A0A078BPE0_CAEEL Loading...

Mediator complex subunit 1

AlphaFold DB , UniProt , Accession A0A078BPE0, Species CAEEL (Caenorhabditis elegans), Gene sop-3, Length 1,159 aa.

						>A0A078BPE0_CAEEL|A0A078BPE0|sop-3
MTGRVGVKSNLKLLTQFPDEGDIQQQYQVDSKMLTKEDDVVAMEMYLSDFRDLSKLIETLRSEWKHASLWESILAICESSKGEQKEVNAVDMQLVLRRTEFFLQFDTDYGSMTMQIFEKSPSNYVVKTTSQITGESPSLDFDKMLTEKLNSTWSIPATLTFAITDLKCRINSVLNCVISFDSSSSSDKQHQNYWSISNNNTQLMQSAAQKSAAKCTKKKVTVLEVGPAIEPTQLVYTRENDEEFQGSLLSSFGEVDDYYVKTSTIGRTRPQPRPKREPNQLTSMDMMSAELDKSRHTMEGSMRDAQTSSFLDAARVRMKQSIGAAHAVGLASHQPPASPVAAAAAAPGGPMRHNSYPSGFEPPPSVAPYDFPADPSKKQRKQRAKKQPGEEPPAGRGKGGKKGRGAGAVGAAAAGGRKSAGGAGENPFGMDPMRPPMLQRSSSEQHNPNPHQMSQYQMQQYQQNQQFRMHQMQQQQQQQFQMQSPKNPLVPAYTDEDSDEECDPPPPPKPQVSTSSRMSSVPSHPPPPPQQLGNPMVGYPGMPLQSPNHLPLTPSPLSAPPKPFSPEQQHHFGMKMRETSYWKELERLETKPDVEKLKQQLSSSSSSSQAEASDPPSTSTEAQDPPKPSSSSAPPPPKKKLGLEAAISKIRGQQEQALQKQLQQQESVESELATPHPGSSGAPPLAPHQVNRARNLNDIFDDEADDSSPTADIKPSLQALQKPTDTSSQSTSSEPPPKKEPADEQPEREKEKLILKIPKMLKPVVDDRREDRKERDRDRDRDRDRDEDREKVRDKEDKAQREKDKKEKERERRRQRDRDRTEQKKSDREKEPSKKRKLEKKDEKEKDRREPERKKGKSDGKEYSKASTTSLIPTLSLKNFRIPKKDTVEEEKKDVKEEAPGPSSSTESKKEPPSAAPITRKESTTAPVAPAVQQQQQRKESFTALPSLPEQQQHHREPLLKKKPPLQPPPPPQMTGPPIGIYPGPPAPGNLPGSSRPSGNRKQPLPPPPPMIRGPPPDQMYRDRSGGGGGSMRGGFPPASHYHGGTSGVNKQVASYAQGLPPGMGPPVVKPHGNNYQASQWVRPPTHRDSSHSYHGMPSLGPPQLQREPPAPPPPQMIPLPKDPPVLREHPREHRAHRGGADDDGPDSPEEGTLRIDDE
					

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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	30.2	Very low	34.3	Very low	246 Å²	246	120 Å²	120	100%	1.212	67%	0.673	S	S	*	*				0	116.6	0	-76.6	170.4	155.6	0	0	108.4	G3	M1-G3 PolarHBondContact O-N 3.49Å
2	T	32.8	Very low	34.8	Very low	143 Å²	143	116.8 Å²	116.8	88%	0.877	65%	0.647	S	S	*	*			trans	-88.1	79.8	-179.5	48.8	0	0	0	0	110.9	R4	T2-R4 PolarHBondContact O-N 3.29Å
3	G	25.9	Very low	35.3	Very low	69 Å²	69	110.8 Å²	110.8	71%	0.711	61%	0.612	S	S	*	*			trans	-70.8	94.4	175.7	0	0	0	0	0	111.4	M1 V5	M1-G3 PolarHBondContact O-N 3.49Å; G3-V5 PolarHBondContact O-N 3.48Å
4	R	29.1	Very low	35.6	Very low	244 Å²	244	108.4 Å²	108.4	92%	0.921	60%	0.597	S	S	*	*			trans	-66.4	96.4	166.5	-75.3	-172.3	177.9	-172.5	-0.9	108.8	T2 G6	T2-R4 PolarHBondContact O-N 3.29Å; R4-G6 PolarHBondContact O-N 3.37Å; R4-G6 VanDerWaalsContact O-N 3.08Å
5	V	28.8	Very low	35.9	Very low	129 Å²	129	102 Å²	102	78%	0.782	56%	0.563	S	S	*	*			trans	-65.9	106.6	167.8	179.7	0	0	0	0	107.3	G3 V7	G3-V5 PolarHBondContact O-N 3.48Å; V5-V7 PolarHBondContact O-N 3.03Å
6	G	31.1	Very low	35.8	Very low	65 Å²	65	102 Å²	102	67%	0.67	56%	0.558	S	S	*	*			trans	-74.1	88.2	-178.1	0	0	0	0	0	111.2	R4 K8	R4-G6 PolarHBondContact O-N 3.37Å; R4-G6 VanDerWaalsContact O-N 3.08Å; G6-K8 PolarHBondContact O-N 3.02Å
7	V	35.9	Very low	35.9	Very low	83 Å²	83	100.9 Å²	100.9	50%	0.503	55%	0.546	S	S	.	.			trans	-54.3	133.6	177.2	-176.1	0	0	0	0	110.1	V5 K32	V5-V7 PolarHBondContact O-N 3.03Å; V7-K32 WeakPolarHBondContact O-CE 3.34Å
8	K	40.6	Very low	35.8	Very low	174 Å²	174	101.1 Å²	101.1	76%	0.757	55%	0.554	S	S	*	*			trans	-107.8	77.8	169	-76.2	-177.2	174.4	-171.2	0	107.4	G6 N10	G6-K8 PolarHBondContact O-N 3.02Å; K8-N10 PolarHBondContact O-N 3.27Å
9	S	42.1	Very low	35.8	Very low	52 Å²	52	103.1 Å²	103.1	36%	0.364	56%	0.563	S	S	.	*			trans	-88.2	96.7	176.5	33.6	0	0	0	0	109.2	L11 S31	S9-L11 PolarHBondContact O-N 3.36Å; S9-S31 WeakPolarHBondContact O-CB 3.2Å; S9-S31 PolarHBondContact O-N 3.34Å; S9-S31 PolarHBondContact O-OG 3.37Å; S9-S31 PolarHBondContact OG-OG 3.04Å
10	N	42	Very low	35.9	Very low	71 Å²	71	107.6 Å²	107.6	38%	0.38	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.1	116.2	156.1	-65.5	10.1	0	0	0	106.1	K8 Q28 V29	K8-N10 PolarHBondContact O-N 3.27Å; N10-Q28 PolarHBondContact ND2-OE1 3.36Å; N10-V29 CarbonylContact C-O 3.56Å; N10-V29 VanDerWaalsContact CA-O 3.31Å; N10-V29 WeakPolarHBondContact CA-O 3.43Å
11	L	38.4	Very low	36.1	Very low	44 Å²	44	104.7 Å²	104.7	23%	0.23	58%	0.576	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-59.9	145	165.1	-67.1	169.6	0	0	0	107.9	S9 Q28 V29 L34	S9-L11 PolarHBondContact O-N 3.36Å; L11-Q28 WeakPolarHBondContact O-CA 3.44Å; L11-V29 HydrophobicContact CB-CB 4.3Å; L11-V29 PolarHBondContact N-O 2.98Å; L11-V29 PolarHBondContact O-N 3.39Å; L11-L34 HydrophobicContact CD1-CD1 4.14Å
12	K	41	Very low	36.5	Very low	82 Å²	82	99.5 Å²	99.5	36%	0.357	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.9	118.4	178.1	-65.6	-161.8	175.8	-161.3	0	109.9	Y27 Q28	K12-Y27 WeakPolarHBondContact CA-O 3.5Å; K12-Q28 HydrophobicContact CD-CG 4.46Å; K12-Q28 HydrophobicContact CG-CG 4.27Å
13	L	41	Very low	36.7	Very low	38 Å²	38	98 Å²	98	20%	0.199	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	138.4	162.2	-178.4	66.5	0	0	0	108.5	T15 Q26 Y27 W70 L74	L13-T15 HydrophobicContact CD1-CG2 4.48Å; L13-T15 HydrophobicContact CD2-CG2 3.68Å; L13-T15 HydrophobicContact CG-CG2 3.92Å; L13-Q26 CarbonylContact O-C 3.54Å; L13-Q26 WeakPolarHBondContact O-CA 3.43Å; L13-Y27 PolarHBondContact N-O 2.91Å; L13-Y27 PolarHBondContact O-N 3.31Å; L13-W70 HydrophobicContact CD2-CB 3.62Å; L13-W70 HydrophobicContact CD2-CD2 3.86Å; L13-W70 HydrophobicContact CD2-CE3 3.68Å; L13-W70 HydrophobicContact CD2-CG 3.87Å; L13-L74 HydrophobicContact CB-CD1 3.99Å; L13-L74 HydrophobicContact CB-CD2 4.15Å; L13-L74 HydrophobicContact CB-CG 4.36Å; L13-L74 HydrophobicContact CD1-CD2 4.39Å
14	L	40	Very low	37.4	Very low	77 Å²	77	99.7 Å²	99.7	40%	0.403	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.3	161	-66.6	101.9	0	0	0	107.4	Q24 Q25	L14-Q24 HydrophobicContact CD2-CB 4.45Å; L14-Q25 WeakPolarHBondContact CA-O 3.5Å
15	T	39.9	Very low	37.8	Very low	13 Å²	13	90.5 Å²	90.5	8%	0.08	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.5	167.8	56.5	0	0	0	0	108.3	L13 F17 Q25 W70	L13-T15 HydrophobicContact CD1-CG2 4.48Å; L13-T15 HydrophobicContact CD2-CG2 3.68Å; L13-T15 HydrophobicContact CG-CG2 3.92Å; T15-F17 WeakPolarHBondContact OG1-CE2 3.49Å; T15-Q25 PolarHBondContact N-O 2.93Å; T15-Q25 VanDerWaalsContact N-O 3.08Å; T15-Q25 PolarHBondContact O-N 3.42Å; T15-W70 HydrophobicContact CG2-CD2 4.18Å; T15-W70 HydrophobicContact CG2-CE3 4.23Å; T15-W70 HydrophobicContact CG2-CH2 4.12Å; T15-W70 HydrophobicContact CG2-CZ2 4.06Å; T15-W70 HydrophobicContact CG2-CZ3 4.2Å
16	Q	34.3	Very low	38.3	Very low	102 Å²	102	88.4 Å²	88.4	48%	0.477	48%	0.477	S	S	.	.			trans	-101.3	126.9	170.3	-169.8	160.6	-9.7	0	0	108.4	D22 Q24	Q16-D22 PolarHBondContact NE2-OD1 3.42Å; Q16-Q24 HydrophobicContact CB-CG 4.11Å; Q16-Q24 HydrophobicContact CG-CG 4.07Å
17	F	37.1	Very low	38.8	Very low	83 Å²	83	87.1 Å²	87.1	36%	0.364	45%	0.452	S	S	.	.			trans	-100	147.1	177.7	-63.2	-77.8	0	0	0	109.6	T15 D19 Q25	T15-F17 WeakPolarHBondContact OG1-CE2 3.49Å; F17-D19 PolarHBondContact O-N 3.29Å; F17-Q25 HydrophobicContact CE2-CG 4.49Å
18	P	34.6	Very low	38.9	Very low	105 Å²	105	88.1 Å²	88.1	68%	0.682	45%	0.452	S	S	*	.	S	Bend	trans	-78.8	-12.6	-171.5	30.9	-36.4	0	0	0	115
19	D	34.9	Very low	39	Very low	138 Å²	138	80.1 Å²	80.1	74%	0.738	42%	0.418	S	S	*	.	S	Bend	trans	-99.2	126.6	-173.6	-68.1	-39.4	0	0	0	112.8	F17	F17-D19 PolarHBondContact O-N 3.29Å
20	E	38.4	Very low	39.1	Very low	193 Å²	193	80.1 Å²	80.1	90%	0.902	41%	0.414	S	S	*	.	S	Bend	trans	50.6	62.7	166.6	-60.2	-160.5	145	0	0	117.8
21	G	40.3	Very low	39.3	Very low	48 Å²	48	78 Å²	78	50%	0.495	40%	0.404	S	S	.	.	S	Bend	trans	106.6	156.2	163.4	0	0	0	0	0	113.8	I23	G21-I23 PolarHBondContact O-N 3.49Å
22	D	38.9	Very low	39.9	Very low	136 Å²	136	80.6 Å²	80.6	73%	0.727	41%	0.413	S	S	*	.			trans	-73.4	54.5	-173.1	-59.6	-74.8	0	0	0	114.1	Q16 Q24	Q16-D22 PolarHBondContact NE2-OD1 3.42Å; D22-Q24 PolarHBondContact O-N 3.01Å
23	I	35.6	Very low	40	Very low	112 Å²	112	83.2 Å²	83.2	57%	0.574	43%	0.429	S	S	*	.			trans	-78.1	68.8	177.2	-50.1	-178.9	0	0	0	108.9	G21 Q25	G21-I23 PolarHBondContact O-N 3.49Å; I23-Q25 HydrophobicContact CG2-CG 4.3Å; I23-Q25 PolarHBondContact O-N 3.32Å; I23-Q25 VanDerWaalsContact O-N 3.13Å
24	Q	40.6	Very low	40.2	Very low	105 Å²	105	82.8 Å²	82.8	49%	0.491	43%	0.427	S	S	.	.			trans	-64	107.8	167.5	-69.6	-170.9	-11.3	0	0	109.5	L14 Q16 D22 Q26	L14-Q24 HydrophobicContact CD2-CB 4.45Å; Q16-Q24 HydrophobicContact CB-CG 4.11Å; Q16-Q24 HydrophobicContact CG-CG 4.07Å; D22-Q24 PolarHBondContact O-N 3.01Å; Q24-Q26 PolarHBondContact O-N 2.96Å
25	Q	38.5	Very low	40.4	Very low	50 Å²	50	83.8 Å²	83.8	23%	0.234	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	110.9	174.7	-62.3	-173	-13.3	0	0	109.2	L14 T15 F17 I23 Y27	L14-Q25 WeakPolarHBondContact CA-O 3.5Å; T15-Q25 PolarHBondContact N-O 2.93Å; T15-Q25 VanDerWaalsContact N-O 3.08Å; T15-Q25 PolarHBondContact O-N 3.42Å; F17-Q25 HydrophobicContact CE2-CG 4.49Å; I23-Q25 HydrophobicContact CG2-CG 4.3Å; I23-Q25 PolarHBondContact O-N 3.32Å; I23-Q25 VanDerWaalsContact O-N 3.13Å; Q25-Y27 HydrophobicContact CB-CD2 4.43Å; Q25-Y27 HydrophobicContact CB-CE2 3.72Å; Q25-Y27 PolarHBondContact OE1-OH 3.21Å
26	Q	39.4	Very low	40.5	Very low	86 Å²	86	88.2 Å²	88.2	40%	0.402	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	106.9	177.2	-178.2	174.8	118.5	0	0	110.8	L13 Q24 Q28	L13-Q26 CarbonylContact O-C 3.54Å; L13-Q26 WeakPolarHBondContact O-CA 3.43Å; Q24-Q26 PolarHBondContact O-N 2.96Å; Q26-Q28 HydrophobicContact CG-CG 4.27Å
27	Y	41.3	Very low	40.8	Very low	37 Å²	37	92.1 Å²	92.1	15%	0.145	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	124.1	171.6	-62.9	-92.9	0	0	0	109.3	K12 L13 Q25 W64 A67	K12-Y27 WeakPolarHBondContact CA-O 3.5Å; L13-Y27 PolarHBondContact N-O 2.91Å; L13-Y27 PolarHBondContact O-N 3.31Å; Q25-Y27 HydrophobicContact CB-CD2 4.43Å; Q25-Y27 HydrophobicContact CB-CE2 3.72Å; Q25-Y27 PolarHBondContact OE1-OH 3.21Å; Y27-W64 PolarHBondContact OH-O 2.96Å; Y27-A67 HydrophobicContact CD1-CB 3.84Å; Y27-A67 HydrophobicContact CE1-CB 4.11Å
28	Q	38.7	Very low	40.8	Very low	104 Å²	104	94.8 Å²	94.8	49%	0.486	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	107.3	174.5	-62.7	-163.1	28.1	0	0	110.3	N10 L11 K12 Q26	N10-Q28 PolarHBondContact ND2-OE1 3.36Å; L11-Q28 WeakPolarHBondContact O-CA 3.44Å; K12-Q28 HydrophobicContact CD-CG 4.46Å; K12-Q28 HydrophobicContact CG-CG 4.27Å; Q26-Q28 HydrophobicContact CG-CG 4.27Å
29	V	41.7	Very low	40.7	Very low	7 Å²	7	91.8 Å²	91.8	4%	0.042	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113.3	-175	-173.8	0	0	0	0	108.6	N10 L11 S31 L34 E71 L74	N10-V29 CarbonylContact C-O 3.56Å; N10-V29 VanDerWaalsContact CA-O 3.31Å; N10-V29 WeakPolarHBondContact CA-O 3.43Å; L11-V29 HydrophobicContact CB-CB 4.3Å; L11-V29 PolarHBondContact N-O 2.98Å; L11-V29 PolarHBondContact O-N 3.39Å; V29-S31 PolarHBondContact O-N 3.15Å; V29-L34 HydrophobicContact CG1-CD1 3.82Å; V29-L34 HydrophobicContact CG1-CG 4.21Å; V29-E71 HydrophobicContact CG1-CG 3.97Å; V29-E71 HydrophobicContact CG2-CG 3.69Å; V29-L74 HydrophobicContact CG2-CD1 3.87Å
30	D	45.4	Very low	40.8	Very low	52 Å²	52	87.3 Å²	87.3	28%	0.278	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	114.1	176.5	-173.6	-7.5	0	0	0	109.4	K32 M33	D30-K32 PolarHBondContact O-N 3.49Å; D30-K32 VanDerWaalsContact OD1-CB 3.26Å; D30-K32 WeakPolarHBondContact OD1-CB 3.33Å; D30-K32 VanDerWaalsContact OD1-CG 3.24Å; D30-K32 WeakPolarHBondContact OD1-CG 3.45Å; D30-K32 PolarHBondContact OD1-N 3Å; D30-M33 HydrophobicContact CB-CG 4.32Å; D30-M33 WeakPolarHBondContact O-CB 3.48Å; D30-M33 PolarHBondContact O-N 3.09Å
31	S	45.2	Very low	40.6	Very low	26 Å²	26	82.1 Å²	82.1	18%	0.182	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-11.1	176.7	55.7	0	0	0	0	113.8	S9 V29 M33 L34	S9-S31 WeakPolarHBondContact O-CB 3.2Å; S9-S31 PolarHBondContact O-N 3.34Å; S9-S31 PolarHBondContact O-OG 3.37Å; S9-S31 PolarHBondContact OG-OG 3.04Å; V29-S31 PolarHBondContact O-N 3.15Å; S31-M33 VanDerWaalsContact C-N 3.33Å; S31-L34 PolarHBondContact O-N 3.24Å
32	K	50.8	Low	40.4	Very low	98 Å²	98	82 Å²	82	43%	0.426	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.7	172.3	-59.4	173.4	-174.6	-163.9	0	114.2	V7 D30 T35	V7-K32 WeakPolarHBondContact O-CE 3.34Å; D30-K32 PolarHBondContact O-N 3.49Å; D30-K32 VanDerWaalsContact OD1-CB 3.26Å; D30-K32 WeakPolarHBondContact OD1-CB 3.33Å; D30-K32 VanDerWaalsContact OD1-CG 3.24Å; D30-K32 WeakPolarHBondContact OD1-CG 3.45Å; D30-K32 PolarHBondContact OD1-N 3Å; K32-T35 VanDerWaalsContact O-CG2 3.24Å; K32-T35 WeakPolarHBondContact O-CG2 3.44Å
33	M	44.4	Very low	40.2	Very low	137 Å²	137	78.6 Å²	78.6	68%	0.675	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-36.1	166.5	-60.2	-61.4	-176.8	0	0	110.5	D30 S31 T35 D39	D30-M33 HydrophobicContact CB-CG 4.32Å; D30-M33 WeakPolarHBondContact O-CB 3.48Å; D30-M33 PolarHBondContact O-N 3.09Å; S31-M33 VanDerWaalsContact C-N 3.33Å; M33-T35 VanDerWaalsContact C-N 3.28Å; M33-T35 PolarHBondContact O-N 2.66Å; M33-D39 WeakPolarHBondContact O-CB 3.27Å
34	L	43.7	Very low	40.3	Very low	30 Å²	30	78.7 Å²	78.7	16%	0.157	40%	0.401	C	S	.	.			trans	-83.2	52.9	-179.8	-59.1	178.6	0	0	0	113.1	L11 V29 S31 D39	L11-L34 HydrophobicContact CD1-CD1 4.14Å; V29-L34 HydrophobicContact CG1-CD1 3.82Å; V29-L34 HydrophobicContact CG1-CG 4.21Å; S31-L34 PolarHBondContact O-N 3.24Å; L34-D39 WeakPolarHBondContact CD2-O 3.45Å
35	T	44.2	Very low	40.1	Very low	97 Å²	97	76.5 Å²	76.5	60%	0.595	39%	0.391	S	S	*	.			trans	-99	-11.1	-169.9	55.6	0	0	0	0	115.8	K32 M33 D39	K32-T35 VanDerWaalsContact O-CG2 3.24Å; K32-T35 WeakPolarHBondContact O-CG2 3.44Å; M33-T35 VanDerWaalsContact C-N 3.28Å; M33-T35 PolarHBondContact O-N 2.66Å; T35-D39 PolarHBondContact N-OD2 3.17Å; T35-D39 PolarHBondContact OG1-OD2 3.07Å
36	K	42.3	Very low	40	Very low	107 Å²	107	80.9 Å²	80.9	47%	0.465	41%	0.406	S	S	.	.	S	Bend	trans	-125.9	159.4	177.9	-58.3	175.4	-130.9	65.4	0	109	D38 D39	K36-D38 HydrophobicContact CB-CB 4.25Å; K36-D38 PolarHBondContact O-N 3.21Å; K36-D39 HydrophobicContact CB-CB 4.34Å; K36-D39 WeakPolarHBondContact CB-OD2 3.5Å; K36-D39 WeakPolarHBondContact CG-OD2 3.34Å; K36-D39 PolarHBondContact N-OD2 3.43Å; K36-D39 IonicContact NZ-OD1 2.75Å; K36-D39 PolarHBondContact NZ-OD1 3.03Å; K36-D39 IonicContact NZ-OD2 3.69Å; K36-D39 PolarHBondContact NZ-OD2 3.07Å; K36-D39 WeakPolarHBondContact O-CB 3.41Å; K36-D39 PolarHBondContact O-N 2.97Å
37	E	39.9	Very low	39.9	Very low	183 Å²	183	77.9 Å²	77.9	86%	0.855	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-59.2	-36.9	167.4	-67.1	160.8	156.6	0	0	110.1	D39 V40	E37-D39 VanDerWaalsContact C-N 3.25Å; E37-D39 PolarHBondContact O-N 3.44Å; E37-V40 PolarHBondContact O-N 2.83Å
38	D	38.6	Very low	39.8	Very low	139 Å²	139	80.7 Å²	80.7	74%	0.743	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.7	171.8	-45.4	-50.3	0	0	0	114.9	K36 V40	K36-D38 HydrophobicContact CB-CB 4.25Å; K36-D38 PolarHBondContact O-N 3.21Å; D38-V40 VanDerWaalsContact C-N 3.31Å
39	D	32	Very low	39.9	Very low	42 Å²	42	77.5 Å²	77.5	23%	0.225	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-82	-16.6	-179.6	-64	-29.4	0	0	0	111.4	M33 L34 T35 K36 E37 V41	M33-D39 WeakPolarHBondContact O-CB 3.27Å; L34-D39 WeakPolarHBondContact CD2-O 3.45Å; T35-D39 PolarHBondContact N-OD2 3.17Å; T35-D39 PolarHBondContact OG1-OD2 3.07Å; K36-D39 HydrophobicContact CB-CB 4.34Å; K36-D39 WeakPolarHBondContact CB-OD2 3.5Å; K36-D39 WeakPolarHBondContact CG-OD2 3.34Å; K36-D39 PolarHBondContact N-OD2 3.43Å; K36-D39 IonicContact NZ-OD1 2.75Å; K36-D39 PolarHBondContact NZ-OD1 3.03Å; K36-D39 IonicContact NZ-OD2 3.69Å; K36-D39 PolarHBondContact NZ-OD2 3.07Å; K36-D39 WeakPolarHBondContact O-CB 3.41Å; K36-D39 PolarHBondContact O-N 2.97Å; E37-D39 VanDerWaalsContact C-N 3.25Å; E37-D39 PolarHBondContact O-N 3.44Å; D39-V41 PolarHBondContact O-N 2.97Å
40	V	36.5	Very low	40	Very low	45 Å²	45	77.7 Å²	77.7	27%	0.273	40%	0.404	S	S	.	.	S	Bend	trans	-78	99.5	166.8	-174.5	0	0	0	0	107.2	E37 D38 A42 A75	E37-V40 PolarHBondContact O-N 2.83Å; D38-V40 VanDerWaalsContact C-N 3.31Å; V40-A42 HydrophobicContact CG1-CB 4.21Å; V40-A42 PolarHBondContact O-N 2.97Å; V40-A75 HydrophobicContact CB-CB 4.28Å; V40-A75 HydrophobicContact CG1-CB 3.63Å; V40-A75 HydrophobicContact CG2-CB 3.67Å
41	V	35.2	Very low	40	Very low	84 Å²	84	83.8 Å²	83.8	51%	0.509	42%	0.424	S	S	.	.			trans	-68.8	78.7	160.7	-177.3	0	0	0	0	106.8	D39 M43 S72	D39-V41 PolarHBondContact O-N 2.97Å; V41-M43 PolarHBondContact O-N 3.29Å; V41-S72 WeakPolarHBondContact O-CB 3.48Å; V41-S72 PolarHBondContact O-OG 3.35Å
42	A	34.7	Very low	40	Very low	46 Å²	46	85.6 Å²	85.6	38%	0.38	43%	0.431	S	S	.	.			trans	-67.3	100.1	165.7	0	0	0	0	0	106.2	V40 E44	V40-A42 HydrophobicContact CG1-CB 4.21Å; V40-A42 PolarHBondContact O-N 2.97Å; A42-E44 HydrophobicContact CB-CG 4.15Å; A42-E44 PolarHBondContact O-N 2.96Å
43	M	34.8	Very low	39.7	Very low	64 Å²	64	81 Å²	81	32%	0.315	41%	0.411	S	S	.	.			trans	-76.1	71.6	171.6	-159.6	-174.9	-59.6	0	0	107.8	V41 M45 L69 S72	V41-M43 PolarHBondContact O-N 3.29Å; M43-M45 HydrophobicContact CG-CG 3.82Å; M43-M45 PolarHBondContact O-N 3.07Å; M43-M45 HydrophobicContact SD-CE 3.85Å; M43-M45 HydrophobicContact SD-CG 4.06Å; M43-M45 HydrophobicContact SD-SD 4.08Å; M43-L69 HydrophobicContact CB-CD1 4.2Å; M43-L69 HydrophobicContact CE-CB 4.38Å; M43-L69 HydrophobicContact SD-CD1 4.39Å; M43-S72 PolarHBondContact N-OG 3.11Å; M43-S72 VanDerWaalsContact N-OG 3.11Å
44	E	37.9	Very low	39.8	Very low	114 Å²	114	76.9 Å²	76.9	53%	0.533	40%	0.396	S	S	.	.			trans	-65	85	169.8	-65.4	-169.6	129.5	0	0	107.9	A42 Y46	A42-E44 HydrophobicContact CB-CG 4.15Å; A42-E44 PolarHBondContact O-N 2.96Å; E44-Y46 HydrophobicContact CB-CD2 3.95Å; E44-Y46 HydrophobicContact CB-CE2 3.52Å; E44-Y46 HydrophobicContact CG-CE2 4.47Å; E44-Y46 WeakPolarHBondContact O-CD2 3.48Å; E44-Y46 PolarHBondContact O-N 3.41Å; E44-Y46 PolarHBondContact OE2-OH 2.95Å; E44-Y46 VanDerWaalsContact OE2-OH 3.07Å
45	M	36.5	Very low	40.1	Very low	59 Å²	59	81.3 Å²	81.3	29%	0.291	41%	0.414	S	S	.	.			trans	-73.2	75.6	177.4	-70.2	-167.5	117.2	0	0	109.3	M43 L47 L56 T59 L60	M43-M45 HydrophobicContact CG-CG 3.82Å; M43-M45 PolarHBondContact O-N 3.07Å; M43-M45 HydrophobicContact SD-CE 3.85Å; M43-M45 HydrophobicContact SD-CG 4.06Å; M43-M45 HydrophobicContact SD-SD 4.08Å; M45-L47 VanDerWaalsContact C-N 3.33Å; M45-L47 PolarHBondContact O-N 3.4Å; M45-L56 HydrophobicContact CB-CD1 4.06Å; M45-L56 HydrophobicContact CB-CD2 4.5Å; M45-L56 HydrophobicContact CE-CD1 3.63Å; M45-L56 HydrophobicContact CE-CG 4.1Å; M45-L56 HydrophobicContact CG-CD1 4.35Å; M45-L56 HydrophobicContact SD-CD1 3.79Å; M45-L56 HydrophobicContact SD-CD2 4.13Å; M45-L56 HydrophobicContact SD-CG 3.99Å; M45-T59 HydrophobicContact CE-CG2 4.23Å; M45-L60 HydrophobicContact CE-CD2 4.46Å; M45-L60 HydrophobicContact SD-CD2 3.8Å; M45-L60 HydrophobicContact SD-CG 4.2Å
46	Y	37	Very low	40.4	Very low	141 Å²	141	78.1 Å²	78.1	55%	0.553	39%	0.393	S	S	*	.			trans	-59.8	91.5	174.4	-72.2	-77.1	0	0	0	110.6	E44 S48 W153	E44-Y46 HydrophobicContact CB-CD2 3.95Å; E44-Y46 HydrophobicContact CB-CE2 3.52Å; E44-Y46 HydrophobicContact CG-CE2 4.47Å; E44-Y46 WeakPolarHBondContact O-CD2 3.48Å; E44-Y46 PolarHBondContact O-N 3.41Å; E44-Y46 PolarHBondContact OE2-OH 2.95Å; E44-Y46 VanDerWaalsContact OE2-OH 3.07Å; Y46-S48 VanDerWaalsContact C-N 3.32Å; Y46-S48 PolarHBondContact O-N 3Å; Y46-W153 HydrophobicContact CD1-CB 4.49Å
47	L	37.7	Very low	40.6	Very low	23 Å²	23	73.6 Å²	73.6	12%	0.12	37%	0.374	C	S	.	.			trans	-67.2	91.7	167.4	-78.3	171.9	0	0	0	108.9	M45 D49 F50 L53 L56	M45-L47 VanDerWaalsContact C-N 3.33Å; M45-L47 PolarHBondContact O-N 3.4Å; L47-D49 PolarHBondContact O-N 3.39Å; L47-F50 HydrophobicContact CB-CD2 4.42Å; L47-F50 HydrophobicContact CD1-CD2 3.64Å; L47-F50 HydrophobicContact CD1-CE2 3.61Å; L47-L53 HydrophobicContact CD1-CD1 4.08Å; L47-L56 HydrophobicContact CD1-CD2 4.05Å; L47-L56 HydrophobicContact CD2-CB 4.09Å; L47-L56 HydrophobicContact CD2-CD1 3.96Å; L47-L56 HydrophobicContact CD2-CD2 4.05Å; L47-L56 HydrophobicContact CD2-CG 4.26Å; L47-L56 HydrophobicContact CG-CD1 4.48Å; L47-L56 HydrophobicContact CG-CD2 4.11Å
48	S	38	Very low	41	Very low	96 Å²	96	71.5 Å²	71.5	67%	0.671	36%	0.364	S	S	*	.	S	Bend	trans	-66.9	-19.2	168.5	52.8	0	0	0	0	112.7	Y46	Y46-S48 VanDerWaalsContact C-N 3.32Å; Y46-S48 PolarHBondContact O-N 3Å
49	D	40.8	Very low	41.5	Very low	37 Å²	37	67.6 Å²	67.6	20%	0.198	35%	0.345	C	S	.	.			trans	-154.5	123.9	178.8	-165.6	-37.6	0	0	0	110.1	L47 R51 D52	L47-D49 PolarHBondContact O-N 3.39Å; D49-R51 PolarHBondContact O-N 3.19Å; D49-R51 WeakPolarHBondContact OD1-CB 3.42Å; D49-R51 VanDerWaalsContact OD1-CG 3.28Å; D49-R51 WeakPolarHBondContact OD1-CG 3.45Å; D49-R51 IonicContact OD1-CZ 3.69Å; D49-R51 PolarHBondContact OD1-N 3Å; D49-R51 IonicContact OD1-NE 2.91Å; D49-R51 PolarHBondContact OD1-NE 3.5Å; D49-R51 IonicContact OD1-NH2 3.8Å; D49-R51 IonicContact OD2-CZ 2.74Å; D49-R51 VanDerWaalsContact OD2-CZ 3.25Å; D49-R51 IonicContact OD2-NE 3.94Å; D49-R51 PolarHBondContact OD2-NE 3.04Å; D49-R51 IonicContact OD2-NH2 2.76Å; D49-R51 PolarHBondContact OD2-NH2 3.26Å; D49-D52 PolarHBondContact O-N 3.45Å; D49-D52 VanDerWaalsContact O-N 3.09Å
50	F	43.6	Very low	42.3	Very low	11 Å²	11	67.3 Å²	67.3	5%	0.048	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-70.7	-10.8	178.3	-124	-131.2	0	0	0	112.9	L47 D52 L53 F101 E118 Y124	L47-F50 HydrophobicContact CB-CD2 4.42Å; L47-F50 HydrophobicContact CD1-CD2 3.64Å; L47-F50 HydrophobicContact CD1-CE2 3.61Å; F50-D52 PolarHBondContact O-N 3.02Å; F50-L53 HydrophobicContact CD1-CD2 3.65Å; F50-L53 HydrophobicContact CD2-CD2 4.49Å; F50-L53 HydrophobicContact CE1-CD2 3.58Å; F50-L53 HydrophobicContact CE2-CD2 4.43Å; F50-L53 HydrophobicContact CG-CB 4.3Å; F50-L53 HydrophobicContact CG-CD2 4.16Å; F50-L53 HydrophobicContact CZ-CD2 4.02Å; F50-L53 WeakPolarHBondContact O-CB 3.39Å; F50-L53 PolarHBondContact O-N 2.68Å; F50-F101 HydrophobicContact CE1-CE2 4.14Å; F50-F101 HydrophobicContact CE2-CE2 4.05Å; F50-F101 HydrophobicContact CZ-CD2 4.05Å; F50-F101 AromaticContact CZ-CE2 3.49Å; F50-F101 HydrophobicContact CZ-CE2 3.49Å; F50-F101 VanDerWaalsContact CZ-CE2 3.49Å; F50-E118 HydrophobicContact CB-CB 4.36Å; F50-E118 VanDerWaalsContact CB-CD 3.44Å; F50-E118 HydrophobicContact CB-CG 4.49Å; F50-E118 WeakPolarHBondContact CB-OE1 3.25Å; F50-E118 VanDerWaalsContact CB-OE2 3.27Å; F50-E118 WeakPolarHBondContact CB-OE2 3.34Å; F50-E118 HydrophobicContact CD1-CB 3.51Å; F50-E118 HydrophobicContact CD1-CG 4.47Å; F50-E118 HydrophobicContact CE1-CB 3.79Å; F50-E118 HydrophobicContact CG-CB 4.04Å; F50-Y124 HydrophobicContact CB-CE1 4.49Å; F50-Y124 HydrophobicContact CD1-CE1 4.32Å; F50-Y124 HydrophobicContact CD2-CD1 4.15Å; F50-Y124 AromaticContact CD2-CE1 3.23Å; F50-Y124 HydrophobicContact CD2-CE1 3.23Å; F50-Y124 AromaticContact CD2-CZ 3.63Å; F50-Y124 WeakPolarHBondContact CD2-OH 3.49Å; F50-Y124 HydrophobicContact CE1-CD1 4.35Å; F50-Y124 HydrophobicContact CE1-CE1 4.25Å; F50-Y124 AromaticContact CE2-CD1 3.67Å; F50-Y124 HydrophobicContact CE2-CD1 3.67Å; F50-Y124 AromaticContact CE2-CE1 3.15Å; F50-Y124 HydrophobicContact CE2-CE1 3.15Å; F50-Y124 HydrophobicContact CE2-CE2 4.5Å; F50-Y124 AromaticContact CE2-CZ 3.64Å; F50-Y124 AromaticContact CG-CE1 3.83Å; F50-Y124 HydrophobicContact CG-CE1 3.83Å; F50-Y124 AromaticContact CZ-CD1 3.75Å; F50-Y124 HydrophobicContact CZ-CD1 3.75Å; F50-Y124 AromaticContact CZ-CE1 3.68Å; F50-Y124 HydrophobicContact CZ-CE1 3.68Å
51	R	46.2	Very low	42.8	Very low	180 Å²	180	73.3 Å²	73.3	68%	0.679	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-67.4	-25.8	169.3	-62.1	174.4	-69.4	-172.2	-0.2	111.6	D49 L53	D49-R51 PolarHBondContact O-N 3.19Å; D49-R51 WeakPolarHBondContact OD1-CB 3.42Å; D49-R51 VanDerWaalsContact OD1-CG 3.28Å; D49-R51 WeakPolarHBondContact OD1-CG 3.45Å; D49-R51 IonicContact OD1-CZ 3.69Å; D49-R51 PolarHBondContact OD1-N 3Å; D49-R51 IonicContact OD1-NE 2.91Å; D49-R51 PolarHBondContact OD1-NE 3.5Å; D49-R51 IonicContact OD1-NH2 3.8Å; D49-R51 IonicContact OD2-CZ 2.74Å; D49-R51 VanDerWaalsContact OD2-CZ 3.25Å; D49-R51 IonicContact OD2-NE 3.94Å; D49-R51 PolarHBondContact OD2-NE 3.04Å; D49-R51 IonicContact OD2-NH2 2.76Å; D49-R51 PolarHBondContact OD2-NH2 3.26Å; R51-L53 VanDerWaalsContact C-N 3.28Å
52	D	44.7	Very low	43.3	Very low	65 Å²	65	72.4 Å²	72.4	35%	0.348	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-81.3	-2.7	168.8	-76.1	-17.5	0	0	0	113.1	D49 F50 S54 K55 L56	D49-D52 PolarHBondContact O-N 3.45Å; D49-D52 VanDerWaalsContact O-N 3.09Å; F50-D52 PolarHBondContact O-N 3.02Å; D52-S54 PolarHBondContact O-N 2.74Å; D52-K55 HydrophobicContact CB-CD 4.47Å; D52-K55 CarbonylContact O-C 3.59Å; D52-K55 WeakPolarHBondContact O-CA 3.3Å; D52-K55 WeakPolarHBondContact O-CB 3.47Å; D52-K55 PolarHBondContact O-N 3.5Å; D52-K55 WeakPolarHBondContact OD1-CD 3.02Å; D52-K55 WeakPolarHBondContact OD1-CE 3.49Å; D52-K55 IonicContact OD1-NZ 3.6Å; D52-K55 PolarHBondContact OD1-NZ 3.4Å; D52-K55 IonicContact OD2-NZ 2.75Å; D52-L56 PolarHBondContact O-N 3.47Å
53	L	45.8	Very low	43.9	Very low	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-57.7	-32.2	170.5	179.9	57.6	0	0	0	112.1	L47 F50 R51 L56 I57 F101	L47-L53 HydrophobicContact CD1-CD1 4.08Å; F50-L53 HydrophobicContact CD1-CD2 3.65Å; F50-L53 HydrophobicContact CD2-CD2 4.49Å; F50-L53 HydrophobicContact CE1-CD2 3.58Å; F50-L53 HydrophobicContact CE2-CD2 4.43Å; F50-L53 HydrophobicContact CG-CB 4.3Å; F50-L53 HydrophobicContact CG-CD2 4.16Å; F50-L53 HydrophobicContact CZ-CD2 4.02Å; F50-L53 WeakPolarHBondContact O-CB 3.39Å; F50-L53 PolarHBondContact O-N 2.68Å; R51-L53 VanDerWaalsContact C-N 3.28Å; L53-L56 HydrophobicContact CD1-CB 4.33Å; L53-L56 HydrophobicContact CD1-CD2 4.16Å; L53-L56 PolarHBondContact O-N 3.33Å; L53-I57 HydrophobicContact CD1-CD1 3.93Å; L53-I57 HydrophobicContact CD1-CG1 3.86Å; L53-I57 HydrophobicContact CD2-CD1 4.39Å; L53-I57 HydrophobicContact CG-CD1 3.76Å; L53-I57 HydrophobicContact CG-CG1 4.18Å; L53-I57 WeakPolarHBondContact O-CB 3.37Å; L53-I57 VanDerWaalsContact O-CG1 3.24Å; L53-I57 WeakPolarHBondContact O-CG1 3.28Å; L53-I57 PolarHBondContact O-N 3.24Å; L53-F101 HydrophobicContact CD1-CE1 4.38Å; L53-F101 HydrophobicContact CD1-CE2 3.71Å; L53-F101 HydrophobicContact CD1-CZ 3.4Å; L53-F101 HydrophobicContact CD2-CD2 4.37Å; L53-F101 HydrophobicContact CD2-CE2 3.61Å; L53-F101 HydrophobicContact CD2-CZ 4.21Å; L53-F101 HydrophobicContact CG-CE2 4.34Å; L53-F101 HydrophobicContact CG-CZ 4.47Å
54	S	45	Very low	44.3	Very low	52 Å²	52	75 Å²	75	36%	0.364	36%	0.358	S	S	.	.	H	α-helix	trans	-64.7	-40.5	173.8	-68.9	0	0	0	0	111.7	D52 E58	D52-S54 PolarHBondContact O-N 2.74Å; S54-E58 WeakPolarHBondContact O-CB 3.3Å; S54-E58 PolarHBondContact O-N 3.42Å
55	K	50.3	Low	44.4	Very low	123 Å²	123	76.1 Å²	76.1	54%	0.535	36%	0.362	S	S	.	.	H	α-helix	trans	-71.1	-32.5	173.2	-58.1	176.1	-169.5	155.5	0	111.6	D52 E58 T59	D52-K55 HydrophobicContact CB-CD 4.47Å; D52-K55 CarbonylContact O-C 3.59Å; D52-K55 WeakPolarHBondContact O-CA 3.3Å; D52-K55 WeakPolarHBondContact O-CB 3.47Å; D52-K55 PolarHBondContact O-N 3.5Å; D52-K55 WeakPolarHBondContact OD1-CD 3.02Å; D52-K55 WeakPolarHBondContact OD1-CE 3.49Å; D52-K55 IonicContact OD1-NZ 3.6Å; D52-K55 PolarHBondContact OD1-NZ 3.4Å; D52-K55 IonicContact OD2-NZ 2.75Å; K55-E58 PolarHBondContact O-N 3Å; K55-T59 VanDerWaalsContact O-CB 3.26Å; K55-T59 WeakPolarHBondContact O-CB 3.16Å; K55-T59 PolarHBondContact O-N 3.38Å; K55-T59 PolarHBondContact O-OG1 3.13Å
56	L	50.1	Low	44.6	Very low	29 Å²	29	76.7 Å²	76.7	15%	0.152	36%	0.363	C	S	.	.	H	α-helix	trans	-68.6	-44.9	176.4	-160.7	95.5	0	0	0	110.6	M45 L47 D52 L53 E58 T59 L60	M45-L56 HydrophobicContact CB-CD1 4.06Å; M45-L56 HydrophobicContact CB-CD2 4.5Å; M45-L56 HydrophobicContact CE-CD1 3.63Å; M45-L56 HydrophobicContact CE-CG 4.1Å; M45-L56 HydrophobicContact CG-CD1 4.35Å; M45-L56 HydrophobicContact SD-CD1 3.79Å; M45-L56 HydrophobicContact SD-CD2 4.13Å; M45-L56 HydrophobicContact SD-CG 3.99Å; L47-L56 HydrophobicContact CD1-CD2 4.05Å; L47-L56 HydrophobicContact CD2-CB 4.09Å; L47-L56 HydrophobicContact CD2-CD1 3.96Å; L47-L56 HydrophobicContact CD2-CD2 4.05Å; L47-L56 HydrophobicContact CD2-CG 4.26Å; L47-L56 HydrophobicContact CG-CD1 4.48Å; L47-L56 HydrophobicContact CG-CD2 4.11Å; D52-L56 PolarHBondContact O-N 3.47Å; L53-L56 HydrophobicContact CD1-CB 4.33Å; L53-L56 HydrophobicContact CD1-CD2 4.16Å; L53-L56 PolarHBondContact O-N 3.33Å; L56-E58 VanDerWaalsContact C-N 3.32Å; L56-T59 CarbonylContact O-C 3.56Å; L56-T59 PolarHBondContact O-N 2.97Å; L56-L60 HydrophobicContact CD2-CD1 3.94Å; L56-L60 HydrophobicContact CG-CD1 4.23Å; L56-L60 WeakPolarHBondContact O-CB 3.22Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 2.93Å
57	I	46.3	Very low	44.9	Very low	12 Å²	12	71.3 Å²	71.3	6%	0.062	35%	0.348	C	S	.	.	H	α-helix	trans	-63.1	-40.3	173	-69.8	167.8	0	0	0	110	L53 R61 L96 R97	L53-I57 HydrophobicContact CD1-CD1 3.93Å; L53-I57 HydrophobicContact CD1-CG1 3.86Å; L53-I57 HydrophobicContact CD2-CD1 4.39Å; L53-I57 HydrophobicContact CG-CD1 3.76Å; L53-I57 HydrophobicContact CG-CG1 4.18Å; L53-I57 WeakPolarHBondContact O-CB 3.37Å; L53-I57 VanDerWaalsContact O-CG1 3.24Å; L53-I57 WeakPolarHBondContact O-CG1 3.28Å; L53-I57 PolarHBondContact O-N 3.24Å; I57-R61 HydrophobicContact CG2-CG 4.44Å; I57-R61 WeakPolarHBondContact O-CB 3.36Å; I57-R61 WeakPolarHBondContact O-CG 3.44Å; I57-R61 PolarHBondContact O-N 3.24Å; I57-L96 HydrophobicContact CD1-CB 4.04Å; I57-L96 HydrophobicContact CG1-CB 4.27Å; I57-L96 HydrophobicContact CG1-CD1 4.32Å; I57-R97 WeakPolarHBondContact CD1-O 3.3Å
58	E	48.8	Very low	45.2	Very low	140 Å²	140	71.6 Å²	71.6	65%	0.654	35%	0.352	S	S	*	.	H	α-helix	trans	-64.9	-38.6	173.8	-168.8	170.2	-164.7	0	0	112.2	S54 K55 L56 R61 S62	S54-E58 WeakPolarHBondContact O-CB 3.3Å; S54-E58 PolarHBondContact O-N 3.42Å; K55-E58 PolarHBondContact O-N 3Å; L56-E58 VanDerWaalsContact C-N 3.32Å; E58-R61 CarbonylContact O-C 3.49Å; E58-R61 PolarHBondContact O-N 2.99Å; E58-S62 PolarHBondContact O-N 2.67Å
59	T	50.3	Low	45.7	Very low	56 Å²	56	68.7 Å²	68.7	34%	0.344	33%	0.329	S	S	.	.	H	α-helix	trans	-68.5	-45.4	174.7	-58.1	0	0	0	0	111	M45 K55 L56 R61 S62 E63	M45-T59 HydrophobicContact CE-CG2 4.23Å; K55-T59 VanDerWaalsContact O-CB 3.26Å; K55-T59 WeakPolarHBondContact O-CB 3.16Å; K55-T59 PolarHBondContact O-N 3.38Å; K55-T59 PolarHBondContact O-OG1 3.13Å; L56-T59 CarbonylContact O-C 3.56Å; L56-T59 PolarHBondContact O-N 2.97Å; T59-R61 PolarHBondContact O-N 3.36Å; T59-S62 PolarHBondContact O-N 2.97Å; T59-S62 PolarHBondContact O-OG 3.47Å; T59-E63 HydrophobicContact CG2-CG 3.71Å; T59-E63 WeakPolarHBondContact O-CB 3.48Å; T59-E63 VanDerWaalsContact O-CG 3.25Å; T59-E63 WeakPolarHBondContact O-CG 3.19Å; T59-E63 PolarHBondContact O-N 3.36Å
60	L	48.8	Very low	46.3	Very low	36 Å²	36	69.7 Å²	69.7	19%	0.188	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-33.8	172.5	-70.3	167	0	0	0	110.8	M45 L56 W64 L69	M45-L60 HydrophobicContact CE-CD2 4.46Å; M45-L60 HydrophobicContact SD-CD2 3.8Å; M45-L60 HydrophobicContact SD-CG 4.2Å; L56-L60 HydrophobicContact CD2-CD1 3.94Å; L56-L60 HydrophobicContact CG-CD1 4.23Å; L56-L60 WeakPolarHBondContact O-CB 3.22Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 2.93Å; L60-W64 WeakPolarHBondContact O-CA 3.49Å; L60-W64 VanDerWaalsContact O-CB 3.28Å; L60-W64 WeakPolarHBondContact O-CB 3.25Å; L60-W64 PolarHBondContact O-N 3.05Å; L60-L69 HydrophobicContact CD2-CD1 4.35Å; L60-L69 HydrophobicContact CD2-CD2 3.4Å; L60-L69 VanDerWaalsContact CD2-CD2 3.4Å
61	R	47.3	Very low	46.5	Very low	171 Å²	171	71.9 Å²	71.9	65%	0.645	34%	0.34	S	S	*	.	H	α-helix	trans	-82.5	-1.6	173.2	-70.1	172	179.1	-177.3	-0.6	114.8	I57 E58 T59 W64	I57-R61 HydrophobicContact CG2-CG 4.44Å; I57-R61 WeakPolarHBondContact O-CB 3.36Å; I57-R61 WeakPolarHBondContact O-CG 3.44Å; I57-R61 PolarHBondContact O-N 3.24Å; E58-R61 CarbonylContact O-C 3.49Å; E58-R61 PolarHBondContact O-N 2.99Å; T59-R61 PolarHBondContact O-N 3.36Å; R61-W64 PolarHBondContact O-NE1 3.06Å
62	S	45.6	Very low	46.5	Very low	65 Å²	65	63.6 Å²	63.6	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-105.1	-41.8	165.2	65.9	0	0	0	0	112.2	E58 T59	E58-S62 PolarHBondContact O-N 2.67Å; T59-S62 PolarHBondContact O-N 2.97Å; T59-S62 PolarHBondContact O-OG 3.47Å
63	E	45.6	Very low	46.8	Very low	71 Å²	71	63.2 Å²	63.2	33%	0.332	31%	0.307	S	S	.	.	H	α-helix	trans	-87.5	-0.6	-178	-55.2	-68.4	106.5	0	0	113.4	T59 K65 H66	T59-E63 HydrophobicContact CG2-CG 3.71Å; T59-E63 WeakPolarHBondContact O-CB 3.48Å; T59-E63 VanDerWaalsContact O-CG 3.25Å; T59-E63 WeakPolarHBondContact O-CG 3.19Å; T59-E63 PolarHBondContact O-N 3.36Å; E63-K65 PolarHBondContact O-N 3.49Å; E63-H66 VanDerWaalsContact CD-CE1 3.49Å; E63-H66 VanDerWaalsContact CD-ND1 3.34Å; E63-H66 WeakPolarHBondContact O-CA 3.16Å; E63-H66 VanDerWaalsContact O-CB 3.28Å; E63-H66 WeakPolarHBondContact O-CB 3.21Å; E63-H66 PolarHBondContact O-N 3.42Å; E63-H66 IonicContact OE1-CE1 2.71Å; E63-H66 PolarHBondContact OE1-CE1 2.97Å; E63-H66 IonicContact OE1-ND1 3.48Å; E63-H66 IonicContact OE2-CE1 3.21Å; E63-H66 PolarHBondContact OE2-CE1 3.02Å; E63-H66 IonicContact OE2-CG 2.73Å; E63-H66 IonicContact OE2-ND1 2.73Å; E63-H66 PolarHBondContact OE2-ND1 3.23Å
64	W	44.8	Very low	47	Very low	93 Å²	93	64.7 Å²	64.7	35%	0.352	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-25.3	173.2	58.3	-69.6	0	0	0	114.4	Y27 L60 R61 H66	Y27-W64 PolarHBondContact OH-O 2.96Å; L60-W64 WeakPolarHBondContact O-CA 3.49Å; L60-W64 VanDerWaalsContact O-CB 3.28Å; L60-W64 WeakPolarHBondContact O-CB 3.25Å; L60-W64 PolarHBondContact O-N 3.05Å; R61-W64 PolarHBondContact O-NE1 3.06Å; W64-H66 VanDerWaalsContact C-N 3.28Å
65	K	38.4	Very low	47	Very low	139 Å²	139	63.2 Å²	63.2	60%	0.604	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-11.1	176.5	-57.6	-174	-178.7	-177	0	113.3	E63	E63-K65 PolarHBondContact O-N 3.49Å
66	H	40.9	Very low	46.7	Very low	70 Å²	70	61 Å²	61	32%	0.324	30%	0.299	S	S	.	.			trans	-93.9	110.5	-176.9	-62.1	178.6	0	0	0	108.6	E63 W64 S68	E63-H66 VanDerWaalsContact CD-CE1 3.49Å; E63-H66 VanDerWaalsContact CD-ND1 3.34Å; E63-H66 WeakPolarHBondContact O-CA 3.16Å; E63-H66 VanDerWaalsContact O-CB 3.28Å; E63-H66 WeakPolarHBondContact O-CB 3.21Å; E63-H66 PolarHBondContact O-N 3.42Å; E63-H66 IonicContact OE1-CE1 2.71Å; E63-H66 PolarHBondContact OE1-CE1 2.97Å; E63-H66 IonicContact OE1-ND1 3.48Å; E63-H66 IonicContact OE2-CE1 3.21Å; E63-H66 PolarHBondContact OE2-CE1 3.02Å; E63-H66 IonicContact OE2-CG 2.73Å; E63-H66 IonicContact OE2-ND1 2.73Å; E63-H66 PolarHBondContact OE2-ND1 3.23Å; W64-H66 VanDerWaalsContact C-N 3.28Å; H66-S68 PolarHBondContact O-N 2.99Å
67	A	44.3	Very low	46.2	Very low	28 Å²	28	63.5 Å²	63.5	23%	0.231	32%	0.318	C	S	.	.	H	α-helix	trans	-57.8	-23.9	-174.4	0	0	0	0	0	113.4	Y27 L69 W70 E71	Y27-A67 HydrophobicContact CD1-CB 3.84Å; Y27-A67 HydrophobicContact CE1-CB 4.11Å; A67-L69 VanDerWaalsContact C-N 3.33Å; A67-L69 PolarHBondContact O-N 3.1Å; A67-W70 CarbonylContact O-C 3.59Å; A67-W70 WeakPolarHBondContact O-CA 3.46Å; A67-W70 WeakPolarHBondContact O-CB 3.43Å; A67-W70 PolarHBondContact O-N 3.33Å; A67-E71 HydrophobicContact CB-CG 4.34Å; A67-E71 WeakPolarHBondContact O-CB 3.2Å; A67-E71 WeakPolarHBondContact O-CG 3.29Å; A67-E71 PolarHBondContact O-N 3.02Å
68	S	43.6	Very low	46	Very low	29 Å²	29	66.9 Å²	66.9	20%	0.203	33%	0.333	C	S	.	.	H	α-helix	trans	-53.7	-38.3	-174.3	50.6	0	0	0	0	115.1	H66 E71 S72	H66-S68 PolarHBondContact O-N 2.99Å; S68-E71 WeakPolarHBondContact CA-OE2 3.48Å; S68-E71 PolarHBondContact O-N 3.08Å; S68-S72 PolarHBondContact O-N 3.41Å; S68-S72 PolarHBondContact O-OG 2.98Å
69	L	48.4	Very low	45.4	Very low	36 Å²	36	65.5 Å²	65.5	19%	0.188	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-42.8	175.8	178.5	73.6	0	0	0	111.8	M43 L60 A67 S72 I73	M43-L69 HydrophobicContact CB-CD1 4.2Å; M43-L69 HydrophobicContact CE-CB 4.38Å; M43-L69 HydrophobicContact SD-CD1 4.39Å; L60-L69 HydrophobicContact CD2-CD1 4.35Å; L60-L69 HydrophobicContact CD2-CD2 3.4Å; L60-L69 VanDerWaalsContact CD2-CD2 3.4Å; A67-L69 VanDerWaalsContact C-N 3.33Å; A67-L69 PolarHBondContact O-N 3.1Å; L69-S72 WeakPolarHBondContact O-CB 3.37Å; L69-S72 PolarHBondContact O-N 3.49Å; L69-S72 PolarHBondContact O-OG 2.84Å; L69-I73 WeakPolarHBondContact O-CG1 3.37Å; L69-I73 PolarHBondContact O-N 3.04Å
70	W	53.6	Low	44.9	Very low	57 Å²	57	68.4 Å²	68.4	22%	0.216	36%	0.362	C	S	.	.	H	α-helix	trans	-73.5	-32.8	178.8	-67.5	114.3	0	0	0	111.5	L13 T15 A67 I73 L74	L13-W70 HydrophobicContact CD2-CB 3.62Å; L13-W70 HydrophobicContact CD2-CD2 3.86Å; L13-W70 HydrophobicContact CD2-CE3 3.68Å; L13-W70 HydrophobicContact CD2-CG 3.87Å; T15-W70 HydrophobicContact CG2-CD2 4.18Å; T15-W70 HydrophobicContact CG2-CE3 4.23Å; T15-W70 HydrophobicContact CG2-CH2 4.12Å; T15-W70 HydrophobicContact CG2-CZ2 4.06Å; T15-W70 HydrophobicContact CG2-CZ3 4.2Å; A67-W70 CarbonylContact O-C 3.59Å; A67-W70 WeakPolarHBondContact O-CA 3.46Å; A67-W70 WeakPolarHBondContact O-CB 3.43Å; A67-W70 PolarHBondContact O-N 3.33Å; W70-I73 HydrophobicContact CE3-CD1 3.83Å; W70-I73 HydrophobicContact CZ3-CD1 4.03Å; W70-I73 PolarHBondContact O-N 3.04Å; W70-L74 WeakPolarHBondContact O-CB 3.31Å; W70-L74 VanDerWaalsContact O-CG 3.3Å; W70-L74 WeakPolarHBondContact O-CG 3.45Å; W70-L74 PolarHBondContact O-N 3.28Å
71	E	48.6	Very low	44.5	Very low	58 Å²	58	75.6 Å²	75.6	27%	0.271	39%	0.392	S	S	.	.	H	α-helix	trans	-63.8	-36.4	168.2	-70.9	168.3	162.9	0	0	111.6	V29 A67 S68 A75	V29-E71 HydrophobicContact CG1-CG 3.97Å; V29-E71 HydrophobicContact CG2-CG 3.69Å; A67-E71 HydrophobicContact CB-CG 4.34Å; A67-E71 WeakPolarHBondContact O-CB 3.2Å; A67-E71 WeakPolarHBondContact O-CG 3.29Å; A67-E71 PolarHBondContact O-N 3.02Å; S68-E71 WeakPolarHBondContact CA-OE2 3.48Å; S68-E71 PolarHBondContact O-N 3.08Å; E71-A75 VanDerWaalsContact O-CB 3.29Å; E71-A75 WeakPolarHBondContact O-CB 3.47Å; E71-A75 PolarHBondContact O-N 2.85Å
72	S	46.3	Very low	44.1	Very low	6 Å²	6	69.6 Å²	69.6	4%	0.042	38%	0.383	C	S	.	.	H	α-helix	trans	-55.3	-52.9	169.2	-40	0	0	0	0	110.8	V41 M43 S68 L69 A75 I76	V41-S72 WeakPolarHBondContact O-CB 3.48Å; V41-S72 PolarHBondContact O-OG 3.35Å; M43-S72 PolarHBondContact N-OG 3.11Å; M43-S72 VanDerWaalsContact N-OG 3.11Å; S68-S72 PolarHBondContact O-N 3.41Å; S68-S72 PolarHBondContact O-OG 2.98Å; L69-S72 WeakPolarHBondContact O-CB 3.37Å; L69-S72 PolarHBondContact O-N 3.49Å; L69-S72 PolarHBondContact O-OG 2.84Å; S72-A75 PolarHBondContact O-N 3.14Å; S72-I76 WeakPolarHBondContact O-CD1 3.47Å; S72-I76 VanDerWaalsContact O-CG1 3.26Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 3.33Å
