A0A3Q0KM38_SCHMA Loading...

Putative myo inositol monophosphatase

AlphaFold DB , UniProt , Accession A0A3Q0KM38, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 900 aa.

						>A0A3Q0KM38_SCHMA|A0A3Q0KM38
MWPHFSAAAWTKSLIHGPPPSVEEKVDNSDGWGALARQWVHQRSSQLQSNYTNNVAPPPPPPPPPPPPPPSPPPPPPISFIPPTQVQSSTSNVVFSASQVDSSHPLIHNSLICAQEKPLSSQSMCPVPENQEALQSSWSLFENSRVSQNSWSTSGGHAYLQNLCTAPGYHGPPQSAWPSYNSHEPSQNAWPSQASLQSKWSAPESHSYDNQVPQGYSNTIPQPGPSSQYYEHNHQINYLSSENSNNPVSHCKSYGEQYCNVGSGHTGQITRYQKRWTQNDQGNNEYCSHASEVYDYHHSYSFERSFNSSAARPTNPYNQPYPRFSQNNRNMWPRNPESFQPVDGFPPPAQFDDMHLHRLSYQYQEEPKYIPLSEDTPVIESKQFRGCHDHDYRITIQSPTVPSGSVEENWKDVDTRPILPSDSDHTSPAIFPSAIANKALDDPRPISLIPTPIIESSCKPRGRITHLPVPEHLMTAFEEAAASTGVWPPKGLEPEQTGGGNTKPRALPAWLRDELEKLEKKKAKELAAVSGATVLGAAPDAKRDDEGDIVMEDEAKTDVQTIKSLLNNNEELDGDVKEQESPFDISSNPVGDLQSPFSSRSQPPTELEEISNPETAVKQLTTNSSQSILPNIPASLTPTHLLSLQEFRELFTSLSDEEQRTETARFITRTLTEALLAVTTELIDGIVEEVMTEAVSGKSHVLPSEDSPSVEIKSPILGLVSYNSESESESEQNVLESKLPTNKLSGILPGDVPDDVKHDYTSQNSPSNENNKIVTGNGKFQTAQEKNHEKHSYSSSIHQKSKRYKNEKETDMAVTISRSRSKHSHKRRTNSRHSHRSRKRDFRGSSTASSESSSSNHGNQKVGFSRFSRSSADHIKNVRSPKHYFAKSSHSKHSHHKSHH
					

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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	42.6	Very low	57.2	Low	207 Å²	207	106.9 Å²	106.9	100%	1.02	57%	0.572	S	S	*	*				0	142.1	0	-69.1	166.4	65.1	0	0	108.4
2	W	42	Very low	57.9	Low	192 Å²	192	110.1 Å²	110.1	73%	0.727	58%	0.577	S	S	*	*			trans	-75	142.5	168.6	-71	21.4	0	0	0	108.8	F5 W32	W2-F5 HydrophobicContact CB-CB 4.37Å; W2-W32 HydrophobicContact CZ3-CH2 4.4Å
3	P	45.6	Very low	58.7	Low	96 Å²	96	104.8 Å²	104.8	62%	0.623	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	152.2	166	30.2	-34.3	0	0	0	109.4	F5	P3-F5 PolarHBondContact O-N 3.31Å; P3-F5 VanDerWaalsContact O-N 3.07Å
4	H	53.4	Low	59.4	Low	187 Å²	187	102.8 Å²	102.8	87%	0.866	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	-15.6	-178.2	-46.4	-79.1	0	0	0	117.6
5	F	50.2	Low	60.1	Low	104 Å²	104	104 Å²	104	46%	0.456	55%	0.549	S	S	.	.			trans	-90.2	109.2	172.8	-136.8	-95.6	0	0	0	111.5	W2 P3 A9 W10	W2-F5 HydrophobicContact CB-CB 4.37Å; P3-F5 PolarHBondContact O-N 3.31Å; P3-F5 VanDerWaalsContact O-N 3.07Å; F5-A9 HydrophobicContact CD1-CB 4.12Å; F5-A9 HydrophobicContact CE1-CB 3.83Å; F5-A9 HydrophobicContact CZ-CB 4.13Å; F5-W10 HydrophobicContact CD1-CB 4.21Å; F5-W10 HydrophobicContact CE1-CB 4.12Å
6	S	66.6	Low	60.6	Low	64 Å²	64	106.8 Å²	106.8	45%	0.448	56%	0.558	S	S	.	*			trans	-76.9	154.5	178.8	77	0	0	0	0	111.7	A8 A9 W10	S6-A8 PolarHBondContact O-N 3.48Å; S6-A9 PolarHBondContact O-N 3.38Å; S6-A9 VanDerWaalsContact O-N 3.13Å; S6-A9 WeakPolarHBondContact OG-CB 3.29Å; S6-A9 PolarHBondContact OG-N 3.31Å; S6-W10 PolarHBondContact O-N 2.84Å; S6-W10 VanDerWaalsContact O-N 3.09Å
7	A	61.6	Low	60	Low	70 Å²	70	102.1 Å²	102.1	58%	0.579	54%	0.542	S	S	*	.	H	α-helix	trans	-58.3	-37.7	174	0	0	0	0	0	111.6	A9 W10 T11	A7-A9 PolarHBondContact O-N 3.35Å; A7-W10 WeakPolarHBondContact O-CB 3.16Å; A7-W10 PolarHBondContact O-N 2.78Å; A7-T11 PolarHBondContact O-N 3.37Å; A7-T11 PolarHBondContact O-OG1 3.32Å; A7-T11 VanDerWaalsContact O-OG1 3.1Å
8	A	68.3	Low	59.7	Low	64 Å²	64	102.2 Å²	102.2	53%	0.529	55%	0.549	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.2	0	0	0	0	0	113.1	S6 W10 K12	S6-A8 PolarHBondContact O-N 3.48Å; A8-W10 VanDerWaalsContact C-N 3.34Å; A8-K12 WeakPolarHBondContact O-CB 3.42Å; A8-K12 WeakPolarHBondContact O-CG 3.27Å; A8-K12 PolarHBondContact O-N 3.49Å
9	A	66.4	Low	58.9	Low	35 Å²	35	102.5 Å²	102.5	29%	0.289	56%	0.557	S	S	.	*	H	α-helix	trans	-65.9	-39.1	173.2	0	0	0	0	0	111.4	F5 S6 A7 S13	F5-A9 HydrophobicContact CD1-CB 4.12Å; F5-A9 HydrophobicContact CE1-CB 3.83Å; F5-A9 HydrophobicContact CZ-CB 4.13Å; S6-A9 PolarHBondContact O-N 3.38Å; S6-A9 VanDerWaalsContact O-N 3.13Å; S6-A9 WeakPolarHBondContact OG-CB 3.29Å; S6-A9 PolarHBondContact OG-N 3.31Å; A7-A9 PolarHBondContact O-N 3.35Å; A9-S13 WeakPolarHBondContact O-CB 3.44Å; A9-S13 PolarHBondContact O-N 3.07Å
10	W	67.1	Low	58.4	Low	87 Å²	87	103.3 Å²	103.3	33%	0.33	57%	0.568	S	S	.	*	H	α-helix	trans	-64.6	-50.8	175.3	-157.6	80.1	0	0	0	111.7	F5 S6 A7 A8 K12 S13 L14 L675	F5-W10 HydrophobicContact CD1-CB 4.21Å; F5-W10 HydrophobicContact CE1-CB 4.12Å; S6-W10 PolarHBondContact O-N 2.84Å; S6-W10 VanDerWaalsContact O-N 3.09Å; A7-W10 WeakPolarHBondContact O-CB 3.16Å; A7-W10 PolarHBondContact O-N 2.78Å; A8-W10 VanDerWaalsContact C-N 3.34Å; W10-K12 PolarHBondContact O-N 3.17Å; W10-S13 PolarHBondContact O-N 3.29Å; W10-S13 VanDerWaalsContact O-N 3.15Å; W10-L14 HydrophobicContact CD2-CD1 3.71Å; W10-L14 HydrophobicContact CE3-CD1 3.81Å; W10-L14 HydrophobicContact CE3-CD2 4.23Å; W10-L14 HydrophobicContact CG-CD1 4.36Å; W10-L14 HydrophobicContact CH2-CD1 3.78Å; W10-L14 HydrophobicContact CH2-CD2 3.45Å; W10-L14 VanDerWaalsContact CH2-CD2 3.45Å; W10-L14 HydrophobicContact CH2-CG 4.28Å; W10-L14 HydrophobicContact CZ2-CD1 3.69Å; W10-L14 HydrophobicContact CZ2-CD2 4.16Å; W10-L14 HydrophobicContact CZ3-CD1 3.84Å; W10-L14 HydrophobicContact CZ3-CD2 3.5Å; W10-L14 VanDerWaalsContact CZ3-CD2 3.5Å; W10-L14 HydrophobicContact CZ3-CG 4.3Å; W10-L14 VanDerWaalsContact O-CD1 3.29Å; W10-L14 WeakPolarHBondContact O-CD1 3.43Å; W10-L14 PolarHBondContact O-N 3.27Å; W10-L675 HydrophobicContact CE3-CD1 4.13Å; W10-L675 HydrophobicContact CH2-CB 4.34Å; W10-L675 HydrophobicContact CH2-CD1 3.4Å; W10-L675 HydrophobicContact CH2-CG 4.49Å; W10-L675 HydrophobicContact CZ2-CD1 3.95Å; W10-L675 HydrophobicContact CZ3-CB 4.19Å; W10-L675 HydrophobicContact CZ3-CD1 3.49Å; W10-L675 VanDerWaalsContact CZ3-CD1 3.49Å; W10-L675 HydrophobicContact CZ3-CG 4.44Å
11	T	65.6	Low	57.7	Low	70 Å²	70	103.8 Å²	103.8	43%	0.429	58%	0.579	S	S	.	*	H	α-helix	trans	-58.5	-44.2	175.6	-56.4	0	0	0	0	112.2	A7 S13 L14 I15	A7-T11 PolarHBondContact O-N 3.37Å; A7-T11 PolarHBondContact O-OG1 3.32Å; A7-T11 VanDerWaalsContact O-OG1 3.1Å; T11-S13 PolarHBondContact O-N 2.83Å; T11-L14 PolarHBondContact O-N 3.17Å; T11-I15 HydrophobicContact CG2-CD1 3.65Å; T11-I15 HydrophobicContact CG2-CG1 4.35Å; T11-I15 WeakPolarHBondContact O-CG1 3.33Å; T11-I15 PolarHBondContact O-N 3.49Å
12	K	65.6	Low	57.9	Low	145 Å²	145	100 Å²	100	63%	0.63	57%	0.567	S	S	*	*	H	α-helix	trans	-60	-43.9	174.8	-80	-173.9	174.9	-170.5	0	112	A8 W10 L14 I15 H16	A8-K12 WeakPolarHBondContact O-CB 3.42Å; A8-K12 WeakPolarHBondContact O-CG 3.27Å; A8-K12 PolarHBondContact O-N 3.49Å; W10-K12 PolarHBondContact O-N 3.17Å; K12-L14 VanDerWaalsContact C-N 3.26Å; K12-L14 PolarHBondContact O-N 2.7Å; K12-I15 PolarHBondContact O-N 3.15Å; K12-H16 PolarHBondContact O-CD2 3.05Å; K12-H16 PolarHBondContact O-N 3.37Å
13	S	67.6	Low	57.9	Low	41 Å²	41	99.4 Å²	99.4	29%	0.287	57%	0.572	S	S	.	*	H	α-helix	trans	-69.4	-19.9	179.8	-168.9	0	0	0	0	114	A9 W10 T11 G17	A9-S13 WeakPolarHBondContact O-CB 3.44Å; A9-S13 PolarHBondContact O-N 3.07Å; W10-S13 PolarHBondContact O-N 3.29Å; W10-S13 VanDerWaalsContact O-N 3.15Å; T11-S13 PolarHBondContact O-N 2.83Å; S13-G17 WeakPolarHBondContact CA-O 3.23Å; S13-G17 CarbonylContact O-C 3.47Å; S13-G17 WeakPolarHBondContact O-CA 3.23Å; S13-G17 PolarHBondContact O-N 3.25Å
14	L	68.4	Low	57.7	Low	77 Å²	77	102.4 Å²	102.4	40%	0.403	58%	0.578	S	S	.	*	H	α-helix	trans	-85.2	-40.7	171.2	-92.9	77.2	0	0	0	112.4	W10 T11 K12 T672	W10-L14 HydrophobicContact CD2-CD1 3.71Å; W10-L14 HydrophobicContact CE3-CD1 3.81Å; W10-L14 HydrophobicContact CE3-CD2 4.23Å; W10-L14 HydrophobicContact CG-CD1 4.36Å; W10-L14 HydrophobicContact CH2-CD1 3.78Å; W10-L14 HydrophobicContact CH2-CD2 3.45Å; W10-L14 VanDerWaalsContact CH2-CD2 3.45Å; W10-L14 HydrophobicContact CH2-CG 4.28Å; W10-L14 HydrophobicContact CZ2-CD1 3.69Å; W10-L14 HydrophobicContact CZ2-CD2 4.16Å; W10-L14 HydrophobicContact CZ3-CD1 3.84Å; W10-L14 HydrophobicContact CZ3-CD2 3.5Å; W10-L14 VanDerWaalsContact CZ3-CD2 3.5Å; W10-L14 HydrophobicContact CZ3-CG 4.3Å; W10-L14 VanDerWaalsContact O-CD1 3.29Å; W10-L14 WeakPolarHBondContact O-CD1 3.43Å; W10-L14 PolarHBondContact O-N 3.27Å; T11-L14 PolarHBondContact O-N 3.17Å; K12-L14 VanDerWaalsContact C-N 3.26Å; K12-L14 PolarHBondContact O-N 2.7Å; L14-T672 HydrophobicContact CD2-CG2 3.69Å
15	I	70	Confident	57.3	Low	121 Å²	121	103 Å²	103	62%	0.621	58%	0.578	S	S	*	*	H	α-helix	trans	-74	-38.5	-177	-65.7	174.3	0	0	0	111.8	T11 K12	T11-I15 HydrophobicContact CG2-CD1 3.65Å; T11-I15 HydrophobicContact CG2-CG1 4.35Å; T11-I15 WeakPolarHBondContact O-CG1 3.33Å; T11-I15 PolarHBondContact O-N 3.49Å; K12-I15 PolarHBondContact O-N 3.15Å
16	H	68.2	Low	57.2	Low	148 Å²	148	101.3 Å²	101.3	69%	0.685	58%	0.576	S	S	*	*	S	Bend	trans	-109.3	1.8	-174.6	-54.3	-67.6	0	0	0	113.7	K12	K12-H16 PolarHBondContact O-CD2 3.05Å; K12-H16 PolarHBondContact O-N 3.37Å
17	G	50.3	Low	56.2	Low	28 Å²	28	105.1 Å²	105.1	29%	0.289	59%	0.591	S	S	.	*			trans	70.9	179.9	-164.2	0	0	0	0	0	112.5	S13	S13-G17 WeakPolarHBondContact CA-O 3.23Å; S13-G17 CarbonylContact O-C 3.47Å; S13-G17 WeakPolarHBondContact O-CA 3.23Å; S13-G17 PolarHBondContact O-N 3.25Å
18	P	55.3	Low	55.4	Low	104 Å²	104	106.8 Å²	106.8	68%	0.675	59%	0.59	S	S	*	*	S	Bend	trans	-61	135.9	167	28.3	-33.6	0	0	0	109
19	P	44.4	Very low	54.6	Low	107 Å²	107	107.9 Å²	107.9	70%	0.695	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-60.8	143.2	178.1	26.2	-34	0	0	0	110.1	S21	P19-S21 PolarHBondContact O-N 2.83Å
20	P	48.9	Very low	54.2	Low	119 Å²	119	111.6 Å²	111.6	77%	0.773	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-57.6	135.6	171.2	26.6	-34	0	0	0	108.7	V22	P20-V22 PolarHBondContact O-N 3.37Å
21	S	44.7	Very low	54.2	Low	114 Å²	114	109.3 Å²	109.3	80%	0.797	61%	0.613	S	S	*	*			trans	-66.8	92.9	-172	54.8	0	0	0	0	111.6	P19 E23	P19-S21 PolarHBondContact O-N 2.83Å; S21-E23 PolarHBondContact O-N 2.59Å
22	V	45	Very low	54	Low	128 Å²	128	114.5 Å²	114.5	78%	0.776	62%	0.624	S	S	*	*			trans	-60.7	125.8	152.8	-179.8	0	0	0	0	106.4	P20 E24	P20-V22 PolarHBondContact O-N 3.37Å; V22-E24 PolarHBondContact O-N 2.95Å
23	E	42.3	Very low	54.4	Low	179 Å²	179	108.6 Å²	108.6	84%	0.836	61%	0.605	S	S	*	*			trans	-72.7	70.5	172.6	-66.4	-173.6	141.5	0	0	109.8	S21 K25	S21-E23 PolarHBondContact O-N 2.59Å; E23-K25 PolarHBondContact O-N 2.96Å
24	E	42	Very low	54.5	Low	158 Å²	158	109 Å²	109	74%	0.738	61%	0.611	S	S	*	*			trans	-66.2	100	168.7	-155.9	-170.6	158.4	0	0	107.6	V22 V26	V22-E24 PolarHBondContact O-N 2.95Å; E24-V26 HydrophobicContact CB-CG2 4.32Å; E24-V26 HydrophobicContact CG-CG2 3.67Å; E24-V26 PolarHBondContact O-N 2.94Å; E24-V26 WeakPolarHBondContact OE1-CG2 3.48Å
25	K	44.3	Very low	54.7	Low	199 Å²	199	108.7 Å²	108.7	87%	0.865	61%	0.609	S	S	*	*			trans	-68.9	74.1	173.8	-77	-172.3	174.2	-176.2	0	110.4	E23	E23-K25 PolarHBondContact O-N 2.96Å
26	V	48.9	Very low	54.8	Low	70 Å²	70	105.5 Å²	105.5	42%	0.424	60%	0.601	S	S	.	*			trans	-104.6	121	163.8	-159	0	0	0	0	107.2	E24 N28	E24-V26 HydrophobicContact CB-CG2 4.32Å; E24-V26 HydrophobicContact CG-CG2 3.67Å; E24-V26 PolarHBondContact O-N 2.94Å; E24-V26 WeakPolarHBondContact OE1-CG2 3.48Å; V26-N28 HydrophobicContact CG1-CB 4.36Å; V26-N28 VanDerWaalsContact CG1-ND2 3.31Å; V26-N28 WeakPolarHBondContact CG1-ND2 3.44Å; V26-N28 PolarHBondContact O-N 3.23Å
27	D	45.2	Very low	55.2	Low	143 Å²	143	105 Å²	105	77%	0.765	59%	0.593	S	S	*	*			trans	-73.1	40	179.4	-70.3	-53.7	0	0	0	113.1	S29	D27-S29 PolarHBondContact O-N 3.34Å
28	N	45.8	Very low	56.5	Low	105 Å²	105	109.9 Å²	109.9	56%	0.561	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	8.4	175.3	-78.9	-20.4	0	0	0	113.4	V26 D30 G31 W32	V26-N28 HydrophobicContact CG1-CB 4.36Å; V26-N28 VanDerWaalsContact CG1-ND2 3.31Å; V26-N28 WeakPolarHBondContact CG1-ND2 3.44Å; V26-N28 PolarHBondContact O-N 3.23Å; N28-D30 PolarHBondContact O-N 3.49Å; N28-G31 WeakPolarHBondContact O-CA 3.14Å; N28-G31 PolarHBondContact O-N 2.87Å; N28-W32 PolarHBondContact O-N 3.05Å
29	S	49.8	Very low	57.3	Low	87 Å²	87	111.7 Å²	111.7	61%	0.608	60%	0.602	S	S	*	*	H	α-helix	trans	-56.4	-38.9	168.5	53.2	0	0	0	0	111.3	D27 G31 W32 G33	D27-S29 PolarHBondContact O-N 3.34Å; S29-G31 VanDerWaalsContact C-N 3.31Å; S29-G31 PolarHBondContact O-N 3.5Å; S29-W32 PolarHBondContact O-N 3.47Å; S29-G33 PolarHBondContact O-N 3.46Å
30	D	58.2	Low	59	Low	113 Å²	113	110.8 Å²	110.8	60%	0.604	59%	0.594	S	S	*	*	H	α-helix	trans	-68.8	-27.1	172.9	-95.8	-32.3	0	0	0	113.3	N28 G33 A34 R37	N28-D30 PolarHBondContact O-N 3.49Å; D30-G33 PolarHBondContact O-N 2.91Å; D30-A34 WeakPolarHBondContact O-CB 3.44Å; D30-A34 PolarHBondContact O-N 2.87Å; D30-R37 IonicContact OD1-NH2 2.65Å
31	G	67.7	Low	60.3	Low	39 Å²	39	111.5 Å²	111.5	40%	0.402	59%	0.587	S	S	.	*	H	α-helix	trans	-63.1	-46.1	172.4	0	0	0	0	0	112.1	N28 S29 A34 L35	N28-G31 WeakPolarHBondContact O-CA 3.14Å; N28-G31 PolarHBondContact O-N 2.87Å; S29-G31 VanDerWaalsContact C-N 3.31Å; S29-G31 PolarHBondContact O-N 3.5Å; G31-A34 PolarHBondContact O-N 3.29Å; G31-L35 WeakPolarHBondContact O-CB 3.24Å; G31-L35 PolarHBondContact O-N 3.29Å
32	W	61.5	Low	61.7	Low	179 Å²	179	111.4 Å²	111.4	68%	0.678	57%	0.574	S	S	*	*	H	α-helix	trans	-63.8	-43.7	172.7	-73.1	102.5	0	0	0	112	W2 N28 S29 A34 L35 A36	W2-W32 HydrophobicContact CZ3-CH2 4.4Å; N28-W32 PolarHBondContact O-N 3.05Å; S29-W32 PolarHBondContact O-N 3.47Å; W32-A34 PolarHBondContact O-N 3.24Å; W32-L35 PolarHBondContact O-N 3.1Å; W32-A36 WeakPolarHBondContact O-CB 3.34Å; W32-A36 PolarHBondContact O-N 3.45Å
33	G	73.5	Confident	62.9	Low	21 Å²	21	112.9 Å²	112.9	22%	0.216	57%	0.565	C	S	.	*	H	α-helix	trans	-59.8	-45.1	175.3	0	0	0	0	0	112.6	S29 D30 R37	S29-G33 PolarHBondContact O-N 3.46Å; D30-G33 PolarHBondContact O-N 2.91Å; G33-R37 VanDerWaalsContact O-CB 3.29Å; G33-R37 WeakPolarHBondContact O-CB 3.35Å; G33-R37 WeakPolarHBondContact O-CG 3.45Å; G33-R37 PolarHBondContact O-N 3.41Å; G33-R37 PolarHBondContact O-NE 3.45Å
34	A	69.8	Low	64.1	Low	51 Å²	51	106.6 Å²	106.6	42%	0.421	54%	0.541	S	S	.	.	H	α-helix	trans	-65.5	-45.8	177.7	0	0	0	0	0	112.2	D30 G31 W32 R37 Q38	D30-A34 WeakPolarHBondContact O-CB 3.44Å; D30-A34 PolarHBondContact O-N 2.87Å; G31-A34 PolarHBondContact O-N 3.29Å; W32-A34 PolarHBondContact O-N 3.24Å; A34-R37 PolarHBondContact O-N 2.96Å; A34-Q38 WeakPolarHBondContact O-CB 3.31Å; A34-Q38 PolarHBondContact O-N 2.88Å
35	L	72.8	Confident	65	Low	70 Å²	70	102.9 Å²	102.9	37%	0.366	53%	0.533	S	S	.	.	H	α-helix	trans	-69.8	-37.1	-179.4	-167.6	145.2	0	0	0	111.9	G31 W32 Q38 W39	G31-L35 WeakPolarHBondContact O-CB 3.24Å; G31-L35 PolarHBondContact O-N 3.29Å; W32-L35 PolarHBondContact O-N 3.1Å; L35-Q38 PolarHBondContact O-N 2.75Å; L35-W39 WeakPolarHBondContact O-CB 3.48Å; L35-W39 PolarHBondContact O-N 3.46Å
36	A	73.1	Confident	65.5	Low	53 Å²	53	100.6 Å²	100.6	44%	0.438	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-45	170.4	0	0	0	0	0	111.6	W32 Q38 W39 V40	W32-A36 WeakPolarHBondContact O-CB 3.34Å; W32-A36 PolarHBondContact O-N 3.45Å; A36-Q38 VanDerWaalsContact C-N 3.32Å; A36-Q38 PolarHBondContact O-N 2.86Å; A36-W39 PolarHBondContact O-N 2.91Å; A36-V40 WeakPolarHBondContact O-CG2 3.31Å; A36-V40 PolarHBondContact O-N 3.26Å
37	R	76	Confident	65.8	Low	138 Å²	138	103.3 Å²	103.3	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-58.6	-42.3	172.8	-77.4	177.1	-76.1	-116.9	6	111.3	D30 G33 A34 V40 H41	D30-R37 IonicContact OD1-NH2 2.65Å; G33-R37 VanDerWaalsContact O-CB 3.29Å; G33-R37 WeakPolarHBondContact O-CB 3.35Å; G33-R37 WeakPolarHBondContact O-CG 3.45Å; G33-R37 PolarHBondContact O-N 3.41Å; G33-R37 PolarHBondContact O-NE 3.45Å; A34-R37 PolarHBondContact O-N 2.96Å; R37-V40 PolarHBondContact O-N 2.94Å; R37-H41 PolarHBondContact O-N 3.45Å; R37-H41 PolarHBondContact O-ND1 2.91Å
38	Q	77.6	Confident	66	Low	130 Å²	130	103.4 Å²	103.4	61%	0.607	53%	0.532	S	S	*	.	H	α-helix	trans	-64.7	-43.4	176.9	-170.9	179.9	9.3	0	0	112	A34 L35 A36 V40 H41 Q42	A34-Q38 WeakPolarHBondContact O-CB 3.31Å; A34-Q38 PolarHBondContact O-N 2.88Å; L35-Q38 PolarHBondContact O-N 2.75Å; A36-Q38 VanDerWaalsContact C-N 3.32Å; A36-Q38 PolarHBondContact O-N 2.86Å; Q38-V40 PolarHBondContact O-N 3.38Å; Q38-H41 PolarHBondContact O-N 2.91Å; Q38-Q42 WeakPolarHBondContact O-CB 3.07Å; Q38-Q42 PolarHBondContact O-N 3.09Å
39	W	72.7	Confident	66	Low	142 Å²	142	102.2 Å²	102.2	54%	0.538	53%	0.533	S	S	.	.	H	α-helix	trans	-62.4	-40.4	175.1	-111.9	70.5	0	0	0	112.6	L35 A36 Q42 R43	L35-W39 WeakPolarHBondContact O-CB 3.48Å; L35-W39 PolarHBondContact O-N 3.46Å; A36-W39 PolarHBondContact O-N 2.91Å; W39-Q42 PolarHBondContact O-N 3.48Å; W39-R43 PolarHBondContact O-N 3.24Å
40	V	78.6	Confident	65.9	Low	89 Å²	89	105.1 Å²	105.1	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-45.1	173.5	170.8	0	0	0	0	110.7	A36 R37 Q38 Q42 R43 S44	A36-V40 WeakPolarHBondContact O-CG2 3.31Å; A36-V40 PolarHBondContact O-N 3.26Å; R37-V40 PolarHBondContact O-N 2.94Å; Q38-V40 PolarHBondContact O-N 3.38Å; V40-Q42 PolarHBondContact O-N 3.35Å; V40-R43 PolarHBondContact O-N 3.34Å; V40-S44 WeakPolarHBondContact O-CB 3.22Å; V40-S44 PolarHBondContact O-N 3.37Å; V40-S44 PolarHBondContact O-OG 3.3Å; V40-S44 VanDerWaalsContact O-OG 3.06Å
41	H	76.5	Confident	65.1	Low	134 Å²	134	109.7 Å²	109.7	62%	0.62	55%	0.551	S	S	*	*	H	α-helix	trans	-64.2	-37.6	176.2	-76.9	78.7	0	0	0	112.6	R37 Q38 S45	R37-H41 PolarHBondContact O-N 3.45Å; R37-H41 PolarHBondContact O-ND1 2.91Å; Q38-H41 PolarHBondContact O-N 2.91Å; H41-S45 WeakPolarHBondContact O-CB 3.35Å; H41-S45 PolarHBondContact O-N 2.96Å; H41-S45 PolarHBondContact O-OG 2.6Å
42	Q	74.8	Confident	64.1	Low	112 Å²	112	112.8 Å²	112.8	52%	0.523	56%	0.563	S	S	.	*	H	α-helix	trans	-68.5	-35.3	176.7	-170.5	176.2	6.5	0	0	112.2	Q38 W39 V40 S45 Q46	Q38-Q42 WeakPolarHBondContact O-CB 3.07Å; Q38-Q42 PolarHBondContact O-N 3.09Å; W39-Q42 PolarHBondContact O-N 3.48Å; V40-Q42 PolarHBondContact O-N 3.35Å; Q42-S45 WeakPolarHBondContact CA-OG 3.41Å; Q42-S45 PolarHBondContact O-OG 3.3Å; Q42-Q46 PolarHBondContact O-N 3.44Å
43	R	69.3	Low	63.3	Low	158 Å²	158	112.6 Å²	112.6	60%	0.596	58%	0.575	S	S	*	*	H	α-helix	trans	-74.9	-43	172.8	-76	-175.2	166.7	-152.2	-7.1	112.3	W39 V40 S45 Q46 L47	W39-R43 PolarHBondContact O-N 3.24Å; V40-R43 PolarHBondContact O-N 3.34Å; R43-S45 VanDerWaalsContact C-N 3.3Å; R43-S45 PolarHBondContact O-N 3.14Å; R43-Q46 CarbonylContact O-C 3.58Å; R43-Q46 PolarHBondContact O-N 3.44Å; R43-Q46 VanDerWaalsContact O-N 3.08Å; R43-L47 WeakPolarHBondContact O-CG 3.2Å; R43-L47 PolarHBondContact O-N 3.24Å
44	S	69.1	Low	61.9	Low	48 Å²	48	118.3 Å²	118.3	34%	0.336	60%	0.601	S	S	.	*	H	α-helix	trans	-59.6	-39.5	175.7	-67.7	0	0	0	0	112.1	V40 Q46 L47 Q48	V40-S44 WeakPolarHBondContact O-CB 3.22Å; V40-S44 PolarHBondContact O-N 3.37Å; V40-S44 PolarHBondContact O-OG 3.3Å; V40-S44 VanDerWaalsContact O-OG 3.06Å; S44-Q46 VanDerWaalsContact C-N 3.3Å; S44-Q46 PolarHBondContact O-N 2.9Å; S44-L47 CarbonylContact O-C 3.59Å; S44-L47 PolarHBondContact O-N 3.43Å; S44-Q48 WeakPolarHBondContact O-CB 3.44Å; S44-Q48 WeakPolarHBondContact O-CG 3.37Å; S44-Q48 PolarHBondContact O-N 3.04Å
45	S	59.1	Low	60.9	Low	79 Å²	79	122.8 Å²	122.8	55%	0.552	62%	0.622	S	S	*	*	H	α-helix	trans	-70	-21	175.6	48	0	0	0	0	114.2	H41 Q42 R43	H41-S45 WeakPolarHBondContact O-CB 3.35Å; H41-S45 PolarHBondContact O-N 2.96Å; H41-S45 PolarHBondContact O-OG 2.6Å; Q42-S45 WeakPolarHBondContact CA-OG 3.41Å; Q42-S45 PolarHBondContact O-OG 3.3Å; R43-S45 VanDerWaalsContact C-N 3.3Å; R43-S45 PolarHBondContact O-N 3.14Å
46	Q	55.4	Low	60	Low	151 Å²	151	123.4 Å²	123.4	71%	0.706	64%	0.637	S	S	*	*	H	α-helix	trans	-85.6	-14.8	166	-70	-165	-0	0	0	114.1	Q42 R43 S44	Q42-Q46 PolarHBondContact O-N 3.44Å; R43-Q46 CarbonylContact O-C 3.58Å; R43-Q46 PolarHBondContact O-N 3.44Å; R43-Q46 VanDerWaalsContact O-N 3.08Å; S44-Q46 VanDerWaalsContact C-N 3.3Å; S44-Q46 PolarHBondContact O-N 2.9Å
47	L	56	Low	59.9	Low	127 Å²	127	126.3 Å²	126.3	67%	0.665	65%	0.652	S	S	*	*	H	α-helix	trans	-100.9	-14.6	178.1	-68.2	172.3	0	0	0	113.6	R43 S44	R43-L47 WeakPolarHBondContact O-CG 3.2Å; R43-L47 PolarHBondContact O-N 3.24Å; S44-L47 CarbonylContact O-C 3.59Å; S44-L47 PolarHBondContact O-N 3.43Å
48	Q	48	Very low	60	Low	145 Å²	145	125.1 Å²	125.1	68%	0.678	66%	0.662	S	S	*	*			trans	-89.2	-5.5	179.3	-79.2	-177.4	-25.7	0	0	114.4	S44 N50 Y51	S44-Q48 WeakPolarHBondContact O-CB 3.44Å; S44-Q48 WeakPolarHBondContact O-CG 3.37Å; S44-Q48 PolarHBondContact O-N 3.04Å; Q48-N50 PolarHBondContact O-N 2.89Å; Q48-Y51 PolarHBondContact O-N 2.87Å
49	S	46.4	Very low	60	Low	81 Å²	81	124.5 Å²	124.5	57%	0.566	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	110.4	167	53.2	0	0	0	0	110.1
50	N	47	Very low	60.3	Low	147 Å²	147	123.2 Å²	123.2	79%	0.786	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.2	18.1	176.2	-49.1	-25.1	0	0	0	118.3	Q48 T52	Q48-N50 PolarHBondContact O-N 2.89Å; N50-T52 PolarHBondContact O-N 3.22Å
51	Y	41.3	Very low	60.4	Low	209 Å²	209	124.4 Å²	124.4	82%	0.82	69%	0.689	S	S	*	*			trans	-81.6	57.5	162.4	-89.6	-81.2	0	0	0	112.6	Q48	Q48-Y51 PolarHBondContact O-N 2.87Å
52	T	47.2	Very low	60.6	Low	105 Å²	105	123.6 Å²	123.6	64%	0.644	70%	0.696	S	S	*	*	S	Bend	trans	-121.3	117.4	171.7	49.9	0	0	0	0	110.3	N50 N54	N50-T52 PolarHBondContact O-N 3.22Å; T52-N54 PolarHBondContact O-N 2.97Å; T52-N54 PolarHBondContact O-ND2 3.43Å
53	N	44.6	Very low	60.9	Low	175 Å²	175	123.8 Å²	123.8	94%	0.936	71%	0.706	S	S	*	*	S	Bend	trans	-12.8	88.1	-179	-80.9	-31.7	0	0	0	116.3
54	N	44.2	Very low	61.6	Low	141 Å²	141	121.7 Å²	121.7	75%	0.754	71%	0.713	S	S	*	*			trans	-137.7	122.6	164.6	-81.7	-78.4	0	0	0	108.6	T52 A56	T52-N54 PolarHBondContact O-N 2.97Å; T52-N54 PolarHBondContact O-ND2 3.43Å; N54-A56 PolarHBondContact O-N 2.83Å
55	V	50	Low	62.3	Low	144 Å²	144	125 Å²	125	87%	0.873	73%	0.734	S	S	*	*			trans	-65.2	114.7	166.1	176.6	0	0	0	0	106.4
56	A	53.4	Low	63.3	Low	83 Å²	83	126.7 Å²	126.7	69%	0.686	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-56.7	129.2	178.5	0	0	0	0	0	109.2	N54	N54-A56 PolarHBondContact O-N 2.83Å
57	P	70.6	Confident	64.7	Low	114 Å²	114	125 Å²	125	74%	0.74	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-59.8	145.7	177	25.8	-33.7	0	0	0	109.4
58	P	78	Confident	66.1	Low	113 Å²	113	124.5 Å²	124.5	73%	0.734	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-57.9	145.6	178	25.6	-34.3	0	0	0	110
59	P	78.3	Confident	67.6	Low	117 Å²	117	123.1 Å²	123.1	76%	0.76	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-57.8	143.5	178	25.5	-34.2	0	0	0	110
60	P	78.2	Confident	69.3	Low	115 Å²	115	125.2 Å²	125.2	75%	0.747	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-58.9	145.9	177.4	26.1	-34.3	0	0	0	110.1
61	P	81.2	Confident	71	Confident	115 Å²	115	123.4 Å²	123.4	75%	0.747	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-59.5	145.6	176.6	26.6	-34.5	0	0	0	110.2
62	P	81.7	Confident	72.8	Confident	117 Å²	117	119 Å²	119	76%	0.76	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-59.3	144.5	176.7	26.3	-34.4	0	0	0	110.2
63	P	79.6	Confident	74.4	Confident	115 Å²	115	119.4 Å²	119.4	75%	0.747	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-60.3	147.4	176.9	26.6	-34.4	0	0	0	110.4
64	P	83.5	Confident	76.2	Confident	115 Å²	115	116.7 Å²	116.7	75%	0.747	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-60.3	145.1	175.9	26.9	-34.5	0	0	0	110.2
65	P	84.5	Confident	77.9	Confident	117 Å²	117	115.5 Å²	115.5	76%	0.76	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-60.8	144	178.7	26.3	-34.5	0	0	0	110.5
66	P	80.7	Confident	79.2	Confident	114 Å²	114	113.9 Å²	113.9	74%	0.74	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-61.1	146.3	177.4	26.5	-34.3	0	0	0	110.6
67	P	83.9	Confident	80.1	Confident	115 Å²	115	115.6 Å²	115.6	75%	0.747	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62	145.7	177.1	27.2	-34.5	0	0	0	110.5
68	P	85	Confident	79.9	Confident	118 Å²	118	117.2 Å²	117.2	77%	0.766	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-61.6	141.8	179.2	26.4	-34.5	0	0	0	110.6
69	P	80.7	Confident	79.2	Confident	116 Å²	116	116.8 Å²	116.8	75%	0.753	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-62.2	146.7	177.8	26.6	-34.3	0	0	0	110.7	S71	P69-S71 PolarHBondContact O-N 3.07Å
70	P	81.4	Confident	78.1	Confident	125 Å²	125	120.7 Å²	120.7	81%	0.812	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.7	137.9	178.2	26.6	-34.4	0	0	0	110.7
71	S	82.5	Confident	77	Confident	109 Å²	109	122.7 Å²	122.7	76%	0.762	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-56.2	133.6	177.8	54.4	0	0	0	0	111.4	P69	P69-S71 PolarHBondContact O-N 3.07Å
72	P	80	Confident	75.9	Confident	115 Å²	115	121.7 Å²	121.7	75%	0.747	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-62.3	148.2	179.9	26.4	-34.6	0	0	0	111.4
73	P	80.5	Confident	74.2	Confident	115 Å²	115	122.4 Å²	122.4	75%	0.747	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.3	148.6	178.4	28	-35	0	0	0	111.2
74	P	82.5	Confident	72.6	Confident	117 Å²	117	122.2 Å²	122.2	76%	0.76	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-63.5	142.3	179.1	27	-34.6	0	0	0	111.1
75	P	79.2	Confident	70.8	Confident	116 Å²	116	123.9 Å²	123.9	75%	0.753	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-63.5	147.4	176.8	27.3	-34.4	0	0	0	110.9
76	P	77	Confident	68.5	Low	110 Å²	110	125.3 Å²	125.3	71%	0.714	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-62.8	147.6	178.2	27.4	-34.9	0	0	0	111	I78	P76-I78 PolarHBondContact O-N 2.97Å
77	P	73.5	Confident	66.6	Low	120 Å²	120	127.2 Å²	127.2	78%	0.779	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-61.7	126.7	-179.4	25.6	-34	0	0	0	110.6	S79	P77-S79 PolarHBondContact O-N 2.69Å
78	I	65	Low	64.3	Low	147 Å²	147	127.1 Å²	127.1	75%	0.754	76%	0.763	S	S	*	*			trans	-68.7	105.1	174.8	-60.9	175.2	0	0	0	107.9	P76 F80	P76-I78 PolarHBondContact O-N 2.97Å; I78-F80 WeakPolarHBondContact O-CD2 3.36Å; I78-F80 PolarHBondContact O-N 2.82Å
79	S	64.9	Low	62.3	Low	105 Å²	105	126.8 Å²	126.8	73%	0.734	76%	0.763	S	S	*	*			trans	-62.5	105.6	171.9	-64.2	0	0	0	0	109.8	P77 I81	P77-S79 PolarHBondContact O-N 2.69Å; S79-I81 PolarHBondContact O-N 2.86Å
80	F	53.7	Low	60.2	Low	199 Å²	199	127.8 Å²	127.8	87%	0.873	77%	0.767	S	S	*	*			trans	-60.4	107.2	176.9	-82	-101.1	0	0	0	110.7	I78 P82	I78-F80 WeakPolarHBondContact O-CD2 3.36Å; I78-F80 PolarHBondContact O-N 2.82Å; F80-P82 WeakPolarHBondContact O-CD 3.45Å
81	I	55.8	Low	58.3	Low	156 Å²	156	126.8 Å²	126.8	80%	0.8	76%	0.763	S	S	*	*			trans	-82.3	117.6	169	-60.5	174.7	0	0	0	107.5	S79	S79-I81 PolarHBondContact O-N 2.86Å
82	P	58.4	Low	56.3	Low	94 Å²	94	128.8 Å²	128.8	61%	0.61	77%	0.765	S	S	*	*			trans	-75.4	135.7	-176.9	29.1	-34.1	0	0	0	112	F80 T84	F80-P82 WeakPolarHBondContact O-CD 3.45Å; P82-T84 PolarHBondContact O-N 2.97Å; P82-T84 VanDerWaalsContact O-N 3.08Å
83	P	47	Very low	54.4	Low	133 Å²	133	130 Å²	130	86%	0.864	77%	0.77	S	S	*	*			trans	-82.1	84.8	-180	32.8	-34.7	0	0	0	111.6
