A0A5K4FA96_SCHMA Loading...

ETS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FA96, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 891 aa.

						>A0A5K4FA96_SCHMA|A0A5K4FA96
MNMNDIHSLTPCDYNNEKEDLSSLSIKRSRLDHHHHHHPHNHHSTELTSTTAKRPFIRVEDNEEDEYNGTQDNIITITTNSIKSGIKLTSNDECQHHDLDKISSSSSPISTPTTIVTRQTTSVTVVNNSNSYINDENKDQLNVFNQRNRTDQINLFDDKKDSHIPSIQFQLNDHDSEDFTTEIDGSNGKLTLWQFLLELLLSNKYEHIIRWTNKRGEFILVQAEIVAKLWGMRKDKNHRMNYDKLSRALRYYYQKNIIRKVHGRKFVYQFIGLKNLIKFCCTSMNSTSITTSVTPPTVVTSTLTSLNHLPVYSNIDDNNLPVTSSLYHTSKLNELYNHNNQKQHQDWFYTPPQRDCKHTTNTTTSNTTNNNLNTINNVNTCNLTSTQTDKASNLNCSTNNSIYSPTNLDITTITTFINSYLNKNSYETNTITNSNNNEYDNNDNNILLNHASESTSTLSDQSQIKTSHEMNDFNDFISSWVSIMSQSNYLNNFRLMECFKQSGSLLNLFNCRNIEQFNVDQEKQIYSTDPCCRIEQTNSMLHKEKMISNVTDNNNNQYMNNQNIDHCPMNLHVNYHPDLMNNYDSELWKVEDITQYEKDNPINFTSTNLGTSEKSQFKQYSQEDNNRPRSPCCECSCHIQSNYPFMQTIKNQINSSHLTDNNNNNNNNNKIIRKLGEYSNKQSISGNSDELPTKLHNKRHSINMKRLSEQLTRLNHLNLTGNYSNNNLMFINKYSSINNNNDHLTKSNLMKDEQTANHNEDIHKNDYFSTDECNKIPLTKSVMLSDSKMTSNLNSSTINTTYNSSRTDTMSMSSLPTLSMSENKCVWMPVPVTMLNSWFNLLSNIKGLNNNSINQSNFMTLSPFSTSSSSSTSSSSMSSTSLPSSSSVNNN
					

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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	32.5	Very low	34.5	Very low	234 Å²	234	144.3 Å²	144.3	100%	1.153	78%	0.776	S	S	*	*				0	126.4	0	-65	168.5	177.9	0	0	106.4
2	N	39.8	Very low	34	Very low	165 Å²	165	141.8 Å²	141.8	88%	0.882	78%	0.775	S	S	*	*			cis	-87.9	152.3	9	-86.4	-6.5	0	0	0	115.8
3	M	32.3	Very low	33.6	Very low	166 Å²	166	143.6 Å²	143.6	82%	0.818	78%	0.784	S	S	*	*			trans	-64.1	161.9	156.3	-86.7	153.6	165.8	0	0	111.1
4	N	32.9	Very low	33.3	Very low	124 Å²	124	147.7 Å²	147.7	66%	0.663	78%	0.784	S	S	*	*			cis	-172.2	180	-21.9	-127.9	51.4	0	0	0	107.7
5	D	36.5	Very low	33.2	Very low	118 Å²	118	146.1 Å²	146.1	63%	0.631	78%	0.776	S	S	*	*			trans	71.2	119.3	149.5	-60.2	-14.3	0	0	0	118.9
6	I	34.4	Very low	33.2	Very low	137 Å²	137	144.4 Å²	144.4	70%	0.703	77%	0.767	S	S	*	*				80.6	124.5	61.6	-69.9	172.8	0	0	0	110.6
7	H	34.3	Very low	33.1	Very low	158 Å²	158	143.3 Å²	143.3	73%	0.731	76%	0.756	S	S	*	*			cis	-163.1	169.2	1.1	-130.7	-149.5	0	0	0	112.4
8	S	32.4	Very low	33.2	Very low	94 Å²	94	141.2 Å²	141.2	66%	0.657	74%	0.74	S	S	*	*			trans	35.6	128	145	68.5	0	0	0	0	122.6
9	L	33	Very low	33.4	Very low	161 Å²	161	141.3 Å²	141.3	84%	0.843	74%	0.736	S	S	*	*			trans	168.4	130.7	137.1	-88.3	-178.8	0	0	0	104.8
10	T	39.1	Very low	33.4	Very low	121 Å²	121	141 Å²	141	74%	0.742	74%	0.735	S	S	*	*			cis	-155.8	177.7	-1.2	-2.7	0	0	0	0	107.3
11	P	31.9	Very low	33.4	Very low	109 Å²	109	140.8 Å²	140.8	71%	0.708	73%	0.734	S	S	*	*			trans	-125.9	-167.3	-131.3	35.5	-13.1	0	0	0	115.5
12	C	28.3	Very low	33.3	Very low	114 Å²	114	134.9 Å²	134.9	77%	0.77	72%	0.716	S	S	*	*			trans	81	74	161.5	-56.6	0	0	0	0	118.1
13	D	28.8	Very low	32.8	Very low	166 Å²	166	131.8 Å²	131.8	89%	0.888	71%	0.708	S	S	*	*				-119.4	129	124.9	-89.8	-49.8	0	0	0	107.3
14	Y	29.3	Very low	32.7	Very low	201 Å²	201	131.1 Å²	131.1	79%	0.788	71%	0.707	S	S	*	*			trans	-159	146.1	-177.9	-140.4	-94.7	0	0	0	112.5
15	N	32.5	Very low	32.5	Very low	124 Å²	124	129.9 Å²	129.9	66%	0.663	71%	0.708	S	S	*	*			trans	73.1	104	-171.5	-49.6	-64.1	0	0	0	112.8
16	N	33.1	Very low	32.2	Very low	118 Å²	118	131 Å²	131	63%	0.631	71%	0.712	S	S	*	*				74.9	140.7	64.4	-66.5	33.3	0	0	0	111.3
17	E	31.7	Very low	32	Very low	126 Å²	126	131.5 Å²	131.5	59%	0.589	71%	0.709	S	S	*	*			cis	-161.7	158.3	-9.8	-102.4	171.6	106.8	0	0	104.1
18	K	34.8	Very low	31.8	Very low	105 Å²	105	128 Å²	128	46%	0.457	69%	0.689	S	S	.	*			cis	-155.2	163.5	10	-132	-174.6	-179	95.9	0	108.5
19	E	36.4	Very low	32.2	Very low	143 Å²	143	124.6 Å²	124.6	67%	0.668	67%	0.666	S	S	*	*			trans	25.9	128.1	142.1	-67.8	150.2	-149.1	0	0	120.3
20	D	34.6	Very low	32.3	Very low	135 Å²	135	122.4 Å²	122.4	72%	0.722	65%	0.647	S	S	*	*			cis	-157.1	151.8	-5.7	-134.4	-0.6	0	0	0	116.9
21	L	31.8	Very low	32.3	Very low	137 Å²	137	118.4 Å²	118.4	72%	0.717	62%	0.62	S	S	*	*			trans	-9.3	132.1	159.2	-64.5	163.4	0	0	0	120.1
22	S	30.5	Very low	32.6	Very low	110 Å²	110	113.9 Å²	113.9	77%	0.769	59%	0.59	S	S	*	*			trans	72.7	158.3	134.7	91	0	0	0	0	117.5
23	S	31.1	Very low	33.2	Very low	100 Å²	100	110.6 Å²	110.6	70%	0.699	56%	0.563	S	S	*	*			cis	-157.6	177.9	-9.1	31.6	0	0	0	0	110.9
24	L	28.7	Very low	33.9	Very low	153 Å²	153	105.2 Å²	105.2	80%	0.801	53%	0.533	S	S	*	.			trans	-28.6	128.5	168.8	-63.7	75.2	0	0	0	117.1
25	S	30.3	Very low	34.5	Very low	98 Å²	98	101.8 Å²	101.8	69%	0.685	52%	0.524	S	S	*	.				90	139.9	125.4	80.2	0	0	0	0	122.8
26	I	30.1	Very low	34.9	Very low	140 Å²	140	101.4 Å²	101.4	72%	0.718	52%	0.518	S	S	*	.			trans	78.3	100.3	147.2	-64	156.5	0	0	0	119.7
27	K	29.3	Very low	35.6	Very low	148 Å²	148	103.2 Å²	103.2	64%	0.643	52%	0.522	S	S	*	.			trans	58.8	131.7	137.1	-57.6	179.7	-173.4	-173.9	0	122.2	S478	K27-S478 WeakPolarHBondContact CE-OG 3.34Å; K27-S478 PolarHBondContact NZ-OG 2.88Å
28	R	30.9	Very low	36	Very low	84 Å²	84	105 Å²	105	32%	0.317	53%	0.53	S	S	.	.			trans	97.1	165.9	137.7	-71.2	158.1	154.7	-113.9	-13.4	123.9	N474 D475	R28-N474 HydrophobicContact CG-CB 4.38Å; R28-N474 PolarHBondContact NE-O 3.36Å; R28-N474 PolarHBondContact NH2-O 2.9Å; R28-D475 WeakPolarHBondContact CB-OD1 3.43Å; R28-D475 WeakPolarHBondContact CD-OD1 3.36Å; R28-D475 WeakPolarHBondContact CG-OD1 3.32Å; R28-D475 VanDerWaalsContact CZ-CA 3.46Å; R28-D475 VanDerWaalsContact CZ-CG 3.5Å; R28-D475 IonicContact CZ-OD1 3.02Å; R28-D475 IonicContact CZ-OD2 3.08Å; R28-D475 IonicContact NE-OD1 2.68Å; R28-D475 PolarHBondContact NE-OD1 3.26Å; R28-D475 IonicContact NH1-OD1 2.7Å; R28-D475 PolarHBondContact NH1-OD1 2.93Å; R28-D475 IonicContact NH1-OD2 2.68Å; R28-D475 PolarHBondContact NH1-OD2 3.4Å; R28-D475 PolarHBondContact NH2-O 3.36Å; R28-D475 IonicContact NH2-OD1 2.64Å
29	S	40.1	Very low	36.6	Very low	24 Å²	24	104.6 Å²	104.6	17%	0.168	54%	0.538	C	S	.	.			cis	141.1	140.2	-35.3	-172.3	0	0	0	0	117.5	N471 D472 D475	S29-N471 CarbonylContact C-O 3.38Å; S29-N471 WeakPolarHBondContact CA-O 2.96Å; S29-N471 PolarHBondContact OG-O 3.37Å; S29-D472 WeakPolarHBondContact OG-CA 3.48Å; S29-D472 PolarHBondContact OG-N 3.07Å; S29-D472 PolarHBondContact OG-O 3.13Å; S29-D475 WeakPolarHBondContact O-CB 3.17Å; S29-D475 VanDerWaalsContact O-OD1 3.06Å; S29-D475 WeakPolarHBondContact OG-CB 3.06Å; S29-D475 PolarHBondContact OG-N 3.5Å
30	R	35.3	Very low	36.7	Very low	115 Å²	115	105.1 Å²	105.1	43%	0.434	54%	0.54	S	S	.	.			trans	162.3	163.3	165	-78.5	-148.3	92.1	76.9	-4.6	112.1	N471 D472 D475	R30-N471 PolarHBondContact N-O 2.9Å; R30-D472 VanDerWaalsContact C-CG 3.45Å; R30-D472 VanDerWaalsContact C-OD1 3.24Å; R30-D472 VanDerWaalsContact CA-OD1 3.27Å; R30-D472 WeakPolarHBondContact CA-OD1 3.36Å; R30-D475 HydrophobicContact CG-CB 3.78Å; R30-D475 WeakPolarHBondContact CG-OD2 3.42Å; R30-D475 IonicContact CZ-OD2 2.75Å; R30-D475 IonicContact NH1-OD2 2.87Å; R30-D475 PolarHBondContact NH1-OD2 2.87Å
31	L	39.5	Very low	36.7	Very low	37 Å²	37	102 Å²	102	19%	0.194	52%	0.524	C	S	.	.			cis	-168.2	151	-22.1	-128.3	71.4	0	0	0	114.3	Y420 K423 D472	L31-Y420 HydrophobicContact CD1-CD2 3.65Å; L31-Y420 HydrophobicContact CD1-CE2 3.62Å; L31-Y420 HydrophobicContact CG-CD2 4.35Å; L31-K423 HydrophobicContact CB-CB 4.09Å; L31-K423 HydrophobicContact CD2-CB 3.48Å; L31-K423 VanDerWaalsContact CD2-CB 3.48Å; L31-K423 HydrophobicContact CD2-CG 4Å; L31-K423 HydrophobicContact CG-CB 3.61Å; L31-K423 HydrophobicContact CG-CG 4.48Å; L31-K423 WeakPolarHBondContact O-CE 3.45Å; L31-K423 PolarHBondContact O-NZ 2.93Å; L31-D472 VanDerWaalsContact CA-OD1 3.31Å; L31-D472 WeakPolarHBondContact CA-OD1 3.15Å; L31-D472 WeakPolarHBondContact CA-OD2 3.42Å; L31-D472 WeakPolarHBondContact CD1-OD1 3.42Å; L31-D472 PolarHBondContact N-OD1 2.97Å; L31-D472 PolarHBondContact N-OD2 2.97Å; L31-D472 VanDerWaalsContact N-OD2 3.11Å
32	D	36.8	Very low	37	Very low	13 Å²	13	98.8 Å²	98.8	7%	0.07	51%	0.505	C	S	.	.			trans	-132.3	-86.7	-155.2	163.5	17.2	0	0	0	125.5	K423 N424 S425 Y426 E427	D32-K423 VanDerWaalsContact C-C 3.47Å; D32-K423 VanDerWaalsContact C-CA 3.44Å; D32-K423 VanDerWaalsContact CA-NZ 3.34Å; D32-K423 WeakPolarHBondContact CA-O 3.32Å; D32-K423 VanDerWaalsContact N-C 3.25Å; D32-K423 VanDerWaalsContact N-CE 3.28Å; D32-K423 PolarHBondContact N-O 3.34Å; D32-K423 WeakPolarHBondContact O-CD 3.26Å; D32-K423 WeakPolarHBondContact O-CE 3.48Å; D32-K423 PolarHBondContact O-NZ 3.32Å; D32-N424 PolarHBondContact OD2-ND2 3.21Å; D32-S425 WeakPolarHBondContact OD1-CA 3.47Å; D32-S425 PolarHBondContact OD1-N 3.18Å; D32-S425 VanDerWaalsContact OD2-CA 3.32Å; D32-S425 WeakPolarHBondContact OD2-CA 3.14Å; D32-S425 PolarHBondContact OD2-N 2.72Å; D32-Y426 PolarHBondContact OD1-N 3.12Å; D32-E427 HydrophobicContact CB-CG 4.4Å; D32-E427 WeakPolarHBondContact CB-OE2 3.37Å; D32-E427 VanDerWaalsContact CG-OE2 3.27Å; D32-E427 WeakPolarHBondContact OD1-CG 3.46Å; D32-E427 PolarHBondContact OD1-N 3.33Å
33	H	40.8	Very low	37.2	Very low	45 Å²	45	98.5 Å²	98.5	21%	0.208	49%	0.491	C	S	.	.			trans	-28	178.7	-176.9	-120.3	-7.6	0	0	0	125.3	L421 N422 N424 S425 Y426	H33-L421 WeakPolarHBondContact CB-O 3.46Å; H33-L421 PolarHBondContact CD2-O 2.82Å; H33-L421 VanDerWaalsContact CD2-O 3.24Å; H33-N422 CarbonylContact C-O 3.07Å; H33-N424 VanDerWaalsContact CB-N 3.32Å; H33-N424 VanDerWaalsContact CB-O 3.29Å; H33-N424 WeakPolarHBondContact CB-O 3.33Å; H33-N424 PolarHBondContact CD2-O 3.05Å; H33-N424 VanDerWaalsContact CD2-O 3.26Å; H33-N424 VanDerWaalsContact N-CA 3.34Å; H33-S425 PolarHBondContact CD2-OG 2.68Å; H33-S425 PolarHBondContact CE1-O 2.86Å; H33-S425 PolarHBondContact CE1-OG 2.65Å; H33-S425 PolarHBondContact ND1-O 3.23Å; H33-S425 PolarHBondContact ND1-OG 3.06Å; H33-S425 PolarHBondContact NE2-OG 2.74Å; H33-Y426 VanDerWaalsContact CA-CB 3.48Å; H33-Y426 VanDerWaalsContact CA-N 3.28Å; H33-Y426 PolarHBondContact ND1-N 2.8Å; H33-Y426 WeakPolarHBondContact O-CD2 3.46Å
34	H	43.3	Very low	37.3	Very low	54 Å²	54	98.6 Å²	98.6	25%	0.25	49%	0.492	C	S	.	.			cis	-116.8	-138	18.9	-153.6	-1.3	0	0	0	117.6	N422 Y426	H34-N422 HydrophobicContact CB-CB 4.41Å; H34-N422 PolarHBondContact CD2-OD1 3.44Å; H34-Y426 WeakPolarHBondContact O-CD1 3.5Å; H34-Y426 WeakPolarHBondContact O-CE1 3.41Å
35	H	43.1	Very low	37.6	Very low	129 Å²	129	96.2 Å²	96.2	60%	0.597	48%	0.484	S	S	*	.			cis	-170.4	171	5.4	-136.1	24.5	0	0	0	108.7
36	H	41.1	Very low	37.8	Very low	115 Å²	115	99.1 Å²	99.1	53%	0.532	49%	0.487	S	S	.	.			cis	-171.5	-174.1	-34.3	-163.9	69	0	0	0	112.9
37	H	48	Very low	38.2	Very low	156 Å²	156	99.2 Å²	99.2	72%	0.722	49%	0.488	S	S	*	.			trans	99.5	84.7	158.3	-69.1	-70.3	0	0	0	126.9
38	H	39.8	Very low	38.6	Very low	164 Å²	164	98.1 Å²	98.1	76%	0.759	49%	0.493	S	S	*	.				56.1	163.5	114.1	-92.8	-5.6	0	0	0	127.9
39	P	46.1	Very low	38.8	Very low	96 Å²	96	99.2 Å²	99.2	62%	0.623	51%	0.514	S	S	*	.				-148.3	171.2	-60.7	40.1	-18.3	0	0	0	120.1
40	H	38.4	Very low	38.8	Very low	154 Å²	154	104.1 Å²	104.1	71%	0.713	54%	0.543	S	S	*	.			trans	165.1	173.3	162.9	-89.2	-23	0	0	0	115.3
41	N	35.6	Very low	38.9	Very low	71 Å²	71	105.1 Å²	105.1	38%	0.38	56%	0.562	S	S	.	*			cis	-166	179	-21.2	-80.1	-20.4	0	0	0	114	S292 V293	N41-S292 WeakPolarHBondContact CA-OG 3.01Å; N41-S292 WeakPolarHBondContact OD1-CB 3.43Å; N41-V293 HydrophobicContact CB-CB 4.03Å; N41-V293 HydrophobicContact CB-CG2 3.85Å; N41-V293 WeakPolarHBondContact ND2-CG2 3.25Å
42	H	37.2	Very low	38.8	Very low	69 Å²	69	107.3 Å²	107.3	32%	0.319	59%	0.586	S	S	.	*				-144.5	-120.6	-76.2	-167.5	21	0	0	0	120	T290 T291 S292 V293	H42-T290 PolarHBondContact ND1-O 2.92Å; H42-T291 WeakPolarHBondContact CE1-CA 3.44Å; H42-T291 VanDerWaalsContact ND1-C 3.31Å; H42-T291 VanDerWaalsContact ND1-CA 3.25Å; H42-T291 WeakPolarHBondContact ND1-CA 3.46Å; H42-S292 PolarHBondContact CD2-N 3.06Å; H42-S292 PolarHBondContact CE1-N 2.76Å; H42-S292 PolarHBondContact ND1-N 3.49Å; H42-S292 PolarHBondContact NE2-N 3.02Å; H42-V293 HydrophobicContact CB-CB 3.51Å; H42-V293 HydrophobicContact CB-CG1 3.46Å; H42-V293 VanDerWaalsContact CB-CG1 3.46Å; H42-V293 PolarHBondContact CD2-N 3.06Å; H42-V293 VanDerWaalsContact CG-N 3.3Å
43	H	36.3	Very low	38.9	Very low	104 Å²	104	116.3 Å²	116.3	48%	0.481	62%	0.624	S	S	.	*			trans	-154.5	-176.7	-148.3	-91.5	2.7	0	0	0	121.4	T290	H43-T290 VanDerWaalsContact CE1-CB 3.46Å; H43-T290 WeakPolarHBondContact CE1-CB 3.46Å; H43-T290 PolarHBondContact CE1-O 3.1Å; H43-T290 PolarHBondContact ND1-O 3.44Å; H43-T290 PolarHBondContact NE2-O 3.46Å
44	S	33.5	Very low	38.6	Very low	101 Å²	101	125.8 Å²	125.8	71%	0.706	66%	0.658	S	S	*	*			cis	-153.8	-144.4	28.4	-140.7	0	0	0	0	120.6
45	T	33.6	Very low	38.8	Very low	104 Å²	104	128.2 Å²	128.2	64%	0.638	68%	0.679	S	S	*	*			trans	-137.8	-163.6	-154	50.4	0	0	0	0	113.6
46	E	35.4	Very low	38.4	Very low	159 Å²	159	132 Å²	132	74%	0.743	69%	0.694	S	S	*	*			cis	-160.8	-160.1	9.1	-135.4	151	108.5	0	0	110.6