73	I	50.4	Low	43.6	Very low	57 Å²	57	75.3 Å²	75.3	29%	0.292	40%	0.402	S	S	.	.	H	α-helix	trans	-65.7	-44	-174.5	-65.1	164.8	0	0	0	110.3	L69 W70 A75 I76 C77	L69-I73 WeakPolarHBondContact O-CG1 3.37Å; L69-I73 PolarHBondContact O-N 3.04Å; W70-I73 HydrophobicContact CE3-CD1 3.83Å; W70-I73 HydrophobicContact CZ3-CD1 4.03Å; W70-I73 PolarHBondContact O-N 3.04Å; I73-A75 PolarHBondContact O-N 2.63Å; I73-I76 PolarHBondContact O-N 3.02Å; I73-C77 WeakPolarHBondContact O-CB 3.08Å; I73-C77 PolarHBondContact O-N 3.09Å; I73-C77 VanDerWaalsContact O-N 3.09Å; I73-C77 PolarHBondContact O-SG 3.4Å; I73-C77 VanDerWaalsContact O-SG 3.32Å
74	L	49.3	Very low	43.4	Very low	31 Å²	31	80.9 Å²	80.9	16%	0.162	43%	0.428	C	S	.	.	H	α-helix	trans	-59.4	-45.5	175.2	-76.1	171.4	0	0	0	112.7	L13 V29 W70 C77 E78	L13-L74 HydrophobicContact CB-CD1 3.99Å; L13-L74 HydrophobicContact CB-CD2 4.15Å; L13-L74 HydrophobicContact CB-CG 4.36Å; L13-L74 HydrophobicContact CD1-CD2 4.39Å; V29-L74 HydrophobicContact CG2-CD1 3.87Å; W70-L74 WeakPolarHBondContact O-CB 3.31Å; W70-L74 VanDerWaalsContact O-CG 3.3Å; W70-L74 WeakPolarHBondContact O-CG 3.45Å; W70-L74 PolarHBondContact O-N 3.28Å; L74-C77 CarbonylContact O-C 3.56Å; L74-C77 PolarHBondContact O-N 2.94Å; L74-E78 PolarHBondContact O-N 3.15Å
75	A	45.8	Very low	43.1	Very low	20 Å²	20	83.8 Å²	83.8	17%	0.165	44%	0.444	C	S	.	.	H	α-helix	trans	-68.2	-37.8	-178.5	0	0	0	0	0	112.3	V40 E71 S72 I73 C77 E78	V40-A75 HydrophobicContact CB-CB 4.28Å; V40-A75 HydrophobicContact CG1-CB 3.63Å; V40-A75 HydrophobicContact CG2-CB 3.67Å; E71-A75 VanDerWaalsContact O-CB 3.29Å; E71-A75 WeakPolarHBondContact O-CB 3.47Å; E71-A75 PolarHBondContact O-N 2.85Å; S72-A75 PolarHBondContact O-N 3.14Å; I73-A75 PolarHBondContact O-N 2.63Å; A75-C77 PolarHBondContact O-N 2.83Å; A75-E78 PolarHBondContact O-N 3.43Å
76	I	44.1	Very low	43.2	Very low	76 Å²	76	82.7 Å²	82.7	39%	0.39	44%	0.441	S	S	.	.	H	α-helix	trans	-63.6	-32.2	173.1	-68.2	164.8	0	0	0	111	S72 I73 P156	S72-I76 WeakPolarHBondContact O-CD1 3.47Å; S72-I76 VanDerWaalsContact O-CG1 3.26Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 3.33Å; I73-I76 PolarHBondContact O-N 3.02Å; I76-P156 HydrophobicContact CD1-CB 4.12Å
77	C	39.8	Very low	43.1	Very low	82 Å²	82	83.8 Å²	83.8	55%	0.554	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-5.8	175.5	-69.2	0	0	0	0	114.9	I73 L74 A75 S79	I73-C77 WeakPolarHBondContact O-CB 3.08Å; I73-C77 PolarHBondContact O-N 3.09Å; I73-C77 VanDerWaalsContact O-N 3.09Å; I73-C77 PolarHBondContact O-SG 3.4Å; I73-C77 VanDerWaalsContact O-SG 3.32Å; L74-C77 CarbonylContact O-C 3.56Å; L74-C77 PolarHBondContact O-N 2.94Å; A75-C77 PolarHBondContact O-N 2.83Å; C77-S79 VanDerWaalsContact C-N 3.3Å; C77-S79 PolarHBondContact O-N 2.94Å
78	E	41.9	Very low	43.1	Very low	83 Å²	83	87.7 Å²	87.7	39%	0.388	47%	0.469	S	S	.	.			trans	-76.7	76.9	179.9	-162.8	-173.2	143.5	0	0	112.1	L74 A75	L74-E78 PolarHBondContact O-N 3.15Å; A75-E78 PolarHBondContact O-N 3.43Å
79	S	34.8	Very low	43.7	Very low	112 Å²	112	88 Å²	88	78%	0.783	47%	0.473	S	S	*	.			trans	-60.1	146.1	167.6	66.9	0	0	0	0	111.9	C77 K81	C77-S79 VanDerWaalsContact C-N 3.3Å; C77-S79 PolarHBondContact O-N 2.94Å; S79-K81 PolarHBondContact O-N 3.12Å
80	S	39.7	Very low	44.4	Very low	116 Å²	116	87.6 Å²	87.6	81%	0.811	47%	0.472	S	S	*	.			trans	-69.1	111.6	-153.3	51.7	0	0	0	0	116.4
81	K	41	Very low	45.3	Very low	188 Å²	188	90.2 Å²	90.2	82%	0.817	49%	0.49	S	S	*	.			trans	30.8	90.5	147.4	-71.9	171	177.1	126	0	116.8	S79	S79-K81 PolarHBondContact O-N 3.12Å
82	G	38.2	Very low	46.7	Very low	45 Å²	45	90.8 Å²	90.8	46%	0.464	49%	0.494	S	S	.	.			trans	-163	95.6	169.9	0	0	0	0	0	114.9
83	E	36.6	Very low	48.3	Very low	184 Å²	184	95.3 Å²	95.3	86%	0.86	51%	0.514	S	S	*	.	S	Bend	trans	66.3	172.1	172.5	-53.1	-177.1	131.4	0	0	115.5	K85	E83-K85 PolarHBondContact O-N 3.08Å
84	Q	40.2	Very low	49.8	Very low	188 Å²	188	96.7 Å²	96.7	88%	0.879	52%	0.522	S	S	*	.	S	Bend	trans	-77.7	74.4	172.9	-75.3	-170.3	-57	0	0	109.8
85	K	40.1	Very low	51.2	Low	155 Å²	155	98.5 Å²	98.5	67%	0.674	53%	0.534	S	S	*	.			trans	-80.2	137.9	168	-70.5	-177.3	178.7	179.4	0	110.4	E83 V87	E83-K85 PolarHBondContact O-N 3.08Å; K85-V87 PolarHBondContact O-N 3.29Å
86	E	38.7	Very low	52.6	Low	116 Å²	116	99.4 Å²	99.4	54%	0.542	54%	0.536	S	S	.	.			trans	-8.8	111.2	140.2	-153.9	152	-142.1	0	0	112.2	N88 S172	E86-N88 PolarHBondContact O-N 3.04Å; E86-N88 PolarHBondContact O-OD1 2.69Å; E86-S172 VanDerWaalsContact CD-OG 3.25Å; E86-S172 WeakPolarHBondContact CG-OG 3.28Å; E86-S172 VanDerWaalsContact OE1-CB 3.28Å; E86-S172 WeakPolarHBondContact OE1-CB 3.29Å; E86-S172 PolarHBondContact OE1-OG 2.96Å
87	V	38.7	Very low	54.3	Low	93 Å²	93	101.9 Å²	101.9	56%	0.564	54%	0.54	S	S	*	.			trans	-78.4	109.3	-177.9	177.7	0	0	0	0	107.7	K85 A89	K85-V87 PolarHBondContact O-N 3.29Å; V87-A89 PolarHBondContact O-N 3.19Å
88	N	45.3	Very low	55.9	Low	110 Å²	110	107.2 Å²	107.2	59%	0.588	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	94.4	-176.4	-79.4	5.4	0	0	0	111.2	E86 I170	E86-N88 PolarHBondContact O-N 3.04Å; E86-N88 PolarHBondContact O-OD1 2.69Å; N88-I170 HydrophobicContact CB-CD1 4.1Å; N88-I170 HydrophobicContact CB-CG2 3.33Å; N88-I170 VanDerWaalsContact CG-CG2 3.5Å
89	A	55.4	Low	57.7	Low	34 Å²	34	107.4 Å²	107.4	28%	0.281	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.2	139	175.4	0	0	0	0	0	111.3	V87 I170 N171 V173	V87-A89 PolarHBondContact O-N 3.19Å; A89-I170 CarbonylContact O-C 3.5Å; A89-I170 WeakPolarHBondContact O-CA 3.15Å; A89-N171 PolarHBondContact N-O 3.1Å; A89-N171 PolarHBondContact O-N 3.15Å; A89-V173 HydrophobicContact CB-CG2 3.86Å
90	V	63.8	Low	60.2	Low	29 Å²	29	103.9 Å²	103.9	18%	0.176	53%	0.527	C	S	.	.			trans	-106.3	128.8	166.6	-178.9	0	0	0	0	106.7	M92 F105 I163 C168	V90-M92 HydrophobicContact CB-CG 4.29Å; V90-M92 HydrophobicContact CG1-CG 3.85Å; V90-M92 HydrophobicContact CG1-SD 4.36Å; V90-F105 HydrophobicContact CG1-CB 4.08Å; V90-I163 HydrophobicContact CG2-CG2 4.18Å; V90-C168 HydrophobicContact CG1-CB 3.93Å; V90-C168 HydrophobicContact CG2-CB 3.76Å
91	D	72.3	Confident	62.5	Low	111 Å²	111	99 Å²	99	59%	0.594	49%	0.491	S	S	*	.			trans	-76.2	133.1	172.6	-161.9	-5.5	0	0	0	109.4	F105	D91-F105 WeakPolarHBondContact O-CA 3.48Å; D91-F105 WeakPolarHBondContact O-CB 3.36Å
92	M	79	Confident	64.8	Low	71 Å²	71	91.7 Å²	91.7	35%	0.35	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	111.3	-167.3	-64.4	-162	-80.9	0	0	112.1	V90 Q104 F105 L159 I163	V90-M92 HydrophobicContact CB-CG 4.29Å; V90-M92 HydrophobicContact CG1-CG 3.85Å; V90-M92 HydrophobicContact CG1-SD 4.36Å; M92-Q104 CarbonylContact C-O 3.49Å; M92-Q104 WeakPolarHBondContact CA-O 3.49Å; M92-F105 HydrophobicContact CG-CB 3.9Å; M92-L159 HydrophobicContact CE-CD2 4.36Å; M92-L159 HydrophobicContact SD-CD1 4.26Å; M92-L159 HydrophobicContact SD-CD2 3.94Å; M92-L159 HydrophobicContact SD-CG 4.5Å; M92-I163 HydrophobicContact CE-CD1 4.48Å; M92-I163 HydrophobicContact SD-CD1 3.98Å
93	Q	79.6	Confident	67.3	Low	100 Å²	100	90.2 Å²	90.2	47%	0.467	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	119	173.7	-170.7	180	41.9	0	0	110.3	Q104	Q93-Q104 HydrophobicContact CB-CB 4.31Å; Q93-Q104 PolarHBondContact N-O 3.27Å; Q93-Q104 PolarHBondContact O-N 2.68Å
94	L	81.2	Confident	69.9	Low	87 Å²	87	84.4 Å²	84.4	46%	0.455	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.2	178.9	174	63.2	0	0	0	111.2	L96 L103	L94-L96 HydrophobicContact CD1-CD2 3.83Å; L94-L96 HydrophobicContact CD1-CG 4.22Å; L94-L96 HydrophobicContact CD2-CD1 4.33Å; L94-L96 HydrophobicContact CD2-CD2 4.33Å; L94-L96 HydrophobicContact CD2-CG 4.3Å; L94-L96 HydrophobicContact CG-CD2 4.21Å; L94-L96 HydrophobicContact CG-CG 4.1Å; L94-L103 HydrophobicContact CB-CD2 4.14Å; L94-L103 HydrophobicContact CD1-CD2 3.77Å; L94-L103 HydrophobicContact CD1-CG 3.9Å; L94-L103 HydrophobicContact CG-CD2 4.49Å
95	V	79.8	Confident	72.2	Confident	68 Å²	68	75.6 Å²	75.6	41%	0.412	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.1	172.6	179	0	0	0	0	109.8	F102	V95-F102 HydrophobicContact CB-CB 4.26Å; V95-F102 PolarHBondContact N-O 3.34Å; V95-F102 PolarHBondContact O-N 3.48Å
96	L	73.8	Confident	74.5	Confident	39 Å²	39	71.3 Å²	71.3	20%	0.204	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.9	-175.8	-64	171.2	0	0	0	111.2	I57 L94 F101	I57-L96 HydrophobicContact CD1-CB 4.04Å; I57-L96 HydrophobicContact CG1-CB 4.27Å; I57-L96 HydrophobicContact CG1-CD1 4.32Å; L94-L96 HydrophobicContact CD1-CD2 3.83Å; L94-L96 HydrophobicContact CD1-CG 4.22Å; L94-L96 HydrophobicContact CD2-CD1 4.33Å; L94-L96 HydrophobicContact CD2-CD2 4.33Å; L94-L96 HydrophobicContact CD2-CG 4.3Å; L94-L96 HydrophobicContact CG-CD2 4.21Å; L94-L96 HydrophobicContact CG-CG 4.1Å; L96-F101 HydrophobicContact CD2-CD1 3.24Å; L96-F101 HydrophobicContact CD2-CE1 3.57Å; L96-F101 HydrophobicContact CD2-CG 4.01Å
97	R	79.6	Confident	76.8	Confident	128 Å²	128	65.8 Å²	65.8	48%	0.483	33%	0.331	S	S	.	.			trans	-117.7	171	172	-56.4	-173	-174.6	161.1	-3.5	110.5	I57 T99 E100 F102	I57-R97 WeakPolarHBondContact CD1-O 3.3Å; R97-T99 PolarHBondContact O-N 2.92Å; R97-E100 CarbonylContact C-O 3.45Å; R97-E100 WeakPolarHBondContact CA-O 3.42Å; R97-E100 HydrophobicContact CB-CB 4.21Å; R97-E100 WeakPolarHBondContact CB-O 3.5Å; R97-E100 VanDerWaalsContact CD-OE2 3.31Å; R97-E100 WeakPolarHBondContact CD-OE2 3.44Å; R97-E100 IonicContact CZ-OE2 3.9Å; R97-E100 PolarHBondContact N-O 3.49Å; R97-E100 IonicContact NE-OE2 3.85Å; R97-E100 IonicContact NH1-OE2 2.7Å; R97-E100 PolarHBondContact NH1-OE2 3.49Å; R97-F102 HydrophobicContact CG-CE2 4.4Å; R97-F102 VanDerWaalsContact CZ-CE2 3.46Å; R97-F102 VanDerWaalsContact NH1-CE2 3.34Å
98	R	73.9	Confident	78.9	Confident	194 Å²	194	65.5 Å²	65.5	73%	0.732	33%	0.327	S	S	*	.	S	Bend	trans	-62.6	-24.1	-176.5	-78	-174.7	172.8	155	-0.5	115.2
99	T	80.7	Confident	80.6	Confident	88 Å²	88	67.1 Å²	67.1	54%	0.54	33%	0.325	S	S	.	.	S	Bend	trans	-133	-1.9	-174	45.3	0	0	0	0	112.7	R97 F117 E118	R97-T99 PolarHBondContact O-N 2.92Å; T99-F117 WeakPolarHBondContact O-CA 3.5Å; T99-E118 PolarHBondContact O-N 2.89Å
100	E	87.4	Confident	82.1	Confident	37 Å²	37	65.8 Å²	65.8	17%	0.173	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	141.8	-169.3	-44.9	-177.2	105.5	0	0	111	R97 F102 Q115 I116 F117	R97-E100 CarbonylContact C-O 3.45Å; R97-E100 WeakPolarHBondContact CA-O 3.42Å; R97-E100 HydrophobicContact CB-CB 4.21Å; R97-E100 WeakPolarHBondContact CB-O 3.5Å; R97-E100 VanDerWaalsContact CD-OE2 3.31Å; R97-E100 WeakPolarHBondContact CD-OE2 3.44Å; R97-E100 IonicContact CZ-OE2 3.9Å; R97-E100 PolarHBondContact N-O 3.49Å; R97-E100 IonicContact NE-OE2 3.85Å; R97-E100 IonicContact NH1-OE2 2.7Å; R97-E100 PolarHBondContact NH1-OE2 3.49Å; E100-F102 HydrophobicContact CB-CD2 4.24Å; E100-F102 HydrophobicContact CB-CE2 3.57Å; E100-F102 HydrophobicContact CB-CZ 4.3Å; E100-F102 HydrophobicContact CG-CE2 4.29Å; E100-F102 WeakPolarHBondContact OE2-CE2 3.49Å; E100-Q115 PolarHBondContact OE1-NE2 2.69Å; E100-I116 CarbonylContact C-O 3.6Å; E100-I116 VanDerWaalsContact CA-O 3.29Å; E100-I116 WeakPolarHBondContact CA-O 3.43Å; E100-F117 HydrophobicContact CB-CB 4.46Å; E100-F117 HydrophobicContact CG-CB 4.12Å
101	F	87.4	Confident	83.3	Confident	15 Å²	15	65.2 Å²	65.2	7%	0.066	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.7	165.1	-62.1	-118.9	0	0	0	107.8	F50 L53 L96 Q115 I116 I155	F50-F101 HydrophobicContact CE1-CE2 4.14Å; F50-F101 HydrophobicContact CE2-CE2 4.05Å; F50-F101 HydrophobicContact CZ-CD2 4.05Å; F50-F101 AromaticContact CZ-CE2 3.49Å; F50-F101 HydrophobicContact CZ-CE2 3.49Å; F50-F101 VanDerWaalsContact CZ-CE2 3.49Å; L53-F101 HydrophobicContact CD1-CE1 4.38Å; L53-F101 HydrophobicContact CD1-CE2 3.71Å; L53-F101 HydrophobicContact CD1-CZ 3.4Å; L53-F101 HydrophobicContact CD2-CD2 4.37Å; L53-F101 HydrophobicContact CD2-CE2 3.61Å; L53-F101 HydrophobicContact CD2-CZ 4.21Å; L53-F101 HydrophobicContact CG-CE2 4.34Å; L53-F101 HydrophobicContact CG-CZ 4.47Å; L96-F101 HydrophobicContact CD2-CD1 3.24Å; L96-F101 HydrophobicContact CD2-CE1 3.57Å; L96-F101 HydrophobicContact CD2-CG 4.01Å; F101-Q115 CarbonylContact O-C 3.5Å; F101-Q115 WeakPolarHBondContact O-CA 3.36Å; F101-I116 HydrophobicContact CB-CB 4.22Å; F101-I116 PolarHBondContact N-O 3.41Å; F101-I116 PolarHBondContact O-N 2.85Å; F101-I155 HydrophobicContact CD1-CD1 3.9Å; F101-I155 HydrophobicContact CD2-CD1 4.38Å; F101-I155 HydrophobicContact CE1-CD1 3.64Å; F101-I155 HydrophobicContact CE2-CD1 4.15Å; F101-I155 HydrophobicContact CG-CD1 4.28Å; F101-I155 HydrophobicContact CZ-CD1 3.76Å
102	F	89.1	Confident	84.3	Confident	34 Å²	34	60.1 Å²	60.1	15%	0.149	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.6	169.1	-64.7	-100.1	0	0	0	108.9	V95 R97 E100 T113 M114 Q115	V95-F102 HydrophobicContact CB-CB 4.26Å; V95-F102 PolarHBondContact N-O 3.34Å; V95-F102 PolarHBondContact O-N 3.48Å; R97-F102 HydrophobicContact CG-CE2 4.4Å; R97-F102 VanDerWaalsContact CZ-CE2 3.46Å; R97-F102 VanDerWaalsContact NH1-CE2 3.34Å; E100-F102 HydrophobicContact CB-CD2 4.24Å; E100-F102 HydrophobicContact CB-CE2 3.57Å; E100-F102 HydrophobicContact CB-CZ 4.3Å; E100-F102 HydrophobicContact CG-CE2 4.29Å; E100-F102 WeakPolarHBondContact OE2-CE2 3.49Å; F102-T113 HydrophobicContact CD1-CG2 4.06Å; F102-M114 WeakPolarHBondContact CA-O 3.34Å; F102-Q115 HydrophobicContact CD1-CB 3.99Å; F102-Q115 HydrophobicContact CD1-CG 4.04Å; F102-Q115 HydrophobicContact CE1-CB 3.85Å; F102-Q115 HydrophobicContact CE1-CG 3.5Å; F102-Q115 HydrophobicContact CE2-CG 4.42Å; F102-Q115 HydrophobicContact CZ-CG 3.71Å
103	L	90.8	Very high	85	Confident	14 Å²	14	58.1 Å²	58.1	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	108.1	175.8	-82.9	158.2	0	0	0	107.8	L94 M114 I155	L94-L103 HydrophobicContact CB-CD2 4.14Å; L94-L103 HydrophobicContact CD1-CD2 3.77Å; L94-L103 HydrophobicContact CD1-CG 3.9Å; L94-L103 HydrophobicContact CG-CD2 4.49Å; L103-M114 HydrophobicContact CB-CB 4.34Å; L103-M114 HydrophobicContact CB-CE 4.28Å; L103-M114 HydrophobicContact CD1-CE 3.61Å; L103-M114 PolarHBondContact N-O 3.08Å; L103-M114 PolarHBondContact O-N 3.05Å; L103-I155 HydrophobicContact CD1-CG2 4.27Å
104	Q	90.8	Very high	85.8	Confident	62 Å²	62	53.3 Å²	53.3	29%	0.29	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132	172.4	171.8	176.4	-22.8	0	0	109.7	M92 Q93 S111 M112	M92-Q104 CarbonylContact C-O 3.49Å; M92-Q104 WeakPolarHBondContact CA-O 3.49Å; Q93-Q104 HydrophobicContact CB-CB 4.31Å; Q93-Q104 PolarHBondContact N-O 3.27Å; Q93-Q104 PolarHBondContact O-N 2.68Å; Q104-S111 PolarHBondContact NE2-OG 2.97Å; Q104-S111 VanDerWaalsContact NE2-OG 3.1Å; Q104-M112 CarbonylContact C-O 3.52Å; Q104-M112 VanDerWaalsContact CA-O 3.26Å; Q104-M112 WeakPolarHBondContact CA-O 3.18Å
105	F	89.8	Confident	86.4	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	149	-179.7	57	-99.2	0	0	0	111.7	V90 D91 M92 T107 M112 M114 L159 A162 L166 C168	V90-F105 HydrophobicContact CG1-CB 4.08Å; D91-F105 WeakPolarHBondContact O-CA 3.48Å; D91-F105 WeakPolarHBondContact O-CB 3.36Å; M92-F105 HydrophobicContact CG-CB 3.9Å; F105-T107 HydrophobicContact CD2-CG2 3.92Å; F105-T107 HydrophobicContact CE2-CG2 3.78Å; F105-M112 HydrophobicContact CD2-CB 4.12Å; F105-M112 HydrophobicContact CE2-CB 3.89Å; F105-M112 HydrophobicContact CE2-CG 4.23Å; F105-M112 HydrophobicContact CZ-CB 4.33Å; F105-M112 HydrophobicContact CZ-CG 4.36Å; F105-M112 PolarHBondContact N-O 3.21Å; F105-M112 WeakPolarHBondContact O-CB 3.29Å; F105-M112 PolarHBondContact O-N 3.23Å; F105-M114 HydrophobicContact CE1-CB 3.93Å; F105-L159 HydrophobicContact CD1-CD1 4.45Å; F105-L159 HydrophobicContact CE1-CD1 4.24Å; F105-A162 HydrophobicContact CZ-CB 4.49Å; F105-L166 HydrophobicContact CE2-CD1 3.69Å; F105-L166 HydrophobicContact CZ-CD1 3.75Å; F105-C168 WeakPolarHBondContact CD2-SG 3.26Å; F105-C168 VanDerWaalsContact CE2-SG 3.57Å
106	D	86.9	Confident	87.1	Confident	65 Å²	65	47.9 Å²	47.9	35%	0.348	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	141.8	-178.5	-86.5	-31	0	0	0	113.3	S111 C168 R169	D106-S111 VanDerWaalsContact OD1-CA 3.23Å; D106-S111 WeakPolarHBondContact OD1-CA 3.49Å; D106-S111 WeakPolarHBondContact OD1-CB 3.29Å; D106-S111 PolarHBondContact OD1-N 3.49Å; D106-C168 CarbonylContact O-C 3.54Å; D106-C168 VanDerWaalsContact O-CA 3.3Å; D106-C168 WeakPolarHBondContact O-CA 3.38Å; D106-C168 WeakPolarHBondContact O-CB 3.4Å; D106-R169 HydrophobicContact CB-CB 4.19Å; D106-R169 PolarHBondContact O-N 3.49Å
107	T	87.7	Confident	88.1	Confident	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	166.9	176	72.6	0	0	0	0	111.8	F105 Y109 G110 M112 L166 R169	F105-T107 HydrophobicContact CD2-CG2 3.92Å; F105-T107 HydrophobicContact CE2-CG2 3.78Å; T107-Y109 PolarHBondContact O-N 2.95Å; T107-Y109 VanDerWaalsContact O-N 3.11Å; T107-Y109 PolarHBondContact OG1-N 3.17Å; T107-G110 WeakPolarHBondContact CB-O 3.47Å; T107-G110 PolarHBondContact N-O 3.26Å; T107-G110 PolarHBondContact O-N 3.41Å; T107-G110 PolarHBondContact OG1-N 3.48Å; T107-G110 PolarHBondContact OG1-O 3.18Å; T107-M112 HydrophobicContact CG2-CB 3.79Å; T107-M112 HydrophobicContact CG2-CG 4.35Å; T107-L166 HydrophobicContact CG2-CB 3.97Å; T107-L166 HydrophobicContact CG2-CD1 4.43Å; T107-R169 WeakPolarHBondContact O-CD 3.24Å; T107-R169 PolarHBondContact O-NE 3.13Å
108	D	83.5	Confident	88.7	Confident	88 Å²	88	44.1 Å²	44.1	47%	0.471	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.8	170.8	-85.3	-20.1	0	0	0	112.3	K167 R169	D108-K167 PolarHBondContact N-O 3.48Å; D108-R169 PolarHBondContact O-NH2 2.87Å; D108-R169 IonicContact OD1-NE 2.65Å
109	Y	80.9	Confident	89.5	Confident	143 Å²	143	42.1 Å²	42.1	56%	0.561	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	4.4	178.6	-49.7	-80.3	0	0	0	113.9	T107 L166 K167	T107-Y109 PolarHBondContact O-N 2.95Å; T107-Y109 VanDerWaalsContact O-N 3.11Å; T107-Y109 PolarHBondContact OG1-N 3.17Å; Y109-L166 WeakPolarHBondContact CD2-O 3.28Å; Y109-L166 WeakPolarHBondContact CE2-O 3.19Å; Y109-K167 PolarHBondContact OH-NZ 3.15Å
110	G	86.4	Confident	89.9	Confident	7 Å²	7	40.8 Å²	40.8	7%	0.072	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.6	-176.1	-180	0	0	0	0	0	114.6	T107 M112	T107-G110 WeakPolarHBondContact CB-O 3.47Å; T107-G110 PolarHBondContact N-O 3.26Å; T107-G110 PolarHBondContact O-N 3.41Å; T107-G110 PolarHBondContact OG1-N 3.48Å; T107-G110 PolarHBondContact OG1-O 3.18Å; G110-M112 PolarHBondContact O-N 3.29Å
111	S	89.9	Confident	89.7	Confident	17 Å²	17	43.7 Å²	43.7	12%	0.119	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	129.5	174.4	172.1	0	0	0	0	110.7	Q104 D106 Q131	Q104-S111 PolarHBondContact NE2-OG 2.97Å; Q104-S111 VanDerWaalsContact NE2-OG 3.1Å; D106-S111 VanDerWaalsContact OD1-CA 3.23Å; D106-S111 WeakPolarHBondContact OD1-CA 3.49Å; D106-S111 WeakPolarHBondContact OD1-CB 3.29Å; D106-S111 PolarHBondContact OD1-N 3.49Å; S111-Q131 PolarHBondContact O-N 2.92Å; S111-Q131 PolarHBondContact OG-OE1 3.46Å
112	M	92.4	Very high	89.4	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.02	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.7	-175	-156	71.7	166.8	0	0	109.9	Q104 F105 T107 G110 S130 P137 L166	Q104-M112 CarbonylContact C-O 3.52Å; Q104-M112 VanDerWaalsContact CA-O 3.26Å; Q104-M112 WeakPolarHBondContact CA-O 3.18Å; F105-M112 HydrophobicContact CD2-CB 4.12Å; F105-M112 HydrophobicContact CE2-CB 3.89Å; F105-M112 HydrophobicContact CE2-CG 4.23Å; F105-M112 HydrophobicContact CZ-CB 4.33Å; F105-M112 HydrophobicContact CZ-CG 4.36Å; F105-M112 PolarHBondContact N-O 3.21Å; F105-M112 WeakPolarHBondContact O-CB 3.29Å; F105-M112 PolarHBondContact O-N 3.23Å; T107-M112 HydrophobicContact CG2-CB 3.79Å; T107-M112 HydrophobicContact CG2-CG 4.35Å; G110-M112 PolarHBondContact O-N 3.29Å; M112-S130 WeakPolarHBondContact SD-CA 3.48Å; M112-P137 HydrophobicContact CE-CB 3.73Å; M112-P137 VanDerWaalsContact CE-CD 3.42Å; M112-P137 HydrophobicContact CE-CG 3.37Å; M112-L166 HydrophobicContact CE-CD1 4.39Å; M112-L166 HydrophobicContact CE-CD2 4.07Å; M112-L166 HydrophobicContact CG-CD1 4.13Å
113	T	94.2	Very high	89.4	Confident	28 Å²	28	46.2 Å²	46.2	17%	0.172	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.4	173.6	-51.8	0	0	0	0	109.8	F102 T128 T129 Q131	F102-T113 HydrophobicContact CD1-CG2 4.06Å; T113-T128 CarbonylContact O-C 3.52Å; T113-T128 VanDerWaalsContact O-CA 3.31Å; T113-T128 WeakPolarHBondContact O-CA 3.41Å; T113-T129 PolarHBondContact N-O 3.38Å; T113-T129 PolarHBondContact O-N 3.14Å; T113-Q131 PolarHBondContact OG1-NE2 2.86Å
114	M	94.9	Very high	89.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113.2	168.2	-177.5	170.2	66.1	0	0	109.9	F102 L103 F105 I116 V126 K127 T128 L145 L159 A162	F102-M114 WeakPolarHBondContact CA-O 3.34Å; L103-M114 HydrophobicContact CB-CB 4.34Å; L103-M114 HydrophobicContact CB-CE 4.28Å; L103-M114 HydrophobicContact CD1-CE 3.61Å; L103-M114 PolarHBondContact N-O 3.08Å; L103-M114 PolarHBondContact O-N 3.05Å; F105-M114 HydrophobicContact CE1-CB 3.93Å; M114-I116 HydrophobicContact CE-CD1 4.22Å; M114-I116 HydrophobicContact CG-CG1 4.28Å; M114-V126 HydrophobicContact CG-CG1 3.6Å; M114-V126 HydrophobicContact SD-CG1 3.71Å; M114-K127 CarbonylContact C-O 3.55Å; M114-K127 WeakPolarHBondContact CA-O 3.42Å; M114-T128 HydrophobicContact CB-CG2 3.99Å; M114-T128 HydrophobicContact CG-CG2 3.88Å; M114-T128 HydrophobicContact SD-CG2 4.33Å; M114-L145 HydrophobicContact SD-CD1 4.16Å; M114-L159 HydrophobicContact CE-CB 4.33Å; M114-L159 HydrophobicContact CE-CD1 3.72Å; M114-A162 HydrophobicContact SD-CB 4.17Å
115	Q	95.4	Very high	89.7	Confident	40 Å²	40	44.6 Å²	44.6	19%	0.187	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.9	173.6	-178.9	-173.8	19.4	0	0	109.1	E100 F101 F102 F117 V126 K127	E100-Q115 PolarHBondContact OE1-NE2 2.69Å; F101-Q115 CarbonylContact O-C 3.5Å; F101-Q115 WeakPolarHBondContact O-CA 3.36Å; F102-Q115 HydrophobicContact CD1-CB 3.99Å; F102-Q115 HydrophobicContact CD1-CG 4.04Å; F102-Q115 HydrophobicContact CE1-CB 3.85Å; F102-Q115 HydrophobicContact CE1-CG 3.5Å; F102-Q115 HydrophobicContact CE2-CG 4.42Å; F102-Q115 HydrophobicContact CZ-CG 3.71Å; Q115-F117 HydrophobicContact CG-CD1 4.17Å; Q115-V126 WeakPolarHBondContact O-CA 3.36Å; Q115-K127 HydrophobicContact CB-CB 4.49Å; Q115-K127 PolarHBondContact N-O 3.11Å; Q115-K127 PolarHBondContact O-N 3.15Å
116	I	94.9	Very high	90.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.3	172.1	-50.2	179.2	0	0	0	108	E100 F101 M114 V125 V126 L149 I155	E100-I116 CarbonylContact C-O 3.6Å; E100-I116 VanDerWaalsContact CA-O 3.29Å; E100-I116 WeakPolarHBondContact CA-O 3.43Å; F101-I116 HydrophobicContact CB-CB 4.22Å; F101-I116 PolarHBondContact N-O 3.41Å; F101-I116 PolarHBondContact O-N 2.85Å; M114-I116 HydrophobicContact CE-CD1 4.22Å; M114-I116 HydrophobicContact CG-CG1 4.28Å; I116-V125 WeakPolarHBondContact CA-O 3.45Å; I116-V126 HydrophobicContact CG1-CG1 4.45Å; I116-V126 HydrophobicContact CG1-CG2 4.26Å; I116-L149 HydrophobicContact CD1-CD2 4.32Å; I116-L149 HydrophobicContact CG2-CD2 3.34Å; I116-I155 HydrophobicContact CD1-CD1 4.35Å; I116-I155 HydrophobicContact CD1-CG1 4.1Å; I116-I155 HydrophobicContact CD1-CG2 3.86Å
117	F	93.8	Very high	90.5	Very high	42 Å²	42	45.9 Å²	45.9	18%	0.184	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.3	178.9	63.8	-80.7	0	0	0	111.6	T99 E100 Q115 Y124 V125 K127	T99-F117 WeakPolarHBondContact O-CA 3.5Å; E100-F117 HydrophobicContact CB-CB 4.46Å; E100-F117 HydrophobicContact CG-CB 4.12Å; Q115-F117 HydrophobicContact CG-CD1 4.17Å; F117-Y124 CarbonylContact O-C 3.56Å; F117-Y124 WeakPolarHBondContact O-CA 3.49Å; F117-V125 HydrophobicContact CD1-CB 4.38Å; F117-V125 WeakPolarHBondContact CD1-O 3.47Å; F117-V125 HydrophobicContact CE1-CB 3.8Å; F117-V125 HydrophobicContact CE1-CG1 3.71Å; F117-V125 HydrophobicContact CE2-CB 4.03Å; F117-V125 HydrophobicContact CE2-CG1 4.46Å; F117-V125 HydrophobicContact CZ-CB 3.61Å; F117-V125 HydrophobicContact CZ-CG1 3.59Å; F117-V125 HydrophobicContact CZ-CG2 4.38Å; F117-V125 PolarHBondContact N-O 2.73Å; F117-V125 PolarHBondContact O-N 3.36Å; F117-K127 HydrophobicContact CE1-CD 3.86Å; F117-K127 HydrophobicContact CE1-CG 4.07Å; F117-K127 HydrophobicContact CZ-CD 4.45Å
118	E	91.6	Very high	90.9	Very high	46 Å²	46	45.9 Å²	45.9	22%	0.215	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.7	172.8	-172.1	173.3	-113.4	0	0	110.3	F50 T99 S120 P121 S122 Y124	F50-E118 HydrophobicContact CB-CB 4.36Å; F50-E118 VanDerWaalsContact CB-CD 3.44Å; F50-E118 HydrophobicContact CB-CG 4.49Å; F50-E118 WeakPolarHBondContact CB-OE1 3.25Å; F50-E118 VanDerWaalsContact CB-OE2 3.27Å; F50-E118 WeakPolarHBondContact CB-OE2 3.34Å; F50-E118 HydrophobicContact CD1-CB 3.51Å; F50-E118 HydrophobicContact CD1-CG 4.47Å; F50-E118 HydrophobicContact CE1-CB 3.79Å; F50-E118 HydrophobicContact CG-CB 4.04Å; T99-E118 PolarHBondContact O-N 2.89Å; E118-S120 WeakPolarHBondContact CG-O 3.43Å; E118-P121 VanDerWaalsContact OE1-CA 3.3Å; E118-P121 WeakPolarHBondContact OE1-CA 3.36Å; E118-S122 PolarHBondContact OE1-N 3.2Å; E118-Y124 HydrophobicContact CB-CD1 3.91Å; E118-Y124 HydrophobicContact CB-CE1 3.95Å; E118-Y124 HydrophobicContact CG-CD1 4.09Å; E118-Y124 HydrophobicContact CG-CE1 3.88Å; E118-Y124 WeakPolarHBondContact OE1-CE1 3.3Å
119	K	91.7	Very high	91.4	Very high	152 Å²	152	44 Å²	44	66%	0.661	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	-32.4	176.2	179.7	179.6	174	-174	0	112	N123 V125	K119-N123 PolarHBondContact N-O 3.27Å; K119-V125 HydrophobicContact CB-CG2 3.81Å; K119-V125 HydrophobicContact CD-CG2 3.89Å; K119-V125 HydrophobicContact CG-CG2 4.47Å
120	S	88.7	Confident	92	Very high	59 Å²	59	37.7 Å²	37.7	41%	0.413	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	160.7	169.7	59.3	0	0	0	0	108.3	E118 S122 N123	E118-S120 WeakPolarHBondContact CG-O 3.43Å; S120-S122 PolarHBondContact O-N 3.38Å; S120-N123 WeakPolarHBondContact O-CA 3.27Å; S120-N123 WeakPolarHBondContact O-CB 3.28Å; S120-N123 PolarHBondContact O-N 3.38Å; S120-N123 WeakPolarHBondContact OG-CB 3.21Å
121	P	83.6	Confident	92.3	Very high	99 Å²	99	41.9 Å²	41.9	64%	0.643	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.9	122.3	-177.6	-32.7	37.1	0	0	0	113.8	E118 N123	E118-P121 VanDerWaalsContact OE1-CA 3.3Å; E118-P121 WeakPolarHBondContact OE1-CA 3.36Å; P121-N123 PolarHBondContact O-N 3.02Å
122	S	80.1	Confident	92.2	Very high	40 Å²	40	47.1 Å²	47.1	28%	0.28	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	24.2	-176.4	-49.3	0	0	0	0	115.3	E118 S120	E118-S122 PolarHBondContact OE1-N 3.2Å; S120-S122 PolarHBondContact O-N 3.38Å
123	N	89.9	Confident	92.1	Very high	62 Å²	62	51.2 Å²	51.2	33%	0.332	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	99.8	172.5	-167.7	-104.1	0	0	0	110.1	K119 S120 P121 N150	K119-N123 PolarHBondContact N-O 3.27Å; S120-N123 WeakPolarHBondContact O-CA 3.27Å; S120-N123 WeakPolarHBondContact O-CB 3.28Å; S120-N123 PolarHBondContact O-N 3.38Å; S120-N123 WeakPolarHBondContact OG-CB 3.21Å; P121-N123 PolarHBondContact O-N 3.02Å; N123-N150 WeakPolarHBondContact CA-OD1 3.41Å
124	Y	91.9	Very high	92	Very high	13 Å²	13	52.7 Å²	52.7	5%	0.051	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	146.2	-178.3	-51.3	-54.2	0	0	0	110.5	F50 F117 E118 T146 L149 N150	F50-Y124 HydrophobicContact CB-CE1 4.49Å; F50-Y124 HydrophobicContact CD1-CE1 4.32Å; F50-Y124 HydrophobicContact CD2-CD1 4.15Å; F50-Y124 AromaticContact CD2-CE1 3.23Å; F50-Y124 HydrophobicContact CD2-CE1 3.23Å; F50-Y124 AromaticContact CD2-CZ 3.63Å; F50-Y124 WeakPolarHBondContact CD2-OH 3.49Å; F50-Y124 HydrophobicContact CE1-CD1 4.35Å; F50-Y124 HydrophobicContact CE1-CE1 4.25Å; F50-Y124 AromaticContact CE2-CD1 3.67Å; F50-Y124 HydrophobicContact CE2-CD1 3.67Å; F50-Y124 AromaticContact CE2-CE1 3.15Å; F50-Y124 HydrophobicContact CE2-CE1 3.15Å; F50-Y124 HydrophobicContact CE2-CE2 4.5Å; F50-Y124 AromaticContact CE2-CZ 3.64Å; F50-Y124 AromaticContact CG-CE1 3.83Å; F50-Y124 HydrophobicContact CG-CE1 3.83Å; F50-Y124 AromaticContact CZ-CD1 3.75Å; F50-Y124 HydrophobicContact CZ-CD1 3.75Å; F50-Y124 AromaticContact CZ-CE1 3.68Å; F50-Y124 HydrophobicContact CZ-CE1 3.68Å; F117-Y124 CarbonylContact O-C 3.56Å; F117-Y124 WeakPolarHBondContact O-CA 3.49Å; E118-Y124 HydrophobicContact CB-CD1 3.91Å; E118-Y124 HydrophobicContact CB-CE1 3.95Å; E118-Y124 HydrophobicContact CG-CD1 4.09Å; E118-Y124 HydrophobicContact CG-CE1 3.88Å; E118-Y124 WeakPolarHBondContact OE1-CE1 3.3Å; Y124-T146 WeakPolarHBondContact O-CG2 3.39Å; Y124-L149 HydrophobicContact CD2-CD2 4.42Å; Y124-L149 HydrophobicContact CD2-CG 4.33Å; Y124-L149 HydrophobicContact CG-CD2 4.24Å; Y124-N150 PolarHBondContact N-OD1 2.86Å; Y124-N150 PolarHBondContact O-ND2 3.24Å
125	V	96.4	Very high	91.8	Very high	29 Å²	29	59.2 Å²	59.2	18%	0.176	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	129.1	172.6	176.3	0	0	0	0	108.1	I116 F117 K119	I116-V125 WeakPolarHBondContact CA-O 3.45Å; F117-V125 HydrophobicContact CD1-CB 4.38Å; F117-V125 WeakPolarHBondContact CD1-O 3.47Å; F117-V125 HydrophobicContact CE1-CB 3.8Å; F117-V125 HydrophobicContact CE1-CG1 3.71Å; F117-V125 HydrophobicContact CE2-CB 4.03Å; F117-V125 HydrophobicContact CE2-CG1 4.46Å; F117-V125 HydrophobicContact CZ-CB 3.61Å; F117-V125 HydrophobicContact CZ-CG1 3.59Å; F117-V125 HydrophobicContact CZ-CG2 4.38Å; F117-V125 PolarHBondContact N-O 2.73Å; F117-V125 PolarHBondContact O-N 3.36Å; K119-V125 HydrophobicContact CB-CG2 3.81Å; K119-V125 HydrophobicContact CD-CG2 3.89Å; K119-V125 HydrophobicContact CG-CG2 4.47Å
126	V	96.4	Very high	91.5	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.4	171.1	-173.1	0	0	0	0	107.9	M114 Q115 I116 T128 L145 T146 L149 T158	M114-V126 HydrophobicContact CG-CG1 3.6Å; M114-V126 HydrophobicContact SD-CG1 3.71Å; Q115-V126 WeakPolarHBondContact O-CA 3.36Å; I116-V126 HydrophobicContact CG1-CG1 4.45Å; I116-V126 HydrophobicContact CG1-CG2 4.26Å; V126-T128 HydrophobicContact CG1-CG2 4.44Å; V126-L145 HydrophobicContact CB-CB 3.96Å; V126-L145 HydrophobicContact CG1-CB 3.83Å; V126-L145 HydrophobicContact CG1-CD1 4.01Å; V126-L145 HydrophobicContact CG2-CB 4.22Å; V126-T146 PolarHBondContact N-OG1 2.92Å; V126-T146 PolarHBondContact O-OG1 3.29Å; V126-L149 HydrophobicContact CG2-CB 4.12Å; V126-L149 HydrophobicContact CG2-CD2 3.69Å; V126-T158 HydrophobicContact CG2-CG2 4.24Å
127	K	96.4	Very high	91.1	Very high	93 Å²	93	62.8 Å²	62.8	40%	0.404	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.1	163.6	-71.4	174.6	-177.9	171.3	0	108.7	M114 Q115 F117 D142	M114-K127 CarbonylContact C-O 3.55Å; M114-K127 WeakPolarHBondContact CA-O 3.42Å; Q115-K127 HydrophobicContact CB-CB 4.49Å; Q115-K127 PolarHBondContact N-O 3.11Å; Q115-K127 PolarHBondContact O-N 3.15Å; F117-K127 HydrophobicContact CE1-CD 3.86Å; F117-K127 HydrophobicContact CE1-CG 4.07Å; F117-K127 HydrophobicContact CZ-CD 4.45Å; K127-D142 VanDerWaalsContact CA-OD2 3.3Å; K127-D142 WeakPolarHBondContact CA-OD2 3.47Å
128	T	95.3	Very high	91.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	149.6	167.5	62.9	0	0	0	0	109.5	T113 M114 V126 S136 P137 F141 D142 L145	T113-T128 CarbonylContact O-C 3.52Å; T113-T128 VanDerWaalsContact O-CA 3.31Å; T113-T128 WeakPolarHBondContact O-CA 3.41Å; M114-T128 HydrophobicContact CB-CG2 3.99Å; M114-T128 HydrophobicContact CG-CG2 3.88Å; M114-T128 HydrophobicContact SD-CG2 4.33Å; V126-T128 HydrophobicContact CG1-CG2 4.44Å; T128-S136 WeakPolarHBondContact O-CA 2.9Å; T128-S136 VanDerWaalsContact O-CB 3.31Å; T128-S136 WeakPolarHBondContact O-CB 3.32Å; T128-P137 WeakPolarHBondContact OG1-CD 3.46Å; T128-P137 VanDerWaalsContact OG1-CG 3.26Å; T128-P137 WeakPolarHBondContact OG1-CG 3.22Å; T128-F141 HydrophobicContact CG2-CD1 4.5Å; T128-F141 HydrophobicContact CG2-CE1 4Å; T128-D142 WeakPolarHBondContact CB-OD1 3.44Å; T128-D142 PolarHBondContact N-OD1 3.13Å; T128-D142 PolarHBondContact N-OD2 3.32Å; T128-D142 PolarHBondContact OG1-OD1 3.1Å; T128-L145 HydrophobicContact CG2-CD1 3.77Å
129	T	95.4	Very high	91.2	Very high	47 Å²	47	67.4 Å²	67.4	29%	0.288	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	123.8	-173.1	-54.9	0	0	0	0	108.9	T113 G134 E135	T113-T129 PolarHBondContact N-O 3.38Å; T113-T129 PolarHBondContact O-N 3.14Å; T129-G134 WeakPolarHBondContact CG2-O 3.47Å; T129-E135 WeakPolarHBondContact CA-O 3.48Å
130	S	93.4	Very high	91.3	Very high	11 Å²	11	65.4 Å²	65.4	8%	0.077	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	132.9	173	175.5	0	0	0	0	109.5	M112 I132 G134 E135	M112-S130 WeakPolarHBondContact SD-CA 3.48Å; S130-I132 PolarHBondContact O-N 3.03Å; S130-I132 PolarHBondContact OG-N 3.29Å; S130-G134 WeakPolarHBondContact O-CA 3.47Å; S130-G134 PolarHBondContact O-N 2.62Å; S130-E135 PolarHBondContact N-O 3.46Å
131	Q	90.9	Very high	91.5	Very high	96 Å²	96	63.8 Å²	63.8	45%	0.449	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.6	174.1	-61.6	-167.1	-11.3	0	0	112.7	S111 T113	S111-Q131 PolarHBondContact O-N 2.92Å; S111-Q131 PolarHBondContact OG-OE1 3.46Å; T113-Q131 PolarHBondContact OG1-NE2 2.86Å
132	I	88.8	Confident	92.1	Very high	127 Å²	127	59.7 Å²	59.7	65%	0.651	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-41.8	177.6	-57.4	-174.2	0	0	0	111.3	S130	S130-I132 PolarHBondContact O-N 3.03Å; S130-I132 PolarHBondContact OG-N 3.29Å
133	T	91	Very high	92.8	Very high	90 Å²	90	64 Å²	64	55%	0.552	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-23.2	-179.1	64.2	0	0	0	0	113.8	E135	T133-E135 PolarHBondContact O-N 2.88Å; T133-E135 PolarHBondContact OG1-N 3.19Å; T133-E135 VanDerWaalsContact OG1-N 3.12Å
134	G	90.9	Very high	93.1	Very high	59 Å²	59	63.4 Å²	63.4	61%	0.608	35%	0.348	S	S	*	.	S	Bend	trans	73	5.5	-167.6	0	0	0	0	0	114	T129 S130	T129-G134 WeakPolarHBondContact CG2-O 3.47Å; S130-G134 WeakPolarHBondContact O-CA 3.47Å; S130-G134 PolarHBondContact O-N 2.62Å
135	E	90.3	Very high	93.3	Very high	136 Å²	136	62.8 Å²	62.8	64%	0.636	35%	0.346	S	S	*	.	S	Bend	trans	-114.2	156.3	-174.6	-62.2	-173	146.1	0	0	112.4	T129 S130 T133	T129-E135 WeakPolarHBondContact CA-O 3.48Å; S130-E135 PolarHBondContact N-O 3.46Å; T133-E135 PolarHBondContact O-N 2.88Å; T133-E135 PolarHBondContact OG1-N 3.19Å; T133-E135 VanDerWaalsContact OG1-N 3.12Å
136	S	90	Very high	93.3	Very high	51 Å²	51	62.7 Å²	62.7	36%	0.357	35%	0.345	S	S	.	.			trans	-69.4	142.3	168.8	58.9	0	0	0	0	111.2	T128 S138	T128-S136 WeakPolarHBondContact O-CA 2.9Å; T128-S136 VanDerWaalsContact O-CB 3.31Å; T128-S136 WeakPolarHBondContact O-CB 3.32Å; S136-S138 VanDerWaalsContact C-N 3.28Å; S136-S138 PolarHBondContact O-N 3.46Å
137	P	87.2	Confident	93.2	Very high	66 Å²	66	69 Å²	69	43%	0.429	38%	0.375	S	S	.	.	S	Bend	trans	-67.2	-31.8	-178.2	31.3	-35	0	0	0	111.8	M112 T128 F141 L166	M112-P137 HydrophobicContact CE-CB 3.73Å; M112-P137 VanDerWaalsContact CE-CD 3.42Å; M112-P137 HydrophobicContact CE-CG 3.37Å; T128-P137 WeakPolarHBondContact OG1-CD 3.46Å; T128-P137 VanDerWaalsContact OG1-CG 3.26Å; T128-P137 WeakPolarHBondContact OG1-CG 3.22Å; P137-F141 HydrophobicContact CG-CD1 3.62Å; P137-F141 HydrophobicContact CG-CE1 4.15Å; P137-F141 HydrophobicContact CG-CG 4.41Å; P137-L166 HydrophobicContact CB-CD2 4.22Å; P137-L166 HydrophobicContact CG-CD2 4.06Å
138	S	92.3	Very high	93	Very high	48 Å²	48	68 Å²	68	34%	0.336	37%	0.37	S	S	.	.			trans	-165.6	143	165.7	173.3	0	0	0	0	109.5	S136 D140 F141 D142	S136-S138 VanDerWaalsContact C-N 3.28Å; S136-S138 PolarHBondContact O-N 3.46Å; S138-D140 VanDerWaalsContact C-N 3.25Å; S138-D140 PolarHBondContact O-N 3.22Å; S138-D140 PolarHBondContact OG-N 3.18Å; S138-D140 VanDerWaalsContact OG-N 3.14Å; S138-F141 WeakPolarHBondContact O-CB 3.49Å; S138-F141 PolarHBondContact O-N 3.3Å; S138-D142 PolarHBondContact O-N 3.04Å
139	L	93.5	Very high	92.9	Very high	136 Å²	136	68.1 Å²	68.1	71%	0.712	37%	0.371	S	S	*	.	H	α-helix	trans	-61.9	-35.2	171.3	-172.7	72.7	0	0	0	111.7	F141 K143	L139-F141 VanDerWaalsContact C-N 3.28Å; L139-F141 PolarHBondContact O-N 3.14Å; L139-K143 VanDerWaalsContact O-CB 3.26Å; L139-K143 WeakPolarHBondContact O-CB 3.45Å; L139-K143 PolarHBondContact O-N 3.05Å
140	D	94.8	Very high	92.8	Very high	111 Å²	111	67.7 Å²	67.7	59%	0.594	37%	0.367	S	S	*	.	H	α-helix	trans	-70.1	-27.6	177.7	-70	-51.5	0	0	0	112	S138 M144	S138-D140 VanDerWaalsContact C-N 3.25Å; S138-D140 PolarHBondContact O-N 3.22Å; S138-D140 PolarHBondContact OG-N 3.18Å; S138-D140 VanDerWaalsContact OG-N 3.14Å; D140-M144 VanDerWaalsContact O-CB 3.26Å; D140-M144 WeakPolarHBondContact O-CB 3.46Å; D140-M144 PolarHBondContact O-N 3.41Å
141	F	92.9	Very high	92.8	Very high	25 Å²	25	71 Å²	71	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-72.9	-48	175.6	179.4	-106	0	0	0	111.5	T128 P137 S138 L139 K143 M144 L145 A162 D165 L166	T128-F141 HydrophobicContact CG2-CD1 4.5Å; T128-F141 HydrophobicContact CG2-CE1 4Å; P137-F141 HydrophobicContact CG-CD1 3.62Å; P137-F141 HydrophobicContact CG-CE1 4.15Å; P137-F141 HydrophobicContact CG-CG 4.41Å; S138-F141 WeakPolarHBondContact O-CB 3.49Å; S138-F141 PolarHBondContact O-N 3.3Å; L139-F141 VanDerWaalsContact C-N 3.28Å; L139-F141 PolarHBondContact O-N 3.14Å; F141-K143 VanDerWaalsContact C-N 3.26Å; F141-K143 PolarHBondContact O-N 3.39Å; F141-M144 HydrophobicContact CD2-CE 3.71Å; F141-M144 HydrophobicContact CE2-CE 3.69Å; F141-M144 WeakPolarHBondContact O-CB 3.38Å; F141-M144 PolarHBondContact O-N 3.5Å; F141-M144 VanDerWaalsContact O-N 3.08Å; F141-L145 HydrophobicContact CD1-CD1 4.12Å; F141-L145 HydrophobicContact CE1-CD1 3.5Å; F141-L145 VanDerWaalsContact CE1-CD1 3.5Å; F141-L145 HydrophobicContact CE1-CG 4.2Å; F141-L145 HydrophobicContact CE2-CD1 4.34Å; F141-L145 HydrophobicContact CE2-CD2 4.37Å; F141-L145 HydrophobicContact CE2-CG 4.27Å; F141-L145 HydrophobicContact CZ-CD1 3.64Å; F141-L145 HydrophobicContact CZ-CD2 4.28Å; F141-L145 HydrophobicContact CZ-CG 4.05Å; F141-L145 PolarHBondContact O-N 3.22Å; F141-A162 HydrophobicContact CZ-CB 4.39Å; F141-D165 HydrophobicContact CD2-CB 4.48Å; F141-D165 HydrophobicContact CE2-CB 3.67Å; F141-D165 HydrophobicContact CZ-CB 4.43Å; F141-L166 HydrophobicContact CD1-CD2 4.41Å; F141-L166 HydrophobicContact CE1-CD1 3.82Å; F141-L166 HydrophobicContact CE1-CD2 3.74Å; F141-L166 HydrophobicContact CE1-CG 3.78Å; F141-L166 HydrophobicContact CE2-CG 4.46Å; F141-L166 HydrophobicContact CZ-CD1 3.87Å; F141-L166 HydrophobicContact CZ-CD2 3.88Å; F141-L166 HydrophobicContact CZ-CG 3.54Å
