A0A5K4FB36_SCHMA Loading...

Fork-head domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FB36, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 936 aa.

						>A0A5K4FB36_SCHMA|A0A5K4FB36
MFEYTSDYLAEKLRENWLIRNHSNEFIVNMEEYDDSLTNLNWLQTLNIHEFTSTTSPISPPPTPPLHLFHPIHNLYSSTSTSMTTLKSPSQKFHNYNTTLNNCKQKDVSLFNGLHHRNENNSTIPFVNYLKHRSYTSVSNHNNTTNTTDNNYVSSIALTNKQYKDSPLKCLNNTINFYSNSNPIQFDPIPVTMATNTMNNNNLNCQQLFNTVYMNPNDVNPMDNQQFSIYDLYNNNNNNHSLRNNNLSRFECHSSIQKLRKNDDNDVGNNIDEDDPQQQQQSINVTDINLLLNSSTTHIINPISSQVNSKKIFNHHHQNTTLIDYSNHYQYYITENNKLFVQYDQLSLHEKQIYQNNINYKPVFNSHTLIYMSMNGLKKYKITLKEIYEWIELHFDIIRKHLTSSRCFQRVSKRKEELDGHNDLWRLNSELHNQLLNHKISHKFLLLWQNQIYPKLPDLIDFIEYDTISSEINNYPRLNNDHNDDPDHDQVINDNHNNQSSKRRCINQIDHLSNFNIDQSSQSNSSTSSASELSDLYTNSSLDLLPVTTSDLTLLDHNNNYLNTSLNSIGLNDTIHSNNLLRNNLLCHSIQSLPFNVIEQEQYDLQGLFNEHETYSILNDHFYDRSTSSLSPFDLNDDHDNNTTTNTTTTSSSSTTTTNTTNTNTTTNTNGLFNEIPSLNDFDNDELLDPLDLTIHNMNSRLTHDWWLNNSSNVTQDNLSESMTNFINSTLNELERKEQEEVGVNDETAVERETDEVHQRINEQEDINRIKLHINPLSTEFLTNELLLNQTLSLLSSSSSSSSPTDLTILSPRLLSIMNPLDMIEPPSSTSSTSSTSTSSTLSASSTSSLSIPITCKYSKTNETNMNNEEDAFFHYLNKTKQNINDSISMNNINDPNDIQQENINNNTNQIDQIQNQHWIDHKMNLDDLDHILGLN
					

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(Predicted Aligned Error values between residue pairs)

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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	46.1	Very low	76.7	Confident	241 Å²	241	126.5 Å²	126.5	100%	1.187	64%	0.637	S	S	*	*				0	110.6	0	-171.7	172.8	-171.8	0	0	106.4
2	F	57.9	Low	77.7	Confident	188 Å²	188	122.8 Å²	122.8	83%	0.825	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-82.5	132	178.8	-71.4	-88.5	0	0	0	109	Y4	F2-Y4 PolarHBondContact O-N 3.44Å
3	E	66.8	Low	78.6	Confident	193 Å²	193	122.9 Å²	122.9	90%	0.902	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-74.6	116.4	166.2	-75	-175.6	131.8	0	0	108.2	T5	E3-T5 PolarHBondContact O-N 2.68Å
4	Y	82.1	Confident	79.2	Confident	143 Å²	143	122.6 Å²	122.6	56%	0.561	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-68.6	121.7	172	-66	-61	0	0	0	109.1	F2 Y8	F2-Y4 PolarHBondContact O-N 3.44Å; Y4-Y8 AromaticContact CD1-CD1 3.29Å; Y4-Y8 HydrophobicContact CD1-CD1 3.29Å; Y4-Y8 AromaticContact CD1-CE1 3.23Å; Y4-Y8 HydrophobicContact CD1-CE1 3.23Å; Y4-Y8 HydrophobicContact CD1-CG 4.03Å; Y4-Y8 AromaticContact CD1-CZ 3.94Å; Y4-Y8 HydrophobicContact CE1-CD1 4.03Å; Y4-Y8 AromaticContact CE1-CE1 3.47Å; Y4-Y8 HydrophobicContact CE1-CE1 3.47Å; Y4-Y8 VanDerWaalsContact CE1-CE1 3.47Å; Y4-Y8 AromaticContact CE1-CZ 3.83Å; Y4-Y8 AromaticContact CG-CD1 3.77Å; Y4-Y8 HydrophobicContact CG-CD1 3.77Å; Y4-Y8 AromaticContact CG-CE1 3.89Å; Y4-Y8 HydrophobicContact CG-CE1 3.89Å
5	T	83.2	Confident	79.6	Confident	78 Å²	78	120.7 Å²	120.7	48%	0.479	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-65.2	158.6	176.6	60.3	0	0	0	0	110.9	E3 D7 Y8 L9	E3-T5 PolarHBondContact O-N 2.68Å; T5-D7 PolarHBondContact O-N 3.03Å; T5-Y8 PolarHBondContact O-N 3.22Å; T5-Y8 PolarHBondContact OG1-N 3.37Å; T5-L9 WeakPolarHBondContact O-CG 3.28Å; T5-L9 PolarHBondContact O-N 3.06Å
6	S	79.1	Confident	79.8	Confident	96 Å²	96	118.3 Å²	118.3	67%	0.671	58%	0.583	S	S	*	*	H	α-helix	trans	-54	-37.3	173.4	-168.7	0	0	0	0	111.3	L9 A10	S6-L9 PolarHBondContact O-N 3.15Å; S6-A10 WeakPolarHBondContact O-CB 3.31Å; S6-A10 PolarHBondContact O-N 3.15Å
7	D	82.8	Confident	80	Confident	118 Å²	118	120.4 Å²	120.4	63%	0.631	58%	0.584	S	S	*	*	H	α-helix	trans	-67.9	-44.8	-179	-36.9	-56.2	0	0	0	111.1	T5 L9 A10 E11	T5-D7 PolarHBondContact O-N 3.03Å; D7-L9 VanDerWaalsContact C-N 3.31Å; D7-L9 PolarHBondContact O-N 3.09Å; D7-A10 PolarHBondContact O-N 3.49Å; D7-E11 WeakPolarHBondContact O-CB 3.46Å; D7-E11 PolarHBondContact O-N 3.4Å
8	Y	87	Confident	80.1	Confident	95 Å²	95	116.7 Å²	116.7	37%	0.373	57%	0.567	S	S	.	*	H	α-helix	trans	-61.5	-39.3	174.1	177.5	-88.2	0	0	0	112.1	Y4 T5 K12	Y4-Y8 AromaticContact CD1-CD1 3.29Å; Y4-Y8 HydrophobicContact CD1-CD1 3.29Å; Y4-Y8 AromaticContact CD1-CE1 3.23Å; Y4-Y8 HydrophobicContact CD1-CE1 3.23Å; Y4-Y8 HydrophobicContact CD1-CG 4.03Å; Y4-Y8 AromaticContact CD1-CZ 3.94Å; Y4-Y8 HydrophobicContact CE1-CD1 4.03Å; Y4-Y8 AromaticContact CE1-CE1 3.47Å; Y4-Y8 HydrophobicContact CE1-CE1 3.47Å; Y4-Y8 VanDerWaalsContact CE1-CE1 3.47Å; Y4-Y8 AromaticContact CE1-CZ 3.83Å; Y4-Y8 AromaticContact CG-CD1 3.77Å; Y4-Y8 HydrophobicContact CG-CD1 3.77Å; Y4-Y8 AromaticContact CG-CE1 3.89Å; Y4-Y8 HydrophobicContact CG-CE1 3.89Å; T5-Y8 PolarHBondContact O-N 3.22Å; T5-Y8 PolarHBondContact OG1-N 3.37Å; Y8-K12 HydrophobicContact CE1-CD 3.67Å; Y8-K12 WeakPolarHBondContact O-CB 3.47Å; Y8-K12 PolarHBondContact O-N 3.38Å; Y8-K12 PolarHBondContact OH-NZ 2.91Å
9	L	88.6	Confident	80.1	Confident	95 Å²	95	117.4 Å²	117.4	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-68.9	-36	177	-66.6	175.1	0	0	0	112	T5 S6 D7 L13	T5-L9 WeakPolarHBondContact O-CG 3.28Å; T5-L9 PolarHBondContact O-N 3.06Å; S6-L9 PolarHBondContact O-N 3.15Å; D7-L9 VanDerWaalsContact C-N 3.31Å; D7-L9 PolarHBondContact O-N 3.09Å; L9-L13 VanDerWaalsContact O-CB 3.22Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 PolarHBondContact O-N 3.44Å
10	A	84	Confident	79.9	Confident	57 Å²	57	121.9 Å²	121.9	47%	0.471	58%	0.583	S	S	.	*	H	α-helix	trans	-68.9	-45	174	0	0	0	0	0	112	S6 D7 K12 L13 R14	S6-A10 WeakPolarHBondContact O-CB 3.31Å; S6-A10 PolarHBondContact O-N 3.15Å; D7-A10 PolarHBondContact O-N 3.49Å; A10-K12 PolarHBondContact O-N 3.49Å; A10-L13 PolarHBondContact O-N 3.33Å; A10-R14 PolarHBondContact O-N 2.89Å
11	E	86	Confident	79.3	Confident	88 Å²	88	119.5 Å²	119.5	41%	0.411	57%	0.573	S	S	.	*	H	α-helix	trans	-56.3	-51.6	175.5	-160	71.9	-174.3	0	0	110.3	D7 L13 R14 E15	D7-E11 WeakPolarHBondContact O-CB 3.46Å; D7-E11 PolarHBondContact O-N 3.4Å; E11-L13 VanDerWaalsContact C-N 3.33Å; E11-L13 PolarHBondContact O-N 3.18Å; E11-R14 VanDerWaalsContact CD-NH2 3.26Å; E11-R14 WeakPolarHBondContact O-CB 3.32Å; E11-R14 PolarHBondContact O-N 3.36Å; E11-R14 VanDerWaalsContact O-N 3.15Å; E11-R14 IonicContact OE1-CZ 3.35Å; E11-R14 IonicContact OE1-NH1 3.16Å; E11-R14 PolarHBondContact OE1-NH1 3.26Å; E11-R14 VanDerWaalsContact OE1-NH1 3.16Å; E11-R14 IonicContact OE1-NH2 2.69Å; E11-R14 PolarHBondContact OE1-NH2 2.8Å; E11-R14 IonicContact OE2-CZ 3.52Å; E11-R14 IonicContact OE2-NH1 2.69Å; E11-R14 PolarHBondContact OE2-NH1 3.31Å; E11-R14 IonicContact OE2-NH2 3.64Å; E11-E15 WeakPolarHBondContact O-CG 3.25Å; E11-E15 PolarHBondContact O-N 3.33Å
12	K	89	Confident	79.7	Confident	82 Å²	82	112.7 Å²	112.7	36%	0.357	54%	0.538	S	S	.	.	H	α-helix	trans	-67.5	-30.1	179.3	-164.6	166.9	-164.9	165.9	0	113.1	Y8 A10 N16	Y8-K12 HydrophobicContact CE1-CD 3.67Å; Y8-K12 WeakPolarHBondContact O-CB 3.47Å; Y8-K12 PolarHBondContact O-N 3.38Å; Y8-K12 PolarHBondContact OH-NZ 2.91Å; A10-K12 PolarHBondContact O-N 3.49Å; K12-N16 WeakPolarHBondContact O-CB 3.44Å; K12-N16 PolarHBondContact O-N 2.75Å; K12-N16 PolarHBondContact O-ND2 2.78Å
13	L	89	Confident	79.1	Confident	124 Å²	124	107.3 Å²	107.3	65%	0.649	52%	0.524	S	S	*	.	H	α-helix	trans	-70.1	-41.5	171.9	-174.6	150.8	0	0	0	110.8	L9 A10 E11 N16 W17	L9-L13 VanDerWaalsContact O-CB 3.22Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 PolarHBondContact O-N 3.44Å; A10-L13 PolarHBondContact O-N 3.33Å; E11-L13 VanDerWaalsContact C-N 3.33Å; E11-L13 PolarHBondContact O-N 3.18Å; L13-N16 PolarHBondContact O-N 3.42Å; L13-W17 WeakPolarHBondContact O-CB 3.37Å; L13-W17 PolarHBondContact O-N 3.38Å
14	R	87.6	Confident	78.2	Confident	118 Å²	118	103.5 Å²	103.5	45%	0.445	51%	0.51	S	S	.	.	H	α-helix	trans	-60.1	-48.2	174.2	-167.4	-170.5	71.3	-126.5	-5.6	110.8	A10 E11 W17 L18	A10-R14 PolarHBondContact O-N 2.89Å; E11-R14 VanDerWaalsContact CD-NH2 3.26Å; E11-R14 WeakPolarHBondContact O-CB 3.32Å; E11-R14 PolarHBondContact O-N 3.36Å; E11-R14 VanDerWaalsContact O-N 3.15Å; E11-R14 IonicContact OE1-CZ 3.35Å; E11-R14 IonicContact OE1-NH1 3.16Å; E11-R14 PolarHBondContact OE1-NH1 3.26Å; E11-R14 VanDerWaalsContact OE1-NH1 3.16Å; E11-R14 IonicContact OE1-NH2 2.69Å; E11-R14 PolarHBondContact OE1-NH2 2.8Å; E11-R14 IonicContact OE2-CZ 3.52Å; E11-R14 IonicContact OE2-NH1 2.69Å; E11-R14 PolarHBondContact OE2-NH1 3.31Å; E11-R14 IonicContact OE2-NH2 3.64Å; R14-W17 PolarHBondContact O-N 3.35Å; R14-L18 HydrophobicContact CG-CD1 3.94Å; R14-L18 HydrophobicContact CG-CG 4.4Å; R14-L18 WeakPolarHBondContact O-CB 3.36Å; R14-L18 VanDerWaalsContact O-CG 3.25Å; R14-L18 WeakPolarHBondContact O-CG 3.35Å; R14-L18 PolarHBondContact O-N 3.45Å
15	E	84.7	Confident	76.7	Confident	95 Å²	95	105.3 Å²	105.3	44%	0.444	52%	0.524	S	S	.	.	H	α-helix	trans	-56.5	-50.5	174.8	-70.5	175.1	155.8	0	0	112.2	E11 W17 L18 I19	E11-E15 WeakPolarHBondContact O-CG 3.25Å; E11-E15 PolarHBondContact O-N 3.33Å; E15-W17 VanDerWaalsContact C-N 3.29Å; E15-W17 PolarHBondContact O-N 3.07Å; E15-L18 PolarHBondContact O-N 2.9Å; E15-I19 WeakPolarHBondContact O-CB 3.44Å; E15-I19 WeakPolarHBondContact O-CD1 3.5Å; E15-I19 VanDerWaalsContact O-CG1 3.24Å; E15-I19 WeakPolarHBondContact O-CG1 2.97Å; E15-I19 PolarHBondContact O-N 3.46Å
16	N	82.9	Confident	74.8	Confident	81 Å²	81	109.6 Å²	109.6	43%	0.433	54%	0.536	S	S	.	.	H	α-helix	trans	-64.6	-31.6	179.2	-84.6	-83.5	0	0	0	113.1	K12 L13 R20	K12-N16 WeakPolarHBondContact O-CB 3.44Å; K12-N16 PolarHBondContact O-N 2.75Å; K12-N16 PolarHBondContact O-ND2 2.78Å; L13-N16 PolarHBondContact O-N 3.42Å; N16-R20 WeakPolarHBondContact O-CD 2.92Å; N16-R20 VanDerWaalsContact O-CG 3.27Å; N16-R20 WeakPolarHBondContact O-CG 3.09Å; N16-R20 PolarHBondContact O-N 3.34Å
17	W	84.1	Confident	73.4	Confident	155 Å²	155	109.7 Å²	109.7	59%	0.587	53%	0.528	S	S	*	.	H	α-helix	trans	-72.9	-44.7	174.6	-174.9	92.9	0	0	0	111.3	L13 R14 E15 R20 N21	L13-W17 WeakPolarHBondContact O-CB 3.37Å; L13-W17 PolarHBondContact O-N 3.38Å; R14-W17 PolarHBondContact O-N 3.35Å; E15-W17 VanDerWaalsContact C-N 3.29Å; E15-W17 PolarHBondContact O-N 3.07Å; W17-R20 PolarHBondContact O-N 3.17Å; W17-N21 PolarHBondContact NE1-ND2 3.46Å; W17-N21 PolarHBondContact O-N 3.31Å; W17-N21 VanDerWaalsContact O-N 3.13Å; W17-N21 PolarHBondContact O-ND2 3.04Å
18	L	80.7	Confident	71.6	Confident	54 Å²	54	109.4 Å²	109.4	28%	0.283	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-53	176.3	-76.4	170.4	0	0	0	111.1	R14 E15 R20 N21 H22	R14-L18 HydrophobicContact CG-CD1 3.94Å; R14-L18 HydrophobicContact CG-CG 4.4Å; R14-L18 WeakPolarHBondContact O-CB 3.36Å; R14-L18 VanDerWaalsContact O-CG 3.25Å; R14-L18 WeakPolarHBondContact O-CG 3.35Å; R14-L18 PolarHBondContact O-N 3.45Å; E15-L18 PolarHBondContact O-N 2.9Å; L18-R20 PolarHBondContact O-N 3.06Å; L18-R20 VanDerWaalsContact O-N 3.07Å; L18-N21 PolarHBondContact O-N 3.37Å; L18-H22 WeakPolarHBondContact O-CB 3.4Å; L18-H22 PolarHBondContact O-CD2 3.18Å; L18-H22 VanDerWaalsContact O-CG 3.28Å; L18-H22 PolarHBondContact O-N 2.92Å
19	I	79.8	Confident	69.5	Low	130 Å²	130	111.9 Å²	111.9	67%	0.667	55%	0.55	S	S	*	.	H	α-helix	trans	-53.5	-33.7	177.9	-69.7	163.6	0	0	0	112.3	E15	E15-I19 WeakPolarHBondContact O-CB 3.44Å; E15-I19 WeakPolarHBondContact O-CD1 3.5Å; E15-I19 VanDerWaalsContact O-CG1 3.24Å; E15-I19 WeakPolarHBondContact O-CG1 2.97Å; E15-I19 PolarHBondContact O-N 3.46Å
20	R	76.5	Confident	67.3	Low	207 Å²	207	113.4 Å²	113.4	78%	0.781	56%	0.556	S	S	*	*	H	α-helix	trans	-84.4	-19.6	-179.9	-74.2	177.1	174	-160.9	-3.1	115	N16 W17 L18	N16-R20 WeakPolarHBondContact O-CD 2.92Å; N16-R20 VanDerWaalsContact O-CG 3.27Å; N16-R20 WeakPolarHBondContact O-CG 3.09Å; N16-R20 PolarHBondContact O-N 3.34Å; W17-R20 PolarHBondContact O-N 3.17Å; L18-R20 PolarHBondContact O-N 3.06Å; L18-R20 VanDerWaalsContact O-N 3.07Å
21	N	68.3	Low	65.3	Low	71 Å²	71	119.9 Å²	119.9	38%	0.38	58%	0.576	S	S	.	*	H	α-helix	trans	-118.5	3.5	-174.6	-62.1	-73.9	0	0	0	113.5	W17 L18 S23	W17-N21 PolarHBondContact NE1-ND2 3.46Å; W17-N21 PolarHBondContact O-N 3.31Å; W17-N21 VanDerWaalsContact O-N 3.13Å; W17-N21 PolarHBondContact O-ND2 3.04Å; L18-N21 PolarHBondContact O-N 3.37Å; N21-S23 PolarHBondContact O-N 3.33Å; N21-S23 PolarHBondContact O-OG 3.02Å
22	H	52.9	Low	63.5	Low	98 Å²	98	124.2 Å²	124.2	45%	0.454	60%	0.597	S	S	.	*			trans	-71.7	35.6	176.1	-87.5	-48.8	0	0	0	115.2	L18 N24	L18-H22 WeakPolarHBondContact O-CB 3.4Å; L18-H22 PolarHBondContact O-CD2 3.18Å; L18-H22 VanDerWaalsContact O-CG 3.28Å; L18-H22 PolarHBondContact O-N 2.92Å; H22-N24 VanDerWaalsContact C-N 3.31Å; H22-N24 PolarHBondContact ND1-OD1 2.91Å; H22-N24 PolarHBondContact O-N 3.21Å; H22-N24 VanDerWaalsContact O-N 3.08Å
23	S	47.1	Very low	61.2	Low	76 Å²	76	129.9 Å²	129.9	53%	0.531	62%	0.617	S	S	.	*			trans	-70.8	91.2	152.8	51.1	0	0	0	0	108.2	N21 E25 F26	N21-S23 PolarHBondContact O-N 3.33Å; N21-S23 PolarHBondContact O-OG 3.02Å; S23-E25 PolarHBondContact O-N 3.38Å; S23-F26 PolarHBondContact O-N 3.43Å
24	N	47.3	Very low	59	Low	113 Å²	113	129 Å²	129	60%	0.604	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	2.7	-168.8	-77.7	-13.9	0	0	0	116.2	H22	H22-N24 VanDerWaalsContact C-N 3.31Å; H22-N24 PolarHBondContact ND1-OD1 2.91Å; H22-N24 PolarHBondContact O-N 3.21Å; H22-N24 VanDerWaalsContact O-N 3.08Å
25	E	50.3	Low	56.9	Low	181 Å²	181	129.5 Å²	129.5	85%	0.846	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-17.9	174.3	-61.2	-176.5	135.9	0	0	113.4	S23	S23-E25 PolarHBondContact O-N 3.38Å
26	F	43.8	Very low	55.3	Low	168 Å²	168	129.6 Å²	129.6	74%	0.737	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-8.9	-175.9	-110.4	-87.4	0	0	0	115.5	S23	S23-F26 PolarHBondContact O-N 3.43Å
27	I	48.2	Very low	53.6	Low	98 Å²	98	132.8 Å²	132.8	50%	0.503	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.4	-29	-169	-62.8	175.6	0	0	0	112.3	N29	I27-N29 VanDerWaalsContact C-N 3.3Å; I27-N29 PolarHBondContact O-N 3.31Å
28	V	44.9	Very low	52.1	Low	112 Å²	112	130 Å²	130	68%	0.679	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-19.4	-171.1	-176.8	0	0	0	0	113.8
29	N	43.1	Very low	50.5	Low	147 Å²	147	132.2 Å²	132.2	79%	0.786	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	21.1	-173.7	-68.2	-5.2	0	0	0	114.1	I27	I27-N29 VanDerWaalsContact C-N 3.3Å; I27-N29 PolarHBondContact O-N 3.31Å
30	M	43.1	Very low	50	Low	126 Å²	126	130.6 Å²	130.6	62%	0.621	66%	0.656	S	S	*	*			trans	-125.5	10.4	-175.4	-81.6	-70.3	177.9	0	0	114.8	E32	M30-E32 PolarHBondContact O-N 3.35Å
31	E	43	Very low	49.4	Very low	194 Å²	194	124.9 Å²	124.9	91%	0.907	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	6.3	-170.8	-146.4	166.6	-144.1	0	0	115.1
32	E	48.2	Very low	49.2	Very low	179 Å²	179	129 Å²	129	84%	0.836	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.4	3.9	-174.6	-153.5	166.2	-146.5	0	0	114.4	M30	M30-E32 PolarHBondContact O-N 3.35Å
33	Y	40.7	Very low	49.7	Very low	200 Å²	200	128.2 Å²	128.2	78%	0.784	65%	0.651	S	S	*	*	S	Bend	trans	-138.8	34.4	-169.4	-90.2	-79.3	0	0	0	117
34	D	40.9	Very low	50.4	Low	107 Å²	107	132.3 Å²	132.3	57%	0.572	66%	0.661	S	S	*	*			trans	-138.6	75.5	168.7	-165.6	13.2	0	0	0	115.6	S36 L37	D34-S36 PolarHBondContact OD1-N 3.48Å; D34-L37 PolarHBondContact OD1-N 2.8Å; D34-L37 WeakPolarHBondContact OD2-CD1 2.91Å
35	D	45.1	Very low	51	Low	127 Å²	127	132.2 Å²	132.2	68%	0.679	67%	0.665	S	S	*	*			trans	-111	24.2	155.7	-129.9	-20.7	0	0	0	110.7	T38	D35-T38 PolarHBondContact O-OG1 3.09Å; D35-T38 PolarHBondContact OD1-OG1 3.42Å
36	S	51.1	Low	51.4	Low	97 Å²	97	127.5 Å²	127.5	68%	0.678	65%	0.645	S	S	*	*	S	Bend	trans	-91.2	-27.6	-175.8	-67.8	0	0	0	0	112.7	D34	D34-S36 PolarHBondContact OD1-N 3.48Å
37	L	47	Very low	51.7	Low	148 Å²	148	123.5 Å²	123.5	78%	0.775	63%	0.632	S	S	*	*	S	Bend	trans	-81.5	-15.8	-179.3	-71	174	0	0	0	114.2	D34	D34-L37 PolarHBondContact OD1-N 2.8Å; D34-L37 WeakPolarHBondContact OD2-CD1 2.91Å
38	T	51.6	Low	52.1	Low	97 Å²	97	124.4 Å²	124.4	60%	0.595	64%	0.636	S	S	*	*	S	Bend	trans	-90.5	-24.3	174.8	51.6	0	0	0	0	112.7	D35 L40	D35-T38 PolarHBondContact O-OG1 3.09Å; D35-T38 PolarHBondContact OD1-OG1 3.42Å; T38-L40 PolarHBondContact O-N 2.89Å
39	N	47.2	Very low	52.3	Low	100 Å²	100	126 Å²	126	54%	0.535	64%	0.636	S	S	.	*			trans	-83.6	82.1	-168.4	-164.9	-13.1	0	0	0	113.3	N41	N39-N41 PolarHBondContact O-N 3.03Å; N39-N41 WeakPolarHBondContact OD1-CB 2.92Å
40	L	68.7	Low	52.7	Low	96 Å²	96	125.8 Å²	125.8	50%	0.503	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	21.6	-179.5	-64.2	178.7	0	0	0	115.5	T38 W42 L43	T38-L40 PolarHBondContact O-N 2.89Å; L40-W42 PolarHBondContact O-N 3.35Å; L40-W42 VanDerWaalsContact O-N 3.14Å; L40-L43 HydrophobicContact CB-CD1 4.22Å; L40-L43 HydrophobicContact CD1-CD1 4.25Å; L40-L43 HydrophobicContact CD2-CD1 4.1Å; L40-L43 HydrophobicContact CG-CD1 4.43Å; L40-L43 WeakPolarHBondContact O-CB 3.49Å; L40-L43 PolarHBondContact O-N 3.15Å
41	N	64.2	Low	53	Low	88 Å²	88	127.5 Å²	127.5	47%	0.471	64%	0.635	S	S	.	*	H	α-helix	trans	-61.6	-23.3	-179.6	-161	21.1	0	0	0	113.3	N39 L43 Q44 T45	N39-N41 PolarHBondContact O-N 3.03Å; N39-N41 WeakPolarHBondContact OD1-CB 2.92Å; N41-L43 PolarHBondContact O-N 3.21Å; N41-Q44 WeakPolarHBondContact O-CB 3.27Å; N41-Q44 PolarHBondContact O-N 2.99Å; N41-Q44 VanDerWaalsContact O-N 3.08Å; N41-T45 PolarHBondContact O-N 3.48Å; N41-T45 PolarHBondContact O-OG1 3.07Å
42	W	65.2	Low	53.1	Low	158 Å²	158	122.1 Å²	122.1	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-65.9	-23	171.9	71.9	-91.9	0	0	0	113.7	L40 T45 L46	L40-W42 PolarHBondContact O-N 3.35Å; L40-W42 VanDerWaalsContact O-N 3.14Å; W42-T45 WeakPolarHBondContact CA-OG1 3.34Å; W42-T45 PolarHBondContact O-OG1 3.34Å; W42-L46 HydrophobicContact CE3-CD1 4.18Å; W42-L46 HydrophobicContact CZ3-CD1 3.96Å
43	L	63.7	Low	52.7	Low	81 Å²	81	117.1 Å²	117.1	42%	0.424	60%	0.6	S	S	.	*	H	α-helix	trans	-75.6	-27.5	170.7	-70.1	177.5	0	0	0	112	L40 N41 T45 L46	L40-L43 HydrophobicContact CB-CD1 4.22Å; L40-L43 HydrophobicContact CD1-CD1 4.25Å; L40-L43 HydrophobicContact CD2-CD1 4.1Å; L40-L43 HydrophobicContact CG-CD1 4.43Å; L40-L43 WeakPolarHBondContact O-CB 3.49Å; L40-L43 PolarHBondContact O-N 3.15Å; N41-L43 PolarHBondContact O-N 3.21Å; L43-T45 VanDerWaalsContact C-N 3.3Å; L43-L46 HydrophobicContact CD2-CD1 4.16Å; L43-L46 PolarHBondContact O-N 3.07Å
44	Q	60.9	Low	52.6	Low	161 Å²	161	114 Å²	114	75%	0.752	60%	0.601	S	S	*	*	H	α-helix	trans	-74.7	-22.5	178	-56.1	-169.9	23.8	0	0	112.6	N41	N41-Q44 WeakPolarHBondContact O-CB 3.27Å; N41-Q44 PolarHBondContact O-N 2.99Å; N41-Q44 VanDerWaalsContact O-N 3.08Å
45	T	59.6	Low	52.8	Low	112 Å²	112	115 Å²	115	69%	0.687	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-5.3	177.2	33.5	0	0	0	0	113.8	N41 W42 L43 N47	N41-T45 PolarHBondContact O-N 3.48Å; N41-T45 PolarHBondContact O-OG1 3.07Å; W42-T45 WeakPolarHBondContact CA-OG1 3.34Å; W42-T45 PolarHBondContact O-OG1 3.34Å; L43-T45 VanDerWaalsContact C-N 3.3Å; T45-N47 PolarHBondContact O-N 3.26Å
46	L	58.5	Low	52.7	Low	82 Å²	82	113.7 Å²	113.7	43%	0.429	61%	0.613	S	S	.	*	S	Bend	trans	-80	105.9	169.4	-77.2	172.7	0	0	0	110.5	W42 L43 I48	W42-L46 HydrophobicContact CE3-CD1 4.18Å; W42-L46 HydrophobicContact CZ3-CD1 3.96Å; L43-L46 HydrophobicContact CD2-CD1 4.16Å; L43-L46 PolarHBondContact O-N 3.07Å; L46-I48 PolarHBondContact O-N 3.48Å
47	N	50.3	Low	52.3	Low	84 Å²	84	114.9 Å²	114.9	45%	0.449	62%	0.618	S	S	.	*			trans	-73.4	86.8	176.4	-169.8	-0.5	0	0	0	111.2	T45 H49 E50	T45-N47 PolarHBondContact O-N 3.26Å; N47-H49 PolarHBondContact O-N 2.83Å; N47-H49 PolarHBondContact OD1-N 3.26Å; N47-E50 HydrophobicContact CB-CG 4.25Å; N47-E50 PolarHBondContact O-N 3.3Å
48	I	56.6	Low	52.2	Low	116 Å²	116	115.9 Å²	115.9	60%	0.595	62%	0.623	S	S	*	*	H	α-helix	trans	-56.3	-22.8	-177.9	-59.8	175.4	0	0	0	112.1	L46 E50 F51 T52	L46-I48 PolarHBondContact O-N 3.48Å; I48-E50 PolarHBondContact O-N 3.44Å; I48-F51 PolarHBondContact O-N 3.42Å; I48-T52 HydrophobicContact CG2-CG2 4.13Å; I48-T52 PolarHBondContact O-N 3.39Å; I48-T52 VanDerWaalsContact O-N 3.1Å; I48-T52 PolarHBondContact O-OG1 3.37Å
49	H	49.4	Very low	51.7	Low	146 Å²	146	116 Å²	116	68%	0.676	63%	0.627	S	S	*	*	H	α-helix	trans	-71.2	-22.3	174.6	-69.9	-51.1	0	0	0	114.6	N47 F51 T52 S53	N47-H49 PolarHBondContact O-N 2.83Å; N47-H49 PolarHBondContact OD1-N 3.26Å; H49-F51 VanDerWaalsContact C-N 3.31Å; H49-T52 WeakPolarHBondContact CA-OG1 3.27Å; H49-S53 WeakPolarHBondContact O-CB 3.49Å; H49-S53 PolarHBondContact O-N 3.35Å; H49-S53 PolarHBondContact O-OG 3.41Å
50	E	52.7	Low	52	Low	143 Å²	143	116.8 Å²	116.8	67%	0.668	64%	0.638	S	S	*	*	H	α-helix	trans	-71.6	-28.3	169.1	-67.8	-173.3	123.5	0	0	112	N47 I48	N47-E50 HydrophobicContact CB-CG 4.25Å; N47-E50 PolarHBondContact O-N 3.3Å; I48-E50 PolarHBondContact O-N 3.44Å
51	F	48.3	Very low	51.3	Low	162 Å²	162	117.5 Å²	117.5	71%	0.711	65%	0.648	S	S	*	*	H	α-helix	trans	-88.8	-11.4	177.9	-61.2	-79	0	0	0	113.9	I48 H49	I48-F51 PolarHBondContact O-N 3.42Å; H49-F51 VanDerWaalsContact C-N 3.31Å
52	T	44.4	Very low	50.5	Low	80 Å²	80	119.3 Å²	119.3	49%	0.491	67%	0.665	S	S	.	*	H	α-helix	trans	-122.6	-1.1	-176.3	54.3	0	0	0	0	114.3	I48 H49 T54	I48-T52 HydrophobicContact CG2-CG2 4.13Å; I48-T52 PolarHBondContact O-N 3.39Å; I48-T52 VanDerWaalsContact O-N 3.1Å; I48-T52 PolarHBondContact O-OG1 3.37Å; H49-T52 WeakPolarHBondContact CA-OG1 3.27Å; T52-T54 PolarHBondContact O-N 3.49Å
53	S	41.3	Very low	49.9	Very low	74 Å²	74	117.9 Å²	117.9	52%	0.517	67%	0.673	S	S	.	*			trans	-72.9	90	174.6	37.4	0	0	0	0	111	H49 T55	H49-S53 WeakPolarHBondContact O-CB 3.49Å; H49-S53 PolarHBondContact O-N 3.35Å; H49-S53 PolarHBondContact O-OG 3.41Å; S53-T55 PolarHBondContact O-N 3.17Å
54	T	38.8	Very low	49.2	Very low	134 Å²	134	118.5 Å²	118.5	82%	0.822	68%	0.683	S	S	*	*			trans	-64.4	81.1	168.7	55.3	0	0	0	0	110.2	T52 S56	T52-T54 PolarHBondContact O-N 3.49Å; T54-S56 PolarHBondContact O-N 3.07Å
55	T	43.9	Very low	48.3	Very low	129 Å²	129	116.9 Å²	116.9	79%	0.791	69%	0.686	S	S	*	*			trans	-58.7	122.6	165.5	43.9	0	0	0	0	108	S53	S53-T55 PolarHBondContact O-N 3.17Å
56	S	43.6	Very low	47.4	Very low	100 Å²	100	119.7 Å²	119.7	70%	0.699	70%	0.696	S	S	*	*			trans	-53.7	139.7	-170.4	-54.7	0	0	0	0	111.3	T54 I58	T54-S56 PolarHBondContact O-N 3.07Å; S56-I58 PolarHBondContact O-N 3.44Å
57	P	43.3	Very low	46.5	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	71%	0.712	S	S	*	*			trans	-58.9	113.2	179.6	24.6	-33.6	0	0	0	109.4	S59	P57-S59 PolarHBondContact O-N 3.19Å
58	I	44	Very low	45.8	Very low	169 Å²	169	125.9 Å²	125.9	87%	0.867	72%	0.723	S	S	*	*			trans	-61.2	107.7	175.8	-66.5	177	0	0	0	106.6	S56	S56-I58 PolarHBondContact O-N 3.44Å
59	S	41.1	Very low	44.9	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-60.6	139.8	-177.6	-59.8	0	0	0	0	109.5	P57	P57-S59 PolarHBondContact O-N 3.19Å
60	P	54.6	Low	44.2	Very low	117 Å²	117	130.5 Å²	130.5	76%	0.76	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-58.1	142	176	25.5	-33.9	0	0	0	109.7
61	P	52.5	Low	43.4	Very low	111 Å²	111	129.4 Å²	129.4	72%	0.721	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-60.9	140.7	-177.8	25.5	-34.3	0	0	0	110.4	T63	P61-T63 PolarHBondContact O-N 2.81Å; P61-T63 VanDerWaalsContact O-N 3.13Å
62	P	47.3	Very low	43.1	Very low	127 Å²	127	129.9 Å²	129.9	83%	0.825	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-65	116.2	-176.8	25.9	-33.9	0	0	0	110.8
63	T	53.8	Low	42.7	Very low	127 Å²	127	133.4 Å²	133.4	78%	0.779	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-58.3	132	176.8	-38.1	0	0	0	0	110.4	P61	P61-T63 PolarHBondContact O-N 2.81Å; P61-T63 VanDerWaalsContact O-N 3.13Å
64	P	48.4	Very low	42.5	Very low	95 Å²	95	136.2 Å²	136.2	62%	0.617	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64.1	147.6	179.3	25.9	-34.6	0	0	0	111.8	L66	P64-L66 PolarHBondContact O-N 3.13Å
65	P	43	Very low	42.3	Very low	127 Å²	127	136 Å²	136	83%	0.825	77%	0.765	S	S	*	*			trans	-75.2	93.3	-170.1	29.8	-36.1	0	0	0	112.9	H67	P65-H67 VanDerWaalsContact C-N 3.33Å; P65-H67 PolarHBondContact O-N 3.42Å
66	L	39.6	Very low	41.9	Very low	170 Å²	170	141.4 Å²	141.4	89%	0.89	77%	0.773	S	S	*	*			trans	-85.6	70.3	170.1	-68.5	-179.9	0	0	0	111.4	P64	P64-L66 PolarHBondContact O-N 3.13Å
67	H	40.7	Very low	41.6	Very low	167 Å²	167	141.4 Å²	141.4	77%	0.773	77%	0.773	S	S	*	*			trans	-146.8	60.1	178	-155.3	-71.9	0	0	0	114.5	P65	P65-H67 VanDerWaalsContact C-N 3.33Å; P65-H67 PolarHBondContact O-N 3.42Å
68	L	35.4	Very low	41.2	Very low	129 Å²	129	140.9 Å²	140.9	68%	0.675	77%	0.772	S	S	*	*			trans	-168.4	86.2	145.4	-128.8	65.1	0	0	0	113.3
69	F	37.3	Very low	40.8	Very low	215 Å²	215	139.1 Å²	139.1	94%	0.943	77%	0.77	S	S	*	*			trans	-118.9	120.8	149.3	-90.1	-79.4	0	0	0	107.9
70	H	35.4	Very low	40.6	Very low	145 Å²	145	138.9 Å²	138.9	67%	0.671	77%	0.768	S	S	*	*			trans	-74.7	138.6	-172.4	-75.9	55.8	0	0	0	111	I72	H70-I72 PolarHBondContact O-N 3.06Å
71	P	35.8	Very low	39.7	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	77%	0.77	S	S	*	*			trans	-72.2	113.1	170.2	29.7	-32.5	0	0	0	109.8	H73	P71-H73 VanDerWaalsContact C-N 3.27Å; P71-H73 PolarHBondContact O-N 3.38Å
72	I	41.1	Very low	38.9	Very low	172 Å²	172	139.1 Å²	139.1	88%	0.882	77%	0.77	S	S	*	*			trans	-78.6	86.6	165.7	-59.3	-178	0	0	0	107.8	H70	H70-I72 PolarHBondContact O-N 3.06Å
73	H	35.4	Very low	38.1	Very low	154 Å²	154	140.6 Å²	140.6	71%	0.713	77%	0.767	S	S	*	*			trans	-73.2	123.9	168.3	-172.9	-85.8	0	0	0	109.4	P71	P71-H73 VanDerWaalsContact C-N 3.27Å; P71-H73 PolarHBondContact O-N 3.38Å
74	N	36.6	Very low	37.2	Very low	134 Å²	134	140.3 Å²	140.3	72%	0.717	77%	0.766	S	S	*	*			trans	-172.4	119.9	142	-96.5	-17.6	0	0	0	114.1
75	L	36.3	Very low	36.7	Very low	129 Å²	129	141 Å²	141	68%	0.675	77%	0.768	S	S	*	*			trans	33.3	110.9	148.1	-69.7	78.1	0	0	0	119
76	Y	34.5	Very low	36.1	Very low	242 Å²	242	142.1 Å²	142.1	95%	0.949	77%	0.767	S	S	*	*			trans	-105.1	129.1	137.9	-109.9	-91.8	0	0	0	108.7
77	S	36.6	Very low	36	Very low	101 Å²	101	143.3 Å²	143.3	71%	0.706	77%	0.765	S	S	*	*			trans	-102.3	137.2	173.9	-71.8	0	0	0	0	112.2
78	S	35.1	Very low	35.7	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	76%	0.764	S	S	*	*			trans	-42	141.5	179.5	-45.1	0	0	0	0	117.6
79	T	36.5	Very low	35.6	Very low	133 Å²	133	139.8 Å²	139.8	82%	0.816	77%	0.767	S	S	*	*				-170.9	110.5	125.4	25.8	0	0	0	0	107
80	S	36.4	Very low	35.3	Very low	92 Å²	92	135.2 Å²	135.2	64%	0.643	76%	0.762	S	S	*	*			cis	86.6	129.4	47.9	75.1	0	0	0	0	114.5
81	T	35.8	Very low	35.2	Very low	131 Å²	131	136.1 Å²	136.1	80%	0.804	77%	0.766	S	S	*	*			trans	66.8	144.6	176.2	12.5	0	0	0	0	115.4
82	S	35.8	Very low	35.2	Very low	103 Å²	103	138 Å²	138	72%	0.72	76%	0.762	S	S	*	*			cis	-137.7	140.8	6.5	-59.1	0	0	0	0	109.7
83	M	30.4	Very low	34.8	Very low	157 Å²	157	138.1 Å²	138.1	77%	0.773	76%	0.757	S	S	*	*				68.5	127.5	64.9	-97.7	-72.1	-87.3	0	0	115.6
84	T	34.5	Very low	34.7	Very low	121 Å²	121	138.2 Å²	138.2	74%	0.742	76%	0.757	S	S	*	*			trans	70.4	151.3	176.8	78.9	0	0	0	0	115.4
85	T	37.9	Very low	34.4	Very low	109 Å²	109	137.1 Å²	137.1	67%	0.669	75%	0.751	S	S	*	*			cis	-144	135.8	18.5	50.9	0	0	0	0	115.3
86	L	31.4	Very low	34.3	Very low	152 Å²	152	138.1 Å²	138.1	80%	0.796	75%	0.747	S	S	*	*				55.7	156.3	126.6	-57	166.4	0	0	0	123.5
87	K	37.7	Very low	34.2	Very low	195 Å²	195	130.7 Å²	130.7	85%	0.848	72%	0.724	S	S	*	*			trans	85.4	123.7	163.7	-56.5	175.8	-173.7	173.9	0	116
88	S	34.5	Very low	34	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	71%	0.712	S	S	*	*			cis	-155	149.3	-6.3	-74.4	0	0	0	0	111.4
89	P	32.1	Very low	33.9	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	71%	0.708	S	S	*	*			trans	-99.9	172.4	175.9	39.6	-35.8	0	0	0	114.5
90	S	30.9	Very low	33.7	Very low	119 Å²	119	127.8 Å²	127.8	83%	0.832	69%	0.693	S	S	*	*			trans	34.8	113.1	149.8	-55.3	0	0	0	0	121.1
91	Q	34.1	Very low	33.6	Very low	164 Å²	164	127 Å²	127	77%	0.766	68%	0.682	S	S	*	*			trans	-150.1	135.8	162.5	-89.8	-167.3	33.6	0	0	107.5
92	K	35.9	Very low	33.6	Very low	158 Å²	158	126 Å²	126	69%	0.687	67%	0.671	S	S	*	*			cis	-145	156	11.5	-69.9	-165.7	178.7	170.7	0	114.2
93	F	32.4	Very low	33.2	Very low	175 Å²	175	126.1 Å²	126.1	77%	0.768	67%	0.671	S	S	*	*			trans	4.1	140.9	153.1	-48.9	-69.3	0	0	0	121
94	H	32.7	Very low	33.4	Very low	155 Å²	155	126.9 Å²	126.9	72%	0.718	67%	0.67	S	S	*	*			cis	99	127	31.1	-90.2	27.9	0	0	0	116.8
95	N	32.1	Very low	33.4	Very low	112 Å²	112	127.9 Å²	127.9	60%	0.599	67%	0.667	S	S	*	*			trans	66.6	156.6	156.2	-48.9	-20.7	0	0	0	117
96	Y	33.4	Very low	33.3	Very low	149 Å²	149	129.9 Å²	129.9	58%	0.584	67%	0.666	S	S	*	*			cis	-146.1	173.9	17.7	-54	-93.5	0	0	0	108.6	S846 T847	Y96-S846 VanDerWaalsContact CE1-CB 3.49Å; Y96-T847 HydrophobicContact CD1-CG2 3.97Å; Y96-T847 HydrophobicContact CE1-CG2 3.75Å
97	N	31.8	Very low	33.5	Very low	87 Å²	87	129.3 Å²	129.3	47%	0.465	66%	0.663	S	S	.	*			cis	-152	163.2	-1.9	-130.3	40.2	0	0	0	107.4	T847 S848	N97-T847 PolarHBondContact ND2-N 3.31Å; N97-T847 WeakPolarHBondContact OD1-CA 3.48Å; N97-T847 PolarHBondContact OD1-N 3.29Å; N97-S848 PolarHBondContact ND2-N 3.4Å; N97-S848 PolarHBondContact OD1-N 3.31Å
98	T	32.1	Very low	33.4	Very low	76 Å²	76	125.6 Å²	125.6	47%	0.466	66%	0.657	S	S	.	*			cis	85.8	112.3	8.6	46	0	0	0	0	121.4	S848	T98-S848 CarbonylContact O-C 3.08Å; T98-S848 PolarHBondContact OG1-N 3.32Å
99	T	34.9	Very low	33.5	Very low	109 Å²	109	124.7 Å²	124.7	67%	0.669	65%	0.651	S	S	*	*			trans	-163	165.2	168.7	26.6	0	0	0	0	113.1	S849 L850	T99-S849 CarbonylContact C-O 2.96Å; T99-S849 CarbonylContact O-C 3.54Å; T99-S849 VanDerWaalsContact O-O 3.07Å; T99-L850 CarbonylContact C-O 3.28Å; T99-L850 CarbonylContact O-C 3.57Å; T99-L850 VanDerWaalsContact O-CA 3.27Å; T99-L850 WeakPolarHBondContact O-CA 3.3Å; T99-L850 PolarHBondContact O-N 3.15Å
100	L	31.6	Very low	33.6	Very low	98 Å²	98	126.3 Å²	126.3	51%	0.513	65%	0.652	S	S	.	*			trans	-111.4	140.2	-145.1	-159	76.6	0	0	0	119.6	S849 L850	L100-S849 WeakPolarHBondContact CA-O 3.33Å; L100-S849 WeakPolarHBondContact CB-O 3.06Å; L100-S849 WeakPolarHBondContact CD1-O 3.41Å; L100-S849 WeakPolarHBondContact CG-O 3.33Å; L100-S849 PolarHBondContact N-O 3.17Å; L100-S849 VanDerWaalsContact N-O 3.08Å; L100-L850 CarbonylContact C-O 3.59Å; L100-L850 WeakPolarHBondContact CA-O 3.34Å; L100-L850 HydrophobicContact CD1-CD1 3.67Å; L100-L850 HydrophobicContact CD1-CD2 3.75Å; L100-L850 HydrophobicContact CD1-CG 4.28Å
101	N	34.8	Very low	33.8	Very low	75 Å²	75	128.5 Å²	128.5	40%	0.401	65%	0.647	S	S	.	*			trans	92.6	152.4	158.6	-58.3	-68.8	0	0	0	118.7	L850 S851 I852	N101-L850 PolarHBondContact N-O 2.92Å; N101-S851 WeakPolarHBondContact CA-OG 3.27Å; N101-S851 PolarHBondContact N-OG 3.23Å; N101-S851 CarbonylContact O-C 3.1Å; N101-S851 VanDerWaalsContact O-C 3.28Å; N101-I852 CarbonylContact C-O 2.97Å
102	N	34.2	Very low	33.8	Very low	110 Å²	110	127.7 Å²	127.7	59%	0.588	65%	0.648	S	S	*	*			cis	-157.3	162.2	-0.2	-128	-35.9	0	0	0	116.1	I852	N102-I852 PolarHBondContact N-O 2.87Å
103	C	27.8	Very low	33.7	Very low	106 Å²	106	123.3 Å²	123.3	72%	0.716	65%	0.648	S	S	*	*			trans	-91.3	160	168.4	-49.9	0	0	0	0	113
104	K	35.9	Very low	33.7	Very low	173 Å²	173	121.9 Å²	121.9	75%	0.752	65%	0.647	S	S	*	*			trans	-174.4	127.8	136.2	-100.6	154.7	-175	179.8	0	110.8
105	Q	33.3	Very low	33.9	Very low	142 Å²	142	121.2 Å²	121.2	66%	0.664	64%	0.644	S	S	*	*				66.8	138.6	84.7	-65.7	-172.3	-8.8	0	0	113.4
