179	-106.6	-82.1	0	0	0	113.2	K554	F552-K554 PolarHBondContact O-N 3.15Å; F552-K554 VanDerWaalsContact O-N 3.13Å
553	R	44.2	Very low	41.5	Very low	231 Å²	231	139.1 Å²	139.1	87%	0.872	73%	0.734	S	S	*	*			trans	-80.1	89.4	168.9	-74.1	-96.2	-87.5	-159.2	-9.1	109.5	V551 K555	V551-R553 HydrophobicContact CG1-CG 3.79Å; V551-R553 PolarHBondContact O-N 3.27Å; R553-K555 PolarHBondContact O-N 2.91Å
554	K	45.5	Very low	41.3	Very low	191 Å²	191	137.3 Å²	137.3	83%	0.83	73%	0.734	S	S	*	*			trans	-78.8	106.3	-167.6	-177	-177.7	-176.6	178.3	0	114	F552	F552-K554 PolarHBondContact O-N 3.15Å; F552-K554 VanDerWaalsContact O-N 3.13Å
555	K	34.1	Very low	41.3	Very low	193 Å²	193	142.3 Å²	142.3	84%	0.839	75%	0.752	S	S	*	*			trans	-156.6	116.3	153.2	-126.8	177.8	-177.7	-175.8	0	115.1	R553	R553-K555 PolarHBondContact O-N 2.91Å
556	V	31.8	Very low	41.5	Very low	136 Å²	136	147.4 Å²	147.4	82%	0.824	77%	0.773	S	S	*	*			trans	42.2	128.2	145.3	-176	0	0	0	0	120.2
557	V	42.5	Very low	42.3	Very low	143 Å²	143	146.2 Å²	146.2	87%	0.867	77%	0.766	S	S	*	*			trans	-104.4	138.2	175.9	172.5	0	0	0	0	112.3
558	S	33.7	Very low	43.3	Very low	114 Å²	114	142.6 Å²	142.6	80%	0.797	75%	0.75	S	S	*	*			trans	-161.1	137.7	150	-166.1	0	0	0	0	106.3
559	G	33	Very low	44.6	Very low	58 Å²	58	140.8 Å²	140.8	60%	0.598	75%	0.752	S	S	*	*			cis	96.6	132.9	19	0	0	0	0	0	110.5
560	I	40.5	Very low	45.9	Very low	172 Å²	172	137.1 Å²	137.1	88%	0.882	75%	0.746	S	S	*	*			cis	-157.8	150.6	4.1	-71.4	171.6	0	0	0	108.4
561	A	38.5	Very low	47.3	Very low	94 Å²	94	134.7 Å²	134.7	78%	0.777	73%	0.726	S	S	*	*			trans	166.5	151.1	145.2	0	0	0	0	0	111.5
562	S	41.9	Very low	49.2	Very low	101 Å²	101	134.2 Å²	134.2	71%	0.706	72%	0.718	S	S	*	*			cis	-161.1	166.8	-16	55.8	0	0	0	0	106.8
563	K	38.3	Very low	51.3	Low	189 Å²	189	127.2 Å²	127.2	82%	0.822	70%	0.696	S	S	*	*			cis	-161.3	-171.1	40.3	-61.4	-179.5	178.8	176.2	0	108.9
564	P	45.4	Very low	52.9	Low	116 Å²	116	119 Å²	119	75%	0.753	68%	0.676	S	S	*	*			cis	-124.2	161.9	-40.9	27.6	-8.5	0	0	0	114.7
565	K	47	Very low	54.9	Low	183 Å²	183	117.6 Å²	117.6	80%	0.796	67%	0.666	S	S	*	*			trans	6	123.2	157.6	-60.4	-176	175.7	-173.8	0	121.5
566	Q	49.1	Very low	57.5	Low	198 Å²	198	113.9 Å²	113.9	93%	0.925	66%	0.656	S	S	*	*	S	Bend	trans	-152.5	11.6	135.6	-147.7	-168.5	-31.4	0	0	115.4
567	D	59.1	Low	60.3	Low	96 Å²	96	116.5 Å²	116.5	51%	0.513	65%	0.651	S	S	.	*			trans	-145.6	37.5	-159.6	-153.1	-2.4	0	0	0	116	R571	D567-R571 WeakPolarHBondContact O-CG 3.24Å; D567-R571 PolarHBondContact O-N 2.96Å; D567-R571 PolarHBondContact O-NE 3.15Å; D567-R571 PolarHBondContact O-NH1 2.62Å
568	D	70.1	Confident	62.4	Low	77 Å²	77	115.7 Å²	115.7	41%	0.412	64%	0.641	S	S	.	*	H	α-helix	trans	-80.2	-28.3	178.3	-71.6	-55.4	0	0	0	113.5	R571 I572	D568-R571 PolarHBondContact O-N 3.02Å; D568-R571 IonicContact OD1-CZ 2.82Å; D568-R571 VanDerWaalsContact OD1-CZ 3.22Å; D568-R571 IonicContact OD1-NE 2.84Å; D568-R571 PolarHBondContact OD1-NE 3.37Å; D568-R571 IonicContact OD1-NH2 2.89Å; D568-R571 PolarHBondContact OD1-NH2 2.9Å; D568-R571 IonicContact OD2-NH2 3.31Å; D568-R571 PolarHBondContact OD2-NH2 2.76Å; D568-I572 VanDerWaalsContact O-CG1 3.29Å; D568-I572 WeakPolarHBondContact O-CG1 3.48Å; D568-I572 PolarHBondContact O-N 2.8Å
569	A	69.2	Low	64.8	Low	82 Å²	82	112.3 Å²	112.3	68%	0.678	62%	0.62	S	S	*	*	H	α-helix	trans	-63.4	-46.9	173.4	0	0	0	0	0	111.9	R571 I572 A573	A569-R571 VanDerWaalsContact C-N 3.33Å; A569-R571 PolarHBondContact O-N 3.05Å; A569-I572 PolarHBondContact O-N 3.08Å; A569-I572 VanDerWaalsContact O-N 3.16Å; A569-A573 PolarHBondContact O-N 3.1Å
570	G	75.8	Confident	67.2	Low	36 Å²	36	112.3 Å²	112.3	37%	0.371	61%	0.614	S	S	.	*	H	α-helix	trans	-59.6	-41.9	174.9	0	0	0	0	0	112.3	I572 A573 A574	G570-I572 PolarHBondContact O-N 2.87Å; G570-A573 PolarHBondContact O-N 3.22Å; G570-A574 VanDerWaalsContact O-CB 3.31Å; G570-A574 WeakPolarHBondContact O-CB 3.3Å; G570-A574 PolarHBondContact O-N 3.04Å
571	R	76.7	Confident	69.4	Low	106 Å²	106	109.6 Å²	109.6	40%	0.4	60%	0.6	S	S	.	*	H	α-helix	trans	-64.4	-33.4	174.6	-74.9	-172.7	-77.3	-94.2	10.4	113.9	D567 D568 A569 R575	D567-R571 WeakPolarHBondContact O-CG 3.24Å; D567-R571 PolarHBondContact O-N 2.96Å; D567-R571 PolarHBondContact O-NE 3.15Å; D567-R571 PolarHBondContact O-NH1 2.62Å; D568-R571 PolarHBondContact O-N 3.02Å; D568-R571 IonicContact OD1-CZ 2.82Å; D568-R571 VanDerWaalsContact OD1-CZ 3.22Å; D568-R571 IonicContact OD1-NE 2.84Å; D568-R571 PolarHBondContact OD1-NE 3.37Å; D568-R571 IonicContact OD1-NH2 2.89Å; D568-R571 PolarHBondContact OD1-NH2 2.9Å; D568-R571 IonicContact OD2-NH2 3.31Å; D568-R571 PolarHBondContact OD2-NH2 2.76Å; A569-R571 VanDerWaalsContact C-N 3.33Å; A569-R571 PolarHBondContact O-N 3.05Å; R571-R575 VanDerWaalsContact O-CG 3.31Å; R571-R575 WeakPolarHBondContact O-CG 3.42Å; R571-R575 PolarHBondContact O-N 3.33Å; R571-R575 PolarHBondContact O-NH1 3.1Å
572	I	78.6	Confident	71.6	Confident	110 Å²	110	111.3 Å²	111.3	56%	0.564	59%	0.59	S	S	*	*	H	α-helix	trans	-73.7	-46.7	175.7	-69.3	163.5	0	0	0	110.2	D568 A569 G570 A574 R575 N576	D568-I572 VanDerWaalsContact O-CG1 3.29Å; D568-I572 WeakPolarHBondContact O-CG1 3.48Å; D568-I572 PolarHBondContact O-N 2.8Å; A569-I572 PolarHBondContact O-N 3.08Å; A569-I572 VanDerWaalsContact O-N 3.16Å; G570-I572 PolarHBondContact O-N 2.87Å; I572-A574 VanDerWaalsContact C-N 3.33Å; I572-A574 PolarHBondContact O-N 3.5Å; I572-R575 PolarHBondContact O-N 2.86Å; I572-N576 PolarHBondContact O-N 3.25Å
573	A	81.5	Confident	73.6	Confident	46 Å²	46	110.5 Å²	110.5	38%	0.38	58%	0.578	S	S	.	*	H	α-helix	trans	-59.5	-41.6	176.8	0	0	0	0	0	112.5	A569 G570 N576 R577	A569-A573 PolarHBondContact O-N 3.1Å; G570-A573 PolarHBondContact O-N 3.22Å; A573-N576 PolarHBondContact O-N 3.12Å; A573-R577 WeakPolarHBondContact O-CG 3.26Å; A573-R577 PolarHBondContact O-N 2.96Å
574	A	77.8	Confident	75.8	Confident	57 Å²	57	103.8 Å²	103.8	47%	0.471	56%	0.558	S	S	.	*	H	α-helix	trans	-63.1	-41.8	175.9	0	0	0	0	0	112.7	G570 I572 L578	G570-A574 VanDerWaalsContact O-CB 3.31Å; G570-A574 WeakPolarHBondContact O-CB 3.3Å; G570-A574 PolarHBondContact O-N 3.04Å; I572-A574 VanDerWaalsContact C-N 3.33Å; I572-A574 PolarHBondContact O-N 3.5Å; A574-L578 WeakPolarHBondContact O-CB 3.2Å; A574-L578 PolarHBondContact O-N 2.97Å
575	R	89	Confident	77.4	Confident	162 Å²	162	103.9 Å²	103.9	61%	0.611	55%	0.55	S	S	*	.	H	α-helix	trans	-65.6	-39.7	175.4	-73.4	177.9	-171.5	117.3	-8.3	112.2	R571 I572 L578 A579	R571-R575 VanDerWaalsContact O-CG 3.31Å; R571-R575 WeakPolarHBondContact O-CG 3.42Å; R571-R575 PolarHBondContact O-N 3.33Å; R571-R575 PolarHBondContact O-NH1 3.1Å; I572-R575 PolarHBondContact O-N 2.86Å; R575-L578 PolarHBondContact O-N 2.77Å; R575-A579 WeakPolarHBondContact O-CB 3.45Å; R575-A579 PolarHBondContact O-N 3.5Å