142	D	95.6	Very high	92.6	Very high	13 Å²	13	68.9 Å²	68.9	7%	0.07	38%	0.384	C	S	.	.	H	α-helix	trans	-59	-39.4	173.2	-79	4.4	0	0	0	111.9	K127 T128 S138 T146	K127-D142 VanDerWaalsContact CA-OD2 3.3Å; K127-D142 WeakPolarHBondContact CA-OD2 3.47Å; T128-D142 WeakPolarHBondContact CB-OD1 3.44Å; T128-D142 PolarHBondContact N-OD1 3.13Å; T128-D142 PolarHBondContact N-OD2 3.32Å; T128-D142 PolarHBondContact OG1-OD1 3.1Å; S138-D142 PolarHBondContact O-N 3.04Å; D142-T146 WeakPolarHBondContact O-CB 3.43Å; D142-T146 PolarHBondContact O-N 3.31Å; D142-T146 PolarHBondContact O-OG1 3.1Å
143	K	96	Very high	92.5	Very high	129 Å²	129	68.1 Å²	68.1	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-63.9	-43.1	172.6	-178.8	-173.6	170.3	-165	0	112.2	L139 F141 T146 E147	L139-K143 VanDerWaalsContact O-CB 3.26Å; L139-K143 WeakPolarHBondContact O-CB 3.45Å; L139-K143 PolarHBondContact O-N 3.05Å; F141-K143 VanDerWaalsContact C-N 3.26Å; F141-K143 PolarHBondContact O-N 3.39Å; K143-T146 WeakPolarHBondContact O-CB 3.34Å; K143-T146 PolarHBondContact O-N 3.46Å; K143-E147 WeakPolarHBondContact O-CB 3.43Å; K143-E147 PolarHBondContact O-N 3.36Å
144	M	95.7	Very high	92.1	Very high	51 Å²	51	64.9 Å²	64.9	25%	0.251	35%	0.354	S	S	.	.	H	α-helix	trans	-64.3	-45.9	177.5	-178.2	-80.4	-67.8	0	0	111.4	D140 F141 T146 E147 K148 D165	D140-M144 VanDerWaalsContact O-CB 3.26Å; D140-M144 WeakPolarHBondContact O-CB 3.46Å; D140-M144 PolarHBondContact O-N 3.41Å; F141-M144 HydrophobicContact CD2-CE 3.71Å; F141-M144 HydrophobicContact CE2-CE 3.69Å; F141-M144 WeakPolarHBondContact O-CB 3.38Å; F141-M144 PolarHBondContact O-N 3.5Å; F141-M144 VanDerWaalsContact O-N 3.08Å; M144-T146 VanDerWaalsContact C-N 3.33Å; M144-T146 PolarHBondContact O-N 2.88Å; M144-E147 PolarHBondContact O-N 3.09Å; M144-K148 WeakPolarHBondContact O-CG 3.43Å; M144-K148 PolarHBondContact O-N 3.3Å; M144-K148 HydrophobicContact SD-CG 3.8Å; M144-D165 WeakPolarHBondContact CE-OD2 3.15Å
145	L	95.2	Very high	91.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-38.3	174.1	-65.6	-176.6	0	0	0	112	M114 V126 T128 F141 K148 L149 T158 F161 A162	M114-L145 HydrophobicContact SD-CD1 4.16Å; V126-L145 HydrophobicContact CB-CB 3.96Å; V126-L145 HydrophobicContact CG1-CB 3.83Å; V126-L145 HydrophobicContact CG1-CD1 4.01Å; V126-L145 HydrophobicContact CG2-CB 4.22Å; T128-L145 HydrophobicContact CG2-CD1 3.77Å; F141-L145 HydrophobicContact CD1-CD1 4.12Å; F141-L145 HydrophobicContact CE1-CD1 3.5Å; F141-L145 VanDerWaalsContact CE1-CD1 3.5Å; F141-L145 HydrophobicContact CE1-CG 4.2Å; F141-L145 HydrophobicContact CE2-CD1 4.34Å; F141-L145 HydrophobicContact CE2-CD2 4.37Å; F141-L145 HydrophobicContact CE2-CG 4.27Å; F141-L145 HydrophobicContact CZ-CD1 3.64Å; F141-L145 HydrophobicContact CZ-CD2 4.28Å; F141-L145 HydrophobicContact CZ-CG 4.05Å; F141-L145 PolarHBondContact O-N 3.22Å; L145-K148 PolarHBondContact O-N 2.96Å; L145-L149 WeakPolarHBondContact O-CB 3.43Å; L145-L149 PolarHBondContact O-N 3.42Å; L145-T158 HydrophobicContact CB-CG2 4.06Å; L145-T158 HydrophobicContact CD2-CG2 4.18Å; L145-F161 HydrophobicContact CD2-CB 3.92Å; L145-A162 HydrophobicContact CD1-CB 3.79Å; L145-A162 HydrophobicContact CD2-CB 3.95Å
146	T	96.2	Very high	91.1	Very high	27 Å²	27	59.8 Å²	59.8	17%	0.166	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-44.8	172.5	-66.8	0	0	0	0	111.7	Y124 V126 D142 K143 M144 L149 N150	Y124-T146 WeakPolarHBondContact O-CG2 3.39Å; V126-T146 PolarHBondContact N-OG1 2.92Å; V126-T146 PolarHBondContact O-OG1 3.29Å; D142-T146 WeakPolarHBondContact O-CB 3.43Å; D142-T146 PolarHBondContact O-N 3.31Å; D142-T146 PolarHBondContact O-OG1 3.1Å; K143-T146 WeakPolarHBondContact O-CB 3.34Å; K143-T146 PolarHBondContact O-N 3.46Å; M144-T146 VanDerWaalsContact C-N 3.33Å; M144-T146 PolarHBondContact O-N 2.88Å; T146-L149 PolarHBondContact O-N 3.12Å; T146-N150 PolarHBondContact O-N 3.12Å; T146-N150 PolarHBondContact O-ND2 2.91Å
147	E	95.2	Very high	90.6	Very high	134 Å²	134	58.6 Å²	58.6	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-66.7	-40.2	177.1	-169	176.5	150.4	0	0	111.5	K143 M144 S151	K143-E147 WeakPolarHBondContact O-CB 3.43Å; K143-E147 PolarHBondContact O-N 3.36Å; M144-E147 PolarHBondContact O-N 3.09Å; E147-S151 VanDerWaalsContact O-CB 3.28Å; E147-S151 WeakPolarHBondContact O-CB 3.33Å; E147-S151 PolarHBondContact O-N 3.04Å; E147-S151 PolarHBondContact O-OG 2.89Å
148	K	93.4	Very high	90.5	Very high	71 Å²	71	55.5 Å²	55.5	31%	0.309	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-45.6	172.2	-72.1	-59.1	-172	-173.2	0	112.5	M144 L145 S151 T152 F161	M144-K148 WeakPolarHBondContact O-CG 3.43Å; M144-K148 PolarHBondContact O-N 3.3Å; M144-K148 HydrophobicContact SD-CG 3.8Å; L145-K148 PolarHBondContact O-N 2.96Å; K148-S151 WeakPolarHBondContact CA-OG 3.44Å; K148-S151 PolarHBondContact O-N 3.13Å; K148-S151 PolarHBondContact O-OG 3.42Å; K148-T152 WeakPolarHBondContact O-CB 3.41Å; K148-T152 WeakPolarHBondContact O-CG2 3.36Å; K148-T152 PolarHBondContact O-N 3.41Å; K148-T152 PolarHBondContact O-OG1 2.72Å; K148-F161 HydrophobicContact CB-CD2 4.24Å; K148-F161 HydrophobicContact CD-CD2 3.98Å; K148-F161 HydrophobicContact CD-CE2 3.7Å; K148-F161 HydrophobicContact CD-CZ 4.03Å; K148-F161 HydrophobicContact CG-CD2 3.84Å; K148-F161 HydrophobicContact CG-CE2 4.11Å; K148-F161 HydrophobicContact CG-CG 4.24Å
149	L	93.1	Very high	90.1	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-64.3	-44.6	179.4	-174.9	60.4	0	0	0	112.2	I116 Y124 V126 L145 T146 S151 W153 I155 T158	I116-L149 HydrophobicContact CD1-CD2 4.32Å; I116-L149 HydrophobicContact CG2-CD2 3.34Å; Y124-L149 HydrophobicContact CD2-CD2 4.42Å; Y124-L149 HydrophobicContact CD2-CG 4.33Å; Y124-L149 HydrophobicContact CG-CD2 4.24Å; V126-L149 HydrophobicContact CG2-CB 4.12Å; V126-L149 HydrophobicContact CG2-CD2 3.69Å; L145-L149 WeakPolarHBondContact O-CB 3.43Å; L145-L149 PolarHBondContact O-N 3.42Å; T146-L149 PolarHBondContact O-N 3.12Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.43Å; L149-W153 WeakPolarHBondContact O-CA 3.48Å; L149-W153 PolarHBondContact O-N 3.08Å; L149-I155 HydrophobicContact CD1-CG1 3.9Å; L149-T158 WeakPolarHBondContact CA-OG1 3.4Å; L149-T158 HydrophobicContact CB-CG2 4.15Å
150	N	93	Very high	89.7	Confident	38 Å²	38	50.5 Å²	50.5	20%	0.203	26%	0.264	C	S	.	.	H	α-helix	trans	-75.7	-16.4	179.4	-67.1	-73.3	0	0	0	114	N123 Y124 T146 W153	N123-N150 WeakPolarHBondContact CA-OD1 3.41Å; Y124-N150 PolarHBondContact N-OD1 2.86Å; Y124-N150 PolarHBondContact O-ND2 3.24Å; T146-N150 PolarHBondContact O-N 3.12Å; T146-N150 PolarHBondContact O-ND2 2.91Å; N150-W153 VanDerWaalsContact O-CD1 3.25Å; N150-W153 PolarHBondContact O-NE1 3.12Å
151	S	91.9	Very high	89.2	Confident	81 Å²	81	48.9 Å²	48.9	57%	0.566	25%	0.252	S	S	*	.	H	α-helix	trans	-93.7	-31.6	174.7	55.7	0	0	0	0	113.4	E147 K148 L149	E147-S151 VanDerWaalsContact O-CB 3.28Å; E147-S151 WeakPolarHBondContact O-CB 3.33Å; E147-S151 PolarHBondContact O-N 3.04Å; E147-S151 PolarHBondContact O-OG 2.89Å; K148-S151 WeakPolarHBondContact CA-OG 3.44Å; K148-S151 PolarHBondContact O-N 3.13Å; K148-S151 PolarHBondContact O-OG 3.42Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-S151 PolarHBondContact O-N 3.43Å
152	T	87.9	Confident	88.9	Confident	50 Å²	50	47.7 Å²	47.7	31%	0.307	25%	0.247	S	C	.	.	H	α-helix	trans	-97	-21.6	179.1	61.5	0	0	0	0	114.1	K148 S154	K148-T152 WeakPolarHBondContact O-CB 3.41Å; K148-T152 WeakPolarHBondContact O-CG2 3.36Å; K148-T152 PolarHBondContact O-N 3.41Å; K148-T152 PolarHBondContact O-OG1 2.72Å; T152-S154 PolarHBondContact O-N 3.42Å; T152-S154 VanDerWaalsContact O-N 3.1Å; T152-S154 PolarHBondContact OG1-N 3.2Å
153	W	85.8	Confident	88.4	Confident	111 Å²	111	49 Å²	49	42%	0.42	25%	0.254	S	S	.	.			trans	55.8	20.2	-171.6	-67.3	50.5	0	0	0	113.3	Y46 L149 N150	Y46-W153 HydrophobicContact CD1-CB 4.49Å; L149-W153 WeakPolarHBondContact O-CA 3.48Å; L149-W153 PolarHBondContact O-N 3.08Å; N150-W153 VanDerWaalsContact O-CD1 3.25Å; N150-W153 PolarHBondContact O-NE1 3.12Å
154	S	83.7	Confident	87.8	Confident	22 Å²	22	47.4 Å²	47.4	15%	0.154	26%	0.255	C	S	.	.			trans	-124.3	113	-170.5	178.6	0	0	0	0	111.5	T152 A157 T158	T152-S154 PolarHBondContact O-N 3.42Å; T152-S154 VanDerWaalsContact O-N 3.1Å; T152-S154 PolarHBondContact OG1-N 3.2Å; S154-A157 PolarHBondContact O-N 3.28Å; S154-A157 PolarHBondContact OG-N 2.76Å; S154-T158 PolarHBondContact O-N 3.15Å; S154-T158 VanDerWaalsContact O-N 3.08Å; S154-T158 PolarHBondContact O-OG1 3.28Å
155	I	81.6	Confident	87.2	Confident	43 Å²	43	49.2 Å²	49.2	22%	0.221	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-45.2	173.1	-63.1	175.1	0	0	0	110.7	F101 L103 I116 L149 A157 T158 L159	F101-I155 HydrophobicContact CD1-CD1 3.9Å; F101-I155 HydrophobicContact CD2-CD1 4.38Å; F101-I155 HydrophobicContact CE1-CD1 3.64Å; F101-I155 HydrophobicContact CE2-CD1 4.15Å; F101-I155 HydrophobicContact CG-CD1 4.28Å; F101-I155 HydrophobicContact CZ-CD1 3.76Å; L103-I155 HydrophobicContact CD1-CG2 4.27Å; I116-I155 HydrophobicContact CD1-CD1 4.35Å; I116-I155 HydrophobicContact CD1-CG1 4.1Å; I116-I155 HydrophobicContact CD1-CG2 3.86Å; L149-I155 HydrophobicContact CD1-CG1 3.9Å; I155-A157 PolarHBondContact O-N 3.31Å; I155-T158 PolarHBondContact O-N 2.87Å; I155-L159 VanDerWaalsContact O-CB 3.32Å; I155-L159 WeakPolarHBondContact O-CB 3.42Å; I155-L159 PolarHBondContact O-N 2.97Å
156	P	79.3	Confident	86.4	Confident	45 Å²	45	49.9 Å²	49.9	29%	0.292	27%	0.269	S	S	.	.	H	α-helix	trans	-56.6	-44.3	174.8	-27.4	36.1	0	0	0	113.5	I76 T158 L159 T160	I76-P156 HydrophobicContact CD1-CB 4.12Å; P156-T158 PolarHBondContact O-N 3.34Å; P156-L159 PolarHBondContact O-N 3.39Å; P156-T160 PolarHBondContact O-N 3.19Å; P156-T160 PolarHBondContact O-OG1 3.07Å
157	A	77.8	Confident	85.6	Confident	27 Å²	27	54 Å²	54	22%	0.223	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-44.5	178	0	0	0	0	0	111.8	S154 I155 L159 T160 F161	S154-A157 PolarHBondContact O-N 3.28Å; S154-A157 PolarHBondContact OG-N 2.76Å; I155-A157 PolarHBondContact O-N 3.31Å; A157-L159 VanDerWaalsContact C-N 3.33Å; A157-L159 PolarHBondContact O-N 2.86Å; A157-T160 WeakPolarHBondContact O-CB 3.31Å; A157-T160 PolarHBondContact O-N 3.17Å; A157-F161 WeakPolarHBondContact O-CD2 3.43Å; A157-F161 PolarHBondContact O-N 2.99Å; A157-F161 VanDerWaalsContact O-N 3.15Å
158	T	86.8	Confident	84.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-42.4	175.8	-54.1	0	0	0	0	111.8	V126 L145 L149 S154 I155 P156 F161 A162	V126-T158 HydrophobicContact CG2-CG2 4.24Å; L145-T158 HydrophobicContact CB-CG2 4.06Å; L145-T158 HydrophobicContact CD2-CG2 4.18Å; L149-T158 WeakPolarHBondContact CA-OG1 3.4Å; L149-T158 HydrophobicContact CB-CG2 4.15Å; S154-T158 PolarHBondContact O-N 3.15Å; S154-T158 VanDerWaalsContact O-N 3.08Å; S154-T158 PolarHBondContact O-OG1 3.28Å; I155-T158 PolarHBondContact O-N 2.87Å; P156-T158 PolarHBondContact O-N 3.34Å; T158-F161 PolarHBondContact O-N 2.91Å; T158-A162 PolarHBondContact O-N 2.92Å
159	L	83.6	Confident	83.1	Confident	22 Å²	22	50.7 Å²	50.7	12%	0.115	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-37.7	175.8	-179.9	63.3	0	0	0	111.8	M92 F105 M114 I155 P156 A157 F161 A162 I163	M92-L159 HydrophobicContact CE-CD2 4.36Å; M92-L159 HydrophobicContact SD-CD1 4.26Å; M92-L159 HydrophobicContact SD-CD2 3.94Å; M92-L159 HydrophobicContact SD-CG 4.5Å; F105-L159 HydrophobicContact CD1-CD1 4.45Å; F105-L159 HydrophobicContact CE1-CD1 4.24Å; M114-L159 HydrophobicContact CE-CB 4.33Å; M114-L159 HydrophobicContact CE-CD1 3.72Å; I155-L159 VanDerWaalsContact O-CB 3.32Å; I155-L159 WeakPolarHBondContact O-CB 3.42Å; I155-L159 PolarHBondContact O-N 2.97Å; P156-L159 PolarHBondContact O-N 3.39Å; A157-L159 VanDerWaalsContact C-N 3.33Å; A157-L159 PolarHBondContact O-N 2.86Å; L159-F161 PolarHBondContact O-N 3.23Å; L159-A162 PolarHBondContact O-N 3.24Å; L159-I163 HydrophobicContact CD1-CD1 3.87Å; L159-I163 HydrophobicContact CD1-CG1 4.03Å; L159-I163 HydrophobicContact CD2-CD1 4.43Å; L159-I163 HydrophobicContact CG-CD1 3.76Å; L159-I163 HydrophobicContact CG-CG1 4.31Å; L159-I163 WeakPolarHBondContact O-CB 3.39Å; L159-I163 VanDerWaalsContact O-CG1 3.29Å; L159-I163 WeakPolarHBondContact O-CG1 3.43Å; L159-I163 PolarHBondContact O-N 2.95Å
160	T	83.8	Confident	81.5	Confident	57 Å²	57	54.5 Å²	54.5	35%	0.35	29%	0.285	S	S	.	.	H	α-helix	trans	-61.9	-42.2	173.7	-52.5	0	0	0	0	112	P156 A157 T164	P156-T160 PolarHBondContact O-N 3.19Å; P156-T160 PolarHBondContact O-OG1 3.07Å; A157-T160 WeakPolarHBondContact O-CB 3.31Å; A157-T160 PolarHBondContact O-N 3.17Å; T160-T164 WeakPolarHBondContact O-CB 3.18Å; T160-T164 PolarHBondContact O-N 3.37Å; T160-T164 VanDerWaalsContact O-N 3.09Å; T160-T164 PolarHBondContact O-OG1 3.49Å
161	F	85.2	Confident	79.5	Confident	78 Å²	78	56.4 Å²	56.4	34%	0.342	30%	0.296	S	S	.	.	H	α-helix	trans	-61.4	-46.8	171.6	-72.2	-71	0	0	0	111.1	L145 K148 A157 T158 L159 I163 T164 D165	L145-F161 HydrophobicContact CD2-CB 3.92Å; K148-F161 HydrophobicContact CB-CD2 4.24Å; K148-F161 HydrophobicContact CD-CD2 3.98Å; K148-F161 HydrophobicContact CD-CE2 3.7Å; K148-F161 HydrophobicContact CD-CZ 4.03Å; K148-F161 HydrophobicContact CG-CD2 3.84Å; K148-F161 HydrophobicContact CG-CE2 4.11Å; K148-F161 HydrophobicContact CG-CG 4.24Å; A157-F161 WeakPolarHBondContact O-CD2 3.43Å; A157-F161 PolarHBondContact O-N 2.99Å; A157-F161 VanDerWaalsContact O-N 3.15Å; T158-F161 PolarHBondContact O-N 2.91Å; L159-F161 PolarHBondContact O-N 3.23Å; F161-I163 PolarHBondContact O-N 2.91Å; F161-T164 PolarHBondContact O-N 3.3Å; F161-D165 PolarHBondContact O-N 3Å; F161-D165 VanDerWaalsContact O-N 3.09Å
162	A	86	Confident	77	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-47.2	-179.3	0	0	0	0	0	112.7	F105 M114 F141 L145 T158 L159 T164 L166	F105-A162 HydrophobicContact CZ-CB 4.49Å; M114-A162 HydrophobicContact SD-CB 4.17Å; F141-A162 HydrophobicContact CZ-CB 4.39Å; L145-A162 HydrophobicContact CD1-CB 3.79Å; L145-A162 HydrophobicContact CD2-CB 3.95Å; T158-A162 PolarHBondContact O-N 2.92Å; L159-A162 PolarHBondContact O-N 3.24Å; A162-T164 PolarHBondContact O-N 3.48Å; A162-L166 VanDerWaalsContact O-CB 3.24Å; A162-L166 WeakPolarHBondContact O-CB 3.36Å; A162-L166 WeakPolarHBondContact O-CD1 3.23Å; A162-L166 VanDerWaalsContact O-CG 3.25Å; A162-L166 WeakPolarHBondContact O-CG 3.28Å; A162-L166 PolarHBondContact O-N 3.06Å; A162-L166 VanDerWaalsContact O-N 3.09Å
163	I	84.8	Confident	74.5	Confident	40 Å²	40	56.4 Å²	56.4	21%	0.205	29%	0.294	C	S	.	.	H	α-helix	trans	-64.5	-39.3	179.5	-71.8	173.8	0	0	0	111.9	V90 M92 L159 F161 K167 C168	V90-I163 HydrophobicContact CG2-CG2 4.18Å; M92-I163 HydrophobicContact CE-CD1 4.48Å; M92-I163 HydrophobicContact SD-CD1 3.98Å; L159-I163 HydrophobicContact CD1-CD1 3.87Å; L159-I163 HydrophobicContact CD1-CG1 4.03Å; L159-I163 HydrophobicContact CD2-CD1 4.43Å; L159-I163 HydrophobicContact CG-CD1 3.76Å; L159-I163 HydrophobicContact CG-CG1 4.31Å; L159-I163 WeakPolarHBondContact O-CB 3.39Å; L159-I163 VanDerWaalsContact O-CG1 3.29Å; L159-I163 WeakPolarHBondContact O-CG1 3.43Å; L159-I163 PolarHBondContact O-N 2.95Å; F161-I163 PolarHBondContact O-N 2.91Å; I163-K167 PolarHBondContact O-N 3.5Å; I163-C168 HydrophobicContact CG2-CB 3.99Å; I163-C168 PolarHBondContact O-N 2.98Å
164	T	83.3	Confident	71.9	Confident	95 Å²	95	56.9 Å²	56.9	58%	0.583	30%	0.304	S	S	*	.	H	α-helix	trans	-68.4	-47	-177.5	-58.2	0	0	0	0	111.7	T160 F161 A162	T160-T164 WeakPolarHBondContact O-CB 3.18Å; T160-T164 PolarHBondContact O-N 3.37Å; T160-T164 VanDerWaalsContact O-N 3.09Å; T160-T164 PolarHBondContact O-OG1 3.49Å; F161-T164 PolarHBondContact O-N 3.3Å; A162-T164 PolarHBondContact O-N 3.48Å
165	D	83.4	Confident	69.4	Low	90 Å²	90	62 Å²	62	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-78.9	-36.4	-174.9	-73.9	-11.1	0	0	0	112.7	F141 M144 F161 K167	F141-D165 HydrophobicContact CD2-CB 4.48Å; F141-D165 HydrophobicContact CE2-CB 3.67Å; F141-D165 HydrophobicContact CZ-CB 4.43Å; M144-D165 WeakPolarHBondContact CE-OD2 3.15Å; F161-D165 PolarHBondContact O-N 3Å; F161-D165 VanDerWaalsContact O-N 3.09Å; D165-K167 VanDerWaalsContact C-N 3.27Å; D165-K167 PolarHBondContact O-N 3.13Å
166	L	79	Confident	66.8	Low	13 Å²	13	65.8 Å²	65.8	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-76	-11	179.7	-68.7	172.1	0	0	0	114.3	F105 T107 Y109 M112 P137 F141 A162	F105-L166 HydrophobicContact CE2-CD1 3.69Å; F105-L166 HydrophobicContact CZ-CD1 3.75Å; T107-L166 HydrophobicContact CG2-CB 3.97Å; T107-L166 HydrophobicContact CG2-CD1 4.43Å; Y109-L166 WeakPolarHBondContact CD2-O 3.28Å; Y109-L166 WeakPolarHBondContact CE2-O 3.19Å; M112-L166 HydrophobicContact CE-CD1 4.39Å; M112-L166 HydrophobicContact CE-CD2 4.07Å; M112-L166 HydrophobicContact CG-CD1 4.13Å; P137-L166 HydrophobicContact CB-CD2 4.22Å; P137-L166 HydrophobicContact CG-CD2 4.06Å; F141-L166 HydrophobicContact CD1-CD2 4.41Å; F141-L166 HydrophobicContact CE1-CD1 3.82Å; F141-L166 HydrophobicContact CE1-CD2 3.74Å; F141-L166 HydrophobicContact CE1-CG 3.78Å; F141-L166 HydrophobicContact CE2-CG 4.46Å; F141-L166 HydrophobicContact CZ-CD1 3.87Å; F141-L166 HydrophobicContact CZ-CD2 3.88Å; F141-L166 HydrophobicContact CZ-CG 3.54Å; A162-L166 VanDerWaalsContact O-CB 3.24Å; A162-L166 WeakPolarHBondContact O-CB 3.36Å; A162-L166 WeakPolarHBondContact O-CD1 3.23Å; A162-L166 VanDerWaalsContact O-CG 3.25Å; A162-L166 WeakPolarHBondContact O-CG 3.28Å; A162-L166 PolarHBondContact O-N 3.06Å; A162-L166 VanDerWaalsContact O-N 3.09Å
167	K	78.8	Confident	64.5	Low	115 Å²	115	68.8 Å²	68.8	50%	0.5	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	70.6	-171	-54	169	-166.8	155.5	0	110.4	D108 Y109 I163 D165	D108-K167 PolarHBondContact N-O 3.48Å; Y109-K167 PolarHBondContact OH-NZ 3.15Å; I163-K167 PolarHBondContact O-N 3.5Å; D165-K167 VanDerWaalsContact C-N 3.27Å; D165-K167 PolarHBondContact O-N 3.13Å
168	C	73.1	Confident	62.3	Low	9 Å²	9	75.1 Å²	75.1	6%	0.061	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-53.3	143.7	174.1	-75.4	0	0	0	0	111.5	V90 F105 D106 I163 I170	V90-C168 HydrophobicContact CG1-CB 3.93Å; V90-C168 HydrophobicContact CG2-CB 3.76Å; F105-C168 WeakPolarHBondContact CD2-SG 3.26Å; F105-C168 VanDerWaalsContact CE2-SG 3.57Å; D106-C168 CarbonylContact O-C 3.54Å; D106-C168 VanDerWaalsContact O-CA 3.3Å; D106-C168 WeakPolarHBondContact O-CA 3.38Å; D106-C168 WeakPolarHBondContact O-CB 3.4Å; I163-C168 HydrophobicContact CG2-CB 3.99Å; I163-C168 PolarHBondContact O-N 2.98Å; C168-I170 WeakPolarHBondContact O-CG1 3.43Å; C168-I170 PolarHBondContact O-N 2.86Å
169	R	63.4	Low	59.3	Low	125 Å²	125	80.7 Å²	80.7	47%	0.472	44%	0.444	S	S	.	.			trans	-72.1	103.2	171.9	-92.5	178.3	-168	170.6	17.1	107.8	D106 T107 D108 N171	D106-R169 HydrophobicContact CB-CB 4.19Å; D106-R169 PolarHBondContact O-N 3.49Å; T107-R169 WeakPolarHBondContact O-CD 3.24Å; T107-R169 PolarHBondContact O-NE 3.13Å; D108-R169 PolarHBondContact O-NH2 2.87Å; D108-R169 IonicContact OD1-NE 2.65Å; R169-N171 PolarHBondContact O-N 2.68Å
170	I	59.3	Low	56.5	Low	83 Å²	83	89.7 Å²	89.7	43%	0.426	48%	0.482	S	S	.	.			trans	-78.5	110.7	179.2	-54	-172.3	0	0	0	107.9	N88 A89 C168 S172	N88-I170 HydrophobicContact CB-CD1 4.1Å; N88-I170 HydrophobicContact CB-CG2 3.33Å; N88-I170 VanDerWaalsContact CG-CG2 3.5Å; A89-I170 CarbonylContact O-C 3.5Å; A89-I170 WeakPolarHBondContact O-CA 3.15Å; C168-I170 WeakPolarHBondContact O-CG1 3.43Å; C168-I170 PolarHBondContact O-N 2.86Å; I170-S172 PolarHBondContact O-N 3.43Å
171	N	52.2	Low	53.7	Low	79 Å²	79	94.7 Å²	94.7	42%	0.422	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	116.3	172.5	-77.9	-31.5	0	0	0	109.3	A89 R169 V173	A89-N171 PolarHBondContact N-O 3.1Å; A89-N171 PolarHBondContact O-N 3.15Å; R169-N171 PolarHBondContact O-N 2.68Å; N171-V173 PolarHBondContact O-N 3.42Å
172	S	38	Very low	51	Low	53 Å²	53	96.1 Å²	96.1	37%	0.371	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	95.9	170.5	172.3	0	0	0	0	109.8	E86 I170 L174	E86-S172 VanDerWaalsContact CD-OG 3.25Å; E86-S172 WeakPolarHBondContact CG-OG 3.28Å; E86-S172 VanDerWaalsContact OE1-CB 3.28Å; E86-S172 WeakPolarHBondContact OE1-CB 3.29Å; E86-S172 PolarHBondContact OE1-OG 2.96Å; I170-S172 PolarHBondContact O-N 3.43Å; S172-L174 VanDerWaalsContact C-N 3.27Å; S172-L174 PolarHBondContact O-N 3.23Å
173	V	36.8	Very low	48.1	Very low	78 Å²	78	102 Å²	102	47%	0.473	57%	0.567	S	S	.	*			trans	-81.9	78.2	173.8	-172.8	0	0	0	0	109.1	A89 N171	A89-V173 HydrophobicContact CB-CG2 3.86Å; N171-V173 PolarHBondContact O-N 3.42Å
174	L	30	Very low	45.3	Very low	121 Å²	121	105.6 Å²	105.6	63%	0.634	60%	0.596	S	S	*	*			trans	-58.8	136.5	166.6	-69.1	175.1	0	0	0	109.8	S172 C176	S172-L174 VanDerWaalsContact C-N 3.27Å; S172-L174 PolarHBondContact O-N 3.23Å; L174-C176 VanDerWaalsContact C-N 3.28Å; L174-C176 PolarHBondContact O-N 3.05Å
175	N	32.2	Very low	42.5	Very low	128 Å²	128	106.7 Å²	106.7	68%	0.684	61%	0.608	S	S	*	*			trans	-72.2	73.3	-174.8	-102.4	-76.6	0	0	0	112.7	V177	N175-V177 PolarHBondContact O-N 3.34Å
176	C	25.8	Very low	39.7	Very low	123 Å²	123	107.3 Å²	107.3	83%	0.831	62%	0.619	S	S	*	*			trans	-76.3	52	174.3	-79.9	0	0	0	0	113.1	L174	L174-C176 VanDerWaalsContact C-N 3.28Å; L174-C176 PolarHBondContact O-N 3.05Å
177	V	32.4	Very low	37.2	Very low	108 Å²	108	112.2 Å²	112.2	66%	0.655	65%	0.646	S	S	*	*			trans	-133.6	58.1	176.6	-163.5	0	0	0	0	111.7	N175	N175-V177 PolarHBondContact O-N 3.34Å
178	I	29.9	Very low	34.7	Very low	160 Å²	160	114 Å²	114	82%	0.821	65%	0.653	S	S	*	*			trans	-143	94.9	157.3	-51.6	178.8	0	0	0	109.3
179	S	24.2	Very low	32.5	Very low	118 Å²	118	120.4 Å²	120.4	83%	0.825	68%	0.682	S	S	*	*			trans	176.7	75.2	148.4	-79.7	0	0	0	0	110.8
180	F	25	Very low	30.7	Very low	211 Å²	211	121.1 Å²	121.1	93%	0.925	69%	0.691	S	S	*	*			trans	-126.3	102.3	155.4	-111.7	-82.9	0	0	0	106.6
181	D	26	Very low	29	Very low	161 Å²	161	123.6 Å²	123.6	86%	0.861	70%	0.7	S	S	*	*			trans	-136.6	131	173.6	-155.8	-9.4	0	0	0	107.8
182	S	27.5	Very low	27.7	Very low	109 Å²	109	125 Å²	125	76%	0.762	71%	0.708	S	S	*	*			trans	-115.1	103.2	-163.6	-68.4	0	0	0	0	111.1
183	S	25	Very low	27	Very low	122 Å²	122	130.8 Å²	130.8	85%	0.853	72%	0.723	S	S	*	*			trans	-144.3	134.9	165.9	61.1	0	0	0	0	111.6
184	S	25.1	Very low	26.4	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	74%	0.737	S	S	*	*			trans	-97.3	145.8	-178.1	49.6	0	0	0	0	111.7
185	S	25	Very low	26.1	Very low	117 Å²	117	134.7 Å²	134.7	82%	0.818	73%	0.733	S	S	*	*				-176.3	161.5	120.7	65.5	0	0	0	0	112
186	S	25.1	Very low	25.7	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	74%	0.74	S	S	*	*			trans	-53.4	169.5	166.3	-37.8	0	0	0	0	112.3
187	D	26.4	Very low	25.6	Very low	117 Å²	117	135.7 Å²	135.7	63%	0.626	74%	0.737	S	S	*	*			cis	-169.2	164.5	36.9	-146.2	-5.5	0	0	0	115.4
188	K	27.3	Very low	25.4	Very low	152 Å²	152	137 Å²	137	66%	0.661	74%	0.74	S	S	*	*			trans	62.8	114.8	151	-77.7	157.4	-177.7	130.7	0	123.5
189	Q	26	Very low	25.3	Very low	143 Å²	143	136.3 Å²	136.3	67%	0.668	74%	0.738	S	S	*	*				84.4	128.6	118.8	-73.6	-168.2	-80.6	0	0	123.6
190	H	25.2	Very low	25.4	Very low	140 Å²	140	138.2 Å²	138.2	65%	0.648	74%	0.739	S	S	*	*			trans	63.9	147	130.9	-74.6	-128.6	0	0	0	119.7
191	Q	23.9	Very low	25.6	Very low	135 Å²	135	133.8 Å²	133.8	63%	0.631	73%	0.73	S	S	*	*			cis	-162.5	162.7	-15	-129	-175.9	-37	0	0	109.6
192	N	25.2	Very low	25.7	Very low	108 Å²	108	134.7 Å²	134.7	58%	0.578	73%	0.729	S	S	*	*			trans	63	123.2	142.4	-68.7	-5	0	0	0	122.5
193	Y	22.8	Very low	25.8	Very low	176 Å²	176	137.1 Å²	137.1	69%	0.69	73%	0.732	S	S	*	*				102.8	110.5	118.7	-89.9	-131.7	0	0	0	121.5
194	W	23.9	Very low	26	Very low	202 Å²	202	138.2 Å²	138.2	77%	0.765	73%	0.726	S	S	*	*				78.5	106.7	121.8	-80	43.9	0	0	0	121
195	S	23.6	Very low	26.3	Very low	78 Å²	78	140.6 Å²	140.6	55%	0.545	72%	0.724	S	S	.	*				92.2	120.2	113.2	-61.6	0	0	0	0	121.4
196	I	24.1	Very low	26.6	Very low	162 Å²	162	140 Å²	140	83%	0.831	72%	0.72	S	S	*	*				52.1	112.1	126.7	-50.4	163.6	0	0	0	117.6
197	S	24.9	Very low	26.8	Very low	110 Å²	110	139.6 Å²	139.6	77%	0.769	72%	0.722	S	S	*	*				178.5	142.5	115.4	-176.3	0	0	0	0	114.1
198	N	27.2	Very low	27	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	73%	0.73	S	S	*	*			trans	-45	147.7	175.2	-56.8	-27.8	0	0	0	118
199	N	27.1	Very low	27.3	Very low	145 Å²	145	141 Å²	141	78%	0.775	74%	0.744	S	S	*	*			trans	29.9	122.1	130.8	-52	-18.2	0	0	0	119.8
200	N	27.8	Very low	27.6	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	76%	0.755	S	S	*	*				-157.3	170.6	111.2	-126.8	-53.2	0	0	0	116.4
201	T	28.8	Very low	27.9	Very low	119 Å²	119	143.6 Å²	143.6	73%	0.73	77%	0.768	S	S	*	*			trans	-86.4	177.1	-168.4	-37.7	0	0	0	0	113
202	Q	28.5	Very low	28.3	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	78%	0.778	S	S	*	*			trans	71.6	125	172.7	-71.5	175.7	-11.8	0	0	115.8
203	L	29.3	Very low	28.5	Very low	160 Å²	160	142 Å²	142	84%	0.838	79%	0.793	S	S	*	*			cis	86.8	125.6	30.4	-165.6	74	0	0	0	114.4
204	M	29.5	Very low	29	Very low	145 Å²	145	143.9 Å²	143.9	71%	0.714	80%	0.804	S	S	*	*			trans	85.6	134	172.8	-68.1	-122.5	76.5	0	0	119.5
205	Q	30.1	Very low	29.2	Very low	167 Å²	167	139.2 Å²	139.2	78%	0.78	80%	0.801	S	S	*	*			trans	68.9	146.9	158	-65.5	169.2	52.3	0	0	117.9
206	S	31.1	Very low	29.7	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	82%	0.816	S	S	*	*			cis	-159.9	159.9	-21.4	60.6	0	0	0	0	112.3
207	A	29.3	Very low	30	Very low	93 Å²	93	143.5 Å²	143.5	77%	0.769	82%	0.816	S	S	*	*			trans	42.9	117.1	152.8	0	0	0	0	0	122.7
208	A	30.8	Very low	30.2	Very low	96 Å²	96	147.6 Å²	147.6	79%	0.793	82%	0.82	S	S	*	*			trans	63.9	119.9	134.5	0	0	0	0	0	122.2
209	Q	34	Very low	30.1	Very low	202 Å²	202	150.8 Å²	150.8	94%	0.944	83%	0.827	S	S	*	*				-156.9	166.8	112.1	-109	179.1	27.9	0	0	112.1
210	K	33.4	Very low	29.9	Very low	209 Å²	209	149.4 Å²	149.4	91%	0.909	82%	0.824	S	S	*	*			trans	-109.9	132.7	-175.2	-63.1	175	-178.7	173.6	0	111.7
211	S	31.5	Very low	29.7	Very low	130 Å²	130	147.4 Å²	147.4	91%	0.909	82%	0.818	S	S	*	*			trans	-153.7	162.2	145.8	63.7	0	0	0	0	109.2
212	A	31.8	Very low	29.5	Very low	104 Å²	104	147.5 Å²	147.5	86%	0.86	82%	0.818	S	S	*	*			trans	-122.7	133.6	-162.3	0	0	0	0	0	113.9
213	A	29.9	Very low	29.2	Very low	106 Å²	106	146.6 Å²	146.6	88%	0.876	82%	0.818	S	S	*	*			trans	-148.9	148.8	162.8	0	0	0	0	0	110.8
214	K	31.6	Very low	28.9	Very low	214 Å²	214	147.7 Å²	147.7	93%	0.93	82%	0.819	S	S	*	*			trans	-81.3	132.3	177.4	-57.4	166.9	-178	172	0	110.1
215	C	29.5	Very low	28.7	Very low	105 Å²	105	147.5 Å²	147.5	71%	0.709	83%	0.825	S	S	*	*			trans	-162.5	131.6	140.5	-158.6	0	0	0	0	112.1
216	T	33.5	Very low	28.5	Very low	139 Å²	139	142.2 Å²	142.2	85%	0.853	82%	0.816	S	S	*	*			trans	-82.9	115.2	167.3	47.3	0	0	0	0	109.8
217	K	30.6	Very low	28.4	Very low	191 Å²	191	143.2 Å²	143.2	83%	0.83	82%	0.82	S	S	*	*			trans	-130.2	136.5	165.3	-76.2	-166.5	173.6	-175.3	0	111.5
218	K	28.9	Very low	28.3	Very low	196 Å²	196	143.4 Å²	143.4	85%	0.852	82%	0.821	S	S	*	*			trans	-69.6	148.2	175.5	-60.2	175.9	-179.8	179.8	0	109.2	V220	K218-V220 PolarHBondContact O-N 3.35Å
219	K	24.4	Very low	28.2	Very low	202 Å²	202	146.6 Å²	146.6	88%	0.878	82%	0.823	S	S	*	*			trans	-72.6	108.6	166	-158.1	177.2	-174	-174.8	0	107.4
220	V	24.1	Very low	28	Very low	116 Å²	116	144.7 Å²	144.7	70%	0.703	81%	0.814	S	S	*	*			trans	-95.2	114	169.5	177.5	0	0	0	0	106.4	K218 V222	K218-V220 PolarHBondContact O-N 3.35Å; V220-V222 HydrophobicContact CG1-CG2 4.15Å
221	T	24.1	Very low	27.8	Very low	117 Å²	117	140.8 Å²	140.8	72%	0.718	81%	0.81	S	S	*	*			trans	-91.3	106.7	165.8	-49.9	0	0	0	0	106.6
222	V	23.1	Very low	27.7	Very low	120 Å²	120	140.7 Å²	140.7	73%	0.727	80%	0.804	S	S	*	*			trans	-76.4	131.1	162.4	178.7	0	0	0	0	106.5	V220	V220-V222 HydrophobicContact CG1-CG2 4.15Å
223	L	22.8	Very low	27.4	Very low	162 Å²	162	144.2 Å²	144.2	85%	0.848	80%	0.803	S	S	*	*			trans	-106.1	141.9	158.6	-155.1	75.7	0	0	0	107.8
224	E	22.9	Very low	27.3	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	80%	0.796	S	S	*	*			trans	-88	132.3	-163.4	-166.4	167.4	-179.6	0	0	111	G226	E224-G226 PolarHBondContact O-N 3.03Å
225	V	25.8	Very low	26.9	Very low	140 Å²	140	141.3 Å²	141.3	85%	0.848	79%	0.786	S	S	*	*			trans	-85	112.7	175.8	176	0	0	0	0	108.2
226	G	26	Very low	26.8	Very low	57 Å²	57	145.8 Å²	145.8	59%	0.588	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-61.4	155.3	172.4	0	0	0	0	0	112.2	E224	E224-G226 PolarHBondContact O-N 3.03Å
227	P	27.6	Very low	26.4	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.1	155.4	-168.3	28.7	-36.1	0	0	0	113.5
228	A	28.2	Very low	26.3	Very low	96 Å²	96	146 Å²	146	79%	0.793	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.9	139.7	172.6	0	0	0	0	0	111.4	E230	A228-E230 PolarHBondContact O-N 3.12Å
229	I	28.8	Very low	26.4	Very low	164 Å²	164	143.2 Å²	143.2	84%	0.841	77%	0.774	S	S	*	*			trans	-82	109.4	169.6	-61.1	174.8	0	0	0	107.6
230	E	28.6	Very low	26.8	Very low	162 Å²	162	140.6 Å²	140.6	76%	0.757	77%	0.77	S	S	*	*			trans	-71.4	127.4	169.6	-69	-169	150.2	0	0	110.3	A228 T232	A228-E230 PolarHBondContact O-N 3.12Å; E230-T232 PolarHBondContact O-N 3.5Å
231	P	30.4	Very low	27.1	Very low	127 Å²	127	142 Å²	142	83%	0.825	77%	0.774	S	S	*	*			trans	-73	100.1	178	29.2	-33.6	0	0	0	110.4
232	T	29.5	Very low	27.7	Very low	127 Å²	127	145 Å²	145	78%	0.779	78%	0.779	S	S	*	*			trans	-88.4	134	175.6	7	0	0	0	0	111.6	E230	E230-T232 PolarHBondContact O-N 3.5Å
233	Q	26	Very low	28.5	Very low	178 Å²	178	148 Å²	148	83%	0.832	79%	0.786	S	S	*	*			trans	70	97.1	-179.2	-55.4	-170	7.5	0	0	116.9
234	L	27.5	Very low	29.1	Very low	140 Å²	140	148.2 Å²	148.2	73%	0.733	78%	0.78	S	S	*	*			trans	-62.8	136	141.6	-85.2	73.5	0	0	0	108.8	Y236	L234-Y236 HydrophobicContact CD2-CD2 4.1Å; L234-Y236 HydrophobicContact CD2-CE2 3.64Å
235	V	23.3	Very low	29.6	Very low	120 Å²	120	147.3 Å²	147.3	73%	0.727	78%	0.776	S	S	*	*			trans	-101.5	110.8	157.9	177.6	0	0	0	0	107.8
236	Y	27.1	Very low	29.9	Very low	198 Å²	198	143.2 Å²	143.2	78%	0.776	76%	0.762	S	S	*	*			trans	-91.4	108	166.1	-95.3	-69.9	0	0	0	109.4	L234	L234-Y236 HydrophobicContact CD2-CD2 4.1Å; L234-Y236 HydrophobicContact CD2-CE2 3.64Å
237	T	25.8	Very low	30.4	Very low	132 Å²	132	144.3 Å²	144.3	81%	0.81	76%	0.761	S	S	*	*			trans	-110.8	131.9	150.5	46	0	0	0	0	107.6
238	R	27.2	Very low	30.7	Very low	203 Å²	203	144.4 Å²	144.4	77%	0.766	75%	0.754	S	S	*	*			trans	-130.8	157.5	-178	-155.8	-164.3	-177.8	-145.2	10.5	108.6
239	E	30.9	Very low	31	Very low	137 Å²	137	146.7 Å²	146.7	64%	0.64	75%	0.752	S	S	*	*	S	Bend	trans	83.1	121.8	167.4	-66.7	155.4	-154.1	0	0	115.8
240	N	33.8	Very low	31.3	Very low	147 Å²	147	143 Å²	143	79%	0.786	74%	0.741	S	S	*	*			trans	81.8	79.9	167.2	-45.2	-42.7	0	0	0	118.6
241	D	30.4	Very low	31.5	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	73%	0.732	S	S	*	*			trans	-144.8	74.5	155.8	-99.4	-39.2	0	0	0	109.4
242	E	36.1	Very low	31.9	Very low	180 Å²	180	141.8 Å²	141.8	84%	0.841	73%	0.73	S	S	*	*			trans	-78.5	-17.4	-179.6	-68	-164.1	133.8	0	0	113.4	F244	E242-F244 VanDerWaalsContact C-N 3.3Å; E242-F244 PolarHBondContact O-N 3.03Å
243	E	39.3	Very low	32.1	Very low	184 Å²	184	138.5 Å²	138.5	86%	0.86	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-69.1	-24.1	-174.3	-61	-163.4	144.1	0	0	113.5	Q245 G246	E243-Q245 PolarHBondContact O-N 2.92Å; E243-G246 PolarHBondContact O-N 3.37Å
244	F	34.8	Very low	32.6	Very low	167 Å²	167	138.7 Å²	138.7	73%	0.732	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-76.5	-18.6	-175.8	-120.9	-88.5	0	0	0	114.8	E242 G246	E242-F244 VanDerWaalsContact C-N 3.3Å; E242-F244 PolarHBondContact O-N 3.03Å; F244-G246 VanDerWaalsContact C-N 3.3Å; F244-G246 PolarHBondContact O-N 2.89Å
245	Q	35.4	Very low	33.4	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-73.8	-20.2	176.3	-68.9	-163.3	4.4	0	0	113.3	E243 S247	E243-Q245 PolarHBondContact O-N 2.92Å; Q245-S247 VanDerWaalsContact C-N 3.32Å; Q245-S247 PolarHBondContact O-N 3.06Å
246	G	31.1	Very low	34.4	Very low	54 Å²	54	135.6 Å²	135.6	56%	0.557	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-67.5	-29	178.9	0	0	0	0	0	114.1	E243 F244	E243-G246 PolarHBondContact O-N 3.37Å; F244-G246 VanDerWaalsContact C-N 3.3Å; F244-G246 PolarHBondContact O-N 2.89Å
247	S	36.7	Very low	35.4	Very low	80 Å²	80	130.6 Å²	130.6	56%	0.559	69%	0.693	S	S	*	*	H	α-helix	trans	-75.2	-43.2	-172.4	-165.1	0	0	0	0	113.2	Q245 L249 S250	Q245-S247 VanDerWaalsContact C-N 3.32Å; Q245-S247 PolarHBondContact O-N 3.06Å; S247-L249 PolarHBondContact O-N 2.92Å; S247-S250 WeakPolarHBondContact O-CB 3.45Å; S247-S250 PolarHBondContact O-N 2.94Å; S247-S250 VanDerWaalsContact O-N 3.11Å
248	L	34	Very low	36.5	Very low	129 Å²	129	131.7 Å²	131.7	68%	0.675	68%	0.684	S	S	*	*	H	α-helix	trans	-70.1	-13.8	-175.6	-79.9	167.4	0	0	0	114.9	S251	L248-S251 PolarHBondContact O-OG 3.29Å
249	L	34.4	Very low	37.4	Very low	144 Å²	144	129.1 Å²	129.1	75%	0.754	68%	0.675	S	S	*	*	H	α-helix	trans	-92.3	-18.6	173	-78.1	165.2	0	0	0	113.1	S247	S247-L249 PolarHBondContact O-N 2.92Å
250	S	35	Very low	38.8	Very low	87 Å²	87	126.6 Å²	126.6	61%	0.608	67%	0.669	S	S	*	*	H	α-helix	trans	-74.2	-37.4	179	-162	0	0	0	0	112.2	S247 F252 G253	S247-S250 WeakPolarHBondContact O-CB 3.45Å; S247-S250 PolarHBondContact O-N 2.94Å; S247-S250 VanDerWaalsContact O-N 3.11Å; S250-F252 PolarHBondContact O-N 2.88Å; S250-F252 VanDerWaalsContact O-N 3.11Å; S250-G253 PolarHBondContact O-N 3.25Å
251	S	33.6	Very low	39.6	Very low	83 Å²	83	126.8 Å²	126.8	58%	0.58	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-7.9	-177.9	56.3	0	0	0	0	115.3	L248	L248-S251 PolarHBondContact O-OG 3.29Å
252	F	37.4	Very low	40.4	Very low	179 Å²	179	123.1 Å²	123.1	79%	0.785	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-6.4	170.2	-74.2	-84.1	0	0	0	113.6	S250	S250-F252 PolarHBondContact O-N 2.88Å; S250-F252 VanDerWaalsContact O-N 3.11Å
253	G	34.3	Very low	40.8	Very low	59 Å²	59	117.6 Å²	117.6	61%	0.608	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-17.3	-179.3	0	0	0	0	0	115.2	S250 V255	S250-G253 PolarHBondContact O-N 3.25Å; G253-V255 PolarHBondContact O-N 2.75Å
254	E	35.7	Very low	41	Very low	182 Å²	182	115.3 Å²	115.3	85%	0.85	63%	0.625	S	S	*	*			trans	-80.6	87.1	-174	-160.7	160.5	-131.7	0	0	111.4
255	V	44.5	Very low	41.4	Very low	95 Å²	95	114.6 Å²	114.6	58%	0.576	63%	0.628	S	S	*	*			trans	-71.9	125.8	171.5	178.8	0	0	0	0	108.9	G253 D257 V260	G253-V255 PolarHBondContact O-N 2.75Å; V255-D257 PolarHBondContact O-N 2.92Å; V255-V260 HydrophobicContact CB-CG2 4.44Å; V255-V260 HydrophobicContact CG1-CG2 4.11Å
256	D	45.5	Very low	41.7	Very low	100 Å²	100	110 Å²	110	54%	0.535	62%	0.624	S	S	.	*			trans	-44.4	125.1	175.3	179.1	-1.7	0	0	0	111.7	Y258 Y259 V260	D256-Y258 PolarHBondContact O-N 3.12Å; D256-Y258 VanDerWaalsContact O-N 3.15Å; D256-Y258 VanDerWaalsContact OD1-CB 3.3Å; D256-Y258 WeakPolarHBondContact OD1-CB 3.26Å; D256-Y258 PolarHBondContact OD1-N 3.22Å; D256-Y259 WeakPolarHBondContact O-CA 3.45Å; D256-Y259 VanDerWaalsContact O-CB 3.27Å; D256-Y259 WeakPolarHBondContact O-CB 3.46Å; D256-Y259 PolarHBondContact O-N 3.36Å; D256-V260 PolarHBondContact O-N 2.98Å; D256-V260 VanDerWaalsContact O-N 3.08Å
257	D	46.9	Very low	42	Very low	92 Å²	92	118.7 Å²	118.7	49%	0.492	64%	0.64	S	S	.	*	H	α-helix	trans	-59.8	-23.9	-179	-170.5	32.7	0	0	0	111.8	V255 K261	V255-D257 PolarHBondContact O-N 2.92Å; D257-K261 WeakPolarHBondContact O-CB 3.42Å; D257-K261 WeakPolarHBondContact O-CD 3.36Å; D257-K261 VanDerWaalsContact O-CG 3.24Å; D257-K261 WeakPolarHBondContact O-CG 3.28Å; D257-K261 PolarHBondContact O-N 3.24Å; D257-K261 VanDerWaalsContact O-N 3.07Å; D257-K261 VanDerWaalsContact OD1-CE 3.23Å; D257-K261 WeakPolarHBondContact OD1-CE 3.29Å; D257-K261 IonicContact OD1-NZ 3.25Å; D257-K261 PolarHBondContact OD1-NZ 3.09Å; D257-K261 WeakPolarHBondContact OD2-CE 3.48Å; D257-K261 IonicContact OD2-NZ 2.64Å; D257-K261 PolarHBondContact OD2-NZ 3.14Å
258	Y	49.8	Very low	42.1	Very low	156 Å²	156	121.3 Å²	121.3	61%	0.612	65%	0.653	S	S	*	*	H	α-helix	trans	-64.9	-41.3	167.3	-176.2	-96.9	0	0	0	112.6	D256 K261 T262	D256-Y258 PolarHBondContact O-N 3.12Å; D256-Y258 VanDerWaalsContact O-N 3.15Å; D256-Y258 VanDerWaalsContact OD1-CB 3.3Å; D256-Y258 WeakPolarHBondContact OD1-CB 3.26Å; D256-Y258 PolarHBondContact OD1-N 3.22Å; Y258-K261 PolarHBondContact O-N 2.99Å; Y258-T262 HydrophobicContact CD1-CG2 4.33Å; Y258-T262 HydrophobicContact CD2-CG2 4.37Å; Y258-T262 HydrophobicContact CE1-CG2 3.97Å; Y258-T262 HydrophobicContact CE2-CG2 4.03Å; Y258-T262 WeakPolarHBondContact O-CB 3.21Å; Y258-T262 WeakPolarHBondContact O-CG2 3.25Å; Y258-T262 PolarHBondContact O-N 3.1Å; Y258-T262 PolarHBondContact O-OG1 2.75Å
259	Y	45.1	Very low	42.2	Very low	148 Å²	148	124.2 Å²	124.2	58%	0.58	66%	0.655	S	S	*	*	H	α-helix	trans	-68.7	-37.3	175.8	-113.7	-87.9	0	0	0	111.9	D256 K261 T262 S263	D256-Y259 WeakPolarHBondContact O-CA 3.45Å; D256-Y259 VanDerWaalsContact O-CB 3.27Å; D256-Y259 WeakPolarHBondContact O-CB 3.46Å; D256-Y259 PolarHBondContact O-N 3.36Å; Y259-K261 VanDerWaalsContact C-N 3.27Å; Y259-K261 PolarHBondContact O-N 3.35Å; Y259-T262 PolarHBondContact O-N 3.19Å; Y259-S263 VanDerWaalsContact O-CB 3.23Å; Y259-S263 WeakPolarHBondContact O-CB 3.22Å; Y259-S263 PolarHBondContact O-N 3.45Å
260	V	60	Low	42.3	Very low	85 Å²	85	123 Å²	123	52%	0.515	66%	0.655	S	S	.	*	H	α-helix	trans	-62.3	-35.5	173.1	-179.4	0	0	0	0	111.4	V255 D256	V255-V260 HydrophobicContact CB-CG2 4.44Å; V255-V260 HydrophobicContact CG1-CG2 4.11Å; D256-V260 PolarHBondContact O-N 2.98Å; D256-V260 VanDerWaalsContact O-N 3.08Å
261	K	52.5	Low	42.5	Very low	150 Å²	150	127.5 Å²	127.5	65%	0.652	67%	0.667	S	S	*	*	H	α-helix	trans	-83.6	-25	179.4	-71.9	166	-171.4	166	0	114.6	D257 Y258 Y259	D257-K261 WeakPolarHBondContact O-CB 3.42Å; D257-K261 WeakPolarHBondContact O-CD 3.36Å; D257-K261 VanDerWaalsContact O-CG 3.24Å; D257-K261 WeakPolarHBondContact O-CG 3.28Å; D257-K261 PolarHBondContact O-N 3.24Å; D257-K261 VanDerWaalsContact O-N 3.07Å; D257-K261 VanDerWaalsContact OD1-CE 3.23Å; D257-K261 WeakPolarHBondContact OD1-CE 3.29Å; D257-K261 IonicContact OD1-NZ 3.25Å; D257-K261 PolarHBondContact OD1-NZ 3.09Å; D257-K261 WeakPolarHBondContact OD2-CE 3.48Å; D257-K261 IonicContact OD2-NZ 2.64Å; D257-K261 PolarHBondContact OD2-NZ 3.14Å; Y258-K261 PolarHBondContact O-N 2.99Å; Y259-K261 VanDerWaalsContact C-N 3.27Å; Y259-K261 PolarHBondContact O-N 3.35Å
