A0A5K4FEZ8_SCHMA Loading...

Homeobox domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FEZ8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 951 aa.

						>A0A5K4FEZ8_SCHMA|A0A5K4FEZ8
MTTVTTPMELNKQTDICYISNLISPNNMMKINDNNMNTGNESNDDNEMNYDKNIHHKTLKHLKNLNFSSKLLSENENIVNIMKHFIHHSQQSSFSSSSSSSSSSSSTTSTSSPILNNSNDYLRNNDNTDDDNNNKNNLLNTLTSDELEQENEGQKSFLISDLLNTNDTNDECEENSMKSISMKQKIKSEEDQFSDQSIESKPQQLHESKSPNPTIQSINMNPSFIKSKQNSSYSFNQITQLKNSTFNYQIIQSTNNAHTINDYPIKTCKRRLTDKTIQVTHQNKRSREINNWPYSLLSTKLPKDNLKMNIETDELPTRQHQQQQVPYNKRFDFNNIHGKVDSCLLNLCTNSNQSDNHHDDNDHCLYDLDDEDDADVEEQEDDNDDDDENEKSEENDVDDNESDSDNDYNFKKCSKSTTNNNNNSNVNDSNMKPRRARTAFTYEQLVTLENKFKMTRYLSVCERLNLALSLNLTETQVKIWFQNRRTKWKKQNPGKDVNMQNDKSFISKVMISSTSSLSSTVSTVSMPSIFSSIPSVQSLGIHRRRHHHHHHHHLQQTQPEMENFSQLSKLYYETSLANKSIPKEMSTLEFLRTMNYLMNNNNTLTSSTINNKESPDYKLNNDSFKQPISFDLNKYSNLLEYYQQIWSSLNKQNNNLIQNHSTSQLNNERFTNDDIKHSMNSISIPTSEVYLDNLKSIIDNKVLYNKNVFQQANLNNHNHDDPSILTNINESCLDYKSELHNPMKNIFNESMNSLPTYIYPTLFKPISNHESKIPSSTSTSSSLKWDPVEMIPNSIEHNDKNKKLNNEQNETIIWNKNSMTDVAYAMLTNSFEQTNFKQYLNQWTEKNELFNSISNNNNSRILSTEVNSKNIELSKIKQFGNSNNDPDDVDNSHYTSTSPSALQHSTTSSSTSSPHTTTHLYHIEQQSSPDDLMNKLNDNLNNHNPPIQSIN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	32.3	Very low	238 Å²	238	137.5 Å²	137.5	100%	1.172	77%	0.767	S	S	*	*				0	140.7	0	-74.9	173.4	165.8	0	0	107.8
2	T	25	Very low	33.5	Very low	142 Å²	142	135.2 Å²	135.2	87%	0.871	74%	0.742	S	S	*	*			trans	-96.2	101.4	-176.4	45.9	0	0	0	0	110.9
3	T	30.8	Very low	34.3	Very low	130 Å²	130	134 Å²	134	80%	0.798	73%	0.728	S	S	*	*			trans	-94.2	111.1	169.3	46.4	0	0	0	0	109.2	T5	T3-T5 PolarHBondContact O-N 3.1Å
4	V	28.2	Very low	35.5	Very low	132 Å²	132	128.8 Å²	128.8	80%	0.8	70%	0.703	S	S	*	*			trans	-72.5	110.7	177.7	177.3	0	0	0	0	109.3	T6	V4-T6 PolarHBondContact O-N 3.44Å
5	T	33	Very low	36.5	Very low	136 Å²	136	121.1 Å²	121.1	83%	0.834	66%	0.661	S	S	*	*			trans	-75.7	110.3	165.8	7.1	0	0	0	0	109.1	T3	T3-T5 PolarHBondContact O-N 3.1Å
6	T	29.1	Very low	37.5	Very low	117 Å²	117	116.8 Å²	116.8	72%	0.718	64%	0.636	S	S	*	*			trans	-64.4	135.9	168.5	45.7	0	0	0	0	109.9	V4 M8	V4-T6 PolarHBondContact O-N 3.44Å; T6-M8 PolarHBondContact O-N 2.96Å
7	P	31.2	Very low	38.2	Very low	122 Å²	122	113.8 Å²	113.8	79%	0.792	63%	0.625	S	S	*	*			trans	-64.8	126.5	176.7	27.7	-33.8	0	0	0	109.8
8	M	31.8	Very low	39.1	Very low	143 Å²	143	112.7 Å²	112.7	70%	0.704	61%	0.611	S	S	*	*			trans	-88.7	112	177.7	-165.1	165.8	88	0	0	109	T6 L10	T6-M8 PolarHBondContact O-N 2.96Å; M8-L10 VanDerWaalsContact C-N 3.31Å; M8-L10 HydrophobicContact CE-CD1 4.35Å; M8-L10 HydrophobicContact CE-CD2 3.62Å; M8-L10 HydrophobicContact CE-CG 3.88Å; M8-L10 PolarHBondContact O-N 2.64Å
9	E	32.8	Very low	39.9	Very low	200 Å²	200	106.9 Å²	106.9	94%	0.935	58%	0.58	S	S	*	*			trans	-67.5	91.3	170.1	-74.3	-169.5	124.9	0	0	109.4
10	L	37.2	Very low	40.5	Very low	63 Å²	63	104.9 Å²	104.9	33%	0.33	57%	0.574	S	S	.	*			trans	-68.8	140.3	173.5	-81.6	154.2	0	0	0	110.2	M8 T14 D15	M8-L10 VanDerWaalsContact C-N 3.31Å; M8-L10 HydrophobicContact CE-CD1 4.35Å; M8-L10 HydrophobicContact CE-CD2 3.62Å; M8-L10 HydrophobicContact CE-CG 3.88Å; M8-L10 PolarHBondContact O-N 2.64Å; L10-T14 HydrophobicContact CD2-CG2 3.56Å; L10-D15 WeakPolarHBondContact CB-OD1 3.25Å
11	N	45.9	Very low	41.3	Very low	90 Å²	90	104.2 Å²	104.2	48%	0.481	57%	0.57	S	S	.	*			trans	-74.8	146.5	177.9	-175.9	13	0	0	0	109.9	Q13 T14 D15	N11-Q13 PolarHBondContact O-N 2.9Å; N11-T14 WeakPolarHBondContact O-CA 3.45Å; N11-T14 WeakPolarHBondContact O-CB 3.17Å; N11-T14 PolarHBondContact O-N 3.1Å; N11-T14 PolarHBondContact O-OG1 3.38Å; N11-D15 PolarHBondContact O-N 3.16Å
12	K	46.6	Very low	42.6	Very low	109 Å²	109	94.1 Å²	94.1	47%	0.474	52%	0.52	S	S	.	.	H	α-helix	trans	-43.8	-40.4	-176	-71	-158.9	156.3	-152.1	0	114.3	I16 L71 E74	K12-I16 WeakPolarHBondContact O-CD1 3.35Å; K12-I16 WeakPolarHBondContact O-CG1 3.28Å; K12-I16 PolarHBondContact O-N 3.27Å; K12-L71 HydrophobicContact CB-CD2 3.96Å; K12-L71 HydrophobicContact CD-CD2 3.86Å; K12-L71 HydrophobicContact CG-CD1 4.31Å; K12-L71 HydrophobicContact CG-CD2 3.83Å; K12-E74 IonicContact NZ-OE1 3.78Å; K12-E74 IonicContact NZ-OE2 2.81Å; K12-E74 PolarHBondContact NZ-OE2 3.32Å
13	Q	44.3	Very low	43.9	Very low	120 Å²	120	88.4 Å²	88.4	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-73.9	-34.1	-178.4	-160	66.4	29.8	0	0	112.8	N11 I16 C17	N11-Q13 PolarHBondContact O-N 2.9Å; Q13-I16 PolarHBondContact O-N 3.16Å; Q13-C17 PolarHBondContact O-N 2.74Å; Q13-C17 VanDerWaalsContact O-N 3.16Å
14	T	50.6	Low	45	Very low	61 Å²	61	83.1 Å²	83.1	37%	0.374	45%	0.453	S	S	.	.	H	α-helix	trans	-70.1	-41.7	-178.8	-38.7	0	0	0	0	110.8	L10 N11 I16 C17 Y18	L10-T14 HydrophobicContact CD2-CG2 3.56Å; N11-T14 WeakPolarHBondContact O-CA 3.45Å; N11-T14 WeakPolarHBondContact O-CB 3.17Å; N11-T14 PolarHBondContact O-N 3.1Å; N11-T14 PolarHBondContact O-OG1 3.38Å; T14-I16 PolarHBondContact O-N 3.43Å; T14-C17 PolarHBondContact O-N 3.27Å; T14-Y18 WeakPolarHBondContact O-CB 3.49Å; T14-Y18 PolarHBondContact O-N 3.41Å
15	D	51.6	Low	45.9	Very low	14 Å²	14	81 Å²	81	8%	0.075	44%	0.441	C	S	.	.	H	α-helix	trans	-55.5	-50.7	172.2	-71.3	-26.2	0	0	0	111.3	L10 N11 C17 Y18 I19 F67 L71	L10-D15 WeakPolarHBondContact CB-OD1 3.25Å; N11-D15 PolarHBondContact O-N 3.16Å; D15-C17 VanDerWaalsContact C-N 3.35Å; D15-C17 PolarHBondContact O-N 3.37Å; D15-Y18 PolarHBondContact O-N 3.34Å; D15-Y18 VanDerWaalsContact O-N 3.13Å; D15-I19 WeakPolarHBondContact O-CB 3.44Å; D15-I19 WeakPolarHBondContact O-CG1 3.08Å; D15-I19 PolarHBondContact O-N 2.59Å; D15-F67 HydrophobicContact CB-CD1 4.05Å; D15-F67 HydrophobicContact CB-CE1 3.94Å; D15-L71 WeakPolarHBondContact OD2-CD1 3.38Å
16	I	52.1	Low	46.5	Very low	51 Å²	51	78.7 Å²	78.7	26%	0.262	42%	0.424	S	S	.	.	H	α-helix	trans	-58.2	-45.7	-178.9	-70.3	170.5	0	0	0	111.3	K12 Q13 T14 S20	K12-I16 WeakPolarHBondContact O-CD1 3.35Å; K12-I16 WeakPolarHBondContact O-CG1 3.28Å; K12-I16 PolarHBondContact O-N 3.27Å; Q13-I16 PolarHBondContact O-N 3.16Å; T14-I16 PolarHBondContact O-N 3.43Å; I16-S20 VanDerWaalsContact O-CB 3.25Å; I16-S20 WeakPolarHBondContact O-CB 3.44Å; I16-S20 PolarHBondContact O-N 3.24Å
17	C	49.4	Very low	47.4	Very low	66 Å²	66	75.8 Å²	75.8	45%	0.446	40%	0.404	S	S	.	.	H	α-helix	trans	-67.2	-38.2	176.5	-70.7	0	0	0	0	112.6	Q13 T14 D15 N21	Q13-C17 PolarHBondContact O-N 2.74Å; Q13-C17 VanDerWaalsContact O-N 3.16Å; T14-C17 PolarHBondContact O-N 3.27Å; D15-C17 VanDerWaalsContact C-N 3.35Å; D15-C17 PolarHBondContact O-N 3.37Å; C17-N21 WeakPolarHBondContact O-CB 3.47Å; C17-N21 VanDerWaalsContact O-CG 3.28Å; C17-N21 PolarHBondContact O-N 3.13Å; C17-N21 PolarHBondContact O-ND2 3.42Å
18	Y	54.7	Low	48	Very low	94 Å²	94	71.4 Å²	71.4	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-67.9	-46	179	-168.2	-111.2	0	0	0	111.8	T14 D15 N21 L22 H61 L65	T14-Y18 WeakPolarHBondContact O-CB 3.49Å; T14-Y18 PolarHBondContact O-N 3.41Å; D15-Y18 PolarHBondContact O-N 3.34Å; D15-Y18 VanDerWaalsContact O-N 3.13Å; Y18-N21 PolarHBondContact O-N 3.32Å; Y18-L22 HydrophobicContact CD1-CD1 3.69Å; Y18-L22 HydrophobicContact CD1-CG 4.45Å; Y18-L22 HydrophobicContact CE1-CD1 3.46Å; Y18-L22 VanDerWaalsContact CE1-CD1 3.46Å; Y18-L22 HydrophobicContact CE1-CG 4.25Å; Y18-L22 HydrophobicContact CG-CD1 4.45Å; Y18-L22 WeakPolarHBondContact O-CG 3.48Å; Y18-L22 PolarHBondContact O-N 3.37Å; Y18-H61 AromaticContact CE1-NE2 3.49Å; Y18-H61 WeakPolarHBondContact CE1-NE2 3.4Å; Y18-H61 AromaticContact CZ-NE2 3.21Å; Y18-H61 PolarHBondContact OH-NE2 3.46Å; Y18-L65 HydrophobicContact CD1-CD1 4Å; Y18-L65 HydrophobicContact CD1-CD2 4.25Å; Y18-L65 HydrophobicContact CE1-CD1 3.59Å; Y18-L65 HydrophobicContact CE1-CD2 3.69Å; Y18-L65 HydrophobicContact CE1-CG 4.31Å
19	I	53.5	Low	48.6	Very low	4 Å²	4	71.3 Å²	71.3	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-59.8	-48.2	173.8	-63.6	165.4	0	0	0	110.7	D15 N21 L22 I23 L62 F67 L72 I78	D15-I19 WeakPolarHBondContact O-CB 3.44Å; D15-I19 WeakPolarHBondContact O-CG1 3.08Å; D15-I19 PolarHBondContact O-N 2.59Å; I19-N21 VanDerWaalsContact C-N 3.28Å; I19-N21 PolarHBondContact O-N 3.36Å; I19-L22 PolarHBondContact O-N 3.38Å; I19-L22 VanDerWaalsContact O-N 3.16Å; I19-I23 HydrophobicContact CG2-CD1 3.56Å; I19-I23 HydrophobicContact CG2-CG1 4.43Å; I19-I23 WeakPolarHBondContact O-CG1 3.18Å; I19-I23 PolarHBondContact O-N 3.01Å; I19-L62 HydrophobicContact CG2-CD2 4.4Å; I19-F67 HydrophobicContact CD1-CD1 3.9Å; I19-F67 HydrophobicContact CD1-CD2 4.06Å; I19-F67 HydrophobicContact CD1-CE1 3.6Å; I19-F67 HydrophobicContact CD1-CE2 3.75Å; I19-F67 HydrophobicContact CD1-CG 4.12Å; I19-F67 HydrophobicContact CD1-CZ 3.51Å; I19-F67 HydrophobicContact CG1-CD1 4.45Å; I19-F67 HydrophobicContact CG1-CD2 4.41Å; I19-F67 HydrophobicContact CG1-CE1 3.69Å; I19-F67 HydrophobicContact CG1-CE2 3.61Å; I19-F67 HydrophobicContact CG1-CZ 3.17Å; I19-L72 HydrophobicContact CD1-CD2 4.34Å; I19-I78 HydrophobicContact CB-CD1 4.44Å; I19-I78 HydrophobicContact CD1-CD1 3.63Å; I19-I78 HydrophobicContact CG2-CD1 3.83Å; I19-I78 HydrophobicContact CG2-CG1 3.97Å
20	S	52.4	Low	49.3	Very low	65 Å²	65	67.7 Å²	67.7	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-62.5	-35.2	179.9	-168.1	0	0	0	0	112.4	I16 S24	I16-S20 VanDerWaalsContact O-CB 3.25Å; I16-S20 WeakPolarHBondContact O-CB 3.44Å; I16-S20 PolarHBondContact O-N 3.24Å; S20-S24 PolarHBondContact O-N 3.44Å; S20-S24 VanDerWaalsContact O-N 3.16Å; S20-S24 PolarHBondContact O-OG 3.38Å
21	N	56.5	Low	49.5	Very low	92 Å²	92	67.5 Å²	67.5	49%	0.492	35%	0.353	S	S	.	.	H	α-helix	trans	-70.9	-40.8	173.5	-78.2	-27.1	0	0	0	112.2	C17 Y18 I19 I23 S24 N27	C17-N21 WeakPolarHBondContact O-CB 3.47Å; C17-N21 VanDerWaalsContact O-CG 3.28Å; C17-N21 PolarHBondContact O-N 3.13Å; C17-N21 PolarHBondContact O-ND2 3.42Å; Y18-N21 PolarHBondContact O-N 3.32Å; I19-N21 VanDerWaalsContact C-N 3.28Å; I19-N21 PolarHBondContact O-N 3.36Å; N21-I23 VanDerWaalsContact C-N 3.35Å; N21-I23 PolarHBondContact O-N 3.4Å; N21-S24 PolarHBondContact O-N 2.95Å; N21-N27 WeakPolarHBondContact O-CB 3.28Å; N21-N27 PolarHBondContact O-ND2 2.72Å
22	L	56.9	Low	49.1	Very low	25 Å²	25	64.9 Å²	64.9	13%	0.131	34%	0.339	C	S	.	.	H	α-helix	trans	-65.2	-36	179.3	-76.9	170.8	0	0	0	113.3	Y18 I19 H61 L65	Y18-L22 HydrophobicContact CD1-CD1 3.69Å; Y18-L22 HydrophobicContact CD1-CG 4.45Å; Y18-L22 HydrophobicContact CE1-CD1 3.46Å; Y18-L22 VanDerWaalsContact CE1-CD1 3.46Å; Y18-L22 HydrophobicContact CE1-CG 4.25Å; Y18-L22 HydrophobicContact CG-CD1 4.45Å; Y18-L22 WeakPolarHBondContact O-CG 3.48Å; Y18-L22 PolarHBondContact O-N 3.37Å; I19-L22 PolarHBondContact O-N 3.38Å; I19-L22 VanDerWaalsContact O-N 3.16Å; L22-H61 VanDerWaalsContact CD2-CD2 3.49Å; L22-H61 WeakPolarHBondContact CD2-CD2 3.48Å; L22-L65 HydrophobicContact CD1-CD1 3.63Å
23	I	53.6	Low	48.7	Very low	22 Å²	22	65 Å²	65	11%	0.113	34%	0.344	C	S	.	.	S	Bend	trans	-98.4	2.6	-176.4	-45.7	167.3	0	0	0	111.8	I19 N21 M28 T58 L62 I81	I19-I23 HydrophobicContact CG2-CD1 3.56Å; I19-I23 HydrophobicContact CG2-CG1 4.43Å; I19-I23 WeakPolarHBondContact O-CG1 3.18Å; I19-I23 PolarHBondContact O-N 3.01Å; N21-I23 VanDerWaalsContact C-N 3.35Å; N21-I23 PolarHBondContact O-N 3.4Å; I23-M28 HydrophobicContact CG2-SD 4.11Å; I23-T58 HydrophobicContact CG1-CG2 4.1Å; I23-L62 HydrophobicContact CD1-CD1 3.86Å; I23-L62 HydrophobicContact CD1-CD2 4.24Å; I23-L62 HydrophobicContact CG1-CD1 4.32Å; I23-I81 HydrophobicContact CB-CD1 4.01Å; I23-I81 HydrophobicContact CD1-CD1 3.91Å; I23-I81 HydrophobicContact CD1-CG2 4.25Å; I23-I81 HydrophobicContact CG2-CD1 3.61Å; I23-I81 HydrophobicContact CG2-CG1 4.03Å; I23-I81 HydrophobicContact CG2-CG2 3.93Å
24	S	53.7	Low	48.6	Very low	20 Å²	20	65.4 Å²	65.4	14%	0.14	35%	0.35	C	S	.	.	S	Bend	trans	-62.3	132.4	169	-75.8	0	0	0	0	110.3	S20 N21 N26 N27 M28	S20-S24 PolarHBondContact O-N 3.44Å; S20-S24 VanDerWaalsContact O-N 3.16Å; S20-S24 PolarHBondContact O-OG 3.38Å; N21-S24 PolarHBondContact O-N 2.95Å; S24-N26 PolarHBondContact O-N 3.04Å; S24-N26 VanDerWaalsContact O-N 3.09Å; S24-N27 PolarHBondContact O-N 3.21Å; S24-M28 PolarHBondContact O-N 3.25Å; S24-M28 VanDerWaalsContact O-N 3.1Å
25	P	46.3	Very low	47.9	Very low	86 Å²	86	68.4 Å²	68.4	56%	0.558	36%	0.364	S	S	*	.	H	α-helix	trans	-52.5	-39.2	-176.3	-29.9	35.4	0	0	0	113.9	N27 M28 M29	P25-N27 PolarHBondContact O-N 3.27Å; P25-M28 PolarHBondContact O-N 2.77Å; P25-M29 PolarHBondContact O-N 3.18Å; P25-M29 VanDerWaalsContact O-N 3.12Å
26	N	47.1	Very low	47	Very low	89 Å²	89	75 Å²	75	48%	0.476	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-24.1	178.2	-64.8	-6.3	0	0	0	113.8	S24 K30	S24-N26 PolarHBondContact O-N 3.04Å; S24-N26 VanDerWaalsContact O-N 3.09Å; N26-K30 WeakPolarHBondContact O-CD 3.4Å; N26-K30 VanDerWaalsContact O-CG 3.25Å; N26-K30 WeakPolarHBondContact O-CG 3.44Å
27	N	46.7	Very low	46	Very low	56 Å²	56	80 Å²	80	30%	0.299	42%	0.424	S	S	.	.	H	α-helix	trans	-95.6	-30.9	175.7	-77.9	-14.6	0	0	0	112.2	N21 S24 P25 M29 K30 I31	N21-N27 WeakPolarHBondContact O-CB 3.28Å; N21-N27 PolarHBondContact O-ND2 2.72Å; S24-N27 PolarHBondContact O-N 3.21Å; P25-N27 PolarHBondContact O-N 3.27Å; N27-M29 PolarHBondContact O-N 2.65Å; N27-K30 PolarHBondContact O-N 3.06Å; N27-K30 VanDerWaalsContact O-N 3.13Å; N27-I31 WeakPolarHBondContact O-CG1 3.32Å; N27-I31 PolarHBondContact O-N 3.26Å
28	M	43.4	Very low	45.3	Very low	30 Å²	30	82.7 Å²	82.7	15%	0.148	44%	0.439	C	S	.	.	H	α-helix	trans	-58.4	-36.6	170.3	-66.9	-176	64.7	0	0	111.8	I23 S24 P25 I54	I23-M28 HydrophobicContact CG2-SD 4.11Å; S24-M28 PolarHBondContact O-N 3.25Å; S24-M28 VanDerWaalsContact O-N 3.1Å; P25-M28 PolarHBondContact O-N 2.77Å; M28-I54 HydrophobicContact CB-CG2 3.93Å; M28-I54 HydrophobicContact CE-CG2 3.9Å; M28-I54 WeakPolarHBondContact O-CG2 3.23Å
29	M	44.7	Very low	44.1	Very low	141 Å²	141	82 Å²	82	70%	0.695	46%	0.46	S	S	*	.	H	α-helix	trans	-67.7	-49.2	168.8	-75.3	-177.7	161.8	0	0	112.9	P25 N27 I31 N32	P25-M29 PolarHBondContact O-N 3.18Å; P25-M29 VanDerWaalsContact O-N 3.12Å; N27-M29 PolarHBondContact O-N 2.65Å; M29-I31 PolarHBondContact O-N 2.93Å; M29-I31 VanDerWaalsContact O-N 3.11Å; M29-N32 PolarHBondContact O-N 3.14Å
30	K	47.3	Very low	42.9	Very low	123 Å²	123	89.6 Å²	89.6	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-18.1	-176.4	-73.1	172.5	-176.3	179.8	0	115.1	N26 N27 N32 D33	N26-K30 WeakPolarHBondContact O-CD 3.4Å; N26-K30 VanDerWaalsContact O-CG 3.25Å; N26-K30 WeakPolarHBondContact O-CG 3.44Å; N27-K30 PolarHBondContact O-N 3.06Å; N27-K30 VanDerWaalsContact O-N 3.13Å; K30-N32 PolarHBondContact O-N 3.35Å; K30-D33 PolarHBondContact O-N 2.9Å
31	I	42.9	Very low	41.9	Very low	59 Å²	59	95.7 Å²	95.7	30%	0.303	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.2	172.9	-74.7	165.2	0	0	0	112.3	N27 M29 K57	N27-I31 WeakPolarHBondContact O-CG1 3.32Å; N27-I31 PolarHBondContact O-N 3.26Å; M29-I31 PolarHBondContact O-N 2.93Å; M29-I31 VanDerWaalsContact O-N 3.11Å; I31-K57 HydrophobicContact CG2-CB 3.98Å; I31-K57 HydrophobicContact CG2-CD 3.62Å; I31-K57 HydrophobicContact CG2-CG 4.43Å
32	N	36.4	Very low	40.7	Very low	36 Å²	36	96.1 Å²	96.1	19%	0.193	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-38.3	175.4	-109.6	8.2	0	0	0	114.5	M29 K30 N34 K57	M29-N32 PolarHBondContact O-N 3.14Å; K30-N32 PolarHBondContact O-N 3.35Å; N32-N34 VanDerWaalsContact C-N 3.27Å; N32-N34 PolarHBondContact O-N 2.66Å; N32-K57 PolarHBondContact OD1-NZ 2.97Å
33	D	39.3	Very low	39.5	Very low	110 Å²	110	102.2 Å²	102.2	59%	0.588	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-68.6	-22.4	-168.6	-62.6	-21.7	0	0	0	114.3	K30 N35	K30-D33 PolarHBondContact O-N 2.9Å; D33-N35 PolarHBondContact O-N 3.24Å
34	N	40.6	Very low	38.5	Very low	129 Å²	129	107.8 Å²	107.8	69%	0.69	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-90.7	13.9	-170.2	-71.1	-25.3	0	0	0	114.6	N32	N32-N34 VanDerWaalsContact C-N 3.27Å; N32-N34 PolarHBondContact O-N 2.66Å
35	N	35.9	Very low	37.6	Very low	125 Å²	125	114.6 Å²	114.6	67%	0.668	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-145.3	14.4	-179.5	-139.1	14.6	0	0	0	116.3	D33 N37	D33-N35 PolarHBondContact O-N 3.24Å; N35-N37 PolarHBondContact O-N 3.35Å; N35-N37 VanDerWaalsContact O-N 3.08Å
36	M	34	Very low	37	Very low	153 Å²	153	115 Å²	115	75%	0.754	63%	0.627	S	S	*	*			trans	-83.4	44.4	177.8	-77.3	-66	-165.7	0	0	113.3
37	N	30.1	Very low	36.5	Very low	154 Å²	154	119.5 Å²	119.5	82%	0.824	65%	0.645	S	S	*	*			trans	-129.5	36	-178.8	-155.7	9.4	0	0	0	113.3	N35	N35-N37 PolarHBondContact O-N 3.35Å; N35-N37 VanDerWaalsContact O-N 3.08Å
38	T	34.4	Very low	36.1	Very low	124 Å²	124	125.4 Å²	125.4	76%	0.761	67%	0.673	S	S	*	*	S	Bend	trans	-147.3	127	171	53.8	0	0	0	0	111.6
39	G	30.1	Very low	36	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	69%	0.686	S	S	*	*			trans	88.1	115.6	159.2	0	0	0	0	0	116
40	N	28	Very low	35.6	Very low	163 Å²	163	127.3 Å²	127.3	87%	0.872	68%	0.678	S	S	*	*			trans	-72.1	141.1	155.5	-45.9	-64	0	0	0	108.3
41	E	32.3	Very low	35.2	Very low	194 Å²	194	126.4 Å²	126.4	91%	0.907	68%	0.679	S	S	*	*				-166.7	151.8	124.2	-108.8	163.7	-155.3	0	0	110.6
42	S	30.6	Very low	35.4	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	69%	0.692	S	S	*	*			trans	-82.6	138.4	-179.6	52.3	0	0	0	0	111.4
43	N	33	Very low	36	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	71%	0.705	S	S	*	*				-177.8	158.3	125.3	-85.5	-25.9	0	0	0	110.4
44	D	31.8	Very low	36.6	Very low	139 Å²	139	128.3 Å²	128.3	74%	0.743	68%	0.683	S	S	*	*			trans	-76.8	-160.6	178.1	-58.1	-80.5	0	0	0	112.7
45	D	34.4	Very low	37.2	Very low	162 Å²	162	124.7 Å²	124.7	87%	0.866	66%	0.662	S	S	*	*			trans	68.6	37.4	168.6	-55.9	-25.3	0	0	0	118.6
46	N	35	Very low	38.2	Very low	95 Å²	95	124.5 Å²	124.5	51%	0.508	66%	0.657	S	S	.	*			trans	-135.2	20.1	178.4	-96.1	-84.2	0	0	0	118	M48 N49	N46-M48 VanDerWaalsContact C-N 3.25Å; N46-M48 PolarHBondContact O-N 3.12Å; N46-N49 HydrophobicContact CB-CB 4.4Å; N46-N49 WeakPolarHBondContact O-CB 3.36Å; N46-N49 PolarHBondContact O-N 3.29Å; N46-N49 WeakPolarHBondContact OD1-CB 3.29Å; N46-N49 PolarHBondContact OD1-ND2 3.44Å
47	E	36.4	Very low	39.4	Very low	184 Å²	184	120.3 Å²	120.3	86%	0.86	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-60.2	-31.4	-178.3	-158.6	166.3	-145.1	0	0	113.4	N49	E47-N49 PolarHBondContact O-N 2.89Å
48	M	38.3	Very low	40.7	Very low	180 Å²	180	113.4 Å²	113.4	89%	0.887	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-76.5	6.1	174.9	-77.9	-105.9	-76.2	0	0	115.4	N46	N46-M48 VanDerWaalsContact C-N 3.25Å; N46-M48 PolarHBondContact O-N 3.12Å
49	N	39.6	Very low	41.8	Very low	78 Å²	78	109.8 Å²	109.8	42%	0.417	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-110.8	-7.9	-175.9	-147.2	0.9	0	0	0	113.7	N46 E47	N46-N49 HydrophobicContact CB-CB 4.4Å; N46-N49 WeakPolarHBondContact O-CB 3.36Å; N46-N49 PolarHBondContact O-N 3.29Å; N46-N49 WeakPolarHBondContact OD1-CB 3.29Å; N46-N49 PolarHBondContact OD1-ND2 3.44Å; E47-N49 PolarHBondContact O-N 2.89Å
50	Y	36.3	Very low	43.3	Very low	133 Å²	133	111.6 Å²	111.6	52%	0.522	56%	0.559	S	S	.	*	H	α-helix	trans	-65.3	-48.8	-176.1	-91.3	-94.3	0	0	0	113.4	K52 N53 I54	Y50-K52 VanDerWaalsContact C-N 3.34Å; Y50-K52 PolarHBondContact O-N 2.91Å; Y50-N53 PolarHBondContact O-N 2.83Å; Y50-I54 PolarHBondContact O-N 3.08Å
51	D	40.5	Very low	44.6	Very low	103 Å²	103	108.1 Å²	108.1	55%	0.551	54%	0.537	S	S	*	.	H	α-helix	trans	-61.1	-41.7	-179.2	-68.2	-33.9	0	0	0	112.4	N53 I54 H55	D51-N53 PolarHBondContact O-N 2.94Å; D51-I54 PolarHBondContact O-N 2.83Å; D51-H55 PolarHBondContact O-CD2 2.89Å; D51-H55 PolarHBondContact O-N 2.71Å
52	K	46.7	Very low	45.8	Very low	132 Å²	132	99.9 Å²	99.9	57%	0.574	50%	0.499	S	S	*	.	H	α-helix	trans	-57.2	-40.1	-179.1	-65	-178.3	-179	177.8	0	111.7	Y50 H56	Y50-K52 VanDerWaalsContact C-N 3.34Å; Y50-K52 PolarHBondContact O-N 2.91Å; K52-H56 WeakPolarHBondContact O-CB 3.02Å; K52-H56 PolarHBondContact O-N 2.83Å
53	N	48.7	Very low	47.1	Very low	88 Å²	88	99.4 Å²	99.4	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-71.2	-41.3	-179.3	-159.2	-28.9	0	0	0	111.6	Y50 D51 H56 K57	Y50-N53 PolarHBondContact O-N 2.83Å; D51-N53 PolarHBondContact O-N 2.94Å; N53-H56 PolarHBondContact O-N 3.5Å; N53-K57 WeakPolarHBondContact O-CG 3.39Å; N53-K57 PolarHBondContact O-N 3.01Å; N53-K57 VanDerWaalsContact OD1-CE 3.25Å; N53-K57 WeakPolarHBondContact OD1-CE 3.47Å
54	I	52	Low	48.2	Very low	25 Å²	25	97.7 Å²	97.7	13%	0.128	48%	0.475	C	S	.	.	H	α-helix	trans	-60.1	-51.3	174.8	-65.1	170.4	0	0	0	110.3	M28 Y50 D51 H56 K57 T58	M28-I54 HydrophobicContact CB-CG2 3.93Å; M28-I54 HydrophobicContact CE-CG2 3.9Å; M28-I54 WeakPolarHBondContact O-CG2 3.23Å; Y50-I54 PolarHBondContact O-N 3.08Å; D51-I54 PolarHBondContact O-N 2.83Å; I54-H56 PolarHBondContact O-N 2.8Å; I54-K57 PolarHBondContact O-N 3.18Å; I54-T58 PolarHBondContact O-N 3.29Å; I54-T58 VanDerWaalsContact O-N 3.08Å; I54-T58 PolarHBondContact O-OG1 3.22Å
55	H	53.4	Low	49.3	Very low	54 Å²	54	92.7 Å²	92.7	25%	0.25	45%	0.448	C	S	.	.	H	α-helix	trans	-62.4	-39.7	179.7	-68.6	-60.5	0	0	0	112.9	D51 T58 L59 F85	D51-H55 PolarHBondContact O-CD2 2.89Å; D51-H55 PolarHBondContact O-N 2.71Å; H55-T58 PolarHBondContact O-N 3.27Å; H55-L59 WeakPolarHBondContact O-CB 3.4Å; H55-L59 PolarHBondContact O-N 2.86Å; H55-F85 HydrophobicContact CB-CE2 4.31Å
56	H	57.7	Low	50.1	Low	121 Å²	121	93 Å²	93	56%	0.56	45%	0.45	S	S	*	.	H	α-helix	trans	-64.7	-40.9	176.7	-174.9	82	0	0	0	112.4	K52 N53 I54 L59 K60	K52-H56 WeakPolarHBondContact O-CB 3.02Å; K52-H56 PolarHBondContact O-N 2.83Å; N53-H56 PolarHBondContact O-N 3.5Å; I54-H56 PolarHBondContact O-N 2.8Å; H56-L59 PolarHBondContact O-N 3.14Å; H56-K60 WeakPolarHBondContact O-CB 3.49Å; H56-K60 PolarHBondContact O-N 2.9Å
57	K	58.9	Low	51	Low	65 Å²	65	89.4 Å²	89.4	28%	0.283	43%	0.43	S	S	.	.	H	α-helix	trans	-61.1	-47.2	174.1	-71.5	174.6	-174.3	176.1	0	111.6	I31 N32 N53 I54 K60 H61	I31-K57 HydrophobicContact CG2-CB 3.98Å; I31-K57 HydrophobicContact CG2-CD 3.62Å; I31-K57 HydrophobicContact CG2-CG 4.43Å; N32-K57 PolarHBondContact OD1-NZ 2.97Å; N53-K57 WeakPolarHBondContact O-CG 3.39Å; N53-K57 PolarHBondContact O-N 3.01Å; N53-K57 VanDerWaalsContact OD1-CE 3.25Å; N53-K57 WeakPolarHBondContact OD1-CE 3.47Å; I54-K57 PolarHBondContact O-N 3.18Å; K57-K60 PolarHBondContact O-N 3.47Å; K57-H61 PolarHBondContact O-N 3.34Å
58	T	56.8	Low	51.7	Low	9 Å²	9	83.5 Å²	83.5	6%	0.055	41%	0.409	C	S	.	.	H	α-helix	trans	-62.4	-43.9	178.1	-55.4	0	0	0	0	111.5	I23 I54 H55 H61 L62	I23-T58 HydrophobicContact CG1-CG2 4.1Å; I54-T58 PolarHBondContact O-N 3.29Å; I54-T58 VanDerWaalsContact O-N 3.08Å; I54-T58 PolarHBondContact O-OG1 3.22Å; H55-T58 PolarHBondContact O-N 3.27Å; T58-H61 PolarHBondContact O-N 2.89Å; T58-L62 HydrophobicContact CG2-CD1 4.18Å; T58-L62 WeakPolarHBondContact O-CG 3.37Å; T58-L62 PolarHBondContact O-N 2.89Å
59	L	57.4	Low	52.4	Low	47 Å²	47	77 Å²	77	25%	0.246	38%	0.381	C	S	.	.	H	α-helix	trans	-62.5	-43.3	175.4	-87.2	166	0	0	0	112.6	H55 H56 H61 L62 K63 F85 L163	H55-L59 WeakPolarHBondContact O-CB 3.4Å; H55-L59 PolarHBondContact O-N 2.86Å; H56-L59 PolarHBondContact O-N 3.14Å; L59-H61 VanDerWaalsContact C-N 3.28Å; L59-H61 PolarHBondContact O-N 3.37Å; L59-L62 PolarHBondContact O-N 3.17Å; L59-K63 WeakPolarHBondContact O-CG 3.36Å; L59-K63 PolarHBondContact O-N 2.98Å; L59-F85 HydrophobicContact CD1-CD2 4.16Å; L59-F85 HydrophobicContact CD1-CE1 3.9Å; L59-F85 HydrophobicContact CD1-CE2 3.51Å; L59-F85 HydrophobicContact CD1-CZ 3.37Å; L59-L163 HydrophobicContact CD2-CD2 4.44Å
60	K	62.5	Low	53.1	Low	118 Å²	118	78.1 Å²	78.1	51%	0.513	38%	0.382	S	S	.	.	H	α-helix	trans	-62.4	-36.4	176.4	-172	162.3	-173	157	0	111.9	H56 K57 N64	H56-K60 WeakPolarHBondContact O-CB 3.49Å; H56-K60 PolarHBondContact O-N 2.9Å; K57-K60 PolarHBondContact O-N 3.47Å; K60-N64 VanDerWaalsContact O-CG 3.24Å; K60-N64 PolarHBondContact O-N 3.42Å; K60-N64 PolarHBondContact O-ND2 2.98Å; K60-N64 PolarHBondContact O-OD1 3.46Å
61	H	54.8	Low	54	Low	90 Å²	90	72.6 Å²	72.6	42%	0.417	36%	0.361	S	S	.	.	H	α-helix	trans	-71.5	-35.5	174.8	-157	65.2	0	0	0	112.4	Y18 L22 K57 T58 L59 N64 L65	Y18-H61 AromaticContact CE1-NE2 3.49Å; Y18-H61 WeakPolarHBondContact CE1-NE2 3.4Å; Y18-H61 AromaticContact CZ-NE2 3.21Å; Y18-H61 PolarHBondContact OH-NE2 3.46Å; L22-H61 VanDerWaalsContact CD2-CD2 3.49Å; L22-H61 WeakPolarHBondContact CD2-CD2 3.48Å; K57-H61 PolarHBondContact O-N 3.34Å; T58-H61 PolarHBondContact O-N 2.89Å; L59-H61 VanDerWaalsContact C-N 3.28Å; L59-H61 PolarHBondContact O-N 3.37Å; H61-N64 PolarHBondContact O-N 3.31Å; H61-L65 VanDerWaalsContact O-CD1 3.23Å; H61-L65 WeakPolarHBondContact O-CD1 3.41Å; H61-L65 VanDerWaalsContact O-CG 3.3Å; H61-L65 WeakPolarHBondContact O-CG 3.41Å
62	L	57.4	Low	54.8	Low	20 Å²	20	68.1 Å²	68.1	11%	0.105	34%	0.337	C	S	.	.	H	α-helix	trans	-67.9	-38.5	172.1	-68.4	169.7	0	0	0	112.7	I19 I23 T58 L59 N64 L65 F67	I19-L62 HydrophobicContact CG2-CD2 4.4Å; I23-L62 HydrophobicContact CD1-CD1 3.86Å; I23-L62 HydrophobicContact CD1-CD2 4.24Å; I23-L62 HydrophobicContact CG1-CD1 4.32Å; T58-L62 HydrophobicContact CG2-CD1 4.18Å; T58-L62 WeakPolarHBondContact O-CG 3.37Å; T58-L62 PolarHBondContact O-N 2.89Å; L59-L62 PolarHBondContact O-N 3.17Å; L62-N64 VanDerWaalsContact C-N 3.26Å; L62-N64 PolarHBondContact O-N 2.96Å; L62-L65 PolarHBondContact O-N 3.32Å; L62-L65 VanDerWaalsContact O-N 3.15Å; L62-F67 HydrophobicContact CD2-CE2 3.93Å
63	K	57.5	Low	55.4	Low	91 Å²	91	62.8 Å²	62.8	40%	0.396	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-30.8	172.9	-71.7	-166.1	-175.8	-137.3	0	112.8	L59 L65 L163 T165	L59-K63 WeakPolarHBondContact O-CG 3.36Å; L59-K63 PolarHBondContact O-N 2.98Å; K63-L65 PolarHBondContact O-N 3.43Å; K63-L163 VanDerWaalsContact CD-O 3.24Å; K63-L163 WeakPolarHBondContact CD-O 3.44Å; K63-L163 WeakPolarHBondContact CE-O 3.38Å; K63-L163 HydrophobicContact CG-CD2 4.45Å; K63-L163 WeakPolarHBondContact CG-O 3.35Å; K63-L163 PolarHBondContact NZ-O 3.09Å; K63-T165 PolarHBondContact NZ-O 2.76Å; K63-T165 PolarHBondContact NZ-OG1 3.08Å
64	N	56.6	Low	56	Low	117 Å²	117	62.8 Å²	62.8	63%	0.626	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-6.2	176.6	-71.4	-11.8	0	0	0	113.8	K60 H61 L62	K60-N64 VanDerWaalsContact O-CG 3.24Å; K60-N64 PolarHBondContact O-N 3.42Å; K60-N64 PolarHBondContact O-ND2 2.98Å; K60-N64 PolarHBondContact O-OD1 3.46Å; H61-N64 PolarHBondContact O-N 3.31Å; L62-N64 VanDerWaalsContact C-N 3.26Å; L62-N64 PolarHBondContact O-N 2.96Å
65	L	54.8	Low	56.4	Low	35 Å²	35	62.5 Å²	62.5	18%	0.183	31%	0.313	C	S	.	.	S	Bend	trans	-108.5	117.9	-176.9	-66.8	160.1	0	0	0	108.9	Y18 L22 H61 L62 K63 F67	Y18-L65 HydrophobicContact CD1-CD1 4Å; Y18-L65 HydrophobicContact CD1-CD2 4.25Å; Y18-L65 HydrophobicContact CE1-CD1 3.59Å; Y18-L65 HydrophobicContact CE1-CD2 3.69Å; Y18-L65 HydrophobicContact CE1-CG 4.31Å; L22-L65 HydrophobicContact CD1-CD1 3.63Å; H61-L65 VanDerWaalsContact O-CD1 3.23Å; H61-L65 WeakPolarHBondContact O-CD1 3.41Å; H61-L65 VanDerWaalsContact O-CG 3.3Å; H61-L65 WeakPolarHBondContact O-CG 3.41Å; L62-L65 PolarHBondContact O-N 3.32Å; L62-L65 VanDerWaalsContact O-N 3.15Å; K63-L65 PolarHBondContact O-N 3.43Å; L65-F67 HydrophobicContact CB-CD2 3.85Å; L65-F67 HydrophobicContact CB-CE1 4.03Å; L65-F67 HydrophobicContact CB-CE2 3.29Å; L65-F67 HydrophobicContact CB-CG 4.44Å; L65-F67 HydrophobicContact CB-CZ 3.4Å; L65-F67 HydrophobicContact CD1-CE2 3.88Å; L65-F67 HydrophobicContact CD1-CZ 3.67Å; L65-F67 HydrophobicContact CG-CE2 4.2Å; L65-F67 HydrophobicContact CG-CZ 4.04Å; L65-F67 WeakPolarHBondContact O-CD2 3.4Å; L65-F67 PolarHBondContact O-N 3.32Å
66	N	50.9	Low	57	Low	167 Å²	167	64.9 Å²	64.9	89%	0.893	32%	0.324	S	S	*	.			trans	-79.9	56.1	-168	-162.7	15.8	0	0	0	112.3
67	F	53.2	Low	57.1	Low	21 Å²	21	63 Å²	63	9%	0.092	32%	0.318	C	S	.	.			trans	-68.3	140.3	-177.3	-61.2	-54.2	0	0	0	111.5	D15 I19 L62 L65 S69 L72	D15-F67 HydrophobicContact CB-CD1 4.05Å; D15-F67 HydrophobicContact CB-CE1 3.94Å; I19-F67 HydrophobicContact CD1-CD1 3.9Å; I19-F67 HydrophobicContact CD1-CD2 4.06Å; I19-F67 HydrophobicContact CD1-CE1 3.6Å; I19-F67 HydrophobicContact CD1-CE2 3.75Å; I19-F67 HydrophobicContact CD1-CG 4.12Å; I19-F67 HydrophobicContact CD1-CZ 3.51Å; I19-F67 HydrophobicContact CG1-CD1 4.45Å; I19-F67 HydrophobicContact CG1-CD2 4.41Å; I19-F67 HydrophobicContact CG1-CE1 3.69Å; I19-F67 HydrophobicContact CG1-CE2 3.61Å; I19-F67 HydrophobicContact CG1-CZ 3.17Å; L62-F67 HydrophobicContact CD2-CE2 3.93Å; L65-F67 HydrophobicContact CB-CD2 3.85Å; L65-F67 HydrophobicContact CB-CE1 4.03Å; L65-F67 HydrophobicContact CB-CE2 3.29Å; L65-F67 HydrophobicContact CB-CG 4.44Å; L65-F67 HydrophobicContact CB-CZ 3.4Å; L65-F67 HydrophobicContact CD1-CE2 3.88Å; L65-F67 HydrophobicContact CD1-CZ 3.67Å; L65-F67 HydrophobicContact CG-CE2 4.2Å; L65-F67 HydrophobicContact CG-CZ 4.04Å; L65-F67 WeakPolarHBondContact O-CD2 3.4Å; L65-F67 PolarHBondContact O-N 3.32Å; F67-S69 PolarHBondContact O-N 3.31Å; F67-L72 HydrophobicContact CB-CD1 3.84Å; F67-L72 HydrophobicContact CB-CD2 4.16Å; F67-L72 HydrophobicContact CB-CG 3.89Å; F67-L72 HydrophobicContact CD2-CD2 3.99Å; F67-L72 HydrophobicContact CG-CD2 4.29Å
68	S	51.4	Low	57.2	Low	60 Å²	60	60.4 Å²	60.4	42%	0.42	31%	0.307	S	S	.	.			trans	-59.7	127	165.8	-174	0	0	0	0	109.3	K70 L71 L72	S68-K70 PolarHBondContact O-N 2.81Å; S68-L71 WeakPolarHBondContact O-CA 3.41Å; S68-L71 WeakPolarHBondContact O-CB 3.24Å; S68-L71 PolarHBondContact O-N 2.8Å; S68-L72 PolarHBondContact O-N 3.47Å
69	S	53	Low	57.7	Low	42 Å²	42	60.6 Å²	60.6	29%	0.294	31%	0.308	S	S	.	.	H	α-helix	trans	-49.9	-34	172.3	56.5	0	0	0	0	112.4	F67 L72 S73 S160	F67-S69 PolarHBondContact O-N 3.31Å; S69-L72 PolarHBondContact O-N 3.37Å; S69-S73 PolarHBondContact O-N 3.2Å; S69-S73 VanDerWaalsContact O-N 3.12Å; S69-S73 PolarHBondContact O-OG 2.9Å; S69-S160 WeakPolarHBondContact CB-OG 3.48Å
70	K	54.6	Low	58	Low	102 Å²	102	60.9 Å²	60.9	44%	0.443	31%	0.31	S	S	.	.	H	α-helix	trans	-68.4	-35.2	175.3	-154.5	177.7	-165.1	-85.4	0	113.5	S68 S73 E74	S68-K70 PolarHBondContact O-N 2.81Å; K70-S73 WeakPolarHBondContact CA-OG 3.15Å; K70-S73 PolarHBondContact O-N 3.39Å; K70-S73 PolarHBondContact O-OG 3.39Å; K70-E74 WeakPolarHBondContact CD-OE1 3.48Å; K70-E74 HydrophobicContact CG-CG 4.28Å; K70-E74 WeakPolarHBondContact CG-OE1 3.17Å; K70-E74 IonicContact NZ-OE1 2.65Å; K70-E74 PolarHBondContact NZ-OE1 3.25Å; K70-E74 WeakPolarHBondContact O-CB 2.99Å; K70-E74 WeakPolarHBondContact O-CG 3.48Å; K70-E74 PolarHBondContact O-N 3.15Å
71	L	56.2	Low	58	Low	17 Å²	17	58.1 Å²	58.1	9%	0.089	30%	0.3	C	S	.	.	H	α-helix	trans	-69.5	-34.8	174.9	-81.4	169.8	0	0	0	112.2	K12 D15 S68 N75	K12-L71 HydrophobicContact CB-CD2 3.96Å; K12-L71 HydrophobicContact CD-CD2 3.86Å; K12-L71 HydrophobicContact CG-CD1 4.31Å; K12-L71 HydrophobicContact CG-CD2 3.83Å; D15-L71 WeakPolarHBondContact OD2-CD1 3.38Å; S68-L71 WeakPolarHBondContact O-CA 3.41Å; S68-L71 WeakPolarHBondContact O-CB 3.24Å; S68-L71 PolarHBondContact O-N 2.8Å; L71-N75 PolarHBondContact O-N 2.84Å
72	L	55.8	Low	58.6	Low	9 Å²	9	55 Å²	55	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-69.8	-35.6	176	-64.1	158.5	0	0	0	111.6	I19 F67 S68 S69 I78 I159 L163	I19-L72 HydrophobicContact CD1-CD2 4.34Å; F67-L72 HydrophobicContact CB-CD1 3.84Å; F67-L72 HydrophobicContact CB-CD2 4.16Å; F67-L72 HydrophobicContact CB-CG 3.89Å; F67-L72 HydrophobicContact CD2-CD2 3.99Å; F67-L72 HydrophobicContact CG-CD2 4.29Å; S68-L72 PolarHBondContact O-N 3.47Å; S69-L72 PolarHBondContact O-N 3.37Å; L72-I78 HydrophobicContact CD2-CD1 4.16Å; L72-I78 HydrophobicContact CD2-CG2 4Å; L72-I159 HydrophobicContact CB-CG2 3.51Å; L72-I159 HydrophobicContact CD1-CG2 3.88Å; L72-I159 HydrophobicContact CG-CG2 4.28Å; L72-L163 HydrophobicContact CD1-CD1 3.45Å; L72-L163 VanDerWaalsContact CD1-CD1 3.45Å
73	S	60.7	Low	59	Low	21 Å²	21	55.7 Å²	55.7	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-80.6	-30.6	174	61	0	0	0	0	114.5	S69 K70 N75 S156	S69-S73 PolarHBondContact O-N 3.2Å; S69-S73 VanDerWaalsContact O-N 3.12Å; S69-S73 PolarHBondContact O-OG 2.9Å; K70-S73 WeakPolarHBondContact CA-OG 3.15Å; K70-S73 PolarHBondContact O-N 3.39Å; K70-S73 PolarHBondContact O-OG 3.39Å; S73-N75 PolarHBondContact O-N 2.83Å; S73-S156 WeakPolarHBondContact OG-CB 3.35Å
74	E	60.9	Low	59.3	Low	88 Å²	88	56.5 Å²	56.5	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-69.5	-13.9	177.2	-81.9	171.6	-173.9	0	0	112.6	K12 K70	K12-E74 IonicContact NZ-OE1 3.78Å; K12-E74 IonicContact NZ-OE2 2.81Å; K12-E74 PolarHBondContact NZ-OE2 3.32Å; K70-E74 WeakPolarHBondContact CD-OE1 3.48Å; K70-E74 HydrophobicContact CG-CG 4.28Å; K70-E74 WeakPolarHBondContact CG-OE1 3.17Å; K70-E74 IonicContact NZ-OE1 2.65Å; K70-E74 PolarHBondContact NZ-OE1 3.25Å; K70-E74 WeakPolarHBondContact O-CB 2.99Å; K70-E74 WeakPolarHBondContact O-CG 3.48Å; K70-E74 PolarHBondContact O-N 3.15Å
75	N	59.8	Low	59.4	Low	18 Å²	18	54 Å²	54	10%	0.096	28%	0.277	C	S	.	.			trans	-113.9	101.6	-174.8	-173.7	-10.5	0	0	0	112.5	L71 S73 N77 I78 V79	L71-N75 PolarHBondContact O-N 2.84Å; S73-N75 PolarHBondContact O-N 2.83Å; N75-N77 PolarHBondContact O-N 3.12Å; N75-N77 VanDerWaalsContact O-N 3.09Å; N75-N77 PolarHBondContact OD1-N 3.2Å; N75-N77 PolarHBondContact OD1-ND2 3.29Å; N75-I78 HydrophobicContact CB-CD1 3.74Å; N75-I78 HydrophobicContact CB-CG1 3.87Å; N75-I78 WeakPolarHBondContact O-CB 3.31Å; N75-I78 PolarHBondContact O-N 3.46Å; N75-V79 PolarHBondContact O-N 3.42Å
76	E	66.3	Low	59.8	Low	104 Å²	104	53 Å²	53	49%	0.486	27%	0.271	S	S	.	.	H	α-helix	trans	-57	-27.5	-175.7	-156.9	179.7	-163.3	0	0	114.2	N80 I766	E76-N80 WeakPolarHBondContact O-CB 3.24Å; E76-N80 VanDerWaalsContact O-CG 3.26Å; E76-N80 PolarHBondContact O-N 3.06Å; E76-N80 PolarHBondContact O-ND2 2.72Å; E76-I766 HydrophobicContact CB-CD1 4.02Å; E76-I766 HydrophobicContact CG-CD1 3.8Å; E76-I766 WeakPolarHBondContact OE1-CG2 3.44Å; E76-I766 WeakPolarHBondContact OE2-CD1 3.41Å
77	N	60	Low	60.2	Low	83 Å²	83	49.2 Å²	49.2	44%	0.444	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-43	173.3	-65.4	-72.4	0	0	0	111.5	N75 N80 I81	N75-N77 PolarHBondContact O-N 3.12Å; N75-N77 VanDerWaalsContact O-N 3.09Å; N75-N77 PolarHBondContact OD1-N 3.2Å; N75-N77 PolarHBondContact OD1-ND2 3.29Å; N77-N80 PolarHBondContact O-N 2.83Å; N77-I81 WeakPolarHBondContact O-CB 3.17Å; N77-I81 VanDerWaalsContact O-CD1 3.31Å; N77-I81 WeakPolarHBondContact O-CD1 3.28Å; N77-I81 VanDerWaalsContact O-CG1 3.22Å; N77-I81 WeakPolarHBondContact O-CG1 3.43Å; N77-I81 PolarHBondContact O-N 2.87Å
78	I	60.9	Low	60.2	Low	9 Å²	9	52.4 Å²	52.4	5%	0.046	26%	0.264	C	S	.	.	H	α-helix	trans	-70.6	-40	-179	-44.7	179.1	0	0	0	109.7	I19 L72 N75 N80 I81 M82	I19-I78 HydrophobicContact CB-CD1 4.44Å; I19-I78 HydrophobicContact CD1-CD1 3.63Å; I19-I78 HydrophobicContact CG2-CD1 3.83Å; I19-I78 HydrophobicContact CG2-CG1 3.97Å; L72-I78 HydrophobicContact CD2-CD1 4.16Å; L72-I78 HydrophobicContact CD2-CG2 4Å; N75-I78 HydrophobicContact CB-CD1 3.74Å; N75-I78 HydrophobicContact CB-CG1 3.87Å; N75-I78 WeakPolarHBondContact O-CB 3.31Å; N75-I78 PolarHBondContact O-N 3.46Å; I78-N80 PolarHBondContact O-N 2.83Å; I78-I81 PolarHBondContact O-N 3.01Å; I78-M82 HydrophobicContact CB-CE 4.45Å; I78-M82 HydrophobicContact CG2-CE 3.56Å; I78-M82 PolarHBondContact O-N 2.78Å
79	V	66.1	Low	60.1	Low	13 Å²	13	51.3 Å²	51.3	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-57.9	-47.7	171.7	179.1	0	0	0	0	110.8	N75 I81 M82 K83 I159	N75-V79 PolarHBondContact O-N 3.42Å; V79-I81 VanDerWaalsContact C-N 3.35Å; V79-I81 PolarHBondContact O-N 3.3Å; V79-M82 PolarHBondContact O-N 3.27Å; V79-M82 VanDerWaalsContact O-N 3.17Å; V79-K83 WeakPolarHBondContact O-CG 3.1Å; V79-K83 PolarHBondContact O-N 3.29Å; V79-I159 HydrophobicContact CG2-CD1 4.21Å
80	N	64.5	Low	59.9	Low	53 Å²	53	51.3 Å²	51.3	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-68.8	-30.6	179.1	-72.8	-29	0	0	0	113.3	E76 N77 I78 K83 H84 I766	E76-N80 WeakPolarHBondContact O-CB 3.24Å; E76-N80 VanDerWaalsContact O-CG 3.26Å; E76-N80 PolarHBondContact O-N 3.06Å; E76-N80 PolarHBondContact O-ND2 2.72Å; N77-N80 PolarHBondContact O-N 2.83Å; I78-N80 PolarHBondContact O-N 2.83Å; N80-K83 PolarHBondContact OD1-NZ 2.95Å; N80-K83 VanDerWaalsContact OD1-NZ 3.16Å; N80-H84 WeakPolarHBondContact O-CB 3.35Å; N80-H84 PolarHBondContact O-N 3.07Å; N80-I766 WeakPolarHBondContact ND2-CD1 3.37Å
81	I	62.7	Low	59.5	Low	61 Å²	61	51.5 Å²	51.5	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-64.6	-43.1	169.3	-73.8	157.1	0	0	0	110.7	I23 N77 I78 V79 H84 F85	I23-I81 HydrophobicContact CB-CD1 4.01Å; I23-I81 HydrophobicContact CD1-CD1 3.91Å; I23-I81 HydrophobicContact CD1-CG2 4.25Å; I23-I81 HydrophobicContact CG2-CD1 3.61Å; I23-I81 HydrophobicContact CG2-CG1 4.03Å; I23-I81 HydrophobicContact CG2-CG2 3.93Å; N77-I81 WeakPolarHBondContact O-CB 3.17Å; N77-I81 VanDerWaalsContact O-CD1 3.31Å; N77-I81 WeakPolarHBondContact O-CD1 3.28Å; N77-I81 VanDerWaalsContact O-CG1 3.22Å; N77-I81 WeakPolarHBondContact O-CG1 3.43Å; N77-I81 PolarHBondContact O-N 2.87Å; I78-I81 PolarHBondContact O-N 3.01Å; V79-I81 VanDerWaalsContact C-N 3.35Å; V79-I81 PolarHBondContact O-N 3.3Å; I81-H84 WeakPolarHBondContact O-CB 2.83Å; I81-H84 PolarHBondContact O-N 2.92Å; I81-F85 PolarHBondContact O-N 2.79Å