84	T	44.7	Very low	52.4	Low	111 Å²	111	130.4 Å²	130.4	68%	0.681	77%	0.77	S	S	*	*			trans	-99.5	97.6	-174.2	-52.1	0	0	0	0	113.5	P82	P82-T84 PolarHBondContact O-N 2.97Å; P82-T84 VanDerWaalsContact O-N 3.08Å
85	Q	45	Very low	50.5	Low	149 Å²	149	134.1 Å²	134.1	70%	0.696	78%	0.775	S	S	*	*			trans	54.5	100.1	151.5	-59	-172.4	4.3	0	0	119.1	Q87	Q85-Q87 PolarHBondContact O-N 3.22Å
86	V	36.9	Very low	48.6	Very low	147 Å²	147	133.5 Å²	133.5	89%	0.891	77%	0.773	S	S	*	*			trans	-69.5	103.6	149.9	-179.6	0	0	0	0	108.4
87	Q	41.6	Very low	46.7	Very low	154 Å²	154	133 Å²	133	72%	0.72	78%	0.778	S	S	*	*			trans	-89.9	107.8	165.6	-84.4	-167	-5.6	0	0	110.2	Q85 S89	Q85-Q87 PolarHBondContact O-N 3.22Å; Q87-S89 PolarHBondContact O-N 3.25Å
88	S	35.8	Very low	45.2	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	78%	0.776	S	S	*	*			trans	-78.2	100.6	171.8	56.8	0	0	0	0	110.8
89	S	41.5	Very low	43.9	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	78%	0.78	S	S	*	*			trans	-116.2	120.8	169.8	46.8	0	0	0	0	110.6	Q87	Q87-S89 PolarHBondContact O-N 3.25Å
90	T	38.4	Very low	42.8	Very low	137 Å²	137	134.9 Å²	134.9	84%	0.84	78%	0.782	S	S	*	*			trans	-90.1	127.7	-169.9	50.7	0	0	0	0	113.1
91	S	40.6	Very low	42.1	Very low	103 Å²	103	132 Å²	132	72%	0.72	78%	0.775	S	S	*	*			trans	-176.5	137.2	136.5	52	0	0	0	0	112.7
92	N	40.8	Very low	41.4	Very low	152 Å²	152	129.6 Å²	129.6	81%	0.813	77%	0.772	S	S	*	*			trans	27.3	130.3	139.2	-45.2	-22.6	0	0	0	117.8
93	V	39.9	Very low	40.8	Very low	140 Å²	140	130.5 Å²	130.5	85%	0.848	78%	0.781	S	S	*	*				-146.3	150.8	53.5	163.2	0	0	0	0	112.8
94	V	39.2	Very low	40.5	Very low	124 Å²	124	133.1 Å²	133.1	75%	0.752	78%	0.782	S	S	*	*			trans	-71.3	141.7	177.6	169.2	0	0	0	0	113
95	F	41.8	Very low	40.5	Very low	194 Å²	194	132.2 Å²	132.2	85%	0.851	78%	0.777	S	S	*	*			trans	-157.6	138.3	134.9	-110.6	-69.8	0	0	0	113.5
96	S	39	Very low	40.2	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	78%	0.784	S	S	*	*			trans	50.9	105.8	162.5	-58.9	0	0	0	0	120.7
97	A	37	Very low	40.3	Very low	98 Å²	98	132.9 Å²	132.9	81%	0.81	78%	0.778	S	S	*	*			trans	-73	178.7	145.1	0	0	0	0	0	109.9
98	S	41.6	Very low	40.2	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	78%	0.782	S	S	*	*			cis	-165.2	143	17.3	52.7	0	0	0	0	112
99	Q	38.4	Very low	40.1	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	78%	0.782	S	S	*	*				177.3	138.1	128.5	-100.7	-178.8	12	0	0	112.7
100	V	41.7	Very low	40	Very low	127 Å²	127	135.6 Å²	135.6	77%	0.77	78%	0.784	S	S	*	*			trans	39.8	96.4	151.4	-165.6	0	0	0	0	116.9
101	D	38.9	Very low	39.8	Very low	138 Å²	138	137 Å²	137	74%	0.738	79%	0.785	S	S	*	*				69.8	93	67	-153.7	37.3	0	0	0	112.8
102	S	40.3	Very low	39.6	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	79%	0.79	S	S	*	*				72.1	139.2	101.1	-50.3	0	0	0	0	114.8
103	S	47.8	Very low	39.4	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	79%	0.792	S	S	*	*			cis	-142.6	156	14.6	54.8	0	0	0	0	113.3
104	H	40.5	Very low	39.1	Very low	188 Å²	188	136.5 Å²	136.5	87%	0.87	79%	0.789	S	S	*	*			trans	-132.7	179	-175.5	-120.4	-25.2	0	0	0	110.9
105	P	44.9	Very low	38.8	Very low	91 Å²	91	138.7 Å²	138.7	59%	0.591	79%	0.792	S	S	*	*				-133.4	-171.9	-124.4	45.7	-29.1	0	0	0	117.2
106	L	37.4	Very low	38.7	Very low	160 Å²	160	137.4 Å²	137.4	84%	0.838	79%	0.788	S	S	*	*			trans	71.1	176.9	155.5	-74.5	167.1	0	0	0	118.9
107	I	39.3	Very low	38.5	Very low	151 Å²	151	141.9 Å²	141.9	77%	0.774	79%	0.794	S	S	*	*			trans	83.6	136	167.1	-53.4	170.1	0	0	0	113.7
108	H	40.2	Very low	38.9	Very low	171 Å²	171	142.1 Å²	142.1	79%	0.792	79%	0.788	S	S	*	*			cis	-142.7	161.1	10.9	-146.3	-74.9	0	0	0	112.8
109	N	33.6	Very low	38.8	Very low	149 Å²	149	145 Å²	145	80%	0.797	79%	0.794	S	S	*	*			trans	-95.2	158.1	166.2	-89.8	-36.7	0	0	0	112.7
110	S	38.9	Very low	38.8	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	79%	0.792	S	S	*	*			trans	173.7	144	139.2	-92.8	0	0	0	0	114.4
111	L	34	Very low	38.7	Very low	167 Å²	167	140 Å²	140	87%	0.874	79%	0.785	S	S	*	*			trans	-91.2	163.8	161.7	-72.4	75.5	0	0	0	110
112	I	37.2	Very low	38.7	Very low	161 Å²	161	142.3 Å²	142.3	83%	0.826	79%	0.791	S	S	*	*			trans	-166.3	139.8	142.1	-109.2	155.8	0	0	0	114.1
113	C	36.7	Very low	38.6	Very low	125 Å²	125	141.8 Å²	141.8	85%	0.845	79%	0.788	S	S	*	*			trans	42.5	143.1	159.5	-60.5	0	0	0	0	124.1
114	A	33	Very low	38.2	Very low	97 Å²	97	144.5 Å²	144.5	80%	0.802	79%	0.79	S	S	*	*			trans	-114	160.3	152.5	0	0	0	0	0	109.1
115	Q	33.4	Very low	37.7	Very low	171 Å²	171	141 Å²	141	80%	0.799	79%	0.785	S	S	*	*			trans	-180	160.1	137.8	-144	172.7	-81	0	0	112.3
116	E	39.7	Very low	37.3	Very low	166 Å²	166	142 Å²	142	78%	0.776	79%	0.792	S	S	*	*			trans	81.9	123.8	157.5	-50	-155.1	158.5	0	0	122.7
117	K	34.7	Very low	37.4	Very low	198 Å²	198	140.6 Å²	140.6	86%	0.861	79%	0.79	S	S	*	*			trans	-93.5	167.7	163.6	-118	175.4	-177.1	173.7	0	107.2
118	P	44.4	Very low	37.5	Very low	104 Å²	104	138.5 Å²	138.5	68%	0.675	79%	0.786	S	S	*	*				-159.7	176.1	58	43.4	-21.5	0	0	0	119.8
119	L	39.9	Very low	37.2	Very low	164 Å²	164	138.1 Å²	138.1	86%	0.859	78%	0.784	S	S	*	*			trans	58	123	145.4	-75.5	162	0	0	0	122.6
120	S	37.9	Very low	37.2	Very low	114 Å²	114	137.1 Å²	137.1	80%	0.797	78%	0.779	S	S	*	*			trans	145.7	142.4	132.4	-172.9	0	0	0	0	111.4
121	S	39	Very low	37	Very low	89 Å²	89	139.3 Å²	139.3	62%	0.622	78%	0.777	S	S	*	*			cis	-166.8	149.9	-23.7	-78.6	0	0	0	0	108.6
122	Q	40.7	Very low	37	Very low	187 Å²	187	139.1 Å²	139.1	87%	0.874	77%	0.771	S	S	*	*			trans	65.3	151.8	165.2	-63.3	167.7	28.3	0	0	117
123	S	36.6	Very low	36.9	Very low	95 Å²	95	135.4 Å²	135.4	66%	0.664	77%	0.765	S	S	*	*			cis	-165.3	164.2	-21.4	58.4	0	0	0	0	111.5
124	M	39.9	Very low	36.7	Very low	170 Å²	170	137 Å²	137	84%	0.837	76%	0.764	S	S	*	*			trans	76.3	139.1	164.5	-56.3	-96.7	57.1	0	0	118.8
125	C	30.2	Very low	36.7	Very low	115 Å²	115	140.9 Å²	140.9	78%	0.777	77%	0.766	S	S	*	*			trans	-125.4	-173.7	175.8	-32.4	0	0	0	0	108
126	P	37.7	Very low	36.6	Very low	113 Å²	113	138.4 Å²	138.4	73%	0.734	77%	0.767	S	S	*	*			cis	-133.7	168.2	-16.3	36.2	-17.3	0	0	0	115.4
127	V	37.7	Very low	36.1	Very low	130 Å²	130	135 Å²	135	79%	0.788	76%	0.761	S	S	*	*			trans	9.9	145.6	130.2	-175.5	0	0	0	0	118.8
128	P	42.7	Very low	35.8	Very low	107 Å²	107	136.7 Å²	136.7	70%	0.695	76%	0.763	S	S	*	*			cis	-130.4	-179.2	2.1	30.3	-8.1	0	0	0	116.2
129	E	33.7	Very low	35.2	Very low	163 Å²	163	137.2 Å²	137.2	76%	0.762	77%	0.768	S	S	*	*				136.6	121.8	115.7	-161.1	157.6	-169.9	0	0	117.2
130	N	32.8	Very low	34.9	Very low	128 Å²	128	136.9 Å²	136.9	68%	0.684	77%	0.767	S	S	*	*			trans	22.5	113.4	156.6	-56	-33.5	0	0	0	120.8
131	Q	35.1	Very low	34.8	Very low	162 Å²	162	139.5 Å²	139.5	76%	0.757	76%	0.764	S	S	*	*				-169.7	149	102.6	-103.6	179.6	-52.5	0	0	113.3
132	E	34	Very low	34.7	Very low	162 Å²	162	141.1 Å²	141.1	76%	0.757	76%	0.762	S	S	*	*			trans	25.7	144.5	143.4	-65.8	157.4	-135.2	0	0	122
133	A	35	Very low	34.4	Very low	84 Å²	84	137.7 Å²	137.7	69%	0.694	75%	0.749	S	S	*	*			cis	-172.9	156.9	-14.1	0	0	0	0	0	109.6
134	L	33.4	Very low	34.4	Very low	159 Å²	159	136.5 Å²	136.5	83%	0.832	74%	0.741	S	S	*	*			trans	155.4	139.9	131.4	-85.1	168	0	0	0	113.5
135	Q	32.3	Very low	34.1	Very low	178 Å²	178	139 Å²	139	83%	0.832	74%	0.741	S	S	*	*			trans	57.6	105.8	165.8	-58.2	177.3	12.9	0	0	115.8
136	S	31.2	Very low	34.5	Very low	119 Å²	119	139.6 Å²	139.6	83%	0.832	74%	0.741	S	S	*	*				-171.4	145.5	62.9	43.4	0	0	0	0	115.4
137	S	29.1	Very low	34.5	Very low	93 Å²	93	139.8 Å²	139.8	65%	0.65	75%	0.745	S	S	*	*			trans	67.5	145.3	150.6	-150.3	0	0	0	0	123
138	W	28.9	Very low	34.4	Very low	235 Å²	235	141.8 Å²	141.8	89%	0.89	75%	0.746	S	S	*	*			trans	86.2	144.3	163.2	-55.6	108.2	0	0	0	120.7
139	S	32	Very low	34.3	Very low	114 Å²	114	144.7 Å²	144.7	80%	0.797	76%	0.756	S	S	*	*			trans	83.1	101.2	167.2	-56.8	0	0	0	0	120.8
140	L	33.8	Very low	34.2	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	75%	0.751	S	S	*	*			trans	-143	152.4	152.6	-90.8	100.5	0	0	0	106.8
141	F	34.9	Very low	34.4	Very low	168 Å²	168	147.9 Å²	147.9	74%	0.737	77%	0.766	S	S	*	*			cis	-165.3	158.1	-8.5	-130.8	-141.6	0	0	0	106.7
142	E	36.3	Very low	34.3	Very low	123 Å²	123	145.7 Å²	145.7	58%	0.575	77%	0.768	S	S	*	*			cis	-137.8	-118	-9.2	-157.9	-152.8	116.6	0	0	107.6
143	N	35.9	Very low	34.4	Very low	115 Å²	115	144.5 Å²	144.5	62%	0.615	77%	0.772	S	S	*	*			cis	-148.9	154.1	-12.9	-147.5	-70.2	0	0	0	111.1
144	S	35.2	Very low	34.5	Very low	70 Å²	70	145.8 Å²	145.8	49%	0.49	78%	0.776	S	S	.	*			trans	12.8	147.1	152.9	-65.1	0	0	0	0	123.3
145	R	35.3	Very low	34.6	Very low	222 Å²	222	142.2 Å²	142.2	84%	0.838	78%	0.778	S	S	*	*			cis	-167	138.4	2.2	-113.2	162.3	-161.9	-127	0.9	114
146	V	36.5	Very low	34.7	Very low	128 Å²	128	137 Å²	137	78%	0.776	77%	0.773	S	S	*	*			trans	48.6	117.6	131.4	179.2	0	0	0	0	121.2
147	S	39.2	Very low	35	Very low	117 Å²	117	140.9 Å²	140.9	82%	0.818	78%	0.777	S	S	*	*				-170.2	147.5	113.3	-79.1	0	0	0	0	112.5
148	Q	34.6	Very low	35.3	Very low	173 Å²	173	140.8 Å²	140.8	81%	0.808	78%	0.781	S	S	*	*			trans	-108.9	162.6	174.6	-61.8	-179.6	-79.2	0	0	111.1
149	N	40.6	Very low	35.5	Very low	168 Å²	168	139.6 Å²	139.6	90%	0.898	78%	0.778	S	S	*	*				-169.9	145.9	120.8	-92.1	-26.7	0	0	0	111.6
150	S	33.1	Very low	35.7	Very low	96 Å²	96	142.3 Å²	142.3	67%	0.671	78%	0.783	S	S	*	*			trans	-107.2	170	-176.5	-47	0	0	0	0	111.7
151	W	35.8	Very low	35.7	Very low	262 Å²	262	142 Å²	142	99%	0.992	78%	0.777	S	S	*	*			trans	-166.9	159.2	137.4	-90.2	0.6	0	0	0	110.3
152	S	33.1	Very low	35.8	Very low	115 Å²	115	142 Å²	142	80%	0.804	79%	0.785	S	S	*	*			trans	-151.3	138.9	-170.7	-49.9	0	0	0	0	112.1
153	T	36.8	Very low	35.7	Very low	137 Å²	137	143.4 Å²	143.4	84%	0.84	80%	0.796	S	S	*	*			trans	-146.9	109	176	-61.5	0	0	0	0	114.3
154	S	35.9	Very low	35.6	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	81%	0.811	S	S	*	*			trans	28.2	134	149.6	68.6	0	0	0	0	125.8
155	G	35.6	Very low	35.6	Very low	84 Å²	84	147.7 Å²	147.7	87%	0.866	83%	0.828	S	S	*	*				98.6	145.2	128.5	0	0	0	0	0	118.7
156	G	35.1	Very low	35.6	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	83%	0.825	S	S	*	*			cis	159.1	135.3	-12	0	0	0	0	0	114.3
157	H	37.5	Very low	35.4	Very low	200 Å²	200	141.9 Å²	141.9	93%	0.926	83%	0.829	S	S	*	*			trans	65	154.6	173.9	-79.4	-95.4	0	0	0	116.9
158	A	35.9	Very low	35.1	Very low	90 Å²	90	139.6 Å²	139.6	74%	0.744	82%	0.824	S	S	*	*			cis	-151.4	177.5	-6.4	0	0	0	0	0	112
159	Y	31.8	Very low	35	Very low	210 Å²	210	142.6 Å²	142.6	82%	0.824	83%	0.83	S	S	*	*			trans	-59.2	151.4	178	-89.5	-123.8	0	0	0	115.5
160	L	37.8	Very low	34.7	Very low	172 Å²	172	144.1 Å²	144.1	90%	0.901	83%	0.831	S	S	*	*				-157.3	150.6	119.5	-111.6	173.6	0	0	0	112
161	Q	33.5	Very low	34.6	Very low	151 Å²	151	142.5 Å²	142.5	71%	0.706	83%	0.83	S	S	*	*			trans	-95.9	150.8	176.3	-66.7	172.4	-25.7	0	0	110.8
162	N	37.5	Very low	34.5	Very low	169 Å²	169	136.1 Å²	136.1	90%	0.904	82%	0.822	S	S	*	*			trans	-162.6	144.2	138.4	-101.4	-39.8	0	0	0	110.8
163	L	32.9	Very low	34.6	Very low	151 Å²	151	136 Å²	136	79%	0.791	82%	0.818	S	S	*	*			trans	-96.2	145.9	177.5	-61.9	93.1	0	0	0	110.9
164	C	34.7	Very low	34.2	Very low	139 Å²	139	139 Å²	139	94%	0.939	82%	0.823	S	S	*	*			trans	-157.5	147	144.9	-124.5	0	0	0	0	110.3
165	T	34.3	Very low	33.8	Very low	137 Å²	137	138.8 Å²	138.8	84%	0.84	82%	0.822	S	S	*	*			trans	-114.1	128.6	-158.7	-55.2	0	0	0	0	113.5
166	A	35.1	Very low	33.5	Very low	94 Å²	94	139.5 Å²	139.5	78%	0.777	82%	0.819	S	S	*	*			trans	-153.8	143	153	0	0	0	0	0	109.9
167	P	32.8	Very low	33.2	Very low	134 Å²	134	148.3 Å²	148.3	87%	0.87	83%	0.831	S	S	*	*			trans	-94.6	149.1	-167.5	35.9	-35.4	0	0	0	114.7
168	G	33.1	Very low	33	Very low	69 Å²	69	144.5 Å²	144.5	71%	0.711	82%	0.824	S	S	*	*			trans	-167.1	66.8	179.3	0	0	0	0	0	115.3
169	Y	32.7	Very low	32.7	Very low	235 Å²	235	146.2 Å²	146.2	92%	0.922	83%	0.83	S	S	*	*			trans	45.5	112.5	163.8	-79.1	-90.5	0	0	0	120.1
170	H	33.7	Very low	32.5	Very low	201 Å²	201	145.3 Å²	145.3	93%	0.931	83%	0.826	S	S	*	*			trans	-127	131.4	167.3	-115.7	-82.2	0	0	0	110.2
171	G	30.7	Very low	32.2	Very low	62 Å²	62	144 Å²	144	64%	0.639	82%	0.82	S	S	*	*			trans	74.3	178.4	174	0	0	0	0	0	115.3
172	P	34.7	Very low	32.2	Very low	128 Å²	128	142.1 Å²	142.1	83%	0.831	82%	0.824	S	S	*	*			cis	-102.4	-177.5	7.9	41.9	-35	0	0	0	113.3
173	P	33.6	Very low	32	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	82%	0.817	S	S	*	*			trans	-91	-179.3	-167.5	37.6	-36	0	0	0	114.6	S175	P173-S175 PolarHBondContact O-N 3.36Å
174	Q	29.4	Very low	32.2	Very low	200 Å²	200	142.2 Å²	142.2	94%	0.935	82%	0.815	S	S	*	*			trans	-58.9	126.6	169.7	-63.9	168.1	-55.7	0	0	111.2
175	S	28.3	Very low	32.4	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	80%	0.802	S	S	*	*			trans	-155.2	121.7	170.8	60.4	0	0	0	0	112.6	P173	P173-S175 PolarHBondContact O-N 3.36Å
176	A	28.5	Very low	32.2	Very low	98 Å²	98	139.2 Å²	139.2	81%	0.81	80%	0.799	S	S	*	*			trans	34.9	114.5	157.2	0	0	0	0	0	119.7
177	W	29.4	Very low	32.1	Very low	256 Å²	256	143.4 Å²	143.4	97%	0.97	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.6	134	154.2	-72.1	77.9	0	0	0	109.6
178	P	33.5	Very low	32	Very low	120 Å²	120	144.4 Å²	144.4	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-80.2	158.5	177	33.1	-35.2	0	0	0	112.6
179	S	28.7	Very low	31.9	Very low	126 Å²	126	146.3 Å²	146.3	88%	0.881	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.3	170.4	-175.5	-51.9	0	0	0	0	115.3
180	Y	27.8	Very low	32.1	Very low	190 Å²	190	146 Å²	146	75%	0.745	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-53.3	166.3	-175.6	-101.8	-104.1	0	0	0	118.8
181	N	31.6	Very low	32.1	Very low	144 Å²	144	139.6 Å²	139.6	77%	0.77	78%	0.783	S	S	*	*			trans	90.8	101.3	153.7	-61.9	-33.6	0	0	0	120.6
182	S	33.9	Very low	32.5	Very low	112 Å²	112	140.8 Å²	140.8	78%	0.783	78%	0.781	S	S	*	*				-178.6	124	113.6	60.5	0	0	0	0	114.1
183	H	33.3	Very low	32.7	Very low	164 Å²	164	142.3 Å²	142.3	76%	0.759	78%	0.777	S	S	*	*			trans	22.3	122.8	155	-75.1	-83.5	0	0	0	121.3
184	E	35.7	Very low	33	Very low	158 Å²	158	139.8 Å²	139.8	74%	0.738	77%	0.766	S	S	*	*				78.2	162.3	75.7	-98.3	-155.3	123.3	0	0	115.5
185	P	39.4	Very low	33.5	Very low	105 Å²	105	133.3 Å²	133.3	68%	0.682	74%	0.743	S	S	*	*			cis	-136.1	168.8	-30	35.2	-18.8	0	0	0	114.4
186	S	30.9	Very low	33.9	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	73%	0.729	S	S	*	*			trans	-154	142.6	149.5	80.2	0	0	0	0	113.5
187	Q	32.1	Very low	34.5	Very low	181 Å²	181	134.9 Å²	134.9	85%	0.846	72%	0.724	S	S	*	*	S	Bend	trans	55	67.8	165.9	-54.9	-167.8	19.1	0	0	118.7
188	N	30.6	Very low	34.9	Very low	155 Å²	155	127.4 Å²	127.4	83%	0.829	71%	0.711	S	S	*	*			trans	-178.9	68.1	132.4	-92.3	-32.1	0	0	0	110.8	W190	N188-W190 PolarHBondContact O-N 3.27Å
189	A	30.5	Very low	35	Very low	109 Å²	109	130.1 Å²	130.1	90%	0.901	71%	0.71	S	S	*	*			trans	-73.5	92.7	-170.8	0	0	0	0	0	113.6
190	W	37.3	Very low	35.1	Very low	229 Å²	229	134.3 Å²	134.3	87%	0.867	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-79.2	149.9	157.3	-79.8	75.9	0	0	0	110.3	N188 S192	N188-W190 PolarHBondContact O-N 3.27Å; W190-S192 PolarHBondContact O-N 2.65Å
191	P	34.8	Very low	35.3	Very low	67 Å²	67	130.4 Å²	130.4	44%	0.435	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-67.3	133	-176.5	27.1	-34.7	0	0	0	111.8	L196	P191-L196 HydrophobicContact CG-CD2 3.97Å; P191-L196 HydrophobicContact CG-CG 4.22Å
192	S	38.3	Very low	35.3	Very low	86 Å²	86	127.5 Å²	127.5	60%	0.601	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-51.8	149.7	172.1	173	0	0	0	0	111.9	W190 A194 S195 L196	W190-S192 PolarHBondContact O-N 2.65Å; S192-A194 PolarHBondContact O-N 2.97Å; S192-S195 WeakPolarHBondContact O-CA 3.26Å; S192-S195 WeakPolarHBondContact O-CB 3.36Å; S192-S195 PolarHBondContact O-N 3.36Å; S192-L196 PolarHBondContact O-N 3.25Å
193	Q	38.4	Very low	35.1	Very low	161 Å²	161	127.5 Å²	127.5	75%	0.752	70%	0.7	S	S	*	*	H	α-helix	trans	-51.9	-31.3	-176.8	-168	172.4	-3.2	0	0	113.5	L196 Q197	Q193-L196 PolarHBondContact O-N 3.06Å; Q193-Q197 PolarHBondContact O-N 3.43Å
194	A	40.3	Very low	35	Very low	59 Å²	59	128.5 Å²	128.5	49%	0.488	71%	0.705	S	S	.	*	H	α-helix	trans	-65.6	-43	172.6	0	0	0	0	0	113	S192 L196 Q197 S198	S192-A194 PolarHBondContact O-N 2.97Å; A194-L196 PolarHBondContact O-N 3.36Å; A194-Q197 PolarHBondContact O-N 3.03Å; A194-S198 PolarHBondContact O-N 2.76Å; A194-S198 PolarHBondContact O-OG 3Å
195	S	40.3	Very low	34.8	Very low	64 Å²	64	125.8 Å²	125.8	45%	0.448	70%	0.704	S	S	.	*	H	α-helix	trans	-67.9	-19.7	174.3	-67.4	0	0	0	0	113.3	S192 K199	S192-S195 WeakPolarHBondContact O-CA 3.26Å; S192-S195 WeakPolarHBondContact O-CB 3.36Å; S192-S195 PolarHBondContact O-N 3.36Å; S195-K199 WeakPolarHBondContact O-CB 3.24Å
196	L	36.1	Very low	34.5	Very low	90 Å²	90	129.4 Å²	129.4	47%	0.471	71%	0.711	S	S	.	*	H	α-helix	trans	-80.2	-17.3	169.3	-69.3	174.8	0	0	0	113.1	P191 S192 Q193 A194 W200	P191-L196 HydrophobicContact CG-CD2 3.97Å; P191-L196 HydrophobicContact CG-CG 4.22Å; S192-L196 PolarHBondContact O-N 3.25Å; Q193-L196 PolarHBondContact O-N 3.06Å; A194-L196 PolarHBondContact O-N 3.36Å; L196-W200 VanDerWaalsContact O-CD1 3.26Å
197	Q	40.6	Very low	34.5	Very low	148 Å²	148	128.9 Å²	128.9	69%	0.692	71%	0.707	S	S	*	*	H	α-helix	trans	-83.3	-42.2	166.9	-70.9	-177.7	-27.2	0	0	111.5	Q193 A194 K199	Q193-Q197 PolarHBondContact O-N 3.43Å; A194-Q197 PolarHBondContact O-N 3.03Å; Q197-K199 PolarHBondContact O-N 3.15Å; Q197-K199 VanDerWaalsContact O-N 3.12Å
198	S	39.1	Very low	34.6	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-16	-178.9	-48	0	0	0	0	115.3	A194	A194-S198 PolarHBondContact O-N 2.76Å; A194-S198 PolarHBondContact O-OG 3Å
199	K	34.3	Very low	34.8	Very low	177 Å²	177	128.9 Å²	128.9	77%	0.77	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-0.4	-171.1	-152.9	173	-176.1	-178.7	0	114.6	S195 Q197	S195-K199 WeakPolarHBondContact O-CB 3.24Å; Q197-K199 PolarHBondContact O-N 3.15Å; Q197-K199 VanDerWaalsContact O-N 3.12Å
200	W	32.8	Very low	34.9	Very low	214 Å²	214	130 Å²	130	81%	0.811	69%	0.691	S	S	*	*	S	Bend	trans	-112.1	0.2	177.6	-74.2	87.4	0	0	0	114.1	L196 A202	L196-W200 VanDerWaalsContact O-CD1 3.26Å; W200-A202 PolarHBondContact O-N 2.96Å
201	S	30.8	Very low	34.8	Very low	108 Å²	108	127.7 Å²	127.7	76%	0.755	69%	0.69	S	S	*	*			trans	-76.8	66.3	172.3	-54.5	0	0	0	0	112.4
202	A	31.1	Very low	34.7	Very low	82 Å²	82	130.5 Å²	130.5	68%	0.678	71%	0.705	S	S	*	*			trans	-86.7	139.2	165.9	0	0	0	0	0	109.9	W200 E204	W200-A202 PolarHBondContact O-N 2.96Å; A202-E204 PolarHBondContact O-N 3Å
203	P	29.8	Very low	34.7	Very low	112 Å²	112	131.6 Å²	131.6	73%	0.727	71%	0.71	S	S	*	*			trans	-79	118.8	-172.7	30.1	-34.1	0	0	0	112.4	S205	P203-S205 VanDerWaalsContact C-N 3.27Å; P203-S205 PolarHBondContact O-N 3.14Å
204	E	31.9	Very low	34.7	Very low	186 Å²	186	132.2 Å²	132.2	87%	0.869	71%	0.713	S	S	*	*			trans	-74.9	75.2	171.3	-67.7	-167.5	130.5	0	0	111.7	A202 H206	A202-E204 PolarHBondContact O-N 3Å; E204-H206 VanDerWaalsContact C-N 3.34Å; E204-H206 PolarHBondContact O-N 3.34Å
205	S	30.9	Very low	34.3	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	72%	0.72	S	S	*	*			trans	-92.5	57.5	173.1	56.1	0	0	0	0	112.5	P203 S207	P203-S205 VanDerWaalsContact C-N 3.27Å; P203-S205 PolarHBondContact O-N 3.14Å; S205-S207 PolarHBondContact O-N 2.88Å
206	H	34.6	Very low	34.2	Very low	180 Å²	180	139.4 Å²	139.4	83%	0.833	74%	0.738	S	S	*	*			trans	-98.8	77.2	178.7	-74.2	-51.3	0	0	0	113.3	E204	E204-H206 VanDerWaalsContact C-N 3.34Å; E204-H206 PolarHBondContact O-N 3.34Å
207	S	30.3	Very low	34.2	Very low	98 Å²	98	139.2 Å²	139.2	69%	0.685	74%	0.744	S	S	*	*			trans	-92.7	109	158.1	-179.7	0	0	0	0	109.4	S205	S205-S207 PolarHBondContact O-N 2.88Å
208	Y	33.5	Very low	33.9	Very low	199 Å²	199	139.2 Å²	139.2	78%	0.78	75%	0.749	S	S	*	*				173	113.8	122.2	-108.4	-80.8	0	0	0	111
209	D	34.3	Very low	33.8	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	75%	0.752	S	S	*	*			trans	-59	137.6	156.7	-99.5	-66.5	0	0	0	110.2
210	N	33.3	Very low	34	Very low	134 Å²	134	139.4 Å²	139.4	72%	0.717	75%	0.754	S	S	*	*			trans	-144	87.2	162.4	-93.8	-78.5	0	0	0	109.1
211	Q	35.4	Very low	34.3	Very low	180 Å²	180	134.6 Å²	134.6	84%	0.841	75%	0.75	S	S	*	*			trans	-75.6	136.4	170	-65	-173.5	22.4	0	0	110.8
212	V	33.2	Very low	34.6	Very low	125 Å²	125	138.3 Å²	138.3	76%	0.758	76%	0.756	S	S	*	*			trans	-150.6	144.5	-175.1	166	0	0	0	0	104.5
213	P	38.3	Very low	35	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	76%	0.758	S	S	*	*			cis	-133.3	-158.5	19	31.7	-7.6	0	0	0	114.8
214	Q	37.5	Very low	35.3	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	76%	0.759	S	S	*	*			trans	114.4	127.9	160.6	-54.6	-124.5	26.4	0	0	113.2
215	G	32.6	Very low	35.8	Very low	60 Å²	60	135.8 Å²	135.8	62%	0.619	76%	0.762	S	S	*	*			cis	-179.9	177.6	-6.5	0	0	0	0	0	112.8
216	Y	37.3	Very low	35.9	Very low	213 Å²	213	136 Å²	136	84%	0.835	76%	0.763	S	S	*	*			trans	79.9	115.7	164	-63	-75.3	0	0	0	122.6
217	S	36.7	Very low	36	Very low	87 Å²	87	132.5 Å²	132.5	61%	0.608	76%	0.759	S	S	*	*				93.2	90.7	124.2	-62.2	0	0	0	0	123.8
218	N	33.4	Very low	36.3	Very low	147 Å²	147	135.2 Å²	135.2	79%	0.786	76%	0.761	S	S	*	*				83.7	148	114.3	-62.3	-16.9	0	0	0	123.7
219	T	38.8	Very low	36.3	Very low	122 Å²	122	134.5 Å²	134.5	75%	0.748	76%	0.758	S	S	*	*			trans	85.4	81.4	160.8	-30.4	0	0	0	0	115.8
220	I	37.4	Very low	36.5	Very low	159 Å²	159	136.7 Å²	136.7	82%	0.815	76%	0.757	S	S	*	*				88.7	134.5	81.7	-74.4	168.9	0	0	0	113.3
221	P	39.8	Very low	36.6	Very low	113 Å²	113	137.6 Å²	137.6	73%	0.734	76%	0.757	S	S	*	*			trans	-115.8	179.9	-161	43.6	-34.1	0	0	0	115.2
222	Q	36.4	Very low	36.8	Very low	186 Å²	186	136.1 Å²	136.1	87%	0.869	75%	0.75	S	S	*	*			trans	-173.1	163.7	141.3	-94.2	-82	-35.6	0	0	111.5
223	P	39.7	Very low	37.1	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	74%	0.741	S	S	*	*			trans	-133.7	171.8	-162.5	43	-27	0	0	0	118.5
224	G	35.4	Very low	37.1	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	74%	0.742	S	S	*	*			trans	90.3	175.4	161.6	0	0	0	0	0	116.7
225	P	42.3	Very low	37	Very low	143 Å²	143	136.4 Å²	136.4	93%	0.929	74%	0.737	S	S	*	*			cis	-130.9	-157.2	9.6	43.8	-26.6	0	0	0	115.8
226	S	33.9	Very low	37.3	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	74%	0.739	S	S	*	*			trans	-99.4	152.2	-162.8	153.2	0	0	0	0	117.4
227	S	36.5	Very low	37.3	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	73%	0.726	S	S	*	*			trans	-166.6	125.1	140.5	-108.4	0	0	0	0	109.6
228	Q	35.6	Very low	37.3	Very low	154 Å²	154	139.8 Å²	139.8	72%	0.72	73%	0.733	S	S	*	*				70.3	123.4	74.3	-75.1	-71.5	4	0	0	115.8
229	Y	35.5	Very low	37.5	Very low	185 Å²	185	139.9 Å²	139.9	73%	0.725	73%	0.733	S	S	*	*				161.9	143.3	126.1	-94	-63	0	0	0	117.1
230	Y	37.1	Very low	37.2	Very low	183 Å²	183	139 Å²	139	72%	0.718	73%	0.732	S	S	*	*			trans	47.7	133.2	165.7	-65.2	-78.3	0	0	0	120.6
231	E	36.9	Very low	37.1	Very low	153 Å²	153	136.7 Å²	136.7	72%	0.715	73%	0.73	S	S	*	*			cis	106.5	158.8	14.8	-170.8	-179	-115.3	0	0	115.1
232	H	39.6	Very low	36.8	Very low	148 Å²	148	140 Å²	140	69%	0.685	74%	0.736	S	S	*	*			trans	91.1	140.7	-176.1	-75.1	25.6	0	0	0	116.7
233	N	38.7	Very low	36.7	Very low	107 Å²	107	138.3 Å²	138.3	57%	0.572	73%	0.733	S	S	*	*			cis	-158.6	152.6	-13.2	-114.8	-4.7	0	0	0	113.9
234	H	37	Very low	36.3	Very low	157 Å²	157	137 Å²	137	73%	0.727	73%	0.726	S	S	*	*			trans	9.8	159.8	140.3	-63.8	-47.9	0	0	0	122.7
235	Q	36.4	Very low	36.4	Very low	151 Å²	151	140 Å²	140	71%	0.706	73%	0.725	S	S	*	*			cis	-169.8	180	22.1	-136.8	164.7	39.6	0	0	113.8
236	I	38.4	Very low	35.8	Very low	131 Å²	131	140.5 Å²	140.5	67%	0.672	72%	0.72	S	S	*	*			trans	73.6	136.2	151.3	-73	161.1	0	0	0	118.2
237	N	37.3	Very low	36.3	Very low	104 Å²	104	140.6 Å²	140.6	56%	0.556	72%	0.718	S	S	*	*			cis	-165.9	144.6	-12.4	-104.8	-6.2	0	0	0	112.8
238	Y	36.3	Very low	36	Very low	196 Å²	196	141.6 Å²	141.6	77%	0.769	72%	0.719	S	S	*	*			trans	54.8	159.5	145.8	-56.8	-46.7	0	0	0	121.9
239	L	38.8	Very low	35.9	Very low	150 Å²	150	138.8 Å²	138.8	79%	0.785	72%	0.717	S	S	*	*			cis	-147.5	169.7	3.1	-155.1	63.2	0	0	0	112.5
240	S	32.6	Very low	35.8	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	72%	0.723	S	S	*	*			trans	-38.6	172.5	175.6	-40.5	0	0	0	0	119.4
241	S	34.2	Very low	35.3	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	73%	0.726	S	S	*	*			cis	-157.9	156.2	21	-161.4	0	0	0	0	115
242	E	33.4	Very low	35.1	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	73%	0.731	S	S	*	*			trans	-92.2	154.4	160.2	-65.4	175.4	97.7	0	0	112
243	N	35.4	Very low	34.6	Very low	150 Å²	150	135.1 Å²	135.1	80%	0.802	73%	0.732	S	S	*	*			trans	-176.8	118.1	149.8	-105.5	-15.3	0	0	0	106.7
244	S	31.5	Very low	34.1	Very low	82 Å²	82	140.6 Å²	140.6	57%	0.573	75%	0.746	S	S	*	*			cis	87.6	138.8	47.1	88.2	0	0	0	0	114.6
245	N	37	Very low	33.7	Very low	136 Å²	136	136 Å²	136	73%	0.727	74%	0.742	S	S	*	*			trans	87.6	95.2	162.1	-54.7	-45	0	0	0	122.1
246	N	30.3	Very low	33.3	Very low	155 Å²	155	137 Å²	137	83%	0.829	75%	0.746	S	S	*	*				81.9	160.7	122	-85.8	-19.1	0	0	0	121.8
247	P	44.5	Very low	32.8	Very low	107 Å²	107	136.3 Å²	136.3	70%	0.695	74%	0.741	S	S	*	*			trans	-131.4	-141.6	-142.7	43.8	-24.6	0	0	0	113.6
248	V	30.4	Very low	32.4	Very low	127 Å²	127	140 Å²	140	77%	0.77	75%	0.748	S	S	*	*			trans	80.9	136.9	179.9	-166.1	0	0	0	0	110.7
249	S	32.6	Very low	32	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	74%	0.744	S	S	*	*			cis	-154.2	156.4	27.7	-7.2	0	0	0	0	115.6
250	H	32.6	Very low	31.5	Very low	186 Å²	186	135.4 Å²	135.4	86%	0.861	74%	0.744	S	S	*	*			trans	60.9	122.2	143.2	-75.4	-62.9	0	0	0	124.7
251	C	27.3	Very low	31.5	Very low	115 Å²	115	136.4 Å²	136.4	78%	0.777	75%	0.745	S	S	*	*			trans	-67.9	152	161.5	-36.1	0	0	0	0	114.6
252	K	32.8	Very low	31.4	Very low	190 Å²	190	134 Å²	134	83%	0.826	74%	0.738	S	S	*	*				-167.9	134.3	127.3	-92.5	143.8	-173	-179.1	0	105.6
253	S	29.8	Very low	31.5	Very low	101 Å²	101	128.1 Å²	128.1	71%	0.706	72%	0.717	S	S	*	*			cis	67.7	142.4	49.3	-162	0	0	0	0	112.6
254	Y	28.5	Very low	31.4	Very low	221 Å²	221	123.2 Å²	123.2	87%	0.867	70%	0.702	S	S	*	*			trans	62.6	128	-150.6	-53.8	-87.9	0	0	0	111.8
255	G	27.7	Very low	31.6	Very low	62 Å²	62	124 Å²	124	64%	0.639	70%	0.696	S	S	*	*			cis	125.2	153	3.3	0	0	0	0	0	110.5
256	E	28.7	Very low	31.6	Very low	170 Å²	170	123.6 Å²	123.6	79%	0.794	70%	0.699	S	S	*	*			trans	67.1	158.7	177.2	-54.6	-161.3	103	0	0	113.3
257	Q	27.7	Very low	31.8	Very low	118 Å²	118	119.4 Å²	119.4	55%	0.551	69%	0.693	S	S	*	*			cis	-159.5	159.4	-2	-129.8	165.1	37	0	0	109.6
258	Y	27.8	Very low	31.4	Very low	182 Å²	182	123.3 Å²	123.3	71%	0.714	70%	0.702	S	S	*	*			trans	60.3	124.2	164.4	-59.7	-57.8	0	0	0	118.7