262	T	47.3	Very low	42.8	Very low	69 Å²	69	129.2 Å²	129.2	42%	0.423	68%	0.676	S	S	.	*	H	α-helix	trans	-106	-16.7	-175.4	56.4	0	0	0	0	115	Y258 Y259 T264	Y258-T262 HydrophobicContact CD1-CG2 4.33Å; Y258-T262 HydrophobicContact CD2-CG2 4.37Å; Y258-T262 HydrophobicContact CE1-CG2 3.97Å; Y258-T262 HydrophobicContact CE2-CG2 4.03Å; Y258-T262 WeakPolarHBondContact O-CB 3.21Å; Y258-T262 WeakPolarHBondContact O-CG2 3.25Å; Y258-T262 PolarHBondContact O-N 3.1Å; Y258-T262 PolarHBondContact O-OG1 2.75Å; Y259-T262 PolarHBondContact O-N 3.19Å; T262-T264 PolarHBondContact O-N 2.74Å; T262-T264 VanDerWaalsContact O-N 3.17Å
263	S	43.7	Very low	42.8	Very low	63 Å²	63	132 Å²	132	44%	0.441	68%	0.681	S	S	.	*			trans	-72.7	108.3	178.4	-174.5	0	0	0	0	112.5	Y259 I265	Y259-S263 VanDerWaalsContact O-CB 3.23Å; Y259-S263 WeakPolarHBondContact O-CB 3.22Å; Y259-S263 PolarHBondContact O-N 3.45Å; S263-I265 PolarHBondContact O-N 3.35Å; S263-I265 PolarHBondContact OG-N 3.02Å
264	T	44.2	Very low	43	Very low	136 Å²	136	135.1 Å²	135.1	83%	0.834	69%	0.691	S	S	*	*			trans	-81.1	-1	170.2	54.3	0	0	0	0	113.2	T262 G266	T262-T264 PolarHBondContact O-N 2.74Å; T262-T264 VanDerWaalsContact O-N 3.17Å; T264-G266 PolarHBondContact O-N 2.76Å
265	I	42.6	Very low	43.1	Very low	153 Å²	153	136 Å²	136	79%	0.785	69%	0.691	S	S	*	*	S	Bend	trans	-90.8	99.1	-175.7	-58.6	178	0	0	0	109.6	S263	S263-I265 PolarHBondContact O-N 3.35Å; S263-I265 PolarHBondContact OG-N 3.02Å
266	G	42.6	Very low	42.6	Very low	66 Å²	66	143.3 Å²	143.3	68%	0.68	71%	0.709	S	S	*	*	S	Bend	trans	146.1	-20.8	167.4	0	0	0	0	0	116.4	T264 T268	T264-G266 PolarHBondContact O-N 2.76Å; G266-T268 PolarHBondContact O-N 3.48Å
267	R	36.8	Very low	42.4	Very low	237 Å²	237	146.8 Å²	146.8	89%	0.894	72%	0.722	S	S	*	*			trans	-85.8	70	-175.2	-67.9	-170.4	-179.7	-170.4	2.2	113.7	R269	R267-R269 PolarHBondContact O-N 3.17Å; R267-R269 VanDerWaalsContact O-N 3.07Å
268	T	37.5	Very low	42.2	Very low	134 Å²	134	148.1 Å²	148.1	82%	0.822	74%	0.735	S	S	*	*			trans	-73.1	94.6	165.5	51.7	0	0	0	0	110.6	G266	G266-T268 PolarHBondContact O-N 3.48Å
269	R	36.4	Very low	41.6	Very low	190 Å²	190	148.1 Å²	148.1	72%	0.717	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-56.3	124.7	172	-161.8	179.6	-170	-179.4	3	108.7	R267 Q271 D1158	R267-R269 PolarHBondContact O-N 3.17Å; R267-R269 VanDerWaalsContact O-N 3.07Å; R269-Q271 PolarHBondContact O-N 3.09Å; R269-D1158 IonicContact CZ-OD2 3.24Å; R269-D1158 IonicContact NH1-OD1 3.64Å; R269-D1158 PolarHBondContact NH1-OD1 3.29Å; R269-D1158 IonicContact NH1-OD2 2.68Å; R269-D1158 PolarHBondContact NH1-OD2 3.35Å; R269-D1158 IonicContact NH2-OD2 3.41Å; R269-D1158 PolarHBondContact NH2-OD2 3.03Å
270	P	36.3	Very low	41.1	Very low	119 Å²	119	150.2 Å²	150.2	77%	0.773	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-67.1	125.1	-178.8	26.3	-33.3	0	0	0	110.1
271	Q	40.3	Very low	40	Very low	182 Å²	182	153.6 Å²	153.6	85%	0.85	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-64.6	140.9	179.2	-82.3	-167.3	-17.9	0	0	111.8	R269 R273	R269-Q271 PolarHBondContact O-N 3.09Å; Q271-R273 PolarHBondContact O-N 3.17Å
272	P	39.9	Very low	39.2	Very low	118 Å²	118	153.2 Å²	153.2	77%	0.766	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-64.1	134.6	168.2	28.6	-33.6	0	0	0	109.7
273	R	37.3	Very low	38.8	Very low	239 Å²	239	155.1 Å²	155.1	90%	0.902	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.5	127.5	175.6	-68.7	178.4	176.8	169.4	-0.9	109.4	Q271 K275	Q271-R273 PolarHBondContact O-N 3.17Å; R273-K275 PolarHBondContact O-N 3.44Å
274	P	37.6	Very low	38.2	Very low	124 Å²	124	159.7 Å²	159.7	81%	0.805	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-61.4	135.4	171.2	25.5	-32.9	0	0	0	109.9
275	K	38.3	Very low	37.7	Very low	199 Å²	199	159.8 Å²	159.8	87%	0.865	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-68	146.3	174.4	-72.4	179.6	-180	173.8	0	109.7	R273	R273-K275 PolarHBondContact O-N 3.44Å
276	R	35	Very low	37.3	Very low	249 Å²	249	159.8 Å²	159.8	94%	0.94	81%	0.812	S	S	*	*			trans	-98.8	105.6	-176.8	-177.8	-176	-171.8	167.3	3.2	109.7
277	E	40.3	Very low	37	Very low	174 Å²	174	163.8 Å²	163.8	81%	0.813	82%	0.815	S	S	*	*			trans	-108	160.8	169.3	-72.6	-154.4	178.3	0	0	111.5
278	P	43.7	Very low	36.8	Very low	119 Å²	119	159.1 Å²	159.1	77%	0.773	82%	0.819	S	S	*	*			trans	-94.2	166.3	-153.5	36.2	-36	0	0	0	115	Q280	P278-Q280 PolarHBondContact O-N 3.25Å
279	N	37.1	Very low	36.7	Very low	157 Å²	157	156.6 Å²	156.6	84%	0.84	81%	0.811	S	S	*	*			trans	-41.8	132.4	174.1	-55.2	-18.4	0	0	0	113.8
280	Q	33.6	Very low	36.5	Very low	191 Å²	191	156.2 Å²	156.2	89%	0.893	82%	0.818	S	S	*	*			trans	-131.2	149.9	136.2	-69.1	-157.7	28.1	0	0	110.4	P278	P278-Q280 PolarHBondContact O-N 3.25Å
281	L	36.5	Very low	36.4	Very low	156 Å²	156	158 Å²	158	82%	0.817	82%	0.82	S	S	*	*			trans	-94.4	175.1	171.7	-76.2	153.8	0	0	0	109
282	T	36.5	Very low	36.1	Very low	143 Å²	143	155.7 Å²	155.7	88%	0.877	81%	0.813	S	S	*	*			trans	72.9	150.5	-174.6	79.2	0	0	0	0	113.8
283	S	39.1	Very low	35.7	Very low	108 Å²	108	159.3 Å²	159.3	76%	0.755	82%	0.817	S	S	*	*			cis	-133.8	152.5	2.4	57.4	0	0	0	0	113
284	M	30.5	Very low	35.4	Very low	160 Å²	160	153.4 Å²	153.4	79%	0.788	81%	0.812	S	S	*	*			trans	-63.9	168.2	158	-81.1	167.7	45.6	0	0	111.6
285	D	34.1	Very low	35.3	Very low	137 Å²	137	159 Å²	159	73%	0.733	82%	0.817	S	S	*	*			trans	58.5	125.3	162.1	-80.4	-54.8	0	0	0	118.3
286	M	34.5	Very low	35.1	Very low	154 Å²	154	157.8 Å²	157.8	76%	0.759	82%	0.815	S	S	*	*				-176.6	139	118.8	-98	-73.9	-89.3	0	0	112
287	M	35.3	Very low	35.1	Very low	150 Å²	150	152.3 Å²	152.3	74%	0.739	81%	0.809	S	S	*	*			trans	64.1	96.8	161.9	-58	-171.3	-62.3	0	0	119.4
288	S	34	Very low	34.6	Very low	138 Å²	138	153.2 Å²	153.2	97%	0.965	82%	0.816	S	S	*	*			trans	-95.4	94.1	138	-69.6	0	0	0	0	109.4
289	A	34.2	Very low	34.3	Very low	81 Å²	81	157.1 Å²	157.1	67%	0.669	82%	0.823	S	S	*	*			trans	-165.6	152.3	171.1	0	0	0	0	0	107.3
290	E	32.8	Very low	34.3	Very low	183 Å²	183	153.7 Å²	153.7	86%	0.855	83%	0.825	S	S	*	*			cis	-126.5	167	7.3	-65.9	179.4	118.6	0	0	111.8
291	L	33.7	Very low	34.2	Very low	155 Å²	155	150.1 Å²	150.1	81%	0.812	82%	0.821	S	S	*	*			trans	-105.3	165.7	163.4	-112.9	164.5	0	0	0	109.7
292	D	33.4	Very low	33.9	Very low	134 Å²	134	151.6 Å²	151.6	72%	0.717	83%	0.827	S	S	*	*			trans	62	94.3	166.7	-61	-34.6	0	0	0	119.4
293	K	31.8	Very low	33.9	Very low	194 Å²	194	155.6 Å²	155.6	84%	0.843	83%	0.826	S	S	*	*			trans	-157.3	161.8	134.8	-103.4	133.8	-162.6	162.3	0	113.9
294	S	30.9	Very low	33.6	Very low	115 Å²	115	158.6 Å²	158.6	80%	0.804	83%	0.833	S	S	*	*			trans	54.9	86.9	175.3	57.7	0	0	0	0	118.1
295	R	35.1	Very low	33.9	Very low	241 Å²	241	154.9 Å²	154.9	91%	0.909	83%	0.828	S	S	*	*			trans	-71.1	115	135.4	-76.4	177.3	171	173.9	-3.3	108.3
296	H	36	Very low	33.9	Very low	174 Å²	174	157.1 Å²	157.1	81%	0.806	83%	0.834	S	S	*	*			trans	174.9	170	139.7	-95.3	-59.4	0	0	0	110.6
297	T	35	Very low	34.2	Very low	134 Å²	134	156.8 Å²	156.8	82%	0.822	84%	0.841	S	S	*	*			trans	51.7	82.6	169.6	49.9	0	0	0	0	117.6
298	M	29.7	Very low	34.3	Very low	193 Å²	193	154.1 Å²	154.1	95%	0.951	84%	0.837	S	S	*	*			trans	-151.7	73.5	137.5	-87.4	-141.6	173.2	0	0	110.5
299	E	36	Very low	35	Very low	201 Å²	201	150 Å²	150	94%	0.939	81%	0.808	S	S	*	*			trans	-95.6	135.9	148.3	-82.1	-171.1	115.3	0	0	107.6
300	G	36.9	Very low	35.5	Very low	85 Å²	85	155.4 Å²	155.4	88%	0.876	82%	0.817	S	S	*	*			trans	100.4	54	169.2	0	0	0	0	0	117.7
301	S	31.6	Very low	36.3	Very low	116 Å²	116	152.9 Å²	152.9	81%	0.811	81%	0.808	S	S	*	*			trans	-155.5	82.2	149.5	-166.3	0	0	0	0	112.9
302	M	30.1	Very low	36.9	Very low	188 Å²	188	148.7 Å²	148.7	93%	0.926	79%	0.787	S	S	*	*			trans	-161.8	87.7	159.5	-90.6	-152	-74.6	0	0	109.1
303	R	37	Very low	37.9	Very low	227 Å²	227	144.6 Å²	144.6	86%	0.857	77%	0.772	S	S	*	*			trans	-136.1	-32.3	166.4	-88.7	-165.3	170.5	-178.1	-0.7	114.2	A305	R303-A305 VanDerWaalsContact C-N 3.3Å; R303-A305 PolarHBondContact O-N 3.14Å
304	D	33.8	Very low	38.9	Very low	170 Å²	170	137.6 Å²	137.6	91%	0.909	75%	0.75	S	S	*	*	S	Bend	trans	-90.7	62.7	-172.9	-51.7	-65.8	0	0	0	112.5
305	A	35.7	Very low	40.1	Very low	82 Å²	82	139.2 Å²	139.2	68%	0.678	74%	0.738	S	S	*	*			trans	-144.1	33	-179.9	0	0	0	0	0	113.1	R303	R303-A305 VanDerWaalsContact C-N 3.3Å; R303-A305 PolarHBondContact O-N 3.14Å
306	Q	35.4	Very low	41	Very low	185 Å²	185	131.6 Å²	131.6	86%	0.864	72%	0.718	S	S	*	*			trans	-136.2	44.8	-177.3	-68.9	-157.6	-29.7	0	0	115
307	T	40.1	Very low	41.8	Very low	147 Å²	147	132.7 Å²	132.7	90%	0.902	72%	0.716	S	S	*	*			trans	-131.5	10.1	167.3	48.7	0	0	0	0	114
308	S	37.3	Very low	42.4	Very low	94 Å²	94	132.1 Å²	132.1	66%	0.657	71%	0.705	S	S	*	*	S	Bend	trans	-70.6	134.5	171.4	48.8	0	0	0	0	111.2
309	S	48.2	Very low	43.6	Very low	52 Å²	52	130.4 Å²	130.4	36%	0.364	69%	0.692	S	S	.	*			trans	-63.2	148.2	-176.9	87.6	0	0	0	0	111.7	L311 D312 A313	S309-L311 PolarHBondContact O-N 3.18Å; S309-L311 VanDerWaalsContact O-N 3.13Å; S309-L311 PolarHBondContact OG-N 2.94Å; S309-D312 PolarHBondContact O-N 3.16Å; S309-D312 PolarHBondContact OG-N 3.25Å; S309-D312 VanDerWaalsContact OG-N 3.15Å; S309-D312 PolarHBondContact OG-OD2 3.25Å; S309-A313 PolarHBondContact O-N 2.91Å; S309-A313 VanDerWaalsContact O-N 3.12Å
310	F	45.4	Very low	44.2	Very low	194 Å²	194	127 Å²	127	85%	0.851	68%	0.676	S	S	*	*	H	α-helix	trans	-58	-29	177.3	-161.2	-95.8	0	0	0	112.2	A314	F310-A314 WeakPolarHBondContact O-CB 3.33Å; F310-A314 PolarHBondContact O-N 3.35Å; F310-A314 VanDerWaalsContact O-N 3.13Å
311	L	49.3	Very low	44.3	Very low	129 Å²	129	126.2 Å²	126.2	68%	0.675	66%	0.657	S	S	*	*	H	α-helix	trans	-70.9	-38	176.3	-67.8	171	0	0	0	112.6	S309 A314 R315	S309-L311 PolarHBondContact O-N 3.18Å; S309-L311 VanDerWaalsContact O-N 3.13Å; S309-L311 PolarHBondContact OG-N 2.94Å; L311-A314 PolarHBondContact O-N 3.49Å; L311-R315 VanDerWaalsContact O-CB 3.27Å; L311-R315 WeakPolarHBondContact O-CB 3.26Å; L311-R315 PolarHBondContact O-N 2.76Å
312	D	46.1	Very low	44.9	Very low	68 Å²	68	126.2 Å²	126.2	36%	0.364	65%	0.647	S	S	.	*	H	α-helix	trans	-75.4	-35.4	177.2	-72.7	-62.8	0	0	0	112.5	S309 A314 R315 V316	S309-D312 PolarHBondContact O-N 3.16Å; S309-D312 PolarHBondContact OG-N 3.25Å; S309-D312 VanDerWaalsContact OG-N 3.15Å; S309-D312 PolarHBondContact OG-OD2 3.25Å; D312-A314 VanDerWaalsContact C-N 3.29Å; D312-A314 PolarHBondContact O-N 2.73Å; D312-R315 PolarHBondContact O-N 3.34Å; D312-R315 IonicContact OD1-CZ 3.43Å; D312-R315 IonicContact OD1-NE 2.69Å; D312-R315 IonicContact OD1-NH1 3.49Å; D312-R315 PolarHBondContact OD1-NH1 3Å; D312-V316 WeakPolarHBondContact O-CB 3.19Å; D312-V316 WeakPolarHBondContact O-CG2 3.33Å; D312-V316 PolarHBondContact O-N 3.07Å
313	A	53.9	Low	45.2	Very low	48 Å²	48	119.5 Å²	119.5	40%	0.397	63%	0.626	S	S	.	*	H	α-helix	trans	-59.3	-41	169.3	0	0	0	0	0	111.8	S309 R317	S309-A313 PolarHBondContact O-N 2.91Å; S309-A313 VanDerWaalsContact O-N 3.12Å; A313-R317 PolarHBondContact O-N 3.32Å; A313-R317 VanDerWaalsContact O-N 3.12Å
314	A	52.6	Low	45.3	Very low	46 Å²	46	111.2 Å²	111.2	38%	0.38	61%	0.606	S	S	.	*	H	α-helix	trans	-66.5	-44.4	173.2	0	0	0	0	0	112.3	F310 L311 D312 V316 R317 M318	F310-A314 WeakPolarHBondContact O-CB 3.33Å; F310-A314 PolarHBondContact O-N 3.35Å; F310-A314 VanDerWaalsContact O-N 3.13Å; L311-A314 PolarHBondContact O-N 3.49Å; D312-A314 VanDerWaalsContact C-N 3.29Å; D312-A314 PolarHBondContact O-N 2.73Å; A314-V316 PolarHBondContact O-N 3.48Å; A314-R317 PolarHBondContact O-N 2.73Å; A314-M318 WeakPolarHBondContact O-CB 3.44Å; A314-M318 PolarHBondContact O-N 3.31Å
315	R	56	Low	45.3	Very low	149 Å²	149	107.1 Å²	107.1	56%	0.562	60%	0.596	S	S	*	*	H	α-helix	trans	-61.6	-39.9	178.7	-174.2	-178	-76.8	156.3	-11	112.4	L311 D312 K319	L311-R315 VanDerWaalsContact O-CB 3.27Å; L311-R315 WeakPolarHBondContact O-CB 3.26Å; L311-R315 PolarHBondContact O-N 2.76Å; D312-R315 PolarHBondContact O-N 3.34Å; D312-R315 IonicContact OD1-CZ 3.43Å; D312-R315 IonicContact OD1-NE 2.69Å; D312-R315 IonicContact OD1-NH1 3.49Å; D312-R315 PolarHBondContact OD1-NH1 3Å; R315-K319 PolarHBondContact O-N 3.44Å; R315-K319 VanDerWaalsContact O-N 3.1Å
316	V	55	Low	45.2	Very low	82 Å²	82	112 Å²	112	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-68	-47.6	174.4	171.2	0	0	0	0	111	D312 A314 M318 K319 Q320	D312-V316 WeakPolarHBondContact O-CB 3.19Å; D312-V316 WeakPolarHBondContact O-CG2 3.33Å; D312-V316 PolarHBondContact O-N 3.07Å; A314-V316 PolarHBondContact O-N 3.48Å; V316-M318 VanDerWaalsContact C-N 3.3Å; V316-M318 PolarHBondContact O-N 3.25Å; V316-K319 PolarHBondContact O-N 3.18Å; V316-Q320 WeakPolarHBondContact O-CG 3.42Å; V316-Q320 PolarHBondContact O-N 3.24Å
317	R	53.7	Low	45.3	Very low	197 Å²	197	106.9 Å²	106.9	74%	0.743	59%	0.593	S	S	*	*	H	α-helix	trans	-58.4	-40.4	175.5	-83.9	-176.6	165.8	-176.1	-4.1	112.6	A313 A314 Q320 S321	A313-R317 PolarHBondContact O-N 3.32Å; A313-R317 VanDerWaalsContact O-N 3.12Å; A314-R317 PolarHBondContact O-N 2.73Å; R317-Q320 PolarHBondContact O-N 3.34Å; R317-S321 PolarHBondContact O-N 3.09Å
318	M	47.1	Very low	45.2	Very low	121 Å²	121	106.5 Å²	106.5	60%	0.596	59%	0.591	S	S	*	*	H	α-helix	trans	-70.2	-37.2	-180	-163.6	180	-65.8	0	0	112.4	A314 V316 S321 I322	A314-M318 WeakPolarHBondContact O-CB 3.44Å; A314-M318 PolarHBondContact O-N 3.31Å; V316-M318 VanDerWaalsContact C-N 3.3Å; V316-M318 PolarHBondContact O-N 3.25Å; M318-S321 PolarHBondContact O-OG 3.42Å; M318-I322 HydrophobicContact CG-CD1 4.43Å; M318-I322 WeakPolarHBondContact O-CG1 3.39Å; M318-I322 PolarHBondContact O-N 3.05Å
319	K	53.6	Low	45	Very low	157 Å²	157	105.2 Å²	105.2	68%	0.683	59%	0.592	S	S	*	*	H	α-helix	trans	-65.3	-38.7	170.2	-77.3	-174.3	174.1	-175.9	0	112	R315 V316 G323	R315-K319 PolarHBondContact O-N 3.44Å; R315-K319 VanDerWaalsContact O-N 3.1Å; V316-K319 PolarHBondContact O-N 3.18Å; K319-G323 PolarHBondContact O-N 3.36Å; K319-G323 VanDerWaalsContact O-N 3.09Å
320	Q	49.8	Very low	44.3	Very low	130 Å²	130	111.3 Å²	111.3	61%	0.607	62%	0.62	S	S	*	*	H	α-helix	trans	-67.6	-38.1	176.9	-73.9	176.3	-14.1	0	0	112.8	V316 R317 G323 A324	V316-Q320 WeakPolarHBondContact O-CG 3.42Å; V316-Q320 PolarHBondContact O-N 3.24Å; R317-Q320 PolarHBondContact O-N 3.34Å; Q320-G323 PolarHBondContact O-N 3.02Å; Q320-A324 WeakPolarHBondContact O-CB 3.35Å; Q320-A324 PolarHBondContact O-N 3.16Å
321	S	39.4	Very low	43.6	Very low	68 Å²	68	106.9 Å²	106.9	48%	0.476	62%	0.619	S	S	.	*	H	α-helix	trans	-68.4	-39.7	177.4	64.8	0	0	0	0	112.7	R317 M318 G323 A324 A325	R317-S321 PolarHBondContact O-N 3.09Å; M318-S321 PolarHBondContact O-OG 3.42Å; S321-G323 VanDerWaalsContact C-N 3.35Å; S321-A324 PolarHBondContact O-N 3.33Å; S321-A325 PolarHBondContact O-N 3.18Å
322	I	42.7	Very low	42.6	Very low	116 Å²	116	105.1 Å²	105.1	60%	0.595	62%	0.617	S	S	*	*	H	α-helix	trans	-65	-39.4	175	-65.7	167.8	0	0	0	110.8	M318	M318-I322 HydrophobicContact CG-CD1 4.43Å; M318-I322 WeakPolarHBondContact O-CG1 3.39Å; M318-I322 PolarHBondContact O-N 3.05Å
323	G	37.1	Very low	42	Very low	47 Å²	47	110.6 Å²	110.6	49%	0.485	64%	0.641	S	S	.	*	H	α-helix	trans	-65.3	-41.2	173.4	0	0	0	0	0	113.6	K319 Q320 S321 H326	K319-G323 PolarHBondContact O-N 3.36Å; K319-G323 VanDerWaalsContact O-N 3.09Å; Q320-G323 PolarHBondContact O-N 3.02Å; S321-G323 VanDerWaalsContact C-N 3.35Å; G323-H326 PolarHBondContact O-N 3.3Å
324	A	38.3	Very low	41	Very low	54 Å²	54	117.2 Å²	117.2	45%	0.446	66%	0.663	S	S	.	*	H	α-helix	trans	-67.5	-38	-180	0	0	0	0	0	113	Q320 S321 H326 A327	Q320-A324 WeakPolarHBondContact O-CB 3.35Å; Q320-A324 PolarHBondContact O-N 3.16Å; S321-A324 PolarHBondContact O-N 3.33Å; A324-H326 PolarHBondContact O-N 3.43Å; A324-A327 PolarHBondContact O-N 3.35Å; A324-A327 VanDerWaalsContact O-N 3.1Å
325	A	34.6	Very low	40.3	Very low	83 Å²	83	120.4 Å²	120.4	69%	0.686	68%	0.68	S	S	*	*	H	α-helix	trans	-61	-25.9	-179.4	0	0	0	0	0	113.7	S321	S321-A325 PolarHBondContact O-N 3.18Å
326	H	34.5	Very low	39.6	Very low	184 Å²	184	119.5 Å²	119.5	85%	0.852	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-6.3	178.2	-107.6	-95.8	0	0	0	114.6	G323 A324	G323-H326 PolarHBondContact O-N 3.3Å; A324-H326 PolarHBondContact O-N 3.43Å
327	A	36.4	Very low	38.4	Very low	78 Å²	78	120.4 Å²	120.4	65%	0.645	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-15.5	-172.3	0	0	0	0	0	114.7	A324 G329	A324-A327 PolarHBondContact O-N 3.35Å; A324-A327 VanDerWaalsContact O-N 3.1Å; A327-G329 PolarHBondContact O-N 2.93Å
328	V	39.1	Very low	37.4	Very low	140 Å²	140	116.4 Å²	116.4	85%	0.848	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	70	-176.7	-169.8	0	0	0	0	110.9
329	G	32.7	Very low	37.4	Very low	66 Å²	66	115.6 Å²	115.6	68%	0.68	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150	-12.9	-178.2	0	0	0	0	0	117.6	A327	A327-G329 PolarHBondContact O-N 2.93Å
330	L	33.4	Very low	36.2	Very low	180 Å²	180	114.8 Å²	114.8	94%	0.942	72%	0.723	S	S	*	*	S	Bend	trans	-138.9	47.1	-171.6	-71.4	176.8	0	0	0	114.3
331	A	30.7	Very low	35.2	Very low	101 Å²	101	113 Å²	113	84%	0.835	73%	0.731	S	S	*	*			trans	-157.7	92	168	0	0	0	0	0	113.6
332	S	27.9	Very low	34.7	Very low	92 Å²	92	114.1 Å²	114.1	64%	0.643	74%	0.744	S	S	*	*			trans	-173.1	127	144.1	-172.1	0	0	0	0	113
333	H	33.3	Very low	34.1	Very low	184 Å²	184	113.2 Å²	113.2	85%	0.852	75%	0.754	S	S	*	*			trans	130.3	87.7	144.8	-71.2	-60.3	0	0	0	114.7
334	Q	32.8	Very low	33.8	Very low	187 Å²	187	115.7 Å²	115.7	87%	0.874	77%	0.77	S	S	*	*			trans	-110.6	131.1	162.9	-160.9	171.6	13.7	0	0	107.7
335	P	38	Very low	33.4	Very low	112 Å²	112	118 Å²	118	73%	0.727	79%	0.789	S	S	*	*			trans	-75.7	161.6	-176.2	29.8	-34.5	0	0	0	113.1
336	P	41.5	Very low	33.3	Very low	131 Å²	131	118.6 Å²	118.6	85%	0.851	79%	0.794	S	S	*	*			trans	-76.3	167.8	-168.4	31	-36.8	0	0	0	115.2
337	A	30.5	Very low	33.8	Very low	100 Å²	100	116.1 Å²	116.1	83%	0.826	79%	0.794	S	S	*	*			trans	-99.2	-168	-166.3	0	0	0	0	0	115
338	S	32	Very low	33.5	Very low	114 Å²	114	116.2 Å²	116.2	80%	0.797	80%	0.802	S	S	*	*			trans	98.3	144.1	165.2	-153.1	0	0	0	0	116.2
339	P	46.9	Very low	32.9	Very low	104 Å²	104	113.1 Å²	113.1	68%	0.675	80%	0.799	S	S	*	*			cis	-142.2	163	-36.2	37.5	-21.4	0	0	0	116.8
340	V	28.4	Very low	33.9	Very low	139 Å²	139	115.7 Å²	115.7	84%	0.842	80%	0.804	S	S	*	*			trans	69.7	140.5	140.1	164.1	0	0	0	0	121.7
341	A	28.8	Very low	33.7	Very low	93 Å²	93	114.1 Å²	114.1	77%	0.769	79%	0.793	S	S	*	*			trans	72.7	151	163.2	0	0	0	0	0	119.2
342	A	29.4	Very low	33.7	Very low	92 Å²	92	119.3 Å²	119.3	76%	0.76	79%	0.791	S	S	*	*			cis	-167.3	150.2	-30	0	0	0	0	0	110.3
343	A	29.8	Very low	33.7	Very low	96 Å²	96	123 Å²	123	79%	0.793	80%	0.798	S	S	*	*			trans	52.2	117.2	151.7	0	0	0	0	0	122.2
344	A	30	Very low	33.4	Very low	99 Å²	99	121.2 Å²	121.2	82%	0.818	80%	0.795	S	S	*	*				87	149.6	127.5	0	0	0	0	0	122.8
345	A	31.2	Very low	33.3	Very low	104 Å²	104	117.9 Å²	117.9	86%	0.86	79%	0.792	S	S	*	*			trans	68.5	118.1	159.1	0	0	0	0	0	120.7
346	A	31.2	Very low	32.9	Very low	95 Å²	95	123.2 Å²	123.2	79%	0.785	80%	0.8	S	S	*	*			trans	-95.5	-176.1	147	0	0	0	0	0	108.5
347	P	44.9	Very low	33.2	Very low	132 Å²	132	122.1 Å²	122.1	86%	0.857	79%	0.792	S	S	*	*			cis	-131.9	-179.1	-5.2	41.9	-26.2	0	0	0	114.2
348	G	30.4	Very low	33.3	Very low	79 Å²	79	122.5 Å²	122.5	81%	0.814	79%	0.789	S	S	*	*			trans	141.2	139.1	154.3	0	0	0	0	0	117.7
349	G	28	Very low	33.1	Very low	75 Å²	75	120.2 Å²	120.2	77%	0.773	78%	0.783	S	S	*	*			trans	-113.1	-155.4	150.9	0	0	0	0	0	109.1
350	P	52.3	Low	32.4	Very low	121 Å²	121	125.9 Å²	125.9	79%	0.786	80%	0.797	S	S	*	*			cis	-134.7	-140.4	3.3	41.1	-19.9	0	0	0	112.1
351	M	30.3	Very low	32.4	Very low	147 Å²	147	127.7 Å²	127.7	72%	0.724	80%	0.797	S	S	*	*			trans	72.5	114	176.1	-64.3	-73.3	178.1	0	0	115.1
352	R	29.8	Very low	33.9	Very low	210 Å²	210	127.8 Å²	127.8	79%	0.792	79%	0.789	S	S	*	*				71.5	122.4	68.6	-74.3	-164.2	179.9	-161.2	-1.7	114.3
353	H	29.1	Very low	35.1	Very low	169 Å²	169	128.8 Å²	128.8	78%	0.782	79%	0.788	S	S	*	*				-170.7	159.7	102.6	-111	-94	0	0	0	112.9
354	N	27	Very low	36.1	Very low	146 Å²	146	129.3 Å²	129.3	78%	0.781	78%	0.784	S	S	*	*			trans	-94.5	164.2	175.4	-59.4	-21.6	0	0	0	111.1
355	S	29.7	Very low	36.2	Very low	118 Å²	118	129.9 Å²	129.9	83%	0.825	78%	0.782	S	S	*	*				166.2	140.9	108	-82.2	0	0	0	0	115.9
356	Y	29.8	Very low	36.4	Very low	224 Å²	224	130.8 Å²	130.8	88%	0.878	78%	0.776	S	S	*	*			trans	-80.5	164.9	157.5	-99.5	-91.4	0	0	0	109.7
357	P	48.3	Very low	36.3	Very low	108 Å²	108	130.2 Å²	130.2	70%	0.701	77%	0.771	S	S	*	*				-159.7	179	79	41.3	-18.8	0	0	0	118.8
358	S	30.9	Very low	36.5	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	76%	0.759	S	S	*	*			trans	39.6	141.6	146.4	57.7	0	0	0	0	122.2
359	G	29.7	Very low	36.6	Very low	65 Å²	65	134.1 Å²	134.1	67%	0.67	76%	0.758	S	S	*	*			cis	104	125.6	5.5	0	0	0	0	0	114.3
360	F	31.3	Very low	36.7	Very low	223 Å²	223	136 Å²	136	98%	0.978	75%	0.751	S	S	*	*			trans	-164.8	174.3	162.8	-121.2	-83	0	0	0	112.2
361	E	28.4	Very low	35.6	Very low	177 Å²	177	138.9 Å²	138.9	83%	0.827	75%	0.751	S	S	*	*			trans	-133.3	-140.6	-155.9	-151.9	-154.9	169.5	0	0	116.3
362	P	61.2	Low	36.6	Very low	95 Å²	95	137.3 Å²	137.3	62%	0.617	75%	0.752	S	S	*	*			trans	-117.1	-146.4	-143.4	44.9	-23.6	0	0	0	112.5
363	P	53.2	Low	36.7	Very low	113 Å²	113	131.6 Å²	131.6	73%	0.734	75%	0.75	S	S	*	*			cis	-125.2	-119.5	-12.8	31	-4.4	0	0	0	111.2
364	P	51	Low	37.2	Very low	107 Å²	107	131 Å²	131	70%	0.695	75%	0.752	S	S	*	*			cis	-136.3	153.4	-37.3	32.5	-11.7	0	0	0	118.4
365	S	32.4	Very low	38.2	Very low	112 Å²	112	129.5 Å²	129.5	78%	0.783	75%	0.75	S	S	*	*			trans	67.7	166.2	151.1	-139.3	0	0	0	0	118.3
366	V	34.5	Very low	38.4	Very low	122 Å²	122	127.8 Å²	127.8	74%	0.739	74%	0.738	S	S	*	*			cis	-143.6	168.8	10	-140.3	0	0	0	0	107.4
367	A	29.3	Very low	38.5	Very low	83 Å²	83	125.6 Å²	125.6	69%	0.686	73%	0.733	S	S	*	*			cis	71.6	157.4	19.6	0	0	0	0	0	117.2
368	P	50.7	Low	37.9	Very low	93 Å²	93	128.9 Å²	128.9	60%	0.604	74%	0.737	S	S	*	*			cis	-140.7	-170.5	-7	36.4	-13.5	0	0	0	116.7
369	Y	32.2	Very low	38.2	Very low	201 Å²	201	132.3 Å²	132.3	79%	0.788	74%	0.741	S	S	*	*			trans	68.7	154.1	152.9	-65.1	-40.6	0	0	0	121.8
370	D	28.7	Very low	38.4	Very low	115 Å²	115	138.4 Å²	138.4	62%	0.615	74%	0.743	S	S	*	*			cis	-158.1	170.4	-12.7	-121	-15.5	0	0	0	115.6
371	F	30.3	Very low	39.2	Very low	180 Å²	180	137.6 Å²	137.6	79%	0.789	74%	0.739	S	S	*	*			trans	-4.2	173.2	160.4	-80.3	-79.6	0	0	0	123.9
372	P	51.3	Low	39.7	Very low	114 Å²	114	135.5 Å²	135.5	74%	0.74	73%	0.73	S	S	*	*			cis	-136.8	170	-3.6	25.3	0.1	0	0	0	119.4
373	A	30.9	Very low	38.4	Very low	91 Å²	91	141.3 Å²	141.3	75%	0.752	74%	0.739	S	S	*	*			trans	18.4	129.7	148.6	0	0	0	0	0	125.3
374	D	39.3	Very low	37.6	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	74%	0.739	S	S	*	*			trans	49.4	161.5	134	-119.1	25.8	0	0	0	121.6
375	P	48.1	Very low	36.9	Very low	114 Å²	114	144.2 Å²	144.2	74%	0.74	75%	0.746	S	S	*	*			cis	-133.9	-173.9	8	43.9	-25.2	0	0	0	117.8
376	S	34.4	Very low	37	Very low	83 Å²	83	148 Å²	148	58%	0.58	75%	0.748	S	S	*	*			trans	-62.9	161.8	-165.8	77	0	0	0	0	120.7
377	K	32.9	Very low	36.6	Very low	177 Å²	177	150.8 Å²	150.8	77%	0.77	75%	0.753	S	S	*	*			trans	71.4	112.6	142.9	-75.6	164.3	-170.4	156.9	0	120.2
378	K	35.4	Very low	37.5	Very low	178 Å²	178	152.7 Å²	152.7	77%	0.774	76%	0.758	S	S	*	*				154.1	151.5	99.8	-99.4	156	179.7	176.7	0	115.9
379	Q	36.2	Very low	36.6	Very low	179 Å²	179	151.5 Å²	151.5	84%	0.836	76%	0.764	S	S	*	*			trans	67.9	162.4	154.6	-69.8	175.1	1.3	0	0	116.3
380	R	34.2	Very low	36.6	Very low	193 Å²	193	151.6 Å²	151.6	73%	0.728	77%	0.771	S	S	*	*			cis	-146.3	121.8	17	-174.9	169.3	165.5	172.4	-6.4	114.1	Q382	R380-Q382 HydrophobicContact CG-CG 4.38Å
381	K	47.9	Very low	37	Very low	206 Å²	206	155 Å²	155	90%	0.896	78%	0.783	S	S	*	*			trans	-84.7	144.6	150.8	-83.4	-174.1	176.4	-179.4	0	109.6
382	Q	39.4	Very low	38.5	Very low	134 Å²	134	151.8 Å²	151.8	63%	0.626	78%	0.78	S	S	*	*			trans	-148.3	162.8	145.3	-67.1	-162.5	-1.5	0	0	107.6	R380	R380-Q382 HydrophobicContact CG-CG 4.38Å
383	R	34.7	Very low	39.1	Very low	216 Å²	216	151.9 Å²	151.9	82%	0.815	78%	0.781	S	S	*	*			cis	-148	122.6	13.5	-145.6	153.9	178.4	-131.4	0.8	106.1
384	A	36.6	Very low	39.6	Very low	88 Å²	88	152.7 Å²	152.7	73%	0.727	79%	0.788	S	S	*	*				65.7	150.9	86.4	0	0	0	0	0	113.7
385	K	35.1	Very low	39.4	Very low	194 Å²	194	148.7 Å²	148.7	84%	0.843	78%	0.784	S	S	*	*			cis	-156	147.7	1.7	-120.6	169.2	177.9	-168.9	0	104.7
386	K	34.3	Very low	39.1	Very low	191 Å²	191	155.9 Å²	155.9	83%	0.83	80%	0.796	S	S	*	*			cis	72.1	120.5	44.2	-143.4	-169.5	-172.9	-169.5	0	115
387	Q	27.2	Very low	39.2	Very low	181 Å²	181	155.7 Å²	155.7	85%	0.846	81%	0.808	S	S	*	*			trans	104.5	151.1	166.2	-62.2	-128	-90.3	0	0	118.2
388	P	46.8	Very low	39.6	Very low	122 Å²	122	157.7 Å²	157.7	79%	0.792	82%	0.816	S	S	*	*			trans	-126.3	172.9	-147.4	43.1	-28.8	0	0	0	116.1
389	G	31.8	Very low	39.6	Very low	69 Å²	69	153.4 Å²	153.4	71%	0.711	82%	0.822	S	S	*	*			trans	-173.3	135.6	165.3	0	0	0	0	0	113.4
390	E	33.7	Very low	39.7	Very low	203 Å²	203	148.8 Å²	148.8	95%	0.949	82%	0.823	S	S	*	*			trans	67	140.1	156.1	-56.9	-174.8	131.9	0	0	122.1
391	E	37.3	Very low	40.3	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	83%	0.831	S	S	*	*			trans	-102.2	-163.2	171.5	-44.9	180	100.7	0	0	109.1
392	P	61.9	Low	40	Very low	112 Å²	112	149.6 Å²	149.6	73%	0.727	83%	0.832	S	S	*	*			cis	-126.8	-156.2	-18	37.4	-16.7	0	0	0	110.5
393	P	63	Low	40	Very low	116 Å²	116	146.5 Å²	146.5	75%	0.753	84%	0.836	S	S	*	*			cis	-128.2	165.6	-15.3	20.1	4.4	0	0	0	116.4
394	A	40.8	Very low	40.4	Very low	108 Å²	108	148.4 Å²	148.4	89%	0.893	84%	0.843	S	S	*	*			trans	31.3	143.6	149.6	0	0	0	0	0	123.8
395	G	36.2	Very low	40.7	Very low	73 Å²	73	148 Å²	148	75%	0.753	85%	0.848	S	S	*	*			cis	166.9	162.4	-6	0	0	0	0	0	116
396	R	41.6	Very low	41.1	Very low	264 Å²	264	143.8 Å²	143.8	100%	0.996	85%	0.849	S	S	*	*			trans	46.9	127.7	163.2	-79.1	-175.4	168.2	-172	-1.4	122.8
397	G	36.3	Very low	41.5	Very low	80 Å²	80	138.4 Å²	138.4	83%	0.825	85%	0.847	S	S	*	*			trans	-175	159.2	159.8	0	0	0	0	0	114.4
398	K	41.2	Very low	42.2	Very low	219 Å²	219	134.3 Å²	134.3	95%	0.952	85%	0.845	S	S	*	*			trans	-142.6	146.1	-175	-79.6	-171.8	177.1	-177.7	0	115.8
399	G	36.1	Very low	41.8	Very low	87 Å²	87	135.7 Å²	135.7	90%	0.897	85%	0.851	S	S	*	*			trans	78.5	161	153.7	0	0	0	0	0	117.5
400	G	37.7	Very low	42	Very low	83 Å²	83	135.8 Å²	135.8	86%	0.856	85%	0.851	S	S	*	*			cis	-179.4	144.5	-8.6	0	0	0	0	0	111.6
401	K	47.6	Very low	42.2	Very low	207 Å²	207	131.4 Å²	131.4	90%	0.9	85%	0.85	S	S	*	*			trans	-91.3	161.2	179.3	-56.8	178.6	178.8	177.7	0	110.8
402	K	41.6	Very low	42.2	Very low	208 Å²	208	127.7 Å²	127.7	90%	0.904	85%	0.851	S	S	*	*			cis	-145.5	173.5	15.5	-55.6	169.9	-178.6	175.7	0	109
403	G	38.5	Very low	40.8	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	86%	0.858	S	S	*	*			cis	139.4	80.8	-13.1	0	0	0	0	0	117.9
404	R	43.6	Very low	39.6	Very low	256 Å²	256	126.6 Å²	126.6	97%	0.966	86%	0.861	S	S	*	*			trans	67.6	161.3	156.6	-59	-176.4	178.9	-151.1	-3.5	117.9
405	G	41.5	Very low	39.1	Very low	80 Å²	80	125.7 Å²	125.7	83%	0.825	86%	0.862	S	S	*	*			cis	107.8	150.9	11	0	0	0	0	0	111.8
406	A	44.3	Very low	39	Very low	105 Å²	105	125.7 Å²	125.7	87%	0.868	86%	0.863	S	S	*	*			cis	-141.4	-170.3	7.9	0	0	0	0	0	110.3
407	G	42.8	Very low	38.6	Very low	78 Å²	78	124.6 Å²	124.6	80%	0.804	86%	0.859	S	S	*	*				88.6	158.1	55	0	0	0	0	0	111.3
408	A	42.9	Very low	38.9	Very low	96 Å²	96	130.1 Å²	130.1	79%	0.793	86%	0.86	S	S	*	*			cis	-166.7	-175.1	-14.9	0	0	0	0	0	106.2
409	V	37.2	Very low	38.6	Very low	151 Å²	151	124.7 Å²	124.7	92%	0.915	85%	0.85	S	S	*	*			cis	-148.9	-154.4	11.7	-148.6	0	0	0	0	108.7
410	G	35.7	Very low	38.6	Very low	70 Å²	70	125.8 Å²	125.8	72%	0.722	85%	0.85	S	S	*	*			trans	-158.5	169.6	168.4	0	0	0	0	0	113.7
411	A	37.5	Very low	38.3	Very low	112 Å²	112	125.7 Å²	125.7	93%	0.926	85%	0.849	S	S	*	*			trans	-161.2	171.2	177.6	0	0	0	0	0	112.7
412	A	37.4	Very low	37.6	Very low	107 Å²	107	120 Å²	120	88%	0.884	85%	0.849	S	S	*	*			trans	-152.1	155.9	-169.5	0	0	0	0	0	116.7
413	A	34.4	Very low	37.5	Very low	105 Å²	105	115.6 Å²	115.6	87%	0.868	85%	0.851	S	S	*	*			trans	176.8	174.7	160.9	0	0	0	0	0	110.7
414	A	36.5	Very low	37.2	Very low	100 Å²	100	115.8 Å²	115.8	83%	0.826	85%	0.854	S	S	*	*				-168.5	131.3	-54	0	0	0	0	0	112
415	G	29.8	Very low	37.2	Very low	89 Å²	89	113.2 Å²	113.2	92%	0.918	85%	0.853	S	S	*	*			trans	76.2	162.8	169	0	0	0	0	0	118.1
416	G	34.1	Very low	37.2	Very low	74 Å²	74	116.9 Å²	116.9	76%	0.763	85%	0.853	S	S	*	*			cis	166.1	149.9	-15	0	0	0	0	0	115.8
417	R	34.7	Very low	37.9	Very low	241 Å²	241	117.1 Å²	117.1	91%	0.909	85%	0.846	S	S	*	*			trans	76.9	124.7	170.2	-63	-176.4	177.5	-147.5	-0.9	117.1
418	K	41.3	Very low	37.6	Very low	196 Å²	196	123.7 Å²	123.7	85%	0.852	85%	0.853	S	S	*	*				72.9	143.4	81.9	-73.5	-168.5	177.7	-168.9	0	114.1
419	S	35.3	Very low	37.3	Very low	105 Å²	105	122.5 Å²	122.5	73%	0.734	85%	0.85	S	S	*	*			cis	-175.8	154.6	1.7	41.1	0	0	0	0	113.3
420	A	36.5	Very low	37.4	Very low	110 Å²	110	124.8 Å²	124.8	91%	0.909	85%	0.853	S	S	*	*			trans	57.5	160.8	159.4	0	0	0	0	0	118.8
421	G	32.1	Very low	37.7	Very low	81 Å²	81	128.5 Å²	128.5	84%	0.835	86%	0.857	S	S	*	*			cis	154.1	150.5	-6.2	0	0	0	0	0	111.1
422	G	31.7	Very low	38.3	Very low	87 Å²	87	128 Å²	128	90%	0.897	84%	0.844	S	S	*	*			trans	137.7	165.5	175.2	0	0	0	0	0	115.3
423	A	39.2	Very low	38.1	Very low	115 Å²	115	130.6 Å²	130.6	95%	0.95	84%	0.839	S	S	*	*			trans	-137.8	165.2	-178	0	0	0	0	0	111.7
424	G	33.8	Very low	38.2	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	84%	0.839	S	S	*	*			trans	174.1	154	176.4	0	0	0	0	0	112.2
425	E	42.5	Very low	38.8	Very low	202 Å²	202	137 Å²	137	94%	0.944	83%	0.834	S	S	*	*			trans	-109.6	175.7	-172.3	-64.7	175.9	116.3	0	0	113.1
426	N	42.6	Very low	39.8	Very low	157 Å²	157	137.9 Å²	137.9	84%	0.84	82%	0.824	S	S	*	*			trans	-57.7	165.3	176.5	-66.4	-43.5	0	0	0	113
427	P	57	Low	39.9	Very low	110 Å²	110	141.7 Å²	141.7	71%	0.714	82%	0.823	S	S	*	*			cis	-149.1	-175.6	27.9	44.2	-23.1	0	0	0	118.9
428	F	38.4	Very low	40.1	Very low	215 Å²	215	138 Å²	138	94%	0.943	82%	0.821	S	S	*	*			trans	28	120.3	157.5	-73.1	-71.5	0	0	0	121.8
429	G	34.7	Very low	39.6	Very low	72 Å²	72	136.5 Å²	136.5	74%	0.742	82%	0.817	S	S	*	*			trans	144.9	99.9	137.9	0	0	0	0	0	120.6
430	M	41.1	Very low	39.5	Very low	198 Å²	198	143.4 Å²	143.4	98%	0.975	83%	0.827	S	S	*	*			trans	72.3	157.1	153.1	-67	-64.1	173.1	0	0	122.3
431	D	41.7	Very low	39.7	Very low	149 Å²	149	144.3 Å²	144.3	80%	0.797	83%	0.826	S	S	*	*			trans	-73.7	174.1	-171.7	-142	29.7	0	0	0	113.2
432	P	50.4	Low	39.7	Very low	100 Å²	100	146 Å²	146	65%	0.649	83%	0.826	S	S	*	*			cis	-147.2	-175.7	13.9	46.2	-25.9	0	0	0	119.8
433	M	32.5	Very low	39.9	Very low	162 Å²	162	148 Å²	148	80%	0.798	83%	0.826	S	S	*	*			trans	80.2	105.8	153.9	-71	-83.6	-86.3	0	0	122.8
434	R	35.6	Very low	39.7	Very low	229 Å²	229	150.9 Å²	150.9	86%	0.864	82%	0.82	S	S	*	*				25.9	162.7	128.7	-93.5	-171.1	161.6	179.5	-3.7	122.6
435	P	49.1	Very low	39.8	Very low	110 Å²	110	156.6 Å²	156.6	71%	0.714	83%	0.826	S	S	*	*			cis	-129.2	-151	-32.5	42.6	-23.7	0	0	0	109.8
436	P	52.6	Low	39.6	Very low	109 Å²	109	155.4 Å²	155.4	71%	0.708	82%	0.821	S	S	*	*			cis	-134.9	158.5	-10.7	39.9	-20.9	0	0	0	118.8
437	M	35.1	Very low	39.5	Very low	153 Å²	153	155.5 Å²	155.5	75%	0.754	82%	0.821	S	S	*	*			trans	39.2	119.7	146.8	-58.6	-162.6	77.3	0	0	123.9
438	L	38.5	Very low	39.3	Very low	164 Å²	164	154.6 Å²	154.6	86%	0.859	82%	0.815	S	S	*	*				-161.1	161.4	97.6	-107.5	170.5	0	0	0	111.6
439	Q	32.1	Very low	40.4	Very low	165 Å²	165	149.4 Å²	149.4	77%	0.771	80%	0.797	S	S	*	*			trans	-103.1	152.3	-160.1	-67.2	171.8	-63	0	0	115.3
440	R	33.1	Very low	41.8	Very low	250 Å²	250	150.6 Å²	150.6	94%	0.943	79%	0.792	S	S	*	*			trans	-107.6	150.4	156.4	-71.1	-177.4	174.9	-174.3	-1	109
441	S	39.5	Very low	43.1	Very low	128 Å²	128	148.1 Å²	148.1	90%	0.895	78%	0.778	S	S	*	*			trans	-103.9	131.4	178.5	-52.5	0	0	0	0	111.7
442	S	31.6	Very low	44.5	Very low	118 Å²	118	147.9 Å²	147.9	83%	0.825	77%	0.772	S	S	*	*			trans	-112.4	136.1	170.9	49	0	0	0	0	110.1
443	S	36.4	Very low	45.8	Very low	128 Å²	128	149.6 Å²	149.6	90%	0.895	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-89.7	124.8	179.9	54.3	0	0	0	0	111.9
444	E	36.1	Very low	48.1	Very low	175 Å²	175	145 Å²	145	82%	0.818	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-94.9	139.9	-174.1	-166.5	171.2	178.8	0	0	111.7	H446	E444-H446 PolarHBondContact O-N 2.96Å
445	Q	34.8	Very low	50.4	Low	194 Å²	194	140.7 Å²	140.7	91%	0.907	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-76.9	123.7	179.3	-73.5	177.5	-78.6	0	0	110.9
446	H	38.3	Very low	52.3	Low	177 Å²	177	142.5 Å²	142.5	82%	0.819	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-103.9	122.9	167.7	-104.6	38.2	0	0	0	110.5	E444 P448	E444-H446 PolarHBondContact O-N 2.96Å; H446-P448 WeakPolarHBondContact O-CD 3.22Å
447	N	40.3	Very low	53.9	Low	159 Å²	159	144.2 Å²	144.2	85%	0.85	74%	0.739	S	S	*	*			trans	-84.7	114.6	179.1	-160.7	3.6	0	0	0	109.1	N449	N447-N449 PolarHBondContact O-N 3.07Å
448	P	53.7	Low	56.6	Low	92 Å²	92	143.3 Å²	143.3	60%	0.597	73%	0.734	S	S	*	*			trans	-71.5	131	-170.6	27.7	-34.3	0	0	0	112	H446	H446-P448 WeakPolarHBondContact O-CD 3.22Å
449	N	62.3	Low	59.2	Low	105 Å²	105	141.6 Å²	141.6	56%	0.561	72%	0.722	S	S	*	*			trans	-60	120.6	179.9	-178.3	-21.2	0	0	0	110.7	N447 H451 Q452	N447-N449 PolarHBondContact O-N 3.07Å; N449-H451 PolarHBondContact O-N 2.98Å; N449-H451 PolarHBondContact OD1-N 3.08Å; N449-Q452 PolarHBondContact O-N 2.99Å
450	P	63.2	Low	61.9	Low	97 Å²	97	138 Å²	138	63%	0.63	71%	0.705	S	S	*	*	H	α-helix	trans	-60.8	-23.2	-169.7	21.7	-33.6	0	0	0	114.3	Q452 M453 S454	P450-Q452 VanDerWaalsContact C-N 3.3Å; P450-Q452 PolarHBondContact O-N 3.09Å; P450-M453 PolarHBondContact O-N 3.38Å; P450-S454 PolarHBondContact O-N 3.16Å
451	H	67.4	Low	64.7	Low	146 Å²	146	133.4 Å²	133.4	68%	0.676	69%	0.689	S	S	*	*	H	α-helix	trans	-62	-32.5	175	-102.9	59	0	0	0	113.6	N449 Q455	N449-H451 PolarHBondContact O-N 2.98Å; N449-H451 PolarHBondContact OD1-N 3.08Å; H451-Q455 PolarHBondContact O-N 3.09Å
452	Q	72.9	Confident	67.2	Low	144 Å²	144	133.6 Å²	133.6	67%	0.673	68%	0.675	S	S	*	*	H	α-helix	trans	-70.4	-36.2	176.8	-77.9	-168.7	-10.5	0	0	112.3	N449 P450 S454 Q455 Y456	N449-Q452 PolarHBondContact O-N 2.99Å; P450-Q452 VanDerWaalsContact C-N 3.3Å; P450-Q452 PolarHBondContact O-N 3.09Å; Q452-S454 VanDerWaalsContact C-N 3.34Å; Q452-S454 PolarHBondContact O-N 3.29Å; Q452-Q455 PolarHBondContact O-N 2.72Å; Q452-Y456 WeakPolarHBondContact O-CB 3.49Å; Q452-Y456 PolarHBondContact O-N 3.32Å
453	M	75.8	Confident	70.1	Confident	136 Å²	136	133.8 Å²	133.8	67%	0.67	66%	0.663	S	S	*	*	H	α-helix	trans	-66.1	-40	179.8	-155.7	-163.2	-55.5	0	0	111.1	P450 Y456 Q457	P450-M453 PolarHBondContact O-N 3.38Å; M453-Y456 PolarHBondContact O-N 3.38Å; M453-Q457 WeakPolarHBondContact O-CB 2.96Å; M453-Q457 PolarHBondContact O-N 2.76Å
454	S	81.8	Confident	72.9	Confident	66 Å²	66	132.8 Å²	132.8	46%	0.462	65%	0.648	S	S	.	*	H	α-helix	trans	-60.5	-47.9	175	-179.7	0	0	0	0	112.4	P450 Q452 Y456 Q457 M458	P450-S454 PolarHBondContact O-N 3.16Å; Q452-S454 VanDerWaalsContact C-N 3.34Å; Q452-S454 PolarHBondContact O-N 3.29Å; S454-Y456 VanDerWaalsContact C-N 3.34Å; S454-Y456 PolarHBondContact O-N 3.06Å; S454-Q457 PolarHBondContact O-N 3.25Å; S454-M458 WeakPolarHBondContact O-CB 3.46Å; S454-M458 PolarHBondContact O-N 3.14Å
455	Q	83.8	Confident	75.6	Confident	139 Å²	139	128.3 Å²	128.3	65%	0.65	63%	0.627	S	S	*	*	H	α-helix	trans	-62.1	-40.1	175.8	-73.8	-168.4	-11.9	0	0	112.5	H451 Q452 M458 Q459	H451-Q455 PolarHBondContact O-N 3.09Å; Q452-Q455 PolarHBondContact O-N 2.72Å; Q455-M458 PolarHBondContact O-N 3.24Å; Q455-Q459 WeakPolarHBondContact O-CB 3.38Å; Q455-Q459 PolarHBondContact O-N 3.23Å
456	Y	88.8	Confident	78.3	Confident	148 Å²	148	125.5 Å²	125.5	58%	0.58	61%	0.614	S	S	*	*	H	α-helix	trans	-65.4	-40.8	177.8	-160.6	-93.4	0	0	0	112	Q452 M453 S454 Q459 Q460	Q452-Y456 WeakPolarHBondContact O-CB 3.49Å; Q452-Y456 PolarHBondContact O-N 3.32Å; M453-Y456 PolarHBondContact O-N 3.38Å; S454-Y456 VanDerWaalsContact C-N 3.34Å; S454-Y456 PolarHBondContact O-N 3.06Å; Y456-Q459 PolarHBondContact O-N 3.25Å; Y456-Q460 HydrophobicContact CD1-CG 4.04Å; Y456-Q460 HydrophobicContact CE1-CG 3.89Å; Y456-Q460 WeakPolarHBondContact O-CG 3.48Å; Y456-Q460 PolarHBondContact O-N 3.43Å
457	Q	86.4	Confident	81	Confident	145 Å²	145	123.2 Å²	123.2	68%	0.678	60%	0.602	S	S	*	*	H	α-helix	trans	-64.7	-41	176	-167.3	177.3	36.3	0	0	111.8	M453 S454 Q460 Y461	M453-Q457 WeakPolarHBondContact O-CB 2.96Å; M453-Q457 PolarHBondContact O-N 2.76Å; S454-Q457 PolarHBondContact O-N 3.25Å; Q457-Q460 PolarHBondContact O-N 3.36Å; Q457-Y461 PolarHBondContact O-N 3.07Å
458	M	91.1	Very high	83.5	Confident	133 Å²	133	123.5 Å²	123.5	66%	0.655	59%	0.591	S	S	*	*	H	α-helix	trans	-64	-41	175	-169.5	-177.9	-65.5	0	0	112.1	S454 Q455 Y461 Q462	S454-M458 WeakPolarHBondContact O-CB 3.46Å; S454-M458 PolarHBondContact O-N 3.14Å; Q455-M458 PolarHBondContact O-N 3.24Å; M458-Y461 PolarHBondContact O-N 2.93Å; M458-Q462 PolarHBondContact O-N 3.35Å
459	Q	93.6	Very high	85.4	Confident	129 Å²	129	125.2 Å²	125.2	60%	0.603	59%	0.593	S	S	*	*	H	α-helix	trans	-66.8	-40.5	176.6	-172.8	171.9	70.9	0	0	112.2	Q455 Y456 Q462 Q463	Q455-Q459 WeakPolarHBondContact O-CB 3.38Å; Q455-Q459 PolarHBondContact O-N 3.23Å; Y456-Q459 PolarHBondContact O-N 3.25Å; Q459-Q462 PolarHBondContact O-N 3.15Å; Q459-Q463 WeakPolarHBondContact O-CB 3.45Å; Q459-Q463 PolarHBondContact O-N 3.31Å
460	Q	88.3	Confident	87	Confident	88 Å²	88	125.3 Å²	125.3	41%	0.411	59%	0.589	S	S	.	*	H	α-helix	trans	-60.1	-44.4	171.9	-75	-69.6	-36.6	0	0	111.7	Y456 Q457 Q462 Q463 N464	Y456-Q460 HydrophobicContact CD1-CG 4.04Å; Y456-Q460 HydrophobicContact CE1-CG 3.89Å; Y456-Q460 WeakPolarHBondContact O-CG 3.48Å; Y456-Q460 PolarHBondContact O-N 3.43Å; Q457-Q460 PolarHBondContact O-N 3.36Å; Q460-Q462 PolarHBondContact O-N 3.44Å; Q460-Q463 PolarHBondContact O-N 3.44Å; Q460-N464 WeakPolarHBondContact O-CB 3.44Å; Q460-N464 PolarHBondContact O-N 3.49Å