82	M	67.3	Low	58.8	Low	24 Å²	24	53.9 Å²	53.9	12%	0.118	27%	0.271	C	S	.	.	H	α-helix	trans	-68.8	-38.9	176.8	-81.4	-176.4	-91.7	0	0	112.6	I78 V79 H84 F85 I86 I159 L162	I78-M82 HydrophobicContact CB-CE 4.45Å; I78-M82 HydrophobicContact CG2-CE 3.56Å; I78-M82 PolarHBondContact O-N 2.78Å; V79-M82 PolarHBondContact O-N 3.27Å; V79-M82 VanDerWaalsContact O-N 3.17Å; M82-H84 VanDerWaalsContact C-N 3.33Å; M82-H84 PolarHBondContact O-N 3.17Å; M82-F85 PolarHBondContact O-N 3.26Å; M82-I86 WeakPolarHBondContact O-CG1 3.41Å; M82-I86 PolarHBondContact O-N 3.39Å; M82-I159 HydrophobicContact CE-CB 4.23Å; M82-I159 HydrophobicContact CE-CD1 3.86Å; M82-I159 HydrophobicContact CE-CG1 3.68Å; M82-I159 HydrophobicContact CE-CG2 3.65Å; M82-I159 HydrophobicContact SD-CB 4.28Å; M82-I159 HydrophobicContact SD-CG1 3.82Å; M82-I159 HydrophobicContact SD-CG2 4.05Å; M82-L162 HydrophobicContact SD-CD1 4.2Å
83	K	66.1	Low	57.9	Low	34 Å²	34	56.2 Å²	56.2	15%	0.148	29%	0.289	C	S	.	.	H	α-helix	trans	-55.7	-47.7	167.8	-69.8	179.2	-170.8	169.8	0	111.2	V79 N80 F85 I86 H87 L147 E148	V79-K83 WeakPolarHBondContact O-CG 3.1Å; V79-K83 PolarHBondContact O-N 3.29Å; N80-K83 PolarHBondContact OD1-NZ 2.95Å; N80-K83 VanDerWaalsContact OD1-NZ 3.16Å; K83-F85 VanDerWaalsContact C-N 3.32Å; K83-F85 PolarHBondContact O-N 3.46Å; K83-I86 PolarHBondContact O-N 3.49Å; K83-H87 VanDerWaalsContact O-CB 3.25Å; K83-H87 WeakPolarHBondContact O-CB 3.34Å; K83-H87 PolarHBondContact O-N 2.63Å; K83-L147 HydrophobicContact CG-CD1 4.43Å; K83-E148 HydrophobicContact CD-CG 4.48Å; K83-E148 WeakPolarHBondContact CE-OE1 3.48Å; K83-E148 IonicContact NZ-OE1 2.66Å; K83-E148 PolarHBondContact NZ-OE1 3.43Å
84	H	62.5	Low	56.7	Low	108 Å²	108	63.5 Å²	63.5	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-41.6	177.5	-169.9	-72.4	0	0	0	111.7	N80 I81 M82 H88	N80-H84 WeakPolarHBondContact O-CB 3.35Å; N80-H84 PolarHBondContact O-N 3.07Å; I81-H84 WeakPolarHBondContact O-CB 2.83Å; I81-H84 PolarHBondContact O-N 2.92Å; M82-H84 VanDerWaalsContact C-N 3.33Å; M82-H84 PolarHBondContact O-N 3.17Å; H84-H88 AromaticContact CE1-CD2 3.6Å; H84-H88 WeakPolarHBondContact O-CB 3.26Å; H84-H88 PolarHBondContact O-N 2.93Å
85	F	59.5	Low	55.3	Low	66 Å²	66	63.9 Å²	63.9	29%	0.289	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-46.7	177.1	-176.4	-100.2	0	0	0	112.5	H55 L59 I81 M82 K83 H88 S89	H55-F85 HydrophobicContact CB-CE2 4.31Å; L59-F85 HydrophobicContact CD1-CD2 4.16Å; L59-F85 HydrophobicContact CD1-CE1 3.9Å; L59-F85 HydrophobicContact CD1-CE2 3.51Å; L59-F85 HydrophobicContact CD1-CZ 3.37Å; I81-F85 PolarHBondContact O-N 2.79Å; M82-F85 PolarHBondContact O-N 3.26Å; K83-F85 VanDerWaalsContact C-N 3.32Å; K83-F85 PolarHBondContact O-N 3.46Å; F85-H88 PolarHBondContact O-N 2.78Å; F85-S89 WeakPolarHBondContact O-CB 3.46Å; F85-S89 PolarHBondContact O-N 3.24Å
86	I	63.5	Low	53.9	Low	12 Å²	12	67.8 Å²	67.8	6%	0.062	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-47.1	176.5	-72.2	161.4	0	0	0	110.8	M82 K83 H88 S89 Q90 L142 L147 L162	M82-I86 WeakPolarHBondContact O-CG1 3.41Å; M82-I86 PolarHBondContact O-N 3.39Å; K83-I86 PolarHBondContact O-N 3.49Å; I86-H88 PolarHBondContact O-N 3.32Å; I86-S89 WeakPolarHBondContact O-CB 3.47Å; I86-S89 PolarHBondContact O-N 3.46Å; I86-Q90 WeakPolarHBondContact O-CB 3.45Å; I86-Q90 WeakPolarHBondContact O-CG 3.48Å; I86-Q90 PolarHBondContact O-N 2.75Å; I86-L142 WeakPolarHBondContact CG2-O 3.11Å; I86-L147 HydrophobicContact CD1-CD1 3.35Å; I86-L162 HydrophobicContact CD1-CD1 4.07Å; I86-L162 HydrophobicContact CD1-CD2 4.49Å
87	H	59	Low	52.1	Low	88 Å²	88	67.2 Å²	67.2	41%	0.407	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-43	178.5	-174.6	-130.1	0	0	0	112.2	K83 Q90 Q91	K83-H87 VanDerWaalsContact O-CB 3.25Å; K83-H87 WeakPolarHBondContact O-CB 3.34Å; K83-H87 PolarHBondContact O-N 2.63Å; H87-Q90 PolarHBondContact O-N 3.03Å; H87-Q91 PolarHBondContact CE1-NE2 2.95Å; H87-Q91 PolarHBondContact NE2-NE2 2.97Å; H87-Q91 WeakPolarHBondContact O-CG 3.27Å; H87-Q91 PolarHBondContact O-N 2.98Å
88	H	53.3	Low	50.8	Low	89 Å²	89	69.2 Å²	69.2	41%	0.412	39%	0.387	S	S	.	.	H	α-helix	trans	-67.2	-37.6	175.5	-128.7	-92.4	0	0	0	112.3	H84 F85 I86 S92	H84-H88 AromaticContact CE1-CD2 3.6Å; H84-H88 WeakPolarHBondContact O-CB 3.26Å; H84-H88 PolarHBondContact O-N 2.93Å; F85-H88 PolarHBondContact O-N 2.78Å; I86-H88 PolarHBondContact O-N 3.32Å; H88-S92 PolarHBondContact O-N 3.13Å; H88-S92 VanDerWaalsContact O-N 3.1Å
89	S	49.9	Very low	49.4	Very low	37 Å²	37	74.4 Å²	74.4	26%	0.259	42%	0.424	S	S	.	.	H	α-helix	trans	-60.1	-48.4	173.4	-168.8	0	0	0	0	110.6	F85 I86 S92 S93	F85-S89 WeakPolarHBondContact O-CB 3.46Å; F85-S89 PolarHBondContact O-N 3.24Å; I86-S89 WeakPolarHBondContact O-CB 3.47Å; I86-S89 PolarHBondContact O-N 3.46Å; S89-S92 WeakPolarHBondContact O-CB 3.38Å; S89-S92 PolarHBondContact O-N 3.28Å; S89-S92 PolarHBondContact O-OG 3.3Å; S89-S93 PolarHBondContact O-N 3.13Å; S89-S93 PolarHBondContact O-OG 3.48Å
90	Q	47.7	Very low	47.8	Very low	41 Å²	41	79.3 Å²	79.3	19%	0.192	46%	0.459	C	S	.	.	H	α-helix	trans	-66.6	-40.1	-179.6	-73.7	170.1	-1.1	0	0	112.9	I86 H87 S92 S93 F94 L142	I86-Q90 WeakPolarHBondContact O-CB 3.45Å; I86-Q90 WeakPolarHBondContact O-CG 3.48Å; I86-Q90 PolarHBondContact O-N 2.75Å; H87-Q90 PolarHBondContact O-N 3.03Å; Q90-S92 VanDerWaalsContact C-N 3.26Å; Q90-S92 PolarHBondContact O-N 2.82Å; Q90-S93 WeakPolarHBondContact CA-OG 3.31Å; Q90-S93 PolarHBondContact O-N 2.79Å; Q90-S93 VanDerWaalsContact O-N 3.15Å; Q90-S93 PolarHBondContact O-OG 3.07Å; Q90-F94 VanDerWaalsContact O-CD2 3.31Å; Q90-F94 WeakPolarHBondContact O-CD2 3.42Å; Q90-F94 PolarHBondContact O-N 2.99Å; Q90-L142 PolarHBondContact NE2-O 2.83Å
91	Q	46.4	Very low	46.4	Very low	107 Å²	107	82.1 Å²	82.1	50%	0.5	48%	0.483	S	S	.	.	H	α-helix	trans	-63.7	-32.1	173.6	-71.8	-169.5	12.1	0	0	112.6	H87 S93 F94 S95	H87-Q91 PolarHBondContact CE1-NE2 2.95Å; H87-Q91 PolarHBondContact NE2-NE2 2.97Å; H87-Q91 WeakPolarHBondContact O-CG 3.27Å; H87-Q91 PolarHBondContact O-N 2.98Å; Q91-S93 PolarHBondContact O-N 3.49Å; Q91-F94 PolarHBondContact O-N 3.46Å; Q91-S95 PolarHBondContact O-OG 3.02Å
92	S	40.8	Very low	45.1	Very low	66 Å²	66	84 Å²	84	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-70.2	-17.3	175.7	82.3	0	0	0	0	114.3	H88 S89 Q90	H88-S92 PolarHBondContact O-N 3.13Å; H88-S92 VanDerWaalsContact O-N 3.1Å; S89-S92 WeakPolarHBondContact O-CB 3.38Å; S89-S92 PolarHBondContact O-N 3.28Å; S89-S92 PolarHBondContact O-OG 3.3Å; Q90-S92 VanDerWaalsContact C-N 3.26Å; Q90-S92 PolarHBondContact O-N 2.82Å
93	S	37.9	Very low	43.4	Very low	58 Å²	58	87.8 Å²	87.8	41%	0.406	53%	0.53	S	S	.	.	H	α-helix	trans	-93.7	-16.5	175.6	42.1	0	0	0	0	115.2	S89 Q90 Q91	S89-S93 PolarHBondContact O-N 3.13Å; S89-S93 PolarHBondContact O-OG 3.48Å; Q90-S93 WeakPolarHBondContact CA-OG 3.31Å; Q90-S93 PolarHBondContact O-N 2.79Å; Q90-S93 VanDerWaalsContact O-N 3.15Å; Q90-S93 PolarHBondContact O-OG 3.07Å; Q91-S93 PolarHBondContact O-N 3.49Å
94	F	35.9	Very low	41.9	Very low	174 Å²	174	90.8 Å²	90.8	76%	0.763	56%	0.555	S	S	*	*	H	α-helix	trans	-103.5	-1	-178.3	-76.2	-67.3	0	0	0	115	Q90 Q91	Q90-F94 VanDerWaalsContact O-CD2 3.31Å; Q90-F94 WeakPolarHBondContact O-CD2 3.42Å; Q90-F94 PolarHBondContact O-N 2.99Å; Q91-F94 PolarHBondContact O-N 3.46Å
95	S	30.9	Very low	40.4	Very low	97 Å²	97	90.6 Å²	90.6	68%	0.678	57%	0.567	S	S	*	*	S	Bend	trans	-98.9	9.4	-173.9	39.7	0	0	0	0	114.8	Q91	Q91-S95 PolarHBondContact O-OG 3.02Å
96	S	29.7	Very low	39.1	Very low	100 Å²	100	92 Å²	92	70%	0.699	58%	0.584	S	S	*	*	S	Bend	trans	-137.3	38.9	-170.4	59	0	0	0	0	115.4
97	S	30	Very low	37.6	Very low	92 Å²	92	97.1 Å²	97.1	64%	0.643	62%	0.616	S	S	*	*			trans	-150.9	141.8	171	63.9	0	0	0	0	113.9
98	S	31.1	Very low	36.2	Very low	124 Å²	124	98.9 Å²	98.9	87%	0.867	63%	0.634	S	S	*	*			trans	69.2	143.7	-176.3	84.5	0	0	0	0	115.1
99	S	31.8	Very low	35	Very low	119 Å²	119	99.2 Å²	99.2	83%	0.832	65%	0.646	S	S	*	*			cis	-140.8	139.7	-3.3	56.6	0	0	0	0	112.1
100	S	32.9	Very low	34	Very low	116 Å²	116	103.6 Å²	103.6	81%	0.811	67%	0.671	S	S	*	*			trans	-117.7	110.2	176	57.1	0	0	0	0	110.7
101	S	35.5	Very low	33.2	Very low	111 Å²	111	107.1 Å²	107.1	78%	0.776	70%	0.701	S	S	*	*			trans	-178.1	119.6	150.2	56.5	0	0	0	0	114.6
102	S	34.2	Very low	32.4	Very low	100 Å²	100	107.4 Å²	107.4	70%	0.699	71%	0.714	S	S	*	*			trans	49.8	107	134.7	67.1	0	0	0	0	122.5
103	S	32.3	Very low	32.2	Very low	104 Å²	104	109.4 Å²	109.4	73%	0.727	73%	0.726	S	S	*	*				86.8	158.5	111.3	74.9	0	0	0	0	123.2
104	S	34.2	Very low	31.6	Very low	97 Å²	97	113.5 Å²	113.5	68%	0.678	74%	0.741	S	S	*	*			trans	71	87.5	159.9	41.9	0	0	0	0	120.7
105	S	32.1	Very low	31.3	Very low	105 Å²	105	111.8 Å²	111.8	73%	0.734	74%	0.74	S	S	*	*				73.6	138	114.3	64.3	0	0	0	0	123.7
106	S	31.8	Very low	31.1	Very low	95 Å²	95	113.3 Å²	113.3	66%	0.664	74%	0.74	S	S	*	*			trans	77.9	102.1	137.5	59	0	0	0	0	121.6
107	T	31.7	Very low	31.1	Very low	119 Å²	119	115.5 Å²	115.5	73%	0.73	74%	0.744	S	S	*	*				66.9	103.4	125	60.1	0	0	0	0	121.3
108	T	29.3	Very low	31	Very low	126 Å²	126	115.7 Å²	115.7	77%	0.773	75%	0.746	S	S	*	*				72.6	144.4	125.6	57.1	0	0	0	0	122.7
109	S	28.8	Very low	30.9	Very low	96 Å²	96	116.4 Å²	116.4	67%	0.671	74%	0.74	S	S	*	*			trans	79	106.9	149	49.7	0	0	0	0	121.1
110	T	28.6	Very low	31	Very low	128 Å²	128	116.6 Å²	116.6	79%	0.785	73%	0.731	S	S	*	*			trans	78.3	134.8	130	55.9	0	0	0	0	122
111	S	31	Very low	30.7	Very low	116 Å²	116	120.2 Å²	120.2	81%	0.811	73%	0.728	S	S	*	*			trans	84.6	97.5	149.7	-57.3	0	0	0	0	119.8
112	S	30.2	Very low	30.5	Very low	113 Å²	113	122 Å²	122	79%	0.79	73%	0.729	S	S	*	*			trans	-42.4	177.9	150.5	-16.4	0	0	0	0	115.7
113	P	35.4	Very low	30.2	Very low	108 Å²	108	126.6 Å²	126.6	70%	0.701	73%	0.73	S	S	*	*			cis	-138	-152.1	-14	26.2	0.6	0	0	0	112.7
114	I	27	Very low	30.1	Very low	143 Å²	143	126.8 Å²	126.8	73%	0.733	72%	0.724	S	S	*	*			trans	100.9	105.3	146.4	-73	163.9	0	0	0	120.8
115	L	28.8	Very low	29.9	Very low	139 Å²	139	127.8 Å²	127.8	73%	0.728	72%	0.721	S	S	*	*			trans	67.9	127.5	136.3	-62	179.6	0	0	0	125.5
116	N	27.8	Very low	30	Very low	129 Å²	129	128.1 Å²	128.1	69%	0.69	72%	0.715	S	S	*	*				81.2	117.5	127.9	-70.6	-0.1	0	0	0	124.6
117	N	28.3	Very low	30.1	Very low	145 Å²	145	129.9 Å²	129.9	78%	0.775	72%	0.717	S	S	*	*				33.3	125.2	125.6	-70.9	11.4	0	0	0	120.6
118	S	28.5	Very low	30.2	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	71%	0.713	S	S	*	*				172.5	149.8	89.1	-65.2	0	0	0	0	111.6
119	N	29	Very low	30.4	Very low	139 Å²	139	130 Å²	130	74%	0.743	71%	0.712	S	S	*	*			trans	51.6	146.3	133.7	-66.6	31.1	0	0	0	120.8
120	D	32.8	Very low	30.7	Very low	122 Å²	122	133.6 Å²	133.6	65%	0.652	72%	0.724	S	S	*	*			cis	-159	158.7	27.1	-101.8	-34.9	0	0	0	113.5
121	Y	28	Very low	30.9	Very low	192 Å²	192	134.3 Å²	134.3	75%	0.753	72%	0.723	S	S	*	*			trans	21.5	132.8	145.1	-68.2	-67.2	0	0	0	125.2
122	L	30.4	Very low	30.9	Very low	149 Å²	149	135.6 Å²	135.6	78%	0.78	72%	0.721	S	S	*	*				72.2	154.8	130	-63.1	173.4	0	0	0	119.8
123	R	28.5	Very low	30.9	Very low	196 Å²	196	138.1 Å²	138.1	74%	0.74	73%	0.725	S	S	*	*			cis	-175.6	148.5	-14.8	167.7	178.1	170.7	-164.5	-0.8	112.4
124	N	30.7	Very low	30.6	Very low	109 Å²	109	139.6 Å²	139.6	58%	0.583	73%	0.727	S	S	*	*			trans	72.9	148.5	155.9	-89.5	48	0	0	0	122.7
125	N	30.2	Very low	30.8	Very low	118 Å²	118	141.9 Å²	141.9	63%	0.631	73%	0.732	S	S	*	*			trans	72.6	148.4	145.4	-76.4	41.1	0	0	0	118.7
126	D	34.3	Very low	31	Very low	112 Å²	112	142.8 Å²	142.8	60%	0.599	74%	0.737	S	S	*	*			cis	-154.9	150.6	7.3	-111.2	-32.5	0	0	0	111.4
127	N	32.1	Very low	31.2	Very low	131 Å²	131	140.9 Å²	140.9	70%	0.701	73%	0.727	S	S	*	*			trans	59.5	155.5	148.5	-61	-31.3	0	0	0	119.8
128	T	35.5	Very low	31.4	Very low	107 Å²	107	140.5 Å²	140.5	66%	0.656	73%	0.725	S	S	*	*			cis	-159.7	159.6	-3.2	8.9	0	0	0	0	109.4
129	D	33.2	Very low	31.7	Very low	142 Å²	142	139.5 Å²	139.5	76%	0.759	71%	0.711	S	S	*	*			trans	40.4	115.4	148.6	-44.3	-25.7	0	0	0	121.1
130	D	35.3	Very low	32.1	Very low	170 Å²	170	137.4 Å²	137.4	91%	0.909	70%	0.7	S	S	*	*				-169.6	161.3	105.2	-119.3	-30.5	0	0	0	112.9
131	D	33.2	Very low	32.7	Very low	144 Å²	144	135.9 Å²	135.9	77%	0.77	70%	0.695	S	S	*	*			trans	-87	167	-165.7	-99.9	-48.3	0	0	0	116.9
132	N	29.2	Very low	33.4	Very low	142 Å²	142	128.5 Å²	128.5	76%	0.759	67%	0.669	S	S	*	*			trans	83.8	82.8	167.7	-49	-83	0	0	0	118.6
133	N	31.7	Very low	34.7	Very low	167 Å²	167	124.2 Å²	124.2	89%	0.893	65%	0.649	S	S	*	*			trans	177.9	74	134.1	-96.6	-44.5	0	0	0	111.6
134	N	29	Very low	36	Very low	138 Å²	138	116.1 Å²	116.1	74%	0.738	62%	0.622	S	S	*	*			trans	-139.9	70.6	-173.6	-150.9	5.8	0	0	0	115.6
135	K	31.3	Very low	37.3	Very low	192 Å²	192	115.7 Å²	115.7	84%	0.835	62%	0.62	S	S	*	*	S	Bend	trans	-134.4	-1	161.5	-76.9	-163.5	174	-173	0	115.1
136	N	31.6	Very low	38.8	Very low	157 Å²	157	113.9 Å²	113.9	84%	0.84	61%	0.607	S	S	*	*	S	Bend	trans	-106.8	6.1	-170.2	-66.5	0.3	0	0	0	115
137	N	33.2	Very low	40	Very low	89 Å²	89	108.6 Å²	108.6	48%	0.476	58%	0.579	S	S	.	*			trans	-104.3	1.2	-167	-93.6	-36	0	0	0	116.5	L139 N140	N137-L139 PolarHBondContact O-N 2.86Å; N137-N140 WeakPolarHBondContact O-CB 3.35Å; N137-N140 PolarHBondContact O-N 3.44Å; N137-N140 PolarHBondContact OD1-ND2 3.17Å
138	L	32.2	Very low	41.3	Very low	138 Å²	138	107.7 Å²	107.7	72%	0.723	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-66.8	-15.6	-176.7	-96.8	161.5	0	0	0	114.8	N140 T141	L138-N140 VanDerWaalsContact C-N 3.29Å; L138-N140 PolarHBondContact O-N 3.41Å; L138-T141 PolarHBondContact O-OG1 2.91Å
139	L	33.9	Very low	42.4	Very low	76 Å²	76	110.4 Å²	110.4	40%	0.398	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-75	-14.8	170.4	-96.8	79.4	0	0	0	113.9	N137 T141	N137-L139 PolarHBondContact O-N 2.86Å; L139-T141 VanDerWaalsContact C-N 3.31Å; L139-T141 PolarHBondContact O-N 3.41Å
140	N	37.8	Very low	43.6	Very low	94 Å²	94	105.8 Å²	105.8	50%	0.503	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-90.7	10	-174.9	-67	-30.6	0	0	0	113.5	N137 L138	N137-N140 WeakPolarHBondContact O-CB 3.35Å; N137-N140 PolarHBondContact O-N 3.44Å; N137-N140 PolarHBondContact OD1-ND2 3.17Å; L138-N140 VanDerWaalsContact C-N 3.29Å; L138-N140 PolarHBondContact O-N 3.41Å
141	T	45	Very low	44.7	Very low	91 Å²	91	103.2 Å²	103.2	56%	0.558	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-117.1	15	-176.4	29.4	0	0	0	0	114.1	L138 L139	L138-T141 PolarHBondContact O-OG1 2.91Å; L139-T141 VanDerWaalsContact C-N 3.31Å; L139-T141 PolarHBondContact O-N 3.41Å
142	L	43.9	Very low	45.8	Very low	36 Å²	36	103 Å²	103	19%	0.188	53%	0.531	C	S	.	.			trans	-134.7	110.2	174.3	-70.9	173.2	0	0	0	111.3	I86 Q90 L158	I86-L142 WeakPolarHBondContact CG2-O 3.11Å; Q90-L142 PolarHBondContact NE2-O 2.83Å; L142-L158 HydrophobicContact CD1-CB 4.42Å; L142-L158 HydrophobicContact CD1-CD1 4.24Å; L142-L158 HydrophobicContact CD1-CD2 3.96Å; L142-L158 HydrophobicContact CD1-CG 4.44Å; L142-L158 HydrophobicContact CD2-CD1 3.67Å; L142-L158 HydrophobicContact CD2-CD2 3.81Å; L142-L158 HydrophobicContact CD2-CG 4.36Å
143	T	56.7	Low	47.1	Very low	59 Å²	59	98.6 Å²	98.6	36%	0.362	52%	0.518	S	S	.	.			trans	-79.6	164	171.8	61.9	0	0	0	0	111.5	D145 E146	T143-D145 PolarHBondContact O-N 3.38Å; T143-E146 WeakPolarHBondContact CB-OE2 3.39Å; T143-E146 PolarHBondContact N-OE2 3.17Å; T143-E146 PolarHBondContact O-N 2.87Å; T143-E146 WeakPolarHBondContact OG1-CG 3.28Å; T143-E146 PolarHBondContact OG1-N 3.4Å; T143-E146 PolarHBondContact OG1-OE2 3.08Å
144	S	57.2	Low	48.5	Very low	26 Å²	26	94.2 Å²	94.2	18%	0.182	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.3	171.9	-63.3	0	0	0	0	112	L147 E148	S144-L147 PolarHBondContact O-N 3.45Å; S144-E148 PolarHBondContact O-N 3.48Å
145	D	57.7	Low	50.1	Low	100 Å²	100	89.9 Å²	89.9	54%	0.535	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-35	-175.4	-57.7	6.4	0	0	0	112.2	T143 E148 Q149	T143-D145 PolarHBondContact O-N 3.38Å; D145-E148 PolarHBondContact O-N 3.27Å; D145-E148 VanDerWaalsContact O-N 3.09Å; D145-Q149 WeakPolarHBondContact O-CG 3.39Å; D145-Q149 PolarHBondContact O-N 2.8Å
146	E	61.9	Low	51.3	Low	80 Å²	80	81.9 Å²	81.9	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-40.9	175.6	-76.7	158.9	125.5	0	0	111.2	T143 E148 Q149 E150	T143-E146 WeakPolarHBondContact CB-OE2 3.39Å; T143-E146 PolarHBondContact N-OE2 3.17Å; T143-E146 PolarHBondContact O-N 2.87Å; T143-E146 WeakPolarHBondContact OG1-CG 3.28Å; T143-E146 PolarHBondContact OG1-N 3.4Å; T143-E146 PolarHBondContact OG1-OE2 3.08Å; E146-E148 PolarHBondContact O-N 2.95Å; E146-E148 VanDerWaalsContact O-N 3.17Å; E146-Q149 PolarHBondContact O-N 3.47Å; E146-E150 WeakPolarHBondContact O-CB 3.37Å; E146-E150 WeakPolarHBondContact O-CG 3.42Å; E146-E150 PolarHBondContact O-N 3.08Å
147	L	59.1	Low	52.6	Low	2 Å²	2	80.3 Å²	80.3	1%	0.01	42%	0.421	C	S	.	.	H	α-helix	trans	-65.9	-12.3	172	-90	176.2	0	0	0	114.3	K83 I86 S144 K155 L158	K83-L147 HydrophobicContact CG-CD1 4.43Å; I86-L147 HydrophobicContact CD1-CD1 3.35Å; S144-L147 PolarHBondContact O-N 3.45Å; L147-K155 WeakPolarHBondContact O-CE 3.47Å; L147-L158 HydrophobicContact CD2-CB 4.25Å; L147-L158 HydrophobicContact CD2-CD1 3.89Å; L147-L158 HydrophobicContact CG-CD1 4.24Å
148	E	59.1	Low	53.9	Low	112 Å²	112	76.9 Å²	76.9	52%	0.523	40%	0.403	S	S	.	.	H	α-helix	trans	-92.1	-45.6	173.1	-66.5	-163.1	159.1	0	0	111.9	K83 S144 D145 E146 E150 K155	K83-E148 HydrophobicContact CD-CG 4.48Å; K83-E148 WeakPolarHBondContact CE-OE1 3.48Å; K83-E148 IonicContact NZ-OE1 2.66Å; K83-E148 PolarHBondContact NZ-OE1 3.43Å; S144-E148 PolarHBondContact O-N 3.48Å; D145-E148 PolarHBondContact O-N 3.27Å; D145-E148 VanDerWaalsContact O-N 3.09Å; E146-E148 PolarHBondContact O-N 2.95Å; E146-E148 VanDerWaalsContact O-N 3.17Å; E148-E150 PolarHBondContact O-N 2.94Å; E148-K155 PolarHBondContact O-NZ 2.91Å
149	Q	59.2	Low	55.3	Low	163 Å²	163	70.3 Å²	70.3	76%	0.762	37%	0.368	S	S	*	.	H	α-helix	trans	-73.6	-21.1	-174	-66.6	178.6	50.6	0	0	114.6	D145 E146	D145-Q149 WeakPolarHBondContact O-CG 3.39Å; D145-Q149 PolarHBondContact O-N 2.8Å; E146-Q149 PolarHBondContact O-N 3.47Å
150	E	56.6	Low	56.4	Low	46 Å²	46	67.8 Å²	67.8	22%	0.215	36%	0.358	C	S	.	.	S	Bend	trans	-77.7	153.1	-173	-82.9	-157.4	142.2	0	0	116	E146 E148 Q154 K155 L158	E146-E150 WeakPolarHBondContact O-CB 3.37Å; E146-E150 WeakPolarHBondContact O-CG 3.42Å; E146-E150 PolarHBondContact O-N 3.08Å; E148-E150 PolarHBondContact O-N 2.94Å; E150-Q154 HydrophobicContact CB-CB 3.92Å; E150-Q154 VanDerWaalsContact CD-CB 3.44Å; E150-Q154 VanDerWaalsContact CD-NE2 3.31Å; E150-Q154 HydrophobicContact CG-CB 4.1Å; E150-Q154 PolarHBondContact OE1-NE2 3.49Å; E150-Q154 VanDerWaalsContact OE2-CB 3.23Å; E150-Q154 WeakPolarHBondContact OE2-CB 3.18Å; E150-K155 HydrophobicContact CB-CG 4.27Å; E150-K155 WeakPolarHBondContact O-CD 3.4Å; E150-K155 WeakPolarHBondContact O-CE 3.46Å; E150-K155 PolarHBondContact O-NZ 3.49Å; E150-L158 WeakPolarHBondContact OE2-CD1 3.46Å; E150-L158 VanDerWaalsContact OE2-CG 3.29Å; E150-L158 WeakPolarHBondContact OE2-CG 3.39Å
151	N	59.7	Low	57.4	Low	115 Å²	115	66.9 Å²	66.9	62%	0.615	35%	0.352	S	S	*	.			trans	-68.5	157.2	176	-66.2	-80.2	0	0	0	111.9	G153 Q154 K155	N151-G153 PolarHBondContact O-N 3.47Å; N151-G153 VanDerWaalsContact O-N 3.08Å; N151-Q154 PolarHBondContact ND2-OE1 3.27Å; N151-Q154 PolarHBondContact O-N 2.99Å; N151-K155 PolarHBondContact O-N 3.19Å
152	E	56.6	Low	58.1	Low	140 Å²	140	64.1 Å²	64.1	65%	0.654	33%	0.334	S	S	*	.	H	α-helix	trans	-48.5	-41.4	178.9	-65.1	-172.8	167.3	0	0	113.6	S156	E152-S156 WeakPolarHBondContact O-CB 3.23Å; E152-S156 PolarHBondContact O-N 3.09Å
153	G	55.7	Low	58.6	Low	49 Å²	49	63.6 Å²	63.6	51%	0.505	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-40.5	178.3	0	0	0	0	0	113.3	N151 S156 F157	N151-G153 PolarHBondContact O-N 3.47Å; N151-G153 VanDerWaalsContact O-N 3.08Å; G153-S156 PolarHBondContact O-N 2.91Å; G153-S156 PolarHBondContact O-OG 3.34Å; G153-F157 PolarHBondContact O-N 2.9Å; G153-F157 VanDerWaalsContact O-N 3.12Å
154	Q	61.8	Low	58.3	Low	76 Å²	76	66.7 Å²	66.7	36%	0.355	35%	0.346	S	S	.	.	H	α-helix	trans	-72.5	-42.4	176.8	-63.4	166.4	-98.5	0	0	110.9	E150 N151 S156 F157 L158	E150-Q154 HydrophobicContact CB-CB 3.92Å; E150-Q154 VanDerWaalsContact CD-CB 3.44Å; E150-Q154 VanDerWaalsContact CD-NE2 3.31Å; E150-Q154 HydrophobicContact CG-CB 4.1Å; E150-Q154 PolarHBondContact OE1-NE2 3.49Å; E150-Q154 VanDerWaalsContact OE2-CB 3.23Å; E150-Q154 WeakPolarHBondContact OE2-CB 3.18Å; N151-Q154 PolarHBondContact ND2-OE1 3.27Å; N151-Q154 PolarHBondContact O-N 2.99Å; Q154-S156 VanDerWaalsContact C-N 3.29Å; Q154-S156 PolarHBondContact O-N 3.2Å; Q154-F157 CarbonylContact O-C 3.58Å; Q154-F157 WeakPolarHBondContact O-CA 3.3Å; Q154-F157 VanDerWaalsContact O-CB 3.32Å; Q154-F157 WeakPolarHBondContact O-CB 3.21Å; Q154-F157 PolarHBondContact O-N 3.33Å; Q154-L158 PolarHBondContact O-N 3.39Å
155	K	62.1	Low	57.4	Low	47 Å²	47	68 Å²	68	20%	0.204	35%	0.353	C	S	.	.	H	α-helix	trans	-51.2	-47.4	168.9	-78	167.3	168.9	141	0	111.4	L147 E148 E150 N151 F157 I159	L147-K155 WeakPolarHBondContact O-CE 3.47Å; E148-K155 PolarHBondContact O-NZ 2.91Å; E150-K155 HydrophobicContact CB-CG 4.27Å; E150-K155 WeakPolarHBondContact O-CD 3.4Å; E150-K155 WeakPolarHBondContact O-CE 3.46Å; E150-K155 PolarHBondContact O-NZ 3.49Å; N151-K155 PolarHBondContact O-N 3.19Å; K155-F157 VanDerWaalsContact C-N 3.26Å; K155-F157 PolarHBondContact O-N 3.44Å; K155-I159 VanDerWaalsContact O-CB 3.24Å; K155-I159 WeakPolarHBondContact O-CB 3.47Å; K155-I159 VanDerWaalsContact O-CD1 3.31Å; K155-I159 WeakPolarHBondContact O-CD1 3.41Å; K155-I159 WeakPolarHBondContact O-CG1 3.47Å; K155-I159 PolarHBondContact O-N 3.46Å
156	S	55.5	Low	56.2	Low	23 Å²	23	69.1 Å²	69.1	16%	0.161	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-29.7	175.7	81.9	0	0	0	0	113.7	S73 E152 G153 Q154 S160	S73-S156 WeakPolarHBondContact OG-CB 3.35Å; E152-S156 WeakPolarHBondContact O-CB 3.23Å; E152-S156 PolarHBondContact O-N 3.09Å; G153-S156 PolarHBondContact O-N 2.91Å; G153-S156 PolarHBondContact O-OG 3.34Å; Q154-S156 VanDerWaalsContact C-N 3.29Å; Q154-S156 PolarHBondContact O-N 3.2Å; S156-S160 WeakPolarHBondContact O-CB 3.36Å; S156-S160 PolarHBondContact O-N 2.87Å; S156-S160 VanDerWaalsContact O-N 3.14Å; S156-S160 PolarHBondContact O-OG 3.49Å
157	F	59.5	Low	54.6	Low	124 Å²	124	73 Å²	73	54%	0.544	38%	0.382	S	S	.	.	H	α-helix	trans	-74.9	-52.7	176.1	-177.2	-99	0	0	0	111.5	G153 Q154 K155 I159 S160 D161	G153-F157 PolarHBondContact O-N 2.9Å; G153-F157 VanDerWaalsContact O-N 3.12Å; Q154-F157 CarbonylContact O-C 3.58Å; Q154-F157 WeakPolarHBondContact O-CA 3.3Å; Q154-F157 VanDerWaalsContact O-CB 3.32Å; Q154-F157 WeakPolarHBondContact O-CB 3.21Å; Q154-F157 PolarHBondContact O-N 3.33Å; K155-F157 VanDerWaalsContact C-N 3.26Å; K155-F157 PolarHBondContact O-N 3.44Å; F157-I159 VanDerWaalsContact C-N 3.25Å; F157-I159 PolarHBondContact O-N 2.94Å; F157-S160 CarbonylContact O-C 3.56Å; F157-S160 WeakPolarHBondContact O-CA 3.42Å; F157-S160 VanDerWaalsContact O-CB 3.28Å; F157-S160 WeakPolarHBondContact O-CB 3.39Å; F157-S160 PolarHBondContact O-N 3.17Å; F157-D161 WeakPolarHBondContact CE1-OD2 3.33Å; F157-D161 WeakPolarHBondContact CZ-OD2 3.5Å; F157-D161 PolarHBondContact O-N 2.93Å
158	L	61.5	Low	53.2	Low	17 Å²	17	78.1 Å²	78.1	9%	0.089	41%	0.414	C	S	.	.	H	α-helix	trans	-55.9	-41.3	176.7	-62.9	-168.2	0	0	0	112.3	L142 L147 E150 Q154 S160 D161 L162	L142-L158 HydrophobicContact CD1-CB 4.42Å; L142-L158 HydrophobicContact CD1-CD1 4.24Å; L142-L158 HydrophobicContact CD1-CD2 3.96Å; L142-L158 HydrophobicContact CD1-CG 4.44Å; L142-L158 HydrophobicContact CD2-CD1 3.67Å; L142-L158 HydrophobicContact CD2-CD2 3.81Å; L142-L158 HydrophobicContact CD2-CG 4.36Å; L147-L158 HydrophobicContact CD2-CB 4.25Å; L147-L158 HydrophobicContact CD2-CD1 3.89Å; L147-L158 HydrophobicContact CG-CD1 4.24Å; E150-L158 WeakPolarHBondContact OE2-CD1 3.46Å; E150-L158 VanDerWaalsContact OE2-CG 3.29Å; E150-L158 WeakPolarHBondContact OE2-CG 3.39Å; Q154-L158 PolarHBondContact O-N 3.39Å; L158-S160 VanDerWaalsContact C-N 3.34Å; L158-D161 PolarHBondContact O-N 3.46Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 WeakPolarHBondContact O-CD1 3.38Å; L158-L162 VanDerWaalsContact O-CG 3.28Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 3.21Å
159	I	60.9	Low	51.9	Low	0 Å²	0	80.1 Å²	80.1	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-38.5	175.5	-72	171.6	0	0	0	111.7	L72 V79 M82 K155 F157 L163	L72-I159 HydrophobicContact CB-CG2 3.51Å; L72-I159 HydrophobicContact CD1-CG2 3.88Å; L72-I159 HydrophobicContact CG-CG2 4.28Å; V79-I159 HydrophobicContact CG2-CD1 4.21Å; M82-I159 HydrophobicContact CE-CB 4.23Å; M82-I159 HydrophobicContact CE-CD1 3.86Å; M82-I159 HydrophobicContact CE-CG1 3.68Å; M82-I159 HydrophobicContact CE-CG2 3.65Å; M82-I159 HydrophobicContact SD-CB 4.28Å; M82-I159 HydrophobicContact SD-CG1 3.82Å; M82-I159 HydrophobicContact SD-CG2 4.05Å; K155-I159 VanDerWaalsContact O-CB 3.24Å; K155-I159 WeakPolarHBondContact O-CB 3.47Å; K155-I159 VanDerWaalsContact O-CD1 3.31Å; K155-I159 WeakPolarHBondContact O-CD1 3.41Å; K155-I159 WeakPolarHBondContact O-CG1 3.47Å; K155-I159 PolarHBondContact O-N 3.46Å; F157-I159 VanDerWaalsContact C-N 3.25Å; F157-I159 PolarHBondContact O-N 2.94Å; I159-L163 HydrophobicContact CG2-CD1 4.38Å; I159-L163 WeakPolarHBondContact O-CG 3.49Å; I159-L163 PolarHBondContact O-N 2.91Å
160	S	56.9	Low	50.4	Low	24 Å²	24	79.4 Å²	79.4	17%	0.168	43%	0.429	C	S	.	.	H	α-helix	trans	-64.5	-45.6	174.2	-59.6	0	0	0	0	110.8	S69 S156 F157 L158 L163 N164	S69-S160 WeakPolarHBondContact CB-OG 3.48Å; S156-S160 WeakPolarHBondContact O-CB 3.36Å; S156-S160 PolarHBondContact O-N 2.87Å; S156-S160 VanDerWaalsContact O-N 3.14Å; S156-S160 PolarHBondContact O-OG 3.49Å; F157-S160 CarbonylContact O-C 3.56Å; F157-S160 WeakPolarHBondContact O-CA 3.42Å; F157-S160 VanDerWaalsContact O-CB 3.28Å; F157-S160 WeakPolarHBondContact O-CB 3.39Å; F157-S160 PolarHBondContact O-N 3.17Å; L158-S160 VanDerWaalsContact C-N 3.34Å; S160-L163 PolarHBondContact O-N 3.29Å; S160-N164 WeakPolarHBondContact O-CB 3.34Å; S160-N164 PolarHBondContact O-N 3.48Å; S160-N164 PolarHBondContact O-ND2 3.36Å
161	D	59.3	Low	49	Very low	74 Å²	74	86 Å²	86	40%	0.396	46%	0.46	S	S	.	.	H	α-helix	trans	-66.7	-42.2	-178.6	-75.1	2.9	0	0	0	111.9	F157 L158 L163 N164 T165	F157-D161 WeakPolarHBondContact CE1-OD2 3.33Å; F157-D161 WeakPolarHBondContact CZ-OD2 3.5Å; F157-D161 PolarHBondContact O-N 2.93Å; L158-D161 PolarHBondContact O-N 3.46Å; D161-L163 VanDerWaalsContact C-N 3.26Å; D161-L163 PolarHBondContact O-N 3.49Å; D161-N164 PolarHBondContact O-N 2.89Å; D161-T165 PolarHBondContact O-N 3.33Å
162	L	59.5	Low	47.5	Very low	33 Å²	33	86.5 Å²	86.5	17%	0.173	47%	0.471	C	S	.	.	H	α-helix	trans	-53.7	-42.2	172.7	-79	161.7	0	0	0	111.9	M82 I86 L158 T165	M82-L162 HydrophobicContact SD-CD1 4.2Å; I86-L162 HydrophobicContact CD1-CD1 4.07Å; I86-L162 HydrophobicContact CD1-CD2 4.49Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 WeakPolarHBondContact O-CD1 3.38Å; L158-L162 VanDerWaalsContact O-CG 3.28Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 3.21Å; L162-T165 PolarHBondContact O-OG1 2.92Å
163	L	54.2	Low	46.2	Very low	26 Å²	26	88.3 Å²	88.3	14%	0.136	48%	0.48	C	S	.	.	H	α-helix	trans	-80.1	-36.2	178.2	-67	171.6	0	0	0	113	L59 K63 L72 I159 S160 D161 T165	L59-L163 HydrophobicContact CD2-CD2 4.44Å; K63-L163 VanDerWaalsContact CD-O 3.24Å; K63-L163 WeakPolarHBondContact CD-O 3.44Å; K63-L163 WeakPolarHBondContact CE-O 3.38Å; K63-L163 HydrophobicContact CG-CD2 4.45Å; K63-L163 WeakPolarHBondContact CG-O 3.35Å; K63-L163 PolarHBondContact NZ-O 3.09Å; L72-L163 HydrophobicContact CD1-CD1 3.45Å; L72-L163 VanDerWaalsContact CD1-CD1 3.45Å; I159-L163 HydrophobicContact CG2-CD1 4.38Å; I159-L163 WeakPolarHBondContact O-CG 3.49Å; I159-L163 PolarHBondContact O-N 2.91Å; S160-L163 PolarHBondContact O-N 3.29Å; D161-L163 VanDerWaalsContact C-N 3.26Å; D161-L163 PolarHBondContact O-N 3.49Å; L163-T165 VanDerWaalsContact C-N 3.28Å; L163-T165 PolarHBondContact O-N 3.24Å
164	N	49.3	Very low	45.2	Very low	123 Å²	123	93 Å²	93	66%	0.658	49%	0.488	S	S	*	.	H	α-helix	trans	-84.7	9	-175	-68.8	-27.5	0	0	0	114.4	S160 D161 N166	S160-N164 WeakPolarHBondContact O-CB 3.34Å; S160-N164 PolarHBondContact O-N 3.48Å; S160-N164 PolarHBondContact O-ND2 3.36Å; D161-N164 PolarHBondContact O-N 2.89Å; N164-N166 PolarHBondContact O-N 3.36Å
165	T	38.4	Very low	43.8	Very low	55 Å²	55	95.7 Å²	95.7	34%	0.337	51%	0.505	S	S	.	.			trans	-57.9	94.1	172.6	37.3	0	0	0	0	113.1	K63 D161 L162 L163	K63-T165 PolarHBondContact NZ-O 2.76Å; K63-T165 PolarHBondContact NZ-OG1 3.08Å; D161-T165 PolarHBondContact O-N 3.33Å; L162-T165 PolarHBondContact O-OG1 2.92Å; L163-T165 VanDerWaalsContact C-N 3.28Å; L163-T165 PolarHBondContact O-N 3.24Å
166	N	32.8	Very low	42.6	Very low	123 Å²	123	97.5 Å²	97.5	66%	0.658	52%	0.524	S	S	*	.			trans	40.3	102	153.9	-58.7	-24.4	0	0	0	118.7	N164	N164-N166 PolarHBondContact O-N 3.36Å
167	D	29.1	Very low	41.6	Very low	161 Å²	161	104 Å²	104	86%	0.861	55%	0.554	S	S	*	*			trans	-140.8	59.5	143.1	-110.4	-25.8	0	0	0	107.8	N169	D167-N169 PolarHBondContact O-N 2.9Å
168	T	30.1	Very low	40.4	Very low	110 Å²	110	103.7 Å²	103.7	68%	0.675	55%	0.552	S	S	*	*			trans	-84.4	99.5	-179.1	32.9	0	0	0	0	111.8
169	N	31.1	Very low	39.1	Very low	154 Å²	154	105.9 Å²	105.9	82%	0.824	57%	0.569	S	S	*	*			trans	-100.1	94.1	153.4	-78.6	-36.7	0	0	0	108.8	D167	D167-N169 PolarHBondContact O-N 2.9Å
170	D	27.4	Very low	37.9	Very low	147 Å²	147	111.1 Å²	111.1	79%	0.786	60%	0.596	S	S	*	*	S	Bend	trans	59.7	152.9	156.2	-54.8	-38.7	0	0	0	121.4
171	E	27.6	Very low	37	Very low	186 Å²	186	114 Å²	114	87%	0.869	62%	0.616	S	S	*	*	S	Bend	trans	61.8	73.2	165.9	-54.6	-164.8	148.3	0	0	119.9
172	C	27.7	Very low	35.9	Very low	125 Å²	125	117.2 Å²	117.2	85%	0.845	63%	0.63	S	S	*	*			trans	-177.2	24.6	139.1	-100.7	0	0	0	0	119.2	E174	C172-E174 PolarHBondContact O-N 2.9Å
173	E	29.5	Very low	35	Very low	177 Å²	177	123.7 Å²	123.7	83%	0.827	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-71.8	-23.2	-167.1	-80.8	-170.4	141.3	0	0	118.5	N175	E173-N175 PolarHBondContact O-N 3.34Å
174	E	35.4	Very low	34.4	Very low	148 Å²	148	129.7 Å²	129.7	69%	0.692	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-82.1	-8	-161.3	-142.3	-149.2	122.2	0	0	117	C172 K178	C172-E174 PolarHBondContact O-N 2.9Å; E174-K178 PolarHBondContact O-NZ 3.34Å; E174-K178 IonicContact OE1-NZ 2.64Å; E174-K178 PolarHBondContact OE1-NZ 2.86Å
175	N	32.2	Very low	34	Very low	132 Å²	132	130.3 Å²	130.3	71%	0.706	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-102.3	-21.4	-171	-79.9	-35.3	0	0	0	115.3	E173	E173-N175 PolarHBondContact O-N 3.34Å
176	S	35.7	Very low	34.2	Very low	85 Å²	85	133.3 Å²	133.3	59%	0.594	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-47.3	-174.6	-167.2	0	0	0	0	112.8	K178 S179	S176-K178 VanDerWaalsContact C-N 3.28Å; S176-K178 PolarHBondContact O-N 2.83Å; S176-K178 VanDerWaalsContact O-N 3.16Å; S176-S179 WeakPolarHBondContact O-CB 3.5Å; S176-S179 PolarHBondContact O-N 2.94Å; S176-S179 VanDerWaalsContact O-N 3.1Å; S176-S179 PolarHBondContact O-OG 3.04Å
177	M	35.2	Very low	34.5	Very low	161 Å²	161	136.6 Å²	136.6	79%	0.793	70%	0.702	S	S	*	*	H	α-helix	trans	-60.2	-31.3	-173.3	-66.9	-165.3	-176.5	0	0	114.4	S179 I180	M177-S179 PolarHBondContact O-N 2.77Å; M177-I180 PolarHBondContact O-N 3.46Å
178	K	35.5	Very low	35.2	Very low	116 Å²	116	133.1 Å²	133.1	50%	0.504	69%	0.691	S	S	.	*	H	α-helix	trans	-65	-25.4	-179.8	-68.2	166.5	-174.2	133.9	0	112.6	E174 S176	E174-K178 PolarHBondContact O-NZ 3.34Å; E174-K178 IonicContact OE1-NZ 2.64Å; E174-K178 PolarHBondContact OE1-NZ 2.86Å; S176-K178 VanDerWaalsContact C-N 3.28Å; S176-K178 PolarHBondContact O-N 2.83Å; S176-K178 VanDerWaalsContact O-N 3.16Å
179	S	33.2	Very low	35.6	Very low	63 Å²	63	134.1 Å²	134.1	44%	0.441	69%	0.688	S	S	.	*	H	α-helix	trans	-73.5	-30	-178	72.7	0	0	0	0	114.2	S176 M177	S176-S179 WeakPolarHBondContact O-CB 3.5Å; S176-S179 PolarHBondContact O-N 2.94Å; S176-S179 VanDerWaalsContact O-N 3.1Å; S176-S179 PolarHBondContact O-OG 3.04Å; M177-S179 PolarHBondContact O-N 2.77Å
180	I	36	Very low	36	Very low	110 Å²	110	135.4 Å²	135.4	56%	0.564	69%	0.689	S	S	*	*	H	α-helix	trans	-76.6	-42.9	-174.9	-63.5	174.5	0	0	0	110.4	M177 M182 K183 Q184	M177-I180 PolarHBondContact O-N 3.46Å; I180-M182 VanDerWaalsContact C-N 3.31Å; I180-M182 PolarHBondContact O-N 3.13Å; I180-K183 PolarHBondContact O-N 3.29Å; I180-K183 VanDerWaalsContact O-N 3.16Å; I180-Q184 PolarHBondContact O-N 3.27Å
181	S	37.5	Very low	36.4	Very low	85 Å²	85	136.1 Å²	136.1	59%	0.594	69%	0.693	S	S	*	*	H	α-helix	trans	-61.7	-35	179	-173.1	0	0	0	0	112.9
182	M	36.6	Very low	36.9	Very low	142 Å²	142	135.6 Å²	135.6	70%	0.7	69%	0.69	S	S	*	*	H	α-helix	trans	-66.4	-39.7	174.1	-92.6	-174.8	167.1	0	0	113.3	I180 Q184 K185 I186	I180-M182 VanDerWaalsContact C-N 3.31Å; I180-M182 PolarHBondContact O-N 3.13Å; M182-Q184 VanDerWaalsContact C-N 3.32Å; M182-Q184 PolarHBondContact O-N 3.23Å; M182-K185 PolarHBondContact O-N 3.49Å; M182-K185 VanDerWaalsContact O-N 3.13Å; M182-I186 PolarHBondContact O-N 3.37Å
183	K	41	Very low	37.2	Very low	168 Å²	168	140 Å²	140	73%	0.73	70%	0.695	S	S	*	*	H	α-helix	trans	-70.2	-26.1	-177.4	-77.1	-177.8	175.8	176.4	0	113.6	I180	I180-K183 PolarHBondContact O-N 3.29Å; I180-K183 VanDerWaalsContact O-N 3.16Å
184	Q	42	Very low	37.4	Very low	153 Å²	153	136.2 Å²	136.2	72%	0.715	69%	0.688	S	S	*	*	H	α-helix	trans	-75.1	-24.1	171.5	-75.4	-179.1	-32.3	0	0	113.2	I180 M182	I180-Q184 PolarHBondContact O-N 3.27Å; M182-Q184 VanDerWaalsContact C-N 3.32Å; M182-Q184 PolarHBondContact O-N 3.23Å
185	K	40.4	Very low	37.3	Very low	136 Å²	136	136.2 Å²	136.2	59%	0.591	69%	0.693	S	S	*	*	H	α-helix	trans	-83.7	-28.5	-177.8	-157	-173	176.5	-155.1	0	114.1	M182 K187 S188	M182-K185 PolarHBondContact O-N 3.49Å; M182-K185 VanDerWaalsContact O-N 3.13Å; K185-K187 VanDerWaalsContact C-N 3.3Å; K185-K187 PolarHBondContact O-N 2.95Å; K185-S188 PolarHBondContact O-OG 2.83Å
186	I	42.2	Very low	37.5	Very low	118 Å²	118	138.6 Å²	138.6	61%	0.605	70%	0.7	S	S	*	*	H	α-helix	trans	-72.9	-23.2	-177.9	-66.8	166.4	0	0	0	111.9	M182 S188	M182-I186 PolarHBondContact O-N 3.37Å; I186-S188 VanDerWaalsContact C-N 3.26Å; I186-S188 PolarHBondContact O-N 3.5Å
187	K	40	Very low	37.3	Very low	192 Å²	192	139.9 Å²	139.9	84%	0.835	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	25.4	-177.2	-149.5	174.3	-177.9	179.6	0	114.1	K185	K185-K187 VanDerWaalsContact C-N 3.3Å; K185-K187 PolarHBondContact O-N 2.95Å
188	S	42.1	Very low	37.4	Very low	88 Å²	88	140.7 Å²	140.7	62%	0.615	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.1	16.1	-178.6	53.2	0	0	0	0	113.9	K185 I186	K185-S188 PolarHBondContact O-OG 2.83Å; I186-S188 VanDerWaalsContact C-N 3.26Å; I186-S188 PolarHBondContact O-N 3.5Å
189	E	39.3	Very low	37.1	Very low	130 Å²	130	143.1 Å²	143.1	61%	0.607	73%	0.727	S	S	*	*	S	Bend	trans	-124.5	8	-174.7	-67.1	-178	165.4	0	0	113.9
190	E	39	Very low	37.2	Very low	182 Å²	182	145.7 Å²	145.7	85%	0.85	75%	0.746	S	S	*	*	S	Bend	trans	-91.5	-18.4	177.2	-69.3	-174.6	125.9	0	0	114.4	Q192	E190-Q192 VanDerWaalsContact C-N 3.27Å; E190-Q192 PolarHBondContact O-N 3Å; E190-Q192 VanDerWaalsContact O-N 3.1Å
191	D	36.4	Very low	37	Very low	162 Å²	162	149.6 Å²	149.6	87%	0.866	76%	0.759	S	S	*	*	S	Bend	trans	-85.3	52.1	175.8	-78.2	-47.7	0	0	0	112.8
192	Q	37.4	Very low	36.8	Very low	174 Å²	174	151.6 Å²	151.6	81%	0.813	77%	0.769	S	S	*	*			trans	-168.4	93.1	170.4	-118.6	157.6	106.3	0	0	114	E190	E190-Q192 VanDerWaalsContact C-N 3.27Å; E190-Q192 PolarHBondContact O-N 3Å; E190-Q192 VanDerWaalsContact O-N 3.1Å
193	F	35.7	Very low	36.7	Very low	219 Å²	219	153.6 Å²	153.6	96%	0.961	78%	0.777	S	S	*	*			trans	-168.1	137.8	139.9	-113	-70.5	0	0	0	111.7
194	S	32.5	Very low	36.1	Very low	96 Å²	96	152.6 Å²	152.6	67%	0.671	78%	0.775	S	S	*	*			trans	-128.4	157.7	-171.7	-47.1	0	0	0	0	113.5
195	D	33.8	Very low	35.6	Very low	148 Å²	148	151.5 Å²	151.5	79%	0.791	77%	0.773	S	S	*	*			trans	73.9	158	152.1	-57	-38.6	0	0	0	121.5
196	Q	35.3	Very low	35.3	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	78%	0.778	S	S	*	*			trans	83	98.1	178.1	-53.5	178.7	42	0	0	114.7
197	S	32.1	Very low	34.8	Very low	111 Å²	111	154 Å²	154	78%	0.776	78%	0.784	S	S	*	*			cis	77.4	117.3	47.8	-49.6	0	0	0	0	115.4
198	I	36.7	Very low	34.5	Very low	179 Å²	179	148.8 Å²	148.8	92%	0.918	77%	0.772	S	S	*	*				174.4	154.3	129.5	-90.3	157.9	0	0	0	111.4
199	E	29.3	Very low	34.1	Very low	166 Å²	166	154 Å²	154	78%	0.776	78%	0.784	S	S	*	*			trans	-123.8	143.5	-167.7	174.3	-160.8	160.1	0	0	111.3
200	S	36.2	Very low	33.7	Very low	118 Å²	118	153 Å²	153	83%	0.825	79%	0.791	S	S	*	*			trans	-173.1	116	154	-88.5	0	0	0	0	118.2
201	K	32.6	Very low	33.6	Very low	192 Å²	192	149.9 Å²	149.9	84%	0.835	79%	0.787	S	S	*	*			trans	11.6	145	145.8	-66.9	171.4	179.7	167.7	0	124.3
202	P	33.3	Very low	33.3	Very low	126 Å²	126	149.6 Å²	149.6	82%	0.818	79%	0.785	S	S	*	*			trans	-107.4	155.7	164.9	39.9	-32.6	0	0	0	115.9