259	C	28	Very low	31.5	Very low	100 Å²	100	123.8 Å²	123.8	68%	0.676	70%	0.699	S	S	*	*				64.4	149.1	65.2	-60.8	0	0	0	0	112.4
260	N	29.5	Very low	31.4	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	70%	0.704	S	S	*	*			cis	-162.1	173.6	-3.3	-107.5	-12.8	0	0	0	106.4
261	V	30.9	Very low	31.5	Very low	124 Å²	124	123.5 Å²	123.5	75%	0.752	69%	0.69	S	S	*	*			cis	-148.8	164.5	3.3	99.6	0	0	0	0	105.8
262	G	32.6	Very low	31.6	Very low	60 Å²	60	128.6 Å²	128.6	62%	0.619	69%	0.694	S	S	*	*				91.6	159.8	53.4	0	0	0	0	0	111.6
263	S	36.7	Very low	31.5	Very low	61 Å²	61	125.3 Å²	125.3	43%	0.427	68%	0.682	S	S	.	*			cis	-173.4	156.1	-3.4	172.6	0	0	0	0	112.3	H357 R358	S263-H357 WeakPolarHBondContact CB-O 3.42Å; S263-H357 PolarHBondContact OG-O 3.26Å; S263-R358 WeakPolarHBondContact O-CB 3.46Å; S263-R358 VanDerWaalsContact O-CG 3.31Å; S263-R358 WeakPolarHBondContact O-CG 3.37Å
264	G	32.1	Very low	31.5	Very low	46 Å²	46	128.3 Å²	128.3	47%	0.474	68%	0.682	S	S	.	*			trans	98.9	152.6	148.5	0	0	0	0	0	117.7
265	H	36.5	Very low	31.5	Very low	98 Å²	98	124.7 Å²	124.7	45%	0.454	67%	0.667	S	S	.	*			cis	-163.9	157.8	-0.3	-81	-41.6	0	0	0	107.1	L356 H357	H265-L356 WeakPolarHBondContact NE2-CA 3.21Å; H265-H357 WeakPolarHBondContact NE2-CA 3.39Å; H265-H357 PolarHBondContact NE2-N 3.42Å; H265-H357 PolarHBondContact NE2-O 3.36Å
266	T	36.6	Very low	31.6	Very low	128 Å²	128	132.4 Å²	132.4	79%	0.785	68%	0.677	S	S	*	*			cis	-166.2	165.8	-9.4	20.3	0	0	0	0	106.8
267	G	33.9	Very low	31.6	Very low	68 Å²	68	129.1 Å²	129.1	70%	0.701	67%	0.669	S	S	*	*			cis	-175.7	162.9	-1.2	0	0	0	0	0	110.9
268	Q	36.5	Very low	31.8	Very low	189 Å²	189	131 Å²	131	88%	0.883	68%	0.678	S	S	*	*			trans	-101.5	-166	169.1	-57.5	-178.7	-16.2	0	0	109
269	I	32.1	Very low	31.9	Very low	137 Å²	137	129.2 Å²	129.2	70%	0.703	68%	0.68	S	S	*	*				-167.7	150.4	61.1	-82.4	179.5	0	0	0	109.9	R271	I269-R271 HydrophobicContact CG2-CG 4.28Å
270	T	31.9	Very low	32.3	Very low	129 Å²	129	130.4 Å²	130.4	79%	0.791	68%	0.68	S	S	*	*			trans	-90.3	145.1	166.6	46.7	0	0	0	0	112
271	R	33.6	Very low	32.4	Very low	147 Å²	147	132.1 Å²	132.1	56%	0.555	68%	0.683	S	S	*	*			trans	-137.3	141.9	165.5	-74.8	-165.4	-173.8	159.2	12.4	112.9	I269 D352 D353	I269-R271 HydrophobicContact CG2-CG 4.28Å; R271-D352 VanDerWaalsContact NH1-C 3.25Å; R271-D352 PolarHBondContact NH1-O 2.97Å; R271-D353 PolarHBondContact NH2-O 3.46Å; R271-D353 VanDerWaalsContact NH2-O 3.09Å
272	Y	29.8	Very low	32.6	Very low	221 Å²	221	129.8 Å²	129.8	87%	0.867	68%	0.684	S	S	*	*			trans	-87.6	148.9	169.1	-74.6	-121.9	0	0	0	110.1
273	Q	31.4	Very low	32.7	Very low	121 Å²	121	134.1 Å²	134.1	57%	0.565	69%	0.693	S	S	*	*				-171.4	147.8	122.5	-104.1	-179.9	46.7	0	0	116.5
274	K	30.1	Very low	32.5	Very low	164 Å²	164	137 Å²	137	71%	0.713	70%	0.704	S	S	*	*			trans	19.7	108.3	144.7	-61.1	168	-176.9	173	0	122.1
275	R	26.8	Very low	32.8	Very low	145 Å²	145	142.6 Å²	142.6	55%	0.547	72%	0.717	S	S	.	*				28.8	110.6	108.3	-175	-157.9	-68.9	-132.9	-0	117.4
276	W	29.9	Very low	32.6	Very low	224 Å²	224	147.6 Å²	147.6	85%	0.848	73%	0.734	S	S	*	*			trans	-144.7	140.6	143.3	-93.5	88.9	0	0	0	110.2
277	T	29.8	Very low	32.7	Very low	102 Å²	102	147.8 Å²	147.8	63%	0.626	74%	0.739	S	S	*	*			trans	-126.6	120	169.7	43.5	0	0	0	0	108	P346	T277-P346 HydrophobicContact CG2-CG 3.57Å
278	Q	30.7	Very low	32.6	Very low	158 Å²	158	148.8 Å²	148.8	74%	0.738	74%	0.735	S	S	*	*			trans	-151.9	144.4	166.3	-164.7	162.9	-35.6	0	0	110.1
279	N	29.8	Very low	32.7	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	73%	0.734	S	S	*	*			trans	-69	151.9	173.2	-49.8	-49.2	0	0	0	110.1
280	D	36.9	Very low	32.8	Very low	126 Å²	126	146.2 Å²	146.2	67%	0.674	74%	0.735	S	S	*	*				-164.3	130.2	114.7	-99.4	-37.7	0	0	0	113.6
281	Q	32.3	Very low	32.8	Very low	184 Å²	184	145.5 Å²	145.5	86%	0.86	74%	0.735	S	S	*	*			trans	18.4	120.4	139.2	-53	172.3	49.6	0	0	118.5
282	G	34.9	Very low	32.9	Very low	75 Å²	75	145.9 Å²	145.9	77%	0.773	74%	0.743	S	S	*	*			trans	-165.1	20.2	-176.8	0	0	0	0	0	120.6
283	N	33.4	Very low	33.1	Very low	150 Å²	150	141.8 Å²	141.8	80%	0.802	74%	0.74	S	S	*	*			trans	40.8	142.8	159.3	-88.7	11.4	0	0	0	123.6
284	N	33.1	Very low	33.2	Very low	123 Å²	123	143.7 Å²	143.7	66%	0.658	74%	0.744	S	S	*	*			trans	75	143.4	158	-61.3	19	0	0	0	116.7
285	E	38.8	Very low	33.4	Very low	162 Å²	162	143.2 Å²	143.2	76%	0.757	75%	0.749	S	S	*	*			cis	-147.2	161.7	5.2	-132.8	154.5	-116.5	0	0	114.5
286	Y	33.2	Very low	34	Very low	203 Å²	203	145.8 Å²	145.8	80%	0.796	76%	0.76	S	S	*	*			trans	-40.9	136.2	-175.3	-84.3	-110.9	0	0	0	118.6
287	C	37.2	Very low	34.2	Very low	133 Å²	133	142.5 Å²	142.5	90%	0.899	75%	0.754	S	S	*	*				-157.2	149.1	102.2	-97.6	0	0	0	0	111.6
288	S	32.7	Very low	34.5	Very low	88 Å²	88	145.9 Å²	145.9	62%	0.615	76%	0.762	S	S	*	*			trans	-120.7	154.8	-164.6	-54.8	0	0	0	0	113.2
289	H	38.4	Very low	34.7	Very low	186 Å²	186	143.7 Å²	143.7	86%	0.861	77%	0.765	S	S	*	*			trans	146.7	85.7	155.2	-81.7	-63.4	0	0	0	107.1
290	A	33.8	Very low	34.7	Very low	87 Å²	87	146.7 Å²	146.7	72%	0.719	77%	0.766	S	S	*	*				53.5	98.8	73.1	0	0	0	0	0	111
291	S	31.7	Very low	34.6	Very low	114 Å²	114	146.8 Å²	146.8	80%	0.797	78%	0.777	S	S	*	*				75.8	92.2	59.6	-178.2	0	0	0	0	113
292	E	35.9	Very low	34.6	Very low	155 Å²	155	146.8 Å²	146.8	72%	0.724	78%	0.775	S	S	*	*			trans	-127.5	121	158.6	-68.5	-160.2	135.2	0	0	110.6	Y294	E292-Y294 HydrophobicContact CB-CD2 4.07Å; E292-Y294 HydrophobicContact CB-CE2 4.28Å; E292-Y294 HydrophobicContact CG-CE2 4.36Å
293	V	33.8	Very low	34.7	Very low	134 Å²	134	151 Å²	151	81%	0.812	77%	0.774	S	S	*	*			trans	-99.9	127.5	161.4	171.4	0	0	0	0	105.9
294	Y	34.5	Very low	34.7	Very low	161 Å²	161	153.9 Å²	153.9	63%	0.631	77%	0.774	S	S	*	*			trans	-129.4	85.8	177.9	-98.4	-69.1	0	0	0	112.4	E292 Y296	E292-Y294 HydrophobicContact CB-CD2 4.07Å; E292-Y294 HydrophobicContact CB-CE2 4.28Å; E292-Y294 HydrophobicContact CG-CE2 4.36Å; Y294-Y296 AromaticContact CD1-CD2 3.63Å; Y294-Y296 HydrophobicContact CD1-CD2 3.63Å; Y294-Y296 HydrophobicContact CD1-CE2 4.48Å; Y294-Y296 HydrophobicContact CD1-CG 4.24Å; Y294-Y296 AromaticContact CE1-CD2 3.56Å; Y294-Y296 HydrophobicContact CE1-CD2 3.56Å; Y294-Y296 HydrophobicContact CE1-CE2 4.01Å; Y294-Y296 HydrophobicContact CE1-CG 4.29Å
295	D	34.1	Very low	34.9	Very low	154 Å²	154	153.1 Å²	153.1	82%	0.824	78%	0.778	S	S	*	*			trans	-80.1	120.6	141.8	-98.2	-44.4	0	0	0	107.5
296	Y	38.6	Very low	34.8	Very low	199 Å²	199	153.7 Å²	153.7	78%	0.78	78%	0.778	S	S	*	*			trans	-147.8	108	167.2	-119.2	-89.7	0	0	0	112.3	Y294	Y294-Y296 AromaticContact CD1-CD2 3.63Å; Y294-Y296 HydrophobicContact CD1-CD2 3.63Å; Y294-Y296 HydrophobicContact CD1-CE2 4.48Å; Y294-Y296 HydrophobicContact CD1-CG 4.24Å; Y294-Y296 AromaticContact CE1-CD2 3.56Å; Y294-Y296 HydrophobicContact CE1-CD2 3.56Å; Y294-Y296 HydrophobicContact CE1-CE2 4.01Å; Y294-Y296 HydrophobicContact CE1-CG 4.29Å
297	H	34.1	Very low	34.8	Very low	156 Å²	156	150.7 Å²	150.7	72%	0.722	78%	0.776	S	S	*	*			trans	-71.9	143.4	154.1	-76.6	-94	0	0	0	109.1
298	H	35.8	Very low	34.7	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.796	77%	0.77	S	S	*	*				161.6	134.3	112.2	-86.5	-63.8	0	0	0	115.7
299	S	35.2	Very low	34.8	Very low	113 Å²	113	151.4 Å²	151.4	79%	0.79	78%	0.782	S	S	*	*			trans	78.8	140.8	140.2	-61.4	0	0	0	0	121.9
300	Y	30.5	Very low	34.9	Very low	205 Å²	205	146.8 Å²	146.8	80%	0.804	78%	0.776	S	S	*	*			trans	-77.3	157.9	176.8	-82	-115.5	0	0	0	113.2
301	S	35.7	Very low	35.2	Very low	128 Å²	128	147.2 Å²	147.2	90%	0.895	78%	0.78	S	S	*	*				-155.9	171.8	129.6	-86	0	0	0	0	111.6
302	F	31.4	Very low	35.2	Very low	185 Å²	185	153 Å²	153	81%	0.811	78%	0.784	S	S	*	*			trans	-109.2	179.6	-160.3	-128.5	-105.8	0	0	0	113.3
303	E	36.1	Very low	35.7	Very low	163 Å²	163	150.3 Å²	150.3	76%	0.762	78%	0.781	S	S	*	*			trans	77.9	145.6	167.9	-48.1	-140.9	116.1	0	0	117.4
304	R	33.7	Very low	35.9	Very low	211 Å²	211	150.6 Å²	150.6	80%	0.796	78%	0.783	S	S	*	*			cis	156.8	100.1	-26.1	167	-152.5	-89.7	-106.5	-1.8	105.9
305	S	38.3	Very low	36	Very low	107 Å²	107	148.9 Å²	148.9	75%	0.748	79%	0.785	S	S	*	*			trans	-163.1	100.5	162.1	34.5	0	0	0	0	114.5
306	F	35.6	Very low	36.3	Very low	173 Å²	173	146.5 Å²	146.5	76%	0.759	78%	0.777	S	S	*	*			trans	54.4	112.5	144.6	-64.7	-80.2	0	0	0	122.5
307	N	33.9	Very low	36.1	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	77%	0.774	S	S	*	*				58.1	134.3	127.4	-56.6	7.6	0	0	0	119.7
308	S	35.2	Very low	36.4	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	78%	0.778	S	S	*	*			cis	-146.7	150.9	29.7	-54.4	0	0	0	0	113.6
309	S	35.6	Very low	36.6	Very low	126 Å²	126	144.4 Å²	144.4	88%	0.881	77%	0.774	S	S	*	*	S	Bend	trans	52.4	116.7	164.7	-108.9	0	0	0	0	119
310	A	39	Very low	36.7	Very low	89 Å²	89	144.7 Å²	144.7	74%	0.736	77%	0.773	S	S	*	*			cis	-151.6	160.4	-10.9	0	0	0	0	0	110.6
311	A	40.7	Very low	36.7	Very low	97 Å²	97	144.2 Å²	144.2	80%	0.802	77%	0.771	S	S	*	*			trans	-36	133.7	172.9	0	0	0	0	0	114.5
312	R	32.7	Very low	36.9	Very low	234 Å²	234	143.4 Å²	143.4	88%	0.883	76%	0.763	S	S	*	*			cis	60.9	157.3	10.6	-119.8	-151.6	173.9	-151.7	1.8	115.6
313	P	44.8	Very low	37.1	Very low	100 Å²	100	145.4 Å²	145.4	65%	0.649	77%	0.765	S	S	*	*				-125.9	177.5	-99.8	41.5	-27.2	0	0	0	113.5
314	T	37.9	Very low	37	Very low	139 Å²	139	145.9 Å²	145.9	85%	0.853	77%	0.765	S	S	*	*			trans	-141.1	104.5	167.1	32.5	0	0	0	0	114.9
315	N	38.1	Very low	36.8	Very low	126 Å²	126	140.8 Å²	140.8	67%	0.674	76%	0.761	S	S	*	*			trans	-58.5	150.7	145.3	-180	22	0	0	0	109.2	Y317	N315-Y317 PolarHBondContact OD1-N 3.15Å
316	P	39.7	Very low	36.8	Very low	103 Å²	103	144.5 Å²	144.5	67%	0.669	77%	0.767	S	S	*	*				-153.4	138	104.1	36.9	-17.7	0	0	0	118.6
317	Y	34.3	Very low	36.6	Very low	181 Å²	181	142.8 Å²	142.8	71%	0.71	77%	0.766	S	S	*	*				53.2	125.3	129.8	-69.6	-131.6	0	0	0	120.4	N315	N315-Y317 PolarHBondContact OD1-N 3.15Å
318	N	41.5	Very low	36.5	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	76%	0.76	S	S	*	*				-174.1	153.8	89.9	-96.6	-59.1	0	0	0	115.1
319	Q	38.1	Very low	36.4	Very low	151 Å²	151	145.6 Å²	145.6	71%	0.706	76%	0.758	S	S	*	*			trans	-92.5	174.6	169.5	-85.4	-122.3	11.6	0	0	110
320	P	38.2	Very low	36.6	Very low	119 Å²	119	146 Å²	146	77%	0.773	75%	0.75	S	S	*	*			cis	-145	173.1	23.9	43.2	-23.1	0	0	0	119.8
321	Y	30.6	Very low	36.5	Very low	196 Å²	196	149.4 Å²	149.4	77%	0.769	75%	0.753	S	S	*	*			trans	-63.4	-172.6	156.2	-82.4	-84.5	0	0	0	113.6
322	P	39.3	Very low	36.2	Very low	110 Å²	110	154.6 Å²	154.6	71%	0.714	75%	0.752	S	S	*	*			cis	-130.5	170.9	-35.2	32.6	-16.6	0	0	0	113.1
323	R	35.1	Very low	36.7	Very low	227 Å²	227	149.5 Å²	149.5	86%	0.857	75%	0.749	S	S	*	*			trans	-145.5	127	157.1	-85.3	-155.8	175.5	-169.2	0.7	116.5
324	F	35	Very low	36.3	Very low	174 Å²	174	153.6 Å²	153.6	76%	0.763	75%	0.752	S	S	*	*			trans	55.6	108.3	150.6	-73.6	-84.9	0	0	0	122.3
325	S	29.1	Very low	36.1	Very low	103 Å²	103	154.7 Å²	154.7	72%	0.72	75%	0.752	S	S	*	*			trans	-64.9	137.3	142.3	163.9	0	0	0	0	111.3
326	Q	38.8	Very low	36.1	Very low	185 Å²	185	151.8 Å²	151.8	86%	0.864	74%	0.74	S	S	*	*			trans	-135.8	103.9	144.3	-78.5	-157.1	-14	0	0	110.7
327	N	30	Very low	36	Very low	138 Å²	138	155.1 Å²	155.1	74%	0.738	75%	0.747	S	S	*	*			trans	-78.7	169.6	159.4	-165.3	-11	0	0	0	109.1
328	N	32	Very low	36.2	Very low	116 Å²	116	151.3 Å²	151.3	62%	0.62	75%	0.746	S	S	*	*			trans	84	152.5	-174.7	-55.6	-99.3	0	0	0	114.7
329	R	33.8	Very low	35.9	Very low	193 Å²	193	153.1 Å²	153.1	73%	0.728	75%	0.748	S	S	*	*			cis	-156.5	162.2	8.3	-140.6	165.2	-107.8	173.9	-5.2	113.8
330	N	39.1	Very low	35.8	Very low	134 Å²	134	154.7 Å²	154.7	72%	0.717	76%	0.755	S	S	*	*			trans	86.9	132.5	160.7	-49.3	-29.8	0	0	0	117.8
331	M	37.8	Very low	35.6	Very low	161 Å²	161	154.6 Å²	154.6	79%	0.793	75%	0.754	S	S	*	*			cis	-152.5	140.6	-19.5	-94.4	-77.2	79.6	0	0	107.8
332	W	35.3	Very low	35.8	Very low	205 Å²	205	151.3 Å²	151.3	78%	0.777	75%	0.754	S	S	*	*			trans	-89.9	165	167.5	-78.3	62.5	0	0	0	110.3	R334	W332-R334 HydrophobicContact CB-CG 4.26Å; W332-R334 HydrophobicContact CD2-CG 4.02Å; W332-R334 HydrophobicContact CE3-CB 4.14Å; W332-R334 HydrophobicContact CE3-CG 3.38Å; W332-R334 HydrophobicContact CG-CG 4.43Å; W332-R334 HydrophobicContact CZ3-CG 3.96Å
333	P	41.6	Very low	35.6	Very low	128 Å²	128	153.2 Å²	153.2	83%	0.831	76%	0.758	S	S	*	*				-139.4	119	95	34.4	-20	0	0	0	111.9
334	R	35.9	Very low	35.4	Very low	186 Å²	186	145.1 Å²	145.1	70%	0.702	75%	0.746	S	S	*	*				53.8	109.3	70.7	-83.5	-152.3	178.4	-153.4	0.7	114.2	W332	W332-R334 HydrophobicContact CB-CG 4.26Å; W332-R334 HydrophobicContact CD2-CG 4.02Å; W332-R334 HydrophobicContact CE3-CB 4.14Å; W332-R334 HydrophobicContact CE3-CG 3.38Å; W332-R334 HydrophobicContact CG-CG 4.43Å; W332-R334 HydrophobicContact CZ3-CG 3.96Å
335	N	34.1	Very low	35.4	Very low	162 Å²	162	146.3 Å²	146.3	87%	0.866	75%	0.751	S	S	*	*			trans	-126.5	123.1	136.4	-169.6	31.7	0	0	0	107.6
336	P	39.1	Very low	35.8	Very low	65 Å²	65	143.8 Å²	143.8	42%	0.422	73%	0.732	S	S	.	*			trans	-106.2	179.8	-176.1	41.3	-34.9	0	0	0	113.2
337	E	36.7	Very low	35.7	Very low	173 Å²	173	140.4 Å²	140.4	81%	0.808	73%	0.726	S	S	*	*			trans	69.3	148.3	166.6	-65.8	157.1	-135.4	0	0	115
338	S	39.6	Very low	36.2	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	72%	0.723	S	S	*	*			cis	-149.6	159.2	20.6	25.9	0	0	0	0	113.9
339	F	33.8	Very low	36.4	Very low	190 Å²	190	136.2 Å²	136.2	83%	0.833	72%	0.719	S	S	*	*			trans	9.9	132	154.6	-50	-75.5	0	0	0	118.9
340	Q	37.1	Very low	36.5	Very low	184 Å²	184	133.6 Å²	133.6	86%	0.86	71%	0.714	S	S	*	*			cis	-156.9	165.9	36.7	-72.3	-173.2	-40.5	0	0	113.3
341	P	32.8	Very low	36.3	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	71%	0.713	S	S	*	*			trans	-91.2	164.4	164.6	38	-34.8	0	0	0	113.3
342	V	34.8	Very low	36.3	Very low	127 Å²	127	132.3 Å²	132.3	77%	0.77	70%	0.704	S	S	*	*			trans	171.4	121.1	137.5	149.4	0	0	0	0	112.2
343	D	35.3	Very low	36.4	Very low	149 Å²	149	127.2 Å²	127.2	80%	0.797	69%	0.692	S	S	*	*			trans	37.3	125.6	146.9	-47.3	-26.5	0	0	0	124.6
344	G	32.3	Very low	36.2	Very low	58 Å²	58	128.5 Å²	128.5	60%	0.598	69%	0.688	S	S	*	*				98.4	112.6	99.6	0	0	0	0	0	119.6
345	F	34.2	Very low	36.4	Very low	199 Å²	199	125.6 Å²	125.6	87%	0.873	68%	0.682	S	S	*	*			trans	-97.5	136.9	160.8	-94.5	-89.7	0	0	0	111.4
346	P	37.7	Very low	36.4	Very low	50 Å²	50	124 Å²	124	33%	0.325	67%	0.673	S	S	.	*			trans	-133.3	165.2	145.5	17.5	4.2	0	0	0	114.9	T277	T277-P346 HydrophobicContact CG2-CG 3.57Å
347	P	36.1	Very low	36.3	Very low	113 Å²	113	127 Å²	127	73%	0.734	68%	0.681	S	S	*	*			trans	-90.4	-176.7	-167.4	37.6	-37.9	0	0	0	116.2
348	P	41.3	Very low	36.1	Very low	103 Å²	103	126.5 Å²	126.5	67%	0.669	67%	0.672	S	S	*	*			trans	-117.3	159.9	-161.5	41.5	-32.7	0	0	0	118.6
349	A	36.2	Very low	35.9	Very low	64 Å²	64	128.9 Å²	128.9	53%	0.529	68%	0.676	S	S	.	*			trans	-170.4	159.7	166.8	0	0	0	0	0	109.4
350	Q	35.9	Very low	35.7	Very low	137 Å²	137	123.6 Å²	123.6	64%	0.64	66%	0.663	S	S	*	*			cis	-169.8	-174.7	-15.2	-111.9	175	-112.9	0	0	108.4
351	F	35.5	Very low	35.6	Very low	158 Å²	158	125.3 Å²	125.3	69%	0.693	66%	0.663	S	S	*	*			trans	67.3	157.3	165.4	-62.5	-80.3	0	0	0	118.5
352	D	36.6	Very low	35.5	Very low	111 Å²	111	126.3 Å²	126.3	59%	0.594	66%	0.658	S	S	*	*			cis	-157.1	170.7	-47.6	-133.4	-35	0	0	0	115.3	R271	R271-D352 VanDerWaalsContact NH1-C 3.25Å; R271-D352 PolarHBondContact NH1-O 2.97Å
353	D	37.9	Very low	35.5	Very low	98 Å²	98	130.8 Å²	130.8	52%	0.524	66%	0.662	S	S	.	*			trans	59.2	174.4	146.5	-144.8	1.5	0	0	0	123.5	R271 H355	R271-D353 PolarHBondContact NH2-O 3.46Å; R271-D353 VanDerWaalsContact NH2-O 3.09Å; D353-H355 IonicContact OD1-CE1 3.39Å; D353-H355 PolarHBondContact OD1-CE1 2.92Å; D353-H355 IonicContact OD1-ND1 3.11Å; D353-H355 PolarHBondContact OD1-ND1 3.41Å; D353-H355 VanDerWaalsContact OD1-ND1 3.11Å; D353-H355 IonicContact OD2-CE1 3.28Å; D353-H355 PolarHBondContact OD2-CE1 3.1Å; D353-H355 VanDerWaalsContact OD2-CE1 3.28Å; D353-H355 IonicContact OD2-ND1 3.82Å
354	M	38.3	Very low	35.3	Very low	154 Å²	154	131.3 Å²	131.3	76%	0.759	66%	0.66	S	S	*	*			trans	78.2	126.1	170.3	-60.9	-171.1	74.6	0	0	120.6
355	H	39.8	Very low	35.4	Very low	125 Å²	125	138 Å²	138	58%	0.579	68%	0.676	S	S	*	*			cis	-172.5	137.1	-22.2	-111.3	15.7	0	0	0	111.3	D353	D353-H355 IonicContact OD1-CE1 3.39Å; D353-H355 PolarHBondContact OD1-CE1 2.92Å; D353-H355 IonicContact OD1-ND1 3.11Å; D353-H355 PolarHBondContact OD1-ND1 3.41Å; D353-H355 VanDerWaalsContact OD1-ND1 3.11Å; D353-H355 IonicContact OD2-CE1 3.28Å; D353-H355 PolarHBondContact OD2-CE1 3.1Å; D353-H355 VanDerWaalsContact OD2-CE1 3.28Å; D353-H355 IonicContact OD2-ND1 3.82Å
356	L	33.8	Very low	35.5	Very low	128 Å²	128	137 Å²	137	67%	0.67	67%	0.674	S	S	*	*			trans	55.3	-175	158	-59.7	175.1	0	0	0	117.6	H265	H265-L356 WeakPolarHBondContact NE2-CA 3.21Å
357	H	36.2	Very low	35.6	Very low	129 Å²	129	138.6 Å²	138.6	60%	0.597	68%	0.684	S	S	*	*			cis	-141.1	-163	-7.7	-145.9	-1.3	0	0	0	113.7	S263 H265	S263-H357 WeakPolarHBondContact CB-O 3.42Å; S263-H357 PolarHBondContact OG-O 3.26Å; H265-H357 WeakPolarHBondContact NE2-CA 3.39Å; H265-H357 PolarHBondContact NE2-N 3.42Å; H265-H357 PolarHBondContact NE2-O 3.36Å
358	R	32.5	Very low	35.7	Very low	162 Å²	162	141.8 Å²	141.8	61%	0.611	69%	0.686	S	S	*	*			trans	-152	150.2	-169.3	167.1	178.4	-174.9	-140.4	5.8	114.5	S263	S263-R358 WeakPolarHBondContact O-CB 3.46Å; S263-R358 VanDerWaalsContact O-CG 3.31Å; S263-R358 WeakPolarHBondContact O-CG 3.37Å
359	L	35.1	Very low	35.5	Very low	150 Å²	150	147 Å²	147	79%	0.785	69%	0.694	S	S	*	*			trans	-159.2	173.4	156.9	-114.4	175.2	0	0	0	112.6
360	S	30.6	Very low	35.3	Very low	79 Å²	79	150.5 Å²	150.5	55%	0.552	70%	0.702	S	S	*	*			trans	-151.8	150	-164.7	57.4	0	0	0	0	115.2
361	Y	33.8	Very low	35.6	Very low	220 Å²	220	149.8 Å²	149.8	86%	0.863	71%	0.709	S	S	*	*			trans	-166.9	-170.1	153.6	-82.2	-61.1	0	0	0	108
362	Q	31.5	Very low	35.5	Very low	139 Å²	139	149.5 Å²	149.5	65%	0.65	71%	0.714	S	S	*	*				-154.4	-174.3	-81.5	-173.2	157.1	-10.9	0	0	108.2
363	Y	35.1	Very low	35.4	Very low	220 Å²	220	149 Å²	149	86%	0.863	72%	0.719	S	S	*	*			trans	72.2	115.7	-168.9	-62.3	-87.1	0	0	0	113.1
364	Q	30	Very low	35.3	Very low	161 Å²	161	151.9 Å²	151.9	75%	0.752	73%	0.73	S	S	*	*			cis	72.7	95.3	9.2	-159.4	-175.8	19.7	0	0	116.9
365	E	36	Very low	35.2	Very low	199 Å²	199	151.9 Å²	151.9	93%	0.93	73%	0.733	S	S	*	*			trans	-150	162	138.4	-130.5	169.9	-160.2	0	0	109.3
366	E	35.9	Very low	35	Very low	178 Å²	178	152 Å²	152	83%	0.832	74%	0.742	S	S	*	*			trans	-129.1	-151.2	-149.3	-147.5	-149.8	178.8	0	0	114.5
367	P	40.6	Very low	35.1	Very low	82 Å²	82	150.9 Å²	150.9	53%	0.532	74%	0.743	S	S	.	*				-126.1	-177.6	-126.5	43.1	-24.6	0	0	0	116.4
368	K	37	Very low	35.1	Very low	180 Å²	180	150.7 Å²	150.7	78%	0.783	75%	0.751	S	S	*	*			trans	148.6	128.4	141.1	-80.3	153.3	-171.8	166.6	0	109.9
369	Y	36.4	Very low	35.2	Very low	213 Å²	213	150 Å²	150	84%	0.835	76%	0.758	S	S	*	*				-166.6	156.4	60.5	-117	-77.2	0	0	0	111.2
370	I	33.5	Very low	35.3	Very low	137 Å²	137	151.6 Å²	151.6	70%	0.703	76%	0.761	S	S	*	*			trans	-134.6	136.7	171	-64	171.1	0	0	0	108.9	L372	I370-L372 HydrophobicContact CG2-CD1 4.19Å
371	P	42.2	Very low	35.4	Very low	122 Å²	122	151.9 Å²	151.9	79%	0.792	76%	0.763	S	S	*	*			trans	-101.1	145	150.1	-3.6	24.3	0	0	0	111
372	L	33.1	Very low	35.6	Very low	152 Å²	152	149.9 Å²	149.9	80%	0.796	76%	0.759	S	S	*	*			trans	-97.2	-177.1	179.8	-80.3	96.8	0	0	0	112.8	I370	I370-L372 HydrophobicContact CG2-CD1 4.19Å
373	S	35	Very low	35.9	Very low	100 Å²	100	151 Å²	151	70%	0.699	76%	0.764	S	S	*	*			trans	81.4	132.1	171.5	-61.6	0	0	0	0	116.6
374	E	35.8	Very low	35.7	Very low	159 Å²	159	150.7 Å²	150.7	74%	0.743	77%	0.768	S	S	*	*			cis	-162.3	173.1	-19.5	-126.6	145.9	159.6	0	0	109.8
375	D	35.5	Very low	36	Very low	154 Å²	154	154.2 Å²	154.2	82%	0.824	77%	0.774	S	S	*	*			trans	49.6	103.1	168.2	-63.7	-19.8	0	0	0	119.7
376	T	36.3	Very low	36	Very low	127 Å²	127	147.8 Å²	147.8	78%	0.779	76%	0.761	S	S	*	*			trans	-116.8	120.1	168.2	-64	0	0	0	0	110.6	V378	T376-V378 PolarHBondContact O-N 2.88Å
377	P	36	Very low	35.8	Very low	106 Å²	106	145.2 Å²	145.2	69%	0.688	76%	0.761	S	S	*	*			trans	-73.9	122.8	168.3	29.8	-32	0	0	0	109.9	I379	P377-I379 PolarHBondContact O-N 2.9Å; P377-I379 VanDerWaalsContact O-N 3.16Å
378	V	34.8	Very low	35.7	Very low	124 Å²	124	149.7 Å²	149.7	75%	0.752	78%	0.775	S	S	*	*			trans	-72.1	108.6	-178.5	178.3	0	0	0	0	110.5	T376 E380	T376-V378 PolarHBondContact O-N 2.88Å; V378-E380 HydrophobicContact CG1-CG 3.81Å
379	I	35.2	Very low	35.5	Very low	149 Å²	149	148.4 Å²	148.4	76%	0.764	78%	0.776	S	S	*	*			trans	-110.2	83.2	169.6	-55.2	178.8	0	0	0	108.3	P377 S381	P377-I379 PolarHBondContact O-N 2.9Å; P377-I379 VanDerWaalsContact O-N 3.16Å; I379-S381 PolarHBondContact O-N 3.04Å
380	E	37	Very low	36	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	77%	0.771	S	S	*	*			trans	-75.9	90.5	172.8	-76.3	-144.7	118.7	0	0	111.5	V378	V378-E380 HydrophobicContact CG1-CG 3.81Å
381	S	32	Very low	36.3	Very low	85 Å²	85	146.8 Å²	146.8	59%	0.594	78%	0.778	S	S	*	*			trans	-62.8	136.2	154.7	64.8	0	0	0	0	110.4	I379	I379-S381 PolarHBondContact O-N 3.04Å
382	K	38.8	Very low	35.9	Very low	177 Å²	177	151.3 Å²	151.3	77%	0.77	78%	0.781	S	S	*	*				179.3	139.5	119.4	-94.2	147.9	-161.3	163.2	0	116.2
383	Q	36.7	Very low	36	Very low	162 Å²	162	155 Å²	155	76%	0.757	78%	0.784	S	S	*	*			trans	69.8	97.1	139.6	-68.1	175.5	-2.4	0	0	120.7
384	F	30.9	Very low	36.1	Very low	215 Å²	215	157.2 Å²	157.2	94%	0.943	79%	0.787	S	S	*	*			trans	-49	130.6	145.1	-81	-107.8	0	0	0	112.8
385	R	37.6	Very low	36.2	Very low	235 Å²	235	155.3 Å²	155.3	89%	0.887	79%	0.786	S	S	*	*			trans	-162.9	138.8	149	-155.5	179.4	-59.4	-113.7	3.1	105.3
386	G	35.1	Very low	36.3	Very low	63 Å²	63	155.4 Å²	155.4	65%	0.649	79%	0.785	S	S	*	*			cis	153.6	127.3	6.1	0	0	0	0	0	105.4
387	C	32.4	Very low	36.4	Very low	124 Å²	124	157.8 Å²	157.8	84%	0.838	79%	0.787	S	S	*	*			trans	-59.6	141.9	-161.9	-48.9	0	0	0	0	114.4
388	H	37.4	Very low	36.3	Very low	177 Å²	177	157.8 Å²	157.8	82%	0.819	79%	0.79	S	S	*	*			trans	-155.6	149.5	146.4	-91.5	-54	0	0	0	111.1
389	D	33.4	Very low	36.5	Very low	153 Å²	153	157.6 Å²	157.6	82%	0.818	79%	0.791	S	S	*	*			trans	-61.7	153.6	172.7	-65	-78.7	0	0	0	112.4
390	H	46.8	Very low	36.5	Very low	157 Å²	157	157.2 Å²	157.2	73%	0.727	80%	0.796	S	S	*	*			trans	-125.2	96.8	173.1	-72.3	-6.3	0	0	0	110	Y392	H390-Y392 PolarHBondContact O-N 3.09Å
391	D	40.7	Very low	36.7	Very low	159 Å²	159	154.5 Å²	154.5	85%	0.85	79%	0.792	S	S	*	*			trans	-60.4	119.6	166.3	-83.5	-48.9	0	0	0	109.9	R393	D391-R393 VanDerWaalsContact C-N 3.28Å; D391-R393 PolarHBondContact O-N 3.22Å
392	Y	34.2	Very low	37	Very low	216 Å²	216	156 Å²	156	85%	0.847	80%	0.8	S	S	*	*			trans	-74.3	76.5	-179.9	-71.7	-86.9	0	0	0	112.1	H390	H390-Y392 PolarHBondContact O-N 3.09Å
393	R	34.9	Very low	36.7	Very low	229 Å²	229	153.8 Å²	153.8	86%	0.864	81%	0.807	S	S	*	*			trans	-119.7	75.9	166.4	-73.4	-169.7	174.9	-130.3	-1	110.9	D391 T395	D391-R393 VanDerWaalsContact C-N 3.28Å; D391-R393 PolarHBondContact O-N 3.22Å; R393-T395 PolarHBondContact O-N 3.13Å
394	I	37.3	Very low	36.5	Very low	147 Å²	147	149.6 Å²	149.6	75%	0.754	81%	0.806	S	S	*	*			trans	-79.2	110.3	173.4	-59.8	175.2	0	0	0	108.8
395	T	36.1	Very low	36.6	Very low	120 Å²	120	144.9 Å²	144.9	74%	0.736	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.1	119.3	167.7	40.2	0	0	0	0	109.8	R393 Q397	R393-T395 PolarHBondContact O-N 3.13Å; T395-Q397 PolarHBondContact O-N 3.06Å
396	I	39	Very low	36.6	Very low	155 Å²	155	140.7 Å²	140.7	80%	0.795	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.6	117.5	177.2	-56.9	171.3	0	0	0	108.6
397	Q	38.1	Very low	36.7	Very low	177 Å²	177	146.7 Å²	146.7	83%	0.827	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-97.9	118	166.6	-69.4	-172.9	-1.3	0	0	109.2	T395	T395-Q397 PolarHBondContact O-N 3.06Å
398	S	33	Very low	36.8	Very low	106 Å²	106	148.2 Å²	148.2	74%	0.741	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.5	-176.4	-50.1	0	0	0	0	112.2
399	P	39.9	Very low	36.8	Very low	120 Å²	120	146.1 Å²	146.1	78%	0.779	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.3	142.2	167.3	32	-32.7	0	0	0	111.6
400	T	35.2	Very low	36.9	Very low	142 Å²	142	149.9 Å²	149.9	87%	0.871	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-71.3	140.6	-175.6	-50.1	0	0	0	0	113.3
401	V	41.5	Very low	36.7	Very low	126 Å²	126	150.3 Å²	150.3	76%	0.764	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-101	133.5	175.6	-179	0	0	0	0	110.7
402	P	37.8	Very low	36.4	Very low	116 Å²	116	150.5 Å²	150.5	75%	0.753	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-79.9	140.4	168.4	32.7	-32.9	0	0	0	111.3
403	S	32	Very low	36.8	Very low	131 Å²	131	145.9 Å²	145.9	92%	0.916	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-71.1	140.5	-173.2	-169	0	0	0	0	113.8
404	G	34.1	Very low	36.9	Very low	73 Å²	73	139.4 Å²	139.4	75%	0.753	78%	0.781	S	S	*	*			trans	-162.5	110	173	0	0	0	0	0	110.4
405	S	31.6	Very low	37.1	Very low	117 Å²	117	138.9 Å²	138.9	82%	0.818	79%	0.785	S	S	*	*			trans	-84.9	124	-167.8	53.6	0	0	0	0	114.1
406	V	38.8	Very low	37.5	Very low	146 Å²	146	141.7 Å²	141.7	89%	0.885	78%	0.782	S	S	*	*			trans	-135.9	139.7	151.8	-177.3	0	0	0	0	106.9
407	E	37.2	Very low	37.7	Very low	189 Å²	189	140 Å²	140	88%	0.883	78%	0.782	S	S	*	*			trans	-73.4	145	-166.6	-65.9	162.2	116.5	0	0	113.7
408	E	34.4	Very low	37.8	Very low	157 Å²	157	139.4 Å²	139.4	73%	0.734	78%	0.782	S	S	*	*			trans	-72.7	138.5	174	-64	-173.8	101.1	0	0	111.6	W410	E408-W410 PolarHBondContact OE1-NE1 3.49Å
409	N	37.4	Very low	38.2	Very low	132 Å²	132	141.4 Å²	141.4	71%	0.706	78%	0.784	S	S	*	*			trans	-142.9	55	169.4	-137.7	-59.6	0	0	0	110.5	K411	N409-K411 PolarHBondContact O-N 3.31Å; N409-K411 WeakPolarHBondContact OD1-CE 3.29Å
410	W	35.8	Very low	38.8	Very low	232 Å²	232	141.6 Å²	141.6	88%	0.879	79%	0.785	S	S	*	*			trans	-66.9	99.1	172.6	-64.9	104.7	0	0	0	109.7	E408	E408-W410 PolarHBondContact OE1-NE1 3.49Å
411	K	42.7	Very low	39	Very low	166 Å²	166	139.6 Å²	139.6	72%	0.722	78%	0.777	S	S	*	*			trans	-97.5	131.4	168.9	-71.4	-169.5	176.6	-175.9	0	110.2	N409	N409-K411 PolarHBondContact O-N 3.31Å; N409-K411 WeakPolarHBondContact OD1-CE 3.29Å
412	D	33.5	Very low	38.7	Very low	164 Å²	164	140.6 Å²	140.6	88%	0.877	78%	0.778	S	S	*	*			trans	-63.8	129.6	-179.3	-150.9	-10.3	0	0	0	110.6	D414	D412-D414 VanDerWaalsContact C-N 3.35Å; D412-D414 PolarHBondContact O-N 3.24Å
413	V	42.3	Very low	38.7	Very low	119 Å²	119	140.7 Å²	140.7	72%	0.721	78%	0.782	S	S	*	*			trans	-95	72.8	-176.1	-174.4	0	0	0	0	109.2	T415	V413-T415 PolarHBondContact O-N 2.76Å; V413-T415 PolarHBondContact O-OG1 2.79Å