106	K	35.5	Very low	34.2	Very low	150 Å²	150	123.1 Å²	123.1	65%	0.652	65%	0.649	S	S	*	*			cis	-171.4	159.6	-1.8	-119.2	172.9	-178.4	-178.8	0	109.6
107	D	35	Very low	34.2	Very low	140 Å²	140	124.5 Å²	124.5	75%	0.749	65%	0.653	S	S	*	*				168.1	123.2	117.2	-86.1	-27.3	0	0	0	109.2
108	V	36.4	Very low	34.3	Very low	118 Å²	118	125 Å²	125	72%	0.715	66%	0.656	S	S	*	*				73.4	125.9	73.5	172.3	0	0	0	0	110.4
109	S	37.2	Very low	34.5	Very low	90 Å²	90	127.6 Å²	127.6	63%	0.629	66%	0.663	S	S	*	*			cis	-147.1	146.6	27.3	54	0	0	0	0	113.4
110	L	33.2	Very low	34.6	Very low	146 Å²	146	127.8 Å²	127.8	76%	0.764	66%	0.66	S	S	*	*				59.5	147.6	102.9	-46.3	168	0	0	0	116
111	F	35	Very low	34.8	Very low	165 Å²	165	129.7 Å²	129.7	72%	0.724	67%	0.67	S	S	*	*			cis	-162.2	152	35.8	-133.4	-81.3	0	0	0	111.6
112	N	35.3	Very low	34.7	Very low	148 Å²	148	130.3 Å²	130.3	79%	0.791	68%	0.681	S	S	*	*			trans	13.7	159.2	162.2	-59.1	5.3	0	0	0	123.2
113	G	32.8	Very low	34.6	Very low	65 Å²	65	130.4 Å²	130.4	67%	0.67	69%	0.686	S	S	*	*			cis	160.5	139.2	1.4	0	0	0	0	0	110.1
114	L	32.6	Very low	34.8	Very low	146 Å²	146	132.5 Å²	132.5	76%	0.764	69%	0.688	S	S	*	*				104.4	138.9	89.1	-109.8	174.6	0	0	0	114.8
115	H	37.8	Very low	35	Very low	141 Å²	141	128.6 Å²	128.6	65%	0.653	68%	0.681	S	S	*	*			trans	69.6	155.7	172.7	-53.2	-69.8	0	0	0	117.7
116	H	37.5	Very low	34.9	Very low	152 Å²	152	131.3 Å²	131.3	70%	0.704	69%	0.69	S	S	*	*			cis	-175.1	173	-23.6	-98.8	-7.1	0	0	0	109.4
117	R	33.4	Very low	34.6	Very low	177 Å²	177	129.4 Å²	129.4	67%	0.668	69%	0.691	S	S	*	*			cis	171.6	144.8	-29.2	-175.9	-157.8	156.8	-170.1	-8.4	109.8
118	N	33.7	Very low	34.5	Very low	98 Å²	98	130 Å²	130	52%	0.524	69%	0.694	S	S	.	*			trans	71.5	155.8	154.6	-92.6	40.1	0	0	0	119.5
119	E	36	Very low	34.1	Very low	130 Å²	130	133.5 Å²	133.5	61%	0.607	70%	0.696	S	S	*	*			cis	-173.6	170.5	-14.7	-135.4	174.4	-138	0	0	112.7
120	N	37.3	Very low	33.9	Very low	114 Å²	114	136.6 Å²	136.6	61%	0.61	70%	0.704	S	S	*	*			trans	65.9	160.7	151.6	-59.2	-28.4	0	0	0	120.2
121	N	35.4	Very low	33.7	Very low	137 Å²	137	137.2 Å²	137.2	73%	0.733	70%	0.701	S	S	*	*			cis	-177.5	172.1	-29	-92.3	-15.4	0	0	0	106.1
122	S	32.4	Very low	33.6	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	70%	0.703	S	S	*	*			cis	168.3	169.8	-30.4	72.5	0	0	0	0	105.8
123	T	33.5	Very low	33.3	Very low	112 Å²	112	140.3 Å²	140.3	69%	0.687	70%	0.703	S	S	*	*			trans	73.5	112.9	165.5	-39.4	0	0	0	0	115.8
124	I	31.4	Very low	33.1	Very low	150 Å²	150	141 Å²	141	77%	0.769	70%	0.698	S	S	*	*			cis	83.1	155.7	35.1	-40.3	157.6	0	0	0	111.4
125	P	39.6	Very low	33	Very low	91 Å²	91	144 Å²	144	59%	0.591	70%	0.701	S	S	*	*				-116.7	-158.3	-85.8	40.7	-21.4	0	0	0	112.7
126	F	32.2	Very low	32.7	Very low	199 Å²	199	143.1 Å²	143.1	87%	0.873	71%	0.706	S	S	*	*				-168	166.9	115.5	-114.7	-80	0	0	0	113
127	V	29.2	Very low	32.4	Very low	109 Å²	109	140.6 Å²	140.6	66%	0.661	71%	0.705	S	S	*	*			trans	-120.5	143	-169	-179.3	0	0	0	0	110.7
128	N	32.4	Very low	32.4	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	71%	0.71	S	S	*	*			trans	-158.2	159.1	142.2	-123.7	-45.3	0	0	0	115.8
129	Y	27.4	Very low	32.5	Very low	192 Å²	192	137.6 Å²	137.6	75%	0.753	71%	0.713	S	S	*	*			trans	-85.9	151	-176.1	-60.6	-107.7	0	0	0	112.2
130	L	33	Very low	32.6	Very low	154 Å²	154	137.3 Å²	137.3	81%	0.806	72%	0.716	S	S	*	*				-176.2	132.6	114.6	-120.4	68.1	0	0	0	114.5
131	K	30.1	Very low	32.7	Very low	160 Å²	160	138.9 Å²	138.9	70%	0.696	72%	0.719	S	S	*	*			trans	36	143.6	133.6	-80.2	175.9	169.8	175.3	0	122.7
132	H	33	Very low	32.9	Very low	164 Å²	164	137.6 Å²	137.6	76%	0.759	71%	0.712	S	S	*	*			trans	73.5	155.9	153.6	-60.7	-40.7	0	0	0	116.7
133	R	29.2	Very low	33.1	Very low	213 Å²	213	139.3 Å²	139.3	80%	0.804	71%	0.714	S	S	*	*			cis	-170	113.5	-21.9	168.5	-172.7	-178.5	-155.8	2.4	110.7
134	S	28.9	Very low	33.3	Very low	81 Å²	81	138.9 Å²	138.9	57%	0.566	71%	0.712	S	S	*	*			trans	62.2	148.6	149.2	-46.8	0	0	0	0	121.7
135	Y	29.7	Very low	33.6	Very low	208 Å²	208	137.4 Å²	137.4	82%	0.816	71%	0.71	S	S	*	*			trans	68.6	153.4	162.8	-50.7	-59.2	0	0	0	115.9
136	T	32	Very low	33.5	Very low	123 Å²	123	139.3 Å²	139.3	76%	0.755	72%	0.715	S	S	*	*			cis	-168.7	155.3	-9.9	21.2	0	0	0	0	107
137	S	30	Very low	33.7	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	71%	0.706	S	S	*	*			cis	-172.6	-133.4	-19.1	55.5	0	0	0	0	106.8
138	V	34.5	Very low	34.1	Very low	129 Å²	129	135.2 Å²	135.2	78%	0.782	71%	0.707	S	S	*	*			trans	72.3	138.5	165.1	-175	0	0	0	0	116.9
139	S	36.1	Very low	34.3	Very low	83 Å²	83	134.1 Å²	134.1	58%	0.58	70%	0.701	S	S	*	*			cis	-169.6	164	-29.6	66	0	0	0	0	110.9
140	N	37.7	Very low	34.7	Very low	125 Å²	125	130.4 Å²	130.4	67%	0.668	70%	0.695	S	S	*	*			trans	67	157.3	146.2	-66.4	-3.4	0	0	0	118.5
141	H	39.4	Very low	34.7	Very low	146 Å²	146	128.3 Å²	128.3	68%	0.676	68%	0.684	S	S	*	*			cis	-167.5	160.4	-6.7	-110	-2.9	0	0	0	108.3
142	N	38.2	Very low	34.9	Very low	111 Å²	111	130.6 Å²	130.6	59%	0.594	69%	0.69	S	S	*	*			cis	-167.8	174.5	-19.7	-149.1	0.9	0	0	0	109.9
143	N	37.7	Very low	34.9	Very low	124 Å²	124	128.8 Å²	128.8	66%	0.663	69%	0.69	S	S	*	*			trans	69.5	146	151.2	-69.6	-3.3	0	0	0	119.5
144	T	37.3	Very low	34.9	Very low	104 Å²	104	122.9 Å²	122.9	64%	0.638	68%	0.681	S	S	*	*			cis	-160	144.1	-0.7	9.5	0	0	0	0	112.6
145	T	38.3	Very low	35	Very low	119 Å²	119	124 Å²	124	73%	0.73	69%	0.689	S	S	*	*			trans	62	144.4	149.8	53.8	0	0	0	0	119.9
146	N	36.9	Very low	35	Very low	130 Å²	130	121.5 Å²	121.5	70%	0.695	69%	0.688	S	S	*	*			cis	-155.4	150.2	12.4	-125.1	-4.2	0	0	0	113
147	T	36.9	Very low	34.8	Very low	111 Å²	111	119.2 Å²	119.2	68%	0.681	68%	0.682	S	S	*	*			trans	50.6	133.5	150	58.9	0	0	0	0	120.5
148	T	38.3	Very low	34.7	Very low	111 Å²	111	122 Å²	122	68%	0.681	69%	0.688	S	S	*	*			cis	-163.6	128.2	-1.1	12.5	0	0	0	0	109.4
149	D	36.1	Very low	34.3	Very low	130 Å²	130	121 Å²	121	70%	0.695	68%	0.682	S	S	*	*				55.7	138.5	118	-60.3	21.5	0	0	0	121.2
150	N	35.6	Very low	33.9	Very low	115 Å²	115	124 Å²	124	62%	0.615	69%	0.692	S	S	*	*			cis	-163.9	136.5	-5.2	-111.5	-37.2	0	0	0	112
151	N	33.9	Very low	33.5	Very low	110 Å²	110	127 Å²	127	59%	0.588	70%	0.699	S	S	*	*			trans	42.3	142.3	132.6	-70.2	-31.2	0	0	0	122.1
152	Y	33.7	Very low	32.9	Very low	207 Å²	207	128.1 Å²	128.1	81%	0.812	71%	0.705	S	S	*	*			cis	-142.7	-167.6	10.3	-86.4	-53.9	0	0	0	109.1
153	V	33.1	Very low	32.6	Very low	127 Å²	127	132.6 Å²	132.6	77%	0.77	71%	0.714	S	S	*	*			cis	-153.6	-170.1	14.9	80.7	0	0	0	0	112
154	S	29.4	Very low	32.1	Very low	88 Å²	88	135.2 Å²	135.2	62%	0.615	72%	0.72	S	S	*	*			trans	-58.4	159.2	175.4	-42.7	0	0	0	0	114.7
155	S	31.3	Very low	31.8	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	72%	0.724	S	S	*	*			cis	-145.8	138.6	26.9	-65.1	0	0	0	0	110.7
156	I	28.3	Very low	31.4	Very low	157 Å²	157	136.7 Å²	136.7	81%	0.805	73%	0.729	S	S	*	*				54.8	119.9	81.3	-55.5	166.8	0	0	0	111.6
157	A	28.8	Very low	31.2	Very low	74 Å²	74	136.2 Å²	136.2	61%	0.612	73%	0.733	S	S	*	*			cis	-143.7	160.5	11.7	0	0	0	0	0	111.9
158	L	27.7	Very low	30.9	Very low	156 Å²	156	139.1 Å²	139.1	82%	0.817	74%	0.743	S	S	*	*				46.4	135.2	95.9	-49.2	172.9	0	0	0	115.2
159	T	26.5	Very low	30.6	Very low	108 Å²	108	143.5 Å²	143.5	66%	0.663	75%	0.753	S	S	*	*			cis	-170.8	161.9	0.2	12.8	0	0	0	0	110.6
160	N	27.8	Very low	30.4	Very low	146 Å²	146	142.3 Å²	142.3	78%	0.781	75%	0.754	S	S	*	*			trans	66.1	141.7	164.7	-54.6	-26.7	0	0	0	116.4
161	K	28.2	Very low	30.1	Very low	188 Å²	188	143.4 Å²	143.4	82%	0.817	76%	0.759	S	S	*	*			cis	86.4	127.6	21.4	-152.3	179.9	-168.3	-178.2	0	114.3
162	Q	26.7	Very low	30	Very low	171 Å²	171	144.8 Å²	144.8	80%	0.799	77%	0.766	S	S	*	*			trans	93.7	156.6	177.8	-57.6	177.8	-55.2	0	0	117.4
163	Y	31.4	Very low	29.9	Very low	204 Å²	204	141.4 Å²	141.4	80%	0.8	76%	0.762	S	S	*	*			trans	64.2	121.3	-168.5	-54.7	-78.2	0	0	0	113.8
164	K	29	Very low	29.8	Very low	179 Å²	179	140 Å²	140	78%	0.778	75%	0.754	S	S	*	*			cis	68.3	132.7	13.3	-107.8	-166.5	-178.7	-169.4	0	117.1
165	D	30.9	Very low	30	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	76%	0.757	S	S	*	*			trans	70	97.8	163.9	-49	-31.2	0	0	0	119.2
166	S	29.3	Very low	30	Very low	119 Å²	119	143.3 Å²	143.3	83%	0.832	76%	0.755	S	S	*	*			trans	-163.1	130.8	147.1	-84.4	0	0	0	0	111.8
167	P	32.1	Very low	30.1	Very low	120 Å²	120	145 Å²	145	78%	0.779	76%	0.757	S	S	*	*			trans	-88.7	138.1	-178.9	33.9	-33.8	0	0	0	112.9	K169	P167-K169 PolarHBondContact O-N 3.45Å
168	L	31.4	Very low	30.2	Very low	171 Å²	171	151.6 Å²	151.6	90%	0.895	77%	0.768	S	S	*	*			trans	-71.8	113.6	179.2	-70.2	171	0	0	0	112.2
169	K	31.9	Very low	30.2	Very low	203 Å²	203	149.7 Å²	149.7	88%	0.883	77%	0.768	S	S	*	*			trans	-104.1	96.7	167.1	-81.6	-179	175.1	173.6	0	110.6	P167	P167-K169 PolarHBondContact O-N 3.45Å
170	C	31	Very low	30.3	Very low	105 Å²	105	152.3 Å²	152.3	71%	0.709	78%	0.777	S	S	*	*			trans	-135.5	135.4	169.7	-60.3	0	0	0	0	108
171	L	30.7	Very low	30.4	Very low	138 Å²	138	150.5 Å²	150.5	72%	0.723	78%	0.776	S	S	*	*			cis	-129.8	162.3	-7.9	-65.3	89.5	0	0	0	109.2
172	N	31.3	Very low	30.5	Very low	140 Å²	140	148.6 Å²	148.6	75%	0.749	78%	0.775	S	S	*	*			trans	-144.5	76.7	166.8	-153.9	37.9	0	0	0	110.1	T174	N172-T174 PolarHBondContact O-N 3.08Å; N172-T174 PolarHBondContact O-OG1 3.4Å
173	N	31.3	Very low	30.6	Very low	136 Å²	136	146.3 Å²	146.3	73%	0.727	78%	0.775	S	S	*	*			trans	-70.6	89.5	-171.7	-73.7	7.3	0	0	0	111.7	I175	N173-I175 PolarHBondContact O-N 3.47Å
174	T	31.3	Very low	30.8	Very low	96 Å²	96	143.9 Å²	143.9	59%	0.589	77%	0.774	S	S	*	*			trans	-81.2	102.3	179.8	-54.5	0	0	0	0	110.2	N172 N176	N172-T174 PolarHBondContact O-N 3.08Å; N172-T174 PolarHBondContact O-OG1 3.4Å; T174-N176 PolarHBondContact O-N 2.73Å; T174-N176 VanDerWaalsContact O-N 3.1Å
175	I	33.5	Very low	30.7	Very low	135 Å²	135	142.5 Å²	142.5	69%	0.692	77%	0.77	S	S	*	*			trans	-81.7	86.5	175.6	-56.3	178.8	0	0	0	109.4	N173 F177	N173-I175 PolarHBondContact O-N 3.47Å; I175-F177 HydrophobicContact CG2-CD2 3.61Å; I175-F177 HydrophobicContact CG2-CE2 3.35Å; I175-F177 HydrophobicContact CG2-CZ 4.13Å; I175-F177 PolarHBondContact O-N 3.23Å
176	N	30.1	Very low	30.9	Very low	128 Å²	128	145.4 Å²	145.4	68%	0.684	78%	0.777	S	S	*	*			trans	-79.4	102.4	173.9	-81	-30.1	0	0	0	111.2	T174	T174-N176 PolarHBondContact O-N 2.73Å; T174-N176 VanDerWaalsContact O-N 3.1Å
177	F	31.7	Very low	31	Very low	191 Å²	191	145.1 Å²	145.1	84%	0.838	77%	0.766	S	S	*	*			trans	-97	102.5	165.5	-79.1	-64.2	0	0	0	111.1	I175 S179	I175-F177 HydrophobicContact CG2-CD2 3.61Å; I175-F177 HydrophobicContact CG2-CE2 3.35Å; I175-F177 HydrophobicContact CG2-CZ 4.13Å; I175-F177 PolarHBondContact O-N 3.23Å; F177-S179 PolarHBondContact O-N 2.82Å
178	Y	30.7	Very low	30.9	Very low	213 Å²	213	145.2 Å²	145.2	84%	0.835	77%	0.767	S	S	*	*			trans	-72.6	121.1	166.6	-90.2	-86.7	0	0	0	110.5	N180	Y178-N180 PolarHBondContact O-N 3.04Å; Y178-N180 VanDerWaalsContact O-N 3.15Å
179	S	26.9	Very low	31	Very low	117 Å²	117	144.9 Å²	144.9	82%	0.818	76%	0.764	S	S	*	*			trans	-82	86.1	178.4	55.1	0	0	0	0	111.5	F177 S181	F177-S179 PolarHBondContact O-N 2.82Å; S179-S181 PolarHBondContact O-N 2.83Å
180	N	30.3	Very low	30.8	Very low	162 Å²	162	140.5 Å²	140.5	87%	0.866	76%	0.757	S	S	*	*			trans	-79.4	109.1	169.1	-104.2	6.2	0	0	0	110.4	Y178	Y178-N180 PolarHBondContact O-N 3.04Å; Y178-N180 VanDerWaalsContact O-N 3.15Å
181	S	29.1	Very low	30.9	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	76%	0.761	S	S	*	*			trans	-86.9	115.3	178.3	53	0	0	0	0	111.8	S179	S179-S181 PolarHBondContact O-N 2.83Å
182	N	29.9	Very low	30.9	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	76%	0.764	S	S	*	*			trans	-95.1	115.7	163.4	-81.6	-17.6	0	0	0	109.4	I184	N182-I184 PolarHBondContact O-N 3.45Å
183	P	30	Very low	30.6	Very low	123 Å²	123	143.1 Å²	143.1	80%	0.799	77%	0.77	S	S	*	*			trans	-79.8	115.1	173.7	31.1	-31.1	0	0	0	110
184	I	33.6	Very low	30.6	Very low	153 Å²	153	140.8 Å²	140.8	79%	0.785	77%	0.77	S	S	*	*			trans	-99.3	110.3	169.4	-61.9	-176.8	0	0	0	109.1	N182	N182-I184 PolarHBondContact O-N 3.45Å
185	Q	28	Very low	30.4	Very low	149 Å²	149	141.4 Å²	141.4	70%	0.696	77%	0.773	S	S	*	*			trans	-40.1	138.8	169.7	172.1	-177.4	-19.4	0	0	114.2	D187	Q185-D187 PolarHBondContact NE2-OD1 3.42Å
186	F	34.1	Very low	30.3	Very low	197 Å²	197	141.2 Å²	141.2	86%	0.864	77%	0.774	S	S	*	*			trans	-129.5	144	153.2	-98	-83.4	0	0	0	108.8
187	D	31.6	Very low	30.3	Very low	114 Å²	114	140.8 Å²	140.8	61%	0.61	78%	0.776	S	S	*	*			trans	-85.5	154.5	-158.5	-61.4	-59.1	0	0	0	115.1	Q185	Q185-D187 PolarHBondContact NE2-OD1 3.42Å
188	P	29.8	Very low	30.3	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	78%	0.775	S	S	*	*			trans	-83.1	136.1	179	32.9	-34.3	0	0	0	112.8
189	I	34.5	Very low	30.2	Very low	163 Å²	163	135.4 Å²	135.4	84%	0.836	77%	0.767	S	S	*	*			trans	-126	129.5	166.6	-60.7	-177.2	0	0	0	108.8
190	P	28.5	Very low	30.4	Very low	112 Å²	112	136 Å²	136	73%	0.727	76%	0.761	S	S	*	*			trans	-104.6	-153.2	-168.4	42.2	-37.7	0	0	0	113.5
191	V	31.5	Very low	30.5	Very low	133 Å²	133	135 Å²	135	81%	0.806	76%	0.756	S	S	*	*			trans	96.5	130	174	-180	0	0	0	0	114.5
192	T	30.9	Very low	30.5	Very low	128 Å²	128	136.9 Å²	136.9	79%	0.785	76%	0.757	S	S	*	*			cis	-160.6	157	-18.5	-92.7	0	0	0	0	108.9
193	M	24.8	Very low	30.6	Very low	176 Å²	176	137.1 Å²	137.1	87%	0.867	76%	0.758	S	S	*	*			trans	-85	152.1	-177.6	-64.6	-161.8	-64.1	0	0	116.2
194	A	31.4	Very low	30.6	Very low	87 Å²	87	136.3 Å²	136.3	72%	0.719	75%	0.747	S	S	*	*			trans	-152.6	100.3	148.8	0	0	0	0	0	108.8
195	T	28.3	Very low	30.2	Very low	109 Å²	109	135.6 Å²	135.6	67%	0.669	75%	0.754	S	S	*	*				54.1	121.1	94.9	65.9	0	0	0	0	114
196	N	30.3	Very low	30.2	Very low	131 Å²	131	136.6 Å²	136.6	70%	0.701	76%	0.758	S	S	*	*				-163.8	148.6	52	-87.4	-59.9	0	0	0	115
197	T	30.5	Very low	30	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	76%	0.756	S	S	*	*			trans	55.3	138.9	140.1	62.3	0	0	0	0	121.6
198	M	31.5	Very low	29.8	Very low	165 Å²	165	138.3 Å²	138.3	81%	0.813	77%	0.77	S	S	*	*			cis	-145.5	162.1	11.1	-75.2	-159.6	173	0	0	113.9
199	N	29.5	Very low	29.6	Very low	127 Å²	127	141.7 Å²	141.7	68%	0.679	77%	0.773	S	S	*	*			trans	67.7	100.3	147.9	-78.3	-7.4	0	0	0	122.9
200	N	30.6	Very low	29.2	Very low	129 Å²	129	141.1 Å²	141.1	69%	0.69	77%	0.772	S	S	*	*				58.5	91.7	111.2	-59.1	0.3	0	0	0	120.6
201	N	32.9	Very low	29.1	Very low	141 Å²	141	141.9 Å²	141.9	75%	0.754	77%	0.774	S	S	*	*				161.7	112.1	99.5	-79	-29	0	0	0	110.1
202	N	28.1	Very low	29	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	77%	0.765	S	S	*	*				50	89.3	87.7	-84.7	-11.9	0	0	0	115.1
203	L	31.6	Very low	28.9	Very low	155 Å²	155	145.4 Å²	145.4	81%	0.812	77%	0.771	S	S	*	*				-170.3	133.8	97.9	-125	69.4	0	0	0	115.3
204	N	29.8	Very low	29.1	Very low	106 Å²	106	145 Å²	145	57%	0.567	77%	0.769	S	S	*	*			trans	49.6	84.1	139.4	-161.2	16	0	0	0	121.7	Q206	N204-Q206 VanDerWaalsContact C-N 3.35Å; N204-Q206 PolarHBondContact O-N 3.39Å; N204-Q206 VanDerWaalsContact O-N 3.14Å; N204-Q206 WeakPolarHBondContact OD1-CB 3.43Å; N204-Q206 PolarHBondContact OD1-N 3.02Å
205	C	25.1	Very low	29.1	Very low	137 Å²	137	147.8 Å²	147.8	93%	0.926	77%	0.772	S	S	*	*			trans	-82.3	67	162.6	-62.3	0	0	0	0	112.9
206	Q	29.7	Very low	29.2	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	77%	0.773	S	S	*	*			trans	-135.6	39	171.7	-66.8	-165.2	-21.4	0	0	113.7	N204	N204-Q206 VanDerWaalsContact C-N 3.35Å; N204-Q206 PolarHBondContact O-N 3.39Å; N204-Q206 VanDerWaalsContact O-N 3.14Å; N204-Q206 WeakPolarHBondContact OD1-CB 3.43Å; N204-Q206 PolarHBondContact OD1-N 3.02Å
207	Q	28.6	Very low	29.1	Very low	173 Å²	173	148.2 Å²	148.2	81%	0.808	78%	0.776	S	S	*	*			trans	-126.2	80	173.7	-72.5	-172.9	-19.5	0	0	111.8
208	L	27.6	Very low	29.2	Very low	174 Å²	174	150.1 Å²	150.1	91%	0.911	78%	0.782	S	S	*	*			trans	-140.8	37.2	168	-81.4	-177.9	0	0	0	112.6
209	F	26.2	Very low	29.3	Very low	193 Å²	193	148.1 Å²	148.1	85%	0.846	78%	0.779	S	S	*	*	S	Bend	trans	-140.8	121.6	165.7	-85.3	-78.3	0	0	0	109.4
210	N	26.8	Very low	29.3	Very low	152 Å²	152	149.6 Å²	149.6	81%	0.813	79%	0.787	S	S	*	*			trans	62.2	135.4	178.7	-45.2	-29.1	0	0	0	113.3
211	T	26.1	Very low	29.6	Very low	128 Å²	128	148.5 Å²	148.5	79%	0.785	79%	0.786	S	S	*	*			cis	-142.7	173.7	6.4	-27.3	0	0	0	0	106.4
212	V	28.3	Very low	29.6	Very low	100 Å²	100	149.2 Å²	149.2	61%	0.606	79%	0.787	S	S	*	*				-175.7	126.6	83.7	158.6	0	0	0	0	107.2	M214	V212-M214 HydrophobicContact CG1-CE 4.05Å; V212-M214 HydrophobicContact CG1-CG 3.93Å; V212-M214 HydrophobicContact CG1-SD 3.75Å
213	Y	29	Very low	29.8	Very low	234 Å²	234	148.6 Å²	148.6	92%	0.918	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-78.1	119.8	152.7	-115	-103.5	0	0	0	106.5	N215	Y213-N215 PolarHBondContact O-N 3.11Å
214	M	29.7	Very low	29.8	Very low	169 Å²	169	147.4 Å²	147.4	83%	0.833	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.7	118	173.9	-80.7	-62.8	-174.4	0	0	109.3	V212 P216	V212-M214 HydrophobicContact CG1-CE 4.05Å; V212-M214 HydrophobicContact CG1-CG 3.93Å; V212-M214 HydrophobicContact CG1-SD 3.75Å; M214-P216 WeakPolarHBondContact O-CD 3.26Å
215	N	31.2	Very low	29.9	Very low	144 Å²	144	151 Å²	151	77%	0.77	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82.4	118.7	179.9	-172.1	30.2	0	0	0	109.9	Y213 N217	Y213-N215 PolarHBondContact O-N 3.11Å; N215-N217 PolarHBondContact O-N 3.3Å
216	P	30.3	Very low	30	Very low	106 Å²	106	153.4 Å²	153.4	69%	0.688	79%	0.789	S	S	*	*			trans	-84.1	94.2	179.7	32.9	-31.8	0	0	0	110.5	M214	M214-P216 WeakPolarHBondContact O-CD 3.26Å
217	N	28.4	Very low	30	Very low	144 Å²	144	154.3 Å²	154.3	77%	0.77	79%	0.791	S	S	*	*			trans	177.9	108.9	153.3	-93.3	-32	0	0	0	110.1	N215	N215-N217 PolarHBondContact O-N 3.3Å
218	D	32.3	Very low	29.9	Very low	159 Å²	159	150.5 Å²	150.5	85%	0.85	78%	0.783	S	S	*	*			trans	-168.4	130.8	133.4	-110.8	-22.7	0	0	0	114.4
219	V	33.2	Very low	29.9	Very low	123 Å²	123	148.9 Å²	148.9	75%	0.745	77%	0.774	S	S	*	*			trans	51.2	89.7	152.4	-164.7	0	0	0	0	120.6
220	N	30.9	Very low	29.9	Very low	158 Å²	158	149 Å²	149	85%	0.845	77%	0.77	S	S	*	*				54	163.5	109.8	-93	-11	0	0	0	123.2
221	P	36.4	Very low	30	Very low	105 Å²	105	148 Å²	148	68%	0.682	77%	0.765	S	S	*	*			trans	-116.5	169.2	-148.9	43.4	-36.3	0	0	0	115.7
222	M	32.5	Very low	30.1	Very low	157 Å²	157	148.4 Å²	148.4	77%	0.773	76%	0.762	S	S	*	*			trans	-177.4	125.2	131	-98	-60.9	172.8	0	0	109.5
223	D	33.3	Very low	30.2	Very low	134 Å²	134	152.6 Å²	152.6	72%	0.717	77%	0.768	S	S	*	*				159.7	109.3	112.5	-103.4	-50.7	0	0	0	113.8
224	N	30.6	Very low	30.3	Very low	129 Å²	129	147.4 Å²	147.4	69%	0.69	76%	0.756	S	S	*	*			trans	32.5	96.9	134.9	-64.3	-62.4	0	0	0	120.3
225	Q	31.1	Very low	30.2	Very low	183 Å²	183	145 Å²	145	86%	0.855	75%	0.746	S	S	*	*				-160.3	128.5	110.7	-113	156.9	87.6	0	0	113.6
226	Q	27.1	Very low	30.4	Very low	187 Å²	187	146 Å²	146	87%	0.874	75%	0.752	S	S	*	*			trans	-110.5	112.4	177.5	179.3	-178.5	8.8	0	0	108.5
227	F	30	Very low	30.3	Very low	189 Å²	189	147.2 Å²	147.2	83%	0.829	75%	0.753	S	S	*	*			trans	-137.2	153.9	167.4	-93.2	-74.8	0	0	0	110.7
228	S	26.8	Very low	30.7	Very low	93 Å²	93	147 Å²	147	65%	0.65	75%	0.752	S	S	*	*			trans	-139	173.9	-162.7	59.2	0	0	0	0	111.3
229	I	27.6	Very low	30.6	Very low	139 Å²	139	145.6 Å²	145.6	71%	0.713	74%	0.744	S	S	*	*			trans	75.9	113.4	151.7	-75.7	166.7	0	0	0	117.4
230	Y	27.2	Very low	30.7	Very low	197 Å²	197	148.7 Å²	148.7	77%	0.773	75%	0.75	S	S	*	*			trans	61.6	122	139.5	-76.4	-107	0	0	0	122.4
231	D	27.9	Very low	30.5	Very low	131 Å²	131	145 Å²	145	70%	0.701	74%	0.736	S	S	*	*				64.4	158.3	124.3	-69.8	7.5	0	0	0	124.6
232	L	28.1	Very low	30.2	Very low	136 Å²	136	147.1 Å²	147.1	71%	0.712	74%	0.741	S	S	*	*			trans	95.3	143	148	-81.8	155	0	0	0	121
233	Y	30.5	Very low	30	Very low	188 Å²	188	149.9 Å²	149.9	74%	0.737	74%	0.743	S	S	*	*			trans	72.9	146	165.1	-61.7	-60.5	0	0	0	118.4
234	N	30.8	Very low	29.8	Very low	125 Å²	125	149.4 Å²	149.4	67%	0.668	74%	0.74	S	S	*	*			cis	-146.1	162.4	4.1	-140.3	-25.9	0	0	0	115.3
235	N	29.1	Very low	29.9	Very low	118 Å²	118	149.5 Å²	149.5	63%	0.631	74%	0.741	S	S	*	*			trans	-25.4	145.5	169.8	-78.1	-77.9	0	0	0	118.5
236	N	35.3	Very low	30	Very low	166 Å²	166	147.4 Å²	147.4	89%	0.888	74%	0.736	S	S	*	*				-145.9	111.2	117	-111.5	-35.2	0	0	0	111.1
237	N	28.1	Very low	30	Very low	131 Å²	131	146 Å²	146	70%	0.701	73%	0.733	S	S	*	*			trans	-136.8	109.5	-177.7	-141.6	-5	0	0	0	108.8
238	N	35.8	Very low	30.1	Very low	140 Å²	140	142 Å²	142	75%	0.749	73%	0.729	S	S	*	*			trans	-154.1	106.7	167.7	-92.9	-49.9	0	0	0	107.6
239	N	30.5	Very low	30.1	Very low	129 Å²	129	145.6 Å²	145.6	69%	0.69	73%	0.728	S	S	*	*				69.5	86.2	85	-71.9	-42.9	0	0	0	113
240	H	34.3	Very low	30.2	Very low	188 Å²	188	149 Å²	149	87%	0.87	74%	0.738	S	S	*	*				166.1	157.3	120	-91.5	-81.3	0	0	0	109.6
241	S	28.3	Very low	30.2	Very low	80 Å²	80	145.7 Å²	145.7	56%	0.559	73%	0.73	S	S	*	*			cis	171.3	124	-36.1	175	0	0	0	0	106.6
242	L	29	Very low	30.3	Very low	149 Å²	149	145.1 Å²	145.1	78%	0.78	74%	0.735	S	S	*	*			trans	66.1	157.3	173.2	-53.7	157.1	0	0	0	114.1
243	R	29.6	Very low	30.3	Very low	215 Å²	215	147 Å²	147	81%	0.811	74%	0.74	S	S	*	*			cis	-149.8	151.7	-2.5	-143.1	170.5	-179.7	-172.8	-1	112.6
244	N	28.6	Very low	30.4	Very low	125 Å²	125	143.9 Å²	143.9	67%	0.668	75%	0.745	S	S	*	*			trans	-38.8	150.7	167	-34.2	-4	0	0	0	115.6
245	N	32.8	Very low	30.5	Very low	130 Å²	130	142.3 Å²	142.3	70%	0.695	74%	0.744	S	S	*	*				176.1	146.1	98.3	-90.1	-27.9	0	0	0	114.5
246	N	31.9	Very low	30.7	Very low	140 Å²	140	143.3 Å²	143.3	75%	0.749	75%	0.748	S	S	*	*			trans	48	121.2	147.8	-49.6	-11.4	0	0	0	119.1
247	L	28.3	Very low	30.7	Very low	156 Å²	156	142.4 Å²	142.4	82%	0.817	74%	0.738	S	S	*	*			cis	69.8	93.6	20.2	-160.4	77.9	0	0	0	117.3
248	S	31.4	Very low	31.1	Very low	107 Å²	107	143.9 Å²	143.9	75%	0.748	74%	0.738	S	S	*	*			trans	-162.2	106.6	148.8	53.8	0	0	0	0	106.3
249	R	28	Very low	31.1	Very low	168 Å²	168	143.9 Å²	143.9	63%	0.634	74%	0.738	S	S	*	*			cis	64.5	96.9	43.7	-157.4	-177.8	-167.3	-178	1.2	112.7	E251	R249-E251 IonicContact CZ-OE1 3.19Å; R249-E251 IonicContact CZ-OE2 3.39Å; R249-E251 VanDerWaalsContact NE-CD 3.29Å; R249-E251 IonicContact NE-OE1 2.78Å; R249-E251 PolarHBondContact NE-OE1 3.35Å; R249-E251 IonicContact NE-OE2 3.34Å; R249-E251 PolarHBondContact NE-OE2 2.94Å; R249-E251 IonicContact NH2-OE1 2.75Å; R249-E251 PolarHBondContact NH2-OE1 3.12Å; R249-E251 IonicContact NH2-OE2 2.89Å; R249-E251 PolarHBondContact NH2-OE2 3.35Å
250	F	28.4	Very low	31.3	Very low	209 Å²	209	147.7 Å²	147.7	92%	0.917	74%	0.743	S	S	*	*			trans	-125.2	87.1	157.7	-94.2	-76.4	0	0	0	108.9
251	E	28.2	Very low	31.6	Very low	128 Å²	128	146.5 Å²	146.5	60%	0.598	74%	0.735	S	S	*	*			trans	-72.8	150.2	144.1	-71.5	148.6	-151.7	0	0	106	R249	R249-E251 IonicContact CZ-OE1 3.19Å; R249-E251 IonicContact CZ-OE2 3.39Å; R249-E251 VanDerWaalsContact NE-CD 3.29Å; R249-E251 IonicContact NE-OE1 2.78Å; R249-E251 PolarHBondContact NE-OE1 3.35Å; R249-E251 IonicContact NE-OE2 3.34Å; R249-E251 PolarHBondContact NE-OE2 2.94Å; R249-E251 IonicContact NH2-OE1 2.75Å; R249-E251 PolarHBondContact NH2-OE1 3.12Å; R249-E251 IonicContact NH2-OE2 2.89Å; R249-E251 PolarHBondContact NH2-OE2 3.35Å
252	C	29.9	Very low	32.2	Very low	119 Å²	119	148 Å²	148	80%	0.804	74%	0.736	S	S	*	*				-172.2	164.3	54.1	-173	0	0	0	0	110
253	H	27.4	Very low	32.9	Very low	177 Å²	177	146.5 Å²	146.5	82%	0.819	73%	0.729	S	S	*	*			trans	-65.4	148.6	162	-65.5	-114.9	0	0	0	110.9
254	S	32.8	Very low	33.5	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	72%	0.724	S	S	*	*				-155.9	156.8	129.6	-157.6	0	0	0	0	111.1
255	S	33.7	Very low	34.4	Very low	92 Å²	92	142.9 Å²	142.9	64%	0.643	73%	0.726	S	S	*	*			trans	-114.5	150.6	-170.5	-67.3	0	0	0	0	112.3
256	I	32.7	Very low	34.8	Very low	139 Å²	139	143.3 Å²	143.3	71%	0.713	73%	0.728	S	S	*	*			trans	74.1	113.3	144	-75.1	166.8	0	0	0	118.2
257	Q	35.3	Very low	35.3	Very low	147 Å²	147	142.6 Å²	142.6	69%	0.687	73%	0.729	S	S	*	*			trans	69.7	148.3	150.5	-67.2	172.8	39.3	0	0	117.7
258	K	36.6	Very low	35.8	Very low	161 Å²	161	138.3 Å²	138.3	70%	0.7	72%	0.722	S	S	*	*			cis	-154.1	153.3	6.8	-124.5	153.8	-176.7	153.2	0	110.1
259	L	34.8	Very low	36.2	Very low	141 Å²	141	139.8 Å²	139.8	74%	0.738	72%	0.721	S	S	*	*			trans	17	135.3	145.4	-57.1	172.3	0	0	0	118.5
260	R	35.7	Very low	36.8	Very low	209 Å²	209	138.4 Å²	138.4	79%	0.789	73%	0.727	S	S	*	*			cis	-171	149.3	18.6	-119.2	179.4	-173.8	174.2	2.4	111.3
261	K	39.8	Very low	37.6	Very low	163 Å²	163	134.3 Å²	134.3	71%	0.709	71%	0.713	S	S	*	*			trans	59.8	118.6	143.6	-68.8	-143.6	166	-158.2	0	120.7
262	N	41.6	Very low	38.2	Very low	110 Å²	110	135 Å²	135	59%	0.588	72%	0.721	S	S	*	*				109.5	144.2	73.4	-86.3	46.1	0	0	0	108
263	D	44	Very low	38.6	Very low	119 Å²	119	137.1 Å²	137.1	64%	0.636	72%	0.719	S	S	*	*			cis	-157.9	172	-5.1	-85.4	-26.2	0	0	0	110.7
264	D	42.7	Very low	39.3	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	72%	0.72	S	S	*	*			trans	73.5	108.9	151	-62	-26.9	0	0	0	124.2
265	N	46	Very low	39.7	Very low	134 Å²	134	137.5 Å²	137.5	72%	0.717	72%	0.717	S	S	*	*				51	149.3	113.1	-39.2	-30.5	0	0	0	120.2
266	D	41.5	Very low	40.2	Very low	139 Å²	139	137.4 Å²	137.4	74%	0.743	72%	0.715	S	S	*	*			cis	-153.6	138.1	25.8	-119	-7.2	0	0	0	108.9
267	V	42.4	Very low	40.4	Very low	126 Å²	126	138.5 Å²	138.5	76%	0.764	72%	0.717	S	S	*	*				80.3	128	85.3	168.7	0	0	0	0	117.3
268	G	38.7	Very low	40.5	Very low	65 Å²	65	138.4 Å²	138.4	67%	0.67	72%	0.716	S	S	*	*			trans	120.3	135.7	157.2	0	0	0	0	0	115.1
269	N	40.5	Very low	40.3	Very low	138 Å²	138	138.8 Å²	138.8	74%	0.738	72%	0.721	S	S	*	*			cis	166.3	167.3	-20.8	-105.7	-2.2	0	0	0	105.8
270	N	41.2	Very low	40.2	Very low	139 Å²	139	140 Å²	140	74%	0.743	72%	0.722	S	S	*	*			trans	76.5	143.6	156	-66.3	-3.5	0	0	0	118.2
271	I	43.8	Very low	40	Very low	124 Å²	124	138 Å²	138	64%	0.636	72%	0.722	S	S	*	*			cis	-169	169.1	-10.8	-123.8	167.5	0	0	0	110.7
272	D	41.1	Very low	39.3	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	72%	0.723	S	S	*	*			trans	62.5	161.2	165.1	-69.1	-10.9	0	0	0	119.8
273	E	38.8	Very low	38.7	Very low	163 Å²	163	136.5 Å²	136.5	76%	0.762	73%	0.729	S	S	*	*			cis	179.3	-175.5	-40.6	-107.9	-76.6	-176.3	0	0	107.3
274	D	42.3	Very low	37.8	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	74%	0.736	S	S	*	*			trans	82.5	90.4	172.4	-68.6	-21.8	0	0	0	119.1
275	D	40.3	Very low	37.1	Very low	151 Å²	151	137 Å²	137	81%	0.807	74%	0.735	S	S	*	*			trans	-96.8	-162.2	147.8	-152.5	25.6	0	0	0	107.1
276	P	45	Very low	36.2	Very low	91 Å²	91	135.9 Å²	135.9	59%	0.591	73%	0.733	S	S	*	*			cis	-135.3	177.3	-12.7	43.8	-27.7	0	0	0	115.2
277	Q	37.3	Very low	35.5	Very low	162 Å²	162	135.3 Å²	135.3	76%	0.757	73%	0.73	S	S	*	*			trans	166.1	142.5	138.2	-94.3	172.1	69.2	0	0	109.6
278	Q	35.9	Very low	34.8	Very low	144 Å²	144	135.5 Å²	135.5	67%	0.673	73%	0.726	S	S	*	*			cis	-163.6	159.3	35	-133.2	161.6	62.5	0	0	110.7
279	Q	33.2	Very low	34.3	Very low	170 Å²	170	139.2 Å²	139.2	79%	0.794	73%	0.73	S	S	*	*			trans	58.5	110	164.2	-70.3	176.5	3.9	0	0	116.8
280	Q	31.9	Very low	33.8	Very low	165 Å²	165	140 Å²	140	77%	0.771	73%	0.733	S	S	*	*			cis	53.7	132.2	37.9	-56.6	-170	19.2	0	0	113.6
281	Q	31.7	Very low	33.2	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	73%	0.73	S	S	*	*			cis	-149.7	164.6	16.1	-130.2	164.1	68	0	0	111.6
282	S	25.4	Very low	32.6	Very low	102 Å²	102	140 Å²	140	71%	0.713	73%	0.733	S	S	*	*			trans	-101.9	-165.7	-179.6	50.7	0	0	0	0	112.2
283	I	28.6	Very low	31.9	Very low	140 Å²	140	139.4 Å²	139.4	72%	0.718	73%	0.73	S	S	*	*			trans	107.3	93.5	159	-59.3	168.7	0	0	0	117.5
284	N	26.3	Very low	31.5	Very low	146 Å²	146	136.9 Å²	136.9	78%	0.781	73%	0.731	S	S	*	*				72.1	146.5	123.7	-81	-7.2	0	0	0	126.2
285	V	27.1	Very low	31	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.685	73%	0.725	S	S	*	*			trans	82	98.1	135.7	167.8	0	0	0	0	119.5
286	T	26.6	Very low	30.5	Very low	109 Å²	109	133.7 Å²	133.7	67%	0.669	73%	0.726	S	S	*	*			trans	59.8	159.1	135.1	69.2	0	0	0	0	123.1
287	D	27.8	Very low	29.7	Very low	127 Å²	127	134.1 Å²	134.1	68%	0.679	73%	0.728	S	S	*	*			trans	95.2	110.5	144.9	-66.2	-44.6	0	0	0	122.1
288	I	28.1	Very low	29.5	Very low	131 Å²	131	135.6 Å²	135.6	67%	0.672	73%	0.734	S	S	*	*				91.5	107.1	124.1	-69.1	173	0	0	0	119.3
289	N	26.8	Very low	29.1	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	73%	0.732	S	S	*	*			trans	72.8	170.5	145.6	-68.3	-11.1	0	0	0	120.6
290	L	30	Very low	29	Very low	153 Å²	153	134.7 Å²	134.7	80%	0.801	74%	0.736	S	S	*	*			trans	82.2	131.6	167.9	-51.5	-179.1	0	0	0	114.9
291	L	29	Very low	28.9	Very low	129 Å²	129	132 Å²	132	68%	0.675	73%	0.727	S	S	*	*			cis	-170.9	145.5	-7.4	-166.5	59.6	0	0	0	111.8
292	L	30.8	Very low	28.8	Very low	134 Å²	134	129.6 Å²	129.6	70%	0.702	73%	0.726	S	S	*	*			trans	57.5	157.4	155.5	-94	36.9	0	0	0	119.3
293	N	27.4	Very low	29.1	Very low	131 Å²	131	132.6 Å²	132.6	70%	0.701	73%	0.732	S	S	*	*			cis	-164.5	175.9	-26.3	-122.1	16.1	0	0	0	110
294	S	31	Very low	29.2	Very low	110 Å²	110	130.5 Å²	130.5	77%	0.769	73%	0.73	S	S	*	*			trans	89.9	96.6	-177.8	-38.7	0	0	0	0	112.3
295	S	30	Very low	29.4	Very low	103 Å²	103	129 Å²	129	72%	0.72	73%	0.732	S	S	*	*			cis	70.9	130.8	42	-37.4	0	0	0	0	112.2
296	T	30.2	Very low	29.6	Very low	136 Å²	136	131.2 Å²	131.2	83%	0.834	73%	0.734	S	S	*	*			cis	-142.3	153	18.8	-54.8	0	0	0	0	112.4
297	T	29.7	Very low	29.8	Very low	101 Å²	101	132.3 Å²	132.3	62%	0.62	74%	0.741	S	S	*	*			trans	-99.2	165.5	179.4	48.6	0	0	0	0	113.1	I299	T297-I299 HydrophobicContact CG2-CD1 4.44Å
298	H	32.1	Very low	29.7	Very low	193 Å²	193	132.9 Å²	132.9	89%	0.894	74%	0.744	S	S	*	*				-152.9	139.9	127.9	-110.8	-71.5	0	0	0	111.2
299	I	26.9	Very low	29.9	Very low	120 Å²	120	132 Å²	132	62%	0.615	75%	0.75	S	S	*	*			trans	-144.2	135.3	-166.9	-63.9	168	0	0	0	109.5	T297 N301	T297-I299 HydrophobicContact CG2-CD1 4.44Å; I299-N301 HydrophobicContact CG2-CB 4.01Å
300	I	32.2	Very low	30	Very low	175 Å²	175	134.7 Å²	134.7	90%	0.897	75%	0.754	S	S	*	*			trans	-144.9	81.9	147.9	-52.7	-177.9	0	0	0	106.3
301	N	28.6	Very low	30.2	Very low	107 Å²	107	136.5 Å²	136.5	57%	0.572	76%	0.756	S	S	*	*				89.5	85	68.3	-170.8	35.8	0	0	0	114.3	I299	I299-N301 HydrophobicContact CG2-CB 4.01Å
302	P	31.3	Very low	30.3	Very low	119 Å²	119	138 Å²	138	77%	0.773	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-89.5	132.9	156.7	34.5	-28.3	0	0	0	110.8
303	I	31.8	Very low	30.1	Very low	164 Å²	164	140.7 Å²	140.7	84%	0.841	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-80	128.2	176.5	-66.8	172	0	0	0	109.7
304	S	30.6	Very low	30.3	Very low	96 Å²	96	141 Å²	141	67%	0.671	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-101.6	138.1	-174.2	60.7	0	0	0	0	113.9
305	S	29.8	Very low	30.4	Very low	116 Å²	116	143.5 Å²	143.5	81%	0.811	77%	0.77	S	S	*	*			trans	-105.1	81.5	159.2	43.3	0	0	0	0	110.4
306	Q	30.8	Very low	30.3	Very low	158 Å²	158	145.5 Å²	145.5	74%	0.738	77%	0.767	S	S	*	*			trans	-76.9	124.2	167.7	-74.4	-168.5	-0	0	0	110.5