47	L	37.6	Very low	38.1	Very low	142 Å²	142	134.1 Å²	134.1	74%	0.743	71%	0.708	S	S	*	*			cis	-146.9	-149.9	8.5	-122.4	172.5	0	0	0	109.3
48	T	37.5	Very low	37.3	Very low	124 Å²	124	135.9 Å²	135.9	76%	0.761	71%	0.708	S	S	*	*			cis	-165.9	-172.6	12	-14	0	0	0	0	108.8
49	S	36.9	Very low	37.1	Very low	108 Å²	108	134 Å²	134	76%	0.755	71%	0.708	S	S	*	*			cis	-157.8	-128.6	1.9	62.1	0	0	0	0	115.1
50	T	39.1	Very low	36.9	Very low	127 Å²	127	134.5 Å²	134.5	78%	0.779	70%	0.702	S	S	*	*			trans	-145.6	-173.5	-165.1	69.8	0	0	0	0	115
51	T	36.7	Very low	36.9	Very low	135 Å²	135	134.1 Å²	134.1	83%	0.828	71%	0.705	S	S	*	*			cis	-140.8	-142.7	5.4	-30.5	0	0	0	0	110.8
52	A	37.6	Very low	36.9	Very low	84 Å²	84	133.9 Å²	133.9	69%	0.694	70%	0.704	S	S	*	*			cis	-166	-169.6	-0.5	0	0	0	0	0	108.9
53	K	39.1	Very low	37	Very low	202 Å²	202	139 Å²	139	88%	0.878	73%	0.728	S	S	*	*			cis	-161.5	168.1	-30.6	-105.3	172	179.4	176.3	0	109.1
54	R	34.1	Very low	37	Very low	243 Å²	243	143.5 Å²	143.5	92%	0.917	75%	0.749	S	S	*	*			trans	-165.5	-179.7	-161.9	-105.3	-167.4	160.1	-134.6	-4.2	122.4
55	P	49.4	Very low	37.3	Very low	106 Å²	106	145.4 Å²	145.4	69%	0.688	75%	0.751	S	S	*	*			trans	-114.7	-160.7	179.9	45.1	-35.9	0	0	0	118
56	F	34.5	Very low	37.4	Very low	207 Å²	207	147.3 Å²	147.3	91%	0.908	75%	0.753	S	S	*	*			trans	-143.4	173.4	-169.8	-107.7	-83.4	0	0	0	122
57	I	34.6	Very low	37.3	Very low	160 Å²	160	148 Å²	148	82%	0.821	75%	0.75	S	S	*	*			trans	-147.5	177.5	-158.4	-63.9	162.9	0	0	0	115.5
58	R	29.9	Very low	37.1	Very low	193 Å²	193	148.5 Å²	148.5	73%	0.728	75%	0.753	S	S	*	*			trans	-108.6	177.4	-178.6	-140	175.6	-168.7	173.9	3.8	115.3	Q619	R58-Q619 PolarHBondContact NH2-O 3.32Å
59	V	36.4	Very low	37.1	Very low	125 Å²	125	145.8 Å²	145.8	76%	0.758	75%	0.75	S	S	*	*			trans	-144.5	139	-165.3	-179.9	0	0	0	0	111.2
60	E	42.6	Very low	36.9	Very low	107 Å²	107	146.5 Å²	146.5	50%	0.5	75%	0.75	S	S	.	*				70.8	147.9	65.7	-72	-140	139.4	0	0	119.3	R247 Y251	E60-R247 VanDerWaalsContact CD-NE 3.35Å; E60-R247 IonicContact OE1-CZ 3.83Å; E60-R247 VanDerWaalsContact OE1-CZ 3.26Å; E60-R247 IonicContact OE1-NE 2.69Å; E60-R247 PolarHBondContact OE1-NE 3.38Å; E60-R247 VanDerWaalsContact OE1-NE 3.07Å; E60-R247 IonicContact OE1-NH2 3.23Å; E60-R247 PolarHBondContact OE1-NH2 3.13Å; E60-R247 IonicContact OE2-CZ 3.26Å; E60-R247 IonicContact OE2-NE 3.07Å; E60-R247 PolarHBondContact OE2-NE 3.11Å; E60-R247 IonicContact OE2-NH2 2.66Å; E60-Y251 PolarHBondContact OE1-OH 2.82Å
61	D	37.8	Very low	36.7	Very low	146 Å²	146	147.3 Å²	147.3	78%	0.781	75%	0.745	S	S	*	*			trans	-166.7	-165.6	147.1	-136.5	-41.2	0	0	0	114.6
62	N	36.4	Very low	36.6	Very low	65 Å²	65	145.4 Å²	145.4	35%	0.348	73%	0.73	S	S	.	*			trans	-137.3	-174.3	-158.4	-57.7	-91.6	0	0	0	117.8
63	E	38.9	Very low	36.5	Very low	176 Å²	176	147 Å²	147	82%	0.822	73%	0.727	S	S	*	*			trans	-149	154.3	175.4	-150.2	174.2	-127.1	0	0	109.7
64	E	36.3	Very low	36.3	Very low	200 Å²	200	141.3 Å²	141.3	94%	0.935	71%	0.705	S	S	*	*			trans	-133	170.5	-155.7	-64.9	-157.2	122.8	0	0	121
65	D	38.5	Very low	36.4	Very low	141 Å²	141	135.1 Å²	135.1	75%	0.754	69%	0.689	S	S	*	*			trans	-154.3	131.9	-164	164.2	39.1	0	0	0	113.2
66	E	37.2	Very low	35.7	Very low	143 Å²	143	133.2 Å²	133.2	67%	0.668	68%	0.675	S	S	*	*			trans	-158.7	174.8	-177	-109.4	-55	-45.3	0	0	117.3	K265	E66-K265 IonicContact OE1-NZ 3.83Å; E66-K265 PolarHBondContact OE1-NZ 2.8Å; E66-K265 VanDerWaalsContact OE2-CE 3.27Å; E66-K265 WeakPolarHBondContact OE2-CE 3.21Å; E66-K265 IonicContact OE2-NZ 2.94Å; E66-K265 PolarHBondContact OE2-NZ 3.05Å
67	Y	32.9	Very low	35.7	Very low	175 Å²	175	131.5 Å²	131.5	69%	0.686	67%	0.674	S	S	*	*			trans	-171.1	146.3	-166.4	-160.5	-105.1	0	0	0	116.9	K265	Y67-K265 PolarHBondContact O-NZ 3.23Å; Y67-K265 VanDerWaalsContact O-NZ 3.12Å
68	N	33.9	Very low	35.7	Very low	151 Å²	151	129 Å²	129	81%	0.807	67%	0.667	S	S	*	*			trans	95	165.9	158.1	-100.8	7.9	0	0	0	125.1
69	G	35.9	Very low	35.9	Very low	68 Å²	68	126.4 Å²	126.4	70%	0.701	67%	0.672	S	S	*	*			trans	-133.6	-153.3	-166.6	0	0	0	0	0	119.7
70	T	32.3	Very low	35.8	Very low	123 Å²	123	126.8 Å²	126.8	76%	0.755	67%	0.67	S	S	*	*			trans	-141.5	158	-140.2	49	0	0	0	0	122.3
71	Q	35.9	Very low	35.4	Very low	143 Å²	143	126.8 Å²	126.8	67%	0.668	68%	0.682	S	S	*	*			trans	69	164.9	145.3	-75.5	173.2	-96.9	0	0	121.8
72	D	34.5	Very low	35.1	Very low	95 Å²	95	126.9 Å²	126.9	51%	0.508	68%	0.681	S	S	.	*			cis	-166.6	150.5	-10.7	-113.8	-5.5	0	0	0	114.3
73	N	36.6	Very low	34.9	Very low	118 Å²	118	132.7 Å²	132.7	63%	0.631	70%	0.703	S	S	*	*			trans	62.3	172	148.3	-69.6	-55.8	0	0	0	124.1
74	I	34.9	Very low	34.6	Very low	82 Å²	82	129.5 Å²	129.5	42%	0.421	70%	0.7	S	S	.	*			cis	-175.9	172.8	-43.3	-156.2	166	0	0	0	113.7	I115 W347	I74-I115 HydrophobicContact CD1-CD1 4.35Å; I74-W347 HydrophobicContact CG1-CE3 4.14Å; I74-W347 HydrophobicContact CG1-CZ3 4.41Å
75	I	34.9	Very low	34.4	Very low	113 Å²	113	123.3 Å²	123.3	58%	0.579	69%	0.69	S	S	*	*			trans	83.5	157.8	158.8	-84.5	164.3	0	0	0	121.4	W347	I75-W347 HydrophobicContact CG1-CZ3 4.21Å
76	T	34.6	Very low	34	Very low	66 Å²	66	124.4 Å²	124.4	41%	0.405	69%	0.694	S	S	.	*			cis	168.6	148.5	-40.4	-54.2	0	0	0	0	111.4	W347	T76-W347 HydrophobicContact CG2-CH2 3.72Å; T76-W347 HydrophobicContact CG2-CZ2 4.01Å; T76-W347 WeakPolarHBondContact OG1-CH2 3.48Å; T76-W347 WeakPolarHBondContact OG1-CZ3 3.45Å
77	I	34	Very low	33.6	Very low	171 Å²	171	126 Å²	126	88%	0.877	70%	0.699	S	S	*	*			trans	-169.9	168	150.9	-104.6	154.1	0	0	0	119.7
78	T	35.8	Very low	33.3	Very low	109 Å²	109	124.2 Å²	124.2	67%	0.669	70%	0.7	S	S	*	*			trans	-126.6	170.3	-160.5	57	0	0	0	0	117.4
79	T	34.3	Very low	33	Very low	137 Å²	137	122.5 Å²	122.5	84%	0.84	70%	0.695	S	S	*	*			trans	-159.5	168.7	150.3	44.8	0	0	0	0	111.7
80	N	33.1	Very low	32.8	Very low	134 Å²	134	123.8 Å²	123.8	72%	0.717	69%	0.694	S	S	*	*				-169.4	130.3	-56.6	-113.6	-18.6	0	0	0	112.3
81	S	35.8	Very low	32.5	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	69%	0.693	S	S	*	*			trans	176.2	121.6	152.6	-82	0	0	0	0	109.7
82	I	30.8	Very low	32.4	Very low	148 Å²	148	124.1 Å²	124.1	76%	0.759	70%	0.696	S	S	*	*				67.8	116.6	64.8	-58.1	166.1	0	0	0	109.8
83	K	31.7	Very low	32.2	Very low	186 Å²	186	128 Å²	128	81%	0.809	71%	0.711	S	S	*	*			cis	-159.4	165.6	43.1	-143.7	170.6	-176.4	175.3	0	113.5
84	S	33.1	Very low	31.8	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	71%	0.713	S	S	*	*			trans	4.6	147.6	154.5	57.9	0	0	0	0	122
85	G	31.5	Very low	31.7	Very low	70 Å²	70	130.7 Å²	130.7	72%	0.722	73%	0.727	S	S	*	*			cis	147.4	164.3	-0.2	0	0	0	0	0	113.9
86	I	30.5	Very low	31.6	Very low	165 Å²	165	131.9 Å²	131.9	85%	0.846	73%	0.73	S	S	*	*			trans	69.3	90.8	164.6	-47	180	0	0	0	119.1
87	K	29.2	Very low	31.6	Very low	177 Å²	177	135.8 Å²	135.8	77%	0.77	74%	0.744	S	S	*	*				41.6	117.9	111.9	-157.4	-157.1	-174.6	-176.6	0	120.1
88	L	25.8	Very low	32.1	Very low	136 Å²	136	134.4 Å²	134.4	71%	0.712	74%	0.738	S	S	*	*				157.9	153	119.7	-85.8	178.2	0	0	0	116
89	T	28.2	Very low	32.2	Very low	115 Å²	115	136.2 Å²	136.2	71%	0.706	74%	0.743	S	S	*	*			trans	62.2	103.4	148.8	46.3	0	0	0	0	123.1
90	S	30.5	Very low	32.2	Very low	96 Å²	96	134.8 Å²	134.8	67%	0.671	73%	0.73	S	S	*	*				61	125.3	119.5	68	0	0	0	0	123.1
91	N	26.6	Very low	32.2	Very low	139 Å²	139	135.2 Å²	135.2	74%	0.743	73%	0.725	S	S	*	*				88.6	150.3	127.9	-86.5	59.4	0	0	0	122.5
92	D	33.8	Very low	31.9	Very low	133 Å²	133	135.4 Å²	135.4	71%	0.711	72%	0.717	S	S	*	*			trans	74	95.4	154.6	-50.3	-17.3	0	0	0	121.3
93	E	30.6	Very low	31.9	Very low	177 Å²	177	133.6 Å²	133.6	83%	0.827	72%	0.718	S	S	*	*				72.8	126.3	128.8	-62.8	-157.8	128.3	0	0	124.3
94	C	27.8	Very low	32	Very low	99 Å²	99	128.2 Å²	128.2	67%	0.669	70%	0.703	S	S	*	*				95.4	118.2	128.8	-85.6	0	0	0	0	123.3
95	Q	32.1	Very low	32.1	Very low	157 Å²	157	128.1 Å²	128.1	73%	0.734	70%	0.703	S	S	*	*			trans	84.5	111.2	137.9	-58.5	-89.6	-50.2	0	0	120
96	H	34.5	Very low	32.3	Very low	138 Å²	138	129.3 Å²	129.3	64%	0.639	70%	0.7	S	S	*	*			trans	50.4	148.7	137.2	-70.4	-77.9	0	0	0	121.7
97	H	34.4	Very low	32.6	Very low	149 Å²	149	126.1 Å²	126.1	69%	0.69	69%	0.692	S	S	*	*			cis	-144.8	166.3	6.5	-130.6	-42.9	0	0	0	111.3	L99	H97-L99 PolarHBondContact O-N 2.82Å
98	D	44.5	Very low	32.9	Very low	141 Å²	141	120.1 Å²	120.1	75%	0.754	67%	0.672	S	S	*	*			trans	-80.2	89	-156.5	-46	-96	0	0	0	112.8
99	L	36.8	Very low	33	Very low	148 Å²	148	117.6 Å²	117.6	78%	0.775	66%	0.658	S	S	*	*			trans	-129.1	149.7	166	-89	177.3	0	0	0	111.1	H97	H97-L99 PolarHBondContact O-N 2.82Å
100	D	36.1	Very low	32.9	Very low	106 Å²	106	113.2 Å²	113.2	57%	0.567	63%	0.632	S	S	*	*			trans	67.1	143.8	155	-71.3	-4.4	0	0	0	118.9
101	K	32.3	Very low	32.8	Very low	143 Å²	143	112.4 Å²	112.4	62%	0.622	62%	0.623	S	S	*	*			cis	-134.1	127.8	-18.3	-128.4	152.2	-177	79.8	0	106.2	S103	K101-S103 PolarHBondContact O-N 3.35Å
102	I	30.2	Very low	32.9	Very low	112 Å²	112	109.4 Å²	109.4	57%	0.574	61%	0.611	S	S	*	*				43.8	81.4	87.2	-81.7	162.8	0	0	0	107	S104	I102-S104 WeakPolarHBondContact CG2-OG 3.05Å; I102-S104 PolarHBondContact O-OG 3.38Å
103	S	30.3	Very low	32.6	Very low	110 Å²	110	107.9 Å²	107.9	77%	0.769	61%	0.607	S	S	*	*				70.3	-113.6	86.2	75.1	0	0	0	0	109.5	K101 S105	K101-S103 PolarHBondContact O-N 3.35Å; S103-S105 PolarHBondContact O-N 3.46Å; S103-S105 VanDerWaalsContact O-N 3.09Å
104	S	34	Very low	32.4	Very low	72 Å²	72	104.7 Å²	104.7	50%	0.503	60%	0.6	S	S	.	*			trans	11.3	84.3	169	56.4	0	0	0	0	114.3	I102	I102-S104 WeakPolarHBondContact CG2-OG 3.05Å; I102-S104 PolarHBondContact O-OG 3.38Å
105	S	34.2	Very low	32.7	Very low	108 Å²	108	105.1 Å²	105.1	76%	0.755	59%	0.594	S	S	*	*				61.9	135.6	86.3	78.6	0	0	0	0	112.6	S103	S103-S105 PolarHBondContact O-N 3.46Å; S103-S105 VanDerWaalsContact O-N 3.09Å
106	S	35.4	Very low	32.8	Very low	94 Å²	94	102.5 Å²	102.5	66%	0.657	59%	0.588	S	S	*	*			cis	-152.5	124.6	24.6	48.8	0	0	0	0	111
107	S	37.6	Very low	32.8	Very low	98 Å²	98	100.6 Å²	100.6	69%	0.685	59%	0.587	S	S	*	*			trans	59.9	-154.1	159	-49.5	0	0	0	0	110.7
108	P	35.2	Very low	32.6	Very low	52 Å²	52	101.5 Å²	101.5	34%	0.338	58%	0.584	S	S	.	*			cis	-86.6	-158.2	-45.9	-25.6	40	0	0	0	113.9	D599 N600	P108-D599 HydrophobicContact CB-CB 3.73Å; P108-D599 WeakPolarHBondContact CB-OD1 3.41Å; P108-D599 HydrophobicContact CG-CB 3.74Å; P108-N600 VanDerWaalsContact CA-CG 3.41Å; P108-N600 WeakPolarHBondContact CA-ND2 3.31Å; P108-N600 HydrophobicContact CB-CB 3.83Å
109	I	27.6	Very low	32	Very low	82 Å²	82	104.4 Å²	104.4	42%	0.421	59%	0.593	S	S	.	*			trans	105.7	158.3	158.7	-58.5	127.9	0	0	0	117.9	Q343 N600	I109-Q343 VanDerWaalsContact CA-CD 3.49Å; I109-N600 PolarHBondContact N-ND2 3.05Å; I109-N600 PolarHBondContact N-OD1 3.34Å; I109-N600 PolarHBondContact O-OD1 2.86Å
110	S	27.1	Very low	31.6	Very low	24 Å²	24	101.6 Å²	101.6	17%	0.168	58%	0.582	C	S	.	*			trans	-78.6	179.6	-152.4	-77.2	0	0	0	0	118	Q343 H344	S110-Q343 VanDerWaalsContact N-OE1 3.17Å; S110-Q343 VanDerWaalsContact OG-C 3.29Å; S110-Q343 WeakPolarHBondContact OG-CA 3.27Å; S110-Q343 WeakPolarHBondContact OG-CB 3.2Å; S110-Q343 PolarHBondContact OG-OE1 3.11Å; S110-H344 PolarHBondContact OG-N 3.5Å
111	T	27.7	Very low	31.3	Very low	79 Å²	79	103 Å²	103	49%	0.485	60%	0.595	S	S	.	*			trans	95.6	163.6	148.4	83.3	0	0	0	0	116.1	Q345	T111-Q345 HydrophobicContact CG2-CB 3.5Å; T111-Q345 HydrophobicContact CG2-CG 3.53Å
112	P	29.3	Very low	31.2	Very low	76 Å²	76	101 Å²	101	49%	0.494	60%	0.599	S	S	.	*				-143.6	-170.1	-77	42.6	-24.7	0	0	0	115.4	T114 Q345	P112-T114 PolarHBondContact O-N 3.26Å; P112-Q345 WeakPolarHBondContact CB-O 3.1Å; P112-Q345 VanDerWaalsContact CG-O 3.26Å; P112-Q345 WeakPolarHBondContact CG-O 3.37Å
113	T	26.1	Very low	31	Very low	100 Å²	100	102.1 Å²	102.1	61%	0.613	61%	0.611	S	S	*	*			trans	-13.3	106.4	142.7	-46.3	0	0	0	0	116.4	I115	T113-I115 PolarHBondContact O-N 3.24Å
114	T	27.3	Very low	30.9	Very low	111 Å²	111	103.1 Å²	103.1	68%	0.681	61%	0.612	S	S	*	*				37.3	75.1	116.3	-44.4	0	0	0	0	117.8	P112 V116	P112-T114 PolarHBondContact O-N 3.26Å; T114-V116 HydrophobicContact CG2-CB 4.24Å; T114-V116 HydrophobicContact CG2-CG2 3.41Å; T114-V116 VanDerWaalsContact CG2-CG2 3.41Å
115	I	33.1	Very low	30.6	Very low	107 Å²	107	105.3 Å²	105.3	55%	0.549	62%	0.622	S	S	.	*			trans	-120.4	94.6	149.2	-60.4	178	0	0	0	104.2	I74 T113 W347	I74-I115 HydrophobicContact CD1-CD1 4.35Å; T113-I115 PolarHBondContact O-N 3.24Å; I115-W347 HydrophobicContact CD1-CE3 4.47Å; I115-W347 HydrophobicContact CD1-CZ3 4.44Å
116	V	35.4	Very low	30.4	Very low	102 Å²	102	106.4 Å²	106.4	62%	0.618	62%	0.624	S	S	*	*			cis	46.6	88.6	47.4	179.3	0	0	0	0	111.4	T114	T114-V116 HydrophobicContact CG2-CB 4.24Å; T114-V116 HydrophobicContact CG2-CG2 3.41Å; T114-V116 VanDerWaalsContact CG2-CG2 3.41Å
117	T	33.4	Very low	30	Very low	99 Å²	99	107.9 Å²	107.9	61%	0.607	63%	0.625	S	S	*	*				-148.4	121.6	109.8	2.4	0	0	0	0	112.4