576	N	88.6	Confident	78.9	Confident	116 Å²	116	101.2 Å²	101.2	62%	0.62	53%	0.534	S	S	*	.	H	α-helix	trans	-64.6	-47.1	177.6	-164.4	-10.5	0	0	0	111.1	I572 A573 L578 A579 A580	I572-N576 PolarHBondContact O-N 3.25Å; A573-N576 PolarHBondContact O-N 3.12Å; N576-L578 VanDerWaalsContact C-N 3.31Å; N576-L578 PolarHBondContact O-N 2.97Å; N576-A579 WeakPolarHBondContact O-CB 3.49Å; N576-A579 PolarHBondContact O-N 2.93Å; N576-A579 VanDerWaalsContact O-N 3.1Å; N576-A580 PolarHBondContact O-N 2.77Å
577	R	89.1	Confident	80.1	Confident	191 Å²	191	97.4 Å²	97.4	72%	0.721	52%	0.517	S	S	*	.	H	α-helix	trans	-55.5	-42.8	172.4	-72	175.4	179.2	179.9	-0.3	112.5	A573 A580 I581	A573-R577 WeakPolarHBondContact O-CG 3.26Å; A573-R577 PolarHBondContact O-N 2.96Å; R577-A580 PolarHBondContact O-N 3.01Å; R577-I581 WeakPolarHBondContact O-CG1 3.2Å; R577-I581 PolarHBondContact O-N 3.36Å; R577-I581 VanDerWaalsContact O-N 3.12Å
578	L	86.5	Confident	81	Confident	125 Å²	125	101.1 Å²	101.1	65%	0.654	52%	0.524	S	S	*	.	H	α-helix	trans	-66.9	-36.1	177.6	-156.9	81.3	0	0	0	112.5	A574 R575 N576 K582	A574-L578 WeakPolarHBondContact O-CB 3.2Å; A574-L578 PolarHBondContact O-N 2.97Å; R575-L578 PolarHBondContact O-N 2.77Å; N576-L578 VanDerWaalsContact C-N 3.31Å; N576-L578 PolarHBondContact O-N 2.97Å; L578-K582 WeakPolarHBondContact O-CB 3.45Å; L578-K582 PolarHBondContact O-N 3.49Å
579	A	84.1	Confident	81.3	Confident	44 Å²	44	101.3 Å²	101.3	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-43.8	175.6	0	0	0	0	0	111.8	R575 N576 K582 N583	R575-A579 WeakPolarHBondContact O-CB 3.45Å; R575-A579 PolarHBondContact O-N 3.5Å; N576-A579 WeakPolarHBondContact O-CB 3.49Å; N576-A579 PolarHBondContact O-N 2.93Å; N576-A579 VanDerWaalsContact O-N 3.1Å; A579-K582 PolarHBondContact O-N 3.1Å; A579-N583 PolarHBondContact O-N 2.7Å; A579-N583 PolarHBondContact O-OD1 3.46Å
580	A	85.1	Confident	81.6	Confident	57 Å²	57	103.8 Å²	103.8	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-58.2	-48.8	174.8	0	0	0	0	0	111.8	N576 R577 K582 N583 A584	N576-A580 PolarHBondContact O-N 2.77Å; R577-A580 PolarHBondContact O-N 3.01Å; A580-K582 VanDerWaalsContact C-N 3.34Å; A580-K582 PolarHBondContact O-N 3.24Å; A580-N583 PolarHBondContact O-N 3.48Å; A580-N583 VanDerWaalsContact O-N 3.09Å; A580-A584 PolarHBondContact O-N 3.4Å
581	I	85.5	Confident	80.9	Confident	116 Å²	116	108.5 Å²	108.5	60%	0.595	53%	0.532	S	S	*	.	H	α-helix	trans	-59.7	-42.6	176.5	-66.4	165.1	0	0	0	111.3	R577 N583 A584 M585	R577-I581 WeakPolarHBondContact O-CG1 3.2Å; R577-I581 PolarHBondContact O-N 3.36Å; R577-I581 VanDerWaalsContact O-N 3.12Å; I581-N583 VanDerWaalsContact C-N 3.26Å; I581-N583 PolarHBondContact O-N 3.24Å; I581-A584 PolarHBondContact O-N 3.14Å; I581-M585 WeakPolarHBondContact O-CB 3.44Å; I581-M585 PolarHBondContact O-N 2.88Å
582	K	85.6	Confident	80.1	Confident	129 Å²	129	109.2 Å²	109.2	56%	0.561	54%	0.54	S	S	*	.	H	α-helix	trans	-70.6	-19.4	178	-158	-174.1	71.1	172.3	0	113.4	L578 A579 A580 R586	L578-K582 WeakPolarHBondContact O-CB 3.45Å; L578-K582 PolarHBondContact O-N 3.49Å; A579-K582 PolarHBondContact O-N 3.1Å; A580-K582 VanDerWaalsContact C-N 3.34Å; A580-K582 PolarHBondContact O-N 3.24Å; K582-R586 WeakPolarHBondContact O-CG 3.44Å; K582-R586 PolarHBondContact O-NE 3.25Å
583	N	83.7	Confident	79	Confident	84 Å²	84	110.1 Å²	110.1	45%	0.449	54%	0.541	S	S	.	.	H	α-helix	trans	-81.7	-52.2	172.5	-72.3	-3.1	0	0	0	110.1	A579 A580 I581 M585 R586 E587	A579-N583 PolarHBondContact O-N 2.7Å; A579-N583 PolarHBondContact O-OD1 3.46Å; A580-N583 PolarHBondContact O-N 3.48Å; A580-N583 VanDerWaalsContact O-N 3.09Å; I581-N583 VanDerWaalsContact C-N 3.26Å; I581-N583 PolarHBondContact O-N 3.24Å; N583-M585 VanDerWaalsContact C-N 3.27Å; N583-M585 PolarHBondContact O-N 3.47Å; N583-R586 PolarHBondContact O-N 3.02Å; N583-R586 PolarHBondContact OD1-NH2 3.14Å; N583-E587 PolarHBondContact O-N 3.23Å
584	A	83.3	Confident	77.6	Confident	49 Å²	49	115.5 Å²	115.5	41%	0.405	56%	0.558	S	S	.	*	H	α-helix	trans	-55.1	-39.8	175.7	0	0	0	0	0	112.8	A580 I581 R586 E587 R588	A580-A584 PolarHBondContact O-N 3.4Å; I581-A584 PolarHBondContact O-N 3.14Å; A584-R586 VanDerWaalsContact C-N 3.33Å; A584-R586 PolarHBondContact O-N 3.18Å; A584-E587 PolarHBondContact O-N 3.46Å; A584-R588 WeakPolarHBondContact O-CG 3.38Å; A584-R588 PolarHBondContact O-N 3.08Å
585	M	80.4	Confident	76.3	Confident	118 Å²	118	116 Å²	116	58%	0.581	56%	0.562	S	S	*	*	H	α-helix	trans	-60.2	-40.4	174.4	-170.8	74.1	-162.9	0	0	112.6	I581 N583 I589	I581-M585 WeakPolarHBondContact O-CB 3.44Å; I581-M585 PolarHBondContact O-N 2.88Å; N583-M585 VanDerWaalsContact C-N 3.27Å; N583-M585 PolarHBondContact O-N 3.47Å; M585-I589 HydrophobicContact CE-CD1 4.29Å; M585-I589 HydrophobicContact CG-CD1 4.31Å; M585-I589 WeakPolarHBondContact O-CD1 3.42Å; M585-I589 VanDerWaalsContact O-CG1 3.28Å; M585-I589 WeakPolarHBondContact O-CG1 3.04Å; M585-I589 PolarHBondContact O-N 3.16Å; M585-I589 VanDerWaalsContact O-N 3.14Å
586	R	78.5	Confident	74.4	Confident	126 Å²	126	116.4 Å²	116.4	48%	0.475	57%	0.571	S	S	.	*	H	α-helix	trans	-79.9	-26.7	-179.6	-71.1	-177.4	-68.1	166.5	6.4	112.8	K582 N583 A584 K590	K582-R586 WeakPolarHBondContact O-CG 3.44Å; K582-R586 PolarHBondContact O-NE 3.25Å; N583-R586 PolarHBondContact O-N 3.02Å; N583-R586 PolarHBondContact OD1-NH2 3.14Å; A584-R586 VanDerWaalsContact C-N 3.33Å; A584-R586 PolarHBondContact O-N 3.18Å; R586-K590 WeakPolarHBondContact O-CG 3.43Å; R586-K590 PolarHBondContact O-N 3.14Å; R586-K590 VanDerWaalsContact O-N 3.1Å
587	E	74.4	Confident	72.3	Confident	119 Å²	119	116.9 Å²	116.9	56%	0.556	58%	0.579	S	S	*	*	H	α-helix	trans	-68.8	-43.4	171.3	-171.2	167.4	-163.4	0	0	110.9	N583 A584 K590 Q591	N583-E587 PolarHBondContact O-N 3.23Å; A584-E587 PolarHBondContact O-N 3.46Å; E587-K590 PolarHBondContact O-N 3.49Å; E587-Q591 PolarHBondContact O-N 2.91Å
588	R	77.1	Confident	70.1	Confident	174 Å²	174	112.1 Å²	112.1	66%	0.657	58%	0.58	S	S	*	*	H	α-helix	trans	-59.3	-48.8	170.9	-73.1	-165.6	67.7	-175.3	-2.2	112.6	A584 K590 Q591 E592	A584-R588 WeakPolarHBondContact O-CG 3.38Å; A584-R588 PolarHBondContact O-N 3.08Å; R588-K590 VanDerWaalsContact C-N 3.25Å; R588-K590 PolarHBondContact O-N 3.36Å; R588-Q591 PolarHBondContact O-N 3.41Å; R588-Q591 VanDerWaalsContact O-N 3.09Å; R588-E592 WeakPolarHBondContact O-CB 3.39Å; R588-E592 PolarHBondContact O-N 3.06Å
589	I	76.1	Confident	67.7	Low	81 Å²	81	110.4 Å²	110.4	42%	0.415	58%	0.584	S	S	.	*	H	α-helix	trans	-57.2	-39.6	177.3	-69.4	163.1	0	0	0	111.2	M585 E592 E593	M585-I589 HydrophobicContact CE-CD1 4.29Å; M585-I589 HydrophobicContact CG-CD1 4.31Å; M585-I589 WeakPolarHBondContact O-CD1 3.42Å; M585-I589 VanDerWaalsContact O-CG1 3.28Å; M585-I589 WeakPolarHBondContact O-CG1 3.04Å; M585-I589 PolarHBondContact O-N 3.16Å; M585-I589 VanDerWaalsContact O-N 3.14Å; I589-E592 PolarHBondContact O-N 3.34Å; I589-E593 VanDerWaalsContact O-CB 3.28Å; I589-E593 WeakPolarHBondContact O-CB 3.25Å; I589-E593 PolarHBondContact O-N 2.75Å