203	Q	32.8	Very low	33.3	Very low	184 Å²	184	147 Å²	147	86%	0.86	78%	0.783	S	S	*	*			trans	-162.7	159.8	167.4	-89.1	-178.3	-34.2	0	0	108.3
204	Q	28.8	Very low	33	Very low	147 Å²	147	142 Å²	142	69%	0.687	77%	0.771	S	S	*	*			cis	-178.6	167.6	-23.2	-168.9	-177.5	57.9	0	0	107.7
205	L	32.1	Very low	32.7	Very low	130 Å²	130	144.6 Å²	144.6	68%	0.681	78%	0.776	S	S	*	*			trans	103.8	134.7	150.1	-59.3	166	0	0	0	123.4
206	H	34.5	Very low	32.7	Very low	150 Å²	150	147.1 Å²	147.1	69%	0.694	78%	0.783	S	S	*	*			trans	58.2	146	148.8	-69.6	-67.3	0	0	0	122.8
207	E	31.2	Very low	32.1	Very low	156 Å²	156	143.3 Å²	143.3	73%	0.729	78%	0.777	S	S	*	*			cis	-171.9	159	-27.1	-147	179.9	169.2	0	0	114.4
208	S	33.1	Very low	32.1	Very low	84 Å²	84	146.6 Å²	146.6	59%	0.587	78%	0.783	S	S	*	*			trans	106.4	119.9	135	81.9	0	0	0	0	123.9
209	K	34.5	Very low	31.6	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	77%	0.77	S	S	*	*			trans	70.8	130.3	145.5	-60.2	153.5	-172.2	166.3	0	119.8
210	S	30.9	Very low	31.8	Very low	109 Å²	109	143.7 Å²	143.7	76%	0.762	77%	0.772	S	S	*	*			cis	92.4	143.8	21.1	-170.2	0	0	0	0	115.3
211	P	37.6	Very low	31.6	Very low	118 Å²	118	144.7 Å²	144.7	77%	0.766	77%	0.768	S	S	*	*			cis	-135.5	-174.8	-10	33	-10.6	0	0	0	117
212	N	28.8	Very low	31.7	Very low	156 Å²	156	140.5 Å²	140.5	83%	0.834	76%	0.76	S	S	*	*			trans	-75.6	160.9	169.1	-96.3	-17.5	0	0	0	115.1
213	P	38.6	Very low	31.5	Very low	118 Å²	118	139.4 Å²	139.4	77%	0.766	76%	0.756	S	S	*	*				-142.9	172.8	116.5	39.5	-27.7	0	0	0	113.4
214	T	29	Very low	31.5	Very low	116 Å²	116	140.9 Å²	140.9	71%	0.712	76%	0.76	S	S	*	*			cis	163.3	110.4	-27.6	-80.3	0	0	0	0	106.1
215	I	27	Very low	31.6	Very low	150 Å²	150	140.8 Å²	140.8	77%	0.769	76%	0.762	S	S	*	*			trans	44.2	120.9	149	-53.4	169.8	0	0	0	119.6
216	Q	31.7	Very low	31.7	Very low	201 Å²	201	143.8 Å²	143.8	94%	0.939	77%	0.77	S	S	*	*				-152.9	149.2	128.9	-117.3	172.6	28.2	0	0	113
217	S	24.1	Very low	31.6	Very low	103 Å²	103	141.1 Å²	141.1	72%	0.72	77%	0.768	S	S	*	*			trans	-122.5	150.5	-171.2	54.3	0	0	0	0	112
218	I	31.8	Very low	31.7	Very low	179 Å²	179	142.4 Å²	142.4	92%	0.918	77%	0.772	S	S	*	*			trans	-151.1	149.9	159.3	-97.1	136.8	0	0	0	109
219	N	26.3	Very low	31.8	Very low	118 Å²	118	145.5 Å²	145.5	63%	0.631	78%	0.776	S	S	*	*			trans	-126.5	145.8	-173.6	167.9	22	0	0	0	108.8
220	M	33.9	Very low	31.6	Very low	166 Å²	166	142.7 Å²	142.7	82%	0.818	77%	0.771	S	S	*	*			trans	-172.9	108.1	142.2	-87.6	-33.6	163.4	0	0	113.5
221	N	30.7	Very low	31.7	Very low	139 Å²	139	142.7 Å²	142.7	74%	0.743	77%	0.771	S	S	*	*				36.7	161.6	128.6	-81.8	-16	0	0	0	125.1
222	P	35.8	Very low	31.2	Very low	105 Å²	105	141 Å²	141	68%	0.682	76%	0.762	S	S	*	*			trans	-131.4	-173.7	-149.7	45.1	-29.9	0	0	0	117.5
223	S	29	Very low	31.2	Very low	103 Å²	103	143.9 Å²	143.9	72%	0.72	76%	0.763	S	S	*	*			trans	82.5	134.7	151.3	77.8	0	0	0	0	120.8
224	F	32.4	Very low	30.6	Very low	215 Å²	215	143.6 Å²	143.6	94%	0.943	76%	0.764	S	S	*	*			trans	-159.5	162.9	143.8	-118.3	-78.9	0	0	0	110.7
225	I	30.2	Very low	30.5	Very low	144 Å²	144	146.7 Å²	146.7	74%	0.738	77%	0.768	S	S	*	*			trans	-133.2	140.4	-157.8	-58.9	166.4	0	0	0	112.9
226	K	34.5	Very low	30.5	Very low	193 Å²	193	145.8 Å²	145.8	84%	0.839	76%	0.764	S	S	*	*			trans	156.7	155.3	143.8	-88.7	157.5	-173.9	175.9	0	111.6
227	S	32.1	Very low	30.3	Very low	95 Å²	95	144.3 Å²	144.3	66%	0.664	76%	0.757	S	S	*	*			cis	178.4	158.7	-27.4	56	0	0	0	0	109.8
228	K	34.7	Very low	30.5	Very low	183 Å²	183	146.7 Å²	146.7	80%	0.796	76%	0.761	S	S	*	*			trans	80.3	144.9	170.8	-63.1	-173.3	178.4	-174	0	117.3
229	Q	35	Very low	30.3	Very low	148 Å²	148	143.9 Å²	143.9	69%	0.692	75%	0.752	S	S	*	*			cis	-166.2	158.1	-26.4	-133.8	170.8	-26.8	0	0	110.8
230	N	30.2	Very low	30.5	Very low	138 Å²	138	146.4 Å²	146.4	74%	0.738	76%	0.76	S	S	*	*			trans	67.9	142.1	166.9	-52.4	-9.3	0	0	0	117.3
231	S	31.6	Very low	30.1	Very low	108 Å²	108	145.5 Å²	145.5	76%	0.755	76%	0.757	S	S	*	*			cis	-158.5	136	-18.7	47.6	0	0	0	0	112.3
232	S	27.6	Very low	30.3	Very low	84 Å²	84	148.7 Å²	148.7	59%	0.587	77%	0.765	S	S	*	*			trans	-30.3	156.9	158.9	51.3	0	0	0	0	117
233	Y	28.4	Very low	29.8	Very low	215 Å²	215	151.8 Å²	151.8	84%	0.843	78%	0.775	S	S	*	*			cis	-144.6	142.2	36.8	-83.5	-92.8	0	0	0	115.9
234	S	26.1	Very low	29.8	Very low	113 Å²	113	152 Å²	152	79%	0.79	78%	0.777	S	S	*	*			trans	-142.2	132.3	140.9	176.8	0	0	0	0	106.6
235	F	27.8	Very low	29.6	Very low	181 Å²	181	147.5 Å²	147.5	79%	0.794	77%	0.767	S	S	*	*			trans	-150.5	129.6	174.2	-143.7	-91.1	0	0	0	111.7
236	N	26.4	Very low	29.5	Very low	130 Å²	130	149.2 Å²	149.2	70%	0.695	77%	0.77	S	S	*	*			trans	-99.7	147.3	176	-101.4	-42.6	0	0	0	109.9
237	Q	28.1	Very low	29	Very low	171 Å²	171	146.9 Å²	146.9	80%	0.799	77%	0.766	S	S	*	*			trans	68.7	161.9	154.4	-63.8	168.1	-0.1	0	0	119.5
238	I	28.3	Very low	28.9	Very low	153 Å²	153	150.9 Å²	150.9	79%	0.785	77%	0.768	S	S	*	*			trans	102.2	75.6	175.7	-56.2	173.2	0	0	0	112.7
239	T	27.9	Very low	28.4	Very low	119 Å²	119	150 Å²	150	73%	0.73	77%	0.767	S	S	*	*				89.4	110.7	83.4	-68	0	0	0	0	112.9
240	Q	29	Very low	28	Very low	171 Å²	171	149.3 Å²	149.3	80%	0.799	77%	0.766	S	S	*	*			trans	-172.6	122.3	131.5	-105.4	164.9	84.8	0	0	114
241	L	27	Very low	27.7	Very low	147 Å²	147	149.3 Å²	149.3	77%	0.77	77%	0.765	S	S	*	*			trans	48.2	98	136.3	-56.9	170.9	0	0	0	119.6
242	K	33.5	Very low	27.4	Very low	206 Å²	206	152.6 Å²	152.6	90%	0.896	77%	0.768	S	S	*	*				-176.7	111.3	105.8	-99.4	168.3	-178	-179.8	0	112.5
243	N	25.4	Very low	27.3	Very low	170 Å²	170	153.6 Å²	153.6	91%	0.909	78%	0.775	S	S	*	*			trans	-83.7	130	160.3	-70.8	-9.4	0	0	0	108.9
244	S	29.4	Very low	27.2	Very low	108 Å²	108	148.6 Å²	148.6	76%	0.755	77%	0.768	S	S	*	*			trans	-160.8	90.1	155.1	-174.4	0	0	0	0	110.8
245	T	27.6	Very low	27.3	Very low	120 Å²	120	149.6 Å²	149.6	74%	0.736	76%	0.764	S	S	*	*				29	119.3	122.6	-46.5	0	0	0	0	118.2
246	F	29	Very low	27.3	Very low	180 Å²	180	147.7 Å²	147.7	79%	0.789	76%	0.762	S	S	*	*				-151.7	114.1	128.2	-136.2	-99.1	0	0	0	111.9	Y248	F246-Y248 HydrophobicContact CD1-CD2 4.15Å; F246-Y248 AromaticContact CE1-CD2 3.5Å; F246-Y248 HydrophobicContact CE1-CD2 3.5Å; F246-Y248 VanDerWaalsContact CE1-CD2 3.5Å; F246-Y248 HydrophobicContact CE1-CE2 4.31Å; F246-Y248 HydrophobicContact CE1-CG 4.3Å; F246-Y248 AromaticContact CZ-CD2 3.84Å; F246-Y248 HydrophobicContact CZ-CD2 3.84Å; F246-Y248 HydrophobicContact CZ-CE2 4.21Å
247	N	24	Very low	27.4	Very low	144 Å²	144	145 Å²	145	77%	0.77	76%	0.758	S	S	*	*			trans	-118.4	118.3	169.9	-108	-10.3	0	0	0	107
248	Y	28.9	Very low	27.5	Very low	179 Å²	179	145 Å²	145	70%	0.702	76%	0.758	S	S	*	*			trans	-168.1	124.9	166.7	-89.6	-77.3	0	0	0	105.7	F246 I250	F246-Y248 HydrophobicContact CD1-CD2 4.15Å; F246-Y248 AromaticContact CE1-CD2 3.5Å; F246-Y248 HydrophobicContact CE1-CD2 3.5Å; F246-Y248 VanDerWaalsContact CE1-CD2 3.5Å; F246-Y248 HydrophobicContact CE1-CE2 4.31Å; F246-Y248 HydrophobicContact CE1-CG 4.3Å; F246-Y248 AromaticContact CZ-CD2 3.84Å; F246-Y248 HydrophobicContact CZ-CD2 3.84Å; F246-Y248 HydrophobicContact CZ-CE2 4.21Å; Y248-I250 HydrophobicContact CD1-CD1 4.46Å
249	Q	25.4	Very low	27.4	Very low	166 Å²	166	142.4 Å²	142.4	78%	0.776	75%	0.749	S	S	*	*			cis	79	144	14.5	-149.1	159.6	9.2	0	0	115.6
250	I	25.7	Very low	27.4	Very low	132 Å²	132	143.8 Å²	143.8	68%	0.677	75%	0.751	S	S	*	*			trans	83.7	110.9	-164.8	-52.5	163.6	0	0	0	111.1	Y248	Y248-I250 HydrophobicContact CD1-CD1 4.46Å
251	I	24.2	Very low	27.3	Very low	138 Å²	138	141.3 Å²	141.3	71%	0.708	74%	0.743	S	S	*	*			cis	94.1	143.8	34.9	-55.3	160.7	0	0	0	112.7
252	Q	25.8	Very low	27.5	Very low	177 Å²	177	141.1 Å²	141.1	83%	0.827	74%	0.743	S	S	*	*			trans	90.5	141.5	174.8	-53.3	-159.2	20.6	0	0	116.9
253	S	25.3	Very low	27.1	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	74%	0.742	S	S	*	*			cis	-160.8	159.7	-9.6	44.1	0	0	0	0	114.2
254	T	27.1	Very low	27.6	Very low	111 Å²	111	138.1 Å²	138.1	68%	0.681	73%	0.726	S	S	*	*			trans	-57.8	153.4	177.6	50.1	0	0	0	0	118
255	N	28.2	Very low	27.6	Very low	134 Å²	134	139.3 Å²	139.3	72%	0.717	72%	0.723	S	S	*	*				173.2	133.1	117.9	-86.3	-38.1	0	0	0	110.1
256	N	26.8	Very low	27.9	Very low	141 Å²	141	142.3 Å²	142.3	75%	0.754	73%	0.726	S	S	*	*				65.2	130.7	67.3	-73.7	-26.8	0	0	0	112.9
257	A	28.9	Very low	27.9	Very low	74 Å²	74	139.3 Å²	139.3	61%	0.612	72%	0.722	S	S	*	*			cis	-161.4	163.3	10.8	0	0	0	0	0	113.6
258	H	29.1	Very low	28.2	Very low	170 Å²	170	137.3 Å²	137.3	79%	0.787	72%	0.718	S	S	*	*			trans	58.7	153.7	132.6	-75.3	31.3	0	0	0	120.9
259	T	27.8	Very low	28.4	Very low	99 Å²	99	137.9 Å²	137.9	61%	0.607	72%	0.724	S	S	*	*			cis	-175.9	171.2	-16.7	29.8	0	0	0	0	107.1
260	I	27.3	Very low	28.7	Very low	148 Å²	148	142.1 Å²	142.1	76%	0.759	73%	0.733	S	S	*	*			trans	72.2	133.2	153.7	-73.8	155.7	0	0	0	115.1
261	N	27.6	Very low	28.9	Very low	119 Å²	119	146.3 Å²	146.3	64%	0.636	74%	0.74	S	S	*	*			cis	-164.4	174	-4.1	-126.2	32.2	0	0	0	113.4
262	D	30.8	Very low	29.4	Very low	143 Å²	143	148 Å²	148	77%	0.765	75%	0.75	S	S	*	*			trans	77.8	135.8	147.3	-62.6	-37.4	0	0	0	123.9
263	Y	25.7	Very low	29.6	Very low	222 Å²	222	143.9 Å²	143.9	87%	0.871	74%	0.737	S	S	*	*			trans	-101.6	-174.3	-172.5	-110.6	-135.2	0	0	0	109.5
264	P	35.8	Very low	29.9	Very low	90 Å²	90	145.4 Å²	145.4	58%	0.584	74%	0.737	S	S	*	*			cis	-152	-160.8	-37.3	43.7	-24.5	0	0	0	116.1
265	I	27.9	Very low	30.3	Very low	133 Å²	133	149.8 Å²	149.8	68%	0.682	75%	0.747	S	S	*	*			trans	68.8	112.4	150.5	-68	166.4	0	0	0	118.9
266	K	35.2	Very low	30.4	Very low	184 Å²	184	149.2 Å²	149.2	80%	0.8	75%	0.748	S	S	*	*				-179.3	105.8	107.3	-114.4	130.1	-162.4	167.3	0	116.5
267	T	29.1	Very low	30.8	Very low	116 Å²	116	149.9 Å²	149.9	71%	0.712	75%	0.75	S	S	*	*			trans	27.4	120.8	132.6	53.1	0	0	0	0	123.7
268	C	29.3	Very low	30.9	Very low	103 Å²	103	153.9 Å²	153.9	70%	0.696	76%	0.756	S	S	*	*				80.3	130.8	120.4	-82.1	0	0	0	0	124.8
269	K	32.6	Very low	31.2	Very low	191 Å²	191	152.1 Å²	152.1	83%	0.83	76%	0.757	S	S	*	*			trans	69.4	119.4	134	-67.1	172.1	-177.7	175.7	0	120
270	R	32.9	Very low	31.2	Very low	255 Å²	255	151.9 Å²	151.9	96%	0.962	76%	0.756	S	S	*	*				-142.4	151.2	106.8	-116.7	176.6	-179.7	113.2	-1.8	111.8
271	R	28.5	Very low	31.6	Very low	219 Å²	219	153.2 Å²	153.2	83%	0.826	76%	0.759	S	S	*	*			trans	-123.6	137.7	-178	175.7	-179.6	-178.4	158.5	0.3	107.4	T273	R271-T273 HydrophobicContact CG-CG2 4.26Å
272	L	35.2	Very low	31.8	Very low	175 Å²	175	154.4 Å²	154.4	92%	0.916	76%	0.76	S	S	*	*			trans	-131.6	141.2	164.6	-78.4	173.1	0	0	0	108.2
273	T	30.3	Very low	31.8	Very low	90 Å²	90	152.6 Å²	152.6	55%	0.552	75%	0.75	S	S	*	*			trans	-133.8	-176.8	177.7	55.2	0	0	0	0	109.1	R271	R271-T273 HydrophobicContact CG-CG2 4.26Å
274	D	31.6	Very low	32.1	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	74%	0.742	S	S	*	*			trans	80.2	109.6	164.8	-48.3	4.3	0	0	0	116.2
275	K	35	Very low	31.7	Very low	202 Å²	202	156.2 Å²	156.2	88%	0.878	76%	0.755	S	S	*	*				-163.8	130.3	101.3	-100.9	155.2	-172	172.6	0	113.7
276	T	30.2	Very low	31.7	Very low	122 Å²	122	154.5 Å²	154.5	75%	0.748	76%	0.755	S	S	*	*			trans	-72.1	139.8	170.9	-49	0	0	0	0	111	Q278	T276-Q278 HydrophobicContact CG2-CG 4.38Å
277	I	35.4	Very low	31.3	Very low	155 Å²	155	156.1 Å²	156.1	80%	0.795	76%	0.756	S	S	*	*			trans	-129.9	117.6	153.9	-64	-176.9	0	0	0	108.3	V279	I277-V279 HydrophobicContact CG2-CG2 4.37Å
278	Q	31.4	Very low	31.3	Very low	158 Å²	158	157.3 Å²	157.3	74%	0.738	75%	0.754	S	S	*	*			trans	-88.9	144.9	162.7	-67.9	174.1	-51.7	0	0	109	T276	T276-Q278 HydrophobicContact CG2-CG 4.38Å
279	V	34.8	Very low	31.2	Very low	133 Å²	133	158.8 Å²	158.8	81%	0.806	75%	0.753	S	S	*	*			trans	-131.6	123.5	152.8	178.5	0	0	0	0	107.3	I277	I277-V279 HydrophobicContact CG2-CG2 4.37Å
280	T	29	Very low	31.2	Very low	95 Å²	95	156.7 Å²	156.7	58%	0.583	75%	0.751	S	S	*	*			trans	-126.5	124.6	-173.3	48.1	0	0	0	0	111.9
281	H	36.2	Very low	31	Very low	176 Å²	176	151.5 Å²	151.5	82%	0.815	74%	0.743	S	S	*	*			trans	-145.7	114.8	161.6	-85.2	-84	0	0	0	104.9
282	Q	31.2	Very low	31	Very low	143 Å²	143	152.9 Å²	152.9	67%	0.668	75%	0.748	S	S	*	*			cis	50.7	117.5	44.7	-57	-157.9	18.1	0	0	111.9
283	N	31.6	Very low	31	Very low	105 Å²	105	148.6 Å²	148.6	56%	0.561	73%	0.731	S	S	*	*			cis	-156.8	145.4	35.5	-100.2	-69.4	0	0	0	113.8
284	K	30.6	Very low	30.9	Very low	161 Å²	161	154.4 Å²	154.4	70%	0.7	74%	0.744	S	S	*	*			trans	43.3	137	131	-62.1	174.9	-176.6	119.1	0	122.3
285	R	28.7	Very low	30.7	Very low	228 Å²	228	151.9 Å²	151.9	86%	0.86	74%	0.737	S	S	*	*			trans	70.8	158.5	145.5	-71.2	170.3	174.7	-178.2	-3.3	117.3
286	S	27.5	Very low	30.7	Very low	97 Å²	97	149.7 Å²	149.7	68%	0.678	73%	0.734	S	S	*	*			cis	-173.1	131.9	-31	-96.3	0	0	0	0	109.2
287	R	27.3	Very low	30.7	Very low	217 Å²	217	150.9 Å²	150.9	82%	0.819	74%	0.735	S	S	*	*			trans	62.1	156.1	156.3	-63	-166.9	-176.4	176	-3.2	119.9
288	E	27.9	Very low	30.4	Very low	141 Å²	141	148 Å²	148	66%	0.659	73%	0.729	S	S	*	*			trans	71.9	111.3	148.1	-74.2	153	-124.3	0	0	121
289	I	28	Very low	30.5	Very low	135 Å²	135	145.8 Å²	145.8	69%	0.692	73%	0.726	S	S	*	*				57.3	106.8	127.4	-50.7	164.8	0	0	0	117.3
290	N	32.8	Very low	30.4	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	73%	0.726	S	S	*	*				-173.5	149.9	109.1	-101.2	-65.9	0	0	0	112.8
291	N	28.3	Very low	30.5	Very low	146 Å²	146	151.2 Å²	151.2	78%	0.781	74%	0.738	S	S	*	*			trans	-72.3	171.4	162.9	-71.3	-37.8	0	0	0	110.5
292	W	28.5	Very low	30.4	Very low	248 Å²	248	148.1 Å²	148.1	94%	0.939	73%	0.733	S	S	*	*				-168.7	156.5	118.9	-110.5	55.5	0	0	0	112.1
293	P	35	Very low	30.5	Very low	85 Å²	85	149.3 Å²	149.3	55%	0.552	74%	0.736	S	S	*	*			trans	-134.1	-161.9	-150.8	25.6	1	0	0	0	115.4
294	Y	27.7	Very low	30.6	Very low	211 Å²	211	149.2 Å²	149.2	83%	0.827	74%	0.736	S	S	*	*			trans	75.2	154.8	169.7	-66.6	-95.8	0	0	0	117.6
295	S	28.5	Very low	30.5	Very low	85 Å²	85	147.9 Å²	147.9	59%	0.594	74%	0.736	S	S	*	*			cis	-174.4	-168.7	-28.3	62	0	0	0	0	110.8
296	L	33.5	Very low	30.7	Very low	155 Å²	155	144.8 Å²	144.8	81%	0.812	74%	0.736	S	S	*	*			trans	78.5	141.7	177.9	-48	173.8	0	0	0	113.7
297	L	31.3	Very low	30.6	Very low	147 Å²	147	148.9 Å²	148.9	77%	0.77	74%	0.742	S	S	*	*			cis	-145.5	120.5	14	-160	72.2	0	0	0	108.2
298	S	28.4	Very low	30.9	Very low	96 Å²	96	145.6 Å²	145.6	67%	0.671	74%	0.737	S	S	*	*				48	132.6	89	-121.4	0	0	0	0	115
299	T	33.7	Very low	30.9	Very low	110 Å²	110	143.9 Å²	143.9	68%	0.675	73%	0.732	S	S	*	*			cis	-154	147.2	27.8	53.3	0	0	0	0	115.3
300	K	33.9	Very low	31.1	Very low	183 Å²	183	143.8 Å²	143.8	80%	0.796	73%	0.732	S	S	*	*			trans	43.6	150.8	131.4	-52.1	176.6	-178.5	178.2	0	120.9
301	L	30.3	Very low	31.1	Very low	159 Å²	159	144.6 Å²	144.6	83%	0.832	73%	0.731	S	S	*	*			cis	-141.7	167	23.8	-88.5	91.5	0	0	0	113.4
302	P	34.7	Very low	31.3	Very low	112 Å²	112	142.9 Å²	142.9	73%	0.727	73%	0.726	S	S	*	*			trans	-115.6	-162.6	175.6	40.7	-26.7	0	0	0	114.1
303	K	31.9	Very low	31.6	Very low	168 Å²	168	137.5 Å²	137.5	73%	0.73	72%	0.716	S	S	*	*			trans	101.3	149.8	168.1	-64.6	175.1	154.2	-84.8	0	116.6
304	D	33.9	Very low	31.6	Very low	103 Å²	103	141.4 Å²	141.4	55%	0.551	73%	0.727	S	S	*	*			cis	-163.1	141.2	-7.8	-104.8	-18.9	0	0	0	112.1
305	N	28	Very low	31.7	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	73%	0.726	S	S	*	*			trans	62	159.7	140.4	-57.9	-44	0	0	0	126
306	L	32.9	Very low	32	Very low	163 Å²	163	140.2 Å²	140.2	85%	0.853	73%	0.734	S	S	*	*			trans	77	117.7	166.6	-57.6	158.9	0	0	0	116.4
307	K	27.4	Very low	31.7	Very low	183 Å²	183	138.9 Å²	138.9	80%	0.796	73%	0.732	S	S	*	*			cis	89.9	147.7	19.4	-155.9	175.9	-176.6	179.1	0	115.6
308	M	32.2	Very low	31.7	Very low	147 Å²	147	142 Å²	142	72%	0.724	73%	0.733	S	S	*	*			trans	89.6	143.7	178.3	-49.9	-62.5	-75.5	0	0	115.6
309	N	28.3	Very low	31.9	Very low	105 Å²	105	144.3 Å²	144.3	56%	0.561	73%	0.734	S	S	*	*			cis	-177.5	135.7	-33.1	-112.4	25.4	0	0	0	109.8
310	I	32.1	Very low	31.6	Very low	133 Å²	133	147.6 Å²	147.6	68%	0.682	74%	0.741	S	S	*	*			trans	67	166.9	140.3	-62	178	0	0	0	114.7
311	E	32.8	Very low	31.4	Very low	164 Å²	164	148.1 Å²	148.1	77%	0.766	75%	0.746	S	S	*	*			cis	-146.5	146.4	17.3	-139.5	132.1	-129	0	0	112.7
312	T	33.2	Very low	31.3	Very low	110 Å²	110	148.7 Å²	148.7	68%	0.675	75%	0.745	S	S	*	*			trans	14	167	145.6	68.2	0	0	0	0	123.7
313	D	33.2	Very low	31.1	Very low	136 Å²	136	151.5 Å²	151.5	73%	0.727	75%	0.748	S	S	*	*			cis	-164.5	163.7	38.2	-101.9	-53.7	0	0	0	116.8
314	E	35.4	Very low	31.1	Very low	166 Å²	166	151.6 Å²	151.6	78%	0.776	75%	0.751	S	S	*	*			trans	48.6	112.6	154.2	-62.8	-164	149.2	0	0	126
315	L	30.5	Very low	30.8	Very low	154 Å²	154	153 Å²	153	81%	0.806	76%	0.763	S	S	*	*				40	164.4	107.9	-74.6	165.4	0	0	0	123
316	P	34.4	Very low	31.1	Very low	118 Å²	118	151.1 Å²	151.1	77%	0.766	76%	0.758	S	S	*	*			cis	-135.6	-179.4	-3.9	37.2	-16.4	0	0	0	117.7
317	T	27.4	Very low	31	Very low	127 Å²	127	153.4 Å²	153.4	78%	0.779	76%	0.757	S	S	*	*			trans	-61.9	145.1	-179.8	-32.5	0	0	0	0	118.5
318	R	31.7	Very low	30.9	Very low	211 Å²	211	151.5 Å²	151.5	80%	0.796	76%	0.756	S	S	*	*			trans	-174.2	130.3	134.7	-110.2	-176.9	-173.9	-141.9	10.5	118.6
319	Q	32	Very low	30.9	Very low	145 Å²	145	154.1 Å²	154.1	68%	0.678	76%	0.763	S	S	*	*			trans	60.3	139.3	133.6	-73.7	171.6	-25.2	0	0	124.7
320	H	27.8	Very low	30.8	Very low	179 Å²	179	158.5 Å²	158.5	83%	0.829	77%	0.772	S	S	*	*			trans	-36.4	147.4	174.4	-44.2	-63.3	0	0	0	119.6
321	Q	30.6	Very low	30.6	Very low	194 Å²	194	160.3 Å²	160.3	91%	0.907	78%	0.775	S	S	*	*				-170.1	177.6	100.6	-102.9	-175.5	16.2	0	0	114.5
322	Q	26.4	Very low	30.3	Very low	171 Å²	171	157.5 Å²	157.5	80%	0.799	77%	0.765	S	S	*	*			trans	-92.6	141.1	-165.3	-56.3	157.5	-12	0	0	114
323	Q	31.3	Very low	30.2	Very low	172 Å²	172	161.1 Å²	161.1	80%	0.804	77%	0.772	S	S	*	*			trans	-175.8	113.4	138.3	-103.1	146.6	96.3	0	0	110.7
324	Q	31	Very low	29.8	Very low	170 Å²	170	162.2 Å²	162.2	79%	0.794	78%	0.778	S	S	*	*				88.2	100.4	94.2	-75.8	-174	44.6	0	0	116.1
325	V	28	Very low	29.5	Very low	131 Å²	131	161.3 Å²	161.3	79%	0.794	78%	0.778	S	S	*	*			trans	7.9	162.8	141.7	-76.2	0	0	0	0	122
326	P	35.7	Very low	29.5	Very low	94 Å²	94	160.2 Å²	160.2	61%	0.61	77%	0.772	S	S	*	*			cis	-134.4	-162.9	-34.1	39.6	-22.1	0	0	0	111.2
327	Y	28.9	Very low	29.1	Very low	211 Å²	211	163.3 Å²	163.3	83%	0.827	78%	0.776	S	S	*	*				174.6	154.6	121.5	-105.1	-75.5	0	0	0	114.5
328	N	25.9	Very low	29.1	Very low	144 Å²	144	160.5 Å²	160.5	77%	0.77	77%	0.772	S	S	*	*			trans	-80.8	155.7	178.4	-61.8	-54.4	0	0	0	113.4
329	K	32.7	Very low	29.2	Very low	202 Å²	202	160.1 Å²	160.1	88%	0.878	78%	0.776	S	S	*	*			trans	-113.5	106.6	153.6	-110.9	179.1	-179.4	174.8	0	110.6
330	R	26.6	Very low	28.9	Very low	197 Å²	197	159.2 Å²	159.2	74%	0.743	78%	0.78	S	S	*	*			trans	-105.6	135.1	177.1	174.2	174.2	171.3	162.7	-3.3	108.2	D332	R330-D332 IonicContact CZ-OD2 3.12Å; R330-D332 IonicContact NE-OD2 2.7Å; R330-D332 PolarHBondContact NE-OD2 2.81Å; R330-D332 IonicContact NH2-OD2 2.7Å; R330-D332 PolarHBondContact NH2-OD2 3.37Å
331	F	28	Very low	29.3	Very low	171 Å²	171	158.2 Å²	158.2	75%	0.75	78%	0.781	S	S	*	*			trans	-115.3	90.4	174.4	-99	-87.3	0	0	0	109.5	F333	F331-F333 AromaticContact CD1-CD2 3.94Å; F331-F333 HydrophobicContact CD1-CD2 3.94Å; F331-F333 AromaticContact CD1-CE2 3.91Å; F331-F333 HydrophobicContact CD1-CE2 3.91Å; F331-F333 HydrophobicContact CE1-CD2 4.36Å; F331-F333 AromaticContact CE1-CE2 3.92Å; F331-F333 HydrophobicContact CE1-CE2 3.92Å
332	D	26.5	Very low	29.2	Very low	104 Å²	104	153.6 Å²	153.6	56%	0.556	77%	0.77	S	S	*	*			trans	-100	130.8	160.1	-73.4	-38.5	0	0	0	108.3	R330	R330-D332 IonicContact CZ-OD2 3.12Å; R330-D332 IonicContact NE-OD2 2.7Å; R330-D332 PolarHBondContact NE-OD2 2.81Å; R330-D332 IonicContact NH2-OD2 2.7Å; R330-D332 PolarHBondContact NH2-OD2 3.37Å
333	F	30.7	Very low	29.4	Very low	186 Å²	186	151.1 Å²	151.1	82%	0.816	77%	0.77	S	S	*	*			trans	-136.1	68.3	168	-93	-76.2	0	0	0	111.2	F331	F331-F333 AromaticContact CD1-CD2 3.94Å; F331-F333 HydrophobicContact CD1-CD2 3.94Å; F331-F333 AromaticContact CD1-CE2 3.91Å; F331-F333 HydrophobicContact CD1-CE2 3.91Å; F331-F333 HydrophobicContact CE1-CD2 4.36Å; F331-F333 AromaticContact CE1-CE2 3.92Å; F331-F333 HydrophobicContact CE1-CE2 3.92Å
334	N	25.6	Very low	29.4	Very low	160 Å²	160	149.2 Å²	149.2	86%	0.856	77%	0.765	S	S	*	*			trans	-98.6	103.2	157.3	-85.5	-25.4	0	0	0	108.5
335	N	28.3	Very low	29.2	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	76%	0.761	S	S	*	*			trans	-168	148	150.7	-116.2	-25.1	0	0	0	116.9
336	I	30.1	Very low	29.3	Very low	130 Å²	130	148 Å²	148	67%	0.667	76%	0.759	S	S	*	*			trans	73.8	105	144.8	-69.8	161.5	0	0	0	119.6
337	H	26.8	Very low	28.8	Very low	184 Å²	184	151.1 Å²	151.1	85%	0.852	77%	0.769	S	S	*	*			trans	66.3	113.4	137.4	-72.1	49.3	0	0	0	121.2
338	G	27.4	Very low	28.8	Very low	67 Å²	67	147.2 Å²	147.2	69%	0.691	77%	0.772	S	S	*	*				125.8	138	96.9	0	0	0	0	0	118
339	K	33.1	Very low	28.9	Very low	203 Å²	203	146 Å²	146	88%	0.883	77%	0.77	S	S	*	*			trans	71.2	112.4	178	-55.6	177.7	-178.6	179.5	0	113.3
340	V	26.7	Very low	28.6	Very low	127 Å²	127	143.4 Å²	143.4	77%	0.77	77%	0.765	S	S	*	*				75.2	107.7	52.3	-179.3	0	0	0	0	111.9
341	D	35	Very low	28.7	Very low	157 Å²	157	139.1 Å²	139.1	84%	0.84	77%	0.765	S	S	*	*			trans	164.7	103.3	148.5	-84.1	-15.4	0	0	0	106.1
342	S	28.7	Very low	28.6	Very low	97 Å²	97	138 Å²	138	68%	0.678	77%	0.767	S	S	*	*			cis	86.8	61.1	29.2	-162.9	0	0	0	0	116.6
343	C	31.2	Very low	28.7	Very low	120 Å²	120	141.7 Å²	141.7	81%	0.811	78%	0.781	S	S	*	*			trans	-123.3	102.4	145.2	-83.8	0	0	0	0	107.9
344	L	30.6	Very low	28.7	Very low	132 Å²	132	136.9 Å²	136.9	69%	0.691	77%	0.771	S	S	*	*				71.4	101.4	89.6	-67.7	171.1	0	0	0	111.4
345	L	26.2	Very low	29	Very low	135 Å²	135	136.1 Å²	136.1	71%	0.707	77%	0.766	S	S	*	*				69.7	130.7	83.9	-74	-172.3	0	0	0	112.2
346	N	30.5	Very low	29.2	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	76%	0.762	S	S	*	*			cis	-148	156	41.8	-80.8	-68.5	0	0	0	114.8
347	L	25.5	Very low	29.5	Very low	158 Å²	158	136.6 Å²	136.6	83%	0.827	77%	0.765	S	S	*	*			trans	-73.8	142.6	147.6	-84.2	61.2	0	0	0	108.8
348	C	29.5	Very low	29.8	Very low	130 Å²	130	135.3 Å²	135.3	88%	0.878	76%	0.759	S	S	*	*			trans	-154.8	155.4	151.6	-120.3	0	0	0	0	111
349	T	27.3	Very low	30.2	Very low	119 Å²	119	137.7 Å²	137.7	73%	0.73	76%	0.756	S	S	*	*			trans	-113.7	168.9	-167.6	50.8	0	0	0	0	112.8
350	N	25.6	Very low	30.6	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	75%	0.75	S	S	*	*			trans	57.5	115.4	161.4	-55.9	-9.5	0	0	0	116.2
351	S	28.5	Very low	31	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	75%	0.746	S	S	*	*				179.8	157.3	68.8	-63.2	0	0	0	0	111.7
352	N	26.9	Very low	31.3	Very low	148 Å²	148	134.6 Å²	134.6	79%	0.791	75%	0.745	S	S	*	*			trans	-14.2	133.7	151.2	-37.7	-28.3	0	0	0	114.3
353	Q	29.3	Very low	31.8	Very low	181 Å²	181	138 Å²	138	85%	0.846	75%	0.75	S	S	*	*				-171.3	157.5	74.3	-118.2	162.7	-15.3	0	0	114
354	S	30.9	Very low	32.3	Very low	86 Å²	86	137.5 Å²	137.5	60%	0.601	75%	0.746	S	S	*	*			trans	51.1	109	149.2	62.8	0	0	0	0	121.5
355	D	31.3	Very low	32.8	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	74%	0.741	S	S	*	*				82.8	130	115.1	-54.8	-12.5	0	0	0	123
356	N	33	Very low	33.5	Very low	131 Å²	131	139.3 Å²	139.3	70%	0.701	74%	0.744	S	S	*	*			trans	84.4	111.4	137.6	-69.7	-15.9	0	0	0	122.5
357	H	34.9	Very low	34	Very low	157 Å²	157	138.6 Å²	138.6	73%	0.727	74%	0.74	S	S	*	*			trans	65.9	154.3	147.8	-64.9	-70	0	0	0	118.3
358	H	33.7	Very low	35.3	Very low	157 Å²	157	136 Å²	136	73%	0.727	73%	0.726	S	S	*	*			cis	-140.3	171.8	1.9	-134.9	-30.9	0	0	0	110.8
359	D	36.4	Very low	35.9	Very low	116 Å²	116	137.2 Å²	137.2	62%	0.62	72%	0.724	S	S	*	*			trans	-62.4	154.7	176.8	-47.9	-100.2	0	0	0	113.3
360	D	40.8	Very low	37.1	Very low	140 Å²	140	138.3 Å²	138.3	75%	0.749	73%	0.726	S	S	*	*				161.8	135.8	109.9	-93.9	-40	0	0	0	114.2
361	N	34.9	Very low	38.3	Very low	129 Å²	129	140 Å²	140	69%	0.69	73%	0.729	S	S	*	*			trans	28.5	120.2	146.9	-46.3	-56.8	0	0	0	122.2
362	D	42.3	Very low	39.2	Very low	153 Å²	153	142.2 Å²	142.2	82%	0.818	73%	0.732	S	S	*	*				-179.7	123.1	113.9	-94.5	-17.6	0	0	0	109.8
363	H	37.8	Very low	40.4	Very low	168 Å²	168	143.4 Å²	143.4	78%	0.778	74%	0.739	S	S	*	*				83.7	76.7	61.7	-161.4	-45.5	0	0	0	115.3
364	C	42.7	Very low	41.7	Very low	110 Å²	110	138.7 Å²	138.7	74%	0.743	73%	0.73	S	S	*	*			trans	-151.1	116.9	152.2	48.6	0	0	0	0	109.8
365	L	40.3	Very low	42.7	Very low	112 Å²	112	142.7 Å²	142.7	59%	0.586	75%	0.745	S	S	*	*				73.4	91.9	64.1	-173.4	74.3	0	0	0	113.1	D367	L365-D367 VanDerWaalsContact CD1-OD2 3.25Å; L365-D367 WeakPolarHBondContact CD1-OD2 3.43Å
366	Y	41.7	Very low	43.9	Very low	194 Å²	194	141.8 Å²	141.8	76%	0.761	74%	0.744	S	S	*	*			trans	-149.7	70	153.8	-81.6	-66	0	0	0	110.2
367	D	40	Very low	44.8	Very low	125 Å²	125	144.2 Å²	144.2	67%	0.668	75%	0.751	S	S	*	*			trans	-67.3	130.8	159.8	-45.1	-60.4	0	0	0	108.3	L365	L365-D367 VanDerWaalsContact CD1-OD2 3.25Å; L365-D367 WeakPolarHBondContact CD1-OD2 3.43Å
368	L	53.1	Low	45.5	Very low	104 Å²	104	145.1 Å²	145.1	55%	0.545	76%	0.756	S	S	.	*			trans	-147.7	79.2	167.3	-78.3	-177.5	0	0	0	108.2	D370	L368-D370 PolarHBondContact O-N 2.89Å
369	D	41.6	Very low	46.2	Very low	155 Å²	155	146.2 Å²	146.2	83%	0.829	76%	0.762	S	S	*	*			trans	-71.8	113.4	159.9	-51.4	-61.4	0	0	0	107.7
370	D	53.2	Low	46.8	Very low	143 Å²	143	149.3 Å²	149.3	77%	0.765	77%	0.772	S	S	*	*			trans	-129.4	64.3	174.1	-77.8	-48.4	0	0	0	108.4	L368	L368-D370 PolarHBondContact O-N 2.89Å
371	E	50.9	Low	47.3	Very low	181 Å²	181	149.2 Å²	149.2	85%	0.846	77%	0.772	S	S	*	*			trans	-91.7	168.8	162.2	-62.2	-151.2	135.4	0	0	110.6
372	D	48	Very low	48.2	Very low	153 Å²	153	150 Å²	150	82%	0.818	78%	0.776	S	S	*	*			trans	64.8	55.9	169.7	-60.3	-22	0	0	0	119.1	A374	D372-A374 PolarHBondContact O-N 2.86Å
373	D	51.9	Low	48.6	Very low	174 Å²	174	149.4 Å²	149.4	93%	0.93	77%	0.773	S	S	*	*			trans	-83.5	90.5	150	-107.3	-21.3	0	0	0	108.7
374	A	57	Low	49.2	Very low	81 Å²	81	148.4 Å²	148.4	67%	0.669	77%	0.773	S	S	*	*			trans	-93.2	117.3	176.9	0	0	0	0	0	111.6	D372 V376	D372-A374 PolarHBondContact O-N 2.86Å; A374-V376 PolarHBondContact O-N 3.32Å
375	D	51.7	Low	49.8	Very low	171 Å²	171	151.1 Å²	151.1	91%	0.914	78%	0.78	S	S	*	*			trans	-66.1	100.8	175.7	-77.4	-52.5	0	0	0	110.9
376	V	56	Low	50.4	Low	123 Å²	123	153.1 Å²	153.1	75%	0.745	79%	0.791	S	S	*	*			trans	-93	105.9	166.6	179	0	0	0	0	108.4	A374 E378	A374-V376 PolarHBondContact O-N 3.32Å; V376-E378 HydrophobicContact CG1-CG 4.32Å; V376-E378 PolarHBondContact O-N 3.49Å
377	E	52.2	Low	51	Low	182 Å²	182	151.9 Å²	151.9	85%	0.85	80%	0.798	S	S	*	*			trans	-81.7	102.9	166	-64.8	-164.1	150.9	0	0	109	Q379	E377-Q379 PolarHBondContact O-N 2.87Å
378	E	49.2	Very low	51.4	Low	177 Å²	177	154.2 Å²	154.2	83%	0.827	81%	0.805	S	S	*	*			trans	-68.8	124.7	166.3	-67.8	-174.2	133.1	0	0	108.9	V376	V376-E378 HydrophobicContact CG1-CG 4.32Å; V376-E378 PolarHBondContact O-N 3.49Å
379	Q	49.1	Very low	50.9	Low	180 Å²	180	157.1 Å²	157.1	84%	0.841	82%	0.821	S	S	*	*			trans	-83.6	117.5	175.4	-62.7	-176.5	-62.8	0	0	108.9	E377 D381	E377-Q379 PolarHBondContact O-N 2.87Å; Q379-D381 PolarHBondContact O-N 3.38Å
380	E	49.1	Very low	50.9	Low	180 Å²	180	158.2 Å²	158.2	84%	0.841	82%	0.821	S	S	*	*			trans	-81.4	105	170	-66.5	-177.8	139.9	0	0	108.2	D382	E380-D382 VanDerWaalsContact C-N 3.32Å; E380-D382 PolarHBondContact O-N 2.82Å
381	D	49.9	Very low	50.5	Low	138 Å²	138	160.6 Å²	160.6	74%	0.738	83%	0.825	S	S	*	*			trans	-75	78	177.2	-83.8	-36.3	0	0	0	110.8	Q379 N383	Q379-D381 PolarHBondContact O-N 3.38Å; D381-N383 PolarHBondContact O-N 3.01Å; D381-N383 PolarHBondContact O-ND2 3.47Å
382	D	55.3	Low	50.1	Low	147 Å²	147	155.7 Å²	155.7	79%	0.786	81%	0.811	S	S	*	*			trans	-61	119.1	167.6	-80.2	-35.9	0	0	0	109.9	E380	E380-D382 VanDerWaalsContact C-N 3.32Å; E380-D382 PolarHBondContact O-N 2.82Å
383	N	50.8	Low	49.9	Very low	139 Å²	139	156.4 Å²	156.4	74%	0.743	81%	0.809	S	S	*	*			trans	-114.6	98.5	174.7	-75.5	-107.3	0	0	0	108.3	D381	D381-N383 PolarHBondContact O-N 3.01Å; D381-N383 PolarHBondContact O-ND2 3.47Å
384	D	49.8	Very low	49.7	Very low	147 Å²	147	156 Å²	156	79%	0.786	80%	0.802	S	S	*	*			trans	-73.6	119.6	169.8	-65.6	-54.2	0	0	0	110.1
385	D	56.2	Low	49.1	Very low	168 Å²	168	158.5 Å²	158.5	90%	0.898	80%	0.804	S	S	*	*			trans	-103.6	101.2	162.6	-93	-41.7	0	0	0	107.8
386	D	51.4	Low	48.9	Very low	153 Å²	153	157.6 Å²	157.6	82%	0.818	80%	0.799	S	S	*	*			trans	-69.2	136.4	174.6	-73.7	-56.8	0	0	0	111.9
387	D	55.1	Low	48.7	Very low	168 Å²	168	157.7 Å²	157.7	90%	0.898	80%	0.799	S	S	*	*			trans	-140.7	101.3	165.5	-141.3	-7.1	0	0	0	109.7
388	E	47.4	Very low	48.6	Very low	174 Å²	174	155.6 Å²	155.6	81%	0.813	79%	0.794	S	S	*	*			trans	-75.8	145.8	-173.5	-69.2	-173.7	163.6	0	0	113.4
389	N	43.5	Very low	48.6	Very low	165 Å²	165	153.5 Å²	153.5	88%	0.882	79%	0.789	S	S	*	*			trans	-158.3	116.9	138.1	-117.9	-86.9	0	0	0	112.7
390	E	42.3	Very low	48.5	Very low	178 Å²	178	151.5 Å²	151.5	83%	0.832	78%	0.783	S	S	*	*			trans	-72.3	137.4	164.9	-60	-177.3	118.6	0	0	110.9
391	K	44.6	Very low	48.3	Very low	193 Å²	193	151.9 Å²	151.9	84%	0.839	79%	0.785	S	S	*	*				-167.4	130.7	126.8	-116.4	167.3	-174.6	168.4	0	118.4
392	S	42.6	Very low	48.1	Very low	79 Å²	79	151 Å²	151	55%	0.552	79%	0.79	S	S	*	*			trans	53.5	113.2	136.9	64.2	0	0	0	0	121.2
393	E	43.6	Very low	47.5	Very low	168 Å²	168	151.4 Å²	151.4	79%	0.785	79%	0.792	S	S	*	*				84.5	104.5	118.8	-69.1	157.3	-158.4	0	0	121
394	E	47.1	Very low	47.4	Very low	166 Å²	166	150 Å²	150	78%	0.776	79%	0.794	S	S	*	*			trans	79.8	149.2	130.8	-59.6	-174	160.3	0	0	122.1
395	N	45.1	Very low	47.1	Very low	133 Å²	133	150.1 Å²	150.1	71%	0.711	79%	0.794	S	S	*	*			trans	89.1	82.6	163.3	-48	-80.5	0	0	0	118.6
396	D	46.5	Very low	46.7	Very low	152 Å²	152	148.6 Å²	148.6	81%	0.813	79%	0.786	S	S	*	*				48	160.9	113.1	-59	-5.8	0	0	0	123.7
397	V	52.1	Low	46.2	Very low	125 Å²	125	147.2 Å²	147.2	76%	0.758	78%	0.779	S	S	*	*			trans	91	85	163.6	-164.8	0	0	0	0	117.8
398	D	49.5	Very low	45.6	Very low	138 Å²	138	148.8 Å²	148.8	74%	0.738	77%	0.773	S	S	*	*				46.2	129.6	118.3	-53.1	-19.5	0	0	0	122.6
399	D	49	Very low	45.4	Very low	133 Å²	133	146.4 Å²	146.4	71%	0.711	77%	0.766	S	S	*	*				104.6	130.4	117.6	-98.1	17.1	0	0	0	125
400	N	47.4	Very low	44.9	Very low	137 Å²	137	146.5 Å²	146.5	73%	0.733	76%	0.759	S	S	*	*			trans	97.5	144.3	137.2	-75.7	-45.8	0	0	0	123.5
401	E	44.4	Very low	45.2	Very low	189 Å²	189	148.2 Å²	148.2	88%	0.883	76%	0.764	S	S	*	*			trans	-97.8	168.3	-168.8	-50.9	171.8	132.2	0	0	112.2
402	S	45.7	Very low	44.7	Very low	120 Å²	120	147 Å²	147	84%	0.839	76%	0.758	S	S	*	*			trans	-162.1	132.3	145.4	-174.8	0	0	0	0	111.4
403	D	44.6	Very low	44.4	Very low	155 Å²	155	149 Å²	149	83%	0.829	77%	0.771	S	S	*	*			trans	-69.6	165.1	169.2	-74.5	-61.5	0	0	0	113
404	S	48.1	Very low	44.3	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	77%	0.77	S	S	*	*			trans	-152.3	104.4	149.4	-166.5	0	0	0	0	111.6
405	D	43.6	Very low	43.8	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	78%	0.776	S	S	*	*			trans	-59.3	153	165	-76	-61.9	0	0	0	112
406	N	47.7	Very low	43.5	Very low	135 Å²	135	147.4 Å²	147.4	72%	0.722	78%	0.781	S	S	*	*			trans	-154.2	103.4	149.8	-102.8	-77.2	0	0	0	111.2
407	D	40.5	Very low	43.1	Very low	125 Å²	125	146.1 Å²	146.1	67%	0.668	78%	0.779	S	S	*	*			trans	-78.1	126.1	170.9	161.9	31.6	0	0	0	111.2	N409	D407-N409 PolarHBondContact OD1-N 3.06Å
408	Y	42.8	Very low	42.7	Very low	200 Å²	200	145.4 Å²	145.4	78%	0.784	78%	0.775	S	S	*	*			trans	-138.8	87.2	156.6	-81.3	-64.2	0	0	0	115.2
409	N	42.7	Very low	42.3	Very low	125 Å²	125	145.2 Å²	145.2	67%	0.668	77%	0.774	S	S	*	*				65.8	98	129	-93.4	-87.3	0	0	0	120.6	D407	D407-N409 PolarHBondContact OD1-N 3.06Å
410	F	34	Very low	41.9	Very low	166 Å²	166	144.9 Å²	144.9	73%	0.728	77%	0.772	S	S	*	*			trans	-46.2	132.9	154.4	-175.2	-90.1	0	0	0	115.1	K412	F410-K412 HydrophobicContact CD1-CB 4.42Å; F410-K412 HydrophobicContact CE1-CB 3.7Å; F410-K412 HydrophobicContact CE1-CD 4.17Å; F410-K412 HydrophobicContact CZ-CB 3.98Å; F410-K412 HydrophobicContact CZ-CD 3.83Å
411	K	47.4	Very low	41.7	Very low	214 Å²	214	143.8 Å²	143.8	93%	0.93	77%	0.766	S	S	*	*			trans	-138.3	132.8	158.1	-101.9	-178	-177.9	173	0	112.8
412	K	35.6	Very low	41.8	Very low	168 Å²	168	141 Å²	141	73%	0.73	76%	0.757	S	S	*	*			trans	-141.2	110.2	-172.4	172.3	-172.5	174	-177.9	0	110.4	F410	F410-K412 HydrophobicContact CD1-CB 4.42Å; F410-K412 HydrophobicContact CE1-CB 3.7Å; F410-K412 HydrophobicContact CE1-CD 4.17Å; F410-K412 HydrophobicContact CZ-CB 3.98Å; F410-K412 HydrophobicContact CZ-CD 3.83Å
413	C	35.5	Very low	41.6	Very low	121 Å²	121	142.6 Å²	142.6	82%	0.818	76%	0.756	S	S	*	*			trans	-161.3	132.5	159.4	-102.9	0	0	0	0	107.2
414	S	41.4	Very low	41.8	Very low	108 Å²	108	141 Å²	141	76%	0.755	76%	0.757	S	S	*	*				91.1	120.3	51.8	-65.4	0	0	0	0	112.7
415	K	36.6	Very low	41.4	Very low	209 Å²	209	143.3 Å²	143.3	91%	0.909	76%	0.761	S	S	*	*			trans	-29.3	133.1	176.8	-59.2	168.6	175.4	177.7	0	116.8
416	S	39.4	Very low	41.8	Very low	117 Å²	117	141.9 Å²	141.9	82%	0.818	76%	0.758	S	S	*	*				-165.8	151.8	119.3	47	0	0	0	0	114.2
417	T	38.1	Very low	41.7	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	76%	0.76	S	S	*	*			trans	-33.9	149.7	161.8	-15.1	0	0	0	0	113.3
418	T	42.6	Very low	42.1	Very low	110 Å²	110	143.5 Å²	143.5	68%	0.675	77%	0.766	S	S	*	*			cis	-171.9	154.4	48.2	-39	0	0	0	0	111.3
419	N	40.8	Very low	42.6	Very low	135 Å²	135	139.1 Å²	139.1	72%	0.722	77%	0.765	S	S	*	*			trans	33	143.3	153.8	-65.9	11.5	0	0	0	121.1
420	N	41.5	Very low	43.2	Very low	126 Å²	126	139.2 Å²	139.2	67%	0.674	77%	0.765	S	S	*	*			cis	-166.5	170.3	33.6	-135.8	4	0	0	0	113.9
421	N	43.5	Very low	44.7	Very low	114 Å²	114	139 Å²	139	61%	0.61	77%	0.768	S	S	*	*			trans	76.7	103.9	150.2	-67	0.3	0	0	0	122.4
422	N	45.8	Very low	45.8	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	76%	0.756	S	S	*	*				97.8	114.4	118.9	-61.5	-6.2	0	0	0	122.1
423	N	42.4	Very low	47.9	Very low	153 Å²	153	134.2 Å²	134.2	82%	0.818	76%	0.761	S	S	*	*			trans	60.4	93.2	135.9	-62.9	-1.5	0	0	0	120.7
424	S	48.3	Very low	50	Low	121 Å²	121	140 Å²	140	85%	0.846	77%	0.765	S	S	*	*				-159.9	134.6	110.3	39.3	0	0	0	0	112
425	N	39.2	Very low	51.9	Low	159 Å²	159	143.6 Å²	143.6	85%	0.85	76%	0.762	S	S	*	*			trans	-77.2	144.4	165.3	-76.3	-21	0	0	0	109.3
426	V	51.7	Low	54.1	Low	119 Å²	119	137.9 Å²	137.9	72%	0.721	75%	0.754	S	S	*	*				175.8	105.2	126.2	152.7	0	0	0	0	109.9	D428	V426-D428 PolarHBondContact O-N 2.85Å
427	N	45.6	Very low	56.3	Low	143 Å²	143	144 Å²	144	77%	0.765	76%	0.759	S	S	*	*			trans	52	41.8	139.3	-48.5	-4.7	0	0	0	121	S429	N427-S429 VanDerWaalsContact C-N 3.3Å; N427-S429 PolarHBondContact O-N 3.42Å
428	D	50	Low	58.4	Low	151 Å²	151	142.8 Å²	142.8	81%	0.807	75%	0.751	S	S	*	*			trans	-89.3	57.3	171.9	-156.6	2.6	0	0	0	113	V426	V426-D428 PolarHBondContact O-N 2.85Å
429	S	52.6	Low	60.7	Low	108 Å²	108	142.2 Å²	142.2	76%	0.755	76%	0.758	S	S	*	*			trans	-131	45.6	-171.5	69.9	0	0	0	0	113.5	N427	N427-S429 VanDerWaalsContact C-N 3.3Å; N427-S429 PolarHBondContact O-N 3.42Å
430	N	56.1	Low	63.4	Low	126 Å²	126	138.4 Å²	138.4	67%	0.674	74%	0.735	S	S	*	*			trans	-139.5	12.3	177.2	-137.6	-17.3	0	0	0	114.6	K432	N430-K432 PolarHBondContact O-N 3.43Å
431	M	64.6	Low	66	Low	161 Å²	161	135.9 Å²	135.9	79%	0.793	72%	0.724	S	S	*	*			trans	-72.2	103.7	168	-76.4	-68.5	111.9	0	0	109.7
432	K	71.2	Confident	68.6	Low	157 Å²	157	139.5 Å²	139.5	68%	0.683	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-54.8	135.4	172.9	-77.1	77	170.1	177.2	0	109.5	N430 R434	N430-K432 PolarHBondContact O-N 3.43Å; K432-R434 PolarHBondContact O-N 2.85Å; K432-R434 VanDerWaalsContact O-N 3.16Å
433	P	78.1	Confident	71	Confident	126 Å²	126	140.3 Å²	140.3	82%	0.818	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-62.2	120.2	-179.7	25.2	-33.5	0	0	0	110.2	R435	P433-R435 PolarHBondContact O-N 3.28Å
434	R	80.2	Confident	73.7	Confident	241 Å²	241	134.4 Å²	134.4	91%	0.909	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-59.9	121.7	177.5	-69	-177.9	-179.6	-106.1	3.8	109.2	K432 A436	K432-R434 PolarHBondContact O-N 2.85Å; K432-R434 VanDerWaalsContact O-N 3.16Å; R434-A436 PolarHBondContact O-N 2.72Å
435	R	80.9	Confident	76	Confident	185 Å²	185	131.9 Å²	131.9	70%	0.698	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-48.4	122.7	178.7	-175	178.6	-76.4	163.4	-4.4	109.9	P433 R437	P433-R435 PolarHBondContact O-N 3.28Å; R435-R437 PolarHBondContact O-N 3.38Å
436	A	83.3	Confident	78.8	Confident	88 Å²	88	126.8 Å²	126.8	73%	0.727	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-60.3	135.7	-175.7	0	0	0	0	0	110.9	R434 T438	R434-A436 PolarHBondContact O-N 2.72Å; A436-T438 PolarHBondContact O-N 2.84Å
437	R	85.9	Confident	81	Confident	247 Å²	247	123.6 Å²	123.6	93%	0.932	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-71.5	122.8	176.7	-71	-177.5	175.1	176.7	-2	109.7	R435	R435-R437 PolarHBondContact O-N 3.38Å