118	R	31	Very low	29.8	Very low	168 Å²	168	109.4 Å²	109.4	63%	0.634	63%	0.625	S	S	*	*			trans	36.6	113.7	139	-61.2	169.7	-178.3	153.4	0.7	117
119	Q	31.5	Very low	29.8	Very low	201 Å²	201	111.8 Å²	111.8	94%	0.939	64%	0.643	S	S	*	*				-137.7	149.7	96.2	-105.8	163.7	40.8	0	0	111.1
120	T	28.6	Very low	30	Very low	89 Å²	89	114 Å²	114	55%	0.546	66%	0.656	S	S	.	*			trans	-105.8	124.7	-169.2	46.1	0	0	0	0	111
121	T	30.3	Very low	30.2	Very low	137 Å²	137	116 Å²	116	84%	0.84	67%	0.669	S	S	*	*			trans	-165.4	150.3	146.1	14.2	0	0	0	0	112.2
122	S	30.8	Very low	30.3	Very low	99 Å²	99	122 Å²	122	69%	0.692	69%	0.685	S	S	*	*			trans	31.3	113	154.7	57.9	0	0	0	0	120.8
123	V	26	Very low	30.5	Very low	137 Å²	137	124.8 Å²	124.8	83%	0.83	69%	0.694	S	S	*	*				24.8	116.5	119.8	-174.3	0	0	0	0	117.1
124	T	28	Very low	31	Very low	131 Å²	131	125.8 Å²	125.8	80%	0.804	70%	0.696	S	S	*	*				-171.5	153.2	118.3	-75.6	0	0	0	0	111.7
125	V	27.4	Very low	31.5	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.715	70%	0.697	S	S	*	*			trans	-64.2	124.8	176.4	175.7	0	0	0	0	113.6	N127	V125-N127 HydrophobicContact CG1-CB 4.06Å
126	V	28.5	Very low	31.8	Very low	130 Å²	130	129 Å²	129	79%	0.788	71%	0.705	S	S	*	*			trans	-156.8	130.5	130.1	-110.4	0	0	0	0	106.2
127	N	29.1	Very low	31.8	Very low	126 Å²	126	128.7 Å²	128.7	67%	0.674	70%	0.7	S	S	*	*			cis	68.1	143.7	23.8	-134.2	59.1	0	0	0	114.1	V125	V125-N127 HydrophobicContact CG1-CB 4.06Å
128	N	32.3	Very low	32	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	71%	0.705	S	S	*	*			trans	64.9	158.6	-166.8	-48.1	-10.8	0	0	0	111.4
129	S	35.7	Very low	32.5	Very low	103 Å²	103	130 Å²	130	72%	0.72	71%	0.708	S	S	*	*			cis	-143.3	161.8	17.5	-41.2	0	0	0	0	109.7
130	N	30.9	Very low	32.9	Very low	129 Å²	129	128.7 Å²	128.7	69%	0.69	70%	0.702	S	S	*	*			cis	-156.9	153.8	13.9	-140.3	0.4	0	0	0	111.9
131	S	31.9	Very low	33.1	Very low	64 Å²	64	130.8 Å²	130.8	45%	0.448	71%	0.709	S	S	.	*				32.7	143.3	126.7	77.2	0	0	0	0	120.4
132	Y	29.6	Very low	33.3	Very low	207 Å²	207	130.9 Å²	130.9	81%	0.812	70%	0.704	S	S	*	*			cis	-152	-171.4	24.6	-78.5	-79.8	0	0	0	108.2
133	I	33.6	Very low	33.5	Very low	133 Å²	133	132.4 Å²	132.4	68%	0.682	71%	0.709	S	S	*	*			cis	-160.7	165.9	14.9	-146	151.8	0	0	0	110.8
134	N	36.4	Very low	33.8	Very low	121 Å²	121	134.4 Å²	134.4	65%	0.647	71%	0.707	S	S	*	*			trans	68.4	121.6	169.9	-62.7	12.4	0	0	0	116.7
135	D	37.2	Very low	34.1	Very low	134 Å²	134	132.5 Å²	132.5	72%	0.717	69%	0.692	S	S	*	*				95.2	140.9	64.6	-63.1	-25.6	0	0	0	110.7
136	E	39.4	Very low	34.5	Very low	151 Å²	151	133.5 Å²	133.5	71%	0.706	69%	0.689	S	S	*	*			cis	-157.4	168.9	0.8	-137.8	-172	-157.6	0	0	110.5
137	N	36.9	Very low	34.7	Very low	97 Å²	97	136.4 Å²	136.4	52%	0.519	69%	0.685	S	S	.	*			trans	69.9	114.7	158	-64.7	-43.6	0	0	0	119.6
138	K	36.7	Very low	34.6	Very low	166 Å²	166	137.2 Å²	137.2	72%	0.722	69%	0.69	S	S	*	*				81.8	137.4	83.3	-76.5	-165.2	-168	87.9	0	113.4
139	D	41	Very low	34.6	Very low	127 Å²	127	142.3 Å²	142.3	68%	0.679	70%	0.7	S	S	*	*			cis	-152.5	173.7	4.3	-87.4	-44	0	0	0	111.5
140	Q	40.3	Very low	34.2	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	70%	0.698	S	S	*	*			trans	81.1	142	156.8	-52.9	-157	53.5	0	0	120.3
141	L	33.3	Very low	34.2	Very low	133 Å²	133	142.6 Å²	142.6	70%	0.696	70%	0.697	S	S	*	*			cis	-164.8	124.9	-24.8	-167.9	68.8	0	0	0	113.7
142	N	33.5	Very low	34.3	Very low	139 Å²	139	147.2 Å²	147.2	74%	0.743	71%	0.712	S	S	*	*			trans	61.5	166.4	151.3	-69.7	-17	0	0	0	124.1
143	V	35.8	Very low	34.4	Very low	131 Å²	131	143.8 Å²	143.8	79%	0.794	71%	0.706	S	S	*	*			trans	79.2	111.5	165.9	-170.4	0	0	0	0	114.8
144	F	32.6	Very low	34.3	Very low	180 Å²	180	144.1 Å²	144.1	79%	0.789	71%	0.709	S	S	*	*			cis	-152.1	143.6	8.3	-150.8	-125.9	0	0	0	113
145	N	34.5	Very low	34	Very low	91 Å²	91	144.8 Å²	144.8	49%	0.487	71%	0.712	S	S	.	*			trans	22.3	128.1	158.9	-65.4	-52.6	0	0	0	122.1
146	Q	35.3	Very low	33.8	Very low	139 Å²	139	146.1 Å²	146.1	65%	0.65	71%	0.712	S	S	*	*				66.5	135	59.7	-65.2	-178.5	53.5	0	0	113.5
147	R	32	Very low	33.7	Very low	190 Å²	190	145.6 Å²	145.6	72%	0.717	71%	0.714	S	S	*	*			cis	-147.9	154.3	18.4	-97	120.5	-165.4	-164.3	7.4	113.1
148	N	28.5	Very low	33.8	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	72%	0.718	S	S	*	*				24.6	146	121.6	-42.8	-3.8	0	0	0	118.4
149	R	31.8	Very low	34	Very low	236 Å²	236	146.2 Å²	146.2	89%	0.891	72%	0.717	S	S	*	*				-162.7	168.5	50.2	-144.6	171.4	-161.1	169.3	2.8	112.9
150	T	27.3	Very low	33.9	Very low	113 Å²	113	147.5 Å²	147.5	69%	0.693	72%	0.717	S	S	*	*			trans	-78.7	160.1	175	51.2	0	0	0	0	113
151	D	30	Very low	33.7	Very low	125 Å²	125	143.8 Å²	143.8	67%	0.668	70%	0.702	S	S	*	*				161.1	148.3	119.8	-82.1	0.2	0	0	0	113
152	Q	34.4	Very low	33.9	Very low	161 Å²	161	142.1 Å²	142.1	75%	0.752	70%	0.702	S	S	*	*			trans	67.5	115.4	155.6	-68.4	170.2	71	0	0	118
153	I	31.2	Very low	34.1	Very low	134 Å²	134	144.6 Å²	144.6	69%	0.687	71%	0.708	S	S	*	*				109.9	148.6	73.5	-87.9	173.1	0	0	0	110.4
154	N	32.5	Very low	34.2	Very low	140 Å²	140	145.3 Å²	145.3	75%	0.749	71%	0.706	S	S	*	*			trans	74.9	130	-174.6	-55.1	-36	0	0	0	114.8
155	L	29.4	Very low	34.3	Very low	135 Å²	135	142.3 Å²	142.3	71%	0.707	71%	0.705	S	S	*	*			cis	88.4	134.1	25.6	-162.4	70.4	0	0	0	113.7
156	F	33.4	Very low	34.3	Very low	163 Å²	163	143.6 Å²	143.6	72%	0.715	72%	0.721	S	S	*	*			trans	87.7	114.5	178.8	-59.3	-71.6	0	0	0	119.1
157	D	37.2	Very low	34.2	Very low	140 Å²	140	143.9 Å²	143.9	75%	0.749	73%	0.725	S	S	*	*				81.3	96.9	127	-56.4	-8.5	0	0	0	123.8
158	D	39.5	Very low	34.1	Very low	112 Å²	112	143.2 Å²	143.2	60%	0.599	73%	0.73	S	S	*	*				85.4	112.8	103.5	-152.1	34.8	0	0	0	121.8
159	K	40.5	Very low	34.4	Very low	164 Å²	164	143.8 Å²	143.8	71%	0.713	73%	0.726	S	S	*	*			trans	63.9	145.3	162.2	-64.3	160	-177	78.2	0	116.1
160	K	39.7	Very low	34.4	Very low	154 Å²	154	140.6 Å²	140.6	67%	0.67	72%	0.721	S	S	*	*			cis	-159.3	177.5	3.2	-124	178.5	169.7	-77.3	0	106.8
161	D	36.3	Very low	34.8	Very low	96 Å²	96	139.1 Å²	139.1	51%	0.513	71%	0.709	S	S	.	*			cis	-141.1	-89.4	6.3	-147.6	-18.4	0	0	0	114.2
162	S	36.3	Very low	34.9	Very low	97 Å²	97	139.1 Å²	139.1	68%	0.678	71%	0.709	S	S	*	*			trans	-157.8	151.3	-166.4	61.8	0	0	0	0	116.6
163	H	36.9	Very low	35	Very low	191 Å²	191	139 Å²	139	88%	0.884	71%	0.714	S	S	*	*			trans	-150.5	151.9	145.9	-134.1	-84.3	0	0	0	110.1
164	I	39.9	Very low	35.1	Very low	147 Å²	147	140.6 Å²	140.6	75%	0.754	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-94.2	140.6	-163	-60.7	169.3	0	0	0	112.3
165	P	32.9	Very low	35.1	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-74	140.6	173.7	-13.5	29.3	0	0	0	113.3	I167	P165-I167 PolarHBondContact O-N 2.85Å
166	S	34.4	Very low	35.3	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-75.7	120.4	175.7	-53.9	0	0	0	0	112.2	Q168	S166-Q168 PolarHBondContact O-N 2.73Å
167	I	34	Very low	35.3	Very low	145 Å²	145	139.7 Å²	139.7	74%	0.744	72%	0.724	S	S	*	*			trans	-76	105.3	169.7	-60.7	174.9	0	0	0	108.7	P165 F169	P165-I167 PolarHBondContact O-N 2.85Å; I167-F169 HydrophobicContact CG2-CD2 4.47Å; I167-F169 HydrophobicContact CG2-CE2 4.32Å; I167-F169 PolarHBondContact O-N 2.84Å
168	Q	30.8	Very low	34.9	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.822	72%	0.721	S	S	*	*			trans	-74	108.1	165.1	-75.9	-173.2	-100.3	0	0	109.3	S166 Q170	S166-Q168 PolarHBondContact O-N 2.73Å; Q168-Q170 VanDerWaalsContact C-N 3.32Å; Q168-Q170 PolarHBondContact O-N 2.83Å
169	F	34.4	Very low	34.5	Very low	156 Å²	156	137.6 Å²	137.6	68%	0.684	71%	0.709	S	S	*	*			trans	-66.4	97.3	155.7	-73.6	-83.8	0	0	0	108.4	I167 L171	I167-F169 HydrophobicContact CG2-CD2 4.47Å; I167-F169 HydrophobicContact CG2-CE2 4.32Å; I167-F169 PolarHBondContact O-N 2.84Å; F169-L171 PolarHBondContact O-N 3.09Å
170	Q	30.3	Very low	34	Very low	169 Å²	169	134.2 Å²	134.2	79%	0.79	70%	0.702	S	S	*	*			trans	-61.9	113.7	153.6	-69.5	-176.6	-65.9	0	0	106.4	Q168	Q168-Q170 VanDerWaalsContact C-N 3.32Å; Q168-Q170 PolarHBondContact O-N 2.83Å
171	L	37.4	Very low	33.8	Very low	83 Å²	83	129.7 Å²	129.7	44%	0.435	69%	0.687	S	S	.	*			trans	-71.2	135.5	156.4	-68.1	169.5	0	0	0	105.4	F169 D173 I225	F169-L171 PolarHBondContact O-N 3.09Å; L171-D173 PolarHBondContact O-N 2.85Å; L171-I225 HydrophobicContact CD2-CD1 4.07Å
172	N	32.1	Very low	33.6	Very low	125 Å²	125	133.2 Å²	133.2	67%	0.668	70%	0.701	S	S	*	*			trans	-68	104.8	175.8	-69.4	-13.6	0	0	0	107.8	H174	N172-H174 PolarHBondContact O-N 2.94Å
173	D	35.1	Very low	33.8	Very low	158 Å²	158	132.5 Å²	132.5	85%	0.845	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	32.5	179.3	-69.1	-49.5	0	0	0	112.7	L171	L171-D173 PolarHBondContact O-N 2.85Å
174	H	34.7	Very low	33.5	Very low	167 Å²	167	130.8 Å²	130.8	77%	0.773	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	-10.5	-173.8	-126.4	-62	0	0	0	115.8	N172 S176	N172-H174 PolarHBondContact O-N 2.94Å; H174-S176 PolarHBondContact O-N 3.2Å; H174-S176 VanDerWaalsContact O-N 3.15Å
175	D	32.1	Very low	33.2	Very low	140 Å²	140	127.6 Å²	127.6	75%	0.749	69%	0.689	S	S	*	*			trans	-85.2	47.2	163.8	-66	-41.6	0	0	0	110.1	E177	D175-E177 PolarHBondContact O-N 3.44Å
176	S	33.8	Very low	33.4	Very low	104 Å²	104	126 Å²	126	73%	0.727	68%	0.681	S	S	*	*			trans	-82.9	46	-178	64.7	0	0	0	0	112.2	H174 D178	H174-S176 PolarHBondContact O-N 3.2Å; H174-S176 VanDerWaalsContact O-N 3.15Å; S176-D178 PolarHBondContact O-N 3.01Å
177	E	32.6	Very low	33.9	Very low	176 Å²	176	128.7 Å²	128.7	82%	0.822	69%	0.686	S	S	*	*			trans	-74.2	117.1	170.9	-72.4	-158.1	155.6	0	0	110.4	D175 F179	D175-E177 PolarHBondContact O-N 3.44Å; E177-F179 PolarHBondContact O-N 3.29Å; E177-F179 VanDerWaalsContact O-N 3.12Å
178	D	28.9	Very low	35	Very low	129 Å²	129	124.1 Å²	124.1	69%	0.69	67%	0.674	S	S	*	*			trans	-0.8	89.4	175.7	-79.9	-40.3	0	0	0	116.6	S176 T180	S176-D178 PolarHBondContact O-N 3.01Å; D178-T180 WeakPolarHBondContact CA-OG1 3.36Å; D178-T180 WeakPolarHBondContact CB-OG1 3.29Å; D178-T180 VanDerWaalsContact CG-OG1 3.29Å; D178-T180 PolarHBondContact OD1-OG1 2.82Å
179	F	31.6	Very low	37.1	Very low	78 Å²	78	125.1 Å²	125.1	34%	0.342	68%	0.676	S	S	.	*			trans	-104.4	21.7	155	-114.7	-61.5	0	0	0	113.7	E177 T181 K204 Y205	E177-F179 PolarHBondContact O-N 3.29Å; E177-F179 VanDerWaalsContact O-N 3.12Å; F179-T181 HydrophobicContact CD1-CG2 3.59Å; F179-T181 HydrophobicContact CE1-CG2 3.52Å; F179-T181 PolarHBondContact O-N 3.41Å; F179-K204 HydrophobicContact CE2-CB 4.33Å; F179-K204 HydrophobicContact CE2-CD 3.49Å; F179-K204 VanDerWaalsContact CE2-CD 3.49Å; F179-K204 HydrophobicContact CZ-CB 4.43Å; F179-K204 HydrophobicContact CZ-CD 3.73Å; F179-Y205 WeakPolarHBondContact CD1-OH 3.03Å; F179-Y205 WeakPolarHBondContact CD2-OH 3.14Å; F179-Y205 AromaticContact CE1-CE2 3.72Å; F179-Y205 HydrophobicContact CE1-CE2 3.72Å; F179-Y205 AromaticContact CE1-CZ 3.69Å; F179-Y205 WeakPolarHBondContact CE1-OH 3.5Å; F179-Y205 HydrophobicContact CE2-CE1 4.1Å; F179-Y205 HydrophobicContact CE2-CE2 4.08Å; F179-Y205 AromaticContact CE2-CZ 3.58Å; F179-Y205 WeakPolarHBondContact CE2-OH 3.43Å; F179-Y205 WeakPolarHBondContact CG-OH 3.46Å; F179-Y205 HydrophobicContact CZ-CD2 4.39Å; F179-Y205 HydrophobicContact CZ-CE1 4.28Å; F179-Y205 AromaticContact CZ-CE2 3.42Å; F179-Y205 HydrophobicContact CZ-CE2 3.42Å; F179-Y205 VanDerWaalsContact CZ-CE2 3.42Å; F179-Y205 AromaticContact CZ-CZ 3.37Å; F179-Y205 WeakPolarHBondContact CZ-OH 2.97Å
180	T	29.5	Very low	39.6	Very low	94 Å²	94	120.7 Å²	120.7	58%	0.577	66%	0.659	S	S	*	*			trans	-58.6	51.3	143.5	41.4	0	0	0	0	111.2	D178 E182	D178-T180 WeakPolarHBondContact CA-OG1 3.36Å; D178-T180 WeakPolarHBondContact CB-OG1 3.29Å; D178-T180 VanDerWaalsContact CG-OG1 3.29Å; D178-T180 PolarHBondContact OD1-OG1 2.82Å; T180-E182 VanDerWaalsContact C-N 3.27Å; T180-E182 PolarHBondContact O-N 3.14Å
181	T	35	Very low	42.5	Very low	58 Å²	58	114.8 Å²	114.8	36%	0.356	64%	0.635	S	S	.	*			trans	-68.4	94.2	163.5	50.7	0	0	0	0	107.7	F179 I183 R233	F179-T181 HydrophobicContact CD1-CG2 3.59Å; F179-T181 HydrophobicContact CE1-CG2 3.52Å; F179-T181 PolarHBondContact O-N 3.41Å; T181-I183 PolarHBondContact O-N 3.2Å; T181-R233 PolarHBondContact OG1-NH2 3.01Å
182	E	32.9	Very low	45.2	Very low	171 Å²	171	111 Å²	111	80%	0.799	62%	0.615	S	S	*	*			trans	-57.2	98.6	175.5	-64.8	178.2	164.2	0	0	109.6	T180 D184	T180-E182 VanDerWaalsContact C-N 3.27Å; T180-E182 PolarHBondContact O-N 3.14Å; E182-D184 VanDerWaalsContact C-N 3.29Å
183	I	40.9	Very low	48.2	Very low	81 Å²	81	106.8 Å²	106.8	42%	0.415	59%	0.589	S	S	.	*			trans	-106.7	45.9	162.4	-48.9	-176	0	0	0	107.7	T181 E198	T181-I183 PolarHBondContact O-N 3.2Å; I183-E198 HydrophobicContact CD1-CG 4.14Å; I183-E198 WeakPolarHBondContact CD1-OE1 3.4Å; I183-E198 WeakPolarHBondContact CD1-OE2 3.36Å
184	D	30.2	Very low	51	Low	155 Å²	155	101.9 Å²	101.9	83%	0.829	56%	0.562	S	S	*	*			trans	-77	149.6	159.7	-87.1	-35.4	0	0	0	109.4	E182	E182-D184 VanDerWaalsContact C-N 3.29Å