414	D	38.4	Very low	38.8	Very low	93 Å²	93	141.4 Å²	141.4	50%	0.497	78%	0.775	S	S	.	*			trans	-53.7	110.5	172.4	-173	-16.6	0	0	0	110	D412 R416	D412-D414 VanDerWaalsContact C-N 3.35Å; D412-D414 PolarHBondContact O-N 3.24Å; D414-R416 PolarHBondContact O-N 3.46Å; D414-R416 VanDerWaalsContact OD1-CG 3.29Å; D414-R416 WeakPolarHBondContact OD1-CG 3.42Å; D414-R416 IonicContact OD1-CZ 2.8Å; D414-R416 PolarHBondContact OD1-N 2.76Å; D414-R416 IonicContact OD1-NE 3.35Å; D414-R416 PolarHBondContact OD1-NE 2.84Å; D414-R416 IonicContact OD1-NH2 2.62Å; D414-R416 IonicContact OD2-CZ 3.55Å; D414-R416 VanDerWaalsContact OD2-CZ 3.27Å; D414-R416 IonicContact OD2-NE 2.68Å; D414-R416 PolarHBondContact OD2-NE 3.33Å; D414-R416 VanDerWaalsContact OD2-NE 3.11Å; D414-R416 IonicContact OD2-NH2 3.7Å; D414-R416 PolarHBondContact OD2-NH2 3.16Å
415	T	41.1	Very low	39	Very low	135 Å²	135	146.7 Å²	146.7	83%	0.828	78%	0.78	S	S	*	*			trans	-87.9	20.2	-166	-12.8	0	0	0	0	113.1	V413	V413-T415 PolarHBondContact O-N 2.76Å; V413-T415 PolarHBondContact O-OG1 2.79Å
416	R	43.8	Very low	39.1	Very low	180 Å²	180	147 Å²	147	68%	0.679	78%	0.777	S	S	*	*	S	Bend	trans	-74.7	135.6	175.5	-70.8	-177.7	-76.3	177.1	-3.4	110.7	D414 I418	D414-R416 PolarHBondContact O-N 3.46Å; D414-R416 VanDerWaalsContact OD1-CG 3.29Å; D414-R416 WeakPolarHBondContact OD1-CG 3.42Å; D414-R416 IonicContact OD1-CZ 2.8Å; D414-R416 PolarHBondContact OD1-N 2.76Å; D414-R416 IonicContact OD1-NE 3.35Å; D414-R416 PolarHBondContact OD1-NE 2.84Å; D414-R416 IonicContact OD1-NH2 2.62Å; D414-R416 IonicContact OD2-CZ 3.55Å; D414-R416 VanDerWaalsContact OD2-CZ 3.27Å; D414-R416 IonicContact OD2-NE 2.68Å; D414-R416 PolarHBondContact OD2-NE 3.33Å; D414-R416 VanDerWaalsContact OD2-NE 3.11Å; D414-R416 IonicContact OD2-NH2 3.7Å; D414-R416 PolarHBondContact OD2-NH2 3.16Å; R416-I418 PolarHBondContact O-N 2.99Å; R416-I418 VanDerWaalsContact O-N 3.15Å
417	P	42.6	Very low	39	Very low	120 Å²	120	145.5 Å²	145.5	78%	0.779	77%	0.773	S	S	*	*			trans	-68.3	113.8	-177.9	27.1	-33.9	0	0	0	111	L419	P417-L419 PolarHBondContact O-N 3.4Å
418	I	41.4	Very low	38.9	Very low	163 Å²	163	142.4 Å²	142.4	84%	0.836	77%	0.769	S	S	*	*			trans	-77.5	111.1	175.2	-57.8	174.4	0	0	0	108.3	R416	R416-I418 PolarHBondContact O-N 2.99Å; R416-I418 VanDerWaalsContact O-N 3.15Å
419	L	41.9	Very low	38.8	Very low	148 Å²	148	139.6 Å²	139.6	78%	0.775	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.2	140.3	167.2	-83.6	89	0	0	0	110	P417	P417-L419 PolarHBondContact O-N 3.4Å
420	P	50.8	Low	38.8	Very low	124 Å²	124	140.1 Å²	140.1	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-67.5	140.7	164.9	30.6	-33.4	0	0	0	109.8
421	S	39.1	Very low	38.6	Very low	101 Å²	101	137.6 Å²	137.6	71%	0.706	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-82.2	159.1	-176	-139.5	0	0	0	0	112.9
422	D	35.8	Very low	38.2	Very low	146 Å²	146	136.2 Å²	136.2	78%	0.781	78%	0.778	S	S	*	*			trans	67	78.4	151.5	-50.7	-7.2	0	0	0	118
423	S	38.6	Very low	38	Very low	119 Å²	119	133.5 Å²	133.5	83%	0.832	77%	0.771	S	S	*	*				-158.5	141.4	128.8	25.7	0	0	0	0	110.8
424	D	34.3	Very low	37.5	Very low	146 Å²	146	132.8 Å²	132.8	78%	0.781	78%	0.778	S	S	*	*			trans	-70.2	138.7	-172	-51.5	-92.9	0	0	0	112.9
425	H	38.3	Very low	37.3	Very low	183 Å²	183	136.8 Å²	136.8	85%	0.847	80%	0.798	S	S	*	*				-177.9	107.3	126.6	-84.1	-30.3	0	0	0	112.7
426	T	33.8	Very low	36.9	Very low	125 Å²	125	133.9 Å²	133.9	77%	0.767	79%	0.787	S	S	*	*			trans	57.2	89.5	142.5	-44.5	0	0	0	0	120.1
427	S	35.3	Very low	36.4	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	79%	0.791	S	S	*	*			trans	78.2	153.9	135	-58.4	0	0	0	0	120.5
428	P	35.6	Very low	36	Very low	123 Å²	123	135.9 Å²	135.9	80%	0.799	80%	0.795	S	S	*	*			trans	-118.6	154.4	-154.3	40	-27.4	0	0	0	115.6
429	A	32.9	Very low	35.8	Very low	99 Å²	99	132.8 Å²	132.8	82%	0.818	79%	0.794	S	S	*	*			trans	-147.6	103.5	157.7	0	0	0	0	0	110.1
430	I	37.4	Very low	35.6	Very low	143 Å²	143	133 Å²	133	73%	0.733	80%	0.795	S	S	*	*			trans	-84.4	138.7	162.2	-57.3	176.3	0	0	0	106.3
431	F	30.9	Very low	35	Very low	178 Å²	178	134 Å²	134	78%	0.781	79%	0.794	S	S	*	*			trans	73.1	103.9	-172.8	-49.1	-73.1	0	0	0	116.3	S433	F431-S433 PolarHBondContact O-N 2.88Å
432	P	35.6	Very low	34.9	Very low	137 Å²	137	134.5 Å²	134.5	89%	0.89	79%	0.789	S	S	*	*			trans	-89.8	77.2	164.8	35.5	-31.8	0	0	0	111.1
433	S	28.7	Very low	35.1	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	79%	0.791	S	S	*	*			trans	-131	133.3	170.4	-78.7	0	0	0	0	111	F431	F431-S433 PolarHBondContact O-N 2.88Å
434	A	30.5	Very low	35	Very low	104 Å²	104	137 Å²	137	86%	0.86	79%	0.786	S	S	*	*			trans	58.6	70.3	170	0	0	0	0	0	117.7
435	I	36	Very low	35.2	Very low	178 Å²	178	136.2 Å²	136.2	91%	0.913	79%	0.788	S	S	*	*			trans	-118.4	126.5	137.7	-58.3	-178.9	0	0	0	107.2
436	A	32.5	Very low	34.9	Very low	73 Å²	73	134.6 Å²	134.6	60%	0.603	78%	0.784	S	S	*	*			trans	-113.7	168.6	-172.1	0	0	0	0	0	112.7
437	N	31.5	Very low	35	Very low	143 Å²	143	133.6 Å²	133.6	77%	0.765	78%	0.782	S	S	*	*			trans	105.8	118.5	151.8	-54.3	-62.8	0	0	0	119.5
438	K	35.3	Very low	34.8	Very low	199 Å²	199	135.9 Å²	135.9	87%	0.865	79%	0.785	S	S	*	*			trans	82.6	82.2	146.2	-31.5	-153.2	-177.4	-178	0	121.6
439	A	36.2	Very low	34.8	Very low	98 Å²	98	136.5 Å²	136.5	81%	0.81	78%	0.78	S	S	*	*				-161.9	115	128.5	0	0	0	0	0	107.1
440	L	38.7	Very low	34.8	Very low	152 Å²	152	137.9 Å²	137.9	80%	0.796	78%	0.78	S	S	*	*				86.5	99.8	74	-164.6	74.1	0	0	0	112.8
441	D	37.5	Very low	34.7	Very low	146 Å²	146	136.8 Å²	136.8	78%	0.781	78%	0.781	S	S	*	*			trans	55.2	85.9	151.3	-49.9	-15.1	0	0	0	121.9
442	D	38.5	Very low	35	Very low	111 Å²	111	133.6 Å²	133.6	59%	0.594	78%	0.778	S	S	*	*			trans	-152.1	121.4	140.2	-169.8	30.9	0	0	0	110.4	R444	D442-R444 PolarHBondContact O-N 2.88Å; D442-R444 IonicContact OD2-CZ 3.11Å; D442-R444 IonicContact OD2-NE 2.88Å; D442-R444 PolarHBondContact OD2-NE 3.22Å; D442-R444 IonicContact OD2-NH2 3.89Å; D442-R444 PolarHBondContact OD2-NH2 3.06Å
443	P	38.3	Very low	35	Very low	128 Å²	128	134.8 Å²	134.8	83%	0.831	78%	0.775	S	S	*	*			trans	-86.6	95.7	-176.4	32.8	-34	0	0	0	112.7
444	R	37.2	Very low	35.3	Very low	191 Å²	191	136.8 Å²	136.8	72%	0.721	78%	0.776	S	S	*	*			trans	-123.1	138.7	168.8	-59.5	-173.3	-168	-136.7	-3.9	111.6	D442 I446	D442-R444 PolarHBondContact O-N 2.88Å; D442-R444 IonicContact OD2-CZ 3.11Å; D442-R444 IonicContact OD2-NE 2.88Å; D442-R444 PolarHBondContact OD2-NE 3.22Å; D442-R444 IonicContact OD2-NH2 3.89Å; D442-R444 PolarHBondContact OD2-NH2 3.06Å; R444-I446 PolarHBondContact O-N 3.35Å
445	P	38.4	Very low	35.5	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	77%	0.771	S	S	*	*			trans	-69.6	120	179.1	28.3	-33.6	0	0	0	110.7	S447	P445-S447 PolarHBondContact O-N 3.06Å; P445-S447 VanDerWaalsContact O-N 3.16Å
446	I	32.9	Very low	35.3	Very low	150 Å²	150	137.3 Å²	137.3	77%	0.769	77%	0.771	S	S	*	*			trans	-81.6	94.3	178.8	-54.6	177	0	0	0	109	R444 L448	R444-I446 PolarHBondContact O-N 3.35Å; I446-L448 HydrophobicContact CG2-CD2 4.26Å; I446-L448 HydrophobicContact CG2-CG 4.18Å; I446-L448 PolarHBondContact O-N 3.29Å; I446-L448 VanDerWaalsContact O-N 3.14Å
447	S	33.9	Very low	35.3	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	78%	0.779	S	S	*	*			trans	-75.7	95.2	171.6	57.3	0	0	0	0	110.6	P445 I449	P445-S447 PolarHBondContact O-N 3.06Å; P445-S447 VanDerWaalsContact O-N 3.16Å; S447-I449 VanDerWaalsContact C-N 3.31Å; S447-I449 PolarHBondContact O-N 3.3Å
448	L	32.1	Very low	35.3	Very low	162 Å²	162	137.6 Å²	137.6	85%	0.848	78%	0.779	S	S	*	*			trans	-71.9	80.9	175.3	-74	170.3	0	0	0	111.7	I446	I446-L448 HydrophobicContact CG2-CD2 4.26Å; I446-L448 HydrophobicContact CG2-CG 4.18Å; I446-L448 PolarHBondContact O-N 3.29Å; I446-L448 VanDerWaalsContact O-N 3.14Å
449	I	34.7	Very low	35.3	Very low	137 Å²	137	138 Å²	138	70%	0.703	78%	0.78	S	S	*	*			trans	-126.1	123.9	164.3	-58.8	-179.8	0	0	0	107.5	S447 T451	S447-I449 VanDerWaalsContact C-N 3.31Å; S447-I449 PolarHBondContact O-N 3.3Å; I449-T451 PolarHBondContact O-N 3.41Å
450	P	34.6	Very low	35.4	Very low	127 Å²	127	138.7 Å²	138.7	83%	0.825	78%	0.776	S	S	*	*			trans	-67	99.7	177.9	-20.7	33.3	0	0	0	111.7
451	T	35.4	Very low	35.1	Very low	121 Å²	121	143.4 Å²	143.4	74%	0.742	78%	0.784	S	S	*	*			trans	-62.7	126.4	166.1	48.2	0	0	0	0	109.3	I449 I453	I449-T451 PolarHBondContact O-N 3.41Å; T451-I453 PolarHBondContact O-N 3.17Å
452	P	35.8	Very low	34.7	Very low	110 Å²	110	140 Å²	140	71%	0.714	78%	0.783	S	S	*	*			trans	-63.6	128.1	174.5	26.6	-33.3	0	0	0	109.5	I454	P452-I454 PolarHBondContact O-N 2.82Å
453	I	35.3	Very low	34.6	Very low	162 Å²	162	144.8 Å²	144.8	83%	0.831	79%	0.793	S	S	*	*			trans	-68.5	102.1	176.3	-59.9	174.1	0	0	0	108	T451 E455	T451-I453 PolarHBondContact O-N 3.17Å; I453-E455 PolarHBondContact O-N 2.86Å
454	I	37	Very low	34.5	Very low	150 Å²	150	146.9 Å²	146.9	77%	0.769	80%	0.795	S	S	*	*			trans	-83.9	105.2	171.6	-60.7	177.4	0	0	0	107.4	P452 S456	P452-I454 PolarHBondContact O-N 2.82Å; I454-S456 PolarHBondContact O-N 3.31Å
455	E	33.9	Very low	34.3	Very low	161 Å²	161	142.4 Å²	142.4	75%	0.752	79%	0.789	S	S	*	*			trans	-58	120.9	174.8	-67.2	-172.7	140.4	0	0	110.9	I453 S457	I453-E455 PolarHBondContact O-N 2.86Å; E455-S457 PolarHBondContact O-N 3.48Å
456	S	31.6	Very low	34.5	Very low	131 Å²	131	143.9 Å²	143.9	92%	0.916	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	46.6	-172.9	60	0	0	0	0	113.5	I454	I454-S456 PolarHBondContact O-N 3.31Å
457	S	32.1	Very low	35	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.4	23	178.6	-164.4	0	0	0	0	115.6	E455	E455-S457 PolarHBondContact O-N 3.48Å
458	C	31.4	Very low	36.1	Very low	111 Å²	111	144.3 Å²	144.3	75%	0.75	79%	0.785	S	S	*	*			trans	-125.2	110.8	175.8	-92.2	0	0	0	0	112.6	P460	C458-P460 VanDerWaalsContact O-CD 3.31Å; C458-P460 WeakPolarHBondContact O-CD 3.29Å
459	K	35.4	Very low	37	Very low	207 Å²	207	138.5 Å²	138.5	90%	0.9	76%	0.756	S	S	*	*			trans	-72.8	114.5	174.8	-66.8	178.3	-179.2	176	0	110	R461	K459-R461 PolarHBondContact O-N 2.86Å
460	P	38.6	Very low	38.5	Very low	112 Å²	112	134.7 Å²	134.7	73%	0.727	74%	0.74	S	S	*	*			trans	-76.8	90.9	-175.9	31	-34.3	0	0	0	111.2	C458 G462	C458-P460 VanDerWaalsContact O-CD 3.31Å; C458-P460 WeakPolarHBondContact O-CD 3.29Å; P460-G462 PolarHBondContact O-N 3.24Å
461	R	32.8	Very low	39.8	Very low	252 Å²	252	136.1 Å²	136.1	95%	0.951	74%	0.736	S	S	*	*			trans	-73.4	87.5	177.4	-173.1	177.8	-178.6	167.8	0	111.1	K459	K459-R461 PolarHBondContact O-N 2.86Å
462	G	29.5	Very low	41.1	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	73%	0.731	S	S	*	*			trans	74.7	88.6	169.3	0	0	0	0	0	114.3	P460	P460-G462 PolarHBondContact O-N 3.24Å
463	R	36.8	Very low	42.3	Very low	212 Å²	212	134.5 Å²	134.5	80%	0.8	71%	0.711	S	S	*	*			trans	-112.1	145.3	160.1	-76.6	-171.7	172.9	-177.8	-0.7	109.5	T465	R463-T465 HydrophobicContact CB-CG2 4.37Å; R463-T465 PolarHBondContact O-N 3.4Å; R463-T465 VanDerWaalsContact O-N 3.08Å
464	I	34.9	Very low	43.7	Very low	172 Å²	172	128.8 Å²	128.8	88%	0.882	68%	0.682	S	S	*	*			trans	-75.5	96	178.8	-61.4	165.3	0	0	0	107.6
465	T	34.4	Very low	45	Very low	97 Å²	97	125.9 Å²	125.9	60%	0.595	67%	0.671	S	S	*	*			trans	-110.7	60.9	-178	52.3	0	0	0	0	111	R463	R463-T465 HydrophobicContact CB-CG2 4.37Å; R463-T465 PolarHBondContact O-N 3.4Å; R463-T465 VanDerWaalsContact O-N 3.08Å
466	H	41.6	Very low	46.2	Very low	158 Å²	158	120.3 Å²	120.3	73%	0.731	65%	0.652	S	S	*	*			trans	-144.8	116.2	156.9	-99	-82.2	0	0	0	107.3	P468	H466-P468 VanDerWaalsContact O-CD 3.25Å; H466-P468 WeakPolarHBondContact O-CD 3.48Å
467	L	43	Very low	47.3	Very low	164 Å²	164	114.5 Å²	114.5	86%	0.859	61%	0.611	S	S	*	*			trans	-95	91.6	152.9	-72.8	172.9	0	0	0	105.2	V469	L467-V469 PolarHBondContact O-N 3.05Å
468	P	56.8	Low	48.6	Very low	99 Å²	99	110.6 Å²	110.6	64%	0.643	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-62.7	123.5	177.5	27	-33	0	0	0	108.3	H466 P470	H466-P468 VanDerWaalsContact O-CD 3.25Å; H466-P468 WeakPolarHBondContact O-CD 3.48Å; P468-P470 VanDerWaalsContact O-CD 3.27Å; P468-P470 WeakPolarHBondContact O-CD 3.46Å; P468-P470 VanDerWaalsContact O-N 3.14Å
469	V	52.8	Low	50.1	Low	39 Å²	39	109.4 Å²	109.4	24%	0.236	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-54.2	119.3	159.8	174.2	0	0	0	0	105.7	L467 E471 L473 M474	L467-V469 PolarHBondContact O-N 3.05Å; V469-E471 PolarHBondContact O-N 3.41Å; V469-L473 HydrophobicContact CG1-CB 4.01Å; V469-M474 HydrophobicContact CB-CE 3.94Å; V469-M474 HydrophobicContact CG1-CE 4.09Å
470	P	64.6	Low	51	Low	57 Å²	57	100.6 Å²	100.6	37%	0.37	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-54.5	138.7	-176.8	-27.5	34.5	0	0	0	110.8	P468 H472 L473 M474	P468-P470 VanDerWaalsContact O-CD 3.27Å; P468-P470 WeakPolarHBondContact O-CD 3.46Å; P468-P470 VanDerWaalsContact O-N 3.14Å; P470-H472 WeakPolarHBondContact CB-CE1 3.31Å; P470-H472 PolarHBondContact O-N 3.49Å; P470-L473 HydrophobicContact CB-CG 4.47Å; P470-L473 HydrophobicContact CG-CD1 4.41Å; P470-L473 WeakPolarHBondContact O-CA 3.31Å; P470-L473 WeakPolarHBondContact O-CB 3.39Å; P470-L473 PolarHBondContact O-N 2.99Å; P470-M474 PolarHBondContact O-N 2.93Å
471	E	62.1	Low	51.9	Low	157 Å²	157	97.1 Å²	97.1	73%	0.734	51%	0.51	S	S	*	.	H	α-helix	trans	-57.8	-30	-173	-163.7	168.2	-148.8	0	0	112.4	V469 L473 M474	V469-E471 PolarHBondContact O-N 3.41Å; E471-L473 VanDerWaalsContact C-N 3.32Å; E471-L473 PolarHBondContact O-N 3.09Å; E471-M474 VanDerWaalsContact O-CB 3.31Å; E471-M474 WeakPolarHBondContact O-CB 3.35Å; E471-M474 PolarHBondContact O-N 3.07Å
472	H	62.2	Low	52.9	Low	138 Å²	138	87.6 Å²	87.6	64%	0.639	49%	0.485	S	S	*	.	H	α-helix	trans	-71.9	-16.9	173.5	65.2	-105.2	0	0	0	115.2	P470	P470-H472 WeakPolarHBondContact CB-CE1 3.31Å; P470-H472 PolarHBondContact O-N 3.49Å
473	L	61.4	Low	53.6	Low	59 Å²	59	85.3 Å²	85.3	31%	0.309	46%	0.458	S	S	.	.	H	α-helix	trans	-90.9	-20.9	168.5	-64.4	-172	0	0	0	111.9	V469 P470 E471 T475 A476 F477 W510	V469-L473 HydrophobicContact CG1-CB 4.01Å; P470-L473 HydrophobicContact CB-CG 4.47Å; P470-L473 HydrophobicContact CG-CD1 4.41Å; P470-L473 WeakPolarHBondContact O-CA 3.31Å; P470-L473 WeakPolarHBondContact O-CB 3.39Å; P470-L473 PolarHBondContact O-N 2.99Å; E471-L473 VanDerWaalsContact C-N 3.32Å; E471-L473 PolarHBondContact O-N 3.09Å; L473-T475 VanDerWaalsContact C-N 3.3Å; L473-T475 PolarHBondContact O-N 2.79Å; L473-A476 WeakPolarHBondContact O-CB 3.38Å; L473-A476 PolarHBondContact O-N 3.5Å; L473-F477 PolarHBondContact O-N 3.46Å; L473-W510 HydrophobicContact CD2-CH2 4.5Å; L473-W510 HydrophobicContact CD2-CZ2 3.88Å
474	M	64.1	Low	53.9	Low	43 Å²	43	80.3 Å²	80.3	21%	0.212	45%	0.451	C	S	.	.	H	α-helix	trans	-58.7	-41.5	179.6	-163.2	62.4	63.8	0	0	111.5	V469 P470 E471 A476 F477 E478	V469-M474 HydrophobicContact CB-CE 3.94Å; V469-M474 HydrophobicContact CG1-CE 4.09Å; P470-M474 PolarHBondContact O-N 2.93Å; E471-M474 VanDerWaalsContact O-CB 3.31Å; E471-M474 WeakPolarHBondContact O-CB 3.35Å; E471-M474 PolarHBondContact O-N 3.07Å; M474-A476 VanDerWaalsContact C-N 3.31Å; M474-A476 PolarHBondContact O-N 3Å; M474-F477 CarbonylContact O-C 3.52Å; M474-F477 WeakPolarHBondContact O-CA 3.21Å; M474-F477 VanDerWaalsContact O-CB 3.25Å; M474-F477 WeakPolarHBondContact O-CB 3.48Å; M474-F477 PolarHBondContact O-N 3.4Å; M474-F477 VanDerWaalsContact O-N 3.15Å; M474-F477 HydrophobicContact SD-CD1 4.39Å; M474-E478 WeakPolarHBondContact CG-OE1 3.39Å; M474-E478 WeakPolarHBondContact O-CB 3.43Å; M474-E478 WeakPolarHBondContact O-CG 3.28Å; M474-E478 PolarHBondContact O-N 3.22Å
475	T	65.9	Low	54.2	Low	89 Å²	89	73.2 Å²	73.2	55%	0.546	42%	0.42	S	S	.	.	H	α-helix	trans	-65.3	-31.4	175.9	-49.8	0	0	0	0	113.4	L473 E478 E479	L473-T475 VanDerWaalsContact C-N 3.3Å; L473-T475 PolarHBondContact O-N 2.79Å; T475-E478 WeakPolarHBondContact CA-OE2 3.35Å; T475-E479 WeakPolarHBondContact O-CB 3.4Å; T475-E479 PolarHBondContact O-N 3.25Å
476	A	57.9	Low	54.5	Low	43 Å²	43	71.6 Å²	71.6	36%	0.355	41%	0.41	S	S	.	.	H	α-helix	trans	-74.4	-35.4	173.3	0	0	0	0	0	111.5	L473 M474 A480	L473-A476 WeakPolarHBondContact O-CB 3.38Å; L473-A476 PolarHBondContact O-N 3.5Å; M474-A476 VanDerWaalsContact C-N 3.31Å; M474-A476 PolarHBondContact O-N 3Å; A476-A480 WeakPolarHBondContact O-CB 3.43Å; A476-A480 PolarHBondContact O-N 2.85Å; A476-A480 VanDerWaalsContact O-N 3.08Å
477	F	54.2	Low	54.4	Low	9 Å²	9	68.2 Å²	68.2	4%	0.039	39%	0.391	C	S	.	.	H	α-helix	trans	-60.3	-45.9	171.2	-148.9	-120.3	0	0	0	110.6	L473 M474 A481 F647 F651 F666	L473-F477 PolarHBondContact O-N 3.46Å; M474-F477 CarbonylContact O-C 3.52Å; M474-F477 WeakPolarHBondContact O-CA 3.21Å; M474-F477 VanDerWaalsContact O-CB 3.25Å; M474-F477 WeakPolarHBondContact O-CB 3.48Å; M474-F477 PolarHBondContact O-N 3.4Å; M474-F477 VanDerWaalsContact O-N 3.15Å; M474-F477 HydrophobicContact SD-CD1 4.39Å; F477-A481 WeakPolarHBondContact O-CB 3.44Å; F477-A481 PolarHBondContact O-N 2.86Å; F477-F647 AromaticContact CD1-CE1 3.56Å; F477-F647 HydrophobicContact CD1-CE1 3.56Å; F477-F647 AromaticContact CD1-CZ 3.86Å; F477-F647 HydrophobicContact CD1-CZ 3.86Å; F477-F647 AromaticContact CE1-CE1 3.51Å; F477-F647 HydrophobicContact CE1-CE1 3.51Å; F477-F647 AromaticContact CE1-CZ 3.5Å; F477-F647 HydrophobicContact CE1-CZ 3.5Å; F477-F647 HydrophobicContact CZ-CZ 4.36Å; F477-F651 AromaticContact CE1-CD2 3.92Å; F477-F651 HydrophobicContact CE1-CD2 3.92Å; F477-F651 AromaticContact CE1-CE2 3.72Å; F477-F651 HydrophobicContact CE1-CE2 3.72Å; F477-F651 HydrophobicContact CE1-CG 4.48Å; F477-F651 HydrophobicContact CE1-CZ 4.13Å; F477-F651 HydrophobicContact CZ-CD2 4.22Å; F477-F651 AromaticContact CZ-CE2 3.59Å; F477-F651 HydrophobicContact CZ-CE2 3.59Å; F477-F651 AromaticContact CZ-CZ 3.99Å; F477-F651 HydrophobicContact CZ-CZ 3.99Å; F477-F666 HydrophobicContact CB-CZ 4.38Å; F477-F666 HydrophobicContact CD2-CB 4.32Å; F477-F666 AromaticContact CD2-CD1 3.58Å; F477-F666 HydrophobicContact CD2-CD1 3.58Å; F477-F666 AromaticContact CD2-CD2 3.5Å; F477-F666 HydrophobicContact CD2-CD2 3.5Å; F477-F666 VanDerWaalsContact CD2-CD2 3.5Å; F477-F666 AromaticContact CD2-CE1 3.7Å; F477-F666 HydrophobicContact CD2-CE1 3.7Å; F477-F666 AromaticContact CD2-CE2 3.59Å; F477-F666 HydrophobicContact CD2-CE2 3.59Å; F477-F666 AromaticContact CD2-CG 3.51Å; F477-F666 HydrophobicContact CD2-CG 3.51Å; F477-F666 AromaticContact CD2-CZ 3.72Å; F477-F666 HydrophobicContact CD2-CZ 3.72Å; F477-F666 HydrophobicContact CE2-CB 3.66Å; F477-F666 AromaticContact CE2-CD1 3.74Å; F477-F666 HydrophobicContact CE2-CD1 3.74Å; F477-F666 AromaticContact CE2-CD2 3.57Å; F477-F666 HydrophobicContact CE2-CD2 3.57Å; F477-F666 HydrophobicContact CE2-CE1 4.34Å; F477-F666 HydrophobicContact CE2-CE2 4.16Å; F477-F666 AromaticContact CE2-CG 3.35Å; F477-F666 HydrophobicContact CE2-CG 3.35Å; F477-F666 HydrophobicContact CG-CD2 4.42Å; F477-F666 HydrophobicContact CG-CE2 4.24Å; F477-F666 HydrophobicContact CG-CZ 4.42Å
478	E	61.2	Low	54.6	Low	31 Å²	31	64.4 Å²	64.4	15%	0.145	38%	0.376	C	S	.	.	H	α-helix	trans	-65.6	-45.9	176.3	-70	159.2	169.1	0	0	112.3	M474 T475 A480 A481 A482 L644 R648	M474-E478 WeakPolarHBondContact CG-OE1 3.39Å; M474-E478 WeakPolarHBondContact O-CB 3.43Å; M474-E478 WeakPolarHBondContact O-CG 3.28Å; M474-E478 PolarHBondContact O-N 3.22Å; T475-E478 WeakPolarHBondContact CA-OE2 3.35Å; E478-A480 VanDerWaalsContact C-N 3.35Å; E478-A480 PolarHBondContact O-N 3.21Å; E478-A481 PolarHBondContact O-N 3.27Å; E478-A482 VanDerWaalsContact O-CB 3.24Å; E478-A482 WeakPolarHBondContact O-CB 3.23Å; E478-A482 PolarHBondContact O-N 3.34Å; E478-L644 HydrophobicContact CB-CD1 4.49Å; E478-L644 HydrophobicContact CG-CD1 3.99Å; E478-L644 HydrophobicContact CG-CG 4.09Å; E478-L644 WeakPolarHBondContact OE1-CD1 3.35Å; E478-L644 WeakPolarHBondContact OE1-CG 3.4Å; E478-R648 IonicContact OE1-CZ 3.49Å; E478-R648 VanDerWaalsContact OE1-CZ 3.25Å; E478-R648 IonicContact OE1-NE 3.56Å; E478-R648 PolarHBondContact OE1-NE 2.65Å; E478-R648 IonicContact OE1-NH2 2.71Å; E478-R648 PolarHBondContact OE1-NH2 3.11Å
479	E	61.5	Low	54	Low	86 Å²	86	63.4 Å²	63.4	40%	0.402	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-34.6	179.2	-173.7	168.3	-156.1	0	0	112.6	T475 S483 R505	T475-E479 WeakPolarHBondContact O-CB 3.4Å; T475-E479 PolarHBondContact O-N 3.25Å; E479-S483 WeakPolarHBondContact O-CB 3.27Å; E479-S483 PolarHBondContact O-N 2.96Å; E479-R505 IonicContact OE1-NH1 3.9Å; E479-R505 PolarHBondContact OE1-NH1 3.09Å
480	A	55	Low	53.1	Low	22 Å²	22	70.6 Å²	70.6	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-90.9	-18.9	177.7	0	0	0	0	0	114.3	A476 E478 F666	A476-A480 WeakPolarHBondContact O-CB 3.43Å; A476-A480 PolarHBondContact O-N 2.85Å; A476-A480 VanDerWaalsContact O-N 3.08Å; E478-A480 VanDerWaalsContact C-N 3.35Å; E478-A480 PolarHBondContact O-N 3.21Å; A480-F666 HydrophobicContact CB-CE2 3.6Å; A480-F666 HydrophobicContact CB-CZ 3.8Å
481	A	56.7	Low	51.7	Low	38 Å²	38	71 Å²	71	31%	0.314	41%	0.412	S	S	.	.	H	α-helix	trans	-77.4	-33.6	167.4	0	0	0	0	0	112.2	F477 E478 F647	F477-A481 WeakPolarHBondContact O-CB 3.44Å; F477-A481 PolarHBondContact O-N 2.86Å; E478-A481 PolarHBondContact O-N 3.27Å; A481-F647 HydrophobicContact CB-CD2 4.19Å; A481-F647 HydrophobicContact CB-CE2 3.99Å; A481-F647 HydrophobicContact CB-CZ 4.32Å
482	A	55	Low	50.5	Low	53 Å²	53	70.8 Å²	70.8	44%	0.438	42%	0.416	S	S	.	.	H	α-helix	trans	-79.6	-19.6	174.5	0	0	0	0	0	113.7	E478 T484 L641	E478-A482 VanDerWaalsContact O-CB 3.24Å; E478-A482 WeakPolarHBondContact O-CB 3.23Å; E478-A482 PolarHBondContact O-N 3.34Å; A482-T484 PolarHBondContact O-N 3Å; A482-L641 WeakPolarHBondContact O-CD2 3.2Å
483	S	44.4	Very low	49.2	Very low	26 Å²	26	72.5 Å²	72.5	18%	0.182	42%	0.424	C	S	.	.	S	Bend	trans	-81.1	110.6	177.3	-169.8	0	0	0	0	111.1	E479 G485 V486	E479-S483 WeakPolarHBondContact O-CB 3.27Å; E479-S483 PolarHBondContact O-N 2.96Å; S483-G485 VanDerWaalsContact C-N 3.32Å; S483-G485 PolarHBondContact O-N 3.48Å; S483-V486 PolarHBondContact OG-O 2.96Å
484	T	41.7	Very low	47.9	Very low	106 Å²	106	75 Å²	75	65%	0.65	44%	0.444	S	S	*	.			trans	-71.6	79.7	-176.8	37.8	0	0	0	0	112.9	A482 V486 L641	A482-T484 PolarHBondContact O-N 3Å; T484-V486 VanDerWaalsContact C-N 3.29Å; T484-V486 PolarHBondContact O-N 2.9Å; T484-L641 HydrophobicContact CG2-CD2 3.82Å
485	G	42.4	Very low	46.5	Very low	24 Å²	24	81.9 Å²	81.9	25%	0.247	48%	0.475	C	S	.	.	S	Bend	trans	80.7	-8.5	162.3	0	0	0	0	0	116.5	S483 R669	S483-G485 VanDerWaalsContact C-N 3.32Å; S483-G485 PolarHBondContact O-N 3.48Å; G485-R669 PolarHBondContact O-NH2 3.38Å
486	V	40.4	Very low	44.8	Very low	63 Å²	63	86.4 Å²	86.4	38%	0.382	49%	0.49	S	S	.	.			trans	-132.8	104.7	-179.5	-169.5	0	0	0	0	111.1	S483 T484 P488 P489 K490	S483-V486 PolarHBondContact OG-O 2.96Å; T484-V486 VanDerWaalsContact C-N 3.29Å; T484-V486 PolarHBondContact O-N 2.9Å; V486-P488 CarbonylContact O-C 3.14Å; V486-P489 WeakPolarHBondContact O-CA 3.36Å; V486-K490 HydrophobicContact CG1-CD 3.99Å; V486-K490 HydrophobicContact CG1-CG 3.91Å
487	W	39.4	Very low	43.6	Very low	86 Å²	86	91.2 Å²	91.2	33%	0.326	52%	0.515	S	S	.	.	S	Bend	trans	-107.2	136.2	163.1	-130.2	96.6	0	0	0	109.3
488	P	47.7	Very low	42.4	Very low	85 Å²	85	94.6 Å²	94.6	55%	0.552	55%	0.553	S	S	*	*	S	Bend	cis	-64.4	149.1	-7.2	30	-35.7	0	0	0	112.4	V486 K490	V486-P488 CarbonylContact O-C 3.14Å; P488-K490 PolarHBondContact O-N 3.28Å
489	P	42.5	Very low	40.8	Very low	78 Å²	78	97.2 Å²	97.2	51%	0.506	59%	0.588	S	S	.	*			trans	-59.2	126.6	-175.5	22.4	-33.5	0	0	0	111.6	V486 G491	V486-P489 WeakPolarHBondContact O-CA 3.36Å; P489-G491 VanDerWaalsContact C-N 3.29Å; P489-G491 PolarHBondContact O-N 3.27Å
490	K	35.5	Very low	39.3	Very low	189 Å²	189	95.9 Å²	95.9	82%	0.822	60%	0.597	S	S	*	*	S	Bend	trans	-71.3	82.2	176	-77.9	-179	173.8	179.3	0	111	V486 P488	V486-K490 HydrophobicContact CG1-CD 3.99Å; V486-K490 HydrophobicContact CG1-CG 3.91Å; P488-K490 PolarHBondContact O-N 3.28Å
491	G	35.3	Very low	38.3	Very low	66 Å²	66	103.1 Å²	103.1	68%	0.68	63%	0.633	S	S	*	*			trans	-139.9	17	-179.8	0	0	0	0	0	114.4	P489	P489-G491 VanDerWaalsContact C-N 3.29Å; P489-G491 PolarHBondContact O-N 3.27Å
492	L	37.1	Very low	37.5	Very low	153 Å²	153	107.4 Å²	107.4	80%	0.801	66%	0.655	S	S	*	*			trans	-133.8	62.6	175.1	-74.5	174.2	0	0	0	110.6
493	E	34.2	Very low	37	Very low	174 Å²	174	113.9 Å²	113.9	81%	0.813	67%	0.674	S	S	*	*			trans	-61.5	134.1	150	-82	-67.5	151.7	0	0	108.1	E495	E493-E495 VanDerWaalsContact C-N 3.28Å; E493-E495 PolarHBondContact O-N 2.89Å
494	P	34.3	Very low	37.2	Very low	111 Å²	111	117.3 Å²	117.3	72%	0.721	70%	0.695	S	S	*	*			trans	-77.8	76.5	179.8	32.3	-34.8	0	0	0	110.6	Q496	P494-Q496 PolarHBondContact O-N 3.29Å
495	E	33.6	Very low	37.5	Very low	187 Å²	187	122.4 Å²	122.4	87%	0.874	70%	0.702	S	S	*	*			trans	-61	138.4	174.8	-167.4	171.2	-145.1	0	0	110.9	E493 T497	E493-E495 VanDerWaalsContact C-N 3.28Å; E493-E495 PolarHBondContact O-N 2.89Å; E495-T497 PolarHBondContact O-N 3.27Å
496	Q	31.6	Very low	38.4	Very low	185 Å²	185	123.9 Å²	123.9	86%	0.864	71%	0.712	S	S	*	*	S	Bend	trans	-80.5	82.1	-154.7	-60.7	172.2	10.3	0	0	113.3	P494	P494-Q496 PolarHBondContact O-N 3.29Å
497	T	31.9	Very low	39.6	Very low	143 Å²	143	123.1 Å²	123.1	88%	0.877	71%	0.706	S	S	*	*			trans	-159.4	128.2	151.3	9.3	0	0	0	0	115.1	E495	E495-T497 PolarHBondContact O-N 3.27Å
498	G	28.2	Very low	41.4	Very low	80 Å²	80	122.1 Å²	122.1	83%	0.825	71%	0.711	S	S	*	*			trans	75	59.4	139.8	0	0	0	0	0	120
499	G	27.3	Very low	42.4	Very low	86 Å²	86	121 Å²	121	89%	0.887	71%	0.709	S	S	*	*			trans	42.5	100.8	145.3	0	0	0	0	0	120.3
500	G	31.8	Very low	44.2	Very low	58 Å²	58	123.9 Å²	123.9	60%	0.598	71%	0.71	S	S	*	*			trans	-160.5	135.1	163.3	0	0	0	0	0	111.7	T502	G500-T502 VanDerWaalsContact C-N 3.27Å; G500-T502 PolarHBondContact O-N 3.3Å
501	N	32.5	Very low	46	Very low	175 Å²	175	116.6 Å²	116.6	94%	0.936	68%	0.679	S	S	*	*			trans	-78.4	66.4	-175.7	-75.7	-19.7	0	0	0	112.8	K503	N501-K503 PolarHBondContact O-N 2.8Å
502	T	39.9	Very low	47.9	Very low	127 Å²	127	119.4 Å²	119.4	78%	0.779	67%	0.669	S	S	*	*			trans	-82.7	90.6	174.2	45.3	0	0	0	0	111.1	G500	G500-T502 VanDerWaalsContact C-N 3.27Å; G500-T502 PolarHBondContact O-N 3.3Å
503	K	45.4	Very low	49.9	Very low	190 Å²	190	116.7 Å²	116.7	83%	0.826	66%	0.656	S	S	*	*			trans	-53.9	142.7	170.6	-70.1	-170.3	174.2	-167.9	0	110.8	N501	N501-K503 PolarHBondContact O-N 2.8Å
504	P	47.8	Very low	52.1	Low	97 Å²	97	112 Å²	112	63%	0.63	63%	0.634	S	S	*	*			trans	-55.6	149.6	172	24.6	-33.6	0	0	0	110.6	A506	P504-A506 VanDerWaalsContact C-N 3.27Å; P504-A506 PolarHBondContact O-N 2.78Å