438	T	81.8	Confident	83.5	Confident	97 Å²	97	116.8 Å²	116.8	60%	0.595	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-66.2	129.9	169.6	43.8	0	0	0	0	110	A436	A436-T438 PolarHBondContact O-N 2.84Å
439	A	92	Very high	85.8	Confident	98 Å²	98	111.9 Å²	111.9	81%	0.81	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-100.2	132.2	174	0	0	0	0	0	109.6
440	F	95.8	Very high	88	Confident	55 Å²	55	110.3 Å²	110.3	24%	0.241	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-83.3	148.2	172.4	-57.6	-66.5	0	0	0	110.4	Q444 L445 L472 Q476 W480	F440-Q444 HydrophobicContact CB-CB 4.28Å; F440-L445 HydrophobicContact CB-CD2 3.89Å; F440-L445 HydrophobicContact CB-CG 3.89Å; F440-L445 HydrophobicContact CD2-CD2 4.16Å; F440-L445 HydrophobicContact CG-CD2 4.4Å; F440-L472 HydrophobicContact CD1-CD1 3.83Å; F440-L472 HydrophobicContact CD1-CD2 3.79Å; F440-L472 HydrophobicContact CD1-CG 4.49Å; F440-L472 HydrophobicContact CE1-CD1 3.8Å; F440-L472 HydrophobicContact CE1-CD2 3.81Å; F440-L472 HydrophobicContact CE1-CG 4.44Å; F440-Q476 HydrophobicContact CE1-CB 4.23Å; F440-Q476 HydrophobicContact CZ-CB 4.38Å; F440-W480 AromaticContact CD2-CD1 3.87Å; F440-W480 AromaticContact CE2-CD1 3.7Å
441	T	97.1	Very high	90	Very high	73 Å²	73	106.5 Å²	106.5	45%	0.448	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-69.6	160.5	173.3	75.9	0	0	0	0	110.9	E443 Q444 L445	T441-E443 VanDerWaalsContact C-N 3.26Å; T441-E443 PolarHBondContact O-N 3.08Å; T441-Q444 PolarHBondContact O-N 3.33Å; T441-Q444 WeakPolarHBondContact OG1-CG 3.32Å; T441-Q444 PolarHBondContact OG1-N 2.92Å; T441-Q444 VanDerWaalsContact OG1-N 3.14Å; T441-L445 WeakPolarHBondContact O-CG 3.4Å; T441-L445 PolarHBondContact O-N 3.25Å
442	Y	97.1	Very high	91.6	Very high	190 Å²	190	99.1 Å²	99.1	75%	0.745	49%	0.489	S	S	*	.	H	α-helix	trans	-58.5	-39.3	175.8	179.7	-101.7	0	0	0	112.2	L445 V446	Y442-L445 PolarHBondContact O-N 3.01Å; Y442-V446 HydrophobicContact CD1-CG2 4.12Å; Y442-V446 HydrophobicContact CE1-CG2 3.67Å; Y442-V446 HydrophobicContact CE2-CG2 4.1Å; Y442-V446 WeakPolarHBondContact O-CG2 3.12Å; Y442-V446 PolarHBondContact O-N 3.25Å
443	E	97.4	Very high	92.8	Very high	149 Å²	149	97.6 Å²	97.6	70%	0.696	48%	0.483	S	S	*	.	H	α-helix	trans	-66.2	-42.1	177.8	-177.4	170.6	-154.5	0	0	112.8	T441 V446 T447	T441-E443 VanDerWaalsContact C-N 3.26Å; T441-E443 PolarHBondContact O-N 3.08Å; E443-V446 PolarHBondContact O-N 2.84Å; E443-T447 PolarHBondContact O-N 3.18Å; E443-T447 PolarHBondContact O-OG1 2.84Å
444	Q	98	Very high	93.6	Very high	28 Å²	28	98.3 Å²	98.3	13%	0.131	48%	0.477	C	S	.	.	H	α-helix	trans	-59.3	-48	171.2	-73	170.5	-20.8	0	0	110.6	F440 T441 V446 T447 L448 L470	F440-Q444 HydrophobicContact CB-CB 4.28Å; T441-Q444 PolarHBondContact O-N 3.33Å; T441-Q444 WeakPolarHBondContact OG1-CG 3.32Å; T441-Q444 PolarHBondContact OG1-N 2.92Å; T441-Q444 VanDerWaalsContact OG1-N 3.14Å; Q444-V446 PolarHBondContact O-N 3.07Å; Q444-T447 PolarHBondContact O-N 2.84Å; Q444-L448 WeakPolarHBondContact O-CB 3.34Å; Q444-L448 WeakPolarHBondContact O-CD1 3.45Å; Q444-L448 WeakPolarHBondContact O-CG 3.36Å; Q444-L448 PolarHBondContact O-N 3.09Å; Q444-L470 HydrophobicContact CG-CB 4.3Å; Q444-L470 HydrophobicContact CG-CD2 4.38Å; Q444-L470 PolarHBondContact NE2-O 3.15Å
445	L	97.8	Very high	94.4	Very high	68 Å²	68	88.3 Å²	88.3	36%	0.356	44%	0.443	S	S	.	.	H	α-helix	trans	-62.3	-42.2	179.4	-70.2	173.3	0	0	0	112.9	F440 T441 Y442 E449	F440-L445 HydrophobicContact CB-CD2 3.89Å; F440-L445 HydrophobicContact CB-CG 3.89Å; F440-L445 HydrophobicContact CD2-CD2 4.16Å; F440-L445 HydrophobicContact CG-CD2 4.4Å; T441-L445 WeakPolarHBondContact O-CG 3.4Å; T441-L445 PolarHBondContact O-N 3.25Å; Y442-L445 PolarHBondContact O-N 3.01Å; L445-E449 WeakPolarHBondContact O-CB 3.4Å; L445-E449 PolarHBondContact O-N 2.92Å
446	V	97.8	Very high	95.1	Very high	52 Å²	52	81.6 Å²	81.6	32%	0.315	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.4	167.4	0	0	0	0	111	Y442 E443 Q444 N450	Y442-V446 HydrophobicContact CD1-CG2 4.12Å; Y442-V446 HydrophobicContact CE1-CG2 3.67Å; Y442-V446 HydrophobicContact CE2-CG2 4.1Å; Y442-V446 WeakPolarHBondContact O-CG2 3.12Å; Y442-V446 PolarHBondContact O-N 3.25Å; E443-V446 PolarHBondContact O-N 2.84Å; Q444-V446 PolarHBondContact O-N 3.07Å; V446-N450 WeakPolarHBondContact O-CB 3.26Å; V446-N450 PolarHBondContact O-N 3.47Å; V446-N450 PolarHBondContact O-ND2 3.3Å
447	T	97.7	Very high	95.8	Very high	53 Å²	53	83.3 Å²	83.3	33%	0.325	41%	0.406	S	S	.	.	H	α-helix	trans	-71.3	-42.6	-178.6	-52.8	0	0	0	0	111.9	E443 Q444 N450 K451 L466 L470	E443-T447 PolarHBondContact O-N 3.18Å; E443-T447 PolarHBondContact O-OG1 2.84Å; Q444-T447 PolarHBondContact O-N 2.84Å; T447-N450 PolarHBondContact O-N 2.28Å; T447-K451 PolarHBondContact O-N 2.98Å; T447-L466 HydrophobicContact CG2-CD1 4.27Å; T447-L470 HydrophobicContact CG2-CD1 4.41Å; T447-L470 HydrophobicContact CG2-CD2 3.91Å
448	L	98.5	Very high	96.4	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-46.3	172.8	-71	163.4	0	0	0	111.4	Q444 K451 F452 L466 L470 L472 V477 W480 F481	Q444-L448 WeakPolarHBondContact O-CB 3.34Å; Q444-L448 WeakPolarHBondContact O-CD1 3.45Å; Q444-L448 WeakPolarHBondContact O-CG 3.36Å; Q444-L448 PolarHBondContact O-N 3.09Å; L448-K451 PolarHBondContact O-N 2.84Å; L448-F452 WeakPolarHBondContact O-CB 3.2Å; L448-F452 PolarHBondContact O-N 3.13Å; L448-L466 HydrophobicContact CD2-CD2 3.87Å; L448-L466 HydrophobicContact CD2-CG 4.34Å; L448-L470 HydrophobicContact CD1-CD1 4.37Å; L448-L470 HydrophobicContact CD2-CD1 3.81Å; L448-L470 HydrophobicContact CG-CD1 3.68Å; L448-L472 HydrophobicContact CD1-CD1 4.16Å; L448-V477 HydrophobicContact CD2-CG1 4.39Å; L448-V477 HydrophobicContact CD2-CG2 4.46Å; L448-W480 HydrophobicContact CB-CD2 3.85Å; L448-W480 HydrophobicContact CB-CE3 3.9Å; L448-W480 HydrophobicContact CB-CH2 3.76Å; L448-W480 HydrophobicContact CB-CZ2 3.66Å; L448-W480 HydrophobicContact CB-CZ3 3.86Å; L448-W480 HydrophobicContact CD1-CD2 3.96Å; L448-W480 HydrophobicContact CD1-CG 3.87Å; L448-W480 HydrophobicContact CD2-CD2 4.31Å; L448-W480 HydrophobicContact CD2-CE3 4.25Å; L448-W480 HydrophobicContact CG-CD2 4.26Å; L448-W480 HydrophobicContact CG-CE3 4.48Å; L448-F481 HydrophobicContact CD2-CE2 4.05Å
449	E	98.2	Very high	97.1	Very high	47 Å²	47	70.5 Å²	70.5	22%	0.22	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-38.2	178	-175	64	-159.1	0	0	112.5	L445 F452 K453 W480 R484	L445-E449 WeakPolarHBondContact O-CB 3.4Å; L445-E449 PolarHBondContact O-N 2.92Å; E449-F452 PolarHBondContact O-N 2.9Å; E449-K453 WeakPolarHBondContact O-CG 3.14Å; E449-K453 PolarHBondContact O-N 2.97Å; E449-K453 VanDerWaalsContact O-N 3.07Å; E449-W480 HydrophobicContact CB-CH2 4.39Å; E449-R484 IonicContact OE1-CZ 3.49Å; E449-R484 IonicContact OE1-NE 3.37Å; E449-R484 PolarHBondContact OE1-NE 3.37Å; E449-R484 IonicContact OE1-NH2 2.74Å; E449-R484 PolarHBondContact OE1-NH2 3.48Å; E449-R484 WeakPolarHBondContact OE2-CD 3.47Å; E449-R484 IonicContact OE2-CZ 3.58Å; E449-R484 IonicContact OE2-NE 2.71Å; E449-R484 PolarHBondContact OE2-NE 3.16Å; E449-R484 IonicContact OE2-NH2 3.57Å
450	N	97.8	Very high	97.3	Very high	76 Å²	76	69.5 Å²	69.5	41%	0.406	34%	0.34	S	S	.	.	H	α-helix	trans	-67.6	-41.3	175.5	-73	-17.7	0	0	0	111.8	V446 T447 F452 K453 M454	V446-N450 WeakPolarHBondContact O-CB 3.26Å; V446-N450 PolarHBondContact O-N 3.47Å; V446-N450 PolarHBondContact O-ND2 3.3Å; T447-N450 PolarHBondContact O-N 2.28Å; N450-F452 VanDerWaalsContact C-N 3.34Å; N450-F452 PolarHBondContact O-N 2.92Å; N450-K453 PolarHBondContact O-N 3.38Å; N450-K453 PolarHBondContact OD1-NZ 3.33Å; N450-M454 PolarHBondContact O-N 3.27Å
451	K	97.9	Very high	97.4	Very high	46 Å²	46	69.7 Å²	69.7	20%	0.2	35%	0.348	C	S	.	.	H	α-helix	trans	-65.8	-36.5	173.3	-174.6	62.8	179.2	175.1	0	112	T447 L448 K453 M454 T455 L458 E462 L466 F481	T447-K451 PolarHBondContact O-N 2.98Å; L448-K451 PolarHBondContact O-N 2.84Å; K451-K453 PolarHBondContact O-N 3.02Å; K451-M454 HydrophobicContact CD-SD 4.35Å; K451-M454 WeakPolarHBondContact O-CB 3.48Å; K451-M454 PolarHBondContact O-N 3.08Å; K451-T455 PolarHBondContact O-N 3.29Å; K451-L458 HydrophobicContact CD-CD2 4.29Å; K451-L458 VanDerWaalsContact CE-CD2 3.47Å; K451-L458 HydrophobicContact CG-CD2 3.8Å; K451-E462 VanDerWaalsContact CE-OE1 3.27Å; K451-E462 WeakPolarHBondContact CE-OE1 3.49Å; K451-E462 IonicContact NZ-OE1 3.85Å; K451-E462 PolarHBondContact NZ-OE1 3.26Å; K451-L466 HydrophobicContact CB-CD1 4.42Å; K451-L466 HydrophobicContact CB-CD2 4.22Å; K451-L466 HydrophobicContact CG-CD2 3.95Å; K451-F481 HydrophobicContact CB-CZ 4.31Å; K451-F481 HydrophobicContact CG-CZ 4.12Å
452	F	98.1	Very high	97.4	Very high	5 Å²	5	69 Å²	69	2%	0.022	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-36.9	175.7	-172.6	-95.1	0	0	0	113.5	L448 E449 N450 M454 T455 R456 W480 F481 R484 R485 W488	L448-F452 WeakPolarHBondContact O-CB 3.2Å; L448-F452 PolarHBondContact O-N 3.13Å; E449-F452 PolarHBondContact O-N 2.9Å; N450-F452 VanDerWaalsContact C-N 3.34Å; N450-F452 PolarHBondContact O-N 2.92Å; F452-M454 VanDerWaalsContact C-N 3.29Å; F452-M454 PolarHBondContact O-N 3.4Å; F452-T455 CarbonylContact C-O 3.55Å; F452-T455 VanDerWaalsContact CA-O 3.3Å; F452-T455 WeakPolarHBondContact CA-O 3.26Å; F452-T455 CarbonylContact O-C 3.54Å; F452-T455 VanDerWaalsContact O-C 3.28Å; F452-R456 HydrophobicContact CE1-CG 4.15Å; F452-R456 HydrophobicContact CE2-CB 4.07Å; F452-R456 HydrophobicContact CE2-CG 4.21Å; F452-R456 HydrophobicContact CZ-CB 4.14Å; F452-R456 HydrophobicContact CZ-CG 3.84Å; F452-W480 HydrophobicContact CB-CH2 4.09Å; F452-W480 HydrophobicContact CB-CZ3 3.95Å; F452-W480 HydrophobicContact CD2-CZ3 4.23Å; F452-W480 HydrophobicContact CG-CZ3 4.31Å; F452-F481 HydrophobicContact CB-CE1 4.15Å; F452-F481 HydrophobicContact CB-CZ 4.21Å; F452-F481 AromaticContact CD2-CD1 3.8Å; F452-F481 HydrophobicContact CD2-CD1 3.8Å; F452-F481 AromaticContact CD2-CE1 3.73Å; F452-F481 HydrophobicContact CD2-CE1 3.73Å; F452-F481 HydrophobicContact CD2-CZ 4.47Å; F452-F481 HydrophobicContact CE2-CD1 4.43Å; F452-F481 HydrophobicContact CG-CE1 4.44Å; F452-R484 HydrophobicContact CB-CG 4.4Å; F452-R484 HydrophobicContact CD1-CG 3.63Å; F452-R484 HydrophobicContact CD2-CB 4.01Å; F452-R484 HydrophobicContact CD2-CG 3.56Å; F452-R484 HydrophobicContact CE1-CG 3.7Å; F452-R484 HydrophobicContact CE2-CB 3.94Å; F452-R484 HydrophobicContact CE2-CG 3.62Å; F452-R484 HydrophobicContact CG-CB 4.49Å; F452-R484 HydrophobicContact CG-CG 3.57Å; F452-R484 HydrophobicContact CZ-CB 4.36Å; F452-R484 HydrophobicContact CZ-CG 3.7Å; F452-R485 HydrophobicContact CE2-CG 3.86Å; F452-R485 HydrophobicContact CZ-CG 4.22Å; F452-W488 HydrophobicContact CE1-CB 4.07Å; F452-W488 HydrophobicContact CE1-CG 4.11Å; F452-W488 HydrophobicContact CZ-CB 3.98Å; F452-W488 HydrophobicContact CZ-CG 4.29Å
453	K	96.5	Very high	97.5	Very high	125 Å²	125	62.5 Å²	62.5	54%	0.543	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-36.8	173.8	-69.4	163.5	-167.2	156.7	0	111.9	E449 N450 K451	E449-K453 WeakPolarHBondContact O-CG 3.14Å; E449-K453 PolarHBondContact O-N 2.97Å; E449-K453 VanDerWaalsContact O-N 3.07Å; N450-K453 PolarHBondContact O-N 3.38Å; N450-K453 PolarHBondContact OD1-NZ 3.33Å; K451-K453 PolarHBondContact O-N 3.02Å
454	M	96.3	Very high	97.5	Very high	142 Å²	142	59 Å²	59	70%	0.7	30%	0.299	S	S	*	.	H	α-helix	trans	-70.8	-52.2	176.2	-58.6	170.7	75.3	0	0	110.8	N450 K451 F452 Q500	N450-M454 PolarHBondContact O-N 3.27Å; K451-M454 HydrophobicContact CD-SD 4.35Å; K451-M454 WeakPolarHBondContact O-CB 3.48Å; K451-M454 PolarHBondContact O-N 3.08Å; F452-M454 VanDerWaalsContact C-N 3.29Å; F452-M454 PolarHBondContact O-N 3.4Å; M454-Q500 PolarHBondContact O-NE2 2.71Å
455	T	96.5	Very high	97.5	Very high	30 Å²	30	62.8 Å²	62.8	18%	0.184	32%	0.321	C	S	.	.			trans	-140.6	133.9	176.4	-178.6	0	0	0	0	111.7	K451 F452 Y457 L458 F481	K451-T455 PolarHBondContact O-N 3.29Å; F452-T455 CarbonylContact C-O 3.55Å; F452-T455 VanDerWaalsContact CA-O 3.3Å; F452-T455 WeakPolarHBondContact CA-O 3.26Å; F452-T455 CarbonylContact O-C 3.54Å; F452-T455 VanDerWaalsContact O-C 3.28Å; T455-Y457 VanDerWaalsContact C-N 3.29Å; T455-Y457 PolarHBondContact OG1-N 3.03Å; T455-Y457 PolarHBondContact OG1-O 3.26Å; T455-L458 HydrophobicContact CG2-CD2 3.87Å; T455-F481 WeakPolarHBondContact O-CE1 3.5Å
456	R	96.4	Very high	97.5	Very high	45 Å²	45	60.3 Å²	60.3	17%	0.17	31%	0.307	C	S	.	.	S	Bend	trans	-80.6	-12.4	176.1	-62.4	164.5	172.5	66.9	-12.4	112	F452 R485 V497 Q500	F452-R456 HydrophobicContact CE1-CG 4.15Å; F452-R456 HydrophobicContact CE2-CB 4.07Å; F452-R456 HydrophobicContact CE2-CG 4.21Å; F452-R456 HydrophobicContact CZ-CB 4.14Å; F452-R456 HydrophobicContact CZ-CG 3.84Å; R456-R485 WeakPolarHBondContact O-CD 3.43Å; R456-R485 PolarHBondContact O-NH1 3.42Å; R456-V497 HydrophobicContact CB-CG1 4.24Å; R456-Q500 VanDerWaalsContact CB-OE1 3.24Å; R456-Q500 VanDerWaalsContact CG-OE1 3.26Å; R456-Q500 VanDerWaalsContact NH1-CD 3.34Å
457	Y	97.9	Very high	97.5	Very high	123 Å²	123	58 Å²	58	48%	0.482	29%	0.294	S	S	.	.	S	Bend	trans	-132.6	123.4	179.4	-61.7	-90.4	0	0	0	110.3	T455 R485 V497	T455-Y457 VanDerWaalsContact C-N 3.29Å; T455-Y457 PolarHBondContact OG1-N 3.03Å; T455-Y457 PolarHBondContact OG1-O 3.26Å; Y457-R485 VanDerWaalsContact CE1-CD 3.46Å; Y457-V497 HydrophobicContact CE2-CB 4.12Å; Y457-V497 HydrophobicContact CE2-CG1 3.53Å
458	L	97.3	Very high	97.5	Very high	16 Å²	16	61.8 Å²	61.8	8%	0.084	31%	0.312	C	S	.	.			trans	-92.6	130.3	176.5	-62.1	174.9	0	0	0	110.8	K451 T455 E462 R463 L466 V477 F481	K451-L458 HydrophobicContact CD-CD2 4.29Å; K451-L458 VanDerWaalsContact CE-CD2 3.47Å; K451-L458 HydrophobicContact CG-CD2 3.8Å; T455-L458 HydrophobicContact CG2-CD2 3.87Å; L458-E462 HydrophobicContact CB-CB 4.34Å; L458-E462 HydrophobicContact CD2-CB 4.01Å; L458-R463 HydrophobicContact CB-CB 4.12Å; L458-R463 HydrophobicContact CB-CG 4.47Å; L458-R463 HydrophobicContact CD1-CB 4.26Å; L458-R463 HydrophobicContact CD1-CG 4.09Å; L458-R463 PolarHBondContact O-NH2 2.89Å; L458-L466 HydrophobicContact CD1-CD2 3.78Å; L458-V477 HydrophobicContact CD1-CG1 3.63Å; L458-F481 HydrophobicContact CD1-CD1 4.15Å; L458-F481 HydrophobicContact CD1-CD2 3.68Å; L458-F481 HydrophobicContact CD1-CE1 3.97Å; L458-F481 HydrophobicContact CD1-CE2 3.53Å; L458-F481 HydrophobicContact CD1-CG 4.03Å; L458-F481 HydrophobicContact CD1-CZ 3.68Å; L458-F481 HydrophobicContact CD2-CE1 3.99Å; L458-F481 HydrophobicContact CD2-CZ 3.95Å; L458-F481 HydrophobicContact CG-CD1 3.93Å; L458-F481 HydrophobicContact CG-CD2 4.37Å; L458-F481 HydrophobicContact CG-CE1 3.67Å; L458-F481 HydrophobicContact CG-CE2 4.18Å; L458-F481 HydrophobicContact CG-CG 4.29Å; L458-F481 HydrophobicContact CG-CZ 3.83Å
459	S	97.1	Very high	97.5	Very high	59 Å²	59	65.4 Å²	65.4	41%	0.413	34%	0.337	S	S	.	.			trans	-59.6	162	159.3	64.9	0	0	0	0	110.9	C461 E462 R463	S459-C461 VanDerWaalsContact C-N 3.34Å; S459-C461 PolarHBondContact O-N 3.35Å; S459-E462 WeakPolarHBondContact CB-OE2 3.37Å; S459-E462 PolarHBondContact N-OE2 3.29Å; S459-E462 PolarHBondContact O-N 3.43Å; S459-E462 WeakPolarHBondContact OG-CB 3.1Å; S459-E462 VanDerWaalsContact OG-CD 3.32Å; S459-E462 WeakPolarHBondContact OG-CG 3.49Å; S459-E462 PolarHBondContact OG-N 3.03Å; S459-E462 PolarHBondContact OG-OE2 2.89Å; S459-R463 WeakPolarHBondContact O-CB 3.29Å; S459-R463 PolarHBondContact O-N 2.9Å
460	V	96.5	Very high	97.4	Very high	77 Å²	77	63.9 Å²	63.9	47%	0.467	33%	0.33	S	S	.	.	H	α-helix	trans	-58.2	-46.8	-179.7	-178.5	0	0	0	0	111	E462 R463 L464	V460-E462 PolarHBondContact O-N 2.99Å; V460-R463 WeakPolarHBondContact O-CB 3.34Å; V460-R463 PolarHBondContact O-N 3.42Å; V460-R463 VanDerWaalsContact O-N 3.16Å; V460-L464 HydrophobicContact CG1-CD1 4.01Å; V460-L464 HydrophobicContact CG1-CG 4.48Å; V460-L464 WeakPolarHBondContact O-CG 3.34Å; V460-L464 PolarHBondContact O-N 3.16Å
461	C	97.3	Very high	97.4	Very high	59 Å²	59	67.5 Å²	67.5	40%	0.399	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-42.9	178.8	-57	0	0	0	0	112.8	S459 R463 N465	S459-C461 VanDerWaalsContact C-N 3.34Å; S459-C461 PolarHBondContact O-N 3.35Å; C461-R463 VanDerWaalsContact C-N 3.32Å; C461-R463 PolarHBondContact O-N 3.28Å; C461-N465 WeakPolarHBondContact O-CB 3.42Å; C461-N465 PolarHBondContact O-N 3.2Å; C461-N465 PolarHBondContact O-ND2 3.4Å
462	E	97.9	Very high	97.4	Very high	59 Å²	59	66.4 Å²	66.4	28%	0.276	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-35.9	175	-69.4	170	105.2	0	0	112.5	K451 L458 S459 V460 L466	K451-E462 VanDerWaalsContact CE-OE1 3.27Å; K451-E462 WeakPolarHBondContact CE-OE1 3.49Å; K451-E462 IonicContact NZ-OE1 3.85Å; K451-E462 PolarHBondContact NZ-OE1 3.26Å; L458-E462 HydrophobicContact CB-CB 4.34Å; L458-E462 HydrophobicContact CD2-CB 4.01Å; S459-E462 WeakPolarHBondContact CB-OE2 3.37Å; S459-E462 PolarHBondContact N-OE2 3.29Å; S459-E462 PolarHBondContact O-N 3.43Å; S459-E462 WeakPolarHBondContact OG-CB 3.1Å; S459-E462 VanDerWaalsContact OG-CD 3.32Å; S459-E462 WeakPolarHBondContact OG-CG 3.49Å; S459-E462 PolarHBondContact OG-N 3.03Å; S459-E462 PolarHBondContact OG-OE2 2.89Å; V460-E462 PolarHBondContact O-N 2.99Å; E462-L466 WeakPolarHBondContact O-CB 3.25Å; E462-L466 PolarHBondContact O-N 2.92Å
463	R	98.2	Very high	97.3	Very high	54 Å²	54	69.7 Å²	69.7	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-67.8	-43.9	179.8	-156.6	-171.6	-50.8	140.1	0.4	111.4	L458 S459 V460 C461 A467 E474 V477	L458-R463 HydrophobicContact CB-CB 4.12Å; L458-R463 HydrophobicContact CB-CG 4.47Å; L458-R463 HydrophobicContact CD1-CB 4.26Å; L458-R463 HydrophobicContact CD1-CG 4.09Å; L458-R463 PolarHBondContact O-NH2 2.89Å; S459-R463 WeakPolarHBondContact O-CB 3.29Å; S459-R463 PolarHBondContact O-N 2.9Å; V460-R463 WeakPolarHBondContact O-CB 3.34Å; V460-R463 PolarHBondContact O-N 3.42Å; V460-R463 VanDerWaalsContact O-N 3.16Å; C461-R463 VanDerWaalsContact C-N 3.32Å; C461-R463 PolarHBondContact O-N 3.28Å; R463-A467 WeakPolarHBondContact O-CB 3.46Å; R463-A467 PolarHBondContact O-N 2.96Å; R463-E474 HydrophobicContact CB-CG 4.3Å; R463-E474 VanDerWaalsContact CD-CG 3.49Å; R463-E474 WeakPolarHBondContact CD-OE1 3.35Å; R463-E474 HydrophobicContact CG-CG 3.78Å; R463-E474 IonicContact CZ-OE1 2.62Å; R463-E474 IonicContact NE-OE1 2.64Å; R463-E474 IonicContact NH1-OE1 2.68Å; R463-E474 PolarHBondContact NH1-OE1 2.66Å; R463-V477 HydrophobicContact CG-CB 4.2Å; R463-V477 HydrophobicContact CG-CG1 3.83Å
464	L	98	Very high	97.4	Very high	75 Å²	75	66.6 Å²	66.6	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-50.3	172.9	-72	169.6	0	0	0	111.4	V460 L466 A467 L468 E474	V460-L464 HydrophobicContact CG1-CD1 4.01Å; V460-L464 HydrophobicContact CG1-CG 4.48Å; V460-L464 WeakPolarHBondContact O-CG 3.34Å; V460-L464 PolarHBondContact O-N 3.16Å; L464-L466 VanDerWaalsContact C-N 3.33Å; L464-L466 PolarHBondContact O-N 2.89Å; L464-A467 PolarHBondContact O-N 3.1Å; L464-L468 WeakPolarHBondContact O-CG 3.25Å; L464-L468 PolarHBondContact O-N 2.9Å; L464-E474 HydrophobicContact CD2-CB 4.45Å; L464-E474 HydrophobicContact CD2-CG 4.38Å; L464-E474 VanDerWaalsContact CD2-OE2 3.3Å; L464-E474 WeakPolarHBondContact CD2-OE2 3.37Å
465	N	97.8	Very high	97.4	Very high	108 Å²	108	64.1 Å²	64.1	58%	0.578	35%	0.347	S	S	*	.	H	α-helix	trans	-61.2	-41.4	179.3	-70.5	-11.2	0	0	0	111.9	C461 S469	C461-N465 WeakPolarHBondContact O-CB 3.42Å; C461-N465 PolarHBondContact O-N 3.2Å; C461-N465 PolarHBondContact O-ND2 3.4Å; N465-S469 WeakPolarHBondContact O-CB 3.31Å; N465-S469 PolarHBondContact O-N 2.94Å; N465-S469 PolarHBondContact O-OG 3.48Å
466	L	98.1	Very high	97.5	Very high	15 Å²	15	65.1 Å²	65.1	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-67.8	-42.1	177.7	-170.1	64.6	0	0	0	111.8	T447 L448 K451 L458 E462 L464 S469 L470 V477 F481	T447-L466 HydrophobicContact CG2-CD1 4.27Å; L448-L466 HydrophobicContact CD2-CD2 3.87Å; L448-L466 HydrophobicContact CD2-CG 4.34Å; K451-L466 HydrophobicContact CB-CD1 4.42Å; K451-L466 HydrophobicContact CB-CD2 4.22Å; K451-L466 HydrophobicContact CG-CD2 3.95Å; L458-L466 HydrophobicContact CD1-CD2 3.78Å; E462-L466 WeakPolarHBondContact O-CB 3.25Å; E462-L466 PolarHBondContact O-N 2.92Å; L464-L466 VanDerWaalsContact C-N 3.33Å; L464-L466 PolarHBondContact O-N 2.89Å; L466-S469 WeakPolarHBondContact CA-OG 3.36Å; L466-S469 PolarHBondContact O-N 2.9Å; L466-S469 PolarHBondContact O-OG 3.4Å; L466-L470 HydrophobicContact CD1-CD1 3.96Å; L466-L470 HydrophobicContact CD1-CG 4.42Å; L466-L470 HydrophobicContact CG-CD1 4.08Å; L466-L470 WeakPolarHBondContact O-CB 3.47Å; L466-L470 WeakPolarHBondContact O-CG 3.22Å; L466-L470 PolarHBondContact O-N 2.69Å; L466-V477 HydrophobicContact CD2-CG1 3.92Å; L466-F481 HydrophobicContact CD2-CE2 3.79Å; L466-F481 HydrophobicContact CD2-CZ 4.23Å
467	A	98.2	Very high	97.5	Very high	5 Å²	5	63 Å²	63	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-58.6	-50.4	175.6	0	0	0	0	0	111.6	R463 L464 S469 L470 N471 L472 V477	R463-A467 WeakPolarHBondContact O-CB 3.46Å; R463-A467 PolarHBondContact O-N 2.96Å; L464-A467 PolarHBondContact O-N 3.1Å; A467-S469 PolarHBondContact O-N 3.37Å; A467-L470 PolarHBondContact O-N 3.36Å; A467-N471 PolarHBondContact O-N 3.2Å; A467-N471 VanDerWaalsContact O-N 3.16Å; A467-L472 CarbonylContact C-O 3.42Å; A467-L472 WeakPolarHBondContact CB-O 3.35Å; A467-L472 PolarHBondContact O-N 3.45Å; A467-V477 HydrophobicContact CB-CG2 3.87Å
468	L	97.8	Very high	97.5	Very high	132 Å²	132	63.4 Å²	63.4	69%	0.691	35%	0.346	S	S	*	.	H	α-helix	trans	-58.6	-47.2	175.2	-69.8	171.3	0	0	0	112	L464 L470 N471	L464-L468 WeakPolarHBondContact O-CG 3.25Å; L464-L468 PolarHBondContact O-N 2.9Å; L468-L470 PolarHBondContact O-N 3.1Å; L468-L470 VanDerWaalsContact O-N 3.13Å; L468-N471 PolarHBondContact O-N 3.36Å
469	S	97.7	Very high	97.5	Very high	75 Å²	75	67 Å²	67	52%	0.524	36%	0.364	S	S	.	.	H	α-helix	trans	-65.7	-14.7	-178.3	70.9	0	0	0	0	115	N465 L466 A467	N465-S469 WeakPolarHBondContact O-CB 3.31Å; N465-S469 PolarHBondContact O-N 2.94Å; N465-S469 PolarHBondContact O-OG 3.48Å; L466-S469 WeakPolarHBondContact CA-OG 3.36Å; L466-S469 PolarHBondContact O-N 2.9Å; L466-S469 PolarHBondContact O-OG 3.4Å; A467-S469 PolarHBondContact O-N 3.37Å
470	L	97.3	Very high	97.6	Very high	15 Å²	15	65.5 Å²	65.5	8%	0.079	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	2.1	-176.2	-66.7	-176.3	0	0	0	113.6	Q444 T447 L448 L466 A467 L468 L472	Q444-L470 HydrophobicContact CG-CB 4.3Å; Q444-L470 HydrophobicContact CG-CD2 4.38Å; Q444-L470 PolarHBondContact NE2-O 3.15Å; T447-L470 HydrophobicContact CG2-CD1 4.41Å; T447-L470 HydrophobicContact CG2-CD2 3.91Å; L448-L470 HydrophobicContact CD1-CD1 4.37Å; L448-L470 HydrophobicContact CD2-CD1 3.81Å; L448-L470 HydrophobicContact CG-CD1 3.68Å; L466-L470 HydrophobicContact CD1-CD1 3.96Å; L466-L470 HydrophobicContact CD1-CG 4.42Å; L466-L470 HydrophobicContact CG-CD1 4.08Å; L466-L470 WeakPolarHBondContact O-CB 3.47Å; L466-L470 WeakPolarHBondContact O-CG 3.22Å; L466-L470 PolarHBondContact O-N 2.69Å; A467-L470 PolarHBondContact O-N 3.36Å; L468-L470 PolarHBondContact O-N 3.1Å; L468-L470 VanDerWaalsContact O-N 3.13Å; L470-L472 HydrophobicContact CB-CD1 4.08Å; L470-L472 HydrophobicContact CB-CG 3.99Å; L470-L472 HydrophobicContact CD1-CD1 4.36Å; L470-L472 PolarHBondContact O-N 3.41Å
471	N	97.4	Very high	97.7	Very high	152 Å²	152	62 Å²	62	81%	0.813	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.4	-171.2	-62.4	73.2	0	0	0	112.4	A467 L468	A467-N471 PolarHBondContact O-N 3.2Å; A467-N471 VanDerWaalsContact O-N 3.16Å; L468-N471 PolarHBondContact O-N 3.36Å
472	L	96.8	Very high	97.7	Very high	23 Å²	23	64.1 Å²	64.1	12%	0.12	33%	0.332	C	S	.	.			trans	-114	161	175.9	-63.1	-178.5	0	0	0	110.4	F440 L448 A467 L470 Q476 V477	F440-L472 HydrophobicContact CD1-CD1 3.83Å; F440-L472 HydrophobicContact CD1-CD2 3.79Å; F440-L472 HydrophobicContact CD1-CG 4.49Å; F440-L472 HydrophobicContact CE1-CD1 3.8Å; F440-L472 HydrophobicContact CE1-CD2 3.81Å; F440-L472 HydrophobicContact CE1-CG 4.44Å; L448-L472 HydrophobicContact CD1-CD1 4.16Å; A467-L472 CarbonylContact C-O 3.42Å; A467-L472 WeakPolarHBondContact CB-O 3.35Å; A467-L472 PolarHBondContact O-N 3.45Å; L470-L472 HydrophobicContact CB-CD1 4.08Å; L470-L472 HydrophobicContact CB-CG 3.99Å; L470-L472 HydrophobicContact CD1-CD1 4.36Å; L470-L472 PolarHBondContact O-N 3.41Å; L472-Q476 HydrophobicContact CB-CB 4.34Å; L472-V477 HydrophobicContact CB-CG2 4.22Å; L472-V477 HydrophobicContact CD1-CG2 4.45Å
473	T	97.2	Very high	97.6	Very high	74 Å²	74	66.2 Å²	66.2	45%	0.454	35%	0.345	S	S	.	.			trans	-79.7	154.7	169.7	71.3	0	0	0	0	111.2	T475 Q476 V477	T473-T475 PolarHBondContact O-N 2.82Å; T473-Q476 WeakPolarHBondContact O-CB 3.39Å; T473-Q476 PolarHBondContact O-N 2.62Å; T473-Q476 WeakPolarHBondContact OG1-CG 3.44Å; T473-Q476 PolarHBondContact OG1-N 3.48Å; T473-Q476 VanDerWaalsContact OG1-N 3.12Å; T473-V477 PolarHBondContact O-N 2.69Å; T473-V477 VanDerWaalsContact O-N 3.11Å
474	E	97.8	Very high	97.6	Very high	61 Å²	61	65.3 Å²	65.3	29%	0.285	34%	0.342	S	S	.	.	H	α-helix	trans	-55.1	-40	174.1	-168.8	-170.7	158.3	0	0	111.3	R463 L464 Q476 V477 K478	R463-E474 HydrophobicContact CB-CG 4.3Å; R463-E474 VanDerWaalsContact CD-CG 3.49Å; R463-E474 WeakPolarHBondContact CD-OE1 3.35Å; R463-E474 HydrophobicContact CG-CG 3.78Å; R463-E474 IonicContact CZ-OE1 2.62Å; R463-E474 IonicContact NE-OE1 2.64Å; R463-E474 IonicContact NH1-OE1 2.68Å; R463-E474 PolarHBondContact NH1-OE1 2.66Å; L464-E474 HydrophobicContact CD2-CB 4.45Å; L464-E474 HydrophobicContact CD2-CG 4.38Å; L464-E474 VanDerWaalsContact CD2-OE2 3.3Å; L464-E474 WeakPolarHBondContact CD2-OE2 3.37Å; E474-Q476 PolarHBondContact O-N 3.06Å; E474-V477 PolarHBondContact O-N 2.93Å; E474-K478 WeakPolarHBondContact O-CB 3.34Å; E474-K478 PolarHBondContact O-N 3.34Å
475	T	97.1	Very high	97.6	Very high	89 Å²	89	64 Å²	64	55%	0.546	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-40.4	176.2	-45.4	0	0	0	0	112.5	T473 V477 K478 I479	T473-T475 PolarHBondContact O-N 2.82Å; T475-V477 VanDerWaalsContact C-N 3.34Å; T475-V477 PolarHBondContact O-N 3.27Å; T475-K478 PolarHBondContact O-N 2.94Å; T475-I479 HydrophobicContact CG2-CD1 3.94Å; T475-I479 WeakPolarHBondContact O-CB 3.36Å; T475-I479 VanDerWaalsContact O-CG1 3.27Å; T475-I479 WeakPolarHBondContact O-CG1 3.48Å; T475-I479 PolarHBondContact O-N 3.42Å
476	Q	97	Very high	97.5	Very high	51 Å²	51	62.1 Å²	62.1	24%	0.238	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-41.1	174.1	-77.1	169.6	-24.5	0	0	111.5	F440 L472 T473 E474 W480	F440-Q476 HydrophobicContact CE1-CB 4.23Å; F440-Q476 HydrophobicContact CZ-CB 4.38Å; L472-Q476 HydrophobicContact CB-CB 4.34Å; T473-Q476 WeakPolarHBondContact O-CB 3.39Å; T473-Q476 PolarHBondContact O-N 2.62Å; T473-Q476 WeakPolarHBondContact OG1-CG 3.44Å; T473-Q476 PolarHBondContact OG1-N 3.48Å; T473-Q476 VanDerWaalsContact OG1-N 3.12Å; E474-Q476 PolarHBondContact O-N 3.06Å; Q476-W480 WeakPolarHBondContact O-CB 3.36Å; Q476-W480 PolarHBondContact O-N 2.92Å
477	V	98.1	Very high	97.4	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-43	175	179.2	0	0	0	0	111.3	L448 L458 R463 L466 A467 L472 T473 E474 T475 I479 W480 F481	L448-V477 HydrophobicContact CD2-CG1 4.39Å; L448-V477 HydrophobicContact CD2-CG2 4.46Å; L458-V477 HydrophobicContact CD1-CG1 3.63Å; R463-V477 HydrophobicContact CG-CB 4.2Å; R463-V477 HydrophobicContact CG-CG1 3.83Å; L466-V477 HydrophobicContact CD2-CG1 3.92Å; A467-V477 HydrophobicContact CB-CG2 3.87Å; L472-V477 HydrophobicContact CB-CG2 4.22Å; L472-V477 HydrophobicContact CD1-CG2 4.45Å; T473-V477 PolarHBondContact O-N 2.69Å; T473-V477 VanDerWaalsContact O-N 3.11Å; E474-V477 PolarHBondContact O-N 2.93Å; T475-V477 VanDerWaalsContact C-N 3.34Å; T475-V477 PolarHBondContact O-N 3.27Å; V477-I479 PolarHBondContact O-N 3.33Å; V477-W480 PolarHBondContact O-N 3.41Å; V477-F481 HydrophobicContact CG1-CD2 3.94Å; V477-F481 HydrophobicContact CG1-CE2 4.22Å; V477-F481 WeakPolarHBondContact O-CB 3.4Å; V477-F481 WeakPolarHBondContact O-CD2 3.25Å; V477-F481 PolarHBondContact O-N 3.01Å
478	K	97.6	Very high	97.2	Very high	132 Å²	132	68.2 Å²	68.2	57%	0.574	35%	0.348	S	S	*	.	H	α-helix	trans	-55.1	-51.1	174.3	-175.6	-174.8	176.6	-173.5	0	110.9	E474 T475 F481 Q482	E474-K478 WeakPolarHBondContact O-CB 3.34Å; E474-K478 PolarHBondContact O-N 3.34Å; T475-K478 PolarHBondContact O-N 2.94Å; K478-F481 PolarHBondContact O-N 2.79Å; K478-Q482 PolarHBondContact O-N 3.27Å
479	I	97.1	Very high	97	Very high	93 Å²	93	69.3 Å²	69.3	48%	0.477	35%	0.347	S	S	.	.	H	α-helix	trans	-65.6	-42.1	179.7	-69.9	169.3	0	0	0	111.4	T475 V477 Q482 N483	T475-I479 HydrophobicContact CG2-CD1 3.94Å; T475-I479 WeakPolarHBondContact O-CB 3.36Å; T475-I479 VanDerWaalsContact O-CG1 3.27Å; T475-I479 WeakPolarHBondContact O-CG1 3.48Å; T475-I479 PolarHBondContact O-N 3.42Å; V477-I479 PolarHBondContact O-N 3.33Å; I479-Q482 PolarHBondContact O-N 3.09Å; I479-N483 VanDerWaalsContact CG2-ND2 3.33Å; I479-N483 WeakPolarHBondContact CG2-ND2 3.4Å; I479-N483 WeakPolarHBondContact O-CB 3.45Å; I479-N483 PolarHBondContact O-N 3.17Å; I479-N483 PolarHBondContact O-ND2 3.09Å
480	W	98	Very high	96.8	Very high	27 Å²	27	74.2 Å²	74.2	10%	0.102	36%	0.359	C	S	.	.	H	α-helix	trans	-62.5	-45.5	176.8	-172.6	101.3	0	0	0	111.2	F440 L448 E449 F452 Q476 V477 Q482 N483 R484	F440-W480 AromaticContact CD2-CD1 3.87Å; F440-W480 AromaticContact CE2-CD1 3.7Å; L448-W480 HydrophobicContact CB-CD2 3.85Å; L448-W480 HydrophobicContact CB-CE3 3.9Å; L448-W480 HydrophobicContact CB-CH2 3.76Å; L448-W480 HydrophobicContact CB-CZ2 3.66Å; L448-W480 HydrophobicContact CB-CZ3 3.86Å; L448-W480 HydrophobicContact CD1-CD2 3.96Å; L448-W480 HydrophobicContact CD1-CG 3.87Å; L448-W480 HydrophobicContact CD2-CD2 4.31Å; L448-W480 HydrophobicContact CD2-CE3 4.25Å; L448-W480 HydrophobicContact CG-CD2 4.26Å; L448-W480 HydrophobicContact CG-CE3 4.48Å; E449-W480 HydrophobicContact CB-CH2 4.39Å; F452-W480 HydrophobicContact CB-CH2 4.09Å; F452-W480 HydrophobicContact CB-CZ3 3.95Å; F452-W480 HydrophobicContact CD2-CZ3 4.23Å; F452-W480 HydrophobicContact CG-CZ3 4.31Å; Q476-W480 WeakPolarHBondContact O-CB 3.36Å; Q476-W480 PolarHBondContact O-N 2.92Å; V477-W480 PolarHBondContact O-N 3.41Å; W480-Q482 PolarHBondContact O-N 3.16Å; W480-N483 PolarHBondContact O-N 2.87Å; W480-R484 HydrophobicContact CD2-CB 4.49Å; W480-R484 HydrophobicContact CE3-CB 3.98Å; W480-R484 HydrophobicContact CH2-CB 3.87Å; W480-R484 HydrophobicContact CH2-CG 3.59Å; W480-R484 HydrophobicContact CZ2-CB 4.41Å; W480-R484 HydrophobicContact CZ2-CG 4.32Å; W480-R484 HydrophobicContact CZ3-CB 3.64Å; W480-R484 HydrophobicContact CZ3-CG 3.75Å; W480-R484 VanDerWaalsContact O-CB 3.32Å; W480-R484 WeakPolarHBondContact O-CB 3.31Å; W480-R484 PolarHBondContact O-N 3.11Å
481	F	98.3	Very high	96.5	Very high	4 Å²	4	78.6 Å²	78.6	2%	0.018	38%	0.379	C	S	.	.	H	α-helix	trans	-65.1	-37.9	178.6	-94	-102.8	0	0	0	112.7	L448 K451 F452 T455 L458 L466 V477 K478 R484 R485	L448-F481 HydrophobicContact CD2-CE2 4.05Å; K451-F481 HydrophobicContact CB-CZ 4.31Å; K451-F481 HydrophobicContact CG-CZ 4.12Å; F452-F481 HydrophobicContact CB-CE1 4.15Å; F452-F481 HydrophobicContact CB-CZ 4.21Å; F452-F481 AromaticContact CD2-CD1 3.8Å; F452-F481 HydrophobicContact CD2-CD1 3.8Å; F452-F481 AromaticContact CD2-CE1 3.73Å; F452-F481 HydrophobicContact CD2-CE1 3.73Å; F452-F481 HydrophobicContact CD2-CZ 4.47Å; F452-F481 HydrophobicContact CE2-CD1 4.43Å; F452-F481 HydrophobicContact CG-CE1 4.44Å; T455-F481 WeakPolarHBondContact O-CE1 3.5Å; L458-F481 HydrophobicContact CD1-CD1 4.15Å; L458-F481 HydrophobicContact CD1-CD2 3.68Å; L458-F481 HydrophobicContact CD1-CE1 3.97Å; L458-F481 HydrophobicContact CD1-CE2 3.53Å; L458-F481 HydrophobicContact CD1-CG 4.03Å; L458-F481 HydrophobicContact CD1-CZ 3.68Å; L458-F481 HydrophobicContact CD2-CE1 3.99Å; L458-F481 HydrophobicContact CD2-CZ 3.95Å; L458-F481 HydrophobicContact CG-CD1 3.93Å; L458-F481 HydrophobicContact CG-CD2 4.37Å; L458-F481 HydrophobicContact CG-CE1 3.67Å; L458-F481 HydrophobicContact CG-CE2 4.18Å; L458-F481 HydrophobicContact CG-CG 4.29Å; L458-F481 HydrophobicContact CG-CZ 3.83Å; L466-F481 HydrophobicContact CD2-CE2 3.79Å; L466-F481 HydrophobicContact CD2-CZ 4.23Å; V477-F481 HydrophobicContact CG1-CD2 3.94Å; V477-F481 HydrophobicContact CG1-CE2 4.22Å; V477-F481 WeakPolarHBondContact O-CB 3.4Å; V477-F481 WeakPolarHBondContact O-CD2 3.25Å; V477-F481 PolarHBondContact O-N 3.01Å; K478-F481 PolarHBondContact O-N 2.79Å; F481-R484 PolarHBondContact O-N 2.85Å; F481-R485 WeakPolarHBondContact O-CG 3.48Å; F481-R485 PolarHBondContact O-N 3.18Å
482	Q	97.4	Very high	96.1	Very high	102 Å²	102	73.2 Å²	73.2	48%	0.477	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-51.3	174.2	-173.3	67	-6.6	0	0	111.2	K478 I479 W480 R484 R485 T486	K478-Q482 PolarHBondContact O-N 3.27Å; I479-Q482 PolarHBondContact O-N 3.09Å; W480-Q482 PolarHBondContact O-N 3.16Å; Q482-R484 PolarHBondContact O-N 2.98Å; Q482-R485 PolarHBondContact O-N 3.23Å; Q482-R485 VanDerWaalsContact O-N 3.16Å; Q482-T486 PolarHBondContact O-N 2.76Å; Q482-T486 PolarHBondContact O-OG1 3.13Å
483	N	97.5	Very high	95.5	Very high	103 Å²	103	77.3 Å²	77.3	55%	0.551	38%	0.378	S	S	*	.	H	α-helix	trans	-57.7	-37.5	175.5	-76.6	-50	0	0	0	112.3	I479 W480 T486 K487	I479-N483 VanDerWaalsContact CG2-ND2 3.33Å; I479-N483 WeakPolarHBondContact CG2-ND2 3.4Å; I479-N483 WeakPolarHBondContact O-CB 3.45Å; I479-N483 PolarHBondContact O-N 3.17Å; I479-N483 PolarHBondContact O-ND2 3.09Å; W480-N483 PolarHBondContact O-N 2.87Å; N483-T486 PolarHBondContact O-N 3.14Å; N483-K487 WeakPolarHBondContact O-CB 3.3Å; N483-K487 PolarHBondContact O-N 3.23Å
484	R	97.7	Very high	94.7	Very high	36 Å²	36	77.9 Å²	77.9	14%	0.136	40%	0.399	C	S	.	.	H	α-helix	trans	-70.2	-38.6	178.1	-172.3	62.9	-175.5	108.1	-9.2	112.6	E449 F452 W480 F481 Q482 K487 W488	E449-R484 IonicContact OE1-CZ 3.49Å; E449-R484 IonicContact OE1-NE 3.37Å; E449-R484 PolarHBondContact OE1-NE 3.37Å; E449-R484 IonicContact OE1-NH2 2.74Å; E449-R484 PolarHBondContact OE1-NH2 3.48Å; E449-R484 WeakPolarHBondContact OE2-CD 3.47Å; E449-R484 IonicContact OE2-CZ 3.58Å; E449-R484 IonicContact OE2-NE 2.71Å; E449-R484 PolarHBondContact OE2-NE 3.16Å; E449-R484 IonicContact OE2-NH2 3.57Å; F452-R484 HydrophobicContact CB-CG 4.4Å; F452-R484 HydrophobicContact CD1-CG 3.63Å; F452-R484 HydrophobicContact CD2-CB 4.01Å; F452-R484 HydrophobicContact CD2-CG 3.56Å; F452-R484 HydrophobicContact CE1-CG 3.7Å; F452-R484 HydrophobicContact CE2-CB 3.94Å; F452-R484 HydrophobicContact CE2-CG 3.62Å; F452-R484 HydrophobicContact CG-CB 4.49Å; F452-R484 HydrophobicContact CG-CG 3.57Å; F452-R484 HydrophobicContact CZ-CB 4.36Å; F452-R484 HydrophobicContact CZ-CG 3.7Å; W480-R484 HydrophobicContact CD2-CB 4.49Å; W480-R484 HydrophobicContact CE3-CB 3.98Å; W480-R484 HydrophobicContact CH2-CB 3.87Å; W480-R484 HydrophobicContact CH2-CG 3.59Å; W480-R484 HydrophobicContact CZ2-CB 4.41Å; W480-R484 HydrophobicContact CZ2-CG 4.32Å; W480-R484 HydrophobicContact CZ3-CB 3.64Å; W480-R484 HydrophobicContact CZ3-CG 3.75Å; W480-R484 VanDerWaalsContact O-CB 3.32Å; W480-R484 WeakPolarHBondContact O-CB 3.31Å; W480-R484 PolarHBondContact O-N 3.11Å; F481-R484 PolarHBondContact O-N 2.85Å; Q482-R484 PolarHBondContact O-N 2.98Å; R484-K487 PolarHBondContact O-N 3.39Å; R484-W488 VanDerWaalsContact O-CB 3.31Å; R484-W488 WeakPolarHBondContact O-CB 3.44Å; R484-W488 PolarHBondContact O-N 3.25Å
485	R	97.4	Very high	93.5	Very high	47 Å²	47	81 Å²	81	18%	0.177	41%	0.412	C	S	.	.	H	α-helix	trans	-60.5	-48.6	170.2	-77.7	-171.3	-68.1	-92.7	2.5	111.4	F452 R456 Y457 F481 Q482 K487 W488 K489	F452-R485 HydrophobicContact CE2-CG 3.86Å; F452-R485 HydrophobicContact CZ-CG 4.22Å; R456-R485 WeakPolarHBondContact O-CD 3.43Å; R456-R485 PolarHBondContact O-NH1 3.42Å; Y457-R485 VanDerWaalsContact CE1-CD 3.46Å; F481-R485 WeakPolarHBondContact O-CG 3.48Å; F481-R485 PolarHBondContact O-N 3.18Å; Q482-R485 PolarHBondContact O-N 3.23Å; Q482-R485 VanDerWaalsContact O-N 3.16Å; R485-K487 VanDerWaalsContact C-N 3.32Å; R485-K487 PolarHBondContact O-N 3.06Å; R485-W488 WeakPolarHBondContact O-CA 3.23Å; R485-W488 PolarHBondContact O-N 3.34Å; R485-K489 PolarHBondContact O-N 3.25Å
486	T	96	Very high	91.9	Very high	68 Å²	68	83.1 Å²	83.1	42%	0.417	42%	0.42	S	S	.	.	H	α-helix	trans	-59.4	-42.6	177.7	-54.8	0	0	0	0	111.8	Q482 N483 K490	Q482-T486 PolarHBondContact O-N 2.76Å; Q482-T486 PolarHBondContact O-OG1 3.13Å; N483-T486 PolarHBondContact O-N 3.14Å; T486-K490 PolarHBondContact O-N 3.16Å
487	K	95.8	Very high	90.3	Very high	121 Å²	121	82.8 Å²	82.8	53%	0.526	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-39.7	172.5	-172.7	177.6	179.6	179.9	0	112.2	N483 R484 R485 K490 Q491	N483-K487 WeakPolarHBondContact O-CB 3.3Å; N483-K487 PolarHBondContact O-N 3.23Å; R484-K487 PolarHBondContact O-N 3.39Å; R485-K487 VanDerWaalsContact C-N 3.32Å; R485-K487 PolarHBondContact O-N 3.06Å; K487-K490 PolarHBondContact O-N 3.34Å; K487-Q491 HydrophobicContact CG-CG 4.48Å; K487-Q491 WeakPolarHBondContact O-CB 3.38Å; K487-Q491 VanDerWaalsContact O-CG 3.26Å; K487-Q491 WeakPolarHBondContact O-CG 3.35Å; K487-Q491 PolarHBondContact O-N 3.06Å; K487-Q491 VanDerWaalsContact O-N 3.08Å