185	G	33.3	Very low	53.8	Low	80 Å²	80	94.1 Å²	94.1	83%	0.825	53%	0.525	S	S	*	.	S	Bend	trans	121.2	-11.5	-174.7	0	0	0	0	0	114.8
186	S	38.4	Very low	56.9	Low	82 Å²	82	87.4 Å²	87.4	57%	0.573	49%	0.49	S	S	*	.			trans	-119.3	102.2	169	166.6	0	0	0	0	111.4	G188	S186-G188 PolarHBondContact O-N 2.92Å; S186-G188 PolarHBondContact OG-N 3.27Å; S186-G188 PolarHBondContact OG-O 2.84Å
187	N	43.4	Very low	59.8	Low	176 Å²	176	82.5 Å²	82.5	94%	0.941	46%	0.455	S	S	*	.			trans	-67.9	3.7	171.7	-60.9	-19.3	0	0	0	113.1
188	G	57.1	Low	62.6	Low	48 Å²	48	75.3 Å²	75.3	50%	0.495	42%	0.422	S	S	.	.	S	Bend	trans	-88.4	126.7	167.8	0	0	0	0	0	111.9	S186 L190	S186-G188 PolarHBondContact O-N 2.92Å; S186-G188 PolarHBondContact OG-N 3.27Å; S186-G188 PolarHBondContact OG-O 2.84Å; G188-L190 PolarHBondContact O-N 3.46Å; G188-L190 VanDerWaalsContact O-N 3.16Å
189	K	75.4	Confident	65.7	Low	197 Å²	197	69.2 Å²	69.2	86%	0.857	39%	0.389	S	S	*	.			trans	-48.3	113.9	-177.6	-60.2	157.4	-172.2	162.3	0	112.4	T191	K189-T191 PolarHBondContact O-N 2.8Å
190	L	86.5	Confident	68.7	Low	64 Å²	64	66 Å²	66	34%	0.335	38%	0.375	S	S	.	.			trans	-52.4	127.2	171.8	-179	65.8	0	0	0	110.3	G188 Q194 F195 R233	G188-L190 PolarHBondContact O-N 3.46Å; G188-L190 VanDerWaalsContact O-N 3.16Å; L190-Q194 HydrophobicContact CD1-CB 3.69Å; L190-F195 HydrophobicContact CD2-CB 4.34Å; L190-R233 HydrophobicContact CD2-CG 3.66Å
191	T	92	Very high	71.6	Confident	45 Å²	45	62.7 Å²	62.7	28%	0.276	35%	0.354	S	S	.	.			trans	-97.8	154.4	-178.8	67.5	0	0	0	0	111.7	K189 W193 Q194 F195	K189-T191 PolarHBondContact O-N 2.8Å; T191-W193 PolarHBondContact O-N 2.72Å; T191-W193 PolarHBondContact OG1-NE1 2.68Å; T191-W193 VanDerWaalsContact OG1-NE1 3.08Å; T191-Q194 PolarHBondContact O-N 3.38Å; T191-Q194 VanDerWaalsContact O-N 3.08Å; T191-Q194 WeakPolarHBondContact OG1-CG 3.31Å; T191-Q194 PolarHBondContact OG1-OE1 2.92Å; T191-F195 PolarHBondContact O-N 3.21Å
192	L	94.8	Very high	74.2	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-56.8	-37.8	-179.7	173.3	62.9	0	0	0	112.1	F195 L196 W230 L245 A248 L249 Y252	L192-F195 HydrophobicContact CD1-CD1 4.17Å; L192-F195 PolarHBondContact O-N 3.22Å; L192-L196 HydrophobicContact CD1-CD1 3.81Å; L192-L196 HydrophobicContact CD1-CD2 4.32Å; L192-L196 HydrophobicContact CD1-CG 3.81Å; L192-L196 HydrophobicContact CD2-CD1 4.48Å; L192-L196 HydrophobicContact CG-CD1 3.81Å; L192-L196 HydrophobicContact CG-CG 4.25Å; L192-L196 WeakPolarHBondContact O-CB 2.95Å; L192-L196 VanDerWaalsContact O-CG 3.25Å; L192-L196 WeakPolarHBondContact O-CG 3.43Å; L192-L196 PolarHBondContact O-N 2.72Å; L192-W230 HydrophobicContact CB-CH2 4.04Å; L192-W230 HydrophobicContact CB-CZ2 3.58Å; L192-W230 HydrophobicContact CD1-CD2 3.78Å; L192-W230 HydrophobicContact CD1-CE3 4.35Å; L192-W230 HydrophobicContact CD1-CG 3.9Å; L192-W230 HydrophobicContact CD1-CZ2 4.29Å; L192-W230 HydrophobicContact CG-CZ2 4.48Å; L192-L245 HydrophobicContact CD1-CD1 3.97Å; L192-L245 HydrophobicContact CD1-CD2 4.41Å; L192-L245 HydrophobicContact CD1-CG 3.96Å; L192-L245 HydrophobicContact CD2-CD2 4.27Å; L192-L245 HydrophobicContact CD2-CG 4.01Å; L192-A248 HydrophobicContact CD2-CB 3.55Å; L192-L249 HydrophobicContact CD2-CD2 4.13Å; L192-L249 HydrophobicContact CD2-CG 4.24Å; L192-Y252 HydrophobicContact CB-CE2 4.01Å; L192-Y252 HydrophobicContact CD2-CE2 4.2Å; L192-Y252 HydrophobicContact CG-CE2 4.23Å; L192-Y252 PolarHBondContact N-OH 2.74Å
193	W	94.6	Very high	76.7	Confident	36 Å²	36	59.3 Å²	59.3	14%	0.136	34%	0.342	C	S	.	.	H	α-helix	trans	-68.7	-33.5	179.3	77.4	-102.2	0	0	0	112.9	T191 L197 Y252 I257 I258 F270 L276	T191-W193 PolarHBondContact O-N 2.72Å; T191-W193 PolarHBondContact OG1-NE1 2.68Å; T191-W193 VanDerWaalsContact OG1-NE1 3.08Å; W193-L197 HydrophobicContact CZ3-CD2 4.15Å; W193-L197 VanDerWaalsContact O-CB 3.28Å; W193-L197 WeakPolarHBondContact O-CB 3.3Å; W193-L197 PolarHBondContact O-N 2.97Å; W193-L197 VanDerWaalsContact O-N 3.08Å; W193-Y252 HydrophobicContact CB-CD2 4.45Å; W193-Y252 HydrophobicContact CB-CE2 3.92Å; W193-Y252 AromaticContact CD1-CE1 3.86Å; W193-Y252 AromaticContact CD1-CZ 3.81Å; W193-Y252 PolarHBondContact N-OH 3.09Å; W193-I257 HydrophobicContact CB-CG2 3.91Å; W193-I257 HydrophobicContact CD2-CG2 3.97Å; W193-I257 HydrophobicContact CG-CG2 3.68Å; W193-I258 HydrophobicContact CB-CD1 3.92Å; W193-F270 HydrophobicContact CB-CE1 4.15Å; W193-F270 HydrophobicContact CE3-CE1 4.29Å; W193-L276 HydrophobicContact CE3-CD2 4.45Å; W193-L276 HydrophobicContact CH2-CD2 4.05Å; W193-L276 HydrophobicContact CZ3-CB 4.04Å; W193-L276 HydrophobicContact CZ3-CD2 4.01Å; W193-L276 HydrophobicContact CZ3-CG 4.45Å
194	Q	93.4	Very high	79	Confident	56 Å²	56	62 Å²	62	26%	0.262	35%	0.351	S	S	.	.	H	α-helix	trans	-68.5	-48	173.6	-71.3	164.1	-60	0	0	110.5	L190 T191 L196 L197 E198	L190-Q194 HydrophobicContact CD1-CB 3.69Å; T191-Q194 PolarHBondContact O-N 3.38Å; T191-Q194 VanDerWaalsContact O-N 3.08Å; T191-Q194 WeakPolarHBondContact OG1-CG 3.31Å; T191-Q194 PolarHBondContact OG1-OE1 2.92Å; Q194-L196 PolarHBondContact O-N 3.29Å; Q194-L197 WeakPolarHBondContact O-CB 3.41Å; Q194-L197 PolarHBondContact O-N 3.17Å; Q194-E198 WeakPolarHBondContact O-CB 3.14Å; Q194-E198 PolarHBondContact O-N 3.31Å
195	F	94.5	Very high	82	Confident	3 Å²	3	55.8 Å²	55.8	1%	0.013	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-45.9	176.4	168.7	-103.3	0	0	0	112.7	L190 T191 L192 L197 E198 L199 L229 W230 R233	L190-F195 HydrophobicContact CD2-CB 4.34Å; T191-F195 PolarHBondContact O-N 3.21Å; L192-F195 HydrophobicContact CD1-CD1 4.17Å; L192-F195 PolarHBondContact O-N 3.22Å; F195-L197 PolarHBondContact O-N 3.47Å; F195-E198 WeakPolarHBondContact O-CB 3.46Å; F195-E198 PolarHBondContact O-N 2.91Å; F195-L199 HydrophobicContact CD1-CD1 4.43Å; F195-L199 HydrophobicContact CD2-CG 4.48Å; F195-L199 HydrophobicContact CE1-CD1 3.68Å; F195-L199 HydrophobicContact CE1-CG 4.23Å; F195-L199 HydrophobicContact CE2-CD1 4.23Å; F195-L199 HydrophobicContact CE2-CD2 3.94Å; F195-L199 HydrophobicContact CE2-CG 4.06Å; F195-L199 HydrophobicContact CZ-CD1 3.58Å; F195-L199 HydrophobicContact CZ-CD2 4.06Å; F195-L199 HydrophobicContact CZ-CG 3.93Å; F195-L199 WeakPolarHBondContact O-CG 3.42Å; F195-L199 PolarHBondContact O-N 3.15Å; F195-L229 HydrophobicContact CZ-CB 3.79Å; F195-W230 HydrophobicContact CB-CE3 3.89Å; F195-W230 HydrophobicContact CB-CZ3 3.74Å; F195-W230 HydrophobicContact CD1-CB 4.15Å; F195-W230 HydrophobicContact CD1-CD2 4.1Å; F195-W230 AromaticContact CD1-CE3 3.52Å; F195-W230 HydrophobicContact CD1-CE3 3.52Å; F195-W230 HydrophobicContact CD1-CG 4.39Å; F195-W230 HydrophobicContact CD1-CZ3 4.27Å; F195-W230 HydrophobicContact CD2-CE3 4.24Å; F195-W230 HydrophobicContact CE1-CB 3.6Å; F195-W230 HydrophobicContact CE1-CD2 4.44Å; F195-W230 HydrophobicContact CE1-CE3 4.08Å; F195-W230 HydrophobicContact CE1-CG 4.32Å; F195-W230 AromaticContact CG-CE3 3.6Å; F195-W230 HydrophobicContact CG-CE3 3.6Å; F195-W230 AromaticContact CG-CZ3 3.98Å; F195-W230 HydrophobicContact CG-CZ3 3.98Å; F195-W230 HydrophobicContact CZ-CB 4.16Å; F195-R233 HydrophobicContact CD2-CB 4.12Å; F195-R233 HydrophobicContact CD2-CG 3.73Å; F195-R233 HydrophobicContact CE2-CB 3.82Å; F195-R233 HydrophobicContact CE2-CG 3.92Å
196	L	96.4	Very high	84.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-40.2	176.5	-69.8	170.7	0	0	0	111.9	L192 Q194 E198 L200 I209 L220 V226 L249 I258 F270	L192-L196 HydrophobicContact CD1-CD1 3.81Å; L192-L196 HydrophobicContact CD1-CD2 4.32Å; L192-L196 HydrophobicContact CD1-CG 3.81Å; L192-L196 HydrophobicContact CD2-CD1 4.48Å; L192-L196 HydrophobicContact CG-CD1 3.81Å; L192-L196 HydrophobicContact CG-CG 4.25Å; L192-L196 WeakPolarHBondContact O-CB 2.95Å; L192-L196 VanDerWaalsContact O-CG 3.25Å; L192-L196 WeakPolarHBondContact O-CG 3.43Å; L192-L196 PolarHBondContact O-N 2.72Å; Q194-L196 PolarHBondContact O-N 3.29Å; L196-E198 VanDerWaalsContact C-N 3.31Å; L196-L200 VanDerWaalsContact O-CB 3.28Å; L196-L200 WeakPolarHBondContact O-CB 3.29Å; L196-L200 WeakPolarHBondContact O-CD1 3.17Å; L196-L200 VanDerWaalsContact O-CG 3.27Å; L196-L200 WeakPolarHBondContact O-CG 3.22Å; L196-L200 PolarHBondContact O-N 2.98Å; L196-I209 HydrophobicContact CB-CD1 4.47Å; L196-I209 HydrophobicContact CD2-CD1 3.64Å; L196-L220 HydrophobicContact CD2-CD2 4.31Å; L196-V226 HydrophobicContact CD2-CG1 3.49Å; L196-V226 VanDerWaalsContact CD2-CG1 3.49Å; L196-L249 HydrophobicContact CD1-CD2 3.7Å; L196-I258 HydrophobicContact CD1-CD1 4.36Å; L196-F270 HydrophobicContact CB-CZ 4.39Å
197	L	93.9	Very high	87.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-36.6	175.7	-178.8	60.7	0	0	0	111.9	W193 Q194 F195 L200 L201 W211 F270 L273 L276 I277 C280	W193-L197 HydrophobicContact CZ3-CD2 4.15Å; W193-L197 VanDerWaalsContact O-CB 3.28Å; W193-L197 WeakPolarHBondContact O-CB 3.3Å; W193-L197 PolarHBondContact O-N 2.97Å; W193-L197 VanDerWaalsContact O-N 3.08Å; Q194-L197 WeakPolarHBondContact O-CB 3.41Å; Q194-L197 PolarHBondContact O-N 3.17Å; F195-L197 PolarHBondContact O-N 3.47Å; L197-L200 CarbonylContact O-C 3.56Å; L197-L200 PolarHBondContact O-N 3.29Å; L197-L201 HydrophobicContact CD1-CD1 4.43Å; L197-L201 HydrophobicContact CG-CD1 4Å; L197-L201 WeakPolarHBondContact O-CB 3.39Å; L197-L201 WeakPolarHBondContact O-CD1 3.46Å; L197-L201 WeakPolarHBondContact O-CG 3.33Å; L197-L201 PolarHBondContact O-N 3.21Å; L197-W211 HydrophobicContact CD1-CH2 3.97Å; L197-W211 HydrophobicContact CD1-CZ2 4.07Å; L197-F270 HydrophobicContact CB-CE1 4.38Å; L197-F270 HydrophobicContact CB-CE2 4.47Å; L197-F270 HydrophobicContact CB-CZ 3.85Å; L197-F270 HydrophobicContact CD1-CE2 4.45Å; L197-F270 HydrophobicContact CD1-CZ 4.5Å; L197-L273 HydrophobicContact CD1-CD1 3.87Å; L197-L276 HydrophobicContact CD2-CB 4.5Å; L197-I277 HydrophobicContact CD1-CG1 4.36Å; L197-I277 HydrophobicContact CD2-CG1 4.47Å; L197-C280 HydrophobicContact CD2-CB 4.3Å
198	E	92.3	Very high	90	Very high	25 Å²	25	48.6 Å²	48.6	12%	0.117	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-47.6	176.8	-174.4	-157.5	136.6	0	0	112.2	I183 Q194 F195 L196 L200 L201 S202 R233	I183-E198 HydrophobicContact CD1-CG 4.14Å; I183-E198 WeakPolarHBondContact CD1-OE1 3.4Å; I183-E198 WeakPolarHBondContact CD1-OE2 3.36Å; Q194-E198 WeakPolarHBondContact O-CB 3.14Å; Q194-E198 PolarHBondContact O-N 3.31Å; F195-E198 WeakPolarHBondContact O-CB 3.46Å; F195-E198 PolarHBondContact O-N 2.91Å; L196-E198 VanDerWaalsContact C-N 3.31Å; E198-L200 PolarHBondContact O-N 3.08Å; E198-L201 WeakPolarHBondContact O-CB 3.26Å; E198-L201 PolarHBondContact O-N 2.69Å; E198-S202 PolarHBondContact O-N 3.37Å; E198-R233 IonicContact OE1-CZ 2.64Å; E198-R233 VanDerWaalsContact OE1-CZ 3.23Å; E198-R233 IonicContact OE1-NH1 2.89Å; E198-R233 PolarHBondContact OE1-NH1 2.8Å; E198-R233 IonicContact OE1-NH2 2.69Å; E198-R233 PolarHBondContact OE1-NH2 3.47Å; E198-R233 IonicContact OE2-CZ 4Å; E198-R233 IonicContact OE2-NH1 2.66Å; E198-R233 PolarHBondContact OE2-NH1 3.41Å
199	L	94.7	Very high	91.9	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-56.3	-43.6	171.9	-63.8	-174.3	0	0	0	110.6	F195 L201 S202 Y205 I209 V226 L229	F195-L199 HydrophobicContact CD1-CD1 4.43Å; F195-L199 HydrophobicContact CD2-CG 4.48Å; F195-L199 HydrophobicContact CE1-CD1 3.68Å; F195-L199 HydrophobicContact CE1-CG 4.23Å; F195-L199 HydrophobicContact CE2-CD1 4.23Å; F195-L199 HydrophobicContact CE2-CD2 3.94Å; F195-L199 HydrophobicContact CE2-CG 4.06Å; F195-L199 HydrophobicContact CZ-CD1 3.58Å; F195-L199 HydrophobicContact CZ-CD2 4.06Å; F195-L199 HydrophobicContact CZ-CG 3.93Å; F195-L199 WeakPolarHBondContact O-CG 3.42Å; F195-L199 PolarHBondContact O-N 3.15Å; L199-L201 VanDerWaalsContact C-N 3.26Å; L199-L201 PolarHBondContact O-N 3.31Å; L199-S202 PolarHBondContact O-N 2.86Å; L199-S202 VanDerWaalsContact O-N 3.16Å; L199-S202 VanDerWaalsContact O-O 3.1Å; L199-Y205 HydrophobicContact CB-CD2 4.18Å; L199-Y205 HydrophobicContact CD2-CD2 3.49Å; L199-Y205 VanDerWaalsContact CD2-CD2 3.49Å; L199-Y205 HydrophobicContact CD2-CE1 4.48Å; L199-Y205 HydrophobicContact CD2-CE2 3.31Å; L199-Y205 HydrophobicContact CD2-CG 4.13Å; L199-Y205 HydrophobicContact CG-CD2 4.41Å; L199-I209 HydrophobicContact CB-CG2 3.61Å; L199-I209 HydrophobicContact CD1-CG2 3.94Å; L199-I209 HydrophobicContact CG-CG2 4.44Å; L199-V226 HydrophobicContact CD1-CG1 4.39Å; L199-L229 HydrophobicContact CD1-CD1 4.43Å