505	R	48.9	Very low	54.5	Low	213 Å²	213	110.6 Å²	110.6	80%	0.804	62%	0.62	S	S	*	*			trans	-72.6	77.7	-167.1	-165.8	-178.5	-174.1	-144.2	4.3	111.3	E479	E479-R505 IonicContact OE1-NH1 3.9Å; E479-R505 PolarHBondContact OE1-NH1 3.09Å
506	A	61.4	Low	56.8	Low	55 Å²	55	106 Å²	106	46%	0.455	60%	0.599	S	S	.	*			trans	-53.4	150.3	-171.7	0	0	0	0	0	113.9	P504 R512	P504-A506 VanDerWaalsContact C-N 3.27Å; P504-A506 PolarHBondContact O-N 2.78Å; A506-R512 PolarHBondContact O-NH2 3.22Å
507	L	65.3	Low	59.4	Low	47 Å²	47	102.9 Å²	102.9	25%	0.246	58%	0.582	C	S	.	*			trans	-31.1	148.1	-177.2	-64.8	167.8	0	0	0	115.3	A509 L511 R512 L515	L507-A509 PolarHBondContact O-N 2.9Å; L507-L511 HydrophobicContact CD1-CD2 4.07Å; L507-L511 HydrophobicContact CD2-CD2 4.42Å; L507-R512 HydrophobicContact CB-CG 4.06Å; L507-R512 PolarHBondContact O-NE 3.31Å; L507-R512 PolarHBondContact O-NH2 3.14Å; L507-L515 HydrophobicContact CD1-CD1 4.04Å
508	P	76.5	Confident	61.8	Low	66 Å²	66	100.3 Å²	100.3	43%	0.429	56%	0.562	S	S	.	*			trans	-46.8	138.5	174.5	-29	35.9	0	0	0	112.5	W510 L511 R512	P508-W510 VanDerWaalsContact C-N 3.32Å; P508-W510 PolarHBondContact O-N 2.72Å; P508-L511 HydrophobicContact CB-CB 4.4Å; P508-L511 WeakPolarHBondContact O-CA 3.43Å; P508-L511 WeakPolarHBondContact O-CB 3.43Å; P508-L511 PolarHBondContact O-N 3.01Å; P508-R512 PolarHBondContact O-N 3.36Å; P508-R512 VanDerWaalsContact O-N 3.09Å
509	A	70.1	Confident	64.4	Low	62 Å²	62	102.9 Å²	102.9	51%	0.512	55%	0.553	S	S	.	*	H	α-helix	trans	-54.1	-46.4	-170.3	0	0	0	0	0	112.5	L507 L511 R512 D513	L507-A509 PolarHBondContact O-N 2.9Å; A509-L511 PolarHBondContact O-N 2.96Å; A509-L511 VanDerWaalsContact O-N 3.15Å; A509-R512 WeakPolarHBondContact O-CB 3.39Å; A509-R512 PolarHBondContact O-N 2.76Å; A509-R512 VanDerWaalsContact O-N 3.11Å; A509-D513 PolarHBondContact O-N 3.33Å
510	W	78.8	Confident	67.1	Low	138 Å²	138	104.3 Å²	104.3	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-57.2	-31.6	176.6	74.2	-97.1	0	0	0	113.8	L473 P508 E514	L473-W510 HydrophobicContact CD2-CH2 4.5Å; L473-W510 HydrophobicContact CD2-CZ2 3.88Å; P508-W510 VanDerWaalsContact C-N 3.32Å; P508-W510 PolarHBondContact O-N 2.72Å; W510-E514 WeakPolarHBondContact O-CB 3.4Å; W510-E514 PolarHBondContact O-N 2.84Å
511	L	73.9	Confident	69.8	Low	36 Å²	36	108 Å²	108	19%	0.188	53%	0.534	C	S	.	.	H	α-helix	trans	-81.4	-34.6	-178.4	-158	155.9	0	0	0	110.2	L507 P508 A509 L515	L507-L511 HydrophobicContact CD1-CD2 4.07Å; L507-L511 HydrophobicContact CD2-CD2 4.42Å; P508-L511 HydrophobicContact CB-CB 4.4Å; P508-L511 WeakPolarHBondContact O-CA 3.43Å; P508-L511 WeakPolarHBondContact O-CB 3.43Å; P508-L511 PolarHBondContact O-N 3.01Å; A509-L511 PolarHBondContact O-N 2.96Å; A509-L511 VanDerWaalsContact O-N 3.15Å; L511-L515 HydrophobicContact CD2-CD1 3.68Å; L511-L515 HydrophobicContact CD2-CG 4.11Å; L511-L515 VanDerWaalsContact O-CB 3.29Å; L511-L515 WeakPolarHBondContact O-CB 3.29Å; L511-L515 VanDerWaalsContact O-CG 3.24Å; L511-L515 WeakPolarHBondContact O-CG 3.48Å; L511-L515 PolarHBondContact O-N 2.97Å
512	R	75.2	Confident	72.2	Confident	124 Å²	124	106.3 Å²	106.3	47%	0.468	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-47.9	164.6	-80.4	-176.7	-95.4	175.9	-11.1	111.6	A506 L507 P508 A509 E514 L515 E516	A506-R512 PolarHBondContact O-NH2 3.22Å; L507-R512 HydrophobicContact CB-CG 4.06Å; L507-R512 PolarHBondContact O-NE 3.31Å; L507-R512 PolarHBondContact O-NH2 3.14Å; P508-R512 PolarHBondContact O-N 3.36Å; P508-R512 VanDerWaalsContact O-N 3.09Å; A509-R512 WeakPolarHBondContact O-CB 3.39Å; A509-R512 PolarHBondContact O-N 2.76Å; A509-R512 VanDerWaalsContact O-N 3.11Å; R512-E514 PolarHBondContact O-N 2.97Å; R512-L515 PolarHBondContact O-N 2.82Å; R512-E516 VanDerWaalsContact O-CB 3.32Å; R512-E516 WeakPolarHBondContact O-CB 3.29Å; R512-E516 PolarHBondContact O-N 3.45Å
513	D	80	Confident	74.1	Confident	97 Å²	97	102.9 Å²	102.9	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-41.3	-178.9	-61.2	-23	0	0	0	111.4	A509 K517	A509-D513 PolarHBondContact O-N 3.33Å; D513-K517 WeakPolarHBondContact O-CB 3.45Å; D513-K517 PolarHBondContact O-N 2.68Å
514	E	80.7	Confident	75.9	Confident	76 Å²	76	101.7 Å²	101.7	36%	0.355	50%	0.498	S	S	.	.	H	α-helix	trans	-73.2	-35	177.2	-164.5	63.1	-150.6	0	0	112.4	W510 R512 K517 L518	W510-E514 WeakPolarHBondContact O-CB 3.4Å; W510-E514 PolarHBondContact O-N 2.84Å; R512-E514 PolarHBondContact O-N 2.97Å; E514-K517 PolarHBondContact O-N 3.16Å; E514-K517 IonicContact OE1-NZ 2.74Å; E514-K517 PolarHBondContact OE1-NZ 2.86Å; E514-K517 IonicContact OE2-NZ 3.62Å; E514-K517 PolarHBondContact OE2-NZ 3.37Å; E514-L518 WeakPolarHBondContact O-CB 3.29Å; E514-L518 VanDerWaalsContact O-CG 3.25Å; E514-L518 WeakPolarHBondContact O-CG 3.32Å; E514-L518 PolarHBondContact O-N 3.07Å
515	L	83	Confident	77.2	Confident	81 Å²	81	102.8 Å²	102.8	42%	0.424	50%	0.495	S	S	.	.	H	α-helix	trans	-65	-46.8	170.9	-77.8	175.5	0	0	0	111.6	L507 L511 R512 K517 L518 E519	L507-L515 HydrophobicContact CD1-CD1 4.04Å; L511-L515 HydrophobicContact CD2-CD1 3.68Å; L511-L515 HydrophobicContact CD2-CG 4.11Å; L511-L515 VanDerWaalsContact O-CB 3.29Å; L511-L515 WeakPolarHBondContact O-CB 3.29Å; L511-L515 VanDerWaalsContact O-CG 3.24Å; L511-L515 WeakPolarHBondContact O-CG 3.48Å; L511-L515 PolarHBondContact O-N 2.97Å; R512-L515 PolarHBondContact O-N 2.82Å; L515-K517 VanDerWaalsContact C-N 3.27Å; L515-K517 PolarHBondContact O-N 3.47Å; L515-L518 CarbonylContact O-C 3.58Å; L515-L518 PolarHBondContact O-N 3.38Å; L515-L518 VanDerWaalsContact O-N 3.16Å; L515-E519 WeakPolarHBondContact O-CB 3.25Å; L515-E519 PolarHBondContact O-N 3.38Å
516	E	83.7	Confident	78.5	Confident	91 Å²	91	97.4 Å²	97.4	43%	0.425	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-35.1	177.1	-162.2	-146.4	-165.3	0	0	111.1	R512 E519 K520	R512-E516 VanDerWaalsContact O-CB 3.32Å; R512-E516 WeakPolarHBondContact O-CB 3.29Å; R512-E516 PolarHBondContact O-N 3.45Å; E516-E519 PolarHBondContact O-N 2.9Å; E516-K520 HydrophobicContact CG-CD 4.35Å; E516-K520 VanDerWaalsContact O-CB 3.27Å; E516-K520 WeakPolarHBondContact O-CB 3.2Å; E516-K520 WeakPolarHBondContact O-CD 3.23Å; E516-K520 WeakPolarHBondContact O-CG 3.28Å; E516-K520 PolarHBondContact O-N 2.91Å; E516-K520 WeakPolarHBondContact OE1-CE 3.33Å; E516-K520 IonicContact OE1-NZ 3.81Å; E516-K520 PolarHBondContact OE1-NZ 2.63Å; E516-K520 WeakPolarHBondContact OE2-CE 3.24Å; E516-K520 IonicContact OE2-NZ 3.27Å; E516-K520 PolarHBondContact OE2-NZ 2.82Å
517	K	84.4	Confident	79	Confident	119 Å²	119	98.1 Å²	98.1	52%	0.517	49%	0.487	S	S	.	.	H	α-helix	trans	-69.2	-38.2	173.1	173.6	168.3	162.7	-105.2	0	112.7	D513 E514 L515 K521	D513-K517 WeakPolarHBondContact O-CB 3.45Å; D513-K517 PolarHBondContact O-N 2.68Å; E514-K517 PolarHBondContact O-N 3.16Å; E514-K517 IonicContact OE1-NZ 2.74Å; E514-K517 PolarHBondContact OE1-NZ 2.86Å; E514-K517 IonicContact OE2-NZ 3.62Å; E514-K517 PolarHBondContact OE2-NZ 3.37Å; L515-K517 VanDerWaalsContact C-N 3.27Å; L515-K517 PolarHBondContact O-N 3.47Å; K517-K521 WeakPolarHBondContact O-CB 3.48Å; K517-K521 PolarHBondContact O-N 3.49Å
518	L	82.3	Confident	79.2	Confident	89 Å²	89	99.3 Å²	99.3	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-68.9	-39.1	172.1	-75.6	169.3	0	0	0	111.8	E514 L515 K521 K522	E514-L518 WeakPolarHBondContact O-CB 3.29Å; E514-L518 VanDerWaalsContact O-CG 3.25Å; E514-L518 WeakPolarHBondContact O-CG 3.32Å; E514-L518 PolarHBondContact O-N 3.07Å; L515-L518 CarbonylContact O-C 3.58Å; L515-L518 PolarHBondContact O-N 3.38Å; L515-L518 VanDerWaalsContact O-N 3.16Å; L518-K521 PolarHBondContact O-N 2.91Å; L518-K522 WeakPolarHBondContact O-CB 3.19Å; L518-K522 PolarHBondContact O-N 3.29Å
519	E	82.6	Confident	78.4	Confident	134 Å²	134	100.1 Å²	100.1	63%	0.626	51%	0.507	S	S	*	.	H	α-helix	trans	-64.6	-50.2	173.9	-175.7	178.9	-158.2	0	0	111	L515 E516 K521 K522 A523	L515-E519 WeakPolarHBondContact O-CB 3.25Å; L515-E519 PolarHBondContact O-N 3.38Å; E516-E519 PolarHBondContact O-N 2.9Å; E519-K521 PolarHBondContact O-N 3.43Å; E519-K522 CarbonylContact O-C 3.59Å; E519-K522 PolarHBondContact O-N 3.39Å; E519-K522 VanDerWaalsContact O-N 3.09Å; E519-A523 WeakPolarHBondContact O-CB 3.27Å; E519-A523 PolarHBondContact O-N 3.19Å
520	K	85.5	Confident	77.7	Confident	116 Å²	116	101.8 Å²	101.8	50%	0.504	52%	0.515	S	S	.	.	H	α-helix	trans	-56.9	-36.7	173.3	-75.9	166.8	-178.9	172.2	0	112.1	E516 K524	E516-K520 HydrophobicContact CG-CD 4.35Å; E516-K520 VanDerWaalsContact O-CB 3.27Å; E516-K520 WeakPolarHBondContact O-CB 3.2Å; E516-K520 WeakPolarHBondContact O-CD 3.23Å; E516-K520 WeakPolarHBondContact O-CG 3.28Å; E516-K520 PolarHBondContact O-N 2.91Å; E516-K520 WeakPolarHBondContact OE1-CE 3.33Å; E516-K520 IonicContact OE1-NZ 3.81Å; E516-K520 PolarHBondContact OE1-NZ 2.63Å; E516-K520 WeakPolarHBondContact OE2-CE 3.24Å; E516-K520 IonicContact OE2-NZ 3.27Å; E516-K520 PolarHBondContact OE2-NZ 2.82Å; K520-K524 VanDerWaalsContact O-CB 3.29Å; K520-K524 WeakPolarHBondContact O-CB 3.39Å; K520-K524 PolarHBondContact O-N 3.46Å
521	K	86.9	Confident	76.1	Confident	134 Å²	134	97.7 Å²	97.7	58%	0.583	52%	0.516	S	S	*	.	H	α-helix	trans	-66.2	-49.5	173.1	-173.9	-179.3	174.9	-173.5	0	111.4	K517 L518 E519 A523 K524 E525	K517-K521 WeakPolarHBondContact O-CB 3.48Å; K517-K521 PolarHBondContact O-N 3.49Å; L518-K521 PolarHBondContact O-N 2.91Å; E519-K521 PolarHBondContact O-N 3.43Å; K521-A523 PolarHBondContact O-N 3.18Å; K521-K524 PolarHBondContact O-N 2.76Å; K521-E525 WeakPolarHBondContact O-CB 3.47Å; K521-E525 PolarHBondContact O-N 2.81Å
522	K	84.5	Confident	74.6	Confident	140 Å²	140	101.1 Å²	101.1	61%	0.609	55%	0.549	S	S	*	.	H	α-helix	trans	-60.8	-41.4	177.8	-175	-174.2	176.4	-169.6	0	111.9	L518 E519 E525 L526	L518-K522 WeakPolarHBondContact O-CB 3.19Å; L518-K522 PolarHBondContact O-N 3.29Å; E519-K522 CarbonylContact O-C 3.59Å; E519-K522 PolarHBondContact O-N 3.39Å; E519-K522 VanDerWaalsContact O-N 3.09Å; K522-E525 PolarHBondContact O-N 2.8Å; K522-L526 HydrophobicContact CG-CD1 4.13Å; K522-L526 WeakPolarHBondContact O-CB 3.22Å; K522-L526 VanDerWaalsContact O-CG 3.31Å; K522-L526 WeakPolarHBondContact O-CG 3.34Å; K522-L526 PolarHBondContact O-N 3.33Å
523	A	79.5	Confident	73	Confident	55 Å²	55	99.8 Å²	99.8	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-65.4	-40.7	175.4	0	0	0	0	0	111.8	E519 K521 A527	E519-A523 WeakPolarHBondContact O-CB 3.27Å; E519-A523 PolarHBondContact O-N 3.19Å; K521-A523 PolarHBondContact O-N 3.18Å; A523-A527 WeakPolarHBondContact O-CB 3.19Å; A523-A527 PolarHBondContact O-N 2.85Å
524	K	83.5	Confident	71.3	Confident	166 Å²	166	101.7 Å²	101.7	72%	0.722	57%	0.57	S	S	*	*	H	α-helix	trans	-66.1	-36.6	173.6	-173.5	175.5	-178.8	179.3	0	112.4	K520 K521 A528	K520-K524 VanDerWaalsContact O-CB 3.29Å; K520-K524 WeakPolarHBondContact O-CB 3.39Å; K520-K524 PolarHBondContact O-N 3.46Å; K521-K524 PolarHBondContact O-N 2.76Å; K524-A528 WeakPolarHBondContact O-CB 3.33Å; K524-A528 PolarHBondContact O-N 3.12Å
525	E	75.6	Confident	69.6	Low	120 Å²	120	106 Å²	106	56%	0.561	60%	0.595	S	S	*	*	H	α-helix	trans	-68.5	-48.6	176.2	-166.1	170.5	152.8	0	0	111.2	K521 K522 A527 A528 V529	K521-E525 WeakPolarHBondContact O-CB 3.47Å; K521-E525 PolarHBondContact O-N 2.81Å; K522-E525 PolarHBondContact O-N 2.8Å; E525-A527 VanDerWaalsContact C-N 3.33Å; E525-A527 PolarHBondContact O-N 3.16Å; E525-A528 PolarHBondContact O-N 2.91Å; E525-A528 VanDerWaalsContact O-N 3.16Å; E525-V529 WeakPolarHBondContact O-CG2 3.18Å; E525-V529 PolarHBondContact O-N 2.82Å
526	L	74.5	Confident	67.6	Low	99 Å²	99	105.1 Å²	105.1	52%	0.518	61%	0.605	S	S	.	*	H	α-helix	trans	-61.4	-37.4	173.5	-72.2	171.1	0	0	0	112.6	K522 S530	K522-L526 HydrophobicContact CG-CD1 4.13Å; K522-L526 WeakPolarHBondContact O-CB 3.22Å; K522-L526 VanDerWaalsContact O-CG 3.31Å; K522-L526 WeakPolarHBondContact O-CG 3.34Å; K522-L526 PolarHBondContact O-N 3.33Å; L526-S530 VanDerWaalsContact O-CB 3.24Å; L526-S530 WeakPolarHBondContact O-CB 3.42Å; L526-S530 PolarHBondContact O-N 3.41Å; L526-S530 PolarHBondContact O-OG 2.87Å
527	A	71.7	Confident	65.8	Low	70 Å²	70	103.9 Å²	103.9	58%	0.579	61%	0.611	S	S	*	*	H	α-helix	trans	-69.1	-34.5	174.8	0	0	0	0	0	112.7	A523 E525	A523-A527 WeakPolarHBondContact O-CB 3.19Å; A523-A527 PolarHBondContact O-N 2.85Å; E525-A527 VanDerWaalsContact C-N 3.33Å; E525-A527 PolarHBondContact O-N 3.16Å
528	A	70.1	Confident	64.3	Low	73 Å²	73	101 Å²	101	60%	0.603	61%	0.609	S	S	*	*	H	α-helix	trans	-70.7	-40.9	173.7	0	0	0	0	0	112	K524 E525 G531	K524-A528 WeakPolarHBondContact O-CB 3.33Å; K524-A528 PolarHBondContact O-N 3.12Å; E525-A528 PolarHBondContact O-N 2.91Å; E525-A528 VanDerWaalsContact O-N 3.16Å; A528-G531 PolarHBondContact O-N 3.29Å
529	V	60.7	Low	63.3	Low	82 Å²	82	102.4 Å²	102.4	50%	0.497	62%	0.623	S	S	.	*	H	α-helix	trans	-76	-29	179.9	174	0	0	0	0	112.7	E525 G531 T533	E525-V529 WeakPolarHBondContact O-CG2 3.18Å; E525-V529 PolarHBondContact O-N 2.82Å; V529-G531 PolarHBondContact O-N 2.81Å; V529-T533 PolarHBondContact O-OG1 3.11Å
530	S	54.3	Low	62.7	Low	97 Å²	97	103.3 Å²	103.3	68%	0.678	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-9.3	170.4	-58.1	0	0	0	0	112.9	L526 A532	L526-S530 VanDerWaalsContact O-CB 3.24Å; L526-S530 WeakPolarHBondContact O-CB 3.42Å; L526-S530 PolarHBondContact O-N 3.41Å; L526-S530 PolarHBondContact O-OG 2.87Å; S530-A532 PolarHBondContact O-N 2.89Å
531	G	45.4	Very low	62.1	Low	53 Å²	53	99.6 Å²	99.6	55%	0.546	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	89.2	173.7	0	0	0	0	0	112.7	A528 V529	A528-G531 PolarHBondContact O-N 3.29Å; V529-G531 PolarHBondContact O-N 2.81Å
532	A	42.5	Very low	61.8	Low	107 Å²	107	99.5 Å²	99.5	88%	0.884	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.3	8.5	166.7	0	0	0	0	0	119.3	S530	S530-A532 PolarHBondContact O-N 2.89Å
533	T	42.7	Very low	61.8	Low	96 Å²	96	98.7 Å²	98.7	59%	0.589	62%	0.616	S	S	*	*			trans	-105.9	117.4	160.2	36.3	0	0	0	0	111.4	V529	V529-T533 PolarHBondContact O-OG1 3.11Å
534	V	44.1	Very low	62.2	Low	137 Å²	137	99 Å²	99	83%	0.83	61%	0.61	S	S	*	*			trans	-64	136.7	171.8	174.4	0	0	0	0	109.2	G536	V534-G536 PolarHBondContact O-N 2.85Å
535	L	43.9	Very low	62.3	Low	168 Å²	168	99.1 Å²	99.1	88%	0.88	62%	0.619	S	S	*	*	S	Bend	trans	-60.2	132.6	178.6	-60.7	164.2	0	0	0	110.6
536	G	42.3	Very low	62.8	Low	61 Å²	61	101.2 Å²	101.2	63%	0.629	63%	0.628	S	S	*	*	S	Bend	trans	95.6	40.4	166.2	0	0	0	0	0	117.7	V534 R543	V534-G536 PolarHBondContact O-N 2.85Å; G536-R543 PolarHBondContact O-NH2 3.43Å
537	A	44.2	Very low	63.3	Low	66 Å²	66	98 Å²	98	55%	0.545	62%	0.619	S	S	.	*			trans	-141.9	113.4	166.5	0	0	0	0	0	113.1
538	A	53	Low	63.9	Low	59 Å²	59	100.3 Å²	100.3	49%	0.488	62%	0.622	S	S	.	*			trans	-71.4	125.5	144.2	0	0	0	0	0	106.6	D540 A541	A538-D540 VanDerWaalsContact C-N 3.3Å; A538-D540 PolarHBondContact O-N 3.09Å; A538-A541 HydrophobicContact CB-CB 4.33Å
539	P	62.9	Low	64.5	Low	117 Å²	117	101.3 Å²	101.3	76%	0.76	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-24.5	-168.7	26.3	-34	0	0	0	113.9
540	D	69.8	Low	65.5	Low	154 Å²	154	100.3 Å²	100.3	82%	0.824	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	1.1	-171.3	-52	-57.4	0	0	0	113.9	A538	A538-D540 VanDerWaalsContact C-N 3.3Å; A538-D540 PolarHBondContact O-N 3.09Å
541	A	73.2	Confident	66.8	Low	38 Å²	38	103.7 Å²	103.7	31%	0.314	62%	0.617	S	S	.	*			trans	-79.8	132.2	179.5	0	0	0	0	0	111.5	A538 I549	A538-A541 HydrophobicContact CB-CB 4.33Å; A541-I549 HydrophobicContact CB-CG2 4.04Å
542	K	80.5	Confident	68.2	Low	132 Å²	132	107.2 Å²	107.2	57%	0.574	62%	0.62	S	S	*	*			trans	-64.9	143.1	173.5	-69.9	177.6	-177.1	170.7	0	110.3	V550 E552	K542-V550 PolarHBondContact O-N 2.88Å; K542-E552 WeakPolarHBondContact CD-OE1 3.44Å; K542-E552 WeakPolarHBondContact CE-OE1 3.42Å; K542-E552 IonicContact NZ-OE1 2.59Å; K542-E552 PolarHBondContact NZ-OE1 3.29Å
543	R	82.9	Confident	69.2	Low	123 Å²	123	107.9 Å²	107.9	46%	0.464	61%	0.608	S	S	.	*	B	Isolated β-bridge	trans	-122.1	153.6	172.2	-73.4	177.5	149.7	112.8	-3	110.6	G536 G547 D548	G536-R543 PolarHBondContact O-NH2 3.43Å; R543-G547 VanDerWaalsContact CD-O 3.27Å; R543-G547 WeakPolarHBondContact CD-O 3.43Å; R543-G547 PolarHBondContact NE-O 2.76Å; R543-D548 WeakPolarHBondContact CA-O 3.33Å; R543-D548 WeakPolarHBondContact CB-O 3.43Å; R543-D548 WeakPolarHBondContact CG-O 3.22Å
544	D	87.8	Confident	69.9	Low	60 Å²	60	111.9 Å²	111.9	32%	0.321	62%	0.62	S	S	.	*			trans	-81.8	-176.2	168.7	48.4	35	0	0	0	111.4	E546 G547 D548 V550	D544-E546 VanDerWaalsContact C-N 3.25Å; D544-E546 PolarHBondContact O-N 3.5Å; D544-E546 PolarHBondContact OD1-N 2.96Å; D544-G547 PolarHBondContact O-N 2.92Å; D544-G547 PolarHBondContact OD1-N 2.7Å; D544-D548 PolarHBondContact N-O 3.23Å; D544-D548 PolarHBondContact OD1-N 2.96Å; D544-V550 HydrophobicContact CB-CG2 3.71Å
545	D	86.6	Confident	70.4	Confident	170 Å²	170	109.1 Å²	109.1	91%	0.909	61%	0.612	S	S	*	*	S	Bend	trans	-72.6	-21	179.3	-72.9	-31.8	0	0	0	111.9
546	E	85.7	Confident	70.8	Confident	163 Å²	163	108.4 Å²	108.4	76%	0.762	60%	0.601	S	S	*	*	S	Bend	trans	-75.4	-30.3	171.2	-71.5	70.5	-160.4	0	0	112.7	D544	D544-E546 VanDerWaalsContact C-N 3.25Å; D544-E546 PolarHBondContact O-N 3.5Å; D544-E546 PolarHBondContact OD1-N 2.96Å
547	G	85.2	Confident	70.9	Confident	32 Å²	32	111.6 Å²	111.6	33%	0.33	61%	0.609	S	S	.	*			trans	104.4	5.5	176.7	0	0	0	0	0	115.2	R543 D544	R543-G547 VanDerWaalsContact CD-O 3.27Å; R543-G547 WeakPolarHBondContact CD-O 3.43Å; R543-G547 PolarHBondContact NE-O 2.76Å; D544-G547 PolarHBondContact O-N 2.92Å; D544-G547 PolarHBondContact OD1-N 2.7Å
548	D	83.8	Confident	71.1	Confident	118 Å²	118	112.7 Å²	112.7	63%	0.631	61%	0.606	S	S	*	*			trans	-79.5	159.7	174.6	-82.9	-33.2	0	0	0	111.1	R543 D544 V550	R543-D548 WeakPolarHBondContact CA-O 3.33Å; R543-D548 WeakPolarHBondContact CB-O 3.43Å; R543-D548 WeakPolarHBondContact CG-O 3.22Å; D544-D548 PolarHBondContact N-O 3.23Å; D544-D548 PolarHBondContact OD1-N 2.96Å; D548-V550 PolarHBondContact O-N 3.43Å
549	I	82.8	Confident	71	Confident	94 Å²	94	115.2 Å²	115.2	48%	0.482	62%	0.615	S	S	.	*	B	Isolated β-bridge	trans	-83.2	112.6	-175.4	-64.8	173.4	0	0	0	109.5	A541 M551	A541-I549 HydrophobicContact CB-CG2 4.04Å; I549-M551 PolarHBondContact O-N 3.09Å; I549-M551 VanDerWaalsContact O-N 3.15Å
550	V	82.2	Confident	70.5	Confident	62 Å²	62	117.6 Å²	117.6	38%	0.376	62%	0.616	S	S	.	*			trans	-75.2	104.6	176.4	-179.8	0	0	0	0	108.9	K542 D544 D548	K542-V550 PolarHBondContact O-N 2.88Å; D544-V550 HydrophobicContact CB-CG2 3.71Å; D548-V550 PolarHBondContact O-N 3.43Å
551	M	81	Confident	69.7	Low	168 Å²	168	113.7 Å²	113.7	83%	0.828	60%	0.598	S	S	*	*			trans	-70.7	131.9	160.7	-62.9	-167.6	-61.7	0	0	108.5	I549 D553	I549-M551 PolarHBondContact O-N 3.09Å; I549-M551 VanDerWaalsContact O-N 3.15Å; M551-D553 PolarHBondContact O-N 2.84Å
552	E	76.1	Confident	68.6	Low	127 Å²	127	116.6 Å²	116.6	59%	0.593	61%	0.607	S	S	*	*			trans	-77.3	125.3	175.2	-61.5	-164.7	161.1	0	0	109.8	K542 E554	K542-E552 WeakPolarHBondContact CD-OE1 3.44Å; K542-E552 WeakPolarHBondContact CE-OE1 3.42Å; K542-E552 IonicContact NZ-OE1 2.59Å; K542-E552 PolarHBondContact NZ-OE1 3.29Å; E552-E554 VanDerWaalsContact C-N 3.34Å; E552-E554 PolarHBondContact O-N 2.89Å
553	D	63.1	Low	67.3	Low	120 Å²	120	118 Å²	118	64%	0.642	61%	0.613	S	S	*	*			trans	-68.5	80.2	-177.1	-128.2	29.8	0	0	0	110.8	M551 A555 K556	M551-D553 PolarHBondContact O-N 2.84Å; D553-A555 PolarHBondContact O-N 2.96Å; D553-K556 IonicContact OD2-NZ 2.7Å; D553-K556 PolarHBondContact OD2-NZ 2.92Å
554	E	57.8	Low	65.8	Low	180 Å²	180	115.9 Å²	115.9	84%	0.841	62%	0.617	S	S	*	*			trans	-60.3	-12.9	179.8	-62.7	-166.3	154.6	0	0	113.2	E552 K556	E552-E554 VanDerWaalsContact C-N 3.34Å; E552-E554 PolarHBondContact O-N 2.89Å; E554-K556 VanDerWaalsContact C-N 3.3Å; E554-K556 PolarHBondContact O-N 3.15Å
555	A	54.1	Low	64	Low	79 Å²	79	120 Å²	120	65%	0.653	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	56.7	-178.8	0	0	0	0	0	115.3	D553	D553-A555 PolarHBondContact O-N 2.96Å
556	K	51.1	Low	62.4	Low	153 Å²	153	118.9 Å²	118.9	67%	0.665	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.1	-16.1	164.1	-88.3	105.1	-156.8	174.2	0	117.6	D553 E554	D553-K556 IonicContact OD2-NZ 2.7Å; D553-K556 PolarHBondContact OD2-NZ 2.92Å; E554-K556 VanDerWaalsContact C-N 3.3Å; E554-K556 PolarHBondContact O-N 3.15Å
557	T	45.6	Very low	60.5	Low	129 Å²	129	117.5 Å²	117.5	79%	0.791	63%	0.629	S	S	*	*	S	Bend	trans	-114.7	58.4	-163.5	50.9	0	0	0	0	116.3
558	D	47.2	Very low	58.5	Low	88 Å²	88	122.1 Å²	122.1	47%	0.471	65%	0.646	S	S	.	*			trans	-144	-6.2	164.7	-156.6	30.1	0	0	0	116.6	Q560 T561 I562	D558-Q560 PolarHBondContact O-N 2.62Å; D558-Q560 VanDerWaalsContact O-N 3.1Å; D558-T561 PolarHBondContact O-N 3.05Å; D558-T561 PolarHBondContact O-OG1 2.83Å; D558-T561 WeakPolarHBondContact OD1-CB 3.27Å; D558-T561 PolarHBondContact OD1-OG1 3.43Å; D558-I562 PolarHBondContact O-N 3.11Å
559	V	52	Low	56.4	Low	113 Å²	113	124.7 Å²	124.7	69%	0.685	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-16.7	-176.2	-176.6	0	0	0	0	113.4
560	Q	51.7	Low	54.6	Low	166 Å²	166	129.5 Å²	129.5	78%	0.776	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-29.7	175.5	-69.6	-171.9	-11.4	0	0	113.8	D558 K563 S564	D558-Q560 PolarHBondContact O-N 2.62Å; D558-Q560 VanDerWaalsContact O-N 3.1Å; Q560-K563 PolarHBondContact O-N 2.77Å; Q560-S564 PolarHBondContact O-N 2.68Å; Q560-S564 PolarHBondContact O-OG 2.93Å
561	T	53.4	Low	52.7	Low	72 Å²	72	135.9 Å²	135.9	44%	0.442	71%	0.706	S	S	.	*	H	α-helix	trans	-64.5	-49.2	178.2	-23.7	0	0	0	0	110.4	D558 K563 S564 L565	D558-T561 PolarHBondContact O-N 3.05Å; D558-T561 PolarHBondContact O-OG1 2.83Å; D558-T561 WeakPolarHBondContact OD1-CB 3.27Å; D558-T561 PolarHBondContact OD1-OG1 3.43Å; T561-K563 VanDerWaalsContact C-N 3.29Å; T561-K563 PolarHBondContact O-N 2.92Å; T561-S564 WeakPolarHBondContact O-CB 3.45Å; T561-S564 PolarHBondContact O-N 3.39Å; T561-L565 PolarHBondContact O-N 3.29Å
562	I	51.2	Low	50.8	Low	99 Å²	99	136.3 Å²	136.3	51%	0.508	71%	0.711	S	S	.	*	H	α-helix	trans	-61.8	-36.1	-178.1	-57.9	176.4	0	0	0	111.5	D558 S564	D558-I562 PolarHBondContact O-N 3.11Å; I562-S564 VanDerWaalsContact C-N 3.31Å; I562-S564 PolarHBondContact O-N 3.33Å
563	K	52.4	Low	49.1	Very low	163 Å²	163	137.6 Å²	137.6	71%	0.709	72%	0.722	S	S	*	*	H	α-helix	trans	-70.2	-24.3	174.4	-82.3	-168.6	171.9	-173.6	0	114.1	Q560 T561	Q560-K563 PolarHBondContact O-N 2.77Å; T561-K563 VanDerWaalsContact C-N 3.29Å; T561-K563 PolarHBondContact O-N 2.92Å
564	S	51.6	Low	48.2	Very low	77 Å²	77	135.3 Å²	135.3	54%	0.538	73%	0.727	S	S	.	*	H	α-helix	trans	-82.4	-26.4	-178.5	-55.7	0	0	0	0	112.7	Q560 T561 I562 N568	Q560-S564 PolarHBondContact O-N 2.68Å; Q560-S564 PolarHBondContact O-OG 2.93Å; T561-S564 WeakPolarHBondContact O-CB 3.45Å; T561-S564 PolarHBondContact O-N 3.39Å; I562-S564 VanDerWaalsContact C-N 3.31Å; I562-S564 PolarHBondContact O-N 3.33Å; S564-N568 PolarHBondContact O-ND2 2.94Å
565	L	49.7	Very low	47.2	Very low	148 Å²	148	133.1 Å²	133.1	78%	0.775	72%	0.721	S	S	*	*	H	α-helix	trans	-79.7	-19.2	178.7	-71	168.6	0	0	0	113.9	T561	T561-L565 PolarHBondContact O-N 3.29Å
566	L	52.2	Low	46.8	Very low	145 Å²	145	135.8 Å²	135.8	76%	0.759	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-0.5	-173.3	-104.1	165.5	0	0	0	115.2
567	N	46.2	Very low	46.4	Very low	134 Å²	134	135.2 Å²	135.2	72%	0.717	73%	0.726	S	S	*	*	S	Bend	trans	-129.3	17.3	-161.7	-147.9	103.7	0	0	0	115
568	N	43.7	Very low	46.2	Very low	129 Å²	129	136.3 Å²	136.3	69%	0.69	72%	0.722	S	S	*	*			trans	-140.7	77.6	-177.5	-63.7	-68.5	0	0	0	111.5	S564	S564-N568 PolarHBondContact O-ND2 2.94Å
569	N	40	Very low	45.8	Very low	172 Å²	172	139.8 Å²	139.8	92%	0.92	74%	0.736	S	S	*	*			trans	-168.5	65.1	166.9	-99.1	-26.2	0	0	0	111.3
570	E	44.2	Very low	45.1	Very low	196 Å²	196	141.8 Å²	141.8	92%	0.916	74%	0.738	S	S	*	*			trans	-133.5	172.8	162	-72.9	-167.7	123.4	0	0	108.5
571	E	42.1	Very low	44.2	Very low	196 Å²	196	139.2 Å²	139.2	92%	0.916	74%	0.738	S	S	*	*			trans	72.2	82.9	-177.4	-162.1	170	-139.3	0	0	116
572	L	41.7	Very low	43.8	Very low	176 Å²	176	141 Å²	141	92%	0.921	75%	0.751	S	S	*	*			trans	-143	128.8	137.7	-119.6	172.3	0	0	0	111
573	D	40	Very low	43	Very low	154 Å²	154	145.3 Å²	145.3	82%	0.824	77%	0.766	S	S	*	*			trans	-60	155.6	-164.2	-153.6	-13.5	0	0	0	116
574	G	43.4	Very low	42.1	Very low	72 Å²	72	144 Å²	144	74%	0.742	77%	0.767	S	S	*	*			trans	179.9	53.1	-172	0	0	0	0	0	116.9	V576	G574-V576 PolarHBondContact O-N 2.89Å
575	D	38.1	Very low	41.5	Very low	134 Å²	134	148.7 Å²	148.7	72%	0.717	78%	0.784	S	S	*	*			trans	-57.9	110	-178.1	175.1	25.5	0	0	0	115.8
576	V	45.1	Very low	41.1	Very low	136 Å²	136	146.1 Å²	146.1	82%	0.824	78%	0.779	S	S	*	*			trans	-143.3	95.1	151.7	-171.9	0	0	0	0	112.1	G574	G574-V576 PolarHBondContact O-N 2.89Å
577	K	42.9	Very low	40.4	Very low	140 Å²	140	144 Å²	144	61%	0.609	78%	0.776	S	S	*	*			trans	7.7	136.5	144.2	-68	174.5	155.4	-82.4	0	121.9
578	E	41.8	Very low	39.8	Very low	152 Å²	152	144.9 Å²	144.9	71%	0.71	78%	0.781	S	S	*	*				58.3	139.1	129.5	-60.8	157.3	-136.7	0	0	119.2
579	Q	37.3	Very low	40	Very low	162 Å²	162	143.8 Å²	143.8	76%	0.757	78%	0.78	S	S	*	*			cis	-157.7	166.2	10.6	-151.6	-178.7	-23.5	0	0	112.9
580	E	37.5	Very low	39.8	Very low	154 Å²	154	142.1 Å²	142.1	72%	0.72	78%	0.776	S	S	*	*			trans	-16.5	128.6	170.4	-66.8	166.1	101.4	0	0	123.7
581	S	33.9	Very low	39.8	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	77%	0.769	S	S	*	*				72.9	142.5	114.2	-148.3	0	0	0	0	122.9
582	P	44.8	Very low	39.4	Very low	108 Å²	108	134.3 Å²	134.3	70%	0.701	77%	0.765	S	S	*	*			trans	-114.1	172.9	-170.7	43.4	-35.3	0	0	0	116.2
583	F	35.3	Very low	39.3	Very low	191 Å²	191	133 Å²	133	84%	0.838	76%	0.758	S	S	*	*			trans	-159.2	139.5	155.9	-103.7	-68.9	0	0	0	115.6
584	D	33.1	Very low	39.2	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	76%	0.759	S	S	*	*			trans	14.4	144.9	157	-61	-9.7	0	0	0	125.7
585	I	39.3	Very low	38.6	Very low	174 Å²	174	134.7 Å²	134.7	89%	0.892	75%	0.75	S	S	*	*			trans	168.5	152.3	135.1	-89.9	154	0	0	0	109.4
586	S	39.5	Very low	38.6	Very low	95 Å²	95	134 Å²	134	66%	0.664	75%	0.754	S	S	*	*			cis	179.8	142	-48	174.4	0	0	0	0	109.3
587	S	37.4	Very low	38	Very low	101 Å²	101	135.7 Å²	135.7	71%	0.706	75%	0.75	S	S	*	*			trans	69.9	132.4	166.5	-56.6	0	0	0	0	118
588	N	34.3	Very low	37.4	Very low	152 Å²	152	134.1 Å²	134.1	81%	0.813	76%	0.757	S	S	*	*			cis	89.7	151.3	43.1	-80	-19.5	0	0	0	114.6
589	P	47.5	Very low	37	Very low	105 Å²	105	132.6 Å²	132.6	68%	0.682	76%	0.763	S	S	*	*			cis	-148.2	-170.4	-39.4	44	-26.1	0	0	0	114.9
590	V	37.5	Very low	36.7	Very low	137 Å²	137	135.6 Å²	135.6	83%	0.83	77%	0.767	S	S	*	*			trans	71.6	132.1	157.3	176.1	0	0	0	0	120
591	G	42.3	Very low	36.4	Very low	75 Å²	75	133.2 Å²	133.2	77%	0.773	77%	0.768	S	S	*	*			trans	-178.7	97.9	163.5	0	0	0	0	0	112.1