461	Y	92.1	Very high	88.3	Confident	154 Å²	154	126.3 Å²	126.3	60%	0.604	59%	0.585	S	S	*	*	H	α-helix	trans	-61	-45.5	177.1	-175.7	-94.8	0	0	0	112.1	Q457 M458 N464 Q465	Q457-Y461 PolarHBondContact O-N 3.07Å; M458-Y461 PolarHBondContact O-N 2.93Å; Y461-N464 PolarHBondContact O-N 3.36Å; Y461-Q465 HydrophobicContact CD1-CG 4.28Å; Y461-Q465 HydrophobicContact CE1-CG 3.91Å; Y461-Q465 WeakPolarHBondContact O-CG 3.27Å; Y461-Q465 PolarHBondContact O-N 3.12Å; Y461-Q465 PolarHBondContact OH-NE2 3.21Å
462	Q	93.1	Very high	89.4	Confident	132 Å²	132	124.8 Å²	124.8	62%	0.617	58%	0.58	S	S	*	*	H	α-helix	trans	-64.9	-39.4	178.6	-168.7	175.5	65.3	0	0	112.5	M458 Q459 Q460 Q465 Q466	M458-Q462 PolarHBondContact O-N 3.35Å; Q459-Q462 PolarHBondContact O-N 3.15Å; Q460-Q462 PolarHBondContact O-N 3.44Å; Q462-Q465 PolarHBondContact O-N 3.3Å; Q462-Q466 PolarHBondContact O-N 3.32Å
463	Q	91.7	Very high	90.4	Very high	123 Å²	123	123.2 Å²	123.2	58%	0.575	57%	0.573	S	S	*	*	H	α-helix	trans	-64.7	-38.5	174.3	-176.7	169.5	64.4	0	0	112.1	Q459 Q460 Q466 F467	Q459-Q463 WeakPolarHBondContact O-CB 3.45Å; Q459-Q463 PolarHBondContact O-N 3.31Å; Q460-Q463 PolarHBondContact O-N 3.44Å; Q463-Q466 PolarHBondContact O-N 2.99Å; Q463-F467 PolarHBondContact O-N 3.46Å
464	N	95.4	Very high	91.2	Very high	107 Å²	107	121.7 Å²	121.7	57%	0.572	56%	0.564	S	S	*	*	H	α-helix	trans	-68.7	-37	179	-157.1	-7.2	0	0	0	112	Q460 Y461 F467 R468	Q460-N464 WeakPolarHBondContact O-CB 3.44Å; Q460-N464 PolarHBondContact O-N 3.49Å; Y461-N464 PolarHBondContact O-N 3.36Å; N464-F467 PolarHBondContact O-N 2.97Å; N464-R468 PolarHBondContact O-N 3.4Å
465	Q	92.8	Very high	91.5	Very high	81 Å²	81	124.3 Å²	124.3	38%	0.379	57%	0.569	S	S	.	*	H	α-helix	trans	-61.3	-42.6	171.4	-71.6	-72.8	12.9	0	0	112.4	Y461 Q462 R468 M469	Y461-Q465 HydrophobicContact CD1-CG 4.28Å; Y461-Q465 HydrophobicContact CE1-CG 3.91Å; Y461-Q465 WeakPolarHBondContact O-CG 3.27Å; Y461-Q465 PolarHBondContact O-N 3.12Å; Y461-Q465 PolarHBondContact OH-NE2 3.21Å; Q462-Q465 PolarHBondContact O-N 3.3Å; Q465-R468 PolarHBondContact O-N 2.94Å; Q465-M469 PolarHBondContact O-N 2.71Å; Q465-M469 VanDerWaalsContact O-N 3.08Å
466	Q	92.4	Very high	91.8	Very high	135 Å²	135	123.1 Å²	123.1	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-63.5	-40.1	174.6	-71.9	-177.2	-11.2	0	0	112.4	Q462 Q463 M469 H470	Q462-Q466 PolarHBondContact O-N 3.32Å; Q463-Q466 PolarHBondContact O-N 2.99Å; Q466-M469 PolarHBondContact O-N 2.85Å; Q466-H470 PolarHBondContact O-N 2.59Å
467	F	95.2	Very high	91.6	Very high	129 Å²	129	121.8 Å²	121.8	57%	0.566	56%	0.563	S	S	*	*	H	α-helix	trans	-63.5	-43.9	176.6	-172.6	-98.5	0	0	0	112.2	Q463 N464 M469 H470 Q471	Q463-F467 PolarHBondContact O-N 3.46Å; N464-F467 PolarHBondContact O-N 2.97Å; F467-M469 PolarHBondContact O-N 3.45Å; F467-H470 PolarHBondContact O-N 3.22Å; F467-Q471 PolarHBondContact O-N 3.33Å
468	R	92.7	Very high	91.5	Very high	165 Å²	165	120.4 Å²	120.4	62%	0.623	56%	0.556	S	S	*	*	H	α-helix	trans	-60.6	-41.8	175.5	-179.1	177.3	-79.3	-164.9	-4.9	112.3	N464 Q465 Q471 M472	N464-R468 PolarHBondContact O-N 3.4Å; Q465-R468 PolarHBondContact O-N 2.94Å; R468-Q471 PolarHBondContact O-N 2.99Å; R468-M472 PolarHBondContact O-N 3.03Å; R468-M472 VanDerWaalsContact O-N 3.13Å
469	M	92.9	Very high	91	Very high	128 Å²	128	119.7 Å²	119.7	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-60.2	-45.7	173.8	-82	-71.4	-70.3	0	0	112.2	Q465 Q466 F467 M472 Q473	Q465-M469 PolarHBondContact O-N 2.71Å; Q465-M469 VanDerWaalsContact O-N 3.08Å; Q466-M469 PolarHBondContact O-N 2.85Å; F467-M469 PolarHBondContact O-N 3.45Å; M469-M472 PolarHBondContact O-N 3.47Å; M469-Q473 PolarHBondContact O-N 2.86Å; M469-Q473 VanDerWaalsContact O-N 3.08Å
470	H	94.8	Very high	90.3	Very high	106 Å²	106	120.3 Å²	120.3	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-66.7	-39.5	-179.6	-171	61.1	0	0	0	112.6	Q466 F467 M472 Q473 Q474	Q466-H470 PolarHBondContact O-N 2.59Å; F467-H470 PolarHBondContact O-N 3.22Å; H470-M472 PolarHBondContact O-N 3.22Å; H470-Q473 PolarHBondContact O-N 3.38Å; H470-Q474 PolarHBondContact O-N 3Å
471	Q	91.9	Very high	89.5	Confident	118 Å²	118	123.9 Å²	123.9	55%	0.551	57%	0.569	S	S	*	*	H	α-helix	trans	-61.3	-42.8	174.9	-172	179.3	52.5	0	0	112	F467 R468 Q474 Q475	F467-Q471 PolarHBondContact O-N 3.33Å; R468-Q471 PolarHBondContact O-N 2.99Å; Q471-Q474 PolarHBondContact O-N 3.01Å; Q471-Q475 PolarHBondContact O-N 3.5Å
472	M	90.7	Very high	88.3	Confident	115 Å²	115	124.6 Å²	124.6	57%	0.567	58%	0.58	S	S	*	*	H	α-helix	trans	-62.4	-43.1	176	-166.4	-163.3	-55.3	0	0	111.8	R468 M469 H470 Q475 Q476	R468-M472 PolarHBondContact O-N 3.03Å; R468-M472 VanDerWaalsContact O-N 3.13Å; M469-M472 PolarHBondContact O-N 3.47Å; H470-M472 PolarHBondContact O-N 3.22Å; M472-Q475 PolarHBondContact O-N 3.34Å; M472-Q476 PolarHBondContact O-N 3.28Å
473	Q	93.7	Very high	86.6	Confident	111 Å²	111	125 Å²	125	52%	0.519	58%	0.582	S	S	.	*	H	α-helix	trans	-62.6	-42.3	177	-174.3	178.1	47.7	0	0	112.2	M469 H470 Q476 Q477	M469-Q473 PolarHBondContact O-N 2.86Å; M469-Q473 VanDerWaalsContact O-N 3.08Å; H470-Q473 PolarHBondContact O-N 3.38Å; Q473-Q476 PolarHBondContact O-N 2.92Å; Q473-Q477 PolarHBondContact O-N 2.81Å; Q473-Q477 VanDerWaalsContact O-N 3.09Å
474	Q	91.4	Very high	84.4	Confident	103 Å²	103	123.5 Å²	123.5	48%	0.481	58%	0.584	S	S	.	*	H	α-helix	trans	-65.1	-40.9	177.1	-173.5	177.1	85.8	0	0	111.9	H470 Q471 Q476 Q477 Q478	H470-Q474 PolarHBondContact O-N 3Å; Q471-Q474 PolarHBondContact O-N 3.01Å; Q474-Q476 VanDerWaalsContact C-N 3.34Å; Q474-Q476 PolarHBondContact O-N 3.38Å; Q474-Q477 PolarHBondContact O-N 3.38Å; Q474-Q478 PolarHBondContact O-N 3.04Å; Q474-Q478 VanDerWaalsContact O-N 3.17Å
475	Q	89.3	Confident	81.8	Confident	122 Å²	122	123.7 Å²	123.7	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-65.3	-36.7	176.3	-168.2	173.1	71.9	0	0	112	Q471 M472 Q478 Q479	Q471-Q475 PolarHBondContact O-N 3.5Å; M472-Q475 PolarHBondContact O-N 3.34Å; Q475-Q478 PolarHBondContact O-N 2.96Å; Q475-Q479 PolarHBondContact O-N 3.31Å; Q475-Q479 VanDerWaalsContact O-N 3.16Å
476	Q	89.1	Confident	79.4	Confident	114 Å²	114	129.2 Å²	129.2	53%	0.533	61%	0.614	S	S	.	*	H	α-helix	trans	-64.7	-40.4	173.6	-173.2	177.5	86.3	0	0	112.3	M472 Q473 Q474 Q478 Q479 F480	M472-Q476 PolarHBondContact O-N 3.28Å; Q473-Q476 PolarHBondContact O-N 2.92Å; Q474-Q476 VanDerWaalsContact C-N 3.34Å; Q474-Q476 PolarHBondContact O-N 3.38Å; Q476-Q478 VanDerWaalsContact C-N 3.33Å; Q476-Q478 PolarHBondContact O-N 2.83Å; Q476-Q479 PolarHBondContact O-N 3.28Å; Q476-F480 HydrophobicContact CG-CD2 4.15Å; Q476-F480 HydrophobicContact CG-CE2 3.84Å; Q476-F480 WeakPolarHBondContact O-CD2 3.3Å; Q476-F480 PolarHBondContact O-N 2.87Å
477	Q	86.1	Confident	76.9	Confident	120 Å²	120	129.8 Å²	129.8	56%	0.561	62%	0.622	S	S	*	*	H	α-helix	trans	-62.8	-37.3	174.8	-73.2	-174.9	-2.4	0	0	112.8	Q473 Q474 F480 Q481	Q473-Q477 PolarHBondContact O-N 2.81Å; Q473-Q477 VanDerWaalsContact O-N 3.09Å; Q474-Q477 PolarHBondContact O-N 3.38Å; Q477-F480 PolarHBondContact O-N 3.32Å; Q477-Q481 PolarHBondContact O-N 3.07Å
478	Q	84.3	Confident	74.2	Confident	115 Å²	115	129.6 Å²	129.6	54%	0.537	63%	0.633	S	S	.	*	H	α-helix	trans	-65.1	-38.9	175	-68.5	178.7	15.5	0	0	112	Q474 Q475 Q476 F480 Q481 M482	Q474-Q478 PolarHBondContact O-N 3.04Å; Q474-Q478 VanDerWaalsContact O-N 3.17Å; Q475-Q478 PolarHBondContact O-N 2.96Å; Q476-Q478 VanDerWaalsContact C-N 3.33Å; Q476-Q478 PolarHBondContact O-N 2.83Å; Q478-F480 VanDerWaalsContact C-N 3.32Å; Q478-F480 PolarHBondContact O-N 3.44Å; Q478-Q481 PolarHBondContact O-N 3.46Å; Q478-M482 WeakPolarHBondContact O-CG 3.08Å; Q478-M482 PolarHBondContact O-N 2.77Å; Q478-M482 VanDerWaalsContact O-N 3.16Å
479	Q	80.4	Confident	71.5	Confident	118 Å²	118	129.8 Å²	129.8	55%	0.551	65%	0.646	S	S	*	*	H	α-helix	trans	-62.7	-36.9	174.4	-71.4	-172.4	-1.4	0	0	112.6	Q475 Q476 M482 Q483	Q475-Q479 PolarHBondContact O-N 3.31Å; Q475-Q479 VanDerWaalsContact O-N 3.16Å; Q476-Q479 PolarHBondContact O-N 3.28Å; Q479-M482 PolarHBondContact O-N 2.82Å; Q479-Q483 WeakPolarHBondContact O-CG 3.44Å; Q479-Q483 PolarHBondContact O-N 2.94Å
480	F	78.6	Confident	69	Low	143 Å²	143	129.5 Å²	129.5	63%	0.627	65%	0.651	S	S	*	*	H	α-helix	trans	-68.1	-37.7	175.6	-80.4	-64.8	0	0	0	113.4	Q476 Q477 Q478 M482 Q483	Q476-F480 HydrophobicContact CG-CD2 4.15Å; Q476-F480 HydrophobicContact CG-CE2 3.84Å; Q476-F480 WeakPolarHBondContact O-CD2 3.3Å; Q476-F480 PolarHBondContact O-N 2.87Å; Q477-F480 PolarHBondContact O-N 3.32Å; Q478-F480 VanDerWaalsContact C-N 3.32Å; Q478-F480 PolarHBondContact O-N 3.44Å; F480-M482 VanDerWaalsContact C-N 3.31Å; F480-M482 PolarHBondContact O-N 2.83Å; F480-Q483 PolarHBondContact O-N 2.64Å
481	Q	71.4	Confident	66.5	Low	163 Å²	163	130.2 Å²	130.2	76%	0.762	67%	0.665	S	S	*	*	H	α-helix	trans	-64.9	-35.9	174.4	-70.2	-169.7	11.4	0	0	112.4	Q477 Q478 Q483	Q477-Q481 PolarHBondContact O-N 3.07Å; Q478-Q481 PolarHBondContact O-N 3.46Å; Q481-Q483 PolarHBondContact O-N 3.1Å
482	M	65.6	Low	63.7	Low	168 Å²	168	129 Å²	129	83%	0.828	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-11.6	178.8	-70	-73.4	-73.3	0	0	114.3	Q478 Q479 F480	Q478-M482 WeakPolarHBondContact O-CG 3.08Å; Q478-M482 PolarHBondContact O-N 2.77Å; Q478-M482 VanDerWaalsContact O-N 3.16Å; Q479-M482 PolarHBondContact O-N 2.82Å; F480-M482 VanDerWaalsContact C-N 3.31Å; F480-M482 PolarHBondContact O-N 2.83Å
483	Q	57.9	Low	60.9	Low	142 Å²	142	134.6 Å²	134.6	66%	0.664	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	4.3	-178	-70.4	-176.7	20.6	0	0	114.4	Q479 F480 Q481 P485	Q479-Q483 WeakPolarHBondContact O-CG 3.44Å; Q479-Q483 PolarHBondContact O-N 2.94Å; F480-Q483 PolarHBondContact O-N 2.64Å; Q481-Q483 PolarHBondContact O-N 3.1Å; Q483-P485 WeakPolarHBondContact O-CD 3.35Å
484	S	45	Very low	58.2	Low	90 Å²	90	135.2 Å²	135.2	63%	0.629	70%	0.703	S	S	*	*			trans	-71.3	116.4	177.5	-169.7	0	0	0	0	111	K486	S484-K486 PolarHBondContact O-N 3.39Å
485	P	41.7	Very low	55.5	Low	111 Å²	111	136.9 Å²	136.9	72%	0.721	72%	0.715	S	S	*	*			trans	-70.4	123.6	-175.2	28.2	-34.1	0	0	0	111.3	Q483	Q483-P485 WeakPolarHBondContact O-CD 3.35Å
486	K	42.8	Very low	53	Low	198 Å²	198	138.6 Å²	138.6	86%	0.861	72%	0.724	S	S	*	*			trans	-94.4	106	169.1	-69	-177.2	179.2	179.7	0	109	S484	S484-K486 PolarHBondContact O-N 3.39Å
487	N	38.9	Very low	50.2	Low	147 Å²	147	141.3 Å²	141.3	79%	0.786	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-68.8	126.7	168.8	-71.2	-11.2	0	0	0	109.2	L489	N487-L489 PolarHBondContact O-N 3.09Å
488	P	39.5	Very low	47.9	Very low	125 Å²	125	140.5 Å²	140.5	81%	0.812	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-72.5	124.7	169.7	29.9	-31.9	0	0	0	109.2
489	L	34.5	Very low	45.8	Very low	168 Å²	168	142 Å²	142	88%	0.88	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-101.6	121.8	176.8	-133.4	163.1	0	0	0	108.2	N487	N487-L489 PolarHBondContact O-N 3.09Å
490	V	41	Very low	43.9	Very low	123 Å²	123	145.1 Å²	145.1	75%	0.745	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-79.8	128.8	-175.1	-179.3	0	0	0	0	110	A492	V490-A492 PolarHBondContact O-N 3.25Å
491	P	42.2	Very low	42.2	Very low	121 Å²	121	147 Å²	147	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.8	118.4	166.2	-8	25.3	0	0	0	109.6
492	A	32.9	Very low	40.8	Very low	92 Å²	92	144.8 Å²	144.8	76%	0.76	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-90.1	148.4	166.6	0	0	0	0	0	110	V490	V490-A492 PolarHBondContact O-N 3.25Å
493	Y	33.6	Very low	39.6	Very low	232 Å²	232	143.8 Å²	143.8	91%	0.91	79%	0.785	S	S	*	*			trans	-109.1	114.9	175.3	-116.4	-86	0	0	0	109.2
494	T	35.6	Very low	39.6	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	78%	0.782	S	S	*	*			trans	176.5	146.7	163.6	40.7	0	0	0	0	107.1
495	D	35.9	Very low	40.1	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	79%	0.788	S	S	*	*			cis	-169.4	165.9	-31.7	-145	-16.2	0	0	0	105.8
496	E	36.3	Very low	40.6	Very low	159 Å²	159	142.9 Å²	142.9	74%	0.743	79%	0.789	S	S	*	*			trans	56.3	135.4	166.5	-56.8	-79	69.8	0	0	118.4
497	D	29.4	Very low	41.5	Very low	170 Å²	170	138.8 Å²	138.8	91%	0.909	78%	0.783	S	S	*	*				-162	122.3	126.3	-115.7	-18.4	0	0	0	108.6
498	S	38.8	Very low	41.7	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	79%	0.785	S	S	*	*			trans	-98.4	163.1	174.4	-168.7	0	0	0	0	109.5
499	D	39.6	Very low	41.7	Very low	147 Å²	147	141.2 Å²	141.2	79%	0.786	79%	0.787	S	S	*	*			trans	-56.6	141	-178.3	-46.9	-95.7	0	0	0	113.7
500	E	41.2	Very low	42.4	Very low	183 Å²	183	138.2 Å²	138.2	86%	0.855	78%	0.777	S	S	*	*				174.6	147.1	103.4	-92.6	-174.2	131	0	0	115.4
501	E	42.7	Very low	41.9	Very low	184 Å²	184	140.7 Å²	140.7	86%	0.86	78%	0.781	S	S	*	*			trans	67.6	134.6	146.3	-155.8	145.2	-121.2	0	0	123.2
502	C	42.5	Very low	41.2	Very low	115 Å²	115	140.1 Å²	140.1	78%	0.777	78%	0.775	S	S	*	*			trans	-105.6	168.7	165.4	-56.3	0	0	0	0	108.3
503	D	40.4	Very low	41.3	Very low	148 Å²	148	140.4 Å²	140.4	79%	0.791	77%	0.771	S	S	*	*			cis	-157.9	-130.5	33.1	-164.3	16.1	0	0	0	110.2
504	P	57.8	Low	41.2	Very low	92 Å²	92	135.2 Å²	135.2	60%	0.597	76%	0.764	S	S	*	*			trans	-132.2	-154.2	-141.5	45.3	-22.5	0	0	0	114.3
505	P	55.1	Low	41.1	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	77%	0.765	S	S	*	*				-114.7	-115.7	-53.9	26.3	-3.6	0	0	0	112.9
506	P	51.6	Low	41	Very low	114 Å²	114	132.6 Å²	132.6	74%	0.74	76%	0.762	S	S	*	*			trans	-125.6	-146.8	-137	37.5	-11.6	0	0	0	115.3
507	P	62.7	Low	41	Very low	112 Å²	112	135.3 Å²	135.3	73%	0.727	77%	0.765	S	S	*	*				-105.8	172.7	-101.7	43.2	-29.6	0	0	0	114
508	P	42.5	Very low	41.2	Very low	128 Å²	128	134 Å²	134	83%	0.831	76%	0.755	S	S	*	*				-153	-174.2	93.7	40.2	-20.9	0	0	0	116
509	K	39.3	Very low	41	Very low	195 Å²	195	134.5 Å²	134.5	85%	0.848	76%	0.759	S	S	*	*			trans	-80.9	-179.8	163.1	-40.5	174.8	-176.9	175.7	0	109.5
510	P	49.9	Very low	40.6	Very low	105 Å²	105	132.1 Å²	132.1	68%	0.682	75%	0.754	S	S	*	*			cis	-143.6	-170.2	1.6	38	-15.2	0	0	0	116.4
511	Q	29.4	Very low	40.5	Very low	175 Å²	175	129.9 Å²	129.9	82%	0.818	75%	0.752	S	S	*	*			trans	76.7	144.6	138.2	-95.4	-177.3	-14.1	0	0	124.8
512	V	28.4	Very low	41	Very low	109 Å²	109	126.2 Å²	126.2	66%	0.661	74%	0.744	S	S	*	*			trans	77.2	97.6	143.4	175.9	0	0	0	0	120.9
513	S	34.9	Very low	40.9	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	74%	0.74	S	S	*	*				50.8	163.7	113.8	-43.1	0	0	0	0	124.8
514	T	30.7	Very low	41.1	Very low	123 Å²	123	126.9 Å²	126.9	76%	0.755	74%	0.741	S	S	*	*			trans	83.7	116.4	166	74.3	0	0	0	0	115.5
515	S	34.3	Very low	41.2	Very low	113 Å²	113	128 Å²	128	79%	0.79	75%	0.749	S	S	*	*				94.7	155	84.2	-61.6	0	0	0	0	111.8
516	S	33.4	Very low	41.5	Very low	94 Å²	94	127.9 Å²	127.9	66%	0.657	75%	0.748	S	S	*	*			cis	-165	152	23.3	-149.7	0	0	0	0	114.4
517	R	37.3	Very low	42.2	Very low	217 Å²	217	128 Å²	128	82%	0.819	75%	0.749	S	S	*	*			trans	66.9	153.6	139.1	-91.2	-177.1	170.3	-168.6	-2.9	120.8
518	M	32.9	Very low	41.9	Very low	143 Å²	143	128.6 Å²	128.6	70%	0.704	75%	0.753	S	S	*	*			cis	-143.9	163.8	5.6	-71.3	-155.2	70.1	0	0	114.2
519	S	33.6	Very low	42.6	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	75%	0.747	S	S	*	*			trans	65	145.4	160.1	-85.6	0	0	0	0	119.4
520	S	31.9	Very low	42.3	Very low	97 Å²	97	126 Å²	126	68%	0.678	74%	0.742	S	S	*	*			cis	-158.5	124.1	-4.6	42.3	0	0	0	0	108.4
521	V	39	Very low	41.4	Very low	136 Å²	136	127.6 Å²	127.6	82%	0.824	74%	0.74	S	S	*	*				69.7	130.9	86.4	166.1	0	0	0	0	113.8
522	P	53	Low	41.7	Very low	107 Å²	107	127.1 Å²	127.1	70%	0.695	74%	0.742	S	S	*	*			cis	-142.7	176	-13.6	38	-17.7	0	0	0	118.6
523	S	40.2	Very low	41.7	Very low	97 Å²	97	125.1 Å²	125.1	68%	0.678	74%	0.744	S	S	*	*			trans	62.1	130	150.3	50.5	0	0	0	0	121.4
524	H	44.4	Very low	42.2	Very low	179 Å²	179	128.3 Å²	128.3	83%	0.829	75%	0.753	S	S	*	*			cis	73.4	149.3	40.6	-69.6	-50	0	0	0	115.1
525	P	61.4	Low	43.3	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	76%	0.756	S	S	*	*			cis	-128.5	-141.2	22.4	33	-7.8	0	0	0	114.6
526	P	61.3	Low	43.7	Very low	114 Å²	114	131.3 Å²	131.3	74%	0.74	76%	0.759	S	S	*	*				-125.2	172.8	-91.2	40.1	-24.8	0	0	0	116.4
527	P	66.2	Low	44	Very low	118 Å²	118	133.9 Å²	133.9	77%	0.766	77%	0.77	S	S	*	*			trans	-114.6	154.8	179.9	40	-31.2	0	0	0	116.1
528	P	56.3	Low	44	Very low	124 Å²	124	126.3 Å²	126.3	81%	0.805	76%	0.76	S	S	*	*			trans	-102	163	169.4	37.9	-33.5	0	0	0	114.7
529	P	57.7	Low	44.2	Very low	108 Å²	108	130.7 Å²	130.7	70%	0.701	77%	0.771	S	S	*	*			trans	-127.3	-160.6	178.4	36.4	-16.1	0	0	0	113.7
530	Q	32.2	Very low	45.1	Very low	159 Å²	159	130.9 Å²	130.9	74%	0.743	77%	0.769	S	S	*	*			trans	68.5	173.8	166.2	-64.8	-174.5	25.9	0	0	115
531	Q	31.2	Very low	45.2	Very low	139 Å²	139	129.5 Å²	129.5	65%	0.65	77%	0.77	S	S	*	*			cis	-161	167.6	-22.6	-117.8	-178.6	18	0	0	108.6
532	L	34.5	Very low	45.2	Very low	165 Å²	165	131.5 Å²	131.5	86%	0.864	77%	0.773	S	S	*	*			trans	60.8	170.7	149.9	-72.4	164.9	0	0	0	119.3
533	G	29.8	Very low	44.9	Very low	67 Å²	67	130.7 Å²	130.7	69%	0.691	77%	0.767	S	S	*	*			trans	119.3	76.2	153.5	0	0	0	0	0	118.2
534	N	43.9	Very low	44.6	Very low	165 Å²	165	132.9 Å²	132.9	88%	0.882	77%	0.771	S	S	*	*			trans	-68.5	146.4	140.7	-71	-22.4	0	0	0	107.6
535	P	55.7	Low	44.1	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	77%	0.771	S	S	*	*				-143.4	176.9	104.3	37.9	-23.6	0	0	0	115.1
536	M	42.4	Very low	42.7	Very low	174 Å²	174	132.7 Å²	132.7	86%	0.857	77%	0.773	S	S	*	*			trans	-75	172.1	179	-65.5	149.5	46.7	0	0	114
537	V	40.1	Very low	42.1	Very low	147 Å²	147	132.7 Å²	132.7	89%	0.891	77%	0.773	S	S	*	*			trans	126.1	126.7	156.9	171.7	0	0	0	0	111.1
538	G	36.8	Very low	40.5	Very low	59 Å²	59	133.4 Å²	133.4	61%	0.608	77%	0.77	S	S	*	*			cis	164.2	127.9	-11.8	0	0	0	0	0	113.8
539	Y	35.7	Very low	39.5	Very low	234 Å²	234	135 Å²	135	92%	0.918	77%	0.767	S	S	*	*			trans	64.5	167.2	170.7	-76.1	-105.9	0	0	0	116.1
540	P	54.2	Low	38.9	Very low	117 Å²	117	137.9 Å²	137.9	76%	0.76	78%	0.775	S	S	*	*				-137.2	168.5	-58.1	38.8	-23.6	0	0	0	113.8
541	G	33.7	Very low	39.5	Very low	68 Å²	68	136.2 Å²	136.2	70%	0.701	78%	0.778	S	S	*	*			trans	155.1	97	154.7	0	0	0	0	0	119.6
542	M	38.9	Very low	39.7	Very low	179 Å²	179	137.7 Å²	137.7	88%	0.882	79%	0.79	S	S	*	*			trans	64.6	160.8	148.1	-72	-80	84.8	0	0	119
543	P	47	Very low	40.2	Very low	89 Å²	89	136 Å²	136	58%	0.578	79%	0.787	S	S	*	*			trans	-134.4	-177.2	-137.9	45.5	-30.3	0	0	0	116.3
544	L	33.3	Very low	40.4	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	79%	0.792	S	S	*	*			trans	71.2	145.3	162.3	-58.7	173.5	0	0	0	116.8
545	Q	33.4	Very low	40.1	Very low	177 Å²	177	136.5 Å²	136.5	83%	0.827	79%	0.789	S	S	*	*			cis	-163.3	124	-31.2	-140.7	176.4	16.1	0	0	107.8
546	S	33.3	Very low	39.2	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	79%	0.789	S	S	*	*			trans	-169.5	171.6	173.4	71.2	0	0	0	0	111.1
547	P	47.8	Very low	39	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	79%	0.791	S	S	*	*			cis	-120	179.1	-42.6	34.5	-21.4	0	0	0	110.1
548	N	33.2	Very low	39.1	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	79%	0.793	S	S	*	*			trans	-151	149.5	161.2	-135.4	-20	0	0	0	115.2
549	H	34.7	Very low	39.2	Very low	157 Å²	157	137.1 Å²	137.1	73%	0.727	80%	0.799	S	S	*	*			trans	66.6	108.6	167.5	-52.8	-50.1	0	0	0	120.6
550	L	45.7	Very low	39.5	Very low	169 Å²	169	131.3 Å²	131.3	89%	0.885	79%	0.79	S	S	*	*			trans	-54.4	155.8	142	-63.8	160.8	0	0	0	111
551	P	43.3	Very low	39.2	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	79%	0.792	S	S	*	*				-136.1	-177.1	126.2	37.8	-27	0	0	0	114.6
552	L	36.3	Very low	40	Very low	170 Å²	170	137.7 Å²	137.7	89%	0.89	80%	0.799	S	S	*	*			trans	-90.3	174.1	-162.9	-74.9	150.3	0	0	0	115.5
553	T	44.7	Very low	40.8	Very low	130 Å²	130	134.7 Å²	134.7	80%	0.798	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.8	150.1	-176.3	46.7	0	0	0	0	115.2
554	P	35.1	Very low	41.6	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-103.5	161.3	160.9	37.3	-31	0	0	0	112.9
555	S	36.4	Very low	43.1	Very low	119 Å²	119	131.6 Å²	131.6	83%	0.832	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-90	155.2	-179.7	-54.4	0	0	0	0	113.9
556	P	38	Very low	44.5	Very low	126 Å²	126	128.2 Å²	128.2	82%	0.818	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-93.4	122.6	-177.3	34.5	-32.3	0	0	0	113.7
557	L	36.6	Very low	45.7	Very low	172 Å²	172	130.3 Å²	130.3	90%	0.901	76%	0.761	S	S	*	*			trans	-139.8	79.4	167.8	-82.8	176.8	0	0	0	111.3
558	S	43.3	Very low	46.3	Very low	131 Å²	131	130 Å²	130	92%	0.916	75%	0.749	S	S	*	*			trans	172.1	74.7	152.8	-80.2	0	0	0	0	109.7
559	A	38.5	Very low	48	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-101.4	144.8	160.8	0	0	0	0	0	108.1
560	P	42.6	Very low	49.7	Very low	113 Å²	113	127.8 Å²	127.8	73%	0.734	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-57.4	147	166.6	27.2	-34	0	0	0	109.1	K562	P560-K562 PolarHBondContact O-N 2.98Å
561	P	46.6	Very low	50.7	Low	125 Å²	125	124.5 Å²	124.5	81%	0.812	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-56.6	130.4	179.5	24.4	-33.4	0	0	0	109.2
562	K	51.1	Low	51.8	Low	193 Å²	193	125 Å²	125	84%	0.839	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-54.4	138.3	172.2	-74.4	-175.7	175.7	-177.8	0	108.2	P560 F564	P560-K562 PolarHBondContact O-N 2.98Å; K562-F564 PolarHBondContact O-N 2.83Å
563	P	56.7	Low	53.7	Low	116 Å²	116	118.6 Å²	118.6	75%	0.753	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-55	135.7	166.2	25.8	-33.2	0	0	0	108.3
564	F	63.1	Low	55	Low	126 Å²	126	116.3 Å²	116.3	55%	0.553	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-50.5	141.8	174.1	-69.5	-76.6	0	0	0	109.9	K562 Q568 Q569	K562-F564 PolarHBondContact O-N 2.83Å; F564-Q568 HydrophobicContact CB-CB 3.97Å; F564-Q568 HydrophobicContact CD1-CB 4.04Å; F564-Q568 HydrophobicContact CG-CB 4.46Å; F564-Q569 HydrophobicContact CB-CG 3.56Å
565	S	64.9	Low	56.9	Low	43 Å²	43	115.5 Å²	115.5	30%	0.301	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-61	156.4	171.2	70.8	0	0	0	0	110.1	E567 Q568 Q569	S565-E567 PolarHBondContact O-N 3.18Å; S565-Q568 WeakPolarHBondContact O-CA 3.39Å; S565-Q568 PolarHBondContact O-N 3.06Å; S565-Q568 WeakPolarHBondContact OG-CG 3.42Å; S565-Q568 PolarHBondContact OG-N 2.95Å; S565-Q569 PolarHBondContact O-N 2.86Å
566	P	63.1	Low	58.5	Low	106 Å²	106	115 Å²	115	69%	0.688	63%	0.631	S	S	*	*	H	α-helix	trans	-52.3	-38.9	176.7	-29.3	36.8	0	0	0	113	Q569 H570	P566-Q569 PolarHBondContact O-N 3.33Å; P566-H570 WeakPolarHBondContact O-CB 3.27Å; P566-H570 PolarHBondContact O-N 3.42Å
567	E	57.7	Low	60.2	Low	156 Å²	156	118.6 Å²	118.6	73%	0.729	63%	0.628	S	S	*	*	H	α-helix	trans	-62.8	-41.1	172.8	-66.5	172.6	105.9	0	0	113.2	S565 H570 H571	S565-E567 PolarHBondContact O-N 3.18Å; E567-H570 PolarHBondContact O-N 2.65Å; E567-H571 VanDerWaalsContact O-CB 3.26Å; E567-H571 WeakPolarHBondContact O-CB 3.36Å; E567-H571 PolarHBondContact O-N 3.48Å
568	Q	61.6	Low	61.5	Low	108 Å²	108	114.9 Å²	114.9	51%	0.505	61%	0.606	S	S	.	*	H	α-helix	trans	-69.7	-36.5	177.3	-73.9	178.9	-10.8	0	0	111.9	F564 S565 F572	F564-Q568 HydrophobicContact CB-CB 3.97Å; F564-Q568 HydrophobicContact CD1-CB 4.04Å; F564-Q568 HydrophobicContact CG-CB 4.46Å; S565-Q568 WeakPolarHBondContact O-CA 3.39Å; S565-Q568 PolarHBondContact O-N 3.06Å; S565-Q568 WeakPolarHBondContact OG-CG 3.42Å; S565-Q568 PolarHBondContact OG-N 2.95Å; Q568-F572 VanDerWaalsContact O-CB 3.31Å; Q568-F572 WeakPolarHBondContact O-CB 3.3Å; Q568-F572 PolarHBondContact O-N 3.17Å
569	Q	68.6	Low	62.6	Low	115 Å²	115	112.6 Å²	112.6	54%	0.537	59%	0.587	S	S	.	*	H	α-helix	trans	-64.4	-44.8	171.4	-66.6	-170.6	-38.7	0	0	111.1	F564 S565 P566 F572 G573	F564-Q569 HydrophobicContact CB-CG 3.56Å; S565-Q569 PolarHBondContact O-N 2.86Å; P566-Q569 PolarHBondContact O-N 3.33Å; Q569-F572 PolarHBondContact O-N 2.72Å; Q569-G573 PolarHBondContact O-N 3.12Å
570	H	69.2	Low	64.3	Low	129 Å²	129	111.6 Å²	111.6	60%	0.597	57%	0.574	S	S	*	*	H	α-helix	trans	-60.1	-48	176	-169.3	-100.3	0	0	0	111.5	P566 E567 F572 G573 M574	P566-H570 WeakPolarHBondContact O-CB 3.27Å; P566-H570 PolarHBondContact O-N 3.42Å; E567-H570 PolarHBondContact O-N 2.65Å; H570-F572 PolarHBondContact O-N 2.94Å; H570-G573 PolarHBondContact O-N 3.03Å; H570-M574 VanDerWaalsContact CE1-SD 3.57Å; H570-M574 WeakPolarHBondContact O-CG 3.36Å; H570-M574 PolarHBondContact O-N 3.03Å
571	H	66.7	Low	65.6	Low	101 Å²	101	112 Å²	112	47%	0.468	56%	0.562	S	S	.	*	H	α-helix	trans	-70.7	-30	-178	-161.4	72.6	0	0	0	113.4	E567 K575	E567-H571 VanDerWaalsContact O-CB 3.26Å; E567-H571 WeakPolarHBondContact O-CB 3.36Å; E567-H571 PolarHBondContact O-N 3.48Å; H571-K575 WeakPolarHBondContact NE2-CE 3.24Å; H571-K575 PolarHBondContact NE2-NZ 3.33Å; H571-K575 PolarHBondContact O-N 3.42Å
572	F	66.3	Low	66.8	Low	133 Å²	133	114 Å²	114	58%	0.583	55%	0.554	S	S	*	*	H	α-helix	trans	-74.4	-39.6	171.3	-156	-84	0	0	0	111.5	Q568 Q569 H570 K575 M576	Q568-F572 VanDerWaalsContact O-CB 3.31Å; Q568-F572 WeakPolarHBondContact O-CB 3.3Å; Q568-F572 PolarHBondContact O-N 3.17Å; Q569-F572 PolarHBondContact O-N 2.72Å; H570-F572 PolarHBondContact O-N 2.94Å; F572-K575 PolarHBondContact O-N 3.38Å; F572-M576 HydrophobicContact CD1-CG 4.05Å; F572-M576 HydrophobicContact CE1-CG 4.03Å; F572-M576 HydrophobicContact CE1-SD 4.31Å; F572-M576 WeakPolarHBondContact O-CG 3.42Å; F572-M576 PolarHBondContact O-N 3.5Å
573	G	76.2	Confident	67.9	Low	37 Å²	37	111 Å²	111	38%	0.381	54%	0.541	S	S	.	.	H	α-helix	trans	-61.7	-43.6	173.5	0	0	0	0	0	112.9	Q569 H570 K575 M576 R577	Q569-G573 PolarHBondContact O-N 3.12Å; H570-G573 PolarHBondContact O-N 3.03Å; G573-K575 PolarHBondContact O-N 3.44Å; G573-M576 PolarHBondContact O-N 3.06Å; G573-R577 PolarHBondContact O-N 2.85Å
574	M	73.5	Confident	68.5	Low	82 Å²	82	110.7 Å²	110.7	40%	0.404	53%	0.529	S	S	.	.	H	α-helix	trans	-55.5	-51	172.2	-76.4	179.9	71.4	0	0	111.2	H570 M576 R577 E578	H570-M574 VanDerWaalsContact CE1-SD 3.57Å; H570-M574 WeakPolarHBondContact O-CG 3.36Å; H570-M574 PolarHBondContact O-N 3.03Å; M574-M576 VanDerWaalsContact C-N 3.35Å; M574-M576 PolarHBondContact O-N 3.05Å; M574-R577 CarbonylContact O-C 3.58Å; M574-R577 WeakPolarHBondContact O-CA 3.35Å; M574-R577 WeakPolarHBondContact O-CB 3.23Å; M574-R577 PolarHBondContact O-N 3.2Å; M574-E578 WeakPolarHBondContact O-CG 3.45Å; M574-E578 PolarHBondContact O-N 2.68Å
575	K	74.2	Confident	68.7	Low	105 Å²	105	107.8 Å²	107.8	46%	0.457	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-33.3	-178.1	-77.6	172.5	172.1	168.4	0	113.9	H571 F572 G573 R577 T579	H571-K575 WeakPolarHBondContact NE2-CE 3.24Å; H571-K575 PolarHBondContact NE2-NZ 3.33Å; H571-K575 PolarHBondContact O-N 3.42Å; F572-K575 PolarHBondContact O-N 3.38Å; G573-K575 PolarHBondContact O-N 3.44Å; K575-R577 VanDerWaalsContact C-N 3.34Å; K575-T579 WeakPolarHBondContact O-CB 3.49Å; K575-T579 WeakPolarHBondContact O-CG2 3.24Å; K575-T579 PolarHBondContact O-N 2.83Å; K575-T579 PolarHBondContact O-OG1 2.9Å
576	M	71.2	Confident	68.7	Low	110 Å²	110	110.8 Å²	110.8	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-67.5	-33.7	170.3	-70.9	-64.8	-62.5	0	0	112.3	F572 G573 M574 T579 S580	F572-M576 HydrophobicContact CD1-CG 4.05Å; F572-M576 HydrophobicContact CE1-CG 4.03Å; F572-M576 HydrophobicContact CE1-SD 4.31Å; F572-M576 WeakPolarHBondContact O-CG 3.42Å; F572-M576 PolarHBondContact O-N 3.5Å; G573-M576 PolarHBondContact O-N 3.06Å; M574-M576 VanDerWaalsContact C-N 3.35Å; M574-M576 PolarHBondContact O-N 3.05Å; M576-T579 PolarHBondContact O-OG1 3.39Å; M576-S580 PolarHBondContact O-N 3.26Å; M576-S580 PolarHBondContact O-OG 2.61Å
577	R	72.7	Confident	69.1	Low	200 Å²	200	113.6 Å²	113.6	76%	0.755	53%	0.525	S	S	*	.	H	α-helix	trans	-72.8	-46.6	174.9	-165.1	178.7	-68.1	176.8	-3.3	111.7	G573 M574 K575 T579 S580 Y581	G573-R577 PolarHBondContact O-N 2.85Å; M574-R577 CarbonylContact O-C 3.58Å; M574-R577 WeakPolarHBondContact O-CA 3.35Å; M574-R577 WeakPolarHBondContact O-CB 3.23Å; M574-R577 PolarHBondContact O-N 3.2Å; K575-R577 VanDerWaalsContact C-N 3.34Å; R577-T579 PolarHBondContact O-N 3.38Å; R577-S580 WeakPolarHBondContact O-CB 3.36Å; R577-S580 PolarHBondContact O-N 2.9Å; R577-S580 VanDerWaalsContact O-N 3.14Å; R577-Y581 PolarHBondContact O-N 3.29Å
578	E	63.9	Low	69.3	Low	94 Å²	94	113.1 Å²	113.1	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-57.7	-47.3	175	-70.7	174.7	143.2	0	0	112	M574 S580 Y581 W582	M574-E578 WeakPolarHBondContact O-CG 3.45Å; M574-E578 PolarHBondContact O-N 2.68Å; E578-S580 PolarHBondContact O-N 3.12Å; E578-Y581 WeakPolarHBondContact O-CB 3.37Å; E578-Y581 PolarHBondContact O-N 3.43Å; E578-W582 PolarHBondContact O-N 3.11Å
579	T	67.2	Low	69.1	Low	84 Å²	84	115.4 Å²	115.4	52%	0.515	54%	0.537	S	S	.	.	H	α-helix	trans	-69.3	-20.3	178.3	49.9	0	0	0	0	113.6	K575 M576 R577 K583	K575-T579 WeakPolarHBondContact O-CB 3.49Å; K575-T579 WeakPolarHBondContact O-CG2 3.24Å; K575-T579 PolarHBondContact O-N 2.83Å; K575-T579 PolarHBondContact O-OG1 2.9Å; M576-T579 PolarHBondContact O-OG1 3.39Å; R577-T579 PolarHBondContact O-N 3.38Å; T579-K583 WeakPolarHBondContact O-CB 3.33Å
580	S	73.8	Confident	68.7	Low	67 Å²	67	113.8 Å²	113.8	47%	0.469	54%	0.536	S	S	.	.	H	α-helix	trans	-75.9	-47.6	168.5	-57	0	0	0	0	110.7	M576 R577 E578 W582 K583 E584	M576-S580 PolarHBondContact O-N 3.26Å; M576-S580 PolarHBondContact O-OG 2.61Å; R577-S580 WeakPolarHBondContact O-CB 3.36Å; R577-S580 PolarHBondContact O-N 2.9Å; R577-S580 VanDerWaalsContact O-N 3.14Å; E578-S580 PolarHBondContact O-N 3.12Å; S580-W582 PolarHBondContact O-N 2.89Å; S580-K583 CarbonylContact O-C 3.33Å; S580-K583 WeakPolarHBondContact O-CB 3.48Å; S580-K583 PolarHBondContact O-N 3.04Å; S580-K583 VanDerWaalsContact O-N 3.09Å; S580-E584 PolarHBondContact O-N 3.49Å
581	Y	70.3	Confident	68.1	Low	121 Å²	121	116.7 Å²	116.7	48%	0.475	55%	0.546	S	S	.	.	H	α-helix	trans	-56.3	-48.2	177.8	178.5	-98.6	0	0	0	113.1	R577 E578 K583 E584 L585	R577-Y581 PolarHBondContact O-N 3.29Å; E578-Y581 WeakPolarHBondContact O-CB 3.37Å; E578-Y581 PolarHBondContact O-N 3.43Å; Y581-K583 VanDerWaalsContact C-N 3.26Å; Y581-K583 PolarHBondContact O-N 2.9Å; Y581-E584 WeakPolarHBondContact O-CB 3.31Å; Y581-E584 PolarHBondContact O-N 3.01Å; Y581-E584 VanDerWaalsContact O-N 3.09Å; Y581-L585 HydrophobicContact CD1-CD1 4.34Å; Y581-L585 HydrophobicContact CE1-CD1 3.81Å; Y581-L585 HydrophobicContact CE2-CD1 4.12Å; Y581-L585 PolarHBondContact O-N 2.86Å
582	W	70.6	Confident	67.4	Low	169 Å²	169	117.3 Å²	117.3	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-61.9	-33	176.4	-73.5	113.9	0	0	0	113.2	E578 S580 E584 L585 E586	E578-W582 PolarHBondContact O-N 3.11Å; S580-W582 PolarHBondContact O-N 2.89Å; W582-E584 VanDerWaalsContact C-N 3.33Å; W582-L585 HydrophobicContact CE3-CD2 4.21Å; W582-L585 HydrophobicContact CZ3-CD2 3.99Å; W582-E586 PolarHBondContact O-N 3.17Å; W582-E586 VanDerWaalsContact O-N 3.16Å
583	K	74.3	Confident	67.2	Low	130 Å²	130	114.9 Å²	114.9	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-77.1	-20.4	177.3	-170.2	174.8	-177.8	178.3	0	112.9	T579 S580 Y581	T579-K583 WeakPolarHBondContact O-CB 3.33Å; S580-K583 CarbonylContact O-C 3.33Å; S580-K583 WeakPolarHBondContact O-CB 3.48Å; S580-K583 PolarHBondContact O-N 3.04Å; S580-K583 VanDerWaalsContact O-N 3.09Å; Y581-K583 VanDerWaalsContact C-N 3.26Å; Y581-K583 PolarHBondContact O-N 2.9Å
584	E	68.9	Low	66.4	Low	109 Å²	109	118.6 Å²	118.6	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-79.6	-44.8	171.8	-155.4	119.9	-112.4	0	0	110.6	S580 Y581 W582 E586 R587 L588	S580-E584 PolarHBondContact O-N 3.49Å; Y581-E584 WeakPolarHBondContact O-CB 3.31Å; Y581-E584 PolarHBondContact O-N 3.01Å; Y581-E584 VanDerWaalsContact O-N 3.09Å; W582-E584 VanDerWaalsContact C-N 3.33Å; E584-E586 VanDerWaalsContact C-N 3.33Å; E584-E586 PolarHBondContact O-N 2.79Å; E584-R587 WeakPolarHBondContact O-CB 3.49Å; E584-R587 PolarHBondContact O-N 2.68Å; E584-L588 PolarHBondContact O-N 2.76Å; E584-L588 VanDerWaalsContact O-N 3.08Å
585	L	67.8	Low	65.8	Low	65 Å²	65	122.4 Å²	122.4	34%	0.34	58%	0.584	S	S	.	*	H	α-helix	trans	-53.8	-47.1	171.1	-113.2	81.6	0	0	0	112.1	Y581 W582 R587 L588 E589	Y581-L585 HydrophobicContact CD1-CD1 4.34Å; Y581-L585 HydrophobicContact CE1-CD1 3.81Å; Y581-L585 HydrophobicContact CE2-CD1 4.12Å; Y581-L585 PolarHBondContact O-N 2.86Å; W582-L585 HydrophobicContact CE3-CD2 4.21Å; W582-L585 HydrophobicContact CZ3-CD2 3.99Å; L585-R587 PolarHBondContact O-N 3.32Å; L585-L588 PolarHBondContact O-N 2.72Å; L585-E589 PolarHBondContact O-N 3.27Å
586	E	65.2	Low	65.6	Low	106 Å²	106	123.5 Å²	123.5	50%	0.495	59%	0.589	S	S	.	*	H	α-helix	trans	-67.2	-19.8	-179.9	-172.7	173.3	-150	0	0	113.5	W582 E584 T590	W582-E586 PolarHBondContact O-N 3.17Å; W582-E586 VanDerWaalsContact O-N 3.16Å; E584-E586 VanDerWaalsContact C-N 3.33Å; E584-E586 PolarHBondContact O-N 2.79Å; E586-T590 PolarHBondContact O-OG1 3.44Å
587	R	71.9	Confident	64.9	Low	165 Å²	165	123.8 Å²	123.8	62%	0.623	59%	0.592	S	S	*	*	H	α-helix	trans	-74.8	-48.7	167.1	-75.7	174.3	166.6	146.6	-9.7	110.7	E584 L585 E589 T590	E584-R587 WeakPolarHBondContact O-CB 3.49Å; E584-R587 PolarHBondContact O-N 2.68Å; L585-R587 PolarHBondContact O-N 3.32Å; R587-E589 VanDerWaalsContact C-N 3.3Å; R587-E589 PolarHBondContact O-N 3.23Å; R587-T590 VanDerWaalsContact O-CB 3.22Å; R587-T590 WeakPolarHBondContact O-CB 3.48Å; R587-T590 PolarHBondContact O-N 2.77Å; R587-T590 PolarHBondContact O-OG1 2.97Å
588	L	60.6	Low	64.5	Low	145 Å²	145	122 Å²	122	76%	0.759	59%	0.59	S	S	*	*	H	α-helix	trans	-63.6	-30	-178.3	-66.2	169.1	0	0	0	113.2	E584 L585 T590	E584-L588 PolarHBondContact O-N 2.76Å; E584-L588 VanDerWaalsContact O-N 3.08Å; L585-L588 PolarHBondContact O-N 2.72Å; L588-T590 PolarHBondContact O-N 3.26Å
589	E	58.4	Low	64.5	Low	157 Å²	157	124.4 Å²	124.4	73%	0.734	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-13.4	170.8	-73.1	-156.9	144.1	0	0	114.3	L585 R587 K591	L585-E589 PolarHBondContact O-N 3.27Å; R587-E589 VanDerWaalsContact C-N 3.3Å; R587-E589 PolarHBondContact O-N 3.23Å; E589-K591 VanDerWaalsContact C-N 3.34Å; E589-K591 PolarHBondContact O-N 2.82Å
590	T	60.4	Low	64.1	Low	81 Å²	81	127 Å²	127	50%	0.497	61%	0.608	S	S	.	*	S	Bend	trans	-79.9	79.5	-177.2	-54.2	0	0	0	0	110.9	E586 R587 L588 K803	E586-T590 PolarHBondContact O-OG1 3.44Å; R587-T590 VanDerWaalsContact O-CB 3.22Å; R587-T590 WeakPolarHBondContact O-CB 3.48Å; R587-T590 PolarHBondContact O-N 2.77Å; R587-T590 PolarHBondContact O-OG1 2.97Å; L588-T590 PolarHBondContact O-N 3.26Å; T590-K803 PolarHBondContact OG1-NZ 2.99Å; T590-K803 VanDerWaalsContact OG1-NZ 3.14Å
591	K	55.2	Low	63.3	Low	189 Å²	189	130.4 Å²	130.4	82%	0.822	62%	0.619	S	S	*	*			trans	-48	136	-178.7	-62.2	-174.2	179.5	-173.5	0	113.2	E589	E589-K591 VanDerWaalsContact C-N 3.34Å; E589-K591 PolarHBondContact O-N 2.82Å
592	P	52.2	Low	62.6	Low	114 Å²	114	128.6 Å²	128.6	74%	0.74	63%	0.625	S	S	*	*			trans	-67	147.2	-179.4	27.2	-34.7	0	0	0	112.9	V594	P592-V594 PolarHBondContact O-N 2.66Å; P592-V594 VanDerWaalsContact O-N 3.15Å
593	D	62	Low	61.5	Low	82 Å²	82	125.2 Å²	125.2	44%	0.439	63%	0.627	S	S	.	*			trans	-84.2	89.2	-175.8	-172.4	-5.1	0	0	0	111.7	E595 K596	D593-E595 PolarHBondContact O-N 2.88Å; D593-E595 VanDerWaalsContact O-N 3.13Å; D593-E595 PolarHBondContact OD1-N 3.22Å; D593-K596 HydrophobicContact CB-CG 4.41Å; D593-K596 PolarHBondContact O-N 3.37Å; D593-K596 IonicContact OD2-NZ 3.84Å; D593-K596 PolarHBondContact OD2-NZ 3.08Å
594	V	59.3	Low	59.8	Low	115 Å²	115	123.7 Å²	123.7	70%	0.697	63%	0.633	S	S	*	*	H	α-helix	trans	-60.4	-23.1	-172	-162.2	0	0	0	0	113.4	P592 K598	P592-V594 PolarHBondContact O-N 2.66Å; P592-V594 VanDerWaalsContact O-N 3.15Å; V594-K598 PolarHBondContact O-N 3.35Å
595	E	61	Low	58.2	Low	162 Å²	162	123.5 Å²	123.5	76%	0.757	64%	0.643	S	S	*	*	H	α-helix	trans	-70.8	-32.5	176.6	-66.3	-160.4	127.4	0	0	112.2	D593 K598 Q599	D593-E595 PolarHBondContact O-N 2.88Å; D593-E595 VanDerWaalsContact O-N 3.13Å; D593-E595 PolarHBondContact OD1-N 3.22Å; E595-K598 PolarHBondContact O-N 3.16Å; E595-Q599 PolarHBondContact O-N 2.83Å; E595-Q599 VanDerWaalsContact O-N 3.14Å
596	K	70.7	Confident	56.5	Low	128 Å²	128	125.8 Å²	125.8	56%	0.557	67%	0.665	S	S	*	*	H	α-helix	trans	-67.9	-43.7	179.1	-68.8	-166.1	178.4	84.2	0	112.8	D593 K598 Q599 Q600	D593-K596 HydrophobicContact CB-CG 4.41Å; D593-K596 PolarHBondContact O-N 3.37Å; D593-K596 IonicContact OD2-NZ 3.84Å; D593-K596 PolarHBondContact OD2-NZ 3.08Å; K596-K598 VanDerWaalsContact C-N 3.29Å; K596-K598 PolarHBondContact O-N 2.82Å; K596-Q599 WeakPolarHBondContact O-CB 3.47Å; K596-Q599 PolarHBondContact O-N 2.94Å; K596-Q599 VanDerWaalsContact O-N 3.1Å; K596-Q600 PolarHBondContact O-N 2.66Å; K596-Q600 VanDerWaalsContact O-N 3.14Å
597	L	56.7	Low	54.9	Low	116 Å²	116	126.3 Å²	126.3	61%	0.607	68%	0.68	S	S	*	*	H	α-helix	trans	-58.6	-44	176.8	-117.3	77.6	0	0	0	111.2	Q599 Q600 L601	L597-Q599 PolarHBondContact O-N 3.38Å; L597-Q600 PolarHBondContact O-N 3.01Å; L597-L601 PolarHBondContact O-N 3.45Å
598	K	63.9	Low	52.9	Low	164 Å²	164	124.7 Å²	124.7	71%	0.713	69%	0.694	S	S	*	*	H	α-helix	trans	-64.4	-29.3	178.4	-165.6	172.6	-176.9	178.6	0	112.6	V594 E595 K596 S602	V594-K598 PolarHBondContact O-N 3.35Å; E595-K598 PolarHBondContact O-N 3.16Å; K596-K598 VanDerWaalsContact C-N 3.29Å; K596-K598 PolarHBondContact O-N 2.82Å; K598-S602 PolarHBondContact O-OG 3.39Å
599	Q	64.8	Low	51.5	Low	144 Å²	144	127 Å²	127	67%	0.673	70%	0.701	S	S	*	*	H	α-helix	trans	-76.6	-35.1	177.9	-158.4	164.1	47.5	0	0	112.6	E595 K596 L597 S602	E595-Q599 PolarHBondContact O-N 2.83Å; E595-Q599 VanDerWaalsContact O-N 3.14Å; K596-Q599 WeakPolarHBondContact O-CB 3.47Å; K596-Q599 PolarHBondContact O-N 2.94Å; K596-Q599 VanDerWaalsContact O-N 3.1Å; L597-Q599 PolarHBondContact O-N 3.38Å; Q599-S602 PolarHBondContact O-N 2.85Å; Q599-S602 PolarHBondContact O-OG 2.85Å
600	Q	58.4	Low	50.3	Low	139 Å²	139	123.9 Å²	123.9	65%	0.65	70%	0.702	S	S	*	*	H	α-helix	trans	-68	-39.4	172.7	-74.4	-176	-86.9	0	0	112.9	K596 L597 S602 S603	K596-Q600 PolarHBondContact O-N 2.66Å; K596-Q600 VanDerWaalsContact O-N 3.14Å; L597-Q600 PolarHBondContact O-N 3.01Å; Q600-S602 PolarHBondContact O-N 3.42Å; Q600-S603 PolarHBondContact O-N 2.92Å; Q600-S603 PolarHBondContact O-OG 3.06Å
601	L	57	Low	48.9	Very low	137 Å²	137	128.9 Å²	128.9	72%	0.717	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-11.6	178.5	-73.8	169.2	0	0	0	114.1	L597	L597-L601 PolarHBondContact O-N 3.45Å