307	V	32	Very low	30.5	Very low	133 Å²	133	147.5 Å²	147.5	81%	0.806	77%	0.767	S	S	*	*			trans	-116.3	110.6	160.9	-179.7	0	0	0	0	108.3
308	N	25.9	Very low	30.4	Very low	138 Å²	138	150.6 Å²	150.6	74%	0.738	78%	0.775	S	S	*	*			trans	-86.2	131.3	174.3	-80.1	-76.3	0	0	0	110.4
309	S	31	Very low	30.3	Very low	114 Å²	114	149.1 Å²	149.1	80%	0.797	77%	0.773	S	S	*	*			trans	-140.2	77.8	172.6	47.7	0	0	0	0	112.5	K311	S309-K311 PolarHBondContact O-N 3.45Å
310	K	29.2	Very low	30.3	Very low	198 Å²	198	150.2 Å²	150.2	86%	0.861	79%	0.785	S	S	*	*			trans	-70.6	122.6	165	-76.2	-178.1	175.6	178.9	0	110.7
311	K	33.5	Very low	30.4	Very low	192 Å²	192	147.3 Å²	147.3	84%	0.835	78%	0.776	S	S	*	*			trans	-164.5	103.6	149.3	-104	167.1	-176.6	-177.6	0	106.8	S309	S309-K311 PolarHBondContact O-N 3.45Å
312	I	31.6	Very low	30.3	Very low	159 Å²	159	151 Å²	151	82%	0.815	80%	0.795	S	S	*	*				62.4	106.9	78.5	-59.6	173.2	0	0	0	111.1
313	F	26.3	Very low	30.2	Very low	191 Å²	191	150.9 Å²	150.9	84%	0.838	79%	0.787	S	S	*	*			trans	-62.1	145.2	171.1	-102.3	-121.1	0	0	0	112
314	N	31.1	Very low	30.1	Very low	138 Å²	138	148.6 Å²	148.6	74%	0.738	78%	0.776	S	S	*	*				-175.5	141.5	114.3	-97	-16.8	0	0	0	114.5
315	H	33.2	Very low	30.1	Very low	163 Å²	163	153.2 Å²	153.2	76%	0.755	78%	0.78	S	S	*	*			trans	42	104.3	156.4	-74.5	-82	0	0	0	122.2
316	H	29.7	Very low	30.3	Very low	144 Å²	144	151.8 Å²	151.8	67%	0.667	77%	0.77	S	S	*	*				61.4	96.6	108.9	-159.9	90.9	0	0	0	119.2
317	H	32.4	Very low	30.3	Very low	178 Å²	178	149.3 Å²	149.3	82%	0.824	76%	0.762	S	S	*	*				-148.3	144.9	118.4	-122.2	-80.5	0	0	0	110.5
318	Q	28.7	Very low	30.3	Very low	167 Å²	167	149.5 Å²	149.5	78%	0.78	75%	0.754	S	S	*	*			trans	-78.1	138.6	172.3	-68.8	172.9	-24.6	0	0	110.1
319	N	30.2	Very low	30.6	Very low	162 Å²	162	152.9 Å²	152.9	87%	0.866	76%	0.758	S	S	*	*			trans	-151.2	130.8	151.5	-123	-16.9	0	0	0	109.1	T321	N319-T321 PolarHBondContact O-N 3.1Å
320	T	27.7	Very low	30.6	Very low	142 Å²	142	153.1 Å²	153.1	87%	0.871	75%	0.746	S	S	*	*			trans	-84.3	112.7	-171.8	44.8	0	0	0	0	111.3
321	T	32.3	Very low	30.6	Very low	115 Å²	115	152.7 Å²	152.7	71%	0.706	74%	0.741	S	S	*	*			trans	-110	138	156	48.1	0	0	0	0	109.4	N319 I323	N319-T321 PolarHBondContact O-N 3.1Å; T321-I323 VanDerWaalsContact C-N 3.35Å; T321-I323 PolarHBondContact O-N 3.35Å
322	L	27.6	Very low	30.6	Very low	185 Å²	185	151.3 Å²	151.3	97%	0.969	73%	0.731	S	S	*	*			trans	-73	90.6	174.6	-134	78.1	0	0	0	108.1	D324	L322-D324 PolarHBondContact O-N 3.2Å
323	I	29.8	Very low	30.8	Very low	116 Å²	116	148 Å²	148	60%	0.595	71%	0.714	S	S	*	*			trans	-80.4	118.2	173.3	-61.8	179.6	0	0	0	107.5	T321 Y325	T321-I323 VanDerWaalsContact C-N 3.35Å; T321-I323 PolarHBondContact O-N 3.35Å; I323-Y325 WeakPolarHBondContact O-CD2 3.47Å; I323-Y325 PolarHBondContact O-N 3.25Å; I323-Y325 VanDerWaalsContact O-N 3.08Å
324	D	28.3	Very low	31.1	Very low	115 Å²	115	143.5 Å²	143.5	62%	0.615	70%	0.703	S	S	*	*			trans	-70.5	101.6	-177.4	-173.4	-5.6	0	0	0	111	L322 S326	L322-D324 PolarHBondContact O-N 3.2Å; D324-S326 PolarHBondContact O-N 2.85Å; D324-S326 WeakPolarHBondContact OD1-CB 3.28Å; D324-S326 PolarHBondContact OD1-N 3.26Å; D324-S326 VanDerWaalsContact OD1-N 3.11Å
325	Y	32.3	Very low	31.5	Very low	194 Å²	194	145.9 Å²	145.9	76%	0.761	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-71.5	-2.8	-177.7	-81.7	-84.5	0	0	0	114.2	I323 N327	I323-Y325 WeakPolarHBondContact O-CD2 3.47Å; I323-Y325 PolarHBondContact O-N 3.25Å; I323-Y325 VanDerWaalsContact O-N 3.08Å; Y325-N327 PolarHBondContact O-N 3.05Å
326	S	33.9	Very low	31.8	Very low	86 Å²	86	144.3 Å²	144.3	60%	0.601	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-61.4	-41.9	-177.4	-168.5	0	0	0	0	113.3	D324 H328	D324-S326 PolarHBondContact O-N 2.85Å; D324-S326 WeakPolarHBondContact OD1-CB 3.28Å; D324-S326 PolarHBondContact OD1-N 3.26Å; D324-S326 VanDerWaalsContact OD1-N 3.11Å; S326-H328 PolarHBondContact O-N 3.17Å
327	N	30.6	Very low	32.8	Very low	106 Å²	106	144.5 Å²	144.5	57%	0.567	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-91.2	7.6	-162.7	-69.1	-42	0	0	0	116.2	Y325 Y329	Y325-N327 PolarHBondContact O-N 3.05Å; N327-Y329 PolarHBondContact O-N 3.24Å
328	H	31.4	Very low	34.1	Very low	137 Å²	137	141.3 Å²	141.3	63%	0.634	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-87.6	2	-175	-118.1	56.9	0	0	0	115.8	S326	S326-H328 PolarHBondContact O-N 3.17Å
329	Y	31.9	Very low	35.9	Very low	209 Å²	209	135 Å²	135	82%	0.82	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-93.5	-1.7	-177.1	-80.6	-76.6	0	0	0	115.6	N327	N327-Y329 PolarHBondContact O-N 3.24Å
330	Q	30.6	Very low	37.8	Very low	119 Å²	119	127.8 Å²	127.8	56%	0.556	63%	0.629	S	S	*	*	S	Bend	trans	-101.4	-12.4	-155.4	-148.9	163.7	11.2	0	0	116.7
331	Y	29.8	Very low	40.2	Very low	189 Å²	189	121.9 Å²	121.9	74%	0.741	59%	0.592	S	S	*	*	S	Bend	trans	-140.4	49.2	-169.5	-72.8	-76.8	0	0	0	116.3
332	Y	33.9	Very low	42.7	Very low	162 Å²	162	120 Å²	120	64%	0.635	58%	0.575	S	S	*	*			trans	-125.6	28.2	178.8	-66.7	-64.6	0	0	0	115.8
333	I	35.8	Very low	45.4	Very low	90 Å²	90	112.3 Å²	112.3	46%	0.462	53%	0.534	S	S	.	.	S	Bend	trans	-116.2	68.3	167.8	-47.6	179.9	0	0	0	108.8	Q449	I333-Q449 HydrophobicContact CG2-CG 4.42Å; I333-Q449 PolarHBondContact O-NE2 3.02Å
334	T	31.7	Very low	48	Very low	97 Å²	97	113 Å²	113	60%	0.595	54%	0.539	S	S	*	.			trans	-147.1	150.4	-170.9	-4.4	0	0	0	0	112.1	N336	T334-N336 PolarHBondContact O-N 3.2Å
335	E	39	Very low	50.6	Low	188 Å²	188	113.1 Å²	113.1	88%	0.879	54%	0.535	S	S	*	.	S	Bend	trans	61.5	-22	170	-55.9	-162.4	151.5	0	0	120
336	N	41	Very low	53	Low	130 Å²	130	104.4 Å²	104.4	70%	0.695	50%	0.502	S	S	*	.	S	Bend	trans	-115.6	131.1	176	-80.2	-81.3	0	0	0	112.8	T334 K338	T334-N336 PolarHBondContact O-N 3.2Å; N336-K338 HydrophobicContact CB-CG 4.38Å; N336-K338 PolarHBondContact O-N 3.33Å
337	N	49.3	Very low	55.4	Low	147 Å²	147	102.9 Å²	102.9	79%	0.786	49%	0.491	S	S	*	.			trans	-70.6	38.6	-178.8	-68.6	-32	0	0	0	114	L339	N337-L339 PolarHBondContact O-N 3.18Å
338	K	60.8	Low	57.9	Low	111 Å²	111	104 Å²	104	48%	0.483	50%	0.496	S	S	.	.			trans	-76.1	20.1	-177.7	-69.5	-162.7	176.2	-168.3	0	114.6	N336 V341 T368	N336-K338 HydrophobicContact CB-CG 4.38Å; N336-K338 PolarHBondContact O-N 3.33Å; K338-V341 VanDerWaalsContact CA-CG2 3.5Å; K338-V341 HydrophobicContact CB-CG2 3.84Å; K338-V341 HydrophobicContact CG-CG2 4.06Å; K338-T368 PolarHBondContact O-OG1 3.2Å
339	L	65.3	Low	60.3	Low	34 Å²	34	103.5 Å²	103.5	18%	0.178	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	131.1	165.6	-70.2	173	0	0	0	108.7	N337 N365 L445 W448	N337-L339 PolarHBondContact O-N 3.18Å; L339-N365 HydrophobicContact CD2-CB 4.37Å; L339-L445 HydrophobicContact CD1-CD2 3.86Å; L339-W448 HydrophobicContact CD1-CE3 4.37Å; L339-W448 HydrophobicContact CD1-CH2 4.37Å; L339-W448 HydrophobicContact CD1-CZ3 3.67Å; L339-W448 HydrophobicContact CD2-CH2 3.89Å; L339-W448 HydrophobicContact CD2-CZ3 3.69Å; L339-W448 HydrophobicContact CG-CZ3 4.3Å
340	F	71.5	Confident	62.7	Low	12 Å²	12	96 Å²	96	5%	0.053	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	39.4	-177.8	-45.5	-87.8	0	0	0	114.1	T368 Y371 L435 I440 W448	F340-T368 PolarHBondContact N-OG1 3.35Å; F340-Y371 VanDerWaalsContact CA-CD1 3.49Å; F340-Y371 HydrophobicContact CB-CD1 3.67Å; F340-Y371 HydrophobicContact CB-CD2 4.32Å; F340-Y371 HydrophobicContact CB-CE1 3.73Å; F340-Y371 HydrophobicContact CB-CE2 4.37Å; F340-Y371 HydrophobicContact CB-CG 3.95Å; F340-Y371 HydrophobicContact CD1-CD1 4.3Å; F340-Y371 AromaticContact CD1-CD2 3.77Å; F340-Y371 HydrophobicContact CD1-CD2 3.77Å; F340-Y371 HydrophobicContact CD1-CE2 4.4Å; F340-Y371 AromaticContact CD1-CG 3.68Å; F340-Y371 HydrophobicContact CD1-CG 3.68Å; F340-Y371 HydrophobicContact CG-CG 4.32Å; F340-Y371 WeakPolarHBondContact O-CE1 3.47Å; F340-L435 HydrophobicContact CB-CD1 4.47Å; F340-L435 HydrophobicContact CB-CD2 3.45Å; F340-L435 VanDerWaalsContact CB-CD2 3.45Å; F340-L435 HydrophobicContact CD1-CD1 3.62Å; F340-L435 HydrophobicContact CD1-CD2 4Å; F340-L435 HydrophobicContact CD1-CG 4.47Å; F340-L435 HydrophobicContact CD2-CD1 4.47Å; F340-L435 HydrophobicContact CD2-CD2 3.6Å; F340-L435 HydrophobicContact CE1-CD1 3.87Å; F340-L435 HydrophobicContact CE2-CD2 4.32Å; F340-L435 HydrophobicContact CG-CD1 3.95Å; F340-L435 HydrophobicContact CG-CD2 3.41Å; F340-L435 VanDerWaalsContact CG-CD2 3.41Å; F340-L435 HydrophobicContact CG-CG 4.33Å; F340-L435 HydrophobicContact CZ-CD1 4.4Å; F340-I440 HydrophobicContact CD2-CD1 3.85Å; F340-I440 HydrophobicContact CE2-CD1 4.14Å; F340-W448 HydrophobicContact CE2-CH2 4.19Å; F340-W448 HydrophobicContact CE2-CZ2 4.25Å; F340-W448 HydrophobicContact CZ-CH2 4.06Å; F340-W448 AromaticContact CZ-CZ2 3.75Å; F340-W448 HydrophobicContact CZ-CZ2 3.75Å
341	V	78.4	Confident	65.3	Low	18 Å²	18	91.9 Å²	91.9	11%	0.109	45%	0.447	C	S	.	.			trans	-66.3	142.6	164.2	173.7	0	0	0	0	109.4	K338 Q345 L346 T368 M372	K338-V341 VanDerWaalsContact CA-CG2 3.5Å; K338-V341 HydrophobicContact CB-CG2 3.84Å; K338-V341 HydrophobicContact CG-CG2 4.06Å; V341-Q345 HydrophobicContact CG1-CB 4.07Å; V341-L346 HydrophobicContact CG1-CD2 4.07Å; V341-T368 HydrophobicContact CB-CG2 4.34Å; V341-M372 HydrophobicContact CB-CE 3.82Å; V341-M372 HydrophobicContact CG1-CE 3.71Å; V341-M372 WeakPolarHBondContact O-CE 3.33Å; V341-M372 WeakPolarHBondContact O-CG 3.44Å
342	Q	84	Confident	67.6	Low	74 Å²	74	87.4 Å²	87.4	35%	0.346	43%	0.433	S	S	.	.			trans	-87.9	148	172.9	-63.2	-176.9	-45.5	0	0	110.7	D344 Q345 Y371	Q342-D344 PolarHBondContact O-N 3.17Å; Q342-D344 VanDerWaalsContact O-N 3.16Å; Q342-Q345 HydrophobicContact CB-CG 4.13Å; Q342-Q345 WeakPolarHBondContact O-CB 3.44Å; Q342-Q345 PolarHBondContact O-N 3.47Å; Q342-Y371 HydrophobicContact CG-CE1 4Å
343	Y	84.3	Confident	69.8	Low	24 Å²	24	81.3 Å²	81.3	9%	0.094	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-57.9	-32.7	179.5	-173.3	-106.8	0	0	0	112.5	Q345 L346 K351 W390 H394 F395	Y343-Q345 PolarHBondContact O-N 3.19Å; Y343-L346 HydrophobicContact CD2-CD1 3.83Å; Y343-L346 HydrophobicContact CE2-CD1 4.08Å; Y343-L346 WeakPolarHBondContact O-CB 3.5Å; Y343-L346 WeakPolarHBondContact O-CG 3.47Å; Y343-L346 PolarHBondContact O-N 2.92Å; Y343-K351 HydrophobicContact CD1-CD 4.39Å; Y343-K351 HydrophobicContact CE1-CD 3.65Å; Y343-K351 HydrophobicContact CE1-CG 4.22Å; Y343-K351 HydrophobicContact CE2-CD 4.46Å; Y343-K351 HydrophobicContact CE2-CG 4.16Å; Y343-K351 WeakPolarHBondContact O-CE 3.27Å; Y343-K351 PolarHBondContact O-NZ 3.02Å; Y343-W390 HydrophobicContact CD1-CZ2 4.47Å; Y343-W390 AromaticContact CD2-CH2 3.83Å; Y343-W390 HydrophobicContact CD2-CH2 3.83Å; Y343-W390 HydrophobicContact CD2-CZ2 4.16Å; Y343-W390 HydrophobicContact CG-CH2 4.04Å; Y343-W390 AromaticContact CG-CZ2 3.96Å; Y343-W390 HydrophobicContact CG-CZ2 3.96Å; Y343-H394 AromaticContact CE1-CD2 3.62Å; Y343-H394 HydrophobicContact CE2-CB 3.91Å; Y343-H394 AromaticContact CZ-CD2 3.47Å; Y343-H394 VanDerWaalsContact CZ-CD2 3.47Å; Y343-F395 HydrophobicContact CD2-CE2 4.34Å; Y343-F395 AromaticContact CD2-CZ 3.97Å; Y343-F395 HydrophobicContact CD2-CZ 3.97Å; Y343-F395 HydrophobicContact CE2-CE1 4.46Å; Y343-F395 HydrophobicContact CE2-CE2 4.43Å; Y343-F395 AromaticContact CE2-CZ 3.98Å; Y343-F395 HydrophobicContact CE2-CZ 3.98Å
344	D	83.9	Confident	71.9	Confident	131 Å²	131	77.7 Å²	77.7	70%	0.701	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-76.4	-5.6	178.8	-58.7	-39.6	0	0	0	115	Q342 K351	Q342-D344 PolarHBondContact O-N 3.17Å; Q342-D344 VanDerWaalsContact O-N 3.16Å; D344-K351 IonicContact OD1-NZ 3.54Å; D344-K351 PolarHBondContact OD1-NZ 3.14Å
345	Q	83.5	Confident	74	Confident	117 Å²	117	77.3 Å²	77.3	55%	0.547	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-87.6	-6.8	170.1	-64.3	169.1	-24.2	0	0	112.5	V341 Q342 Y343	V341-Q345 HydrophobicContact CG1-CB 4.07Å; Q342-Q345 HydrophobicContact CB-CG 4.13Å; Q342-Q345 WeakPolarHBondContact O-CB 3.44Å; Q342-Q345 PolarHBondContact O-N 3.47Å; Y343-Q345 PolarHBondContact O-N 3.19Å
346	L	83.4	Confident	75.5	Confident	12 Å²	12	74.3 Å²	74.3	6%	0.063	37%	0.373	C	S	.	.	S	Bend	trans	-82.6	136.7	174.1	-53.6	-178	0	0	0	110.2	V341 Y343 E350 K351 Y354 F364 M372 F395	V341-L346 HydrophobicContact CG1-CD2 4.07Å; Y343-L346 HydrophobicContact CD2-CD1 3.83Å; Y343-L346 HydrophobicContact CE2-CD1 4.08Å; Y343-L346 WeakPolarHBondContact O-CB 3.5Å; Y343-L346 WeakPolarHBondContact O-CG 3.47Å; Y343-L346 PolarHBondContact O-N 2.92Å; L346-E350 HydrophobicContact CB-CB 4.43Å; L346-K351 HydrophobicContact CB-CG 3.99Å; L346-K351 WeakPolarHBondContact O-CE 3.3Å; L346-Y354 HydrophobicContact CD1-CD2 4.4Å; L346-Y354 HydrophobicContact CD1-CE2 4.27Å; L346-F364 HydrophobicContact CD1-CE2 3.98Å; L346-F364 HydrophobicContact CD1-CZ 4.06Å; L346-F364 HydrophobicContact CD2-CE1 4.4Å; L346-F364 HydrophobicContact CD2-CE2 4.4Å; L346-F364 HydrophobicContact CD2-CZ 3.64Å; L346-M372 HydrophobicContact CD1-CE 4.16Å; L346-M372 HydrophobicContact CD2-CE 4.32Å; L346-M372 HydrophobicContact CG-CE 4.42Å; L346-F395 HydrophobicContact CD1-CE1 4.39Å; L346-F395 HydrophobicContact CD1-CZ 4.18Å
347	S	82.7	Confident	76.7	Confident	54 Å²	54	71.9 Å²	71.9	38%	0.378	36%	0.36	S	S	.	.			trans	-64.1	154.8	175.8	65.8	0	0	0	0	111.8	H349 E350 K351	S347-H349 PolarHBondContact O-N 3.19Å; S347-E350 VanDerWaalsContact CB-OE2 3.28Å; S347-E350 WeakPolarHBondContact CB-OE2 3.48Å; S347-E350 PolarHBondContact N-OE2 3.35Å; S347-E350 PolarHBondContact O-N 3.04Å; S347-E350 VanDerWaalsContact O-N 3.13Å; S347-E350 WeakPolarHBondContact OG-CB 3.36Å; S347-E350 WeakPolarHBondContact OG-CG 3.44Å; S347-E350 PolarHBondContact OG-N 3.48Å; S347-E350 PolarHBondContact OG-OE2 2.99Å; S347-K351 WeakPolarHBondContact O-CG 3.39Å; S347-K351 PolarHBondContact O-N 2.84Å
348	L	83.3	Confident	77.6	Confident	128 Å²	128	71 Å²	71	67%	0.67	35%	0.354	S	S	*	.	H	α-helix	trans	-54.8	-36.7	177.1	-176.4	65.6	0	0	0	111.9	K351 Q352	L348-K351 PolarHBondContact O-N 3.24Å; L348-Q352 WeakPolarHBondContact O-CB 3.27Å; L348-Q352 VanDerWaalsContact O-CG 3.3Å; L348-Q352 WeakPolarHBondContact O-CG 3.04Å; L348-Q352 PolarHBondContact O-N 3.49Å
349	H	81.9	Confident	77.8	Confident	128 Å²	128	73.3 Å²	73.3	59%	0.593	37%	0.371	S	S	*	.	H	α-helix	trans	-68.9	-44.4	178	-170.9	50.2	0	0	0	112.5	S347 K351 Q352 I353	S347-H349 PolarHBondContact O-N 3.19Å; H349-K351 PolarHBondContact O-N 3.3Å; H349-Q352 PolarHBondContact O-N 3.21Å; H349-I353 WeakPolarHBondContact O-CB 3.42Å; H349-I353 VanDerWaalsContact O-CG1 3.27Å; H349-I353 WeakPolarHBondContact O-CG1 3.37Å; H349-I353 PolarHBondContact O-N 3.42Å
350	E	83.5	Confident	77.8	Confident	51 Å²	51	77.6 Å²	77.6	24%	0.238	39%	0.386	C	S	.	.	H	α-helix	trans	-58.4	-46.6	172.3	-77.1	163.5	117.6	0	0	111.1	L346 S347 Q352 I353 Y354	L346-E350 HydrophobicContact CB-CB 4.43Å; S347-E350 VanDerWaalsContact CB-OE2 3.28Å; S347-E350 WeakPolarHBondContact CB-OE2 3.48Å; S347-E350 PolarHBondContact N-OE2 3.35Å; S347-E350 PolarHBondContact O-N 3.04Å; S347-E350 VanDerWaalsContact O-N 3.13Å; S347-E350 WeakPolarHBondContact OG-CB 3.36Å; S347-E350 WeakPolarHBondContact OG-CG 3.44Å; S347-E350 PolarHBondContact OG-N 3.48Å; S347-E350 PolarHBondContact OG-OE2 2.99Å; E350-Q352 PolarHBondContact O-N 2.67Å; E350-I353 PolarHBondContact O-N 3.19Å; E350-Y354 HydrophobicContact CB-CD2 4.3Å; E350-Y354 HydrophobicContact CB-CE2 3.93Å; E350-Y354 WeakPolarHBondContact O-CB 3.18Å; E350-Y354 WeakPolarHBondContact O-CD2 3.37Å; E350-Y354 VanDerWaalsContact O-CG 3.23Å; E350-Y354 PolarHBondContact O-N 3.23Å
351	K	84	Confident	77.5	Confident	33 Å²	33	83.1 Å²	83.1	14%	0.143	41%	0.41	C	S	.	.	H	α-helix	trans	-58	-49.5	178.1	-68	-176.5	175.9	-168.5	0	111.9	Y343 D344 L346 S347 L348 H349 I353 Y354 Q355	Y343-K351 HydrophobicContact CD1-CD 4.39Å; Y343-K351 HydrophobicContact CE1-CD 3.65Å; Y343-K351 HydrophobicContact CE1-CG 4.22Å; Y343-K351 HydrophobicContact CE2-CD 4.46Å; Y343-K351 HydrophobicContact CE2-CG 4.16Å; Y343-K351 WeakPolarHBondContact O-CE 3.27Å; Y343-K351 PolarHBondContact O-NZ 3.02Å; D344-K351 IonicContact OD1-NZ 3.54Å; D344-K351 PolarHBondContact OD1-NZ 3.14Å; L346-K351 HydrophobicContact CB-CG 3.99Å; L346-K351 WeakPolarHBondContact O-CE 3.3Å; S347-K351 WeakPolarHBondContact O-CG 3.39Å; S347-K351 PolarHBondContact O-N 2.84Å; L348-K351 PolarHBondContact O-N 3.24Å; H349-K351 PolarHBondContact O-N 3.3Å; K351-I353 PolarHBondContact O-N 3.21Å; K351-Y354 PolarHBondContact O-N 3.48Å; K351-Q355 WeakPolarHBondContact O-CG 3.41Å; K351-Q355 PolarHBondContact O-N 3.47Å; K351-Q355 VanDerWaalsContact O-N 3.08Å
352	Q	79.3	Confident	77	Confident	94 Å²	94	82.4 Å²	82.4	44%	0.439	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-40.5	177.1	-74.4	172.8	-24.1	0	0	112.7	L348 H349 E350 N356	L348-Q352 WeakPolarHBondContact O-CB 3.27Å; L348-Q352 VanDerWaalsContact O-CG 3.3Å; L348-Q352 WeakPolarHBondContact O-CG 3.04Å; L348-Q352 PolarHBondContact O-N 3.49Å; H349-Q352 PolarHBondContact O-N 3.21Å; E350-Q352 PolarHBondContact O-N 2.67Å; Q352-N356 VanDerWaalsContact O-CB 3.27Å; Q352-N356 WeakPolarHBondContact O-CB 2.87Å; Q352-N356 PolarHBondContact O-N 3.09Å
353	I	79.3	Confident	76.3	Confident	34 Å²	34	84.4 Å²	84.4	17%	0.174	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-46.7	176.9	-72.8	168.7	0	0	0	110.4	H349 E350 K351 Q355 N356 N357 Y360	H349-I353 WeakPolarHBondContact O-CB 3.42Å; H349-I353 VanDerWaalsContact O-CG1 3.27Å; H349-I353 WeakPolarHBondContact O-CG1 3.37Å; H349-I353 PolarHBondContact O-N 3.42Å; E350-I353 PolarHBondContact O-N 3.19Å; K351-I353 PolarHBondContact O-N 3.21Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 2.99Å; I353-N356 PolarHBondContact O-N 3.13Å; I353-N357 WeakPolarHBondContact O-CB 3.49Å; I353-N357 PolarHBondContact O-N 2.92Å; I353-N357 PolarHBondContact O-ND2 2.64Å; I353-N357 VanDerWaalsContact O-ND2 3.12Å; I353-Y360 HydrophobicContact CB-CD1 4.5Å; I353-Y360 HydrophobicContact CG2-CD1 3.21Å; I353-Y360 HydrophobicContact CG2-CD2 3.87Å; I353-Y360 HydrophobicContact CG2-CE1 3.79Å; I353-Y360 HydrophobicContact CG2-CE2 4.37Å; I353-Y360 HydrophobicContact CG2-CG 3.25Å
354	Y	78.9	Confident	75.9	Confident	15 Å²	15	83.7 Å²	83.7	6%	0.059	42%	0.42	C	S	.	.	H	α-helix	trans	-67.8	-25.5	-178.1	-70	-37.1	0	0	0	115	L346 E350 K351 Y360 P362 F364 F395 D396	L346-Y354 HydrophobicContact CD1-CD2 4.4Å; L346-Y354 HydrophobicContact CD1-CE2 4.27Å; E350-Y354 HydrophobicContact CB-CD2 4.3Å; E350-Y354 HydrophobicContact CB-CE2 3.93Å; E350-Y354 WeakPolarHBondContact O-CB 3.18Å; E350-Y354 WeakPolarHBondContact O-CD2 3.37Å; E350-Y354 VanDerWaalsContact O-CG 3.23Å; E350-Y354 PolarHBondContact O-N 3.23Å; K351-Y354 PolarHBondContact O-N 3.48Å; Y354-Y360 AromaticContact CD1-CD1 3.7Å; Y354-Y360 HydrophobicContact CD1-CD1 3.7Å; Y354-Y360 HydrophobicContact CD1-CE1 4.19Å; Y354-Y360 AromaticContact CE1-CD1 3.45Å; Y354-Y360 HydrophobicContact CE1-CD1 3.45Å; Y354-Y360 VanDerWaalsContact CE1-CD1 3.45Å; Y354-Y360 AromaticContact CE1-CE1 3.51Å; Y354-Y360 HydrophobicContact CE1-CE1 3.51Å; Y354-P362 HydrophobicContact CD1-CB 3.85Å; Y354-P362 HydrophobicContact CD1-CG 4.09Å; Y354-P362 HydrophobicContact CE1-CB 3.55Å; Y354-P362 HydrophobicContact CE1-CG 4.27Å; Y354-P362 HydrophobicContact CE2-CB 4.43Å; Y354-P362 HydrophobicContact CG-CB 4.43Å; Y354-F364 AromaticContact CE2-CE2 3.89Å; Y354-F364 HydrophobicContact CE2-CE2 3.89Å; Y354-F364 HydrophobicContact CE2-CZ 4.11Å; Y354-F395 HydrophobicContact CD2-CD1 4.19Å; Y354-F395 AromaticContact CD2-CE1 3.67Å; Y354-F395 HydrophobicContact CD2-CE1 3.67Å; Y354-F395 HydrophobicContact CE2-CE1 4.29Å; Y354-F395 AromaticContact CG-CD1 3.98Å; Y354-F395 HydrophobicContact CG-CD1 3.98Å; Y354-F395 AromaticContact CG-CE1 3.95Å; Y354-F395 HydrophobicContact CG-CE1 3.95Å; Y354-D396 PolarHBondContact O-N 2.98Å
355	Q	76	Confident	75.6	Confident	88 Å²	88	79.4 Å²	79.4	41%	0.411	40%	0.397	S	S	.	.	H	α-helix	trans	-86.8	-33.1	175.2	-71	178.7	-52.8	0	0	112.7	K351 I353 L393	K351-Q355 WeakPolarHBondContact O-CG 3.41Å; K351-Q355 PolarHBondContact O-N 3.47Å; K351-Q355 VanDerWaalsContact O-N 3.08Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 2.99Å; Q355-L393 PolarHBondContact NE2-O 3.5Å
356	N	71.9	Confident	75.2	Confident	126 Å²	126	74.8 Å²	74.8	67%	0.674	38%	0.378	S	S	*	.	H	α-helix	trans	-104	-9.5	-169.7	-60.9	-12.9	0	0	0	114.7	Q352 I353	Q352-N356 VanDerWaalsContact O-CB 3.27Å; Q352-N356 WeakPolarHBondContact O-CB 2.87Å; Q352-N356 PolarHBondContact O-N 3.09Å; I353-N356 PolarHBondContact O-N 3.13Å
357	N	66.6	Low	75	Confident	79 Å²	79	74.6 Å²	74.6	42%	0.422	38%	0.377	S	S	.	.			trans	-124.9	97.9	-177.1	-60.1	-92.6	0	0	0	111.7	I353 N359 Y360	I353-N357 WeakPolarHBondContact O-CB 3.49Å; I353-N357 PolarHBondContact O-N 2.92Å; I353-N357 PolarHBondContact O-ND2 2.64Å; I353-N357 VanDerWaalsContact O-ND2 3.12Å; N357-N359 PolarHBondContact O-N 3.41Å; N357-Y360 PolarHBondContact O-N 3.18Å
358	I	66.4	Low	75	Confident	127 Å²	127	72.1 Å²	72.1	65%	0.651	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45	-39.1	169.6	-62.4	152.1	0	0	0	111.9	Y360 D396	I358-Y360 VanDerWaalsContact C-N 3.31Å; I358-Y360 PolarHBondContact O-N 3.34Å; I358-D396 WeakPolarHBondContact CG1-OD2 3.25Å
359	N	65.4	Low	75.1	Confident	160 Å²	160	66.1 Å²	66.1	86%	0.856	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-19.4	-178.9	-65.2	-31.5	0	0	0	113.9	N357 K361	N357-N359 PolarHBondContact O-N 3.41Å; N359-K361 PolarHBondContact O-N 2.99Å
360	Y	65.8	Low	75.2	Confident	125 Å²	125	60.1 Å²	60.1	49%	0.49	30%	0.3	S	S	.	.			trans	-96.3	71.4	-173.2	-157.1	-88.4	0	0	0	112	I353 Y354 N357 I358 P362	I353-Y360 HydrophobicContact CB-CD1 4.5Å; I353-Y360 HydrophobicContact CG2-CD1 3.21Å; I353-Y360 HydrophobicContact CG2-CD2 3.87Å; I353-Y360 HydrophobicContact CG2-CE1 3.79Å; I353-Y360 HydrophobicContact CG2-CE2 4.37Å; I353-Y360 HydrophobicContact CG2-CG 3.25Å; Y354-Y360 AromaticContact CD1-CD1 3.7Å; Y354-Y360 HydrophobicContact CD1-CD1 3.7Å; Y354-Y360 HydrophobicContact CD1-CE1 4.19Å; Y354-Y360 AromaticContact CE1-CD1 3.45Å; Y354-Y360 HydrophobicContact CE1-CD1 3.45Å; Y354-Y360 VanDerWaalsContact CE1-CD1 3.45Å; Y354-Y360 AromaticContact CE1-CE1 3.51Å; Y354-Y360 HydrophobicContact CE1-CE1 3.51Å; N357-Y360 PolarHBondContact O-N 3.18Å; I358-Y360 VanDerWaalsContact C-N 3.31Å; I358-Y360 PolarHBondContact O-N 3.34Å; Y360-P362 WeakPolarHBondContact O-CD 3.31Å
361	K	66.1	Low	75.3	Confident	128 Å²	128	59.1 Å²	59.1	56%	0.557	29%	0.294	S	S	*	.			trans	-64.9	106.7	-175.1	-158.5	176.5	-163.8	166.3	0	112.1	N359 V363 I397	N359-K361 PolarHBondContact O-N 2.99Å; K361-V363 PolarHBondContact O-N 2.95Å; K361-I397 HydrophobicContact CB-CD1 4.25Å; K361-I397 HydrophobicContact CG-CD1 3.34Å; K361-I397 HydrophobicContact CG-CG1 4.15Å
362	P	66.3	Low	75.4	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.019	29%	0.287	C	S	.	.			trans	-50.8	136.7	177.3	15.9	-34.4	0	0	0	114.9	Y354 Y360 F364 F395 I397 R399	Y354-P362 HydrophobicContact CD1-CB 3.85Å; Y354-P362 HydrophobicContact CD1-CG 4.09Å; Y354-P362 HydrophobicContact CE1-CB 3.55Å; Y354-P362 HydrophobicContact CE1-CG 4.27Å; Y354-P362 HydrophobicContact CE2-CB 4.43Å; Y354-P362 HydrophobicContact CG-CB 4.43Å; Y360-P362 WeakPolarHBondContact O-CD 3.31Å; P362-F364 HydrophobicContact CB-CD2 3.55Å; P362-F364 HydrophobicContact CB-CE2 3.81Å; P362-F364 HydrophobicContact CB-CG 4.31Å; P362-F364 PolarHBondContact O-N 3.42Å; P362-F395 HydrophobicContact CB-CD1 4.1Å; P362-F395 HydrophobicContact CB-CE1 4.22Å; P362-F395 HydrophobicContact CG-CB 4.26Å; P362-F395 HydrophobicContact CG-CD1 3.59Å; P362-F395 HydrophobicContact CG-CE1 4.2Å; P362-F395 HydrophobicContact CG-CG 4.15Å; P362-I397 VanDerWaalsContact CD-CD1 3.44Å; P362-I397 HydrophobicContact CG-CD1 3.49Å; P362-I397 VanDerWaalsContact CG-CD1 3.49Å; P362-I397 HydrophobicContact CG-CG1 4.22Å; P362-R399 PolarHBondContact O-NH1 3.08Å; P362-R399 PolarHBondContact O-NH2 3.32Å
363	V	70.5	Confident	75.9	Confident	115 Å²	115	53 Å²	53	70%	0.697	27%	0.266	S	S	*	.			trans	-81.9	45.3	178.6	-160	0	0	0	0	110.7	K361	K361-V363 PolarHBondContact O-N 2.95Å
364	F	75.6	Confident	76.3	Confident	10 Å²	10	52.1 Å²	52.1	4%	0.044	26%	0.262	C	S	.	.			trans	-109.5	126.5	176.8	-56.7	-42.8	0	0	0	110.2	L346 Y354 P362 T368 L369 M372 F395 R399	L346-F364 HydrophobicContact CD1-CE2 3.98Å; L346-F364 HydrophobicContact CD1-CZ 4.06Å; L346-F364 HydrophobicContact CD2-CE1 4.4Å; L346-F364 HydrophobicContact CD2-CE2 4.4Å; L346-F364 HydrophobicContact CD2-CZ 3.64Å; Y354-F364 AromaticContact CE2-CE2 3.89Å; Y354-F364 HydrophobicContact CE2-CE2 3.89Å; Y354-F364 HydrophobicContact CE2-CZ 4.11Å; P362-F364 HydrophobicContact CB-CD2 3.55Å; P362-F364 HydrophobicContact CB-CE2 3.81Å; P362-F364 HydrophobicContact CB-CG 4.31Å; P362-F364 PolarHBondContact O-N 3.42Å; F364-T368 HydrophobicContact CB-CG2 4.19Å; F364-T368 HydrophobicContact CD1-CG2 4.05Å; F364-T368 HydrophobicContact CG-CG2 4.21Å; F364-L369 HydrophobicContact CB-CD2 3.76Å; F364-L369 HydrophobicContact CB-CG 3.84Å; F364-L369 HydrophobicContact CD2-CD2 3.96Å; F364-L369 HydrophobicContact CG-CD2 4.33Å; F364-M372 HydrophobicContact CD1-CE 4.29Å; F364-M372 HydrophobicContact CD2-CE 4.12Å; F364-M372 HydrophobicContact CD2-SD 4.13Å; F364-M372 HydrophobicContact CE1-CE 4.09Å; F364-M372 HydrophobicContact CE2-CE 3.93Å; F364-M372 HydrophobicContact CE2-SD 4.31Å; F364-M372 HydrophobicContact CG-CE 4.34Å; F364-M372 HydrophobicContact CZ-CE 3.94Å; F364-F395 AromaticContact CD2-CE1 4Å; F364-F395 HydrophobicContact CD2-CE1 4Å; F364-F395 AromaticContact CD2-CZ 3.92Å; F364-F395 HydrophobicContact CD2-CZ 3.92Å; F364-F395 AromaticContact CE2-CE1 3.74Å; F364-F395 HydrophobicContact CE2-CE1 3.74Å; F364-F395 AromaticContact CE2-CZ 3.82Å; F364-F395 HydrophobicContact CE2-CZ 3.82Å; F364-R399 PolarHBondContact O-NH1 3.47Å
365	N	76.4	Confident	76.6	Confident	41 Å²	41	54.2 Å²	54.2	22%	0.219	27%	0.274	C	S	.	.			trans	-61.9	151.2	167.8	-171.9	-15.5	0	0	0	109.3	L339 H367 T368 L369 I452	L339-N365 HydrophobicContact CD2-CB 4.37Å; N365-H367 PolarHBondContact O-N 3.27Å; N365-H367 VanDerWaalsContact O-N 3.15Å; N365-H367 PolarHBondContact OD1-ND1 3Å; N365-T368 WeakPolarHBondContact O-CA 3.49Å; N365-T368 PolarHBondContact O-N 3.41Å; N365-L369 PolarHBondContact O-N 3.05Å; N365-I452 WeakPolarHBondContact ND2-CD1 3.42Å
366	S	77.1	Confident	77.2	Confident	19 Å²	19	51.8 Å²	51.8	13%	0.133	27%	0.272	C	S	.	.	H	α-helix	trans	-48.6	-43.7	176.8	51.9	0	0	0	0	111.7	T368 L369 I370	S366-T368 VanDerWaalsContact C-N 3.33Å; S366-T368 PolarHBondContact O-N 3.12Å; S366-L369 PolarHBondContact O-N 3.04Å; S366-L369 VanDerWaalsContact O-N 3.13Å; S366-I370 WeakPolarHBondContact O-CD1 2.75Å; S366-I370 WeakPolarHBondContact O-CG1 3.27Å; S366-I370 PolarHBondContact O-N 3.05Å
367	H	78.3	Confident	78	Confident	9 Å²	9	48.7 Å²	48.7	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-52.1	-42.4	173.5	-58.3	82	0	0	0	114.4	N365 Y371 S405 C407 W448	N365-H367 PolarHBondContact O-N 3.27Å; N365-H367 VanDerWaalsContact O-N 3.15Å; N365-H367 PolarHBondContact OD1-ND1 3Å; H367-Y371 WeakPolarHBondContact O-CB 3.37Å; H367-Y371 PolarHBondContact O-N 2.99Å; H367-S405 PolarHBondContact CD2-OG 3.48Å; H367-S405 PolarHBondContact NE2-OG 3.08Å; H367-C407 VanDerWaalsContact CD2-SG 3.59Å; H367-W448 HydrophobicContact CB-CH2 3.38Å; H367-W448 HydrophobicContact CB-CZ2 3.54Å; H367-W448 AromaticContact CD2-CE2 3.58Å; H367-W448 AromaticContact CD2-CH2 3.66Å; H367-W448 AromaticContact CD2-CZ2 3.02Å; H367-W448 WeakPolarHBondContact CD2-CZ2 3.31Å; H367-W448 AromaticContact CD2-NE1 3.95Å; H367-W448 AromaticContact CG-CH2 3.42Å; H367-W448 VanDerWaalsContact CG-CH2 3.42Å; H367-W448 AromaticContact CG-CZ2 3.31Å; H367-W448 AromaticContact NE2-CE2 3.99Å; H367-W448 AromaticContact NE2-CZ2 3.85Å
368	T	83.1	Confident	79	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-73.6	-41.9	175.9	-64.3	0	0	0	0	110.8	K338 F340 V341 F364 N365 S366 I370 Y371 M372	K338-T368 PolarHBondContact O-OG1 3.2Å; F340-T368 PolarHBondContact N-OG1 3.35Å; V341-T368 HydrophobicContact CB-CG2 4.34Å; F364-T368 HydrophobicContact CB-CG2 4.19Å; F364-T368 HydrophobicContact CD1-CG2 4.05Å; F364-T368 HydrophobicContact CG-CG2 4.21Å; N365-T368 WeakPolarHBondContact O-CA 3.49Å; N365-T368 PolarHBondContact O-N 3.41Å; S366-T368 VanDerWaalsContact C-N 3.33Å; S366-T368 PolarHBondContact O-N 3.12Å; T368-I370 VanDerWaalsContact C-N 3.35Å; T368-I370 PolarHBondContact O-N 2.93Å; T368-Y371 PolarHBondContact O-N 3.16Å; T368-M372 HydrophobicContact CG2-CE 3.86Å; T368-M372 HydrophobicContact CG2-CG 4.37Å; T368-M372 HydrophobicContact CG2-SD 4.24Å; T368-M372 VanDerWaalsContact O-CG 3.32Å; T368-M372 WeakPolarHBondContact O-CG 3.39Å; T368-M372 PolarHBondContact O-N 2.86Å
369	L	85	Confident	80	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-41.8	177.9	-67.7	172.3	0	0	0	112.3	F364 N365 S366 M372 S373 I391 F395	F364-L369 HydrophobicContact CB-CD2 3.76Å; F364-L369 HydrophobicContact CB-CG 3.84Å; F364-L369 HydrophobicContact CD2-CD2 3.96Å; F364-L369 HydrophobicContact CG-CD2 4.33Å; N365-L369 PolarHBondContact O-N 3.05Å; S366-L369 PolarHBondContact O-N 3.04Å; S366-L369 VanDerWaalsContact O-N 3.13Å; L369-M372 WeakPolarHBondContact O-CB 3.07Å; L369-M372 PolarHBondContact O-N 2.61Å; L369-S373 PolarHBondContact O-N 3.17Å; L369-I391 HydrophobicContact CB-CD1 3.83Å; L369-I391 HydrophobicContact CB-CG1 4.24Å; L369-F395 HydrophobicContact CD2-CD2 3.77Å; L369-F395 HydrophobicContact CD2-CE2 3.69Å; L369-F395 HydrophobicContact CD2-CG 4.38Å; L369-F395 HydrophobicContact CD2-CZ 4.25Å
370	I	83.2	Confident	80.8	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-73.3	-32.4	179	-54	154.9	0	0	0	111.3	S366 T368 S373 M374 I387 L402 F408	S366-I370 WeakPolarHBondContact O-CD1 2.75Å; S366-I370 WeakPolarHBondContact O-CG1 3.27Å; S366-I370 PolarHBondContact O-N 3.05Å; T368-I370 VanDerWaalsContact C-N 3.35Å; T368-I370 PolarHBondContact O-N 2.93Å; I370-S373 WeakPolarHBondContact CA-OG 3.38Å; I370-S373 PolarHBondContact O-N 2.92Å; I370-S373 PolarHBondContact O-OG 3.31Å; I370-M374 WeakPolarHBondContact O-CG 3.39Å; I370-M374 PolarHBondContact O-N 3.47Å; I370-I387 HydrophobicContact CB-CG2 4.46Å; I370-I387 HydrophobicContact CG1-CG2 3.83Å; I370-I387 HydrophobicContact CG2-CD1 3.53Å; I370-I387 HydrophobicContact CG2-CG1 3.96Å; I370-I387 HydrophobicContact CG2-CG2 4.24Å; I370-L402 HydrophobicContact CD1-CB 4.1Å; I370-L402 HydrophobicContact CD1-CD2 4.3Å; I370-L402 HydrophobicContact CG1-CD1 4.41Å; I370-L402 HydrophobicContact CG1-CD2 4.36Å; I370-F408 HydrophobicContact CB-CE1 4.36Å; I370-F408 HydrophobicContact CB-CE2 3.58Å; I370-F408 HydrophobicContact CB-CZ 3.46Å; I370-F408 VanDerWaalsContact CB-CZ 3.46Å; I370-F408 HydrophobicContact CD1-CD2 4.03Å; I370-F408 HydrophobicContact CD1-CE2 3.48Å; I370-F408 VanDerWaalsContact CD1-CE2 3.48Å; I370-F408 HydrophobicContact CD1-CZ 4.29Å; I370-F408 HydrophobicContact CG1-CE2 4.13Å; I370-F408 HydrophobicContact CG1-CZ 4.48Å; I370-F408 HydrophobicContact CG2-CD1 4.25Å; I370-F408 HydrophobicContact CG2-CD2 4.17Å; I370-F408 HydrophobicContact CG2-CE1 3.57Å; I370-F408 HydrophobicContact CG2-CE2 3.45Å; I370-F408 VanDerWaalsContact CG2-CE2 3.45Å; I370-F408 HydrophobicContact CG2-CZ 3.13Å