200	L	94.3	Very high	92.9	Very high	11 Å²	11	42.3 Å²	42.3	6%	0.058	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.5	177.2	-78.7	166.2	0	0	0	115	L196 L197 E198 I209 R210 W211 F218 F270	L196-L200 VanDerWaalsContact O-CB 3.28Å; L196-L200 WeakPolarHBondContact O-CB 3.29Å; L196-L200 WeakPolarHBondContact O-CD1 3.17Å; L196-L200 VanDerWaalsContact O-CG 3.27Å; L196-L200 WeakPolarHBondContact O-CG 3.22Å; L196-L200 PolarHBondContact O-N 2.98Å; L197-L200 CarbonylContact O-C 3.56Å; L197-L200 PolarHBondContact O-N 3.29Å; E198-L200 PolarHBondContact O-N 3.08Å; L200-I209 HydrophobicContact CD1-CD1 4.1Å; L200-I209 HydrophobicContact CD1-CG1 4.4Å; L200-I209 HydrophobicContact CD2-CD1 4.38Å; L200-I209 HydrophobicContact CD2-CG1 3.84Å; L200-I209 HydrophobicContact CG-CD1 3.89Å; L200-I209 HydrophobicContact CG-CG1 3.9Å; L200-R210 VanDerWaalsContact CD2-CA 3.49Å; L200-W211 HydrophobicContact CB-CH2 4.26Å; L200-W211 HydrophobicContact CB-CZ2 3.51Å; L200-W211 HydrophobicContact CD1-CH2 3.9Å; L200-W211 HydrophobicContact CD1-CZ2 3.98Å; L200-W211 HydrophobicContact CD1-CZ3 4.2Å; L200-W211 HydrophobicContact CD2-CD2 4.06Å; L200-W211 HydrophobicContact CD2-CG 4.23Å; L200-W211 HydrophobicContact CD2-CZ2 4.39Å; L200-W211 HydrophobicContact CG-CZ2 4.18Å; L200-W211 PolarHBondContact O-NE1 3.02Å; L200-F218 HydrophobicContact CD1-CB 3.7Å; L200-F218 HydrophobicContact CD1-CD1 4.05Å; L200-F218 HydrophobicContact CD1-CD2 3.81Å; L200-F218 HydrophobicContact CD1-CE2 4.38Å; L200-F218 HydrophobicContact CD1-CG 3.6Å; L200-F218 HydrophobicContact CD2-CB 3.88Å; L200-F218 HydrophobicContact CG-CB 4.47Å; L200-F270 HydrophobicContact CD1-CE2 3.86Å
201	L	90.4	Very high	93.3	Very high	24 Å²	24	40.7 Å²	40.7	13%	0.126	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-13.5	172.6	-82.4	161.3	0	0	0	111.8	L197 E198 L199 L490 R494	L197-L201 HydrophobicContact CD1-CD1 4.43Å; L197-L201 HydrophobicContact CG-CD1 4Å; L197-L201 WeakPolarHBondContact O-CB 3.39Å; L197-L201 WeakPolarHBondContact O-CD1 3.46Å; L197-L201 WeakPolarHBondContact O-CG 3.33Å; L197-L201 PolarHBondContact O-N 3.21Å; E198-L201 WeakPolarHBondContact O-CB 3.26Å; E198-L201 PolarHBondContact O-N 2.69Å; L199-L201 VanDerWaalsContact C-N 3.26Å; L199-L201 PolarHBondContact O-N 3.31Å; L201-L490 HydrophobicContact CD2-CD2 3.56Å; L201-L490 HydrophobicContact CD2-CG 4.25Å; L201-L490 HydrophobicContact CG-CD2 4.19Å; L201-R494 VanDerWaalsContact O-CZ 3.31Å; L201-R494 PolarHBondContact O-NH1 3.47Å; L201-R494 PolarHBondContact O-NH2 2.78Å
202	S	88.4	Confident	93.2	Very high	38 Å²	38	40.4 Å²	40.4	27%	0.266	19%	0.19	S	C	.	.			trans	-105	118.3	-178.6	179.4	0	0	0	0	111.4	E198 L199 K204 Y205	E198-S202 PolarHBondContact O-N 3.37Å; L199-S202 PolarHBondContact O-N 2.86Å; L199-S202 VanDerWaalsContact O-N 3.16Å; L199-S202 VanDerWaalsContact O-O 3.1Å; S202-K204 PolarHBondContact O-N 3.44Å; S202-K204 VanDerWaalsContact O-N 3.15Å; S202-Y205 PolarHBondContact O-N 3.41Å
203	N	85.3	Confident	92.3	Very high	121 Å²	121	45 Å²	45	65%	0.647	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-64	-21.9	-179.8	-155.3	49.3	0	0	0	112.9	Y205 E206	N203-Y205 PolarHBondContact O-N 2.82Å; N203-Y205 VanDerWaalsContact O-N 3.08Å; N203-E206 PolarHBondContact O-N 3.25Å
204	K	90.6	Very high	91.5	Very high	138 Å²	138	48.5 Å²	48.5	60%	0.6	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-55.9	-26.1	177.2	-65.1	-169.7	176.3	-171	0	112.8	F179 S202 H207	F179-K204 HydrophobicContact CE2-CB 4.33Å; F179-K204 HydrophobicContact CE2-CD 3.49Å; F179-K204 VanDerWaalsContact CE2-CD 3.49Å; F179-K204 HydrophobicContact CZ-CB 4.43Å; F179-K204 HydrophobicContact CZ-CD 3.73Å; S202-K204 PolarHBondContact O-N 3.44Å; S202-K204 VanDerWaalsContact O-N 3.15Å; K204-H207 PolarHBondContact O-CE1 2.85Å; K204-H207 PolarHBondContact O-ND1 3.4Å
205	Y	92.5	Very high	91	Very high	24 Å²	24	49.6 Å²	49.6	9%	0.094	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-104.4	9	-173	-63.4	-59.2	0	0	0	115.7	F179 L199 S202 N203 H207 I208 I209 L229	F179-Y205 WeakPolarHBondContact CD1-OH 3.03Å; F179-Y205 WeakPolarHBondContact CD2-OH 3.14Å; F179-Y205 AromaticContact CE1-CE2 3.72Å; F179-Y205 HydrophobicContact CE1-CE2 3.72Å; F179-Y205 AromaticContact CE1-CZ 3.69Å; F179-Y205 WeakPolarHBondContact CE1-OH 3.5Å; F179-Y205 HydrophobicContact CE2-CE1 4.1Å; F179-Y205 HydrophobicContact CE2-CE2 4.08Å; F179-Y205 AromaticContact CE2-CZ 3.58Å; F179-Y205 WeakPolarHBondContact CE2-OH 3.43Å; F179-Y205 WeakPolarHBondContact CG-OH 3.46Å; F179-Y205 HydrophobicContact CZ-CD2 4.39Å; F179-Y205 HydrophobicContact CZ-CE1 4.28Å; F179-Y205 AromaticContact CZ-CE2 3.42Å; F179-Y205 HydrophobicContact CZ-CE2 3.42Å; F179-Y205 VanDerWaalsContact CZ-CE2 3.42Å; F179-Y205 AromaticContact CZ-CZ 3.37Å; F179-Y205 WeakPolarHBondContact CZ-OH 2.97Å; L199-Y205 HydrophobicContact CB-CD2 4.18Å; L199-Y205 HydrophobicContact CD2-CD2 3.49Å; L199-Y205 VanDerWaalsContact CD2-CD2 3.49Å; L199-Y205 HydrophobicContact CD2-CE1 4.48Å; L199-Y205 HydrophobicContact CD2-CE2 3.31Å; L199-Y205 HydrophobicContact CD2-CG 4.13Å; L199-Y205 HydrophobicContact CG-CD2 4.41Å; S202-Y205 PolarHBondContact O-N 3.41Å; N203-Y205 PolarHBondContact O-N 2.82Å; N203-Y205 VanDerWaalsContact O-N 3.08Å; Y205-H207 PolarHBondContact O-N 3.49Å; Y205-H207 VanDerWaalsContact O-N 3.07Å; Y205-I208 HydrophobicContact CD1-CD1 4.15Å; Y205-I208 WeakPolarHBondContact O-CA 3.42Å; Y205-I208 PolarHBondContact O-N 3.27Å; Y205-I209 PolarHBondContact O-N 2.82Å; Y205-I209 VanDerWaalsContact O-O 3.11Å; Y205-L229 HydrophobicContact CD1-CD1 4.35Å; Y205-L229 HydrophobicContact CE1-CD1 4.05Å
206	E	92.9	Very high	90.8	Very high	63 Å²	63	49.7 Å²	49.7	29%	0.294	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35.5	-175.3	-158.2	-158.2	146.6	0	0	112.9	N203 I208 R210	N203-E206 PolarHBondContact O-N 3.25Å; E206-I208 PolarHBondContact O-N 3.11Å; E206-R210 HydrophobicContact CB-CB 4.49Å; E206-R210 HydrophobicContact CG-CB 3.5Å; E206-R210 VanDerWaalsContact CG-CB 3.5Å; E206-R210 HydrophobicContact CG-CG 4.26Å; E206-R210 VanDerWaalsContact OE1-CD 3.27Å; E206-R210 WeakPolarHBondContact OE1-CD 3.34Å; E206-R210 IonicContact OE1-CZ 3.95Å; E206-R210 IonicContact OE1-NH1 2.92Å; E206-R210 PolarHBondContact OE1-NH1 2.92Å
207	H	94	Very high	90.7	Very high	112 Å²	112	50 Å²	50	52%	0.519	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-10.7	178.1	67.6	-84.3	0	0	0	114.5	K204 Y205 Q222	K204-H207 PolarHBondContact O-CE1 2.85Å; K204-H207 PolarHBondContact O-ND1 3.4Å; Y205-H207 PolarHBondContact O-N 3.49Å; Y205-H207 VanDerWaalsContact O-N 3.07Å; H207-Q222 PolarHBondContact O-NE2 3.2Å
208	I	96.3	Very high	90.8	Very high	11 Å²	11	50 Å²	50	6%	0.056	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-41.6	178.5	-74	156.3	0	0	0	110.9	Y205 E206 V221 Q222 I225 V226 L229	Y205-I208 HydrophobicContact CD1-CD1 4.15Å; Y205-I208 WeakPolarHBondContact O-CA 3.42Å; Y205-I208 PolarHBondContact O-N 3.27Å; E206-I208 PolarHBondContact O-N 3.11Å; I208-V221 PolarHBondContact O-N 2.96Å; I208-Q222 HydrophobicContact CG1-CB 4.46Å; I208-Q222 PolarHBondContact O-N 2.8Å; I208-I225 HydrophobicContact CD1-CG2 3.61Å; I208-I225 HydrophobicContact CG1-CB 4.2Å; I208-I225 HydrophobicContact CG1-CD1 4.27Å; I208-I225 HydrophobicContact CG1-CG2 3.85Å; I208-I225 HydrophobicContact CG2-CB 4.16Å; I208-I225 HydrophobicContact CG2-CG2 4.08Å; I208-V226 HydrophobicContact CG2-CG2 3.46Å; I208-V226 VanDerWaalsContact CG2-CG2 3.46Å; I208-L229 HydrophobicContact CD1-CD1 4.34Å; I208-L229 HydrophobicContact CG2-CD1 4.32Å
209	I	97.3	Very high	91	Very high	2 Å²	2	51 Å²	51	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	130	-177	-174.6	177.3	0	0	0	110.1	L196 L199 L200 Y205 F218 I219 L220 V226	L196-I209 HydrophobicContact CB-CD1 4.47Å; L196-I209 HydrophobicContact CD2-CD1 3.64Å; L199-I209 HydrophobicContact CB-CG2 3.61Å; L199-I209 HydrophobicContact CD1-CG2 3.94Å; L199-I209 HydrophobicContact CG-CG2 4.44Å; L200-I209 HydrophobicContact CD1-CD1 4.1Å; L200-I209 HydrophobicContact CD1-CG1 4.4Å; L200-I209 HydrophobicContact CD2-CD1 4.38Å; L200-I209 HydrophobicContact CD2-CG1 3.84Å; L200-I209 HydrophobicContact CG-CD1 3.89Å; L200-I209 HydrophobicContact CG-CG1 3.9Å; Y205-I209 PolarHBondContact O-N 2.82Å; Y205-I209 VanDerWaalsContact O-O 3.11Å; I209-F218 HydrophobicContact CD1-CD2 4.26Å; I209-F218 HydrophobicContact CD1-CE2 4.46Å; I209-F218 HydrophobicContact CG1-CD2 4.39Å; I209-I219 WeakPolarHBondContact CA-O 3.38Å; I209-L220 HydrophobicContact CD1-CD2 3.49Å; I209-L220 VanDerWaalsContact CD1-CD2 3.49Å; I209-L220 HydrophobicContact CG1-CD2 3.76Å; I209-V226 HydrophobicContact CB-CG2 4Å
210	R	95	Very high	91.2	Very high	112 Å²	112	51 Å²	51	42%	0.423	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	160.2	-176.4	67.3	-176.2	-176.2	158.2	-4.6	114.3	L200 E206 F218 I219 V221	L200-R210 VanDerWaalsContact CD2-CA 3.49Å; E206-R210 HydrophobicContact CB-CB 4.49Å; E206-R210 HydrophobicContact CG-CB 3.5Å; E206-R210 VanDerWaalsContact CG-CB 3.5Å; E206-R210 HydrophobicContact CG-CG 4.26Å; E206-R210 VanDerWaalsContact OE1-CD 3.27Å; E206-R210 WeakPolarHBondContact OE1-CD 3.34Å; E206-R210 IonicContact OE1-CZ 3.95Å; E206-R210 IonicContact OE1-NH1 2.92Å; E206-R210 PolarHBondContact OE1-NH1 2.92Å; R210-F218 CarbonylContact O-C 3.35Å; R210-F218 VanDerWaalsContact O-CA 3.23Å; R210-F218 WeakPolarHBondContact O-CA 3.39Å; R210-F218 WeakPolarHBondContact O-CB 3.39Å; R210-I219 HydrophobicContact CG-CG2 3.71Å; R210-I219 PolarHBondContact N-O 3.44Å; R210-I219 PolarHBondContact O-N 2.91Å; R210-V221 HydrophobicContact CG-CG2 3.83Å
211	W	95	Very high	91.3	Very high	29 Å²	29	53.7 Å²	53.7	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	148.3	170.2	-56.2	99.6	0	0	0	111	L197 L200 E217 F218 F270 L273 N488 L490	L197-W211 HydrophobicContact CD1-CH2 3.97Å; L197-W211 HydrophobicContact CD1-CZ2 4.07Å; L200-W211 HydrophobicContact CB-CH2 4.26Å; L200-W211 HydrophobicContact CB-CZ2 3.51Å; L200-W211 HydrophobicContact CD1-CH2 3.9Å; L200-W211 HydrophobicContact CD1-CZ2 3.98Å; L200-W211 HydrophobicContact CD1-CZ3 4.2Å; L200-W211 HydrophobicContact CD2-CD2 4.06Å; L200-W211 HydrophobicContact CD2-CG 4.23Å; L200-W211 HydrophobicContact CD2-CZ2 4.39Å; L200-W211 HydrophobicContact CG-CZ2 4.18Å; L200-W211 PolarHBondContact O-NE1 3.02Å; W211-E217 WeakPolarHBondContact CA-O 3.21Å; W211-F218 HydrophobicContact CE3-CB 4.03Å; W211-F218 HydrophobicContact CZ3-CB 4.32Å; W211-F218 HydrophobicContact CZ3-CD1 4.39Å; W211-F270 AromaticContact CH2-CD2 3.89Å; W211-F270 HydrophobicContact CH2-CD2 3.89Å; W211-F270 HydrophobicContact CH2-CE2 4.12Å; W211-F270 AromaticContact CZ3-CD2 3.94Å; W211-F270 HydrophobicContact CZ3-CD2 3.94Å; W211-F270 HydrophobicContact CZ3-CE2 4.46Å; W211-L273 HydrophobicContact CH2-CD1 3.67Å; W211-L273 HydrophobicContact CH2-CD2 4.21Å; W211-L273 HydrophobicContact CZ3-CD1 4.21Å; W211-L273 HydrophobicContact CZ3-CD2 4.35Å; W211-N488 WeakPolarHBondContact CB-ND2 3.25Å; W211-L490 HydrophobicContact CH2-CD1 4.31Å; W211-L490 HydrophobicContact CZ2-CD1 3.67Å; W211-L490 HydrophobicContact CZ2-CD2 4.03Å; W211-L490 HydrophobicContact CZ2-CG 4.48Å
212	T	90.9	Very high	91.6	Very high	40 Å²	40	55.4 Å²	55.4	25%	0.245	27%	0.266	C	S	.	.			trans	-102.2	23.8	174.5	61.5	0	0	0	0	112.2	K214 E217 I219	T212-K214 PolarHBondContact O-N 3.41Å; T212-E217 PolarHBondContact N-O 2.98Å; T212-E217 VanDerWaalsContact OG1-CB 3.25Å; T212-E217 WeakPolarHBondContact OG1-CB 3.14Å; T212-E217 WeakPolarHBondContact OG1-CG 3.34Å; T212-E217 PolarHBondContact OG1-O 3.1Å; T212-E217 PolarHBondContact OG1-OE1 3.09Å; T212-I219 HydrophobicContact CG2-CB 3.79Å; T212-I219 HydrophobicContact CG2-CG2 3.76Å
213	N	75.5	Confident	92	Very high	98 Å²	98	54.1 Å²	54.1	52%	0.524	26%	0.257	S	S	.	.	S	Bend	trans	57.8	10.7	-179.2	-64	-8.6	0	0	0	116.4	N488	N213-N488 PolarHBondContact OD1-ND2 2.69Å
214	K	77.8	Confident	92.5	Very high	110 Å²	110	53 Å²	53	48%	0.478	25%	0.248	S	C	.	.	S	Bend	trans	-98.6	159.2	166.2	-67.6	172.7	170.9	-169.2	0	110.9	T212 G216 E217	T212-K214 PolarHBondContact O-N 3.41Å; K214-G216 PolarHBondContact O-N 3.17Å; K214-E217 HydrophobicContact CB-CB 3.75Å; K214-E217 WeakPolarHBondContact CD-OE2 3.32Å; K214-E217 PolarHBondContact O-N 2.96Å
215	R	83.7	Confident	92.7	Very high	80 Å²	80	47.4 Å²	47.4	30%	0.302	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	89.4	-173.8	-69.1	-180	172	155.6	6.2	113.7	E217 Q269 Q521 I525	R215-E217 PolarHBondContact O-N 2.93Å; R215-Q269 PolarHBondContact O-NE2 3.44Å; R215-Q521 VanDerWaalsContact NH2-C 3.3Å; R215-Q521 PolarHBondContact NH2-O 3.49Å; R215-I525 VanDerWaalsContact NH2-CD1 3.28Å
216	G	89.1	Confident	92.9	Very high	4 Å²	4	46.2 Å²	46.2	4%	0.041	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	17.5	-176	0	0	0	0	0	115.6	K214 Q269 F270	K214-G216 PolarHBondContact O-N 3.17Å; G216-Q269 CarbonylContact O-C 2.85Å; G216-Q269 WeakPolarHBondContact O-CA 3.37Å; G216-F270 PolarHBondContact O-N 2.94Å