602	S	55.7	Low	48	Very low	84 Å²	84	124.6 Å²	124.6	59%	0.587	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-0.2	176.4	47.1	0	0	0	0	115	K598 Q599 Q600	K598-S602 PolarHBondContact O-OG 3.39Å; Q599-S602 PolarHBondContact O-N 2.85Å; Q599-S602 PolarHBondContact O-OG 2.85Å; Q600-S602 PolarHBondContact O-N 3.42Å
603	S	46.5	Very low	46.9	Very low	97 Å²	97	125.1 Å²	125.1	68%	0.678	73%	0.726	S	S	*	*	S	Bend	trans	-105.1	2.5	-176	38.8	0	0	0	0	115.8	Q600	Q600-S603 PolarHBondContact O-N 2.92Å; Q600-S603 PolarHBondContact O-OG 3.06Å
604	S	38.6	Very low	45.4	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	74%	0.744	S	S	*	*	S	Bend	trans	-108	16.5	-166.4	50.1	0	0	0	0	115.8
605	S	35.7	Very low	45.7	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	74%	0.744	S	S	*	*			trans	-131.1	39.9	-165.7	54.6	0	0	0	0	116.8
606	S	31.8	Very low	45.5	Very low	114 Å²	114	125.1 Å²	125.1	80%	0.797	74%	0.738	S	S	*	*			trans	-159.3	89.7	171.6	61.8	0	0	0	0	116.4
607	S	31.6	Very low	43.6	Very low	117 Å²	117	124.3 Å²	124.3	82%	0.818	75%	0.749	S	S	*	*			trans	-174.1	95	157.1	55.2	0	0	0	0	114.8
608	S	29.9	Very low	42.3	Very low	130 Å²	130	124.5 Å²	124.5	91%	0.909	76%	0.755	S	S	*	*			trans	-174.2	111	148.8	9.3	0	0	0	0	111.9
609	Q	31	Very low	40.7	Very low	193 Å²	193	121.6 Å²	121.6	90%	0.902	76%	0.755	S	S	*	*			trans	-163.2	146.7	163.8	-154.1	175.5	13.3	0	0	111.2
610	A	34.5	Very low	39.1	Very low	92 Å²	92	120.4 Å²	120.4	76%	0.76	76%	0.758	S	S	*	*			trans	68	152.4	174.1	0	0	0	0	0	115.2
611	E	30.3	Very low	37.7	Very low	187 Å²	187	122.3 Å²	122.3	87%	0.874	77%	0.767	S	S	*	*			cis	-132.9	153.9	0.5	-71	-178.4	134.3	0	0	108.1
612	A	36.6	Very low	36.6	Very low	98 Å²	98	120 Å²	120	81%	0.81	77%	0.767	S	S	*	*			cis	100.3	114.2	25.2	0	0	0	0	0	115
613	S	29.7	Very low	35.5	Very low	126 Å²	126	125.5 Å²	125.5	88%	0.881	78%	0.784	S	S	*	*			trans	-162.3	148.7	162.9	54.2	0	0	0	0	112.6
614	D	30.6	Very low	34.8	Very low	154 Å²	154	128 Å²	128	82%	0.824	79%	0.79	S	S	*	*			trans	-147.2	-171.2	-165.8	-130	-10.7	0	0	0	107.7
615	P	64.6	Low	35.5	Very low	106 Å²	106	128.3 Å²	128.3	69%	0.688	79%	0.789	S	S	*	*			cis	-118.4	-101.8	-18.3	22.8	3.7	0	0	0	109.4
616	P	57.2	Low	36.3	Very low	99 Å²	99	129 Å²	129	64%	0.643	79%	0.791	S	S	*	*			cis	-131.9	174.3	-35.1	40.1	-22.9	0	0	0	116.7
617	S	31	Very low	36.7	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	79%	0.793	S	S	*	*			trans	80.7	137.2	159	-34.1	0	0	0	0	117.5
618	T	28.2	Very low	37.2	Very low	121 Å²	121	133.4 Å²	133.4	74%	0.742	80%	0.795	S	S	*	*			cis	-157.7	150.8	-2.7	34.7	0	0	0	0	110.6
619	S	30.1	Very low	37.3	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	79%	0.787	S	S	*	*			trans	51.4	139.1	150.5	57.7	0	0	0	0	120.3
620	T	31.6	Very low	37.4	Very low	120 Å²	120	128.5 Å²	128.5	74%	0.736	78%	0.782	S	S	*	*			cis	-156.2	-166	-0.1	14	0	0	0	0	107.7
621	E	28.6	Very low	37.4	Very low	178 Å²	178	129.3 Å²	129.3	83%	0.832	78%	0.782	S	S	*	*			cis	-142.2	-119.7	12.5	-154.6	124.5	119.3	0	0	112.3
622	A	34.6	Very low	37.3	Very low	88 Å²	88	126.6 Å²	126.6	73%	0.727	78%	0.783	S	S	*	*			trans	-144.9	148.2	-176.8	0	0	0	0	0	115.2
623	Q	32	Very low	37.2	Very low	200 Å²	200	126.4 Å²	126.4	94%	0.935	78%	0.782	S	S	*	*				-172.6	150.5	118	-101.1	177.9	9.8	0	0	113.5
624	D	33.1	Very low	37.6	Very low	151 Å²	151	126.3 Å²	126.3	81%	0.807	78%	0.778	S	S	*	*			trans	-118.4	173.4	175.4	-133.7	-23.4	0	0	0	106.5
625	P	53.8	Low	38	Very low	105 Å²	105	124.6 Å²	124.6	68%	0.682	78%	0.776	S	S	*	*			cis	-130.6	-149.3	-8.4	43.4	-22.7	0	0	0	110.2
626	P	51.6	Low	36.8	Very low	118 Å²	118	125 Å²	125	77%	0.766	78%	0.778	S	S	*	*			cis	-134.5	-179	-7.7	41.9	-23	0	0	0	117.4
627	K	39.9	Very low	36.2	Very low	194 Å²	194	126.7 Å²	126.7	84%	0.843	79%	0.789	S	S	*	*			trans	-61.1	159.7	178.4	-60.8	170	178.6	169.6	0	114.8
628	P	42.8	Very low	36.5	Very low	130 Å²	130	131.1 Å²	131.1	84%	0.844	80%	0.795	S	S	*	*				-128.1	-170.2	102	38.7	-33.2	0	0	0	114.1
629	S	32.4	Very low	37.3	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	80%	0.8	S	S	*	*			trans	-132.1	-176	-161.4	60.6	0	0	0	0	114.4
630	S	32.5	Very low	38.1	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	81%	0.809	S	S	*	*			trans	85.5	162	174.7	81.7	0	0	0	0	117.2
631	S	33.7	Very low	38.6	Very low	109 Å²	109	142 Å²	142	76%	0.762	82%	0.815	S	S	*	*				177.7	117.6	-67.1	51	0	0	0	0	110.5
632	S	29.1	Very low	39.4	Very low	129 Å²	129	136.5 Å²	136.5	90%	0.902	81%	0.807	S	S	*	*			trans	-166.8	140.3	160.6	56.8	0	0	0	0	111.5
633	A	34.5	Very low	40.2	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	81%	0.806	S	S	*	*			trans	-123	140.3	173.5	0	0	0	0	0	110.6
634	P	37.6	Very low	41.2	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.9	148.7	-179	32.5	-34.5	0	0	0	113.2
635	P	39.7	Very low	42.1	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-88.2	159.9	-176.1	35.1	-36.5	0	0	0	114.5
636	P	39.6	Very low	42.1	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-79.2	153.3	-175.9	31.5	-36.4	0	0	0	114.9
637	P	44.3	Very low	42.8	Very low	134 Å²	134	129.3 Å²	129.3	87%	0.87	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-77.1	152.3	-175.8	30.9	-35.9	0	0	0	114.4
638	K	36.6	Very low	44.1	Very low	204 Å²	204	124.1 Å²	124.1	89%	0.887	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-93.6	146.1	-177.7	-67	178	-179.4	174.8	0	112.9
639	K	45.7	Very low	45.4	Very low	196 Å²	196	125.6 Å²	125.6	85%	0.852	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-62.5	141.5	-179.7	-57.3	175.2	-177.5	178.7	0	112.2
640	K	46.9	Very low	47.4	Very low	207 Å²	207	125.9 Å²	125.9	90%	0.9	73%	0.734	S	S	*	*			trans	-123.1	120.5	163.2	-73.4	-175.2	177.4	179.3	0	109.6
641	L	42.4	Very low	49	Very low	167 Å²	167	129.4 Å²	129.4	87%	0.874	73%	0.73	S	S	*	*			trans	-103.7	158.5	165.6	-83.7	81.1	0	0	0	109.5
642	G	45.2	Very low	51.1	Low	63 Å²	63	125.7 Å²	125.7	65%	0.649	71%	0.709	S	S	*	*			trans	124.4	-12.1	152.2	0	0	0	0	0	118.2
643	L	49.9	Very low	53.3	Low	135 Å²	135	126.6 Å²	126.6	71%	0.707	70%	0.699	S	S	*	*	S	Bend	trans	-76	-41.7	-171.3	-152.2	76.3	0	0	0	113.9	A645 A646 I647	L643-A645 PolarHBondContact O-N 2.77Å; L643-A646 WeakPolarHBondContact O-CB 3.49Å; L643-A646 PolarHBondContact O-N 2.89Å; L643-A646 VanDerWaalsContact O-N 3.12Å; L643-I647 HydrophobicContact CD2-CD1 4.27Å; L643-I647 HydrophobicContact CG-CD1 4.3Å; L643-I647 PolarHBondContact O-N 2.77Å
644	E	53	Low	55	Low	157 Å²	157	128.5 Å²	128.5	73%	0.734	69%	0.691	S	S	*	*	H	α-helix	trans	-65.1	-36.1	-170.4	-60	-176.7	157.4	0	0	113.2	A646 I647 S648	E644-A646 PolarHBondContact O-N 2.79Å; E644-I647 PolarHBondContact O-N 2.97Å; E644-I647 VanDerWaalsContact O-N 3.09Å; E644-S648 PolarHBondContact O-N 3.07Å; E644-S648 PolarHBondContact O-OG 3.15Å
645	A	53.1	Low	56.8	Low	70 Å²	70	128.8 Å²	128.8	58%	0.579	68%	0.682	S	S	*	*	H	α-helix	trans	-64.5	-22.3	177.5	0	0	0	0	0	113.6	L643	L643-A645 PolarHBondContact O-N 2.77Å
646	A	53.8	Low	58.5	Low	52 Å²	52	129.9 Å²	129.9	43%	0.43	68%	0.677	S	S	.	*	H	α-helix	trans	-79.7	-43.7	170.9	0	0	0	0	0	111.2	L643 E644 S648 K649 I650	L643-A646 WeakPolarHBondContact O-CB 3.49Å; L643-A646 PolarHBondContact O-N 2.89Å; L643-A646 VanDerWaalsContact O-N 3.12Å; E644-A646 PolarHBondContact O-N 2.79Å; A646-S648 PolarHBondContact O-N 3.08Å; A646-K649 PolarHBondContact O-N 2.88Å; A646-I650 WeakPolarHBondContact O-CG1 3.45Å; A646-I650 PolarHBondContact O-N 3.42Å; A646-I650 VanDerWaalsContact O-N 3.14Å
647	I	65.3	Low	59.9	Low	97 Å²	97	127.4 Å²	127.4	50%	0.497	67%	0.666	S	S	.	*	H	α-helix	trans	-60.5	-45.2	-179.8	-62.9	170.2	0	0	0	110.9	L643 E644 K649 I650 R651	L643-I647 HydrophobicContact CD2-CD1 4.27Å; L643-I647 HydrophobicContact CG-CD1 4.3Å; L643-I647 PolarHBondContact O-N 2.77Å; E644-I647 PolarHBondContact O-N 2.97Å; E644-I647 VanDerWaalsContact O-N 3.09Å; I647-K649 VanDerWaalsContact C-N 3.31Å; I647-K649 PolarHBondContact O-N 3Å; I647-I650 PolarHBondContact O-N 3.44Å; I647-R651 PolarHBondContact O-N 3.3Å
648	S	66.9	Low	61.2	Low	86 Å²	86	125.7 Å²	125.7	60%	0.601	65%	0.649	S	S	*	*	H	α-helix	trans	-63.2	-32.8	177.7	-61.4	0	0	0	0	113.5	E644 A646 G652	E644-S648 PolarHBondContact O-N 3.07Å; E644-S648 PolarHBondContact O-OG 3.15Å; A646-S648 PolarHBondContact O-N 3.08Å; S648-G652 PolarHBondContact O-N 2.8Å; S648-G652 VanDerWaalsContact O-N 3.1Å
649	K	70.3	Confident	63	Low	161 Å²	161	122.7 Å²	122.7	70%	0.7	64%	0.638	S	S	*	*	H	α-helix	trans	-70	-39.6	175.2	-77.4	-177.8	176.3	-178.6	0	112.4	A646 I647 Q653	A646-K649 PolarHBondContact O-N 2.88Å; I647-K649 VanDerWaalsContact C-N 3.31Å; I647-K649 PolarHBondContact O-N 3Å; K649-Q653 PolarHBondContact O-N 3.32Å
650	I	74.2	Confident	64.2	Low	113 Å²	113	121 Å²	121	58%	0.579	63%	0.631	S	S	*	*	H	α-helix	trans	-66.2	-46.9	177.1	-65	166.9	0	0	0	110.1	A646 I647 G652 Q653 Q654	A646-I650 WeakPolarHBondContact O-CG1 3.45Å; A646-I650 PolarHBondContact O-N 3.42Å; A646-I650 VanDerWaalsContact O-N 3.14Å; I647-I650 PolarHBondContact O-N 3.44Å; I650-G652 PolarHBondContact O-N 3.08Å; I650-Q653 PolarHBondContact O-N 2.9Å; I650-Q654 PolarHBondContact O-N 3.08Å; I650-Q654 VanDerWaalsContact O-N 3.09Å
651	R	66.9	Low	65.2	Low	186 Å²	186	116.9 Å²	116.9	70%	0.702	62%	0.615	S	S	*	*	H	α-helix	trans	-56.8	-47.4	176	177.9	175.5	-85	-175.2	-7.1	112	I647 Q653 Q654 E655	I647-R651 PolarHBondContact O-N 3.3Å; R651-Q653 VanDerWaalsContact C-N 3.31Å; R651-Q653 PolarHBondContact O-N 3.16Å; R651-Q654 PolarHBondContact O-N 2.96Å; R651-E655 PolarHBondContact O-N 2.79Å
652	G	77.6	Confident	66.3	Low	32 Å²	32	113.6 Å²	113.6	33%	0.33	60%	0.598	S	S	.	*	H	α-helix	trans	-64	-29.9	-179.7	0	0	0	0	0	114.6	S648 I650 Q656	S648-G652 PolarHBondContact O-N 2.8Å; S648-G652 VanDerWaalsContact O-N 3.1Å; I650-G652 PolarHBondContact O-N 3.08Å; G652-Q656 PolarHBondContact O-N 3.21Å
653	Q	75.4	Confident	67	Low	148 Å²	148	117.9 Å²	117.9	69%	0.692	60%	0.601	S	S	*	*	H	α-helix	trans	-75.1	-38.2	172.6	-74.8	-171.3	-25.2	0	0	112.5	K649 I650 R651 E655 Q656 A657	K649-Q653 PolarHBondContact O-N 3.32Å; I650-Q653 PolarHBondContact O-N 2.9Å; R651-Q653 VanDerWaalsContact C-N 3.31Å; R651-Q653 PolarHBondContact O-N 3.16Å; Q653-E655 VanDerWaalsContact C-N 3.34Å; Q653-E655 PolarHBondContact O-N 3.22Å; Q653-Q656 PolarHBondContact O-N 3.04Å; Q653-A657 PolarHBondContact O-N 3.19Å; Q653-A657 VanDerWaalsContact O-N 3.15Å
654	Q	69.6	Low	67.3	Low	134 Å²	134	118.7 Å²	118.7	63%	0.626	60%	0.601	S	S	*	*	H	α-helix	trans	-63.1	-40.6	177.1	-169.9	175.6	8.7	0	0	111.7	I650 R651 A657 L658	I650-Q654 PolarHBondContact O-N 3.08Å; I650-Q654 VanDerWaalsContact O-N 3.09Å; R651-Q654 PolarHBondContact O-N 2.96Å; Q654-A657 PolarHBondContact O-N 3.24Å; Q654-L658 PolarHBondContact O-N 2.98Å; Q654-L658 VanDerWaalsContact O-N 3.12Å
655	E	76.5	Confident	67	Low	131 Å²	131	117 Å²	117	61%	0.612	59%	0.593	S	S	*	*	H	α-helix	trans	-64.5	-42.7	178.2	-167.8	170.9	-175.2	0	0	112.4	R651 Q653 A657 L658 Q659	R651-E655 PolarHBondContact O-N 2.79Å; Q653-E655 VanDerWaalsContact C-N 3.34Å; Q653-E655 PolarHBondContact O-N 3.22Å; E655-A657 VanDerWaalsContact C-N 3.33Å; E655-A657 PolarHBondContact O-N 2.78Å; E655-L658 PolarHBondContact O-N 2.99Å; E655-Q659 WeakPolarHBondContact O-CB 3.45Å; E655-Q659 PolarHBondContact O-N 2.62Å
656	Q	75.1	Confident	66.7	Low	141 Å²	141	121.1 Å²	121.1	66%	0.659	60%	0.601	S	S	*	*	H	α-helix	trans	-66.9	-29.8	175.1	-73	-170.9	-0.1	0	0	113.8	G652 Q653 K660	G652-Q656 PolarHBondContact O-N 3.21Å; Q653-Q656 PolarHBondContact O-N 3.04Å; Q656-K660 PolarHBondContact O-N 2.92Å
657	A	69.6	Low	66.1	Low	62 Å²	62	123.6 Å²	123.6	51%	0.512	62%	0.615	S	S	.	*	H	α-helix	trans	-69	-45.6	174.2	0	0	0	0	0	111.2	Q653 Q654 E655 K660 Q661	Q653-A657 PolarHBondContact O-N 3.19Å; Q653-A657 VanDerWaalsContact O-N 3.15Å; Q654-A657 PolarHBondContact O-N 3.24Å; E655-A657 VanDerWaalsContact C-N 3.33Å; E655-A657 PolarHBondContact O-N 2.78Å; A657-K660 PolarHBondContact O-N 3.19Å; A657-Q661 PolarHBondContact O-N 3.05Å
658	L	72	Confident	64.9	Low	98 Å²	98	124.8 Å²	124.8	51%	0.513	63%	0.626	S	S	.	*	H	α-helix	trans	-65.3	-41.1	-179.2	-135.4	159.9	0	0	0	111.7	Q654 E655 K660 Q661 L662	Q654-L658 PolarHBondContact O-N 2.98Å; Q654-L658 VanDerWaalsContact O-N 3.12Å; E655-L658 PolarHBondContact O-N 2.99Å; L658-K660 VanDerWaalsContact C-N 3.29Å; L658-K660 PolarHBondContact O-N 2.78Å; L658-Q661 PolarHBondContact O-N 2.78Å; L658-Q661 VanDerWaalsContact O-N 3.12Å; L658-L662 HydrophobicContact CD2-CD1 4.25Å; L658-L662 PolarHBondContact O-N 3.2Å
659	Q	73.9	Confident	63.3	Low	140 Å²	140	129 Å²	129	65%	0.654	64%	0.636	S	S	*	*	H	α-helix	trans	-65.2	-29.2	176.5	-169.4	167.2	74.6	0	0	113.2	E655	E655-Q659 WeakPolarHBondContact O-CB 3.45Å; E655-Q659 PolarHBondContact O-N 2.62Å
660	K	70.2	Confident	61.8	Low	160 Å²	160	126.6 Å²	126.6	70%	0.696	64%	0.64	S	S	*	*	H	α-helix	trans	-73.7	-29.5	171.6	-86.9	-173.8	172.1	-176.6	0	113.8	Q656 A657 L658	Q656-K660 PolarHBondContact O-N 2.92Å; A657-K660 PolarHBondContact O-N 3.19Å; L658-K660 VanDerWaalsContact C-N 3.29Å; L658-K660 PolarHBondContact O-N 2.78Å
661	Q	69	Low	60	Low	121 Å²	121	130.2 Å²	130.2	57%	0.565	65%	0.654	S	S	*	*	H	α-helix	trans	-74	-44.6	-179.9	-173.6	173.7	-10	0	0	111.5	A657 L658 Q663 Q664 Q665	A657-Q661 PolarHBondContact O-N 3.05Å; L658-Q661 PolarHBondContact O-N 2.78Å; L658-Q661 VanDerWaalsContact O-N 3.12Å; Q661-Q663 VanDerWaalsContact C-N 3.32Å; Q661-Q663 PolarHBondContact O-N 2.87Å; Q661-Q664 PolarHBondContact O-N 3.18Å; Q661-Q665 PolarHBondContact O-N 3.45Å
662	L	64.9	Low	58.3	Low	99 Å²	99	130.2 Å²	130.2	52%	0.518	67%	0.667	S	S	.	*	H	α-helix	trans	-54.9	-46.5	173.9	-91.1	153.8	0	0	0	112.1	L658 Q664 Q665 E666	L658-L662 HydrophobicContact CD2-CD1 4.25Å; L658-L662 PolarHBondContact O-N 3.2Å; L662-Q664 PolarHBondContact O-N 3.18Å; L662-Q665 PolarHBondContact O-N 3.03Å; L662-E666 PolarHBondContact O-N 2.96Å
663	Q	59.4	Low	56.1	Low	152 Å²	152	133.2 Å²	133.2	71%	0.71	69%	0.689	S	S	*	*	H	α-helix	trans	-69.6	1.5	178.9	-170.5	152.9	77.8	0	0	114.4	Q661	Q661-Q663 VanDerWaalsContact C-N 3.32Å; Q661-Q663 PolarHBondContact O-N 2.87Å
664	Q	56.9	Low	53.9	Low	153 Å²	153	132.6 Å²	132.6	72%	0.715	70%	0.695	S	S	*	*	H	α-helix	trans	-105.5	-19	168.8	-71.1	-173.3	-24.3	0	0	113.7	Q661 L662	Q661-Q664 PolarHBondContact O-N 3.18Å; L662-Q664 PolarHBondContact O-N 3.18Å
665	Q	47.3	Very low	52.2	Low	122 Å²	122	131.7 Å²	131.7	57%	0.57	70%	0.701	S	S	*	*	H	α-helix	trans	-83	-38.5	176.8	-71.9	-173.1	-100.9	0	0	112.7	Q661 L662 S667 V668	Q661-Q665 PolarHBondContact O-N 3.45Å; L662-Q665 PolarHBondContact O-N 3.03Å; Q665-S667 PolarHBondContact O-N 3.4Å; Q665-V668 PolarHBondContact O-N 3.5Å
666	E	46.4	Very low	49.9	Very low	156 Å²	156	134.3 Å²	134.3	73%	0.729	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-6.8	179	-66.2	-176.8	138.2	0	0	114.7	L662	L662-E666 PolarHBondContact O-N 2.96Å
667	S	40	Very low	48.1	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	6.3	-176.1	-168.8	0	0	0	0	114.7	Q665	Q665-S667 PolarHBondContact O-N 3.4Å
668	V	41	Very low	46.1	Very low	121 Å²	121	134.6 Å²	134.6	73%	0.733	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	-26.7	-171.8	-170.9	0	0	0	0	113.7	Q665 S670	Q665-V668 PolarHBondContact O-N 3.5Å; V668-S670 PolarHBondContact O-N 3.35Å; V668-S670 VanDerWaalsContact O-N 3.16Å
669	E	33.4	Very low	44.1	Very low	175 Å²	175	135.9 Å²	135.9	82%	0.818	75%	0.754	S	S	*	*			trans	-91.6	62.6	-174.8	-64.8	-176	141.5	0	0	112.8
670	S	38.4	Very low	42	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	77%	0.765	S	S	*	*			trans	-149.4	46.5	176.8	-72.7	0	0	0	0	114.4	V668	V668-S670 PolarHBondContact O-N 3.35Å; V668-S670 VanDerWaalsContact O-N 3.16Å
671	E	35.8	Very low	40	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.883	77%	0.77	S	S	*	*			trans	-164.9	100.1	160.6	-116.9	166.7	-140.9	0	0	112
672	L	31.8	Very low	38.2	Very low	187 Å²	187	130.5 Å²	130.5	98%	0.979	78%	0.784	S	S	*	*			trans	-163.8	153.7	151.8	-137.3	70.3	0	0	0	110.9
673	A	31.2	Very low	36.9	Very low	94 Å²	94	131.4 Å²	131.4	78%	0.777	80%	0.795	S	S	*	*			trans	-133.2	155	-172.4	0	0	0	0	0	113.3
674	T	29.7	Very low	36.2	Very low	136 Å²	136	130.1 Å²	130.1	83%	0.834	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-85.5	132.3	-171.8	-39.2	0	0	0	0	113.4
675	P	34.6	Very low	34.8	Very low	115 Å²	115	131.1 Å²	131.1	75%	0.747	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-94.4	151.6	169	35.5	-32.1	0	0	0	113.1
676	H	28.3	Very low	34.1	Very low	185 Å²	185	130.1 Å²	130.1	86%	0.856	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-100	151.4	168.5	-82	-91	0	0	0	111.3
677	P	36.9	Very low	34.2	Very low	127 Å²	127	128 Å²	128	83%	0.825	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.6	146.6	171.4	33.3	-34.1	0	0	0	112.1
678	G	28.1	Very low	33.7	Very low	82 Å²	82	131 Å²	131	85%	0.845	82%	0.824	S	S	*	*			trans	-121.2	161.1	173.3	0	0	0	0	0	112
679	S	28.6	Very low	33.1	Very low	125 Å²	125	132.9 Å²	132.9	87%	0.874	83%	0.825	S	S	*	*			trans	-123.8	143.1	-170.6	55.9	0	0	0	0	114.5
680	S	30.2	Very low	33	Very low	129 Å²	129	129.9 Å²	129.9	90%	0.902	82%	0.818	S	S	*	*			trans	-171.3	153.8	164.3	55.4	0	0	0	0	108.1
681	G	28.5	Very low	32.5	Very low	76 Å²	76	131.1 Å²	131.1	78%	0.784	82%	0.816	S	S	*	*			cis	153.4	105.2	-3.4	0	0	0	0	0	110.1
682	A	31.5	Very low	32.1	Very low	104 Å²	104	133.4 Å²	133.4	86%	0.86	82%	0.817	S	S	*	*			trans	-90.4	149.8	-175.7	0	0	0	0	0	113.5
683	P	37.7	Very low	32	Very low	118 Å²	118	128.3 Å²	128.3	77%	0.766	80%	0.801	S	S	*	*				-149.9	-170	129.8	39	-20.7	0	0	0	113
684	P	44.4	Very low	32	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	81%	0.808	S	S	*	*				-132.2	-166.3	-62.9	42	-26	0	0	0	114.3
685	L	28.3	Very low	32	Very low	174 Å²	174	135.4 Å²	135.4	91%	0.911	80%	0.803	S	S	*	*			trans	-78.9	157.6	-170	-60.9	145.6	0	0	0	117.5
686	A	31.8	Very low	31.9	Very low	101 Å²	101	137.2 Å²	137.2	84%	0.835	81%	0.805	S	S	*	*			trans	-167.9	162.3	143.6	0	0	0	0	0	113.2
687	P	47.3	Very low	32.2	Very low	111 Å²	111	134.6 Å²	134.6	72%	0.721	80%	0.798	S	S	*	*			trans	-126.5	-165.1	-157.6	44.3	-30.5	0	0	0	117.7
688	H	30.3	Very low	31.9	Very low	167 Å²	167	134.9 Å²	134.9	77%	0.773	79%	0.792	S	S	*	*			trans	87.2	152.5	176.5	-65.4	-41.4	0	0	0	116.9
689	Q	28.3	Very low	32.1	Very low	161 Å²	161	139.2 Å²	139.2	75%	0.752	79%	0.794	S	S	*	*			cis	-153.9	173.4	0.1	-129.3	172.8	65.6	0	0	114
690	V	31.1	Very low	32.3	Very low	112 Å²	112	141.3 Å²	141.3	68%	0.679	79%	0.788	S	S	*	*			trans	-64.2	153.1	-178.8	-85.5	0	0	0	0	117.5
691	N	29	Very low	32.5	Very low	136 Å²	136	141.7 Å²	141.7	73%	0.727	78%	0.78	S	S	*	*				172	147.1	109.8	-99.2	-72.5	0	0	0	118
692	R	27	Very low	33.1	Very low	237 Å²	237	145.9 Å²	145.9	89%	0.894	78%	0.784	S	S	*	*			trans	63.8	160.4	153	-72.9	178.8	174.4	165.9	-1.3	121
693	A	29.5	Very low	33.7	Very low	79 Å²	79	149.5 Å²	149.5	65%	0.653	78%	0.783	S	S	*	*			cis	176.2	151.3	-39	0	0	0	0	0	111
694	R	31.4	Very low	33.9	Very low	246 Å²	246	148 Å²	148	93%	0.928	78%	0.781	S	S	*	*			trans	67.2	163.1	165.3	-69.5	179	178.8	176.6	-1.8	116.5
695	N	30.5	Very low	33.6	Very low	133 Å²	133	149.5 Å²	149.5	71%	0.711	78%	0.782	S	S	*	*			cis	-179.6	137.3	-28.7	175.8	48.8	0	0	0	107.5
696	L	32.3	Very low	34	Very low	153 Å²	153	148 Å²	148	80%	0.801	78%	0.775	S	S	*	*			trans	174.1	138.7	140.3	-98.8	163.8	0	0	0	111.1
697	N	32.8	Very low	34.1	Very low	130 Å²	130	148.6 Å²	148.6	70%	0.695	77%	0.773	S	S	*	*			trans	-101.6	-176.4	162.3	-88.3	13.5	0	0	0	109.3
698	D	31.9	Very low	33.7	Very low	133 Å²	133	148.2 Å²	148.2	71%	0.711	77%	0.773	S	S	*	*			trans	76.9	110.9	159.1	-50.3	-31.6	0	0	0	117.6
699	I	31	Very low	35	Very low	173 Å²	173	146.3 Å²	146.3	89%	0.887	78%	0.776	S	S	*	*				-150.5	142.8	118.4	-103.4	160.4	0	0	0	108.9
700	F	34.6	Very low	35.9	Very low	170 Å²	170	145.4 Å²	145.4	75%	0.746	78%	0.781	S	S	*	*			trans	-85.1	142.5	-178.7	-96.2	-111.9	0	0	0	109.7
701	D	34.3	Very low	36.3	Very low	137 Å²	137	145.1 Å²	145.1	73%	0.733	79%	0.79	S	S	*	*				81.9	124.1	83.8	-161.5	27.6	0	0	0	113.5
702	D	39.9	Very low	36.9	Very low	164 Å²	164	145.8 Å²	145.8	88%	0.877	79%	0.794	S	S	*	*			trans	-169.7	158.4	153	-141	-23.8	0	0	0	111.3
703	E	45.1	Very low	37.1	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	79%	0.791	S	S	*	*			trans	-111	-175.3	-167.1	-71.7	-160.1	120.8	0	0	116
704	A	41.5	Very low	37.5	Very low	86 Å²	86	147.5 Å²	147.5	71%	0.711	80%	0.799	S	S	*	*			trans	114	96.3	137.4	0	0	0	0	0	120.2
705	D	38	Very low	38.4	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	79%	0.792	S	S	*	*				77.1	138.9	114.6	-74.6	-20	0	0	0	126.6
706	D	37.3	Very low	38.4	Very low	143 Å²	143	140 Å²	140	77%	0.765	79%	0.792	S	S	*	*			trans	49.9	125.8	145.4	-109.7	-24.6	0	0	0	123.4
707	S	32.8	Very low	38.4	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	79%	0.79	S	S	*	*				173.6	158.5	88.3	46.3	0	0	0	0	114.1
708	S	39.4	Very low	38.4	Very low	103 Å²	103	141.9 Å²	141.9	72%	0.72	80%	0.796	S	S	*	*			trans	-129.9	166.7	167.3	67.3	0	0	0	0	110.4
709	P	57.9	Low	38.4	Very low	128 Å²	128	140 Å²	140	83%	0.831	80%	0.8	S	S	*	*				-147.5	173	125.4	36.5	-20.7	0	0	0	115.6
710	T	47.3	Very low	38.4	Very low	141 Å²	141	138.5 Å²	138.5	87%	0.865	79%	0.793	S	S	*	*			trans	-108.6	166	-179.3	50.7	0	0	0	0	113.1
711	A	39.1	Very low	38.2	Very low	106 Å²	106	138.9 Å²	138.9	88%	0.876	80%	0.797	S	S	*	*			trans	-155.2	147	159.8	0	0	0	0	0	112
712	D	41.3	Very low	38.3	Very low	151 Å²	151	141.2 Å²	141.2	81%	0.807	80%	0.8	S	S	*	*			trans	-104.7	174.3	-175.5	-117.8	-58.7	0	0	0	112.8
713	I	32	Very low	38.8	Very low	162 Å²	162	138.3 Å²	138.3	83%	0.831	79%	0.791	S	S	*	*			trans	163.3	138.3	132.3	-83.7	158.6	0	0	0	113.5
714	K	36.6	Very low	38.1	Very low	190 Å²	190	135.4 Å²	135.4	83%	0.826	79%	0.785	S	S	*	*			trans	-121.9	167.8	169.4	-77.2	176.7	179.6	168.6	0	107.8
715	P	51.3	Low	37.6	Very low	118 Å²	118	137 Å²	137	77%	0.766	78%	0.782	S	S	*	*			cis	-156.2	-167.6	35.5	43.3	-20.2	0	0	0	118.3
716	S	29.6	Very low	37.3	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	78%	0.777	S	S	*	*			trans	70.9	140.4	139.5	-169	0	0	0	0	120.8
717	L	32.6	Very low	37.3	Very low	146 Å²	146	134 Å²	134	76%	0.764	78%	0.779	S	S	*	*			cis	-169.4	164.7	-20.2	-116	173.2	0	0	0	110.9
718	Q	32.4	Very low	37.5	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.822	78%	0.783	S	S	*	*			trans	75.5	139.1	158.9	-70.2	-177.9	17	0	0	122.7
719	A	32.4	Very low	37.5	Very low	95 Å²	95	138.1 Å²	138.1	79%	0.785	79%	0.789	S	S	*	*			trans	66.4	142.5	161.9	0	0	0	0	0	118.5
720	L	31.6	Very low	36.5	Very low	140 Å²	140	136.8 Å²	136.8	73%	0.733	78%	0.782	S	S	*	*			cis	-150.9	143.4	5.6	-161	74.6	0	0	0	112.9
721	Q	30.7	Very low	36	Very low	179 Å²	179	136.6 Å²	136.6	84%	0.836	78%	0.781	S	S	*	*			trans	70.2	161.7	157.8	-82.9	161.1	3.1	0	0	122.1
722	K	36	Very low	35.7	Very low	185 Å²	185	136.9 Å²	136.9	80%	0.804	78%	0.776	S	S	*	*			trans	-134.9	-173.5	-161.8	-121.6	-169.1	-178.9	-166	0	109
723	P	49.6	Very low	35.4	Very low	104 Å²	104	135.4 Å²	135.4	68%	0.675	78%	0.778	S	S	*	*			cis	-95.8	-150	12.4	43.4	-40.9	0	0	0	112.3
724	T	29.7	Very low	35.5	Very low	118 Å²	118	136.1 Å²	136.1	72%	0.724	78%	0.778	S	S	*	*			cis	-139.1	159.8	-2.8	22.9	0	0	0	0	106.7
725	D	31	Very low	36.3	Very low	120 Å²	120	131.5 Å²	131.5	64%	0.642	77%	0.767	S	S	*	*			cis	90.4	123.5	32.3	-75	-45	0	0	0	116.2
726	T	32.9	Very low	36.6	Very low	120 Å²	120	131.5 Å²	131.5	74%	0.736	77%	0.767	S	S	*	*			cis	-159.4	163.3	-20.7	-18	0	0	0	0	110.8
727	S	36.9	Very low	37.7	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	76%	0.763	S	S	*	*			trans	-138	151.4	160.8	64.9	0	0	0	0	110.2
728	S	38.1	Very low	37.7	Very low	125 Å²	125	133.5 Å²	133.5	87%	0.874	77%	0.767	S	S	*	*			trans	-167.6	165.3	176.4	54.3	0	0	0	0	113.9
729	Q	37.5	Very low	37.9	Very low	178 Å²	178	133.7 Å²	133.7	83%	0.832	77%	0.765	S	S	*	*			trans	-147.2	123.8	-167.1	-151.1	-179	23.6	0	0	112.6
730	S	36.9	Very low	37.8	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	77%	0.765	S	S	*	*			trans	62.3	162	148.7	65.8	0	0	0	0	124
731	T	36.9	Very low	39.1	Very low	138 Å²	138	135.9 Å²	135.9	85%	0.847	77%	0.765	S	S	*	*			trans	76.7	150.8	170.1	73.1	0	0	0	0	118
732	S	34.6	Very low	39.2	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	76%	0.756	S	S	*	*			cis	-167.3	171.8	-25.3	-170.9	0	0	0	0	111.7
733	S	34.5	Very low	39.2	Very low	121 Å²	121	129.8 Å²	129.8	85%	0.846	76%	0.758	S	S	*	*			trans	79.6	-179.7	167.6	77.7	0	0	0	0	120.2
734	E	33.4	Very low	38.5	Very low	176 Å²	176	132.9 Å²	132.9	82%	0.822	76%	0.764	S	S	*	*				-133.3	-132.8	-121.1	-153.7	-154.8	149.1	0	0	119.5
735	P	54.7	Low	38.7	Very low	93 Å²	93	135 Å²	135	60%	0.604	77%	0.765	S	S	*	*				-108.4	-159.4	-127	43.3	-26.6	0	0	0	114.8
736	P	57.2	Low	39.9	Very low	118 Å²	118	133.8 Å²	133.8	77%	0.766	76%	0.764	S	S	*	*			cis	-132.1	-103	4.8	25.8	3.6	0	0	0	121.2
737	P	51.7	Low	40.3	Very low	98 Å²	98	134 Å²	134	64%	0.636	76%	0.756	S	S	*	*				-141.5	174.6	-126.7	44.6	-24.6	0	0	0	121.3
738	K	33.6	Very low	40.6	Very low	193 Å²	193	137.9 Å²	137.9	84%	0.839	75%	0.753	S	S	*	*			trans	120.4	134	145.9	-74.3	172.9	177	174.9	0	121.2
739	K	35.6	Very low	40.8	Very low	181 Å²	181	139.2 Å²	139.2	79%	0.787	75%	0.746	S	S	*	*			trans	71.4	112.5	146.9	-76.3	-165	166.1	-157.4	0	124.4
740	E	30.9	Very low	41.2	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	74%	0.743	S	S	*	*				21.1	160.7	108.1	-71.4	-177.7	135.8	0	0	122.6
741	P	58.4	Low	41.8	Very low	114 Å²	114	141.9 Å²	141.9	74%	0.74	74%	0.744	S	S	*	*			cis	-142.2	-160.5	-29.1	41.5	-22.2	0	0	0	113.5
742	A	34.1	Very low	42.5	Very low	78 Å²	78	143.5 Å²	143.5	65%	0.645	74%	0.74	S	S	*	*			trans	69.5	153.7	163.1	0	0	0	0	0	118.5
743	D	34.2	Very low	42.8	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	75%	0.745	S	S	*	*			cis	-162.7	-167	-26.4	-88.4	-31.9	0	0	0	105.7
744	E	34.9	Very low	43.7	Very low	170 Å²	170	147.9 Å²	147.9	79%	0.794	74%	0.742	S	S	*	*			cis	-155.5	-144.7	11	-153.1	-127.9	83.7	0	0	110.9
745	Q	34.3	Very low	44.3	Very low	161 Å²	161	146.6 Å²	146.6	75%	0.752	74%	0.741	S	S	*	*			trans	-123.1	-157.1	178.1	-126.8	-167.9	-7.7	0	0	109.4
746	P	57.6	Low	44.6	Very low	95 Å²	95	151.5 Å²	151.5	62%	0.617	75%	0.752	S	S	*	*			cis	-131.5	173.4	-27.9	27.9	-5.9	0	0	0	116.1
747	E	40.3	Very low	44.1	Very low	124 Å²	124	153.3 Å²	153.3	58%	0.579	75%	0.754	S	S	*	*			trans	33.1	134	143.1	-62.5	-150.9	143.9	0	0	126.2
748	R	42.6	Very low	43.9	Very low	199 Å²	199	154.1 Å²	154.1	75%	0.751	76%	0.759	S	S	*	*			trans	55.7	132.5	130.6	-61.4	171.6	-179.2	153.9	-3	121.2
749	E	42.5	Very low	44.9	Very low	153 Å²	153	155.1 Å²	155.1	72%	0.715	76%	0.763	S	S	*	*				179.6	169.9	106.1	-103.7	-165.5	163.2	0	0	115.3
750	K	46	Very low	45.5	Very low	180 Å²	180	155 Å²	155	78%	0.783	77%	0.768	S	S	*	*			trans	79.2	100.1	157.7	-74	138	-176.9	143	0	120.3
751	E	49.7	Very low	46.5	Very low	152 Å²	152	154.7 Å²	154.7	71%	0.71	77%	0.771	S	S	*	*			trans	-63.7	-175.7	154.1	-43.1	167.5	110.6	0	0	113.8
752	K	51	Low	46.7	Very low	172 Å²	172	158.6 Å²	158.6	75%	0.748	78%	0.776	S	S	*	*			trans	86.8	91.4	155.9	-65.8	150	-178.2	141.9	0	118
753	L	42.1	Very low	47.6	Very low	169 Å²	169	159.5 Å²	159.5	89%	0.885	78%	0.775	S	S	*	*				-148.5	142.6	126.7	-126.2	137.8	0	0	0	111.6
754	I	53.4	Low	48.7	Very low	155 Å²	155	157 Å²	157	80%	0.795	77%	0.765	S	S	*	*			trans	-105.2	131.4	-172.7	-63.6	165.3	0	0	0	109.2
755	L	45.6	Very low	50	Low	150 Å²	150	154 Å²	154	79%	0.785	76%	0.759	S	S	*	*			trans	-159.2	91.3	159.1	-110.9	167.7	0	0	0	114.7
756	K	61.4	Low	51.5	Low	196 Å²	196	151 Å²	151	85%	0.852	75%	0.748	S	S	*	*			trans	33.1	99.5	133.6	-162.3	173.1	-174.4	175.6	0	118.7
757	I	47.1	Very low	52.3	Low	156 Å²	156	151 Å²	151	80%	0.8	74%	0.742	S	S	*	*			trans	-119.4	147.4	168.8	-64.6	179.1	0	0	0	110.3
758	P	47.1	Very low	54.2	Low	114 Å²	114	153.9 Å²	153.9	74%	0.74	75%	0.748	S	S	*	*			trans	-78.9	161.9	-167.7	-15.8	32.6	0	0	0	116.4	M760	P758-M760 PolarHBondContact O-N 2.98Å
759	K	54.5	Low	56.4	Low	214 Å²	214	152.6 Å²	152.6	93%	0.93	74%	0.743	S	S	*	*			trans	-73.9	99.9	172.7	-68.3	177.6	178	176.2	0	111.7
760	M	47.3	Very low	58.6	Low	178 Å²	178	150.2 Å²	150.2	88%	0.877	73%	0.732	S	S	*	*			trans	-128.8	80.4	162.7	-64.2	-142.2	-53.7	0	0	110.9	P758	P758-M760 PolarHBondContact O-N 2.98Å
761	L	53.3	Low	60.6	Low	162 Å²	162	145.5 Å²	145.5	85%	0.848	72%	0.715	S	S	*	*			trans	-143.3	100.4	176.6	-96.8	173.3	0	0	0	112
762	K	61.6	Low	62.5	Low	196 Å²	196	147 Å²	147	85%	0.852	72%	0.715	S	S	*	*			trans	156.4	120	164.1	-90.4	157.8	-174.9	-177.1	0	104.7
763	P	54	Low	64.5	Low	96 Å²	96	143.1 Å²	143.1	62%	0.623	70%	0.698	S	S	*	*			cis	-126.2	147.1	47.8	38.2	-26.3	0	0	0	115.2
764	V	57.3	Low	66.9	Low	105 Å²	105	140.1 Å²	140.1	64%	0.636	68%	0.679	S	S	*	*	S	Bend	trans	-149.2	21.2	165.8	-159.7	0	0	0	0	110.2
765	V	61	Low	68.8	Low	108 Å²	108	140.7 Å²	140.7	66%	0.655	67%	0.671	S	S	*	*	S	Bend	trans	-114.1	-31.3	-170.9	-179	0	0	0	0	111.6
766	D	66.7	Low	71	Confident	97 Å²	97	137.1 Å²	137.1	52%	0.519	65%	0.653	S	S	.	*	S	Bend	trans	-78	-33.7	-176.2	-62.1	-74.2	0	0	0	113	R768 R769 E770	D766-R768 VanDerWaalsContact C-N 3.3Å; D766-R768 PolarHBondContact O-N 3.2Å; D766-R769 CarbonylContact O-C 3.6Å; D766-R769 WeakPolarHBondContact O-CA 3.3Å; D766-R769 WeakPolarHBondContact O-CB 3.48Å; D766-R769 PolarHBondContact O-N 3.32Å; D766-E770 PolarHBondContact O-N 3.09Å; D766-E770 VanDerWaalsContact O-N 3.07Å
767	D	74.6	Confident	72.6	Confident	95 Å²	95	133.7 Å²	133.7	51%	0.508	64%	0.635	S	S	.	*	H	α-helix	trans	-55.1	-45.4	176.9	-37.5	-29.4	0	0	0	111.3	R769 E770 D771	D767-R769 PolarHBondContact O-N 2.91Å; D767-E770 WeakPolarHBondContact O-CA 3.4Å; D767-E770 WeakPolarHBondContact O-CB 3.2Å; D767-E770 PolarHBondContact O-N 3.29Å; D767-D771 PolarHBondContact O-N 3.26Å
768	R	79.8	Confident	74.8	Confident	185 Å²	185	129.4 Å²	129.4	70%	0.698	61%	0.614	S	S	*	*	H	α-helix	trans	-65.1	-10.8	175.7	-71.7	-177.1	171	-175	-1.5	114.2	D766 R772	D766-R768 VanDerWaalsContact C-N 3.3Å; D766-R768 PolarHBondContact O-N 3.2Å; R768-R772 WeakPolarHBondContact O-CG 3.26Å
769	R	87.6	Confident	77.1	Confident	172 Å²	172	131.7 Å²	131.7	65%	0.649	61%	0.607	S	S	*	*	H	α-helix	trans	-95.5	-28.4	172.3	-165.8	-178.6	-178	-167.9	1.2	111.4	D766 D767 K773	D766-R769 CarbonylContact O-C 3.6Å; D766-R769 WeakPolarHBondContact O-CA 3.3Å; D766-R769 WeakPolarHBondContact O-CB 3.48Å; D766-R769 PolarHBondContact O-N 3.32Å; D767-R769 PolarHBondContact O-N 2.91Å; R769-K773 WeakPolarHBondContact O-CG 3.47Å
770	E	89.3	Confident	78.9	Confident	102 Å²	102	125.7 Å²	125.7	48%	0.477	59%	0.586	S	S	.	*	H	α-helix	trans	-68.1	-51.2	169.7	-147	74.9	-92.5	0	0	110.5	D766 D767 R772 K773 E774	D766-E770 PolarHBondContact O-N 3.09Å; D766-E770 VanDerWaalsContact O-N 3.07Å; D767-E770 WeakPolarHBondContact O-CA 3.4Å; D767-E770 WeakPolarHBondContact O-CB 3.2Å; D767-E770 PolarHBondContact O-N 3.29Å; E770-R772 PolarHBondContact O-N 2.92Å; E770-K773 WeakPolarHBondContact O-CB 3.33Å; E770-K773 PolarHBondContact O-N 2.92Å; E770-K773 WeakPolarHBondContact OE1-CD 3.13Å; E770-K773 IonicContact OE1-NZ 2.91Å; E770-K773 PolarHBondContact OE1-NZ 3.29Å; E770-E774 PolarHBondContact O-N 2.85Å
771	D	87.5	Confident	81.2	Confident	81 Å²	81	123.3 Å²	123.3	43%	0.433	57%	0.567	S	S	.	*	H	α-helix	trans	-45.2	-41.1	175.7	-79.3	-9.5	0	0	0	113.3	D767 R775	D767-D771 PolarHBondContact O-N 3.26Å; D771-R775 WeakPolarHBondContact O-CG 3.14Å; D771-R775 PolarHBondContact O-N 3.3Å
772	R	90.6	Very high	83.1	Confident	184 Å²	184	119.5 Å²	119.5	69%	0.694	55%	0.547	S	S	*	.	H	α-helix	trans	-72.4	-44.6	-178.2	-71.2	179.9	-179.8	-160.3	-0.7	111.6	R768 E770 E774 R775 D776	R768-R772 WeakPolarHBondContact O-CG 3.26Å; E770-R772 PolarHBondContact O-N 2.92Å; R772-E774 VanDerWaalsContact C-N 3.29Å; R772-E774 PolarHBondContact O-N 2.99Å; R772-R775 PolarHBondContact O-N 2.73Å; R772-D776 PolarHBondContact O-N 3.15Å; R772-D776 VanDerWaalsContact O-N 3.07Å
773	K	93.4	Very high	84.7	Confident	91 Å²	91	118.4 Å²	118.4	40%	0.396	54%	0.538	S	S	.	.	H	α-helix	trans	-63.8	-35.8	176.1	-64.2	169.9	-166.5	162.7	0	111.6	R769 E770 D776 R777	R769-K773 WeakPolarHBondContact O-CG 3.47Å; E770-K773 WeakPolarHBondContact O-CB 3.33Å; E770-K773 PolarHBondContact O-N 2.92Å; E770-K773 WeakPolarHBondContact OE1-CD 3.13Å; E770-K773 IonicContact OE1-NZ 2.91Å; E770-K773 PolarHBondContact OE1-NZ 3.29Å; K773-D776 PolarHBondContact O-N 3.02Å; K773-R777 VanDerWaalsContact O-CG 3.27Å; K773-R777 WeakPolarHBondContact O-CG 3.36Å; K773-R777 PolarHBondContact O-N 3.03Å
774	E	92.7	Very high	86.6	Confident	106 Å²	106	118.7 Å²	118.7	50%	0.495	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-49.5	177.3	-174.5	152.6	-116.3	0	0	111.4	E770 R772 D776 R777 D778	E770-E774 PolarHBondContact O-N 2.85Å; R772-E774 VanDerWaalsContact C-N 3.29Å; R772-E774 PolarHBondContact O-N 2.99Å; E774-D776 PolarHBondContact O-N 3.46Å; E774-R777 WeakPolarHBondContact O-CB 3.24Å; E774-R777 PolarHBondContact O-N 3.49Å; E774-R777 VanDerWaalsContact O-N 3.09Å; E774-D778 PolarHBondContact O-N 3.21Å
775	R	92.4	Very high	88.4	Confident	167 Å²	167	120.6 Å²	120.6	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-59.1	-31.7	175.1	-69.9	177.8	-166.8	-155	4	113.8	D771 R772 R779	D771-R775 WeakPolarHBondContact O-CG 3.14Å; D771-R775 PolarHBondContact O-N 3.3Å; R772-R775 PolarHBondContact O-N 2.73Å; R775-R779 WeakPolarHBondContact O-CD 3.35Å; R775-R779 VanDerWaalsContact O-CG 3.3Å; R775-R779 WeakPolarHBondContact O-CG 3.32Å; R775-R779 PolarHBondContact O-N 2.84Å
776	D	92.5	Very high	90	Very high	75 Å²	75	119.9 Å²	119.9	40%	0.401	52%	0.522	S	S	.	.	H	α-helix	trans	-73.9	-40.3	175.2	-70.8	-29.2	0	0	0	111.8	R772 K773 E774 D778 R779 D780	R772-D776 PolarHBondContact O-N 3.15Å; R772-D776 VanDerWaalsContact O-N 3.07Å; K773-D776 PolarHBondContact O-N 3.02Å; E774-D776 PolarHBondContact O-N 3.46Å; D776-D778 VanDerWaalsContact C-N 3.3Å; D776-D778 PolarHBondContact O-N 3.47Å; D776-R779 WeakPolarHBondContact O-CB 3.33Å; D776-R779 PolarHBondContact O-N 3.4Å; D776-R779 IonicContact OD1-CZ 3.91Å; D776-R779 IonicContact OD1-NH1 3.06Å; D776-R779 PolarHBondContact OD1-NH1 3.29Å; D776-D780 PolarHBondContact O-N 2.92Å; D776-D780 VanDerWaalsContact O-N 3.15Å
777	R	94.4	Very high	91.4	Very high	123 Å²	123	120 Å²	120	46%	0.464	52%	0.52	S	S	.	.	H	α-helix	trans	-60.1	-37.2	171.1	-68.6	162.8	-178.1	148.9	-4	112.6	K773 E774 D780 R781	K773-R777 VanDerWaalsContact O-CG 3.27Å; K773-R777 WeakPolarHBondContact O-CG 3.36Å; K773-R777 PolarHBondContact O-N 3.03Å; E774-R777 WeakPolarHBondContact O-CB 3.24Å; E774-R777 PolarHBondContact O-N 3.49Å; E774-R777 VanDerWaalsContact O-N 3.09Å; R777-D780 PolarHBondContact O-N 3.25Å; R777-R781 VanDerWaalsContact O-CG 3.28Å; R777-R781 WeakPolarHBondContact O-CG 3.36Å; R777-R781 PolarHBondContact O-N 3.46Å
778	D	93.1	Very high	92.4	Very high	67 Å²	67	120 Å²	120	36%	0.358	52%	0.519	S	S	.	.	H	α-helix	trans	-69.4	-35.9	177.4	-75	-29.1	0	0	0	112.9	E774 D776 D780 R781 D782	E774-D778 PolarHBondContact O-N 3.21Å; D776-D778 VanDerWaalsContact C-N 3.3Å; D776-D778 PolarHBondContact O-N 3.47Å; D778-D780 VanDerWaalsContact C-N 3.33Å; D778-D780 PolarHBondContact O-N 2.96Å; D778-R781 PolarHBondContact O-N 2.88Å; D778-R781 IonicContact OD1-CZ 2.74Å; D778-R781 IonicContact OD1-NH1 2.68Å; D778-R781 PolarHBondContact OD1-NH1 3.34Å; D778-D782 PolarHBondContact O-N 2.88Å
779	R	94.9	Very high	93.1	Very high	161 Å²	161	118.2 Å²	118.2	61%	0.608	51%	0.513	S	S	*	.	H	α-helix	trans	-62.5	-40.1	172.3	-72.3	162.3	174.9	162.8	-4	112.2	R775 D776 D782 R783	R775-R779 WeakPolarHBondContact O-CD 3.35Å; R775-R779 VanDerWaalsContact O-CG 3.3Å; R775-R779 WeakPolarHBondContact O-CG 3.32Å; R775-R779 PolarHBondContact O-N 2.84Å; D776-R779 WeakPolarHBondContact O-CB 3.33Å; D776-R779 PolarHBondContact O-N 3.4Å; D776-R779 IonicContact OD1-CZ 3.91Å; D776-R779 IonicContact OD1-NH1 3.06Å; D776-R779 PolarHBondContact OD1-NH1 3.29Å; R779-D782 PolarHBondContact O-N 3.23Å; R779-R783 WeakPolarHBondContact O-CB 3.41Å; R779-R783 PolarHBondContact O-N 3.01Å
780	D	93.7	Very high	93.5	Very high	89 Å²	89	116 Å²	116	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-67.9	-42.9	177	-68.2	-27.5	0	0	0	110.9	D776 R777 D778 D782 R783 D784	D776-D780 PolarHBondContact O-N 2.92Å; D776-D780 VanDerWaalsContact O-N 3.15Å; R777-D780 PolarHBondContact O-N 3.25Å; D778-D780 VanDerWaalsContact C-N 3.33Å; D778-D780 PolarHBondContact O-N 2.96Å; D780-D782 VanDerWaalsContact C-N 3.33Å; D780-D782 PolarHBondContact O-N 2.77Å; D780-R783 WeakPolarHBondContact O-CB 3.26Å; D780-R783 PolarHBondContact O-N 3.22Å; D780-R783 VanDerWaalsContact O-N 3.13Å; D780-D784 PolarHBondContact O-N 3.46Å
781	R	94.8	Very high	93.8	Very high	127 Å²	127	114.9 Å²	114.9	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-58	-40.4	173.2	-70.7	163.3	177	162.3	-3.4	113.2	R777 D778 R785	R777-R781 VanDerWaalsContact O-CG 3.28Å; R777-R781 WeakPolarHBondContact O-CG 3.36Å; R777-R781 PolarHBondContact O-N 3.46Å; D778-R781 PolarHBondContact O-N 2.88Å; D778-R781 IonicContact OD1-CZ 2.74Å; D778-R781 IonicContact OD1-NH1 2.68Å; D778-R781 PolarHBondContact OD1-NH1 3.34Å; R781-R785 VanDerWaalsContact O-CG 3.3Å; R781-R785 WeakPolarHBondContact O-CG 3.49Å; R781-R785 PolarHBondContact O-N 2.75Å
782	D	93.4	Very high	94.1	Very high	82 Å²	82	115.1 Å²	115.1	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-72.7	-32.8	176.6	-82	-21.4	0	0	0	112.5	D778 R779 D780 R785 D786	D778-D782 PolarHBondContact O-N 2.88Å; R779-D782 PolarHBondContact O-N 3.23Å; D780-D782 VanDerWaalsContact C-N 3.33Å; D780-D782 PolarHBondContact O-N 2.77Å; D782-R785 PolarHBondContact O-N 3.26Å; D782-R785 WeakPolarHBondContact OD1-CD 3.42Å; D782-R785 IonicContact OD1-CZ 4Å; D782-R785 IonicContact OD1-NE 2.84Å; D782-R785 IonicContact OD1-NH1 2.69Å; D782-R785 PolarHBondContact OD1-NH1 2.55Å; D782-D786 PolarHBondContact O-N 2.93Å
783	R	95.9	Very high	94.3	Very high	174 Å²	174	114.7 Å²	114.7	66%	0.657	51%	0.506	S	S	*	.	H	α-helix	trans	-63	-45.7	172.3	-168.7	-177.2	-130.4	135.2	2.6	111.7	R779 D780 R785 D786 E787	R779-R783 WeakPolarHBondContact O-CB 3.41Å; R779-R783 PolarHBondContact O-N 3.01Å; D780-R783 WeakPolarHBondContact O-CB 3.26Å; D780-R783 PolarHBondContact O-N 3.22Å; D780-R783 VanDerWaalsContact O-N 3.13Å; R783-R785 VanDerWaalsContact C-N 3.31Å; R783-R785 PolarHBondContact O-N 3.01Å; R783-D786 PolarHBondContact O-N 2.83Å; R783-E787 PolarHBondContact O-N 3.41Å