592	D	34	Very low	36.3	Very low	154 Å²	154	136.1 Å²	136.1	82%	0.824	77%	0.769	S	S	*	*			trans	-74	147.4	-179.8	-74.5	-64.1	0	0	0	113.6
593	L	40.4	Very low	35.5	Very low	147 Å²	147	135.5 Å²	135.5	77%	0.77	77%	0.765	S	S	*	*			trans	-166	104.1	139.8	-108.1	171.8	0	0	0	113.7
594	Q	38.4	Very low	35.7	Very low	181 Å²	181	133 Å²	133	85%	0.846	77%	0.768	S	S	*	*			trans	54.3	118.5	146.1	-69.4	170.5	1	0	0	122
595	S	29.3	Very low	35.7	Very low	81 Å²	81	131 Å²	131	57%	0.566	76%	0.76	S	S	*	*			trans	-78.3	166.6	168	60.7	0	0	0	0	114.1	F597	S595-F597 WeakPolarHBondContact OG-CD2 3.42Å; S595-F597 WeakPolarHBondContact OG-CE2 3.46Å
596	P	38.3	Very low	35.4	Very low	121 Å²	121	129.9 Å²	129.9	79%	0.786	75%	0.752	S	S	*	*				-129.6	127.5	86.6	36.9	-29.1	0	0	0	112.4
597	F	32.8	Very low	35.1	Very low	171 Å²	171	133.6 Å²	133.6	75%	0.75	76%	0.763	S	S	*	*				41.8	100.3	82.8	-69.7	-64.5	0	0	0	113.8	S595	S595-F597 WeakPolarHBondContact OG-CD2 3.42Å; S595-F597 WeakPolarHBondContact OG-CE2 3.46Å
598	S	30.3	Very low	35	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	76%	0.764	S	S	*	*				72.8	95.1	78.9	-60.7	0	0	0	0	115.2
599	S	34.4	Very low	35	Very low	120 Å²	120	136.9 Å²	136.9	84%	0.839	76%	0.762	S	S	*	*			trans	-151.7	127.1	144.6	-74.7	0	0	0	0	106.2
600	R	30.4	Very low	34.4	Very low	224 Å²	224	139 Å²	139	85%	0.845	77%	0.766	S	S	*	*			cis	73.9	113.2	43.4	-168.7	-172.3	174.9	168.1	1.1	112.4
601	S	31.3	Very low	34.1	Very low	105 Å²	105	137 Å²	137	73%	0.734	76%	0.759	S	S	*	*			trans	60.1	139	171.4	45.4	0	0	0	0	115.2
602	Q	30.9	Very low	33.7	Very low	173 Å²	173	138.8 Å²	138.8	81%	0.808	75%	0.75	S	S	*	*			cis	-142.4	166.3	28.4	-68.3	166.6	-128.9	0	0	112.2
603	P	28.1	Very low	33.9	Very low	96 Å²	96	137 Å²	137	62%	0.623	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-73.2	156	153.9	34.5	-34.8	0	0	0	111	T605	P603-T605 PolarHBondContact O-N 2.85Å
604	P	40.9	Very low	33.9	Very low	138 Å²	138	135.4 Å²	135.4	90%	0.896	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-73.3	118.3	162.8	30.5	-31	0	0	0	109.5
605	T	33	Very low	34	Very low	93 Å²	93	130.4 Å²	130.4	57%	0.571	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-103.2	149.2	-178.4	-69.4	0	0	0	0	110.4	P603	P603-T605 PolarHBondContact O-N 2.85Å
606	E	32.4	Very low	34.2	Very low	152 Å²	152	129.5 Å²	129.5	71%	0.71	72%	0.715	S	S	*	*			trans	59.5	89.6	163.1	-76.2	145.6	-147.1	0	0	118.7
607	L	34.3	Very low	34.1	Very low	172 Å²	172	128.5 Å²	128.5	90%	0.901	71%	0.706	S	S	*	*				-132.2	118.5	118.7	-83.8	171.3	0	0	0	104
608	E	35.4	Very low	34.5	Very low	155 Å²	155	125.7 Å²	125.7	72%	0.724	69%	0.694	S	S	*	*			cis	47.4	116.3	38.7	-65.8	-158.3	153.8	0	0	111.9
609	E	33.6	Very low	34.8	Very low	167 Å²	167	126.5 Å²	126.5	78%	0.78	69%	0.686	S	S	*	*			cis	-149.8	157.9	14.6	-166.4	-179.6	174.4	0	0	111.5
610	I	33.6	Very low	34.8	Very low	149 Å²	149	127.1 Å²	127.1	76%	0.764	68%	0.679	S	S	*	*			trans	-13.1	119.3	166.5	-53.7	159.2	0	0	0	116.6
611	S	32.9	Very low	35.1	Very low	96 Å²	96	120.1 Å²	120.1	67%	0.671	66%	0.662	S	S	*	*				175.9	145.6	128.3	43.3	0	0	0	0	116.2
612	N	33	Very low	35.6	Very low	112 Å²	112	119 Å²	119	60%	0.599	65%	0.65	S	S	*	*			trans	52	127.4	158.2	-63.6	4.6	0	0	0	121.6	E614	N612-E614 PolarHBondContact O-N 2.74Å
613	P	38	Very low	35.9	Very low	117 Å²	117	116.2 Å²	116.2	76%	0.76	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-11.7	175	30.8	-35.8	0	0	0	114.5	T615 A616	P613-T615 PolarHBondContact O-N 3.27Å; P613-T615 VanDerWaalsContact O-N 3.14Å; P613-A616 PolarHBondContact O-N 3.49Å
614	E	39.7	Very low	36.3	Very low	114 Å²	114	116.4 Å²	116.4	53%	0.533	65%	0.645	S	S	.	*	H	α-helix	trans	-55.1	-28.9	177.2	-115.2	-160.7	94.7	0	0	114	N612 K618	N612-E614 PolarHBondContact O-N 2.74Å; E614-K618 IonicContact OE1-NZ 2.65Å; E614-K618 PolarHBondContact OE1-NZ 2.81Å
615	T	40.8	Very low	36.4	Very low	75 Å²	75	112.5 Å²	112.5	46%	0.46	62%	0.621	S	S	.	*	H	α-helix	trans	-75.6	-30.8	-173	-45.5	0	0	0	0	112.1	P613 K618 Q619	P613-T615 PolarHBondContact O-N 3.27Å; P613-T615 VanDerWaalsContact O-N 3.14Å; T615-K618 PolarHBondContact O-N 3.1Å; T615-Q619 PolarHBondContact O-N 3.39Å
616	A	33.3	Very low	37	Very low	62 Å²	62	116.1 Å²	116.1	51%	0.512	63%	0.631	S	S	.	*	H	α-helix	trans	-66.5	-40.1	-179.9	0	0	0	0	0	112.3	P613 K618 Q619 L620	P613-A616 PolarHBondContact O-N 3.49Å; A616-K618 PolarHBondContact O-N 2.71Å; A616-Q619 PolarHBondContact O-N 2.93Å; A616-L620 PolarHBondContact O-N 3.24Å
617	V	37.9	Very low	37.3	Very low	100 Å²	100	111.5 Å²	111.5	61%	0.606	62%	0.615	S	S	*	*	H	α-helix	trans	-61.7	-32.4	177.1	-174.1	0	0	0	0	111.5	T621	V617-T621 PolarHBondContact O-N 3.08Å; V617-T621 PolarHBondContact O-OG1 3.34Å
618	K	39.9	Very low	37.9	Very low	112 Å²	112	107.1 Å²	107.1	49%	0.487	59%	0.592	S	S	.	*	H	α-helix	trans	-76.7	-18.5	177.7	-64	167.1	-169.8	165.4	0	113.1	E614 T615 A616 T621 T622	E614-K618 IonicContact OE1-NZ 2.65Å; E614-K618 PolarHBondContact OE1-NZ 2.81Å; T615-K618 PolarHBondContact O-N 3.1Å; A616-K618 PolarHBondContact O-N 2.71Å; K618-T621 PolarHBondContact O-OG1 3.09Å; K618-T622 PolarHBondContact O-OG1 2.77Å
619	Q	36.6	Very low	38.3	Very low	124 Å²	124	101.5 Å²	101.5	58%	0.579	57%	0.567	S	S	*	*	H	α-helix	trans	-93.8	-31.3	174.3	-67.6	-163.6	1.7	0	0	113.7	T615 A616 T621 T622 N623	T615-Q619 PolarHBondContact O-N 3.39Å; A616-Q619 PolarHBondContact O-N 2.93Å; Q619-T621 VanDerWaalsContact C-N 3.34Å; Q619-T622 WeakPolarHBondContact CA-OG1 3.34Å; Q619-T622 PolarHBondContact O-OG1 3.43Å; Q619-T622 VanDerWaalsContact O-OG1 3.06Å; Q619-N623 PolarHBondContact O-N 2.85Å
620	L	34.9	Very low	38.5	Very low	134 Å²	134	97.6 Å²	97.6	70%	0.702	56%	0.556	S	S	*	*	H	α-helix	trans	-62.7	-41.7	172.1	-113.2	70.5	0	0	0	111.8	A616 S624	A616-L620 PolarHBondContact O-N 3.24Å; L620-S624 WeakPolarHBondContact O-CB 3.43Å; L620-S624 PolarHBondContact O-N 3.42Å; L620-S624 VanDerWaalsContact O-N 3.17Å
621	T	37.4	Very low	38.7	Very low	77 Å²	77	98.3 Å²	98.3	47%	0.472	56%	0.561	S	S	.	*	H	α-helix	trans	-68.6	-35	-179.8	41.4	0	0	0	0	113.4	V617 K618 Q619 S625	V617-T621 PolarHBondContact O-N 3.08Å; V617-T621 PolarHBondContact O-OG1 3.34Å; K618-T621 PolarHBondContact O-OG1 3.09Å; Q619-T621 VanDerWaalsContact C-N 3.34Å; T621-S625 PolarHBondContact O-OG 3.39Å
622	T	41	Very low	39.1	Very low	81 Å²	81	97.9 Å²	97.9	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-73.2	-41.6	176.1	47.9	0	0	0	0	113	K618 Q619 S625	K618-T622 PolarHBondContact O-OG1 2.77Å; Q619-T622 WeakPolarHBondContact CA-OG1 3.34Å; Q619-T622 PolarHBondContact O-OG1 3.43Å; Q619-T622 VanDerWaalsContact O-OG1 3.06Å; T622-S625 PolarHBondContact O-N 2.72Å
623	N	37.3	Very low	38.9	Very low	114 Å²	114	96.7 Å²	96.7	61%	0.61	55%	0.549	S	S	*	.	H	α-helix	trans	-75.7	-30.6	-176.4	-69.2	-13.3	0	0	0	112.7	Q619 S625	Q619-N623 PolarHBondContact O-N 2.85Å; N623-S625 PolarHBondContact O-N 2.79Å
624	S	37.7	Very low	38.9	Very low	101 Å²	101	96.8 Å²	96.8	71%	0.706	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-2.3	174.8	-168.7	0	0	0	0	114.3	L620 Q626	L620-S624 WeakPolarHBondContact O-CB 3.43Å; L620-S624 PolarHBondContact O-N 3.42Å; L620-S624 VanDerWaalsContact O-N 3.17Å; S624-Q626 VanDerWaalsContact C-N 3.34Å
625	S	42.6	Very low	38.6	Very low	56 Å²	56	96.1 Å²	96.1	39%	0.392	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	0.5	-178.5	-66.4	0	0	0	0	114.3	T621 T622 N623 S627	T621-S625 PolarHBondContact O-OG 3.39Å; T622-S625 PolarHBondContact O-N 2.72Å; N623-S625 PolarHBondContact O-N 2.79Å; S625-S627 PolarHBondContact O-N 3.45Å
626	Q	45.6	Very low	38.2	Very low	169 Å²	169	97.5 Å²	97.5	79%	0.79	57%	0.572	S	S	*	*			trans	-95.7	66.8	-176.7	-62.5	-172.9	14.8	0	0	113.3	S624	S624-Q626 VanDerWaalsContact C-N 3.34Å
627	S	37.6	Very low	38.2	Very low	54 Å²	54	99 Å²	99	38%	0.378	57%	0.574	S	S	.	*			trans	-159	78.4	156.4	47	0	0	0	0	111.1	S625 R665	S625-S627 PolarHBondContact O-N 3.45Å; S627-R665 PolarHBondContact O-NH1 3.08Å; S627-R665 PolarHBondContact OG-NH1 2.89Å; S627-R665 VanDerWaalsContact OG-NH1 3.12Å
628	I	48	Very low	38.4	Very low	80 Å²	80	100.3 Å²	100.3	41%	0.41	59%	0.585	S	S	.	*	S	Bend	trans	-126.8	106	156.3	-58.8	177.2	0	0	0	104.2	I632	I628-I632 WeakPolarHBondContact O-CD1 3.5Å
629	L	42.8	Very low	38.4	Very low	37 Å²	37	100.4 Å²	100.4	19%	0.194	60%	0.595	C	S	.	*	S	Bend	trans	67.6	134.7	-169.7	-54.5	144.4	0	0	0	115.1	I632 L650 L654	L629-I632 HydrophobicContact CB-CD1 4.43Å; L629-I632 HydrophobicContact CB-CG1 4.19Å; L629-I632 HydrophobicContact CD1-CD1 4.3Å; L629-L650 HydrophobicContact CD1-CB 4.07Å; L629-L650 HydrophobicContact CD1-CD1 3.92Å; L629-L650 HydrophobicContact CD1-CD2 3.95Å; L629-L650 HydrophobicContact CD1-CG 4.2Å; L629-L650 HydrophobicContact CD2-CB 4.12Å; L629-L650 HydrophobicContact CD2-CD2 4.24Å; L629-L654 HydrophobicContact CD2-CD2 3.94Å; L629-L654 HydrophobicContact CD2-CG 4.17Å
630	P	37.9	Very low	38.9	Very low	86 Å²	86	99.9 Å²	99.9	56%	0.558	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	147.4	163	31.6	-32.5	0	0	0	110.6	I632	P630-I632 PolarHBondContact O-N 3.37Å
631	N	38.2	Very low	39.7	Very low	163 Å²	163	98.6 Å²	98.6	87%	0.872	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.5	44.3	173.6	-64.8	-19	0	0	0	116.7	P633	N631-P633 WeakPolarHBondContact O-CD 3.08Å
632	I	40.4	Very low	41.1	Very low	87 Å²	87	98 Å²	98	45%	0.446	58%	0.579	S	S	.	*			trans	-64.3	124.2	152.7	-57.7	-177.2	0	0	0	107.7	I628 L629 P630 L636	I628-I632 WeakPolarHBondContact O-CD1 3.5Å; L629-I632 HydrophobicContact CB-CD1 4.43Å; L629-I632 HydrophobicContact CB-CG1 4.19Å; L629-I632 HydrophobicContact CD1-CD1 4.3Å; P630-I632 PolarHBondContact O-N 3.37Å; I632-L636 HydrophobicContact CG2-CB 3.97Å; I632-L636 HydrophobicContact CG2-CD1 3.66Å; I632-L636 HydrophobicContact CG2-CG 4.42Å
633	P	30.7	Very low	42.8	Very low	88 Å²	88	96.7 Å²	96.7	57%	0.571	57%	0.574	S	S	*	*			trans	-65.8	147.4	178.2	27.2	-34.2	0	0	0	111	N631 S635 L636	N631-P633 WeakPolarHBondContact O-CD 3.08Å; P633-S635 PolarHBondContact O-N 3.36Å; P633-L636 PolarHBondContact O-N 3.41Å
634	A	36.3	Very low	44.3	Very low	119 Å²	119	95.5 Å²	95.5	98%	0.983	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	25.2	-168.3	0	0	0	0	0	116.4
635	S	33.1	Very low	46.2	Very low	100 Å²	100	95.8 Å²	95.8	70%	0.699	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-8.4	176.2	62	0	0	0	0	114.2	P633	P633-S635 PolarHBondContact O-N 3.36Å
636	L	34.4	Very low	47.9	Very low	104 Å²	104	96.7 Å²	96.7	55%	0.545	56%	0.555	S	S	.	*			trans	-90.1	110.1	175.7	-82.4	162.9	0	0	0	110.2	I632 P633 H640	I632-L636 HydrophobicContact CG2-CB 3.97Å; I632-L636 HydrophobicContact CG2-CD1 3.66Å; I632-L636 HydrophobicContact CG2-CG 4.42Å; P633-L636 PolarHBondContact O-N 3.41Å; L636-H640 HydrophobicContact CD2-CB 4.29Å
637	T	33	Very low	49.7	Very low	92 Å²	92	89.9 Å²	89.9	56%	0.564	52%	0.523	S	S	*	.			trans	-72.9	158.3	178.6	48.7	0	0	0	0	111.6	T639	T637-T639 PolarHBondContact O-N 2.92Å; T637-T639 PolarHBondContact OG1-OG1 2.81Å; T637-T639 VanDerWaalsContact OG1-OG1 3.1Å
638	P	40.7	Very low	51.6	Low	129 Å²	129	91.6 Å²	91.6	84%	0.838	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	21.5	-175.1	-21.5	34.9	0	0	0	116.6
639	T	41.2	Very low	53.4	Low	113 Å²	113	93.1 Å²	93.1	69%	0.693	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-7.4	-171.2	50.8	0	0	0	0	113.5	T637 L641	T637-T639 PolarHBondContact O-N 2.92Å; T637-T639 PolarHBondContact OG1-OG1 2.81Å; T637-T639 VanDerWaalsContact OG1-OG1 3.1Å; T639-L641 PolarHBondContact O-N 2.91Å
640	H	46.7	Very low	55.3	Low	114 Å²	114	94 Å²	94	53%	0.528	53%	0.531	S	S	.	.			trans	-86.2	89.5	-179.9	-157.6	-73	0	0	0	110.9	L636 L642	L636-H640 HydrophobicContact CD2-CB 4.29Å; H640-L642 PolarHBondContact O-N 3.3Å; H640-L642 VanDerWaalsContact O-N 3.15Å
641	L	50.5	Low	57.6	Low	106 Å²	106	91.2 Å²	91.2	56%	0.555	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58.6	116.5	169.3	-67.5	174.9	0	0	0	109.1	A482 T484 T639 S643	A482-L641 WeakPolarHBondContact O-CD2 3.2Å; T484-L641 HydrophobicContact CG2-CD2 3.82Å; T639-L641 PolarHBondContact O-N 2.91Å; L641-S643 PolarHBondContact O-N 3.3Å
642	L	68.7	Low	59.9	Low	65 Å²	65	88.3 Å²	88.3	34%	0.34	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-64.5	131.9	168.7	-69.2	170.1	0	0	0	108.6	H640 E646 F647 L650	H640-L642 PolarHBondContact O-N 3.3Å; H640-L642 VanDerWaalsContact O-N 3.15Å; L642-E646 HydrophobicContact CB-CB 4.47Å; L642-E646 HydrophobicContact CD2-CB 4.1Å; L642-F647 HydrophobicContact CB-CB 4.46Å; L642-L650 HydrophobicContact CD1-CD1 3.78Å; L642-L650 HydrophobicContact CD2-CD1 3.72Å; L642-L650 HydrophobicContact CG-CD1 4.4Å
643	S	76.7	Confident	61.9	Low	54 Å²	54	88.2 Å²	88.2	38%	0.378	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-65.4	157.4	169.7	68.5	0	0	0	0	110.7	L641 Q645 E646 F647	L641-S643 PolarHBondContact O-N 3.3Å; S643-Q645 PolarHBondContact O-N 2.97Å; S643-Q645 VanDerWaalsContact O-N 3.09Å; S643-E646 WeakPolarHBondContact CB-OE2 3.37Å; S643-E646 PolarHBondContact N-OE2 3.15Å; S643-E646 PolarHBondContact O-N 3.45Å; S643-E646 VanDerWaalsContact O-N 3.1Å; S643-E646 VanDerWaalsContact OG-CD 3.31Å; S643-E646 WeakPolarHBondContact OG-CG 3.48Å; S643-E646 PolarHBondContact OG-N 3.44Å; S643-E646 PolarHBondContact OG-OE2 3.45Å; S643-F647 PolarHBondContact O-N 3.43Å
644	L	68	Low	64.5	Low	88 Å²	88	85 Å²	85	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-53.3	-31	177.3	-178.5	153.5	0	0	0	112.7	E478 R648	E478-L644 HydrophobicContact CB-CD1 4.49Å; E478-L644 HydrophobicContact CG-CD1 3.99Å; E478-L644 HydrophobicContact CG-CG 4.09Å; E478-L644 WeakPolarHBondContact OE1-CD1 3.35Å; E478-L644 WeakPolarHBondContact OE1-CG 3.4Å; L644-R648 WeakPolarHBondContact O-CD 3.37Å; L644-R648 WeakPolarHBondContact O-CG 3.29Å; L644-R648 PolarHBondContact O-N 2.94Å
645	Q	76.6	Confident	67	Low	107 Å²	107	82.1 Å²	82.1	50%	0.5	46%	0.456	S	S	.	.	H	α-helix	trans	-76.3	-50.1	175.7	-174.3	62.3	23.4	0	0	112	S643 F647 R648 E649	S643-Q645 PolarHBondContact O-N 2.97Å; S643-Q645 VanDerWaalsContact O-N 3.09Å; Q645-F647 VanDerWaalsContact C-N 3.29Å; Q645-F647 PolarHBondContact O-N 3.18Å; Q645-R648 PolarHBondContact O-N 2.71Å; Q645-R648 VanDerWaalsContact O-N 3.12Å; Q645-E649 WeakPolarHBondContact CG-OE1 3.49Å; Q645-E649 PolarHBondContact NE2-OE1 3.38Å; Q645-E649 PolarHBondContact O-N 2.88Å
646	E	79.9	Confident	69.4	Low	75 Å²	75	81.4 Å²	81.4	35%	0.35	45%	0.445	S	S	.	.	H	α-helix	trans	-58.9	-41.4	177.8	-69.1	160.8	123.8	0	0	111.2	L642 S643 R648 E649 L650	L642-E646 HydrophobicContact CB-CB 4.47Å; L642-E646 HydrophobicContact CD2-CB 4.1Å; S643-E646 WeakPolarHBondContact CB-OE2 3.37Å; S643-E646 PolarHBondContact N-OE2 3.15Å; S643-E646 PolarHBondContact O-N 3.45Å; S643-E646 VanDerWaalsContact O-N 3.1Å; S643-E646 VanDerWaalsContact OG-CD 3.31Å; S643-E646 WeakPolarHBondContact OG-CG 3.48Å; S643-E646 PolarHBondContact OG-N 3.44Å; S643-E646 PolarHBondContact OG-OE2 3.45Å; E646-R648 PolarHBondContact O-N 3.06Å; E646-E649 PolarHBondContact O-N 2.8Å; E646-L650 VanDerWaalsContact O-CB 3.28Å; E646-L650 WeakPolarHBondContact O-CB 3.34Å; E646-L650 WeakPolarHBondContact O-CD1 3.29Å; E646-L650 WeakPolarHBondContact O-CG 3.26Å; E646-L650 PolarHBondContact O-N 3.47Å
647	F	81.6	Confident	71.9	Confident	26 Å²	26	81.8 Å²	81.8	11%	0.114	44%	0.444	C	S	.	.	H	α-helix	trans	-61.7	-43.7	175.4	179.9	-88.9	0	0	0	112.2	F477 A481 L642 S643 Q645 L650 F651	F477-F647 AromaticContact CD1-CE1 3.56Å; F477-F647 HydrophobicContact CD1-CE1 3.56Å; F477-F647 AromaticContact CD1-CZ 3.86Å; F477-F647 HydrophobicContact CD1-CZ 3.86Å; F477-F647 AromaticContact CE1-CE1 3.51Å; F477-F647 HydrophobicContact CE1-CE1 3.51Å; F477-F647 AromaticContact CE1-CZ 3.5Å; F477-F647 HydrophobicContact CE1-CZ 3.5Å; F477-F647 HydrophobicContact CZ-CZ 4.36Å; A481-F647 HydrophobicContact CB-CD2 4.19Å; A481-F647 HydrophobicContact CB-CE2 3.99Å; A481-F647 HydrophobicContact CB-CZ 4.32Å; L642-F647 HydrophobicContact CB-CB 4.46Å; S643-F647 PolarHBondContact O-N 3.43Å; Q645-F647 VanDerWaalsContact C-N 3.29Å; Q645-F647 PolarHBondContact O-N 3.18Å; F647-L650 PolarHBondContact O-N 3.45Å; F647-F651 HydrophobicContact CE1-CB 4.12Å; F647-F651 HydrophobicContact CE1-CD2 4.29Å; F647-F651 HydrophobicContact CE1-CG 4.37Å; F647-F651 HydrophobicContact CZ-CB 4.34Å; F647-F651 AromaticContact CZ-CD2 3.95Å; F647-F651 HydrophobicContact CZ-CD2 3.95Å; F647-F651 HydrophobicContact CZ-CG 4.44Å; F647-F651 WeakPolarHBondContact O-CB 3.28Å; F647-F651 PolarHBondContact O-N 3.22Å
648	R	79.3	Confident	74.4	Confident	90 Å²	90	80.9 Å²	80.9	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-65.3	-38.8	177.6	-75.3	170.9	177	-142.5	3.5	112	E478 L644 Q645 E646 T652	E478-R648 IonicContact OE1-CZ 3.49Å; E478-R648 VanDerWaalsContact OE1-CZ 3.25Å; E478-R648 IonicContact OE1-NE 3.56Å; E478-R648 PolarHBondContact OE1-NE 2.65Å; E478-R648 IonicContact OE1-NH2 2.71Å; E478-R648 PolarHBondContact OE1-NH2 3.11Å; L644-R648 WeakPolarHBondContact O-CD 3.37Å; L644-R648 WeakPolarHBondContact O-CG 3.29Å; L644-R648 PolarHBondContact O-N 2.94Å; Q645-R648 PolarHBondContact O-N 2.71Å; Q645-R648 VanDerWaalsContact O-N 3.12Å; E646-R648 PolarHBondContact O-N 3.06Å; R648-T652 WeakPolarHBondContact O-CB 3.31Å; R648-T652 WeakPolarHBondContact O-CG2 3.33Å; R648-T652 PolarHBondContact O-N 3.49Å; R648-T652 PolarHBondContact O-OG1 3.5Å
649	E	84	Confident	76.7	Confident	112 Å²	112	77.2 Å²	77.2	52%	0.523	41%	0.405	S	S	.	.	H	α-helix	trans	-67.7	-45	176	-72.5	175.6	-166.5	0	0	111.5	Q645 E646 T652 S653	Q645-E649 WeakPolarHBondContact CG-OE1 3.49Å; Q645-E649 PolarHBondContact NE2-OE1 3.38Å; Q645-E649 PolarHBondContact O-N 2.88Å; E646-E649 PolarHBondContact O-N 2.8Å; E649-T652 PolarHBondContact O-N 3.29Å; E649-T652 PolarHBondContact O-OG1 2.83Å; E649-S653 WeakPolarHBondContact O-CB 3.47Å; E649-S653 PolarHBondContact O-N 3.5Å
650	L	83.9	Confident	78.7	Confident	57 Å²	57	78.1 Å²	78.1	30%	0.298	40%	0.396	S	S	.	.	H	α-helix	trans	-64.8	-45.2	176.9	-72.4	164.1	0	0	0	111.7	L629 L642 E646 F647 T652 S653 L654	L629-L650 HydrophobicContact CD1-CB 4.07Å; L629-L650 HydrophobicContact CD1-CD1 3.92Å; L629-L650 HydrophobicContact CD1-CD2 3.95Å; L629-L650 HydrophobicContact CD1-CG 4.2Å; L629-L650 HydrophobicContact CD2-CB 4.12Å; L629-L650 HydrophobicContact CD2-CD2 4.24Å; L642-L650 HydrophobicContact CD1-CD1 3.78Å; L642-L650 HydrophobicContact CD2-CD1 3.72Å; L642-L650 HydrophobicContact CG-CD1 4.4Å; E646-L650 VanDerWaalsContact O-CB 3.28Å; E646-L650 WeakPolarHBondContact O-CB 3.34Å; E646-L650 WeakPolarHBondContact O-CD1 3.29Å; E646-L650 WeakPolarHBondContact O-CG 3.26Å; E646-L650 PolarHBondContact O-N 3.47Å; F647-L650 PolarHBondContact O-N 3.45Å; L650-T652 PolarHBondContact O-N 2.74Å; L650-S653 PolarHBondContact O-N 3.48Å; L650-S653 VanDerWaalsContact O-N 3.15Å; L650-S653 PolarHBondContact O-OG 3.15Å; L650-L654 PolarHBondContact O-N 2.92Å
651	F	86.6	Confident	80.5	Confident	26 Å²	26	75.8 Å²	75.8	11%	0.114	39%	0.389	C	S	.	.	H	α-helix	trans	-65.7	-36.8	178	-168.9	-85.9	0	0	0	112.6	F477 F647 S653 L654 Q659 E662	F477-F651 AromaticContact CE1-CD2 3.92Å; F477-F651 HydrophobicContact CE1-CD2 3.92Å; F477-F651 AromaticContact CE1-CE2 3.72Å; F477-F651 HydrophobicContact CE1-CE2 3.72Å; F477-F651 HydrophobicContact CE1-CG 4.48Å; F477-F651 HydrophobicContact CE1-CZ 4.13Å; F477-F651 HydrophobicContact CZ-CD2 4.22Å; F477-F651 AromaticContact CZ-CE2 3.59Å; F477-F651 HydrophobicContact CZ-CE2 3.59Å; F477-F651 AromaticContact CZ-CZ 3.99Å; F477-F651 HydrophobicContact CZ-CZ 3.99Å; F647-F651 HydrophobicContact CE1-CB 4.12Å; F647-F651 HydrophobicContact CE1-CD2 4.29Å; F647-F651 HydrophobicContact CE1-CG 4.37Å; F647-F651 HydrophobicContact CZ-CB 4.34Å; F647-F651 AromaticContact CZ-CD2 3.95Å; F647-F651 HydrophobicContact CZ-CD2 3.95Å; F647-F651 HydrophobicContact CZ-CG 4.44Å; F647-F651 WeakPolarHBondContact O-CB 3.28Å; F647-F651 PolarHBondContact O-N 3.22Å; F651-S653 VanDerWaalsContact C-N 3.3Å; F651-L654 HydrophobicContact CD2-CD1 4.44Å; F651-L654 PolarHBondContact O-N 2.6Å; F651-Q659 HydrophobicContact CD1-CG 4.15Å; F651-Q659 HydrophobicContact CE1-CB 3.92Å; F651-Q659 HydrophobicContact CE1-CG 3.78Å; F651-Q659 HydrophobicContact CZ-CB 3.91Å; F651-Q659 HydrophobicContact CZ-CG 4.13Å; F651-Q659 WeakPolarHBondContact O-CG 3.48Å; F651-Q659 PolarHBondContact O-NE2 3.05Å; F651-E662 HydrophobicContact CD2-CG 4.26Å; F651-E662 HydrophobicContact CE2-CB 3.9Å; F651-E662 HydrophobicContact CE2-CG 3.79Å
652	T	85	Confident	82	Confident	102 Å²	102	71.9 Å²	71.9	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-77	-13.9	174.5	52.6	0	0	0	0	113.7	R648 E649 L650	R648-T652 WeakPolarHBondContact O-CB 3.31Å; R648-T652 WeakPolarHBondContact O-CG2 3.33Å; R648-T652 PolarHBondContact O-N 3.49Å; R648-T652 PolarHBondContact O-OG1 3.5Å; E649-T652 PolarHBondContact O-N 3.29Å; E649-T652 PolarHBondContact O-OG1 2.83Å; L650-T652 PolarHBondContact O-N 2.74Å
653	S	83.9	Confident	82.8	Confident	86 Å²	86	70.3 Å²	70.3	60%	0.601	36%	0.362	S	S	*	.	H	α-helix	trans	-81.4	-19.8	171.2	79.6	0	0	0	0	114.3	E649 L650 F651	E649-S653 WeakPolarHBondContact O-CB 3.47Å; E649-S653 PolarHBondContact O-N 3.5Å; L650-S653 PolarHBondContact O-N 3.48Å; L650-S653 VanDerWaalsContact O-N 3.15Å; L650-S653 PolarHBondContact O-OG 3.15Å; F651-S653 VanDerWaalsContact C-N 3.3Å
654	L	85.3	Confident	83.2	Confident	19 Å²	19	70.2 Å²	70.2	10%	0.099	36%	0.364	C	S	.	.	S	Bend	trans	-67	150.9	172.8	-71.6	176.1	0	0	0	111.4	L629 L650 F651 E658 Q659	L629-L654 HydrophobicContact CD2-CD2 3.94Å; L629-L654 HydrophobicContact CD2-CG 4.17Å; L650-L654 PolarHBondContact O-N 2.92Å; F651-L654 HydrophobicContact CD2-CD1 4.44Å; F651-L654 PolarHBondContact O-N 2.6Å; L654-E658 HydrophobicContact CB-CB 3.98Å; L654-E658 HydrophobicContact CD1-CB 4.4Å; L654-E658 HydrophobicContact CD2-CB 4.03Å; L654-E658 HydrophobicContact CG-CB 4.37Å; L654-Q659 HydrophobicContact CB-CG 3.8Å; L654-Q659 PolarHBondContact O-NE2 3.34Å
655	S	87.7	Confident	84	Confident	59 Å²	59	70.2 Å²	70.2	41%	0.413	36%	0.358	S	S	.	.			trans	-66.8	157.2	172.1	67.1	0	0	0	0	112.5	E657 E658 Q659	S655-E657 PolarHBondContact O-N 2.92Å; S655-E658 VanDerWaalsContact CB-OE2 3.25Å; S655-E658 WeakPolarHBondContact CB-OE2 3.41Å; S655-E658 PolarHBondContact N-OE2 2.82Å; S655-E658 PolarHBondContact O-N 2.85Å; S655-E658 WeakPolarHBondContact OG-CG 3.29Å; S655-E658 PolarHBondContact OG-N 3.43Å; S655-E658 PolarHBondContact OG-OE2 3.15Å; S655-Q659 WeakPolarHBondContact O-CG 3.43Å; S655-Q659 PolarHBondContact O-N 2.89Å
656	D	83.9	Confident	84.1	Confident	86 Å²	86	67 Å²	67	46%	0.46	34%	0.342	S	S	.	.	H	α-helix	trans	-44.2	-39.1	175.1	-91.3	39.8	0	0	0	113.7	R660	D656-R660 WeakPolarHBondContact O-CD 3.13Å; D656-R660 WeakPolarHBondContact O-CG 3.24Å; D656-R660 PolarHBondContact O-N 2.92Å; D656-R660 VanDerWaalsContact O-N 3.08Å; D656-R660 IonicContact OD2-NH2 3.56Å
657	E	85.8	Confident	84.3	Confident	111 Å²	111	67.6 Å²	67.6	52%	0.519	35%	0.347	S	S	.	.	H	α-helix	trans	-82.2	-33.7	-175.8	-160	58.9	-152.7	0	0	112.3	S655 R660 T661	S655-E657 PolarHBondContact O-N 2.92Å; E657-R660 WeakPolarHBondContact OE2-CD 3.34Å; E657-R660 IonicContact OE2-CZ 3.25Å; E657-R660 IonicContact OE2-NE 2.99Å; E657-R660 IonicContact OE2-NH1 2.67Å; E657-R660 PolarHBondContact OE2-NH1 3.04Å; E657-T661 VanDerWaalsContact O-CB 3.28Å; E657-T661 WeakPolarHBondContact O-CB 3.22Å; E657-T661 PolarHBondContact O-N 3.45Å; E657-T661 PolarHBondContact O-OG1 2.68Å
658	E	87.6	Confident	84.5	Confident	74 Å²	74	70.4 Å²	70.4	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-68.1	-42.8	169.9	-70.2	164.6	123.9	0	0	111.1	L654 S655 R660 T661 E662	L654-E658 HydrophobicContact CB-CB 3.98Å; L654-E658 HydrophobicContact CD1-CB 4.4Å; L654-E658 HydrophobicContact CD2-CB 4.03Å; L654-E658 HydrophobicContact CG-CB 4.37Å; S655-E658 VanDerWaalsContact CB-OE2 3.25Å; S655-E658 WeakPolarHBondContact CB-OE2 3.41Å; S655-E658 PolarHBondContact N-OE2 2.82Å; S655-E658 PolarHBondContact O-N 2.85Å; S655-E658 WeakPolarHBondContact OG-CG 3.29Å; S655-E658 PolarHBondContact OG-N 3.43Å; S655-E658 PolarHBondContact OG-OE2 3.15Å; E658-R660 VanDerWaalsContact C-N 3.34Å; E658-R660 PolarHBondContact O-N 3.15Å; E658-T661 PolarHBondContact O-N 3.02Å; E658-T661 VanDerWaalsContact O-N 3.15Å; E658-E662 WeakPolarHBondContact O-CB 3.43Å; E658-E662 PolarHBondContact O-N 3.21Å
659	Q	88.2	Confident	84.7	Confident	52 Å²	52	70.6 Å²	70.6	24%	0.243	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-43.2	173.9	-70.7	-176.9	33.5	0	0	111.5	F651 L654 S655 T663	F651-Q659 HydrophobicContact CD1-CG 4.15Å; F651-Q659 HydrophobicContact CE1-CB 3.92Å; F651-Q659 HydrophobicContact CE1-CG 3.78Å; F651-Q659 HydrophobicContact CZ-CB 3.91Å; F651-Q659 HydrophobicContact CZ-CG 4.13Å; F651-Q659 WeakPolarHBondContact O-CG 3.48Å; F651-Q659 PolarHBondContact O-NE2 3.05Å; L654-Q659 HydrophobicContact CB-CG 3.8Å; L654-Q659 PolarHBondContact O-NE2 3.34Å; S655-Q659 WeakPolarHBondContact O-CG 3.43Å; S655-Q659 PolarHBondContact O-N 2.89Å; Q659-T663 VanDerWaalsContact O-CB 3.29Å; Q659-T663 WeakPolarHBondContact O-CB 3.38Å; Q659-T663 PolarHBondContact O-N 2.78Å; Q659-T663 PolarHBondContact O-OG1 3.38Å
660	R	82.6	Confident	84.6	Confident	132 Å²	132	67.7 Å²	67.7	50%	0.498	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-44.6	172.9	-74	164.4	-164.4	172.6	6.1	112	D656 E657 E658 T663 A664	D656-R660 WeakPolarHBondContact O-CD 3.13Å; D656-R660 WeakPolarHBondContact O-CG 3.24Å; D656-R660 PolarHBondContact O-N 2.92Å; D656-R660 VanDerWaalsContact O-N 3.08Å; D656-R660 IonicContact OD2-NH2 3.56Å; E657-R660 WeakPolarHBondContact OE2-CD 3.34Å; E657-R660 IonicContact OE2-CZ 3.25Å; E657-R660 IonicContact OE2-NE 2.99Å; E657-R660 IonicContact OE2-NH1 2.67Å; E657-R660 PolarHBondContact OE2-NH1 3.04Å; E658-R660 VanDerWaalsContact C-N 3.34Å; E658-R660 PolarHBondContact O-N 3.15Å; R660-T663 PolarHBondContact O-N 3.43Å; R660-A664 VanDerWaalsContact O-CB 3.27Å; R660-A664 WeakPolarHBondContact O-CB 3.34Å; R660-A664 PolarHBondContact O-N 2.74Å
661	T	84.4	Confident	84.8	Confident	65 Å²	65	69.6 Å²	69.6	40%	0.399	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-41.1	-179	-61.4	0	0	0	0	111.5	E657 E658 A664 R665	E657-T661 VanDerWaalsContact O-CB 3.28Å; E657-T661 WeakPolarHBondContact O-CB 3.22Å; E657-T661 PolarHBondContact O-N 3.45Å; E657-T661 PolarHBondContact O-OG1 2.68Å; E658-T661 PolarHBondContact O-N 3.02Å; E658-T661 VanDerWaalsContact O-N 3.15Å; T661-A664 PolarHBondContact O-N 3.08Å; T661-R665 WeakPolarHBondContact O-CB 3.25Å; T661-R665 WeakPolarHBondContact O-CG 3.41Å; T661-R665 PolarHBondContact O-N 2.98Å