371	Y	85.5	Confident	81.8	Confident	30 Å²	30	49.4 Å²	49.4	12%	0.118	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-38.8	170.8	177.8	-99.8	0	0	0	112.4	F340 Q342 H367 T368 N375 L435	F340-Y371 VanDerWaalsContact CA-CD1 3.49Å; F340-Y371 HydrophobicContact CB-CD1 3.67Å; F340-Y371 HydrophobicContact CB-CD2 4.32Å; F340-Y371 HydrophobicContact CB-CE1 3.73Å; F340-Y371 HydrophobicContact CB-CE2 4.37Å; F340-Y371 HydrophobicContact CB-CG 3.95Å; F340-Y371 HydrophobicContact CD1-CD1 4.3Å; F340-Y371 AromaticContact CD1-CD2 3.77Å; F340-Y371 HydrophobicContact CD1-CD2 3.77Å; F340-Y371 HydrophobicContact CD1-CE2 4.4Å; F340-Y371 AromaticContact CD1-CG 3.68Å; F340-Y371 HydrophobicContact CD1-CG 3.68Å; F340-Y371 HydrophobicContact CG-CG 4.32Å; F340-Y371 WeakPolarHBondContact O-CE1 3.47Å; Q342-Y371 HydrophobicContact CG-CE1 4Å; H367-Y371 WeakPolarHBondContact O-CB 3.37Å; H367-Y371 PolarHBondContact O-N 2.99Å; T368-Y371 PolarHBondContact O-N 3.16Å; Y371-N375 WeakPolarHBondContact CE1-ND2 3.5Å; Y371-N375 WeakPolarHBondContact CE2-ND2 3.07Å; Y371-N375 WeakPolarHBondContact O-CB 3.42Å; Y371-N375 PolarHBondContact O-N 3.05Å; Y371-N375 VanDerWaalsContact O-N 3.11Å; Y371-N375 PolarHBondContact O-ND2 3.47Å; Y371-N375 PolarHBondContact OH-ND2 3.18Å; Y371-L435 HydrophobicContact CD2-CD1 4.22Å; Y371-L435 HydrophobicContact CE2-CD1 3.92Å
372	M	87.3	Confident	82.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-43.3	171.7	-72.7	177.5	169	0	0	111.1	V341 L346 F364 T368 L369 N375 G376 W390 F395	V341-M372 HydrophobicContact CB-CE 3.82Å; V341-M372 HydrophobicContact CG1-CE 3.71Å; V341-M372 WeakPolarHBondContact O-CE 3.33Å; V341-M372 WeakPolarHBondContact O-CG 3.44Å; L346-M372 HydrophobicContact CD1-CE 4.16Å; L346-M372 HydrophobicContact CD2-CE 4.32Å; L346-M372 HydrophobicContact CG-CE 4.42Å; F364-M372 HydrophobicContact CD1-CE 4.29Å; F364-M372 HydrophobicContact CD2-CE 4.12Å; F364-M372 HydrophobicContact CD2-SD 4.13Å; F364-M372 HydrophobicContact CE1-CE 4.09Å; F364-M372 HydrophobicContact CE2-CE 3.93Å; F364-M372 HydrophobicContact CE2-SD 4.31Å; F364-M372 HydrophobicContact CG-CE 4.34Å; F364-M372 HydrophobicContact CZ-CE 3.94Å; T368-M372 HydrophobicContact CG2-CE 3.86Å; T368-M372 HydrophobicContact CG2-CG 4.37Å; T368-M372 HydrophobicContact CG2-SD 4.24Å; T368-M372 VanDerWaalsContact O-CG 3.32Å; T368-M372 WeakPolarHBondContact O-CG 3.39Å; T368-M372 PolarHBondContact O-N 2.86Å; L369-M372 WeakPolarHBondContact O-CB 3.07Å; L369-M372 PolarHBondContact O-N 2.61Å; M372-N375 PolarHBondContact O-N 3.3Å; M372-G376 PolarHBondContact O-N 3.36Å; M372-W390 HydrophobicContact CB-CH2 3.54Å; M372-W390 HydrophobicContact CB-CZ2 4.44Å; M372-W390 HydrophobicContact CB-CZ3 3.72Å; M372-F395 HydrophobicContact SD-CE2 4.08Å; M372-F395 HydrophobicContact SD-CZ 3.87Å
373	S	88.5	Confident	83.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-43.4	179.2	70.9	0	0	0	0	113.4	L369 I370 N375 G376 L377 W390	L369-S373 PolarHBondContact O-N 3.17Å; I370-S373 WeakPolarHBondContact CA-OG 3.38Å; I370-S373 PolarHBondContact O-N 2.92Å; I370-S373 PolarHBondContact O-OG 3.31Å; S373-N375 VanDerWaalsContact C-N 3.31Å; S373-N375 PolarHBondContact O-N 2.77Å; S373-G376 PolarHBondContact O-N 3.05Å; S373-L377 VanDerWaalsContact O-CB 3.31Å; S373-L377 WeakPolarHBondContact O-CB 3.44Å; S373-L377 WeakPolarHBondContact O-CG 3.45Å; S373-L377 PolarHBondContact O-N 2.79Å; S373-W390 VanDerWaalsContact CA-CD2 3.43Å; S373-W390 VanDerWaalsContact CA-CE3 3.46Å
374	M	87.8	Confident	84.4	Confident	15 Å²	15	40.8 Å²	40.8	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-58.6	-41.9	174	-74.9	-169	75.7	0	0	112.3	I370 K378 K379 Y380 I382 F408 L427	I370-M374 WeakPolarHBondContact O-CG 3.39Å; I370-M374 PolarHBondContact O-N 3.47Å; M374-K378 CarbonylContact O-C 3.58Å; M374-K378 WeakPolarHBondContact O-CA 3.13Å; M374-K378 PolarHBondContact O-N 3.2Å; M374-K379 WeakPolarHBondContact CE-O 3.44Å; M374-K379 PolarHBondContact O-N 3.3Å; M374-Y380 VanDerWaalsContact CE-O 3.25Å; M374-Y380 WeakPolarHBondContact CE-O 3.28Å; M374-I382 HydrophobicContact CE-CG2 4.42Å; M374-I382 HydrophobicContact CG-CB 4.32Å; M374-I382 HydrophobicContact CG-CD1 4.24Å; M374-I382 HydrophobicContact CG-CG2 3.74Å; M374-I382 HydrophobicContact SD-CG2 4.1Å; M374-F408 HydrophobicContact SD-CD1 4.2Å; M374-F408 HydrophobicContact SD-CE1 3.63Å; M374-L427 HydrophobicContact CE-CB 4.35Å; M374-L427 HydrophobicContact SD-CB 4.14Å
375	N	86.6	Confident	84.9	Confident	58 Å²	58	45.5 Å²	45.5	31%	0.31	22%	0.218	S	C	.	.	H	α-helix	trans	-73.7	-42.6	178.3	-76.9	-20.7	0	0	0	112.7	Y371 M372 S373 K378	Y371-N375 WeakPolarHBondContact CE1-ND2 3.5Å; Y371-N375 WeakPolarHBondContact CE2-ND2 3.07Å; Y371-N375 WeakPolarHBondContact O-CB 3.42Å; Y371-N375 PolarHBondContact O-N 3.05Å; Y371-N375 VanDerWaalsContact O-N 3.11Å; Y371-N375 PolarHBondContact O-ND2 3.47Å; Y371-N375 PolarHBondContact OH-ND2 3.18Å; M372-N375 PolarHBondContact O-N 3.3Å; S373-N375 VanDerWaalsContact C-N 3.31Å; S373-N375 PolarHBondContact O-N 2.77Å; N375-K378 WeakPolarHBondContact O-CG 3.48Å; N375-K378 PolarHBondContact O-N 3.18Å
376	G	87.5	Confident	85.5	Confident	37 Å²	37	45.4 Å²	45.4	38%	0.381	22%	0.216	S	C	.	.	H	α-helix	trans	-63.8	-40.2	179	0	0	0	0	0	112.6	M372 S373 K378	M372-G376 PolarHBondContact O-N 3.36Å; S373-G376 PolarHBondContact O-N 3.05Å; G376-K378 VanDerWaalsContact C-N 3.29Å
377	L	89	Confident	85.9	Confident	61 Å²	61	44.7 Å²	44.7	32%	0.319	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-6.2	172.3	-64.8	171.2	0	0	0	113.6	S373 K379 I382 E386 W390	S373-L377 VanDerWaalsContact O-CB 3.31Å; S373-L377 WeakPolarHBondContact O-CB 3.44Å; S373-L377 WeakPolarHBondContact O-CG 3.45Å; S373-L377 PolarHBondContact O-N 2.79Å; L377-K379 HydrophobicContact CB-CB 4.16Å; L377-K379 HydrophobicContact CB-CD 4.15Å; L377-K379 HydrophobicContact CB-CG 4.28Å; L377-K379 PolarHBondContact O-N 2.87Å; L377-I382 HydrophobicContact CD1-CD1 3.6Å; L377-I382 HydrophobicContact CD1-CG1 4.43Å; L377-E386 HydrophobicContact CD1-CB 4.09Å; L377-W390 HydrophobicContact CD1-CB 4Å; L377-W390 HydrophobicContact CD1-CG 4.35Å; L377-W390 HydrophobicContact CG-CB 4.29Å; L377-W390 HydrophobicContact CG-CG 4.15Å
378	K	87.8	Confident	86.2	Confident	182 Å²	182	48.5 Å²	48.5	79%	0.791	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	34.2	-176.1	-57.1	175.8	-176.1	174	0	113.2	M374 N375 G376	M374-K378 CarbonylContact O-C 3.58Å; M374-K378 WeakPolarHBondContact O-CA 3.13Å; M374-K378 PolarHBondContact O-N 3.2Å; N375-K378 WeakPolarHBondContact O-CG 3.48Å; N375-K378 PolarHBondContact O-N 3.18Å; G376-K378 VanDerWaalsContact C-N 3.29Å
379	K	86.4	Confident	86.4	Confident	89 Å²	89	52.9 Å²	52.9	39%	0.387	25%	0.246	S	C	.	.			trans	-111.3	113.1	-169.3	-90.6	179	-176.8	176.8	0	112.1	M374 L377 K381 E386	M374-K379 WeakPolarHBondContact CE-O 3.44Å; M374-K379 PolarHBondContact O-N 3.3Å; L377-K379 HydrophobicContact CB-CB 4.16Å; L377-K379 HydrophobicContact CB-CD 4.15Å; L377-K379 HydrophobicContact CB-CG 4.28Å; L377-K379 PolarHBondContact O-N 2.87Å; K379-K381 WeakPolarHBondContact CB-O 3.37Å; K379-E386 WeakPolarHBondContact CD-OE1 3.48Å; K379-E386 WeakPolarHBondContact CE-OE1 3.32Å; K379-E386 IonicContact NZ-OE1 3.21Å; K379-E386 PolarHBondContact NZ-OE1 2.78Å
380	Y	83.4	Confident	86.6	Confident	172 Å²	172	53.4 Å²	53.4	68%	0.675	25%	0.248	S	C	*	.	S	Bend	trans	-74.8	-25.3	177	-73	-93.8	0	0	0	114.2	M374 R426 H432	M374-Y380 VanDerWaalsContact CE-O 3.25Å; M374-Y380 WeakPolarHBondContact CE-O 3.28Å; Y380-R426 WeakPolarHBondContact O-CB 3.39Å; Y380-H432 AromaticContact CE1-CE1 3.65Å; Y380-H432 AromaticContact CE1-NE2 3.54Å
381	K	86.8	Confident	86.7	Confident	63 Å²	63	53.7 Å²	53.7	27%	0.274	25%	0.249	S	C	.	.	S	Bend	trans	-115.5	140.5	161.5	-60.1	-171.1	-170.8	-179.8	0	107.5	K379 V411 E417 L424 W425	K379-K381 WeakPolarHBondContact CB-O 3.37Å; K381-V411 HydrophobicContact CD-CG1 4.42Å; K381-E417 VanDerWaalsContact NZ-CD 3.31Å; K381-E417 IonicContact NZ-OE1 2.62Å; K381-E417 PolarHBondContact NZ-OE1 3.28Å; K381-E417 IonicContact NZ-OE2 2.68Å; K381-E417 PolarHBondContact NZ-OE2 3.13Å; K381-E417 VanDerWaalsContact NZ-OE2 3.11Å; K381-L424 HydrophobicContact CB-CD2 4.43Å; K381-L424 HydrophobicContact CD-CD1 3.87Å; K381-W425 CarbonylContact C-O 3.32Å; K381-W425 WeakPolarHBondContact CA-O 3.5Å
382	I	87.1	Confident	86.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	144.6	-179.8	-165.3	169.8	0	0	0	109.8	M374 L377 E386 I387 W425	M374-I382 HydrophobicContact CE-CG2 4.42Å; M374-I382 HydrophobicContact CG-CB 4.32Å; M374-I382 HydrophobicContact CG-CD1 4.24Å; M374-I382 HydrophobicContact CG-CG2 3.74Å; M374-I382 HydrophobicContact SD-CG2 4.1Å; L377-I382 HydrophobicContact CD1-CD1 3.6Å; L377-I382 HydrophobicContact CD1-CG1 4.43Å; I382-E386 HydrophobicContact CD1-CB 4.15Å; I382-E386 HydrophobicContact CG1-CB 3.7Å; I382-I387 HydrophobicContact CD1-CG1 3.61Å; I382-I387 HydrophobicContact CG1-CG1 3.91Å; I382-I387 HydrophobicContact CG2-CD1 3.83Å; I382-I387 HydrophobicContact CG2-CG1 3.92Å; I382-W425 PolarHBondContact N-O 3.29Å; I382-W425 PolarHBondContact O-N 3.47Å
383	T	87	Confident	86.5	Confident	13 Å²	13	65.1 Å²	65.1	8%	0.08	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	158.6	170	64.1	0	0	0	0	111	K385 E386 I387 N422 L424	T383-K385 PolarHBondContact O-N 3.06Å; T383-E386 VanDerWaalsContact CB-OE2 3.28Å; T383-E386 WeakPolarHBondContact CB-OE2 3.25Å; T383-E386 WeakPolarHBondContact CG2-OE2 3.48Å; T383-E386 PolarHBondContact N-OE2 3Å; T383-E386 PolarHBondContact O-N 2.85Å; T383-E386 WeakPolarHBondContact OG1-CG 3.47Å; T383-E386 PolarHBondContact OG1-N 3.41Å; T383-E386 PolarHBondContact OG1-OE2 3.42Å; T383-I387 WeakPolarHBondContact O-CG1 3.36Å; T383-I387 PolarHBondContact O-N 3.14Å; T383-N422 HydrophobicContact CG2-CB 3.83Å; T383-L424 HydrophobicContact CG2-CD2 3.69Å
384	L	83.3	Confident	86.2	Confident	52 Å²	52	66.5 Å²	66.5	27%	0.272	31%	0.313	S	S	.	.	H	α-helix	trans	-60.8	-28.2	173.3	-175.1	62	0	0	0	112.7	Y388 L402 T403	L384-Y388 HydrophobicContact CD1-CD2 4.31Å; L384-Y388 HydrophobicContact CD1-CE2 3.75Å; L384-Y388 HydrophobicContact CD2-CE2 4.05Å; L384-Y388 HydrophobicContact CG-CD2 4.07Å; L384-Y388 HydrophobicContact CG-CE2 3.59Å; L384-Y388 WeakPolarHBondContact O-CD2 3.5Å; L384-Y388 PolarHBondContact O-N 3.04Å; L384-L402 HydrophobicContact CD1-CB 4.38Å; L384-T403 HydrophobicContact CD1-CG2 4.16Å; L384-T403 HydrophobicContact CD2-CG2 3.63Å
385	K	85.4	Confident	85.8	Confident	109 Å²	109	65.9 Å²	65.9	47%	0.474	31%	0.31	S	S	.	.	H	α-helix	trans	-65.2	-53.8	175.7	-179.9	-176.8	161.9	-178.2	0	111.4	T383 I387 Y388 E389	T383-K385 PolarHBondContact O-N 3.06Å; K385-I387 PolarHBondContact O-N 3.2Å; K385-Y388 PolarHBondContact O-N 3.4Å; K385-E389 WeakPolarHBondContact CE-OE1 3.49Å; K385-E389 VanDerWaalsContact CE-OE2 3.27Å; K385-E389 WeakPolarHBondContact CE-OE2 3.47Å; K385-E389 HydrophobicContact CG-CG 4.33Å; K385-E389 IonicContact NZ-OE1 2.61Å; K385-E389 PolarHBondContact NZ-OE1 3.23Å; K385-E389 PolarHBondContact O-N 3.13Å
386	E	88.9	Confident	84.9	Confident	39 Å²	39	67.1 Å²	67.1	18%	0.182	32%	0.317	C	S	.	.	H	α-helix	trans	-61.3	-30.5	180	-68	160.7	106.6	0	0	112.6	L377 K379 I382 T383 W390	L377-E386 HydrophobicContact CD1-CB 4.09Å; K379-E386 WeakPolarHBondContact CD-OE1 3.48Å; K379-E386 WeakPolarHBondContact CE-OE1 3.32Å; K379-E386 IonicContact NZ-OE1 3.21Å; K379-E386 PolarHBondContact NZ-OE1 2.78Å; I382-E386 HydrophobicContact CD1-CB 4.15Å; I382-E386 HydrophobicContact CG1-CB 3.7Å; T383-E386 VanDerWaalsContact CB-OE2 3.28Å; T383-E386 WeakPolarHBondContact CB-OE2 3.25Å; T383-E386 WeakPolarHBondContact CG2-OE2 3.48Å; T383-E386 PolarHBondContact N-OE2 3Å; T383-E386 PolarHBondContact O-N 2.85Å; T383-E386 WeakPolarHBondContact OG1-CG 3.47Å; T383-E386 PolarHBondContact OG1-N 3.41Å; T383-E386 PolarHBondContact OG1-OE2 3.42Å; E386-W390 VanDerWaalsContact O-CB 3.31Å; E386-W390 WeakPolarHBondContact O-CB 3.49Å; E386-W390 PolarHBondContact O-N 2.9Å
387	I	85.9	Confident	83.6	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-49.7	171.6	-69.3	169.2	0	0	0	110.5	I370 I382 T383 K385 I391 L402	I370-I387 HydrophobicContact CB-CG2 4.46Å; I370-I387 HydrophobicContact CG1-CG2 3.83Å; I370-I387 HydrophobicContact CG2-CD1 3.53Å; I370-I387 HydrophobicContact CG2-CG1 3.96Å; I370-I387 HydrophobicContact CG2-CG2 4.24Å; I382-I387 HydrophobicContact CD1-CG1 3.61Å; I382-I387 HydrophobicContact CG1-CG1 3.91Å; I382-I387 HydrophobicContact CG2-CD1 3.83Å; I382-I387 HydrophobicContact CG2-CG1 3.92Å; T383-I387 WeakPolarHBondContact O-CG1 3.36Å; T383-I387 PolarHBondContact O-N 3.14Å; K385-I387 PolarHBondContact O-N 3.2Å; I387-I391 HydrophobicContact CG2-CD1 3.81Å; I387-I391 WeakPolarHBondContact O-CD1 3.44Å; I387-I391 VanDerWaalsContact O-CG1 3.25Å; I387-I391 WeakPolarHBondContact O-CG1 3.42Å; I387-I391 PolarHBondContact O-N 3.06Å; I387-I391 VanDerWaalsContact O-N 3.08Å; I387-L402 HydrophobicContact CG2-CD1 3.49Å; I387-L402 VanDerWaalsContact CG2-CD1 3.49Å
388	Y	84.6	Confident	81.9	Confident	89 Å²	89	71.2 Å²	71.2	35%	0.349	33%	0.328	S	S	.	.	H	α-helix	trans	-66.4	-48.5	179.8	-73.5	-58.3	0	0	0	111.6	L384 K385 W390 I391 E392 L402	L384-Y388 HydrophobicContact CD1-CD2 4.31Å; L384-Y388 HydrophobicContact CD1-CE2 3.75Å; L384-Y388 HydrophobicContact CD2-CE2 4.05Å; L384-Y388 HydrophobicContact CG-CD2 4.07Å; L384-Y388 HydrophobicContact CG-CE2 3.59Å; L384-Y388 WeakPolarHBondContact O-CD2 3.5Å; L384-Y388 PolarHBondContact O-N 3.04Å; K385-Y388 PolarHBondContact O-N 3.4Å; Y388-W390 VanDerWaalsContact C-N 3.29Å; Y388-W390 PolarHBondContact O-N 3.4Å; Y388-I391 PolarHBondContact O-N 3.38Å; Y388-E392 WeakPolarHBondContact O-CB 3.48Å; Y388-E392 PolarHBondContact O-N 3.42Å; Y388-L402 HydrophobicContact CD1-CD1 3.62Å; Y388-L402 HydrophobicContact CD1-CG 4.48Å; Y388-L402 HydrophobicContact CE1-CB 4.35Å; Y388-L402 HydrophobicContact CE1-CD1 3.31Å; Y388-L402 HydrophobicContact CE1-CG 3.71Å; Y388-L402 HydrophobicContact CG-CD1 4.49Å
389	E	87.3	Confident	80.2	Confident	92 Å²	92	66.4 Å²	66.4	43%	0.43	31%	0.305	S	S	.	.	H	α-helix	trans	-57.1	-40.5	178.7	-70.6	174.9	137	0	0	112.1	K385 L393	K385-E389 WeakPolarHBondContact CE-OE1 3.49Å; K385-E389 VanDerWaalsContact CE-OE2 3.27Å; K385-E389 WeakPolarHBondContact CE-OE2 3.47Å; K385-E389 HydrophobicContact CG-CG 4.33Å; K385-E389 IonicContact NZ-OE1 2.61Å; K385-E389 PolarHBondContact NZ-OE1 3.23Å; K385-E389 PolarHBondContact O-N 3.13Å; E389-L393 WeakPolarHBondContact O-CB 3.36Å; E389-L393 PolarHBondContact O-N 3.23Å
390	W	89.9	Confident	78.6	Confident	14 Å²	14	70 Å²	70	5%	0.053	32%	0.321	C	S	.	.	H	α-helix	trans	-70.5	-37.8	175.8	-174.8	94.3	0	0	0	112.5	Y343 M372 S373 L377 E386 Y388 H394 F395	Y343-W390 HydrophobicContact CD1-CZ2 4.47Å; Y343-W390 AromaticContact CD2-CH2 3.83Å; Y343-W390 HydrophobicContact CD2-CH2 3.83Å; Y343-W390 HydrophobicContact CD2-CZ2 4.16Å; Y343-W390 HydrophobicContact CG-CH2 4.04Å; Y343-W390 AromaticContact CG-CZ2 3.96Å; Y343-W390 HydrophobicContact CG-CZ2 3.96Å; M372-W390 HydrophobicContact CB-CH2 3.54Å; M372-W390 HydrophobicContact CB-CZ2 4.44Å; M372-W390 HydrophobicContact CB-CZ3 3.72Å; S373-W390 VanDerWaalsContact CA-CD2 3.43Å; S373-W390 VanDerWaalsContact CA-CE3 3.46Å; L377-W390 HydrophobicContact CD1-CB 4Å; L377-W390 HydrophobicContact CD1-CG 4.35Å; L377-W390 HydrophobicContact CG-CB 4.29Å; L377-W390 HydrophobicContact CG-CG 4.15Å; E386-W390 VanDerWaalsContact O-CB 3.31Å; E386-W390 WeakPolarHBondContact O-CB 3.49Å; E386-W390 PolarHBondContact O-N 2.9Å; Y388-W390 VanDerWaalsContact C-N 3.29Å; Y388-W390 PolarHBondContact O-N 3.4Å; W390-H394 AromaticContact CD1-CE1 3.56Å; W390-H394 AromaticContact CD1-ND1 3.82Å; W390-H394 AromaticContact CD2-ND1 3.56Å; W390-H394 AromaticContact CE2-CE1 3.46Å; W390-H394 VanDerWaalsContact CE2-CE1 3.46Å; W390-H394 AromaticContact CE2-ND1 3.32Å; W390-H394 VanDerWaalsContact CE2-ND1 3.32Å; W390-H394 AromaticContact CG-ND1 3.88Å; W390-H394 HydrophobicContact CH2-CB 4.24Å; W390-H394 HydrophobicContact CZ2-CB 4.44Å; W390-H394 AromaticContact CZ2-CE1 3.93Å; W390-H394 AromaticContact CZ2-CG 3.88Å; W390-H394 AromaticContact CZ2-ND1 3.66Å; W390-H394 HydrophobicContact CZ3-CB 4.47Å; W390-H394 AromaticContact NE1-CE1 3.17Å; W390-H394 PolarHBondContact NE1-CE1 2.81Å; W390-H394 AromaticContact NE1-ND1 3.51Å; W390-H394 AromaticContact NE1-NE2 3.95Å; W390-H394 PolarHBondContact O-N 2.98Å; W390-H394 PolarHBondContact O-ND1 2.85Å; W390-F395 AromaticContact CH2-CE2 3.91Å; W390-F395 HydrophobicContact CH2-CE2 3.91Å; W390-F395 HydrophobicContact CZ3-CD2 4.19Å; W390-F395 AromaticContact CZ3-CE2 3.73Å; W390-F395 HydrophobicContact CZ3-CE2 3.73Å
391	I	85.7	Confident	77.3	Confident	8 Å²	8	68.3 Å²	68.3	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-65.5	-49.2	177.9	-72.1	167	0	0	0	109.8	L369 I387 Y388 L393 H394 F395 L402	L369-I391 HydrophobicContact CB-CD1 3.83Å; L369-I391 HydrophobicContact CB-CG1 4.24Å; I387-I391 HydrophobicContact CG2-CD1 3.81Å; I387-I391 WeakPolarHBondContact O-CD1 3.44Å; I387-I391 VanDerWaalsContact O-CG1 3.25Å; I387-I391 WeakPolarHBondContact O-CG1 3.42Å; I387-I391 PolarHBondContact O-N 3.06Å; I387-I391 VanDerWaalsContact O-N 3.08Å; Y388-I391 PolarHBondContact O-N 3.38Å; I391-L393 VanDerWaalsContact C-N 3.28Å; I391-L393 PolarHBondContact O-N 3.11Å; I391-H394 PolarHBondContact O-N 2.94Å; I391-F395 HydrophobicContact CG2-CB 4.36Å; I391-F395 HydrophobicContact CG2-CD2 4.5Å; I391-F395 WeakPolarHBondContact O-CA 3.46Å; I391-F395 WeakPolarHBondContact O-CB 3.5Å; I391-F395 PolarHBondContact O-N 3.35Å; I391-F395 VanDerWaalsContact O-O 3.07Å; I391-L402 HydrophobicContact CD1-CD1 3.56Å; I391-L402 HydrophobicContact CD1-CD2 4.45Å
392	E	83.7	Confident	76.1	Confident	151 Å²	151	65.7 Å²	65.7	71%	0.706	31%	0.308	S	S	*	.	H	α-helix	trans	-55.4	-39.8	178.3	-173.2	171.6	-165.5	0	0	112.4	Y388 H394	Y388-E392 WeakPolarHBondContact O-CB 3.48Å; Y388-E392 PolarHBondContact O-N 3.42Å; E392-H394 VanDerWaalsContact C-N 3.31Å; E392-H394 PolarHBondContact O-N 3.41Å
393	L	84.7	Confident	74.6	Confident	118 Å²	118	69.9 Å²	69.9	62%	0.618	33%	0.334	S	S	*	.	H	α-helix	trans	-67.9	-22.2	177.3	-177.9	60	0	0	0	114.9	Q355 E389 I391	Q355-L393 PolarHBondContact NE2-O 3.5Å; E389-L393 WeakPolarHBondContact O-CB 3.36Å; E389-L393 PolarHBondContact O-N 3.23Å; I391-L393 VanDerWaalsContact C-N 3.28Å; I391-L393 PolarHBondContact O-N 3.11Å
394	H	82.1	Confident	73.2	Confident	30 Å²	30	73.5 Å²	73.5	14%	0.139	36%	0.359	C	S	.	.	H	α-helix	trans	-120.1	-15	-173.3	-61.6	91.2	0	0	0	114.3	Y343 W390 I391 E392	Y343-H394 AromaticContact CE1-CD2 3.62Å; Y343-H394 HydrophobicContact CE2-CB 3.91Å; Y343-H394 AromaticContact CZ-CD2 3.47Å; Y343-H394 VanDerWaalsContact CZ-CD2 3.47Å; W390-H394 AromaticContact CD1-CE1 3.56Å; W390-H394 AromaticContact CD1-ND1 3.82Å; W390-H394 AromaticContact CD2-ND1 3.56Å; W390-H394 AromaticContact CE2-CE1 3.46Å; W390-H394 VanDerWaalsContact CE2-CE1 3.46Å; W390-H394 AromaticContact CE2-ND1 3.32Å; W390-H394 VanDerWaalsContact CE2-ND1 3.32Å; W390-H394 AromaticContact CG-ND1 3.88Å; W390-H394 HydrophobicContact CH2-CB 4.24Å; W390-H394 HydrophobicContact CZ2-CB 4.44Å; W390-H394 AromaticContact CZ2-CE1 3.93Å; W390-H394 AromaticContact CZ2-CG 3.88Å; W390-H394 AromaticContact CZ2-ND1 3.66Å; W390-H394 HydrophobicContact CZ3-CB 4.47Å; W390-H394 AromaticContact NE1-CE1 3.17Å; W390-H394 PolarHBondContact NE1-CE1 2.81Å; W390-H394 AromaticContact NE1-ND1 3.51Å; W390-H394 AromaticContact NE1-NE2 3.95Å; W390-H394 PolarHBondContact O-N 2.98Å; W390-H394 PolarHBondContact O-ND1 2.85Å; I391-H394 PolarHBondContact O-N 2.94Å; E392-H394 VanDerWaalsContact C-N 3.31Å; E392-H394 PolarHBondContact O-N 3.41Å
395	F	79.2	Confident	72.1	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.009	35%	0.35	C	S	.	.			trans	-149.8	116.2	-174.3	-57.9	-69.2	0	0	0	109.5	Y343 L346 Y354 P362 F364 L369 M372 W390 I391 I397	Y343-F395 HydrophobicContact CD2-CE2 4.34Å; Y343-F395 AromaticContact CD2-CZ 3.97Å; Y343-F395 HydrophobicContact CD2-CZ 3.97Å; Y343-F395 HydrophobicContact CE2-CE1 4.46Å; Y343-F395 HydrophobicContact CE2-CE2 4.43Å; Y343-F395 AromaticContact CE2-CZ 3.98Å; Y343-F395 HydrophobicContact CE2-CZ 3.98Å; L346-F395 HydrophobicContact CD1-CE1 4.39Å; L346-F395 HydrophobicContact CD1-CZ 4.18Å; Y354-F395 HydrophobicContact CD2-CD1 4.19Å; Y354-F395 AromaticContact CD2-CE1 3.67Å; Y354-F395 HydrophobicContact CD2-CE1 3.67Å; Y354-F395 HydrophobicContact CE2-CE1 4.29Å; Y354-F395 AromaticContact CG-CD1 3.98Å; Y354-F395 HydrophobicContact CG-CD1 3.98Å; Y354-F395 AromaticContact CG-CE1 3.95Å; Y354-F395 HydrophobicContact CG-CE1 3.95Å; P362-F395 HydrophobicContact CB-CD1 4.1Å; P362-F395 HydrophobicContact CB-CE1 4.22Å; P362-F395 HydrophobicContact CG-CB 4.26Å; P362-F395 HydrophobicContact CG-CD1 3.59Å; P362-F395 HydrophobicContact CG-CE1 4.2Å; P362-F395 HydrophobicContact CG-CG 4.15Å; F364-F395 AromaticContact CD2-CE1 4Å; F364-F395 HydrophobicContact CD2-CE1 4Å; F364-F395 AromaticContact CD2-CZ 3.92Å; F364-F395 HydrophobicContact CD2-CZ 3.92Å; F364-F395 AromaticContact CE2-CE1 3.74Å; F364-F395 HydrophobicContact CE2-CE1 3.74Å; F364-F395 AromaticContact CE2-CZ 3.82Å; F364-F395 HydrophobicContact CE2-CZ 3.82Å; L369-F395 HydrophobicContact CD2-CD2 3.77Å; L369-F395 HydrophobicContact CD2-CE2 3.69Å; L369-F395 HydrophobicContact CD2-CG 4.38Å; L369-F395 HydrophobicContact CD2-CZ 4.25Å; M372-F395 HydrophobicContact SD-CE2 4.08Å; M372-F395 HydrophobicContact SD-CZ 3.87Å; W390-F395 AromaticContact CH2-CE2 3.91Å; W390-F395 HydrophobicContact CH2-CE2 3.91Å; W390-F395 HydrophobicContact CZ3-CD2 4.19Å; W390-F395 AromaticContact CZ3-CE2 3.73Å; W390-F395 HydrophobicContact CZ3-CE2 3.73Å; I391-F395 HydrophobicContact CG2-CB 4.36Å; I391-F395 HydrophobicContact CG2-CD2 4.5Å; I391-F395 WeakPolarHBondContact O-CA 3.46Å; I391-F395 WeakPolarHBondContact O-CB 3.5Å; I391-F395 PolarHBondContact O-N 3.35Å; I391-F395 VanDerWaalsContact O-O 3.07Å; F395-I397 PolarHBondContact O-N 2.65Å
396	D	66.5	Low	71.2	Confident	84 Å²	84	74.8 Å²	74.8	45%	0.449	36%	0.359	S	S	.	.			trans	-74.3	74.3	174	-164.7	-13.6	0	0	0	110.8	Y354 I358	Y354-D396 PolarHBondContact O-N 2.98Å; I358-D396 WeakPolarHBondContact CG1-OD2 3.25Å
397	I	61	Low	70.2	Confident	23 Å²	23	72.9 Å²	72.9	12%	0.118	35%	0.35	C	S	.	.			trans	-139.1	113.5	178.1	-69.1	-164.4	0	0	0	111.3	K361 P362 F395 R399	K361-I397 HydrophobicContact CB-CD1 4.25Å; K361-I397 HydrophobicContact CG-CD1 3.34Å; K361-I397 HydrophobicContact CG-CG1 4.15Å; P362-I397 VanDerWaalsContact CD-CD1 3.44Å; P362-I397 HydrophobicContact CG-CD1 3.49Å; P362-I397 VanDerWaalsContact CG-CD1 3.49Å; P362-I397 HydrophobicContact CG-CG1 4.22Å; F395-I397 PolarHBondContact O-N 2.65Å; I397-R399 HydrophobicContact CG2-CB 3.55Å; I397-R399 HydrophobicContact CG2-CG 3.35Å; I397-R399 PolarHBondContact O-N 2.74Å; I397-R399 VanDerWaalsContact O-N 3.13Å
398	I	54.2	Low	69.7	Low	161 Å²	161	73.8 Å²	73.8	83%	0.826	35%	0.354	S	S	*	.			trans	-75.7	90.8	156.6	-52.9	173.3	0	0	0	108.6
399	R	52.1	Low	69.4	Low	80 Å²	80	73.3 Å²	73.3	30%	0.302	36%	0.355	S	S	.	.			trans	-108.5	98.6	172.3	-102.6	175	-172.9	140.6	-2.9	110.6	P362 F364 I397	P362-R399 PolarHBondContact O-NH1 3.08Å; P362-R399 PolarHBondContact O-NH2 3.32Å; F364-R399 PolarHBondContact O-NH1 3.47Å; I397-R399 HydrophobicContact CG2-CB 3.55Å; I397-R399 HydrophobicContact CG2-CG 3.35Å; I397-R399 PolarHBondContact O-N 2.74Å; I397-R399 VanDerWaalsContact O-N 3.13Å
400	K	52.6	Low	69.1	Low	164 Å²	164	76.1 Å²	76.1	71%	0.713	36%	0.362	S	S	*	.			trans	-52.4	153.7	159.9	-58.8	176.7	-178.4	179.9	0	109.3
401	H	54.8	Low	68.7	Low	138 Å²	138	76.5 Å²	76.5	64%	0.639	37%	0.365	S	S	*	.			trans	75.2	43.3	177.4	-39.7	-78.9	0	0	0	117.7	T403	H401-T403 VanDerWaalsContact C-N 3.28Å
402	L	62.5	Low	68.3	Low	7 Å²	7	81.5 Å²	81.5	4%	0.037	40%	0.401	C	S	.	.	S	Bend	trans	-73.9	-18.7	161.9	-62.4	-170.7	0	0	0	113.4	I370 L384 I387 Y388 I391	I370-L402 HydrophobicContact CD1-CB 4.1Å; I370-L402 HydrophobicContact CD1-CD2 4.3Å; I370-L402 HydrophobicContact CG1-CD1 4.41Å; I370-L402 HydrophobicContact CG1-CD2 4.36Å; L384-L402 HydrophobicContact CD1-CB 4.38Å; I387-L402 HydrophobicContact CG2-CD1 3.49Å; I387-L402 VanDerWaalsContact CG2-CD1 3.49Å; Y388-L402 HydrophobicContact CD1-CD1 3.62Å; Y388-L402 HydrophobicContact CD1-CG 4.48Å; Y388-L402 HydrophobicContact CE1-CB 4.35Å; Y388-L402 HydrophobicContact CE1-CD1 3.31Å; Y388-L402 HydrophobicContact CE1-CG 3.71Å; Y388-L402 HydrophobicContact CG-CD1 4.49Å; I391-L402 HydrophobicContact CD1-CD1 3.56Å; I391-L402 HydrophobicContact CD1-CD2 4.45Å
403	T	54.9	Low	67.7	Low	89 Å²	89	77.6 Å²	77.6	55%	0.546	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-12.9	-169.9	50.8	0	0	0	0	116	L384 H401 S405	L384-T403 HydrophobicContact CD1-CG2 4.16Å; L384-T403 HydrophobicContact CD2-CG2 3.63Å; H401-T403 VanDerWaalsContact C-N 3.28Å; T403-S405 PolarHBondContact O-N 3.26Å
404	S	57.1	Low	67.2	Low	88 Å²	88	78.8 Å²	78.8	62%	0.615	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	4.4	-179.5	54.4	0	0	0	0	114.2	R406	S404-R406 PolarHBondContact O-N 3.23Å
405	S	61.5	Low	66.6	Low	10 Å²	10	87.6 Å²	87.6	7%	0.07	42%	0.416	C	S	.	.			trans	-85.7	111.2	-163.2	-178.4	0	0	0	0	114	H367 T403 C407 F408	H367-S405 PolarHBondContact CD2-OG 3.48Å; H367-S405 PolarHBondContact NE2-OG 3.08Å; T403-S405 PolarHBondContact O-N 3.26Å; S405-C407 PolarHBondContact O-N 3.23Å; S405-C407 VanDerWaalsContact O-N 3.12Å; S405-C407 PolarHBondContact OG-SG 3.05Å; S405-F408 PolarHBondContact O-N 3.45Å; S405-F408 WeakPolarHBondContact OG-CD2 2.99Å; S405-F408 WeakPolarHBondContact OG-CE2 3.27Å
406	R	66.3	Low	66.1	Low	178 Å²	178	94.4 Å²	94.4	67%	0.672	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-6.6	177.2	-76.6	-175.5	171.3	-171.9	-5.3	115.2	S404 F408	S404-R406 PolarHBondContact O-N 3.23Å; R406-F408 VanDerWaalsContact C-N 3.35Å
407	C	68.6	Low	66.1	Low	0 Å²	0	92.8 Å²	92.8	0%	0	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-9.4	173.2	67.1	0	0	0	0	114	H367 S405 L427 N428 L431	H367-C407 VanDerWaalsContact CD2-SG 3.59Å; S405-C407 PolarHBondContact O-N 3.23Å; S405-C407 VanDerWaalsContact O-N 3.12Å; S405-C407 PolarHBondContact OG-SG 3.05Å; C407-L427 HydrophobicContact CB-CD1 4.01Å; C407-L427 CarbonylContact O-C 3.57Å; C407-L427 WeakPolarHBondContact O-CA 3.37Å; C407-L427 WeakPolarHBondContact O-CD1 3.2Å; C407-N428 PolarHBondContact O-N 3Å; C407-L431 HydrophobicContact CB-CD1 3.24Å
408	F	74.1	Confident	66	Low	24 Å²	24	99.6 Å²	99.6	11%	0.105	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.8	175.1	-57.6	-70.2	0	0	0	112.5	I370 M374 S405 R406 W425 R426 L427	I370-F408 HydrophobicContact CB-CE1 4.36Å; I370-F408 HydrophobicContact CB-CE2 3.58Å; I370-F408 HydrophobicContact CB-CZ 3.46Å; I370-F408 VanDerWaalsContact CB-CZ 3.46Å; I370-F408 HydrophobicContact CD1-CD2 4.03Å; I370-F408 HydrophobicContact CD1-CE2 3.48Å; I370-F408 VanDerWaalsContact CD1-CE2 3.48Å; I370-F408 HydrophobicContact CD1-CZ 4.29Å; I370-F408 HydrophobicContact CG1-CE2 4.13Å; I370-F408 HydrophobicContact CG1-CZ 4.48Å; I370-F408 HydrophobicContact CG2-CD1 4.25Å; I370-F408 HydrophobicContact CG2-CD2 4.17Å; I370-F408 HydrophobicContact CG2-CE1 3.57Å; I370-F408 HydrophobicContact CG2-CE2 3.45Å; I370-F408 VanDerWaalsContact CG2-CE2 3.45Å; I370-F408 HydrophobicContact CG2-CZ 3.13Å; M374-F408 HydrophobicContact SD-CD1 4.2Å; M374-F408 HydrophobicContact SD-CE1 3.63Å; S405-F408 PolarHBondContact O-N 3.45Å; S405-F408 WeakPolarHBondContact OG-CD2 2.99Å; S405-F408 WeakPolarHBondContact OG-CE2 3.27Å; R406-F408 VanDerWaalsContact C-N 3.35Å; F408-W425 HydrophobicContact CB-CE3 3.98Å; F408-R426 CarbonylContact C-O 3.56Å; F408-R426 WeakPolarHBondContact CA-O 3.41Å; F408-L427 HydrophobicContact CD1-CD1 4.36Å; F408-L427 HydrophobicContact CE1-CB 4.32Å; F408-L427 HydrophobicContact CE1-CD1 3.71Å; F408-L427 HydrophobicContact CZ-CD1 4.09Å
409	Q	78.2	Confident	66.4	Low	78 Å²	78	98.7 Å²	98.7	36%	0.364	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.8	174.1	-172.2	-177.5	29.6	0	0	108.7	W425 R426	Q409-W425 WeakPolarHBondContact O-CA 3.26Å; Q409-R426 HydrophobicContact CB-CG 4.25Å; Q409-R426 PolarHBondContact N-O 3.43Å; Q409-R426 PolarHBondContact O-N 3.45Å; Q409-R426 VanDerWaalsContact OE1-CZ 3.28Å
410	R	80.6	Confident	66.7	Low	152 Å²	152	97.5 Å²	97.5	57%	0.574	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	136.1	171.8	-160.3	171.7	87.2	140.9	-3.3	110.1	D423 W425	R410-D423 WeakPolarHBondContact CD-OD2 3.43Å; R410-D423 HydrophobicContact CG-CB 4.32Å; R410-D423 IonicContact CZ-OD1 3.71Å; R410-D423 IonicContact CZ-OD2 3.72Å; R410-D423 IonicContact NE-OD1 3.91Å; R410-D423 IonicContact NE-OD2 3.97Å; R410-D423 VanDerWaalsContact NH1-CG 3.29Å; R410-D423 IonicContact NH1-OD1 3.1Å; R410-D423 PolarHBondContact NH1-OD1 2.68Å; R410-D423 VanDerWaalsContact NH1-OD1 3.1Å; R410-D423 IonicContact NH1-OD2 2.74Å; R410-D423 PolarHBondContact NH1-OD2 3.4Å; R410-W425 HydrophobicContact CB-CD2 4.48Å; R410-W425 HydrophobicContact CB-CE3 4.1Å; R410-W425 HydrophobicContact CB-CH2 4.07Å; R410-W425 HydrophobicContact CB-CZ2 4.42Å; R410-W425 HydrophobicContact CB-CZ3 3.9Å; R410-W425 HydrophobicContact CG-CH2 4.31Å; R410-W425 HydrophobicContact CG-CZ2 4.2Å
411	V	81.3	Confident	67.2	Low	22 Å²	22	98.7 Å²	98.7	13%	0.133	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.7	-175.4	-170.6	0	0	0	0	109	K381 K413 L424 R426	K381-V411 HydrophobicContact CD-CG1 4.42Å; V411-K413 PolarHBondContact O-N 2.98Å; V411-L424 HydrophobicContact CB-CB 4.29Å; V411-L424 PolarHBondContact N-O 3.19Å; V411-R426 HydrophobicContact CG2-CB 3.74Å; V411-R426 HydrophobicContact CG2-CG 3.43Å; V411-R426 VanDerWaalsContact CG2-CG 3.43Å
412	S	77.6	Confident	67.8	Low	113 Å²	113	95.4 Å²	95.4	79%	0.79	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-59.1	132.5	169.9	-52.3	0	0	0	0	110.4
413	K	72.8	Confident	68.4	Low	68 Å²	68	98.4 Å²	98.4	30%	0.296	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-64.6	155.4	173	-64.4	-172.1	180	-178.6	0	111.6	V411 E417 D419 G420 N422 L424	V411-K413 PolarHBondContact O-N 2.98Å; K413-E417 VanDerWaalsContact CA-OE2 3.27Å; K413-E417 WeakPolarHBondContact CA-OE2 3.1Å; K413-D419 PolarHBondContact NZ-O 3.27Å; K413-G420 PolarHBondContact NZ-O 3.43Å; K413-N422 WeakPolarHBondContact CE-O 3.33Å; K413-N422 PolarHBondContact NZ-O 3.21Å; K413-L424 HydrophobicContact CG-CD1 3.98Å; K413-L424 HydrophobicContact CG-CG 4.35Å
414	R	72.9	Confident	69.8	Low	144 Å²	144	95.2 Å²	95.2	54%	0.543	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-82.6	161.1	157.8	-59.6	-172.5	-172.7	97.7	-19.3	110.3	E416 E417	R414-E416 PolarHBondContact O-N 2.81Å; R414-E417 HydrophobicContact CB-CG 4.08Å; R414-E417 IonicContact CZ-OE1 3.2Å; R414-E417 PolarHBondContact N-OE2 3.48Å; R414-E417 IonicContact NH1-OE1 3.66Å; R414-E417 PolarHBondContact NH1-OE1 2.93Å; R414-E417 PolarHBondContact O-N 2.94Å