784	D	93.9	Very high	94.4	Very high	102 Å²	102	115.8 Å²	115.8	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-59.3	-42.2	176.6	-69.2	-21.7	0	0	0	111.5	D780 D786 E787 D788	D780-D784 PolarHBondContact O-N 3.46Å; D784-D786 PolarHBondContact O-N 2.84Å; D784-E787 PolarHBondContact O-N 2.89Å; D784-D788 PolarHBondContact O-N 3.24Å
785	R	94.8	Very high	94.5	Very high	145 Å²	145	117.5 Å²	117.5	55%	0.547	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-41.6	176.2	-72.4	165.5	176.7	162.2	-1.3	112.7	R781 D782 R783 R789	R781-R785 VanDerWaalsContact O-CG 3.3Å; R781-R785 WeakPolarHBondContact O-CG 3.49Å; R781-R785 PolarHBondContact O-N 2.75Å; D782-R785 PolarHBondContact O-N 3.26Å; D782-R785 WeakPolarHBondContact OD1-CD 3.42Å; D782-R785 IonicContact OD1-CZ 4Å; D782-R785 IonicContact OD1-NE 2.84Å; D782-R785 IonicContact OD1-NH1 2.69Å; D782-R785 PolarHBondContact OD1-NH1 2.55Å; R783-R785 VanDerWaalsContact C-N 3.31Å; R783-R785 PolarHBondContact O-N 3.01Å; R785-R789 WeakPolarHBondContact O-CD 3.26Å; R785-R789 VanDerWaalsContact O-CG 3.29Å; R785-R789 WeakPolarHBondContact O-CG 3.42Å; R785-R789 PolarHBondContact O-N 2.97Å
786	D	94.1	Very high	94.7	Very high	92 Å²	92	116 Å²	116	49%	0.492	52%	0.522	S	S	.	.	H	α-helix	trans	-73.9	-35	178.5	-83.2	-17.1	0	0	0	112.4	D782 R783 D784 D788 R789 E790	D782-D786 PolarHBondContact O-N 2.93Å; R783-D786 PolarHBondContact O-N 2.83Å; D784-D786 PolarHBondContact O-N 2.84Å; D786-D788 VanDerWaalsContact C-N 3.33Å; D786-D788 PolarHBondContact O-N 3.46Å; D786-R789 WeakPolarHBondContact O-CB 3.44Å; D786-R789 PolarHBondContact O-N 3.42Å; D786-R789 WeakPolarHBondContact OD1-CD 3.48Å; D786-R789 IonicContact OD1-CZ 2.95Å; D786-R789 IonicContact OD1-NE 2.68Å; D786-R789 IonicContact OD1-NH1 2.63Å; D786-R789 PolarHBondContact OD1-NH1 3.46Å; D786-E790 PolarHBondContact O-N 3.48Å
787	E	96.8	Very high	94.8	Very high	100 Å²	100	116.2 Å²	116.2	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-40.6	171.6	-132.7	-165.2	-123.2	0	0	111.4	R783 D784 E790 K791	R783-E787 PolarHBondContact O-N 3.41Å; D784-E787 PolarHBondContact O-N 2.89Å; E787-E790 PolarHBondContact O-N 3.4Å; E787-K791 WeakPolarHBondContact O-CD 3.43Å; E787-K791 VanDerWaalsContact O-CE 3.3Å; E787-K791 WeakPolarHBondContact O-CE 3.35Å; E787-K791 VanDerWaalsContact O-CG 3.22Å; E787-K791 WeakPolarHBondContact O-CG 3.2Å; E787-K791 PolarHBondContact O-N 3.44Å; E787-K791 WeakPolarHBondContact OE2-CE 3.28Å; E787-K791 IonicContact OE2-NZ 2.66Å; E787-K791 PolarHBondContact OE2-NZ 3.06Å
788	D	94.5	Very high	95	Very high	94 Å²	94	117.4 Å²	117.4	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-71.2	-33.1	176	-86	8.2	0	0	0	113.2	D784 D786 E790 K791 V792	D784-D788 PolarHBondContact O-N 3.24Å; D786-D788 VanDerWaalsContact C-N 3.33Å; D786-D788 PolarHBondContact O-N 3.46Å; D788-E790 VanDerWaalsContact C-N 3.34Å; D788-K791 PolarHBondContact O-N 2.88Å; D788-K791 WeakPolarHBondContact OD1-CD 3.45Å; D788-K791 IonicContact OD1-NZ 3.73Å; D788-K791 PolarHBondContact OD1-NZ 2.92Å; D788-V792 WeakPolarHBondContact O-CG2 3.34Å; D788-V792 PolarHBondContact O-N 2.99Å
789	R	94.4	Very high	95.1	Very high	149 Å²	149	117.1 Å²	117.1	56%	0.562	54%	0.539	S	S	*	.	H	α-helix	trans	-62	-40.6	169	-74.4	160.6	169.3	169.2	0.4	111.6	R785 D786 V792 R793	R785-R789 WeakPolarHBondContact O-CD 3.26Å; R785-R789 VanDerWaalsContact O-CG 3.29Å; R785-R789 WeakPolarHBondContact O-CG 3.42Å; R785-R789 PolarHBondContact O-N 2.97Å; D786-R789 WeakPolarHBondContact O-CB 3.44Å; D786-R789 PolarHBondContact O-N 3.42Å; D786-R789 WeakPolarHBondContact OD1-CD 3.48Å; D786-R789 IonicContact OD1-CZ 2.95Å; D786-R789 IonicContact OD1-NE 2.68Å; D786-R789 IonicContact OD1-NH1 2.63Å; D786-R789 PolarHBondContact OD1-NH1 3.46Å; R789-V792 PolarHBondContact O-N 3.44Å; R789-R793 PolarHBondContact O-N 2.97Å; R789-R793 VanDerWaalsContact O-N 3.12Å
790	E	96.2	Very high	95.2	Very high	126 Å²	126	113.8 Å²	113.8	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-66.6	-45.7	175.9	-169.9	160.7	-127.3	0	0	111.4	D786 E787 D788 V792 R793 D794	D786-E790 PolarHBondContact O-N 3.48Å; E787-E790 PolarHBondContact O-N 3.4Å; D788-E790 VanDerWaalsContact C-N 3.34Å; E790-V792 PolarHBondContact O-N 2.7Å; E790-V792 VanDerWaalsContact O-N 3.15Å; E790-R793 PolarHBondContact O-N 2.86Å; E790-R793 VanDerWaalsContact O-N 3.08Å; E790-D794 PolarHBondContact O-N 3.09Å
791	K	95.5	Very high	95.3	Very high	78 Å²	78	117.9 Å²	117.9	34%	0.339	54%	0.539	S	S	.	.	H	α-helix	trans	-60.7	-22.3	173.5	-67	163.1	-144.3	159.5	0	113.8	E787 D788 K795	E787-K791 WeakPolarHBondContact O-CD 3.43Å; E787-K791 VanDerWaalsContact O-CE 3.3Å; E787-K791 WeakPolarHBondContact O-CE 3.35Å; E787-K791 VanDerWaalsContact O-CG 3.22Å; E787-K791 WeakPolarHBondContact O-CG 3.2Å; E787-K791 PolarHBondContact O-N 3.44Å; E787-K791 WeakPolarHBondContact OE2-CE 3.28Å; E787-K791 IonicContact OE2-NZ 2.66Å; E787-K791 PolarHBondContact OE2-NZ 3.06Å; D788-K791 PolarHBondContact O-N 2.88Å; D788-K791 WeakPolarHBondContact OD1-CD 3.45Å; D788-K791 IonicContact OD1-NZ 3.73Å; D788-K791 PolarHBondContact OD1-NZ 2.92Å; K791-K795 WeakPolarHBondContact O-CD 3.43Å; K791-K795 VanDerWaalsContact O-CE 3.25Å; K791-K795 WeakPolarHBondContact O-CE 3.21Å; K791-K795 WeakPolarHBondContact O-CG 3.46Å
792	V	94.7	Very high	95.4	Very high	85 Å²	85	118.1 Å²	118.1	52%	0.515	55%	0.545	S	S	.	.	H	α-helix	trans	-78.3	-47.4	171.3	167.4	0	0	0	0	110.8	D788 R789 E790 D794 K795 E796	D788-V792 WeakPolarHBondContact O-CG2 3.34Å; D788-V792 PolarHBondContact O-N 2.99Å; R789-V792 PolarHBondContact O-N 3.44Å; E790-V792 PolarHBondContact O-N 2.7Å; E790-V792 VanDerWaalsContact O-N 3.15Å; V792-D794 VanDerWaalsContact C-N 3.34Å; V792-D794 PolarHBondContact O-N 3.09Å; V792-K795 WeakPolarHBondContact O-CB 3.4Å; V792-K795 PolarHBondContact O-N 3.28Å; V792-K795 VanDerWaalsContact O-N 3.09Å; V792-E796 PolarHBondContact O-N 3.49Å
793	R	94.3	Very high	95.6	Very high	175 Å²	175	118.1 Å²	118.1	66%	0.66	54%	0.541	S	S	*	.	H	α-helix	trans	-57.4	-45.1	176.4	-70.4	173.1	179	164.1	1.2	111.9	R789 E790 K795 E796 D797	R789-R793 PolarHBondContact O-N 2.97Å; R789-R793 VanDerWaalsContact O-N 3.12Å; E790-R793 PolarHBondContact O-N 2.86Å; E790-R793 VanDerWaalsContact O-N 3.08Å; R793-K795 VanDerWaalsContact C-N 3.26Å; R793-K795 PolarHBondContact O-N 3.42Å; R793-E796 PolarHBondContact O-N 3.21Å; R793-E796 VanDerWaalsContact O-N 3.14Å; R793-D797 WeakPolarHBondContact O-CB 3.29Å; R793-D797 PolarHBondContact O-N 3.5Å
794	D	95.4	Very high	95.6	Very high	115 Å²	115	113.5 Å²	113.5	62%	0.615	53%	0.53	S	S	*	.	H	α-helix	trans	-60.1	-33.4	176.6	-98.9	0.8	0	0	0	113.3	E790 V792 K798	E790-D794 PolarHBondContact O-N 3.09Å; V792-D794 VanDerWaalsContact C-N 3.34Å; V792-D794 PolarHBondContact O-N 3.09Å; D794-K798 WeakPolarHBondContact O-CB 3.49Å; D794-K798 PolarHBondContact O-N 2.84Å; D794-K798 VanDerWaalsContact O-N 3.11Å
795	K	95.4	Very high	95.8	Very high	141 Å²	141	116.3 Å²	116.3	61%	0.613	54%	0.537	S	S	*	.	H	α-helix	trans	-73.1	-39.2	175.7	-71.1	164.5	-167.3	160.5	0	111.5	K791 V792 R793 A799	K791-K795 WeakPolarHBondContact O-CD 3.43Å; K791-K795 VanDerWaalsContact O-CE 3.25Å; K791-K795 WeakPolarHBondContact O-CE 3.21Å; K791-K795 WeakPolarHBondContact O-CG 3.46Å; V792-K795 WeakPolarHBondContact O-CB 3.4Å; V792-K795 PolarHBondContact O-N 3.28Å; V792-K795 VanDerWaalsContact O-N 3.09Å; R793-K795 VanDerWaalsContact C-N 3.26Å; R793-K795 PolarHBondContact O-N 3.42Å; K795-A799 WeakPolarHBondContact O-CB 3.36Å; K795-A799 PolarHBondContact O-N 2.96Å
796	E	96	Very high	95.9	Very high	136 Å²	136	117.4 Å²	117.4	64%	0.636	55%	0.546	S	S	*	.	H	α-helix	trans	-66.4	-48.6	176.1	-173.2	175	-171.3	0	0	111.3	V792 R793 K798 A799 Q800	V792-E796 PolarHBondContact O-N 3.49Å; R793-E796 PolarHBondContact O-N 3.21Å; R793-E796 VanDerWaalsContact O-N 3.14Å; E796-K798 VanDerWaalsContact C-N 3.3Å; E796-K798 PolarHBondContact O-N 2.86Å; E796-A799 WeakPolarHBondContact O-CA 3.29Å; E796-A799 WeakPolarHBondContact O-CB 3.31Å; E796-A799 PolarHBondContact O-N 2.84Å; E796-Q800 PolarHBondContact O-N 3.08Å
797	D	95.6	Very high	96.1	Very high	79 Å²	79	118 Å²	118	42%	0.422	55%	0.546	S	S	.	.	H	α-helix	trans	-63.5	-37.2	179.7	-148.3	74.8	0	0	0	111.4	R793 R801	R793-D797 WeakPolarHBondContact O-CB 3.29Å; R793-D797 PolarHBondContact O-N 3.5Å; D797-R801 WeakPolarHBondContact O-CB 3.43Å; D797-R801 WeakPolarHBondContact O-CD 3.37Å; D797-R801 WeakPolarHBondContact O-CG 3.3Å; D797-R801 PolarHBondContact O-N 3.29Å; D797-R801 IonicContact OD2-CZ 3.98Å; D797-R801 IonicContact OD2-NE 3.1Å; D797-R801 PolarHBondContact OD2-NE 2.83Å; D797-R801 IonicContact OD2-NH2 3.1Å; D797-R801 PolarHBondContact OD2-NH2 2.71Å
798	K	96.8	Very high	96.1	Very high	149 Å²	149	120.2 Å²	120.2	65%	0.648	55%	0.554	S	S	*	*	H	α-helix	trans	-64.8	-41.4	170.5	-176	178.1	179.2	-179.7	0	112.7	D794 E796 R801 E802	D794-K798 WeakPolarHBondContact O-CB 3.49Å; D794-K798 PolarHBondContact O-N 2.84Å; D794-K798 VanDerWaalsContact O-N 3.11Å; E796-K798 VanDerWaalsContact C-N 3.3Å; E796-K798 PolarHBondContact O-N 2.86Å; K798-R801 PolarHBondContact O-N 2.78Å; K798-E802 PolarHBondContact O-N 2.75Å; K798-E802 VanDerWaalsContact O-N 3.11Å
799	A	96.2	Very high	96.3	Very high	61 Å²	61	119.5 Å²	119.5	50%	0.504	55%	0.548	S	S	.	.	H	α-helix	trans	-66.5	-40	177.5	0	0	0	0	0	112	K795 E796 E802 K803	K795-A799 WeakPolarHBondContact O-CB 3.36Å; K795-A799 PolarHBondContact O-N 2.96Å; E796-A799 WeakPolarHBondContact O-CA 3.29Å; E796-A799 WeakPolarHBondContact O-CB 3.31Å; E796-A799 PolarHBondContact O-N 2.84Å; A799-E802 PolarHBondContact O-N 3.35Å; A799-K803 PolarHBondContact O-N 3.19Å
800	Q	96	Very high	96.4	Very high	91 Å²	91	120.3 Å²	120.3	43%	0.425	55%	0.551	S	S	.	*	H	α-helix	trans	-63.8	-47	174.7	-175	60.4	40.3	0	0	111.3	E796 E802 K803 D804	E796-Q800 PolarHBondContact O-N 3.08Å; Q800-E802 PolarHBondContact O-N 2.95Å; Q800-E802 VanDerWaalsContact O-N 3.15Å; Q800-K803 WeakPolarHBondContact O-CA 3.46Å; Q800-K803 WeakPolarHBondContact O-CB 3.36Å; Q800-K803 PolarHBondContact O-N 3.47Å; Q800-D804 PolarHBondContact NE2-OD1 2.96Å; Q800-D804 PolarHBondContact O-N 3.19Å
801	R	96.9	Very high	96.5	Very high	174 Å²	174	117.4 Å²	117.4	66%	0.657	54%	0.537	S	S	*	.	H	α-helix	trans	-58.5	-27.9	174.6	-68.2	168.4	-164.2	-157.9	7.3	112.6	D797 K798 K805	D797-R801 WeakPolarHBondContact O-CB 3.43Å; D797-R801 WeakPolarHBondContact O-CD 3.37Å; D797-R801 WeakPolarHBondContact O-CG 3.3Å; D797-R801 PolarHBondContact O-N 3.29Å; D797-R801 IonicContact OD2-CZ 3.98Å; D797-R801 IonicContact OD2-NE 3.1Å; D797-R801 PolarHBondContact OD2-NE 2.83Å; D797-R801 IonicContact OD2-NH2 3.1Å; D797-R801 PolarHBondContact OD2-NH2 2.71Å; K798-R801 PolarHBondContact O-N 2.78Å; R801-K805 VanDerWaalsContact O-CB 3.3Å; R801-K805 WeakPolarHBondContact O-CB 3.32Å; R801-K805 PolarHBondContact O-N 3.29Å
802	E	96.8	Very high	96.6	Very high	132 Å²	132	120.6 Å²	120.6	62%	0.617	55%	0.547	S	S	*	.	H	α-helix	trans	-80.1	-36.9	172.7	-170.1	161.3	-171.5	0	0	113.2	K798 A799 Q800 K805 K806	K798-E802 PolarHBondContact O-N 2.75Å; K798-E802 VanDerWaalsContact O-N 3.11Å; A799-E802 PolarHBondContact O-N 3.35Å; Q800-E802 PolarHBondContact O-N 2.95Å; Q800-E802 VanDerWaalsContact O-N 3.15Å; E802-K805 PolarHBondContact O-N 3.38Å; E802-K806 VanDerWaalsContact O-CB 3.28Å; E802-K806 WeakPolarHBondContact O-CB 3.4Å; E802-K806 PolarHBondContact O-N 3.13Å
803	K	97.3	Very high	96.7	Very high	82 Å²	82	124.7 Å²	124.7	36%	0.357	55%	0.553	S	S	.	*	H	α-helix	trans	-57	-52.3	170.4	-171.7	175.2	176.2	178.8	0	110.2	T590 A799 Q800 K805 K806 E807	T590-K803 PolarHBondContact OG1-NZ 2.99Å; T590-K803 VanDerWaalsContact OG1-NZ 3.14Å; A799-K803 PolarHBondContact O-N 3.19Å; Q800-K803 WeakPolarHBondContact O-CA 3.46Å; Q800-K803 WeakPolarHBondContact O-CB 3.36Å; Q800-K803 PolarHBondContact O-N 3.47Å; K803-K805 PolarHBondContact O-N 3.08Å; K803-K806 WeakPolarHBondContact O-CB 3.46Å; K803-K806 PolarHBondContact O-N 2.95Å; K803-E807 PolarHBondContact O-N 3.18Å
804	D	96.2	Very high	96.8	Very high	78 Å²	78	122 Å²	122	42%	0.417	54%	0.543	S	S	.	.	H	α-helix	trans	-57.6	-44.9	177.7	-63.4	1.2	0	0	0	112.1	Q800 K806 E807 K808	Q800-D804 PolarHBondContact NE2-OD1 2.96Å; Q800-D804 PolarHBondContact O-N 3.19Å; D804-K806 VanDerWaalsContact C-N 3.35Å; D804-K806 PolarHBondContact O-N 3.36Å; D804-E807 PolarHBondContact O-N 2.7Å; D804-K808 VanDerWaalsContact O-CB 3.29Å; D804-K808 WeakPolarHBondContact O-CB 3.45Å; D804-K808 PolarHBondContact O-N 3.47Å
805	K	97.9	Very high	96.9	Very high	160 Å²	160	120.4 Å²	120.4	70%	0.696	53%	0.532	S	S	*	.	H	α-helix	trans	-64.8	-38.7	179.2	-176.3	-178.7	177.7	-173.5	0	112	R801 E802 K803 E809	R801-K805 VanDerWaalsContact O-CB 3.3Å; R801-K805 WeakPolarHBondContact O-CB 3.32Å; R801-K805 PolarHBondContact O-N 3.29Å; E802-K805 PolarHBondContact O-N 3.38Å; K803-K805 PolarHBondContact O-N 3.08Å; K805-E809 PolarHBondContact O-N 3.03Å
806	K	97.8	Very high	97	Very high	168 Å²	168	119 Å²	119	73%	0.73	52%	0.523	S	S	*	.	H	α-helix	trans	-69.5	-40.4	177.4	-175.1	178.4	-179.2	179.9	0	111.5	E802 K803 D804 E809 R810	E802-K806 VanDerWaalsContact O-CB 3.28Å; E802-K806 WeakPolarHBondContact O-CB 3.4Å; E802-K806 PolarHBondContact O-N 3.13Å; K803-K806 WeakPolarHBondContact O-CB 3.46Å; K803-K806 PolarHBondContact O-N 2.95Å; D804-K806 VanDerWaalsContact C-N 3.35Å; D804-K806 PolarHBondContact O-N 3.36Å; K806-E809 PolarHBondContact O-N 3.4Å; K806-R810 PolarHBondContact O-N 3.39Å; K806-R810 VanDerWaalsContact O-N 3.07Å
807	E	96.8	Very high	97.1	Very high	106 Å²	106	115.5 Å²	115.5	50%	0.495	51%	0.508	S	S	.	.	H	α-helix	trans	-65.3	-46	174.5	-161.6	-153.2	153.1	0	0	111.7	K803 D804 E809 R810 E811	K803-E807 PolarHBondContact O-N 3.18Å; D804-E807 PolarHBondContact O-N 2.7Å; E807-E809 PolarHBondContact O-N 3.45Å; E807-R810 CarbonylContact O-C 3.55Å; E807-R810 WeakPolarHBondContact O-CA 3.49Å; E807-R810 VanDerWaalsContact O-CB 3.25Å; E807-R810 WeakPolarHBondContact O-CB 3.24Å; E807-R810 PolarHBondContact O-N 3.09Å; E807-E811 PolarHBondContact O-N 2.78Å
808	K	97.9	Very high	97.2	Very high	145 Å²	145	116.9 Å²	116.9	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-58.4	-33.5	177.8	-168.2	166.1	-171.9	165.3	0	113	D804 R812	D804-K808 VanDerWaalsContact O-CB 3.29Å; D804-K808 WeakPolarHBondContact O-CB 3.45Å; D804-K808 PolarHBondContact O-N 3.47Å; K808-R812 VanDerWaalsContact O-CG 3.31Å; K808-R812 WeakPolarHBondContact O-CG 3.48Å; K808-R812 PolarHBondContact O-N 3.48Å; K808-R812 VanDerWaalsContact O-N 3.17Å
809	E	97.5	Very high	97.2	Very high	80 Å²	80	113.2 Å²	113.2	37%	0.374	50%	0.495	S	S	.	.	H	α-helix	trans	-79.3	-29.1	172.6	-167.1	56.6	-149.2	0	0	112.9	K805 K806 E807 R812 R813 R816	K805-E809 PolarHBondContact O-N 3.03Å; K806-E809 PolarHBondContact O-N 3.4Å; E807-E809 PolarHBondContact O-N 3.45Å; E809-R812 PolarHBondContact O-N 2.88Å; E809-R812 WeakPolarHBondContact OE2-CD 3.25Å; E809-R812 IonicContact OE2-CZ 3.71Å; E809-R812 IonicContact OE2-NE 3.64Å; E809-R812 IonicContact OE2-NH1 2.67Å; E809-R812 PolarHBondContact OE2-NH1 2.87Å; E809-R812 VanDerWaalsContact OE2-NH1 3.1Å; E809-R813 WeakPolarHBondContact O-CB 3.36Å; E809-R813 PolarHBondContact O-N 3.43Å; E809-R816 IonicContact OE1-CZ 3.74Å; E809-R816 IonicContact OE1-NH1 3.12Å; E809-R816 PolarHBondContact OE1-NH1 2.84Å; E809-R816 IonicContact OE1-NH2 3.84Å; E809-R816 PolarHBondContact OE1-NH2 2.85Å
810	R	97.5	Very high	97.2	Very high	166 Å²	166	118.1 Å²	118.1	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-42.5	170.1	-166.1	-178.5	-172.4	-175.4	2.1	111.3	K806 E807 R813 R814	K806-R810 PolarHBondContact O-N 3.39Å; K806-R810 VanDerWaalsContact O-N 3.07Å; E807-R810 CarbonylContact O-C 3.55Å; E807-R810 WeakPolarHBondContact O-CA 3.49Å; E807-R810 VanDerWaalsContact O-CB 3.25Å; E807-R810 WeakPolarHBondContact O-CB 3.24Å; E807-R810 PolarHBondContact O-N 3.09Å; R810-R813 WeakPolarHBondContact O-CB 3.43Å; R810-R813 PolarHBondContact O-N 2.6Å; R810-R814 PolarHBondContact O-N 3.05Å
811	E	97.6	Very high	97.2	Very high	64 Å²	64	117.6 Å²	117.6	30%	0.299	50%	0.504	S	S	.	.	H	α-helix	trans	-70.9	-39.7	176.1	-168	55.4	-139.9	0	0	112.2	E807 R813 R814 Q815 R818	E807-E811 PolarHBondContact O-N 2.78Å; E811-R813 PolarHBondContact O-N 2.86Å; E811-R814 WeakPolarHBondContact O-CB 3.26Å; E811-R814 PolarHBondContact O-N 2.82Å; E811-R814 VanDerWaalsContact O-N 3.17Å; E811-R814 WeakPolarHBondContact OE2-CD 3.38Å; E811-R814 IonicContact OE2-CZ 3.72Å; E811-R814 IonicContact OE2-NE 2.72Å; E811-R814 IonicContact OE2-NH1 4Å; E811-R814 PolarHBondContact OE2-NH1 2.78Å; E811-Q815 PolarHBondContact O-N 3.11Å; E811-R818 IonicContact OE1-CZ 3.99Å; E811-R818 VanDerWaalsContact OE1-CZ 3.24Å; E811-R818 IonicContact OE1-NH1 2.62Å; E811-R818 PolarHBondContact OE1-NH1 2.8Å; E811-R818 IonicContact OE1-NH2 3.99Å; E811-R818 PolarHBondContact OE1-NH2 3.01Å
812	R	97.6	Very high	97.1	Very high	146 Å²	146	115.5 Å²	115.5	55%	0.551	50%	0.501	S	S	*	.	H	α-helix	trans	-58.4	-30.7	169.1	-76.9	168.8	163.8	-174.5	-3.6	113.1	K808 E809 R816	K808-R812 VanDerWaalsContact O-CG 3.31Å; K808-R812 WeakPolarHBondContact O-CG 3.48Å; K808-R812 PolarHBondContact O-N 3.48Å; K808-R812 VanDerWaalsContact O-N 3.17Å; E809-R812 PolarHBondContact O-N 2.88Å; E809-R812 WeakPolarHBondContact OE2-CD 3.25Å; E809-R812 IonicContact OE2-CZ 3.71Å; E809-R812 IonicContact OE2-NE 3.64Å; E809-R812 IonicContact OE2-NH1 2.67Å; E809-R812 PolarHBondContact OE2-NH1 2.87Å; E809-R812 VanDerWaalsContact OE2-NH1 3.1Å; R812-R816 WeakPolarHBondContact O-CG 3.2Å; R812-R816 PolarHBondContact O-N 3.42Å; R812-R816 PolarHBondContact O-NE 2.74Å; R812-R816 PolarHBondContact O-NH2 3.3Å
813	R	97.3	Very high	97	Very high	170 Å²	170	115 Å²	115	64%	0.642	50%	0.499	S	S	*	.	H	α-helix	trans	-72	-48.8	173.3	-173.2	172.7	177.1	167	-2	111.1	E809 R810 E811 Q815 R816 D817	E809-R813 WeakPolarHBondContact O-CB 3.36Å; E809-R813 PolarHBondContact O-N 3.43Å; R810-R813 WeakPolarHBondContact O-CB 3.43Å; R810-R813 PolarHBondContact O-N 2.6Å; E811-R813 PolarHBondContact O-N 2.86Å; R813-Q815 VanDerWaalsContact C-N 3.28Å; R813-Q815 PolarHBondContact O-N 3.11Å; R813-R816 PolarHBondContact O-N 3.36Å; R813-D817 PolarHBondContact O-N 3.01Å; R813-D817 VanDerWaalsContact O-N 3.08Å
814	R	97.5	Very high	96.9	Very high	119 Å²	119	118.8 Å²	118.8	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-51.7	-45.8	172.6	-74.5	164	167.5	167.1	-3.5	111.6	R810 E811 D817 R818	R810-R814 PolarHBondContact O-N 3.05Å; E811-R814 WeakPolarHBondContact O-CB 3.26Å; E811-R814 PolarHBondContact O-N 2.82Å; E811-R814 VanDerWaalsContact O-N 3.17Å; E811-R814 WeakPolarHBondContact OE2-CD 3.38Å; E811-R814 IonicContact OE2-CZ 3.72Å; E811-R814 IonicContact OE2-NE 2.72Å; E811-R814 IonicContact OE2-NH1 4Å; E811-R814 PolarHBondContact OE2-NH1 2.78Å; R814-D817 PolarHBondContact O-N 3.46Å; R814-R818 WeakPolarHBondContact O-CG 3.03Å; R814-R818 PolarHBondContact O-N 3.3Å
815	Q	97.3	Very high	96.8	Very high	81 Å²	81	121.4 Å²	121.4	38%	0.379	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-50.1	178.1	-170.3	59.1	37.1	0	0	112.3	E811 R813 D817 R818 D819	E811-Q815 PolarHBondContact O-N 3.11Å; R813-Q815 VanDerWaalsContact C-N 3.28Å; R813-Q815 PolarHBondContact O-N 3.11Å; Q815-D817 PolarHBondContact O-N 2.99Å; Q815-D817 VanDerWaalsContact O-N 3.12Å; Q815-R818 WeakPolarHBondContact O-CA 3.31Å; Q815-R818 WeakPolarHBondContact O-CB 3.31Å; Q815-R818 PolarHBondContact O-N 3.14Å; Q815-D819 PolarHBondContact NE2-OD1 2.71Å; Q815-D819 PolarHBondContact O-N 2.86Å
816	R	97.6	Very high	96.4	Very high	113 Å²	113	115.6 Å²	115.6	43%	0.426	50%	0.503	S	S	.	.	H	α-helix	trans	-56.8	-31.1	176.4	-76.3	171.9	-71	-165.7	-1.5	113	E809 R812 R813 R820	E809-R816 IonicContact OE1-CZ 3.74Å; E809-R816 IonicContact OE1-NH1 3.12Å; E809-R816 PolarHBondContact OE1-NH1 2.84Å; E809-R816 IonicContact OE1-NH2 3.84Å; E809-R816 PolarHBondContact OE1-NH2 2.85Å; R812-R816 WeakPolarHBondContact O-CG 3.2Å; R812-R816 PolarHBondContact O-N 3.42Å; R812-R816 PolarHBondContact O-NE 2.74Å; R812-R816 PolarHBondContact O-NH2 3.3Å; R813-R816 PolarHBondContact O-N 3.36Å; R816-R820 WeakPolarHBondContact O-CB 3.19Å; R816-R820 VanDerWaalsContact O-CD 3.29Å; R816-R820 WeakPolarHBondContact O-CD 3.39Å; R816-R820 WeakPolarHBondContact O-CG 3.37Å; R816-R820 PolarHBondContact O-N 2.86Å; R816-R820 VanDerWaalsContact O-N 3.15Å
817	D	96.8	Very high	96.1	Very high	62 Å²	62	111.6 Å²	111.6	33%	0.332	49%	0.489	S	S	.	.	H	α-helix	trans	-82.3	-26.6	176.6	-66.4	-36.4	0	0	0	113	R813 R814 Q815 R820 T821	R813-D817 PolarHBondContact O-N 3.01Å; R813-D817 VanDerWaalsContact O-N 3.08Å; R814-D817 PolarHBondContact O-N 3.46Å; Q815-D817 PolarHBondContact O-N 2.99Å; Q815-D817 VanDerWaalsContact O-N 3.12Å; D817-R820 WeakPolarHBondContact OD1-CD 3.3Å; D817-R820 IonicContact OD1-CZ 3.69Å; D817-R820 IonicContact OD1-NE 2.68Å; D817-R820 IonicContact OD1-NH1 3.53Å; D817-R820 PolarHBondContact OD1-NH1 3.22Å; D817-T821 WeakPolarHBondContact O-CB 3.42Å; D817-T821 PolarHBondContact O-N 2.84Å; D817-T821 PolarHBondContact O-OG1 3.42Å
818	R	97.3	Very high	95.7	Very high	107 Å²	107	116.5 Å²	116.5	40%	0.404	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-53.4	163	-64.7	176.4	-168.7	114.5	5.8	110.4	E811 R814 Q815 R820 T821 E822	E811-R818 IonicContact OE1-CZ 3.99Å; E811-R818 VanDerWaalsContact OE1-CZ 3.24Å; E811-R818 IonicContact OE1-NH1 2.62Å; E811-R818 PolarHBondContact OE1-NH1 2.8Å; E811-R818 IonicContact OE1-NH2 3.99Å; E811-R818 PolarHBondContact OE1-NH2 3.01Å; R814-R818 WeakPolarHBondContact O-CG 3.03Å; R814-R818 PolarHBondContact O-N 3.3Å; Q815-R818 WeakPolarHBondContact O-CA 3.31Å; Q815-R818 WeakPolarHBondContact O-CB 3.31Å; Q815-R818 PolarHBondContact O-N 3.14Å; R818-R820 VanDerWaalsContact C-N 3.3Å; R818-R820 PolarHBondContact O-N 3.29Å; R818-T821 WeakPolarHBondContact O-CA 3.43Å; R818-T821 WeakPolarHBondContact O-CB 3.48Å; R818-T821 PolarHBondContact O-N 2.84Å; R818-E822 PolarHBondContact O-N 2.9Å
819	D	96.6	Very high	94.9	Very high	72 Å²	72	117.4 Å²	117.4	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-55.1	-44.7	-178.1	-52.2	-25.3	0	0	0	111.4	Q815 T821 E822 Q823	Q815-D819 PolarHBondContact NE2-OD1 2.71Å; Q815-D819 PolarHBondContact O-N 2.86Å; D819-T821 VanDerWaalsContact C-N 3.32Å; D819-T821 PolarHBondContact O-N 2.89Å; D819-E822 PolarHBondContact O-N 2.87Å; D819-Q823 WeakPolarHBondContact O-CB 3.39Å; D819-Q823 PolarHBondContact O-N 3.39Å
820	R	97.1	Very high	94.3	Very high	164 Å²	164	120.6 Å²	120.6	62%	0.619	52%	0.523	S	S	*	.	H	α-helix	trans	-60.7	-37.4	173.7	-77.8	164.8	168.7	175.4	-6.9	113.4	R816 D817 R818 K824	R816-R820 WeakPolarHBondContact O-CB 3.19Å; R816-R820 VanDerWaalsContact O-CD 3.29Å; R816-R820 WeakPolarHBondContact O-CD 3.39Å; R816-R820 WeakPolarHBondContact O-CG 3.37Å; R816-R820 PolarHBondContact O-N 2.86Å; R816-R820 VanDerWaalsContact O-N 3.15Å; D817-R820 WeakPolarHBondContact OD1-CD 3.3Å; D817-R820 IonicContact OD1-CZ 3.69Å; D817-R820 IonicContact OD1-NE 2.68Å; D817-R820 IonicContact OD1-NH1 3.53Å; D817-R820 PolarHBondContact OD1-NH1 3.22Å; R818-R820 VanDerWaalsContact C-N 3.3Å; R818-R820 PolarHBondContact O-N 3.29Å; R820-K824 VanDerWaalsContact O-CB 3.3Å; R820-K824 WeakPolarHBondContact O-CB 3.49Å; R820-K824 PolarHBondContact O-N 3.12Å
821	T	95.4	Very high	92.6	Very high	81 Å²	81	120.4 Å²	120.4	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-73	-39.1	-179	-58.8	0	0	0	0	110.8	D817 R818 D819 K824 K825	D817-T821 WeakPolarHBondContact O-CB 3.42Å; D817-T821 PolarHBondContact O-N 2.84Å; D817-T821 PolarHBondContact O-OG1 3.42Å; R818-T821 WeakPolarHBondContact O-CA 3.43Å; R818-T821 WeakPolarHBondContact O-CB 3.48Å; R818-T821 PolarHBondContact O-N 2.84Å; D819-T821 VanDerWaalsContact C-N 3.32Å; D819-T821 PolarHBondContact O-N 2.89Å; T821-K824 PolarHBondContact O-N 3.41Å; T821-K825 WeakPolarHBondContact O-CG 3.49Å; T821-K825 PolarHBondContact O-N 2.79Å
822	E	95.2	Very high	90.8	Very high	129 Å²	129	122 Å²	122	60%	0.603	55%	0.545	S	S	*	.	H	α-helix	trans	-67.6	-44.1	172.9	-68.6	-175.8	179.6	0	0	112.1	R818 D819 K824 K825 S826	R818-E822 PolarHBondContact O-N 2.9Å; D819-E822 PolarHBondContact O-N 2.87Å; E822-K824 VanDerWaalsContact C-N 3.32Å; E822-K824 PolarHBondContact O-N 2.92Å; E822-K825 WeakPolarHBondContact O-CB 3.26Å; E822-K825 PolarHBondContact O-N 3.01Å; E822-K825 VanDerWaalsContact O-N 3.12Å; E822-S826 PolarHBondContact O-N 2.94Å
823	Q	94.9	Very high	88.9	Confident	121 Å²	121	120.6 Å²	120.6	57%	0.565	56%	0.557	S	S	*	*	H	α-helix	trans	-55.7	-48.6	173.6	-175.2	175.8	-0.1	0	0	110.8	D819 K825 S826 D827	D819-Q823 WeakPolarHBondContact O-CB 3.39Å; D819-Q823 PolarHBondContact O-N 3.39Å; Q823-K825 VanDerWaalsContact C-N 3.31Å; Q823-K825 PolarHBondContact O-N 2.55Å; Q823-S826 PolarHBondContact O-N 3.42Å; Q823-S826 PolarHBondContact O-OG 2.95Å; Q823-D827 PolarHBondContact O-N 3.21Å
824	K	95.1	Very high	86.9	Confident	162 Å²	162	121.9 Å²	121.9	70%	0.704	57%	0.567	S	S	*	*	H	α-helix	trans	-63.4	-29.8	178.1	-172.6	177.2	179.6	-176.8	0	113.7	R820 T821 E822 R828	R820-K824 VanDerWaalsContact O-CB 3.3Å; R820-K824 WeakPolarHBondContact O-CB 3.49Å; R820-K824 PolarHBondContact O-N 3.12Å; T821-K824 PolarHBondContact O-N 3.41Å; E822-K824 VanDerWaalsContact C-N 3.32Å; E822-K824 PolarHBondContact O-N 2.92Å; K824-R828 WeakPolarHBondContact O-CB 3.42Å; K824-R828 PolarHBondContact O-N 3.39Å
825	K	94.1	Very high	84.8	Confident	134 Å²	134	126.1 Å²	126.1	58%	0.583	59%	0.589	S	S	*	*	H	α-helix	trans	-67.1	-50.6	168	-74.3	177.2	178.4	-179.2	0	110.4	T821 E822 Q823 D827 R828 E829	T821-K825 WeakPolarHBondContact O-CG 3.49Å; T821-K825 PolarHBondContact O-N 2.79Å; E822-K825 WeakPolarHBondContact O-CB 3.26Å; E822-K825 PolarHBondContact O-N 3.01Å; E822-K825 VanDerWaalsContact O-N 3.12Å; Q823-K825 VanDerWaalsContact C-N 3.31Å; Q823-K825 PolarHBondContact O-N 2.55Å; K825-D827 VanDerWaalsContact C-N 3.28Å; K825-D827 PolarHBondContact O-N 3.25Å; K825-R828 WeakPolarHBondContact O-CB 3.49Å; K825-R828 PolarHBondContact O-N 2.84Å; K825-E829 PolarHBondContact O-N 3.11Å
826	S	90.4	Very high	82.6	Confident	38 Å²	38	133.9 Å²	133.9	27%	0.266	62%	0.615	S	S	.	*	H	α-helix	trans	-62.5	-32.6	-177.6	89.4	0	0	0	0	113.4	E822 Q823 K830	E822-S826 PolarHBondContact O-N 2.94Å; Q823-S826 PolarHBondContact O-N 3.42Å; Q823-S826 PolarHBondContact O-OG 2.95Å; S826-K830 VanDerWaalsContact O-CD 3.29Å; S826-K830 WeakPolarHBondContact O-CD 3.28Å; S826-K830 WeakPolarHBondContact O-CG 3.43Å; S826-K830 PolarHBondContact O-N 2.92Å; S826-K830 PolarHBondContact OG-NZ 3.1Å
827	D	89.9	Confident	80.4	Confident	84 Å²	84	137.8 Å²	137.8	45%	0.449	64%	0.635	S	S	.	*	H	α-helix	trans	-73.7	-33.6	175.8	-68.8	-26.6	0	0	0	111.5	Q823 K825 K830	Q823-D827 PolarHBondContact O-N 3.21Å; K825-D827 VanDerWaalsContact C-N 3.28Å; K825-D827 PolarHBondContact O-N 3.25Å; D827-K830 PolarHBondContact O-N 2.92Å
828	R	88.9	Confident	78.2	Confident	208 Å²	208	142.9 Å²	142.9	79%	0.785	66%	0.661	S	S	*	*	H	α-helix	trans	-70.4	-35.2	174.8	-169.9	179.1	-174.7	-175.4	0.8	112.4	K824 K825 K830	K824-R828 WeakPolarHBondContact O-CB 3.42Å; K824-R828 PolarHBondContact O-N 3.39Å; K825-R828 WeakPolarHBondContact O-CB 3.49Å; K825-R828 PolarHBondContact O-N 2.84Å; R828-K830 VanDerWaalsContact C-N 3.32Å
829	E	82.1	Confident	75.8	Confident	165 Å²	165	147.5 Å²	147.5	77%	0.771	69%	0.687	S	S	*	*	H	α-helix	trans	-74.2	-22.4	175.6	-71.2	175.1	175.2	0	0	113	K825	K825-E829 PolarHBondContact O-N 3.11Å
830	K	83.4	Confident	73.5	Confident	147 Å²	147	153.9 Å²	153.9	64%	0.639	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-5.7	176.1	-74.1	165.8	-168.7	154.3	0	114.4	S826 D827 R828 P832	S826-K830 VanDerWaalsContact O-CD 3.29Å; S826-K830 WeakPolarHBondContact O-CD 3.28Å; S826-K830 WeakPolarHBondContact O-CG 3.43Å; S826-K830 PolarHBondContact O-N 2.92Å; S826-K830 PolarHBondContact OG-NZ 3.1Å; D827-K830 PolarHBondContact O-N 2.92Å; R828-K830 VanDerWaalsContact C-N 3.32Å; K830-P832 VanDerWaalsContact O-CD 3.28Å; K830-P832 WeakPolarHBondContact O-CD 3.35Å
831	E	63.5	Low	71.1	Confident	161 Å²	161	154.8 Å²	154.8	75%	0.752	72%	0.72	S	S	*	*	S	Bend	trans	-75.5	111.5	177.1	-166.5	173	-146.3	0	0	110.5
832	P	58.3	Low	68.9	Low	98 Å²	98	158.3 Å²	158.3	64%	0.636	74%	0.736	S	S	*	*			trans	-77	139.4	-163.7	30	-35	0	0	0	113	K830 K834	K830-P832 VanDerWaalsContact O-CD 3.28Å; K830-P832 WeakPolarHBondContact O-CD 3.35Å; P832-K834 PolarHBondContact O-N 2.89Å
833	S	57.6	Low	66.8	Low	116 Å²	116	161.5 Å²	161.5	81%	0.811	75%	0.751	S	S	*	*			trans	-70.2	44.9	-168.7	48.8	0	0	0	0	116.7	K835	S833-K835 PolarHBondContact O-N 3.44Å
834	K	56.6	Low	64.4	Low	198 Å²	198	165.2 Å²	165.2	86%	0.861	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	13.9	-174.5	-80.6	-174.2	173.8	176.9	0	116.9	P832	P832-K834 PolarHBondContact O-N 2.89Å
835	K	52.3	Low	62.1	Low	207 Å²	207	166.3 Å²	166.3	90%	0.9	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-8.4	175.6	-91.4	-171.7	173.7	-177.1	0	116.8	S833 K837	S833-K835 PolarHBondContact O-N 3.44Å; K835-K837 VanDerWaalsContact C-N 3.27Å; K835-K837 PolarHBondContact O-N 3.19Å
836	R	51.3	Low	59.7	Low	244 Å²	244	170.3 Å²	170.3	92%	0.921	79%	0.79	S	S	*	*			trans	-79.5	65.9	176.6	-91.5	-174.5	165.4	173.1	-4.5	113
837	K	52.1	Low	57.6	Low	196 Å²	196	176 Å²	176	85%	0.852	82%	0.818	S	S	*	*	S	Bend	trans	-151.3	76.4	163.2	-79	-158.2	176.4	-173.5	0	111.8	K835	K835-K837 VanDerWaalsContact C-N 3.27Å; K835-K837 PolarHBondContact O-N 3.19Å
838	L	49.5	Very low	55.4	Low	169 Å²	169	183.2 Å²	183.2	89%	0.885	84%	0.839	S	S	*	*	S	Bend	trans	-158.5	-45.7	153.9	-142.7	72.2	0	0	0	112.4	K840	L838-K840 PolarHBondContact O-N 3.3Å
839	E	48.1	Very low	53	Low	203 Å²	203	185.1 Å²	185.1	95%	0.949	85%	0.846	S	S	*	*			trans	-84.2	69.2	-173	-64.4	164.9	152.4	0	0	112.4
840	K	47.7	Very low	51	Low	206 Å²	206	185.4 Å²	185.4	90%	0.896	85%	0.847	S	S	*	*			trans	-149.5	73	167.1	-166.2	174.6	-177.1	175.1	0	111.1	L838	L838-K840 PolarHBondContact O-N 3.3Å
841	K	47.6	Very low	49.7	Very low	183 Å²	183	183.5 Å²	183.5	80%	0.796	85%	0.85	S	S	*	*	S	Bend	trans	-145.1	-41.7	175.7	-161.1	-175.1	178.8	-162.7	0	115.2	E843	K841-E843 PolarHBondContact O-N 2.85Å
842	D	48.4	Very low	48.6	Very low	156 Å²	156	182.2 Å²	182.2	83%	0.834	84%	0.844	S	S	*	*	S	Bend	trans	-96.9	14.9	-157.4	-53	-29.5	0	0	0	115.4
843	E	50.1	Low	47.7	Very low	196 Å²	196	186.7 Å²	186.7	92%	0.916	85%	0.848	S	S	*	*	S	Bend	trans	-121.4	41.8	-173.2	-159.3	172.7	-138.6	0	0	112.3	K841	K841-E843 PolarHBondContact O-N 2.85Å
844	K	45.1	Very low	46.8	Very low	198 Å²	198	189.5 Å²	189.5	86%	0.861	85%	0.846	S	S	*	*	S	Bend	trans	-143.5	32.7	177.7	-150.2	-151.4	174	-171.9	0	115.1
845	E	47.3	Very low	46	Very low	186 Å²	186	190 Å²	190	87%	0.869	85%	0.848	S	S	*	*			trans	-147.5	61.7	-178.9	-163.5	168.7	-160.9	0	0	113.1
846	K	44.2	Very low	45.1	Very low	217 Å²	217	183.4 Å²	183.4	94%	0.943	84%	0.839	S	S	*	*			trans	-164.2	63.6	162.6	-117.9	164.3	-170.9	176.4	0	114
847	D	45.3	Very low	44.5	Very low	158 Å²	158	181.6 Å²	181.6	85%	0.845	84%	0.837	S	S	*	*			trans	-143	132.5	164.5	-169	6.6	0	0	0	110.1
848	R	44	Very low	43.7	Very low	235 Å²	235	176.7 Å²	176.7	89%	0.887	83%	0.828	S	S	*	*			trans	121.4	97.4	-173	-77.9	173.6	164.4	-175	-5.1	114.9
849	R	38.1	Very low	43	Very low	248 Å²	248	176.6 Å²	176.6	94%	0.936	83%	0.828	S	S	*	*				168.9	119.5	109.8	-99.9	-178.4	165.4	150.3	-3.9	114.7
850	E	41.5	Very low	42.3	Very low	171 Å²	171	170.2 Å²	170.2	80%	0.799	82%	0.818	S	S	*	*			trans	-67	179.2	146	-92.2	-159.4	129.2	0	0	112.5
851	P	54.9	Low	41.7	Very low	108 Å²	108	170.7 Å²	170.7	70%	0.701	82%	0.819	S	S	*	*			cis	-138.4	-176.7	17.4	35.5	-12.7	0	0	0	118.2
852	E	40.7	Very low	40.9	Very low	134 Å²	134	171 Å²	171	63%	0.626	82%	0.824	S	S	*	*			trans	-10.9	148.1	161.5	-52.3	-172.1	106.8	0	0	121.5
853	R	39.1	Very low	40.4	Very low	192 Å²	192	174.6 Å²	174.6	73%	0.725	83%	0.827	S	S	*	*				168.1	138.7	96	-86	-165.3	174.9	165.9	1.2	116.2
854	K	40.1	Very low	39.6	Very low	175 Å²	175	171.4 Å²	171.4	76%	0.761	83%	0.827	S	S	*	*			trans	63	112.4	143.5	-70.3	178.3	179.1	177.1	0	122.5
855	K	38.9	Very low	39	Very low	208 Å²	208	171.6 Å²	171.6	90%	0.904	83%	0.827	S	S	*	*				62.7	110.2	115.2	-171.7	-171.9	-177.9	179.9	0	120.2
856	G	34.3	Very low	38.3	Very low	69 Å²	69	167.4 Å²	167.4	71%	0.711	83%	0.825	S	S	*	*			trans	149.2	111.6	137.8	0	0	0	0	0	119.7
857	K	37.4	Very low	37.5	Very low	205 Å²	205	161.7 Å²	161.7	89%	0.891	81%	0.812	S	S	*	*			trans	36.6	155.5	139.6	-80.5	-169.6	172.1	-171.4	0	124.2
858	S	35.3	Very low	36.8	Very low	94 Å²	94	161 Å²	161	66%	0.657	81%	0.814	S	S	*	*			trans	72.5	108.7	151	45.3	0	0	0	0	120.4
859	D	34.2	Very low	36.4	Very low	166 Å²	166	154.5 Å²	154.5	89%	0.888	80%	0.801	S	S	*	*				56.7	125.9	120.9	-52.2	-57.5	0	0	0	121.7
860	G	33.9	Very low	35.9	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	79%	0.794	S	S	*	*				132.1	95.9	126.1	0	0	0	0	0	118.8
861	K	36.1	Very low	35.4	Very low	215 Å²	215	146.8 Å²	146.8	94%	0.935	79%	0.791	S	S	*	*			trans	37.8	99.3	146.2	-64.5	177.4	177.5	175.2	0	118.1
862	E	29.8	Very low	34.3	Very low	191 Å²	191	149 Å²	149	89%	0.893	80%	0.795	S	S	*	*			trans	-88.1	139.9	157.3	-69.3	-163.3	143	0	0	112.5
863	Y	39.1	Very low	34.3	Very low	231 Å²	231	148.3 Å²	148.3	91%	0.906	80%	0.803	S	S	*	*			trans	-155.3	83	165.5	-119.6	-76	0	0	0	109.4
864	S	32.5	Very low	34.1	Very low	129 Å²	129	145.2 Å²	145.2	90%	0.902	81%	0.806	S	S	*	*			trans	-169.5	163.7	158.2	-94.4	0	0	0	0	114.5
865	K	32.3	Very low	33.9	Very low	201 Å²	201	144.7 Å²	144.7	87%	0.874	81%	0.81	S	S	*	*			trans	-92.1	131.6	-166.6	-60.9	162.9	-178.6	169.3	0	112.7
866	A	31.7	Very low	33.5	Very low	99 Å²	99	140 Å²	140	82%	0.818	80%	0.803	S	S	*	*			trans	50.6	132.9	137	0	0	0	0	0	121.9
867	S	29.2	Very low	33.5	Very low	97 Å²	97	145 Å²	145	68%	0.678	81%	0.813	S	S	*	*				144.2	110.9	105.5	-177.9	0	0	0	0	115.8
868	T	30.1	Very low	33.4	Very low	142 Å²	142	144.1 Å²	144.1	87%	0.871	81%	0.809	S	S	*	*			trans	-175.2	120.3	151	28.8	0	0	0	0	107.8
869	T	34.8	Very low	33.3	Very low	100 Å²	100	146.1 Å²	146.1	61%	0.613	81%	0.813	S	S	*	*			cis	89.4	94	2.8	-41.1	0	0	0	0	117.8	L871	T869-L871 HydrophobicContact CG2-CD1 4.28Å; T869-L871 HydrophobicContact CG2-CD2 4.43Å; T869-L871 HydrophobicContact CG2-CG 4.05Å
870	S	28	Very low	33.4	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	82%	0.815	S	S	*	*			trans	-130.5	128.8	145.6	48.5	0	0	0	0	107.5
871	L	30.4	Very low	33.2	Very low	143 Å²	143	156.2 Å²	156.2	75%	0.749	82%	0.823	S	S	*	*			cis	74.2	129.8	37.6	-52.2	169.3	0	0	0	110.9	T869	T869-L871 HydrophobicContact CG2-CD1 4.28Å; T869-L871 HydrophobicContact CG2-CD2 4.43Å; T869-L871 HydrophobicContact CG2-CG 4.05Å
872	I	33	Very low	33.6	Very low	154 Å²	154	153.3 Å²	153.3	79%	0.79	82%	0.816	S	S	*	*			cis	-142.4	136.9	14.2	-66.5	-179	0	0	0	106.8
873	P	40.5	Very low	34.2	Very low	120 Å²	120	149.9 Å²	149.9	78%	0.779	81%	0.81	S	S	*	*				-148.5	-151.4	63.3	43.6	-22.3	0	0	0	115.4
874	T	35.6	Very low	34.4	Very low	128 Å²	128	148.1 Å²	148.1	79%	0.785	81%	0.807	S	S	*	*			trans	-151.4	165.4	-176.8	56.4	0	0	0	0	112
875	L	34.6	Very low	34.7	Very low	164 Å²	164	151.7 Å²	151.7	86%	0.859	81%	0.806	S	S	*	*				-173.5	128.4	124	-104.7	173.7	0	0	0	115.3
876	S	30.5	Very low	34.8	Very low	108 Å²	108	148.8 Å²	148.8	76%	0.755	80%	0.8	S	S	*	*			trans	56.1	95.2	147.9	-173.7	0	0	0	0	121.4
877	L	35.3	Very low	34.9	Very low	176 Å²	176	150.6 Å²	150.6	92%	0.921	80%	0.802	S	S	*	*			trans	-132.1	143	141.7	-100.5	170.7	0	0	0	109.5
878	K	34	Very low	35.1	Very low	185 Å²	185	152 Å²	152	80%	0.804	81%	0.806	S	S	*	*			trans	-151.1	144.5	-179.6	-124	179.6	-176.8	178.7	0	111
879	N	34.7	Very low	35.1	Very low	137 Å²	137	153.9 Å²	153.9	73%	0.733	80%	0.804	S	S	*	*			trans	62.4	112.7	168.5	-53	-7.7	0	0	0	116.9
880	F	34.9	Very low	35.2	Very low	215 Å²	215	155.8 Å²	155.8	94%	0.943	81%	0.806	S	S	*	*				-153.5	155.5	98	-112	-79.4	0	0	0	110
881	R	30.1	Very low	35.6	Very low	233 Å²	233	157.5 Å²	157.5	88%	0.879	80%	0.802	S	S	*	*			trans	-137.8	146.7	-171.4	-161.8	176.4	-169.9	172.3	2.8	110.4
882	I	45.3	Very low	36	Very low	154 Å²	154	157.1 Å²	157.1	79%	0.79	79%	0.794	S	S	*	*			trans	-62.4	142.1	-179.1	-56.6	157.5	0	0	0	111.4
883	P	42.1	Very low	36.2	Very low	119 Å²	119	158.2 Å²	158.2	77%	0.773	79%	0.793	S	S	*	*			trans	-117.1	127.6	150.2	34.3	-23.3	0	0	0	112.3
884	K	42.9	Very low	36.1	Very low	193 Å²	193	158.7 Å²	158.7	84%	0.839	79%	0.789	S	S	*	*			trans	-96.1	152.6	143.8	-69.8	-174.5	176.5	-173.2	0	107.4
885	K	38.4	Very low	36.1	Very low	205 Å²	205	159 Å²	159	89%	0.891	79%	0.79	S	S	*	*			trans	-162.5	156.2	160.1	-117.3	-170.3	177.5	-161.6	0	111.4
886	D	34.2	Very low	36.1	Very low	139 Å²	139	157.6 Å²	157.6	74%	0.743	78%	0.778	S	S	*	*			trans	-126.8	164	-171.3	-50.7	-85.8	0	0	0	111.7
887	T	34.7	Very low	36.4	Very low	138 Å²	138	159.6 Å²	159.6	85%	0.847	78%	0.775	S	S	*	*			trans	63.3	168.8	151.5	39.3	0	0	0	0	123.7
888	V	32.1	Very low	36.2	Very low	126 Å²	126	159 Å²	159	76%	0.764	77%	0.768	S	S	*	*			trans	90.1	110.5	-175	-175.5	0	0	0	0	113.1
889	E	31.3	Very low	36.3	Very low	181 Å²	181	154.6 Å²	154.6	85%	0.846	77%	0.765	S	S	*	*				75.4	149.4	61	-73.1	-175.1	142.9	0	0	115
890	E	37.3	Very low	37.1	Very low	140 Å²	140	154.1 Å²	154.1	65%	0.654	77%	0.77	S	S	*	*			cis	-92.5	-125.9	-4.3	-153.4	-150.9	113.4	0	0	110	K892	E890-K892 VanDerWaalsContact CD-NZ 3.35Å; E890-K892 WeakPolarHBondContact OE1-CE 3.23Å; E890-K892 WeakPolarHBondContact OE1-CG 3.43Å; E890-K892 PolarHBondContact OE1-N 3.47Å; E890-K892 IonicContact OE1-NZ 3.66Å; E890-K892 PolarHBondContact OE1-NZ 3.48Å; E890-K892 VanDerWaalsContact OE1-NZ 3.08Å; E890-K892 IonicContact OE2-NZ 2.59Å; E890-K892 PolarHBondContact OE2-NZ 3.3Å
891	E	34.9	Very low	36.7	Very low	150 Å²	150	147.3 Å²	147.3	70%	0.701	76%	0.76	S	S	*	*			cis	-145.1	153.3	-5.3	-147.2	-168.5	175.8	0	0	113.4
892	K	39.9	Very low	37.7	Very low	135 Å²	135	141.8 Å²	141.8	59%	0.587	76%	0.755	S	S	*	*			trans	-1.3	145.7	160.3	-68.5	153.5	-154.6	108.2	0	119.9	E890	E890-K892 VanDerWaalsContact CD-NZ 3.35Å; E890-K892 WeakPolarHBondContact OE1-CE 3.23Å; E890-K892 WeakPolarHBondContact OE1-CG 3.43Å; E890-K892 PolarHBondContact OE1-N 3.47Å; E890-K892 IonicContact OE1-NZ 3.66Å; E890-K892 PolarHBondContact OE1-NZ 3.48Å; E890-K892 VanDerWaalsContact OE1-NZ 3.08Å; E890-K892 IonicContact OE2-NZ 2.59Å; E890-K892 PolarHBondContact OE2-NZ 3.3Å