590	K	75.9	Confident	65.5	Low	133 Å²	133	113.6 Å²	113.6	58%	0.578	60%	0.604	S	S	*	*	H	α-helix	trans	-69.2	-35.4	175.9	-77.2	-176.7	169.3	-154.5	0	113.9	R586 E587 R588 E592 H594	R586-K590 WeakPolarHBondContact O-CG 3.43Å; R586-K590 PolarHBondContact O-N 3.14Å; R586-K590 VanDerWaalsContact O-N 3.1Å; E587-K590 PolarHBondContact O-N 3.49Å; R588-K590 VanDerWaalsContact C-N 3.25Å; R588-K590 PolarHBondContact O-N 3.36Å; K590-E592 VanDerWaalsContact C-N 3.31Å; K590-H594 WeakPolarHBondContact O-CB 3.04Å; K590-H594 PolarHBondContact O-CD2 2.71Å; K590-H594 PolarHBondContact O-N 3.4Å; K590-H594 VanDerWaalsContact O-N 3.08Å
591	Q	62	Low	62.9	Low	136 Å²	136	116.3 Å²	116.3	64%	0.636	61%	0.614	S	S	*	*	H	α-helix	trans	-70.5	-31.1	174.2	-73.1	-178.8	-11.1	0	0	111.9	E587 R588 A595	E587-Q591 PolarHBondContact O-N 2.91Å; R588-Q591 PolarHBondContact O-N 3.41Å; R588-Q591 VanDerWaalsContact O-N 3.09Å; Q591-A595 PolarHBondContact O-N 3.41Å
592	E	58.3	Low	60.6	Low	121 Å²	121	118 Å²	118	57%	0.565	62%	0.623	S	S	*	*	H	α-helix	trans	-71.3	-46.6	174.5	-157.8	158.6	-155.4	0	0	110.5	R588 I589 K590 H594 A595	R588-E592 WeakPolarHBondContact O-CB 3.39Å; R588-E592 PolarHBondContact O-N 3.06Å; I589-E592 PolarHBondContact O-N 3.34Å; K590-E592 VanDerWaalsContact C-N 3.31Å; E592-H594 VanDerWaalsContact C-N 3.34Å; E592-H594 PolarHBondContact O-N 2.92Å; E592-A595 WeakPolarHBondContact O-CB 3.48Å; E592-A595 PolarHBondContact O-N 3.02Å
593	E	56.2	Low	58.6	Low	129 Å²	129	117.1 Å²	117.1	60%	0.603	63%	0.63	S	S	*	*	H	α-helix	trans	-60.4	-36.6	175.2	-173.1	172.9	-156.9	0	0	113.1	I589 A595	I589-E593 VanDerWaalsContact O-CB 3.28Å; I589-E593 WeakPolarHBondContact O-CB 3.25Å; I589-E593 PolarHBondContact O-N 2.75Å; E593-A595 VanDerWaalsContact C-N 3.33Å; E593-A595 PolarHBondContact O-N 3.07Å
594	H	51.3	Low	56.5	Low	158 Å²	158	123 Å²	123	73%	0.731	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-9.3	174.3	-80.3	-59.4	0	0	0	114.7	K590 E592	K590-H594 WeakPolarHBondContact O-CB 3.04Å; K590-H594 PolarHBondContact O-CD2 2.71Å; K590-H594 PolarHBondContact O-N 3.4Å; K590-H594 VanDerWaalsContact O-N 3.08Å; E592-H594 VanDerWaalsContact C-N 3.34Å; E592-H594 PolarHBondContact O-N 2.92Å
595	A	51.6	Low	54.4	Low	68 Å²	68	129 Å²	129	56%	0.562	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-31.6	-178.8	0	0	0	0	0	113.9	Q591 E592 E593 T597	Q591-A595 PolarHBondContact O-N 3.41Å; E592-A595 WeakPolarHBondContact O-CB 3.48Å; E592-A595 PolarHBondContact O-N 3.02Å; E593-A595 VanDerWaalsContact C-N 3.33Å; E593-A595 PolarHBondContact O-N 3.07Å; A595-T597 PolarHBondContact O-N 3.17Å
596	E	49.6	Very low	52.7	Low	171 Å²	171	128.7 Å²	128.7	80%	0.799	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-6.5	-174.3	-70.9	-166.6	130.1	0	0	115.1	A598	E596-A598 PolarHBondContact O-N 3.39Å
597	T	43.2	Very low	51.5	Low	126 Å²	126	129.2 Å²	129.2	77%	0.773	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	9.5	-173.7	-48.9	0	0	0	0	113.9	A595	A595-T597 PolarHBondContact O-N 3.17Å
598	A	43.9	Very low	50.6	Low	91 Å²	91	128.1 Å²	128.1	75%	0.752	68%	0.681	S	S	*	*	S	Bend	trans	-106.5	0.4	-164.9	0	0	0	0	0	117.1	E596	E596-A598 PolarHBondContact O-N 3.39Å
599	A	35.2	Very low	50	Low	88 Å²	88	124.2 Å²	124.2	73%	0.727	67%	0.672	S	S	*	*			trans	-148	114.5	172.2	0	0	0	0	0	110.3
600	S	38.7	Very low	48.8	Very low	112 Å²	112	123.2 Å²	123.2	78%	0.783	67%	0.67	S	S	*	*			cis	90.1	132.1	48.1	-179.3	0	0	0	0	113.3
601	V	31	Very low	48	Very low	114 Å²	114	124.4 Å²	124.4	69%	0.691	68%	0.675	S	S	*	*			cis	-161.3	133.3	-18.7	144.2	0	0	0	0	107.1
602	I	37.2	Very low	48	Very low	152 Å²	152	122.6 Å²	122.6	78%	0.779	67%	0.67	S	S	*	*			trans	30.2	143.1	142.7	-55.9	175	0	0	0	120.1
603	P	43.8	Very low	47.9	Very low	109 Å²	109	121.1 Å²	121.1	71%	0.708	68%	0.678	S	S	*	*			cis	-136	153.3	14.1	25.9	-2.1	0	0	0	119.3
604	K	39.6	Very low	48.5	Very low	209 Å²	209	118.6 Å²	118.6	91%	0.909	69%	0.687	S	S	*	*			trans	35.9	101.2	141.2	-60.2	-178.1	179.2	178.8	0	120.8
605	E	38.3	Very low	49.3	Very low	175 Å²	175	119.1 Å²	119.1	82%	0.818	69%	0.688	S	S	*	*				-121	169.3	123.8	-155.5	-179.1	154.9	0	0	108.1
606	V	44.4	Very low	49	Very low	110 Å²	110	122.6 Å²	122.6	67%	0.667	69%	0.69	S	S	*	*			trans	-82.2	129.4	-178.1	179.4	0	0	0	0	110.5	K608	V606-K608 PolarHBondContact O-N 3.47Å
607	D	53.3	Low	50.2	Low	138 Å²	138	120.8 Å²	120.8	74%	0.738	68%	0.676	S	S	*	*			trans	-58.8	100.2	173	-92.3	-33.6	0	0	0	111.6
608	K	56.3	Low	51.4	Low	96 Å²	96	119.2 Å²	119.2	42%	0.417	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.7	125.3	165.2	-55.1	177	-167.3	165.8	0	107.9	V606 V610 E619	V606-K608 PolarHBondContact O-N 3.47Å; K608-V610 PolarHBondContact O-N 3.14Å; K608-E619 HydrophobicContact CD-CB 4.24Å; K608-E619 WeakPolarHBondContact CD-OE2 3.32Å; K608-E619 IonicContact NZ-OE2 3.75Å; K608-E619 PolarHBondContact NZ-OE2 2.97Å
609	I	63.1	Low	52.8	Low	91 Å²	91	118.3 Å²	118.3	47%	0.467	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.4	103.2	167	-55.1	177.7	0	0	0	107.2	F611 I622	I609-F611 HydrophobicContact CG2-CD2 3.81Å; I609-F611 HydrophobicContact CG2-CE2 3.42Å; I609-F611 VanDerWaalsContact CG2-CE2 3.42Å; I609-F611 HydrophobicContact CG2-CZ 3.96Å; I609-I622 HydrophobicContact CD1-CD1 3.92Å; I609-I622 HydrophobicContact CD1-CG1 4.4Å; I609-I622 HydrophobicContact CG1-CD1 4Å; I609-I622 HydrophobicContact CG1-CG1 4.45Å
610	V	52.9	Low	53.4	Low	61 Å²	61	117.3 Å²	117.3	37%	0.37	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84	110.2	171.5	-176.3	0	0	0	0	108.2	K608 R617 E619	K608-V610 PolarHBondContact O-N 3.14Å; V610-R617 VanDerWaalsContact CG1-NH2 3.35Å; V610-E619 HydrophobicContact CG1-CG 4.37Å; V610-E619 HydrophobicContact CG2-CG 3.99Å
611	F	57.8	Low	54	Low	157 Å²	157	117.4 Å²	117.4	69%	0.689	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.5	103.9	163.9	-79	-77.4	0	0	0	108.8	I609 R617 V618	I609-F611 HydrophobicContact CG2-CD2 3.81Å; I609-F611 HydrophobicContact CG2-CE2 3.42Å; I609-F611 VanDerWaalsContact CG2-CE2 3.42Å; I609-F611 HydrophobicContact CG2-CZ 3.96Å; F611-R617 WeakPolarHBondContact O-CA 3.46Å; F611-V618 PolarHBondContact N-O 2.97Å; F611-V618 PolarHBondContact O-N 3.02Å
612	D	63	Low	55	Low	99 Å²	99	117.3 Å²	117.3	53%	0.529	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	122.6	169.8	-162.8	-32.9	0	0	0	109.5	G614 R617	D612-G614 PolarHBondContact OD1-N 3.14Å; D612-R617 HydrophobicContact CB-CG 4.01Å; D612-R617 VanDerWaalsContact CG-CG 3.46Å; D612-R617 VanDerWaalsContact OD2-CD 3.26Å; D612-R617 WeakPolarHBondContact OD2-CD 3.15Å; D612-R617 VanDerWaalsContact OD2-CG 3.26Å; D612-R617 WeakPolarHBondContact OD2-CG 3.5Å; D612-R617 IonicContact OD2-NE 2.87Å
613	A	54.8	Low	55.2	Low	89 Å²	89	118.4 Å²	118.4	74%	0.736	63%	0.625	S	S	*	*			trans	-115.2	20.9	177.1	0	0	0	0	0	112.5	F615 F616	A613-F615 PolarHBondContact O-N 3.3Å; A613-F616 PolarHBondContact N-O 3.27Å; A613-F616 VanDerWaalsContact N-O 3.08Å
614	G	69.9	Low	55	Low	76 Å²	76	117 Å²	117	78%	0.784	62%	0.623	S	S	*	*	S	Bend	trans	73.2	-15.9	176.8	0	0	0	0	0	115.8	D612	D612-G614 PolarHBondContact OD1-N 3.14Å
615	F	68.8	Low	54.8	Low	170 Å²	170	115.8 Å²	115.8	75%	0.746	62%	0.618	S	S	*	*	S	Bend	trans	-120.7	-26.5	174.3	-173	-134	0	0	0	113	A613	A613-F615 PolarHBondContact O-N 3.3Å