488	W	95.1	Very high	88.3	Confident	27 Å²	27	90.3 Å²	90.3	10%	0.102	46%	0.461	C	S	.	.	H	α-helix	trans	-66.1	-43.1	179.3	-175.8	80	0	0	0	112.3	F452 R484 R485 K490 Q491 N492 K495 V497	F452-W488 HydrophobicContact CE1-CB 4.07Å; F452-W488 HydrophobicContact CE1-CG 4.11Å; F452-W488 HydrophobicContact CZ-CB 3.98Å; F452-W488 HydrophobicContact CZ-CG 4.29Å; R484-W488 VanDerWaalsContact O-CB 3.31Å; R484-W488 WeakPolarHBondContact O-CB 3.44Å; R484-W488 PolarHBondContact O-N 3.25Å; R485-W488 WeakPolarHBondContact O-CA 3.23Å; R485-W488 PolarHBondContact O-N 3.34Å; W488-K490 PolarHBondContact O-N 3.43Å; W488-Q491 CarbonylContact O-C 3.53Å; W488-Q491 PolarHBondContact O-N 3.11Å; W488-N492 HydrophobicContact CH2-CB 4.45Å; W488-N492 HydrophobicContact CZ2-CB 4.05Å; W488-N492 PolarHBondContact NE1-ND2 3.23Å; W488-N492 PolarHBondContact O-N 3.13Å; W488-N492 PolarHBondContact O-ND2 3.1Å; W488-N492 VanDerWaalsContact O-ND2 3.08Å; W488-K495 HydrophobicContact CH2-CB 4.19Å; W488-K495 VanDerWaalsContact CH2-O 3.25Å; W488-K495 WeakPolarHBondContact CH2-O 3.42Å; W488-K495 WeakPolarHBondContact CZ3-O 3.46Å; W488-V497 HydrophobicContact CE3-CG1 4.32Å; W488-V497 HydrophobicContact CZ3-CB 4.32Å; W488-V497 HydrophobicContact CZ3-CG1 3.98Å; W488-V497 HydrophobicContact CZ3-CG2 4.3Å
489	K	93.5	Very high	86.2	Confident	155 Å²	155	90.9 Å²	90.9	67%	0.674	47%	0.468	S	S	*	.	H	α-helix	trans	-56.8	-49	173.8	-172.1	162.2	87.7	161.9	0	110.7	R485 Q491 N492	R485-K489 PolarHBondContact O-N 3.25Å; K489-Q491 PolarHBondContact O-N 2.79Å; K489-N492 CarbonylContact O-C 3.32Å; K489-N492 PolarHBondContact O-N 3.34Å; K489-N492 VanDerWaalsContact O-N 3.14Å
490	K	92.7	Very high	84	Confident	178 Å²	178	89.1 Å²	89.1	77%	0.774	46%	0.457	S	S	*	.	H	α-helix	trans	-65.5	-19.7	175.8	-67.7	-169.7	178.2	-164.3	0	114.8	T486 K487 W488	T486-K490 PolarHBondContact O-N 3.16Å; K487-K490 PolarHBondContact O-N 3.34Å; W488-K490 PolarHBondContact O-N 3.43Å
491	Q	91.1	Very high	81.4	Confident	107 Å²	107	94.2 Å²	94.2	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-95	-9.8	175.8	-72.4	-179	-52.2	0	0	113.3	K487 W488 K489	K487-Q491 HydrophobicContact CG-CG 4.48Å; K487-Q491 WeakPolarHBondContact O-CB 3.38Å; K487-Q491 VanDerWaalsContact O-CG 3.26Å; K487-Q491 WeakPolarHBondContact O-CG 3.35Å; K487-Q491 PolarHBondContact O-N 3.06Å; K487-Q491 VanDerWaalsContact O-N 3.08Å; W488-Q491 CarbonylContact O-C 3.53Å; W488-Q491 PolarHBondContact O-N 3.11Å; K489-Q491 PolarHBondContact O-N 2.79Å
492	N	89	Confident	78.8	Confident	40 Å²	40	99.1 Å²	99.1	21%	0.214	51%	0.513	C	S	.	.	S	Bend	trans	-142.6	61.6	-175.5	-63.3	-98.5	0	0	0	110.4	W488 K489 K495	W488-N492 HydrophobicContact CH2-CB 4.45Å; W488-N492 HydrophobicContact CZ2-CB 4.05Å; W488-N492 PolarHBondContact NE1-ND2 3.23Å; W488-N492 PolarHBondContact O-N 3.13Å; W488-N492 PolarHBondContact O-ND2 3.1Å; W488-N492 VanDerWaalsContact O-ND2 3.08Å; K489-N492 CarbonylContact O-C 3.32Å; K489-N492 PolarHBondContact O-N 3.34Å; K489-N492 VanDerWaalsContact O-N 3.14Å; N492-K495 HydrophobicContact CB-CB 4.19Å; N492-K495 HydrophobicContact CB-CD 4.25Å; N492-K495 PolarHBondContact O-N 2.86Å
493	P	84.1	Confident	76.3	Confident	108 Å²	108	99.4 Å²	99.4	70%	0.701	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	145.7	168.6	27.4	-34.8	0	0	0	110	K495	P493-K495 VanDerWaalsContact C-N 3.28Å; P493-K495 PolarHBondContact O-N 3.09Å
494	G	79.9	Confident	73.6	Confident	87 Å²	87	96.6 Å²	96.6	90%	0.897	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	15.8	-178.4	0	0	0	0	0	115.8
495	K	72.5	Confident	71	Confident	127 Å²	127	102.8 Å²	102.8	55%	0.552	53%	0.53	S	S	*	.			trans	-124.4	101.8	172.3	-63.6	-175.9	-173.2	168.3	0	111.1	W488 N492 P493	W488-K495 HydrophobicContact CH2-CB 4.19Å; W488-K495 VanDerWaalsContact CH2-O 3.25Å; W488-K495 WeakPolarHBondContact CH2-O 3.42Å; W488-K495 WeakPolarHBondContact CZ3-O 3.46Å; N492-K495 HydrophobicContact CB-CB 4.19Å; N492-K495 HydrophobicContact CB-CD 4.25Å; N492-K495 PolarHBondContact O-N 2.86Å; P493-K495 VanDerWaalsContact C-N 3.28Å; P493-K495 PolarHBondContact O-N 3.09Å
496	D	64.8	Low	68.4	Low	133 Å²	133	106.8 Å²	106.8	71%	0.711	55%	0.553	S	S	*	*			trans	-62.2	146.2	178.9	-66.9	-40.5	0	0	0	112.7	N498	D496-N498 PolarHBondContact O-N 3.48Å
497	V	62.3	Low	65.9	Low	43 Å²	43	107 Å²	107	26%	0.261	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	-10.7	-174.9	-143.8	0	0	0	0	112.6	R456 Y457 W488	R456-V497 HydrophobicContact CB-CG1 4.24Å; Y457-V497 HydrophobicContact CE2-CB 4.12Å; Y457-V497 HydrophobicContact CE2-CG1 3.53Å; W488-V497 HydrophobicContact CE3-CG1 4.32Å; W488-V497 HydrophobicContact CZ3-CB 4.32Å; W488-V497 HydrophobicContact CZ3-CG1 3.98Å; W488-V497 HydrophobicContact CZ3-CG2 4.3Å
498	N	57.1	Low	63.4	Low	159 Å²	159	109.5 Å²	109.5	85%	0.85	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-12.1	-174	-110.1	-20.4	0	0	0	115.5	D496 Q500	D496-N498 PolarHBondContact O-N 3.48Å; N498-Q500 PolarHBondContact O-N 3.46Å
499	M	52.6	Low	61.1	Low	143 Å²	143	113 Å²	113	70%	0.704	59%	0.593	S	S	*	*			trans	-75.4	47.2	178.5	-71.5	-169.2	70.6	0	0	113.6
500	Q	51	Low	58.8	Low	56 Å²	56	113.4 Å²	113.4	26%	0.262	60%	0.599	S	S	.	*			trans	-102	53.9	-179.3	-70.5	-129.4	-110.4	0	0	113.1	M454 R456 N498	M454-Q500 PolarHBondContact O-NE2 2.71Å; R456-Q500 VanDerWaalsContact CB-OE1 3.24Å; R456-Q500 VanDerWaalsContact CG-OE1 3.26Å; R456-Q500 VanDerWaalsContact NH1-CD 3.34Å; N498-Q500 PolarHBondContact O-N 3.46Å
501	N	43.3	Very low	56.5	Low	134 Å²	134	111.3 Å²	111.3	72%	0.717	60%	0.595	S	S	*	*			trans	-158.6	44.9	164.3	-111.9	-33.1	0	0	0	114.3	K503	N501-K503 PolarHBondContact O-N 3.16Å
502	D	43.2	Very low	53.7	Low	107 Å²	107	111.3 Å²	111.3	57%	0.572	61%	0.606	S	S	*	*			trans	-74.2	64.2	177.2	-114.9	-37.3	0	0	0	113.2	S504	D502-S504 PolarHBondContact O-N 3.08Å; D502-S504 VanDerWaalsContact O-N 3.16Å; D502-S504 VanDerWaalsContact OD1-CB 3.3Å; D502-S504 WeakPolarHBondContact OD1-CB 3.3Å; D502-S504 PolarHBondContact OD1-OG 3.03Å
503	K	45.9	Very low	51.2	Low	108 Å²	108	114.8 Å²	114.8	47%	0.47	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-7.9	163.6	-70.3	175.4	173.4	170.4	0	112.2	N501 F505 I506 E640	N501-K503 PolarHBondContact O-N 3.16Å; K503-F505 PolarHBondContact O-N 3.19Å; K503-I506 PolarHBondContact O-N 3.33Å; K503-E640 IonicContact NZ-OE1 2.69Å; K503-E640 PolarHBondContact NZ-OE1 3.46Å; K503-E640 IonicContact NZ-OE2 3.59Å; K503-E640 PolarHBondContact NZ-OE2 3.2Å
504	S	40.7	Very low	49.2	Very low	45 Å²	45	116.4 Å²	116.4	32%	0.315	64%	0.642	S	S	.	*	H	α-helix	trans	-59.7	-22.4	-178.8	74.8	0	0	0	0	114.6	D502 I506 S507 K508	D502-S504 PolarHBondContact O-N 3.08Å; D502-S504 VanDerWaalsContact O-N 3.16Å; D502-S504 VanDerWaalsContact OD1-CB 3.3Å; D502-S504 WeakPolarHBondContact OD1-CB 3.3Å; D502-S504 PolarHBondContact OD1-OG 3.03Å; S504-I506 VanDerWaalsContact C-N 3.34Å; S504-I506 PolarHBondContact O-N 2.82Å; S504-S507 WeakPolarHBondContact CA-OG 3.01Å; S504-S507 PolarHBondContact O-N 3.08Å; S504-S507 PolarHBondContact O-OG 3.39Å; S504-K508 PolarHBondContact O-N 3.02Å; S504-K508 VanDerWaalsContact O-N 3.16Å
505	F	42.9	Very low	47.2	Very low	165 Å²	165	118.1 Å²	118.1	72%	0.724	64%	0.641	S	S	*	*	H	α-helix	trans	-65.9	-34.3	-180	-167.9	-98.8	0	0	0	112.8	K503 V509	K503-F505 PolarHBondContact O-N 3.19Å; F505-V509 WeakPolarHBondContact O-CG2 3.39Å
506	I	43.9	Very low	45.6	Very low	132 Å²	132	117.2 Å²	117.2	68%	0.677	65%	0.65	S	S	*	*	H	α-helix	trans	-79.1	-38.9	179.2	-63.5	-179.7	0	0	0	110.8	K503 S504 K508 V509	K503-I506 PolarHBondContact O-N 3.33Å; S504-I506 VanDerWaalsContact C-N 3.34Å; S504-I506 PolarHBondContact O-N 2.82Å; I506-K508 PolarHBondContact O-N 3.05Å; I506-V509 PolarHBondContact O-N 3.01Å
507	S	43	Very low	44.4	Very low	73 Å²	73	118.9 Å²	118.9	51%	0.51	66%	0.658	S	S	.	*	H	α-helix	trans	-72.2	-23	-179.1	48.2	0	0	0	0	114.2	S504	S504-S507 WeakPolarHBondContact CA-OG 3.01Å; S504-S507 PolarHBondContact O-N 3.08Å; S504-S507 PolarHBondContact O-OG 3.39Å
508	K	43	Very low	43.2	Very low	172 Å²	172	122.2 Å²	122.2	75%	0.748	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-13.2	173.6	-81	-177.6	174.3	175.1	0	115.4	S504 I506	S504-K508 PolarHBondContact O-N 3.02Å; S504-K508 VanDerWaalsContact O-N 3.16Å; I506-K508 PolarHBondContact O-N 3.05Å
509	V	45.8	Very low	42.2	Very low	102 Å²	102	119.1 Å²	119.1	62%	0.618	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-20.7	-174.6	175.4	0	0	0	0	113.3	F505 I506	F505-V509 WeakPolarHBondContact O-CG2 3.39Å; I506-V509 PolarHBondContact O-N 3.01Å
510	M	47	Very low	41.6	Very low	162 Å²	162	118.9 Å²	118.9	80%	0.798	68%	0.681	S	S	*	*	S	Bend	trans	-103.3	1.3	-167.1	-72.5	-81.3	-109.5	0	0	116.2
511	I	43.3	Very low	41.1	Very low	135 Å²	135	122.1 Å²	122.1	69%	0.692	70%	0.704	S	S	*	*	S	Bend	trans	-104	-15.4	-172.4	-63.3	179.2	0	0	0	113.3	S513	I511-S513 PolarHBondContact O-N 2.78Å
512	S	33.5	Very low	40.8	Very low	106 Å²	106	120.6 Å²	120.6	74%	0.741	70%	0.704	S	S	*	*	S	Bend	trans	-91.3	46.9	-170.5	-56.2	0	0	0	0	115.3
513	S	36	Very low	40.5	Very low	113 Å²	113	121.6 Å²	121.6	79%	0.79	71%	0.714	S	S	*	*	S	Bend	trans	-163.5	51.6	175.5	-83.5	0	0	0	0	117.5	I511	I511-S513 PolarHBondContact O-N 2.78Å
514	T	41.2	Very low	40.2	Very low	142 Å²	142	122.7 Å²	122.7	87%	0.871	73%	0.73	S	S	*	*			trans	-152.4	56.1	168.7	34.5	0	0	0	0	114.6
515	S	37.5	Very low	40.1	Very low	124 Å²	124	126.1 Å²	126.1	87%	0.867	75%	0.754	S	S	*	*			trans	-141.2	54.3	178.5	52.2	0	0	0	0	114.5
516	S	40	Very low	39.7	Very low	108 Å²	108	126.6 Å²	126.6	76%	0.755	76%	0.76	S	S	*	*			trans	-149.5	159	167.1	65.8	0	0	0	0	112.9
517	L	40.4	Very low	39.7	Very low	167 Å²	167	125.4 Å²	125.4	87%	0.874	76%	0.761	S	S	*	*			trans	82.6	138.7	175.9	-49.6	176.4	0	0	0	117.7
518	S	35.4	Very low	39.4	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	77%	0.768	S	S	*	*			trans	62.5	85	170.5	-157.4	0	0	0	0	117.3
519	S	37.8	Very low	39.2	Very low	95 Å²	95	126 Å²	126	66%	0.664	77%	0.772	S	S	*	*			cis	84.4	111	42.6	87.9	0	0	0	0	116.7
520	T	39.7	Very low	38.8	Very low	137 Å²	137	129.3 Å²	129.3	84%	0.84	78%	0.779	S	S	*	*			trans	65.4	143.4	166.9	69.4	0	0	0	0	116.1
521	V	39.7	Very low	38.3	Very low	125 Å²	125	126.8 Å²	126.8	76%	0.758	78%	0.777	S	S	*	*			cis	-144	153.3	30.3	-83.2	0	0	0	0	114.3
522	S	38	Very low	38	Very low	102 Å²	102	125.3 Å²	125.3	71%	0.713	78%	0.779	S	S	*	*			trans	53.5	116.1	146.1	-56.3	0	0	0	0	123.1
523	T	36.9	Very low	38.1	Very low	128 Å²	128	128 Å²	128	79%	0.785	78%	0.783	S	S	*	*			trans	29.6	137.7	130.9	60.3	0	0	0	0	120.1
524	V	39.1	Very low	38.2	Very low	131 Å²	131	128.6 Å²	128.6	79%	0.794	78%	0.784	S	S	*	*				-153.2	152.6	56.4	-148.1	0	0	0	0	114.1
525	S	37.2	Very low	37.8	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	78%	0.778	S	S	*	*			trans	38	127.9	156.8	-66.2	0	0	0	0	124.8
526	M	35.6	Very low	37.9	Very low	175 Å²	175	127.8 Å²	127.8	86%	0.862	78%	0.778	S	S	*	*			trans	-99.1	-166.7	165	-84.1	-76.3	-170.8	0	0	110
527	P	43.1	Very low	37.6	Very low	107 Å²	107	131.7 Å²	131.7	70%	0.695	78%	0.784	S	S	*	*			cis	-141.7	-170.8	-45.3	38.5	-20.4	0	0	0	114.9
528	S	37.4	Very low	37.4	Very low	93 Å²	93	129 Å²	129	65%	0.65	78%	0.78	S	S	*	*			trans	78.1	128.7	135.2	-162.8	0	0	0	0	123.3
529	I	39.2	Very low	37.4	Very low	163 Å²	163	131.3 Å²	131.3	84%	0.836	78%	0.782	S	S	*	*			trans	-143	113.6	141.8	-41.1	177.2	0	0	0	105.1
530	F	37.5	Very low	37.1	Very low	173 Å²	173	130 Å²	130	76%	0.759	78%	0.784	S	S	*	*				35.8	141.3	100.5	-86.6	-100.3	0	0	0	115.5
531	S	35.8	Very low	37.1	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	79%	0.785	S	S	*	*			cis	-165.3	161	19.6	48.4	0	0	0	0	109.5
532	S	37.6	Very low	36.8	Very low	105 Å²	105	134 Å²	134	73%	0.734	79%	0.788	S	S	*	*			cis	-167.2	-176.3	-4.7	-99.3	0	0	0	0	110.1
533	I	34.9	Very low	36.8	Very low	163 Å²	163	141 Å²	141	84%	0.836	80%	0.799	S	S	*	*			trans	-119.7	143.2	179.9	-73.2	160.6	0	0	0	108.6
534	P	37.5	Very low	36.9	Very low	125 Å²	125	145.9 Å²	145.9	81%	0.812	80%	0.803	S	S	*	*				-150.4	160.7	104	38.7	-20.2	0	0	0	117.4
535	S	34	Very low	36.8	Very low	106 Å²	106	150 Å²	150	74%	0.741	80%	0.804	S	S	*	*			trans	-92.2	151.3	168.1	177.2	0	0	0	0	111.4
536	V	38.6	Very low	36.9	Very low	142 Å²	142	151.7 Å²	151.7	86%	0.861	80%	0.799	S	S	*	*			trans	-144.2	135.4	162.6	-84.5	0	0	0	0	110.5
537	Q	33.6	Very low	37.1	Very low	190 Å²	190	150.9 Å²	150.9	89%	0.888	79%	0.793	S	S	*	*			trans	-92.1	147.6	169.1	-60.3	161.4	-40.7	0	0	109.3
538	S	36.4	Very low	36.9	Very low	112 Å²	112	154.3 Å²	154.3	78%	0.783	80%	0.799	S	S	*	*			trans	176.2	148.4	137.4	-167.9	0	0	0	0	113
539	L	35.5	Very low	36.9	Very low	160 Å²	160	159.2 Å²	159.2	84%	0.838	81%	0.812	S	S	*	*			trans	-28.8	123.2	177.4	-69	67	0	0	0	118.6
540	G	32.9	Very low	36.9	Very low	69 Å²	69	160 Å²	160	71%	0.711	81%	0.811	S	S	*	*				51.4	133.3	110.6	0	0	0	0	0	122.9
541	I	38.1	Very low	37	Very low	168 Å²	168	159.5 Å²	159.5	86%	0.862	81%	0.811	S	S	*	*			trans	-161.8	141.3	136.4	-102.6	153.7	0	0	0	109.3
542	H	33.7	Very low	37.2	Very low	178 Å²	178	161.6 Å²	161.6	82%	0.824	81%	0.808	S	S	*	*			trans	-72.4	147.5	179.5	-57.7	-21.4	0	0	0	113.5
543	R	39.1	Very low	37.2	Very low	249 Å²	249	164.5 Å²	164.5	94%	0.94	81%	0.81	S	S	*	*			trans	-155	116	135.5	-112.7	166.1	-145.6	-110.1	3.1	114.6
544	R	38.8	Very low	37.3	Very low	230 Å²	230	163.1 Å²	163.1	87%	0.868	80%	0.804	S	S	*	*			trans	-19.8	139.9	168.7	-64.1	174.6	174.7	178.9	-2.9	119.1
545	R	36.1	Very low	37.3	Very low	217 Å²	217	162.4 Å²	162.4	82%	0.819	79%	0.789	S	S	*	*				27.4	126.1	127.7	-63.3	176.8	162.2	126.8	-1.2	117.5
546	H	39.8	Very low	37.5	Very low	152 Å²	152	165.2 Å²	165.2	70%	0.704	79%	0.791	S	S	*	*				-169.2	150.7	90.6	-100.6	-85	0	0	0	111.4
547	H	39.5	Very low	37.3	Very low	158 Å²	158	162 Å²	162	73%	0.731	77%	0.772	S	S	*	*			trans	19.1	117.1	168.8	-47.3	-62.8	0	0	0	120.4
548	H	38.9	Very low	37.3	Very low	180 Å²	180	158.3 Å²	158.3	83%	0.833	76%	0.755	S	S	*	*				-160.1	110.2	126.8	-103.9	75.3	0	0	0	108.2
549	H	38.1	Very low	37.3	Very low	196 Å²	196	156.6 Å²	156.6	91%	0.907	74%	0.741	S	S	*	*			trans	-129.5	56.9	179.1	-108.1	38.5	0	0	0	110.9
550	H	39.2	Very low	37.2	Very low	178 Å²	178	154.4 Å²	154.4	82%	0.824	73%	0.726	S	S	*	*			trans	-146	80.4	172.7	-96.5	-26.6	0	0	0	109.5
551	H	38	Very low	37.1	Very low	164 Å²	164	156.8 Å²	156.8	76%	0.759	72%	0.72	S	S	*	*			trans	-168	-13.1	159	-127.4	-63.3	0	0	0	117.3	H553	H551-H553 VanDerWaalsContact C-N 3.33Å; H551-H553 PolarHBondContact O-N 3.17Å; H551-H553 VanDerWaalsContact O-N 3.15Å
552	H	40.4	Very low	37	Very low	151 Å²	151	155 Å²	155	70%	0.699	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-79	0.9	-158.1	-144.6	-65.7	0	0	0	117	L554	H552-L554 PolarHBondContact O-N 3.4Å
553	H	38	Very low	37.3	Very low	167 Å²	167	151 Å²	151	77%	0.773	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-79.4	-1.9	179.4	-161.5	47.9	0	0	0	114.1	H551	H551-H553 VanDerWaalsContact C-N 3.33Å; H551-H553 PolarHBondContact O-N 3.17Å; H551-H553 VanDerWaalsContact O-N 3.15Å
554	L	37.8	Very low	37	Very low	134 Å²	134	146 Å²	146	70%	0.702	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-105.8	11.6	-175.7	-130.6	74.7	0	0	0	115.5	H552	H552-L554 PolarHBondContact O-N 3.4Å
555	Q	37.6	Very low	37.1	Very low	109 Å²	109	138.5 Å²	138.5	51%	0.509	66%	0.661	S	S	.	*	S	Bend	trans	-112.9	-11.2	-175.6	-72.7	-173.9	-1.4	0	0	115.9	T557 Q558	Q555-T557 PolarHBondContact O-N 2.91Å; Q555-Q558 PolarHBondContact O-N 3.48Å
556	Q	38.1	Very low	37.5	Very low	166 Å²	166	133.5 Å²	133.5	78%	0.776	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-12.6	176.9	-79.9	-175.4	-15	0	0	114.1
557	T	34.3	Very low	37.5	Very low	75 Å²	75	129.7 Å²	129.7	46%	0.46	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.2	-12.7	177.9	50.5	0	0	0	0	114.4	Q555 E560 M561	Q555-T557 PolarHBondContact O-N 2.91Å; T557-E560 PolarHBondContact O-N 3.22Å; T557-M561 PolarHBondContact O-N 2.71Å
558	Q	32.4	Very low	37.4	Very low	112 Å²	112	125.1 Å²	125.1	52%	0.523	62%	0.617	S	S	.	*	H	α-helix	trans	-63.1	-46.3	-175	-69.6	-160.5	-23.5	0	0	115.4	Q555 E560 M561 E562	Q555-Q558 PolarHBondContact O-N 3.48Å; Q558-E560 VanDerWaalsContact C-N 3.26Å; Q558-E560 PolarHBondContact O-N 2.89Å; Q558-M561 PolarHBondContact O-N 3.44Å; Q558-M561 VanDerWaalsContact O-N 3.16Å; Q558-E562 PolarHBondContact O-N 3.12Å
559	P	38	Very low	37.7	Very low	76 Å²	76	122.2 Å²	122.2	49%	0.494	60%	0.602	S	S	.	*	H	α-helix	trans	-68.5	-24.5	177.5	26.8	-34.7	0	0	0	113	N563	P559-N563 PolarHBondContact O-N 2.97Å; P559-N563 PolarHBondContact O-ND2 3.19Å
560	E	33.4	Very low	37.8	Very low	113 Å²	113	117.6 Å²	117.6	53%	0.528	58%	0.583	S	S	.	*	H	α-helix	trans	-72.1	-39.9	171.2	-64.2	-168.3	137.3	0	0	111.1	T557 Q558 N563 F564	T557-E560 PolarHBondContact O-N 3.22Å; Q558-E560 VanDerWaalsContact C-N 3.26Å; Q558-E560 PolarHBondContact O-N 2.89Å; E560-N563 PolarHBondContact O-N 3.12Å; E560-F564 WeakPolarHBondContact O-CB 3.34Å; E560-F564 PolarHBondContact O-N 2.86Å
561	M	28.9	Very low	37.8	Very low	119 Å²	119	117.1 Å²	117.1	59%	0.586	58%	0.576	S	S	*	*	H	α-helix	trans	-65.6	-37.8	172.7	-71.8	-154.9	-54.1	0	0	113.4	T557 Q558 F564 S565	T557-M561 PolarHBondContact O-N 2.71Å; Q558-M561 PolarHBondContact O-N 3.44Å; Q558-M561 VanDerWaalsContact O-N 3.16Å; M561-F564 PolarHBondContact O-N 3.31Å; M561-S565 WeakPolarHBondContact O-CB 3.38Å; M561-S565 PolarHBondContact O-N 3.49Å
562	E	36.5	Very low	38	Very low	132 Å²	132	117 Å²	117	62%	0.617	57%	0.57	S	S	*	*	H	α-helix	trans	-66	-40.2	175.4	-78.3	-159	128.7	0	0	112	Q558 F564 S565 Q566	Q558-E562 PolarHBondContact O-N 3.12Å; E562-F564 VanDerWaalsContact C-N 3.35Å; E562-S565 PolarHBondContact O-N 3.27Å; E562-Q566 WeakPolarHBondContact O-CB 3.46Å; E562-Q566 WeakPolarHBondContact O-CG 3.39Å; E562-Q566 PolarHBondContact O-N 3.02Å
563	N	39.8	Very low	38.6	Very low	94 Å²	94	114.1 Å²	114.1	50%	0.503	56%	0.556	S	S	.	*	H	α-helix	trans	-61.7	-42.6	171.4	-80.1	-53.6	0	0	0	111.7	P559 E560 S565 Q566 L567	P559-N563 PolarHBondContact O-N 2.97Å; P559-N563 PolarHBondContact O-ND2 3.19Å; E560-N563 PolarHBondContact O-N 3.12Å; N563-S565 PolarHBondContact O-N 2.82Å; N563-Q566 PolarHBondContact O-N 3.32Å; N563-L567 WeakPolarHBondContact O-CB 3.33Å; N563-L567 VanDerWaalsContact O-CG 3.28Å; N563-L567 WeakPolarHBondContact O-CG 3.46Å; N563-L567 PolarHBondContact O-N 3.34Å
564	F	33.3	Very low	38.9	Very low	144 Å²	144	109.7 Å²	109.7	63%	0.632	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-41.5	176.3	-155.3	-85.5	0	0	0	111.9	E560 M561 E562 L567 S568	E560-F564 WeakPolarHBondContact O-CB 3.34Å; E560-F564 PolarHBondContact O-N 2.86Å; M561-F564 PolarHBondContact O-N 3.31Å; E562-F564 VanDerWaalsContact C-N 3.35Å; F564-L567 PolarHBondContact O-N 3.31Å; F564-S568 WeakPolarHBondContact O-CB 3.1Å; F564-S568 PolarHBondContact O-N 3.43Å
565	S	41	Very low	38.9	Very low	72 Å²	72	105.9 Å²	105.9	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-51.1	175.2	-171.1	0	0	0	0	111.8	M561 E562 N563 L567 S568 K569	M561-S565 WeakPolarHBondContact O-CB 3.38Å; M561-S565 PolarHBondContact O-N 3.49Å; E562-S565 PolarHBondContact O-N 3.27Å; N563-S565 PolarHBondContact O-N 2.82Å; S565-L567 VanDerWaalsContact C-N 3.34Å; S565-L567 PolarHBondContact O-N 3.02Å; S565-S568 PolarHBondContact O-N 3.01Å; S565-S568 PolarHBondContact O-OG 3.26Å; S565-K569 PolarHBondContact O-N 3.48Å
566	Q	44.9	Very low	39.3	Very low	112 Å²	112	106.3 Å²	106.3	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-60.9	-40.1	177.5	-71.3	179.4	57.9	0	0	112.4	E562 N563 K569 L570	E562-Q566 WeakPolarHBondContact O-CB 3.46Å; E562-Q566 WeakPolarHBondContact O-CG 3.39Å; E562-Q566 PolarHBondContact O-N 3.02Å; N563-Q566 PolarHBondContact O-N 3.32Å; Q566-K569 PolarHBondContact O-N 3.44Å; Q566-L570 WeakPolarHBondContact O-CG 3.4Å; Q566-L570 PolarHBondContact O-N 3.12Å
567	L	38.9	Very low	39.7	Very low	72 Å²	72	101.9 Å²	101.9	38%	0.377	52%	0.523	S	S	.	.	H	α-helix	trans	-69.7	-38	175.8	-72.5	168.8	0	0	0	112.5	N563 F564 S565 K569 L570 Y571 Y641	N563-L567 WeakPolarHBondContact O-CB 3.33Å; N563-L567 VanDerWaalsContact O-CG 3.28Å; N563-L567 WeakPolarHBondContact O-CG 3.46Å; N563-L567 PolarHBondContact O-N 3.34Å; F564-L567 PolarHBondContact O-N 3.31Å; S565-L567 VanDerWaalsContact C-N 3.34Å; S565-L567 PolarHBondContact O-N 3.02Å; L567-K569 VanDerWaalsContact C-N 3.27Å; L567-K569 PolarHBondContact O-N 2.81Å; L567-L570 HydrophobicContact CD2-CD1 4.4Å; L567-L570 PolarHBondContact O-N 3.32Å; L567-Y571 WeakPolarHBondContact O-CB 3.45Å; L567-Y571 PolarHBondContact O-N 3.11Å; L567-Y641 HydrophobicContact CD1-CE2 3.58Å
568	S	37.1	Very low	39.7	Very low	62 Å²	62	102.2 Å²	102.2	43%	0.434	52%	0.522	S	S	.	.	H	α-helix	trans	-61.1	-38.5	171.9	80.3	0	0	0	0	111.8	F564 S565 Y571 Y572	F564-S568 WeakPolarHBondContact O-CB 3.1Å; F564-S568 PolarHBondContact O-N 3.43Å; S565-S568 PolarHBondContact O-N 3.01Å; S565-S568 PolarHBondContact O-OG 3.26Å; S568-Y571 PolarHBondContact O-N 3.31Å; S568-Y572 WeakPolarHBondContact O-CB 3.47Å; S568-Y572 PolarHBondContact O-N 3.37Å
569	K	45.6	Very low	39.8	Very low	119 Å²	119	106.9 Å²	106.9	52%	0.517	54%	0.541	S	S	.	.	H	α-helix	trans	-67.7	-44.6	176.9	-171.5	173.8	-178.7	-70.8	0	111.1	S565 Q566 L567 Y571 Y572 E573	S565-K569 PolarHBondContact O-N 3.48Å; Q566-K569 PolarHBondContact O-N 3.44Å; L567-K569 VanDerWaalsContact C-N 3.27Å; L567-K569 PolarHBondContact O-N 2.81Å; K569-Y571 PolarHBondContact O-N 3.35Å; K569-Y572 PolarHBondContact O-N 3.09Å; K569-E573 WeakPolarHBondContact CE-OE1 3.12Å; K569-E573 IonicContact NZ-OE1 2.61Å; K569-E573 PolarHBondContact NZ-OE1 3.48Å; K569-E573 IonicContact NZ-OE2 2.66Å; K569-E573 WeakPolarHBondContact O-CB 3.28Å; K569-E573 VanDerWaalsContact O-CG 3.3Å; K569-E573 WeakPolarHBondContact O-CG 3.47Å; K569-E573 PolarHBondContact O-N 2.89Å
570	L	41.4	Very low	39.7	Very low	98 Å²	98	108.3 Å²	108.3	51%	0.513	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-38.9	173.9	-76.3	169.6	0	0	0	112.7	Q566 L567 T574	Q566-L570 WeakPolarHBondContact O-CG 3.4Å; Q566-L570 PolarHBondContact O-N 3.12Å; L567-L570 HydrophobicContact CD2-CD1 4.4Å; L567-L570 PolarHBondContact O-N 3.32Å; L570-T574 VanDerWaalsContact O-CB 3.23Å; L570-T574 WeakPolarHBondContact O-CB 3.36Å; L570-T574 PolarHBondContact O-N 3.41Å; L570-T574 PolarHBondContact O-OG1 3.11Å
571	Y	38.6	Very low	39.6	Very low	169 Å²	169	107.3 Å²	107.3	66%	0.663	55%	0.549	S	S	*	.	H	α-helix	trans	-63.7	-46	173.5	178.9	-94.6	0	0	0	111.4	L567 S568 K569 T574 S575	L567-Y571 WeakPolarHBondContact O-CB 3.45Å; L567-Y571 PolarHBondContact O-N 3.11Å; S568-Y571 PolarHBondContact O-N 3.31Å; K569-Y571 PolarHBondContact O-N 3.35Å; Y571-T574 PolarHBondContact O-N 2.89Å; Y571-S575 WeakPolarHBondContact O-CB 3.26Å; Y571-S575 PolarHBondContact O-N 3.42Å
572	Y	42	Very low	39.7	Very low	161 Å²	161	105.9 Å²	105.9	63%	0.631	55%	0.549	S	S	*	.	H	α-helix	trans	-66	-40.7	178.7	-160.5	-99.5	0	0	0	112.5	S568 K569 S575 L576	S568-Y572 WeakPolarHBondContact O-CB 3.47Å; S568-Y572 PolarHBondContact O-N 3.37Å; K569-Y572 PolarHBondContact O-N 3.09Å; Y572-S575 WeakPolarHBondContact O-CB 3.3Å; Y572-S575 PolarHBondContact O-N 2.93Å; Y572-L576 HydrophobicContact CD1-CD1 3.69Å; Y572-L576 HydrophobicContact CD1-CG 4.46Å; Y572-L576 HydrophobicContact CE1-CD1 3.63Å; Y572-L576 HydrophobicContact CE1-CG 4.36Å; Y572-L576 WeakPolarHBondContact O-CB 3.17Å; Y572-L576 PolarHBondContact O-N 3.21Å
573	E	52.4	Low	39.6	Very low	90 Å²	90	108.9 Å²	108.9	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-66.5	-39.1	174.2	-73.7	173.4	174.7	0	0	111.9	K569 S575 L576 A577	K569-E573 WeakPolarHBondContact CE-OE1 3.12Å; K569-E573 IonicContact NZ-OE1 2.61Å; K569-E573 PolarHBondContact NZ-OE1 3.48Å; K569-E573 IonicContact NZ-OE2 2.66Å; K569-E573 WeakPolarHBondContact O-CB 3.28Å; K569-E573 VanDerWaalsContact O-CG 3.3Å; K569-E573 WeakPolarHBondContact O-CG 3.47Å; K569-E573 PolarHBondContact O-N 2.89Å; E573-S575 VanDerWaalsContact C-N 3.34Å; E573-L576 PolarHBondContact O-N 2.89Å; E573-A577 WeakPolarHBondContact O-CB 3.33Å; E573-A577 PolarHBondContact O-N 2.84Å
574	T	45.3	Very low	39.4	Very low	74 Å²	74	113.7 Å²	113.7	45%	0.454	58%	0.58	S	S	.	*	H	α-helix	trans	-67.6	-34.5	174.2	-57.7	0	0	0	0	112	L570 Y571 N578	L570-T574 VanDerWaalsContact O-CB 3.23Å; L570-T574 WeakPolarHBondContact O-CB 3.36Å; L570-T574 PolarHBondContact O-N 3.41Å; L570-T574 PolarHBondContact O-OG1 3.11Å; Y571-T574 PolarHBondContact O-N 2.89Å; T574-N578 PolarHBondContact O-N 3.14Å; T574-N578 PolarHBondContact O-ND2 3.41Å
575	S	38.3	Very low	39.4	Very low	55 Å²	55	109.9 Å²	109.9	39%	0.385	57%	0.565	S	S	.	*	H	α-helix	trans	-68.7	-40.4	173.7	-172.6	0	0	0	0	111.8	Y571 Y572 E573	Y571-S575 WeakPolarHBondContact O-CB 3.26Å; Y571-S575 PolarHBondContact O-N 3.42Å; Y572-S575 WeakPolarHBondContact O-CB 3.3Å; Y572-S575 PolarHBondContact O-N 2.93Å; E573-S575 VanDerWaalsContact C-N 3.34Å
576	L	45.7	Very low	39.6	Very low	117 Å²	117	109.4 Å²	109.4	61%	0.613	56%	0.561	S	S	*	*	H	α-helix	trans	-68.3	-33.4	173.8	-82.4	165.8	0	0	0	113.5	Y572 E573	Y572-L576 HydrophobicContact CD1-CD1 3.69Å; Y572-L576 HydrophobicContact CD1-CG 4.46Å; Y572-L576 HydrophobicContact CE1-CD1 3.63Å; Y572-L576 HydrophobicContact CE1-CG 4.36Å; Y572-L576 WeakPolarHBondContact O-CB 3.17Å; Y572-L576 PolarHBondContact O-N 3.21Å; E573-L576 PolarHBondContact O-N 2.89Å
577	A	47	Very low	39.4	Very low	74 Å²	74	108 Å²	108	61%	0.612	56%	0.56	S	S	*	*	H	α-helix	trans	-71.4	-37.3	178.7	0	0	0	0	0	113	E573	E573-A577 WeakPolarHBondContact O-CB 3.33Å; E573-A577 PolarHBondContact O-N 2.84Å
578	N	33.1	Very low	39.5	Very low	81 Å²	81	108 Å²	108	43%	0.433	56%	0.561	S	S	.	*			trans	-100.3	90.8	-172.8	-67.3	-60.4	0	0	0	112.3	T574 S580 I581	T574-N578 PolarHBondContact O-N 3.14Å; T574-N578 PolarHBondContact O-ND2 3.41Å; N578-S580 PolarHBondContact O-N 2.8Å; N578-I581 HydrophobicContact CB-CD1 3.9Å; N578-I581 HydrophobicContact CB-CG1 4.2Å
579	K	34.6	Very low	39.9	Very low	211 Å²	211	108.6 Å²	108.6	92%	0.917	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	29	-176.3	-65.3	-173.8	174.4	-179.1	0	116.6
580	S	35.7	Very low	39.8	Very low	105 Å²	105	105.9 Å²	105.9	73%	0.734	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.9	13.1	-178.1	68.4	0	0	0	0	115.2	N578	N578-S580 PolarHBondContact O-N 2.8Å
581	I	31.8	Very low	39.8	Very low	92 Å²	92	106.3 Å²	106.3	47%	0.472	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-91	127	173.8	-56.6	177	0	0	0	108.5	N578 K583	N578-I581 HydrophobicContact CB-CD1 3.9Å; N578-I581 HydrophobicContact CB-CG1 4.2Å; I581-K583 PolarHBondContact O-N 3.49Å
582	P	30.6	Very low	40.3	Very low	89 Å²	89	104 Å²	104	58%	0.578	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-58	136.9	172.3	-23.9	34.5	0	0	0	111.5
583	K	34	Very low	40.5	Very low	195 Å²	195	98.9 Å²	98.9	85%	0.848	52%	0.522	S	S	*	.	S	Bend	trans	-65.5	146.8	159.5	-65.8	-179.1	178.3	-178.1	0	107.9	I581	I581-K583 PolarHBondContact O-N 3.49Å
584	E	35.5	Very low	40	Very low	195 Å²	195	96.6 Å²	96.6	91%	0.911	51%	0.512	S	S	*	.			trans	60.4	64.8	-178.1	-64.7	163.9	-135.2	0	0	113
585	M	34.4	Very low	39.8	Very low	65 Å²	65	97.4 Å²	97.4	32%	0.32	51%	0.514	S	S	.	.			trans	-107.3	113.4	154.7	172.3	167.5	-83.1	0	0	107.8	E589 F590 T593	M585-E589 HydrophobicContact CE-CG 4.33Å; M585-E589 HydrophobicContact CG-CB 4.09Å; M585-E589 HydrophobicContact CG-CG 4.11Å; M585-F590 HydrophobicContact CG-CB 4.08Å; M585-F590 HydrophobicContact SD-CB 4.02Å; M585-F590 HydrophobicContact SD-CD2 4.39Å; M585-T593 HydrophobicContact CE-CG2 4.43Å; M585-T593 VanDerWaalsContact CE-OG1 3.26Å; M585-T593 WeakPolarHBondContact CE-OG1 3.43Å
586	S	44.1	Very low	40.2	Very low	62 Å²	62	102.2 Å²	102.2	43%	0.434	53%	0.525	S	S	.	.			trans	-68.4	161	178.8	62.8	0	0	0	0	112	L588 E589 F590	S586-L588 PolarHBondContact O-N 3.37Å; S586-E589 PolarHBondContact N-OE2 3.09Å; S586-E589 CarbonylContact O-C 3.59Å; S586-E589 WeakPolarHBondContact O-CA 3.3Å; S586-E589 WeakPolarHBondContact O-CB 3.49Å; S586-E589 PolarHBondContact O-N 3.45Å; S586-E589 WeakPolarHBondContact OG-CB 3.11Å; S586-E589 PolarHBondContact OG-N 3.24Å; S586-E589 PolarHBondContact OG-OE2 3.41Å; S586-F590 PolarHBondContact O-N 3.09Å
587	T	40.9	Very low	40	Very low	81 Å²	81	99.9 Å²	99.9	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-57.2	-38.7	179.4	-39.2	0	0	0	0	112.2	E589 L591 Y642	T587-E589 VanDerWaalsContact C-N 3.26Å; T587-E589 PolarHBondContact O-N 3.21Å; T587-L591 WeakPolarHBondContact O-CB 3.42Å; T587-L591 VanDerWaalsContact O-CG 3.26Å; T587-L591 WeakPolarHBondContact O-CG 3.33Å; T587-L591 PolarHBondContact O-N 3.43Å; T587-Y642 HydrophobicContact CG2-CE1 4.1Å
588	L	40.5	Very low	39.5	Very low	74 Å²	74	101.3 Å²	101.3	39%	0.387	51%	0.508	S	S	.	.	H	α-helix	trans	-66.3	-31.2	177	-168.4	152.6	0	0	0	111.6	S586 L591 R592	S586-L588 PolarHBondContact O-N 3.37Å; L588-L591 PolarHBondContact O-N 3.49Å; L588-R592 HydrophobicContact CD2-CG 4.27Å; L588-R592 WeakPolarHBondContact O-CG 3.47Å; L588-R592 PolarHBondContact O-N 2.82Å
589	E	47.3	Very low	39.8	Very low	74 Å²	74	101.9 Å²	101.9	35%	0.346	51%	0.511	S	S	.	.	H	α-helix	trans	-85.4	-34.9	-177.8	-169.1	161.6	-129.6	0	0	112.3	M585 S586 T587 L591 R592 T593	M585-E589 HydrophobicContact CE-CG 4.33Å; M585-E589 HydrophobicContact CG-CB 4.09Å; M585-E589 HydrophobicContact CG-CG 4.11Å; S586-E589 PolarHBondContact N-OE2 3.09Å; S586-E589 CarbonylContact O-C 3.59Å; S586-E589 WeakPolarHBondContact O-CA 3.3Å; S586-E589 WeakPolarHBondContact O-CB 3.49Å; S586-E589 PolarHBondContact O-N 3.45Å; S586-E589 WeakPolarHBondContact OG-CB 3.11Å; S586-E589 PolarHBondContact OG-N 3.24Å; S586-E589 PolarHBondContact OG-OE2 3.41Å; T587-E589 VanDerWaalsContact C-N 3.26Å; T587-E589 PolarHBondContact O-N 3.21Å; E589-L591 VanDerWaalsContact C-N 3.31Å; E589-R592 WeakPolarHBondContact O-CB 3.37Å; E589-R592 PolarHBondContact O-N 3.01Å; E589-T593 WeakPolarHBondContact O-CB 3.24Å; E589-T593 PolarHBondContact O-N 3.35Å; E589-T593 PolarHBondContact O-OG1 3.22Å; E589-T593 VanDerWaalsContact O-OG1 3.13Å
590	F	43.6	Very low	40.1	Very low	62 Å²	62	93.7 Å²	93.7	27%	0.272	48%	0.477	S	S	.	.	H	α-helix	trans	-58.1	-44.4	161.6	175	-101.8	0	0	0	110.8	M585 S586 T593 M594 L638	M585-F590 HydrophobicContact CG-CB 4.08Å; M585-F590 HydrophobicContact SD-CB 4.02Å; M585-F590 HydrophobicContact SD-CD2 4.39Å; S586-F590 PolarHBondContact O-N 3.09Å; F590-T593 PolarHBondContact O-N 3.41Å; F590-M594 HydrophobicContact CD1-CG 4.25Å; F590-M594 HydrophobicContact CD2-CG 4.28Å; F590-M594 HydrophobicContact CE1-CG 3.81Å; F590-M594 HydrophobicContact CE2-CG 3.85Å; F590-M594 HydrophobicContact CE2-SD 4.14Å; F590-M594 HydrophobicContact CG-CG 4.47Å; F590-M594 HydrophobicContact CZ-CG 3.6Å; F590-M594 HydrophobicContact CZ-SD 4.01Å; F590-M594 WeakPolarHBondContact O-CB 3.29Å; F590-M594 VanDerWaalsContact O-CG 3.32Å; F590-M594 WeakPolarHBondContact O-CG 3.42Å; F590-M594 PolarHBondContact O-N 2.91Å; F590-L638 HydrophobicContact CE1-CD2 4.11Å; F590-L638 HydrophobicContact CZ-CD2 3.98Å
591	L	41.4	Very low	40	Very low	106 Å²	106	92.2 Å²	92.2	56%	0.555	46%	0.461	S	S	*	.	H	α-helix	trans	-65.1	-38.9	174.9	-71.4	168.2	0	0	0	112.3	T587 L588 E589 N595	T587-L591 WeakPolarHBondContact O-CB 3.42Å; T587-L591 VanDerWaalsContact O-CG 3.26Å; T587-L591 WeakPolarHBondContact O-CG 3.33Å; T587-L591 PolarHBondContact O-N 3.43Å; L588-L591 PolarHBondContact O-N 3.49Å; E589-L591 VanDerWaalsContact C-N 3.31Å; L591-N595 WeakPolarHBondContact O-CB 3.3Å; L591-N595 PolarHBondContact O-N 3.12Å
592	R	47.1	Very low	40.1	Very low	121 Å²	121	93.2 Å²	93.2	46%	0.457	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-47.9	170.1	-77.3	172.5	177.8	154.6	1	111.5	L588 E589 N595 Y596	L588-R592 HydrophobicContact CD2-CG 4.27Å; L588-R592 WeakPolarHBondContact O-CG 3.47Å; L588-R592 PolarHBondContact O-N 2.82Å; E589-R592 WeakPolarHBondContact O-CB 3.37Å; E589-R592 PolarHBondContact O-N 3.01Å; R592-N595 PolarHBondContact O-N 3.24Å; R592-Y596 VanDerWaalsContact O-CB 3.31Å; R592-Y596 WeakPolarHBondContact O-CB 3.25Å; R592-Y596 PolarHBondContact O-N 3.26Å
593	T	47.7	Very low	40.2	Very low	53 Å²	53	93.7 Å²	93.7	33%	0.325	47%	0.468	S	S	.	.	H	α-helix	trans	-66.3	-41.5	-179.7	-64	0	0	0	0	111.8	M585 E589 F590 Y596 L597	M585-T593 HydrophobicContact CE-CG2 4.43Å; M585-T593 VanDerWaalsContact CE-OG1 3.26Å; M585-T593 WeakPolarHBondContact CE-OG1 3.43Å; E589-T593 WeakPolarHBondContact O-CB 3.24Å; E589-T593 PolarHBondContact O-N 3.35Å; E589-T593 PolarHBondContact O-OG1 3.22Å; E589-T593 VanDerWaalsContact O-OG1 3.13Å; F590-T593 PolarHBondContact O-N 3.41Å; T593-Y596 PolarHBondContact O-N 2.93Å; T593-L597 HydrophobicContact CG2-CD1 4Å; T593-L597 HydrophobicContact CG2-CG 4.47Å; T593-L597 WeakPolarHBondContact O-CB 3.23Å; T593-L597 VanDerWaalsContact O-CG 3.27Å; T593-L597 WeakPolarHBondContact O-CG 3.44Å; T593-L597 PolarHBondContact O-N 3.47Å
594	M	42.2	Very low	40	Very low	43 Å²	43	90.6 Å²	90.6	21%	0.212	46%	0.461	C	S	.	.	H	α-helix	trans	-63.7	-44.3	173.6	-72.7	-62.7	-66.9	0	0	111.5	F590 Y596 L597 M598 Y635	F590-M594 HydrophobicContact CD1-CG 4.25Å; F590-M594 HydrophobicContact CD2-CG 4.28Å; F590-M594 HydrophobicContact CE1-CG 3.81Å; F590-M594 HydrophobicContact CE2-CG 3.85Å; F590-M594 HydrophobicContact CE2-SD 4.14Å; F590-M594 HydrophobicContact CG-CG 4.47Å; F590-M594 HydrophobicContact CZ-CG 3.6Å; F590-M594 HydrophobicContact CZ-SD 4.01Å; F590-M594 WeakPolarHBondContact O-CB 3.29Å; F590-M594 VanDerWaalsContact O-CG 3.32Å; F590-M594 WeakPolarHBondContact O-CG 3.42Å; F590-M594 PolarHBondContact O-N 2.91Å; M594-Y596 PolarHBondContact O-N 3.49Å; M594-L597 PolarHBondContact O-N 3.25Å; M594-M598 WeakPolarHBondContact O-CB 3.29Å; M594-M598 WeakPolarHBondContact O-CG 3.35Å; M594-M598 PolarHBondContact O-N 3.22Å; M594-Y635 HydrophobicContact CE-CD1 4.39Å
595	N	41.3	Very low	39.8	Very low	90 Å²	90	86.2 Å²	86.2	48%	0.481	45%	0.447	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175.7	-167.4	16	0	0	0	111.5	L591 R592 M598 N599	L591-N595 WeakPolarHBondContact O-CB 3.3Å; L591-N595 PolarHBondContact O-N 3.12Å; R592-N595 PolarHBondContact O-N 3.24Å; N595-M598 PolarHBondContact O-N 2.94Å; N595-N599 WeakPolarHBondContact O-CB 3.35Å; N595-N599 PolarHBondContact O-N 3.43Å; N595-N599 PolarHBondContact O-ND2 3.2Å; N595-N599 PolarHBondContact OD1-ND2 3.2Å
596	Y	46.6	Very low	39.4	Very low	156 Å²	156	88 Å²	88	61%	0.612	47%	0.466	S	S	*	.	H	α-helix	trans	-61.3	-45.7	174	179.8	-89.3	0	0	0	112.2	R592 T593 M594 N599 N600	R592-Y596 VanDerWaalsContact O-CB 3.31Å; R592-Y596 WeakPolarHBondContact O-CB 3.25Å; R592-Y596 PolarHBondContact O-N 3.26Å; T593-Y596 PolarHBondContact O-N 2.93Å; M594-Y596 PolarHBondContact O-N 3.49Å; Y596-N599 PolarHBondContact O-N 3.34Å; Y596-N600 WeakPolarHBondContact CD2-ND2 3.48Å; Y596-N600 WeakPolarHBondContact CE2-ND2 3.29Å; Y596-N600 WeakPolarHBondContact O-CB 3.33Å; Y596-N600 PolarHBondContact O-N 2.94Å; Y596-N600 PolarHBondContact O-ND2 2.91Å
597	L	39.6	Very low	38.5	Very low	68 Å²	68	89.6 Å²	89.6	36%	0.356	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-46	177.6	-72.3	168.5	0	0	0	111.5	T593 M594 N599 N600 N601	T593-L597 HydrophobicContact CG2-CD1 4Å; T593-L597 HydrophobicContact CG2-CG 4.47Å; T593-L597 WeakPolarHBondContact O-CB 3.23Å; T593-L597 VanDerWaalsContact O-CG 3.27Å; T593-L597 WeakPolarHBondContact O-CG 3.44Å; T593-L597 PolarHBondContact O-N 3.47Å; M594-L597 PolarHBondContact O-N 3.25Å; L597-N599 VanDerWaalsContact C-N 3.32Å; L597-N599 PolarHBondContact O-N 3.29Å; L597-N600 PolarHBondContact O-N 3.35Å; L597-N601 PolarHBondContact O-N 3.16Å; L597-N601 PolarHBondContact O-ND2 2.99Å; L597-N601 VanDerWaalsContact O-ND2 3.13Å; L597-N601 PolarHBondContact O-OD1 3.41Å
598	M	37.9	Very low	37.9	Very low	104 Å²	104	91.7 Å²	91.7	51%	0.512	49%	0.49	S	S	.	.	H	α-helix	trans	-55.4	-46.1	176.8	-72.2	-74.6	-76.7	0	0	111.7	M594 N595 N601 L632	M594-M598 WeakPolarHBondContact O-CB 3.29Å; M594-M598 WeakPolarHBondContact O-CG 3.35Å; M594-M598 PolarHBondContact O-N 3.22Å; N595-M598 PolarHBondContact O-N 2.94Å; M598-N601 PolarHBondContact O-ND2 2.92Å; M598-L632 HydrophobicContact SD-CD2 3.86Å
599	N	40.1	Very low	37.3	Very low	94 Å²	94	95.4 Å²	95.4	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-78.7	-20.5	-176.9	-61.8	-25.5	0	0	0	114.1	N595 Y596 L597	N595-N599 WeakPolarHBondContact O-CB 3.35Å; N595-N599 PolarHBondContact O-N 3.43Å; N595-N599 PolarHBondContact O-ND2 3.2Å; N595-N599 PolarHBondContact OD1-ND2 3.2Å; Y596-N599 PolarHBondContact O-N 3.34Å; L597-N599 VanDerWaalsContact C-N 3.32Å; L597-N599 PolarHBondContact O-N 3.29Å
600	N	39.1	Very low	36.4	Very low	39 Å²	39	98.8 Å²	98.8	21%	0.209	53%	0.529	C	S	.	.	H	α-helix	trans	-99.9	2.6	-179.3	-73.8	-78.3	0	0	0	114.7	Y596 L597 N602 T603	Y596-N600 WeakPolarHBondContact CD2-ND2 3.48Å; Y596-N600 WeakPolarHBondContact CE2-ND2 3.29Å; Y596-N600 WeakPolarHBondContact O-CB 3.33Å; Y596-N600 PolarHBondContact O-N 2.94Å; Y596-N600 PolarHBondContact O-ND2 2.91Å; L597-N600 PolarHBondContact O-N 3.35Å; N600-N602 PolarHBondContact O-N 2.94Å; N600-T603 PolarHBondContact O-N 3.22Å; N600-T603 PolarHBondContact O-OG1 2.93Å