893	K	37.7	Very low	36.9	Very low	177 Å²	177	139.4 Å²	139.4	77%	0.77	75%	0.752	S	S	*	*			cis	-164.9	139.2	44.2	-167.8	169	-179.8	179.4	0	115.1
894	D	38.4	Very low	36.3	Very low	129 Å²	129	138.7 Å²	138.7	69%	0.69	75%	0.75	S	S	*	*			trans	35.1	147.8	150.8	-47.4	-19.6	0	0	0	121.7
895	V	34.3	Very low	35.6	Very low	134 Å²	134	134.2 Å²	134.2	81%	0.812	74%	0.742	S	S	*	*			cis	-172.6	164.8	-2.4	129.1	0	0	0	0	106.1
896	K	35.3	Very low	35.2	Very low	135 Å²	135	130.4 Å²	130.4	59%	0.587	74%	0.737	S	S	*	*			cis	-140.6	-161.2	17.1	-156.3	-130	-171.7	-112.4	0	111.3	E898	K896-E898 IonicContact NZ-OE1 3.86Å; K896-E898 PolarHBondContact NZ-OE1 3.39Å
897	E	37.2	Very low	35	Very low	150 Å²	150	131.6 Å²	131.6	70%	0.701	74%	0.738	S	S	*	*			trans	-90	-177.2	173.9	-49.5	148.7	108.7	0	0	111
898	E	30.1	Very low	34.8	Very low	164 Å²	164	129.1 Å²	129.1	77%	0.766	73%	0.726	S	S	*	*			cis	-143.4	-169.1	38.2	-72.3	-176.5	-177	0	0	114.9	K896	K896-E898 IonicContact NZ-OE1 3.86Å; K896-E898 PolarHBondContact NZ-OE1 3.39Å
899	A	36	Very low	34.8	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	73%	0.73	S	S	*	*			trans	-124.4	-133.6	-150.9	0	0	0	0	0	116
900	P	52.3	Low	34.6	Very low	127 Å²	127	132 Å²	132	83%	0.825	73%	0.725	S	S	*	*				-131.4	163.8	-97.8	36.8	-20.5	0	0	0	118.5
901	G	26.9	Very low	34.4	Very low	72 Å²	72	133 Å²	133	74%	0.742	73%	0.73	S	S	*	*			trans	97.4	-172.8	145.8	0	0	0	0	0	118.9
902	P	50.2	Low	36	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	73%	0.729	S	S	*	*				-141.1	172.8	-74.8	38.2	-23.1	0	0	0	117.1
903	S	28.2	Very low	36.9	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	74%	0.739	S	S	*	*			trans	74.8	138.9	145.9	50.8	0	0	0	0	125
904	S	29.1	Very low	36.8	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	74%	0.742	S	S	*	*			trans	75.4	109.8	134.6	64.3	0	0	0	0	125.3
905	S	29.5	Very low	36.5	Very low	98 Å²	98	126.1 Å²	126.1	69%	0.685	75%	0.749	S	S	*	*				69.5	124.4	118.6	71.4	0	0	0	0	125.7
906	T	29.7	Very low	36.8	Very low	125 Å²	125	124.3 Å²	124.3	77%	0.767	75%	0.748	S	S	*	*			trans	71.5	130.5	130.6	53.8	0	0	0	0	125
907	E	28.9	Very low	37.8	Very low	165 Å²	165	122.9 Å²	122.9	77%	0.771	75%	0.752	S	S	*	*			trans	77.6	114.3	136.8	-78.5	-141.7	69.7	0	0	124.7
908	S	32	Very low	37.7	Very low	85 Å²	85	122.9 Å²	122.9	59%	0.594	76%	0.755	S	S	*	*				76	129.7	116.5	-61.6	0	0	0	0	124.4
909	K	31	Very low	38.2	Very low	195 Å²	195	120.4 Å²	120.4	85%	0.848	75%	0.752	S	S	*	*			trans	86.2	116.2	138.3	-84.3	172.7	-180	165.9	0	123
910	K	28	Very low	37.9	Very low	173 Å²	173	127 Å²	127	75%	0.752	76%	0.757	S	S	*	*				104.1	93.5	113.3	-161.5	-179.7	-176.8	-172.2	0	121.9
911	E	33	Very low	37.2	Very low	161 Å²	161	128.6 Å²	128.6	75%	0.752	75%	0.751	S	S	*	*				76.8	178.2	120.7	-114.1	-174.8	164	0	0	120.9
912	P	67.8	Low	37.4	Very low	103 Å²	103	131.8 Å²	131.8	67%	0.669	75%	0.747	S	S	*	*				-126.2	-167.4	-123.4	42.4	-22	0	0	0	115.3
913	P	60.1	Low	36.6	Very low	123 Å²	123	131 Å²	131	80%	0.799	74%	0.743	S	S	*	*				-155	147.8	98.6	38.9	-19.9	0	0	0	119.9
914	S	34.7	Very low	36.8	Very low	121 Å²	121	131.9 Å²	131.9	85%	0.846	75%	0.745	S	S	*	*				50.4	123.5	128.7	-160.2	0	0	0	0	125.2
915	A	32.1	Very low	37	Very low	100 Å²	100	133.5 Å²	133.5	83%	0.826	75%	0.75	S	S	*	*				-167.6	160.5	127.8	0	0	0	0	0	111.9
916	A	40.3	Very low	37.5	Very low	95 Å²	95	132.8 Å²	132.8	79%	0.785	75%	0.75	S	S	*	*			trans	-149.1	-163.5	-174.4	0	0	0	0	0	110.1
917	P	57.8	Low	37.9	Very low	106 Å²	106	132.1 Å²	132.1	69%	0.688	75%	0.748	S	S	*	*			cis	-145.3	-158.5	3.9	36.7	-10.7	0	0	0	116.7
918	I	35.1	Very low	37.9	Very low	149 Å²	149	131 Å²	131	76%	0.764	75%	0.752	S	S	*	*			trans	83.2	131.9	159.1	-65.4	159.5	0	0	0	118
919	T	39.6	Very low	38.2	Very low	113 Å²	113	131 Å²	131	69%	0.693	76%	0.758	S	S	*	*			cis	-164.7	151.7	-20.7	35.8	0	0	0	0	111.5
920	R	30.1	Very low	38.8	Very low	231 Å²	231	128 Å²	128	87%	0.872	76%	0.759	S	S	*	*			trans	63.9	149.4	152.6	-82.2	-175.2	175	-173.2	-0.9	118.7
921	K	37.1	Very low	39	Very low	160 Å²	160	124.2 Å²	124.2	70%	0.696	76%	0.759	S	S	*	*			cis	-164.9	157.2	-20.5	-143.6	-174.8	168.6	-148.5	0	109.2
922	E	32.2	Very low	39.3	Very low	139 Å²	139	122.5 Å²	122.5	65%	0.65	76%	0.759	S	S	*	*			trans	70.3	116.4	156.2	-79.9	162	-139.5	0	0	122.9
923	S	33.1	Very low	37.6	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	77%	0.768	S	S	*	*				81.1	116.5	121	-57.1	0	0	0	0	124
924	T	32.1	Very low	36.5	Very low	123 Å²	123	126.3 Å²	126.3	76%	0.755	76%	0.758	S	S	*	*				81.8	112.1	124.8	-55.6	0	0	0	0	122
925	T	32.4	Very low	36.4	Very low	138 Å²	138	129.6 Å²	129.6	85%	0.847	76%	0.759	S	S	*	*			trans	72.8	157	149.7	-54.4	0	0	0	0	118.9
926	A	40.3	Very low	36.7	Very low	83 Å²	83	132 Å²	132	69%	0.686	75%	0.753	S	S	*	*			trans	-92.1	147.2	-159.1	0	0	0	0	0	116.4
927	P	38.9	Very low	36.3	Very low	111 Å²	111	136.1 Å²	136.1	72%	0.721	76%	0.757	S	S	*	*			trans	-84.1	152.9	152.9	35.3	-30.8	0	0	0	110.5
928	V	28.9	Very low	35.2	Very low	141 Å²	141	140.6 Å²	140.6	86%	0.855	76%	0.76	S	S	*	*			cis	75	137	46.6	-177.3	0	0	0	0	112.9
929	A	38.8	Very low	35.2	Very low	86 Å²	86	141.6 Å²	141.6	71%	0.711	76%	0.759	S	S	*	*			trans	-76.6	160.2	-163.5	0	0	0	0	0	115.4
930	P	42.8	Very low	35.2	Very low	133 Å²	133	142.1 Å²	142.1	86%	0.864	75%	0.753	S	S	*	*			trans	-82.1	147.9	166.2	34.4	-33.6	0	0	0	111.8
931	A	32.6	Very low	35.8	Very low	93 Å²	93	135.8 Å²	135.8	77%	0.769	74%	0.744	S	S	*	*			trans	-131.2	154.5	176.1	0	0	0	0	0	111.9
932	V	38.8	Very low	35.7	Very low	124 Å²	124	137.3 Å²	137.3	75%	0.752	75%	0.751	S	S	*	*			trans	28.9	124.2	143.7	-179.3	0	0	0	0	119.2
933	Q	32	Very low	35.8	Very low	183 Å²	183	136.2 Å²	136.2	86%	0.855	75%	0.754	S	S	*	*			trans	-163.6	167.5	131.2	-110.2	-178.5	3	0	0	112
934	Q	37.3	Very low	35.7	Very low	124 Å²	124	135.3 Å²	135.3	58%	0.579	75%	0.753	S	S	*	*				-177.5	133.1	-75.3	171.6	-172.2	62.5	0	0	110
935	Q	32.2	Very low	35.9	Very low	189 Å²	189	136.9 Å²	136.9	88%	0.883	76%	0.756	S	S	*	*			trans	175.7	128.1	151.4	-101.3	165.6	24.2	0	0	107.2
936	Q	38.2	Very low	36.7	Very low	150 Å²	150	136 Å²	136	70%	0.701	75%	0.753	S	S	*	*			cis	74.2	104.9	16.9	-67.4	-163.9	-7.6	0	0	118.8
937	Q	33.1	Very low	36.2	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	76%	0.757	S	S	*	*				-142.8	124	126.9	-63.5	-160.5	15.4	0	0	106.3
938	R	33.1	Very low	35.9	Very low	201 Å²	201	139.2 Å²	139.2	76%	0.758	76%	0.76	S	S	*	*				74.5	135.4	72	-81.9	-174.8	150.5	154.3	5.8	113.1	E940	R938-E940 WeakPolarHBondContact CG-OE1 3.34Å; R938-E940 IonicContact CZ-OE1 2.79Å; R938-E940 IonicContact NE-OE1 2.55Å; R938-E940 PolarHBondContact NE-OE1 3.22Å; R938-E940 IonicContact NH2-OE1 3.08Å
939	K	36	Very low	36.8	Very low	169 Å²	169	137.8 Å²	137.8	74%	0.735	75%	0.754	S	S	*	*			cis	-144.7	142.5	25.8	-107.3	146.6	172.5	-167.7	0	110.6
940	E	40.1	Very low	36.5	Very low	125 Å²	125	140.8 Å²	140.8	58%	0.584	75%	0.753	S	S	*	*				74.3	142.2	76.9	-63.7	162.8	-141.4	0	0	112.9	R938	R938-E940 WeakPolarHBondContact CG-OE1 3.34Å; R938-E940 IonicContact CZ-OE1 2.79Å; R938-E940 IonicContact NE-OE1 2.55Å; R938-E940 PolarHBondContact NE-OE1 3.22Å; R938-E940 IonicContact NH2-OE1 3.08Å
941	S	41.9	Very low	35.8	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	74%	0.741	S	S	*	*			cis	-173.5	163.7	11.9	33	0	0	0	0	115.8
942	F	35.3	Very low	35.8	Very low	191 Å²	191	143 Å²	143	84%	0.838	74%	0.736	S	S	*	*			trans	79.5	142	149	-86.5	-144.4	0	0	0	120.2
943	T	33.3	Very low	35.4	Very low	116 Å²	116	144.3 Å²	144.3	71%	0.712	73%	0.734	S	S	*	*			cis	-140.5	-172.2	5.3	-18.9	0	0	0	0	108.6
944	A	32	Very low	35.3	Very low	81 Å²	81	143 Å²	143	67%	0.669	73%	0.727	S	S	*	*			cis	-151.9	169.6	7	0	0	0	0	0	107.8
945	L	35.7	Very low	35	Very low	157 Å²	157	146.2 Å²	146.2	82%	0.822	74%	0.742	S	S	*	*			cis	71.2	141.1	33.2	-59.2	175.7	0	0	0	115.3
946	P	50.2	Low	34.8	Very low	120 Å²	120	147.1 Å²	147.1	78%	0.779	74%	0.737	S	S	*	*			cis	-111	-158	-5.2	44.2	-31.4	0	0	0	111.5
947	S	29.6	Very low	34.4	Very low	110 Å²	110	147.2 Å²	147.2	77%	0.769	74%	0.738	S	S	*	*			cis	-163.7	170.2	-6.1	22.3	0	0	0	0	110.4
948	L	32.1	Very low	34.9	Very low	151 Å²	151	143.6 Å²	143.6	79%	0.791	73%	0.73	S	S	*	*			trans	-131.5	167.8	162.4	-147	87.1	0	0	0	109.6
949	P	48.4	Very low	34.8	Very low	111 Å²	111	140.8 Å²	140.8	72%	0.721	73%	0.729	S	S	*	*				-146.7	173	105.2	39.6	-22.2	0	0	0	112.8
950	E	31	Very low	34.5	Very low	148 Å²	148	139.4 Å²	139.4	69%	0.692	73%	0.729	S	S	*	*			cis	66.3	140.3	42.5	-75.6	-163.1	105.2	0	0	114.5
951	Q	29.9	Very low	34.2	Very low	133 Å²	133	141.5 Å²	141.5	62%	0.621	74%	0.736	S	S	*	*			cis	-161	166.5	12	-127.1	-177.8	39.5	0	0	113.9
952	Q	31.4	Very low	33.8	Very low	141 Å²	141	146 Å²	146	66%	0.659	74%	0.744	S	S	*	*			trans	60.4	127.6	148.5	-65.5	-171.4	31.6	0	0	126.5
953	Q	30.1	Very low	33.9	Very low	151 Å²	151	146.7 Å²	146.7	71%	0.706	75%	0.746	S	S	*	*			trans	65.8	130.6	130.9	-65.5	-168	6.1	0	0	126.3
954	H	31.1	Very low	34.5	Very low	154 Å²	154	146.7 Å²	146.7	71%	0.713	75%	0.748	S	S	*	*			trans	44	122	146	-61	-60.4	0	0	0	123.4
955	H	30.2	Very low	35.6	Very low	193 Å²	193	148.3 Å²	148.3	89%	0.894	75%	0.752	S	S	*	*				-172.7	-177.5	116	-106.4	-75.9	0	0	0	113.2
956	R	28.5	Very low	35.7	Very low	207 Å²	207	149.2 Å²	149.2	78%	0.781	76%	0.757	S	S	*	*			trans	-98.3	144.6	-170.8	-69	164.5	89.3	157.3	7.2	113.9
957	E	28.9	Very low	35.3	Very low	153 Å²	153	152.1 Å²	152.1	72%	0.715	76%	0.76	S	S	*	*			trans	51.7	167	136.3	-60.4	-177.3	100.1	0	0	119.9
958	P	44.7	Very low	35.9	Very low	106 Å²	106	152.6 Å²	152.6	69%	0.688	76%	0.76	S	S	*	*			cis	-141	164.1	8.6	43.8	-25.3	0	0	0	119.6
959	L	30	Very low	36.7	Very low	141 Å²	141	151.3 Å²	151.3	74%	0.738	76%	0.761	S	S	*	*			trans	62.9	149.7	135.6	-73.5	169.4	0	0	0	127.1
960	L	31.3	Very low	36.7	Very low	141 Å²	141	151.8 Å²	151.8	74%	0.738	76%	0.764	S	S	*	*			trans	95.8	116.6	161.9	-51.7	-173.4	0	0	0	116.8
961	K	33.9	Very low	37.4	Very low	168 Å²	168	150.3 Å²	150.3	73%	0.73	77%	0.767	S	S	*	*				75.7	138.6	52.6	-66.3	177.8	-179.1	169.8	0	112.3
962	K	33.3	Very low	38.6	Very low	193 Å²	193	150 Å²	150	84%	0.839	78%	0.777	S	S	*	*			cis	-169.5	149	11.6	-132.9	179.7	178.9	-174.8	0	111.2
963	K	36.2	Very low	38.9	Very low	205 Å²	205	152.7 Å²	152.7	89%	0.891	79%	0.79	S	S	*	*			trans	-170.7	156.2	141.1	-109.4	175.2	-178.7	-178.2	0	112.1
964	P	46.7	Very low	39.4	Very low	117 Å²	117	154 Å²	154	76%	0.76	80%	0.798	S	S	*	*			trans	-132.3	-155.5	-158	51.6	-33.9	0	0	0	113.4
965	P	54.7	Low	39.6	Very low	115 Å²	115	154 Å²	154	75%	0.747	81%	0.809	S	S	*	*				-136.3	-169.1	-122.5	35.9	-10.1	0	0	0	116.3
966	L	38.1	Very low	39.6	Very low	175 Å²	175	148.1 Å²	148.1	92%	0.916	80%	0.8	S	S	*	*			trans	-161	169.9	151.3	-111.5	167.5	0	0	0	112
967	Q	40.6	Very low	41.3	Very low	182 Å²	182	144.2 Å²	144.2	85%	0.85	80%	0.802	S	S	*	*			trans	-125.8	161.8	-164.1	-79.8	-177.9	-47.8	0	0	115.7
968	P	43.5	Very low	42.4	Very low	119 Å²	119	143.1 Å²	143.1	77%	0.773	81%	0.808	S	S	*	*			trans	-99.2	168.9	171	39.7	-35	0	0	0	114.7
969	P	48	Very low	41.9	Very low	125 Å²	125	146.2 Å²	146.2	81%	0.812	82%	0.817	S	S	*	*			trans	-96.9	166.7	-176	37.7	-36.3	0	0	0	116.6
970	P	49	Very low	42.1	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	81%	0.813	S	S	*	*			trans	-107.9	173.8	-173.3	41.7	-36.1	0	0	0	116.4
971	P	45	Very low	42	Very low	118 Å²	118	144.2 Å²	144.2	77%	0.766	82%	0.821	S	S	*	*			trans	-99	168.1	-177.5	39	-36.4	0	0	0	116
972	P	55.1	Low	42	Very low	127 Å²	127	146.7 Å²	146.7	83%	0.825	83%	0.827	S	S	*	*			trans	-95.7	170.9	-177.8	38	-36.2	0	0	0	115.9
973	Q	37.4	Very low	42.6	Very low	197 Å²	197	143.1 Å²	143.1	92%	0.921	82%	0.824	S	S	*	*			trans	-131.5	174.8	179.6	-68.8	-174.7	-15.5	0	0	112.9
974	M	40.7	Very low	42.1	Very low	179 Å²	179	136.8 Å²	136.8	88%	0.882	82%	0.817	S	S	*	*			trans	-91.3	166.4	-171.2	-57.2	-173.9	76.1	0	0	115.6
975	T	35.6	Very low	42.8	Very low	154 Å²	154	137.2 Å²	137.2	95%	0.945	82%	0.819	S	S	*	*			trans	-161.3	172.3	156.8	-4.8	0	0	0	0	112.3
976	G	31.1	Very low	42.4	Very low	69 Å²	69	138 Å²	138	71%	0.711	82%	0.824	S	S	*	*			trans	-113.4	-160.7	-160.4	0	0	0	0	0	119.3
977	P	63.3	Low	41.9	Very low	124 Å²	124	134 Å²	134	81%	0.805	82%	0.816	S	S	*	*			trans	-109.7	175.7	-150.9	42.1	-38.9	0	0	0	117.4
978	P	52	Low	42.1	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	82%	0.817	S	S	*	*			trans	-138.4	-162.2	141.2	39.4	-24.2	0	0	0	114.8
979	I	35.4	Very low	41.3	Very low	171 Å²	171	129.3 Å²	129.3	88%	0.877	82%	0.815	S	S	*	*			trans	-125.1	131.8	-152.5	-62.3	162.9	0	0	0	115.2
980	G	34.2	Very low	40.3	Very low	64 Å²	64	130.5 Å²	130.5	66%	0.66	82%	0.815	S	S	*	*			trans	44.9	147.5	138.7	0	0	0	0	0	125.8
981	I	28.3	Very low	39.3	Very low	177 Å²	177	132.2 Å²	132.2	91%	0.908	82%	0.816	S	S	*	*			trans	161.8	147.7	140.3	-85	159.2	0	0	0	112.8
982	Y	33	Very low	39.3	Very low	219 Å²	219	132.5 Å²	132.5	86%	0.859	82%	0.818	S	S	*	*			trans	-92.2	-174.8	176.5	-109.9	-112.4	0	0	0	111.6
983	P	47.7	Very low	38	Very low	119 Å²	119	130.3 Å²	130.3	77%	0.773	82%	0.819	S	S	*	*			cis	-140.7	-175.7	2.1	43.6	-25.3	0	0	0	117.4
984	G	25.8	Very low	37.7	Very low	72 Å²	72	126.4 Å²	126.4	74%	0.742	81%	0.813	S	S	*	*			trans	109.1	134.8	131.1	0	0	0	0	0	121.4
985	P	60.3	Low	37.2	Very low	125 Å²	125	122.8 Å²	122.8	81%	0.812	81%	0.806	S	S	*	*			trans	-110.5	171.3	177.1	42.3	-35.2	0	0	0	115
986	P	46.4	Very low	37	Very low	131 Å²	131	127.1 Å²	127.1	85%	0.851	80%	0.804	S	S	*	*				-152.9	-176	101.4	40.6	-21.9	0	0	0	117
987	A	27.5	Very low	37.9	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	81%	0.805	S	S	*	*			trans	-102.6	-160.4	175.9	0	0	0	0	0	111.7
988	P	45.4	Very low	36.7	Very low	133 Å²	133	129.4 Å²	129.4	86%	0.864	81%	0.81	S	S	*	*			cis	-140.2	-175.9	-5.9	43.8	-25.3	0	0	0	117
989	G	25.6	Very low	35.7	Very low	71 Å²	71	126.1 Å²	126.1	73%	0.732	80%	0.8	S	S	*	*			trans	158.5	107.4	156	0	0	0	0	0	123.5
990	N	28	Very low	35.4	Very low	150 Å²	150	124.4 Å²	124.4	80%	0.802	79%	0.793	S	S	*	*			trans	37.9	120.9	140.4	-61.2	-14.3	0	0	0	127.6
991	L	27.6	Very low	35.3	Very low	156 Å²	156	132.1 Å²	132.1	82%	0.817	80%	0.802	S	S	*	*				55.1	166.1	122.6	-61.3	177.7	0	0	0	123.6
992	P	44.5	Very low	35.4	Very low	124 Å²	124	132.9 Å²	132.9	81%	0.805	80%	0.798	S	S	*	*			cis	-142	173	-37.6	39.6	-21.7	0	0	0	117.5
993	G	27.5	Very low	35.6	Very low	81 Å²	81	129.3 Å²	129.3	84%	0.835	79%	0.79	S	S	*	*			trans	131	120.8	136.9	0	0	0	0	0	125.8
994	S	30.8	Very low	35.3	Very low	115 Å²	115	129.6 Å²	129.6	80%	0.804	79%	0.791	S	S	*	*			trans	90.8	124.2	132.3	-149.3	0	0	0	0	128.4
995	S	32.1	Very low	35.4	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	79%	0.794	S	S	*	*			trans	66.8	106.8	134	59.2	0	0	0	0	129
996	R	30.2	Very low	35.4	Very low	244 Å²	244	132.8 Å²	132.8	92%	0.921	79%	0.79	S	S	*	*				29.5	172.5	109.3	-100.2	-175	179.6	-165.7	1.6	123.9
997	P	49.7	Very low	35	Very low	112 Å²	112	132.4 Å²	132.4	73%	0.727	79%	0.787	S	S	*	*			cis	-152.4	177.5	-14.6	43	-21.9	0	0	0	121.6
998	S	38	Very low	35.5	Very low	130 Å²	130	133.9 Å²	133.9	91%	0.909	79%	0.789	S	S	*	*			trans	79.4	147.5	136.3	-157	0	0	0	0	127.9
999	G	30.9	Very low	35.7	Very low	61 Å²	61	133.4 Å²	133.4	63%	0.629	79%	0.786	S	S	*	*			trans	-177.2	162.7	169.9	0	0	0	0	0	117.1
1000	N	31	Very low	36.7	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	79%	0.788	S	S	*	*			trans	-170.7	156.3	-175.2	-125.3	-120.9	0	0	0	120.7
1001	R	31.3	Very low	36.8	Very low	226 Å²	226	136.4 Å²	136.4	85%	0.853	79%	0.789	S	S	*	*			trans	77.8	167.7	158	-62.4	147.4	-162.1	-155.2	-1.2	119.2
1002	K	31	Very low	37.3	Very low	193 Å²	193	136 Å²	136	84%	0.839	79%	0.786	S	S	*	*			cis	-156.1	-170.3	9.3	-152.2	-145.3	171.4	-172.2	0	114
1003	Q	35.8	Very low	36.6	Very low	144 Å²	144	142.1 Å²	142.1	67%	0.673	79%	0.793	S	S	*	*			trans	-148.4	171.5	174.3	-88.9	-164.4	-0.6	0	0	114.3
1004	P	43	Very low	36.6	Very low	124 Å²	124	141.4 Å²	141.4	81%	0.805	79%	0.785	S	S	*	*			trans	-148	-179.5	132.8	39.2	-21.2	0	0	0	118
1005	L	26	Very low	38.1	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	79%	0.785	S	S	*	*			trans	-132.7	-136.5	-170.2	-70.1	164.7	0	0	0	116.7
1006	P	61.1	Low	38.6	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	79%	0.789	S	S	*	*				-136.9	-168.1	-118.3	45.8	-24.9	0	0	0	118
1007	P	37.8	Very low	39.5	Very low	123 Å²	123	136.1 Å²	136.1	80%	0.799	78%	0.777	S	S	*	*			trans	-138.6	172	145.4	23.3	-0.7	0	0	0	117.1
1008	P	39.1	Very low	38.8	Very low	123 Å²	123	136.9 Å²	136.9	80%	0.799	78%	0.775	S	S	*	*			trans	-125.2	-179.7	-157	43.5	-30.5	0	0	0	119.6
1009	P	49.1	Very low	38.4	Very low	123 Å²	123	137.8 Å²	137.8	80%	0.799	77%	0.765	S	S	*	*			trans	-127.1	-173.7	-170.6	45.3	-32.4	0	0	0	117.2
1010	P	46.8	Very low	38.3	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	77%	0.769	S	S	*	*			trans	-135	123.2	169.3	37.4	-20	0	0	0	119.9
1011	M	30.4	Very low	38.3	Very low	166 Å²	166	144.2 Å²	144.2	82%	0.818	77%	0.77	S	S	*	*			trans	53.9	114.3	132.5	-62	-179.8	72	0	0	127.8
1012	I	36.7	Very low	38.3	Very low	147 Å²	147	142.6 Å²	142.6	75%	0.754	76%	0.764	S	S	*	*				54.2	121.4	117.9	-56.6	169.5	0	0	0	123.1
1013	R	30.7	Very low	38.3	Very low	252 Å²	252	138.2 Å²	138.2	95%	0.951	75%	0.749	S	S	*	*				-172.4	174.1	112.1	-130.3	165.8	-175.8	162.6	0.9	113.3
1014	G	27.9	Very low	38.1	Very low	66 Å²	66	142 Å²	142	68%	0.68	76%	0.757	S	S	*	*			trans	-134.2	178.6	-167.9	0	0	0	0	0	118.3
1015	P	60.9	Low	37.6	Very low	122 Å²	122	142.1 Å²	142.1	79%	0.792	76%	0.761	S	S	*	*			trans	-96.1	-179.8	-167.5	40.4	-39.3	0	0	0	115.3
1016	P	43.9	Very low	37.8	Very low	125 Å²	125	138.8 Å²	138.8	81%	0.812	76%	0.764	S	S	*	*				-138.6	-123.6	116.5	32	-8.7	0	0	0	116.4
1017	P	48.5	Very low	36.3	Very low	104 Å²	104	137.3 Å²	137.3	68%	0.675	77%	0.769	S	S	*	*				-141	179.9	-124.8	45.4	-24.3	0	0	0	120.9
1018	D	34.3	Very low	35.7	Very low	128 Å²	128	135.5 Å²	135.5	68%	0.684	77%	0.773	S	S	*	*			trans	86.2	115.9	137.6	-86	-33.4	0	0	0	127.1
1019	Q	30.5	Very low	35.2	Very low	150 Å²	150	133.5 Å²	133.5	70%	0.701	78%	0.775	S	S	*	*				68.3	127	122.5	-82.7	-178.1	78.4	0	0	127.1
1020	M	28.4	Very low	34.2	Very low	143 Å²	143	131.3 Å²	131.3	70%	0.704	77%	0.774	S	S	*	*				87.8	112	124.9	-72	-98.4	-88.9	0	0	124.6
1021	Y	31	Very low	33.5	Very low	187 Å²	187	131.3 Å²	131.3	73%	0.733	78%	0.777	S	S	*	*				71	113.8	125.3	-111.9	-113.9	0	0	0	123.3
1022	R	31.1	Very low	33.7	Very low	193 Å²	193	131.3 Å²	131.3	73%	0.728	78%	0.777	S	S	*	*				124.2	130.3	107.5	-138.3	-166.9	174.5	126	8.1	121.1
1023	D	31.3	Very low	33.5	Very low	101 Å²	101	135.3 Å²	135.3	54%	0.54	78%	0.783	S	S	.	*			trans	61	132.7	144.8	-91.9	-48.1	0	0	0	124.8
1024	R	31.5	Very low	33.6	Very low	222 Å²	222	127.2 Å²	127.2	84%	0.838	78%	0.778	S	S	*	*			trans	44.2	125.2	142	-67.4	166	-179.8	-135.6	-4.1	119.5
1025	S	31.7	Very low	33.8	Very low	127 Å²	127	127.7 Å²	127.7	89%	0.888	78%	0.783	S	S	*	*				-169.6	160.7	62.3	47.8	0	0	0	0	113
1026	G	31.4	Very low	32.6	Very low	82 Å²	82	131.9 Å²	131.9	85%	0.845	79%	0.789	S	S	*	*			trans	-149.4	144.5	167.7	0	0	0	0	0	109.8
1027	G	28	Very low	33.2	Very low	81 Å²	81	131.5 Å²	131.5	84%	0.835	79%	0.786	S	S	*	*			trans	-178.4	124.9	-178.2	0	0	0	0	0	113.9
1028	G	27.2	Very low	33	Very low	86 Å²	86	132.3 Å²	132.3	89%	0.887	79%	0.791	S	S	*	*			trans	81.5	144	176.7	0	0	0	0	0	114.5
1029	G	27.4	Very low	33	Very low	81 Å²	81	130.4 Å²	130.4	84%	0.835	79%	0.793	S	S	*	*			cis	159.5	151.5	-5.6	0	0	0	0	0	112.3
1030	G	28.6	Very low	33.1	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	80%	0.797	S	S	*	*			trans	93.7	116.7	-172.4	0	0	0	0	0	110.9
1031	S	32.4	Very low	33.5	Very low	117 Å²	117	129.7 Å²	129.7	82%	0.818	80%	0.8	S	S	*	*			cis	75.8	153.9	31.4	-156.7	0	0	0	0	114.3
1032	M	34.4	Very low	33.6	Very low	167 Å²	167	129.3 Å²	129.3	82%	0.823	80%	0.799	S	S	*	*			trans	81.8	143.7	-169.8	-53.8	-61	-178.7	0	0	115.9
1033	R	33.2	Very low	33.6	Very low	231 Å²	231	128.4 Å²	128.4	87%	0.872	80%	0.803	S	S	*	*			cis	-169.8	123.6	-25.4	-167.3	178.3	-171	-151.8	4.1	110.7
1034	G	31.1	Very low	33.6	Very low	82 Å²	82	127.6 Å²	127.6	85%	0.845	82%	0.818	S	S	*	*			trans	70.4	169.7	172.6	0	0	0	0	0	115.1
1035	G	32.3	Very low	33.7	Very low	76 Å²	76	120 Å²	120	78%	0.784	81%	0.808	S	S	*	*			cis	-175.7	137.2	-8.5	0	0	0	0	0	112.5
1036	F	36.7	Very low	33.8	Very low	210 Å²	210	120 Å²	120	92%	0.921	80%	0.803	S	S	*	*			trans	-67.7	168.3	160.4	-66.3	-93.8	0	0	0	109.7
1037	P	55.4	Low	33.8	Very low	116 Å²	116	121.8 Å²	121.8	75%	0.753	80%	0.803	S	S	*	*			cis	-129.1	-151.9	14.7	43.6	-23	0	0	0	110.3
1038	P	44.2	Very low	33.9	Very low	122 Å²	122	121.2 Å²	121.2	79%	0.792	80%	0.797	S	S	*	*			cis	-129.7	-176.6	-2.8	42.3	-24	0	0	0	116.1
1039	A	35.6	Very low	34.1	Very low	87 Å²	87	123.3 Å²	123.3	72%	0.719	79%	0.792	S	S	*	*			trans	-110.7	179.1	177.8	0	0	0	0	0	111.7
1040	S	33	Very low	34.2	Very low	112 Å²	112	125.7 Å²	125.7	78%	0.783	79%	0.786	S	S	*	*			trans	73.9	151.5	172.1	87.1	0	0	0	0	115
1041	H	35.4	Very low	34.4	Very low	166 Å²	166	129.8 Å²	129.8	77%	0.769	78%	0.782	S	S	*	*			cis	-150.8	-164	-2.2	-142.1	30.7	0	0	0	112
1042	Y	33.7	Very low	34.2	Very low	179 Å²	179	131.5 Å²	131.5	70%	0.702	78%	0.777	S	S	*	*			trans	-20.6	147.4	158.6	-95.2	-109	0	0	0	116.4
1043	H	32.1	Very low	33.9	Very low	175 Å²	175	129.2 Å²	129.2	81%	0.81	77%	0.772	S	S	*	*				-172.5	156.7	96	-95.5	-69.8	0	0	0	112.2
1044	G	30.9	Very low	33.7	Very low	84 Å²	84	122.5 Å²	122.5	87%	0.866	77%	0.766	S	S	*	*			trans	-75.9	116.1	155.2	0	0	0	0	0	108.4
1045	G	33.6	Very low	33.6	Very low	61 Å²	61	123 Å²	123	63%	0.629	76%	0.756	S	S	*	*			trans	-179.8	84.6	-173.9	0	0	0	0	0	113.9
1046	T	33.7	Very low	33.4	Very low	127 Å²	127	129.8 Å²	129.8	78%	0.779	76%	0.76	S	S	*	*			trans	46.2	124.1	150.1	56.1	0	0	0	0	120.9
1047	S	31.2	Very low	33	Very low	120 Å²	120	123.2 Å²	123.2	84%	0.839	74%	0.744	S	S	*	*			trans	50.1	131.9	146.7	58.7	0	0	0	0	120.4
1048	G	30	Very low	31.8	Very low	69 Å²	69	127.2 Å²	127.2	71%	0.711	75%	0.753	S	S	*	*			cis	143.6	179.9	3.4	0	0	0	0	0	111.7
1049	V	31.4	Very low	31.1	Very low	131 Å²	131	125 Å²	125	79%	0.794	75%	0.752	S	S	*	*			trans	71.4	97.5	155.6	-173	0	0	0	0	118.7
1050	N	30	Very low	30.9	Very low	130 Å²	130	129 Å²	129	70%	0.695	76%	0.761	S	S	*	*			trans	78.7	140.8	134.1	-86.7	-29.6	0	0	0	124.6
1051	K	31.9	Very low	32	Very low	164 Å²	164	129.2 Å²	129.2	71%	0.713	76%	0.759	S	S	*	*			trans	73.7	152.2	136.4	-74.5	178.8	-178	-176.6	0	119.8
1052	Q	29.3	Very low	32.2	Very low	152 Å²	152	127.3 Å²	127.3	71%	0.71	76%	0.761	S	S	*	*			cis	-169.5	165.2	-25.2	-124.2	176.3	-23.8	0	0	110.4
1053	V	26.9	Very low	32	Very low	120 Å²	120	122 Å²	122	73%	0.727	76%	0.761	S	S	*	*			trans	62	107.8	147.6	175.2	0	0	0	0	120.4
1054	A	29.6	Very low	32.1	Very low	89 Å²	89	123.1 Å²	123.1	74%	0.736	77%	0.769	S	S	*	*				51.1	-178.2	120.5	0	0	0	0	0	120.9
1055	S	29.1	Very low	32.1	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	76%	0.76	S	S	*	*			cis	-164.1	163.1	2.2	-136.4	0	0	0	0	111.7
1056	Y	28.7	Very low	32.7	Very low	218 Å²	218	124.7 Å²	124.7	86%	0.855	77%	0.765	S	S	*	*			trans	66.6	168.3	154.4	-80.3	-141	0	0	0	118.6
1057	A	27.3	Very low	33	Very low	72 Å²	72	124.3 Å²	124.3	60%	0.595	76%	0.764	S	S	*	*			cis	-173.2	175.5	-35.2	0	0	0	0	0	111.6
1058	Q	30.6	Very low	32.8	Very low	200 Å²	200	124.6 Å²	124.6	94%	0.935	76%	0.761	S	S	*	*			trans	69.5	151.1	155.3	-69.4	171.4	-10.8	0	0	121.2
1059	G	29.4	Very low	32.8	Very low	75 Å²	75	126.5 Å²	126.5	77%	0.773	76%	0.759	S	S	*	*			trans	146.6	91	165.8	0	0	0	0	0	116.6
1060	L	30.5	Very low	32.7	Very low	173 Å²	173	129 Å²	129	91%	0.906	76%	0.759	S	S	*	*			trans	-122.6	-165.2	166.3	-69.5	173.1	0	0	0	109.4
1061	P	56.2	Low	33.6	Very low	116 Å²	116	127.3 Å²	127.3	75%	0.753	76%	0.755	S	S	*	*				-107.2	-175.4	-91.6	42.4	-28.2	0	0	0	111.7
1062	P	39.6	Very low	33.5	Very low	125 Å²	125	128 Å²	128	81%	0.812	76%	0.761	S	S	*	*				-144.2	-178.7	82.5	34.1	-13.3	0	0	0	112.4
1063	G	29.8	Very low	33.5	Very low	67 Å²	67	123.8 Å²	123.8	69%	0.691	76%	0.758	S	S	*	*			cis	114.2	95.1	1.2	0	0	0	0	0	113.9
1064	M	35	Very low	33.7	Very low	199 Å²	199	124.9 Å²	124.9	98%	0.98	76%	0.759	S	S	*	*			trans	-159.8	152.3	157	-83.9	-134.2	80.9	0	0	110.6
1065	G	29.9	Very low	33.8	Very low	65 Å²	65	126.2 Å²	126.2	67%	0.67	75%	0.754	S	S	*	*			trans	-109.9	-172	-172.7	0	0	0	0	0	115.7
1066	P	47.7	Very low	34	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	76%	0.757	S	S	*	*			trans	-104.6	163.5	-167.5	39.8	-35.8	0	0	0	115.2
1067	P	38.9	Very low	34.1	Very low	118 Å²	118	128 Å²	128	77%	0.766	75%	0.754	S	S	*	*			trans	-84.3	145.1	151.9	35.3	-31.3	0	0	0	110.4
1068	V	26.6	Very low	34.2	Very low	127 Å²	127	128.4 Å²	128.4	77%	0.77	76%	0.757	S	S	*	*			cis	78	121.3	25.4	-176.5	0	0	0	0	113.3
1069	V	30.1	Very low	34.3	Very low	109 Å²	109	123.6 Å²	123.6	66%	0.661	75%	0.745	S	S	*	*			cis	-170.4	152.4	-18	88.5	0	0	0	0	111.8
1070	K	29.6	Very low	34.4	Very low	183 Å²	183	128.6 Å²	128.6	80%	0.796	75%	0.749	S	S	*	*			trans	64.1	-178.5	154	-73.4	179.9	-167	173.5	0	118.7
1071	P	48.8	Very low	34.5	Very low	95 Å²	95	130.7 Å²	130.7	62%	0.617	74%	0.744	S	S	*	*				-141.8	-163.9	-55.8	42.8	-26.4	0	0	0	115.1
1072	H	29.3	Very low	33.2	Very low	179 Å²	179	130.6 Å²	130.6	83%	0.829	74%	0.742	S	S	*	*			trans	77.3	141.9	165	-64.4	-55.7	0	0	0	118.6
1073	G	29.3	Very low	33.2	Very low	63 Å²	63	135.8 Å²	135.8	65%	0.649	75%	0.745	S	S	*	*			cis	170.9	151.6	-12.6	0	0	0	0	0	118
1074	N	32.7	Very low	33.6	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	75%	0.748	S	S	*	*			trans	70.7	152.6	150.2	-67.8	12	0	0	0	123
1075	N	30.4	Very low	33.6	Very low	117 Å²	117	134.5 Å²	134.5	63%	0.626	74%	0.74	S	S	*	*			trans	76.2	138.6	156.8	-68.2	-7.7	0	0	0	118.8
1076	Y	33.7	Very low	34	Very low	179 Å²	179	137.2 Å²	137.2	70%	0.702	74%	0.743	S	S	*	*			cis	-147.2	152.7	1.9	-108.4	-49.2	0	0	0	112.4
1077	Q	30.6	Very low	33.2	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.794	74%	0.744	S	S	*	*			trans	30.8	160.5	143	-75.3	167.5	-1	0	0	123.2
1078	A	29	Very low	32.8	Very low	80 Å²	80	143.3 Å²	143.3	66%	0.661	74%	0.743	S	S	*	*			cis	179	167.2	-28.1	0	0	0	0	0	109.5
1079	S	33.4	Very low	32.9	Very low	99 Å²	99	145 Å²	145	69%	0.692	75%	0.747	S	S	*	*			trans	69.2	134.1	171.2	-54.8	0	0	0	0	116
1080	Q	31.9	Very low	33	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	75%	0.751	S	S	*	*			cis	78.5	165.4	27.6	-60.1	-147.7	13.8	0	0	116.7
1081	W	31.6	Very low	33.1	Very low	216 Å²	216	141.1 Å²	141.1	82%	0.818	75%	0.748	S	S	*	*			trans	81.3	149	-175.8	-55.3	89.8	0	0	0	115.7
1082	V	29.6	Very low	32.4	Very low	115 Å²	115	145.3 Å²	145.3	70%	0.697	76%	0.759	S	S	*	*			cis	-175.5	159.5	-42.9	128.2	0	0	0	0	106.8
1083	R	39.3	Very low	32.6	Very low	233 Å²	233	141.7 Å²	141.7	88%	0.879	75%	0.754	S	S	*	*			trans	-73.7	136.7	177	-68.6	-177.1	176.7	-173.5	-1.6	113.3
1084	P	38.1	Very low	32.6	Very low	116 Å²	116	149.5 Å²	149.5	75%	0.753	77%	0.766	S	S	*	*			trans	-87.1	171.8	156.5	-9	28.5	0	0	0	112.8
1085	P	36.3	Very low	32.8	Very low	124 Å²	124	151.1 Å²	151.1	81%	0.805	77%	0.768	S	S	*	*			trans	-109.5	-165.2	-161.9	43	-36.5	0	0	0	115.6
1086	T	37.8	Very low	32.9	Very low	122 Å²	122	148.5 Å²	148.5	75%	0.748	77%	0.769	S	S	*	*			trans	-90.1	-178.3	-175.3	49.7	0	0	0	0	114.2
1087	H	30.8	Very low	33	Very low	162 Å²	162	148.6 Å²	148.6	75%	0.75	78%	0.778	S	S	*	*			trans	77.4	156.7	175.3	-80.9	-126.9	0	0	0	117.2
1088	R	29.5	Very low	33.6	Very low	198 Å²	198	145.8 Å²	145.8	75%	0.747	78%	0.775	S	S	*	*			cis	172.8	124.6	-32.6	168.1	-177.5	-176.5	-177.1	1.7	105.9
1089	D	28.6	Very low	33.9	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	78%	0.783	S	S	*	*			trans	-157.2	158	153.5	-104.3	-37.5	0	0	0	112
1090	S	32.3	Very low	34.4	Very low	105 Å²	105	150.9 Å²	150.9	73%	0.734	79%	0.792	S	S	*	*			trans	-163.8	137.9	-175.2	-51.7	0	0	0	0	111.7
1091	S	32.6	Very low	35	Very low	107 Å²	107	145.2 Å²	145.2	75%	0.748	78%	0.782	S	S	*	*			trans	-179.1	173.5	150.9	39.7	0	0	0	0	112.1
1092	H	33.5	Very low	36.2	Very low	182 Å²	182	140.9 Å²	140.9	84%	0.843	78%	0.781	S	S	*	*			trans	74.1	80.3	-167.3	-50.7	-49.8	0	0	0	113.2
1093	S	33	Very low	37.1	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	78%	0.782	S	S	*	*			cis	78.3	102.7	29.1	-165.9	0	0	0	0	115.9
1094	Y	30.4	Very low	37.2	Very low	227 Å²	227	138.7 Å²	138.7	89%	0.89	78%	0.783	S	S	*	*			trans	-148.6	154.4	150.4	-131.8	-94.4	0	0	0	110.4
1095	H	37.2	Very low	37.4	Very low	176 Å²	176	140.9 Å²	140.9	82%	0.815	79%	0.788	S	S	*	*			trans	-87.4	162.1	-179.1	-60	-100.1	0	0	0	111.3
1096	G	32.6	Very low	37.6	Very low	63 Å²	63	144.2 Å²	144.2	65%	0.649	79%	0.793	S	S	*	*			cis	167.2	-168.2	-0.3	0	0	0	0	0	111.4
1097	M	35.3	Very low	37.8	Very low	180 Å²	180	150 Å²	150	89%	0.887	80%	0.801	S	S	*	*			trans	77.5	165.4	-179.3	-50.8	-85.2	73.3	0	0	114.5
1098	P	44.1	Very low	38.2	Very low	111 Å²	111	151 Å²	151	72%	0.721	81%	0.806	S	S	*	*				-114.9	152.1	-104.4	10.7	14	0	0	0	115.1	L1100	P1098-L1100 PolarHBondContact O-N 3.33Å
1099	S	34.7	Very low	39.3	Very low	121 Å²	121	147.1 Å²	147.1	85%	0.846	81%	0.806	S	S	*	*			trans	-76.5	109.7	177.9	-179.8	0	0	0	0	112.5
1100	L	44.3	Very low	40.5	Very low	165 Å²	165	145.6 Å²	145.6	86%	0.864	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86.9	147	160	-67.2	174.9	0	0	0	110.2	P1098	P1098-L1100 PolarHBondContact O-N 3.33Å
1101	G	43.7	Very low	41.3	Very low	61 Å²	61	145.1 Å²	145.1	63%	0.629	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.7	163.3	-176.7	0	0	0	0	0	114
1102	P	55.8	Low	42.5	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.1	176.6	27.8	-34.8	0	0	0	111.5
1103	P	48.3	Very low	43.8	Very low	111 Å²	111	142.6 Å²	142.6	72%	0.721	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.9	147.7	-174.1	28.6	-35.5	0	0	0	112.6	L1105	P1103-L1105 PolarHBondContact O-N 3.48Å
1104	Q	42.9	Very low	44.6	Very low	192 Å²	192	143.3 Å²	143.3	90%	0.897	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.1	122.3	164.2	-68.5	-175.1	1	0	0	109.2
1105	L	42.3	Very low	45.7	Very low	162 Å²	162	138.8 Å²	138.8	85%	0.848	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-96	127	162	-71	174	0	0	0	108.8	P1103	P1103-L1105 PolarHBondContact O-N 3.48Å
1106	Q	40.5	Very low	46.2	Very low	194 Å²	194	139.4 Å²	139.4	91%	0.907	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-67.2	146	178	-68	168.6	-36.8	0	0	110.1
1107	R	41	Very low	46.8	Very low	243 Å²	243	145.4 Å²	145.4	92%	0.917	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-96.9	144.9	170.5	-87.2	-176.6	167.7	170	-3.9	110.6
1108	E	40.3	Very low	47.2	Very low	184 Å²	184	144.3 Å²	144.3	86%	0.86	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-61.7	143.9	174.8	-61.2	157	115.4	0	0	111.7
1109	P	52.8	Low	47.3	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-82.9	143.2	169.6	33.5	-32.7	0	0	0	111.7
1110	P	53.7	Low	47.5	Very low	128 Å²	128	146.9 Å²	146.9	83%	0.831	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-78.9	162.4	177	32.8	-35.7	0	0	0	113.6
1111	A	48.1	Very low	47.7	Very low	95 Å²	95	144.2 Å²	144.2	79%	0.785	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-69.1	155.6	-173.5	0	0	0	0	0	115.6
1112	P	57.5	Low	47.5	Very low	121 Å²	121	150.1 Å²	150.1	79%	0.786	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-84	149.6	-179.1	33.8	-35.8	0	0	0	114.3
1113	P	60.7	Low	46.5	Very low	116 Å²	116	151.5 Å²	151.5	75%	0.753	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-87.1	162.4	173.8	35.6	-35.3	0	0	0	113.6
1114	P	50.9	Low	46.6	Very low	119 Å²	119	151.2 Å²	151.2	77%	0.773	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.4	157.5	-178.4	30.6	-36.6	0	0	0	114.2
1115	P	53.6	Low	47	Very low	132 Å²	132	147 Å²	147	86%	0.857	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-77.5	153.2	-175.7	32	-36.3	0	0	0	113.9
1116	Q	46.6	Very low	46.6	Very low	189 Å²	189	145.5 Å²	145.5	88%	0.883	81%	0.808	S	S	*	*			trans	-118.8	148.4	168.2	-65.9	-173.7	1	0	0	110.4
1117	M	46.4	Very low	46.2	Very low	189 Å²	189	143.4 Å²	143.4	93%	0.931	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-78.2	143.8	-177.4	-68.3	170.5	60.5	0	0	112.7
1118	I	42.1	Very low	45.8	Very low	157 Å²	157	141.2 Å²	141.2	81%	0.805	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-103.3	146.8	170.7	-71.2	177.7	0	0	0	109.4
1119	P	46.8	Very low	45.3	Very low	117 Å²	117	139.5 Å²	139.5	76%	0.76	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82.4	158.5	-171.9	-8.7	27.4	0	0	0	114.2
1120	L	38.5	Very low	44.4	Very low	168 Å²	168	142.7 Å²	142.7	88%	0.88	79%	0.79	S	S	*	*			trans	-119.3	163.1	167.4	-79.9	171.1	0	0	0	111.1
1121	P	49.5	Very low	44.3	Very low	109 Å²	109	142.2 Å²	142.2	71%	0.708	79%	0.787	S	S	*	*			trans	-110.1	171.3	-144.2	41	-37	0	0	0	117
1122	K	39.3	Very low	43.4	Very low	185 Å²	185	146.9 Å²	146.9	80%	0.804	78%	0.784	S	S	*	*			trans	0.2	137.5	152.1	-56.3	175.6	178.7	177.1	0	118.6
1123	D	33.9	Very low	42.2	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	78%	0.776	S	S	*	*				-161.2	171.3	97.9	-101.1	-9.3	0	0	0	113.1
1124	P	52.1	Low	40.8	Very low	106 Å²	106	149.2 Å²	149.2	69%	0.688	78%	0.775	S	S	*	*			trans	-127.4	-147.6	-160.5	46.5	-31.1	0	0	0	112.1
1125	P	50.9	Low	39.8	Very low	102 Å²	102	154.9 Å²	154.9	66%	0.662	78%	0.78	S	S	*	*			cis	-128.6	-173.4	-28.6	28.3	-5.9	0	0	0	114.1
1126	V	32.9	Very low	38.8	Very low	132 Å²	132	151.9 Å²	151.9	80%	0.8	77%	0.767	S	S	*	*			trans	57.9	161.4	160.4	-78.5	0	0	0	0	118.4
1127	L	33.7	Very low	38.1	Very low	150 Å²	150	151.4 Å²	151.4	79%	0.785	76%	0.764	S	S	*	*			cis	-135.1	-180	-0	-88.2	103.6	0	0	0	108.4
1128	R	30.9	Very low	37.4	Very low	196 Å²	196	153.8 Å²	153.8	74%	0.74	76%	0.763	S	S	*	*			cis	-179.6	155.9	-38.2	-166.5	-168	140.6	138.7	-12.8	108
1129	E	30.1	Very low	36.9	Very low	149 Å²	149	150.1 Å²	150.1	70%	0.696	76%	0.764	S	S	*	*			trans	84.3	135.8	163.3	-47.8	-154.4	148.3	0	0	121.9
1130	H	34.8	Very low	36.2	Very low	183 Å²	183	148.1 Å²	148.1	85%	0.847	77%	0.765	S	S	*	*			trans	-87.5	179.6	164.8	-75.8	-85.1	0	0	0	109.7
1131	P	50	Low	36	Very low	117 Å²	117	144.3 Å²	144.3	76%	0.76	76%	0.757	S	S	*	*			cis	-136.3	-147.8	23.3	33.6	-5.2	0	0	0	112.5
1132	R	30.3	Very low	35.5	Very low	194 Å²	194	146.1 Å²	146.1	73%	0.732	76%	0.761	S	S	*	*			cis	-153.3	157.9	9.4	-163.1	159.6	-167.8	159.9	12.4	116.7
1133	E	31.7	Very low	35.6	Very low	131 Å²	131	144.1 Å²	144.1	61%	0.612	76%	0.759	S	S	*	*			trans	-39.7	-175	168.5	-52.4	168.8	111.3	0	0	121.8
1134	H	32.1	Very low	35.9	Very low	155 Å²	155	144.4 Å²	144.4	72%	0.718	76%	0.761	S	S	*	*			trans	82.9	126	177	-51.9	-77.2	0	0	0	115.2
1135	R	28.9	Very low	35.2	Very low	237 Å²	237	142.6 Å²	142.6	89%	0.894	76%	0.762	S	S	*	*			cis	68.4	95.5	6.2	-159.4	-168.5	-173.6	-174.1	4	117
1136	A	32.3	Very low	35.4	Very low	69 Å²	69	143.6 Å²	143.6	57%	0.57	77%	0.768	S	S	*	*				165.8	151.6	100.4	0	0	0	0	0	115.2
1137	H	33.2	Very low	35.6	Very low	179 Å²	179	144.5 Å²	144.5	83%	0.829	77%	0.768	S	S	*	*			trans	68.1	159.9	156.1	-56.1	-46.4	0	0	0	118.1
1138	R	31.7	Very low	35.7	Very low	239 Å²	239	142.8 Å²	142.8	90%	0.902	77%	0.769	S	S	*	*			cis	-159	142.9	-1.3	-137.4	176.8	-177.2	-170.6	0.8	111.7
1139	G	31.8	Very low	36.6	Very low	81 Å²	81	138.9 Å²	138.9	84%	0.835	77%	0.769	S	S	*	*			trans	72.3	158.2	163.2	0	0	0	0	0	116.5
1140	G	31.2	Very low	36.9	Very low	75 Å²	75	141 Å²	141	77%	0.773	78%	0.779	S	S	*	*			cis	133.4	133.7	-8.5	0	0	0	0	0	113.2
1141	A	34.9	Very low	37.2	Very low	88 Å²	88	141.9 Å²	141.9	73%	0.727	78%	0.783	S	S	*	*			trans	67.7	141	-178	0	0	0	0	0	116.4
1142	D	38.6	Very low	36.5	Very low	146 Å²	146	139.4 Å²	139.4	78%	0.781	78%	0.779	S	S	*	*			cis	-152.6	160.5	-12.7	-87.6	-31.6	0	0	0	110.1
1143	D	40.6	Very low	36.8	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	79%	0.787	S	S	*	*			trans	43.4	134.6	157.5	-65.6	-30.9	0	0	0	126
1144	D	41.6	Very low	37	Very low	159 Å²	159	138.9 Å²	138.9	85%	0.85	80%	0.8	S	S	*	*			trans	56.7	129.3	146	-74.7	-26	0	0	0	124.4
1145	G	36.2	Very low	37.4	Very low	69 Å²	69	141.6 Å²	141.6	71%	0.711	80%	0.804	S	S	*	*			trans	-89	-154.7	164.1	0	0	0	0	0	113.1
1146	P	55.8	Low	38.2	Very low	122 Å²	122	138.4 Å²	138.4	79%	0.792	80%	0.803	S	S	*	*				-142.2	170.3	66.7	39.8	-24.2	0	0	0	116.3
1147	D	36.6	Very low	39.2	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	81%	0.81	S	S	*	*			trans	21.5	139.4	150.4	-58.1	-23	0	0	0	120.9
1148	S	37.3	Very low	39.8	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	80%	0.801	S	S	*	*			cis	-151.5	161	35.7	-128.6	0	0	0	0	113.3
1149	P	49.3	Very low	40.3	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	82%	0.819	S	S	*	*			trans	-95	159.6	-165.6	37.3	-36.2	0	0	0	115.7
1150	E	35.5	Very low	40.7	Very low	194 Å²	194	143.5 Å²	143.5	91%	0.907	82%	0.819	S	S	*	*			trans	-97.4	134.7	165.8	-168.7	172.4	-147.3	0	0	109.3	G1152	E1150-G1152 PolarHBondContact O-N 3.43Å
1151	E	41	Very low	41.2	Very low	200 Å²	200	147.1 Å²	147.1	94%	0.935	82%	0.821	S	S	*	*			trans	-77.2	112.8	-170.8	-70.4	-167.9	128.1	0	0	113.3
1152	G	35.5	Very low	41.5	Very low	66 Å²	66	150.3 Å²	150.3	68%	0.68	83%	0.826	S	S	*	*			trans	-120	93	-178.2	0	0	0	0	0	114.8	E1150	E1150-G1152 PolarHBondContact O-N 3.43Å
1153	T	36.3	Very low	41.7	Very low	146 Å²	146	150.6 Å²	150.6	90%	0.896	83%	0.829	S	S	*	*			trans	17	101.8	153.9	-48.3	0	0	0	0	117.7
1154	L	37.5	Very low	41.8	Very low	168 Å²	168	151 Å²	151	88%	0.88	83%	0.833	S	S	*	*			trans	-99.3	135.2	165.6	-89.7	172.8	0	0	0	112.9
1155	R	40.6	Very low	41.8	Very low	211 Å²	211	150.5 Å²	150.5	80%	0.796	83%	0.831	S	S	*	*			trans	-71	156	163.9	-70.2	177.4	165.4	91.5	-3.5	110
1156	I	45.8	Very low	42.2	Very low	170 Å²	170	156.3 Å²	156.3	87%	0.872	84%	0.84	S	S	*	*			trans	-125.5	119.5	155.4	-59.2	178	0	0	0	106
1157	D	52.1	Low	41.2	Very low	135 Å²	135	158.9 Å²	158.9	72%	0.722	84%	0.844	S	S	*	*			trans	-99.2	164.6	172.6	-76.6	-69.9	0	0	0	110
1158	D	45.6	Very low	41.5	Very low	120 Å²	120	159.5 Å²	159.5	64%	0.642	85%	0.846	S	S	*	*			trans	-73	130.9	-178.6	-63.4	-55.8	0	0	0	112.6	R269	R269-D1158 IonicContact CZ-OD2 3.24Å; R269-D1158 IonicContact NH1-OD1 3.64Å; R269-D1158 PolarHBondContact NH1-OD1 3.29Å; R269-D1158 IonicContact NH1-OD2 2.68Å; R269-D1158 PolarHBondContact NH1-OD2 3.35Å; R269-D1158 IonicContact NH2-OD2 3.41Å; R269-D1158 PolarHBondContact NH2-OD2 3.03Å
1159	E	42	Very low	41.9	Very low	276 Å²	276	163.6 Å²	163.6	100%	1.29	85%	0.851	S	S	*	*			trans	-135.5	0	145.1	-78.3	-155.6	132.8	0	0	110.4

Retrieved 1,159 of 1,159 residues in 267.7 ms (Link to these results)

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