415	K	69.1	Low	70.9	Confident	214 Å²	214	94 Å²	94	93%	0.93	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-25.9	176.1	-167.8	-178.5	174.8	-169.1	0	112.6
416	E	69.3	Low	72.1	Confident	146 Å²	146	98.2 Å²	98.2	68%	0.682	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-10.2	176.4	-51.5	101.9	-122.2	0	0	114.9	R414 L418	R414-E416 PolarHBondContact O-N 2.81Å; E416-L418 PolarHBondContact O-N 2.73Å
417	E	67	Low	72.8	Confident	49 Å²	49	90.3 Å²	90.3	23%	0.229	44%	0.441	C	S	.	.			trans	-82.6	82.7	-173.3	-71.9	167.9	175.1	0	0	110.3	K381 K413 R414 D419 L424	K381-E417 VanDerWaalsContact NZ-CD 3.31Å; K381-E417 IonicContact NZ-OE1 2.62Å; K381-E417 PolarHBondContact NZ-OE1 3.28Å; K381-E417 IonicContact NZ-OE2 2.68Å; K381-E417 PolarHBondContact NZ-OE2 3.13Å; K381-E417 VanDerWaalsContact NZ-OE2 3.11Å; K413-E417 VanDerWaalsContact CA-OE2 3.27Å; K413-E417 WeakPolarHBondContact CA-OE2 3.1Å; R414-E417 HydrophobicContact CB-CG 4.08Å; R414-E417 IonicContact CZ-OE1 3.2Å; R414-E417 PolarHBondContact N-OE2 3.48Å; R414-E417 IonicContact NH1-OE1 3.66Å; R414-E417 PolarHBondContact NH1-OE1 2.93Å; R414-E417 PolarHBondContact O-N 2.94Å; E417-D419 VanDerWaalsContact C-N 3.29Å; E417-D419 PolarHBondContact O-N 3Å; E417-D419 VanDerWaalsContact O-N 3.09Å; E417-L424 VanDerWaalsContact OE2-CD1 3.26Å; E417-L424 WeakPolarHBondContact OE2-CD1 3.43Å
418	L	59.4	Low	73.2	Confident	167 Å²	167	92.6 Å²	92.6	87%	0.874	45%	0.453	S	S	*	.			trans	-53.6	-25.1	-165.6	-75.1	166.5	0	0	0	117.2	E416 G420	E416-L418 PolarHBondContact O-N 2.73Å; L418-G420 PolarHBondContact O-N 3.33Å
419	D	62.1	Low	73.1	Confident	141 Å²	141	94.6 Å²	94.6	75%	0.754	47%	0.47	S	S	*	.			trans	-73.9	73.9	-179.7	-70.4	-46.1	0	0	0	111.7	K413 E417 H421	K413-D419 PolarHBondContact NZ-O 3.27Å; E417-D419 VanDerWaalsContact C-N 3.29Å; E417-D419 PolarHBondContact O-N 3Å; E417-D419 VanDerWaalsContact O-N 3.09Å; D419-H421 VanDerWaalsContact C-N 3.34Å; D419-H421 PolarHBondContact O-N 3.41Å; D419-H421 VanDerWaalsContact O-N 3.11Å
420	G	57	Low	72.6	Confident	56 Å²	56	96 Å²	96	58%	0.577	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-35.4	-161.5	0	0	0	0	0	116.8	K413 L418	K413-G420 PolarHBondContact NZ-O 3.43Å; L418-G420 PolarHBondContact O-N 3.33Å
421	H	63	Low	72.1	Confident	189 Å²	189	88.9 Å²	88.9	88%	0.875	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-33.2	-163.3	-68.5	-71.4	0	0	0	117	D419	D419-H421 VanDerWaalsContact C-N 3.34Å; D419-H421 PolarHBondContact O-N 3.41Å; D419-H421 VanDerWaalsContact O-N 3.11Å
422	N	68.6	Low	71.5	Confident	68 Å²	68	90.3 Å²	90.3	36%	0.364	46%	0.455	S	S	.	.	S	Bend	trans	-97.4	133.2	-167.8	-66	-21.2	0	0	0	113.3	T383 K413	T383-N422 HydrophobicContact CG2-CB 3.83Å; K413-N422 WeakPolarHBondContact CE-O 3.33Å; K413-N422 PolarHBondContact NZ-O 3.21Å
423	D	75	Confident	71.1	Confident	71 Å²	71	89.4 Å²	89.4	38%	0.38	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-59.6	136.9	173	-90.2	-40	0	0	0	112.1	R410 W425	R410-D423 WeakPolarHBondContact CD-OD2 3.43Å; R410-D423 HydrophobicContact CG-CB 4.32Å; R410-D423 IonicContact CZ-OD1 3.71Å; R410-D423 IonicContact CZ-OD2 3.72Å; R410-D423 IonicContact NE-OD1 3.91Å; R410-D423 IonicContact NE-OD2 3.97Å; R410-D423 VanDerWaalsContact NH1-CG 3.29Å; R410-D423 IonicContact NH1-OD1 3.1Å; R410-D423 PolarHBondContact NH1-OD1 2.68Å; R410-D423 VanDerWaalsContact NH1-OD1 3.1Å; R410-D423 IonicContact NH1-OD2 2.74Å; R410-D423 PolarHBondContact NH1-OD2 3.4Å; D423-W425 VanDerWaalsContact O-CD1 3.26Å; D423-W425 PolarHBondContact O-NE1 2.93Å
424	L	83.3	Confident	70.8	Confident	22 Å²	22	88 Å²	88	12%	0.115	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.6	172.2	-72.2	173.4	0	0	0	110.8	K381 T383 V411 K413 E417	K381-L424 HydrophobicContact CB-CD2 4.43Å; K381-L424 HydrophobicContact CD-CD1 3.87Å; T383-L424 HydrophobicContact CG2-CD2 3.69Å; V411-L424 HydrophobicContact CB-CB 4.29Å; V411-L424 PolarHBondContact N-O 3.19Å; K413-L424 HydrophobicContact CG-CD1 3.98Å; K413-L424 HydrophobicContact CG-CG 4.35Å; E417-L424 VanDerWaalsContact OE2-CD1 3.26Å; E417-L424 WeakPolarHBondContact OE2-CD1 3.43Å
425	W	82	Confident	70.6	Confident	62 Å²	62	81.8 Å²	81.8	24%	0.235	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.3	177.8	-59.4	82.1	0	0	0	109.4	K381 I382 F408 Q409 R410 D423	K381-W425 CarbonylContact C-O 3.32Å; K381-W425 WeakPolarHBondContact CA-O 3.5Å; I382-W425 PolarHBondContact N-O 3.29Å; I382-W425 PolarHBondContact O-N 3.47Å; F408-W425 HydrophobicContact CB-CE3 3.98Å; Q409-W425 WeakPolarHBondContact O-CA 3.26Å; R410-W425 HydrophobicContact CB-CD2 4.48Å; R410-W425 HydrophobicContact CB-CE3 4.1Å; R410-W425 HydrophobicContact CB-CH2 4.07Å; R410-W425 HydrophobicContact CB-CZ2 4.42Å; R410-W425 HydrophobicContact CB-CZ3 3.9Å; R410-W425 HydrophobicContact CG-CH2 4.31Å; R410-W425 HydrophobicContact CG-CZ2 4.2Å; D423-W425 VanDerWaalsContact O-CD1 3.26Å; D423-W425 PolarHBondContact O-NE1 2.93Å
426	R	84.8	Confident	70.3	Confident	99 Å²	99	76.9 Å²	76.9	37%	0.374	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	154.4	166.8	68	-176.7	178.2	-171.3	1.9	109.1	Y380 F408 Q409 V411	Y380-R426 WeakPolarHBondContact O-CB 3.39Å; F408-R426 CarbonylContact C-O 3.56Å; F408-R426 WeakPolarHBondContact CA-O 3.41Å; Q409-R426 HydrophobicContact CB-CG 4.25Å; Q409-R426 PolarHBondContact N-O 3.43Å; Q409-R426 PolarHBondContact O-N 3.45Å; Q409-R426 VanDerWaalsContact OE1-CZ 3.28Å; V411-R426 HydrophobicContact CG2-CB 3.74Å; V411-R426 HydrophobicContact CG2-CG 3.43Å; V411-R426 VanDerWaalsContact CG2-CG 3.43Å
427	L	81.3	Confident	70	Confident	12 Å²	12	74.8 Å²	74.8	6%	0.063	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	138.2	162.1	-169.5	78.6	0	0	0	109.2	M374 C407 F408 S429 L431 H432 L435	M374-L427 HydrophobicContact CE-CB 4.35Å; M374-L427 HydrophobicContact SD-CB 4.14Å; C407-L427 HydrophobicContact CB-CD1 4.01Å; C407-L427 CarbonylContact O-C 3.57Å; C407-L427 WeakPolarHBondContact O-CA 3.37Å; C407-L427 WeakPolarHBondContact O-CD1 3.2Å; F408-L427 HydrophobicContact CD1-CD1 4.36Å; F408-L427 HydrophobicContact CE1-CB 4.32Å; F408-L427 HydrophobicContact CE1-CD1 3.71Å; F408-L427 HydrophobicContact CZ-CD1 4.09Å; L427-S429 PolarHBondContact O-N 3.03Å; L427-L431 HydrophobicContact CG-CB 4.43Å; L427-H432 HydrophobicContact CD2-CB 3.91Å; L427-L435 HydrophobicContact CD2-CD1 3.79Å
428	N	76.8	Confident	69.8	Low	47 Å²	47	80.7 Å²	80.7	25%	0.251	42%	0.417	S	S	.	.			trans	-53.4	128.5	173.5	177.4	-9.6	0	0	0	109.6	C407 E430 L431 H432	C407-N428 PolarHBondContact O-N 3Å; N428-E430 PolarHBondContact O-N 3.41Å; N428-E430 PolarHBondContact OD1-N 3.38Å; N428-L431 HydrophobicContact CB-CB 4.43Å; N428-L431 HydrophobicContact CB-CD1 4.44Å; N428-L431 WeakPolarHBondContact O-CB 2.86Å; N428-L431 PolarHBondContact O-N 3.22Å; N428-H432 PolarHBondContact O-N 2.77Å
429	S	72.1	Confident	69.9	Low	66 Å²	66	80.3 Å²	80.3	46%	0.462	41%	0.409	S	S	.	.	H	α-helix	trans	-59.6	-29.7	-176.6	45.1	0	0	0	0	113.7	L427 N433	L427-S429 PolarHBondContact O-N 3.03Å; S429-N433 VanDerWaalsContact O-CG 3.3Å; S429-N433 PolarHBondContact O-N 2.68Å; S429-N433 VanDerWaalsContact O-N 3.12Å; S429-N433 PolarHBondContact O-ND2 3.26Å
430	E	69.6	Low	70.1	Confident	107 Å²	107	75.5 Å²	75.5	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-64.4	-46.5	173.8	-169	-170.4	161.4	0	0	111	N428 N433 Q434	N428-E430 PolarHBondContact O-N 3.41Å; N428-E430 PolarHBondContact OD1-N 3.38Å; E430-N433 PolarHBondContact O-N 2.85Å; E430-Q434 WeakPolarHBondContact O-CG 3.15Å; E430-Q434 PolarHBondContact O-N 2.75Å; E430-Q434 PolarHBondContact OE1-NE2 3.2Å
431	L	68.4	Low	70.5	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.016	38%	0.377	C	S	.	.	H	α-helix	trans	-68.1	-38.8	176.7	-80.7	175.3	0	0	0	112.5	C407 L427 N428 N433 Q434 L435 F444	C407-L431 HydrophobicContact CB-CD1 3.24Å; L427-L431 HydrophobicContact CG-CB 4.43Å; N428-L431 HydrophobicContact CB-CB 4.43Å; N428-L431 HydrophobicContact CB-CD1 4.44Å; N428-L431 WeakPolarHBondContact O-CB 2.86Å; N428-L431 PolarHBondContact O-N 3.22Å; L431-N433 VanDerWaalsContact C-N 3.28Å; L431-N433 PolarHBondContact O-N 3Å; L431-Q434 PolarHBondContact O-N 3.01Å; L431-L435 VanDerWaalsContact O-CB 3.32Å; L431-L435 WeakPolarHBondContact O-CB 3.28Å; L431-L435 WeakPolarHBondContact O-CD1 3.15Å; L431-L435 VanDerWaalsContact O-CG 3.27Å; L431-L435 WeakPolarHBondContact O-CG 3.47Å; L431-L435 PolarHBondContact O-N 3.43Å; L431-F444 HydrophobicContact CD1-CZ 4.14Å; L431-F444 HydrophobicContact CD2-CD1 4.27Å; L431-F444 HydrophobicContact CD2-CE1 3.56Å; L431-F444 HydrophobicContact CD2-CE2 4.3Å; L431-F444 HydrophobicContact CD2-CZ 3.57Å; L431-F444 HydrophobicContact CG-CE1 4.5Å; L431-F444 HydrophobicContact CG-CZ 4.1Å
432	H	70.5	Confident	70.6	Confident	52 Å²	52	73.4 Å²	73.4	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-56.6	-45.6	175	-168	63.9	0	0	0	111.2	Y380 L427 N428 L435 L436	Y380-H432 AromaticContact CE1-CE1 3.65Å; Y380-H432 AromaticContact CE1-NE2 3.54Å; L427-H432 HydrophobicContact CD2-CB 3.91Å; N428-H432 PolarHBondContact O-N 2.77Å; H432-L435 PolarHBondContact O-N 3.11Å; H432-L436 WeakPolarHBondContact NE2-CD1 3.35Å; H432-L436 WeakPolarHBondContact O-CB 3.32Å; H432-L436 WeakPolarHBondContact O-CG 3.44Å; H432-L436 PolarHBondContact O-N 2.85Å
433	N	68.2	Low	70.5	Confident	95 Å²	95	77.4 Å²	77.4	51%	0.508	38%	0.379	S	S	.	.	H	α-helix	trans	-67	-39.5	176.3	-69.5	-19.8	0	0	0	112.7	S429 E430 L431 L435 N437	S429-N433 VanDerWaalsContact O-CG 3.3Å; S429-N433 PolarHBondContact O-N 2.68Å; S429-N433 VanDerWaalsContact O-N 3.12Å; S429-N433 PolarHBondContact O-ND2 3.26Å; E430-N433 PolarHBondContact O-N 2.85Å; L431-N433 VanDerWaalsContact C-N 3.28Å; L431-N433 PolarHBondContact O-N 3Å; N433-L435 VanDerWaalsContact C-N 3.35Å; N433-N437 WeakPolarHBondContact O-CB 3.46Å; N433-N437 PolarHBondContact O-N 3.33Å; N433-N437 PolarHBondContact O-ND2 3.33Å
434	Q	67.1	Low	70.1	Confident	37 Å²	37	76.7 Å²	76.7	17%	0.173	37%	0.373	C	S	.	.	H	α-helix	trans	-66.8	-35.5	176.3	-71.3	-179.2	36.4	0	0	112.4	E430 L431 H438 K439	E430-Q434 WeakPolarHBondContact O-CG 3.15Å; E430-Q434 PolarHBondContact O-N 2.75Å; E430-Q434 PolarHBondContact OE1-NE2 3.2Å; L431-Q434 PolarHBondContact O-N 3.01Å; Q434-H438 PolarHBondContact O-N 3.23Å; Q434-K439 CarbonylContact O-C 3.6Å; Q434-K439 PolarHBondContact O-N 3.09Å
435	L	67.2	Low	69.2	Low	14 Å²	14	76.8 Å²	76.8	7%	0.073	37%	0.373	C	S	.	.	H	α-helix	trans	-73.2	-48.2	179.4	-75.6	164.1	0	0	0	113	F340 Y371 L427 L431 H432 N433 N437 H438 I440	F340-L435 HydrophobicContact CB-CD1 4.47Å; F340-L435 HydrophobicContact CB-CD2 3.45Å; F340-L435 VanDerWaalsContact CB-CD2 3.45Å; F340-L435 HydrophobicContact CD1-CD1 3.62Å; F340-L435 HydrophobicContact CD1-CD2 4Å; F340-L435 HydrophobicContact CD1-CG 4.47Å; F340-L435 HydrophobicContact CD2-CD1 4.47Å; F340-L435 HydrophobicContact CD2-CD2 3.6Å; F340-L435 HydrophobicContact CE1-CD1 3.87Å; F340-L435 HydrophobicContact CE2-CD2 4.32Å; F340-L435 HydrophobicContact CG-CD1 3.95Å; F340-L435 HydrophobicContact CG-CD2 3.41Å; F340-L435 VanDerWaalsContact CG-CD2 3.41Å; F340-L435 HydrophobicContact CG-CG 4.33Å; F340-L435 HydrophobicContact CZ-CD1 4.4Å; Y371-L435 HydrophobicContact CD2-CD1 4.22Å; Y371-L435 HydrophobicContact CE2-CD1 3.92Å; L427-L435 HydrophobicContact CD2-CD1 3.79Å; L431-L435 VanDerWaalsContact O-CB 3.32Å; L431-L435 WeakPolarHBondContact O-CB 3.28Å; L431-L435 WeakPolarHBondContact O-CD1 3.15Å; L431-L435 VanDerWaalsContact O-CG 3.27Å; L431-L435 WeakPolarHBondContact O-CG 3.47Å; L431-L435 PolarHBondContact O-N 3.43Å; H432-L435 PolarHBondContact O-N 3.11Å; N433-L435 VanDerWaalsContact C-N 3.35Å; L435-N437 PolarHBondContact O-N 2.87Å; L435-H438 PolarHBondContact O-N 3.34Å; L435-I440 HydrophobicContact CD2-CD1 3.57Å; L435-I440 HydrophobicContact CD2-CG1 4.06Å; L435-I440 HydrophobicContact CG-CD1 4.45Å
436	L	64.6	Low	68.5	Low	112 Å²	112	77.9 Å²	77.9	59%	0.586	38%	0.383	S	S	*	.	H	α-helix	trans	-57.7	-30.4	175.4	-74.6	176.5	0	0	0	112.6	H432	H432-L436 WeakPolarHBondContact NE2-CD1 3.35Å; H432-L436 WeakPolarHBondContact O-CB 3.32Å; H432-L436 WeakPolarHBondContact O-CG 3.44Å; H432-L436 PolarHBondContact O-N 2.85Å
437	N	62.7	Low	67.4	Low	101 Å²	101	77.8 Å²	77.8	54%	0.54	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	1	177.8	-75.6	-76.4	0	0	0	114	N433 L435 K439	N433-N437 WeakPolarHBondContact O-CB 3.46Å; N433-N437 PolarHBondContact O-N 3.33Å; N433-N437 PolarHBondContact O-ND2 3.33Å; L435-N437 PolarHBondContact O-N 2.87Å; N437-K439 HydrophobicContact CB-CB 4.24Å; N437-K439 HydrophobicContact CB-CD 4.35Å; N437-K439 WeakPolarHBondContact O-CG 3.4Å; N437-K439 PolarHBondContact O-N 3.47Å; N437-K439 VanDerWaalsContact O-N 3.11Å
438	H	61.6	Low	66.5	Low	174 Å²	174	77.9 Å²	77.9	81%	0.806	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	30.3	-170.3	-59.5	-71.3	0	0	0	114.1	Q434 L435	Q434-H438 PolarHBondContact O-N 3.23Å; L435-H438 PolarHBondContact O-N 3.34Å
439	K	62.7	Low	65.8	Low	158 Å²	158	78.1 Å²	78.1	69%	0.687	39%	0.389	S	S	*	.			trans	-121.9	49.6	-172.1	-79.1	172	-175.4	173.3	0	111.7	Q434 N437 S441	Q434-K439 CarbonylContact O-C 3.6Å; Q434-K439 PolarHBondContact O-N 3.09Å; N437-K439 HydrophobicContact CB-CB 4.24Å; N437-K439 HydrophobicContact CB-CD 4.35Å; N437-K439 WeakPolarHBondContact O-CG 3.4Å; N437-K439 PolarHBondContact O-N 3.47Å; N437-K439 VanDerWaalsContact O-N 3.11Å; K439-S441 PolarHBondContact O-N 3.24Å
440	I	65.8	Low	64.9	Low	40 Å²	40	79.7 Å²	79.7	21%	0.205	39%	0.392	C	S	.	.			trans	-70.5	126.4	165.4	-35	170.6	0	0	0	107.7	F340 L435 F444 L445	F340-I440 HydrophobicContact CD2-CD1 3.85Å; F340-I440 HydrophobicContact CE2-CD1 4.14Å; L435-I440 HydrophobicContact CD2-CD1 3.57Å; L435-I440 HydrophobicContact CD2-CG1 4.06Å; L435-I440 HydrophobicContact CG-CD1 4.45Å; I440-F444 HydrophobicContact CG2-CB 4.4Å; I440-F444 HydrophobicContact CG2-CD1 3.89Å; I440-F444 HydrophobicContact CG2-CG 4.4Å; I440-L445 HydrophobicContact CB-CD2 4.21Å; I440-L445 HydrophobicContact CB-CG 4.31Å; I440-L445 HydrophobicContact CD1-CD2 4.03Å; I440-L445 HydrophobicContact CG2-CD2 3.62Å; I440-L445 HydrophobicContact CG2-CG 3.85Å
441	S	65.2	Low	64.1	Low	65 Å²	65	79.2 Å²	79.2	46%	0.455	39%	0.39	S	S	.	.			trans	-67.3	135.2	176.8	177.7	0	0	0	0	110.7	K439 K443 F444 L445	K439-S441 PolarHBondContact O-N 3.24Å; S441-K443 PolarHBondContact O-N 3.34Å; S441-K443 PolarHBondContact OG-N 3.13Å; S441-F444 WeakPolarHBondContact O-CA 3.27Å; S441-F444 VanDerWaalsContact O-CB 3.3Å; S441-F444 WeakPolarHBondContact O-CB 3.32Å; S441-F444 PolarHBondContact O-N 2.81Å; S441-L445 PolarHBondContact O-N 2.9Å
442	H	64.2	Low	63.2	Low	136 Å²	136	83 Å²	83	63%	0.63	41%	0.409	S	S	*	.	H	α-helix	trans	-55	-35.2	172.7	-175.9	-93.1	0	0	0	111.9	F444 L445 L446	H442-F444 VanDerWaalsContact C-N 3.34Å; H442-F444 PolarHBondContact O-N 3.06Å; H442-L445 PolarHBondContact O-N 2.78Å; H442-L446 WeakPolarHBondContact O-CB 3.48Å; H442-L446 PolarHBondContact O-N 2.77Å
443	K	66.8	Low	61.4	Low	152 Å²	152	87.9 Å²	87.9	66%	0.661	43%	0.427	S	S	*	.	H	α-helix	trans	-65.4	-35.4	173.9	-176	176.1	178.7	178.9	0	112.3	S441 L447	S441-K443 PolarHBondContact O-N 3.34Å; S441-K443 PolarHBondContact OG-N 3.13Å; K443-L447 HydrophobicContact CG-CD1 4.02Å; K443-L447 HydrophobicContact CG-CG 4.49Å; K443-L447 WeakPolarHBondContact O-CB 3.47Å; K443-L447 WeakPolarHBondContact O-CD1 3.49Å; K443-L447 VanDerWaalsContact O-CG 3.23Å; K443-L447 WeakPolarHBondContact O-CG 3.46Å; K443-L447 PolarHBondContact O-N 3.45Å; K443-L447 VanDerWaalsContact O-N 3.09Å
444	F	67.4	Low	59.8	Low	56 Å²	56	88.3 Å²	88.3	25%	0.246	44%	0.435	C	S	.	.	H	α-helix	trans	-66.6	-50.3	174	-177.2	-77.6	0	0	0	110.3	L431 I440 S441 H442 L446 L447 W448	L431-F444 HydrophobicContact CD1-CZ 4.14Å; L431-F444 HydrophobicContact CD2-CD1 4.27Å; L431-F444 HydrophobicContact CD2-CE1 3.56Å; L431-F444 HydrophobicContact CD2-CE2 4.3Å; L431-F444 HydrophobicContact CD2-CZ 3.57Å; L431-F444 HydrophobicContact CG-CE1 4.5Å; L431-F444 HydrophobicContact CG-CZ 4.1Å; I440-F444 HydrophobicContact CG2-CB 4.4Å; I440-F444 HydrophobicContact CG2-CD1 3.89Å; I440-F444 HydrophobicContact CG2-CG 4.4Å; S441-F444 WeakPolarHBondContact O-CA 3.27Å; S441-F444 VanDerWaalsContact O-CB 3.3Å; S441-F444 WeakPolarHBondContact O-CB 3.32Å; S441-F444 PolarHBondContact O-N 2.81Å; H442-F444 VanDerWaalsContact C-N 3.34Å; H442-F444 PolarHBondContact O-N 3.06Å; F444-L446 VanDerWaalsContact C-N 3.33Å; F444-L446 PolarHBondContact O-N 3.15Å; F444-L447 PolarHBondContact O-N 3.39Å; F444-W448 HydrophobicContact CD1-CB 4.34Å; F444-W448 HydrophobicContact CE1-CB 3.98Å; F444-W448 AromaticContact CE1-CD1 3.8Å; F444-W448 AromaticContact CE1-CG 3.95Å; F444-W448 HydrophobicContact CE1-CG 3.95Å; F444-W448 AromaticContact CZ-CD1 4Å; F444-W448 WeakPolarHBondContact O-CB 3.34Å; F444-W448 PolarHBondContact O-N 3.11Å
445	L	65.2	Low	58.4	Low	25 Å²	25	96.3 Å²	96.3	13%	0.131	47%	0.469	C	S	.	.	H	α-helix	trans	-54.8	-48.7	178.3	-65.8	177.2	0	0	0	111.4	L339 I440 S441 H442 W448 Q449	L339-L445 HydrophobicContact CD1-CD2 3.86Å; I440-L445 HydrophobicContact CB-CD2 4.21Å; I440-L445 HydrophobicContact CB-CG 4.31Å; I440-L445 HydrophobicContact CD1-CD2 4.03Å; I440-L445 HydrophobicContact CG2-CD2 3.62Å; I440-L445 HydrophobicContact CG2-CG 3.85Å; S441-L445 PolarHBondContact O-N 2.9Å; H442-L445 PolarHBondContact O-N 2.78Å; L445-W448 PolarHBondContact O-N 2.69Å; L445-Q449 VanDerWaalsContact O-CB 3.26Å; L445-Q449 WeakPolarHBondContact O-CB 3.02Å; L445-Q449 PolarHBondContact O-N 3.03Å
446	L	65.7	Low	56.7	Low	85 Å²	85	101.6 Å²	101.6	45%	0.445	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-45.2	-179	-159.1	76.1	0	0	0	112.5	H442 F444 W448 N450	H442-L446 WeakPolarHBondContact O-CB 3.48Å; H442-L446 PolarHBondContact O-N 2.77Å; F444-L446 VanDerWaalsContact C-N 3.33Å; F444-L446 PolarHBondContact O-N 3.15Å; L446-W448 VanDerWaalsContact C-N 3.29Å; L446-W448 PolarHBondContact O-N 2.98Å; L446-N450 VanDerWaalsContact O-CB 3.3Å; L446-N450 WeakPolarHBondContact O-CB 3.43Å; L446-N450 PolarHBondContact O-N 2.62Å; L446-N450 PolarHBondContact O-ND2 2.79Å; L446-N450 PolarHBondContact O-OD1 3.3Å
447	L	63.6	Low	55.3	Low	97 Å²	97	100.8 Å²	100.8	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-34.8	177	-76.8	171.5	0	0	0	112.7	K443 F444 Q451	K443-L447 HydrophobicContact CG-CD1 4.02Å; K443-L447 HydrophobicContact CG-CG 4.49Å; K443-L447 WeakPolarHBondContact O-CB 3.47Å; K443-L447 WeakPolarHBondContact O-CD1 3.49Å; K443-L447 VanDerWaalsContact O-CG 3.23Å; K443-L447 WeakPolarHBondContact O-CG 3.46Å; K443-L447 PolarHBondContact O-N 3.45Å; K443-L447 VanDerWaalsContact O-N 3.09Å; F444-L447 PolarHBondContact O-N 3.39Å; L447-Q451 WeakPolarHBondContact O-CG 3.5Å; L447-Q451 PolarHBondContact O-N 3.08Å; L447-Q451 PolarHBondContact O-NE2 2.97Å
448	W	61.2	Low	54.1	Low	13 Å²	13	102.4 Å²	102.4	5%	0.049	51%	0.506	C	S	.	.	H	α-helix	trans	-81.2	-38.7	-177.1	177.5	99.8	0	0	0	112	L339 F340 H367 F444 L445 L446 N450 Q451	L339-W448 HydrophobicContact CD1-CE3 4.37Å; L339-W448 HydrophobicContact CD1-CH2 4.37Å; L339-W448 HydrophobicContact CD1-CZ3 3.67Å; L339-W448 HydrophobicContact CD2-CH2 3.89Å; L339-W448 HydrophobicContact CD2-CZ3 3.69Å; L339-W448 HydrophobicContact CG-CZ3 4.3Å; F340-W448 HydrophobicContact CE2-CH2 4.19Å; F340-W448 HydrophobicContact CE2-CZ2 4.25Å; F340-W448 HydrophobicContact CZ-CH2 4.06Å; F340-W448 AromaticContact CZ-CZ2 3.75Å; F340-W448 HydrophobicContact CZ-CZ2 3.75Å; H367-W448 HydrophobicContact CB-CH2 3.38Å; H367-W448 HydrophobicContact CB-CZ2 3.54Å; H367-W448 AromaticContact CD2-CE2 3.58Å; H367-W448 AromaticContact CD2-CH2 3.66Å; H367-W448 AromaticContact CD2-CZ2 3.02Å; H367-W448 WeakPolarHBondContact CD2-CZ2 3.31Å; H367-W448 AromaticContact CD2-NE1 3.95Å; H367-W448 AromaticContact CG-CH2 3.42Å; H367-W448 VanDerWaalsContact CG-CH2 3.42Å; H367-W448 AromaticContact CG-CZ2 3.31Å; H367-W448 AromaticContact NE2-CE2 3.99Å; H367-W448 AromaticContact NE2-CZ2 3.85Å; F444-W448 HydrophobicContact CD1-CB 4.34Å; F444-W448 HydrophobicContact CE1-CB 3.98Å; F444-W448 AromaticContact CE1-CD1 3.8Å; F444-W448 AromaticContact CE1-CG 3.95Å; F444-W448 HydrophobicContact CE1-CG 3.95Å; F444-W448 AromaticContact CZ-CD1 4Å; F444-W448 WeakPolarHBondContact O-CB 3.34Å; F444-W448 PolarHBondContact O-N 3.11Å; L445-W448 PolarHBondContact O-N 2.69Å; L446-W448 VanDerWaalsContact C-N 3.29Å; L446-W448 PolarHBondContact O-N 2.98Å; W448-N450 VanDerWaalsContact C-N 3.33Å; W448-Q451 PolarHBondContact O-N 3.48Å
449	Q	61.7	Low	52.8	Low	52 Å²	52	98.2 Å²	98.2	24%	0.243	49%	0.49	C	S	.	.	H	α-helix	trans	-59.9	-44.6	170	176.5	169.3	-17.1	0	0	110.7	I333 L445 Q451 I452	I333-Q449 HydrophobicContact CG2-CG 4.42Å; I333-Q449 PolarHBondContact O-NE2 3.02Å; L445-Q449 VanDerWaalsContact O-CB 3.26Å; L445-Q449 WeakPolarHBondContact O-CB 3.02Å; L445-Q449 PolarHBondContact O-N 3.03Å; Q449-Q451 PolarHBondContact O-N 3.19Å; Q449-I452 PolarHBondContact O-N 3.14Å
450	N	53.9	Low	51.6	Low	99 Å²	99	97.2 Å²	97.2	53%	0.529	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.1	179.6	-64	-0.2	0	0	0	113.8	L446 W448	L446-N450 VanDerWaalsContact O-CB 3.3Å; L446-N450 WeakPolarHBondContact O-CB 3.43Å; L446-N450 PolarHBondContact O-N 2.62Å; L446-N450 PolarHBondContact O-ND2 2.79Å; L446-N450 PolarHBondContact O-OD1 3.3Å; W448-N450 VanDerWaalsContact C-N 3.33Å
451	Q	52.7	Low	50.3	Low	98 Å²	98	101.1 Å²	101.1	46%	0.458	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-3	173.4	-82.7	168.4	35	0	0	113.7	L447 W448 Q449	L447-Q451 WeakPolarHBondContact O-CG 3.5Å; L447-Q451 PolarHBondContact O-N 3.08Å; L447-Q451 PolarHBondContact O-NE2 2.97Å; W448-Q451 PolarHBondContact O-N 3.48Å; Q449-Q451 PolarHBondContact O-N 3.19Å
452	I	48.9	Very low	49.1	Very low	83 Å²	83	105.7 Å²	105.7	43%	0.426	52%	0.524	S	S	.	.	S	Bend	trans	-80.2	-23.2	176.7	-62.5	177.6	0	0	0	111.3	N365 Q449	N365-I452 WeakPolarHBondContact ND2-CD1 3.42Å; Q449-I452 PolarHBondContact O-N 3.14Å
453	Y	32.7	Very low	47.9	Very low	153 Å²	153	105 Å²	105	60%	0.6	52%	0.524	S	S	*	.	S	Bend	trans	-87.1	131.8	168.2	-62.2	-85.1	0	0	0	109.6	K455	Y453-K455 PolarHBondContact O-N 3.33Å
454	P	35.9	Very low	46.5	Very low	104 Å²	104	104.9 Å²	104.9	68%	0.675	53%	0.525	S	S	*	.			trans	-59.3	139.5	154	29.4	-32.3	0	0	0	107.3	L456	P454-L456 VanDerWaalsContact C-N 3.27Å; P454-L456 PolarHBondContact O-N 3.19Å
455	K	36.2	Very low	45.1	Very low	206 Å²	206	111 Å²	111	90%	0.896	55%	0.548	S	S	*	.			trans	-65.7	97.4	160.4	-77	-169.2	172.2	-163.7	0	107	Y453	Y453-K455 PolarHBondContact O-N 3.33Å
456	L	33.2	Very low	43.7	Very low	125 Å²	125	116.8 Å²	116.8	65%	0.654	58%	0.579	S	S	*	*			trans	-54.6	130.7	150	-112.9	68.2	0	0	0	106.2	P454	P454-L456 VanDerWaalsContact C-N 3.27Å; P454-L456 PolarHBondContact O-N 3.19Å
457	P	34.1	Very low	42.3	Very low	95 Å²	95	118.5 Å²	118.5	62%	0.617	59%	0.593	S	S	*	*			trans	-54.6	155.9	157.3	-19.4	32.8	0	0	0	108.9	L459	P457-L459 PolarHBondContact O-N 3.11Å
458	D	37.1	Very low	41	Very low	134 Å²	134	120.3 Å²	120.3	72%	0.717	60%	0.602	S	S	*	*			trans	-71.6	64.4	-172.2	-54.4	-78.8	0	0	0	112.7	I460 D461	D458-I460 PolarHBondContact O-N 2.88Å; D458-I460 VanDerWaalsContact O-N 3.14Å; D458-D461 PolarHBondContact O-N 3.21Å; D458-D461 VanDerWaalsContact O-N 3.16Å
459	L	35.3	Very low	39.6	Very low	87 Å²	87	125.2 Å²	125.2	46%	0.455	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	-9.6	-177.5	-89.2	158.6	0	0	0	113.7	P457 F462 I463	P457-L459 PolarHBondContact O-N 3.11Å; L459-F462 HydrophobicContact CD2-CB 4.24Å; L459-F462 PolarHBondContact O-N 3.39Å; L459-I463 WeakPolarHBondContact O-CG1 3.41Å; L459-I463 PolarHBondContact O-N 3Å
460	I	37.5	Very low	38.2	Very low	137 Å²	137	128.3 Å²	128.3	70%	0.703	67%	0.666	S	S	*	*	H	α-helix	trans	-66.8	-40.7	171.8	-65.3	175.3	0	0	0	109.6	D458 F462 I463	D458-I460 PolarHBondContact O-N 2.88Å; D458-I460 VanDerWaalsContact O-N 3.14Å; I460-F462 PolarHBondContact O-N 2.92Å; I460-I463 PolarHBondContact O-N 3.29Å
461	D	38.6	Very low	37.2	Very low	121 Å²	121	132.5 Å²	132.5	65%	0.647	68%	0.682	S	S	*	*	H	α-helix	trans	-67.1	-16.9	175.8	-65.9	5.6	0	0	0	112.6	D458	D458-D461 PolarHBondContact O-N 3.21Å; D458-D461 VanDerWaalsContact O-N 3.16Å
462	F	38.9	Very low	36.3	Very low	161 Å²	161	135 Å²	135	71%	0.706	70%	0.697	S	S	*	*	H	α-helix	trans	-92.2	-18	177.5	-110.5	-87.5	0	0	0	114.2	L459 I460	L459-F462 HydrophobicContact CD2-CB 4.24Å; L459-F462 PolarHBondContact O-N 3.39Å; I460-F462 PolarHBondContact O-N 2.92Å
463	I	39.2	Very low	35.7	Very low	123 Å²	123	137.2 Å²	137.2	63%	0.631	71%	0.71	S	S	*	*	H	α-helix	trans	-94.1	-23.2	-177.1	-69.8	168.8	0	0	0	111.7	L459 I460 Y465	L459-I463 WeakPolarHBondContact O-CG1 3.41Å; L459-I463 PolarHBondContact O-N 3Å; I460-I463 PolarHBondContact O-N 3.29Å; I463-Y465 VanDerWaalsContact C-N 3.31Å; I463-Y465 PolarHBondContact O-N 3.12Å
464	E	38.4	Very low	35.7	Very low	148 Å²	148	136.5 Å²	136.5	69%	0.692	72%	0.716	S	S	*	*	S	Bend	trans	-77	-12.1	-178.9	-161.6	159.8	-152	0	0	114
465	Y	37	Very low	35.5	Very low	186 Å²	186	142.7 Å²	142.7	73%	0.729	73%	0.728	S	S	*	*	S	Bend	trans	-98.6	-28.5	-173.9	-101.6	-79	0	0	0	117	I463 T467	I463-Y465 VanDerWaalsContact C-N 3.31Å; I463-Y465 PolarHBondContact O-N 3.12Å; Y465-T467 VanDerWaalsContact C-N 3.26Å; Y465-T467 PolarHBondContact O-N 3.4Å
466	D	35.6	Very low	35.5	Very low	146 Å²	146	138.6 Å²	138.6	78%	0.781	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-77.6	-7.9	-177.9	-83.9	-22.8	0	0	0	114	I468	D466-I468 VanDerWaalsContact C-N 3.34Å; D466-I468 PolarHBondContact O-N 3.14Å
467	T	37.4	Very low	35.5	Very low	120 Å²	120	143.6 Å²	143.6	74%	0.736	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-86.7	2.8	-176.4	-31.5	0	0	0	0	113.9	Y465	Y465-T467 VanDerWaalsContact C-N 3.26Å; Y465-T467 PolarHBondContact O-N 3.4Å
468	I	35	Very low	35.9	Very low	135 Å²	135	147.3 Å²	147.3	69%	0.692	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-131.5	30.2	-170.4	-34.8	-177.4	0	0	0	112.6	D466	D466-I468 VanDerWaalsContact C-N 3.34Å; D466-I468 PolarHBondContact O-N 3.14Å
469	S	31.8	Very low	35.8	Very low	116 Å²	116	147.2 Å²	147.2	81%	0.811	75%	0.746	S	S	*	*	S	Bend	trans	-146.7	28.3	-178.2	-78.5	0	0	0	0	116.7
470	S	33.5	Very low	36	Very low	118 Å²	118	150.5 Å²	150.5	83%	0.825	76%	0.764	S	S	*	*			trans	-132.7	9	166.6	73.3	0	0	0	0	115.8	I472	S470-I472 PolarHBondContact O-N 3.12Å
471	E	31.6	Very low	35.9	Very low	187 Å²	187	150.6 Å²	150.6	87%	0.874	77%	0.766	S	S	*	*			trans	-84.1	92.1	158.7	-75.3	-159.4	152.4	0	0	109.7
472	I	33.5	Very low	36.1	Very low	149 Å²	149	152.4 Å²	152.4	76%	0.764	77%	0.77	S	S	*	*			trans	179	104.7	150.8	-92.1	147.3	0	0	0	107.1	S470	S470-I472 PolarHBondContact O-N 3.12Å
473	N	36.6	Very low	36.1	Very low	131 Å²	131	150.6 Å²	150.6	70%	0.701	77%	0.768	S	S	*	*			trans	171.9	93.7	133.5	-94.5	-59	0	0	0	112.9
474	N	32.7	Very low	36.2	Very low	137 Å²	137	151.7 Å²	151.7	73%	0.733	78%	0.775	S	S	*	*			trans	50.4	90.6	131.8	-59.1	-50	0	0	0	119.8
475	Y	32.7	Very low	36.4	Very low	235 Å²	235	152.2 Å²	152.2	92%	0.922	78%	0.782	S	S	*	*			trans	-115.5	102	141.9	-88.5	-76.3	0	0	0	109.9
476	P	36.4	Very low	36.8	Very low	120 Å²	120	147.8 Å²	147.8	78%	0.779	78%	0.776	S	S	*	*			trans	-78	131.1	177.2	31.1	-32.7	0	0	0	110.6
477	R	33.4	Very low	37	Very low	229 Å²	229	147.2 Å²	147.2	86%	0.864	77%	0.773	S	S	*	*			trans	-135.9	67.1	174.1	-148.6	178.9	-162.2	-143.4	4	112.5
478	L	42	Very low	37.3	Very low	173 Å²	173	148.6 Å²	148.6	91%	0.906	77%	0.771	S	S	*	*			trans	-96	104.1	163.4	-84.3	166.7	0	0	0	109
479	N	34.5	Very low	37.6	Very low	133 Å²	133	147.5 Å²	147.5	71%	0.711	77%	0.766	S	S	*	*			trans	-75.7	127.5	155.9	-71.8	8	0	0	0	107.5
480	N	39.4	Very low	38	Very low	156 Å²	156	149.5 Å²	149.5	83%	0.834	76%	0.763	S	S	*	*			trans	-163.9	138	136.9	-97.9	-15.7	0	0	0	109.2
481	D	36.4	Very low	38.1	Very low	138 Å²	138	149 Å²	149	74%	0.738	76%	0.755	S	S	*	*			trans	-56.4	146.9	-174.4	-43.9	-60.1	0	0	0	113.1
482	H	41.4	Very low	38.4	Very low	160 Å²	160	147.1 Å²	147.1	74%	0.741	75%	0.749	S	S	*	*				-175.9	116.1	113.8	-95.3	20.3	0	0	0	113.3
483	N	38.5	Very low	38.4	Very low	123 Å²	123	146.1 Å²	146.1	66%	0.658	75%	0.745	S	S	*	*				82.2	145.3	129.2	-55.1	-3.4	0	0	0	122.4
484	D	41.5	Very low	38.3	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	74%	0.742	S	S	*	*			trans	78.5	77.9	148.4	-53.8	-19	0	0	0	122
485	D	43.3	Very low	38.5	Very low	158 Å²	158	144.6 Å²	144.6	85%	0.845	74%	0.737	S	S	*	*				69.5	173.4	118.8	-114.5	14.6	0	0	0	119.5
486	P	45.4	Very low	38.7	Very low	94 Å²	94	140.5 Å²	140.5	61%	0.61	73%	0.726	S	S	*	*				-133.5	-151.3	-118.7	42.3	-20.9	0	0	0	114.9
487	D	40.5	Very low	38.5	Very low	133 Å²	133	140.7 Å²	140.7	71%	0.711	72%	0.721	S	S	*	*			trans	98.4	133.1	160.1	-72	-17.2	0	0	0	121.6
488	H	42.6	Very low	38.5	Very low	150 Å²	150	137.4 Å²	137.4	69%	0.694	72%	0.72	S	S	*	*			trans	67.7	93.6	147.5	-70.9	-49.3	0	0	0	122.3
489	D	42.4	Very low	38	Very low	111 Å²	111	138.3 Å²	138.3	59%	0.594	72%	0.72	S	S	*	*				114.3	127.6	96	-91.7	22.1	0	0	0	121.5
490	Q	38.6	Very low	37.8	Very low	159 Å²	159	137 Å²	137	74%	0.743	72%	0.721	S	S	*	*			trans	75.9	140.8	135	-73	-172.3	60.3	0	0	121
491	V	36.2	Very low	37.4	Very low	107 Å²	107	134 Å²	134	65%	0.648	71%	0.712	S	S	*	*			cis	-166	148.9	-20.5	91.4	0	0	0	0	111.2
492	I	37.4	Very low	37	Very low	148 Å²	148	136.5 Å²	136.5	76%	0.759	72%	0.717	S	S	*	*			trans	44.4	118.3	155.2	-67.4	160.3	0	0	0	119
493	N	34.4	Very low	36.4	Very low	127 Å²	127	139.7 Å²	139.7	68%	0.679	72%	0.722	S	S	*	*				89.6	122.2	55.3	-144.9	64.1	0	0	0	115.7
494	D	35	Very low	36.4	Very low	117 Å²	117	145.7 Å²	145.7	63%	0.626	74%	0.736	S	S	*	*			trans	69.7	135.4	144.9	-77.3	0.4	0	0	0	126.6
495	N	35.8	Very low	35.9	Very low	119 Å²	119	144 Å²	144	64%	0.636	73%	0.734	S	S	*	*			trans	67.6	140.7	141.7	-72.3	-44.9	0	0	0	119.8
496	H	37.1	Very low	35.3	Very low	149 Å²	149	143 Å²	143	69%	0.69	73%	0.727	S	S	*	*			cis	-155.2	159.2	18.9	-99.4	-45.4	0	0	0	113.8
497	N	33.4	Very low	34.8	Very low	125 Å²	125	145 Å²	145	67%	0.668	73%	0.733	S	S	*	*			trans	20.6	121.7	143.7	-52.1	-7.9	0	0	0	120.9
498	N	32.4	Very low	34.5	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	73%	0.731	S	S	*	*				-173.1	167.6	101.2	-102.9	-48	0	0	0	115
499	Q	32.6	Very low	34.1	Very low	192 Å²	192	144.8 Å²	144.8	90%	0.897	73%	0.731	S	S	*	*			trans	-67.2	123.1	-171.8	-61.5	169.8	-15.5	0	0	114.2
500	S	30.4	Very low	33.7	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	74%	0.736	S	S	*	*			trans	-164.9	148.6	159.4	-165.7	0	0	0	0	113.5
501	S	29.8	Very low	33.3	Very low	94 Å²	94	146.2 Å²	146.2	66%	0.657	74%	0.738	S	S	*	*			trans	53.1	114.8	147	-60.3	0	0	0	0	122.7
502	K	29.2	Very low	33.1	Very low	191 Å²	191	148.4 Å²	148.4	83%	0.83	75%	0.745	S	S	*	*				41.2	125	116.2	-64.4	174.1	177.5	171.8	0	120.8
503	R	28.2	Very low	32.8	Very low	227 Å²	227	145.9 Å²	145.9	86%	0.857	74%	0.74	S	S	*	*			trans	57.3	122.7	132.2	-69.6	-173.2	170.2	-166.4	-3.2	120.9
504	R	38.3	Very low	32.5	Very low	248 Å²	248	147.5 Å²	147.5	94%	0.936	75%	0.749	S	S	*	*			trans	44.1	98.5	130.1	-173.2	-166.1	-94.4	-171.2	-6.8	117.2
505	C	30.1	Very low	32.2	Very low	111 Å²	111	150.3 Å²	150.3	75%	0.75	76%	0.756	S	S	*	*			trans	-150.3	156.5	172.5	-84.9	0	0	0	0	108.8