616	F	44.7	Very low	54.7	Low	141 Å²	141	113.1 Å²	113.1	62%	0.618	62%	0.619	S	S	*	*			trans	-141.3	150.6	172	-58.6	-64.3	0	0	0	110.7	A613	A613-F616 PolarHBondContact N-O 3.27Å; A613-F616 VanDerWaalsContact N-O 3.08Å
617	R	73.8	Confident	54.2	Low	133 Å²	133	111.3 Å²	111.3	50%	0.502	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.2	134.2	172.4	-68.5	173.7	72.7	-90.4	0.9	109.6	V610 F611 D612 E619	V610-R617 VanDerWaalsContact CG1-NH2 3.35Å; F611-R617 WeakPolarHBondContact O-CA 3.46Å; D612-R617 HydrophobicContact CB-CG 4.01Å; D612-R617 VanDerWaalsContact CG-CG 3.46Å; D612-R617 VanDerWaalsContact OD2-CD 3.26Å; D612-R617 WeakPolarHBondContact OD2-CD 3.15Å; D612-R617 VanDerWaalsContact OD2-CG 3.26Å; D612-R617 WeakPolarHBondContact OD2-CG 3.5Å; D612-R617 IonicContact OD2-NE 2.87Å; R617-E619 IonicContact CZ-OE1 2.7Å; R617-E619 VanDerWaalsContact CZ-OE1 3.27Å; R617-E619 IonicContact NH1-OE1 2.59Å; R617-E619 PolarHBondContact NH1-OE1 3.14Å; R617-E619 IonicContact NH2-OE1 3.13Å; R617-E619 PolarHBondContact NH2-OE1 3.04Å
618	V	69.4	Low	53.3	Low	92 Å²	92	113.3 Å²	113.3	56%	0.558	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-129	131.6	172.6	-176.8	0	0	0	0	109.1	F611	F611-V618 PolarHBondContact N-O 2.97Å; F611-V618 PolarHBondContact O-N 3.02Å
619	E	73.4	Confident	52.1	Low	72 Å²	72	113.6 Å²	113.6	34%	0.336	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.8	141.2	179.3	-46.5	-169.7	177.7	0	0	108.4	K608 V610 R617	K608-E619 HydrophobicContact CD-CB 4.24Å; K608-E619 WeakPolarHBondContact CD-OE2 3.32Å; K608-E619 IonicContact NZ-OE2 3.75Å; K608-E619 PolarHBondContact NZ-OE2 2.97Å; V610-E619 HydrophobicContact CG1-CG 4.37Å; V610-E619 HydrophobicContact CG2-CG 3.99Å; R617-E619 IonicContact CZ-OE1 2.7Å; R617-E619 VanDerWaalsContact CZ-OE1 3.27Å; R617-E619 IonicContact NH1-OE1 2.59Å; R617-E619 PolarHBondContact NH1-OE1 3.14Å; R617-E619 IonicContact NH2-OE1 3.13Å; R617-E619 PolarHBondContact NH2-OE1 3.04Å
620	S	47.5	Very low	50.6	Low	67 Å²	67	115.7 Å²	115.7	47%	0.469	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-146.5	130.6	177.5	-68.8	0	0	0	0	111.8
621	P	51.3	Low	49.5	Very low	115 Å²	115	117.9 Å²	117.9	75%	0.747	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.9	143.3	177	-16.9	31.2	0	0	0	112.9
622	I	51.3	Low	48.2	Very low	111 Å²	111	114.6 Å²	114.6	57%	0.569	68%	0.676	S	S	*	*			trans	-91	135.6	177.4	-47.3	175.5	0	0	0	110.2	I609	I609-I622 HydrophobicContact CD1-CD1 3.92Å; I609-I622 HydrophobicContact CD1-CG1 4.4Å; I609-I622 HydrophobicContact CG1-CD1 4Å; I609-I622 HydrophobicContact CG1-CG1 4.45Å
623	K	42.4	Very low	46.7	Very low	175 Å²	175	118.4 Å²	118.4	76%	0.761	69%	0.691	S	S	*	*			trans	-108.9	111.9	173.4	-171.4	171.2	-174.2	174.5	0	110.7	F625	K623-F625 HydrophobicContact CD-CE2 4.4Å; K623-F625 HydrophobicContact CG-CE2 4.39Å
624	A	38.9	Very low	45.5	Very low	79 Å²	79	117.1 Å²	117.1	65%	0.653	69%	0.687	S	S	*	*			trans	-93.1	151.4	179.6	0	0	0	0	0	112.6
625	F	36	Very low	44	Very low	184 Å²	184	120 Å²	120	81%	0.807	69%	0.691	S	S	*	*			trans	-141.7	136.7	162	-77.3	-72	0	0	0	108.5	K623	K623-F625 HydrophobicContact CD-CE2 4.4Å; K623-F625 HydrophobicContact CG-CE2 4.39Å
626	S	36.4	Very low	42.1	Very low	119 Å²	119	116.9 Å²	116.9	83%	0.832	69%	0.691	S	S	*	*			trans	-129.8	138.3	-169	-62.3	0	0	0	0	112.5
627	G	34.3	Very low	41.6	Very low	72 Å²	72	119.6 Å²	119.6	74%	0.742	71%	0.706	S	S	*	*			trans	82	127.2	147	0	0	0	0	0	118.7
628	I	33.5	Very low	39.6	Very low	180 Å²	180	123.5 Å²	123.5	92%	0.923	72%	0.72	S	S	*	*				-164.9	152.8	123.4	-97.8	156.9	0	0	0	107.2
629	S	30.6	Very low	37.7	Very low	103 Å²	103	126 Å²	126	72%	0.72	73%	0.73	S	S	*	*			trans	-151.2	176.4	-173	53.9	0	0	0	0	111.6
630	V	32.3	Very low	35.5	Very low	135 Å²	135	134 Å²	134	82%	0.818	76%	0.757	S	S	*	*			trans	89	124.9	162.6	-177.9	0	0	0	0	118.9
631	S	29.6	Very low	35	Very low	106 Å²	106	137 Å²	137	74%	0.741	77%	0.773	S	S	*	*			trans	81.6	122.2	143.9	-166.2	0	0	0	0	124.6
632	S	31.3	Very low	34.1	Very low	88 Å²	88	136.7 Å²	136.7	62%	0.615	77%	0.771	S	S	*	*			trans	60.3	164.4	133.7	-145.4	0	0	0	0	123.9
633	E	29.9	Very low	33	Very low	179 Å²	179	140.9 Å²	140.9	84%	0.836	79%	0.785	S	S	*	*			trans	60.1	142.2	166.4	-86.4	112.8	-114.6	0	0	121.1
634	G	31.1	Very low	32.3	Very low	63 Å²	63	137.2 Å²	137.2	65%	0.649	78%	0.782	S	S	*	*			trans	-104.4	176.7	158.6	0	0	0	0	0	110
635	P	37.2	Very low	31.8	Very low	135 Å²	135	139.6 Å²	139.6	88%	0.877	79%	0.788	S	S	*	*				-142.7	-174.3	73	39.7	-24.2	0	0	0	115.4
636	S	29.1	Very low	31.3	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	78%	0.784	S	S	*	*			trans	-58.4	139.1	176.5	176.3	0	0	0	0	114.3
637	Q	34.6	Very low	31.1	Very low	199 Å²	199	139.7 Å²	139.7	93%	0.93	79%	0.786	S	S	*	*			trans	-150.5	159.2	134.5	-116.2	174.6	65.6	0	0	111.7
638	R	30.7	Very low	30.8	Very low	215 Å²	215	140.8 Å²	140.8	81%	0.811	79%	0.788	S	S	*	*			trans	-141.7	140.3	-167.6	-144.2	-159.5	-170.3	-161.8	5	110.9
639	L	31.1	Very low	30.6	Very low	145 Å²	145	137.7 Å²	137.7	76%	0.759	78%	0.777	S	S	*	*			trans	61.9	113.6	165.1	-56.2	169.2	0	0	0	117.5
640	R	27.4	Very low	30.6	Very low	238 Å²	238	138.6 Å²	138.6	90%	0.898	78%	0.783	S	S	*	*				-169.6	140.2	103.8	-105.9	170.4	179.8	154.9	0.6	113.2
641	T	35.2	Very low	30.5	Very low	131 Å²	131	140.9 Å²	140.9	80%	0.804	79%	0.785	S	S	*	*			trans	-85.7	139.8	150.4	39.4	0	0	0	0	109.1
642	P	34.2	Very low	30.7	Very low	109 Å²	109	141.4 Å²	141.4	71%	0.708	79%	0.789	S	S	*	*				-103.1	161.1	118	-14.3	33	0	0	0	109.5
643	K	27.9	Very low	30.6	Very low	198 Å²	198	147 Å²	147	86%	0.861	80%	0.796	S	S	*	*				51	133.6	66.7	-73.2	-174.8	177.6	-176.4	0	112.8
644	S	26.7	Very low	30.7	Very low	99 Å²	99	143.7 Å²	143.7	69%	0.692	79%	0.793	S	S	*	*			cis	-174.8	153.5	2.1	40.4	0	0	0	0	113.2
645	V	28.1	Very low	30.6	Very low	129 Å²	129	147.3 Å²	147.3	78%	0.782	79%	0.793	S	S	*	*			trans	74.2	138.9	140.5	163.5	0	0	0	0	120.8
646	S	27.1	Very low	30.3	Very low	103 Å²	103	150.2 Å²	150.2	72%	0.72	80%	0.797	S	S	*	*			trans	92	124.4	151	68	0	0	0	0	123.4
647	K	31.6	Very low	30.2	Very low	201 Å²	201	148.4 Å²	148.4	87%	0.874	79%	0.794	S	S	*	*			trans	49.5	113.1	134.4	-67.2	-177	172.9	-178.1	0	122.5
648	A	28.7	Very low	30	Very low	96 Å²	96	147.1 Å²	147.1	79%	0.793	79%	0.793	S	S	*	*				-162.7	127.7	114.2	0	0	0	0	0	107.2
649	V	28.8	Very low	30.3	Very low	114 Å²	114	141.3 Å²	141.3	69%	0.691	78%	0.784	S	S	*	*			cis	93.2	110.3	45.3	171.7	0	0	0	0	113.6	Q651	V649-Q651 HydrophobicContact CG1-CG 4.49Å
650	S	29.2	Very low	30.2	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	78%	0.784	S	S	*	*			trans	-179.1	98.9	155.2	-75.8	0	0	0	0	106.6
651	Q	31.9	Very low	30.2	Very low	184 Å²	184	138.7 Å²	138.7	86%	0.86	78%	0.778	S	S	*	*				94.8	91.5	58.7	-83.1	-154.5	-6.2	0	0	115.8	V649	V649-Q651 HydrophobicContact CG1-CG 4.49Å
652	S	32.2	Very low	29.6	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	77%	0.771	S	S	*	*			trans	-167	118.5	143.5	45.9	0	0	0	0	105.6