601	N	34.6	Very low	35.8	Very low	74 Å²	74	103.8 Å²	103.8	40%	0.396	56%	0.559	S	S	.	*	H	α-helix	trans	-57.9	-19.1	-174.9	-84.2	-43.9	0	0	0	115.6	L597 M598 T605	L597-N601 PolarHBondContact O-N 3.16Å; L597-N601 PolarHBondContact O-ND2 2.99Å; L597-N601 VanDerWaalsContact O-ND2 3.13Å; L597-N601 PolarHBondContact O-OD1 3.41Å; M598-N601 PolarHBondContact O-ND2 2.92Å; N601-T605 WeakPolarHBondContact O-CG2 3.38Å; N601-T605 PolarHBondContact O-OG1 3.47Å
602	N	32.7	Very low	35.4	Very low	112 Å²	112	108 Å²	108	60%	0.599	57%	0.573	S	S	*	*	H	α-helix	trans	-72.7	-23	175.8	-72.2	-29	0	0	0	114.1	N600 S606	N600-N602 PolarHBondContact O-N 2.94Å; N602-S606 PolarHBondContact O-OG 3.5Å
603	T	33.3	Very low	34.7	Very low	99 Å²	99	110.7 Å²	110.7	61%	0.607	59%	0.591	S	S	*	*	H	α-helix	trans	-91.4	-21.5	-178.3	57.6	0	0	0	0	113.8	N600	N600-T603 PolarHBondContact O-N 3.22Å; N600-T603 PolarHBondContact O-OG1 2.93Å
604	L	30.8	Very low	33.8	Very low	131 Å²	131	113.8 Å²	113.8	69%	0.686	61%	0.614	S	S	*	*	H	α-helix	trans	-93.1	-10.4	178.8	-89.9	73.1	0	0	0	114.6
605	T	30.4	Very low	33.4	Very low	103 Å²	103	116.7 Å²	116.7	63%	0.632	64%	0.636	S	S	*	*	S	Bend	trans	-110.5	-11.6	-173.2	53.7	0	0	0	0	114.8	N601	N601-T605 WeakPolarHBondContact O-CG2 3.38Å; N601-T605 PolarHBondContact O-OG1 3.47Å
606	S	26.7	Very low	32.9	Very low	102 Å²	102	118.2 Å²	118.2	71%	0.713	64%	0.644	S	S	*	*	S	Bend	trans	-95.5	8.9	-172	-56.2	0	0	0	0	115.1	N602	N602-S606 PolarHBondContact O-OG 3.5Å
607	S	25.5	Very low	32	Very low	96 Å²	96	121.9 Å²	121.9	67%	0.671	66%	0.659	S	S	*	*	S	Bend	trans	-113.2	16.7	-170.4	56.6	0	0	0	0	115.5
608	T	26.6	Very low	31.5	Very low	124 Å²	124	126.6 Å²	126.6	76%	0.761	68%	0.677	S	S	*	*	S	Bend	trans	-146.6	97.5	166.5	-13.4	0	0	0	0	113.4
609	I	28.7	Very low	31.1	Very low	153 Å²	153	130.3 Å²	130.3	79%	0.785	70%	0.698	S	S	*	*	S	Bend	trans	172.5	141.7	143.6	-92.5	154.8	0	0	0	107.4
610	N	27.6	Very low	30.6	Very low	144 Å²	144	131.3 Å²	131.3	77%	0.77	70%	0.703	S	S	*	*	S	Bend	trans	62.3	73.7	178.9	-58.2	-22.5	0	0	0	116.5
611	N	31.2	Very low	30.2	Very low	168 Å²	168	136.2 Å²	136.2	90%	0.898	73%	0.729	S	S	*	*				-146.2	146	110.8	-93.7	-30.9	0	0	0	109.9
612	K	33.5	Very low	29.8	Very low	194 Å²	194	139.3 Å²	139.3	84%	0.843	75%	0.745	S	S	*	*			trans	-99.2	169.2	171.1	-74.8	-178	174	178.8	0	109.1
613	E	33	Very low	29.6	Very low	178 Å²	178	139.3 Å²	139.3	83%	0.832	75%	0.754	S	S	*	*			trans	76.9	75.9	168.2	-62.2	169.6	-165.4	0	0	115.7
614	S	29.2	Very low	29.3	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	77%	0.767	S	S	*	*				38.4	154.5	113.4	-54.5	0	0	0	0	121.9
615	P	33.7	Very low	29.2	Very low	104 Å²	104	147.4 Å²	147.4	68%	0.675	78%	0.776	S	S	*	*			cis	-138.8	-167.5	-32.3	40.1	-21.7	0	0	0	113
616	D	29.5	Very low	29	Very low	122 Å²	122	150.2 Å²	150.2	65%	0.652	78%	0.782	S	S	*	*			trans	66	136.8	173.3	-58.1	-45.2	0	0	0	115.5
617	Y	29	Very low	29.1	Very low	233 Å²	233	151.5 Å²	151.5	91%	0.914	79%	0.788	S	S	*	*			cis	-119.2	167.7	23.6	-81.3	-105.8	0	0	0	114.6
618	K	27.8	Very low	29.1	Very low	168 Å²	168	152.5 Å²	152.5	73%	0.73	78%	0.784	S	S	*	*			trans	-94.3	141.5	-177.4	-59.9	164.5	-175.5	164.6	0	112.8
619	L	30.1	Very low	29.1	Very low	182 Å²	182	152.1 Å²	152.1	95%	0.953	79%	0.787	S	S	*	*			trans	-148.3	140	141.9	-113.8	160.3	0	0	0	108.3
620	N	29.7	Very low	29.1	Very low	115 Å²	115	150.2 Å²	150.2	62%	0.615	77%	0.773	S	S	*	*			trans	-113.7	169.4	-151.3	-64.4	-11.1	0	0	0	114.5
621	N	29.9	Very low	29.3	Very low	142 Å²	142	147 Å²	147	76%	0.759	76%	0.756	S	S	*	*			trans	73.3	97.9	162	-52.6	-21.2	0	0	0	113.9
622	D	27.4	Very low	29.4	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	74%	0.736	S	S	*	*				72.2	93.6	50.8	-60.2	-57.8	0	0	0	115.4
623	S	28.6	Very low	29.4	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	73%	0.729	S	S	*	*	S	Bend	trans	-149.3	124.9	139.9	-84.3	0	0	0	0	109.5
624	F	27.4	Very low	29.7	Very low	200 Å²	200	139.5 Å²	139.5	88%	0.877	72%	0.722	S	S	*	*			trans	56.4	64.6	170.2	-63.9	-80.9	0	0	0	118.3
625	K	28.7	Very low	30	Very low	200 Å²	200	137.8 Å²	137.8	87%	0.87	70%	0.699	S	S	*	*			trans	-78.3	110.5	144.2	-77.8	-175.8	177.7	177	0	110
626	Q	25.6	Very low	30.3	Very low	162 Å²	162	136 Å²	136	76%	0.757	69%	0.689	S	S	*	*			trans	-126	135.2	147.1	-76.4	-162.8	-2.3	0	0	108.5	I628	Q626-I628 PolarHBondContact O-N 2.95Å; Q626-I628 VanDerWaalsContact O-N 3.13Å
627	P	27.7	Very low	30.8	Very low	129 Å²	129	135.9 Å²	135.9	84%	0.838	69%	0.688	S	S	*	*			trans	-73.4	104	174.7	29.8	-32.1	0	0	0	109.3	S629	P627-S629 PolarHBondContact O-N 3.39Å; P627-S629 VanDerWaalsContact O-N 3.08Å
628	I	26.1	Very low	31.5	Very low	118 Å²	118	127.7 Å²	127.7	61%	0.605	66%	0.66	S	S	*	*			trans	-70	106.3	174.6	-57.1	176.5	0	0	0	108.1	Q626 F630	Q626-I628 PolarHBondContact O-N 2.95Å; Q626-I628 VanDerWaalsContact O-N 3.13Å; I628-F630 HydrophobicContact CB-CD2 4.15Å; I628-F630 HydrophobicContact CB-CE2 3.75Å; I628-F630 HydrophobicContact CB-CZ 4.31Å; I628-F630 HydrophobicContact CG2-CD1 4.41Å; I628-F630 HydrophobicContact CG2-CD2 3.79Å; I628-F630 HydrophobicContact CG2-CE1 4.16Å; I628-F630 HydrophobicContact CG2-CE2 3.51Å; I628-F630 HydrophobicContact CG2-CG 4.24Å; I628-F630 HydrophobicContact CG2-CZ 3.71Å; I628-F630 WeakPolarHBondContact O-CD2 3.34Å; I628-F630 PolarHBondContact O-N 2.84Å
629	S	25.9	Very low	32.2	Very low	116 Å²	116	125.1 Å²	125.1	81%	0.811	65%	0.653	S	S	*	*			trans	-72.8	95.7	171.2	-172.1	0	0	0	0	109.2	P627 D631	P627-S629 PolarHBondContact O-N 3.39Å; P627-S629 VanDerWaalsContact O-N 3.08Å; S629-D631 PolarHBondContact O-N 3.2Å
630	F	29.6	Very low	33	Very low	112 Å²	112	119.7 Å²	119.7	49%	0.491	62%	0.623	S	S	.	*			trans	-75.3	88.6	173	-74.5	-83.8	0	0	0	110.1	I628 L632 Y635	I628-F630 HydrophobicContact CB-CD2 4.15Å; I628-F630 HydrophobicContact CB-CE2 3.75Å; I628-F630 HydrophobicContact CB-CZ 4.31Å; I628-F630 HydrophobicContact CG2-CD1 4.41Å; I628-F630 HydrophobicContact CG2-CD2 3.79Å; I628-F630 HydrophobicContact CG2-CE1 4.16Å; I628-F630 HydrophobicContact CG2-CE2 3.51Å; I628-F630 HydrophobicContact CG2-CG 4.24Å; I628-F630 HydrophobicContact CG2-CZ 3.71Å; I628-F630 WeakPolarHBondContact O-CD2 3.34Å; I628-F630 PolarHBondContact O-N 2.84Å; F630-L632 PolarHBondContact O-N 3.37Å; F630-Y635 HydrophobicContact CD1-CE2 4.05Å
631	D	31.7	Very low	33.6	Very low	76 Å²	76	117.5 Å²	117.5	41%	0.406	61%	0.607	S	S	.	*			trans	-66.1	99	167.1	178	15.5	0	0	0	109.8	S629 N633 K634	S629-D631 PolarHBondContact O-N 3.2Å; D631-N633 PolarHBondContact O-N 2.95Å; D631-N633 WeakPolarHBondContact OD1-CB 3.48Å; D631-N633 PolarHBondContact OD1-N 2.81Å; D631-N633 PolarHBondContact OD1-ND2 3.44Å; D631-K634 HydrophobicContact CB-CB 4.31Å; D631-K634 WeakPolarHBondContact O-CB 3.47Å; D631-K634 PolarHBondContact O-N 2.95Å
632	L	34	Very low	34.1	Very low	94 Å²	94	115.5 Å²	115.5	49%	0.492	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	-27	-179.1	-78.9	163.1	0	0	0	112.8	M598 F630 K634 Y635	M598-L632 HydrophobicContact SD-CD2 3.86Å; F630-L632 PolarHBondContact O-N 3.37Å; L632-K634 PolarHBondContact O-N 2.81Å; L632-Y635 PolarHBondContact O-N 3.46Å; L632-Y635 VanDerWaalsContact O-N 3.12Å
633	N	33.3	Very low	34.9	Very low	128 Å²	128	114.1 Å²	114.1	68%	0.684	58%	0.578	S	S	*	*	H	α-helix	trans	-62.3	-30.9	175.3	-54.8	-75.1	0	0	0	111.5	D631 Y635 S636	D631-N633 PolarHBondContact O-N 2.95Å; D631-N633 WeakPolarHBondContact OD1-CB 3.48Å; D631-N633 PolarHBondContact OD1-N 2.81Å; D631-N633 PolarHBondContact OD1-ND2 3.44Å; N633-Y635 PolarHBondContact O-N 2.95Å; N633-S636 WeakPolarHBondContact O-CB 3.48Å; N633-S636 PolarHBondContact O-N 3.5Å; N633-S636 VanDerWaalsContact O-N 3.12Å
634	K	39.6	Very low	35.8	Very low	161 Å²	161	114.3 Å²	114.3	70%	0.7	57%	0.567	S	S	*	*	H	α-helix	trans	-66.9	-23.2	178.7	-147.6	170.9	-172.3	176.2	0	112.9	D631 L632	D631-K634 HydrophobicContact CB-CB 4.31Å; D631-K634 WeakPolarHBondContact O-CB 3.47Å; D631-K634 PolarHBondContact O-N 2.95Å; L632-K634 PolarHBondContact O-N 2.81Å
635	Y	35.3	Very low	36.4	Very low	81 Å²	81	107.5 Å²	107.5	32%	0.318	54%	0.539	S	S	.	.	H	α-helix	trans	-90.8	-9.9	175.1	-67.5	-89	0	0	0	113.5	M594 F630 L632 N633 N637 L638 L639	M594-Y635 HydrophobicContact CE-CD1 4.39Å; F630-Y635 HydrophobicContact CD1-CE2 4.05Å; L632-Y635 PolarHBondContact O-N 3.46Å; L632-Y635 VanDerWaalsContact O-N 3.12Å; N633-Y635 PolarHBondContact O-N 2.95Å; Y635-N637 VanDerWaalsContact C-N 3.28Å; Y635-N637 PolarHBondContact O-N 3.35Å; Y635-L638 HydrophobicContact CD1-CD2 4.13Å; Y635-L638 WeakPolarHBondContact O-CB 3.21Å; Y635-L638 PolarHBondContact O-N 3.48Å; Y635-L639 PolarHBondContact O-N 3.14Å
636	S	39.7	Very low	37	Very low	68 Å²	68	104.6 Å²	104.6	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-53.7	-46.1	173.9	-172.6	0	0	0	0	111.5	N633 L638 L639 E640	N633-S636 WeakPolarHBondContact O-CB 3.48Å; N633-S636 PolarHBondContact O-N 3.5Å; N633-S636 VanDerWaalsContact O-N 3.12Å; S636-L638 VanDerWaalsContact C-N 3.28Å; S636-L638 PolarHBondContact O-N 2.92Å; S636-L639 PolarHBondContact O-N 2.93Å; S636-E640 WeakPolarHBondContact O-CB 3.43Å; S636-E640 PolarHBondContact O-N 2.85Å
637	N	40.9	Very low	37.9	Very low	118 Å²	118	100.2 Å²	100.2	63%	0.631	51%	0.51	S	S	*	.	H	α-helix	trans	-62.8	-32.6	177.4	-63.5	-6.3	0	0	0	112.8	Y635 Y641	Y635-N637 VanDerWaalsContact C-N 3.28Å; Y635-N637 PolarHBondContact O-N 3.35Å; N637-Y641 VanDerWaalsContact O-CB 3.23Å; N637-Y641 WeakPolarHBondContact O-CB 3.31Å; N637-Y641 PolarHBondContact O-N 2.9Å
638	L	42.1	Very low	38.5	Very low	62 Å²	62	96.4 Å²	96.4	33%	0.325	49%	0.486	S	S	.	.	H	α-helix	trans	-74.7	-39.2	178.4	-172.2	68.9	0	0	0	111.2	F590 Y635 S636 Y641 Y642	F590-L638 HydrophobicContact CE1-CD2 4.11Å; F590-L638 HydrophobicContact CZ-CD2 3.98Å; Y635-L638 HydrophobicContact CD1-CD2 4.13Å; Y635-L638 WeakPolarHBondContact O-CB 3.21Å; Y635-L638 PolarHBondContact O-N 3.48Å; S636-L638 VanDerWaalsContact C-N 3.28Å; S636-L638 PolarHBondContact O-N 2.92Å; L638-Y641 HydrophobicContact CD1-CD1 4.29Å; L638-Y641 PolarHBondContact O-N 2.79Å; L638-Y642 HydrophobicContact CD1-CD2 4.38Å; L638-Y642 HydrophobicContact CD1-CE2 3.96Å; L638-Y642 HydrophobicContact CD2-CE2 4.48Å; L638-Y642 HydrophobicContact CG-CD2 4.14Å; L638-Y642 HydrophobicContact CG-CE2 3.97Å; L638-Y642 VanDerWaalsContact O-CD2 3.26Å; L638-Y642 WeakPolarHBondContact O-CD2 3.16Å; L638-Y642 PolarHBondContact O-N 2.7Å
639	L	43.3	Very low	39.1	Very low	113 Å²	113	95.1 Å²	95.1	59%	0.592	48%	0.48	S	S	*	.	H	α-helix	trans	-64.7	-44	173.6	-176.7	63.2	0	0	0	111.1	Y635 S636 Y641 Y642 Q643	Y635-L639 PolarHBondContact O-N 3.14Å; S636-L639 PolarHBondContact O-N 2.93Å; L639-Y641 VanDerWaalsContact C-N 3.34Å; L639-Y641 PolarHBondContact O-N 2.9Å; L639-Y642 PolarHBondContact O-N 2.91Å; L639-Q643 WeakPolarHBondContact O-CG 3.23Å; L639-Q643 PolarHBondContact O-N 3.3Å
640	E	47.1	Very low	39.8	Very low	68 Å²	68	92.2 Å²	92.2	32%	0.318	46%	0.455	S	S	.	.	H	α-helix	trans	-66.3	-34.9	176.9	-167.9	164.5	-118.6	0	0	112	K503 S636 Q643 Q644	K503-E640 IonicContact NZ-OE1 2.69Å; K503-E640 PolarHBondContact NZ-OE1 3.46Å; K503-E640 IonicContact NZ-OE2 3.59Å; K503-E640 PolarHBondContact NZ-OE2 3.2Å; S636-E640 WeakPolarHBondContact O-CB 3.43Å; S636-E640 PolarHBondContact O-N 2.85Å; E640-Q643 PolarHBondContact O-N 2.88Å; E640-Q644 VanDerWaalsContact O-CG 3.29Å; E640-Q644 WeakPolarHBondContact O-CG 3.49Å; E640-Q644 PolarHBondContact O-N 2.89Å
641	Y	42.5	Very low	40.9	Very low	70 Å²	70	93.3 Å²	93.3	28%	0.275	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-45.9	170.8	172.3	-109.4	0	0	0	112.7	L567 N637 L638 L639 Q643 Q644 I645	L567-Y641 HydrophobicContact CD1-CE2 3.58Å; N637-Y641 VanDerWaalsContact O-CB 3.23Å; N637-Y641 WeakPolarHBondContact O-CB 3.31Å; N637-Y641 PolarHBondContact O-N 2.9Å; L638-Y641 HydrophobicContact CD1-CD1 4.29Å; L638-Y641 PolarHBondContact O-N 2.79Å; L639-Y641 VanDerWaalsContact C-N 3.34Å; L639-Y641 PolarHBondContact O-N 2.9Å; Y641-Q643 VanDerWaalsContact C-N 3.34Å; Y641-Q643 PolarHBondContact O-N 2.94Å; Y641-Q644 WeakPolarHBondContact O-CB 3.42Å; Y641-Q644 PolarHBondContact O-N 3.13Å; Y641-I645 HydrophobicContact CD1-CD1 4.06Å; Y641-I645 HydrophobicContact CD2-CD1 4.49Å; Y641-I645 HydrophobicContact CE1-CD1 3.52Å; Y641-I645 HydrophobicContact CE2-CD1 3.99Å; Y641-I645 HydrophobicContact CE2-CG1 4.41Å; Y641-I645 VanDerWaalsContact CZ-CD1 3.49Å; Y641-I645 PolarHBondContact O-N 3.15Å
642	Y	40.1	Very low	41.1	Very low	99 Å²	99	94.9 Å²	94.9	39%	0.388	47%	0.465	S	S	.	.	H	α-helix	trans	-66.5	-34.1	175.1	-81.4	-65.6	0	0	0	112.8	T587 L638 L639 I645 W646	T587-Y642 HydrophobicContact CG2-CE1 4.1Å; L638-Y642 HydrophobicContact CD1-CD2 4.38Å; L638-Y642 HydrophobicContact CD1-CE2 3.96Å; L638-Y642 HydrophobicContact CD2-CE2 4.48Å; L638-Y642 HydrophobicContact CG-CD2 4.14Å; L638-Y642 HydrophobicContact CG-CE2 3.97Å; L638-Y642 VanDerWaalsContact O-CD2 3.26Å; L638-Y642 WeakPolarHBondContact O-CD2 3.16Å; L638-Y642 PolarHBondContact O-N 2.7Å; L639-Y642 PolarHBondContact O-N 2.91Å; Y642-I645 HydrophobicContact CD1-CD1 4.45Å; Y642-I645 PolarHBondContact O-N 2.77Å; Y642-W646 WeakPolarHBondContact O-CB 3.43Å; Y642-W646 PolarHBondContact O-N 3.21Å
643	Q	44.8	Very low	41.1	Very low	109 Å²	109	94.1 Å²	94.1	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-64.3	-38.6	171.4	-74.1	175.7	-5	0	0	112.4	L639 E640 Y641 S647	L639-Q643 WeakPolarHBondContact O-CG 3.23Å; L639-Q643 PolarHBondContact O-N 3.3Å; E640-Q643 PolarHBondContact O-N 2.88Å; Y641-Q643 VanDerWaalsContact C-N 3.34Å; Y641-Q643 PolarHBondContact O-N 2.94Å; Q643-S647 WeakPolarHBondContact O-CB 3.18Å; Q643-S647 PolarHBondContact O-N 2.88Å; Q643-S647 PolarHBondContact O-OG 3.34Å
644	Q	46.7	Very low	41.3	Very low	117 Å²	117	91.3 Å²	91.3	55%	0.547	45%	0.447	S	S	.	.	H	α-helix	trans	-65.7	-44.5	173.3	-73.3	170.9	23.6	0	0	111.8	E640 Y641 W646 S647 S648	E640-Q644 VanDerWaalsContact O-CG 3.29Å; E640-Q644 WeakPolarHBondContact O-CG 3.49Å; E640-Q644 PolarHBondContact O-N 2.89Å; Y641-Q644 WeakPolarHBondContact O-CB 3.42Å; Y641-Q644 PolarHBondContact O-N 3.13Å; Q644-W646 PolarHBondContact O-N 3.39Å; Q644-S647 PolarHBondContact O-N 3.21Å; Q644-S648 WeakPolarHBondContact O-CB 3.31Å; Q644-S648 PolarHBondContact O-N 3.21Å
645	I	40.3	Very low	41.2	Very low	56 Å²	56	87.5 Å²	87.5	29%	0.287	43%	0.434	S	S	.	.	H	α-helix	trans	-58	-49.4	174.1	-74.8	173.6	0	0	0	111	Y641 Y642 S647 S648 L649	Y641-I645 HydrophobicContact CD1-CD1 4.06Å; Y641-I645 HydrophobicContact CD2-CD1 4.49Å; Y641-I645 HydrophobicContact CE1-CD1 3.52Å; Y641-I645 HydrophobicContact CE2-CD1 3.99Å; Y641-I645 HydrophobicContact CE2-CG1 4.41Å; Y641-I645 VanDerWaalsContact CZ-CD1 3.49Å; Y641-I645 PolarHBondContact O-N 3.15Å; Y642-I645 HydrophobicContact CD1-CD1 4.45Å; Y642-I645 PolarHBondContact O-N 2.77Å; I645-S647 VanDerWaalsContact C-N 3.33Å; I645-S647 PolarHBondContact O-N 3.01Å; I645-S648 PolarHBondContact O-N 2.92Å; I645-L649 HydrophobicContact CG2-CD1 3.79Å; I645-L649 HydrophobicContact CG2-CG 4.47Å; I645-L649 WeakPolarHBondContact O-CB 3.46Å; I645-L649 WeakPolarHBondContact O-CG 3.27Å; I645-L649 PolarHBondContact O-N 3.3Å
646	W	41.7	Very low	41.1	Very low	140 Å²	140	87.6 Å²	87.6	53%	0.53	44%	0.439	S	S	.	.	H	α-helix	trans	-65.1	-38.7	-178.7	-172.3	84.2	0	0	0	112.2	Y642 Q644 N650	Y642-W646 WeakPolarHBondContact O-CB 3.43Å; Y642-W646 PolarHBondContact O-N 3.21Å; Q644-W646 PolarHBondContact O-N 3.39Å; W646-N650 VanDerWaalsContact CE2-ND2 3.28Å; W646-N650 WeakPolarHBondContact CH2-ND2 3.39Å; W646-N650 WeakPolarHBondContact CZ2-ND2 3.39Å; W646-N650 VanDerWaalsContact CZ3-ND2 3.31Å; W646-N650 WeakPolarHBondContact CZ3-ND2 3.21Å; W646-N650 WeakPolarHBondContact O-CB 3.1Å; W646-N650 PolarHBondContact O-N 3.36Å
647	S	44.6	Very low	40.7	Very low	69 Å²	69	88 Å²	88	48%	0.483	44%	0.435	S	S	.	.	H	α-helix	trans	-66.5	-37.4	174	-64.7	0	0	0	0	112.2	Q643 Q644 I645 K651	Q643-S647 WeakPolarHBondContact O-CB 3.18Å; Q643-S647 PolarHBondContact O-N 2.88Å; Q643-S647 PolarHBondContact O-OG 3.34Å; Q644-S647 PolarHBondContact O-N 3.21Å; I645-S647 VanDerWaalsContact C-N 3.33Å; I645-S647 PolarHBondContact O-N 3.01Å; S647-K651 VanDerWaalsContact O-CB 3.26Å; S647-K651 WeakPolarHBondContact O-CB 3.31Å; S647-K651 PolarHBondContact O-N 3.23Å
648	S	40.4	Very low	40.5	Very low	49 Å²	49	87.8 Å²	87.8	34%	0.343	43%	0.431	S	S	.	.	H	α-helix	trans	-70.7	-43	176	-163.1	0	0	0	0	111.8	Q644 I645 N650 K651 Q652	Q644-S648 WeakPolarHBondContact O-CB 3.31Å; Q644-S648 PolarHBondContact O-N 3.21Å; I645-S648 PolarHBondContact O-N 2.92Å; S648-N650 PolarHBondContact O-N 2.96Å; S648-K651 CarbonylContact O-C 3.54Å; S648-K651 PolarHBondContact O-N 3.19Å; S648-K651 VanDerWaalsContact O-N 3.14Å; S648-Q652 WeakPolarHBondContact O-CB 3.47Å; S648-Q652 WeakPolarHBondContact O-CG 3.48Å; S648-Q652 PolarHBondContact O-N 2.68Å
649	L	38.5	Very low	40	Very low	91 Å²	91	88.8 Å²	88.8	48%	0.476	44%	0.436	S	S	.	.	H	α-helix	trans	-59.3	-44.7	172.6	-78.5	165	0	0	0	112	I645 K651 Q652 N653	I645-L649 HydrophobicContact CG2-CD1 3.79Å; I645-L649 HydrophobicContact CG2-CG 4.47Å; I645-L649 WeakPolarHBondContact O-CB 3.46Å; I645-L649 WeakPolarHBondContact O-CG 3.27Å; I645-L649 PolarHBondContact O-N 3.3Å; L649-K651 VanDerWaalsContact C-N 3.35Å; L649-Q652 PolarHBondContact O-N 3.12Å; L649-N653 WeakPolarHBondContact O-CB 3.43Å; L649-N653 PolarHBondContact O-N 3.37Å
650	N	40.6	Very low	39.6	Very low	55 Å²	55	89.6 Å²	89.6	29%	0.294	44%	0.437	S	S	.	.	H	α-helix	trans	-67.4	-34.5	174.6	-80.3	-19.5	0	0	0	112.4	W646 S648 N654	W646-N650 VanDerWaalsContact CE2-ND2 3.28Å; W646-N650 WeakPolarHBondContact CH2-ND2 3.39Å; W646-N650 WeakPolarHBondContact CZ2-ND2 3.39Å; W646-N650 VanDerWaalsContact CZ3-ND2 3.31Å; W646-N650 WeakPolarHBondContact CZ3-ND2 3.21Å; W646-N650 WeakPolarHBondContact O-CB 3.1Å; W646-N650 PolarHBondContact O-N 3.36Å; S648-N650 PolarHBondContact O-N 2.96Å; N650-N654 WeakPolarHBondContact O-CB 3.29Å; N650-N654 PolarHBondContact O-N 2.77Å; N650-N654 PolarHBondContact O-ND2 2.8Å
651	K	51.1	Low	38.9	Very low	136 Å²	136	90 Å²	90	59%	0.591	45%	0.447	S	S	*	.	H	α-helix	trans	-70.3	-36.4	173.9	-167.3	178.4	-178.8	-173	0	111.7	S647 S648 L649 N655	S647-K651 VanDerWaalsContact O-CB 3.26Å; S647-K651 WeakPolarHBondContact O-CB 3.31Å; S647-K651 PolarHBondContact O-N 3.23Å; S648-K651 CarbonylContact O-C 3.54Å; S648-K651 PolarHBondContact O-N 3.19Å; S648-K651 VanDerWaalsContact O-N 3.14Å; L649-K651 VanDerWaalsContact C-N 3.35Å; K651-N655 WeakPolarHBondContact O-CB 3.15Å; K651-N655 PolarHBondContact O-N 3.32Å; K651-N655 PolarHBondContact O-OD1 2.92Å
652	Q	36.2	Very low	38.5	Very low	108 Å²	108	90.1 Å²	90.1	51%	0.505	46%	0.455	S	S	.	.	H	α-helix	trans	-67.4	-45.4	173.2	-77.1	-175.6	-13.2	0	0	111.3	S648 L649 N654 N655 L656	S648-Q652 WeakPolarHBondContact O-CB 3.47Å; S648-Q652 WeakPolarHBondContact O-CG 3.48Å; S648-Q652 PolarHBondContact O-N 2.68Å; L649-Q652 PolarHBondContact O-N 3.12Å; Q652-N654 PolarHBondContact O-N 2.64Å; Q652-N655 PolarHBondContact O-N 3.21Å; Q652-L656 VanDerWaalsContact O-CB 3.24Å; Q652-L656 WeakPolarHBondContact O-CB 3.45Å; Q652-L656 PolarHBondContact O-N 3.14Å
653	N	35.1	Very low	38.2	Very low	79 Å²	79	89.9 Å²	89.9	42%	0.422	47%	0.468	S	S	.	.	H	α-helix	trans	-57.7	-48.3	172	-89.4	-23.4	0	0	0	111.5	L649 N655 L656 I657	L649-N653 WeakPolarHBondContact O-CB 3.43Å; L649-N653 PolarHBondContact O-N 3.37Å; N653-N655 PolarHBondContact O-N 3.34Å; N653-L656 PolarHBondContact O-N 2.87Å; N653-I657 WeakPolarHBondContact O-CB 3.18Å; N653-I657 WeakPolarHBondContact O-CD1 3.43Å; N653-I657 WeakPolarHBondContact O-CG1 3.44Å; N653-I657 PolarHBondContact O-N 3.5Å
654	N	37	Very low	37.6	Very low	69 Å²	69	92.3 Å²	92.3	37%	0.369	48%	0.479	S	S	.	.	H	α-helix	trans	-64.8	-39	177.8	-76.5	-50.9	0	0	0	112.5	N650 Q652 Q658	N650-N654 WeakPolarHBondContact O-CB 3.29Å; N650-N654 PolarHBondContact O-N 2.77Å; N650-N654 PolarHBondContact O-ND2 2.8Å; Q652-N654 PolarHBondContact O-N 2.64Å; N654-Q658 VanDerWaalsContact O-CB 3.26Å; N654-Q658 WeakPolarHBondContact O-CB 3.17Å; N654-Q658 WeakPolarHBondContact O-CG 3.28Å; N654-Q658 PolarHBondContact O-N 3.37Å
655	N	38	Very low	36.8	Very low	80 Å²	80	93.6 Å²	93.6	43%	0.428	49%	0.489	S	S	.	.	H	α-helix	trans	-69.3	-36	175.3	-77.4	8.8	0	0	0	112.3	K651 Q652 N653 Q658 N659	K651-N655 WeakPolarHBondContact O-CB 3.15Å; K651-N655 PolarHBondContact O-N 3.32Å; K651-N655 PolarHBondContact O-OD1 2.92Å; Q652-N655 PolarHBondContact O-N 3.21Å; N653-N655 PolarHBondContact O-N 3.34Å; N655-Q658 PolarHBondContact O-N 2.73Å; N655-N659 WeakPolarHBondContact O-CB 3.33Å; N655-N659 PolarHBondContact O-N 3.32Å; N655-N659 PolarHBondContact O-OD1 2.79Å
656	L	33	Very low	36.3	Very low	83 Å²	83	98 Å²	98	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-46.4	175.6	-166.4	69.5	0	0	0	109.7	Q652 N653 N659 H660	Q652-L656 VanDerWaalsContact O-CB 3.24Å; Q652-L656 WeakPolarHBondContact O-CB 3.45Å; Q652-L656 PolarHBondContact O-N 3.14Å; N653-L656 PolarHBondContact O-N 2.87Å; L656-N659 PolarHBondContact O-N 2.93Å; L656-H660 WeakPolarHBondContact O-CB 3.23Å; L656-H660 PolarHBondContact O-CD2 2.94Å; L656-H660 PolarHBondContact O-N 2.86Å
657	I	30.7	Very low	35.7	Very low	76 Å²	76	98.7 Å²	98.7	39%	0.39	53%	0.527	S	S	.	.	H	α-helix	trans	-59.7	-46.7	173.1	-68	164.3	0	0	0	111.1	N653 S661	N653-I657 WeakPolarHBondContact O-CB 3.18Å; N653-I657 WeakPolarHBondContact O-CD1 3.43Å; N653-I657 WeakPolarHBondContact O-CG1 3.44Å; N653-I657 PolarHBondContact O-N 3.5Å; I657-S661 VanDerWaalsContact O-CB 3.3Å; I657-S661 WeakPolarHBondContact O-CB 3.42Å; I657-S661 PolarHBondContact O-N 3.09Å; I657-S661 PolarHBondContact O-OG 3.03Å
658	Q	36.3	Very low	35.1	Very low	115 Å²	115	103.9 Å²	103.9	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-46.7	178.8	-77.1	-78.3	-20.9	0	0	112.1	N654 N655 H660 S661 T662	N654-Q658 VanDerWaalsContact O-CB 3.26Å; N654-Q658 WeakPolarHBondContact O-CB 3.17Å; N654-Q658 WeakPolarHBondContact O-CG 3.28Å; N654-Q658 PolarHBondContact O-N 3.37Å; N655-Q658 PolarHBondContact O-N 2.73Å; Q658-H660 PolarHBondContact O-N 3.33Å; Q658-S661 CarbonylContact O-C 3.28Å; Q658-S661 WeakPolarHBondContact O-CA 3.2Å; Q658-S661 PolarHBondContact O-N 2.77Å; Q658-T662 WeakPolarHBondContact O-CB 3.48Å; Q658-T662 WeakPolarHBondContact O-CG2 3.16Å; Q658-T662 PolarHBondContact O-N 3.42Å; Q658-T662 PolarHBondContact O-OG1 3.49Å
659	N	32.8	Very low	34.5	Very low	82 Å²	82	113.3 Å²	113.3	44%	0.439	57%	0.572	S	S	.	*	H	α-helix	trans	-63.8	-42.2	-179.1	-70.5	-0.8	0	0	0	111.1	N655 L656 S661 T662 S663	N655-N659 WeakPolarHBondContact O-CB 3.33Å; N655-N659 PolarHBondContact O-N 3.32Å; N655-N659 PolarHBondContact O-OD1 2.79Å; L656-N659 PolarHBondContact O-N 2.93Å; N659-S661 VanDerWaalsContact C-N 3.3Å; N659-S661 PolarHBondContact O-N 2.79Å; N659-T662 PolarHBondContact O-N 3.27Å; N659-T662 PolarHBondContact O-OG1 3.29Å; N659-S663 WeakPolarHBondContact O-CB 3.43Å; N659-S663 PolarHBondContact O-N 2.82Å; N659-S663 PolarHBondContact O-OG 3.47Å
660	H	33.4	Very low	34.1	Very low	131 Å²	131	115.4 Å²	115.4	61%	0.606	58%	0.577	S	S	*	*	H	α-helix	trans	-69.3	-24.7	172.2	-70.9	-60	0	0	0	113.4	L656 Q658	L656-H660 WeakPolarHBondContact O-CB 3.23Å; L656-H660 PolarHBondContact O-CD2 2.94Å; L656-H660 PolarHBondContact O-N 2.86Å; Q658-H660 PolarHBondContact O-N 3.33Å
661	S	33.8	Very low	33.8	Very low	75 Å²	75	116.4 Å²	116.4	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-81.1	-17.8	174.9	-56.7	0	0	0	0	114	I657 Q658 N659	I657-S661 VanDerWaalsContact O-CB 3.3Å; I657-S661 WeakPolarHBondContact O-CB 3.42Å; I657-S661 PolarHBondContact O-N 3.09Å; I657-S661 PolarHBondContact O-OG 3.03Å; Q658-S661 CarbonylContact O-C 3.28Å; Q658-S661 WeakPolarHBondContact O-CA 3.2Å; Q658-S661 PolarHBondContact O-N 2.77Å; N659-S661 VanDerWaalsContact C-N 3.3Å; N659-S661 PolarHBondContact O-N 2.79Å
662	T	34	Very low	32.9	Very low	73 Å²	73	116 Å²	116	45%	0.448	59%	0.59	S	S	.	*	H	α-helix	trans	-115.6	-30.7	-171.9	50.7	0	0	0	0	113.8	Q658 N659 Q664	Q658-T662 WeakPolarHBondContact O-CB 3.48Å; Q658-T662 WeakPolarHBondContact O-CG2 3.16Å; Q658-T662 PolarHBondContact O-N 3.42Å; Q658-T662 PolarHBondContact O-OG1 3.49Å; N659-T662 PolarHBondContact O-N 3.27Å; N659-T662 PolarHBondContact O-OG1 3.29Å; T662-Q664 PolarHBondContact O-N 2.93Å; T662-Q664 VanDerWaalsContact O-N 3.13Å
663	S	33.1	Very low	32.8	Very low	94 Å²	94	115.5 Å²	115.5	66%	0.657	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	12.7	-169.7	-52.2	0	0	0	0	115.5	N659	N659-S663 WeakPolarHBondContact O-CB 3.43Å; N659-S663 PolarHBondContact O-N 2.82Å; N659-S663 PolarHBondContact O-OG 3.47Å
664	Q	31.6	Very low	32.7	Very low	160 Å²	160	115 Å²	115	75%	0.748	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	12.7	176.9	-71.6	-167.3	-16.8	0	0	114.3	T662 N666	T662-Q664 PolarHBondContact O-N 2.93Å; T662-Q664 VanDerWaalsContact O-N 3.13Å; Q664-N666 VanDerWaalsContact C-N 3.3Å; Q664-N666 PolarHBondContact O-N 3.46Å
665	L	31.4	Very low	32.5	Very low	145 Å²	145	115.9 Å²	115.9	76%	0.759	59%	0.592	S	S	*	*	S	Bend	trans	-84.2	1.5	176.8	-73.8	171.8	0	0	0	114.6
666	N	29.8	Very low	32.4	Very low	147 Å²	147	117.2 Å²	117.2	79%	0.786	59%	0.594	S	S	*	*	S	Bend	trans	-111.8	106.6	177.3	-76.7	-37.3	0	0	0	111.6	Q664	Q664-N666 VanDerWaalsContact C-N 3.3Å; Q664-N666 PolarHBondContact O-N 3.46Å
667	N	27.6	Very low	32.5	Very low	155 Å²	155	120 Å²	120	83%	0.829	61%	0.605	S	S	*	*	S	Bend	trans	41.9	81.7	156.4	-62.8	-24.9	0	0	0	118.5
668	E	32.2	Very low	32.5	Very low	178 Å²	178	119.2 Å²	119.2	83%	0.832	61%	0.605	S	S	*	*				-165.6	162.8	126.1	-110.6	164.2	-152	0	0	112.4	F670	E668-F670 PolarHBondContact O-N 2.65Å
669	R	29.4	Very low	32.1	Very low	248 Å²	248	120.4 Å²	120.4	94%	0.936	61%	0.613	S	S	*	*			trans	-83	96.4	-177.7	-79.9	179.2	168.5	174.9	-4.8	111
670	F	29.8	Very low	31.9	Very low	134 Å²	134	123 Å²	123	59%	0.588	63%	0.627	S	S	*	*			trans	-88.6	151.2	161.8	-74.8	-80.5	0	0	0	111.6	E668 D674	E668-F670 PolarHBondContact O-N 2.65Å; F670-D674 HydrophobicContact CB-CB 4.3Å; F670-D674 HydrophobicContact CD1-CB 3.86Å
671	T	34.1	Very low	31.7	Very low	77 Å²	77	121 Å²	121	47%	0.472	63%	0.627	S	S	.	*			trans	-98.6	166.7	-179.2	70.2	0	0	0	0	111.1	D673 D674	T671-D673 PolarHBondContact O-N 2.97Å; T671-D673 VanDerWaalsContact O-N 3.15Å; T671-D674 WeakPolarHBondContact CA-OD2 3.26Å; T671-D674 WeakPolarHBondContact CB-OD2 3.33Å; T671-D674 PolarHBondContact N-OD2 3.38Å; T671-D674 PolarHBondContact O-N 3.41Å; T671-D674 PolarHBondContact OG1-OD2 3.08Å
672	N	31.2	Very low	31.3	Very low	128 Å²	128	122 Å²	122	68%	0.684	63%	0.626	S	S	*	*	H	α-helix	trans	-61.1	-24.7	-178.7	-73.6	-28.6	0	0	0	113.3	K676	N672-K676 PolarHBondContact O-N 2.96Å
673	D	33.6	Very low	30.8	Very low	96 Å²	96	123.8 Å²	123.8	51%	0.513	64%	0.641	S	S	.	*	H	α-helix	trans	-79.1	-30.9	-179.2	-60.7	-50.7	0	0	0	112.2	T671 I675 K676 H677	T671-D673 PolarHBondContact O-N 2.97Å; T671-D673 VanDerWaalsContact O-N 3.15Å; D673-I675 VanDerWaalsContact C-N 3.26Å; D673-I675 PolarHBondContact O-N 3.07Å; D673-K676 PolarHBondContact O-N 3.11Å; D673-H677 PolarHBondContact O-CD2 3.13Å; D673-H677 VanDerWaalsContact O-CD2 3.26Å; D673-H677 PolarHBondContact O-N 2.91Å
674	D	33.9	Very low	30.5	Very low	70 Å²	70	123.7 Å²	123.7	37%	0.374	63%	0.632	S	S	.	*	H	α-helix	trans	-63.1	-35.6	172.3	-55.5	-64.7	0	0	0	111.3	F670 T671 S678	F670-D674 HydrophobicContact CB-CB 4.3Å; F670-D674 HydrophobicContact CD1-CB 3.86Å; T671-D674 WeakPolarHBondContact CA-OD2 3.26Å; T671-D674 WeakPolarHBondContact CB-OD2 3.33Å; T671-D674 PolarHBondContact N-OD2 3.38Å; T671-D674 PolarHBondContact O-N 3.41Å; T671-D674 PolarHBondContact OG1-OD2 3.08Å; D674-S678 WeakPolarHBondContact O-CB 3.47Å; D674-S678 PolarHBondContact O-N 2.86Å; D674-S678 PolarHBondContact O-OG 3.34Å
675	I	33.8	Very low	30.2	Very low	87 Å²	87	120.6 Å²	120.6	45%	0.446	63%	0.626	S	S	.	*	H	α-helix	trans	-70.4	-40.5	175.2	-57.8	175.4	0	0	0	110.7	D673 S678 M679	D673-I675 VanDerWaalsContact C-N 3.26Å; D673-I675 PolarHBondContact O-N 3.07Å; I675-S678 WeakPolarHBondContact CA-OG 3.24Å; I675-S678 PolarHBondContact O-OG 3.43Å; I675-M679 PolarHBondContact O-N 3.34Å; I675-M679 VanDerWaalsContact O-N 3.13Å
676	K	35.6	Very low	30.2	Very low	108 Å²	108	118.6 Å²	118.6	47%	0.47	62%	0.62	S	S	.	*	H	α-helix	trans	-63.6	-42.7	173.2	-77.1	-177.3	175.1	-179.6	0	112.1	N672 D673 N680	N672-K676 PolarHBondContact O-N 2.96Å; D673-K676 PolarHBondContact O-N 3.11Å; K676-N680 PolarHBondContact O-N 3.22Å
677	H	34.6	Very low	30.3	Very low	142 Å²	142	115.3 Å²	115.3	66%	0.657	61%	0.609	S	S	*	*	H	α-helix	trans	-70.2	-34	-179.8	-82.5	-66.3	0	0	0	113.5	D673 S681	D673-H677 PolarHBondContact O-CD2 3.13Å; D673-H677 VanDerWaalsContact O-CD2 3.26Å; D673-H677 PolarHBondContact O-N 2.91Å; H677-S681 PolarHBondContact O-OG 2.65Å
678	S	29.7	Very low	30.4	Very low	58 Å²	58	114.1 Å²	114.1	41%	0.406	60%	0.598	S	S	.	*	H	α-helix	trans	-75.3	-28.6	175.1	49.7	0	0	0	0	113.8	D674 I675 S681	D674-S678 WeakPolarHBondContact O-CB 3.47Å; D674-S678 PolarHBondContact O-N 2.86Å; D674-S678 PolarHBondContact O-OG 3.34Å; I675-S678 WeakPolarHBondContact CA-OG 3.24Å; I675-S678 PolarHBondContact O-OG 3.43Å; S678-S681 PolarHBondContact O-OG 3.15Å; S678-S681 VanDerWaalsContact O-OG 3.09Å
679	M	27.8	Very low	30.5	Very low	140 Å²	140	109.8 Å²	109.8	69%	0.69	58%	0.583	S	S	*	*	H	α-helix	trans	-75.2	-33.6	172.6	-71.8	-155	168.2	0	0	113.3	I675 S681 I682	I675-M679 PolarHBondContact O-N 3.34Å; I675-M679 VanDerWaalsContact O-N 3.13Å; M679-S681 PolarHBondContact O-N 2.69Å; M679-I682 PolarHBondContact O-N 2.93Å
680	N	30.3	Very low	30.6	Very low	137 Å²	137	105.3 Å²	105.3	73%	0.733	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-8.1	178.6	-77.5	-17.9	0	0	0	114.6	K676	K676-N680 PolarHBondContact O-N 3.22Å
681	S	28.4	Very low	30.9	Very low	88 Å²	88	103.9 Å²	103.9	62%	0.615	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	0.2	176.7	53.2	0	0	0	0	114.4	H677 S678 M679 S683	H677-S681 PolarHBondContact O-OG 2.65Å; S678-S681 PolarHBondContact O-OG 3.15Å; S678-S681 VanDerWaalsContact O-OG 3.09Å; M679-S681 PolarHBondContact O-N 2.69Å; S681-S683 PolarHBondContact O-N 2.78Å
682	I	24.6	Very low	31.1	Very low	97 Å²	97	105.1 Å²	105.1	50%	0.497	57%	0.569	S	S	.	*			trans	-102.7	64.7	177.4	-52.8	177.5	0	0	0	110	M679 I684	M679-I682 PolarHBondContact O-N 2.93Å; I682-I684 HydrophobicContact CG2-CD1 3.76Å; I682-I684 HydrophobicContact CG2-CG1 3.91Å; I682-I684 PolarHBondContact O-N 3.11Å; I682-I684 VanDerWaalsContact O-N 3.09Å
683	S	24.1	Very low	31.3	Very low	110 Å²	110	102.7 Å²	102.7	77%	0.769	56%	0.556	S	S	*	*			trans	-82.7	74.6	178.4	57.3	0	0	0	0	112.1	S681	S681-S683 PolarHBondContact O-N 2.78Å
684	I	26.7	Very low	31.4	Very low	93 Å²	93	102.1 Å²	102.1	48%	0.477	55%	0.553	S	S	.	*			trans	-102.8	110.2	178.7	-51	178.7	0	0	0	110.4	I682 T686	I682-I684 HydrophobicContact CG2-CD1 3.76Å; I682-I684 HydrophobicContact CG2-CG1 3.91Å; I682-I684 PolarHBondContact O-N 3.11Å; I682-I684 VanDerWaalsContact O-N 3.09Å; I684-T686 HydrophobicContact CG2-CG2 3.97Å; I684-T686 PolarHBondContact O-N 3.24Å; I684-T686 VanDerWaalsContact O-N 3.14Å
685	P	26.2	Very low	31.7	Very low	94 Å²	94	103.8 Å²	103.8	61%	0.61	56%	0.557	S	S	*	*			trans	-75.9	103.2	-175.7	29.8	-34	0	0	0	111.6
686	T	30.3	Very low	32	Very low	104 Å²	104	100.9 Å²	100.9	64%	0.638	54%	0.544	S	S	*	.			trans	-118.8	-16.2	-173.6	47.7	0	0	0	0	115	I684	I684-T686 HydrophobicContact CG2-CG2 3.97Å; I684-T686 PolarHBondContact O-N 3.24Å; I684-T686 VanDerWaalsContact O-N 3.14Å
687	S	31.9	Very low	32	Very low	78 Å²	78	100.1 Å²	100.1	55%	0.545	55%	0.545	S	S	.	.	S	Bend	trans	-81.8	-51.6	-179.5	47.9	0	0	0	0	113.3	Y690 L691	S687-Y690 PolarHBondContact O-N 3.39Å; S687-L691 PolarHBondContact O-N 3.38Å; S687-L691 VanDerWaalsContact O-N 3.13Å
688	E	31.1	Very low	32	Very low	130 Å²	130	98.3 Å²	98.3	61%	0.607	54%	0.539	S	S	*	.	H	α-helix	trans	-65	-44.9	-173.7	-65.9	179.9	135.3	0	0	112	Y690 L691 D692	E688-Y690 PolarHBondContact O-N 2.73Å; E688-L691 PolarHBondContact O-N 3.5Å; E688-L691 VanDerWaalsContact O-N 3.07Å; E688-D692 PolarHBondContact O-N 3.21Å
689	V	33.2	Very low	32.6	Very low	86 Å²	86	99.3 Å²	99.3	52%	0.521	54%	0.539	S	S	.	.	H	α-helix	trans	-58.5	-32.7	177.1	-177	0	0	0	0	111.9	N693	V689-N693 WeakPolarHBondContact O-CB 3.19Å; V689-N693 PolarHBondContact O-N 3.36Å; V689-N693 PolarHBondContact O-ND2 3.44Å
690	Y	32.8	Very low	33	Very low	154 Å²	154	96.1 Å²	96.1	60%	0.604	53%	0.525	S	S	*	.	H	α-helix	trans	-76	-39.4	177.3	-151.9	-86.1	0	0	0	111.8	S687 E688 L694	S687-Y690 PolarHBondContact O-N 3.39Å; E688-Y690 PolarHBondContact O-N 2.73Å; Y690-L694 HydrophobicContact CD1-CD1 3.87Å; Y690-L694 HydrophobicContact CD1-CG 4.35Å; Y690-L694 HydrophobicContact CE1-CD1 3.96Å; Y690-L694 HydrophobicContact CE1-CG 4.38Å; Y690-L694 PolarHBondContact O-N 3.28Å; Y690-L694 VanDerWaalsContact O-N 3.08Å
691	L	34.6	Very low	33.4	Very low	105 Å²	105	96.4 Å²	96.4	55%	0.55	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-42.8	175.9	-73.3	167.7	0	0	0	112.3	S687 E688 L694 K695	S687-L691 PolarHBondContact O-N 3.38Å; S687-L691 VanDerWaalsContact O-N 3.13Å; E688-L691 PolarHBondContact O-N 3.5Å; E688-L691 VanDerWaalsContact O-N 3.07Å; L691-L694 PolarHBondContact O-N 3.49Å; L691-K695 VanDerWaalsContact O-CB 3.29Å; L691-K695 WeakPolarHBondContact O-CB 3.4Å; L691-K695 PolarHBondContact O-N 3.44Å
692	D	39.3	Very low	33.7	Very low	103 Å²	103	96.5 Å²	96.5	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-67	-35.3	177.2	-84.6	-26.1	0	0	0	112.4	E688 S696	E688-D692 PolarHBondContact O-N 3.21Å; D692-S696 WeakPolarHBondContact O-CB 3.4Å; D692-S696 PolarHBondContact O-N 2.79Å
693	N	34.3	Very low	34.2	Very low	77 Å²	77	96.2 Å²	96.2	41%	0.412	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-46.2	172.2	-83.2	-58.6	0	0	0	111.7	V689 S696 I697	V689-N693 WeakPolarHBondContact O-CB 3.19Å; V689-N693 PolarHBondContact O-N 3.36Å; V689-N693 PolarHBondContact O-ND2 3.44Å; N693-S696 PolarHBondContact O-N 3.15Å; N693-I697 WeakPolarHBondContact O-CD1 3.14Å; N693-I697 VanDerWaalsContact O-CG1 3.26Å; N693-I697 WeakPolarHBondContact O-CG1 3.26Å; N693-I697 PolarHBondContact O-N 3.16Å
694	L	36.7	Very low	34.7	Very low	83 Å²	83	97.4 Å²	97.4	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-61.1	-44.9	175.1	-77.8	171.2	0	0	0	112.3	Y690 L691 I697 I698	Y690-L694 HydrophobicContact CD1-CD1 3.87Å; Y690-L694 HydrophobicContact CD1-CG 4.35Å; Y690-L694 HydrophobicContact CE1-CD1 3.96Å; Y690-L694 HydrophobicContact CE1-CG 4.38Å; Y690-L694 PolarHBondContact O-N 3.28Å; Y690-L694 VanDerWaalsContact O-N 3.08Å; L691-L694 PolarHBondContact O-N 3.49Å; L694-I697 PolarHBondContact O-N 3.32Å; L694-I698 WeakPolarHBondContact O-CG1 3.2Å; L694-I698 PolarHBondContact O-N 3.46Å
695	K	39	Very low	35.1	Very low	105 Å²	105	97.8 Å²	97.8	46%	0.457	51%	0.507	S	S	.	.	H	α-helix	trans	-60.1	-48.1	176.1	-177.4	-175.4	171.5	-167.6	0	111.1	L691 I697 I698 D699	L691-K695 VanDerWaalsContact O-CB 3.29Å; L691-K695 WeakPolarHBondContact O-CB 3.4Å; L691-K695 PolarHBondContact O-N 3.44Å; K695-I697 VanDerWaalsContact C-N 3.32Å; K695-I697 PolarHBondContact O-N 3.33Å; K695-I698 PolarHBondContact O-N 3.16Å; K695-D699 WeakPolarHBondContact O-CB 3.35Å; K695-D699 PolarHBondContact O-N 2.64Å
696	S	40.7	Very low	35.8	Very low	27 Å²	27	99.4 Å²	99.4	19%	0.189	50%	0.504	C	S	.	.	H	α-helix	trans	-57.6	-42.2	174.9	-178.3	0	0	0	0	111.9	D692 N693 N700	D692-S696 WeakPolarHBondContact O-CB 3.4Å; D692-S696 PolarHBondContact O-N 2.79Å; N693-S696 PolarHBondContact O-N 3.15Å; S696-N700 VanDerWaalsContact O-CB 3.28Å; S696-N700 WeakPolarHBondContact O-CB 3.42Å; S696-N700 VanDerWaalsContact O-CG 3.27Å; S696-N700 PolarHBondContact O-N 3.4Å; S696-N700 PolarHBondContact O-ND2 3.13Å; S696-N700 PolarHBondContact OG-ND2 3.37Å
697	I	35.5	Very low	36.1	Very low	92 Å²	92	98.1 Å²	98.1	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-44.5	176.3	-70.4	162.2	0	0	0	111.2	N693 L694 K695 K701	N693-I697 WeakPolarHBondContact O-CD1 3.14Å; N693-I697 VanDerWaalsContact O-CG1 3.26Å; N693-I697 WeakPolarHBondContact O-CG1 3.26Å; N693-I697 PolarHBondContact O-N 3.16Å; L694-I697 PolarHBondContact O-N 3.32Å; K695-I697 VanDerWaalsContact C-N 3.32Å; K695-I697 PolarHBondContact O-N 3.33Å; I697-K701 WeakPolarHBondContact O-CB 3.31Å; I697-K701 PolarHBondContact O-N 2.94Å; I697-K701 VanDerWaalsContact O-N 3.08Å
698	I	35.8	Very low	36.4	Very low	104 Å²	104	97.7 Å²	97.7	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-64.5	-50	177.6	-67.1	165	0	0	0	110.9	L694 K695 N700 K701 V702	L694-I698 WeakPolarHBondContact O-CG1 3.2Å; L694-I698 PolarHBondContact O-N 3.46Å; K695-I698 PolarHBondContact O-N 3.16Å; I698-N700 VanDerWaalsContact C-N 3.34Å; I698-N700 PolarHBondContact O-N 2.78Å; I698-K701 PolarHBondContact O-N 3.45Å; I698-K701 VanDerWaalsContact O-N 3.08Å; I698-V702 WeakPolarHBondContact O-CG2 3.3Å; I698-V702 PolarHBondContact O-N 3.38Å