506	I	32.1	Very low	31.7	Very low	137 Å²	137	151.3 Å²	151.3	70%	0.703	76%	0.761	S	S	*	*			cis	-147.1	137.1	-1.8	-108.8	151	0	0	0	110.2
507	N	33.6	Very low	31.2	Very low	135 Å²	135	150.6 Å²	150.6	72%	0.722	76%	0.761	S	S	*	*	S	Bend	trans	173.2	125.4	141.5	-91.8	-21.7	0	0	0	106.3
508	Q	34.7	Very low	31	Very low	146 Å²	146	150.2 Å²	150.2	68%	0.682	76%	0.759	S	S	*	*			cis	-159.4	153.3	-6.2	-129.6	169.6	59.5	0	0	108.7
509	I	35.1	Very low	30.8	Very low	133 Å²	133	150.2 Å²	150.2	68%	0.682	75%	0.754	S	S	*	*			trans	70	122.8	156.9	-62.7	164	0	0	0	118.4
510	D	34.1	Very low	30.7	Very low	133 Å²	133	145.7 Å²	145.7	71%	0.711	74%	0.744	S	S	*	*			trans	48.1	124.4	153.3	-55.4	-8.6	0	0	0	121.5
511	H	30.4	Very low	30.7	Very low	168 Å²	168	144.7 Å²	144.7	78%	0.778	74%	0.737	S	S	*	*			cis	100.8	140.3	36.9	-81.2	-64.2	0	0	0	114.1
512	L	32.3	Very low	30.6	Very low	153 Å²	153	148.7 Å²	148.7	80%	0.801	75%	0.745	S	S	*	*			trans	83.4	95.9	161	-67.7	161.7	0	0	0	121
513	S	30.7	Very low	30.6	Very low	94 Å²	94	143.5 Å²	143.5	66%	0.657	73%	0.733	S	S	*	*				72.6	124.7	122.8	62.8	0	0	0	0	122.5	F515	S513-F515 PolarHBondContact O-N 3.39Å
514	N	26.6	Very low	30.6	Very low	161 Å²	161	139.8 Å²	139.8	86%	0.861	73%	0.73	S	S	*	*			trans	-55.6	115.4	148.4	-73	-22.5	0	0	0	111.6
515	F	29.1	Very low	30.2	Very low	177 Å²	177	132.9 Å²	132.9	78%	0.776	72%	0.72	S	S	*	*			trans	-155.1	114.2	140.2	-91.5	-79.1	0	0	0	103.8	S513	S513-F515 PolarHBondContact O-N 3.39Å
516	N	25.2	Very low	30.1	Very low	139 Å²	139	132.3 Å²	132.3	74%	0.743	72%	0.717	S	S	*	*				57.8	133.6	55.8	-161.3	20.9	0	0	0	111.3
517	I	27.6	Very low	30	Very low	134 Å²	134	131.9 Å²	131.9	69%	0.687	72%	0.721	S	S	*	*			trans	74.3	124.4	-173.1	-55.3	161.7	0	0	0	110.2
518	D	28	Very low	29.9	Very low	118 Å²	118	130 Å²	130	63%	0.631	72%	0.718	S	S	*	*			cis	-157.7	177.4	10.7	-138.2	-17.2	0	0	0	114.6
519	Q	28.9	Very low	29.9	Very low	159 Å²	159	128.8 Å²	128.8	74%	0.743	73%	0.726	S	S	*	*			trans	40.6	132.5	143.4	-76.5	172.5	73.3	0	0	120.5
520	S	30	Very low	29.9	Very low	96 Å²	96	126.2 Å²	126.2	67%	0.671	73%	0.725	S	S	*	*			cis	-171.4	157.4	22.6	41.7	0	0	0	0	114.6
521	S	29.8	Very low	29.9	Very low	85 Å²	85	124.1 Å²	124.1	59%	0.594	72%	0.72	S	S	*	*			trans	56	120.3	137.5	-66.1	0	0	0	0	122.4
522	Q	29.5	Very low	30	Very low	178 Å²	178	124 Å²	124	83%	0.832	72%	0.72	S	S	*	*				72	148.7	126.4	-62.3	164.9	27.6	0	0	118.4
523	S	29.1	Very low	30.1	Very low	81 Å²	81	123.8 Å²	123.8	57%	0.566	72%	0.719	S	S	*	*			cis	-173.7	144.3	-19.3	53.4	0	0	0	0	110.6
524	N	27.1	Very low	30.2	Very low	150 Å²	150	123.8 Å²	123.8	80%	0.802	72%	0.719	S	S	*	*			trans	57.8	174.9	144.5	-58.5	-12.9	0	0	0	119.8
525	S	29.7	Very low	30.5	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	71%	0.712	S	S	*	*			trans	54.9	99.1	167.3	44.1	0	0	0	0	117.1
526	S	28.8	Very low	30.7	Very low	98 Å²	98	121.2 Å²	121.2	69%	0.685	71%	0.712	S	S	*	*				80.6	150	59.4	76.4	0	0	0	0	114.7
527	T	29.6	Very low	31	Very low	129 Å²	129	124.3 Å²	124.3	79%	0.791	72%	0.715	S	S	*	*			trans	63.4	143.1	163	46.5	0	0	0	0	117
528	S	31	Very low	31.3	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	72%	0.721	S	S	*	*			cis	-178.1	167.4	-8.9	46.7	0	0	0	0	110.4
529	S	35.3	Very low	31.3	Very low	119 Å²	119	126.1 Å²	126.1	83%	0.832	73%	0.731	S	S	*	*			trans	68.6	160.8	157.6	77.7	0	0	0	0	117.2
530	A	35.6	Very low	31.4	Very low	80 Å²	80	123.7 Å²	123.7	66%	0.661	73%	0.732	S	S	*	*			cis	-144	136.8	-1.9	0	0	0	0	0	108.5
531	S	32.9	Very low	31.3	Very low	88 Å²	88	123.8 Å²	123.8	62%	0.615	73%	0.733	S	S	*	*				74.2	123.2	93.9	-70.5	0	0	0	0	116.2
532	E	33.4	Very low	31.3	Very low	166 Å²	166	127.2 Å²	127.2	78%	0.776	74%	0.743	S	S	*	*				63.5	156	124.5	-63.3	153.4	-128.2	0	0	118.9
533	L	33.7	Very low	31.3	Very low	148 Å²	148	125.2 Å²	125.2	78%	0.775	74%	0.738	S	S	*	*			cis	-163	172	-9.2	-107.9	168.4	0	0	0	105.7
534	S	34.1	Very low	31.5	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	75%	0.75	S	S	*	*			cis	-149.4	-170.4	9.8	65	0	0	0	0	112.3
535	D	31.2	Very low	31.9	Very low	132 Å²	132	129.1 Å²	129.1	71%	0.706	75%	0.751	S	S	*	*			trans	-63.7	-174.2	168.4	-46	-94.2	0	0	0	115.8
536	L	34.8	Very low	32.4	Very low	151 Å²	151	129.3 Å²	129.3	79%	0.791	75%	0.75	S	S	*	*			trans	93.1	145	164.4	-51.2	178.1	0	0	0	117.2
537	Y	31	Very low	32.5	Very low	204 Å²	204	130.5 Å²	130.5	80%	0.8	75%	0.753	S	S	*	*			cis	-175.6	173.1	-33.5	-135.8	-99.2	0	0	0	107.1
538	T	34.3	Very low	32.8	Very low	131 Å²	131	129.6 Å²	129.6	80%	0.804	75%	0.747	S	S	*	*			trans	74.2	149	163.1	60	0	0	0	0	122.1
539	N	27.2	Very low	32.8	Very low	159 Å²	159	130.6 Å²	130.6	85%	0.85	75%	0.75	S	S	*	*			trans	-103.3	150.2	-175	-38.9	-61.5	0	0	0	113.3
540	S	31.3	Very low	32.8	Very low	109 Å²	109	129.7 Å²	129.7	76%	0.762	74%	0.743	S	S	*	*			trans	-176.1	130	140.2	50	0	0	0	0	108.3
541	S	28.2	Very low	32.5	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	75%	0.747	S	S	*	*			cis	74.3	126.3	42.7	-54.8	0	0	0	0	113.7
542	L	30.2	Very low	32.6	Very low	156 Å²	156	135.4 Å²	135.4	82%	0.817	76%	0.755	S	S	*	*			trans	68.5	147.5	174.8	-79	75.5	0	0	0	114.5
543	D	29.3	Very low	32.5	Very low	136 Å²	136	133.1 Å²	133.1	73%	0.727	75%	0.753	S	S	*	*			cis	-164.8	-171.1	-13.8	-129.3	-24.2	0	0	0	110.3
544	L	33.3	Very low	32.3	Very low	157 Å²	157	133.5 Å²	133.5	82%	0.822	76%	0.755	S	S	*	*			trans	79.3	100.5	153	-70.9	145	0	0	0	121
545	L	35.8	Very low	32.1	Very low	156 Å²	156	135.8 Å²	135.8	82%	0.817	76%	0.758	S	S	*	*				-31.5	162.6	128.7	-74.8	165.3	0	0	0	114.3
546	P	39.4	Very low	32.1	Very low	107 Å²	107	135.5 Å²	135.5	70%	0.695	76%	0.757	S	S	*	*			cis	-161.2	175.6	46.1	45.9	-24.6	0	0	0	120.6
547	V	32.1	Very low	32.2	Very low	123 Å²	123	136.4 Å²	136.4	75%	0.745	76%	0.757	S	S	*	*			trans	64.5	151.6	137.1	162.6	0	0	0	0	118.1
548	T	34.7	Very low	32.4	Very low	111 Å²	111	134 Å²	134	68%	0.681	76%	0.758	S	S	*	*			cis	-153.4	124.9	30.9	-5.1	0	0	0	0	108.3
549	T	30.8	Very low	32.1	Very low	117 Å²	117	134.3 Å²	134.3	72%	0.718	75%	0.754	S	S	*	*				74	142.8	98.6	63.4	0	0	0	0	120.3
550	S	35.5	Very low	32.2	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	75%	0.748	S	S	*	*			trans	76	142.2	151.8	-66.4	0	0	0	0	119.2
551	D	30.3	Very low	32.1	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	75%	0.752	S	S	*	*			cis	-165.7	-175.9	-14.5	-114.8	-53.9	0	0	0	110.9
552	L	34.8	Very low	32	Very low	149 Å²	149	140.3 Å²	140.3	78%	0.78	76%	0.755	S	S	*	*			trans	86.6	80.4	164.5	-52.2	-178	0	0	0	119.6
553	T	30.2	Very low	31.7	Very low	118 Å²	118	139.4 Å²	139.4	72%	0.724	75%	0.751	S	S	*	*				9.2	129.4	126.2	59	0	0	0	0	119.9
554	L	29.9	Very low	31.5	Very low	156 Å²	156	138.5 Å²	138.5	82%	0.817	75%	0.751	S	S	*	*				179.9	147.9	106.3	-98.1	161.4	0	0	0	114.1
555	L	30.1	Very low	31.1	Very low	142 Å²	142	136 Å²	136	74%	0.743	75%	0.746	S	S	*	*			trans	72.3	127.1	156.8	-68.7	161.5	0	0	0	121.8
556	D	31.2	Very low	30.6	Very low	127 Å²	127	135.5 Å²	135.5	68%	0.679	74%	0.744	S	S	*	*			trans	95.8	129.6	139.2	-73.1	5.9	0	0	0	123.1
557	H	37.3	Very low	30	Very low	169 Å²	169	137.1 Å²	137.1	78%	0.782	75%	0.747	S	S	*	*			trans	66.2	93	174.6	-62.2	83.8	0	0	0	117.5
558	N	33.9	Very low	29.7	Very low	153 Å²	153	135.4 Å²	135.4	82%	0.818	74%	0.74	S	S	*	*			trans	-58.1	139.6	175.2	-49.8	-59.2	0	0	0	111.7
559	N	29	Very low	29.4	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	75%	0.749	S	S	*	*			cis	76.6	148.1	38.3	-75.9	-42.2	0	0	0	117
560	N	29.2	Very low	29.2	Very low	134 Å²	134	135.1 Å²	135.1	72%	0.717	74%	0.74	S	S	*	*			trans	85.7	104	-179.4	-49.9	-27.9	0	0	0	112.9
561	Y	30.1	Very low	29.1	Very low	214 Å²	214	138.4 Å²	138.4	84%	0.839	75%	0.749	S	S	*	*			cis	59	155.9	27.3	-96.2	-75.4	0	0	0	114.3
562	L	25.3	Very low	29	Very low	144 Å²	144	137.5 Å²	137.5	75%	0.754	74%	0.744	S	S	*	*			trans	74.9	154.1	-174.4	-53.3	174.5	0	0	0	113.5
563	N	24.6	Very low	28.6	Very low	138 Å²	138	136 Å²	136	74%	0.738	74%	0.737	S	S	*	*			cis	178.7	176.2	-35.7	-119.2	-17.4	0	0	0	104.4
564	T	24.8	Very low	28.5	Very low	117 Å²	117	135.3 Å²	135.3	72%	0.718	73%	0.732	S	S	*	*			trans	-42.4	151.2	166.8	51.3	0	0	0	0	116.8
565	S	24.5	Very low	28.4	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	73%	0.726	S	S	*	*			trans	85.2	121.5	149.8	76.4	0	0	0	0	120.8
566	L	25.4	Very low	28.3	Very low	146 Å²	146	136 Å²	136	76%	0.764	73%	0.73	S	S	*	*			trans	52	137.5	131.8	-68.9	166.9	0	0	0	121.9
567	N	26.7	Very low	28.2	Very low	142 Å²	142	133.9 Å²	133.9	76%	0.759	73%	0.725	S	S	*	*			trans	76.3	151.3	162.8	-53.5	-52.7	0	0	0	116.9
568	S	26.1	Very low	27.7	Very low	86 Å²	86	132.1 Å²	132.1	60%	0.601	72%	0.722	S	S	*	*			cis	-174	146	-28	-98.3	0	0	0	0	107.7
569	I	28	Very low	27.5	Very low	172 Å²	172	131.4 Å²	131.4	88%	0.882	72%	0.718	S	S	*	*			trans	67.3	136.7	169.7	-52.9	145.3	0	0	0	113.5
570	G	26.8	Very low	27.4	Very low	51 Å²	51	131.7 Å²	131.7	53%	0.526	72%	0.719	S	S	.	*			cis	138.4	110.4	-3.7	0	0	0	0	0	112
571	L	34	Very low	27.4	Very low	168 Å²	168	131.9 Å²	131.9	88%	0.88	72%	0.719	S	S	*	*			trans	-134.9	120.7	152.7	-68.2	176.2	0	0	0	104.6
572	N	26.6	Very low	27.3	Very low	120 Å²	120	131.7 Å²	131.7	64%	0.642	72%	0.717	S	S	*	*				59.1	124.1	55.1	-65.1	64.4	0	0	0	111.4
573	D	28	Very low	27.5	Very low	118 Å²	118	130.8 Å²	130.8	63%	0.631	71%	0.713	S	S	*	*			cis	-148	146.1	4.1	-114.5	-33.9	0	0	0	115.8
574	T	26.1	Very low	27.6	Very low	103 Å²	103	129.9 Å²	129.9	63%	0.632	71%	0.708	S	S	*	*			trans	10.2	158.3	147	53.4	0	0	0	0	123.8
575	I	28.5	Very low	27.8	Very low	135 Å²	135	129 Å²	129	69%	0.692	70%	0.699	S	S	*	*			trans	82.6	118.3	139	-80.9	157.9	0	0	0	118.1
576	H	28.7	Very low	28.1	Very low	178 Å²	178	132.2 Å²	132.2	82%	0.824	71%	0.707	S	S	*	*			trans	60.4	160.4	152.8	-70.3	-20.1	0	0	0	118.7
577	S	27.9	Very low	28.2	Very low	82 Å²	82	129.3 Å²	129.3	57%	0.573	70%	0.697	S	S	*	*			cis	-167.8	155.4	-29.2	56.6	0	0	0	0	108.8
578	N	27.8	Very low	28.3	Very low	132 Å²	132	130.4 Å²	130.4	71%	0.706	70%	0.697	S	S	*	*			trans	53.6	109.8	148	-62.5	-16.3	0	0	0	118.9
579	N	28.6	Very low	28.2	Very low	138 Å²	138	129.7 Å²	129.7	74%	0.738	69%	0.692	S	S	*	*				83.5	144.8	129.2	-63.9	-18.7	0	0	0	120.7
580	L	28	Very low	28.3	Very low	145 Å²	145	129.4 Å²	129.4	76%	0.759	69%	0.691	S	S	*	*			trans	69.2	103.1	147.9	-70.3	161.2	0	0	0	118.7
581	L	28.4	Very low	28.2	Very low	138 Å²	138	134.3 Å²	134.3	72%	0.723	70%	0.701	S	S	*	*				94	132.7	128.5	-66.9	168.6	0	0	0	120
582	R	27.5	Very low	27.9	Very low	209 Å²	209	132 Å²	132	79%	0.789	70%	0.699	S	S	*	*			trans	84.9	130.1	138.8	-82.4	170.9	176.5	-166.7	-2.4	119.5
583	N	29.7	Very low	27.9	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	70%	0.704	S	S	*	*			trans	78.7	119	148.6	-58.4	-4.3	0	0	0	114.4
584	N	28.1	Very low	28.1	Very low	118 Å²	118	133 Å²	133	63%	0.631	71%	0.709	S	S	*	*				70	135.7	67.8	-66.4	-11.3	0	0	0	111.3
585	L	28.7	Very low	28.2	Very low	100 Å²	100	137.9 Å²	137.9	52%	0.524	72%	0.722	S	S	.	*			cis	-163.1	147.6	3.1	-124.3	167.8	0	0	0	109.6
586	L	29.4	Very low	28.1	Very low	170 Å²	170	138.5 Å²	138.5	89%	0.89	73%	0.726	S	S	*	*	S	Bend	trans	168.5	113.8	149.8	-96.8	160.4	0	0	0	107.7
587	C	28.1	Very low	28.1	Very low	84 Å²	84	136.2 Å²	136.2	57%	0.568	73%	0.725	S	S	*	*	S	Bend	cis	-163.3	147.9	-16.9	-121.8	0	0	0	0	105.7
588	H	28.6	Very low	28	Very low	165 Å²	165	139.1 Å²	139.1	76%	0.764	73%	0.733	S	S	*	*			cis	-114.6	146.5	3.7	-58.4	-47.4	0	0	0	108.9
589	S	25.2	Very low	28.1	Very low	71 Å²	71	141.2 Å²	141.2	50%	0.497	74%	0.738	S	S	.	*				54.2	126.4	69.3	-46.5	0	0	0	0	112.2
590	I	29.2	Very low	28.1	Very low	167 Å²	167	142.8 Å²	142.8	86%	0.856	74%	0.741	S	S	*	*			cis	-136.2	147.6	23	-65.9	171.9	0	0	0	111.2
591	Q	25.8	Very low	28.2	Very low	154 Å²	154	144.4 Å²	144.4	72%	0.72	75%	0.745	S	S	*	*			trans	-84.5	137.9	170.5	-60.5	171.8	-81.3	0	0	111.7
592	S	26.3	Very low	28.2	Very low	120 Å²	120	144.7 Å²	144.7	84%	0.839	74%	0.742	S	S	*	*			trans	-115.7	93	165.1	42.9	0	0	0	0	111
593	L	27.1	Very low	28.3	Very low	146 Å²	146	145.3 Å²	145.3	76%	0.764	75%	0.746	S	S	*	*			trans	-78.2	154.1	160.2	-105.2	76.8	0	0	0	109.7
594	P	33.1	Very low	28.2	Very low	112 Å²	112	144.1 Å²	144.1	73%	0.727	74%	0.74	S	S	*	*			trans	-83.4	142.7	-172	33.2	-35.4	0	0	0	113.1
595	F	28.4	Very low	28.4	Very low	206 Å²	206	146.9 Å²	146.9	90%	0.904	75%	0.754	S	S	*	*			trans	-156	165.3	150.4	-108.5	-72.6	0	0	0	111.4
596	N	24.8	Very low	28.3	Very low	147 Å²	147	150.1 Å²	150.1	79%	0.786	77%	0.766	S	S	*	*			trans	-80.9	-175.3	-170.8	-62.8	-41.5	0	0	0	114.5
597	V	29.3	Very low	28.4	Very low	131 Å²	131	145 Å²	145	79%	0.794	76%	0.755	S	S	*	*			trans	97.7	96.5	-175.3	-178.1	0	0	0	0	110.2
598	I	25.9	Very low	28.5	Very low	143 Å²	143	148.8 Å²	148.8	73%	0.733	77%	0.768	S	S	*	*				72.2	94	59	-55.2	169.8	0	0	0	112.7
599	E	30.4	Very low	28.4	Very low	176 Å²	176	150 Å²	150	82%	0.822	77%	0.771	S	S	*	*			trans	-172.8	124.6	142.2	-99.9	157	-158.3	0	0	103.5
600	Q	27.3	Very low	28.6	Very low	171 Å²	171	152.8 Å²	152.8	80%	0.799	78%	0.781	S	S	*	*				48.2	125.5	75.3	-66.4	-171.6	-55.1	0	0	111.5
601	E	31.2	Very low	28.9	Very low	179 Å²	179	153 Å²	153	84%	0.836	78%	0.778	S	S	*	*			cis	-124.4	169.5	37.9	-59.4	-176.3	121.2	0	0	115.8
602	Q	27.5	Very low	28.9	Very low	144 Å²	144	153.6 Å²	153.6	67%	0.673	78%	0.781	S	S	*	*			trans	-83.7	150.4	166.6	-61.1	158.8	-113.6	0	0	110.1
603	Y	30.7	Very low	29	Very low	222 Å²	222	155.2 Å²	155.2	87%	0.871	78%	0.775	S	S	*	*			trans	-142.1	116.7	132.5	-91.6	-71.7	0	0	0	110.2
604	D	26.5	Very low	29.1	Very low	100 Å²	100	153.7 Å²	153.7	54%	0.535	77%	0.772	S	S	.	*			trans	-68.3	148.7	168.4	-76.5	-87.2	0	0	0	111
605	L	32.7	Very low	29	Very low	177 Å²	177	158.7 Å²	158.7	93%	0.927	78%	0.778	S	S	*	*			trans	-147.6	93.8	141.6	-113	171.8	0	0	0	109.6
606	Q	26.9	Very low	29	Very low	168 Å²	168	153.8 Å²	153.8	79%	0.785	77%	0.769	S	S	*	*			trans	-86	144.8	170.7	-61.5	177	14.6	0	0	109.9
607	G	30.3	Very low	29.1	Very low	63 Å²	63	153.9 Å²	153.9	65%	0.649	77%	0.768	S	S	*	*			trans	126.1	131.1	176.3	0	0	0	0	0	111.8
608	L	30.6	Very low	29.1	Very low	162 Å²	162	155 Å²	155	85%	0.848	77%	0.769	S	S	*	*			cis	-129.7	140.1	-3.2	-58	95.1	0	0	0	107
609	F	27.9	Very low	29.3	Very low	190 Å²	190	154.7 Å²	154.7	83%	0.833	77%	0.769	S	S	*	*				52.6	126.4	70.5	-91	-72.1	0	0	0	114.2
610	N	29.1	Very low	29.3	Very low	130 Å²	130	151.8 Å²	151.8	70%	0.695	76%	0.759	S	S	*	*			trans	70.6	153.4	176.3	-60.4	20.9	0	0	0	115.1
611	E	34	Very low	29.5	Very low	171 Å²	171	150.2 Å²	150.2	80%	0.799	75%	0.751	S	S	*	*			cis	-134.1	172.2	10	-141.9	124	-109.8	0	0	112.6
612	H	27.5	Very low	29.7	Very low	167 Å²	167	150 Å²	150	77%	0.773	75%	0.748	S	S	*	*			trans	-99.7	176	-179.2	-126.2	-118.9	0	0	0	111.1
613	E	28.3	Very low	30	Very low	154 Å²	154	151.7 Å²	151.7	72%	0.72	75%	0.749	S	S	*	*			trans	69.1	111.2	154.9	-75.8	169.1	-151.4	0	0	121.1
614	T	29.1	Very low	30.1	Very low	115 Å²	115	146.5 Å²	146.5	71%	0.706	74%	0.737	S	S	*	*				70.4	150.9	127.8	-35.3	0	0	0	0	119.1
615	Y	30.5	Very low	30.3	Very low	217 Å²	217	151.3 Å²	151.3	85%	0.851	75%	0.747	S	S	*	*			trans	156.5	134	130.7	-84.7	-66.5	0	0	0	111.2
616	S	29	Very low	30.3	Very low	102 Å²	102	147.4 Å²	147.4	71%	0.713	74%	0.735	S	S	*	*			trans	-91.3	179.3	170.8	-57	0	0	0	0	110.4
617	I	26.4	Very low	30.5	Very low	150 Å²	150	144.8 Å²	144.8	77%	0.769	73%	0.731	S	S	*	*			trans	69.9	114.4	164.5	-23.6	176.8	0	0	0	115.5
618	L	28.6	Very low	30.5	Very low	153 Å²	153	146.9 Å²	146.9	80%	0.801	74%	0.735	S	S	*	*				175.2	152.4	108.4	-92.8	168.7	0	0	0	113.3
619	N	30.9	Very low	30.5	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	73%	0.725	S	S	*	*			trans	-72.1	168.9	161.4	-55.5	-34.3	0	0	0	108.8
620	D	29.3	Very low	30.7	Very low	114 Å²	114	141.6 Å²	141.6	61%	0.61	72%	0.723	S	S	*	*				-179.1	153.2	82.8	-110.1	-37.9	0	0	0	114.3
621	H	31.3	Very low	30.8	Very low	138 Å²	138	140.4 Å²	140.4	64%	0.639	73%	0.725	S	S	*	*			trans	63.5	160	161.6	-52	-19.7	0	0	0	115.6
622	F	36	Very low	31	Very low	176 Å²	176	137.6 Å²	137.6	77%	0.772	72%	0.721	S	S	*	*			cis	-146.3	157	23.9	-75.1	-100.6	0	0	0	108.8
623	Y	34.3	Very low	31.3	Very low	178 Å²	178	139.4 Å²	139.4	70%	0.698	73%	0.727	S	S	*	*			cis	-164.5	167.7	-6.7	-141.4	-126.9	0	0	0	109.6
624	D	33.7	Very low	31.5	Very low	114 Å²	114	137.9 Å²	137.9	61%	0.61	72%	0.724	S	S	*	*			trans	50.3	147.7	153.4	-88.4	12.7	0	0	0	122.7
625	R	30.5	Very low	31.8	Very low	200 Å²	200	138.8 Å²	138.8	76%	0.755	72%	0.724	S	S	*	*			cis	-177.2	132.2	-13.7	169.2	167.8	179.4	-173.6	1	113.7
626	S	31.4	Very low	32	Very low	95 Å²	95	134.9 Å²	134.9	66%	0.664	72%	0.718	S	S	*	*			trans	64.1	155.4	153.5	-67.2	0	0	0	0	119.7
627	T	31.5	Very low	32.5	Very low	114 Å²	114	137.4 Å²	137.4	70%	0.699	72%	0.723	S	S	*	*			cis	-169.8	150.7	-16.2	30.5	0	0	0	0	108.8
628	S	29.7	Very low	33.1	Very low	106 Å²	106	136.9 Å²	136.9	74%	0.741	72%	0.722	S	S	*	*			trans	55.1	143.8	143.9	64	0	0	0	0	121.3
629	S	30.6	Very low	33.8	Very low	92 Å²	92	138 Å²	138	64%	0.643	72%	0.723	S	S	*	*			cis	177.2	166	-5.1	50.3	0	0	0	0	111.8
630	L	33.5	Very low	34.2	Very low	149 Å²	149	137.3 Å²	137.3	78%	0.78	72%	0.719	S	S	*	*			trans	70.1	94.8	143.7	-76.5	159.8	0	0	0	121.6
631	S	30.1	Very low	34.8	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	72%	0.721	S	S	*	*				68.8	153.6	119.9	59.2	0	0	0	0	123.2
632	P	39.5	Very low	35.2	Very low	113 Å²	113	137.2 Å²	137.2	73%	0.734	72%	0.723	S	S	*	*			trans	-111	157.8	-168.3	41.6	-33.1	0	0	0	116.4
633	F	32.7	Very low	35.2	Very low	204 Å²	204	134.1 Å²	134.1	90%	0.895	72%	0.719	S	S	*	*			trans	-175.7	156.4	161.1	-81.4	-52.3	0	0	0	109
634	D	32.8	Very low	35.4	Very low	123 Å²	123	131.2 Å²	131.2	66%	0.658	72%	0.72	S	S	*	*			cis	-167.1	170.3	-32.4	-145.8	-21.7	0	0	0	110.7
635	L	35	Very low	35.5	Very low	134 Å²	134	131 Å²	131	70%	0.702	72%	0.723	S	S	*	*			trans	48.2	131.3	159	-66.3	168.2	0	0	0	123.5
636	N	35.8	Very low	35.9	Very low	134 Å²	134	128.3 Å²	128.3	72%	0.717	72%	0.723	S	S	*	*			trans	40	139	137.9	-56.7	3.7	0	0	0	123.8
637	D	38.8	Very low	36.2	Very low	155 Å²	155	128.5 Å²	128.5	83%	0.829	72%	0.721	S	S	*	*				-172.1	164.4	106.8	-99.2	-4	0	0	0	113.2
638	D	38.8	Very low	36.4	Very low	139 Å²	139	129 Å²	129	74%	0.743	72%	0.724	S	S	*	*			trans	-89	165.1	-165.8	-58.5	-61.2	0	0	0	116.3
639	H	42.7	Very low	36.9	Very low	176 Å²	176	129 Å²	129	82%	0.815	72%	0.719	S	S	*	*				-174.6	144.4	108.4	-103.9	-38.4	0	0	0	116.7
640	D	40.1	Very low	37.2	Very low	125 Å²	125	130.4 Å²	130.4	67%	0.668	73%	0.725	S	S	*	*			trans	-80.4	172.7	177.3	-32.2	-110.9	0	0	0	114.2
641	N	41.4	Very low	37.3	Very low	121 Å²	121	127.7 Å²	127.7	65%	0.647	72%	0.718	S	S	*	*				174.2	141.5	101.9	-98.3	-80.9	0	0	0	116.3
642	N	39.4	Very low	37.7	Very low	128 Å²	128	127.8 Å²	127.8	68%	0.684	72%	0.718	S	S	*	*			trans	68.8	153.2	141.8	-67.4	-28	0	0	0	122.8
643	T	37.1	Very low	37.5	Very low	111 Å²	111	127 Å²	127	68%	0.681	72%	0.716	S	S	*	*			cis	-173.3	166.9	-49	24.9	0	0	0	0	111.8
644	T	38	Very low	37.8	Very low	117 Å²	117	122 Å²	122	72%	0.718	71%	0.706	S	S	*	*			trans	70.9	98.5	150.1	40.8	0	0	0	0	122.5
645	T	36.9	Very low	38	Very low	110 Å²	110	121.7 Å²	121.7	68%	0.675	71%	0.709	S	S	*	*				42.5	134.9	112.9	60.2	0	0	0	0	122.9
646	N	38.9	Very low	38.1	Very low	143 Å²	143	121.1 Å²	121.1	77%	0.765	71%	0.711	S	S	*	*				155	156.9	127.2	-80.5	-14.4	0	0	0	112.1
647	T	37.2	Very low	38.2	Very low	100 Å²	100	120.1 Å²	120.1	61%	0.613	71%	0.71	S	S	*	*			cis	176.6	147.7	-48.2	29.6	0	0	0	0	108.5
648	T	36.4	Very low	38.2	Very low	123 Å²	123	117.7 Å²	117.7	76%	0.755	70%	0.701	S	S	*	*			trans	64.7	156.8	152.1	53.8	0	0	0	0	118.6
649	T	38.7	Very low	38.1	Very low	106 Å²	106	117.8 Å²	117.8	65%	0.65	70%	0.701	S	S	*	*			cis	-168	159.1	-5.1	20.1	0	0	0	0	111.9
650	T	37.6	Very low	37.9	Very low	123 Å²	123	115 Å²	115	76%	0.755	70%	0.697	S	S	*	*			trans	60.2	156.1	143.1	55	0	0	0	0	121.9
651	S	36.2	Very low	37.9	Very low	91 Å²	91	114.8 Å²	114.8	64%	0.636	70%	0.7	S	S	*	*			cis	-178.9	171.7	-28.2	58.4	0	0	0	0	109.4
652	S	37.2	Very low	37.8	Very low	107 Å²	107	115.1 Å²	115.1	75%	0.748	70%	0.702	S	S	*	*			trans	65.4	152.8	154.9	34	0	0	0	0	118.7
653	S	36.7	Very low	37.8	Very low	98 Å²	98	114 Å²	114	69%	0.685	70%	0.7	S	S	*	*			cis	-171.3	175.9	-12.8	50.2	0	0	0	0	110.8
654	S	38.8	Very low	37.8	Very low	97 Å²	97	115 Å²	115	68%	0.678	70%	0.701	S	S	*	*			trans	68.6	148.5	142.9	51.9	0	0	0	0	120.5
655	T	36.4	Very low	37.7	Very low	118 Å²	118	114.4 Å²	114.4	72%	0.724	70%	0.697	S	S	*	*			cis	-171.1	156.7	-13.1	25.9	0	0	0	0	110.6
656	T	36.5	Very low	37.6	Very low	122 Å²	122	114.8 Å²	114.8	75%	0.748	70%	0.7	S	S	*	*			trans	65.5	164.1	149.3	50.9	0	0	0	0	118.6
657	T	38	Very low	37.4	Very low	112 Å²	112	113 Å²	113	69%	0.687	69%	0.694	S	S	*	*			cis	-157.1	136.1	15.3	-13.4	0	0	0	0	113.6
658	T	38.6	Very low	37.2	Very low	104 Å²	104	115.2 Å²	115.2	64%	0.638	70%	0.702	S	S	*	*			trans	43.8	130.8	141.1	58.1	0	0	0	0	125.3
659	N	37.1	Very low	37.2	Very low	141 Å²	141	115.6 Å²	115.6	75%	0.754	71%	0.705	S	S	*	*				60.1	142.7	127.1	-47	-10.9	0	0	0	120
660	T	38.6	Very low	36.8	Very low	118 Å²	118	118.7 Å²	118.7	72%	0.724	72%	0.717	S	S	*	*				-173.3	147.9	58.5	34.4	0	0	0	0	112.4
661	T	40.5	Very low	36.6	Very low	120 Å²	120	116.3 Å²	116.3	74%	0.736	72%	0.717	S	S	*	*			trans	58.6	155	148.1	57.6	0	0	0	0	119.7
662	N	38.6	Very low	36.5	Very low	128 Å²	128	119 Å²	119	68%	0.684	72%	0.724	S	S	*	*			cis	-160.4	164.6	9.6	-131.1	-2	0	0	0	110.7
663	T	40.1	Very low	36.4	Very low	104 Å²	104	122.3 Å²	122.3	64%	0.638	73%	0.725	S	S	*	*			trans	35.8	139.6	146.8	59.4	0	0	0	0	121.2
664	N	36.8	Very low	36.3	Very low	134 Å²	134	123.3 Å²	123.3	72%	0.717	72%	0.723	S	S	*	*			cis	-170.7	163.3	25.4	-125.7	1.2	0	0	0	113.1
665	T	35.9	Very low	36.2	Very low	103 Å²	103	126.7 Å²	126.7	63%	0.632	73%	0.727	S	S	*	*			trans	41.4	117.7	149.8	57.5	0	0	0	0	120.9
666	T	35.8	Very low	36.1	Very low	118 Å²	118	128.9 Å²	128.9	72%	0.724	73%	0.733	S	S	*	*				63.9	141.3	58.8	73.1	0	0	0	0	115.2
667	T	33.7	Very low	36.2	Very low	106 Å²	106	128 Å²	128	65%	0.65	73%	0.73	S	S	*	*			cis	-175.3	-173.3	-15.5	34.6	0	0	0	0	107.1
668	N	33.8	Very low	36	Very low	147 Å²	147	127.6 Å²	127.6	79%	0.786	73%	0.731	S	S	*	*			trans	84.5	153.7	156.6	-52.1	-30.1	0	0	0	115.3
669	T	34.9	Very low	35.8	Very low	131 Å²	131	129.8 Å²	129.8	80%	0.804	74%	0.738	S	S	*	*			cis	-132.1	155.2	25.4	45.7	0	0	0	0	115.3
670	N	31.4	Very low	35.7	Very low	170 Å²	170	128.5 Å²	128.5	91%	0.909	73%	0.732	S	S	*	*			trans	-121.9	150	173.4	-84.2	-22	0	0	0	110.1
671	G	34.1	Very low	35.6	Very low	73 Å²	73	128.3 Å²	128.3	75%	0.753	73%	0.726	S	S	*	*			trans	77.3	171.9	169.6	0	0	0	0	0	115
672	L	32.4	Very low	35.5	Very low	148 Å²	148	131.9 Å²	131.9	78%	0.775	73%	0.732	S	S	*	*			cis	-165.8	175.5	-5.4	-129.8	163.4	0	0	0	107.6
673	F	35.3	Very low	35.5	Very low	176 Å²	176	131.3 Å²	131.3	77%	0.772	73%	0.728	S	S	*	*			trans	67.3	163.8	179.3	-59.2	-82.2	0	0	0	115
674	N	34.4	Very low	35.5	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	74%	0.741	S	S	*	*			cis	-167.9	173.2	-46.6	-128.6	31.5	0	0	0	106.7
675	E	36.9	Very low	35.5	Very low	167 Å²	167	135.4 Å²	135.4	78%	0.78	75%	0.746	S	S	*	*			trans	66.7	110.9	156	-74.9	145.1	-121.8	0	0	120.6
676	I	34.7	Very low	35.8	Very low	165 Å²	165	139.8 Å²	139.8	85%	0.846	76%	0.76	S	S	*	*			trans	-66	137.7	160.4	-67.4	160.1	0	0	0	108.3
677	P	38.3	Very low	35.9	Very low	103 Å²	103	140.8 Å²	140.8	67%	0.669	76%	0.76	S	S	*	*				-159.8	166.8	81.1	42	-21	0	0	0	120.6
678	S	35.3	Very low	35.9	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	77%	0.765	S	S	*	*			trans	65.1	158.3	142.2	56.7	0	0	0	0	120.8
679	L	33.1	Very low	35.9	Very low	150 Å²	150	142.3 Å²	142.3	79%	0.785	76%	0.764	S	S	*	*			cis	-171	161.4	-35.4	-157.1	75.5	0	0	0	106.6
680	N	34.7	Very low	35.7	Very low	114 Å²	114	141.3 Å²	141.3	61%	0.61	76%	0.759	S	S	*	*			trans	72.1	129.8	162	-82.7	46.7	0	0	0	120.4
681	D	36.6	Very low	35.8	Very low	113 Å²	113	140.3 Å²	140.3	60%	0.604	75%	0.753	S	S	*	*			trans	59.3	111.8	133.5	-40.6	-15.8	0	0	0	120.1
682	F	38.6	Very low	35.8	Very low	196 Å²	196	143.2 Å²	143.2	86%	0.86	75%	0.751	S	S	*	*				-159.3	136.3	99.5	-104	-66.6	0	0	0	112.6
683	D	39	Very low	35.6	Very low	115 Å²	115	144.8 Å²	144.8	62%	0.615	76%	0.759	S	S	*	*			trans	-61.5	154.3	-168.5	-37.5	-64.9	0	0	0	115.2
684	N	39.4	Very low	35.7	Very low	170 Å²	170	141.5 Å²	141.5	91%	0.909	75%	0.754	S	S	*	*			trans	-157.5	84.4	145.4	-90.6	-71.6	0	0	0	108.7
685	D	37.8	Very low	35.5	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	76%	0.76	S	S	*	*			trans	-74.7	129.7	165.6	-72	-53.2	0	0	0	110
686	E	41.3	Very low	35.3	Very low	196 Å²	196	143.8 Å²	143.8	92%	0.916	76%	0.764	S	S	*	*			trans	-142.6	147.5	150.7	-161.4	153.6	-147	0	0	111.5
687	L	39	Very low	35.1	Very low	138 Å²	138	142.3 Å²	142.3	72%	0.723	76%	0.758	S	S	*	*			trans	-85.5	152.1	-154.1	-84.2	68.4	0	0	0	115.2
688	L	33	Very low	34.6	Very low	146 Å²	146	144.3 Å²	144.3	76%	0.764	76%	0.76	S	S	*	*			trans	30.4	129.4	141.3	-79.3	60.8	0	0	0	119.8
689	D	32.8	Very low	34.2	Very low	140 Å²	140	146.5 Å²	146.5	75%	0.749	76%	0.763	S	S	*	*				-142.8	118.2	110.5	-158.1	1.7	0	0	0	110.6	L691	D689-L691 PolarHBondContact O-N 2.98Å
690	P	31.8	Very low	34.1	Very low	109 Å²	109	144.6 Å²	144.6	71%	0.708	76%	0.763	S	S	*	*			trans	-91.8	65.2	-172	36.5	-36.1	0	0	0	112.7
691	L	33.7	Very low	33.8	Very low	150 Å²	150	149.8 Å²	149.8	79%	0.785	77%	0.774	S	S	*	*			trans	-144.7	42.3	-170.2	-121.2	174.3	0	0	0	117.3	D689	D689-L691 PolarHBondContact O-N 2.98Å
692	D	32.6	Very low	33.5	Very low	133 Å²	133	151.9 Å²	151.9	71%	0.711	78%	0.784	S	S	*	*			trans	-137.8	111.5	158.9	-153.3	-29	0	0	0	111.3	T694	D692-T694 WeakPolarHBondContact OD1-CB 3.4Å; D692-T694 PolarHBondContact OD1-OG1 3.4Å
693	L	30.1	Very low	33.4	Very low	181 Å²	181	147 Å²	147	95%	0.948	77%	0.771	S	S	*	*			trans	-123.9	68.2	-176.4	-103.8	173.2	0	0	0	109.9
694	T	35.7	Very low	33.1	Very low	108 Å²	108	150.6 Å²	150.6	66%	0.663	78%	0.783	S	S	*	*			trans	-135.6	125.9	-173.1	-35.9	0	0	0	0	106.7	D692	D692-T694 WeakPolarHBondContact OD1-CB 3.4Å; D692-T694 PolarHBondContact OD1-OG1 3.4Å
695	I	30.5	Very low	33	Very low	149 Å²	149	146.8 Å²	146.8	76%	0.764	76%	0.763	S	S	*	*	S	Bend	cis	-135.5	123.2	14.4	-57.8	159.5	0	0	0	110
696	H	32.7	Very low	33	Very low	186 Å²	186	149.7 Å²	149.7	86%	0.861	76%	0.762	S	S	*	*			trans	-149.6	139.3	153.7	-103.9	-70.3	0	0	0	109.9
697	N	29.9	Very low	32.9	Very low	134 Å²	134	152 Å²	152	72%	0.717	76%	0.763	S	S	*	*	S	Bend	trans	69.1	114.1	178.6	-100.2	1.7	0	0	0	118.9
698	M	28.8	Very low	33.1	Very low	145 Å²	145	152 Å²	152	71%	0.714	76%	0.763	S	S	*	*			trans	77.8	128	137.7	-55.7	-62.3	167.9	0	0	121.8
699	N	27.9	Very low	33.3	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	76%	0.762	S	S	*	*			trans	73.3	74.2	141.6	-60.5	-20	0	0	0	122.5
700	S	30.3	Very low	33.6	Very low	111 Å²	111	150.4 Å²	150.4	78%	0.776	76%	0.755	S	S	*	*			trans	-163.7	130.6	136.8	30.8	0	0	0	0	109.4
701	R	28.8	Very low	33.7	Very low	222 Å²	222	150.7 Å²	150.7	84%	0.838	76%	0.759	S	S	*	*				55.6	134	80.8	-65.4	-174	77.8	-171.7	4.9	114.1
702	L	29.4	Very low	34	Very low	157 Å²	157	147.5 Å²	147.5	82%	0.822	75%	0.75	S	S	*	*			trans	77	142.6	169.6	-56.4	146.3	0	0	0	114.1
703	T	36.1	Very low	34.7	Very low	95 Å²	95	149 Å²	149	58%	0.583	76%	0.758	S	S	*	*			cis	-130.4	-166.2	-5.8	59.3	0	0	0	0	111.2	D705	T703-D705 WeakPolarHBondContact CB-OD2 3.14Å; T703-D705 VanDerWaalsContact OG1-CG 3.31Å; T703-D705 PolarHBondContact OG1-N 2.89Å; T703-D705 PolarHBondContact OG1-OD2 2.85Å
704	H	32.8	Very low	35.5	Very low	190 Å²	190	144 Å²	144	88%	0.88	73%	0.734	S	S	*	*	S	Bend	trans	-88	8.2	175.6	-88.2	-7.8	0	0	0	114.4
705	D	37.2	Very low	35.9	Very low	89 Å²	89	142.5 Å²	142.5	48%	0.476	73%	0.726	S	S	.	*			trans	-97.3	6.5	-154.7	-51.1	-48.3	0	0	0	116.3	T703 W707 L708	T703-D705 WeakPolarHBondContact CB-OD2 3.14Å; T703-D705 VanDerWaalsContact OG1-CG 3.31Å; T703-D705 PolarHBondContact OG1-N 2.89Å; T703-D705 PolarHBondContact OG1-OD2 2.85Å; D705-W707 VanDerWaalsContact C-N 3.29Å; D705-W707 PolarHBondContact O-N 3.2Å; D705-L708 PolarHBondContact O-N 3.3Å; D705-L708 VanDerWaalsContact O-N 3.16Å
706	W	38.3	Very low	36.7	Very low	216 Å²	216	143 Å²	143	82%	0.818	72%	0.724	S	S	*	*	H	α-helix	trans	-46.9	-52	179.2	-178.8	-29.5	0	0	0	111.4	L708 N709	W706-L708 PolarHBondContact O-N 2.81Å; W706-N709 PolarHBondContact O-N 2.87Å; W706-N709 VanDerWaalsContact O-N 3.15Å
707	W	38.5	Very low	37.6	Very low	245 Å²	245	139.5 Å²	139.5	93%	0.928	71%	0.712	S	S	*	*	H	α-helix	trans	-59.2	-20.8	-172.7	-92.7	83	0	0	0	115.1	D705	D705-W707 VanDerWaalsContact C-N 3.29Å; D705-W707 PolarHBondContact O-N 3.2Å
708	L	43.1	Very low	38.8	Very low	138 Å²	138	137.3 Å²	137.3	72%	0.723	70%	0.701	S	S	*	*	H	α-helix	trans	-83.7	-24	-178.8	-71.6	167.3	0	0	0	113.4	D705 W706	D705-L708 PolarHBondContact O-N 3.3Å; D705-L708 VanDerWaalsContact O-N 3.16Å; W706-L708 PolarHBondContact O-N 2.81Å
709	N	37.2	Very low	39.9	Very low	140 Å²	140	136 Å²	136	75%	0.749	70%	0.696	S	S	*	*	H	α-helix	trans	-94	-12.1	-161.1	-136.5	16.3	0	0	0	115.5	W706	W706-N709 PolarHBondContact O-N 2.87Å; W706-N709 VanDerWaalsContact O-N 3.15Å
710	N	39.3	Very low	41.8	Very low	112 Å²	112	131.9 Å²	131.9	60%	0.599	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	9.4	180	-78.6	8.2	0	0	0	114.1	S712	N710-S712 PolarHBondContact O-N 2.82Å
711	S	35.6	Very low	43.6	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	67%	0.669	S	S	*	*			trans	-78.3	29.5	-171.1	-145.9	0	0	0	0	114.8
712	S	40.1	Very low	45.7	Very low	83 Å²	83	125.8 Å²	125.8	58%	0.58	66%	0.657	S	S	*	*	S	Bend	trans	-147.8	137.2	173.5	64.9	0	0	0	0	112.6	N710 V714	N710-S712 PolarHBondContact O-N 2.82Å; S712-V714 VanDerWaalsContact C-N 3.31Å; S712-V714 PolarHBondContact O-N 2.94Å; S712-V714 VanDerWaalsContact O-N 3.13Å
713	N	46.6	Very low	47.3	Very low	164 Å²	164	124 Å²	124	88%	0.877	65%	0.645	S	S	*	*	S	Bend	trans	63.5	6.4	167.6	-55.9	-21	0	0	0	119.3	T715	N713-T715 PolarHBondContact O-N 3.24Å
714	V	46	Very low	49.2	Very low	76 Å²	76	122.7 Å²	122.7	46%	0.461	64%	0.638	S	S	.	*			trans	-81.9	116.7	170.4	-175.3	0	0	0	0	110	S712 N718	S712-V714 VanDerWaalsContact C-N 3.31Å; S712-V714 PolarHBondContact O-N 2.94Å; S712-V714 VanDerWaalsContact O-N 3.13Å; V714-N718 HydrophobicContact CG1-CB 3.94Å
715	T	44.2	Very low	51.3	Low	78 Å²	78	118 Å²	118	48%	0.479	62%	0.619	S	S	.	*			trans	-67.3	150.2	172.4	41.1	0	0	0	0	111.5	N713 D717 N718	N713-T715 PolarHBondContact O-N 3.24Å; T715-D717 PolarHBondContact O-N 2.82Å; T715-D717 VanDerWaalsContact O-N 3.15Å; T715-N718 PolarHBondContact O-N 3.41Å; T715-N718 VanDerWaalsContact O-N 3.17Å; T715-N718 PolarHBondContact OG1-OD1 2.79Å
716	Q	48.2	Very low	53.4	Low	158 Å²	158	120.6 Å²	120.6	74%	0.738	63%	0.626	S	S	*	*	H	α-helix	trans	-59.4	-30.3	-173.7	-165.3	168.3	-2.8	0	0	112.8	L719 S720	Q716-L719 PolarHBondContact O-N 2.91Å; Q716-S720 PolarHBondContact O-N 2.74Å
717	D	51.9	Low	55.4	Low	113 Å²	113	114.4 Å²	114.4	60%	0.604	61%	0.609	S	S	*	*	H	α-helix	trans	-64.9	-45.4	178.5	-43.4	-67.9	0	0	0	112	T715 L719 S720 E721	T715-D717 PolarHBondContact O-N 2.82Å; T715-D717 VanDerWaalsContact O-N 3.15Å; D717-L719 PolarHBondContact O-N 2.85Å; D717-S720 WeakPolarHBondContact O-CA 3.44Å; D717-S720 WeakPolarHBondContact O-CB 3.27Å; D717-S720 PolarHBondContact O-N 2.96Å; D717-S720 PolarHBondContact O-OG 3.5Å; D717-E721 PolarHBondContact O-N 3.39Å