653	R	30.2	Very low	29.1	Very low	207 Å²	207	139.2 Å²	139.2	78%	0.781	78%	0.779	S	S	*	*				54.9	120.3	66.4	-149	173.7	-163	177.5	6.8	111.7	E655	R653-E655 IonicContact CZ-OE2 3.5Å; R653-E655 VanDerWaalsContact CZ-OE2 3.31Å; R653-E655 IonicContact NE-OE2 3.56Å; R653-E655 PolarHBondContact NE-OE2 2.72Å; R653-E655 IonicContact NH2-OE1 2.65Å; R653-E655 IonicContact NH2-OE2 2.6Å; R653-E655 PolarHBondContact NH2-OE2 3.46Å
654	S	31.4	Very low	28.9	Very low	108 Å²	108	135 Å²	135	76%	0.755	78%	0.775	S	S	*	*			cis	-126.6	156.1	24.8	-56.8	0	0	0	0	112.2
655	E	28.6	Very low	29.6	Very low	140 Å²	140	135.2 Å²	135.2	65%	0.654	77%	0.773	S	S	*	*			cis	98.7	86.6	25.4	-169.1	167.9	-146.9	0	0	114.9	R653	R653-E655 IonicContact CZ-OE2 3.5Å; R653-E655 VanDerWaalsContact CZ-OE2 3.31Å; R653-E655 IonicContact NE-OE2 3.56Å; R653-E655 PolarHBondContact NE-OE2 2.72Å; R653-E655 IonicContact NH2-OE1 2.65Å; R653-E655 IonicContact NH2-OE2 2.6Å; R653-E655 PolarHBondContact NH2-OE2 3.46Å
656	M	31	Very low	29.5	Very low	196 Å²	196	136.8 Å²	136.8	97%	0.966	77%	0.772	S	S	*	*			trans	-176.6	152.9	153.4	-99.4	-67.3	-91.3	0	0	107.9
657	G	27.3	Very low	29.4	Very low	66 Å²	66	136.9 Å²	136.9	68%	0.68	77%	0.773	S	S	*	*			trans	170.6	-159.4	176.8	0	0	0	0	0	118.3
658	L	31	Very low	29.1	Very low	172 Å²	172	131.7 Å²	131.7	90%	0.901	77%	0.767	S	S	*	*			trans	76.4	158.7	176.1	-67	166.4	0	0	0	117.3
659	P	37.4	Very low	28.9	Very low	94 Å²	94	130.4 Å²	130.4	61%	0.61	76%	0.763	S	S	*	*			cis	-133.9	159.1	-12.4	26.5	-4.9	0	0	0	116.9
660	Q	28.2	Very low	29.7	Very low	166 Å²	166	130.4 Å²	130.4	78%	0.776	77%	0.765	S	S	*	*			trans	66	166.3	147.2	-70.5	175.6	35.8	0	0	118.7
661	Q	27.3	Very low	29.6	Very low	162 Å²	162	131.7 Å²	131.7	76%	0.757	76%	0.758	S	S	*	*			cis	-140.8	172.1	-1	-141.7	175	80.9	0	0	112.5
662	T	21.8	Very low	29.3	Very low	110 Å²	110	129.1 Å²	129.1	68%	0.675	75%	0.75	S	S	*	*			trans	-98.5	153.5	178.3	48.6	0	0	0	0	113
663	T	24.5	Very low	29.1	Very low	141 Å²	141	128.3 Å²	128.3	87%	0.865	74%	0.74	S	S	*	*				169.2	156.3	119.2	38.7	0	0	0	0	114.9
664	S	23.5	Very low	29	Very low	110 Å²	110	127 Å²	127	77%	0.769	74%	0.741	S	S	*	*			trans	-112.5	-170.8	160.2	-135.9	0	0	0	0	107.8
665	P	42.3	Very low	28.9	Very low	102 Å²	102	127 Å²	127	66%	0.662	74%	0.74	S	S	*	*			cis	-125.7	-139	6.9	28.7	-0.3	0	0	0	111.4
666	E	24.9	Very low	28.7	Very low	163 Å²	163	128.6 Å²	128.6	76%	0.762	75%	0.748	S	S	*	*			cis	-156.5	-101.7	8.3	-165.6	57.1	86.5	0	0	114.4
667	S	24.7	Very low	29.3	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	74%	0.735	S	S	*	*			trans	-153.2	179.6	-164.3	67.1	0	0	0	0	111.2
668	A	27	Very low	29.3	Very low	92 Å²	92	126.6 Å²	126.6	76%	0.76	74%	0.735	S	S	*	*			cis	-142.2	-178.5	5.8	0	0	0	0	0	108.8
669	G	23.6	Very low	29.3	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	73%	0.728	S	S	*	*			cis	89.7	150.6	24.1	0	0	0	0	0	112.4
670	P	44.9	Very low	29	Very low	114 Å²	114	131 Å²	131	74%	0.74	74%	0.737	S	S	*	*			cis	-144.3	-151.5	-6.4	41.9	-19.5	0	0	0	114.9
671	Q	28.3	Very low	29	Very low	150 Å²	150	129.4 Å²	129.4	70%	0.701	74%	0.739	S	S	*	*			trans	86.5	120.1	172.9	-46.2	-58.6	-4.3	0	0	116.7
672	N	25.3	Very low	29.1	Very low	129 Å²	129	128 Å²	128	69%	0.69	74%	0.736	S	S	*	*			cis	81.1	131.7	45.3	-72.8	-43.1	0	0	0	114.2
673	T	28.6	Very low	29.3	Very low	99 Å²	99	130.9 Å²	130.9	61%	0.607	74%	0.739	S	S	*	*			cis	-141.8	-161.7	7.6	1.3	0	0	0	0	109.8
674	K	28	Very low	29.4	Very low	181 Å²	181	130.5 Å²	130.5	79%	0.787	73%	0.731	S	S	*	*			cis	-162.8	-177.3	16.7	-126.8	140	-155.1	124.7	0	107.2
675	S	28.1	Very low	29.7	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	73%	0.726	S	S	*	*			cis	-152.7	-156.2	1.5	59.5	0	0	0	0	110.2
676	E	25.6	Very low	29.3	Very low	174 Å²	174	132.6 Å²	132.6	81%	0.813	73%	0.727	S	S	*	*			trans	-131.7	-171.2	175.1	-56	-169.6	91	0	0	110
677	P	42.3	Very low	29.6	Very low	108 Å²	108	130.8 Å²	130.8	70%	0.701	73%	0.729	S	S	*	*			cis	-146.4	159.2	3.5	40.8	-19.2	0	0	0	121
678	V	28.1	Very low	30	Very low	112 Å²	112	134.6 Å²	134.6	68%	0.679	74%	0.736	S	S	*	*			trans	87	118.5	131.5	155.9	0	0	0	0	125.2
679	K	30.6	Very low	30.1	Very low	174 Å²	174	135.2 Å²	135.2	76%	0.757	73%	0.734	S	S	*	*			trans	77.5	112.1	143.6	-76.4	168.5	-155.5	161	0	125.6
680	K	32	Very low	30.5	Very low	186 Å²	186	142.5 Å²	142.5	81%	0.809	74%	0.741	S	S	*	*				73.3	157.8	121.7	-71.6	-171.8	173.1	-169.3	0	123.4
681	T	26.8	Very low	29.7	Very low	131 Å²	131	144 Å²	144	80%	0.804	74%	0.742	S	S	*	*			trans	91.6	143	157.7	-34.7	0	0	0	0	115.7
682	L	29.5	Very low	29.9	Very low	132 Å²	132	140.9 Å²	140.9	69%	0.691	74%	0.737	S	S	*	*			cis	-168.6	153.8	-45.9	-107	174.6	0	0	0	109.2
683	F	26.8	Very low	30.2	Very low	172 Å²	172	142.1 Å²	142.1	75%	0.754	74%	0.742	S	S	*	*			trans	75.7	139.9	144	-85	-45.3	0	0	0	127.2
684	L	27.2	Very low	30.2	Very low	132 Å²	132	142.6 Å²	142.6	69%	0.691	75%	0.745	S	S	*	*			trans	90	111.6	136.6	-72	165	0	0	0	124.7
685	N	28.3	Very low	30.4	Very low	125 Å²	125	142 Å²	142	67%	0.668	75%	0.745	S	S	*	*				59.8	131.4	122	-70.6	16.6	0	0	0	126.1
686	I	34	Very low	30.5	Very low	132 Å²	132	143.9 Å²	143.9	68%	0.677	75%	0.747	S	S	*	*				56.6	137.7	127.2	-55.3	168.5	0	0	0	120.1
687	P	32.6	Very low	30.7	Very low	125 Å²	125	139.8 Å²	139.8	81%	0.812	74%	0.742	S	S	*	*			trans	-126	133.4	139.8	36.1	-25.5	0	0	0	114.3
688	E	31.6	Very low	30	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.864	75%	0.747	S	S	*	*			trans	-115.1	136.7	154.9	-82.2	-173	127.5	0	0	108.9
689	S	29.1	Very low	29.8	Very low	105 Å²	105	142.9 Å²	142.9	73%	0.734	75%	0.751	S	S	*	*			trans	-172.4	150.5	166.5	58.3	0	0	0	0	111.1
690	R	33.4	Very low	30.3	Very low	220 Å²	220	140.7 Å²	140.7	83%	0.83	76%	0.755	S	S	*	*			cis	-164.7	165.6	-14.6	-104.8	178.6	175.2	179.5	-3.9	105.7
691	N	28.1	Very low	29.9	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	76%	0.755	S	S	*	*				167.1	155.4	99.3	-86	-24.1	0	0	0	108.3
692	S	31.8	Very low	30.1	Very low	85 Å²	85	136.8 Å²	136.8	59%	0.594	76%	0.756	S	S	*	*			cis	173.9	173.8	-22.4	52.9	0	0	0	0	109.5
693	I	30.8	Very low	30.5	Very low	156 Å²	156	135.6 Å²	135.6	80%	0.8	76%	0.756	S	S	*	*			trans	76.2	143.8	163.7	-96	160.6	0	0	0	115
694	V	29.6	Very low	30.5	Very low	109 Å²	109	133.9 Å²	133.9	66%	0.661	75%	0.754	S	S	*	*			cis	-172	147.5	-22.3	110.9	0	0	0	0	107
695	E	32.6	Very low	30.5	Very low	167 Å²	167	134.3 Å²	134.3	78%	0.78	76%	0.757	S	S	*	*			cis	-131.6	-84.3	-17	-158.9	78.6	-53.2	0	0	112
696	D	28.8	Very low	30.8	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	76%	0.762	S	S	*	*			cis	-161.5	162	-16	-173.4	31.9	0	0	0	111.8
697	A	30.7	Very low	30.5	Very low	87 Å²	87	138.5 Å²	138.5	72%	0.719	77%	0.773	S	S	*	*			trans	60.4	149.2	164.7	0	0	0	0	0	121.2
698	Q	26.7	Very low	30.5	Very low	173 Å²	173	140.4 Å²	140.4	81%	0.808	77%	0.771	S	S	*	*			trans	-154.5	130.2	-162.3	176.2	178.1	-4	0	0	114.5
699	C	25.1	Very low	30.4	Very low	113 Å²	113	138.5 Å²	138.5	76%	0.764	77%	0.766	S	S	*	*			trans	62.6	179.8	163.9	-68.2	0	0	0	0	115.7
700	P	40.4	Very low	30.7	Very low	128 Å²	128	141.2 Å²	141.2	83%	0.831	77%	0.767	S	S	*	*			cis	-130.7	173.6	-2.2	42.1	-26.8	0	0	0	116.3