699	D	42.3	Very low	36.6	Very low	79 Å²	79	96.6 Å²	96.6	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-61	-41.6	-179.7	-72.3	-21.7	0	0	0	111.4	K695 K701 V702 L703	K695-D699 WeakPolarHBondContact O-CB 3.35Å; K695-D699 PolarHBondContact O-N 2.64Å; D699-K701 VanDerWaalsContact C-N 3.35Å; D699-K701 PolarHBondContact O-N 2.71Å; D699-V702 PolarHBondContact O-N 2.95Å; D699-L703 WeakPolarHBondContact O-CB 3.32Å; D699-L703 WeakPolarHBondContact O-CG 3.45Å; D699-L703 PolarHBondContact O-N 3.47Å
700	N	35	Very low	36.9	Very low	72 Å²	72	97.3 Å²	97.3	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-63.3	-37.7	173.8	-77.7	-59.4	0	0	0	112.3	S696 I698 L703 Y704	S696-N700 VanDerWaalsContact O-CB 3.28Å; S696-N700 WeakPolarHBondContact O-CB 3.42Å; S696-N700 VanDerWaalsContact O-CG 3.27Å; S696-N700 PolarHBondContact O-N 3.4Å; S696-N700 PolarHBondContact O-ND2 3.13Å; S696-N700 PolarHBondContact OG-ND2 3.37Å; I698-N700 VanDerWaalsContact C-N 3.34Å; I698-N700 PolarHBondContact O-N 2.78Å; N700-L703 PolarHBondContact O-N 2.97Å; N700-Y704 WeakPolarHBondContact O-CB 3.26Å; N700-Y704 PolarHBondContact O-N 3.48Å
701	K	38.1	Very low	37.2	Very low	143 Å²	143	95.5 Å²	95.5	62%	0.622	48%	0.475	S	S	*	.	H	α-helix	trans	-70.6	-36.1	178.7	-158.8	169.6	-172.4	173.1	0	111.9	I697 I698 D699 N705	I697-K701 WeakPolarHBondContact O-CB 3.31Å; I697-K701 PolarHBondContact O-N 2.94Å; I697-K701 VanDerWaalsContact O-N 3.08Å; I698-K701 PolarHBondContact O-N 3.45Å; I698-K701 VanDerWaalsContact O-N 3.08Å; D699-K701 VanDerWaalsContact C-N 3.35Å; D699-K701 PolarHBondContact O-N 2.71Å; K701-N705 PolarHBondContact O-N 2.94Å
702	V	35.5	Very low	37.3	Very low	90 Å²	90	93.2 Å²	93.2	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-67.9	-44.1	171.5	174	0	0	0	0	111.3	I698 D699 N705 K706	I698-V702 WeakPolarHBondContact O-CG2 3.3Å; I698-V702 PolarHBondContact O-N 3.38Å; D699-V702 PolarHBondContact O-N 2.95Å; V702-N705 PolarHBondContact O-N 3.48Å; V702-K706 WeakPolarHBondContact O-CB 3.42Å; V702-K706 PolarHBondContact O-N 2.92Å
703	L	35.3	Very low	37.1	Very low	91 Å²	91	93.9 Å²	93.9	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-39.9	175.3	-81.6	164.1	0	0	0	112.4	D699 N700 K706 N707	D699-L703 WeakPolarHBondContact O-CB 3.32Å; D699-L703 WeakPolarHBondContact O-CG 3.45Å; D699-L703 PolarHBondContact O-N 3.47Å; N700-L703 PolarHBondContact O-N 2.97Å; L703-K706 PolarHBondContact O-N 3.03Å; L703-N707 WeakPolarHBondContact O-CB 3.46Å; L703-N707 VanDerWaalsContact O-CG 3.29Å; L703-N707 PolarHBondContact O-N 3.35Å; L703-N707 PolarHBondContact O-ND2 2.69Å
704	Y	34.8	Very low	37.3	Very low	136 Å²	136	96.8 Å²	96.8	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-53.4	174.4	-177.3	-97.1	0	0	0	111.1	N700 K706 N707 V708	N700-Y704 WeakPolarHBondContact O-CB 3.26Å; N700-Y704 PolarHBondContact O-N 3.48Å; Y704-K706 VanDerWaalsContact C-N 3.29Å; Y704-K706 PolarHBondContact O-N 3.28Å; Y704-N707 PolarHBondContact O-N 2.85Å; Y704-N707 VanDerWaalsContact O-N 3.17Å; Y704-V708 HydrophobicContact CD1-CG2 4.14Å; Y704-V708 HydrophobicContact CE1-CG2 3.77Å; Y704-V708 HydrophobicContact CE2-CG2 4.33Å; Y704-V708 WeakPolarHBondContact O-CG2 3.24Å; Y704-V708 PolarHBondContact O-N 2.84Å
705	N	33.9	Very low	37.4	Very low	100 Å²	100	99.4 Å²	99.4	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-39.2	178.1	-74.6	2.2	0	0	0	112.2	K701 V702 V708 F709	K701-N705 PolarHBondContact O-N 2.94Å; V702-N705 PolarHBondContact O-N 3.48Å; N705-V708 PolarHBondContact O-N 2.81Å; N705-F709 PolarHBondContact O-N 2.88Å
706	K	41.8	Very low	37.1	Very low	129 Å²	129	101.2 Å²	101.2	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-40.3	176.9	-167.8	174.3	-176.4	178.4	0	112.5	V702 L703 Y704 F709 Q710	V702-K706 WeakPolarHBondContact O-CB 3.42Å; V702-K706 PolarHBondContact O-N 2.92Å; L703-K706 PolarHBondContact O-N 3.03Å; Y704-K706 VanDerWaalsContact C-N 3.29Å; Y704-K706 PolarHBondContact O-N 3.28Å; K706-F709 PolarHBondContact O-N 2.85Å; K706-Q710 WeakPolarHBondContact O-CG 3.45Å; K706-Q710 PolarHBondContact O-N 3.4Å
707	N	35.8	Very low	37	Very low	77 Å²	77	108.3 Å²	108.3	41%	0.412	55%	0.549	S	S	.	.	H	α-helix	trans	-69.5	-38.4	176.1	-75	-26.8	0	0	0	112.1	L703 Y704 Q710 Q711	L703-N707 WeakPolarHBondContact O-CB 3.46Å; L703-N707 VanDerWaalsContact O-CG 3.29Å; L703-N707 PolarHBondContact O-N 3.35Å; L703-N707 PolarHBondContact O-ND2 2.69Å; Y704-N707 PolarHBondContact O-N 2.85Å; Y704-N707 VanDerWaalsContact O-N 3.17Å; N707-Q710 PolarHBondContact O-N 3.24Å; N707-Q711 WeakPolarHBondContact O-CB 3.43Å; N707-Q711 WeakPolarHBondContact O-CG 3.37Å; N707-Q711 PolarHBondContact O-N 3.48Å
708	V	39.2	Very low	37	Very low	68 Å²	68	111.3 Å²	111.3	41%	0.412	57%	0.566	S	S	.	*	H	α-helix	trans	-62.2	-43.1	172.5	171.8	0	0	0	0	110.6	Y704 N705 Q710 Q711 A712	Y704-V708 HydrophobicContact CD1-CG2 4.14Å; Y704-V708 HydrophobicContact CE1-CG2 3.77Å; Y704-V708 HydrophobicContact CE2-CG2 4.33Å; Y704-V708 WeakPolarHBondContact O-CG2 3.24Å; Y704-V708 PolarHBondContact O-N 2.84Å; N705-V708 PolarHBondContact O-N 2.81Å; V708-Q710 PolarHBondContact O-N 2.82Å; V708-Q711 PolarHBondContact O-N 2.84Å; V708-A712 WeakPolarHBondContact O-CB 3.44Å; V708-A712 PolarHBondContact O-N 3.22Å
709	F	35.8	Very low	37.2	Very low	107 Å²	107	113.9 Å²	113.9	47%	0.469	58%	0.576	S	S	.	*	H	α-helix	trans	-61.2	-40.7	173.7	-119.5	-87.1	0	0	0	112.9	N705 K706 A712 N713 C732	N705-F709 PolarHBondContact O-N 2.88Å; K706-F709 PolarHBondContact O-N 2.85Å; F709-A712 PolarHBondContact O-N 2.83Å; F709-N713 PolarHBondContact O-N 3.21Å; F709-C732 HydrophobicContact CZ-CB 4.47Å
710	Q	39.2	Very low	36.7	Very low	101 Å²	101	117 Å²	117	47%	0.472	59%	0.592	S	S	.	*	H	α-helix	trans	-70.3	-37.5	177	-74.8	-176.9	-27.5	0	0	112.5	K706 N707 V708 N713 L714	K706-Q710 WeakPolarHBondContact O-CG 3.45Å; K706-Q710 PolarHBondContact O-N 3.4Å; N707-Q710 PolarHBondContact O-N 3.24Å; V708-Q710 PolarHBondContact O-N 2.82Å; Q710-N713 PolarHBondContact O-N 3.41Å; Q710-L714 WeakPolarHBondContact O-CB 3.47Å; Q710-L714 WeakPolarHBondContact O-CD1 3.47Å; Q710-L714 VanDerWaalsContact O-CG 3.25Å; Q710-L714 WeakPolarHBondContact O-CG 3.38Å; Q710-L714 PolarHBondContact O-N 3.45Å
711	Q	38.3	Very low	36.7	Very low	116 Å²	116	117.9 Å²	117.9	54%	0.542	60%	0.597	S	S	.	*	H	α-helix	trans	-69.4	-32.4	173.9	-71.9	-178.5	5.4	0	0	112.6	N707 V708 N715	N707-Q711 WeakPolarHBondContact O-CB 3.43Å; N707-Q711 WeakPolarHBondContact O-CG 3.37Å; N707-Q711 PolarHBondContact O-N 3.48Å; V708-Q711 PolarHBondContact O-N 2.84Å; Q711-N715 PolarHBondContact O-N 3.16Å; Q711-N715 PolarHBondContact O-ND2 2.83Å
712	A	36	Very low	36.6	Very low	58 Å²	58	116.7 Å²	116.7	48%	0.479	60%	0.604	S	S	.	*	H	α-helix	trans	-63.9	-47.3	170.3	0	0	0	0	0	111.5	V708 F709 L714 N715	V708-A712 WeakPolarHBondContact O-CB 3.44Å; V708-A712 PolarHBondContact O-N 3.22Å; F709-A712 PolarHBondContact O-N 2.83Å; A712-L714 VanDerWaalsContact C-N 3.34Å; A712-L714 PolarHBondContact O-N 3.49Å; A712-N715 PolarHBondContact O-N 2.88Å
713	N	36.6	Very low	36.8	Very low	117 Å²	117	116 Å²	116	63%	0.626	60%	0.603	S	S	*	*	H	α-helix	trans	-69.4	-24.8	178.8	-79.7	-18.9	0	0	0	114.2	F709 Q710	F709-N713 PolarHBondContact O-N 3.21Å; Q710-N713 PolarHBondContact O-N 3.41Å
714	L	38.5	Very low	36.7	Very low	138 Å²	138	116.7 Å²	116.7	72%	0.723	61%	0.606	S	S	*	*	H	α-helix	trans	-82.2	-15.5	178	-75.9	166.8	0	0	0	114	Q710 A712	Q710-L714 WeakPolarHBondContact O-CB 3.47Å; Q710-L714 WeakPolarHBondContact O-CD1 3.47Å; Q710-L714 VanDerWaalsContact O-CG 3.25Å; Q710-L714 WeakPolarHBondContact O-CG 3.38Å; Q710-L714 PolarHBondContact O-N 3.45Å; A712-L714 VanDerWaalsContact C-N 3.34Å; A712-L714 PolarHBondContact O-N 3.49Å
715	N	37.5	Very low	36.6	Very low	137 Å²	137	116.4 Å²	116.4	73%	0.733	61%	0.613	S	S	*	*	S	Bend	trans	-95.1	-6.3	-178.8	-75.8	-39.6	0	0	0	114.4	Q711 A712	Q711-N715 PolarHBondContact O-N 3.16Å; Q711-N715 PolarHBondContact O-ND2 2.83Å; A712-N715 PolarHBondContact O-N 2.88Å
716	N	34.2	Very low	36.6	Very low	144 Å²	144	116.1 Å²	116.1	77%	0.77	62%	0.615	S	S	*	*			trans	-109.5	89.4	173.2	-91	-18	0	0	0	110.6
717	H	36.9	Very low	36.2	Very low	176 Å²	176	115.9 Å²	115.9	82%	0.815	62%	0.62	S	S	*	*			trans	-130.2	75.4	176.7	-142.6	54.7	0	0	0	111.5
718	N	36.8	Very low	36.1	Very low	155 Å²	155	116.9 Å²	116.9	83%	0.829	63%	0.625	S	S	*	*			trans	-163.8	134.8	159.7	-91.7	-45.1	0	0	0	110.2
719	H	38.7	Very low	35.7	Very low	157 Å²	157	119.2 Å²	119.2	73%	0.727	64%	0.635	S	S	*	*			trans	57.7	96.6	169.5	-69.2	-50.2	0	0	0	120.9	D721	H719-D721 PolarHBondContact O-N 3.17Å
720	D	32.9	Very low	35.4	Very low	144 Å²	144	121.8 Å²	121.8	77%	0.77	65%	0.648	S	S	*	*				46.8	60.7	102.8	-44	-40.1	0	0	0	119.6
721	D	34.2	Very low	35.1	Very low	92 Å²	92	120.7 Å²	120.7	49%	0.492	65%	0.652	S	S	.	*			trans	-143.6	109.3	151.7	-158.7	-40.3	0	0	0	112.2	H719 S723	H719-D721 PolarHBondContact O-N 3.17Å; D721-S723 PolarHBondContact O-N 2.54Å; D721-S723 VanDerWaalsContact OD1-CB 3.28Å; D721-S723 WeakPolarHBondContact OD1-CB 3.21Å; D721-S723 PolarHBondContact OD1-N 2.81Å; D721-S723 PolarHBondContact OD1-OG 3.17Å
722	P	37.1	Very low	34.6	Very low	118 Å²	118	118.3 Å²	118.3	77%	0.766	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-3	-177.3	31.7	-35.5	0	0	0	114
723	S	38.4	Very low	34.2	Very low	76 Å²	76	122.2 Å²	122.2	53%	0.531	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-11.9	-175.9	66.5	0	0	0	0	115.3	D721	D721-S723 PolarHBondContact O-N 2.54Å; D721-S723 VanDerWaalsContact OD1-CB 3.28Å; D721-S723 WeakPolarHBondContact OD1-CB 3.21Å; D721-S723 PolarHBondContact OD1-N 2.81Å; D721-S723 PolarHBondContact OD1-OG 3.17Å
724	I	34.7	Very low	34	Very low	104 Å²	104	122.4 Å²	122.4	53%	0.533	66%	0.66	S	S	.	*	S	Bend	trans	-93.4	-21.4	-173.4	-62.2	176.8	0	0	0	112.6	T726 I728	I724-T726 VanDerWaalsContact C-N 3.27Å; I724-T726 PolarHBondContact O-N 2.95Å; I724-I728 HydrophobicContact CG2-CD1 4.23Å
725	L	31	Very low	33.5	Very low	131 Å²	131	123.4 Å²	123.4	69%	0.686	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-14.1	-174.3	-87.4	162.2	0	0	0	115.2
726	T	33.9	Very low	33.2	Very low	94 Å²	94	126.1 Å²	126.1	58%	0.577	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-31.4	-179.5	51.5	0	0	0	0	113.7	I724	I724-T726 VanDerWaalsContact C-N 3.27Å; I724-T726 PolarHBondContact O-N 2.95Å
727	N	34.1	Very low	33.1	Very low	124 Å²	124	121.8 Å²	121.8	66%	0.663	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-2.1	-172.1	-67.9	0.6	0	0	0	114.5	S731	N727-S731 PolarHBondContact O-OG 3.23Å
728	I	33.2	Very low	32.8	Very low	98 Å²	98	119.1 Å²	119.1	50%	0.503	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.8	-18.6	-179.1	-59.4	178	0	0	0	111.8	I724 S731	I724-I728 HydrophobicContact CG2-CD1 4.23Å; I728-S731 PolarHBondContact O-OG 2.71Å
729	N	30.8	Very low	32.6	Very low	117 Å²	117	118.3 Å²	118.3	63%	0.626	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-24.9	177.1	-86.4	-26.4	0	0	0	114
730	E	31.2	Very low	32.2	Very low	161 Å²	161	116.9 Å²	116.9	75%	0.752	62%	0.618	S	S	*	*	S	Bend	trans	-83	-29.8	177.3	-64.4	-171.2	141.6	0	0	112.5	C732	E730-C732 VanDerWaalsContact C-N 3.28Å; E730-C732 PolarHBondContact O-N 2.66Å
731	S	32.1	Very low	32.3	Very low	78 Å²	78	114.1 Å²	114.1	55%	0.545	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81	1.1	-178.7	46.7	0	0	0	0	114.9	N727 I728	N727-S731 PolarHBondContact O-OG 3.23Å; I728-S731 PolarHBondContact O-OG 2.71Å
732	C	27.2	Very low	32.1	Very low	65 Å²	65	113 Å²	113	44%	0.439	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.3	6.5	-178.5	-136.2	0	0	0	0	114.8	F709 E730	F709-C732 HydrophobicContact CZ-CB 4.47Å; E730-C732 VanDerWaalsContact C-N 3.28Å; E730-C732 PolarHBondContact O-N 2.66Å
733	L	29.2	Very low	31.8	Very low	140 Å²	140	113.2 Å²	113.2	73%	0.733	59%	0.593	S	S	*	*	S	Bend	trans	-102.1	-22.3	179.5	-74.8	171.6	0	0	0	114.6	Y735	L733-Y735 PolarHBondContact O-N 3.34Å
734	D	30.4	Very low	31.4	Very low	122 Å²	122	115.1 Å²	115.1	65%	0.652	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-20.9	-179.1	-102.9	-39.1	0	0	0	114.8	K736 S737	D734-K736 PolarHBondContact O-N 2.95Å; D734-S737 PolarHBondContact O-N 3.16Å; D734-S737 VanDerWaalsContact O-N 3.09Å; D734-S737 PolarHBondContact O-OG 3.47Å
735	Y	29.3	Very low	31.3	Very low	159 Å²	159	114.4 Å²	114.4	62%	0.624	59%	0.589	S	S	*	*	H	α-helix	trans	-67.4	1.2	-179.6	-79.2	-68.8	0	0	0	115.4	L733 E738	L733-Y735 PolarHBondContact O-N 3.34Å; Y735-E738 WeakPolarHBondContact CE1-OE2 3.35Å
736	K	31.8	Very low	31.3	Very low	194 Å²	194	112.3 Å²	112.3	84%	0.843	58%	0.578	S	S	*	*	H	α-helix	trans	-80.5	-16.1	171.3	-133	176.6	-174.3	-179.8	0	113.5	D734	D734-K736 PolarHBondContact O-N 2.95Å
737	S	31.4	Very low	31.3	Very low	52 Å²	52	111.7 Å²	111.7	36%	0.364	57%	0.567	S	S	.	*	H	α-helix	trans	-94.9	-42.2	-179.9	65.8	0	0	0	0	112.8	D734 L739 H740 N741	D734-S737 PolarHBondContact O-N 3.16Å; D734-S737 VanDerWaalsContact O-N 3.09Å; D734-S737 PolarHBondContact O-OG 3.47Å; S737-L739 PolarHBondContact O-N 2.96Å; S737-H740 PolarHBondContact O-N 3.42Å; S737-N741 PolarHBondContact O-N 3.39Å
738	E	30.8	Very low	31.2	Very low	120 Å²	120	108.9 Å²	108.9	56%	0.561	55%	0.552	S	S	*	*	H	α-helix	trans	-68.2	-28.8	-169.3	-62.9	-157.5	133.3	0	0	115.2	Y735 P742	Y735-E738 WeakPolarHBondContact CE1-OE2 3.35Å; E738-P742 WeakPolarHBondContact O-CD 3.34Å; E738-P742 WeakPolarHBondContact O-CG 3.49Å
739	L	31.7	Very low	31.2	Very low	138 Å²	138	110.7 Å²	110.7	72%	0.723	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-17.8	177.4	-94.9	166.1	0	0	0	113.9	S737	S737-L739 PolarHBondContact O-N 2.96Å
740	H	31.5	Very low	31.3	Very low	127 Å²	127	108.3 Å²	108.3	59%	0.588	55%	0.551	S	S	*	*	H	α-helix	trans	-86.4	-36.2	-178.3	-156.6	-5.6	0	0	0	111.9	S737 K744	S737-H740 PolarHBondContact O-N 3.42Å; H740-K744 VanDerWaalsContact O-CB 3.3Å; H740-K744 WeakPolarHBondContact O-CB 3.17Å; H740-K744 PolarHBondContact O-N 2.89Å
741	N	34.2	Very low	31.3	Very low	86 Å²	86	103.6 Å²	103.6	46%	0.46	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-43.4	-177.1	-74.5	-22.9	0	0	0	114.8	S737 M743 K744 N745	S737-N741 PolarHBondContact O-N 3.39Å; N741-M743 PolarHBondContact O-N 2.95Å; N741-K744 PolarHBondContact O-N 2.97Å; N741-N745 VanDerWaalsContact O-CB 3.29Å; N741-N745 WeakPolarHBondContact O-CB 3.48Å; N741-N745 VanDerWaalsContact O-CG 3.22Å; N741-N745 PolarHBondContact O-N 2.84Å; N741-N745 PolarHBondContact O-OD1 3.26Å
742	P	31.2	Very low	31.3	Very low	70 Å²	70	106.5 Å²	106.5	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-61.5	-43.8	179.6	-24.1	34.1	0	0	0	112.2	E738 N745 I746	E738-P742 WeakPolarHBondContact O-CD 3.34Å; E738-P742 WeakPolarHBondContact O-CG 3.49Å; P742-N745 PolarHBondContact O-N 2.94Å; P742-I746 WeakPolarHBondContact O-CB 3.41Å; P742-I746 WeakPolarHBondContact O-CD1 3.32Å; P742-I746 VanDerWaalsContact O-CG1 3.24Å; P742-I746 WeakPolarHBondContact O-CG1 3.44Å; P742-I746 PolarHBondContact O-N 3.27Å
743	M	29.1	Very low	31.5	Very low	122 Å²	122	107.8 Å²	107.8	60%	0.601	55%	0.549	S	S	*	.	H	α-helix	trans	-70.3	-37.5	-179.5	-159.2	179.7	-65.9	0	0	111.7	N741 F747	N741-M743 PolarHBondContact O-N 2.95Å; M743-F747 VanDerWaalsContact O-CB 3.3Å; M743-F747 WeakPolarHBondContact O-CB 3.38Å; M743-F747 PolarHBondContact O-N 2.93Å
744	K	30.3	Very low	31.5	Very low	115 Å²	115	105.1 Å²	105.1	50%	0.5	54%	0.535	S	S	.	.	H	α-helix	trans	-69	-37.4	175	-166.7	175.1	-176.6	-179.2	0	112.2	H740 N741 N748	H740-K744 VanDerWaalsContact O-CB 3.3Å; H740-K744 WeakPolarHBondContact O-CB 3.17Å; H740-K744 PolarHBondContact O-N 2.89Å; N741-K744 PolarHBondContact O-N 2.97Å; K744-N748 WeakPolarHBondContact O-CB 3.4Å; K744-N748 PolarHBondContact O-N 3.48Å; K744-N748 PolarHBondContact O-ND2 3.35Å; K744-N748 PolarHBondContact O-OD1 3.13Å
745	N	32.2	Very low	31.4	Very low	89 Å²	89	103.9 Å²	103.9	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-70.8	-45.4	175.8	-72.4	-1.8	0	0	0	111.6	N741 P742 F747 N748 E749	N741-N745 VanDerWaalsContact O-CB 3.29Å; N741-N745 WeakPolarHBondContact O-CB 3.48Å; N741-N745 VanDerWaalsContact O-CG 3.22Å; N741-N745 PolarHBondContact O-N 2.84Å; N741-N745 PolarHBondContact O-OD1 3.26Å; P742-N745 PolarHBondContact O-N 2.94Å; N745-F747 VanDerWaalsContact C-N 3.29Å; N745-F747 PolarHBondContact O-N 2.88Å; N745-N748 CarbonylContact O-C 3.52Å; N745-N748 PolarHBondContact O-N 3.4Å; N745-N748 VanDerWaalsContact O-N 3.12Å; N745-E749 WeakPolarHBondContact O-CB 3.21Å; N745-E749 WeakPolarHBondContact O-CG 3.48Å; N745-E749 PolarHBondContact O-N 2.84Å
746	I	31.7	Very low	31.4	Very low	87 Å²	87	103 Å²	103	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-60.4	-39.8	175	-69.6	164.6	0	0	0	111	P742 S750	P742-I746 WeakPolarHBondContact O-CB 3.41Å; P742-I746 WeakPolarHBondContact O-CD1 3.32Å; P742-I746 VanDerWaalsContact O-CG1 3.24Å; P742-I746 WeakPolarHBondContact O-CG1 3.44Å; P742-I746 PolarHBondContact O-N 3.27Å; I746-S750 VanDerWaalsContact O-CB 3.23Å; I746-S750 WeakPolarHBondContact O-CB 3.3Å; I746-S750 PolarHBondContact O-N 3.47Å; I746-S750 PolarHBondContact O-OG 2.85Å
747	F	34.1	Very low	31.3	Very low	81 Å²	81	104.4 Å²	104.4	36%	0.355	55%	0.547	S	S	.	.	H	α-helix	trans	-62.5	-46.8	173.1	-177.5	-93.9	0	0	0	111.7	M743 N745 S750 M751	M743-F747 VanDerWaalsContact O-CB 3.3Å; M743-F747 WeakPolarHBondContact O-CB 3.38Å; M743-F747 PolarHBondContact O-N 2.93Å; N745-F747 VanDerWaalsContact C-N 3.29Å; N745-F747 PolarHBondContact O-N 2.88Å; F747-S750 PolarHBondContact O-N 3.39Å; F747-M751 HydrophobicContact CD1-CG 4.34Å; F747-M751 HydrophobicContact CE1-CE 4.45Å; F747-M751 HydrophobicContact CE1-CG 4.06Å; F747-M751 HydrophobicContact CE2-CE 3.76Å; F747-M751 HydrophobicContact CZ-CE 3.67Å; F747-M751 HydrophobicContact CZ-CG 4.19Å; F747-M751 WeakPolarHBondContact O-CB 3.43Å; F747-M751 WeakPolarHBondContact O-CG 3.23Å; F747-M751 PolarHBondContact O-N 2.95Å
748	N	31.3	Very low	31.2	Very low	66 Å²	66	106.6 Å²	106.6	35%	0.353	55%	0.553	S	S	.	*	H	α-helix	trans	-65.9	-42.6	178.4	-72.1	-11.6	0	0	0	112.7	K744 N745 S750 M751 N752	K744-N748 WeakPolarHBondContact O-CB 3.4Å; K744-N748 PolarHBondContact O-N 3.48Å; K744-N748 PolarHBondContact O-ND2 3.35Å; K744-N748 PolarHBondContact O-OD1 3.13Å; N745-N748 CarbonylContact O-C 3.52Å; N745-N748 PolarHBondContact O-N 3.4Å; N745-N748 VanDerWaalsContact O-N 3.12Å; N748-S750 VanDerWaalsContact C-N 3.33Å; N748-S750 PolarHBondContact O-N 3.47Å; N748-M751 PolarHBondContact O-N 3.18Å; N748-N752 WeakPolarHBondContact O-CB 3.26Å; N748-N752 PolarHBondContact O-N 2.89Å; N748-N752 PolarHBondContact O-ND2 3.33Å
749	E	33.9	Very low	30.9	Very low	136 Å²	136	106.7 Å²	106.7	64%	0.636	55%	0.549	S	S	*	.	H	α-helix	trans	-64.5	-38	175.2	-71.8	179.5	130.7	0	0	111.6	N745 S753	N745-E749 WeakPolarHBondContact O-CB 3.21Å; N745-E749 WeakPolarHBondContact O-CG 3.48Å; N745-E749 PolarHBondContact O-N 2.84Å; E749-S753 WeakPolarHBondContact O-CB 3.44Å; E749-S753 PolarHBondContact O-N 3.37Å; E749-S753 PolarHBondContact O-OG 3Å
750	S	32.5	Very low	30.6	Very low	67 Å²	67	106 Å²	106	47%	0.469	55%	0.553	S	S	.	*	H	α-helix	trans	-69.2	-32	175.4	-57.9	0	0	0	0	112.9	I746 F747 N748 S753 L754	I746-S750 VanDerWaalsContact O-CB 3.23Å; I746-S750 WeakPolarHBondContact O-CB 3.3Å; I746-S750 PolarHBondContact O-N 3.47Å; I746-S750 PolarHBondContact O-OG 2.85Å; F747-S750 PolarHBondContact O-N 3.39Å; N748-S750 VanDerWaalsContact C-N 3.33Å; N748-S750 PolarHBondContact O-N 3.47Å; S750-S753 PolarHBondContact O-OG 2.9Å; S750-L754 WeakPolarHBondContact O-CD1 3.21Å
751	M	31.3	Very low	30.3	Very low	61 Å²	61	103.2 Å²	103.2	30%	0.3	55%	0.545	S	S	.	.	H	α-helix	trans	-82.5	-38.2	176.7	-73.1	-66.8	-177.4	0	0	112.8	F747 N748 S753 L754	F747-M751 HydrophobicContact CD1-CG 4.34Å; F747-M751 HydrophobicContact CE1-CE 4.45Å; F747-M751 HydrophobicContact CE1-CG 4.06Å; F747-M751 HydrophobicContact CE2-CE 3.76Å; F747-M751 HydrophobicContact CZ-CE 3.67Å; F747-M751 HydrophobicContact CZ-CG 4.19Å; F747-M751 WeakPolarHBondContact O-CB 3.43Å; F747-M751 WeakPolarHBondContact O-CG 3.23Å; F747-M751 PolarHBondContact O-N 2.95Å; N748-M751 PolarHBondContact O-N 3.18Å; M751-S753 PolarHBondContact O-N 3.17Å; M751-L754 PolarHBondContact O-N 3.02Å; M751-L754 HydrophobicContact SD-CD1 4.4Å
752	N	32.2	Very low	29.8	Very low	139 Å²	139	103.6 Å²	103.6	74%	0.743	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.2	179.6	-69.3	-18.7	0	0	0	113.6	N748	N748-N752 WeakPolarHBondContact O-CB 3.26Å; N748-N752 PolarHBondContact O-N 2.89Å; N748-N752 PolarHBondContact O-ND2 3.33Å
753	S	32.5	Very low	29.6	Very low	93 Å²	93	108.7 Å²	108.7	65%	0.65	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	2.6	177.4	46.4	0	0	0	0	114.3	E749 S750 M751	E749-S753 WeakPolarHBondContact O-CB 3.44Å; E749-S753 PolarHBondContact O-N 3.37Å; E749-S753 PolarHBondContact O-OG 3Å; S750-S753 PolarHBondContact O-OG 2.9Å; M751-S753 PolarHBondContact O-N 3.17Å
754	L	28.8	Very low	29.5	Very low	84 Å²	84	112 Å²	112	44%	0.44	57%	0.572	S	S	.	*	S	Bend	trans	-86.7	146.9	170.5	-78	119.4	0	0	0	112.6	S750 M751 T756	S750-L754 WeakPolarHBondContact O-CD1 3.21Å; M751-L754 PolarHBondContact O-N 3.02Å; M751-L754 HydrophobicContact SD-CD1 4.4Å; L754-T756 PolarHBondContact O-N 3.23Å
755	P	28.2	Very low	29.4	Very low	96 Å²	96	112 Å²	112	62%	0.623	59%	0.585	S	S	*	*			trans	-58.9	134.6	176.5	-25.6	35.4	0	0	0	113.8	Y757	P755-Y757 PolarHBondContact O-N 3.33Å
756	T	28.5	Very low	29	Very low	139 Å²	139	111.3 Å²	111.3	85%	0.853	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	22.4	-164.7	-29.6	0	0	0	0	115.9	L754	L754-T756 PolarHBondContact O-N 3.23Å
757	Y	30	Very low	28.9	Very low	225 Å²	225	112 Å²	112	88%	0.882	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	6.8	-174.9	-77.4	-80.3	0	0	0	114.6	P755	P755-Y757 PolarHBondContact O-N 3.33Å
758	I	29	Very low	28.6	Very low	97 Å²	97	116.1 Å²	116.1	50%	0.497	62%	0.618	S	S	.	*	S	Bend	trans	-125.5	40.1	-172.3	-34	-177.8	0	0	0	113.6
759	Y	25.7	Very low	28.5	Very low	123 Å²	123	122.4 Å²	122.4	48%	0.482	65%	0.645	S	S	.	*			trans	-146.6	124	164	-79.5	-70.6	0	0	0	111.6	L762	Y759-L762 HydrophobicContact CE1-CB 4.41Å
760	P	25.3	Very low	28.4	Very low	123 Å²	123	125 Å²	125	80%	0.799	66%	0.657	S	S	*	*	S	Bend		-145.1	95.6	118.9	34.5	-17.8	0	0	0	112.7
761	T	25.5	Very low	28.4	Very low	68 Å²	68	126.7 Å²	126.7	42%	0.417	67%	0.669	S	S	.	*	S	Bend	trans	-166.4	-16.7	158.4	-3.4	0	0	0	0	114.1
762	L	23	Very low	28.4	Very low	94 Å²	94	133.5 Å²	133.5	49%	0.492	70%	0.697	S	S	.	*	S	Bend	trans	-119.6	131	176.5	-65.1	170.6	0	0	0	109.9	Y759	Y759-L762 HydrophobicContact CE1-CB 4.41Å
763	F	27.4	Very low	28.3	Very low	178 Å²	178	134.3 Å²	134.3	78%	0.781	70%	0.7	S	S	*	*			trans	55.9	82.6	174.4	-49.3	-72.3	0	0	0	116.6
764	K	26.5	Very low	28.2	Very low	190 Å²	190	135.1 Å²	135.1	83%	0.826	70%	0.703	S	S	*	*			trans	-81.1	123.5	156.3	-138.5	178.3	-172.3	-178.6	0	107.9
765	P	27	Very low	28.3	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	72%	0.717	S	S	*	*			trans	-75.4	144.5	-179.1	30.5	-34.5	0	0	0	110.9
766	I	24.9	Very low	28.3	Very low	74 Å²	74	136.1 Å²	136.1	38%	0.379	72%	0.719	S	S	.	*			trans	-116.3	111.9	170.8	-53.2	164	0	0	0	108	E76 N80	E76-I766 HydrophobicContact CB-CD1 4.02Å; E76-I766 HydrophobicContact CG-CD1 3.8Å; E76-I766 WeakPolarHBondContact OE1-CG2 3.44Å; E76-I766 WeakPolarHBondContact OE2-CD1 3.41Å; N80-I766 WeakPolarHBondContact ND2-CD1 3.37Å
767	S	28.7	Very low	28.4	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	71%	0.713	S	S	*	*			trans	-156.5	109.6	166	61.1	0	0	0	0	108.5
768	N	27.7	Very low	28.2	Very low	168 Å²	168	129 Å²	129	90%	0.898	70%	0.703	S	S	*	*			trans	-167.3	69.3	158.2	-99.5	-17.9	0	0	0	109.3
769	H	30.4	Very low	28.2	Very low	197 Å²	197	130.3 Å²	130.3	91%	0.912	72%	0.716	S	S	*	*			trans	-129.7	85.7	168.2	-127.8	-66.1	0	0	0	108
770	E	31.1	Very low	28.1	Very low	191 Å²	191	129.4 Å²	129.4	89%	0.893	73%	0.728	S	S	*	*			trans	-122.6	128.9	170.3	-166.7	168.4	-133.1	0	0	109.3
771	S	33.7	Very low	28.3	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	73%	0.73	S	S	*	*			trans	-83.9	122.3	-166.2	44.7	0	0	0	0	112.2	I773	S771-I773 PolarHBondContact O-N 2.61Å; S771-I773 VanDerWaalsContact O-N 3.1Å
772	K	30.5	Very low	28.2	Very low	205 Å²	205	130.8 Å²	130.8	89%	0.891	74%	0.743	S	S	*	*			trans	-66.3	107.8	168.7	-73.3	176.1	179	169.3	0	110.4
773	I	30.9	Very low	28.3	Very low	155 Å²	155	133.8 Å²	133.8	80%	0.795	76%	0.759	S	S	*	*			trans	-90.5	122.3	156.6	-59.9	179.2	0	0	0	107.5	S771	S771-I773 PolarHBondContact O-N 2.61Å; S771-I773 VanDerWaalsContact O-N 3.1Å
774	P	29.2	Very low	28.2	Very low	111 Å²	111	133.9 Å²	133.9	72%	0.721	76%	0.759	S	S	*	*			trans	-92.9	143.3	-178.3	34.8	-32.8	0	0	0	112.4
775	S	31.1	Very low	28.1	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	76%	0.757	S	S	*	*				174.4	128.6	116.8	61.9	0	0	0	0	114.7
776	S	29.1	Very low	28.1	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	76%	0.758	S	S	*	*			trans	61	129.6	135.2	66.1	0	0	0	0	123.7
777	T	29.3	Very low	28.1	Very low	117 Å²	117	138 Å²	138	72%	0.718	78%	0.775	S	S	*	*			trans	73.6	87	133.5	53	0	0	0	0	121.8
778	S	26.4	Very low	28.1	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	78%	0.782	S	S	*	*				70.6	152.3	106.5	69.3	0	0	0	0	122.7
779	T	29.3	Very low	28	Very low	124 Å²	124	139.9 Å²	139.9	76%	0.761	78%	0.776	S	S	*	*			trans	66	112	173.7	65.1	0	0	0	0	114.8
780	S	24	Very low	27.7	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	77%	0.771	S	S	*	*			cis	75.7	88.5	48.3	83.4	0	0	0	0	114.9
781	S	28	Very low	27.6	Very low	120 Å²	120	137 Å²	137	84%	0.839	77%	0.769	S	S	*	*				-175.8	139	128.3	45.4	0	0	0	0	114
782	S	24.9	Very low	27.5	Very low	99 Å²	99	136.9 Å²	136.9	69%	0.692	77%	0.765	S	S	*	*			trans	30.3	133.8	140.1	-68.6	0	0	0	0	123.6
783	L	24.8	Very low	27.4	Very low	158 Å²	158	134.6 Å²	134.6	83%	0.827	76%	0.763	S	S	*	*			trans	60.3	124.5	132.5	-58.2	168	0	0	0	117
784	K	24.7	Very low	27.1	Very low	180 Å²	180	132 Å²	132	78%	0.783	76%	0.759	S	S	*	*			cis	177.3	167.6	47.4	-159.5	162.9	179.1	-173.2	0	110.2
785	W	24.4	Very low	27.1	Very low	209 Å²	209	134.3 Å²	134.3	79%	0.792	76%	0.763	S	S	*	*			trans	-35.3	147.7	167.4	-47.7	85.4	0	0	0	114.9
786	D	26.3	Very low	26.9	Very low	144 Å²	144	136.7 Å²	136.7	77%	0.77	76%	0.763	S	S	*	*				-161.8	156.5	70.7	-78.6	-37.6	0	0	0	114.2
787	P	25.3	Very low	26.9	Very low	114 Å²	114	139.4 Å²	139.4	74%	0.74	77%	0.765	S	S	*	*			trans	-91.2	144.9	166.8	36.2	-31.5	0	0	0	112.3
788	V	29.5	Very low	27	Very low	141 Å²	141	139.8 Å²	139.8	86%	0.855	76%	0.762	S	S	*	*			trans	-135.2	142.6	177.4	-178.4	0	0	0	0	111.3
789	E	24.7	Very low	27.2	Very low	168 Å²	168	140.8 Å²	140.8	79%	0.785	76%	0.76	S	S	*	*			trans	-92.7	160.2	-167.5	-59.8	177.3	116.1	0	0	115.3
790	M	24.7	Very low	27.5	Very low	162 Å²	162	144.4 Å²	144.4	80%	0.798	77%	0.765	S	S	*	*			trans	17.7	116.4	145.1	-61.7	176.1	58.8	0	0	120.2
791	I	29.2	Very low	27.7	Very low	164 Å²	164	145.8 Å²	145.8	84%	0.841	77%	0.765	S	S	*	*			trans	-141.3	117.9	137.1	-52.4	179.3	0	0	0	110.2
792	P	32.1	Very low	27.9	Very low	100 Å²	100	150.2 Å²	150.2	65%	0.649	77%	0.769	S	S	*	*			trans	-102.2	127.4	158	33.7	-25.4	0	0	0	110.5
793	N	26.8	Very low	28	Very low	157 Å²	157	154 Å²	154	84%	0.84	77%	0.772	S	S	*	*			trans	-166.3	151.6	156.2	-108.4	-36.8	0	0	0	115.6
794	S	24.4	Very low	28.3	Very low	101 Å²	101	154.7 Å²	154.7	71%	0.706	78%	0.776	S	S	*	*			trans	-50.9	148.1	176	-43.4	0	0	0	0	117.7
795	I	30.2	Very low	28.3	Very low	159 Å²	159	152.5 Å²	152.5	82%	0.815	77%	0.773	S	S	*	*			trans	-168.5	116	139.4	-88.2	140	0	0	0	103.6
796	E	25.9	Very low	28.6	Very low	156 Å²	156	150.3 Å²	150.3	73%	0.729	78%	0.777	S	S	*	*			cis	88.9	139.3	44	-160.9	173	-131.5	0	0	113.3
797	H	30.5	Very low	28.6	Very low	152 Å²	152	152.7 Å²	152.7	70%	0.704	78%	0.784	S	S	*	*			trans	70.9	144.3	-175.5	-66.4	-71.6	0	0	0	117.1
798	N	31.9	Very low	28.8	Very low	126 Å²	126	156.3 Å²	156.3	67%	0.674	79%	0.79	S	S	*	*			cis	-151.5	138.6	9.3	-121.5	-16	0	0	0	115.8
799	D	29.8	Very low	28.6	Very low	118 Å²	118	157.2 Å²	157.2	63%	0.631	79%	0.791	S	S	*	*			trans	19.9	129.1	149.8	-63.3	-21.1	0	0	0	123.6
800	K	35.7	Very low	28.7	Very low	201 Å²	201	158.4 Å²	158.4	87%	0.874	80%	0.796	S	S	*	*				-172.4	100	100.5	-97.7	147	-164.5	160.6	0	116.6
801	N	27.2	Very low	28.9	Very low	133 Å²	133	156 Å²	156	71%	0.711	79%	0.79	S	S	*	*			trans	16.9	119.9	142.3	-69.8	-71.4	0	0	0	121.1
802	K	33.2	Very low	28.8	Very low	213 Å²	213	155 Å²	155	93%	0.926	79%	0.785	S	S	*	*				-155.7	133.4	114.3	-117	171.5	-176.4	176.6	0	112.7
803	K	27.4	Very low	28.5	Very low	177 Å²	177	157.1 Å²	157.1	77%	0.77	79%	0.79	S	S	*	*			trans	-83.3	150.6	177.3	-59.9	174.9	177.2	178.7	0	111.1
804	L	30	Very low	28.5	Very low	173 Å²	173	159.9 Å²	159.9	91%	0.906	79%	0.789	S	S	*	*				-166.4	154.5	114.3	-102.8	159.6	0	0	0	110.8
805	N	26	Very low	28.7	Very low	134 Å²	134	160.1 Å²	160.1	72%	0.717	78%	0.782	S	S	*	*			trans	-93.4	149.2	-167	-51	-5.7	0	0	0	111.9
806	N	30.1	Very low	28.7	Very low	164 Å²	164	161 Å²	161	88%	0.877	78%	0.78	S	S	*	*				-167.9	140.7	118.9	-98	-13.1	0	0	0	111.4
807	E	25.9	Very low	29	Very low	194 Å²	194	157.2 Å²	157.2	91%	0.907	77%	0.765	S	S	*	*			trans	-90.1	118.5	175.8	-59.9	163.3	115.3	0	0	109.8
808	Q	28.9	Very low	29.2	Very low	189 Å²	189	153.2 Å²	153.2	88%	0.883	75%	0.754	S	S	*	*			trans	-141.2	145.4	158.2	-72.9	-158.5	-12.9	0	0	110.9	E810	Q808-E810 PolarHBondContact O-N 3.03Å
809	N	25.2	Very low	29	Very low	161 Å²	161	154.6 Å²	154.6	86%	0.861	76%	0.758	S	S	*	*			trans	-73.8	119	-170.4	-51.1	-74.5	0	0	0	111.9
810	E	28.4	Very low	29.2	Very low	193 Å²	193	153.1 Å²	153.1	90%	0.902	75%	0.753	S	S	*	*			trans	-93	103.6	161	-69.3	-161.5	144.9	0	0	110.2	Q808	Q808-E810 PolarHBondContact O-N 3.03Å
811	T	27.4	Very low	29.1	Very low	110 Å²	110	148.7 Å²	148.7	68%	0.675	74%	0.739	S	S	*	*			trans	-70.8	127.8	166.9	43.1	0	0	0	0	109.3	I813	T811-I813 PolarHBondContact O-N 3.47Å
812	I	27.9	Very low	29.5	Very low	144 Å²	144	145.9 Å²	145.9	74%	0.738	73%	0.727	S	S	*	*			trans	-69.3	93.1	176.3	-56.6	176.2	0	0	0	109	W814	I812-W814 PolarHBondContact O-N 3.18Å; I812-W814 VanDerWaalsContact O-N 3.11Å
813	I	26.4	Very low	29.5	Very low	145 Å²	145	137.9 Å²	137.9	74%	0.744	70%	0.7	S	S	*	*			trans	-76.3	95.6	173.6	-60.9	176.1	0	0	0	108	T811 N815	T811-I813 PolarHBondContact O-N 3.47Å; I813-N815 PolarHBondContact O-N 3.41Å; I813-N815 VanDerWaalsContact O-N 3.09Å
814	W	27.3	Very low	29.8	Very low	214 Å²	214	137 Å²	137	81%	0.811	69%	0.693	S	S	*	*			trans	-62.5	110.3	168.1	-75.3	79	0	0	0	109.5	I812 K816	I812-W814 PolarHBondContact O-N 3.18Å; I812-W814 VanDerWaalsContact O-N 3.11Å; W814-K816 PolarHBondContact O-N 3.07Å; W814-K816 VanDerWaalsContact O-N 3.16Å
815	N	26.9	Very low	30	Very low	106 Å²	106	131.3 Å²	131.3	57%	0.567	67%	0.671	S	S	*	*			trans	-64.7	114.5	175.4	-177.5	-4	0	0	0	109.4	I813 N817 S818	I813-N815 PolarHBondContact O-N 3.41Å; I813-N815 VanDerWaalsContact O-N 3.09Å; N815-N817 PolarHBondContact O-N 2.91Å; N815-N817 VanDerWaalsContact O-N 3.09Å; N815-N817 PolarHBondContact OD1-N 3.35Å; N815-S818 PolarHBondContact O-N 3.47Å; N815-S818 VanDerWaalsContact O-N 3.17Å
816	K	31.7	Very low	30.4	Very low	179 Å²	179	131 Å²	131	78%	0.778	67%	0.667	S	S	*	*	H	α-helix	trans	-57.4	-28.2	-174	-69.7	-177.6	176.9	178.3	0	113.4	W814 S818 M819	W814-K816 PolarHBondContact O-N 3.07Å; W814-K816 VanDerWaalsContact O-N 3.16Å; K816-S818 VanDerWaalsContact C-N 3.3Å; K816-S818 PolarHBondContact O-N 3.38Å; K816-M819 PolarHBondContact O-N 3.5Å
817	N	32.2	Very low	30.4	Very low	76 Å²	76	129 Å²	129	41%	0.406	66%	0.656	S	S	.	*	H	α-helix	trans	-63.7	-34.4	-178	-60.4	9.3	0	0	0	112.1	N815 M819 T820 D821	N815-N817 PolarHBondContact O-N 2.91Å; N815-N817 VanDerWaalsContact O-N 3.09Å; N815-N817 PolarHBondContact OD1-N 3.35Å; N817-M819 VanDerWaalsContact C-N 3.26Å; N817-M819 PolarHBondContact O-N 3.31Å; N817-T820 WeakPolarHBondContact CA-OG1 3.3Å; N817-T820 PolarHBondContact O-N 2.81Å; N817-T820 PolarHBondContact O-OG1 2.88Å; N817-D821 PolarHBondContact O-N 3.37Å
818	S	33.9	Very low	30.9	Very low	67 Å²	67	122.3 Å²	122.3	47%	0.469	63%	0.628	S	S	.	*	H	α-helix	trans	-60	-36.5	179.9	172.9	0	0	0	0	112.5	N815 K816 V822	N815-S818 PolarHBondContact O-N 3.47Å; N815-S818 VanDerWaalsContact O-N 3.17Å; K816-S818 VanDerWaalsContact C-N 3.3Å; K816-S818 PolarHBondContact O-N 3.38Å; S818-V822 WeakPolarHBondContact O-CB 3.19Å; S818-V822 VanDerWaalsContact O-CG2 3.3Å; S818-V822 WeakPolarHBondContact O-CG2 3.47Å; S818-V822 PolarHBondContact O-N 2.94Å; S818-V822 VanDerWaalsContact O-N 3.12Å
819	M	27.7	Very low	31.2	Very low	156 Å²	156	116.7 Å²	116.7	77%	0.768	60%	0.604	S	S	*	*	H	α-helix	trans	-79	-27.6	-178.7	-155.7	169.3	75.2	0	0	112.4	K816 N817 A823	K816-M819 PolarHBondContact O-N 3.5Å; N817-M819 VanDerWaalsContact C-N 3.26Å; N817-M819 PolarHBondContact O-N 3.31Å; M819-A823 WeakPolarHBondContact O-CB 3.34Å; M819-A823 PolarHBondContact O-N 2.91Å; M819-A823 VanDerWaalsContact O-N 3.09Å
820	T	34.4	Very low	31.4	Very low	87 Å²	87	112.1 Å²	112.1	53%	0.534	59%	0.585	S	S	.	*	H	α-helix	trans	-72.1	-39.5	169.9	43	0	0	0	0	112.1	N817 A823 Y824	N817-T820 WeakPolarHBondContact CA-OG1 3.3Å; N817-T820 PolarHBondContact O-N 2.81Å; N817-T820 PolarHBondContact O-OG1 2.88Å; T820-A823 PolarHBondContact O-N 3.22Å; T820-Y824 VanDerWaalsContact O-CB 3.3Å; T820-Y824 WeakPolarHBondContact O-CB 3.17Å; T820-Y824 PolarHBondContact O-N 2.81Å
821	D	33	Very low	31.7	Very low	107 Å²	107	109.3 Å²	109.3	57%	0.572	57%	0.57	S	S	*	*	H	α-helix	trans	-69	-42.2	-177.8	-59.6	-15.5	0	0	0	110.9	N817 Y824 A825	N817-D821 PolarHBondContact O-N 3.37Å; D821-Y824 PolarHBondContact O-N 3.21Å; D821-A825 WeakPolarHBondContact O-CB 3.4Å; D821-A825 PolarHBondContact O-N 3.11Å
822	V	35.2	Very low	32.2	Very low	74 Å²	74	109.3 Å²	109.3	45%	0.448	56%	0.562	S	S	.	*	H	α-helix	trans	-64.7	-43.7	172.6	172.4	0	0	0	0	111.3	S818 Y824 A825 M826	S818-V822 WeakPolarHBondContact O-CB 3.19Å; S818-V822 VanDerWaalsContact O-CG2 3.3Å; S818-V822 WeakPolarHBondContact O-CG2 3.47Å; S818-V822 PolarHBondContact O-N 2.94Å; S818-V822 VanDerWaalsContact O-N 3.12Å; V822-Y824 PolarHBondContact O-N 3.49Å; V822-A825 PolarHBondContact O-N 3.07Å; V822-M826 HydrophobicContact CG1-CE 3.74Å; V822-M826 HydrophobicContact CG1-CG 4.47Å; V822-M826 HydrophobicContact CG1-SD 4.07Å; V822-M826 WeakPolarHBondContact O-CB 3.44Å; V822-M826 VanDerWaalsContact O-CG 3.29Å; V822-M826 WeakPolarHBondContact O-CG 3.27Å; V822-M826 PolarHBondContact O-N 2.98Å
823	A	32.8	Very low	32.6	Very low	45 Å²	45	107.3 Å²	107.3	37%	0.372	55%	0.549	S	S	.	.	H	α-helix	trans	-63.8	-40.1	176.8	0	0	0	0	0	112.3	M819 T820 M826 L827	M819-A823 WeakPolarHBondContact O-CB 3.34Å; M819-A823 PolarHBondContact O-N 2.91Å; M819-A823 VanDerWaalsContact O-N 3.09Å; T820-A823 PolarHBondContact O-N 3.22Å; A823-M826 PolarHBondContact O-N 3.36Å; A823-L827 WeakPolarHBondContact O-CB 3.37Å; A823-L827 VanDerWaalsContact O-CG 3.23Å; A823-L827 WeakPolarHBondContact O-CG 3.41Å; A823-L827 PolarHBondContact O-N 3.36Å
824	Y	34.4	Very low	33.2	Very low	159 Å²	159	103.4 Å²	103.4	62%	0.624	53%	0.533	S	S	*	.	H	α-helix	trans	-66.9	-43.6	177.3	-167.4	-95.6	0	0	0	111.5	T820 D821 V822 M826 L827 T828	T820-Y824 VanDerWaalsContact O-CB 3.3Å; T820-Y824 WeakPolarHBondContact O-CB 3.17Å; T820-Y824 PolarHBondContact O-N 2.81Å; D821-Y824 PolarHBondContact O-N 3.21Å; V822-Y824 PolarHBondContact O-N 3.49Å; Y824-M826 PolarHBondContact O-N 3.27Å; Y824-L827 PolarHBondContact O-N 2.69Å; Y824-T828 HydrophobicContact CD1-CG2 4.11Å; Y824-T828 HydrophobicContact CE1-CG2 3.73Å; Y824-T828 PolarHBondContact O-N 3.33Å; Y824-T828 PolarHBondContact O-OG1 2.75Å; Y824-T828 VanDerWaalsContact O-OG1 3.11Å
825	A	35.2	Very low	33.8	Very low	53 Å²	53	95.8 Å²	95.8	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-37.6	174.5	0	0	0	0	0	112.8	D821 V822 T828 N829	D821-A825 WeakPolarHBondContact O-CB 3.4Å; D821-A825 PolarHBondContact O-N 3.11Å; V822-A825 PolarHBondContact O-N 3.07Å; A825-T828 PolarHBondContact O-OG1 3.42Å; A825-N829 WeakPolarHBondContact O-CB 3.33Å; A825-N829 PolarHBondContact O-N 3.25Å; A825-N829 VanDerWaalsContact O-N 3.11Å
826	M	33.1	Very low	34.4	Very low	129 Å²	129	95.7 Å²	95.7	64%	0.635	50%	0.503	S	S	*	.	H	α-helix	trans	-66.5	-40.4	172.2	-74.7	178.1	174.9	0	0	111.8	V822 A823 Y824 S830	V822-M826 HydrophobicContact CG1-CE 3.74Å; V822-M826 HydrophobicContact CG1-CG 4.47Å; V822-M826 HydrophobicContact CG1-SD 4.07Å; V822-M826 WeakPolarHBondContact O-CB 3.44Å; V822-M826 VanDerWaalsContact O-CG 3.29Å; V822-M826 WeakPolarHBondContact O-CG 3.27Å; V822-M826 PolarHBondContact O-N 2.98Å; A823-M826 PolarHBondContact O-N 3.36Å; Y824-M826 PolarHBondContact O-N 3.27Å; M826-S830 WeakPolarHBondContact O-CB 3.48Å; M826-S830 PolarHBondContact O-N 3.16Å
827	L	31.4	Very low	34.9	Very low	122 Å²	122	93.9 Å²	93.9	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-68.3	-45	179.1	-76.6	166.4	0	0	0	112.5	A823 Y824 S830 F831	A823-L827 WeakPolarHBondContact O-CB 3.37Å; A823-L827 VanDerWaalsContact O-CG 3.23Å; A823-L827 WeakPolarHBondContact O-CG 3.41Å; A823-L827 PolarHBondContact O-N 3.36Å; Y824-L827 PolarHBondContact O-N 2.69Å; L827-S830 PolarHBondContact O-N 2.9Å; L827-F831 VanDerWaalsContact O-CB 3.31Å; L827-F831 WeakPolarHBondContact O-CB 3.49Å; L827-F831 PolarHBondContact O-N 2.82Å