662	E	82.9	Confident	84.7	Confident	23 Å²	23	69.9 Å²	69.9	11%	0.107	37%	0.371	C	S	.	.	H	α-helix	trans	-66.1	-46	173.8	-166.2	64.6	-106.8	0	0	111.1	F651 E658 A664 R665 F666	F651-E662 HydrophobicContact CD2-CG 4.26Å; F651-E662 HydrophobicContact CE2-CB 3.9Å; F651-E662 HydrophobicContact CE2-CG 3.79Å; E658-E662 WeakPolarHBondContact O-CB 3.43Å; E658-E662 PolarHBondContact O-N 3.21Å; E662-A664 VanDerWaalsContact C-N 3.3Å; E662-A664 PolarHBondContact O-N 3.18Å; E662-R665 PolarHBondContact O-N 3.36Å; E662-R665 IonicContact OE1-CZ 2.78Å; E662-R665 IonicContact OE1-NH1 3.39Å; E662-R665 PolarHBondContact OE1-NH1 3.15Å; E662-R665 IonicContact OE1-NH2 2.68Å; E662-R665 IonicContact OE2-CZ 2.8Å; E662-R665 IonicContact OE2-NH1 3.72Å; E662-R665 PolarHBondContact OE2-NH1 3.2Å; E662-R665 VanDerWaalsContact OE2-NH1 3.09Å; E662-R665 IonicContact OE2-NH2 2.63Å; E662-R665 PolarHBondContact OE2-NH2 3.07Å; E662-F666 VanDerWaalsContact O-CB 3.31Å; E662-F666 WeakPolarHBondContact O-CB 3.25Å; E662-F666 PolarHBondContact O-N 2.82Å
663	T	85.2	Confident	84.5	Confident	33 Å²	33	67 Å²	67	20%	0.202	35%	0.35	C	S	.	.	H	α-helix	trans	-59.7	-40.2	174.4	-55.6	0	0	0	0	111.7	Q659 R660 I667	Q659-T663 VanDerWaalsContact O-CB 3.29Å; Q659-T663 WeakPolarHBondContact O-CB 3.38Å; Q659-T663 PolarHBondContact O-N 2.78Å; Q659-T663 PolarHBondContact O-OG1 3.38Å; R660-T663 PolarHBondContact O-N 3.43Å; T663-I667 HydrophobicContact CG2-CD1 3.84Å; T663-I667 HydrophobicContact CG2-CG1 4.5Å; T663-I667 WeakPolarHBondContact O-CB 3.39Å; T663-I667 VanDerWaalsContact O-CG1 3.26Å; T663-I667 WeakPolarHBondContact O-CG1 3.45Å; T663-I667 PolarHBondContact O-N 3.4Å
664	A	84.7	Confident	84.5	Confident	51 Å²	51	64 Å²	64	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-70.2	-42.3	177.9	0	0	0	0	0	112.2	R660 T661 E662 I667 T668	R660-A664 VanDerWaalsContact O-CB 3.27Å; R660-A664 WeakPolarHBondContact O-CB 3.34Å; R660-A664 PolarHBondContact O-N 2.74Å; T661-A664 PolarHBondContact O-N 3.08Å; E662-A664 VanDerWaalsContact C-N 3.3Å; E662-A664 PolarHBondContact O-N 3.18Å; A664-I667 PolarHBondContact O-N 3.05Å; A664-T668 VanDerWaalsContact O-CB 3.28Å; A664-T668 WeakPolarHBondContact O-CB 3.36Å; A664-T668 PolarHBondContact O-N 3.2Å; A664-T668 PolarHBondContact O-OG1 2.6Å
665	R	84.3	Confident	84.5	Confident	89 Å²	89	66.9 Å²	66.9	34%	0.336	35%	0.345	S	S	.	.	H	α-helix	trans	-61.4	-44.5	172.5	-79.9	-173.4	-76.3	99.8	9.5	111.3	S627 T661 E662 T668 R669	S627-R665 PolarHBondContact O-NH1 3.08Å; S627-R665 PolarHBondContact OG-NH1 2.89Å; S627-R665 VanDerWaalsContact OG-NH1 3.12Å; T661-R665 WeakPolarHBondContact O-CB 3.25Å; T661-R665 WeakPolarHBondContact O-CG 3.41Å; T661-R665 PolarHBondContact O-N 2.98Å; E662-R665 PolarHBondContact O-N 3.36Å; E662-R665 IonicContact OE1-CZ 2.78Å; E662-R665 IonicContact OE1-NH1 3.39Å; E662-R665 PolarHBondContact OE1-NH1 3.15Å; E662-R665 IonicContact OE1-NH2 2.68Å; E662-R665 IonicContact OE2-CZ 2.8Å; E662-R665 IonicContact OE2-NH1 3.72Å; E662-R665 PolarHBondContact OE2-NH1 3.2Å; E662-R665 VanDerWaalsContact OE2-NH1 3.09Å; E662-R665 IonicContact OE2-NH2 2.63Å; E662-R665 PolarHBondContact OE2-NH2 3.07Å; R665-T668 PolarHBondContact O-N 3.38Å; R665-R669 WeakPolarHBondContact O-CB 3.47Å; R665-R669 PolarHBondContact O-N 3Å
666	F	79.3	Confident	84.5	Confident	39 Å²	39	68.8 Å²	68.8	17%	0.171	35%	0.35	C	S	.	.	H	α-helix	trans	-57.5	-55.6	173.8	-177.8	-82.6	0	0	0	112.2	F477 A480 E662 T668 R669 T670	F477-F666 HydrophobicContact CB-CZ 4.38Å; F477-F666 HydrophobicContact CD2-CB 4.32Å; F477-F666 AromaticContact CD2-CD1 3.58Å; F477-F666 HydrophobicContact CD2-CD1 3.58Å; F477-F666 AromaticContact CD2-CD2 3.5Å; F477-F666 HydrophobicContact CD2-CD2 3.5Å; F477-F666 VanDerWaalsContact CD2-CD2 3.5Å; F477-F666 AromaticContact CD2-CE1 3.7Å; F477-F666 HydrophobicContact CD2-CE1 3.7Å; F477-F666 AromaticContact CD2-CE2 3.59Å; F477-F666 HydrophobicContact CD2-CE2 3.59Å; F477-F666 AromaticContact CD2-CG 3.51Å; F477-F666 HydrophobicContact CD2-CG 3.51Å; F477-F666 AromaticContact CD2-CZ 3.72Å; F477-F666 HydrophobicContact CD2-CZ 3.72Å; F477-F666 HydrophobicContact CE2-CB 3.66Å; F477-F666 AromaticContact CE2-CD1 3.74Å; F477-F666 HydrophobicContact CE2-CD1 3.74Å; F477-F666 AromaticContact CE2-CD2 3.57Å; F477-F666 HydrophobicContact CE2-CD2 3.57Å; F477-F666 HydrophobicContact CE2-CE1 4.34Å; F477-F666 HydrophobicContact CE2-CE2 4.16Å; F477-F666 AromaticContact CE2-CG 3.35Å; F477-F666 HydrophobicContact CE2-CG 3.35Å; F477-F666 HydrophobicContact CG-CD2 4.42Å; F477-F666 HydrophobicContact CG-CE2 4.24Å; F477-F666 HydrophobicContact CG-CZ 4.42Å; A480-F666 HydrophobicContact CB-CE2 3.6Å; A480-F666 HydrophobicContact CB-CZ 3.8Å; E662-F666 VanDerWaalsContact O-CB 3.31Å; E662-F666 WeakPolarHBondContact O-CB 3.25Å; E662-F666 PolarHBondContact O-N 2.82Å; F666-T668 VanDerWaalsContact C-N 3.26Å; F666-T668 PolarHBondContact O-N 3.04Å; F666-R669 WeakPolarHBondContact O-CB 3.16Å; F666-R669 PolarHBondContact O-N 2.8Å; F666-R669 VanDerWaalsContact O-N 3.09Å; F666-T670 VanDerWaalsContact CE1-OG1 3.22Å; F666-T670 WeakPolarHBondContact CE1-OG1 3.43Å; F666-T670 PolarHBondContact O-N 2.9Å; F666-T670 PolarHBondContact O-OG1 3.36Å; F666-T670 VanDerWaalsContact O-OG1 3.11Å
667	I	85	Confident	84.5	Confident	88 Å²	88	66.4 Å²	66.4	45%	0.451	34%	0.343	S	S	.	.	H	α-helix	trans	-59.2	-41.3	-178.9	-71	167.6	0	0	0	110.6	T663 A664 L671	T663-I667 HydrophobicContact CG2-CD1 3.84Å; T663-I667 HydrophobicContact CG2-CG1 4.5Å; T663-I667 WeakPolarHBondContact O-CB 3.39Å; T663-I667 VanDerWaalsContact O-CG1 3.26Å; T663-I667 WeakPolarHBondContact O-CG1 3.45Å; T663-I667 PolarHBondContact O-N 3.4Å; A664-I667 PolarHBondContact O-N 3.05Å; I667-L671 HydrophobicContact CG2-CD1 3.78Å; I667-L671 HydrophobicContact CG2-CG 4.36Å; I667-L671 WeakPolarHBondContact O-CB 3.27Å; I667-L671 VanDerWaalsContact O-CG 3.23Å; I667-L671 WeakPolarHBondContact O-CG 3.29Å; I667-L671 PolarHBondContact O-N 3.33Å
668	T	85.4	Confident	84.3	Confident	85 Å²	85	64.2 Å²	64.2	52%	0.521	34%	0.337	S	S	.	.	H	α-helix	trans	-62.8	-43.8	176.9	-57	0	0	0	0	111.2	A664 R665 F666 T672	A664-T668 VanDerWaalsContact O-CB 3.28Å; A664-T668 WeakPolarHBondContact O-CB 3.36Å; A664-T668 PolarHBondContact O-N 3.2Å; A664-T668 PolarHBondContact O-OG1 2.6Å; R665-T668 PolarHBondContact O-N 3.38Å; F666-T668 VanDerWaalsContact C-N 3.26Å; F666-T668 PolarHBondContact O-N 3.04Å; T668-T672 VanDerWaalsContact O-CB 3.29Å; T668-T672 WeakPolarHBondContact O-CB 3.34Å; T668-T672 PolarHBondContact O-N 3.31Å; T668-T672 PolarHBondContact O-OG1 3.33Å
669	R	84.2	Confident	84.1	Confident	93 Å²	93	63.8 Å²	63.8	35%	0.351	34%	0.339	S	S	.	.	H	α-helix	trans	-61.6	-54.1	175.6	-178.9	-178.5	178.7	139.5	19.4	111.6	G485 R665 F666 L671 T672 E673	G485-R669 PolarHBondContact O-NH2 3.38Å; R665-R669 WeakPolarHBondContact O-CB 3.47Å; R665-R669 PolarHBondContact O-N 3Å; F666-R669 WeakPolarHBondContact O-CB 3.16Å; F666-R669 PolarHBondContact O-N 2.8Å; F666-R669 VanDerWaalsContact O-N 3.09Å; R669-L671 VanDerWaalsContact C-N 3.32Å; R669-L671 PolarHBondContact O-N 3.36Å; R669-T672 WeakPolarHBondContact O-CA 3.38Å; R669-T672 WeakPolarHBondContact O-CB 3.33Å; R669-T672 PolarHBondContact O-N 2.86Å; R669-E673 HydrophobicContact CG-CG 4.39Å; R669-E673 IonicContact CZ-OE1 3.09Å; R669-E673 VanDerWaalsContact CZ-OE1 3.24Å; R669-E673 IonicContact NE-OE1 3.39Å; R669-E673 PolarHBondContact NE-OE1 3.46Å; R669-E673 IonicContact NE-OE2 3.24Å; R669-E673 IonicContact NH2-OE1 2.77Å; R669-E673 PolarHBondContact NH2-OE1 2.68Å; R669-E673 PolarHBondContact O-N 3.5Å
670	T	81.8	Confident	83.8	Confident	51 Å²	51	64.8 Å²	64.8	31%	0.313	35%	0.349	S	S	.	.	H	α-helix	trans	-60.4	-40.8	-178.7	-51	0	0	0	0	112	F666 T672 A674	F666-T670 VanDerWaalsContact CE1-OG1 3.22Å; F666-T670 WeakPolarHBondContact CE1-OG1 3.43Å; F666-T670 PolarHBondContact O-N 2.9Å; F666-T670 PolarHBondContact O-OG1 3.36Å; F666-T670 VanDerWaalsContact O-OG1 3.11Å; T670-T672 VanDerWaalsContact C-N 3.33Å; T670-A674 WeakPolarHBondContact O-CB 3.48Å; T670-A674 PolarHBondContact O-N 3.15Å
671	L	86.8	Confident	83.9	Confident	98 Å²	98	64.9 Å²	64.9	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-66.4	-35.3	174.4	-71.3	173.3	0	0	0	112.1	I667 R669 L675	I667-L671 HydrophobicContact CG2-CD1 3.78Å; I667-L671 HydrophobicContact CG2-CG 4.36Å; I667-L671 WeakPolarHBondContact O-CB 3.27Å; I667-L671 VanDerWaalsContact O-CG 3.23Å; I667-L671 WeakPolarHBondContact O-CG 3.29Å; I667-L671 PolarHBondContact O-N 3.33Å; R669-L671 VanDerWaalsContact C-N 3.32Å; R669-L671 PolarHBondContact O-N 3.36Å; L671-L675 VanDerWaalsContact O-CB 3.27Å; L671-L675 WeakPolarHBondContact O-CB 3.16Å; L671-L675 WeakPolarHBondContact O-CD1 3.21Å; L671-L675 VanDerWaalsContact O-CG 3.23Å; L671-L675 WeakPolarHBondContact O-CG 3.4Å; L671-L675 PolarHBondContact O-N 3Å
672	T	85.7	Confident	83.9	Confident	32 Å²	32	67 Å²	67	20%	0.196	36%	0.363	C	S	.	.	H	α-helix	trans	-70.4	-47.1	177.6	-60.5	0	0	0	0	111.9	L14 T668 R669 T670 A674 L675 L676	L14-T672 HydrophobicContact CD2-CG2 3.69Å; T668-T672 VanDerWaalsContact O-CB 3.29Å; T668-T672 WeakPolarHBondContact O-CB 3.34Å; T668-T672 PolarHBondContact O-N 3.31Å; T668-T672 PolarHBondContact O-OG1 3.33Å; R669-T672 WeakPolarHBondContact O-CA 3.38Å; R669-T672 WeakPolarHBondContact O-CB 3.33Å; R669-T672 PolarHBondContact O-N 2.86Å; T670-T672 VanDerWaalsContact C-N 3.33Å; T672-A674 VanDerWaalsContact C-N 3.34Å; T672-A674 PolarHBondContact O-N 3.1Å; T672-L675 PolarHBondContact O-N 3.09Å; T672-L676 HydrophobicContact CG2-CD1 4.05Å; T672-L676 HydrophobicContact CG2-CG 4.49Å; T672-L676 WeakPolarHBondContact O-CB 3.28Å; T672-L676 VanDerWaalsContact O-CG 3.28Å; T672-L676 WeakPolarHBondContact O-CG 3.34Å; T672-L676 PolarHBondContact O-N 3.47Å
673	E	80.7	Confident	84	Confident	42 Å²	42	70.6 Å²	70.6	20%	0.196	38%	0.382	C	S	.	.	H	α-helix	trans	-63.2	-40.1	176.3	-69.7	172.7	166.9	0	0	111.2	R669 A677	R669-E673 HydrophobicContact CG-CG 4.39Å; R669-E673 IonicContact CZ-OE1 3.09Å; R669-E673 VanDerWaalsContact CZ-OE1 3.24Å; R669-E673 IonicContact NE-OE1 3.39Å; R669-E673 PolarHBondContact NE-OE1 3.46Å; R669-E673 IonicContact NE-OE2 3.24Å; R669-E673 IonicContact NH2-OE1 2.77Å; R669-E673 PolarHBondContact NH2-OE1 2.68Å; R669-E673 PolarHBondContact O-N 3.5Å; E673-A677 WeakPolarHBondContact O-CB 3.43Å; E673-A677 PolarHBondContact O-N 3.45Å
674	A	82.2	Confident	83.9	Confident	21 Å²	21	73.9 Å²	73.9	17%	0.174	40%	0.399	C	S	.	.	H	α-helix	trans	-66.9	-40.4	174.4	0	0	0	0	0	113.1	T670 T672 A677 V678	T670-A674 WeakPolarHBondContact O-CB 3.48Å; T670-A674 PolarHBondContact O-N 3.15Å; T672-A674 VanDerWaalsContact C-N 3.34Å; T672-A674 PolarHBondContact O-N 3.1Å; A674-A677 PolarHBondContact O-N 2.72Å; A674-V678 WeakPolarHBondContact O-CG2 3.37Å; A674-V678 PolarHBondContact O-N 3Å
675	L	86.4	Confident	83.9	Confident	81 Å²	81	73.4 Å²	73.4	42%	0.424	40%	0.399	S	S	.	.	H	α-helix	trans	-69	-39.2	176.4	-77.6	166.2	0	0	0	111.7	W10 L671 T672 V678 T679	W10-L675 HydrophobicContact CE3-CD1 4.13Å; W10-L675 HydrophobicContact CH2-CB 4.34Å; W10-L675 HydrophobicContact CH2-CD1 3.4Å; W10-L675 HydrophobicContact CH2-CG 4.49Å; W10-L675 HydrophobicContact CZ2-CD1 3.95Å; W10-L675 HydrophobicContact CZ3-CB 4.19Å; W10-L675 HydrophobicContact CZ3-CD1 3.49Å; W10-L675 VanDerWaalsContact CZ3-CD1 3.49Å; W10-L675 HydrophobicContact CZ3-CG 4.44Å; L671-L675 VanDerWaalsContact O-CB 3.27Å; L671-L675 WeakPolarHBondContact O-CB 3.16Å; L671-L675 WeakPolarHBondContact O-CD1 3.21Å; L671-L675 VanDerWaalsContact O-CG 3.23Å; L671-L675 WeakPolarHBondContact O-CG 3.4Å; L671-L675 PolarHBondContact O-N 3Å; T672-L675 PolarHBondContact O-N 3.09Å; L675-V678 PolarHBondContact O-N 3.31Å; L675-T679 WeakPolarHBondContact O-CG2 3.41Å; L675-T679 PolarHBondContact O-N 3.35Å; L675-T679 PolarHBondContact O-OG1 2.67Å
676	L	87.4	Confident	83.9	Confident	98 Å²	98	73.3 Å²	73.3	51%	0.513	40%	0.404	S	S	.	.	H	α-helix	trans	-58.7	-50	172.3	-75.4	169.2	0	0	0	110.9	T672 V678 T679 T680	T672-L676 HydrophobicContact CG2-CD1 4.05Å; T672-L676 HydrophobicContact CG2-CG 4.49Å; T672-L676 WeakPolarHBondContact O-CB 3.28Å; T672-L676 VanDerWaalsContact O-CG 3.28Å; T672-L676 WeakPolarHBondContact O-CG 3.34Å; T672-L676 PolarHBondContact O-N 3.47Å; L676-V678 PolarHBondContact O-N 3.12Å; L676-T679 WeakPolarHBondContact CA-OG1 3.22Å; L676-T679 PolarHBondContact O-N 2.83Å; L676-T679 VanDerWaalsContact O-N 3.09Å; L676-T679 PolarHBondContact O-OG1 2.99Å; L676-T680 PolarHBondContact O-N 3.29Å; L676-T680 PolarHBondContact O-OG1 3.12Å
677	A	83	Confident	84.2	Confident	36 Å²	36	75.3 Å²	75.3	30%	0.298	42%	0.419	S	S	.	.	H	α-helix	trans	-58.2	-43.9	178.1	0	0	0	0	0	112.9	E673 A674 T679 T680 E681	E673-A677 WeakPolarHBondContact O-CB 3.43Å; E673-A677 PolarHBondContact O-N 3.45Å; A674-A677 PolarHBondContact O-N 2.72Å; A677-T679 VanDerWaalsContact C-N 3.35Å; A677-T680 WeakPolarHBondContact CA-OG1 3.37Å; A677-T680 PolarHBondContact O-N 3.27Å; A677-T680 PolarHBondContact O-OG1 3.01Å; A677-E681 PolarHBondContact O-N 3.18Å
678	V	83.3	Confident	84.1	Confident	65 Å²	65	78 Å²	78	39%	0.394	43%	0.43	S	S	.	.	H	α-helix	trans	-66	-36.4	175.3	171	0	0	0	0	111.6	A674 L675 L676 L682	A674-V678 WeakPolarHBondContact O-CG2 3.37Å; A674-V678 PolarHBondContact O-N 3Å; L675-V678 PolarHBondContact O-N 3.31Å; L676-V678 PolarHBondContact O-N 3.12Å; V678-L682 VanDerWaalsContact O-CB 3.29Å; V678-L682 WeakPolarHBondContact O-CB 3.2Å; V678-L682 PolarHBondContact O-N 2.84Å
679	T	82.1	Confident	83.9	Confident	65 Å²	65	80.6 Å²	80.6	40%	0.399	44%	0.436	S	S	.	.	H	α-helix	trans	-70.4	-33.7	174.7	53.9	0	0	0	0	113.3	L675 L676 A677 I683	L675-T679 WeakPolarHBondContact O-CG2 3.41Å; L675-T679 PolarHBondContact O-N 3.35Å; L675-T679 PolarHBondContact O-OG1 2.67Å; L676-T679 WeakPolarHBondContact CA-OG1 3.22Å; L676-T679 PolarHBondContact O-N 2.83Å; L676-T679 VanDerWaalsContact O-N 3.09Å; L676-T679 PolarHBondContact O-OG1 2.99Å; A677-T679 VanDerWaalsContact C-N 3.35Å; T679-I683 WeakPolarHBondContact O-CB 3.4Å; T679-I683 WeakPolarHBondContact O-CD1 3.49Å; T679-I683 WeakPolarHBondContact O-CG1 3.36Å; T679-I683 PolarHBondContact O-N 3.31Å
680	T	83.4	Confident	83.9	Confident	73 Å²	73	80.2 Å²	80.2	45%	0.448	44%	0.444	S	S	.	.	H	α-helix	trans	-68.9	-46.7	174	46.4	0	0	0	0	111.4	L676 A677 L682 I683 D684	L676-T680 PolarHBondContact O-N 3.29Å; L676-T680 PolarHBondContact O-OG1 3.12Å; A677-T680 WeakPolarHBondContact CA-OG1 3.37Å; A677-T680 PolarHBondContact O-N 3.27Å; A677-T680 PolarHBondContact O-OG1 3.01Å; T680-L682 PolarHBondContact O-N 3.05Å; T680-I683 PolarHBondContact O-N 3.39Å; T680-I683 VanDerWaalsContact O-N 3.14Å; T680-D684 WeakPolarHBondContact O-CB 3.31Å; T680-D684 VanDerWaalsContact O-CG 3.29Å; T680-D684 PolarHBondContact O-N 3.2Å
681	E	82.8	Confident	83.7	Confident	134 Å²	134	83.5 Å²	83.5	63%	0.626	46%	0.457	S	S	*	.	H	α-helix	trans	-59.4	-35.9	175.3	-72.6	-174.2	175.3	0	0	112.1	A677 G685	A677-E681 PolarHBondContact O-N 3.18Å; E681-G685 PolarHBondContact O-N 3.4Å
682	L	84.6	Confident	83.3	Confident	110 Å²	110	83.1 Å²	83.1	58%	0.576	46%	0.459	S	S	*	.	H	α-helix	trans	-69.3	-41.9	175.2	-179.1	63.1	0	0	0	112.7	V678 T680 I686	V678-L682 VanDerWaalsContact O-CB 3.29Å; V678-L682 WeakPolarHBondContact O-CB 3.2Å; V678-L682 PolarHBondContact O-N 2.84Å; T680-L682 PolarHBondContact O-N 3.05Å; L682-I686 HydrophobicContact CD1-CD1 4.11Å; L682-I686 HydrophobicContact CG-CD1 4.06Å; L682-I686 WeakPolarHBondContact O-CD1 3.49Å; L682-I686 VanDerWaalsContact O-CG1 3.26Å; L682-I686 WeakPolarHBondContact O-CG1 3.25Å; L682-I686 PolarHBondContact O-N 3.48Å; L682-I686 VanDerWaalsContact O-N 3.07Å
683	I	85.8	Confident	82.7	Confident	98 Å²	98	88.4 Å²	88.4	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-66	-47.3	177.5	-72.5	163.9	0	0	0	110.2	T679 T680 G685 I686 V687	T679-I683 WeakPolarHBondContact O-CB 3.4Å; T679-I683 WeakPolarHBondContact O-CD1 3.49Å; T679-I683 WeakPolarHBondContact O-CG1 3.36Å; T679-I683 PolarHBondContact O-N 3.31Å; T680-I683 PolarHBondContact O-N 3.39Å; T680-I683 VanDerWaalsContact O-N 3.14Å; I683-G685 VanDerWaalsContact C-N 3.33Å; I683-G685 PolarHBondContact O-N 3.18Å; I683-I686 PolarHBondContact O-N 3.24Å; I683-V687 HydrophobicContact CG2-CG2 4.44Å; I683-V687 WeakPolarHBondContact O-CG2 3.45Å; I683-V687 PolarHBondContact O-N 3.18Å
684	D	84	Confident	82.1	Confident	103 Å²	103	89.3 Å²	89.3	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-61.4	-41.7	179	-66.7	-24.5	0	0	0	111.2	T680 V687 E688	T680-D684 WeakPolarHBondContact O-CB 3.31Å; T680-D684 VanDerWaalsContact O-CG 3.29Å; T680-D684 PolarHBondContact O-N 3.2Å; D684-V687 PolarHBondContact O-N 3.21Å; D684-E688 PolarHBondContact O-N 2.83Å
685	G	84.5	Confident	81.5	Confident	41 Å²	41	93.4 Å²	93.4	42%	0.423	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-41.9	174.5	0	0	0	0	0	113.8	E681 I683 V687 E688 E689	E681-G685 PolarHBondContact O-N 3.4Å; I683-G685 VanDerWaalsContact C-N 3.33Å; I683-G685 PolarHBondContact O-N 3.18Å; G685-V687 VanDerWaalsContact C-N 3.35Å; G685-E688 PolarHBondContact O-N 3.44Å; G685-E689 PolarHBondContact O-N 3.04Å
686	I	84.4	Confident	80.3	Confident	87 Å²	87	93.6 Å²	93.6	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-66.7	-37.5	174.8	-69	164.9	0	0	0	110.8	L682 I683 E689 V690	L682-I686 HydrophobicContact CD1-CD1 4.11Å; L682-I686 HydrophobicContact CG-CD1 4.06Å; L682-I686 WeakPolarHBondContact O-CD1 3.49Å; L682-I686 VanDerWaalsContact O-CG1 3.26Å; L682-I686 WeakPolarHBondContact O-CG1 3.25Å; L682-I686 PolarHBondContact O-N 3.48Å; L682-I686 VanDerWaalsContact O-N 3.07Å; I683-I686 PolarHBondContact O-N 3.24Å; I686-E689 PolarHBondContact O-N 3.05Å; I686-V690 HydrophobicContact CG2-CG2 4.38Å; I686-V690 WeakPolarHBondContact O-CB 3.31Å; I686-V690 VanDerWaalsContact O-CG2 3.31Å; I686-V690 WeakPolarHBondContact O-CG2 3.37Å; I686-V690 PolarHBondContact O-N 3.02Å
687	V	84.3	Confident	78.7	Confident	80 Å²	80	92 Å²	92	49%	0.485	53%	0.534	S	S	.	.	H	α-helix	trans	-66.2	-42	176.2	170.2	0	0	0	0	111.1	I683 D684 G685 M691	I683-V687 HydrophobicContact CG2-CG2 4.44Å; I683-V687 WeakPolarHBondContact O-CG2 3.45Å; I683-V687 PolarHBondContact O-N 3.18Å; D684-V687 PolarHBondContact O-N 3.21Å; G685-V687 VanDerWaalsContact C-N 3.35Å; V687-M691 HydrophobicContact CG1-CG 4.27Å; V687-M691 VanDerWaalsContact O-CB 3.24Å; V687-M691 WeakPolarHBondContact O-CB 2.85Å; V687-M691 WeakPolarHBondContact O-CG 3.41Å; V687-M691 PolarHBondContact O-N 2.95Å
688	E	83.6	Confident	77.3	Confident	146 Å²	146	99 Å²	99	68%	0.682	56%	0.558	S	S	*	*	H	α-helix	trans	-65.3	-39.8	173.3	-71.2	-138.7	132.7	0	0	112.5	D684 G685 M691 T692	D684-E688 PolarHBondContact O-N 2.83Å; G685-E688 PolarHBondContact O-N 3.44Å; E688-M691 PolarHBondContact O-N 3.08Å; E688-T692 WeakPolarHBondContact O-CB 3.43Å; E688-T692 VanDerWaalsContact O-CG2 3.31Å; E688-T692 WeakPolarHBondContact O-CG2 3.44Å; E688-T692 PolarHBondContact O-N 2.94Å; E688-T692 PolarHBondContact O-OG1 2.73Å
689	E	82	Confident	75.5	Confident	138 Å²	138	100.5 Å²	100.5	65%	0.645	57%	0.571	S	S	*	*	H	α-helix	trans	-62	-49	175.9	-172.5	167.6	-152.4	0	0	111.3	G685 I686 M691 T692 E693	G685-E689 PolarHBondContact O-N 3.04Å; I686-E689 PolarHBondContact O-N 3.05Å; E689-M691 PolarHBondContact O-N 2.98Å; E689-T692 PolarHBondContact O-N 3.05Å; E689-T692 PolarHBondContact O-OG1 2.82Å; E689-T692 VanDerWaalsContact O-OG1 3.09Å; E689-E693 WeakPolarHBondContact O-CB 3.31Å; E689-E693 PolarHBondContact O-N 3.46Å
690	V	82.1	Confident	73.5	Confident	85 Å²	85	105.6 Å²	105.6	52%	0.515	59%	0.59	S	S	.	*	H	α-helix	trans	-64.1	-39.9	177.6	171	0	0	0	0	112	I686 A694	I686-V690 HydrophobicContact CG2-CG2 4.38Å; I686-V690 WeakPolarHBondContact O-CB 3.31Å; I686-V690 VanDerWaalsContact O-CG2 3.31Å; I686-V690 WeakPolarHBondContact O-CG2 3.37Å; I686-V690 PolarHBondContact O-N 3.02Å; V690-A694 VanDerWaalsContact O-CB 3.23Å; V690-A694 WeakPolarHBondContact O-CB 3.36Å; V690-A694 PolarHBondContact O-N 2.95Å
691	M	78.6	Confident	71.6	Confident	120 Å²	120	108 Å²	108	59%	0.591	60%	0.604	S	S	*	*	H	α-helix	trans	-70.1	-38.9	178.3	-73.3	-70.8	-75.2	0	0	112.2	V687 E688 E689 A694 V695	V687-M691 HydrophobicContact CG1-CG 4.27Å; V687-M691 VanDerWaalsContact O-CB 3.24Å; V687-M691 WeakPolarHBondContact O-CB 2.85Å; V687-M691 WeakPolarHBondContact O-CG 3.41Å; V687-M691 PolarHBondContact O-N 2.95Å; E688-M691 PolarHBondContact O-N 3.08Å; E689-M691 PolarHBondContact O-N 2.98Å; M691-A694 PolarHBondContact O-N 3.05Å; M691-V695 WeakPolarHBondContact O-CG2 3.43Å; M691-V695 PolarHBondContact O-N 2.94Å
692	T	78.3	Confident	69.7	Low	91 Å²	91	110 Å²	110	56%	0.558	62%	0.619	S	S	*	*	H	α-helix	trans	-71.6	-36.4	176.5	52.8	0	0	0	0	112.2	E688 E689 S696	E688-T692 WeakPolarHBondContact O-CB 3.43Å; E688-T692 VanDerWaalsContact O-CG2 3.31Å; E688-T692 WeakPolarHBondContact O-CG2 3.44Å; E688-T692 PolarHBondContact O-N 2.94Å; E688-T692 PolarHBondContact O-OG1 2.73Å; E689-T692 PolarHBondContact O-N 3.05Å; E689-T692 PolarHBondContact O-OG1 2.82Å; E689-T692 VanDerWaalsContact O-OG1 3.09Å; T692-S696 VanDerWaalsContact O-CB 3.23Å; T692-S696 WeakPolarHBondContact O-CB 3.1Å; T692-S696 PolarHBondContact O-N 3.28Å
693	E	72.6	Confident	67.7	Low	143 Å²	143	110.1 Å²	110.1	67%	0.668	63%	0.626	S	S	*	*	H	α-helix	trans	-63	-46.8	170.3	-172.6	175.5	-154.1	0	0	111.4	E689 V695 S696 G697	E689-E693 WeakPolarHBondContact O-CB 3.31Å; E689-E693 PolarHBondContact O-N 3.46Å; E693-V695 VanDerWaalsContact C-N 3.31Å; E693-V695 PolarHBondContact O-N 2.74Å; E693-S696 PolarHBondContact O-N 3.39Å; E693-G697 PolarHBondContact O-N 3.11Å
694	A	69.4	Low	65.5	Low	60 Å²	60	111 Å²	111	50%	0.496	64%	0.641	S	S	.	*	H	α-helix	trans	-62	-34.8	179.7	0	0	0	0	0	113.6	V690 M691	V690-A694 VanDerWaalsContact O-CB 3.23Å; V690-A694 WeakPolarHBondContact O-CB 3.36Å; V690-A694 PolarHBondContact O-N 2.95Å; M691-A694 PolarHBondContact O-N 3.05Å
695	V	68.9	Low	63.4	Low	108 Å²	108	114.9 Å²	114.9	66%	0.655	66%	0.656	S	S	*	*	H	α-helix	trans	-73.9	-45.8	173.6	170.2	0	0	0	0	111.1	M691 E693 G697 K698	M691-V695 WeakPolarHBondContact O-CG2 3.43Å; M691-V695 PolarHBondContact O-N 2.94Å; E693-V695 VanDerWaalsContact C-N 3.31Å; E693-V695 PolarHBondContact O-N 2.74Å; V695-G697 PolarHBondContact O-N 3.09Å; V695-K698 PolarHBondContact O-N 3.17Å
696	S	60.3	Low	61.4	Low	84 Å²	84	120.2 Å²	120.2	59%	0.587	67%	0.674	S	S	*	*	H	α-helix	trans	-60.5	-47.4	-179.9	-171.8	0	0	0	0	111.9	T692 E693 K698 S699	T692-S696 VanDerWaalsContact O-CB 3.23Å; T692-S696 WeakPolarHBondContact O-CB 3.1Å; T692-S696 PolarHBondContact O-N 3.28Å; E693-S696 PolarHBondContact O-N 3.39Å; S696-K698 PolarHBondContact O-N 3.02Å; S696-K698 VanDerWaalsContact O-N 3.07Å; S696-S699 PolarHBondContact O-N 3.16Å; S696-S699 PolarHBondContact O-OG 2.81Å
697	G	54.8	Low	59.2	Low	65 Å²	65	121.2 Å²	121.2	67%	0.67	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-10.4	-179.7	0	0	0	0	0	115.5	E693 V695	E693-G697 PolarHBondContact O-N 3.11Å; V695-G697 PolarHBondContact O-N 3.09Å
698	K	52.9	Low	57.1	Low	183 Å²	183	123.1 Å²	123.1	80%	0.796	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-10.2	178.8	-130.3	72.9	178	-173.8	0	114.7	V695 S696	V695-K698 PolarHBondContact O-N 3.17Å; S696-K698 PolarHBondContact O-N 3.02Å; S696-K698 VanDerWaalsContact O-N 3.07Å
699	S	45.6	Very low	54.8	Low	97 Å²	97	121.5 Å²	121.5	68%	0.678	71%	0.708	S	S	*	*	S	Bend	trans	-94	-4.2	-163.9	65	0	0	0	0	116.4	S696	S696-S699 PolarHBondContact O-N 3.16Å; S696-S699 PolarHBondContact O-OG 2.81Å
700	H	41.3	Very low	53	Low	172 Å²	172	121.6 Å²	121.6	80%	0.796	72%	0.718	S	S	*	*	S	Bend	trans	-130.3	30.3	-162.7	-147.6	-60.1	0	0	0	116.6
701	V	42.9	Very low	50.7	Low	123 Å²	123	125.8 Å²	125.8	75%	0.745	73%	0.732	S	S	*	*			trans	-132.4	90.8	171.2	-172.3	0	0	0	0	111.9	P703	V701-P703 HydrophobicContact CG1-CG 4.25Å
702	L	42.6	Very low	49.2	Very low	177 Å²	177	127.1 Å²	127.1	93%	0.927	74%	0.739	S	S	*	*			trans	-121.6	102.1	156.2	-77.5	177.5	0	0	0	108.1	S704	L702-S704 PolarHBondContact O-N 2.79Å
703	P	42.8	Very low	47.2	Very low	112 Å²	112	131.9 Å²	131.9	73%	0.727	75%	0.752	S	S	*	*			trans	-78.2	111.6	170.2	1.2	16.9	0	0	0	108.2	V701	V701-P703 HydrophobicContact CG1-CG 4.25Å
704	S	38.7	Very low	45.9	Very low	116 Å²	116	129.3 Å²	129.3	81%	0.811	75%	0.75	S	S	*	*			trans	-67.7	137.6	160.7	-172.6	0	0	0	0	108.2	L702 D706	L702-S704 PolarHBondContact O-N 2.79Å; S704-D706 PolarHBondContact O-N 2.68Å
705	E	40.7	Very low	44.6	Very low	185 Å²	185	132.8 Å²	132.8	86%	0.864	77%	0.768	S	S	*	*			trans	-67.9	122.5	177.8	-56.2	-154.2	133.7	0	0	110.7
706	D	41.7	Very low	43.2	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	78%	0.775	S	S	*	*				-169.7	146.8	129.7	-124.9	-35.3	0	0	0	112.8	S704	S704-D706 PolarHBondContact O-N 2.68Å
707	S	39.9	Very low	42.4	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	79%	0.792	S	S	*	*			trans	62.9	132.2	168.6	-61.8	0	0	0	0	119.9
708	P	40.1	Very low	41.5	Very low	120 Å²	120	140.1 Å²	140.1	78%	0.779	80%	0.796	S	S	*	*			trans	-97.1	170.6	-174	38.4	-37.7	0	0	0	116.1
709	S	35.1	Very low	40.8	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	80%	0.802	S	S	*	*			trans	68	90.2	155.4	59.5	0	0	0	0	119.8
710	V	43.4	Very low	40.7	Very low	141 Å²	141	141 Å²	141	86%	0.855	81%	0.805	S	S	*	*			trans	-136.3	132.7	144.5	-179.7	0	0	0	0	108.2
711	E	35.2	Very low	40.8	Very low	173 Å²	173	137.9 Å²	137.9	81%	0.808	80%	0.803	S	S	*	*			trans	-69.8	134.6	174.8	-64.3	177.9	99.9	0	0	111.5
712	I	45.3	Very low	40.8	Very low	147 Å²	147	141.2 Å²	141.2	75%	0.754	80%	0.803	S	S	*	*			trans	-126.3	118	163.7	-58.9	-178.5	0	0	0	108.6
713	K	37.8	Very low	40.7	Very low	191 Å²	191	139.5 Å²	139.5	83%	0.83	80%	0.795	S	S	*	*			trans	-88.6	111.4	171.7	-73.2	178.1	177.5	174.2	0	109.5
714	S	44.2	Very low	40.6	Very low	89 Å²	89	139.4 Å²	139.4	62%	0.622	80%	0.797	S	S	*	*			trans	-126.9	124	170.7	-60.8	0	0	0	0	109
715	P	41.8	Very low	40.6	Very low	134 Å²	134	142.3 Å²	142.3	87%	0.87	80%	0.798	S	S	*	*			trans	-78.1	126.3	174.7	30.9	-31.7	0	0	0	110.3
716	I	40.5	Very low	40.6	Very low	158 Å²	158	137.9 Å²	137.9	81%	0.81	79%	0.787	S	S	*	*			trans	-125.5	106	168.5	-59.8	177.7	0	0	0	107.6
717	L	43.4	Very low	40.7	Very low	179 Å²	179	139.9 Å²	139.9	94%	0.937	79%	0.792	S	S	*	*			trans	-148.3	137.4	169.4	-77.4	174	0	0	0	106.4
718	G	34.9	Very low	40.8	Very low	73 Å²	73	140 Å²	140	75%	0.753	79%	0.793	S	S	*	*			trans	154.7	-13.9	173.3	0	0	0	0	0	118.1
719	L	38.8	Very low	41	Very low	176 Å²	176	143.7 Å²	143.7	92%	0.921	80%	0.799	S	S	*	*			trans	-130.2	104.6	174.4	-71.8	176.2	0	0	0	110.8
720	V	44.1	Very low	41.2	Very low	122 Å²	122	143.8 Å²	143.8	74%	0.739	80%	0.8	S	S	*	*			trans	-119.5	110.9	166.3	175	0	0	0	0	106.9	Y722	V720-Y722 HydrophobicContact CG1-CD2 4.13Å; V720-Y722 HydrophobicContact CG1-CE2 4.08Å; V720-Y722 PolarHBondContact O-N 3.45Å