701	G	24.8	Very low	30.6	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	76%	0.764	S	S	*	*			trans	111.7	131	139.9	0	0	0	0	0	119.3
702	L	30.6	Very low	30.9	Very low	157 Å²	157	135.6 Å²	135.6	82%	0.822	76%	0.757	S	S	*	*			trans	-133.6	140.8	152.3	-111.6	160.9	0	0	0	104.7
703	P	37.6	Very low	31.1	Very low	107 Å²	107	138.5 Å²	138.5	70%	0.695	77%	0.766	S	S	*	*				-124.1	174.9	77.2	40	-29.1	0	0	0	111.6
704	D	25.9	Very low	31.2	Very low	135 Å²	135	139.9 Å²	139.9	72%	0.722	77%	0.766	S	S	*	*			cis	-158.9	-171.8	46.7	-128.3	-37.7	0	0	0	116.5
705	L	28.6	Very low	31.4	Very low	142 Å²	142	139.5 Å²	139.5	74%	0.743	76%	0.764	S	S	*	*			trans	-43.7	134.4	-171.1	-70.1	153.7	0	0	0	121.1
706	I	33.6	Very low	31.2	Very low	153 Å²	153	137.4 Å²	137.4	79%	0.785	76%	0.758	S	S	*	*			trans	10.7	125.6	131.1	-53.5	165.3	0	0	0	119.1
707	E	28.4	Very low	31.3	Very low	191 Å²	191	136.8 Å²	136.8	89%	0.893	75%	0.754	S	S	*	*				-161.4	159	121.9	-159.2	148.1	-148.5	0	0	112
708	E	33	Very low	31.2	Very low	165 Å²	165	140 Å²	140	77%	0.771	75%	0.752	S	S	*	*			trans	-93.2	157.3	177.4	-60.9	175.2	109.9	0	0	112.2
709	N	29.2	Very low	31.4	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	75%	0.751	S	S	*	*				173.5	-177.6	117.2	-98.3	-80	0	0	0	115.7
710	H	34.8	Very low	31.4	Very low	163 Å²	163	137 Å²	137	76%	0.755	74%	0.739	S	S	*	*			trans	-100	138.5	-160.2	-76.3	-95	0	0	0	117.5
711	D	31	Very low	30.9	Very low	144 Å²	144	135.7 Å²	135.7	77%	0.77	73%	0.731	S	S	*	*				61.9	149.4	117.2	-146.6	9.4	0	0	0	124.3
712	V	35.2	Very low	31.4	Very low	103 Å²	103	139.6 Å²	139.6	62%	0.624	73%	0.733	S	S	*	*			trans	70.7	100.6	160.5	-158.2	0	0	0	0	124
713	N	36.4	Very low	32.2	Very low	146 Å²	146	137.6 Å²	137.6	78%	0.781	73%	0.729	S	S	*	*			trans	47.6	130	133.8	-57.5	-33.7	0	0	0	127.5
714	K	32.5	Very low	31.8	Very low	185 Å²	185	136.6 Å²	136.6	80%	0.804	73%	0.725	S	S	*	*				91.1	129.6	126.7	-92.2	-169.7	171.5	-178.7	0	126.1
715	T	33.7	Very low	31.8	Very low	100 Å²	100	138.9 Å²	138.9	61%	0.613	73%	0.731	S	S	*	*			trans	90.3	138.4	136.3	48.7	0	0	0	0	125.4
716	N	29.4	Very low	31.8	Very low	123 Å²	123	134.8 Å²	134.8	66%	0.658	72%	0.723	S	S	*	*			trans	75.7	153.2	148.6	-67.8	-14.1	0	0	0	119.9
717	L	30.7	Very low	31.5	Very low	135 Å²	135	136.5 Å²	136.5	71%	0.707	73%	0.73	S	S	*	*			cis	-164.3	147.6	-3.8	-122.5	167.7	0	0	0	112.5
718	K	27.7	Very low	31.3	Very low	154 Å²	154	132.6 Å²	132.6	67%	0.67	72%	0.723	S	S	*	*			trans	54.1	174.3	153.5	-103.3	-175.7	166.4	-148	0	117.7	D720	K718-D720 WeakPolarHBondContact CE-OD1 3.27Å; K718-D720 VanDerWaalsContact CE-OD2 3.27Å; K718-D720 WeakPolarHBondContact CE-OD2 3.42Å; K718-D720 IonicContact NZ-OD1 3.43Å; K718-D720 PolarHBondContact NZ-OD1 3.43Å; K718-D720 IonicContact NZ-OD2 2.7Å; K718-D720 PolarHBondContact NZ-OD2 2.7Å
719	V	30.2	Very low	30.9	Very low	128 Å²	128	132.5 Å²	132.5	78%	0.776	73%	0.727	S	S	*	*			cis	-140.5	175.6	15.5	-92	0	0	0	0	108.4
720	D	25.1	Very low	32	Very low	96 Å²	96	130.8 Å²	130.8	51%	0.513	72%	0.724	S	S	.	*			cis	178.2	168.7	-35.5	-90.6	-8.4	0	0	0	105.6	K718	K718-D720 WeakPolarHBondContact CE-OD1 3.27Å; K718-D720 VanDerWaalsContact CE-OD2 3.27Å; K718-D720 WeakPolarHBondContact CE-OD2 3.42Å; K718-D720 IonicContact NZ-OD1 3.43Å; K718-D720 PolarHBondContact NZ-OD1 3.43Å; K718-D720 IonicContact NZ-OD2 2.7Å; K718-D720 PolarHBondContact NZ-OD2 2.7Å
721	C	30.6	Very low	31.5	Very low	100 Å²	100	130.9 Å²	130.9	68%	0.676	73%	0.73	S	S	*	*			cis	-175.6	174.1	-28.9	-96.3	0	0	0	0	108.1
722	L	35.5	Very low	31.2	Very low	159 Å²	159	131 Å²	131	83%	0.832	73%	0.73	S	S	*	*			trans	73.9	172.9	151.9	-75.7	-179.2	0	0	0	119.9
723	P	47.8	Very low	30.7	Very low	116 Å²	116	130.9 Å²	130.9	75%	0.753	74%	0.739	S	S	*	*			cis	-110.7	-177.7	2.1	44.9	-34.3	0	0	0	113.5
724	S	28.7	Very low	30.2	Very low	85 Å²	85	128 Å²	128	59%	0.594	74%	0.744	S	S	*	*			cis	-162.5	174	-3.2	-123	0	0	0	0	107.4
725	E	26.5	Very low	29.9	Very low	184 Å²	184	122.7 Å²	122.7	86%	0.86	74%	0.741	S	S	*	*			cis	-159.9	-158.8	-7.2	-132.7	163.1	110.1	0	0	106.9
726	G	28.1	Very low	29.5	Very low	55 Å²	55	124.9 Å²	124.9	57%	0.567	75%	0.754	S	S	*	*			cis	163.2	145.6	-2.4	0	0	0	0	0	112
727	M	26.2	Very low	29.6	Very low	190 Å²	190	122.6 Å²	122.6	94%	0.936	75%	0.753	S	S	*	*			trans	57.1	142.5	178.8	-70.7	-178.7	158.9	0	0	118.5
728	S	26	Very low	29.6	Very low	108 Å²	108	123.3 Å²	123.3	76%	0.755	76%	0.757	S	S	*	*			cis	-165.8	150.8	-20.5	46.6	0	0	0	0	111.1
729	L	23.3	Very low	29.7	Very low	163 Å²	163	122.5 Å²	122.5	85%	0.853	76%	0.76	S	S	*	*			trans	-89.1	-172.5	167.1	-72.2	168.7	0	0	0	110.6
730	P	52.5	Low	29.9	Very low	109 Å²	109	123.5 Å²	123.5	71%	0.708	76%	0.759	S	S	*	*				-125.2	-161.6	-58.4	38.7	-23.1	0	0	0	110.2
731	L	24.3	Very low	30.1	Very low	166 Å²	166	124.5 Å²	124.5	87%	0.869	77%	0.765	S	S	*	*			trans	163.2	174.9	150.1	-88.2	160.8	0	0	0	107.7
732	L	24.9	Very low	30	Very low	147 Å²	147	124.6 Å²	124.6	77%	0.77	76%	0.762	S	S	*	*				172.3	114	-58.2	176.1	129.2	0	0	0	107.1
733	A	24.8	Very low	29.8	Very low	100 Å²	100	123.8 Å²	123.8	83%	0.826	76%	0.759	S	S	*	*			trans	57.5	140.5	160.1	0	0	0	0	0	122.2
734	G	26.3	Very low	28.9	Very low	86 Å²	86	126.9 Å²	126.9	89%	0.887	76%	0.761	S	S	*	*			trans	107.8	145.5	167.3	0	0	0	0	0	115.1
735	G	25.6	Very low	29.1	Very low	72 Å²	72	130.4 Å²	130.4	74%	0.742	77%	0.765	S	S	*	*			cis	162.2	97	-12.9	0	0	0	0	0	116.6
736	V	26.2	Very low	29.3	Very low	146 Å²	146	128.8 Å²	128.8	89%	0.885	76%	0.758	S	S	*	*			trans	71.4	150.4	153.8	-177.1	0	0	0	0	118.8
737	A	30.1	Very low	29.4	Very low	76 Å²	76	129.2 Å²	129.2	63%	0.628	76%	0.762	S	S	*	*			trans	70.6	147.2	166	0	0	0	0	0	119.1
738	D	31.7	Very low	29.5	Very low	149 Å²	149	127.4 Å²	127.4	80%	0.797	76%	0.755	S	S	*	*			cis	-158.9	130.1	-18.3	-94.9	-23.1	0	0	0	106.6
739	D	28.8	Very low	29.6	Very low	138 Å²	138	127 Å²	127	74%	0.738	75%	0.752	S	S	*	*				84.3	-178.8	91.9	-159	16	0	0	0	114.3
740	I	34.8	Very low	29.8	Very low	148 Å²	148	126.3 Å²	126.3	76%	0.759	75%	0.749	S	S	*	*			trans	93.9	90.3	-174.1	-55.7	175.4	0	0	0	113.4
741	N	29.7	Very low	28.6	Very low	118 Å²	118	127.4 Å²	127.4	63%	0.631	75%	0.753	S	S	*	*				71.2	101.9	91.6	-83.5	-36.4	0	0	0	116.1
742	T	27.3	Very low	28.8	Very low	101 Å²	101	125 Å²	125	62%	0.62	75%	0.745	S	S	*	*				78.4	125.1	80.8	62.7	0	0	0	0	117.3
743	N	31.3	Very low	29	Very low	142 Å²	142	126.7 Å²	126.7	76%	0.759	75%	0.749	S	S	*	*				-167.2	140.2	121.6	-90	-43.5	0	0	0	106.8
744	K	29.5	Very low	29.1	Very low	182 Å²	182	124.6 Å²	124.6	79%	0.791	74%	0.737	S	S	*	*				60.8	136.4	57.8	-62.8	-179.5	178.3	172.4	0	111
745	K	33.2	Very low	29.1	Very low	159 Å²	159	128.4 Å²	128.4	69%	0.691	73%	0.734	S	S	*	*			cis	-163.1	169.6	24.7	-154.8	179.9	168	-141.2	0	110.6
746	E	30.1	Very low	29.3	Very low	150 Å²	150	133 Å²	133	70%	0.701	74%	0.736	S	S	*	*			trans	63.9	153.2	161.8	-77.2	135.4	-179.6	0	0	119
747	G	30.2	Very low	29.5	Very low	63 Å²	63	132.3 Å²	132.3	65%	0.649	73%	0.726	S	S	*	*			cis	177.3	135.4	-10.9	0	0	0	0	0	116.1