217	E	94.9	Very high	93.1	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.033	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.7	174.5	-167.6	-172.2	113.2	0	0	109.8	W211 T212 K214 R215 V261 R264 V267 Y268 Q269	W211-E217 WeakPolarHBondContact CA-O 3.21Å; T212-E217 PolarHBondContact N-O 2.98Å; T212-E217 VanDerWaalsContact OG1-CB 3.25Å; T212-E217 WeakPolarHBondContact OG1-CB 3.14Å; T212-E217 WeakPolarHBondContact OG1-CG 3.34Å; T212-E217 PolarHBondContact OG1-O 3.1Å; T212-E217 PolarHBondContact OG1-OE1 3.09Å; K214-E217 HydrophobicContact CB-CB 3.75Å; K214-E217 WeakPolarHBondContact CD-OE2 3.32Å; K214-E217 PolarHBondContact O-N 2.96Å; R215-E217 PolarHBondContact O-N 2.93Å; E217-V261 HydrophobicContact CG-CG2 4.01Å; E217-R264 IonicContact OE1-NH1 2.86Å; E217-R264 PolarHBondContact OE1-NH1 3.02Å; E217-V267 HydrophobicContact CG-CG1 3.55Å; E217-V267 WeakPolarHBondContact OE1-CG1 3.3Å; E217-Y268 CarbonylContact C-O 3.55Å; E217-Y268 WeakPolarHBondContact CA-O 3.18Å; E217-Y268 WeakPolarHBondContact CG-O 3.39Å; E217-Q269 HydrophobicContact CB-CB 4.39Å; E217-Q269 HydrophobicContact CB-CG 4.21Å; E217-Q269 HydrophobicContact CG-CB 4.48Å
218	F	96.5	Very high	93.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.3	-178.2	66.4	-85.7	0	0	0	111.5	L200 I209 R210 W211 L220 I258 V267 Y268 F270	L200-F218 HydrophobicContact CD1-CB 3.7Å; L200-F218 HydrophobicContact CD1-CD1 4.05Å; L200-F218 HydrophobicContact CD1-CD2 3.81Å; L200-F218 HydrophobicContact CD1-CE2 4.38Å; L200-F218 HydrophobicContact CD1-CG 3.6Å; L200-F218 HydrophobicContact CD2-CB 3.88Å; L200-F218 HydrophobicContact CG-CB 4.47Å; I209-F218 HydrophobicContact CD1-CD2 4.26Å; I209-F218 HydrophobicContact CD1-CE2 4.46Å; I209-F218 HydrophobicContact CG1-CD2 4.39Å; R210-F218 CarbonylContact O-C 3.35Å; R210-F218 VanDerWaalsContact O-CA 3.23Å; R210-F218 WeakPolarHBondContact O-CA 3.39Å; R210-F218 WeakPolarHBondContact O-CB 3.39Å; W211-F218 HydrophobicContact CE3-CB 4.03Å; W211-F218 HydrophobicContact CZ3-CB 4.32Å; W211-F218 HydrophobicContact CZ3-CD1 4.39Å; F218-L220 HydrophobicContact CD2-CD2 4.04Å; F218-L220 HydrophobicContact CE2-CD2 3.84Å; F218-I258 HydrophobicContact CE1-CG2 4.3Å; F218-I258 HydrophobicContact CZ-CD1 4.23Å; F218-I258 HydrophobicContact CZ-CG2 4.24Å; F218-V267 WeakPolarHBondContact O-CA 3.38Å; F218-Y268 HydrophobicContact CE2-CD2 4.49Å; F218-Y268 HydrophobicContact CE2-CG 4.48Å; F218-Y268 VanDerWaalsContact CZ-CB 3.44Å; F218-Y268 HydrophobicContact CZ-CG 4.34Å; F218-Y268 PolarHBondContact N-O 3.47Å; F218-Y268 PolarHBondContact O-N 3.37Å; F218-Y268 VanDerWaalsContact O-O 3.08Å; F218-F270 AromaticContact CD1-CD2 3.63Å; F218-F270 HydrophobicContact CD1-CD2 3.63Å; F218-F270 AromaticContact CD1-CE2 3.78Å; F218-F270 HydrophobicContact CD1-CE2 3.78Å; F218-F270 AromaticContact CE1-CD2 3.4Å; F218-F270 HydrophobicContact CE1-CD2 3.4Å; F218-F270 AromaticContact CE1-CE2 3.41Å; F218-F270 HydrophobicContact CE1-CE2 3.41Å; F218-F270 VanDerWaalsContact CE1-CE2 3.41Å; F218-F270 HydrophobicContact CE1-CG 4.25Å; F218-F270 HydrophobicContact CE1-CZ 4.28Å; F218-F270 HydrophobicContact CZ-CD2 4.38Å; F218-F270 AromaticContact CZ-CE2 3.99Å; F218-F270 HydrophobicContact CZ-CE2 3.99Å
219	I	96.8	Very high	93	Very high	46 Å²	46	43.9 Å²	43.9	24%	0.236	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.5	176.4	-170.8	168.7	0	0	0	109.7	I209 R210 T212 V221 F266 V267	I209-I219 WeakPolarHBondContact CA-O 3.38Å; R210-I219 HydrophobicContact CG-CG2 3.71Å; R210-I219 PolarHBondContact N-O 3.44Å; R210-I219 PolarHBondContact O-N 2.91Å; T212-I219 HydrophobicContact CG2-CB 3.79Å; T212-I219 HydrophobicContact CG2-CG2 3.76Å; I219-V221 HydrophobicContact CG2-CG2 3.99Å; I219-V221 PolarHBondContact O-N 3.42Å; I219-F266 HydrophobicContact CG1-CB 4.37Å; I219-V267 HydrophobicContact CB-CG2 4.01Å; I219-V267 HydrophobicContact CD1-CG2 3.83Å; I219-V267 HydrophobicContact CG1-CG2 3.83Å
220	L	97.5	Very high	92.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	100.3	163.4	-41.7	-177	0	0	0	106.8	L196 I209 F218 Q222 A223 V226 Y242 L245 F266 Y268	L196-L220 HydrophobicContact CD2-CD2 4.31Å; I209-L220 HydrophobicContact CD1-CD2 3.49Å; I209-L220 VanDerWaalsContact CD1-CD2 3.49Å; I209-L220 HydrophobicContact CG1-CD2 3.76Å; F218-L220 HydrophobicContact CD2-CD2 4.04Å; F218-L220 HydrophobicContact CE2-CD2 3.84Å; L220-Q222 VanDerWaalsContact C-N 3.34Å; L220-A223 HydrophobicContact CB-CB 4.03Å; L220-A223 HydrophobicContact CD1-CB 4.3Å; L220-V226 HydrophobicContact CB-CG2 4.25Å; L220-V226 HydrophobicContact CD2-CG1 4.26Å; L220-V226 HydrophobicContact CD2-CG2 4.26Å; L220-Y242 HydrophobicContact CD1-CD2 4.05Å; L220-Y242 HydrophobicContact CD1-CE2 3.65Å; L220-L245 HydrophobicContact CD1-CD2 4.32Å; L220-F266 HydrophobicContact CB-CB 4.2Å; L220-F266 PolarHBondContact N-O 3.41Å; L220-F266 VanDerWaalsContact N-O 3.12Å; L220-F266 WeakPolarHBondContact O-CB 3.24Å; L220-Y268 HydrophobicContact CD1-CE2 4.37Å; L220-Y268 HydrophobicContact CG-CD2 4.48Å
221	V	96.7	Very high	92.8	Very high	68 Å²	68	39.4 Å²	39.4	41%	0.412	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-41.6	179.9	-174.7	0	0	0	0	110	I208 R210 I219	I208-V221 PolarHBondContact O-N 2.96Å; R210-V221 HydrophobicContact CG-CG2 3.83Å; I219-V221 HydrophobicContact CG2-CG2 3.99Å; I219-V221 PolarHBondContact O-N 3.42Å
222	Q	96.9	Very high	92.6	Very high	60 Å²	60	44.3 Å²	44.3	28%	0.28	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.3	77	177.4	-61.8	-170.3	69.2	0	0	109.3	H207 I208 L220 E224 I225 V226	H207-Q222 PolarHBondContact O-NE2 3.2Å; I208-Q222 HydrophobicContact CG1-CB 4.46Å; I208-Q222 PolarHBondContact O-N 2.8Å; L220-Q222 VanDerWaalsContact C-N 3.34Å; Q222-E224 VanDerWaalsContact C-N 3.27Å; Q222-E224 PolarHBondContact O-N 3.35Å; Q222-I225 HydrophobicContact CB-CB 4.16Å; Q222-I225 HydrophobicContact CB-CD1 3.94Å; Q222-I225 HydrophobicContact CB-CG1 4.05Å; Q222-I225 HydrophobicContact CG-CD1 4.44Å; Q222-I225 PolarHBondContact O-N 2.91Å; Q222-V226 PolarHBondContact O-N 3.13Å; Q222-V226 VanDerWaalsContact O-N 3.09Å
223	A	96.9	Very high	92.5	Very high	10 Å²	10	45.1 Å²	45.1	8%	0.083	22%	0.216	C	C	.	.	H	α-helix	trans	-56	-35.3	-170.4	0	0	0	0	0	114.5	L220 V226 A227 Y242 F266	L220-A223 HydrophobicContact CB-CB 4.03Å; L220-A223 HydrophobicContact CD1-CB 4.3Å; A223-V226 PolarHBondContact O-N 3.43Å; A223-A227 PolarHBondContact O-N 3.2Å; A223-Y242 HydrophobicContact CB-CD1 4.45Å; A223-Y242 HydrophobicContact CB-CD2 3.67Å; A223-Y242 HydrophobicContact CB-CE2 4.15Å; A223-Y242 HydrophobicContact CB-CG 3.82Å; A223-F266 HydrophobicContact CB-CD1 3.42Å; A223-F266 VanDerWaalsContact CB-CD1 3.42Å; A223-F266 HydrophobicContact CB-CE1 3.55Å; A223-F266 HydrophobicContact CB-CG 4.24Å; A223-F266 HydrophobicContact CB-CZ 4.46Å
224	E	96	Very high	93	Very high	99 Å²	99	44.4 Å²	44.4	46%	0.463	21%	0.208	S	C	.	.	H	α-helix	trans	-71.2	-30.6	174.6	-65.8	-57.5	159.1	0	0	113.2	Q222 A227 K228 N241 Y242	Q222-E224 VanDerWaalsContact C-N 3.27Å; Q222-E224 PolarHBondContact O-N 3.35Å; E224-A227 PolarHBondContact O-N 3.35Å; E224-K228 WeakPolarHBondContact O-CG 3.47Å; E224-K228 PolarHBondContact O-N 2.57Å; E224-N241 WeakPolarHBondContact OE2-CA 3.3Å; E224-Y242 WeakPolarHBondContact OE1-CB 3.49Å; E224-Y242 PolarHBondContact OE1-N 3.05Å; E224-Y242 PolarHBondContact OE2-N 3.35Å
225	I	95.6	Very high	92.6	Very high	19 Å²	19	45 Å²	45	10%	0.097	22%	0.217	C	C	.	.	H	α-helix	trans	-72	-40.3	173.8	-57.1	-178.3	0	0	0	110	L171 I208 Q222 A227 K228 L229	L171-I225 HydrophobicContact CD2-CD1 4.07Å; I208-I225 HydrophobicContact CD1-CG2 3.61Å; I208-I225 HydrophobicContact CG1-CB 4.2Å; I208-I225 HydrophobicContact CG1-CD1 4.27Å; I208-I225 HydrophobicContact CG1-CG2 3.85Å; I208-I225 HydrophobicContact CG2-CB 4.16Å; I208-I225 HydrophobicContact CG2-CG2 4.08Å; Q222-I225 HydrophobicContact CB-CB 4.16Å; Q222-I225 HydrophobicContact CB-CD1 3.94Å; Q222-I225 HydrophobicContact CB-CG1 4.05Å; Q222-I225 HydrophobicContact CG-CD1 4.44Å; Q222-I225 PolarHBondContact O-N 2.91Å; I225-A227 PolarHBondContact O-N 3.08Å; I225-K228 PolarHBondContact O-N 2.94Å; I225-L229 HydrophobicContact CG2-CD1 4.07Å; I225-L229 HydrophobicContact CG2-CG 4.19Å; I225-L229 WeakPolarHBondContact O-CB 3.45Å; I225-L229 WeakPolarHBondContact O-CG 3.27Å; I225-L229 PolarHBondContact O-N 3.35Å
226	V	96.7	Very high	91.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-56.3	-40.1	171.3	-178	0	0	0	0	110.8	L196 L199 I208 I209 L220 Q222 A223 W230 L245	L196-V226 HydrophobicContact CD2-CG1 3.49Å; L196-V226 VanDerWaalsContact CD2-CG1 3.49Å; L199-V226 HydrophobicContact CD1-CG1 4.39Å; I208-V226 HydrophobicContact CG2-CG2 3.46Å; I208-V226 VanDerWaalsContact CG2-CG2 3.46Å; I209-V226 HydrophobicContact CB-CG2 4Å; L220-V226 HydrophobicContact CB-CG2 4.25Å; L220-V226 HydrophobicContact CD2-CG1 4.26Å; L220-V226 HydrophobicContact CD2-CG2 4.26Å; Q222-V226 PolarHBondContact O-N 3.13Å; Q222-V226 VanDerWaalsContact O-N 3.09Å; A223-V226 PolarHBondContact O-N 3.43Å; V226-W230 WeakPolarHBondContact O-CB 3.27Å; V226-W230 PolarHBondContact O-N 2.84Å; V226-L245 HydrophobicContact CG1-CD1 3.96Å
227	A	96	Very high	90.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-69.2	-42.6	175.9	0	0	0	0	0	113.5	A223 E224 I225 W230 G231 M240 L245	A223-A227 PolarHBondContact O-N 3.2Å; E224-A227 PolarHBondContact O-N 3.35Å; I225-A227 PolarHBondContact O-N 3.08Å; A227-W230 PolarHBondContact O-N 3.2Å; A227-G231 PolarHBondContact O-N 3.23Å; A227-M240 HydrophobicContact CB-CG 4.25Å; A227-M240 WeakPolarHBondContact O-CB 3.32Å; A227-M240 WeakPolarHBondContact O-CG 3.29Å; A227-L245 HydrophobicContact CB-CB 4.47Å; A227-L245 HydrophobicContact CB-CD1 4.21Å
228	K	94	Very high	89.3	Confident	105 Å²	105	59.2 Å²	59.2	46%	0.457	28%	0.284	S	S	.	.	H	α-helix	trans	-57.9	-51.2	172.5	-74.2	175.4	-179.3	-175.8	0	111.2	E224 I225 W230 G231 M232	E224-K228 WeakPolarHBondContact O-CG 3.47Å; E224-K228 PolarHBondContact O-N 2.57Å; I225-K228 PolarHBondContact O-N 2.94Å; K228-W230 VanDerWaalsContact C-N 3.31Å; K228-W230 PolarHBondContact O-N 2.79Å; K228-G231 CarbonylContact O-C 3.58Å; K228-G231 WeakPolarHBondContact O-CA 3Å; K228-G231 PolarHBondContact O-N 3.17Å; K228-M232 WeakPolarHBondContact O-CG 3.25Å; K228-M232 PolarHBondContact O-N 3.07Å
229	L	94.1	Very high	88.8	Confident	31 Å²	31	68.4 Å²	68.4	16%	0.162	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-39.4	177.9	-67.7	172	0	0	0	111.9	F195 L199 Y205 I208 I225 G231 M232 R233	F195-L229 HydrophobicContact CZ-CB 3.79Å; L199-L229 HydrophobicContact CD1-CD1 4.43Å; Y205-L229 HydrophobicContact CD1-CD1 4.35Å; Y205-L229 HydrophobicContact CE1-CD1 4.05Å; I208-L229 HydrophobicContact CD1-CD1 4.34Å; I208-L229 HydrophobicContact CG2-CD1 4.32Å; I225-L229 HydrophobicContact CG2-CD1 4.07Å; I225-L229 HydrophobicContact CG2-CG 4.19Å; I225-L229 WeakPolarHBondContact O-CB 3.45Å; I225-L229 WeakPolarHBondContact O-CG 3.27Å; I225-L229 PolarHBondContact O-N 3.35Å; L229-G231 VanDerWaalsContact C-N 3.34Å; L229-M232 HydrophobicContact CD2-SD 4.27Å; L229-M232 PolarHBondContact O-N 3.47Å; L229-R233 VanDerWaalsContact O-CB 3.29Å; L229-R233 WeakPolarHBondContact O-CB 3.42Å; L229-R233 PolarHBondContact O-N 2.68Å
230	W	94.4	Very high	88.5	Confident	19 Å²	19	67.4 Å²	67.4	7%	0.072	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-33.9	173.2	179.8	-132.2	0	0	0	113.1	L192 F195 V226 A227 K228 K234 M240 L245	L192-W230 HydrophobicContact CB-CH2 4.04Å; L192-W230 HydrophobicContact CB-CZ2 3.58Å; L192-W230 HydrophobicContact CD1-CD2 3.78Å; L192-W230 HydrophobicContact CD1-CE3 4.35Å; L192-W230 HydrophobicContact CD1-CG 3.9Å; L192-W230 HydrophobicContact CD1-CZ2 4.29Å; L192-W230 HydrophobicContact CG-CZ2 4.48Å; F195-W230 HydrophobicContact CB-CE3 3.89Å; F195-W230 HydrophobicContact CB-CZ3 3.74Å; F195-W230 HydrophobicContact CD1-CB 4.15Å; F195-W230 HydrophobicContact CD1-CD2 4.1Å; F195-W230 AromaticContact CD1-CE3 3.52Å; F195-W230 HydrophobicContact CD1-CE3 3.52Å; F195-W230 HydrophobicContact CD1-CG 4.39Å; F195-W230 HydrophobicContact CD1-CZ3 4.27Å; F195-W230 HydrophobicContact CD2-CE3 4.24Å; F195-W230 HydrophobicContact CE1-CB 3.6Å; F195-W230 HydrophobicContact CE1-CD2 4.44Å; F195-W230 HydrophobicContact CE1-CE3 4.08Å; F195-W230 HydrophobicContact CE1-CG 4.32Å; F195-W230 AromaticContact CG-CE3 3.6Å; F195-W230 HydrophobicContact CG-CE3 3.6Å; F195-W230 AromaticContact CG-CZ3 3.98Å; F195-W230 HydrophobicContact CG-CZ3 3.98Å; F195-W230 HydrophobicContact CZ-CB 4.16Å; V226-W230 WeakPolarHBondContact O-CB 3.27Å; V226-W230 PolarHBondContact O-N 2.84Å; A227-W230 PolarHBondContact O-N 3.2Å; K228-W230 VanDerWaalsContact C-N 3.31Å; K228-W230 PolarHBondContact O-N 2.79Å; W230-K234 HydrophobicContact CD2-CD 4.14Å; W230-K234 HydrophobicContact CD2-CG 4.46Å; W230-K234 HydrophobicContact CE3-CD 4.34Å; W230-K234 HydrophobicContact CE3-CG 4.24Å; W230-K234 HydrophobicContact CH2-CD 3.8Å; W230-K234 HydrophobicContact CH2-CG 4.09Å; W230-K234 HydrophobicContact CZ2-CD 3.56Å; W230-K234 HydrophobicContact CZ2-CG 4.32Å; W230-K234 HydrophobicContact CZ3-CD 4.19Å; W230-K234 HydrophobicContact CZ3-CG 4.05Å; W230-K234 PolarHBondContact O-N 2.87Å; W230-M240 HydrophobicContact CB-CG 4.48Å; W230-L245 HydrophobicContact CB-CD1 3.93Å; W230-L245 HydrophobicContact CG-CD1 4.15Å