828	T	35.2	Very low	35.7	Very low	53 Å²	53	95.3 Å²	95.3	33%	0.325	50%	0.499	S	S	.	.	H	α-helix	trans	-66.5	-45.6	177	50.8	0	0	0	0	111.7	Y824 A825 S830 F831 E832	Y824-T828 HydrophobicContact CD1-CG2 4.11Å; Y824-T828 HydrophobicContact CE1-CG2 3.73Å; Y824-T828 PolarHBondContact O-N 3.33Å; Y824-T828 PolarHBondContact O-OG1 2.75Å; Y824-T828 VanDerWaalsContact O-OG1 3.11Å; A825-T828 PolarHBondContact O-OG1 3.42Å; T828-S830 VanDerWaalsContact C-N 3.32Å; T828-S830 PolarHBondContact O-N 3.04Å; T828-F831 PolarHBondContact O-N 2.92Å; T828-F831 VanDerWaalsContact O-N 3.14Å; T828-E832 WeakPolarHBondContact O-CG 3.18Å; T828-E832 PolarHBondContact O-N 3.37Å
829	N	35	Very low	36	Very low	71 Å²	71	99 Å²	99	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-37.9	177.6	-165	-4.6	0	0	0	111.6	A825 Q833	A825-N829 WeakPolarHBondContact O-CB 3.33Å; A825-N829 PolarHBondContact O-N 3.25Å; A825-N829 VanDerWaalsContact O-N 3.11Å; N829-Q833 VanDerWaalsContact O-CB 3.31Å; N829-Q833 WeakPolarHBondContact O-CB 3.35Å; N829-Q833 WeakPolarHBondContact O-CG 3.21Å; N829-Q833 PolarHBondContact O-N 3.03Å; N829-Q833 PolarHBondContact OD1-NE2 2.94Å
830	S	29.4	Very low	36.5	Very low	65 Å²	65	94.2 Å²	94.2	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-66.5	-38.9	172.3	-174.3	0	0	0	0	112.6	M826 L827 T828 T834	M826-S830 WeakPolarHBondContact O-CB 3.48Å; M826-S830 PolarHBondContact O-N 3.16Å; L827-S830 PolarHBondContact O-N 2.9Å; T828-S830 VanDerWaalsContact C-N 3.32Å; T828-S830 PolarHBondContact O-N 3.04Å; S830-T834 WeakPolarHBondContact O-CB 3.3Å; S830-T834 WeakPolarHBondContact O-CG2 3.33Å; S830-T834 PolarHBondContact O-N 3.32Å; S830-T834 PolarHBondContact O-OG1 3.06Å
831	F	34.4	Very low	37.2	Very low	133 Å²	133	93.6 Å²	93.6	58%	0.583	47%	0.474	S	S	*	.	H	α-helix	trans	-69	-40.1	176.9	-168.3	-101.1	0	0	0	112.3	L827 T828 T834 N835	L827-F831 VanDerWaalsContact O-CB 3.31Å; L827-F831 WeakPolarHBondContact O-CB 3.49Å; L827-F831 PolarHBondContact O-N 2.82Å; T828-F831 PolarHBondContact O-N 2.92Å; T828-F831 VanDerWaalsContact O-N 3.14Å; F831-T834 WeakPolarHBondContact CA-OG1 3.25Å; F831-T834 PolarHBondContact O-OG1 2.68Å; F831-N835 WeakPolarHBondContact CD1-ND2 3.21Å; F831-N835 VanDerWaalsContact CE1-ND2 3.27Å; F831-N835 WeakPolarHBondContact CE1-ND2 3.34Å; F831-N835 WeakPolarHBondContact CZ-ND2 3.42Å; F831-N835 PolarHBondContact O-N 3.36Å; F831-N835 VanDerWaalsContact O-N 3.14Å; F831-N835 PolarHBondContact O-ND2 3.35Å
832	E	39.2	Very low	37.8	Very low	111 Å²	111	92 Å²	92	52%	0.519	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-48.6	172.9	-72.9	172.7	-177.7	0	0	110.9	T828 T834 F836	T828-E832 WeakPolarHBondContact O-CG 3.18Å; T828-E832 PolarHBondContact O-N 3.37Å; E832-T834 PolarHBondContact O-N 2.99Å; E832-F836 VanDerWaalsContact O-CB 3.29Å; E832-F836 WeakPolarHBondContact O-CB 3.27Å; E832-F836 PolarHBondContact O-N 3.5Å
833	Q	35.7	Very low	38.3	Very low	101 Å²	101	93.3 Å²	93.3	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-40.2	178	-74.9	177.7	37.7	0	0	113.3	N829 K837	N829-Q833 VanDerWaalsContact O-CB 3.31Å; N829-Q833 WeakPolarHBondContact O-CB 3.35Å; N829-Q833 WeakPolarHBondContact O-CG 3.21Å; N829-Q833 PolarHBondContact O-N 3.03Å; N829-Q833 PolarHBondContact OD1-NE2 2.94Å; Q833-K837 WeakPolarHBondContact O-CB 3.4Å; Q833-K837 PolarHBondContact O-N 3.36Å
834	T	39.9	Very low	38.9	Very low	64 Å²	64	93.6 Å²	93.6	39%	0.393	46%	0.457	S	S	.	.	H	α-helix	trans	-69.3	-43.9	179.7	43.4	0	0	0	0	112.2	S830 F831 E832 Q838	S830-T834 WeakPolarHBondContact O-CB 3.3Å; S830-T834 WeakPolarHBondContact O-CG2 3.33Å; S830-T834 PolarHBondContact O-N 3.32Å; S830-T834 PolarHBondContact O-OG1 3.06Å; F831-T834 WeakPolarHBondContact CA-OG1 3.25Å; F831-T834 PolarHBondContact O-OG1 2.68Å; E832-T834 PolarHBondContact O-N 2.99Å; T834-Q838 VanDerWaalsContact O-CB 3.31Å; T834-Q838 WeakPolarHBondContact O-CB 3.39Å; T834-Q838 PolarHBondContact O-N 3.27Å
835	N	38.7	Very low	39.6	Very low	54 Å²	54	91.3 Å²	91.3	29%	0.289	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-44.7	173.8	-76.4	-70.2	0	0	0	111.8	F831 Q838 Y839	F831-N835 WeakPolarHBondContact CD1-ND2 3.21Å; F831-N835 VanDerWaalsContact CE1-ND2 3.27Å; F831-N835 WeakPolarHBondContact CE1-ND2 3.34Å; F831-N835 WeakPolarHBondContact CZ-ND2 3.42Å; F831-N835 PolarHBondContact O-N 3.36Å; F831-N835 VanDerWaalsContact O-N 3.14Å; F831-N835 PolarHBondContact O-ND2 3.35Å; N835-Q838 PolarHBondContact O-N 3.45Å; N835-Y839 WeakPolarHBondContact O-CB 3.34Å; N835-Y839 PolarHBondContact O-N 2.78Å
836	F	40	Very low	40.3	Very low	104 Å²	104	93.9 Å²	93.9	46%	0.456	45%	0.453	S	S	.	.	H	α-helix	trans	-64.7	-41.7	178.8	-176	-113.1	0	0	0	112.3	E832 Y839 L840	E832-F836 VanDerWaalsContact O-CB 3.29Å; E832-F836 WeakPolarHBondContact O-CB 3.27Å; E832-F836 PolarHBondContact O-N 3.5Å; F836-Y839 PolarHBondContact O-N 3.19Å; F836-L840 HydrophobicContact CD1-CD1 3.95Å; F836-L840 HydrophobicContact CD1-CG 4.48Å; F836-L840 HydrophobicContact CE1-CD1 3.49Å; F836-L840 VanDerWaalsContact CE1-CD1 3.49Å; F836-L840 HydrophobicContact CE1-CG 4.14Å; F836-L840 HydrophobicContact CE2-CG 4.43Å; F836-L840 HydrophobicContact CZ-CD1 3.87Å; F836-L840 HydrophobicContact CZ-CD2 4.32Å; F836-L840 HydrophobicContact CZ-CG 4.11Å; F836-L840 WeakPolarHBondContact O-CG 3.26Å; F836-L840 PolarHBondContact O-N 3.35Å
837	K	42.5	Very low	40.7	Very low	141 Å²	141	90.3 Å²	90.3	61%	0.613	44%	0.437	S	S	*	.	H	α-helix	trans	-65	-39.2	174.4	-174.2	167.5	-175.6	167.1	0	112.1	Q833 L840 N841	Q833-K837 WeakPolarHBondContact O-CB 3.4Å; Q833-K837 PolarHBondContact O-N 3.36Å; K837-L840 PolarHBondContact O-N 2.9Å; K837-N841 WeakPolarHBondContact O-CB 3.32Å; K837-N841 PolarHBondContact O-N 2.71Å; K837-N841 PolarHBondContact O-OD1 2.74Å; K837-N841 VanDerWaalsContact O-OD1 3.11Å
838	Q	48.4	Very low	41.6	Very low	105 Å²	105	90 Å²	90	49%	0.491	43%	0.433	S	S	.	.	H	α-helix	trans	-66.4	-37.8	175.9	-169.1	170	9.2	0	0	111.9	T834 N835 Q842	T834-Q838 VanDerWaalsContact O-CB 3.31Å; T834-Q838 WeakPolarHBondContact O-CB 3.39Å; T834-Q838 PolarHBondContact O-N 3.27Å; N835-Q838 PolarHBondContact O-N 3.45Å; Q838-Q842 WeakPolarHBondContact O-CG 3.49Å; Q838-Q842 PolarHBondContact O-N 3.37Å; Q838-Q842 VanDerWaalsContact O-N 3.07Å
839	Y	40.2	Very low	42.2	Very low	146 Å²	146	92.7 Å²	92.7	57%	0.573	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-45.7	172.6	-178.3	-93.4	0	0	0	112.3	N835 F836 Q842 W843	N835-Y839 WeakPolarHBondContact O-CB 3.34Å; N835-Y839 PolarHBondContact O-N 2.78Å; F836-Y839 PolarHBondContact O-N 3.19Å; Y839-Q842 PolarHBondContact O-N 3.16Å; Y839-W843 WeakPolarHBondContact O-CB 3.47Å; Y839-W843 PolarHBondContact O-N 2.9Å
840	L	38.9	Very low	42.4	Very low	55 Å²	55	96 Å²	96	29%	0.288	46%	0.455	S	S	.	.	H	α-helix	trans	-60	-46.8	175.2	-77.3	178.3	0	0	0	111.9	F836 K837 Q842 W843 T844	F836-L840 HydrophobicContact CD1-CD1 3.95Å; F836-L840 HydrophobicContact CD1-CG 4.48Å; F836-L840 HydrophobicContact CE1-CD1 3.49Å; F836-L840 VanDerWaalsContact CE1-CD1 3.49Å; F836-L840 HydrophobicContact CE1-CG 4.14Å; F836-L840 HydrophobicContact CE2-CG 4.43Å; F836-L840 HydrophobicContact CZ-CD1 3.87Å; F836-L840 HydrophobicContact CZ-CD2 4.32Å; F836-L840 HydrophobicContact CZ-CG 4.11Å; F836-L840 WeakPolarHBondContact O-CG 3.26Å; F836-L840 PolarHBondContact O-N 3.35Å; K837-L840 PolarHBondContact O-N 2.9Å; L840-Q842 PolarHBondContact O-N 2.93Å; L840-W843 WeakPolarHBondContact O-CB 3.3Å; L840-W843 PolarHBondContact O-N 3.3Å; L840-W843 VanDerWaalsContact O-N 3.08Å; L840-T844 PolarHBondContact O-N 3.48Å; L840-T844 PolarHBondContact O-OG1 3.38Å
841	N	48.4	Very low	42.9	Very low	73 Å²	73	96 Å²	96	39%	0.39	45%	0.45	S	S	.	.	H	α-helix	trans	-58.2	-45	176.6	-82.2	40.9	0	0	0	111.9	K837 W843 T844 E845	K837-N841 WeakPolarHBondContact O-CB 3.32Å; K837-N841 PolarHBondContact O-N 2.71Å; K837-N841 PolarHBondContact O-OD1 2.74Å; K837-N841 VanDerWaalsContact O-OD1 3.11Å; N841-W843 VanDerWaalsContact C-N 3.27Å; N841-W843 PolarHBondContact O-N 3.05Å; N841-T844 WeakPolarHBondContact CA-OG1 3.33Å; N841-T844 PolarHBondContact O-N 3.45Å; N841-T844 PolarHBondContact O-OG1 2.89Å; N841-E845 WeakPolarHBondContact O-CB 3.46Å; N841-E845 VanDerWaalsContact O-CG 3.3Å; N841-E845 WeakPolarHBondContact O-CG 3.46Å; N841-E845 PolarHBondContact O-N 2.97Å
842	Q	46.7	Very low	43.4	Very low	74 Å²	74	92.7 Å²	92.7	35%	0.346	44%	0.444	S	S	.	.	H	α-helix	trans	-66.1	-28.7	176.3	-73.7	178.1	2.6	0	0	112.9	Q838 Y839 L840 K846	Q838-Q842 WeakPolarHBondContact O-CG 3.49Å; Q838-Q842 PolarHBondContact O-N 3.37Å; Q838-Q842 VanDerWaalsContact O-N 3.07Å; Y839-Q842 PolarHBondContact O-N 3.16Å; L840-Q842 PolarHBondContact O-N 2.93Å; Q842-K846 WeakPolarHBondContact O-CB 3.39Å; Q842-K846 VanDerWaalsContact O-CG 3.26Å; Q842-K846 WeakPolarHBondContact O-CG 3.32Å; Q842-K846 PolarHBondContact O-N 2.94Å; Q842-K846 VanDerWaalsContact O-N 3.13Å
843	W	45.3	Very low	43.6	Very low	102 Å²	102	92.1 Å²	92.1	39%	0.386	44%	0.443	S	S	.	.	H	α-helix	trans	-75.5	-39.9	174.9	-173.2	84	0	0	0	111.9	Y839 L840 N841 K846 N847	Y839-W843 WeakPolarHBondContact O-CB 3.47Å; Y839-W843 PolarHBondContact O-N 2.9Å; L840-W843 WeakPolarHBondContact O-CB 3.3Å; L840-W843 PolarHBondContact O-N 3.3Å; L840-W843 VanDerWaalsContact O-N 3.08Å; N841-W843 VanDerWaalsContact C-N 3.27Å; N841-W843 PolarHBondContact O-N 3.05Å; W843-K846 PolarHBondContact O-N 3.47Å; W843-N847 VanDerWaalsContact CE2-ND2 3.32Å; W843-N847 WeakPolarHBondContact CH2-ND2 3.39Å; W843-N847 WeakPolarHBondContact CZ2-ND2 3.48Å; W843-N847 VanDerWaalsContact CZ3-ND2 3.28Å; W843-N847 WeakPolarHBondContact CZ3-ND2 3.37Å; W843-N847 WeakPolarHBondContact O-CB 3.43Å; W843-N847 PolarHBondContact O-N 3Å
844	T	44.3	Very low	43.8	Very low	50 Å²	50	89.4 Å²	89.4	31%	0.307	44%	0.435	S	S	.	.	H	α-helix	trans	-67.2	-45.3	173	49.5	0	0	0	0	111.8	L840 N841 K846 N847 E848	L840-T844 PolarHBondContact O-N 3.48Å; L840-T844 PolarHBondContact O-OG1 3.38Å; N841-T844 WeakPolarHBondContact CA-OG1 3.33Å; N841-T844 PolarHBondContact O-N 3.45Å; N841-T844 PolarHBondContact O-OG1 2.89Å; T844-K846 VanDerWaalsContact C-N 3.3Å; T844-K846 PolarHBondContact O-N 3.43Å; T844-N847 PolarHBondContact O-N 2.93Å; T844-N847 VanDerWaalsContact O-N 3.11Å; T844-E848 WeakPolarHBondContact O-CB 3.49Å; T844-E848 WeakPolarHBondContact O-CG 3.44Å; T844-E848 PolarHBondContact O-N 3.34Å
845	E	50	Low	43.8	Very low	111 Å²	111	91.4 Å²	91.4	52%	0.519	44%	0.444	S	S	.	.	H	α-helix	trans	-57.5	-42.5	174.7	-74.7	169.8	-176.5	0	0	111.3	N841 E848 L849	N841-E845 WeakPolarHBondContact O-CB 3.46Å; N841-E845 VanDerWaalsContact O-CG 3.3Å; N841-E845 WeakPolarHBondContact O-CG 3.46Å; N841-E845 PolarHBondContact O-N 2.97Å; E845-E848 PolarHBondContact O-N 3.32Å; E845-L849 WeakPolarHBondContact O-CB 3.38Å; E845-L849 WeakPolarHBondContact O-CG 3.1Å; E845-L849 PolarHBondContact O-N 3.34Å
846	K	48.8	Very low	43.9	Very low	107 Å²	107	93.7 Å²	93.7	47%	0.465	46%	0.456	S	S	.	.	H	α-helix	trans	-66.5	-38.3	174.7	-79.9	176.8	177.5	176.8	0	113.3	Q842 W843 T844 F850	Q842-K846 WeakPolarHBondContact O-CB 3.39Å; Q842-K846 VanDerWaalsContact O-CG 3.26Å; Q842-K846 WeakPolarHBondContact O-CG 3.32Å; Q842-K846 PolarHBondContact O-N 2.94Å; Q842-K846 VanDerWaalsContact O-N 3.13Å; W843-K846 PolarHBondContact O-N 3.47Å; T844-K846 VanDerWaalsContact C-N 3.3Å; T844-K846 PolarHBondContact O-N 3.43Å; K846-F850 VanDerWaalsContact O-CB 3.24Å; K846-F850 WeakPolarHBondContact O-CB 3.5Å; K846-F850 PolarHBondContact O-N 3.34Å
847	N	43	Very low	44	Very low	55 Å²	55	92.6 Å²	92.6	29%	0.294	46%	0.455	S	S	.	.	H	α-helix	trans	-70.6	-37	175.7	-82.1	-16.3	0	0	0	112.3	W843 T844 F850 N851	W843-N847 VanDerWaalsContact CE2-ND2 3.32Å; W843-N847 WeakPolarHBondContact CH2-ND2 3.39Å; W843-N847 WeakPolarHBondContact CZ2-ND2 3.48Å; W843-N847 VanDerWaalsContact CZ3-ND2 3.28Å; W843-N847 WeakPolarHBondContact CZ3-ND2 3.37Å; W843-N847 WeakPolarHBondContact O-CB 3.43Å; W843-N847 PolarHBondContact O-N 3Å; T844-N847 PolarHBondContact O-N 2.93Å; T844-N847 VanDerWaalsContact O-N 3.11Å; N847-F850 PolarHBondContact O-N 3.49Å; N847-N851 VanDerWaalsContact O-CB 3.23Å; N847-N851 WeakPolarHBondContact O-CB 3.47Å; N847-N851 PolarHBondContact O-N 3.42Å; N847-N851 PolarHBondContact O-ND2 3.39Å
848	E	49.1	Very low	43.8	Very low	116 Å²	116	89.9 Å²	89.9	54%	0.542	45%	0.447	S	S	.	.	H	α-helix	trans	-67.6	-40.4	174.7	-73.5	179.5	171.3	0	0	111.3	T844 E845 S852	T844-E848 WeakPolarHBondContact O-CB 3.49Å; T844-E848 WeakPolarHBondContact O-CG 3.44Å; T844-E848 PolarHBondContact O-N 3.34Å; E845-E848 PolarHBondContact O-N 3.32Å; E848-S852 WeakPolarHBondContact O-CB 3.19Å; E848-S852 PolarHBondContact O-N 2.9Å; E848-S852 PolarHBondContact O-OG 3.48Å
849	L	47.9	Very low	43.4	Very low	109 Å²	109	87.4 Å²	87.4	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-62.5	-46.7	169.7	-76.2	167.1	0	0	0	112	E845 N851 S852 I853	E845-L849 WeakPolarHBondContact O-CB 3.38Å; E845-L849 WeakPolarHBondContact O-CG 3.1Å; E845-L849 PolarHBondContact O-N 3.34Å; L849-N851 PolarHBondContact O-N 3.14Å; L849-S852 PolarHBondContact O-N 3.3Å; L849-I853 WeakPolarHBondContact O-CB 3.49Å; L849-I853 VanDerWaalsContact O-CG1 3.26Å; L849-I853 WeakPolarHBondContact O-CG1 3.25Å; L849-I853 PolarHBondContact O-N 2.91Å
850	F	40.1	Very low	43.3	Very low	140 Å²	140	89.3 Å²	89.3	61%	0.614	45%	0.447	S	S	*	.	H	α-helix	trans	-61	-44.8	177.8	-178.1	-95.5	0	0	0	111.9	K846 N847 I853 S854	K846-F850 VanDerWaalsContact O-CB 3.24Å; K846-F850 WeakPolarHBondContact O-CB 3.5Å; K846-F850 PolarHBondContact O-N 3.34Å; N847-F850 PolarHBondContact O-N 3.49Å; F850-I853 PolarHBondContact O-N 3.12Å; F850-S854 WeakPolarHBondContact O-CB 3.46Å; F850-S854 PolarHBondContact O-N 2.94Å
851	N	40.2	Very low	43.3	Very low	65 Å²	65	91 Å²	91	35%	0.348	46%	0.456	S	S	.	.	H	α-helix	trans	-66.3	-37.9	175.7	-71.9	-24.2	0	0	0	111.7	N847 L849 N855	N847-N851 VanDerWaalsContact O-CB 3.23Å; N847-N851 WeakPolarHBondContact O-CB 3.47Å; N847-N851 PolarHBondContact O-N 3.42Å; N847-N851 PolarHBondContact O-ND2 3.39Å; L849-N851 PolarHBondContact O-N 3.14Å; N851-N855 WeakPolarHBondContact O-CB 3.45Å; N851-N855 PolarHBondContact O-N 2.81Å; N851-N855 PolarHBondContact O-ND2 3.08Å
852	S	44.5	Very low	42.6	Very low	63 Å²	63	93 Å²	93	44%	0.441	47%	0.466	S	S	.	.	H	α-helix	trans	-67.2	-41	176.2	-61.4	0	0	0	0	112.2	E848 L849 N856	E848-S852 WeakPolarHBondContact O-CB 3.19Å; E848-S852 PolarHBondContact O-N 2.9Å; E848-S852 PolarHBondContact O-OG 3.48Å; L849-S852 PolarHBondContact O-N 3.3Å; S852-N856 VanDerWaalsContact O-CB 3.25Å; S852-N856 WeakPolarHBondContact O-CB 3.44Å; S852-N856 PolarHBondContact O-N 3.27Å; S852-N856 PolarHBondContact O-ND2 3.29Å
853	I	43.5	Very low	42	Very low	100 Å²	100	92.8 Å²	92.8	51%	0.513	47%	0.472	S	S	.	.	H	α-helix	trans	-67.9	-44.9	175.2	-68.3	164.3	0	0	0	110.4	L849 F850 N856 N857	L849-I853 WeakPolarHBondContact O-CB 3.49Å; L849-I853 VanDerWaalsContact O-CG1 3.26Å; L849-I853 WeakPolarHBondContact O-CG1 3.25Å; L849-I853 PolarHBondContact O-N 2.91Å; F850-I853 PolarHBondContact O-N 3.12Å; I853-N856 PolarHBondContact O-N 3.31Å; I853-N857 WeakPolarHBondContact O-CB 3.47Å; I853-N857 VanDerWaalsContact O-CG 3.29Å; I853-N857 PolarHBondContact O-N 3.23Å; I853-N857 PolarHBondContact O-ND2 2.7Å
854	S	38.4	Very low	41.8	Very low	44 Å²	44	92 Å²	92	31%	0.308	48%	0.479	S	S	.	.	H	α-helix	trans	-59.7	-47.9	175.8	-174.6	0	0	0	0	111.6	F850 N857 N858	F850-S854 WeakPolarHBondContact O-CB 3.46Å; F850-S854 PolarHBondContact O-N 2.94Å; S854-N857 PolarHBondContact O-N 2.99Å; S854-N858 WeakPolarHBondContact O-CB 3.32Å; S854-N858 VanDerWaalsContact O-CG 3.25Å; S854-N858 PolarHBondContact O-N 3.11Å; S854-N858 PolarHBondContact O-ND2 3.22Å; S854-N858 VanDerWaalsContact O-ND2 3.16Å
855	N	40.1	Very low	41.5	Very low	106 Å²	106	94 Å²	94	57%	0.567	49%	0.485	S	S	*	.	H	α-helix	trans	-68.5	-36.5	178.6	-71.9	-25.1	0	0	0	112.8	N851 S859	N851-N855 WeakPolarHBondContact O-CB 3.45Å; N851-N855 PolarHBondContact O-N 2.81Å; N851-N855 PolarHBondContact O-ND2 3.08Å; N855-S859 WeakPolarHBondContact O-CB 3.25Å; N855-S859 PolarHBondContact O-N 3.5Å; N855-S859 PolarHBondContact O-OG 3.24Å
856	N	42	Very low	41.1	Very low	101 Å²	101	92.8 Å²	92.8	54%	0.54	49%	0.485	S	S	.	.	H	α-helix	trans	-71.4	-33.2	174.7	-85.6	-36.9	0	0	0	113.3	S852 I853 S859 R860	S852-N856 VanDerWaalsContact O-CB 3.25Å; S852-N856 WeakPolarHBondContact O-CB 3.44Å; S852-N856 PolarHBondContact O-N 3.27Å; S852-N856 PolarHBondContact O-ND2 3.29Å; I853-N856 PolarHBondContact O-N 3.31Å; N856-S859 WeakPolarHBondContact CA-OG 3.31Å; N856-S859 PolarHBondContact O-OG 2.73Å; N856-R860 VanDerWaalsContact O-CB 3.27Å; N856-R860 WeakPolarHBondContact O-CB 3.2Å; N856-R860 WeakPolarHBondContact O-CG 3.33Å; N856-R860 PolarHBondContact O-N 3.08Å
857	N	41.5	Very low	40.6	Very low	82 Å²	82	92.6 Å²	92.6	44%	0.439	49%	0.489	S	S	.	.	H	α-helix	trans	-72.6	-44.9	174.3	-73.4	-20.3	0	0	0	110.9	I853 S854 S859 R860 I861	I853-N857 WeakPolarHBondContact O-CB 3.47Å; I853-N857 VanDerWaalsContact O-CG 3.29Å; I853-N857 PolarHBondContact O-N 3.23Å; I853-N857 PolarHBondContact O-ND2 2.7Å; S854-N857 PolarHBondContact O-N 2.99Å; N857-S859 PolarHBondContact O-N 3.14Å; N857-R860 PolarHBondContact O-N 2.7Å; N857-I861 WeakPolarHBondContact O-CB 3.4Å; N857-I861 WeakPolarHBondContact O-CD1 3.48Å; N857-I861 WeakPolarHBondContact O-CG1 3.19Å; N857-I861 PolarHBondContact O-N 3.08Å
858	N	38.7	Very low	40.6	Very low	84 Å²	84	93.4 Å²	93.4	45%	0.449	50%	0.499	S	S	.	.	H	α-helix	trans	-62.7	-40.9	174.5	-70.5	-30	0	0	0	111.8	S854 L862	S854-N858 WeakPolarHBondContact O-CB 3.32Å; S854-N858 VanDerWaalsContact O-CG 3.25Å; S854-N858 PolarHBondContact O-N 3.11Å; S854-N858 PolarHBondContact O-ND2 3.22Å; S854-N858 VanDerWaalsContact O-ND2 3.16Å; N858-L862 VanDerWaalsContact O-CB 3.32Å; N858-L862 WeakPolarHBondContact O-CB 3.36Å; N858-L862 VanDerWaalsContact O-CG 3.26Å; N858-L862 WeakPolarHBondContact O-CG 3.4Å; N858-L862 PolarHBondContact O-N 3.45Å
859	S	38.8	Very low	40.3	Very low	53 Å²	53	93.3 Å²	93.3	37%	0.371	50%	0.497	S	S	.	.	H	α-helix	trans	-68.8	-39.2	177	77	0	0	0	0	112.5	N855 N856 N857 S863	N855-S859 WeakPolarHBondContact O-CB 3.25Å; N855-S859 PolarHBondContact O-N 3.5Å; N855-S859 PolarHBondContact O-OG 3.24Å; N856-S859 WeakPolarHBondContact CA-OG 3.31Å; N856-S859 PolarHBondContact O-OG 2.73Å; N857-S859 PolarHBondContact O-N 3.14Å; S859-S863 WeakPolarHBondContact O-CB 3.36Å; S859-S863 PolarHBondContact O-N 2.97Å; S859-S863 PolarHBondContact O-OG 2.84Å
860	R	38.8	Very low	39.9	Very low	185 Å²	185	92.7 Å²	92.7	70%	0.698	49%	0.494	S	S	*	.	H	α-helix	trans	-66.5	-46.5	173.2	-84.5	-176.4	165.6	169.7	-1.9	112.4	N856 N857 S863 T864	N856-R860 VanDerWaalsContact O-CB 3.27Å; N856-R860 WeakPolarHBondContact O-CB 3.2Å; N856-R860 WeakPolarHBondContact O-CG 3.33Å; N856-R860 PolarHBondContact O-N 3.08Å; N857-R860 PolarHBondContact O-N 2.7Å; R860-S863 PolarHBondContact O-N 3.47Å; R860-T864 WeakPolarHBondContact O-CB 3.36Å; R860-T864 WeakPolarHBondContact O-CG2 3.45Å; R860-T864 PolarHBondContact O-N 3.24Å; R860-T864 PolarHBondContact O-OG1 3.07Å
861	I	38.2	Very low	40	Very low	92 Å²	92	90.5 Å²	90.5	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-52.5	-179.6	-69.1	165	0	0	0	109.7	N857 S863 T864 E865	N857-I861 WeakPolarHBondContact O-CB 3.4Å; N857-I861 WeakPolarHBondContact O-CD1 3.48Å; N857-I861 WeakPolarHBondContact O-CG1 3.19Å; N857-I861 PolarHBondContact O-N 3.08Å; I861-S863 VanDerWaalsContact C-N 3.33Å; I861-S863 PolarHBondContact O-N 2.85Å; I861-T864 PolarHBondContact O-N 3.03Å; I861-T864 PolarHBondContact O-OG1 2.83Å; I861-E865 WeakPolarHBondContact O-CB 3.42Å; I861-E865 PolarHBondContact O-N 3.38Å
862	L	34.6	Very low	40	Very low	115 Å²	115	93.5 Å²	93.5	60%	0.602	50%	0.5	S	S	*	.	H	α-helix	trans	-60.9	-39.2	176.9	-66.9	171.3	0	0	0	112.4	N858 V866	N858-L862 VanDerWaalsContact O-CB 3.32Å; N858-L862 WeakPolarHBondContact O-CB 3.36Å; N858-L862 VanDerWaalsContact O-CG 3.26Å; N858-L862 WeakPolarHBondContact O-CG 3.4Å; N858-L862 PolarHBondContact O-N 3.45Å; L862-V866 VanDerWaalsContact O-CB 3.25Å; L862-V866 WeakPolarHBondContact O-CB 3.33Å; L862-V866 WeakPolarHBondContact O-CG2 3.27Å; L862-V866 PolarHBondContact O-N 2.97Å
863	S	34.4	Very low	39.7	Very low	68 Å²	68	95.9 Å²	95.9	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-69.9	-34.8	177.7	-62.5	0	0	0	0	113.4	S859 R860 I861 N867	S859-S863 WeakPolarHBondContact O-CB 3.36Å; S859-S863 PolarHBondContact O-N 2.97Å; S859-S863 PolarHBondContact O-OG 2.84Å; R860-S863 PolarHBondContact O-N 3.47Å; I861-S863 VanDerWaalsContact C-N 3.33Å; I861-S863 PolarHBondContact O-N 2.85Å; S863-N867 WeakPolarHBondContact O-CB 3.35Å; S863-N867 PolarHBondContact O-N 3.48Å; S863-N867 PolarHBondContact O-ND2 3.4Å
864	T	40.7	Very low	39.4	Very low	87 Å²	87	94.7 Å²	94.7	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-76.2	-41.1	177	53.3	0	0	0	0	111.5	R860 I861 N867 S868	R860-T864 WeakPolarHBondContact O-CB 3.36Å; R860-T864 WeakPolarHBondContact O-CG2 3.45Å; R860-T864 PolarHBondContact O-N 3.24Å; R860-T864 PolarHBondContact O-OG1 3.07Å; I861-T864 PolarHBondContact O-N 3.03Å; I861-T864 PolarHBondContact O-OG1 2.83Å; T864-N867 PolarHBondContact O-N 3.26Å; T864-S868 WeakPolarHBondContact O-CB 3.5Å; T864-S868 PolarHBondContact O-N 3.38Å; T864-S868 PolarHBondContact O-OG 3.01Å
865	E	38.3	Very low	39.6	Very low	91 Å²	91	99.9 Å²	99.9	43%	0.425	52%	0.524	S	S	.	.	H	α-helix	trans	-73.3	-38.7	-177.1	-157.8	179.3	145.4	0	0	112.6	I861 N867 S868 K869	I861-E865 WeakPolarHBondContact O-CB 3.42Å; I861-E865 PolarHBondContact O-N 3.38Å; E865-N867 VanDerWaalsContact C-N 3.31Å; E865-N867 PolarHBondContact O-N 3.19Å; E865-S868 PolarHBondContact O-N 3.41Å; E865-K869 HydrophobicContact CG-CD 4.25Å; E865-K869 PolarHBondContact O-N 3.39Å; E865-K869 WeakPolarHBondContact OE1-CE 3.26Å; E865-K869 IonicContact OE1-NZ 3.84Å; E865-K869 PolarHBondContact OE1-NZ 3.46Å
866	V	40.9	Very low	39.6	Very low	86 Å²	86	100.9 Å²	100.9	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-34.7	173	171.5	0	0	0	0	111.5	L862 N870	L862-V866 VanDerWaalsContact O-CB 3.25Å; L862-V866 WeakPolarHBondContact O-CB 3.33Å; L862-V866 WeakPolarHBondContact O-CG2 3.27Å; L862-V866 PolarHBondContact O-N 2.97Å; V866-N870 WeakPolarHBondContact O-CB 3.45Å; V866-N870 PolarHBondContact O-N 2.95Å; V866-N870 PolarHBondContact O-ND2 2.97Å
867	N	39.1	Very low	39.5	Very low	102 Å²	102	105.1 Å²	105.1	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-72.8	-43.3	174	-80.3	-58.6	0	0	0	112	S863 T864 E865 K869 N870 I871	S863-N867 WeakPolarHBondContact O-CB 3.35Å; S863-N867 PolarHBondContact O-N 3.48Å; S863-N867 PolarHBondContact O-ND2 3.4Å; T864-N867 PolarHBondContact O-N 3.26Å; E865-N867 VanDerWaalsContact C-N 3.31Å; E865-N867 PolarHBondContact O-N 3.19Å; N867-K869 PolarHBondContact O-N 3.47Å; N867-N870 PolarHBondContact O-N 3.01Å; N867-I871 WeakPolarHBondContact O-CG1 3.33Å; N867-I871 PolarHBondContact O-N 3.2Å; N867-I871 VanDerWaalsContact O-N 3.08Å
868	S	42.9	Very low	39.3	Very low	72 Å²	72	109.2 Å²	109.2	50%	0.503	56%	0.559	S	S	.	*	H	α-helix	trans	-58	-50.2	177.2	-66.2	0	0	0	0	112.4	T864 E865 N870 I871 E872	T864-S868 WeakPolarHBondContact O-CB 3.5Å; T864-S868 PolarHBondContact O-N 3.38Å; T864-S868 PolarHBondContact O-OG 3.01Å; E865-S868 PolarHBondContact O-N 3.41Å; S868-N870 VanDerWaalsContact C-N 3.29Å; S868-N870 PolarHBondContact O-N 3.45Å; S868-I871 PolarHBondContact O-N 3.22Å; S868-E872 PolarHBondContact O-N 2.89Å
869	K	41.8	Very low	39	Very low	115 Å²	115	114.7 Å²	114.7	50%	0.5	58%	0.579	S	S	.	*	H	α-helix	trans	-66.1	-28.2	-179.8	-72.1	174	172.6	171.9	0	113.2	E865 N867 L873	E865-K869 HydrophobicContact CG-CD 4.25Å; E865-K869 PolarHBondContact O-N 3.39Å; E865-K869 WeakPolarHBondContact OE1-CE 3.26Å; E865-K869 IonicContact OE1-NZ 3.84Å; E865-K869 PolarHBondContact OE1-NZ 3.46Å; N867-K869 PolarHBondContact O-N 3.47Å; K869-L873 WeakPolarHBondContact O-CB 3.46Å; K869-L873 WeakPolarHBondContact O-CG 3.5Å; K869-L873 PolarHBondContact O-N 3.38Å
870	N	39.6	Very low	38.7	Very low	96 Å²	96	116.3 Å²	116.3	51%	0.513	60%	0.604	S	S	.	*	H	α-helix	trans	-75	-26	171.4	-84.4	-76.8	0	0	0	113.7	V866 N867 S868 S874	V866-N870 WeakPolarHBondContact O-CB 3.45Å; V866-N870 PolarHBondContact O-N 2.95Å; V866-N870 PolarHBondContact O-ND2 2.97Å; N867-N870 PolarHBondContact O-N 3.01Å; S868-N870 VanDerWaalsContact C-N 3.29Å; S868-N870 PolarHBondContact O-N 3.45Å; N870-S874 WeakPolarHBondContact O-CB 3.48Å; N870-S874 PolarHBondContact O-N 3.22Å; N870-S874 PolarHBondContact O-OG 3.22Å
871	I	43.1	Very low	38.3	Very low	94 Å²	94	115.4 Å²	115.4	48%	0.482	61%	0.613	S	S	.	*	H	α-helix	trans	-77.4	-23.3	176.9	-70.9	166.6	0	0	0	112	N867 S868 S874 K875	N867-I871 WeakPolarHBondContact O-CG1 3.33Å; N867-I871 PolarHBondContact O-N 3.2Å; N867-I871 VanDerWaalsContact O-N 3.08Å; S868-I871 PolarHBondContact O-N 3.22Å; I871-S874 WeakPolarHBondContact CA-OG 3.36Å; I871-S874 PolarHBondContact O-OG 3.19Å; I871-K875 WeakPolarHBondContact O-CD 3.25Å; I871-K875 WeakPolarHBondContact O-CG 3.4Å
872	E	40.6	Very low	37.9	Very low	127 Å²	127	115.4 Å²	115.4	59%	0.593	62%	0.621	S	S	*	*	H	α-helix	trans	-82.2	-47.1	169.8	-65.5	-170.6	123.3	0	0	112.1	S868 S874 K875 I876	S868-E872 PolarHBondContact O-N 2.89Å; E872-S874 PolarHBondContact O-N 3.06Å; E872-S874 VanDerWaalsContact O-N 3.11Å; E872-K875 PolarHBondContact O-N 3.18Å; E872-I876 PolarHBondContact O-N 3.16Å
873	L	36.6	Very low	37.9	Very low	114 Å²	114	116.4 Å²	116.4	60%	0.597	63%	0.627	S	S	*	*	H	α-helix	trans	-61	-22.1	178.7	-78.6	167.4	0	0	0	114.1	K869	K869-L873 WeakPolarHBondContact O-CB 3.46Å; K869-L873 WeakPolarHBondContact O-CG 3.5Å; K869-L873 PolarHBondContact O-N 3.38Å
874	S	39.1	Very low	38	Very low	75 Å²	75	119.6 Å²	119.6	52%	0.524	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-19.2	173.6	47.2	0	0	0	0	114.2	N870 I871 E872	N870-S874 WeakPolarHBondContact O-CB 3.48Å; N870-S874 PolarHBondContact O-N 3.22Å; N870-S874 PolarHBondContact O-OG 3.22Å; I871-S874 WeakPolarHBondContact CA-OG 3.36Å; I871-S874 PolarHBondContact O-OG 3.19Å; E872-S874 PolarHBondContact O-N 3.06Å; E872-S874 VanDerWaalsContact O-N 3.11Å
875	K	42.7	Very low	37.9	Very low	152 Å²	152	122.5 Å²	122.5	66%	0.661	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-24.5	175.1	-69.3	173.3	-175.5	174.7	0	113.2	I871 E872	I871-K875 WeakPolarHBondContact O-CD 3.25Å; I871-K875 WeakPolarHBondContact O-CG 3.4Å; E872-K875 PolarHBondContact O-N 3.18Å
876	I	40.1	Very low	38.2	Very low	128 Å²	128	122.7 Å²	122.7	66%	0.656	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-82.9	-10.8	-176.6	-65.8	169	0	0	0	112.6	E872	E872-I876 PolarHBondContact O-N 3.16Å
877	K	38.3	Very low	38.2	Very low	189 Å²	189	125.5 Å²	125.5	82%	0.822	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-97.4	22.9	-178.4	-82.1	-171.6	171.2	-177.1	0	116.2
878	Q	38.7	Very low	38.3	Very low	169 Å²	169	127.7 Å²	127.7	79%	0.79	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-117.8	2.9	176	-73.2	-167.4	-14	0	0	115.6
879	F	31.5	Very low	38.4	Very low	199 Å²	199	129.7 Å²	129.7	87%	0.873	69%	0.693	S	S	*	*			trans	-128.1	114.9	173.4	-78.7	-92.6	0	0	0	110.3
880	G	33.3	Very low	38.3	Very low	87 Å²	87	130.7 Å²	130.7	90%	0.897	70%	0.704	S	S	*	*			trans	156.5	53.1	-177	0	0	0	0	0	113.7
881	N	28.9	Very low	38.2	Very low	165 Å²	165	132.3 Å²	132.3	88%	0.882	71%	0.713	S	S	*	*			trans	-121	101	-175	-176.2	38	0	0	0	111.4
882	S	30.8	Very low	38.1	Very low	93 Å²	93	132.2 Å²	132.2	65%	0.65	72%	0.72	S	S	*	*			trans	-170.2	136.9	161.5	65.2	0	0	0	0	114
883	N	33.9	Very low	38	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	72%	0.721	S	S	*	*			trans	85.1	118.9	142.3	-60.8	-4.9	0	0	0	121.8
884	N	36.5	Very low	38.1	Very low	135 Å²	135	136 Å²	136	72%	0.722	73%	0.728	S	S	*	*			trans	75.1	139.4	140.8	-53.5	9.8	0	0	0	118.8
885	D	40	Very low	38	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	73%	0.734	S	S	*	*			cis	-160	-177.2	-21.8	-117.8	-13.6	0	0	0	108.7
886	P	44.6	Very low	37.8	Very low	95 Å²	95	135.1 Å²	135.1	62%	0.617	74%	0.736	S	S	*	*			trans	-104.1	175.6	-153	40.8	-37.4	0	0	0	116.4
887	D	39.7	Very low	37.6	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	74%	0.74	S	S	*	*				175.9	162.2	115	-88.3	-27.9	0	0	0	113.7
888	D	41.2	Very low	37.5	Very low	148 Å²	148	130.7 Å²	130.7	79%	0.791	74%	0.736	S	S	*	*			trans	62.2	144.2	160.7	-72.3	-14.6	0	0	0	123.2
889	V	44.7	Very low	38	Very low	115 Å²	115	128.3 Å²	128.3	70%	0.697	74%	0.735	S	S	*	*			cis	-162.1	144.5	-29.9	96.4	0	0	0	0	112.7
890	D	40.6	Very low	38.3	Very low	135 Å²	135	124.8 Å²	124.8	72%	0.722	74%	0.735	S	S	*	*			trans	59.2	150.9	154.7	-80.3	-11.3	0	0	0	128.2
891	N	37.7	Very low	38.5	Very low	131 Å²	131	124.5 Å²	124.5	70%	0.701	72%	0.724	S	S	*	*			trans	72.9	108.7	157.4	-71.6	-53.2	0	0	0	119.5
892	S	40.1	Very low	39	Very low	91 Å²	91	124 Å²	124	64%	0.636	72%	0.721	S	S	*	*			cis	89.2	155.4	49.8	86.2	0	0	0	0	113.3
893	H	39.1	Very low	39.5	Very low	131 Å²	131	126.2 Å²	126.2	61%	0.606	72%	0.721	S	S	*	*			cis	-161.3	167.7	15.4	-148.8	-74.7	0	0	0	111.6
894	Y	38.8	Very low	39.7	Very low	189 Å²	189	128.3 Å²	128.3	74%	0.741	73%	0.726	S	S	*	*			trans	72.5	146.3	164	-63.5	-68.7	0	0	0	120.6
895	T	37.3	Very low	39.7	Very low	107 Å²	107	126.5 Å²	126.5	66%	0.656	72%	0.724	S	S	*	*			cis	-171.5	142.2	-36.9	18.2	0	0	0	0	111.9
896	S	37.1	Very low	39.4	Very low	102 Å²	102	125.1 Å²	125.1	71%	0.713	72%	0.721	S	S	*	*			trans	50.7	175.6	144.2	78.5	0	0	0	0	119.8
897	T	37	Very low	38.9	Very low	119 Å²	119	126.8 Å²	126.8	73%	0.73	73%	0.729	S	S	*	*			cis	-166.8	157.4	2.5	1.5	0	0	0	0	106.4
898	S	35.4	Very low	38.8	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	72%	0.723	S	S	*	*			cis	-164.4	165.7	-11.5	-118	0	0	0	0	109.9
899	P	50.1	Low	38.6	Very low	118 Å²	118	122.5 Å²	122.5	77%	0.766	72%	0.723	S	S	*	*			trans	-105.5	169.9	-170.5	40.5	-36.2	0	0	0	115.9
900	S	38	Very low	38.1	Very low	126 Å²	126	121.5 Å²	121.5	88%	0.881	72%	0.721	S	S	*	*			trans	178.3	165.7	158.9	-84.6	0	0	0	0	111.4
901	A	37.9	Very low	38	Very low	80 Å²	80	121.6 Å²	121.6	66%	0.661	73%	0.726	S	S	*	*			cis	-177.1	-176.8	-28.1	0	0	0	0	0	109.3
902	L	39.1	Very low	38	Very low	155 Å²	155	120.3 Å²	120.3	81%	0.812	73%	0.727	S	S	*	*			trans	88	151.6	167.2	-54.2	165.3	0	0	0	119.2
903	Q	40.2	Very low	37.9	Very low	140 Å²	140	121.3 Å²	121.3	65%	0.654	73%	0.734	S	S	*	*				-174.3	135	-54.4	-112.2	-177.4	0.5	0	0	112.8
904	H	37.8	Very low	38.4	Very low	178 Å²	178	119.2 Å²	119.2	82%	0.824	73%	0.732	S	S	*	*			trans	59.3	170.4	157.4	-46.3	-53.3	0	0	0	117.7
905	S	36.8	Very low	38.6	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	73%	0.734	S	S	*	*			cis	-153.4	144.5	11.9	-47.2	0	0	0	0	114.3
906	T	34.5	Very low	38.7	Very low	119 Å²	119	119 Å²	119	73%	0.73	74%	0.739	S	S	*	*			trans	48.1	135.3	135.6	59.6	0	0	0	0	125.5
907	T	34.9	Very low	38.7	Very low	129 Å²	129	119.6 Å²	119.6	79%	0.791	74%	0.739	S	S	*	*			trans	65.4	153.4	139.9	52.1	0	0	0	0	120.8
908	S	35.9	Very low	38.7	Very low	93 Å²	93	118.8 Å²	118.8	65%	0.65	73%	0.733	S	S	*	*			cis	-174.3	162.2	-18.3	52.4	0	0	0	0	110.9
909	S	37.6	Very low	38.9	Very low	111 Å²	111	121.3 Å²	121.3	78%	0.776	73%	0.733	S	S	*	*			trans	61	162.3	158.7	51.9	0	0	0	0	119.5
910	S	35.3	Very low	38.1	Very low	94 Å²	94	123.5 Å²	123.5	66%	0.657	74%	0.738	S	S	*	*			cis	-171.6	162.3	-32.7	58.3	0	0	0	0	110.2
911	T	37.7	Very low	38	Very low	137 Å²	137	127.3 Å²	127.3	84%	0.84	73%	0.734	S	S	*	*			trans	65.8	155	170.4	70.2	0	0	0	0	116.7
912	S	38	Very low	38	Very low	103 Å²	103	131 Å²	131	72%	0.72	74%	0.737	S	S	*	*			cis	-153.1	134	-5.7	42.9	0	0	0	0	108.5
913	S	37.9	Very low	37.9	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	74%	0.735	S	S	*	*				71.2	154	87.2	-132.1	0	0	0	0	115.3
914	P	49.6	Very low	37.6	Very low	87 Å²	87	130.4 Å²	130.4	57%	0.565	73%	0.734	S	S	*	*			cis	-139.8	-173.8	-20.1	21.6	5.2	0	0	0	115.7
915	H	42.4	Very low	37.4	Very low	169 Å²	169	128.7 Å²	128.7	78%	0.782	73%	0.726	S	S	*	*			trans	72.7	148.1	160.1	-53.8	-53.8	0	0	0	117.6
916	T	39.3	Very low	37.2	Very low	122 Å²	122	131.7 Å²	131.7	75%	0.748	73%	0.729	S	S	*	*			cis	-169.1	168.2	-7.1	21	0	0	0	0	107.5
917	T	36.5	Very low	37.1	Very low	116 Å²	116	132 Å²	132	71%	0.712	74%	0.736	S	S	*	*			cis	-156.6	166.4	4.6	-121.6	0	0	0	0	113
918	T	36.9	Very low	36.9	Very low	101 Å²	101	131 Å²	131	62%	0.62	73%	0.734	S	S	*	*			trans	-38.7	158.3	161.5	4.4	0	0	0	0	116.9
919	H	40.2	Very low	37	Very low	160 Å²	160	131.4 Å²	131.4	74%	0.741	74%	0.735	S	S	*	*			cis	-149.8	160.5	44	-96	-79.7	0	0	0	116.5
920	L	32.7	Very low	36.8	Very low	163 Å²	163	133.5 Å²	133.5	85%	0.853	74%	0.737	S	S	*	*			trans	-129	144.9	167.7	-84.1	166.2	0	0	0	110.5
921	Y	37.4	Very low	37	Very low	206 Å²	206	136.2 Å²	136.2	81%	0.808	75%	0.745	S	S	*	*			trans	-162.6	130.4	158.3	-94.2	-82.4	0	0	0	105.8
922	H	36.6	Very low	36.7	Very low	158 Å²	158	136.3 Å²	136.3	73%	0.731	74%	0.739	S	S	*	*			cis	93.9	154.1	21.4	-152.6	29.5	0	0	0	114.2
923	I	37.5	Very low	36.5	Very low	150 Å²	150	139 Å²	139	77%	0.769	74%	0.742	S	S	*	*			trans	73.5	122.3	-158.2	-48.7	161.8	0	0	0	111.6
924	E	33.2	Very low	36.4	Very low	133 Å²	133	140.7 Å²	140.7	62%	0.621	74%	0.743	S	S	*	*			cis	94.2	121.8	2.5	-130.4	-160.3	127.4	0	0	119.8
925	Q	34.2	Very low	35.9	Very low	141 Å²	141	145.5 Å²	145.5	66%	0.659	76%	0.755	S	S	*	*			trans	80.4	137.5	155.6	-84.5	-172.6	58.9	0	0	124.6
926	Q	32.2	Very low	35.4	Very low	161 Å²	161	144.2 Å²	144.2	75%	0.752	75%	0.753	S	S	*	*			trans	89.1	142.7	148	-72	169.4	46.2	0	0	123.4
927	S	33.1	Very low	34.9	Very low	125 Å²	125	145.4 Å²	145.4	87%	0.874	76%	0.755	S	S	*	*			trans	66.3	148.1	172.8	70.5	0	0	0	0	118.1
928	S	31.8	Very low	34.8	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	76%	0.758	S	S	*	*			cis	-163.3	152.6	-23.4	-177.6	0	0	0	0	108.4
929	P	37	Very low	34.7	Very low	103 Å²	103	148 Å²	148	67%	0.669	76%	0.761	S	S	*	*			trans	-79.5	-179.5	166	35.1	-36.9	0	0	0	113
930	D	33.5	Very low	34.2	Very low	154 Å²	154	148.3 Å²	148.3	82%	0.824	77%	0.767	S	S	*	*			trans	76.6	99.1	169.9	-60.1	-25.5	0	0	0	119
931	D	38.5	Very low	34.2	Very low	152 Å²	152	146.9 Å²	146.9	81%	0.813	76%	0.76	S	S	*	*			trans	-144.7	82.3	148.7	-142.7	-4.7	0	0	0	111.7
932	L	33.4	Very low	34.1	Very low	139 Å²	139	143.6 Å²	143.6	73%	0.728	76%	0.756	S	S	*	*				44.7	103.5	126.8	-63.8	168.1	0	0	0	121.3
933	M	33	Very low	34.1	Very low	158 Å²	158	144.3 Å²	144.3	78%	0.778	76%	0.76	S	S	*	*				36.5	104.1	121.3	-80.6	-76.4	-76.8	0	0	118.5
934	N	36.3	Very low	33.6	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	76%	0.76	S	S	*	*			trans	-150.6	132.5	153.8	-107	-72.8	0	0	0	111.9
935	K	37.7	Very low	33.6	Very low	187 Å²	187	143.6 Å²	143.6	81%	0.813	77%	0.769	S	S	*	*			trans	62.1	81.5	172.7	-57.6	177.4	-176.6	178.3	0	113.9
936	L	31.5	Very low	33.6	Very low	143 Å²	143	142 Å²	142	75%	0.749	77%	0.77	S	S	*	*				53.3	118.7	64	-70.6	166.9	0	0	0	115
937	N	28.9	Very low	33.7	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	77%	0.771	S	S	*	*			trans	15.6	122.4	150.1	-59.3	-2.9	0	0	0	119.6
938	D	36.3	Very low	33.6	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	77%	0.769	S	S	*	*			trans	-139.1	115.6	134.8	-101	-46.5	0	0	0	109.6
939	N	33.5	Very low	33.6	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	77%	0.77	S	S	*	*			trans	34	123.9	150.7	-35	-61.7	0	0	0	118.6
940	L	30.9	Very low	33.4	Very low	165 Å²	165	146.2 Å²	146.2	86%	0.864	77%	0.774	S	S	*	*			cis	51.3	58.8	17.6	-103.7	178.7	0	0	0	114.6
941	N	32.1	Very low	33.2	Very low	134 Å²	134	150 Å²	150	72%	0.717	79%	0.794	S	S	*	*			trans	175	117.5	142.7	-92.4	-31	0	0	0	111.7
942	N	35.5	Very low	33	Very low	137 Å²	137	149.9 Å²	149.9	73%	0.733	79%	0.793	S	S	*	*				168.1	129.8	113.7	-87.4	-29.3	0	0	0	115
943	H	35.4	Very low	32.9	Very low	173 Å²	173	150.5 Å²	150.5	80%	0.801	80%	0.797	S	S	*	*			trans	53.3	113.5	145.7	-70.3	-72.5	0	0	0	122.9
944	N	28.1	Very low	32.9	Very low	145 Å²	145	150.1 Å²	150.1	78%	0.775	80%	0.798	S	S	*	*			trans	-53.7	163.3	145.2	-64.2	-17.9	0	0	0	111.9
945	P	33.4	Very low	32.7	Very low	123 Å²	123	150.1 Å²	150.1	80%	0.799	80%	0.798	S	S	*	*				-126.9	141.5	111.5	35.7	-32	0	0	0	114
946	P	33.1	Very low	32.4	Very low	106 Å²	106	147.8 Å²	147.8	69%	0.688	80%	0.797	S	S	*	*			trans	-87.3	-160	163.2	39.2	-35.3	0	0	0	110.9
947	I	34.2	Very low	32.5	Very low	152 Å²	152	148.1 Å²	148.1	78%	0.779	80%	0.8	S	S	*	*			trans	98.4	103.8	-174.3	-58.8	159.3	0	0	0	109.7
948	Q	31.8	Very low	32.7	Very low	175 Å²	175	148.3 Å²	148.3	82%	0.818	80%	0.802	S	S	*	*			cis	67.4	122	46.9	-70.4	-165.5	-23.4	0	0	116
949	S	31.8	Very low	32.5	Very low	113 Å²	113	148.4 Å²	148.4	79%	0.79	80%	0.803	S	S	*	*			trans	63.5	142.7	176.8	73	0	0	0	0	114.3
950	I	32.3	Very low	32.4	Very low	146 Å²	146	150.3 Å²	150.3	75%	0.749	81%	0.814	S	S	*	*			cis	-142.6	156.8	32	-72.9	168	0	0	0	110
951	N	30.1	Very low	32.5	Very low	234 Å²	234	148.9 Å²	148.9	100%	1.251	81%	0.809	S	S	*	*			trans	75.1	0	-174.1	-61.2	-17.2	0	0	0	114.2

Retrieved 951 of 951 residues in 267.8 ms (Link to these results)

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