748	I	28.4	Very low	29.5	Very low	153 Å²	153	134.6 Å²	134.6	79%	0.785	73%	0.728	S	S	*	*				65.5	107.1	127	-63	171.7	0	0	0	119.9
749	S	27.9	Very low	29.3	Very low	99 Å²	99	132 Å²	132	69%	0.692	72%	0.721	S	S	*	*			trans	52.3	119.6	134.4	83	0	0	0	0	120.8
750	D	27.6	Very low	29.3	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	72%	0.721	S	S	*	*				98	177.6	80.8	-166.3	13.6	0	0	0	110.8
751	V	27.2	Very low	29	Very low	133 Å²	133	131.1 Å²	131.1	81%	0.806	73%	0.725	S	S	*	*			trans	80.4	139.9	-167	-177.6	0	0	0	0	113.1
752	V	29.7	Very low	29	Very low	114 Å²	114	130.6 Å²	130.6	69%	0.691	73%	0.726	S	S	*	*			cis	179.2	173.4	-35.9	126.6	0	0	0	0	106.5
753	E	29.2	Very low	29.1	Very low	183 Å²	183	130.7 Å²	130.7	86%	0.855	73%	0.731	S	S	*	*			trans	69.5	149.5	176.6	-78	176.6	137.9	0	0	116.9
754	G	25.5	Very low	29.1	Very low	56 Å²	56	131.1 Å²	131.1	58%	0.577	73%	0.728	S	S	*	*			cis	161.2	139.7	-7	0	0	0	0	0	112.7
755	M	27.6	Very low	29	Very low	167 Å²	167	128.8 Å²	128.8	82%	0.823	73%	0.725	S	S	*	*			trans	62.6	131.5	177.4	-65.3	71.4	175.4	0	0	115.3
756	E	28.7	Very low	28.8	Very low	169 Å²	169	126.8 Å²	126.8	79%	0.79	73%	0.726	S	S	*	*			cis	81.9	149.3	18.2	-146.8	-171.6	-130	0	0	116.4
757	L	32	Very low	28.7	Very low	130 Å²	130	126.2 Å²	126.2	68%	0.681	73%	0.727	S	S	*	*			trans	76.4	141.5	171.4	-49.6	179.9	0	0	0	115.9
758	N	28.7	Very low	28.6	Very low	124 Å²	124	130.9 Å²	130.9	66%	0.663	73%	0.733	S	S	*	*			cis	-144.2	153.5	-3.1	-102	-44.3	0	0	0	107.8
759	S	28	Very low	28.6	Very low	94 Å²	94	127.8 Å²	127.8	66%	0.657	73%	0.725	S	S	*	*				63.9	141	56.4	121.9	0	0	0	0	113.1
760	S	28.5	Very low	28.7	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	73%	0.73	S	S	*	*			cis	-158.7	156.7	-0.8	-70.3	0	0	0	0	109.3
761	I	29.5	Very low	30.1	Very low	164 Å²	164	126.3 Å²	126.3	84%	0.841	72%	0.724	S	S	*	*			trans	-153.9	146.3	152.2	-126.7	167.3	0	0	0	116.5
762	T	28.7	Very low	30.1	Very low	107 Å²	107	129.1 Å²	129.1	66%	0.656	73%	0.728	S	S	*	*			trans	-31.6	142	178.3	51.9	0	0	0	0	121.8
763	S	30.8	Very low	30.3	Very low	103 Å²	103	131.4 Å²	131.4	72%	0.72	73%	0.729	S	S	*	*				57	161.6	120	-38.2	0	0	0	0	120
764	Q	29.7	Very low	30.2	Very low	150 Å²	150	129.5 Å²	129.5	70%	0.701	73%	0.725	S	S	*	*			cis	-163.1	152.6	20.8	-174.5	131.9	-20.3	0	0	112.2
765	D	27.3	Very low	30.3	Very low	133 Å²	133	132.9 Å²	132.9	71%	0.711	74%	0.735	S	S	*	*			trans	60.5	146	151.4	-72.3	-10.4	0	0	0	120.5
766	V	28.7	Very low	30.3	Very low	118 Å²	118	129.7 Å²	129.7	72%	0.715	73%	0.734	S	S	*	*			cis	-152.4	167.9	-7.7	104.6	0	0	0	0	111.9
767	L	29.6	Very low	30.4	Very low	138 Å²	138	126.1 Å²	126.1	72%	0.723	73%	0.728	S	S	*	*			trans	-56.9	166.6	172.3	-68	84.7	0	0	0	113.1
768	M	27.5	Very low	30.4	Very low	160 Å²	160	127.3 Å²	127.3	79%	0.788	73%	0.73	S	S	*	*				178.6	152.8	75.9	-76	-68	-81.1	0	0	108.4
769	S	27.3	Very low	30.4	Very low	88 Å²	88	127.5 Å²	127.5	62%	0.615	73%	0.731	S	S	*	*			cis	-172.8	139.6	-13.8	50.9	0	0	0	0	110.4
770	S	31.6	Very low	30.5	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	73%	0.728	S	S	*	*			trans	-82.2	-173	153.5	-42.4	0	0	0	0	109.2
771	P	56.5	Low	30.7	Very low	103 Å²	103	129.1 Å²	129.1	67%	0.669	73%	0.73	S	S	*	*			cis	-134.6	178.4	-13.2	42	-27.1	0	0	0	113.7
772	E	26.6	Very low	30.9	Very low	192 Å²	192	127.9 Å²	127.9	90%	0.897	72%	0.724	S	S	*	*			trans	-166.3	149	146.9	-117.9	168	-152.2	0	0	109.7
773	K	33.4	Very low	31	Very low	163 Å²	163	130.3 Å²	130.3	71%	0.709	73%	0.728	S	S	*	*			cis	-179.4	122.8	-47.9	-120.6	-174.8	176.5	178.2	0	105.7
774	N	28.3	Very low	30.9	Very low	143 Å²	143	135 Å²	135	77%	0.765	74%	0.738	S	S	*	*			trans	65.1	166.5	155	-52.5	-18.4	0	0	0	116.4
775	T	27.9	Very low	30.9	Very low	127 Å²	127	131 Å²	131	78%	0.779	74%	0.738	S	S	*	*			cis	-137.2	153.8	14.9	47.5	0	0	0	0	113.9
776	A	27	Very low	30.9	Very low	99 Å²	99	132.5 Å²	132.5	82%	0.818	74%	0.74	S	S	*	*			trans	63.5	159.1	143.9	0	0	0	0	0	120.8
777	S	31.8	Very low	30.9	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	74%	0.736	S	S	*	*			cis	-176.5	-175.4	-28.4	-169.7	0	0	0	0	107.5
778	Q	30.7	Very low	31	Very low	155 Å²	155	132.3 Å²	132.3	72%	0.724	73%	0.733	S	S	*	*			trans	78.8	100.8	179.7	-48.4	-67.6	-21.8	0	0	113.2
779	N	29.3	Very low	31.1	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	73%	0.732	S	S	*	*				78.6	137.1	66.5	-67.9	-21.8	0	0	0	112.8
780	S	29.6	Very low	31.1	Very low	85 Å²	85	132.8 Å²	132.8	59%	0.594	74%	0.738	S	S	*	*			cis	176.9	156.1	-10.8	50.7	0	0	0	0	110
781	I	32.8	Very low	30.8	Very low	148 Å²	148	135.4 Å²	135.4	76%	0.759	74%	0.738	S	S	*	*			trans	66.8	148.3	141.8	-75.7	165.4	0	0	0	117.3
782	L	33.8	Very low	29.4	Very low	137 Å²	137	135.5 Å²	135.5	72%	0.717	74%	0.741	S	S	*	*			cis	-163.2	-174.6	-23.8	-88.5	174.2	0	0	0	105.5
783	E	30.3	Very low	29.4	Very low	158 Å²	158	132.4 Å²	132.4	74%	0.738	74%	0.735	S	S	*	*				-165.1	-154.4	-67	-133.3	66.5	-98.8	0	0	108.2
784	E	29.3	Very low	29	Very low	202 Å²	202	130.9 Å²	130.9	94%	0.944	73%	0.734	S	S	*	*			trans	66.5	155.8	173.7	-60.3	-175.3	148.6	0	0	117.3
785	G	28.7	Very low	28.9	Very low	67 Å²	67	132.4 Å²	132.4	69%	0.691	73%	0.734	S	S	*	*			cis	177.4	157.7	-8.2	0	0	0	0	0	113.8
786	E	29	Very low	28.8	Very low	163 Å²	163	132.7 Å²	132.7	76%	0.762	73%	0.731	S	S	*	*			trans	61.4	128.4	160.6	-59.3	-140.6	102.6	0	0	121.6	K788	E786-K788 IonicContact OE1-NZ 3.15Å
787	T	28.6	Very low	29	Very low	101 Å²	101	136.8 Å²	136.8	62%	0.62	73%	0.73	S	S	*	*				68.7	149.3	82.5	89.5	0	0	0	0	115.9
788	K	31.5	Very low	28.7	Very low	151 Å²	151	136.8 Å²	136.8	66%	0.657	73%	0.73	S	S	*	*			cis	-147.1	142.9	10.5	-105.3	125.1	-162.6	148.3	0	109.4	E786	E786-K788 IonicContact OE1-NZ 3.15Å
789	I	28.3	Very low	28.7	Very low	152 Å²	152	136.3 Å²	136.3	78%	0.779	73%	0.732	S	S	*	*				79.8	144.4	89.2	-60.4	-177.8	0	0	0	117.1
790	S	27.9	Very low	28.6	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	73%	0.731	S	S	*	*			trans	96.9	154.4	167.1	-57.1	0	0	0	0	119.7
791	Q	26.3	Very low	28.6	Very low	169 Å²	169	137 Å²	137	79%	0.79	74%	0.737	S	S	*	*			cis	-174.4	145.9	-37.9	-169.4	176.3	-10.3	0	0	110.5
792	S	27.3	Very low	28.3	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	74%	0.738	S	S	*	*			trans	61.2	173.9	159.6	43.7	0	0	0	0	120.1
793	V	24.9	Very low	28.1	Very low	127 Å²	127	136 Å²	136	77%	0.77	74%	0.735	S	S	*	*				-174.3	151.3	-56	132.2	0	0	0	0	109.8
794	L	25.4	Very low	28	Very low	130 Å²	130	136.6 Å²	136.6	68%	0.681	74%	0.738	S	S	*	*			trans	65.2	155.7	173.9	-79.8	157.8	0	0	0	116.5
795	F	26.3	Very low	28	Very low	175 Å²	175	133.8 Å²	133.8	77%	0.768	73%	0.729	S	S	*	*			cis	-150.9	165	29.8	-122.9	-69.4	0	0	0	114.6
796	D	26.8	Very low	28.2	Very low	133 Å²	133	138 Å²	138	71%	0.711	73%	0.734	S	S	*	*			trans	-75.6	165.1	176	-84	-63.7	0	0	0	118.3
797	K	30.3	Very low	28	Very low	186 Å²	186	137.3 Å²	137.3	81%	0.809	74%	0.736	S	S	*	*			trans	144	151	138.6	-81.4	158.9	-174	172	0	112.3
798	S	26.2	Very low	28.3	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	74%	0.74	S	S	*	*			cis	-174	155.8	-10.2	44.8	0	0	0	0	108