231	G	92.9	Very high	88.3	Confident	2 Å²	2	69.8 Å²	69.8	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-66.8	-39.7	173	0	0	0	0	0	113.3	A227 K228 L229 N237	A227-G231 PolarHBondContact O-N 3.23Å; K228-G231 CarbonylContact O-C 3.58Å; K228-G231 WeakPolarHBondContact O-CA 3Å; K228-G231 PolarHBondContact O-N 3.17Å; L229-G231 VanDerWaalsContact C-N 3.34Å; G231-N237 WeakPolarHBondContact CA-O 3.22Å; G231-N237 CarbonylContact O-C 3.52Å; G231-N237 PolarHBondContact O-N 3.47Å
232	M	91	Very high	88.3	Confident	132 Å²	132	68.3 Å²	68.3	65%	0.65	31%	0.314	S	S	*	.	H	α-helix	trans	-68.2	-51.1	174.9	-67.5	164.9	71.1	0	0	111.5	K228 L229 K234 D235	K228-M232 WeakPolarHBondContact O-CG 3.25Å; K228-M232 PolarHBondContact O-N 3.07Å; L229-M232 HydrophobicContact CD2-SD 4.27Å; L229-M232 PolarHBondContact O-N 3.47Å; M232-K234 PolarHBondContact O-N 3.04Å; M232-D235 WeakPolarHBondContact O-CA 3.29Å; M232-D235 PolarHBondContact O-N 3.43Å
233	R	90.1	Very high	88.3	Confident	56 Å²	56	68.4 Å²	68.4	21%	0.211	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-7.9	-179	-180	57.4	78.2	76.2	2.3	114.6	T181 L190 F195 E198 L229	T181-R233 PolarHBondContact OG1-NH2 3.01Å; L190-R233 HydrophobicContact CD2-CG 3.66Å; F195-R233 HydrophobicContact CD2-CB 4.12Å; F195-R233 HydrophobicContact CD2-CG 3.73Å; F195-R233 HydrophobicContact CE2-CB 3.82Å; F195-R233 HydrophobicContact CE2-CG 3.92Å; E198-R233 IonicContact OE1-CZ 2.64Å; E198-R233 VanDerWaalsContact OE1-CZ 3.23Å; E198-R233 IonicContact OE1-NH1 2.89Å; E198-R233 PolarHBondContact OE1-NH1 2.8Å; E198-R233 IonicContact OE1-NH2 2.69Å; E198-R233 PolarHBondContact OE1-NH2 3.47Å; E198-R233 IonicContact OE2-CZ 4Å; E198-R233 IonicContact OE2-NH1 2.66Å; E198-R233 PolarHBondContact OE2-NH1 3.41Å; L229-R233 VanDerWaalsContact O-CB 3.29Å; L229-R233 WeakPolarHBondContact O-CB 3.42Å; L229-R233 PolarHBondContact O-N 2.68Å
234	K	85.8	Confident	88.1	Confident	83 Å²	83	72.4 Å²	72.4	36%	0.361	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	5.5	171.3	-75.7	-175.5	69.9	-152.4	0	113.6	W230 M232 K236 N237	W230-K234 HydrophobicContact CD2-CD 4.14Å; W230-K234 HydrophobicContact CD2-CG 4.46Å; W230-K234 HydrophobicContact CE3-CD 4.34Å; W230-K234 HydrophobicContact CE3-CG 4.24Å; W230-K234 HydrophobicContact CH2-CD 3.8Å; W230-K234 HydrophobicContact CH2-CG 4.09Å; W230-K234 HydrophobicContact CZ2-CD 3.56Å; W230-K234 HydrophobicContact CZ2-CG 4.32Å; W230-K234 HydrophobicContact CZ3-CD 4.19Å; W230-K234 HydrophobicContact CZ3-CG 4.05Å; W230-K234 PolarHBondContact O-N 2.87Å; M232-K234 PolarHBondContact O-N 3.04Å; K234-K236 WeakPolarHBondContact O-CB 3.38Å; K234-K236 WeakPolarHBondContact O-CG 3.42Å; K234-K236 PolarHBondContact O-N 3.44Å; K234-N237 WeakPolarHBondContact CE-OD1 3.17Å; K234-N237 PolarHBondContact NZ-OD1 3.18Å
235	D	68	Low	88.1	Confident	124 Å²	124	67.7 Å²	67.7	66%	0.663	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	1.1	-179.3	-10.6	-59.5	0	0	0	116.6	M232	M232-D235 WeakPolarHBondContact O-CA 3.29Å; M232-D235 PolarHBondContact O-N 3.43Å
236	K	64.4	Low	88.2	Confident	156 Å²	156	67 Å²	67	68%	0.678	31%	0.307	S	S	*	.	S	Bend	trans	-146.1	8.4	-158.7	-58.2	174.5	-173.5	64.6	0	112.4	K234	K234-K236 WeakPolarHBondContact O-CB 3.38Å; K234-K236 WeakPolarHBondContact O-CG 3.42Å; K234-K236 PolarHBondContact O-N 3.44Å
237	N	67.2	Low	88.1	Confident	56 Å²	56	69.8 Å²	69.8	30%	0.299	32%	0.317	S	S	.	.			trans	-136.1	51.5	-172.1	-73.5	135.9	0	0	0	114.1	G231 K234 R239 M240	G231-N237 WeakPolarHBondContact CA-O 3.22Å; G231-N237 CarbonylContact O-C 3.52Å; G231-N237 PolarHBondContact O-N 3.47Å; K234-N237 WeakPolarHBondContact CE-OD1 3.17Å; K234-N237 PolarHBondContact NZ-OD1 3.18Å; N237-R239 PolarHBondContact O-N 2.95Å; N237-M240 HydrophobicContact CB-CE 4.2Å; N237-M240 VanDerWaalsContact O-CB 3.28Å; N237-M240 WeakPolarHBondContact O-CB 3.46Å; N237-M240 PolarHBondContact O-N 3.42Å
238	H	67.3	Low	88	Confident	176 Å²	176	71.1 Å²	71.1	82%	0.815	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-17.9	170.9	79	101.2	0	0	0	114.6	M240	H238-M240 VanDerWaalsContact C-N 3.3Å; H238-M240 PolarHBondContact O-N 2.92Å
239	R	85.6	Confident	88.2	Confident	193 Å²	193	66.1 Å²	66.1	73%	0.728	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	19.6	174.1	-56.3	-177.4	66.9	-160.2	0.2	114	N237 K244	N237-R239 PolarHBondContact O-N 2.95Å; R239-K244 PolarHBondContact O-NZ 3.02Å
240	M	90.7	Very high	88.3	Confident	26 Å²	26	69.2 Å²	69.2	13%	0.128	32%	0.316	C	S	.	.			trans	-77.4	132.5	171.8	-167.9	64.6	67.4	0	0	109.8	A227 W230 N237 H238 K244	A227-M240 HydrophobicContact CB-CG 4.25Å; A227-M240 WeakPolarHBondContact O-CB 3.32Å; A227-M240 WeakPolarHBondContact O-CG 3.29Å; W230-M240 HydrophobicContact CB-CG 4.48Å; N237-M240 HydrophobicContact CB-CE 4.2Å; N237-M240 VanDerWaalsContact O-CB 3.28Å; N237-M240 WeakPolarHBondContact O-CB 3.46Å; N237-M240 PolarHBondContact O-N 3.42Å; H238-M240 VanDerWaalsContact C-N 3.3Å; H238-M240 PolarHBondContact O-N 2.92Å; M240-K244 HydrophobicContact SD-CB 3.92Å
241	N	94.8	Very high	88.4	Confident	50 Å²	50	73.4 Å²	73.4	27%	0.267	33%	0.332	S	S	.	.			trans	-137.9	166.4	177.8	61.8	-31.4	0	0	0	108.2	E224 D243 K244 L245	E224-N241 WeakPolarHBondContact OE2-CA 3.3Å; N241-D243 VanDerWaalsContact C-N 3.29Å; N241-D243 PolarHBondContact O-N 3.49Å; N241-K244 PolarHBondContact O-N 3.3Å; N241-K244 WeakPolarHBondContact OD1-CD 3.45Å; N241-K244 VanDerWaalsContact OD1-CG 3.23Å; N241-K244 WeakPolarHBondContact OD1-CG 3.33Å; N241-K244 PolarHBondContact OD1-NZ 3.14Å; N241-L245 PolarHBondContact O-N 3.2Å
242	Y	96.9	Very high	88.5	Confident	38 Å²	38	74.7 Å²	74.7	15%	0.149	34%	0.337	C	S	.	.	H	α-helix	trans	-59	-39.3	-174.6	171	-111.6	0	0	0	112.9	L220 A223 E224 K244 L245 S246 F266 Y268	L220-Y242 HydrophobicContact CD1-CD2 4.05Å; L220-Y242 HydrophobicContact CD1-CE2 3.65Å; A223-Y242 HydrophobicContact CB-CD1 4.45Å; A223-Y242 HydrophobicContact CB-CD2 3.67Å; A223-Y242 HydrophobicContact CB-CE2 4.15Å; A223-Y242 HydrophobicContact CB-CG 3.82Å; E224-Y242 WeakPolarHBondContact OE1-CB 3.49Å; E224-Y242 PolarHBondContact OE1-N 3.05Å; E224-Y242 PolarHBondContact OE2-N 3.35Å; Y242-K244 PolarHBondContact O-N 2.89Å; Y242-L245 CarbonylContact O-C 3.38Å; Y242-L245 WeakPolarHBondContact O-CA 3.28Å; Y242-L245 WeakPolarHBondContact O-CB 3.4Å; Y242-L245 PolarHBondContact O-N 3.17Å; Y242-L245 VanDerWaalsContact O-N 3.08Å; Y242-S246 WeakPolarHBondContact O-CB 3.43Å; Y242-S246 PolarHBondContact O-N 3.23Å; Y242-F266 HydrophobicContact CD1-CD1 4.37Å; Y242-F266 AromaticContact CD1-CE1 3.76Å; Y242-F266 HydrophobicContact CD1-CE1 3.76Å; Y242-F266 AromaticContact CE1-CD1 3.8Å; Y242-F266 HydrophobicContact CE1-CD1 3.8Å; Y242-F266 AromaticContact CE1-CE1 3.43Å; Y242-F266 HydrophobicContact CE1-CE1 3.43Å; Y242-F266 VanDerWaalsContact CE1-CE1 3.43Å; Y242-F266 HydrophobicContact CE2-CD1 4.03Å; Y242-F266 HydrophobicContact CE2-CE1 4.38Å; Y242-F266 HydrophobicContact CG-CE1 4.34Å; Y242-F266 AromaticContact CZ-CD1 3.57Å; Y242-F266 AromaticContact CZ-CE1 3.74Å; Y242-Y268 PolarHBondContact OH-OH 3.11Å
243	D	95.4	Very high	88.7	Confident	62 Å²	62	72 Å²	72	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-46.8	-58.8	175.5	153.4	57.9	0	0	0	112.4	N241 L245 S246 R247	N241-D243 VanDerWaalsContact C-N 3.29Å; N241-D243 PolarHBondContact O-N 3.49Å; D243-L245 VanDerWaalsContact C-N 3.28Å; D243-L245 PolarHBondContact O-N 2.89Å; D243-S246 CarbonylContact O-C 3.56Å; D243-S246 WeakPolarHBondContact O-CA 3.47Å; D243-S246 VanDerWaalsContact O-CB 3.3Å; D243-S246 WeakPolarHBondContact O-CB 3.34Å; D243-S246 PolarHBondContact O-N 3.4Å; D243-S246 PolarHBondContact O-OG 2.81Å; D243-R247 PolarHBondContact O-N 3.41Å
244	K	93.9	Very high	88.8	Confident	94 Å²	94	77.8 Å²	77.8	41%	0.409	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-30.5	179.9	-63.9	-179.5	-160.5	95.5	0	113.2	R239 M240 N241 Y242 A248	R239-K244 PolarHBondContact O-NZ 3.02Å; M240-K244 HydrophobicContact SD-CB 3.92Å; N241-K244 PolarHBondContact O-N 3.3Å; N241-K244 WeakPolarHBondContact OD1-CD 3.45Å; N241-K244 VanDerWaalsContact OD1-CG 3.23Å; N241-K244 WeakPolarHBondContact OD1-CG 3.33Å; N241-K244 PolarHBondContact OD1-NZ 3.14Å; Y242-K244 PolarHBondContact O-N 2.89Å; K244-A248 PolarHBondContact O-N 3.44Å
245	L	96.1	Very high	89.1	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-70	-41.1	172.3	-169.6	152.5	0	0	0	110.6	L192 L220 V226 A227 W230 N241 Y242 D243 R247 A248 L249	L192-L245 HydrophobicContact CD1-CD1 3.97Å; L192-L245 HydrophobicContact CD1-CD2 4.41Å; L192-L245 HydrophobicContact CD1-CG 3.96Å; L192-L245 HydrophobicContact CD2-CD2 4.27Å; L192-L245 HydrophobicContact CD2-CG 4.01Å; L220-L245 HydrophobicContact CD1-CD2 4.32Å; V226-L245 HydrophobicContact CG1-CD1 3.96Å; A227-L245 HydrophobicContact CB-CB 4.47Å; A227-L245 HydrophobicContact CB-CD1 4.21Å; W230-L245 HydrophobicContact CB-CD1 3.93Å; W230-L245 HydrophobicContact CG-CD1 4.15Å; N241-L245 PolarHBondContact O-N 3.2Å; Y242-L245 CarbonylContact O-C 3.38Å; Y242-L245 WeakPolarHBondContact O-CA 3.28Å; Y242-L245 WeakPolarHBondContact O-CB 3.4Å; Y242-L245 PolarHBondContact O-N 3.17Å; Y242-L245 VanDerWaalsContact O-N 3.08Å; D243-L245 VanDerWaalsContact C-N 3.28Å; D243-L245 PolarHBondContact O-N 2.89Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 3.18Å; L245-A248 WeakPolarHBondContact O-CB 3.26Å; L245-A248 PolarHBondContact O-N 3.22Å; L245-L249 HydrophobicContact CD2-CD1 3.73Å; L245-L249 HydrophobicContact CD2-CG 4.06Å; L245-L249 PolarHBondContact O-N 2.89Å
246	S	96.8	Very high	90.3	Very high	5 Å²	5	79.9 Å²	79.9	4%	0.035	36%	0.358	C	S	.	.	H	α-helix	trans	-62	-41	174.6	97	0	0	0	0	111	Y242 D243 A248 L249 R250	Y242-S246 WeakPolarHBondContact O-CB 3.43Å; Y242-S246 PolarHBondContact O-N 3.23Å; D243-S246 CarbonylContact O-C 3.56Å; D243-S246 WeakPolarHBondContact O-CA 3.47Å; D243-S246 VanDerWaalsContact O-CB 3.3Å; D243-S246 WeakPolarHBondContact O-CB 3.34Å; D243-S246 PolarHBondContact O-N 3.4Å; D243-S246 PolarHBondContact O-OG 2.81Å; S246-A248 VanDerWaalsContact C-N 3.26Å; S246-A248 PolarHBondContact O-N 3.36Å; S246-L249 CarbonylContact O-C 3.51Å; S246-L249 WeakPolarHBondContact O-CA 3.48Å; S246-L249 WeakPolarHBondContact O-CB 3.24Å; S246-L249 PolarHBondContact O-N 2.92Å; S246-R250 WeakPolarHBondContact O-CG 3.45Å; S246-R250 PolarHBondContact O-N 3.17Å; S246-R250 PolarHBondContact OG-NH2 3.14Å
247	R	95.6	Very high	91.7	Very high	57 Å²	57	74 Å²	74	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-56.4	-41.5	174.6	-177.1	71.5	-166.5	108	-18	111.4	E60 D243 L245 R250 Y251	E60-R247 VanDerWaalsContact CD-NE 3.35Å; E60-R247 IonicContact OE1-CZ 3.83Å; E60-R247 VanDerWaalsContact OE1-CZ 3.26Å; E60-R247 IonicContact OE1-NE 2.69Å; E60-R247 PolarHBondContact OE1-NE 3.38Å; E60-R247 VanDerWaalsContact OE1-NE 3.07Å; E60-R247 IonicContact OE1-NH2 3.23Å; E60-R247 PolarHBondContact OE1-NH2 3.13Å; E60-R247 IonicContact OE2-CZ 3.26Å; E60-R247 IonicContact OE2-NE 3.07Å; E60-R247 PolarHBondContact OE2-NE 3.11Å; E60-R247 IonicContact OE2-NH2 2.66Å; D243-R247 PolarHBondContact O-N 3.41Å; L245-R247 VanDerWaalsContact C-N 3.34Å; L245-R247 PolarHBondContact O-N 3.18Å; R247-R250 PolarHBondContact O-N 3.47Å; R247-Y251 HydrophobicContact CG-CE2 4.45Å; R247-Y251 VanDerWaalsContact CZ-CZ 3.41Å; R247-Y251 VanDerWaalsContact NH1-CE1 3.35Å; R247-Y251 PolarHBondContact NH2-OH 3.48Å; R247-Y251 VanDerWaalsContact NH2-OH 3.14Å; R247-Y251 WeakPolarHBondContact O-CD2 3.1Å
248	A	93.7	Very high	93	Very high	28 Å²	28	71.4 Å²	71.4	23%	0.231	32%	0.319	C	S	.	.	H	α-helix	trans	-70	-37.8	174.3	0	0	0	0	0	113.1	L192 K244 L245 S246 Y251	L192-A248 HydrophobicContact CD2-CB 3.55Å; K244-A248 PolarHBondContact O-N 3.44Å; L245-A248 WeakPolarHBondContact O-CB 3.26Å; L245-A248 PolarHBondContact O-N 3.22Å; S246-A248 VanDerWaalsContact C-N 3.26Å; S246-A248 PolarHBondContact O-N 3.36Å; A248-Y251 PolarHBondContact O-N 3.5Å
249	L	97	Very high	94.4	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.5	-40.2	172.3	-69.3	177.3	0	0	0	112.4	L192 L196 L245 S246 Y251 Y252 Y253 I258 Y268	L192-L249 HydrophobicContact CD2-CD2 4.13Å; L192-L249 HydrophobicContact CD2-CG 4.24Å; L196-L249 HydrophobicContact CD1-CD2 3.7Å; L245-L249 HydrophobicContact CD2-CD1 3.73Å; L245-L249 HydrophobicContact CD2-CG 4.06Å; L245-L249 PolarHBondContact O-N 2.89Å; S246-L249 CarbonylContact O-C 3.51Å; S246-L249 WeakPolarHBondContact O-CA 3.48Å; S246-L249 WeakPolarHBondContact O-CB 3.24Å; S246-L249 PolarHBondContact O-N 2.92Å; L249-Y251 VanDerWaalsContact C-N 3.26Å; L249-Y251 PolarHBondContact O-N 3.23Å; L249-Y252 HydrophobicContact CD2-CD2 4.09Å; L249-Y252 WeakPolarHBondContact O-CB 3.18Å; L249-Y252 PolarHBondContact O-N 2.9Å; L249-Y253 WeakPolarHBondContact O-CD1 3.12Å; L249-Y253 WeakPolarHBondContact O-CE1 3.37Å; L249-I258 HydrophobicContact CD2-CD1 3.83Å; L249-I258 HydrophobicContact CD2-CG2 4.41Å; L249-Y268 HydrophobicContact CB-CE1 4.09Å; L249-Y268 HydrophobicContact CD1-CD1 4.11Å; L249-Y268 HydrophobicContact CD1-CD2 3.98Å; L249-Y268 HydrophobicContact CD1-CE1 3.75Å; L249-Y268 HydrophobicContact CD1-CE2 3.62Å; L249-Y268 HydrophobicContact CD1-CG 4.21Å; L249-Y268 VanDerWaalsContact CD1-CZ 3.5Å