721	S	42	Very low	41.1	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	80%	0.798	S	S	*	*			trans	-74.2	102.1	173.8	-54.4	0	0	0	0	109.5	N723	S721-N723 PolarHBondContact O-N 3.45Å; S721-N723 VanDerWaalsContact O-N 3.17Å
722	Y	42.9	Very low	41.4	Very low	192 Å²	192	144.8 Å²	144.8	75%	0.753	80%	0.795	S	S	*	*			trans	-71.7	104.2	166	-89.5	-93.3	0	0	0	109.3	V720	V720-Y722 HydrophobicContact CG1-CD2 4.13Å; V720-Y722 HydrophobicContact CG1-CE2 4.08Å; V720-Y722 PolarHBondContact O-N 3.45Å
723	N	41.3	Very low	41.1	Very low	141 Å²	141	145 Å²	145	75%	0.754	80%	0.798	S	S	*	*			trans	-126	143.2	165.6	-86.8	-26.4	0	0	0	108.3	S721	S721-N723 PolarHBondContact O-N 3.45Å; S721-N723 VanDerWaalsContact O-N 3.17Å
724	S	40.9	Very low	41.2	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	79%	0.794	S	S	*	*			trans	65.1	58.5	166.1	-54.9	0	0	0	0	117	S726	S724-S726 PolarHBondContact O-N 3.3Å
725	E	38.3	Very low	40.9	Very low	177 Å²	177	145.7 Å²	145.7	83%	0.827	81%	0.807	S	S	*	*			trans	-75.2	102.7	140.8	-70.2	-174.1	132	0	0	107.5
726	S	41.4	Very low	40.9	Very low	92 Å²	92	146.3 Å²	146.3	64%	0.643	80%	0.798	S	S	*	*			trans	-124.9	89.1	174	-64.5	0	0	0	0	108.2	S724 S728	S724-S726 PolarHBondContact O-N 3.3Å; S726-S728 PolarHBondContact O-N 3.47Å
727	E	42.3	Very low	40.9	Very low	196 Å²	196	143.5 Å²	143.5	92%	0.916	79%	0.793	S	S	*	*			trans	-59.9	125.2	167.1	-63.6	-174.4	112.4	0	0	108.4
728	S	43.3	Very low	40.6	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	78%	0.784	S	S	*	*			trans	-131.7	88.9	175.5	-70.7	0	0	0	0	107.3	S726 S730	S726-S728 PolarHBondContact O-N 3.47Å; S728-S730 PolarHBondContact O-N 3.21Å
729	E	42.9	Very low	41	Very low	198 Å²	198	146.7 Å²	146.7	93%	0.925	79%	0.785	S	S	*	*			trans	-58.4	136.3	171.3	-68.7	-166.6	103.8	0	0	109.9
730	S	40.4	Very low	41	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	78%	0.776	S	S	*	*			trans	-85.7	128.3	-173.2	58.9	0	0	0	0	111.8	S728	S728-S730 PolarHBondContact O-N 3.21Å
731	E	40.4	Very low	40.8	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.813	77%	0.773	S	S	*	*			trans	-150.1	121.5	143.5	-123.8	169.9	-145.8	0	0	114.6
732	Q	42.5	Very low	40.7	Very low	160 Å²	160	146.2 Å²	146.2	75%	0.748	78%	0.781	S	S	*	*			trans	18.6	120.2	150.9	-51.8	175.2	11.6	0	0	117.7
733	N	39.3	Very low	40.6	Very low	153 Å²	153	145.7 Å²	145.7	82%	0.818	78%	0.782	S	S	*	*				-163.4	165.6	73.5	-99.9	-75.5	0	0	0	115
734	V	40.2	Very low	40.5	Very low	121 Å²	121	147 Å²	147	73%	0.733	79%	0.788	S	S	*	*			trans	-108.7	140.9	-176.3	171.7	0	0	0	0	111.1
735	L	37.4	Very low	40.5	Very low	173 Å²	173	146.8 Å²	146.8	91%	0.906	79%	0.787	S	S	*	*			trans	-155.7	115.8	144.2	-114.1	164.6	0	0	0	112
736	E	41.7	Very low	40.6	Very low	147 Å²	147	141.5 Å²	141.5	69%	0.687	78%	0.78	S	S	*	*			trans	-81.7	175.9	175.4	-61.3	-175.9	99.9	0	0	113.2
737	S	39.9	Very low	40.6	Very low	98 Å²	98	144.6 Å²	144.6	69%	0.685	79%	0.788	S	S	*	*			trans	105.5	144.5	132.7	81.7	0	0	0	0	118.2
738	K	37.2	Very low	40.5	Very low	173 Å²	173	142.6 Å²	142.6	75%	0.752	78%	0.782	S	S	*	*			cis	-158.8	154.7	-5.5	-120	157.1	-157	145.7	0	111.7
739	L	42.6	Very low	40.7	Very low	147 Å²	147	143 Å²	143	77%	0.77	78%	0.782	S	S	*	*			trans	-80	161.5	163.6	-80.5	81.4	0	0	0	111.5	T741	L739-T741 HydrophobicContact CD2-CG2 4.14Å
740	P	40.7	Very low	40.6	Very low	115 Å²	115	136.5 Å²	136.5	75%	0.747	77%	0.769	S	S	*	*				-142.6	140.2	102	37.2	-23.2	0	0	0	113.3
741	T	39.2	Very low	40.5	Very low	111 Å²	111	138.4 Å²	138.4	68%	0.681	77%	0.77	S	S	*	*				63.5	126.4	54.5	65.1	0	0	0	0	117.4	L739	L739-T741 HydrophobicContact CD2-CG2 4.14Å
742	N	39	Very low	40.9	Very low	170 Å²	170	136.2 Å²	136.2	91%	0.909	77%	0.768	S	S	*	*			trans	-155.8	157.3	150.2	-119.2	-37.6	0	0	0	111.1
743	K	42	Very low	41.3	Very low	181 Å²	181	133 Å²	133	79%	0.787	76%	0.762	S	S	*	*			trans	-141.5	157.2	-169.2	-67.3	-173.9	177.9	-175	0	113.4
744	L	39	Very low	41.4	Very low	168 Å²	168	133 Å²	133	88%	0.88	76%	0.761	S	S	*	*			trans	-169.5	131.9	144	-91.4	136.1	0	0	0	106.5
745	S	40.9	Very low	41.6	Very low	105 Å²	105	134.5 Å²	134.5	73%	0.734	77%	0.765	S	S	*	*			cis	78.4	124.6	26.1	-50.5	0	0	0	0	114.5
746	G	40.9	Very low	42.1	Very low	67 Å²	67	131.2 Å²	131.2	69%	0.691	75%	0.752	S	S	*	*			cis	158.7	-177.2	-7	0	0	0	0	0	113.2
747	I	39.7	Very low	42.1	Very low	157 Å²	157	132.3 Å²	132.3	81%	0.805	76%	0.755	S	S	*	*			trans	78.4	121.5	161.9	-55.8	169.6	0	0	0	115
748	L	40.4	Very low	42.2	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	75%	0.753	S	S	*	*			cis	90.6	166.1	43	-68	166.9	0	0	0	113.7
749	P	48.3	Very low	42.3	Very low	118 Å²	118	131.6 Å²	131.6	77%	0.766	75%	0.747	S	S	*	*				-142.2	-169.9	-51.3	43.1	-26.1	0	0	0	115
750	G	41	Very low	42	Very low	62 Å²	62	134.2 Å²	134.2	64%	0.639	75%	0.748	S	S	*	*			trans	94.2	156.3	156.3	0	0	0	0	0	118.2
751	D	38.7	Very low	41.8	Very low	153 Å²	153	134.2 Å²	134.2	82%	0.818	75%	0.746	S	S	*	*			cis	-168.5	148	-3.8	-102.6	-21.4	0	0	0	113
752	V	48.5	Very low	41.7	Very low	128 Å²	128	133.1 Å²	133.1	78%	0.776	74%	0.743	S	S	*	*			trans	66.8	145.8	136.8	167.9	0	0	0	0	121.2
753	P	50.9	Low	41.6	Very low	94 Å²	94	132.7 Å²	132.7	61%	0.61	74%	0.735	S	S	*	*			cis	-145.7	-162.9	-32.2	45.5	-24.4	0	0	0	115.5
754	D	41.5	Very low	41.3	Very low	151 Å²	151	130.5 Å²	130.5	81%	0.807	73%	0.732	S	S	*	*			trans	35.4	144.5	147.4	-49.5	-28.3	0	0	0	122.5
755	D	45.2	Very low	40.9	Very low	153 Å²	153	128 Å²	128	82%	0.818	73%	0.728	S	S	*	*				-178	179.6	55.2	-162.9	-2	0	0	0	112.7
756	V	46.3	Very low	40.8	Very low	105 Å²	105	128.9 Å²	128.9	64%	0.636	73%	0.732	S	S	*	*			trans	75.9	91.2	155.3	178.5	0	0	0	0	121.6
757	K	42.4	Very low	40.3	Very low	169 Å²	169	130.8 Å²	130.8	74%	0.735	74%	0.735	S	S	*	*				73.4	133.9	115.4	-76	174.9	159.4	-169.5	0	126.7
758	H	42.3	Very low	40.1	Very low	140 Å²	140	129.3 Å²	129.3	65%	0.648	73%	0.728	S	S	*	*			trans	88.4	119.8	132.9	-78.1	-57.8	0	0	0	123.7
759	D	38.4	Very low	40	Very low	117 Å²	117	128.5 Å²	128.5	63%	0.626	72%	0.721	S	S	*	*				101.3	110.1	124.3	-73.3	7.9	0	0	0	124.1
760	Y	36.8	Very low	39.3	Very low	201 Å²	201	128.5 Å²	128.5	79%	0.788	71%	0.714	S	S	*	*			trans	73.5	118.7	132.2	-80.8	-64.6	0	0	0	123.3
761	T	37.3	Very low	39.2	Very low	115 Å²	115	132.7 Å²	132.7	71%	0.706	72%	0.722	S	S	*	*				103.3	130.4	126.3	-64.5	0	0	0	0	120.9
762	S	37	Very low	39.2	Very low	88 Å²	88	133.7 Å²	133.7	62%	0.615	72%	0.719	S	S	*	*			trans	78	103.1	153.9	-78.6	0	0	0	0	123.2
763	Q	35.7	Very low	38.7	Very low	162 Å²	162	134.1 Å²	134.1	76%	0.757	72%	0.716	S	S	*	*				76.2	147.3	112	-72.5	-169.8	-44.7	0	0	122.5
764	N	36.2	Very low	38.4	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	72%	0.722	S	S	*	*			trans	78.5	93.5	153.7	-56.4	-24.5	0	0	0	120
765	S	30.2	Very low	38.2	Very low	115 Å²	115	134.4 Å²	134.4	80%	0.804	72%	0.721	S	S	*	*				-64.9	153.8	121.5	-40.1	0	0	0	0	108.8
766	P	39.6	Very low	38.2	Very low	124 Å²	124	130.6 Å²	130.6	81%	0.805	72%	0.718	S	S	*	*				-150.6	-159.5	81.1	42.6	-23.6	0	0	0	114
767	S	31.1	Very low	37.5	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	73%	0.731	S	S	*	*			trans	-82.6	157.8	-172.7	57.5	0	0	0	0	116.7
768	N	34.9	Very low	37.5	Very low	125 Å²	125	129.6 Å²	129.6	67%	0.668	74%	0.736	S	S	*	*			trans	92.7	129.4	138	-143.6	31.3	0	0	0	121.6
769	E	37.1	Very low	37.1	Very low	137 Å²	137	132.2 Å²	132.2	64%	0.64	75%	0.746	S	S	*	*			trans	60.9	136.7	141.7	-96	172.9	-114.5	0	0	125.2
770	N	35	Very low	37	Very low	118 Å²	118	135.7 Å²	135.7	63%	0.631	76%	0.756	S	S	*	*			trans	95.2	145	130.5	-76.9	-26.6	0	0	0	123.1
771	N	38.6	Very low	37.1	Very low	149 Å²	149	134.3 Å²	134.3	80%	0.797	76%	0.756	S	S	*	*			trans	79.7	152.5	160.9	-60.8	-52.8	0	0	0	116.4
772	K	38.8	Very low	36.7	Very low	174 Å²	174	135.5 Å²	135.5	76%	0.757	76%	0.764	S	S	*	*			cis	-161.9	162.7	22.7	-153.6	-178	-179.9	180	0	113.3
773	I	38.6	Very low	36.8	Very low	138 Å²	138	135.8 Å²	135.8	71%	0.708	77%	0.771	S	S	*	*			trans	61.1	149.9	163.5	24.9	-179.5	0	0	0	117.1
774	V	42.8	Very low	36.5	Very low	124 Å²	124	136 Å²	136	75%	0.752	77%	0.772	S	S	*	*			cis	-136.2	115.6	14.1	178.1	0	0	0	0	109.2
775	T	38.3	Very low	36.5	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	77%	0.77	S	S	*	*				63.7	118.1	95	-40.4	0	0	0	0	117.7
776	G	45.2	Very low	36.9	Very low	74 Å²	74	137.6 Å²	137.6	76%	0.763	76%	0.761	S	S	*	*			trans	179.3	111.6	165.7	0	0	0	0	0	113.1
777	N	32.3	Very low	36.8	Very low	171 Å²	171	138.4 Å²	138.4	91%	0.914	76%	0.758	S	S	*	*			trans	-106.7	144.7	-174.2	-71.1	-24.3	0	0	0	112.8
778	G	40.8	Very low	37	Very low	81 Å²	81	141 Å²	141	84%	0.835	76%	0.758	S	S	*	*			trans	-154.9	123.5	168.2	0	0	0	0	0	112.4
779	K	34.7	Very low	37.2	Very low	196 Å²	196	143.3 Å²	143.3	85%	0.852	77%	0.765	S	S	*	*			trans	-105.6	171.8	173.3	-82.4	-175.1	174.7	-179.3	0	110.6
780	F	37	Very low	37.2	Very low	190 Å²	190	145 Å²	145	83%	0.833	77%	0.77	S	S	*	*			trans	124.6	142.8	164.1	-64.5	-50.5	0	0	0	110.7
781	Q	37.7	Very low	37.5	Very low	172 Å²	172	148.2 Å²	148.2	80%	0.804	78%	0.781	S	S	*	*			cis	-149.3	172.8	1.7	-133.1	161.7	37.8	0	0	111.4
782	T	29.1	Very low	37.2	Very low	140 Å²	140	145.8 Å²	145.8	86%	0.859	78%	0.775	S	S	*	*			trans	-129.3	130.7	-173.8	-48.8	0	0	0	0	112.6
783	A	38.3	Very low	37.2	Very low	93 Å²	93	148.5 Å²	148.5	77%	0.769	78%	0.782	S	S	*	*			trans	-155.1	133.8	158.5	0	0	0	0	0	106.7
784	Q	30.9	Very low	36.8	Very low	168 Å²	168	147.3 Å²	147.3	79%	0.785	79%	0.787	S	S	*	*			cis	73.5	94.9	22.1	-160.7	-173.4	86.8	0	0	115.6
785	E	36.5	Very low	36.5	Very low	143 Å²	143	147 Å²	147	67%	0.668	79%	0.79	S	S	*	*				-168.1	126.2	112.8	-93.7	-160	133.8	0	0	109.1
786	K	37	Very low	36.2	Very low	139 Å²	139	146 Å²	146	60%	0.604	79%	0.788	S	S	*	*				67.4	113.8	90.9	-65.9	-176.1	-159.6	156.3	0	115.9
787	N	39.2	Very low	35.9	Very low	141 Å²	141	149.4 Å²	149.4	75%	0.754	79%	0.787	S	S	*	*				170.2	113.1	119.4	-81.2	-23.7	0	0	0	107.9
788	H	34.1	Very low	35.9	Very low	162 Å²	162	149.3 Å²	149.3	75%	0.75	78%	0.781	S	S	*	*				72.3	94.4	75.9	-78.1	-69.3	0	0	0	114.3
789	E	39.9	Very low	35.8	Very low	173 Å²	173	153.8 Å²	153.8	81%	0.808	78%	0.78	S	S	*	*				-152.3	150.3	123.1	-163.6	78.2	-94.9	0	0	107.4
790	K	36.2	Very low	36	Very low	174 Å²	174	153.3 Å²	153.3	76%	0.757	78%	0.778	S	S	*	*			trans	-139.8	127.8	173.2	-67.9	179.5	-178.6	176.6	0	109.5
791	H	40.6	Very low	35.8	Very low	184 Å²	184	149.8 Å²	149.8	85%	0.852	78%	0.777	S	S	*	*			trans	-140	122.4	155.5	-87.5	-70.4	0	0	0	111.9
792	S	32.5	Very low	35.9	Very low	98 Å²	98	149.1 Å²	149.1	69%	0.685	77%	0.771	S	S	*	*			trans	-111	131.7	-179	-50.4	0	0	0	0	110.5
793	Y	39.7	Very low	36	Very low	231 Å²	231	154.1 Å²	154.1	91%	0.906	77%	0.774	S	S	*	*			trans	-162.3	104.3	151	-88.9	-69.2	0	0	0	106.1
794	S	30.8	Very low	36	Very low	114 Å²	114	158.6 Å²	158.6	80%	0.797	77%	0.773	S	S	*	*			cis	75.7	88.9	40.2	-158.7	0	0	0	0	114.3
795	S	35.9	Very low	36.2	Very low	118 Å²	118	158.8 Å²	158.8	83%	0.825	77%	0.771	S	S	*	*			trans	-153.8	135.3	145.5	-173	0	0	0	0	108.7
796	S	31.9	Very low	36.4	Very low	104 Å²	104	158.9 Å²	158.9	73%	0.727	78%	0.776	S	S	*	*			trans	-143.4	139.8	176.9	89.1	0	0	0	0	110.2
797	I	37.9	Very low	36.4	Very low	145 Å²	145	159.1 Å²	159.1	74%	0.744	78%	0.779	S	S	*	*			trans	-130.3	97.7	170.2	-58.9	-176.8	0	0	0	109.2	Q799	I797-Q799 HydrophobicContact CG2-CG 4.33Å
798	H	33.3	Very low	36.4	Very low	169 Å²	169	161.2 Å²	161.2	78%	0.782	78%	0.782	S	S	*	*			trans	-72.8	124.2	160.7	-86.5	-50.9	0	0	0	110.3
799	Q	38.5	Very low	36.8	Very low	176 Å²	176	162.3 Å²	162.3	82%	0.822	79%	0.787	S	S	*	*			trans	-132.8	94.5	148.9	-64.1	-166.9	11.7	0	0	107.7	I797	I797-Q799 HydrophobicContact CG2-CG 4.33Å
800	K	39.7	Very low	36.8	Very low	186 Å²	186	159.7 Å²	159.7	81%	0.809	78%	0.783	S	S	*	*				55	94	81.4	-71.6	-167.9	172.6	176.9	0	113.5	K802	K800-K802 PolarHBondContact O-N 3.08Å
801	S	31.8	Very low	37	Very low	116 Å²	116	157.7 Å²	157.7	81%	0.811	78%	0.781	S	S	*	*			trans	-46.4	130	161.5	174.7	0	0	0	0	112.3
802	K	39.6	Very low	37	Very low	157 Å²	157	157.1 Å²	157.1	68%	0.683	78%	0.781	S	S	*	*			trans	-142.5	112.8	154	-75.6	-161.9	177.9	-174.7	0	109.5	K800 Y804	K800-K802 PolarHBondContact O-N 3.08Å; K802-Y804 HydrophobicContact CB-CD2 4.24Å; K802-Y804 HydrophobicContact CB-CE2 4.21Å; K802-Y804 HydrophobicContact CD-CD2 4.39Å; K802-Y804 HydrophobicContact CD-CE2 3.56Å; K802-Y804 PolarHBondContact NZ-OH 3.04Å; K802-Y804 PolarHBondContact O-N 3.03Å
803	R	32	Very low	37.2	Very low	245 Å²	245	156.8 Å²	156.8	93%	0.925	78%	0.784	S	S	*	*			trans	-69.9	124.2	156.5	-72.2	-178.6	177.4	174	-0.8	107.6
804	Y	38.4	Very low	37.3	Very low	188 Å²	188	152 Å²	152	74%	0.737	78%	0.779	S	S	*	*			trans	-110.1	151.5	158.7	-89.5	-75.8	0	0	0	110	K802	K802-Y804 HydrophobicContact CB-CD2 4.24Å; K802-Y804 HydrophobicContact CB-CE2 4.21Å; K802-Y804 HydrophobicContact CD-CD2 4.39Å; K802-Y804 HydrophobicContact CD-CE2 3.56Å; K802-Y804 PolarHBondContact NZ-OH 3.04Å; K802-Y804 PolarHBondContact O-N 3.03Å
805	K	34.9	Very low	37.6	Very low	171 Å²	171	152.2 Å²	152.2	74%	0.743	78%	0.775	S	S	*	*			trans	-144.4	124.3	-174.1	-178.8	-159.1	178.7	-152.7	0	107.1
806	N	39.5	Very low	38	Very low	145 Å²	145	154.5 Å²	154.5	78%	0.775	78%	0.776	S	S	*	*			trans	-148.9	136.7	168.4	-84.2	-18.2	0	0	0	103.8
807	E	38.3	Very low	38.1	Very low	144 Å²	144	154.6 Å²	154.6	67%	0.673	78%	0.777	S	S	*	*			cis	63.9	118.1	47.7	-60.3	-168.3	-150.2	0	0	110.9
808	K	39.2	Very low	38.2	Very low	186 Å²	186	159.8 Å²	159.8	81%	0.809	79%	0.787	S	S	*	*			cis	-125.3	-176	12.2	-97.8	160.7	-173.1	175.1	0	109.5
809	E	42.3	Very low	38.3	Very low	184 Å²	184	156.4 Å²	156.4	86%	0.86	78%	0.782	S	S	*	*			cis	-161.4	162.8	45.3	-166.1	157.2	-151.4	0	0	113.4
810	T	39	Very low	38.1	Very low	118 Å²	118	160 Å²	160	72%	0.724	79%	0.788	S	S	*	*			trans	-80.6	165.5	179.1	39.9	0	0	0	0	110.9
811	D	40.4	Very low	38	Very low	133 Å²	133	155.9 Å²	155.9	71%	0.711	78%	0.783	S	S	*	*				-170.7	172.8	58.2	-136.9	-40.4	0	0	0	115.5
812	M	41.2	Very low	38.3	Very low	171 Å²	171	160.2 Å²	160.2	84%	0.842	79%	0.787	S	S	*	*			trans	56.8	124.8	161.2	-64.6	-169.9	-66.7	0	0	118.5
813	A	36.8	Very low	38.3	Very low	91 Å²	91	159.9 Å²	159.9	75%	0.752	79%	0.788	S	S	*	*			cis	-177.1	176.7	17.2	0	0	0	0	0	111.3
814	V	41.6	Very low	38.4	Very low	132 Å²	132	153.3 Å²	153.3	80%	0.8	78%	0.78	S	S	*	*			trans	69.9	90.2	164.5	-164.1	0	0	0	0	118.5
815	T	38.2	Very low	38.8	Very low	117 Å²	117	151.3 Å²	151.3	72%	0.718	78%	0.777	S	S	*	*			trans	-18.6	143.2	143.4	48.5	0	0	0	0	116.3
816	I	44	Very low	39.1	Very low	166 Å²	166	153.2 Å²	153.2	85%	0.851	79%	0.785	S	S	*	*				-135.8	132.5	61.8	-71.9	152.5	0	0	0	112.4
817	S	34.6	Very low	39.3	Very low	106 Å²	106	157.3 Å²	157.3	74%	0.741	79%	0.79	S	S	*	*			trans	-115.1	138.6	173.6	-61.4	0	0	0	0	111.3
818	R	39	Very low	39.4	Very low	255 Å²	255	161 Å²	161	96%	0.962	80%	0.797	S	S	*	*			trans	-138.6	91	165.4	-145.9	173.1	-168.2	174.7	3.9	111.6
819	S	36.1	Very low	39.5	Very low	97 Å²	97	158 Å²	158	68%	0.678	80%	0.795	S	S	*	*			trans	-97	163.1	-174.1	-43.1	0	0	0	0	112.7
820	R	34.2	Very low	39.6	Very low	251 Å²	251	157.6 Å²	157.6	95%	0.947	80%	0.799	S	S	*	*			trans	74.1	146.7	175.3	-51.5	172.5	174.9	179.3	-3.1	112.8
821	S	37.4	Very low	39.4	Very low	101 Å²	101	157.2 Å²	157.2	71%	0.706	80%	0.801	S	S	*	*			cis	-146.4	158.4	28.3	-165.7	0	0	0	0	113.9
822	K	37.6	Very low	39.6	Very low	206 Å²	206	161.7 Å²	161.7	90%	0.896	81%	0.808	S	S	*	*			trans	-78.7	126.5	160.3	-69.7	-172.6	177.6	-173.9	0	108.3
823	H	39	Very low	39.6	Very low	150 Å²	150	161.3 Å²	161.3	69%	0.694	80%	0.804	S	S	*	*			trans	-136.4	118.9	169.1	-121.5	-54.4	0	0	0	111.7	H825	H823-H825 AromaticContact ND1-CE1 3.81Å; H823-H825 AromaticContact ND1-ND1 3.78Å
824	S	34.6	Very low	39.7	Very low	108 Å²	108	162.2 Å²	162.2	76%	0.755	80%	0.804	S	S	*	*			trans	-75.6	140.2	157.4	54.4	0	0	0	0	108.9
825	H	47.3	Very low	39.9	Very low	145 Å²	145	164.5 Å²	164.5	67%	0.671	81%	0.806	S	S	*	*			trans	-127.9	74.9	176.5	-95.3	13.5	0	0	0	111.3	H823 R827	H823-H825 AromaticContact ND1-CE1 3.81Å; H823-H825 AromaticContact ND1-ND1 3.78Å; H825-R827 PolarHBondContact O-N 3.04Å
826	K	40.8	Very low	39.9	Very low	211 Å²	211	169.2 Å²	169.2	92%	0.917	81%	0.811	S	S	*	*			trans	-73.5	76.1	164.3	-167	171.1	-171.5	170.9	0	108.7	R828	K826-R828 PolarHBondContact O-N 3.27Å
827	R	43.2	Very low	39.9	Very low	231 Å²	231	167.1 Å²	167.1	87%	0.872	81%	0.811	S	S	*	*			trans	-84.3	107.3	-170.3	-146.8	176.4	-169.9	-165.5	2.1	111.2	H825	H825-R827 PolarHBondContact O-N 3.04Å
828	R	41.9	Very low	40.2	Very low	222 Å²	222	172.3 Å²	172.3	84%	0.838	81%	0.814	S	S	*	*			trans	-92.7	159.3	175.6	-141	-178.8	-176.5	-176.6	0.1	110.2	K826	K826-R828 PolarHBondContact O-N 3.27Å
829	T	40.1	Very low	40.2	Very low	123 Å²	123	168.6 Å²	168.6	76%	0.755	81%	0.805	S	S	*	*			trans	53.6	117.5	163.1	55.7	0	0	0	0	118.9
830	N	43.7	Very low	40.6	Very low	176 Å²	176	174.9 Å²	174.9	94%	0.941	81%	0.814	S	S	*	*				-146.3	124.9	128.2	-120	-12.4	0	0	0	109.7
831	S	35.6	Very low	40.9	Very low	110 Å²	110	168.7 Å²	168.7	77%	0.769	80%	0.799	S	S	*	*			trans	-129.7	119.8	179.2	174.4	0	0	0	0	109.5
832	R	44.2	Very low	41.1	Very low	226 Å²	226	173 Å²	173	85%	0.853	81%	0.806	S	S	*	*			trans	171.1	123.3	169.9	-96.2	151.6	-173.3	-157.3	1.8	105.6
833	H	42.4	Very low	41.2	Very low	164 Å²	164	174.9 Å²	174.9	76%	0.759	81%	0.807	S	S	*	*			cis	-154	155.2	45.8	-83.6	-68.8	0	0	0	112
834	S	38.3	Very low	41.3	Very low	110 Å²	110	171 Å²	171	77%	0.769	81%	0.808	S	S	*	*			trans	-109.2	137.2	166	56.1	0	0	0	0	110.5
835	H	46	Very low	41.6	Very low	180 Å²	180	172.1 Å²	172.1	83%	0.833	82%	0.815	S	S	*	*			trans	-122.9	124.9	167.5	-83.8	-89	0	0	0	110.3
836	R	38.5	Very low	41.2	Very low	215 Å²	215	170.9 Å²	170.9	81%	0.811	82%	0.823	S	S	*	*			trans	-83.5	133.9	178.5	-77.8	169.1	151.5	177	-5.7	111.1
837	S	42.9	Very low	41.2	Very low	122 Å²	122	167.2 Å²	167.2	85%	0.853	82%	0.818	S	S	*	*			trans	-145.7	92.3	146.9	-79.7	0	0	0	0	108
838	R	42.5	Very low	41	Very low	216 Å²	216	160.4 Å²	160.4	82%	0.815	81%	0.812	S	S	*	*				59.4	82.5	80.4	-77.7	-170.9	162.9	176.4	-4.3	115.4
839	K	38.7	Very low	40.7	Very low	176 Å²	176	155 Å²	155	77%	0.765	81%	0.808	S	S	*	*				59.9	116.9	117.5	-172	178.2	-175.1	175.8	0	118.8	D841	K839-D841 VanDerWaalsContact CE-OD2 3.29Å; K839-D841 WeakPolarHBondContact CE-OD2 3.46Å
840	R	43.8	Very low	40.7	Very low	230 Å²	230	153.9 Å²	153.9	87%	0.868	81%	0.805	S	S	*	*			trans	-156.5	116.3	138.6	-147.4	175	-60.5	173.8	4.7	111.6
841	D	39.6	Very low	40.5	Very low	121 Å²	121	154.2 Å²	154.2	65%	0.647	80%	0.801	S	S	*	*			trans	-95.2	132.6	174.1	-38.1	-86.6	0	0	0	109.1	K839	K839-D841 VanDerWaalsContact CE-OD2 3.29Å; K839-D841 WeakPolarHBondContact CE-OD2 3.46Å
842	F	42.1	Very low	40.5	Very low	192 Å²	192	153.6 Å²	153.6	84%	0.842	80%	0.796	S	S	*	*			trans	-155.9	78.8	168	-113.9	-71.6	0	0	0	115.5
843	R	40.1	Very low	40.1	Very low	245 Å²	245	148.1 Å²	148.1	93%	0.925	79%	0.793	S	S	*	*				28.6	119.2	128.5	-162.2	-178.1	-144.6	-108.7	4	120.3
844	G	41.7	Very low	40.2	Very low	68 Å²	68	145.4 Å²	145.4	70%	0.701	79%	0.793	S	S	*	*			trans	148.8	145.8	155.8	0	0	0	0	0	112.6
845	S	40.1	Very low	40.3	Very low	131 Å²	131	144.8 Å²	144.8	92%	0.916	79%	0.788	S	S	*	*			cis	-156.1	164.8	-9.2	-79	0	0	0	0	110.1
846	S	38.2	Very low	40	Very low	119 Å²	119	142.2 Å²	142.2	83%	0.832	78%	0.78	S	S	*	*			trans	-95.7	149.9	-170.9	-39.6	0	0	0	0	115.4
847	T	41.5	Very low	40.3	Very low	134 Å²	134	140.3 Å²	140.3	82%	0.822	78%	0.781	S	S	*	*			trans	-154.1	119.8	148.8	32.2	0	0	0	0	106.6
848	A	39.4	Very low	40.1	Very low	88 Å²	88	137.9 Å²	137.9	73%	0.727	77%	0.774	S	S	*	*				69.7	133.6	72.8	0	0	0	0	0	113
849	S	35.1	Very low	40	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	77%	0.773	S	S	*	*			cis	148.9	105.6	-21.9	53.3	0	0	0	0	107.9
850	S	40.1	Very low	40.1	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	77%	0.773	S	S	*	*			trans	-162	129.1	170.7	7.5	0	0	0	0	107.3
851	E	39.2	Very low	39.9	Very low	184 Å²	184	131.7 Å²	131.7	86%	0.86	77%	0.769	S	S	*	*				71.5	140	82.9	-66.5	170.8	151	0	0	114.1
852	S	36.7	Very low	39.9	Very low	96 Å²	96	132.5 Å²	132.5	67%	0.671	78%	0.778	S	S	*	*			cis	-168.7	148	-16.8	59.4	0	0	0	0	112.5
853	S	35.4	Very low	39.7	Very low	111 Å²	111	126.6 Å²	126.6	78%	0.776	77%	0.772	S	S	*	*			trans	61.8	165.6	137.1	-60.5	0	0	0	0	123.7
854	S	43.3	Very low	39.5	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	77%	0.773	S	S	*	*			trans	73.1	117.3	176.7	72.4	0	0	0	0	115.4
855	S	40.4	Very low	39.2	Very low	96 Å²	96	125.8 Å²	125.8	67%	0.671	77%	0.766	S	S	*	*				81.7	140	53.7	85.3	0	0	0	0	112.6
856	N	41.2	Very low	39.1	Very low	126 Å²	126	130 Å²	130	67%	0.674	76%	0.762	S	S	*	*			cis	-159.4	-173.3	34	-127.3	-18.2	0	0	0	114.6
857	H	43.8	Very low	39.3	Very low	176 Å²	176	132.5 Å²	132.5	82%	0.815	76%	0.758	S	S	*	*			trans	-29.7	158.9	172.2	-45	-67.5	0	0	0	119.1
858	G	40.1	Very low	39.1	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	75%	0.745	S	S	*	*			cis	147.3	166.4	-5.2	0	0	0	0	0	114.8
859	N	40.4	Very low	39.1	Very low	149 Å²	149	136.6 Å²	136.6	80%	0.797	75%	0.752	S	S	*	*			trans	59.4	127.4	158.3	-83.9	-13.6	0	0	0	123.6
860	Q	40.3	Very low	39.3	Very low	160 Å²	160	136.6 Å²	136.6	75%	0.748	75%	0.752	S	S	*	*			trans	79.2	105.6	136.3	-67.3	-177.8	51.4	0	0	123
861	K	38.6	Very low	39.2	Very low	183 Å²	183	136.8 Å²	136.8	80%	0.796	75%	0.753	S	S	*	*				67.4	136.8	102.6	-148.7	-162.1	179.1	179.6	0	120.5
862	V	41	Very low	39.4	Very low	138 Å²	138	131.6 Å²	131.6	84%	0.836	74%	0.742	S	S	*	*			trans	74.3	138.9	165	-157.8	0	0	0	0	116.6
863	G	36.7	Very low	39.6	Very low	69 Å²	69	133.5 Å²	133.5	71%	0.711	74%	0.744	S	S	*	*			trans	139.2	99.3	149.6	0	0	0	0	0	117
864	F	35.4	Very low	39.8	Very low	216 Å²	216	135.6 Å²	135.6	95%	0.947	74%	0.742	S	S	*	*			trans	-70	147.3	150.1	-71.3	-100.6	0	0	0	109
865	S	36.4	Very low	39.8	Very low	79 Å²	79	136.9 Å²	136.9	55%	0.552	74%	0.739	S	S	*	*				163.8	105.4	124.5	172.2	0	0	0	0	116.2
866	R	39	Very low	39.8	Very low	220 Å²	220	141 Å²	141	83%	0.83	74%	0.744	S	S	*	*			trans	63.6	176.6	133.6	-55.8	174.8	-178.5	173.7	1	120
867	F	41.2	Very low	39.7	Very low	171 Å²	171	141.8 Å²	141.8	75%	0.75	75%	0.749	S	S	*	*			trans	75	133	168.8	-53.3	-85.2	0	0	0	116
868	S	38.7	Very low	39.4	Very low	80 Å²	80	138.9 Å²	138.9	56%	0.559	74%	0.743	S	S	*	*			cis	-160.2	148.6	-14.9	-112.7	0	0	0	0	109.2
869	R	38.4	Very low	39.4	Very low	228 Å²	228	146.3 Å²	146.3	86%	0.86	75%	0.749	S	S	*	*				44.5	128.8	93.7	-45.8	175	70.4	-155.6	2.9	112.1
870	S	38.6	Very low	39.1	Very low	108 Å²	108	144.3 Å²	144.3	76%	0.755	75%	0.747	S	S	*	*			cis	-170.6	-172.1	34.4	56.2	0	0	0	0	109.1
871	S	39.6	Very low	39.4	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	74%	0.744	S	S	*	*			cis	-164.3	169.7	12	-150	0	0	0	0	112.3
872	A	42.8	Very low	39.6	Very low	75 Å²	75	141.9 Å²	141.9	62%	0.62	75%	0.745	S	S	*	*			trans	64.2	131.7	158	0	0	0	0	0	118.3
873	D	40.8	Very low	39.6	Very low	136 Å²	136	141.2 Å²	141.2	73%	0.727	73%	0.732	S	S	*	*			cis	76.5	134	41.4	-59.8	-46	0	0	0	113.1
874	H	40.1	Very low	39.8	Very low	155 Å²	155	145.8 Å²	145.8	72%	0.718	73%	0.729	S	S	*	*			cis	-164.8	172.7	-4.7	-132.6	63.3	0	0	0	109.1
875	I	42.1	Very low	40.2	Very low	136 Å²	136	144.7 Å²	144.7	70%	0.697	72%	0.724	S	S	*	*			trans	72.8	108.5	153.3	-63.6	155.8	0	0	0	120.9
876	K	41.6	Very low	40.6	Very low	181 Å²	181	145 Å²	145	79%	0.787	73%	0.731	S	S	*	*				43.5	139.7	129.3	-50.8	178.5	-177.9	177.7	0	123.8
877	N	37.6	Very low	40.9	Very low	143 Å²	143	143.8 Å²	143.8	77%	0.765	73%	0.732	S	S	*	*			trans	86.8	115.7	137.8	-85.5	11.3	0	0	0	123.3
878	V	39.4	Very low	41	Very low	115 Å²	115	141.2 Å²	141.2	70%	0.697	74%	0.736	S	S	*	*				80.3	124.1	126.3	175.5	0	0	0	0	121
879	R	38.7	Very low	41.2	Very low	227 Å²	227	141.1 Å²	141.1	86%	0.857	74%	0.735	S	S	*	*			trans	67.6	115	158.9	-86.3	175	162.3	147.7	-5.7	120.7
880	S	35.5	Very low	41.6	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	73%	0.733	S	S	*	*				22.4	157.5	112.7	-47	0	0	0	0	121.2
881	P	46.4	Very low	41.9	Very low	106 Å²	106	138.3 Å²	138.3	69%	0.688	73%	0.731	S	S	*	*			cis	-144.7	178.7	-30.2	40.7	-23.4	0	0	0	115.5
882	K	42.6	Very low	42.7	Very low	186 Å²	186	142 Å²	142	81%	0.809	73%	0.734	S	S	*	*			trans	67.5	154.7	153.6	-80.6	-177.4	170.3	-176.2	0	117.5
883	H	40.7	Very low	42.8	Very low	124 Å²	124	146.7 Å²	146.7	57%	0.574	74%	0.742	S	S	*	*			cis	-166.7	168.2	-12	-138.7	-59.1	0	0	0	111.4
884	Y	41	Very low	43.2	Very low	165 Å²	165	145.7 Å²	145.7	65%	0.647	75%	0.746	S	S	*	*			trans	76.3	106.3	148.9	-77.8	-62.5	0	0	0	124.1
885	F	42.9	Very low	43.9	Very low	192 Å²	192	145.6 Å²	145.6	84%	0.842	75%	0.746	S	S	*	*			trans	59.3	168.3	134.6	-62.4	-170.5	0	0	0	118.4
886	A	44.6	Very low	44.7	Very low	85 Å²	85	148.7 Å²	148.7	70%	0.702	76%	0.756	S	S	*	*			cis	-158.9	-173	14.7	0	0	0	0	0	109.5
887	K	45.8	Very low	45.2	Very low	195 Å²	195	148.2 Å²	148.2	85%	0.848	75%	0.754	S	S	*	*			cis	-170.5	144.6	-7.3	-135.3	171	-176	176.8	0	111
888	S	42.5	Very low	46.2	Very low	118 Å²	118	146.5 Å²	146.5	83%	0.825	75%	0.754	S	S	*	*			trans	66.7	167.2	154.4	-113.2	0	0	0	0	119.7
889	S	43.1	Very low	47	Very low	77 Å²	77	148.4 Å²	148.4	54%	0.538	76%	0.755	S	S	.	*			cis	-154.9	175.1	8.2	36.7	0	0	0	0	114.9
890	H	47.4	Very low	47.8	Very low	176 Å²	176	149.6 Å²	149.6	82%	0.815	77%	0.769	S	S	*	*			trans	98.6	143.4	159.4	-46.5	-63.3	0	0	0	118.8
891	S	44.8	Very low	48.5	Very low	102 Å²	102	151.7 Å²	151.7	71%	0.713	77%	0.77	S	S	*	*			cis	-171	153.1	-30.6	-161.5	0	0	0	0	113.4
892	K	56.2	Low	48.6	Very low	182 Å²	182	154.1 Å²	154.1	79%	0.791	78%	0.775	S	S	*	*			trans	95.9	116.3	155.1	-58.2	-167.6	179.4	-177.1	0	122.1
893	H	45.1	Very low	48.9	Very low	173 Å²	173	152.3 Å²	152.3	80%	0.801	77%	0.773	S	S	*	*			trans	54.5	152.9	140.9	-67	-12.6	0	0	0	120.8
894	S	49.5	Very low	49.4	Very low	114 Å²	114	154 Å²	154	80%	0.797	78%	0.784	S	S	*	*			cis	-134.3	172.5	14.9	-162.6	0	0	0	0	113.8
895	H	54.2	Low	49.9	Very low	154 Å²	154	153.3 Å²	153.3	71%	0.713	79%	0.793	S	S	*	*			trans	-91.7	155.9	177.9	-63.8	-86.1	0	0	0	112.9
896	H	58.6	Low	50.4	Low	200 Å²	200	150.7 Å²	150.7	93%	0.926	79%	0.79	S	S	*	*				-150	159.7	123.1	-102	-74.4	0	0	0	109.9
897	K	53.3	Low	50.8	Low	171 Å²	171	155.4 Å²	155.4	74%	0.743	80%	0.796	S	S	*	*			trans	-155.7	124.2	-166.5	-177.8	-175.6	178.6	-172.4	0	112.7
898	S	58.7	Low	51.2	Low	107 Å²	107	152.4 Å²	152.4	75%	0.748	79%	0.792	S	S	*	*			trans	-159.7	110.8	162.5	47.8	0	0	0	0	106.3
899	H	55.9	Low	51.9	Low	155 Å²	155	155.3 Å²	155.3	72%	0.718	79%	0.789	S	S	*	*				44.9	90.8	75.1	-75.4	-70.8	0	0	0	112.5
900	H	56	Low	52.7	Low	252 Å²	252	162.4 Å²	162.4	100%	1.167	81%	0.812	S	S	*	*				-128.8	0	101.1	-146	-50.8	0	0	0	110

Retrieved 900 of 900 residues in 1004.2 ms (Link to these results)

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