799	L	30.4	Very low	29.1	Very low	145 Å²	145	136.7 Å²	136.7	76%	0.759	75%	0.752	S	S	*	*				169	152.9	95.5	-99.8	167.4	0	0	0	112.2
800	T	26.7	Very low	29	Very low	111 Å²	111	133 Å²	133	68%	0.681	75%	0.751	S	S	*	*			trans	13.4	152.2	145.9	53.1	0	0	0	0	121.6
801	T	30.7	Very low	29.4	Very low	116 Å²	116	136.3 Å²	136.3	71%	0.712	76%	0.759	S	S	*	*			cis	-176.1	168.4	19.1	17.6	0	0	0	0	105.6
802	E	25.6	Very low	29.3	Very low	166 Å²	166	136.9 Å²	136.9	78%	0.776	76%	0.762	S	S	*	*			cis	168.2	172.5	-7.3	-170.8	-175.4	-179.2	0	0	105.6
803	C	28.7	Very low	29.4	Very low	98 Å²	98	137.6 Å²	137.6	66%	0.662	77%	0.766	S	S	*	*			trans	73.9	88.4	160.4	-71.1	0	0	0	0	123.9
804	H	29	Very low	29.6	Very low	171 Å²	171	137 Å²	137	79%	0.792	77%	0.767	S	S	*	*				36.6	120.6	119	-63.3	-71.5	0	0	0	125.8
805	L	29.7	Very low	30	Very low	144 Å²	144	136.7 Å²	136.7	75%	0.754	77%	0.766	S	S	*	*				54.7	132.2	120.2	-74.5	169.2	0	0	0	125.5
806	L	33.6	Very low	31	Very low	155 Å²	155	134.2 Å²	134.2	81%	0.812	77%	0.768	S	S	*	*			trans	69.5	155	154.6	-57.1	170.8	0	0	0	117.1
807	D	24.3	Very low	31.5	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	77%	0.766	S	S	*	*			cis	-153.6	-171.3	21.5	-160.1	-2.1	0	0	0	112.9
808	S	35.2	Very low	31.7	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	76%	0.76	S	S	*	*			trans	-120.2	159.7	175	-59.9	0	0	0	0	113.1
809	P	47	Very low	31.9	Very low	139 Å²	139	134.7 Å²	134.7	90%	0.903	76%	0.764	S	S	*	*				-161.3	177.6	101.8	40.8	-20.9	0	0	0	117.8
810	G	26.2	Very low	31.9	Very low	74 Å²	74	133.3 Å²	133.3	76%	0.763	76%	0.756	S	S	*	*			trans	158.8	137.6	159.5	0	0	0	0	0	117.6
811	L	36.9	Very low	32	Very low	176 Å²	176	134.6 Å²	134.6	92%	0.921	76%	0.755	S	S	*	*			trans	-154.6	143	-175.8	-91.8	171.2	0	0	0	115
812	Q	24.9	Very low	31.9	Very low	181 Å²	181	137.1 Å²	137.1	85%	0.846	75%	0.751	S	S	*	*			trans	-161.8	132.3	153.4	-76.9	-150.2	-25.6	0	0	108.8
813	C	27.9	Very low	32	Very low	120 Å²	120	138.7 Å²	138.7	81%	0.811	75%	0.75	S	S	*	*				66.1	136.4	78.9	-60.2	0	0	0	0	115.2
814	S	30.1	Very low	32	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	75%	0.753	S	S	*	*			cis	-168.9	159.7	-1.9	46.3	0	0	0	0	113
815	N	34.6	Very low	31.9	Very low	124 Å²	124	141.8 Å²	141.8	66%	0.663	76%	0.755	S	S	*	*			trans	-93.8	169.1	178.2	-69.9	-17	0	0	0	114.5	F817	N815-F817 HydrophobicContact CB-CD2 4.05Å; N815-F817 HydrophobicContact CB-CE2 4.33Å
816	P	46.6	Very low	31.9	Very low	124 Å²	124	142.2 Å²	142.2	81%	0.805	75%	0.753	S	S	*	*				-140.3	158.4	100.9	33.2	-16.7	0	0	0	114.1
817	F	36.9	Very low	31.7	Very low	155 Å²	155	143 Å²	143	68%	0.68	75%	0.752	S	S	*	*			cis	86.1	131.5	28.2	-80	-135.1	0	0	0	114.8	N815	N815-F817 HydrophobicContact CB-CD2 4.05Å; N815-F817 HydrophobicContact CB-CE2 4.33Å
818	T	35.1	Very low	31.8	Very low	112 Å²	112	139.4 Å²	139.4	69%	0.687	74%	0.744	S	S	*	*			cis	-148.9	-129	-8	11.6	0	0	0	0	110.3
819	Q	29.8	Very low	31.6	Very low	155 Å²	155	145.4 Å²	145.4	72%	0.724	75%	0.751	S	S	*	*			cis	-170	142.5	0.3	-144.8	-173	-0.3	0	0	113.7
820	L	29.6	Very low	30.8	Very low	116 Å²	116	146.7 Å²	146.7	61%	0.607	74%	0.744	S	S	*	*			trans	59.3	123.8	141.5	-101.8	58.5	0	0	0	123.5
821	E	30.3	Very low	30.9	Very low	139 Å²	139	150.2 Å²	150.2	65%	0.65	74%	0.744	S	S	*	*				103.3	171.9	87	-108.7	-176.8	179.5	0	0	114.7
822	R	27.6	Very low	30.6	Very low	168 Å²	168	146.3 Å²	146.3	63%	0.634	73%	0.732	S	S	*	*			cis	-161.7	160.8	15.5	-146.8	-179.8	-70.4	136.2	8.1	114.5
823	R	27.7	Very low	30.9	Very low	199 Å²	199	147.6 Å²	147.6	75%	0.751	74%	0.735	S	S	*	*			trans	67.3	165.5	156.4	-58.7	-160.6	-83.7	-152.8	-1.9	117.7
824	H	29.3	Very low	31.1	Very low	157 Å²	157	145.4 Å²	145.4	73%	0.727	73%	0.733	S	S	*	*			cis	-170.6	150.2	-41.1	-101.8	-62.9	0	0	0	106.4
825	Q	27.3	Very low	31.5	Very low	177 Å²	177	143.6 Å²	143.6	83%	0.827	73%	0.732	S	S	*	*				177.7	140.3	121.4	-153	70.6	3.7	0	0	109.9
826	E	28.6	Very low	31.6	Very low	153 Å²	153	145.5 Å²	145.5	72%	0.715	74%	0.742	S	S	*	*			trans	-99.3	159	170.4	-57	157	110.2	0	0	110.6
827	H	28.9	Very low	31.1	Very low	171 Å²	171	146.9 Å²	146.9	79%	0.792	74%	0.742	S	S	*	*				171.6	134.6	118	-95.5	69.2	0	0	0	115.4
828	A	28.3	Very low	31.2	Very low	75 Å²	75	147.2 Å²	147.2	62%	0.62	75%	0.749	S	S	*	*			trans	62.7	113.6	135.7	0	0	0	0	0	124.8
829	R	29.5	Very low	31.2	Very low	225 Å²	225	146.7 Å²	146.7	85%	0.849	75%	0.746	S	S	*	*				77.6	120.3	122.1	-64	-179.8	-172.9	-168.6	2.9	123.2
830	H	29.8	Very low	31.5	Very low	166 Å²	166	148.5 Å²	148.5	77%	0.769	75%	0.752	S	S	*	*				83.3	139.2	128.3	-88.5	-102.1	0	0	0	124.6
831	I	29.8	Very low	31.6	Very low	148 Å²	148	148.6 Å²	148.6	76%	0.759	76%	0.762	S	S	*	*			trans	80.2	94.5	148	-61.4	157.1	0	0	0	120.3
832	S	30.3	Very low	32.3	Very low	95 Å²	95	147.9 Å²	147.9	66%	0.664	77%	0.77	S	S	*	*				54.3	151.5	110.6	-140	0	0	0	0	125.3
833	F	32	Very low	33.1	Very low	207 Å²	207	148.6 Å²	148.6	91%	0.908	79%	0.785	S	S	*	*			trans	67.6	142.7	160.7	-78.4	-69.2	0	0	0	120.9
834	G	31.5	Very low	33.7	Very low	74 Å²	74	148.5 Å²	148.5	76%	0.763	79%	0.793	S	S	*	*			trans	126.7	78.5	152.2	0	0	0	0	0	116.8
835	G	37.7	Very low	34.4	Very low	75 Å²	75	144.2 Å²	144.2	77%	0.773	79%	0.792	S	S	*	*			trans	-87	144.8	154.2	0	0	0	0	0	109.7
836	N	37.1	Very low	35	Very low	165 Å²	165	144.4 Å²	144.4	88%	0.882	79%	0.792	S	S	*	*			trans	-143.1	138.7	173.7	-107.4	-31.9	0	0	0	112.8
837	L	36.8	Very low	35.5	Very low	153 Å²	153	150.7 Å²	150.7	80%	0.801	82%	0.818	S	S	*	*			trans	-92.9	140.4	174.1	-171.1	75.3	0	0	0	108.5
838	I	38.8	Very low	35.8	Very low	161 Å²	161	149.7 Å²	149.7	83%	0.826	82%	0.819	S	S	*	*			trans	-130.2	123.1	171.2	-60.1	-178.7	0	0	0	109.6
839	T	33.9	Very low	36.2	Very low	102 Å²	102	153.6 Å²	153.6	63%	0.626	83%	0.83	S	S	*	*			trans	-126.3	121.3	174.3	44.9	0	0	0	0	110.6
840	F	37.3	Very low	36.6	Very low	192 Å²	192	149.7 Å²	149.7	84%	0.842	83%	0.829	S	S	*	*			trans	32.6	125.1	155	-58.2	-79.4	0	0	0	121.2
841	S	32.1	Very low	37	Very low	118 Å²	118	148.7 Å²	148.7	83%	0.825	83%	0.832	S	S	*	*				-166.5	142.8	122.7	-78.7	0	0	0	0	111.2
842	P	43.9	Very low	37.4	Very low	125 Å²	125	148.8 Å²	148.8	81%	0.812	84%	0.837	S	S	*	*			trans	-117.3	159.7	140.3	35.6	-29.7	0	0	0	111.6
843	L	43.8	Very low	37.9	Very low	183 Å²	183	152.3 Å²	152.3	96%	0.958	85%	0.848	S	S	*	*			trans	-84	170	-164.3	-76.3	155.5	0	0	0	115.2
844	Q	41.3	Very low	38.3	Very low	197 Å²	197	148.4 Å²	148.4	92%	0.921	84%	0.844	S	S	*	*			trans	-109	148.1	175.9	177.9	-177.6	2.9	0	0	110.3
845	G	44	Very low	38.8	Very low	67 Å²	67	154.2 Å²	154.2	69%	0.691	85%	0.85	S	S	*	*			trans	111.3	142	175.6	0	0	0	0	0	112.9
846	E	39.7	Very low	38.9	Very low	180 Å²	180	160.8 Å²	160.8	84%	0.841	86%	0.857	S	S	*	*			cis	-145.2	141.8	-2.4	-62.9	-177.5	123	0	0	110.2
847	F	38.5	Very low	39.1	Very low	286 Å²	286	160.4 Å²	160.4	100%	1.254	85%	0.854	S	S	*	*			trans	158.4	0	142.1	-90.6	-63	0	0	0	111.5

Retrieved 847 of 847 residues in 1090 ms (Link to these results)

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