718	N	53.8	Low	57.2	Low	89 Å²	89	106.4 Å²	106.4	48%	0.476	58%	0.584	S	S	.	*	H	α-helix	trans	-61.9	-31.8	-179.7	-67.9	18.5	0	0	0	112.3	V714 T715 S722	V714-N718 HydrophobicContact CG1-CB 3.94Å; T715-N718 PolarHBondContact O-N 3.41Å; T715-N718 VanDerWaalsContact O-N 3.17Å; T715-N718 PolarHBondContact OG1-OD1 2.79Å; N718-S722 WeakPolarHBondContact O-CB 3.28Å; N718-S722 PolarHBondContact O-N 3.07Å
719	L	52	Low	58.9	Low	116 Å²	116	103.4 Å²	103.4	61%	0.607	58%	0.575	S	S	*	*	H	α-helix	trans	-69	-38	175.5	-156.2	81.4	0	0	0	111	Q716 D717 M723	Q716-L719 PolarHBondContact O-N 2.91Å; D717-L719 PolarHBondContact O-N 2.85Å; L719-M723 WeakPolarHBondContact O-CB 3.36Å; L719-M723 PolarHBondContact O-N 3.25Å; L719-M723 VanDerWaalsContact O-N 3.12Å
720	S	67.4	Low	61	Low	64 Å²	64	99.6 Å²	99.6	45%	0.448	56%	0.556	S	S	.	*	H	α-helix	trans	-67.4	-40.8	176.6	80.1	0	0	0	0	112.1	Q716 D717 T724	Q716-S720 PolarHBondContact O-N 2.74Å; D717-S720 WeakPolarHBondContact O-CA 3.44Å; D717-S720 WeakPolarHBondContact O-CB 3.27Å; D717-S720 PolarHBondContact O-N 2.96Å; D717-S720 PolarHBondContact O-OG 3.5Å; S720-T724 VanDerWaalsContact O-CB 3.28Å; S720-T724 WeakPolarHBondContact O-CB 3.44Å; S720-T724 PolarHBondContact O-N 3.1Å; S720-T724 PolarHBondContact O-OG1 2.93Å
721	E	69.4	Low	63	Low	122 Å²	122	99.1 Å²	99.1	57%	0.57	55%	0.553	S	S	*	*	H	α-helix	trans	-70.9	-43.4	179.9	-174.6	170	-164.3	0	0	111.7	D717 M723 T724 N725	D717-E721 PolarHBondContact O-N 3.39Å; E721-M723 VanDerWaalsContact C-N 3.35Å; E721-M723 PolarHBondContact O-N 3.19Å; E721-T724 PolarHBondContact O-N 3.11Å; E721-N725 WeakPolarHBondContact O-CB 3.47Å; E721-N725 VanDerWaalsContact O-CG 3.3Å; E721-N725 PolarHBondContact O-N 3Å; E721-N725 PolarHBondContact O-ND2 3.49Å
722	S	73.5	Confident	65	Low	83 Å²	83	98.7 Å²	98.7	58%	0.58	54%	0.542	S	S	*	.	H	α-helix	trans	-58.9	-45	174.6	-175.1	0	0	0	0	112	N718 N725 F726	N718-S722 WeakPolarHBondContact O-CB 3.28Å; N718-S722 PolarHBondContact O-N 3.07Å; S722-N725 PolarHBondContact O-N 3.13Å; S722-F726 PolarHBondContact O-N 2.86Å
723	M	61.6	Low	67.1	Low	118 Å²	118	99.9 Å²	99.9	58%	0.581	54%	0.539	S	S	*	.	H	α-helix	trans	-70.2	-35.7	178.3	-169.9	158.8	57.8	0	0	112.6	L719 E721 F726 I727	L719-M723 WeakPolarHBondContact O-CB 3.36Å; L719-M723 PolarHBondContact O-N 3.25Å; L719-M723 VanDerWaalsContact O-N 3.12Å; E721-M723 VanDerWaalsContact C-N 3.35Å; E721-M723 PolarHBondContact O-N 3.19Å; M723-F726 PolarHBondContact O-N 3.18Å; M723-I727 HydrophobicContact CG-CD1 4.21Å; M723-I727 WeakPolarHBondContact O-CD1 3.44Å; M723-I727 VanDerWaalsContact O-CG1 3.28Å; M723-I727 WeakPolarHBondContact O-CG1 3.35Å; M723-I727 PolarHBondContact O-N 2.85Å
724	T	76.4	Confident	68.6	Low	69 Å²	69	97 Å²	97	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-64.9	-43.5	173.7	-59.4	0	0	0	0	111.4	S720 E721 F726 I727 N728	S720-T724 VanDerWaalsContact O-CB 3.28Å; S720-T724 WeakPolarHBondContact O-CB 3.44Å; S720-T724 PolarHBondContact O-N 3.1Å; S720-T724 PolarHBondContact O-OG1 2.93Å; E721-T724 PolarHBondContact O-N 3.11Å; T724-F726 VanDerWaalsContact C-N 3.35Å; T724-F726 PolarHBondContact O-N 3.07Å; T724-I727 PolarHBondContact O-N 3.2Å; T724-N728 WeakPolarHBondContact O-CB 3.3Å; T724-N728 PolarHBondContact O-N 3.47Å; T724-N728 PolarHBondContact O-ND2 3.29Å
725	N	76.5	Confident	70.2	Confident	90 Å²	90	98.4 Å²	98.4	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-38	176.9	-73.3	-30.9	0	0	0	112	E721 S722 S729	E721-N725 WeakPolarHBondContact O-CB 3.47Å; E721-N725 VanDerWaalsContact O-CG 3.3Å; E721-N725 PolarHBondContact O-N 3Å; E721-N725 PolarHBondContact O-ND2 3.49Å; S722-N725 PolarHBondContact O-N 3.13Å; N725-S729 WeakPolarHBondContact O-CB 3.4Å; N725-S729 PolarHBondContact O-N 2.86Å
726	F	81.4	Confident	71.8	Confident	144 Å²	144	101.8 Å²	101.8	63%	0.632	53%	0.528	S	S	*	.	H	α-helix	trans	-62.7	-46.2	172.1	175.6	-101.7	0	0	0	112.6	S722 M723 T724 S729 T730	S722-F726 PolarHBondContact O-N 2.86Å; M723-F726 PolarHBondContact O-N 3.18Å; T724-F726 VanDerWaalsContact C-N 3.35Å; T724-F726 PolarHBondContact O-N 3.07Å; F726-S729 PolarHBondContact O-N 3.46Å; F726-T730 WeakPolarHBondContact O-CB 3.47Å; F726-T730 PolarHBondContact O-N 2.94Å; F726-T730 PolarHBondContact O-OG1 3.47Å
727	I	79.7	Confident	73.3	Confident	87 Å²	87	99.3 Å²	99.3	45%	0.446	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-48.5	177.1	-71.1	164.5	0	0	0	110.7	M723 T724 S729 T730 L731	M723-I727 HydrophobicContact CG-CD1 4.21Å; M723-I727 WeakPolarHBondContact O-CD1 3.44Å; M723-I727 VanDerWaalsContact O-CG1 3.28Å; M723-I727 WeakPolarHBondContact O-CG1 3.35Å; M723-I727 PolarHBondContact O-N 2.85Å; T724-I727 PolarHBondContact O-N 3.2Å; I727-S729 PolarHBondContact O-N 3.45Å; I727-T730 PolarHBondContact O-N 3.44Å; I727-L731 HydrophobicContact CG2-CD1 4.15Å; I727-L731 PolarHBondContact O-N 3.44Å
728	N	77.9	Confident	74.3	Confident	76 Å²	76	100.5 Å²	100.5	41%	0.406	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-41.1	179.7	-68.5	-14.5	0	0	0	112.2	T724 T730 L731 N732	T724-N728 WeakPolarHBondContact O-CB 3.3Å; T724-N728 PolarHBondContact O-N 3.47Å; T724-N728 PolarHBondContact O-ND2 3.29Å; N728-T730 VanDerWaalsContact C-N 3.31Å; N728-T730 PolarHBondContact O-N 3.08Å; N728-L731 PolarHBondContact O-N 3.46Å; N728-N732 WeakPolarHBondContact O-CB 3.42Å; N728-N732 PolarHBondContact O-N 2.91Å; N728-N732 PolarHBondContact O-OD1 2.76Å
729	S	78.8	Confident	74.9	Confident	76 Å²	76	102.5 Å²	102.5	53%	0.531	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-36.4	175.4	-168.6	0	0	0	0	112.2	N725 F726 I727 E733	N725-S729 WeakPolarHBondContact O-CB 3.4Å; N725-S729 PolarHBondContact O-N 2.86Å; F726-S729 PolarHBondContact O-N 3.46Å; I727-S729 PolarHBondContact O-N 3.45Å; S729-E733 PolarHBondContact O-N 3.01Å
730	T	80.3	Confident	75.8	Confident	60 Å²	60	102.3 Å²	102.3	37%	0.368	52%	0.519	S	S	.	.	H	α-helix	trans	-71.6	-41	178.5	-51.2	0	0	0	0	111.3	F726 I727 N728 E733 L734	F726-T730 WeakPolarHBondContact O-CB 3.47Å; F726-T730 PolarHBondContact O-N 2.94Å; F726-T730 PolarHBondContact O-OG1 3.47Å; I727-T730 PolarHBondContact O-N 3.44Å; N728-T730 VanDerWaalsContact C-N 3.31Å; N728-T730 PolarHBondContact O-N 3.08Å; T730-E733 PolarHBondContact O-N 3.18Å; T730-L734 HydrophobicContact CG2-CD1 4.43Å; T730-L734 WeakPolarHBondContact O-CG 3.26Å; T730-L734 PolarHBondContact O-N 3.03Å; T730-L734 VanDerWaalsContact O-N 3.14Å
731	L	82.1	Confident	75.4	Confident	101 Å²	101	107.6 Å²	107.6	53%	0.529	54%	0.537	S	S	.	.	H	α-helix	trans	-60.6	-48.9	173.9	-95.9	163.1	0	0	0	111.9	I727 N728 E733 L734 E735	I727-L731 HydrophobicContact CG2-CD1 4.15Å; I727-L731 PolarHBondContact O-N 3.44Å; N728-L731 PolarHBondContact O-N 3.46Å; L731-E733 VanDerWaalsContact C-N 3.26Å; L731-E733 PolarHBondContact O-N 3.34Å; L731-L734 PolarHBondContact O-N 3.45Å; L731-L734 VanDerWaalsContact O-N 3.12Å; L731-E735 PolarHBondContact O-N 3.04Å
732	N	77.6	Confident	74.9	Confident	106 Å²	106	107.9 Å²	107.9	57%	0.567	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-32.7	179.2	-69.7	-6.7	0	0	0	112.7	N728 R736	N728-N732 WeakPolarHBondContact O-CB 3.42Å; N728-N732 PolarHBondContact O-N 2.91Å; N728-N732 PolarHBondContact O-OD1 2.76Å; N732-R736 WeakPolarHBondContact O-CB 3.45Å; N732-R736 PolarHBondContact O-N 2.87Å
733	E	82.9	Confident	73.7	Confident	108 Å²	108	106.7 Å²	106.7	51%	0.505	55%	0.547	S	S	.	.	H	α-helix	trans	-75.2	-30.3	176.4	-156.3	-166.7	121.9	0	0	112.7	S729 T730 L731 K737	S729-E733 PolarHBondContact O-N 3.01Å; T730-E733 PolarHBondContact O-N 3.18Å; L731-E733 VanDerWaalsContact C-N 3.26Å; L731-E733 PolarHBondContact O-N 3.34Å; E733-K737 WeakPolarHBondContact O-CD 3.4Å; E733-K737 WeakPolarHBondContact O-CG 3.34Å; E733-K737 PolarHBondContact O-N 3.18Å; E733-K737 IonicContact OE1-NZ 3.23Å; E733-K737 PolarHBondContact OE1-NZ 3.38Å
734	L	79.1	Confident	73.1	Confident	104 Å²	104	106.7 Å²	106.7	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-48.5	173.1	-71.5	167.3	0	0	0	111.3	T730 L731 R736 K737 E738	T730-L734 HydrophobicContact CG2-CD1 4.43Å; T730-L734 WeakPolarHBondContact O-CG 3.26Å; T730-L734 PolarHBondContact O-N 3.03Å; T730-L734 VanDerWaalsContact O-N 3.14Å; L731-L734 PolarHBondContact O-N 3.45Å; L731-L734 VanDerWaalsContact O-N 3.12Å; L734-R736 VanDerWaalsContact C-N 3.25Å; L734-R736 PolarHBondContact O-N 2.99Å; L734-K737 WeakPolarHBondContact O-CB 3.24Å; L734-K737 PolarHBondContact O-N 3.03Å; L734-E738 PolarHBondContact O-N 3.22Å
735	E	78.9	Confident	71.5	Confident	104 Å²	104	109.7 Å²	109.7	49%	0.486	57%	0.567	S	S	.	*	H	α-helix	trans	-59.5	-36.9	178.1	-171.9	178.9	179.5	0	0	111.6	L731 K737 E738 Q739	L731-E735 PolarHBondContact O-N 3.04Å; E735-K737 VanDerWaalsContact C-N 3.32Å; E735-K737 PolarHBondContact O-N 3.21Å; E735-E738 PolarHBondContact O-N 3.26Å; E735-Q739 WeakPolarHBondContact O-CG 3.49Å; E735-Q739 PolarHBondContact O-N 3.12Å; E735-Q739 PolarHBondContact OE1-NE2 2.85Å
736	R	79	Confident	70.2	Confident	149 Å²	149	112.3 Å²	112.3	56%	0.562	58%	0.581	S	S	*	*	H	α-helix	trans	-66.7	-30.4	175	-127.4	-162.9	75.4	-146.1	-1.2	113.9	N732 L734 E740	N732-R736 WeakPolarHBondContact O-CB 3.45Å; N732-R736 PolarHBondContact O-N 2.87Å; L734-R736 VanDerWaalsContact C-N 3.25Å; L734-R736 PolarHBondContact O-N 2.99Å; R736-E740 IonicContact CZ-OE1 3.86Å; R736-E740 VanDerWaalsContact CZ-OE1 3.23Å; R736-E740 IonicContact NE-OE1 2.75Å; R736-E740 PolarHBondContact NE-OE1 3.24Å; R736-E740 IonicContact NH2-OE1 3.11Å; R736-E740 PolarHBondContact NH2-OE1 3.3Å; R736-E740 IonicContact NH2-OE2 2.68Å; R736-E740 WeakPolarHBondContact O-CG 3.28Å; R736-E740 PolarHBondContact O-N 3.33Å
737	K	79.3	Confident	68.8	Low	107 Å²	107	113.7 Å²	113.7	47%	0.465	59%	0.59	S	S	.	*	H	α-helix	trans	-75.4	-41.7	176.4	-77.3	165	174.1	161.3	0	111.2	E733 L734 E735 Q739 E740 E741	E733-K737 WeakPolarHBondContact O-CD 3.4Å; E733-K737 WeakPolarHBondContact O-CG 3.34Å; E733-K737 PolarHBondContact O-N 3.18Å; E733-K737 IonicContact OE1-NZ 3.23Å; E733-K737 PolarHBondContact OE1-NZ 3.38Å; L734-K737 WeakPolarHBondContact O-CB 3.24Å; L734-K737 PolarHBondContact O-N 3.03Å; E735-K737 VanDerWaalsContact C-N 3.32Å; E735-K737 PolarHBondContact O-N 3.21Å; K737-Q739 VanDerWaalsContact C-N 3.29Å; K737-Q739 PolarHBondContact O-N 3.22Å; K737-E740 PolarHBondContact O-N 3.44Å; K737-E741 PolarHBondContact O-N 3.27Å; K737-E741 VanDerWaalsContact O-N 3.13Å
738	E	72.3	Confident	67.6	Low	137 Å²	137	113.5 Å²	113.5	64%	0.64	59%	0.593	S	S	*	*	H	α-helix	trans	-61.4	-37.2	174.9	-164.6	166.7	-151.9	0	0	111.5	L734 E735 V742	L734-E738 PolarHBondContact O-N 3.22Å; E735-E738 PolarHBondContact O-N 3.26Å; E738-V742 WeakPolarHBondContact O-CG2 3.42Å
739	Q	68	Low	66.2	Low	131 Å²	131	112.6 Å²	112.6	61%	0.612	60%	0.596	S	S	*	*	H	α-helix	trans	-73.6	-22.9	172.8	-68.6	179.7	24	0	0	114.4	E735 K737	E735-Q739 WeakPolarHBondContact O-CG 3.49Å; E735-Q739 PolarHBondContact O-N 3.12Å; E735-Q739 PolarHBondContact OE1-NE2 2.85Å; K737-Q739 VanDerWaalsContact C-N 3.29Å; K737-Q739 PolarHBondContact O-N 3.22Å
740	E	70	Confident	65.1	Low	113 Å²	113	113.2 Å²	113.2	53%	0.528	60%	0.596	S	S	.	*	H	α-helix	trans	-80.5	-27.2	175.7	-81.9	169.9	-156.3	0	0	112.6	R736 K737	R736-E740 IonicContact CZ-OE1 3.86Å; R736-E740 VanDerWaalsContact CZ-OE1 3.23Å; R736-E740 IonicContact NE-OE1 2.75Å; R736-E740 PolarHBondContact NE-OE1 3.24Å; R736-E740 IonicContact NH2-OE1 3.11Å; R736-E740 PolarHBondContact NH2-OE1 3.3Å; R736-E740 IonicContact NH2-OE2 2.68Å; R736-E740 WeakPolarHBondContact O-CG 3.28Å; R736-E740 PolarHBondContact O-N 3.33Å; K737-E740 PolarHBondContact O-N 3.44Å
741	E	58.6	Low	63.9	Low	174 Å²	174	117.2 Å²	117.2	81%	0.813	61%	0.61	S	S	*	*	H	α-helix	trans	-79.5	-30.8	176.9	-74.3	-169.5	134.5	0	0	114.3	K737 G743	K737-E741 PolarHBondContact O-N 3.27Å; K737-E741 VanDerWaalsContact O-N 3.13Å; E741-G743 PolarHBondContact O-N 2.78Å
742	V	59	Low	62.7	Low	129 Å²	129	120.8 Å²	120.8	78%	0.782	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-1.2	-175.9	177	0	0	0	0	113.5	E738	E738-V742 WeakPolarHBondContact O-CG2 3.42Å
743	G	48.1	Very low	61.8	Low	57 Å²	57	122.3 Å²	122.3	59%	0.588	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	0.7	-166.9	0	0	0	0	0	118.6	E741	E741-G743 PolarHBondContact O-N 2.78Å
744	V	49	Very low	61	Low	119 Å²	119	120.2 Å²	120.2	72%	0.721	62%	0.615	S	S	*	*	S	Bend	trans	-119.8	118.8	-169.6	-174.7	0	0	0	0	112.3
745	N	43.4	Very low	60.4	Low	132 Å²	132	120.9 Å²	120.9	71%	0.706	62%	0.62	S	S	*	*			trans	-70	146.4	-167.6	-48	-77.2	0	0	0	115.1	E747	N745-E747 VanDerWaalsContact C-N 3.31Å; N745-E747 PolarHBondContact O-N 2.89Å; N745-E747 VanDerWaalsContact O-N 3.14Å
746	D	49.7	Very low	59.9	Low	144 Å²	144	121.1 Å²	121.1	77%	0.77	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-60.7	-22.2	-169.9	-61.3	-77.7	0	0	0	117	T748 A749	D746-T748 PolarHBondContact O-N 3.26Å; D746-A749 PolarHBondContact O-N 3.35Å
747	E	51.4	Low	59.6	Low	174 Å²	174	117.4 Å²	117.4	81%	0.813	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-65.5	-13.5	-169.5	-67	-173.1	136.2	0	0	114.8	N745	N745-E747 VanDerWaalsContact C-N 3.31Å; N745-E747 PolarHBondContact O-N 2.89Å; N745-E747 VanDerWaalsContact O-N 3.14Å
748	T	54.7	Low	59.2	Low	83 Å²	83	118 Å²	118	51%	0.509	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-107.7	5.9	-177.5	66.7	0	0	0	0	115	D746 R752	D746-T748 PolarHBondContact O-N 3.26Å; T748-R752 PolarHBondContact O-NE 2.85Å; T748-R752 PolarHBondContact O-NH2 3.05Å
749	A	48.1	Very low	59.2	Low	57 Å²	57	117.4 Å²	117.4	47%	0.471	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-48.1	168.9	0	0	0	0	0	111	D746 E751 R752 E753	D746-A749 PolarHBondContact O-N 3.35Å; A749-E751 PolarHBondContact O-N 2.77Å; A749-R752 PolarHBondContact O-N 2.95Å; A749-E753 PolarHBondContact O-N 3.07Å
750	V	55.6	Low	59.3	Low	89 Å²	89	118.7 Å²	118.7	54%	0.539	62%	0.615	S	S	.	*	H	α-helix	trans	-57.8	-46	-170.6	-175.1	0	0	0	0	113	R752 E753 T754	V750-R752 VanDerWaalsContact C-N 3.31Å; V750-R752 PolarHBondContact O-N 2.9Å; V750-E753 PolarHBondContact O-N 3.45Å; V750-T754 HydrophobicContact CG1-CG2 4.49Å; V750-T754 PolarHBondContact O-N 3.44Å; V750-T754 PolarHBondContact O-OG1 3.03Å
751	E	54.7	Low	59.6	Low	143 Å²	143	117.6 Å²	117.6	67%	0.668	61%	0.612	S	S	*	*	H	α-helix	trans	-61.9	-36.6	-178.8	-69	-170.2	143.6	0	0	112.8	A749 T754 D755	A749-E751 PolarHBondContact O-N 2.77Å; E751-T754 WeakPolarHBondContact CA-OG1 3.36Å; E751-T754 PolarHBondContact O-N 3Å; E751-T754 PolarHBondContact O-OG1 3.43Å; E751-D755 PolarHBondContact O-N 3.47Å
752	R	57.2	Low	60.3	Low	176 Å²	176	114.1 Å²	114.1	66%	0.664	60%	0.599	S	S	*	*	H	α-helix	trans	-72	-34.3	176.6	-85.6	178.9	-72.6	167.3	-2	112.6	T748 A749 V750 E756	T748-R752 PolarHBondContact O-NE 2.85Å; T748-R752 PolarHBondContact O-NH2 3.05Å; A749-R752 PolarHBondContact O-N 2.95Å; V750-R752 VanDerWaalsContact C-N 3.31Å; V750-R752 PolarHBondContact O-N 2.9Å; R752-E756 PolarHBondContact O-N 3.29Å
753	E	58.9	Low	61	Low	139 Å²	139	113.2 Å²	113.2	65%	0.65	59%	0.586	S	S	*	*	H	α-helix	trans	-70.8	-37.2	175.4	-165.5	164.9	-143.7	0	0	111.2	A749 V750 D755 E756 V757	A749-E753 PolarHBondContact O-N 3.07Å; V750-E753 PolarHBondContact O-N 3.45Å; E753-D755 PolarHBondContact O-N 3.34Å; E753-E756 PolarHBondContact O-N 3.29Å; E753-V757 WeakPolarHBondContact O-CB 3.34Å; E753-V757 VanDerWaalsContact O-CG2 3.27Å; E753-V757 WeakPolarHBondContact O-CG2 3.17Å; E753-V757 PolarHBondContact O-N 2.89Å
754	T	66.8	Low	62.1	Low	64 Å²	64	115 Å²	115	39%	0.393	58%	0.579	S	S	.	*	H	α-helix	trans	-65.1	-36.1	174.8	48.1	0	0	0	0	113.6	V750 E751 H758	V750-T754 HydrophobicContact CG1-CG2 4.49Å; V750-T754 PolarHBondContact O-N 3.44Å; V750-T754 PolarHBondContact O-OG1 3.03Å; E751-T754 WeakPolarHBondContact CA-OG1 3.36Å; E751-T754 PolarHBondContact O-N 3Å; E751-T754 PolarHBondContact O-OG1 3.43Å; T754-H758 PolarHBondContact O-N 3.28Å; T754-H758 PolarHBondContact O-ND1 3.28Å
755	D	66	Low	63.2	Low	118 Å²	118	113.5 Å²	113.5	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-70.1	-44.3	176.9	-80.9	-9	0	0	0	111.8	E751 E753 V757 H758 Q759	E751-D755 PolarHBondContact O-N 3.47Å; E753-D755 PolarHBondContact O-N 3.34Å; D755-V757 VanDerWaalsContact C-N 3.32Å; D755-V757 PolarHBondContact O-N 2.97Å; D755-H758 PolarHBondContact O-N 3.48Å; D755-Q759 PolarHBondContact O-N 3.4Å
756	E	67.9	Low	64.7	Low	109 Å²	109	111.9 Å²	111.9	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-61.8	-38.9	174	-87.3	-156.1	-147.7	0	0	112.3	R752 E753 Q759 R760	R752-E756 PolarHBondContact O-N 3.29Å; E753-E756 PolarHBondContact O-N 3.29Å; E756-Q759 PolarHBondContact O-N 3.31Å; E756-R760 VanDerWaalsContact O-CG 3.26Å; E756-R760 WeakPolarHBondContact O-CG 3.49Å; E756-R760 PolarHBondContact O-N 3.44Å; E756-R760 IonicContact OE2-CZ 2.93Å; E756-R760 IonicContact OE2-NE 3.61Å; E756-R760 IonicContact OE2-NH2 2.67Å; E756-R760 PolarHBondContact OE2-NH2 3.49Å
757	V	72.4	Confident	65.8	Low	70 Å²	70	109 Å²	109	42%	0.424	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-43.5	176.3	167.7	0	0	0	0	111.3	E753 D755 Q759 R760 I761	E753-V757 WeakPolarHBondContact O-CB 3.34Å; E753-V757 VanDerWaalsContact O-CG2 3.27Å; E753-V757 WeakPolarHBondContact O-CG2 3.17Å; E753-V757 PolarHBondContact O-N 2.89Å; D755-V757 VanDerWaalsContact C-N 3.32Å; D755-V757 PolarHBondContact O-N 2.97Å; V757-Q759 VanDerWaalsContact C-N 3.35Å; V757-Q759 PolarHBondContact O-N 3.39Å; V757-R760 PolarHBondContact O-N 3.33Å; V757-I761 HydrophobicContact CG1-CD1 3.7Å; V757-I761 HydrophobicContact CG1-CG1 4.4Å; V757-I761 VanDerWaalsContact O-CG1 3.27Å; V757-I761 WeakPolarHBondContact O-CG1 3.23Å; V757-I761 PolarHBondContact O-N 3.38Å
758	H	71.8	Confident	66.4	Low	119 Å²	119	104.2 Å²	104.2	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-63	-39.4	176	-81.9	81.7	0	0	0	112.5	T754 D755 I761 N762	T754-H758 PolarHBondContact O-N 3.28Å; T754-H758 PolarHBondContact O-ND1 3.28Å; D755-H758 PolarHBondContact O-N 3.48Å; H758-I761 PolarHBondContact O-N 3.09Å; H758-N762 PolarHBondContact O-N 2.95Å; H758-N762 VanDerWaalsContact O-N 3.11Å; H758-N762 PolarHBondContact O-ND2 2.97Å
759	Q	72.8	Confident	67	Low	125 Å²	125	107.3 Å²	107.3	58%	0.584	52%	0.522	S	S	*	.	H	α-helix	trans	-65.4	-43.4	177	-172.9	164.2	-11.8	0	0	111.8	D755 E756 V757 I761 N762 E763	D755-Q759 PolarHBondContact O-N 3.4Å; E756-Q759 PolarHBondContact O-N 3.31Å; V757-Q759 VanDerWaalsContact C-N 3.35Å; V757-Q759 PolarHBondContact O-N 3.39Å; Q759-I761 VanDerWaalsContact C-N 3.35Å; Q759-I761 PolarHBondContact O-N 3.5Å; Q759-N762 PolarHBondContact O-N 3.4Å; Q759-E763 PolarHBondContact O-N 2.92Å; Q759-E763 VanDerWaalsContact O-N 3.12Å
760	R	70.3	Confident	67.8	Low	159 Å²	159	109.5 Å²	109.5	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-35	175.8	-66.8	171.8	-165.4	-151.1	11.1	112.8	E756 V757 Q764	E756-R760 VanDerWaalsContact O-CG 3.26Å; E756-R760 WeakPolarHBondContact O-CG 3.49Å; E756-R760 PolarHBondContact O-N 3.44Å; E756-R760 IonicContact OE2-CZ 2.93Å; E756-R760 IonicContact OE2-NE 3.61Å; E756-R760 IonicContact OE2-NH2 2.67Å; E756-R760 PolarHBondContact OE2-NH2 3.49Å; V757-R760 PolarHBondContact O-N 3.33Å; R760-Q764 WeakPolarHBondContact O-CB 3.19Å; R760-Q764 PolarHBondContact O-N 3.04Å
761	I	76.3	Confident	68	Low	89 Å²	89	111.3 Å²	111.3	46%	0.456	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-45.6	175.7	-72.8	167.1	0	0	0	110.8	V757 H758 Q759 Q764 E765	V757-I761 HydrophobicContact CG1-CD1 3.7Å; V757-I761 HydrophobicContact CG1-CG1 4.4Å; V757-I761 VanDerWaalsContact O-CG1 3.27Å; V757-I761 WeakPolarHBondContact O-CG1 3.23Å; V757-I761 PolarHBondContact O-N 3.38Å; H758-I761 PolarHBondContact O-N 3.09Å; Q759-I761 VanDerWaalsContact C-N 3.35Å; Q759-I761 PolarHBondContact O-N 3.5Å; I761-Q764 PolarHBondContact O-N 2.96Å; I761-E765 PolarHBondContact O-N 3.23Å
762	N	73	Confident	68.1	Low	102 Å²	102	110.5 Å²	110.5	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-46.2	177.7	-74.8	-30.2	0	0	0	112.2	H758 Q759 Q764 E765 D766	H758-N762 PolarHBondContact O-N 2.95Å; H758-N762 VanDerWaalsContact O-N 3.11Å; H758-N762 PolarHBondContact O-ND2 2.97Å; Q759-N762 PolarHBondContact O-N 3.4Å; N762-Q764 VanDerWaalsContact C-N 3.27Å; N762-Q764 PolarHBondContact O-N 3.38Å; N762-E765 PolarHBondContact O-N 3.49Å; N762-D766 PolarHBondContact O-N 3.22Å
763	E	74	Confident	67.9	Low	110 Å²	110	109.7 Å²	109.7	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-37.6	176.2	-70.9	177.7	-169	0	0	111.9	Q759 I767	Q759-E763 PolarHBondContact O-N 2.92Å; Q759-E763 VanDerWaalsContact O-N 3.12Å; E763-I767 WeakPolarHBondContact O-CD1 3.22Å; E763-I767 VanDerWaalsContact O-CG1 3.3Å; E763-I767 WeakPolarHBondContact O-CG1 3.3Å; E763-I767 PolarHBondContact O-N 3.15Å; E763-I767 VanDerWaalsContact O-N 3.1Å
764	Q	70.2	Confident	67.6	Low	93 Å²	93	108 Å²	108	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-74	-31.6	177	-172	54.2	87.1	0	0	113	R760 I761 N762 N768	R760-Q764 WeakPolarHBondContact O-CB 3.19Å; R760-Q764 PolarHBondContact O-N 3.04Å; I761-Q764 PolarHBondContact O-N 2.96Å; N762-Q764 VanDerWaalsContact C-N 3.27Å; N762-Q764 PolarHBondContact O-N 3.38Å; Q764-N768 PolarHBondContact NE2-OD1 2.63Å; Q764-N768 WeakPolarHBondContact O-CB 3.44Å; Q764-N768 PolarHBondContact O-N 3.29Å; Q764-N768 PolarHBondContact O-ND2 2.87Å; Q764-N768 VanDerWaalsContact O-ND2 3.17Å
765	E	73.1	Confident	66.6	Low	89 Å²	89	109.8 Å²	109.8	42%	0.416	53%	0.53	S	S	.	.	H	α-helix	trans	-63	-46.5	169.7	-95.9	-145.4	-153.8	0	0	111.7	I761 N762 I767 N768 R769	I761-E765 PolarHBondContact O-N 3.23Å; N762-E765 PolarHBondContact O-N 3.49Å; E765-I767 PolarHBondContact O-N 3.39Å; E765-N768 CarbonylContact O-C 3.57Å; E765-N768 PolarHBondContact O-N 3.46Å; E765-N768 VanDerWaalsContact O-N 3.09Å; E765-R769 VanDerWaalsContact O-CG 3.28Å; E765-R769 WeakPolarHBondContact O-CG 3.25Å; E765-R769 PolarHBondContact O-N 3.33Å; E765-R769 IonicContact OE2-CZ 3.28Å; E765-R769 VanDerWaalsContact OE2-CZ 3.28Å; E765-R769 IonicContact OE2-NE 3.03Å; E765-R769 PolarHBondContact OE2-NE 3.3Å; E765-R769 IonicContact OE2-NH2 2.68Å; E765-R769 PolarHBondContact OE2-NH2 2.69Å
766	D	74.3	Confident	65.6	Low	97 Å²	97	107.6 Å²	107.6	52%	0.519	52%	0.522	S	S	.	.	H	α-helix	trans	-64.1	-41.1	178.4	-83.3	-23.9	0	0	0	112	N762 N768 R769 I770	N762-D766 PolarHBondContact O-N 3.22Å; D766-N768 VanDerWaalsContact C-N 3.27Å; D766-N768 PolarHBondContact O-N 2.87Å; D766-R769 PolarHBondContact O-N 3.44Å; D766-I770 WeakPolarHBondContact O-CB 3.34Å; D766-I770 VanDerWaalsContact O-CG1 3.25Å; D766-I770 WeakPolarHBondContact O-CG1 3.39Å; D766-I770 PolarHBondContact O-N 3.05Å
767	I	73.3	Confident	64.4	Low	83 Å²	83	108.1 Å²	108.1	43%	0.426	53%	0.527	S	S	.	.	H	α-helix	trans	-59.3	-38.5	171.8	-70.5	166.1	0	0	0	111.5	E763 E765 K771	E763-I767 WeakPolarHBondContact O-CD1 3.22Å; E763-I767 VanDerWaalsContact O-CG1 3.3Å; E763-I767 WeakPolarHBondContact O-CG1 3.3Å; E763-I767 PolarHBondContact O-N 3.15Å; E763-I767 VanDerWaalsContact O-N 3.1Å; E765-I767 PolarHBondContact O-N 3.39Å; I767-K771 PolarHBondContact O-N 3.32Å
768	N	64.1	Low	63.1	Low	75 Å²	75	108 Å²	108	40%	0.401	53%	0.529	S	S	.	.	H	α-helix	trans	-73.6	-38.5	178.6	-73.7	-22.5	0	0	0	112.4	Q764 E765 D766 K771 L772	Q764-N768 PolarHBondContact NE2-OD1 2.63Å; Q764-N768 WeakPolarHBondContact O-CB 3.44Å; Q764-N768 PolarHBondContact O-N 3.29Å; Q764-N768 PolarHBondContact O-ND2 2.87Å; Q764-N768 VanDerWaalsContact O-ND2 3.17Å; E765-N768 CarbonylContact O-C 3.57Å; E765-N768 PolarHBondContact O-N 3.46Å; E765-N768 VanDerWaalsContact O-N 3.09Å; D766-N768 VanDerWaalsContact C-N 3.27Å; D766-N768 PolarHBondContact O-N 2.87Å; N768-K771 PolarHBondContact O-N 3.44Å; N768-L772 WeakPolarHBondContact O-CB 3.22Å; N768-L772 WeakPolarHBondContact O-CG 3.37Å; N768-L772 PolarHBondContact O-N 3.12Å
769	R	67.4	Low	61.9	Low	148 Å²	148	106.5 Å²	106.5	56%	0.558	53%	0.529	S	S	*	.	H	α-helix	trans	-60.8	-44.1	172.3	-70.7	163	-176.4	-104.5	1.9	110.9	E765 D766 L772 H773	E765-R769 VanDerWaalsContact O-CG 3.28Å; E765-R769 WeakPolarHBondContact O-CG 3.25Å; E765-R769 PolarHBondContact O-N 3.33Å; E765-R769 IonicContact OE2-CZ 3.28Å; E765-R769 VanDerWaalsContact OE2-CZ 3.28Å; E765-R769 IonicContact OE2-NE 3.03Å; E765-R769 PolarHBondContact OE2-NE 3.3Å; E765-R769 IonicContact OE2-NH2 2.68Å; E765-R769 PolarHBondContact OE2-NH2 2.69Å; D766-R769 PolarHBondContact O-N 3.44Å; R769-L772 PolarHBondContact O-N 3.1Å; R769-H773 PolarHBondContact O-N 2.89Å
770	I	64.8	Low	60.6	Low	102 Å²	102	107.1 Å²	107.1	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-46.1	175.4	-69	166	0	0	0	111.1	D766 L772 H773 I774	D766-I770 WeakPolarHBondContact O-CB 3.34Å; D766-I770 VanDerWaalsContact O-CG1 3.25Å; D766-I770 WeakPolarHBondContact O-CG1 3.39Å; D766-I770 PolarHBondContact O-N 3.05Å; I770-L772 PolarHBondContact O-N 2.89Å; I770-H773 PolarHBondContact O-N 2.9Å; I770-I774 HydrophobicContact CG2-CD1 3.73Å; I770-I774 WeakPolarHBondContact O-CG1 3.43Å; I770-I774 PolarHBondContact O-N 3.36Å; I770-I774 VanDerWaalsContact O-N 3.15Å
771	K	58.6	Low	59.4	Low	127 Å²	127	107.9 Å²	107.9	55%	0.552	54%	0.54	S	S	*	.	H	α-helix	trans	-60.5	-43.8	175.2	-85.8	179.5	173.1	176.1	0	113	I767 N768 H773 I774 N775	I767-K771 PolarHBondContact O-N 3.32Å; N768-K771 PolarHBondContact O-N 3.44Å; K771-H773 VanDerWaalsContact C-N 3.25Å; K771-H773 PolarHBondContact O-N 3.4Å; K771-I774 PolarHBondContact O-N 3.06Å; K771-N775 PolarHBondContact O-N 3.4Å; K771-N775 VanDerWaalsContact O-N 3.07Å
772	L	57.4	Low	57.9	Low	127 Å²	127	109.4 Å²	109.4	67%	0.665	55%	0.548	S	S	*	.	H	α-helix	trans	-63.5	-30.3	177.3	-77.6	167.2	0	0	0	112.6	N768 R769 I770 P776	N768-L772 WeakPolarHBondContact O-CB 3.22Å; N768-L772 WeakPolarHBondContact O-CG 3.37Å; N768-L772 PolarHBondContact O-N 3.12Å; R769-L772 PolarHBondContact O-N 3.1Å; I770-L772 PolarHBondContact O-N 2.89Å; L772-P776 VanDerWaalsContact O-CD 3.31Å; L772-P776 WeakPolarHBondContact O-CD 3.28Å
773	H	51.9	Low	56.8	Low	158 Å²	158	108.9 Å²	108.9	73%	0.731	55%	0.549	S	S	*	.	H	α-helix	trans	-79.7	-21.8	175.3	-112.3	-56.8	0	0	0	114.7	R769 I770 K771	R769-H773 PolarHBondContact O-N 2.89Å; I770-H773 PolarHBondContact O-N 2.9Å; K771-H773 VanDerWaalsContact C-N 3.25Å; K771-H773 PolarHBondContact O-N 3.4Å
774	I	54	Low	55.6	Low	104 Å²	104	108.4 Å²	108.4	53%	0.533	55%	0.55	S	S	.	.	H	α-helix	trans	-89.4	-37.8	-179.4	-68.2	167.8	0	0	0	111.8	I770 K771 P776 L777	I770-I774 HydrophobicContact CG2-CD1 3.73Å; I770-I774 WeakPolarHBondContact O-CG1 3.43Å; I770-I774 PolarHBondContact O-N 3.36Å; I770-I774 VanDerWaalsContact O-N 3.15Å; K771-I774 PolarHBondContact O-N 3.06Å; I774-P776 VanDerWaalsContact C-N 3.33Å; I774-L777 PolarHBondContact O-N 3.19Å; I774-L777 VanDerWaalsContact O-N 3.15Å
775	N	44.5	Very low	54.6	Low	102 Å²	102	110 Å²	110	55%	0.545	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.8	-25.5	-176.7	-77.7	-9	0	0	0	117	K771 S778	K771-N775 PolarHBondContact O-N 3.4Å; K771-N775 VanDerWaalsContact O-N 3.07Å; N775-S778 PolarHBondContact O-OG 3.35Å
776	P	44.7	Very low	53.6	Low	72 Å²	72	111.4 Å²	111.4	47%	0.468	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.3	-27.9	175.3	-21.9	34.7	0	0	0	114.4	L772 I774 T779	L772-P776 VanDerWaalsContact O-CD 3.31Å; L772-P776 WeakPolarHBondContact O-CD 3.28Å; I774-P776 VanDerWaalsContact C-N 3.33Å; P776-T779 PolarHBondContact O-OG1 3.2Å; P776-T779 VanDerWaalsContact O-OG1 3.09Å
777	L	44	Very low	52.8	Low	120 Å²	120	112 Å²	112	63%	0.628	57%	0.569	S	S	*	*	H	α-helix	trans	-78.4	-22.6	-173.5	-84.1	72.8	0	0	0	113.1	I774	I774-L777 PolarHBondContact O-N 3.19Å; I774-L777 VanDerWaalsContact O-N 3.15Å
778	S	45.3	Very low	52.1	Low	66 Å²	66	113 Å²	113	46%	0.462	58%	0.575	S	S	.	*	H	α-helix	trans	-79.3	-19.6	-178.1	46.6	0	0	0	0	113.8	N775	N775-S778 PolarHBondContact O-OG 3.35Å
779	T	45.6	Very low	51.3	Low	88 Å²	88	114.2 Å²	114.2	54%	0.54	58%	0.582	S	S	.	*	H	α-helix	trans	-81.5	-39.9	178.3	42.3	0	0	0	0	113.6	P776 F781 L782 T783	P776-T779 PolarHBondContact O-OG1 3.2Å; P776-T779 VanDerWaalsContact O-OG1 3.09Å; T779-F781 VanDerWaalsContact C-N 3.32Å; T779-F781 PolarHBondContact O-N 3.34Å; T779-L782 PolarHBondContact O-N 2.89Å; T779-T783 PolarHBondContact O-N 3.22Å; T779-T783 PolarHBondContact O-OG1 3.46Å
780	E	45.4	Very low	50.6	Low	139 Å²	139	112.7 Å²	112.7	65%	0.65	58%	0.581	S	S	*	*	H	α-helix	trans	-66.4	-32.7	-178.8	-68.4	-166.5	136.3	0	0	112.7	T783 N784	E780-T783 WeakPolarHBondContact CA-OG1 3.33Å; E780-T783 PolarHBondContact O-OG1 3.16Å; E780-N784 PolarHBondContact O-N 2.99Å; E780-N784 PolarHBondContact O-ND2 3.47Å
781	F	45.6	Very low	50.1	Low	174 Å²	174	111.2 Å²	111.2	76%	0.763	58%	0.577	S	S	*	*	H	α-helix	trans	-64.4	-45.9	175.9	-102	-88.7	0	0	0	112.2	T779 T783 N784 E785	T779-F781 VanDerWaalsContact C-N 3.32Å; T779-F781 PolarHBondContact O-N 3.34Å; F781-T783 PolarHBondContact O-N 2.83Å; F781-N784 PolarHBondContact O-N 3.2Å; F781-E785 PolarHBondContact O-N 3.22Å
782	L	44.5	Very low	49.6	Very low	121 Å²	121	110.3 Å²	110.3	63%	0.634	58%	0.577	S	S	*	*	H	α-helix	trans	-65.7	-35.5	-179.5	-72	169.3	0	0	0	112.7	T779 N784 L786	T779-L782 PolarHBondContact O-N 2.89Å; L782-N784 PolarHBondContact O-N 2.79Å; L782-L786 PolarHBondContact O-N 2.69Å
783	T	49.4	Very low	49.2	Very low	91 Å²	91	107.6 Å²	107.6	56%	0.558	57%	0.569	S	S	*	*	H	α-helix	trans	-67.4	-33.7	177	45.3	0	0	0	0	113.4	T779 E780 F781 L787	T779-T783 PolarHBondContact O-N 3.22Å; T779-T783 PolarHBondContact O-OG1 3.46Å; E780-T783 WeakPolarHBondContact CA-OG1 3.33Å; E780-T783 PolarHBondContact O-OG1 3.16Å; F781-T783 PolarHBondContact O-N 2.83Å; T783-L787 PolarHBondContact O-N 2.69Å
784	N	49.5	Very low	48.9	Very low	100 Å²	100	106.1 Å²	106.1	54%	0.535	57%	0.566	S	S	.	*	H	α-helix	trans	-74.3	-38.6	-179.2	-79.4	-65.5	0	0	0	112.4	E780 F781 L782 L787 L788	E780-N784 PolarHBondContact O-N 2.99Å; E780-N784 PolarHBondContact O-ND2 3.47Å; F781-N784 PolarHBondContact O-N 3.2Å; L782-N784 PolarHBondContact O-N 2.79Å; N784-L787 PolarHBondContact O-N 3.44Å; N784-L788 PolarHBondContact O-N 3.15Å
785	E	49.9	Very low	48.5	Very low	128 Å²	128	107.9 Å²	107.9	60%	0.598	58%	0.576	S	S	*	*	H	α-helix	trans	-68.9	-35.2	179	-167.4	167.6	-136	0	0	112.3	F781 N789	F781-E785 PolarHBondContact O-N 3.22Å; E785-N789 PolarHBondContact O-N 3.24Å; E785-N789 PolarHBondContact O-ND2 2.66Å
786	L	51.8	Low	48.4	Very low	117 Å²	117	107.6 Å²	107.6	61%	0.613	58%	0.582	S	S	*	*	H	α-helix	trans	-66.7	-39.9	175.5	-161.6	73.8	0	0	0	112.2	L782 N789 Q790	L782-L786 PolarHBondContact O-N 2.69Å; L786-N789 PolarHBondContact O-N 2.56Å; L786-Q790 PolarHBondContact O-N 3.15Å
787	L	57.7	Low	48.1	Very low	109 Å²	109	108.6 Å²	108.6	57%	0.571	59%	0.59	S	S	*	*	H	α-helix	trans	-69.9	-37.2	-178.6	-157.9	77.4	0	0	0	112.7	T783 N784 Q790 T791	T783-L787 PolarHBondContact O-N 2.69Å; N784-L787 PolarHBondContact O-N 3.44Å; L787-Q790 PolarHBondContact O-N 3.03Å; L787-T791 PolarHBondContact O-N 3.16Å; L787-T791 VanDerWaalsContact O-N 3.07Å; L787-T791 PolarHBondContact O-OG1 3.21Å
788	L	58.5	Low	47.9	Very low	106 Å²	106	107.6 Å²	107.6	56%	0.555	59%	0.594	S	S	*	*	H	α-helix	trans	-62.8	-42.6	174.5	-107.1	156.6	0	0	0	112.1	N784 T791 L792	N784-L788 PolarHBondContact O-N 3.15Å; L788-T791 WeakPolarHBondContact CA-OG1 3.4Å; L788-T791 PolarHBondContact O-N 3.44Å; L788-T791 PolarHBondContact O-OG1 2.98Å; L788-T791 VanDerWaalsContact O-OG1 3.06Å; L788-L792 WeakPolarHBondContact O-CG 3.49Å; L788-L792 PolarHBondContact O-N 3.39Å; L788-L792 VanDerWaalsContact O-N 3.17Å
789	N	45.8	Very low	47.5	Very low	100 Å²	100	110.6 Å²	110.6	54%	0.535	62%	0.615	S	S	.	*	H	α-helix	trans	-70.1	-33.2	178.7	-75.3	-61.4	0	0	0	112.8	E785 L786 S793	E785-N789 PolarHBondContact O-N 3.24Å; E785-N789 PolarHBondContact O-ND2 2.66Å; L786-N789 PolarHBondContact O-N 2.56Å; N789-S793 PolarHBondContact O-N 3.02Å
790	Q	53.3	Low	47.3	Very low	115 Å²	115	111.6 Å²	111.6	54%	0.537	63%	0.625	S	S	.	*	H	α-helix	trans	-72.1	-30.8	172.9	-71.7	-173.3	2.8	0	0	113.7	L786 L787 S793	L786-Q790 PolarHBondContact O-N 3.15Å; L787-Q790 PolarHBondContact O-N 3.03Å; Q790-S793 PolarHBondContact O-OG 3.27Å; Q790-S793 VanDerWaalsContact O-OG 3.04Å
791	T	53.7	Low	47.1	Very low	72 Å²	72	110.2 Å²	110.2	44%	0.442	63%	0.631	S	S	.	*	H	α-helix	trans	-74.8	-34.7	176.5	35.7	0	0	0	0	112.4	L787 L788 L794 L795	L787-T791 PolarHBondContact O-N 3.16Å; L787-T791 VanDerWaalsContact O-N 3.07Å; L787-T791 PolarHBondContact O-OG1 3.21Å; L788-T791 WeakPolarHBondContact CA-OG1 3.4Å; L788-T791 PolarHBondContact O-N 3.44Å; L788-T791 PolarHBondContact O-OG1 2.98Å; L788-T791 VanDerWaalsContact O-OG1 3.06Å; T791-L794 PolarHBondContact O-N 2.69Å; T791-L795 PolarHBondContact O-N 3.21Å
792	L	49.1	Very low	46.8	Very low	107 Å²	107	106.7 Å²	106.7	56%	0.56	63%	0.628	S	S	*	*	H	α-helix	trans	-68.8	-31.1	177.5	-74.1	167.3	0	0	0	113.9	L788 S796	L788-L792 WeakPolarHBondContact O-CG 3.49Å; L788-L792 PolarHBondContact O-N 3.39Å; L788-L792 VanDerWaalsContact O-N 3.17Å; L792-S796 PolarHBondContact O-OG 3.19Å
793	S	47.9	Very low	46.5	Very low	71 Å²	71	106.3 Å²	106.3	50%	0.497	64%	0.635	S	S	.	*	H	α-helix	trans	-73.7	-24.3	175.8	63.3	0	0	0	0	113.8	N789 Q790 S796	N789-S793 PolarHBondContact O-N 3.02Å; Q790-S793 PolarHBondContact O-OG 3.27Å; Q790-S793 VanDerWaalsContact O-OG 3.04Å; S793-S796 PolarHBondContact O-OG 3.14Å
794	L	47.3	Very low	46.1	Very low	127 Å²	127	108 Å²	108	67%	0.665	65%	0.648	S	S	*	*	H	α-helix	trans	-83.3	-25.8	175.9	-68.3	171.5	0	0	0	113.3	T791 S796 S797	T791-L794 PolarHBondContact O-N 2.69Å; L794-S796 VanDerWaalsContact C-N 3.34Å; L794-S797 PolarHBondContact O-OG 3.16Å
795	L	45.3	Very low	45.7	Very low	140 Å²	140	109.3 Å²	109.3	73%	0.733	66%	0.659	S	S	*	*	H	α-helix	trans	-79.7	-13.5	178.5	-88.1	155.2	0	0	0	114.2	T791	T791-L795 PolarHBondContact O-N 3.21Å
796	S	42.8	Very low	45	Very low	97 Å²	97	110.1 Å²	110.1	68%	0.678	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	5.6	-173.4	31.8	0	0	0	0	114.4	L792 S793 L794	L792-S796 PolarHBondContact O-OG 3.19Å; S793-S796 PolarHBondContact O-OG 3.14Å; L794-S796 VanDerWaalsContact C-N 3.34Å
797	S	37.9	Very low	44.2	Very low	92 Å²	92	112.2 Å²	112.2	64%	0.643	68%	0.679	S	S	*	*	S	Bend	trans	-127.8	14.2	-168	49	0	0	0	0	116.2	L794	L794-S797 PolarHBondContact O-OG 3.16Å
798	S	39.5	Very low	43.2	Very low	100 Å²	100	113.6 Å²	113.6	70%	0.699	69%	0.692	S	S	*	*			trans	-155.7	106	173.8	64.8	0	0	0	0	116.2
799	S	35.9	Very low	42.3	Very low	129 Å²	129	115.7 Å²	115.7	90%	0.902	70%	0.702	S	S	*	*			trans	179.6	121.4	137.1	59.4	0	0	0	0	111.6
800	S	42	Very low	41.7	Very low	109 Å²	109	119 Å²	119	76%	0.762	72%	0.719	S	S	*	*			trans	-112.4	158	165.1	54.3	0	0	0	0	110.6
801	S	40.7	Very low	40.8	Very low	109 Å²	109	118.9 Å²	118.9	76%	0.762	73%	0.731	S	S	*	*	S	Bend	trans	68.3	121.7	169.7	59.6	0	0	0	0	120.4
802	S	40.1	Very low	40	Very low	101 Å²	101	121.5 Å²	121.5	71%	0.706	75%	0.749	S	S	*	*			trans	54.6	88.6	144.2	56.2	0	0	0	0	121.6
803	S	38.6	Very low	39.2	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	77%	0.765	S	S	*	*				42.7	132.2	121.2	60.9	0	0	0	0	121.7
804	P	41.1	Very low	38.6	Very low	126 Å²	126	132.1 Å²	132.1	82%	0.818	78%	0.782	S	S	*	*			trans	-105.8	171.4	-169.7	42.1	-37.6	0	0	0	116
805	T	40.9	Very low	38	Very low	127 Å²	127	132.9 Å²	132.9	78%	0.779	79%	0.786	S	S	*	*			trans	-141.6	139.5	148.5	21.3	0	0	0	0	111.3
806	D	35.5	Very low	37.3	Very low	145 Å²	145	132.1 Å²	132.1	78%	0.775	79%	0.792	S	S	*	*			trans	24	119.5	155	-50.3	-28.6	0	0	0	120.7
807	L	33.8	Very low	37	Very low	162 Å²	162	133.8 Å²	133.8	85%	0.848	79%	0.792	S	S	*	*				-172.5	118.8	100	-98.3	165.1	0	0	0	112.2
808	T	37.6	Very low	36.9	Very low	138 Å²	138	137 Å²	137	85%	0.847	80%	0.799	S	S	*	*			trans	-86.3	108.3	171.3	35.5	0	0	0	0	111.2
809	I	38.7	Very low	36.7	Very low	149 Å²	149	139.4 Å²	139.4	76%	0.764	80%	0.804	S	S	*	*			trans	-158.1	111.4	160.1	-96.2	139.1	0	0	0	109
810	L	34.4	Very low	37.1	Very low	171 Å²	171	137.6 Å²	137.6	90%	0.895	79%	0.789	S	S	*	*			trans	166.6	145.6	138.1	-91.9	162.8	0	0	0	110.6
811	S	34.3	Very low	36.9	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	79%	0.789	S	S	*	*			trans	-99.6	153.1	-173.7	-52.4	0	0	0	0	112.4
812	P	35.8	Very low	36.9	Very low	127 Å²	127	140.3 Å²	140.3	83%	0.825	79%	0.786	S	S	*	*			trans	-74.2	133.7	-179.3	30.2	-35.2	0	0	0	112.5
813	R	34	Very low	36.9	Very low	238 Å²	238	143 Å²	143	90%	0.898	79%	0.789	S	S	*	*			trans	-162.3	159.6	165.5	-133.4	171.5	-179.8	156.7	0.7	109.5
814	L	35.5	Very low	37.1	Very low	163 Å²	163	145.4 Å²	145.4	85%	0.853	79%	0.791	S	S	*	*			trans	74	136.8	-167.9	-47.7	174.3	0	0	0	112.1
815	L	34.3	Very low	37	Very low	144 Å²	144	147.9 Å²	147.9	75%	0.754	79%	0.792	S	S	*	*			cis	-125.3	156	-3.8	-73.4	89.5	0	0	0	111.6	I817	L815-I817 HydrophobicContact CD2-CD1 3.83Å; L815-I817 HydrophobicContact CD2-CG1 4.45Å
816	S	29.9	Very low	37.6	Very low	123 Å²	123	147.3 Å²	147.3	86%	0.86	79%	0.791	S	S	*	*			trans	-136.5	126.1	159	169.1	0	0	0	0	106.9
817	I	36.6	Very low	38.6	Very low	132 Å²	132	146 Å²	146	68%	0.677	79%	0.79	S	S	*	*			trans	-146.2	140.9	-175.1	-75.1	-170.3	0	0	0	109.5	L815	L815-I817 HydrophobicContact CD2-CD1 3.83Å; L815-I817 HydrophobicContact CD2-CG1 4.45Å
818	M	35.3	Very low	38.9	Very low	160 Å²	160	143.7 Å²	143.7	79%	0.788	79%	0.787	S	S	*	*			trans	72.2	77.6	172.9	-58.9	-104.5	63.6	0	0	118.4
819	N	36.3	Very low	39	Very low	150 Å²	150	141.8 Å²	141.8	80%	0.802	78%	0.78	S	S	*	*			trans	-85.6	174.4	130.3	-140.6	11.3	0	0	0	107.5
820	P	44.4	Very low	39	Very low	91 Å²	91	140.5 Å²	140.5	59%	0.591	78%	0.779	S	S	*	*				-167.8	-165.8	78.8	42.7	-18.1	0	0	0	118.5
821	L	38	Very low	39.3	Very low	144 Å²	144	137.8 Å²	137.8	75%	0.754	78%	0.775	S	S	*	*			trans	74.1	140.8	167.1	-87.5	88.8	0	0	0	119
822	D	40	Very low	39.5	Very low	131 Å²	131	137.1 Å²	137.1	70%	0.701	77%	0.77	S	S	*	*			cis	-159.7	-178.7	-18.4	-131.5	-1.1	0	0	0	115.8
823	M	39.4	Very low	39.7	Very low	159 Å²	159	136.5 Å²	136.5	78%	0.783	76%	0.764	S	S	*	*			trans	-59.4	178.9	-172.7	-56.1	163.7	61.8	0	0	116.9
824	I	42.4	Very low	40	Very low	162 Å²	162	130.2 Å²	130.2	83%	0.831	76%	0.756	S	S	*	*			cis	-154.5	162.5	42.3	-64.9	176.2	0	0	0	113.8
825	E	39.9	Very low	40.3	Very low	178 Å²	178	127 Å²	127	83%	0.832	75%	0.747	S	S	*	*			trans	-83.8	160.8	-170.9	178.5	180	-134.2	0	0	118.7
826	P	54.6	Low	40.4	Very low	116 Å²	116	126 Å²	126	75%	0.753	75%	0.747	S	S	*	*			trans	-122.1	163.7	170.9	41.7	-31	0	0	0	116.1
827	P	54.8	Low	40.7	Very low	118 Å²	118	124.3 Å²	124.3	77%	0.766	74%	0.736	S	S	*	*			trans	-130.7	143.1	173.1	39.1	-24.8	0	0	0	118.4
828	S	40.1	Very low	40.8	Very low	112 Å²	112	124.3 Å²	124.3	78%	0.783	74%	0.742	S	S	*	*			trans	20.6	150.9	140.8	43.1	0	0	0	0	123.5
829	S	40	Very low	40.9	Very low	98 Å²	98	121.3 Å²	121.3	69%	0.685	74%	0.737	S	S	*	*			cis	-174.4	159.4	2.5	43.2	0	0	0	0	115.5
830	T	39.7	Very low	41	Very low	123 Å²	123	119 Å²	119	76%	0.755	73%	0.732	S	S	*	*			trans	70.8	133.1	142.7	46.3	0	0	0	0	124.8
831	S	39.2	Very low	40.5	Very low	114 Å²	114	120.2 Å²	120.2	80%	0.797	74%	0.738	S	S	*	*			trans	68.6	144.5	145.8	58.2	0	0	0	0	120.6
832	S	40.1	Very low	40.5	Very low	96 Å²	96	121 Å²	121	67%	0.671	74%	0.742	S	S	*	*			cis	-168.8	-179.1	-15.3	55.5	0	0	0	0	110.7
833	T	39.9	Very low	40.2	Very low	115 Å²	115	119.5 Å²	119.5	71%	0.706	74%	0.742	S	S	*	*			trans	64.1	106.3	155.9	35.4	0	0	0	0	117.6
834	S	40.5	Very low	40	Very low	106 Å²	106	116.3 Å²	116.3	74%	0.741	74%	0.741	S	S	*	*				67.6	136	92.9	72.8	0	0	0	0	115
835	S	40.8	Very low	39.6	Very low	94 Å²	94	113.6 Å²	113.6	66%	0.657	74%	0.736	S	S	*	*			cis	-171.5	175.8	-0.2	51.4	0	0	0	0	109.2
836	T	37.2	Very low	39.2	Very low	124 Å²	124	108.1 Å²	108.1	76%	0.761	72%	0.718	S	S	*	*			trans	50.5	143	148.1	48.2	0	0	0	0	121.2
837	S	36.5	Very low	38.2	Very low	88 Å²	88	106.6 Å²	106.6	62%	0.615	71%	0.706	S	S	*	*			cis	176.8	175.3	-16.1	48.1	0	0	0	0	107.2
838	T	38.5	Very low	37.3	Very low	132 Å²	132	104.5 Å²	104.5	81%	0.81	70%	0.695	S	S	*	*			trans	65	155.5	164.4	63.7	0	0	0	0	118.8
839	S	36	Very low	37.1	Very low	97 Å²	97	101.3 Å²	101.3	68%	0.678	67%	0.672	S	S	*	*			cis	-171.6	-176	-27.2	61	0	0	0	0	109.3
840	S	38.5	Very low	37	Very low	101 Å²	101	101.6 Å²	101.6	71%	0.706	67%	0.665	S	S	*	*			trans	81	150.5	153.5	85.4	0	0	0	0	118.5
841	T	34.4	Very low	36.8	Very low	117 Å²	117	98 Å²	98	72%	0.718	65%	0.645	S	S	*	*			cis	-170.7	172.5	-32.5	34.4	0	0	0	0	108.6
842	L	37.5	Very low	36.7	Very low	160 Å²	160	99.1 Å²	99.1	84%	0.838	64%	0.641	S	S	*	*			trans	78	155.3	161.9	-49.6	177	0	0	0	117.4
843	S	35	Very low	36.7	Very low	99 Å²	99	99.4 Å²	99.4	69%	0.692	64%	0.641	S	S	*	*			cis	-171.8	135.4	-35.9	55.9	0	0	0	0	112.7
844	A	34.7	Very low	36.5	Very low	92 Å²	92	100.7 Å²	100.7	76%	0.76	64%	0.642	S	S	*	*			trans	64.1	135.4	143.6	0	0	0	0	0	124.9
845	S	33.1	Very low	36	Very low	105 Å²	105	101.3 Å²	101.3	73%	0.734	64%	0.641	S	S	*	*			trans	75.9	99.9	133.2	60.4	0	0	0	0	125.1
846	S	32.5	Very low	35.4	Very low	63 Å²	63	103 Å²	103	44%	0.441	65%	0.652	S	S	.	*				74.5	134.7	117.7	64.6	0	0	0	0	126.6	Y96	Y96-S846 VanDerWaalsContact CE1-CB 3.49Å
847	T	34.3	Very low	35.1	Very low	84 Å²	84	105.8 Å²	105.8	52%	0.515	65%	0.653	S	S	.	*			trans	90.7	116.3	146.3	42.3	0	0	0	0	124.7	Y96 N97	Y96-T847 HydrophobicContact CD1-CG2 3.97Å; Y96-T847 HydrophobicContact CE1-CG2 3.75Å; N97-T847 PolarHBondContact ND2-N 3.31Å; N97-T847 WeakPolarHBondContact OD1-CA 3.48Å; N97-T847 PolarHBondContact OD1-N 3.29Å
848	S	34.7	Very low	35	Very low	75 Å²	75	111.9 Å²	111.9	52%	0.524	66%	0.664	S	S	.	*			trans	71.6	143.8	146.4	58.1	0	0	0	0	122	N97 T98	N97-S848 PolarHBondContact ND2-N 3.4Å; N97-S848 PolarHBondContact OD1-N 3.31Å; T98-S848 CarbonylContact O-C 3.08Å; T98-S848 PolarHBondContact OG1-N 3.32Å
849	S	36.9	Very low	34.6	Very low	44 Å²	44	110.6 Å²	110.6	31%	0.308	66%	0.661	S	S	.	*			cis	-170.8	145.8	-12.4	44.1	0	0	0	0	112.9	T99 L100	T99-S849 CarbonylContact C-O 2.96Å; T99-S849 CarbonylContact O-C 3.54Å; T99-S849 VanDerWaalsContact O-O 3.07Å; L100-S849 WeakPolarHBondContact CA-O 3.33Å; L100-S849 WeakPolarHBondContact CB-O 3.06Å; L100-S849 WeakPolarHBondContact CD1-O 3.41Å; L100-S849 WeakPolarHBondContact CG-O 3.33Å; L100-S849 PolarHBondContact N-O 3.17Å; L100-S849 VanDerWaalsContact N-O 3.08Å
850	L	36.2	Very low	34.5	Very low	104 Å²	104	115.3 Å²	115.3	55%	0.545	67%	0.669	S	S	.	*			trans	52.2	139.3	167.9	74.3	-72.3	0	0	0	129.3	T99 L100 N101	T99-L850 CarbonylContact C-O 3.28Å; T99-L850 CarbonylContact O-C 3.57Å; T99-L850 VanDerWaalsContact O-CA 3.27Å; T99-L850 WeakPolarHBondContact O-CA 3.3Å; T99-L850 PolarHBondContact O-N 3.15Å; L100-L850 CarbonylContact C-O 3.59Å; L100-L850 WeakPolarHBondContact CA-O 3.34Å; L100-L850 HydrophobicContact CD1-CD1 3.67Å; L100-L850 HydrophobicContact CD1-CD2 3.75Å; L100-L850 HydrophobicContact CD1-CG 4.28Å; N101-L850 PolarHBondContact N-O 2.92Å
851	S	37	Very low	34.4	Very low	48 Å²	48	116.4 Å²	116.4	34%	0.336	67%	0.672	S	S	.	*			trans	66.8	144.5	170.1	31.6	0	0	0	0	120.4	N101	N101-S851 WeakPolarHBondContact CA-OG 3.27Å; N101-S851 PolarHBondContact N-OG 3.23Å; N101-S851 CarbonylContact O-C 3.1Å; N101-S851 VanDerWaalsContact O-C 3.28Å
852	I	37.1	Very low	34.4	Very low	137 Å²	137	117.8 Å²	117.8	70%	0.703	68%	0.675	S	S	*	*			cis	100.7	137.5	22.1	-67.8	162.5	0	0	0	112.9	N101 N102	N101-I852 CarbonylContact C-O 2.97Å; N102-I852 PolarHBondContact N-O 2.87Å
853	P	39.5	Very low	34.1	Very low	103 Å²	103	119.3 Å²	119.3	67%	0.669	68%	0.677	S	S	*	*			cis	-134.1	-170.1	0.8	26.1	-0.3	0	0	0	116.1
854	I	35.2	Very low	34.3	Very low	142 Å²	142	120.8 Å²	120.8	73%	0.728	68%	0.682	S	S	*	*				153	112	121.6	-77.2	-178.3	0	0	0	116.4
855	T	30.6	Very low	34.3	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.724	68%	0.684	S	S	*	*			trans	32.2	144.6	147.8	71.7	0	0	0	0	125.5
856	C	28.4	Very low	34.5	Very low	130 Å²	130	127 Å²	127	88%	0.878	69%	0.691	S	S	*	*			trans	-114.3	166.3	139.4	-80.1	0	0	0	0	111.2
857	K	31.6	Very low	34.7	Very low	182 Å²	182	130.2 Å²	130.2	79%	0.791	70%	0.703	S	S	*	*			trans	-147.4	166.9	175.5	-92	-165.4	175.6	-173.2	0	111.2
858	Y	33.6	Very low	34.8	Very low	217 Å²	217	134 Å²	134	85%	0.851	72%	0.72	S	S	*	*			trans	77.7	145.8	178.2	-64.4	-89.8	0	0	0	116
859	S	29.6	Very low	35	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	73%	0.733	S	S	*	*			cis	147.5	152	-33.9	-79	0	0	0	0	110.8
860	K	35	Very low	35.2	Very low	196 Å²	196	145.2 Å²	145.2	85%	0.852	76%	0.759	S	S	*	*			trans	97.7	143.6	179.5	-64.2	-174	173	-175.6	0	114.3
861	T	35.8	Very low	35.5	Very low	124 Å²	124	147.5 Å²	147.5	76%	0.761	77%	0.772	S	S	*	*			cis	-147	155.8	-0.3	-4.7	0	0	0	0	112.4
862	N	34.4	Very low	35.9	Very low	146 Å²	146	148 Å²	148	78%	0.781	78%	0.779	S	S	*	*			trans	-56.4	146.6	-173.4	-44.2	9.1	0	0	0	115.7
863	E	31.1	Very low	36	Very low	192 Å²	192	148.6 Å²	148.6	90%	0.897	78%	0.777	S	S	*	*			trans	-93.1	160.7	146.4	-62.3	-179.3	142.1	0	0	109.7
864	T	38.9	Very low	36.2	Very low	129 Å²	129	151.4 Å²	151.4	79%	0.791	78%	0.779	S	S	*	*			trans	-138	117.9	172.2	49.6	0	0	0	0	110.7
865	N	35.6	Very low	36.7	Very low	149 Å²	149	151.3 Å²	151.3	80%	0.797	78%	0.775	S	S	*	*			trans	-61.9	144.3	179.9	-129.7	-15.5	0	0	0	112.2
866	M	36.3	Very low	37.3	Very low	180 Å²	180	154 Å²	154	89%	0.887	77%	0.773	S	S	*	*			trans	-135.4	101.8	163.1	-94.4	-67.6	-165.4	0	0	108	N868	M866-N868 PolarHBondContact O-N 3.26Å
867	N	36.7	Very low	38	Very low	129 Å²	129	152.4 Å²	152.4	69%	0.69	76%	0.756	S	S	*	*			trans	-60.8	131.2	-175.3	-44.6	-11	0	0	0	110.8
868	N	36.7	Very low	38.6	Very low	165 Å²	165	148.6 Å²	148.6	88%	0.882	74%	0.744	S	S	*	*			trans	177.5	68	156.8	-92.4	-21.9	0	0	0	111.1	M866	M866-N868 PolarHBondContact O-N 3.26Å
869	E	38.6	Very low	39	Very low	167 Å²	167	144.4 Å²	144.4	78%	0.78	73%	0.73	S	S	*	*			trans	-149.9	-7	175	-131.4	161.1	-139.3	0	0	117.3	D871 A872	E869-D871 VanDerWaalsContact C-N 3.29Å; E869-D871 PolarHBondContact O-N 3.36Å; E869-A872 HydrophobicContact CG-CB 4.36Å; E869-A872 VanDerWaalsContact O-CB 3.32Å; E869-A872 WeakPolarHBondContact O-CB 3.48Å; E869-A872 PolarHBondContact O-N 2.94Å
870	E	41.9	Very low	39.6	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	72%	0.72	S	S	*	*	H	α-helix	trans	-65.3	-27.1	-178	-64.7	-174.6	126.2	0	0	113.9	A872	E870-A872 VanDerWaalsContact C-N 3.25Å; E870-A872 PolarHBondContact O-N 3.14Å
871	D	42.5	Very low	39.9	Very low	152 Å²	152	142.4 Å²	142.4	81%	0.813	72%	0.716	S	S	*	*	H	α-helix	trans	-67.4	-21	174	-74.5	-42.7	0	0	0	113.6	E869	E869-D871 VanDerWaalsContact C-N 3.29Å; E869-D871 PolarHBondContact O-N 3.36Å
872	A	45.4	Very low	40.1	Very low	59 Å²	59	142.2 Å²	142.2	49%	0.488	71%	0.706	S	S	.	*	H	α-helix	trans	-71.5	-33.7	-173.4	0	0	0	0	0	113	E869 E870 H875 Y876	E869-A872 HydrophobicContact CG-CB 4.36Å; E869-A872 VanDerWaalsContact O-CB 3.32Å; E869-A872 WeakPolarHBondContact O-CB 3.48Å; E869-A872 PolarHBondContact O-N 2.94Å; E870-A872 VanDerWaalsContact C-N 3.25Å; E870-A872 PolarHBondContact O-N 3.14Å; A872-H875 PolarHBondContact O-N 2.91Å; A872-Y876 PolarHBondContact O-N 3.33Å
873	F	39.5	Very low	40.2	Very low	150 Å²	150	141.7 Å²	141.7	66%	0.658	70%	0.703	S	S	*	*	H	α-helix	trans	-72.1	-44.2	-171.6	-163.7	-102.1	0	0	0	112.6	H875 Y876 L877	F873-H875 VanDerWaalsContact C-N 3.29Å; F873-H875 PolarHBondContact O-N 2.92Å; F873-Y876 PolarHBondContact O-N 3.44Å; F873-L877 HydrophobicContact CD1-CD1 4.45Å; F873-L877 HydrophobicContact CE1-CD1 4.02Å; F873-L877 PolarHBondContact O-N 3.49Å
874	F	42.6	Very low	40.6	Very low	161 Å²	161	139.3 Å²	139.3	71%	0.706	70%	0.695	S	S	*	*	H	α-helix	trans	-65.1	-33	174.2	-86.2	-83.5	0	0	0	112.5	Y876 L877 N878	F874-Y876 VanDerWaalsContact C-N 3.26Å; F874-Y876 PolarHBondContact O-N 3.35Å; F874-L877 PolarHBondContact O-N 3.1Å; F874-N878 PolarHBondContact O-N 3.03Å
875	H	46.5	Very low	40.5	Very low	140 Å²	140	139.4 Å²	139.4	65%	0.648	69%	0.691	S	S	*	*	H	α-helix	trans	-70.2	-22.5	178.5	-150.6	-38.5	0	0	0	113.1	A872 F873	A872-H875 PolarHBondContact O-N 2.91Å; F873-H875 VanDerWaalsContact C-N 3.29Å; F873-H875 PolarHBondContact O-N 2.92Å
876	Y	42.9	Very low	40.3	Very low	175 Å²	175	138.9 Å²	138.9	69%	0.686	69%	0.688	S	S	*	*	H	α-helix	trans	-78.4	-42.8	175.2	-159.9	-101.2	0	0	0	112.3	A872 F873 F874 N878 K879	A872-Y876 PolarHBondContact O-N 3.33Å; F873-Y876 PolarHBondContact O-N 3.44Å; F874-Y876 VanDerWaalsContact C-N 3.26Å; F874-Y876 PolarHBondContact O-N 3.35Å; Y876-N878 PolarHBondContact O-N 3.02Å; Y876-K879 WeakPolarHBondContact O-CB 3.39Å; Y876-K879 PolarHBondContact O-N 3.13Å; Y876-K879 VanDerWaalsContact O-N 3.17Å
877	L	42.5	Very low	40.2	Very low	97 Å²	97	135.8 Å²	135.8	51%	0.508	68%	0.684	S	S	.	*	H	α-helix	trans	-70	-29.2	-178.1	-91.7	164.1	0	0	0	114.5	F873 F874 T880	F873-L877 HydrophobicContact CD1-CD1 4.45Å; F873-L877 HydrophobicContact CE1-CD1 4.02Å; F873-L877 PolarHBondContact O-N 3.49Å; F874-L877 PolarHBondContact O-N 3.1Å; L877-T880 PolarHBondContact O-OG1 2.91Å
878	N	44.1	Very low	40.1	Very low	101 Å²	101	136.9 Å²	136.9	54%	0.54	69%	0.688	S	S	.	*	H	α-helix	trans	-73.5	-30.2	170.6	-83.3	-25.1	0	0	0	112.3	F874 Y876 T880 K881 Q882	F874-N878 PolarHBondContact O-N 3.03Å; Y876-N878 PolarHBondContact O-N 3.02Å; N878-T880 VanDerWaalsContact C-N 3.34Å; N878-T880 PolarHBondContact O-N 3.49Å; N878-K881 PolarHBondContact O-N 3.2Å; N878-K881 VanDerWaalsContact O-N 3.07Å; N878-Q882 PolarHBondContact O-N 2.74Å
879	K	42.5	Very low	39.7	Very low	129 Å²	129	134.2 Å²	134.2	56%	0.561	68%	0.682	S	S	*	*	H	α-helix	trans	-68.7	-31.7	-176.1	-156.9	167.9	-172.6	173.9	0	112.9	Y876 K881 N883	Y876-K879 WeakPolarHBondContact O-CB 3.39Å; Y876-K879 PolarHBondContact O-N 3.13Å; Y876-K879 VanDerWaalsContact O-N 3.17Å; K879-K881 VanDerWaalsContact C-N 3.33Å; K879-N883 PolarHBondContact O-N 2.91Å
880	T	41.8	Very low	39.5	Very low	86 Å²	86	134.4 Å²	134.4	53%	0.528	69%	0.685	S	S	.	*	H	α-helix	trans	-76.8	-14.3	172.1	42.7	0	0	0	0	114.2	L877 N878	L877-T880 PolarHBondContact O-OG1 2.91Å; N878-T880 VanDerWaalsContact C-N 3.34Å; N878-T880 PolarHBondContact O-N 3.49Å
881	K	42.3	Very low	39	Very low	174 Å²	174	131.3 Å²	131.3	76%	0.757	68%	0.675	S	S	*	*	H	α-helix	trans	-91.5	-20.1	171.7	-81.9	-170.9	172.7	-177.1	0	114.6	N878 K879	N878-K881 PolarHBondContact O-N 3.2Å; N878-K881 VanDerWaalsContact O-N 3.07Å; K879-K881 VanDerWaalsContact C-N 3.33Å
882	Q	39.3	Very low	38.6	Very low	119 Å²	119	130.7 Å²	130.7	56%	0.556	67%	0.672	S	S	*	*	H	α-helix	trans	-83.9	-29.1	173.3	-69.9	-177.4	-73.6	0	0	113.1	N878 I884 N885	N878-Q882 PolarHBondContact O-N 2.74Å; Q882-I884 PolarHBondContact O-N 3.34Å; Q882-N885 PolarHBondContact O-N 2.99Å; Q882-N885 VanDerWaalsContact O-N 3.13Å
883	N	37.2	Very low	38.1	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	16.5	-176.2	-101	19.5	0	0	0	116.8	K879	K879-N883 PolarHBondContact O-N 2.91Å
884	I	39.5	Very low	38	Very low	142 Å²	142	134.8 Å²	134.8	73%	0.728	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	-15.8	174.4	-67.1	178.1	0	0	0	112.1	Q882	Q882-I884 PolarHBondContact O-N 3.34Å
885	N	37	Very low	37.7	Very low	130 Å²	130	134.3 Å²	134.3	70%	0.695	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-19.8	-175.1	-71.5	-9.8	0	0	0	115	Q882	Q882-N885 PolarHBondContact O-N 2.99Å; Q882-N885 VanDerWaalsContact O-N 3.13Å
886	D	31.4	Very low	37.4	Very low	138 Å²	138	131.6 Å²	131.6	74%	0.738	69%	0.691	S	S	*	*	S	Bend	trans	-106	59	-170.7	-71.9	-46	0	0	0	114.1
887	S	33.1	Very low	37.1	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	69%	0.692	S	S	*	*			trans	-151.8	49.2	167.7	73.8	0	0	0	0	114.7
888	I	34.4	Very low	37	Very low	152 Å²	152	131.3 Å²	131.3	78%	0.779	70%	0.701	S	S	*	*	S	Bend	trans	-121.5	133.2	169	-65	178.9	0	0	0	109.5
889	S	29.4	Very low	36.7	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	71%	0.71	S	S	*	*			trans	58.9	99.1	169.5	-66.2	0	0	0	0	119
890	M	33.8	Very low	36.6	Very low	171 Å²	171	134.4 Å²	134.4	84%	0.842	72%	0.718	S	S	*	*			trans	-143.5	96.2	144.9	-98.5	-61.9	-177.3	0	0	111.9
891	N	31.6	Very low	36.2	Very low	122 Å²	122	138.7 Å²	138.7	65%	0.652	73%	0.732	S	S	*	*			trans	30.3	122.3	140.2	-53	-24.1	0	0	0	120.1
892	N	33.6	Very low	35.9	Very low	138 Å²	138	138.8 Å²	138.8	74%	0.738	74%	0.735	S	S	*	*				175	138.5	92.7	-94.5	-45.1	0	0	0	116.6
893	I	35.4	Very low	35.7	Very low	132 Å²	132	139 Å²	139	68%	0.677	74%	0.74	S	S	*	*			trans	58.9	101.3	137.1	-56.1	163.1	0	0	0	118.3
894	N	37.9	Very low	35.8	Very low	163 Å²	163	138.7 Å²	138.7	87%	0.872	74%	0.737	S	S	*	*				-165.7	139.6	100.6	-94.3	-60.7	0	0	0	111.7
895	D	36.6	Very low	35.7	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	74%	0.737	S	S	*	*			trans	-107.9	-174.7	-178.8	-145.4	23.2	0	0	0	108.1
896	P	39.4	Very low	35.5	Very low	84 Å²	84	138 Å²	138	55%	0.545	74%	0.735	S	S	.	*			cis	-140.6	-165.5	-0.9	39.6	-17.6	0	0	0	116.2
897	N	36.9	Very low	35.6	Very low	135 Å²	135	138.7 Å²	138.7	72%	0.722	74%	0.738	S	S	*	*			trans	82.2	113.9	164	-52.5	-20.2	0	0	0	115.4
898	D	39.5	Very low	35.7	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	74%	0.735	S	S	*	*			cis	-165.5	132.4	44.6	-91.6	-25.5	0	0	0	109.7
899	I	38.2	Very low	35.6	Very low	140 Å²	140	139.8 Å²	139.8	72%	0.718	74%	0.741	S	S	*	*				72.3	113.8	87	-77.3	177.2	0	0	0	112.5
900	Q	40.4	Very low	35.7	Very low	156 Å²	156	142.8 Å²	142.8	73%	0.729	74%	0.743	S	S	*	*			cis	-144.7	156.7	6.8	-48.8	-174.4	-37.3	0	0	110.9
901	Q	32.7	Very low	35.8	Very low	176 Å²	176	141.3 Å²	141.3	82%	0.822	74%	0.737	S	S	*	*				41.1	131.6	101.8	-47.9	175.9	-15.3	0	0	114.7
902	E	37.8	Very low	36	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	74%	0.744	S	S	*	*			cis	-151.2	177.9	37.6	-79.8	-166.6	119.1	0	0	112.1
903	N	35.1	Very low	36.1	Very low	123 Å²	123	145.5 Å²	145.5	66%	0.658	75%	0.753	S	S	*	*			cis	-175.6	148.3	-39.6	-154.4	1	0	0	0	109.2
904	I	37.9	Very low	36.1	Very low	130 Å²	130	146 Å²	146	67%	0.667	76%	0.756	S	S	*	*			trans	75.6	136.4	156.3	-69.7	154.2	0	0	0	121.9
905	N	38	Very low	36	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	75%	0.753	S	S	*	*			trans	77.2	142.7	163.8	-73.2	-23.6	0	0	0	120.8
906	N	32.8	Very low	35.9	Very low	123 Å²	123	147.3 Å²	147.3	66%	0.658	76%	0.757	S	S	*	*			cis	177	133.9	-46.1	-104.5	-34.4	0	0	0	108.2
907	N	32.3	Very low	35.7	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	77%	0.769	S	S	*	*			trans	64.1	154.3	173.6	-49.1	-30.2	0	0	0	114.7
908	T	35.6	Very low	35.6	Very low	120 Å²	120	152 Å²	152	74%	0.736	77%	0.767	S	S	*	*			cis	-136.8	127.5	10.6	-43.4	0	0	0	0	109.7
909	N	31.9	Very low	35.3	Very low	170 Å²	170	158 Å²	158	91%	0.909	78%	0.78	S	S	*	*			trans	-136	56	179.6	-129.5	0.6	0	0	0	110.5
910	Q	32.5	Very low	35.3	Very low	173 Å²	173	157.7 Å²	157.7	81%	0.808	78%	0.778	S	S	*	*			trans	-149.9	105.6	176.4	-70.8	-173.1	-8.2	0	0	109
911	I	35.9	Very low	35.1	Very low	139 Å²	139	157.6 Å²	157.6	71%	0.713	78%	0.783	S	S	*	*	S	Bend	trans	-168.3	-50.1	157.2	-103.7	149.4	0	0	0	110.9	Q913	I911-Q913 VanDerWaalsContact C-N 3.33Å; I911-Q913 PolarHBondContact O-N 3.49Å; I911-Q913 VanDerWaalsContact O-N 3.09Å
912	D	35.1	Very low	35.6	Very low	149 Å²	149	157.5 Å²	157.5	80%	0.797	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	12.9	-165	-60.4	-58.4	0	0	0	117.5
913	Q	36.4	Very low	35.9	Very low	199 Å²	199	158.7 Å²	158.7	93%	0.93	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	5.2	177.5	-86.2	-170.3	-13.1	0	0	115	I911	I911-Q913 VanDerWaalsContact C-N 3.33Å; I911-Q913 PolarHBondContact O-N 3.49Å; I911-Q913 VanDerWaalsContact O-N 3.09Å
914	I	35.7	Very low	36.5	Very low	144 Å²	144	158.7 Å²	158.7	74%	0.738	78%	0.782	S	S	*	*	S	Bend	trans	-106.4	-18.5	-171.6	-65.5	178.5	0	0	0	113.5
915	Q	35.3	Very low	37.2	Very low	174 Å²	174	156.5 Å²	156.5	81%	0.813	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-7.5	-161.6	-135.9	171.9	9.5	0	0	117
916	N	35.4	Very low	38.1	Very low	166 Å²	166	156.4 Å²	156.4	89%	0.888	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	12.3	-172.8	-84	-35.7	0	0	0	115.8
917	Q	34.1	Very low	39.6	Very low	170 Å²	170	155.6 Å²	155.6	79%	0.794	77%	0.766	S	S	*	*	S	Bend	trans	-119.6	14.9	-169.7	-152.4	59.3	70.6	0	0	115.3
918	H	34.7	Very low	41.2	Very low	147 Å²	147	152.4 Å²	152.4	68%	0.681	75%	0.749	S	S	*	*			trans	-121.9	17.3	-163.8	-142.3	-58.5	0	0	0	116.5
919	W	34.9	Very low	42.1	Very low	258 Å²	258	150.1 Å²	150.1	98%	0.977	73%	0.732	S	S	*	*	S	Bend	trans	-106.9	26.6	-177.5	-88.8	60.4	0	0	0	114.4
920	I	36.7	Very low	43.7	Very low	132 Å²	132	145.5 Å²	145.5	68%	0.677	71%	0.708	S	S	*	*	S	Bend	trans	-123.1	150.5	170.7	-57.7	178.3	0	0	0	107.3
921	D	36.2	Very low	45.4	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	70%	0.703	S	S	*	*			trans	77.7	8.3	176.1	-60.8	-28.5	0	0	0	120.3	K923	D921-K923 VanDerWaalsContact C-N 3.3Å; D921-K923 PolarHBondContact O-N 3.41Å
922	H	43.5	Very low	46.7	Very low	173 Å²	173	143.7 Å²	143.7	80%	0.801	70%	0.698	S	S	*	*			trans	-75.7	82	161.5	-96.7	-68.5	0	0	0	112.2	M924	H922-M924 PolarHBondContact O-N 3.08Å
923	K	45	Very low	48.1	Very low	201 Å²	201	141.5 Å²	141.5	87%	0.874	69%	0.686	S	S	*	*			trans	-62.9	96.1	157.6	-88.9	-175.1	171.3	-179.3	0	109.2	D921 N925	D921-K923 VanDerWaalsContact C-N 3.3Å; D921-K923 PolarHBondContact O-N 3.41Å; K923-N925 PolarHBondContact O-N 3.26Å
924	M	47.4	Very low	48.8	Very low	123 Å²	123	135 Å²	135	61%	0.606	67%	0.672	S	S	*	*			trans	-63	126.6	166.5	-170.4	171.1	-179	0	0	108.7	H922 L929 I932	H922-M924 PolarHBondContact O-N 3.08Å; M924-L929 HydrophobicContact CE-CD1 4.02Å; M924-I932 HydrophobicContact CE-CD1 3.69Å
925	N	52.1	Low	50.2	Low	84 Å²	84	133.6 Å²	133.6	45%	0.449	67%	0.666	S	S	.	*			trans	-78	147.7	-177	-170.8	27.8	0	0	0	110.4	K923 D927 D928	K923-N925 PolarHBondContact O-N 3.26Å; N925-D927 VanDerWaalsContact C-N 3.29Å; N925-D927 PolarHBondContact ND2-OD2 3.13Å; N925-D927 PolarHBondContact O-N 3.17Å; N925-D928 WeakPolarHBondContact CB-OD2 3.38Å; N925-D928 PolarHBondContact O-N 2.93Å
926	L	57.2	Low	50.9	Low	133 Å²	133	134.9 Å²	134.9	70%	0.696	68%	0.678	S	S	*	*	H	α-helix	trans	-67.2	-32.8	-179.4	-82.9	162.2	0	0	0	111.9	D928 L929	L926-D928 PolarHBondContact O-N 2.95Å; L926-L929 VanDerWaalsContact O-CB 3.28Å; L926-L929 WeakPolarHBondContact O-CB 3.47Å; L926-L929 PolarHBondContact O-N 2.77Å
927	D	64.1	Low	51.7	Low	107 Å²	107	133.4 Å²	133.4	57%	0.572	67%	0.668	S	S	*	*	H	α-helix	trans	-65.2	-23.7	178.8	-48.6	-49.7	0	0	0	113.3	N925 L929 H931	N925-D927 VanDerWaalsContact C-N 3.29Å; N925-D927 PolarHBondContact ND2-OD2 3.13Å; N925-D927 PolarHBondContact O-N 3.17Å; D927-L929 VanDerWaalsContact C-N 3.34Å; D927-H931 PolarHBondContact O-ND1 2.98Å; D927-H931 VanDerWaalsContact O-ND1 3.14Å
928	D	64.9	Low	52.7	Low	83 Å²	83	131.4 Å²	131.4	44%	0.444	66%	0.661	S	S	.	*	H	α-helix	trans	-75.5	-26.6	175	-60.8	-38.6	0	0	0	111.2	N925 L926 I932	N925-D928 WeakPolarHBondContact CB-OD2 3.38Å; N925-D928 PolarHBondContact O-N 2.93Å; L926-D928 PolarHBondContact O-N 2.95Å; D928-I932 WeakPolarHBondContact O-CD1 3.45Å; D928-I932 VanDerWaalsContact O-CG1 3.32Å; D928-I932 WeakPolarHBondContact O-CG1 3.4Å; D928-I932 PolarHBondContact O-N 3.24Å
929	L	54.7	Low	53.6	Low	73 Å²	73	130.6 Å²	130.6	38%	0.382	66%	0.66	S	S	.	*	H	α-helix	trans	-70.2	-39.9	-177.1	-152.6	80.7	0	0	0	111.7	M924 L926 D927 H931 I932 L933	M924-L929 HydrophobicContact CE-CD1 4.02Å; L926-L929 VanDerWaalsContact O-CB 3.28Å; L926-L929 WeakPolarHBondContact O-CB 3.47Å; L926-L929 PolarHBondContact O-N 2.77Å; D927-L929 VanDerWaalsContact C-N 3.34Å; L929-H931 VanDerWaalsContact C-N 3.33Å; L929-H931 PolarHBondContact O-N 2.93Å; L929-I932 PolarHBondContact O-N 2.7Å; L929-L933 HydrophobicContact CD2-CD1 3.96Å; L929-L933 HydrophobicContact CG-CD1 3.91Å; L929-L933 HydrophobicContact CG-CG 4.44Å; L929-L933 WeakPolarHBondContact O-CB 3.18Å; L929-L933 VanDerWaalsContact O-CG 3.28Å; L929-L933 WeakPolarHBondContact O-CG 3.43Å; L929-L933 PolarHBondContact O-N 3.01Å
930	D	65.7	Low	54.8	Low	73 Å²	73	123.1 Å²	123.1	39%	0.39	64%	0.641	S	S	.	*	H	α-helix	trans	-69.6	-30.3	180	-75	-24.7	0	0	0	112.7	G934 L935	D930-G934 PolarHBondContact O-N 3.42Å; D930-G934 VanDerWaalsContact O-N 3.07Å; D930-L935 PolarHBondContact O-N 3.3Å
931	H	68.6	Low	55.9	Low	153 Å²	153	122.5 Å²	122.5	71%	0.708	64%	0.639	S	S	*	*	H	α-helix	trans	-70.5	-35.6	170.8	-77.4	90	0	0	0	112.4	D927 L929	D927-H931 PolarHBondContact O-ND1 2.98Å; D927-H931 VanDerWaalsContact O-ND1 3.14Å; L929-H931 VanDerWaalsContact C-N 3.33Å; L929-H931 PolarHBondContact O-N 2.93Å
932	I	63	Low	57.2	Low	121 Å²	121	120.3 Å²	120.3	62%	0.621	63%	0.627	S	S	*	*	H	α-helix	trans	-76.2	-31.1	177.1	-69.2	167.3	0	0	0	111.8	M924 D928 L929	M924-I932 HydrophobicContact CE-CD1 3.69Å; D928-I932 WeakPolarHBondContact O-CD1 3.45Å; D928-I932 VanDerWaalsContact O-CG1 3.32Å; D928-I932 WeakPolarHBondContact O-CG1 3.4Å; D928-I932 PolarHBondContact O-N 3.24Å; L929-I932 PolarHBondContact O-N 2.7Å
933	L	64	Low	58.2	Low	103 Å²	103	116.6 Å²	116.6	54%	0.539	61%	0.614	S	S	.	*	H	α-helix	trans	-87.4	-11.6	179	-68.1	173.2	0	0	0	114.1	L929 L935	L929-L933 HydrophobicContact CD2-CD1 3.96Å; L929-L933 HydrophobicContact CG-CD1 3.91Å; L929-L933 HydrophobicContact CG-CG 4.44Å; L929-L933 WeakPolarHBondContact O-CB 3.18Å; L929-L933 VanDerWaalsContact O-CG 3.28Å; L929-L933 WeakPolarHBondContact O-CG 3.43Å; L929-L933 PolarHBondContact O-N 3.01Å; L933-L935 HydrophobicContact CB-CD1 3.81Å; L933-L935 HydrophobicContact CB-CG 3.88Å; L933-L935 HydrophobicContact CD1-CD1 4.12Å
934	G	52.5	Low	59.2	Low	62 Å²	62	110.1 Å²	110.1	64%	0.639	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.4	44	178.7	0	0	0	0	0	113.1	D930	D930-G934 PolarHBondContact O-N 3.42Å; D930-G934 VanDerWaalsContact O-N 3.07Å
935	L	63.5	Low	60.2	Low	115 Å²	115	109 Å²	109	60%	0.602	59%	0.593	S	S	*	*			trans	-104.4	23.7	-172.8	-65.6	176.8	0	0	0	114.6	D930 L933	D930-L935 PolarHBondContact O-N 3.3Å; L933-L935 HydrophobicContact CB-CD1 3.81Å; L933-L935 HydrophobicContact CB-CG 3.88Å; L933-L935 HydrophobicContact CD1-CD1 4.12Å
936	N	51.7	Low	60.9	Low	201 Å²	201	111.3 Å²	111.3	100%	1.075	61%	0.606	S	S	*	*			trans	-124.9	0	168.3	-79.2	-67.1	0	0	0	110.9

Retrieved 936 of 936 residues in 793.5 ms (Link to these results)

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