250	R	96.6	Very high	94.9	Very high	96 Å²	96	61.2 Å²	61.2	36%	0.362	28%	0.275	S	S	.	.	H	α-helix	trans	-56	-37.7	175.9	-66.4	175	-151.3	-151.6	7.3	111.8	S246 R247 Y252 Y253	S246-R250 WeakPolarHBondContact O-CG 3.45Å; S246-R250 PolarHBondContact O-N 3.17Å; S246-R250 PolarHBondContact OG-NH2 3.14Å; R247-R250 PolarHBondContact O-N 3.47Å; R250-Y252 VanDerWaalsContact C-N 3.27Å; R250-Y252 PolarHBondContact O-N 2.79Å; R250-Y253 HydrophobicContact CB-CE2 4.25Å; R250-Y253 HydrophobicContact CG-CE2 4.12Å; R250-Y253 PolarHBondContact O-N 2.77Å
251	Y	95.7	Very high	95.1	Very high	107 Å²	107	61.1 Å²	61.1	42%	0.42	28%	0.276	S	S	.	.	H	α-helix	trans	-69.4	-16.4	175.1	-63.5	-55.4	0	0	0	114.6	E60 R247 A248 L249	E60-Y251 PolarHBondContact OE1-OH 2.82Å; R247-Y251 HydrophobicContact CG-CE2 4.45Å; R247-Y251 VanDerWaalsContact CZ-CZ 3.41Å; R247-Y251 VanDerWaalsContact NH1-CE1 3.35Å; R247-Y251 PolarHBondContact NH2-OH 3.48Å; R247-Y251 VanDerWaalsContact NH2-OH 3.14Å; R247-Y251 WeakPolarHBondContact O-CD2 3.1Å; A248-Y251 PolarHBondContact O-N 3.5Å; L249-Y251 VanDerWaalsContact C-N 3.26Å; L249-Y251 PolarHBondContact O-N 3.23Å
252	Y	96.3	Very high	95	Very high	29 Å²	29	66.7 Å²	66.7	11%	0.114	30%	0.3	C	S	.	.	H	α-helix	trans	-83	-15.9	177	-68.7	-43.7	0	0	0	113.8	L192 W193 L249 R250 K255 N256 I257 I258	L192-Y252 HydrophobicContact CB-CE2 4.01Å; L192-Y252 HydrophobicContact CD2-CE2 4.2Å; L192-Y252 HydrophobicContact CG-CE2 4.23Å; L192-Y252 PolarHBondContact N-OH 2.74Å; W193-Y252 HydrophobicContact CB-CD2 4.45Å; W193-Y252 HydrophobicContact CB-CE2 3.92Å; W193-Y252 AromaticContact CD1-CE1 3.86Å; W193-Y252 AromaticContact CD1-CZ 3.81Å; W193-Y252 PolarHBondContact N-OH 3.09Å; L249-Y252 HydrophobicContact CD2-CD2 4.09Å; L249-Y252 WeakPolarHBondContact O-CB 3.18Å; L249-Y252 PolarHBondContact O-N 2.9Å; R250-Y252 VanDerWaalsContact C-N 3.27Å; R250-Y252 PolarHBondContact O-N 2.79Å; Y252-K255 PolarHBondContact O-N 3.45Å; Y252-N256 PolarHBondContact O-N 3.14Å; Y252-I257 HydrophobicContact CD1-CB 4.32Å; Y252-I257 HydrophobicContact CD1-CD1 3.95Å; Y252-I257 HydrophobicContact CE1-CD1 4.23Å; Y252-I257 HydrophobicContact CG-CB 4.46Å; Y252-I257 PolarHBondContact O-N 3.27Å; Y252-I258 CarbonylContact C-O 3.59Å; Y252-I258 VanDerWaalsContact C-O 3.26Å; Y252-I258 HydrophobicContact CD2-CD1 4.06Å
253	Y	95.4	Very high	94.9	Very high	77 Å²	77	69.2 Å²	69.2	30%	0.302	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-54.4	179.6	-55.1	-6.9	0	0	0	110.2	L249 R250 K255 N256 I258 K260 Y268	L249-Y253 WeakPolarHBondContact O-CD1 3.12Å; L249-Y253 WeakPolarHBondContact O-CE1 3.37Å; R250-Y253 HydrophobicContact CB-CE2 4.25Å; R250-Y253 HydrophobicContact CG-CE2 4.12Å; R250-Y253 PolarHBondContact O-N 2.77Å; Y253-K255 PolarHBondContact O-N 3.49Å; Y253-N256 PolarHBondContact O-N 3.16Å; Y253-N256 VanDerWaalsContact O-N 3.15Å; Y253-I258 WeakPolarHBondContact CA-O 3.37Å; Y253-I258 WeakPolarHBondContact CD1-O 3.31Å; Y253-I258 PolarHBondContact N-O 3.29Å; Y253-K260 HydrophobicContact CE1-CB 4.12Å; Y253-K260 HydrophobicContact CE2-CB 4.16Å; Y253-Y268 HydrophobicContact CE1-CE1 4.27Å
254	Q	92.2	Very high	94.9	Very high	176 Å²	176	71.7 Å²	71.7	82%	0.822	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.5	177.1	-67.2	177.3	-12.1	0	0	113.5	N256	Q254-N256 VanDerWaalsContact C-N 3.35Å
255	K	92.3	Very high	94.9	Very high	141 Å²	141	71 Å²	71	61%	0.613	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.9	179.9	-66	-178.9	178.2	179.6	0	113.4	Y252 Y253 I257	Y252-K255 PolarHBondContact O-N 3.45Å; Y253-K255 PolarHBondContact O-N 3.49Å; K255-I257 VanDerWaalsContact C-N 3.26Å; K255-I257 HydrophobicContact CB-CD1 4.16Å; K255-I257 HydrophobicContact CB-CG1 4.02Å; K255-I257 PolarHBondContact O-N 3.2Å
256	N	92.6	Very high	95	Very high	111 Å²	111	74.6 Å²	74.6	59%	0.594	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.9	-176.7	-64	-60.5	0	0	0	113.6	Y252 Y253 Q254 I271	Y252-N256 PolarHBondContact O-N 3.14Å; Y253-N256 PolarHBondContact O-N 3.16Å; Y253-N256 VanDerWaalsContact O-N 3.15Å; Q254-N256 VanDerWaalsContact C-N 3.35Å; N256-I271 HydrophobicContact CB-CD1 4.23Å; N256-I271 HydrophobicContact CB-CG2 4.37Å; N256-I271 WeakPolarHBondContact O-CB 3.47Å; N256-I271 WeakPolarHBondContact O-CG2 3.5Å
257	I	92.7	Very high	95	Very high	33 Å²	33	74.6 Å²	74.6	17%	0.169	36%	0.355	C	S	.	.	S	Bend	trans	-103.6	-49.9	175.7	-52.1	-178.8	0	0	0	110.5	W193 Y252 K255 F270 I271 L276	W193-I257 HydrophobicContact CB-CG2 3.91Å; W193-I257 HydrophobicContact CD2-CG2 3.97Å; W193-I257 HydrophobicContact CG-CG2 3.68Å; Y252-I257 HydrophobicContact CD1-CB 4.32Å; Y252-I257 HydrophobicContact CD1-CD1 3.95Å; Y252-I257 HydrophobicContact CE1-CD1 4.23Å; Y252-I257 HydrophobicContact CG-CB 4.46Å; Y252-I257 PolarHBondContact O-N 3.27Å; K255-I257 VanDerWaalsContact C-N 3.26Å; K255-I257 HydrophobicContact CB-CD1 4.16Å; K255-I257 HydrophobicContact CB-CG1 4.02Å; K255-I257 PolarHBondContact O-N 3.2Å; I257-F270 WeakPolarHBondContact O-CA 3.44Å; I257-I271 PolarHBondContact O-N 2.79Å; I257-L276 HydrophobicContact CG2-CD1 4.11Å
258	I	96	Very high	95.1	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	141.2	175.1	-64.4	168.4	0	0	0	107.4	W193 L196 F218 L249 Y252 Y253 Y268 Q269 F270	W193-I258 HydrophobicContact CB-CD1 3.92Å; L196-I258 HydrophobicContact CD1-CD1 4.36Å; F218-I258 HydrophobicContact CE1-CG2 4.3Å; F218-I258 HydrophobicContact CZ-CD1 4.23Å; F218-I258 HydrophobicContact CZ-CG2 4.24Å; L249-I258 HydrophobicContact CD2-CD1 3.83Å; L249-I258 HydrophobicContact CD2-CG2 4.41Å; Y252-I258 CarbonylContact C-O 3.59Å; Y252-I258 VanDerWaalsContact C-O 3.26Å; Y252-I258 HydrophobicContact CD2-CD1 4.06Å; Y253-I258 WeakPolarHBondContact CA-O 3.37Å; Y253-I258 WeakPolarHBondContact CD1-O 3.31Å; Y253-I258 PolarHBondContact N-O 3.29Å; I258-Y268 HydrophobicContact CG2-CD1 4.13Å; I258-Y268 HydrophobicContact CG2-CG 4.43Å; I258-Q269 CarbonylContact C-O 3.47Å; I258-Q269 VanDerWaalsContact CA-O 3.31Å; I258-Q269 WeakPolarHBondContact CA-O 3.5Å; I258-F270 HydrophobicContact CD1-CD1 4.2Å; I258-F270 HydrophobicContact CD1-CE1 3.73Å; I258-F270 HydrophobicContact CD1-CZ 3.98Å; I258-F270 HydrophobicContact CG1-CD1 3.64Å; I258-F270 HydrophobicContact CG1-CE1 3.72Å; I258-F270 HydrophobicContact CG1-CG 4.22Å; I258-F270 HydrophobicContact CG1-CZ 4.3Å
259	R	95.3	Very high	95.2	Very high	116 Å²	116	72.1 Å²	72.1	44%	0.438	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	156.9	168.5	59.9	-177.3	177.1	-144.8	6.8	111.5	Y268 Q269 I271	R259-Y268 WeakPolarHBondContact O-CA 3.26Å; R259-Q269 HydrophobicContact CG-CB 3.97Å; R259-Q269 VanDerWaalsContact CZ-OE1 3.23Å; R259-Q269 PolarHBondContact N-O 3.3Å; R259-Q269 VanDerWaalsContact NH2-CD 3.27Å; R259-Q269 PolarHBondContact O-N 3.28Å; R259-I271 HydrophobicContact CB-CD1 4.02Å; R259-I271 HydrophobicContact CB-CG1 4.47Å; R259-I271 HydrophobicContact CG-CD1 4.2Å; R259-I271 HydrophobicContact CG-CG1 4.12Å
260	K	96.2	Very high	95.1	Very high	39 Å²	39	72.3 Å²	72.3	17%	0.17	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.9	166.8	-176.4	61.5	-166.4	155.4	0	110	Y253 R264 V267 Y268	Y253-K260 HydrophobicContact CE1-CB 4.12Å; Y253-K260 HydrophobicContact CE2-CB 4.16Å; K260-R264 WeakPolarHBondContact CE-O 3.41Å; K260-R264 PolarHBondContact NZ-O 3.44Å; K260-V267 PolarHBondContact NZ-O 2.98Å; K260-Y268 HydrophobicContact CB-CE1 4.46Å; K260-Y268 HydrophobicContact CD-CD1 4.08Å; K260-Y268 HydrophobicContact CD-CE1 3.62Å
261	V	94.9	Very high	94.8	Very high	25 Å²	25	69.9 Å²	69.9	15%	0.152	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-95.4	116.5	162.5	-178.2	0	0	0	0	108	E217 R264 V267 Q269	E217-V261 HydrophobicContact CG-CG2 4.01Å; V261-R264 HydrophobicContact CG1-CB 4.35Å; V261-R264 HydrophobicContact CG1-CG 4.32Å; V261-V267 HydrophobicContact CB-CB 4.23Å; V261-V267 HydrophobicContact CB-CG1 3.82Å; V261-V267 HydrophobicContact CG1-CG1 4.33Å; V261-V267 HydrophobicContact CG2-CG1 3.81Å; V261-V267 PolarHBondContact N-O 3.35Å; V261-Q269 HydrophobicContact CG2-CB 4.12Å
262	H	94.3	Very high	94.3	Very high	166 Å²	166	66.8 Å²	66.8	77%	0.769	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	151.8	-179.2	-55.2	108.7	0	0	0	111.3	R264	H262-R264 PolarHBondContact O-N 3.33Å
263	G	93.8	Very high	93.5	Very high	91 Å²	91	66 Å²	66	94%	0.938	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	9.1	-178	0	0	0	0	0	115.5
264	R	94.7	Very high	92.4	Very high	114 Å²	114	65.9 Å²	65.9	43%	0.43	34%	0.335	S	S	.	.			trans	-133.5	108.5	179.7	-68.6	-174.6	168	-156.1	-16.2	111.5	E217 K260 V261 H262 V267	E217-R264 IonicContact OE1-NH1 2.86Å; E217-R264 PolarHBondContact OE1-NH1 3.02Å; K260-R264 WeakPolarHBondContact CE-O 3.41Å; K260-R264 PolarHBondContact NZ-O 3.44Å; V261-R264 HydrophobicContact CG1-CB 4.35Å; V261-R264 HydrophobicContact CG1-CG 4.32Å; H262-R264 PolarHBondContact O-N 3.33Å; R264-V267 HydrophobicContact CB-CB 3.71Å; R264-V267 HydrophobicContact CB-CG1 4.49Å; R264-V267 HydrophobicContact CB-CG2 3.71Å; R264-V267 HydrophobicContact CG-CG2 4.5Å; R264-V267 PolarHBondContact O-N 2.83Å
265	K	95.7	Very high	91.6	Very high	79 Å²	79	62.5 Å²	62.5	34%	0.343	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	140.5	172.8	-64.7	-171.8	-177.4	178.3	0	110.3	E66 Y67 V267	E66-K265 IonicContact OE1-NZ 3.83Å; E66-K265 PolarHBondContact OE1-NZ 2.8Å; E66-K265 VanDerWaalsContact OE2-CE 3.27Å; E66-K265 WeakPolarHBondContact OE2-CE 3.21Å; E66-K265 IonicContact OE2-NZ 2.94Å; E66-K265 PolarHBondContact OE2-NZ 3.05Å; Y67-K265 PolarHBondContact O-NZ 3.23Å; Y67-K265 VanDerWaalsContact O-NZ 3.12Å; K265-V267 PolarHBondContact O-N 2.64Å
266	F	97.2	Very high	90.9	Very high	76 Å²	76	56.8 Å²	56.8	33%	0.333	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	0.8	179.2	-48.2	-71.1	0	0	0	118.7	I219 L220 A223 Y242 Y268	I219-F266 HydrophobicContact CG1-CB 4.37Å; L220-F266 HydrophobicContact CB-CB 4.2Å; L220-F266 PolarHBondContact N-O 3.41Å; L220-F266 VanDerWaalsContact N-O 3.12Å; L220-F266 WeakPolarHBondContact O-CB 3.24Å; A223-F266 HydrophobicContact CB-CD1 3.42Å; A223-F266 VanDerWaalsContact CB-CD1 3.42Å; A223-F266 HydrophobicContact CB-CE1 3.55Å; A223-F266 HydrophobicContact CB-CG 4.24Å; A223-F266 HydrophobicContact CB-CZ 4.46Å; Y242-F266 HydrophobicContact CD1-CD1 4.37Å; Y242-F266 AromaticContact CD1-CE1 3.76Å; Y242-F266 HydrophobicContact CD1-CE1 3.76Å; Y242-F266 AromaticContact CE1-CD1 3.8Å; Y242-F266 HydrophobicContact CE1-CD1 3.8Å; Y242-F266 AromaticContact CE1-CE1 3.43Å; Y242-F266 HydrophobicContact CE1-CE1 3.43Å; Y242-F266 VanDerWaalsContact CE1-CE1 3.43Å; Y242-F266 HydrophobicContact CE2-CD1 4.03Å; Y242-F266 HydrophobicContact CE2-CE1 4.38Å; Y242-F266 HydrophobicContact CG-CE1 4.34Å; Y242-F266 AromaticContact CZ-CD1 3.57Å; Y242-F266 AromaticContact CZ-CE1 3.74Å; F266-Y268 WeakPolarHBondContact O-CD2 3.44Å
267	V	96.9	Very high	90.1	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.036	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.3	176.2	-175.6	0	0	0	0	111.9	E217 F218 I219 K260 V261 R264 K265	E217-V267 HydrophobicContact CG-CG1 3.55Å; E217-V267 WeakPolarHBondContact OE1-CG1 3.3Å; F218-V267 WeakPolarHBondContact O-CA 3.38Å; I219-V267 HydrophobicContact CB-CG2 4.01Å; I219-V267 HydrophobicContact CD1-CG2 3.83Å; I219-V267 HydrophobicContact CG1-CG2 3.83Å; K260-V267 PolarHBondContact NZ-O 2.98Å; V261-V267 HydrophobicContact CB-CB 4.23Å; V261-V267 HydrophobicContact CB-CG1 3.82Å; V261-V267 HydrophobicContact CG1-CG1 4.33Å; V261-V267 HydrophobicContact CG2-CG1 3.81Å; V261-V267 PolarHBondContact N-O 3.35Å; R264-V267 HydrophobicContact CB-CB 3.71Å; R264-V267 HydrophobicContact CB-CG1 4.49Å; R264-V267 HydrophobicContact CB-CG2 3.71Å; R264-V267 HydrophobicContact CG-CG2 4.5Å; R264-V267 PolarHBondContact O-N 2.83Å; K265-V267 PolarHBondContact O-N 2.64Å
268	Y	97.6	Very high	89.1	Confident	7 Å²	7	57 Å²	57	3%	0.027	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	167	-178	-70.1	-82.4	0	0	0	110.2	E217 F218 L220 Y242 L249 Y253 I258 R259 K260 F266	E217-Y268 CarbonylContact C-O 3.55Å; E217-Y268 WeakPolarHBondContact CA-O 3.18Å; E217-Y268 WeakPolarHBondContact CG-O 3.39Å; F218-Y268 HydrophobicContact CE2-CD2 4.49Å; F218-Y268 HydrophobicContact CE2-CG 4.48Å; F218-Y268 VanDerWaalsContact CZ-CB 3.44Å; F218-Y268 HydrophobicContact CZ-CG 4.34Å; F218-Y268 PolarHBondContact N-O 3.47Å; F218-Y268 PolarHBondContact O-N 3.37Å; F218-Y268 VanDerWaalsContact O-O 3.08Å; L220-Y268 HydrophobicContact CD1-CE2 4.37Å; L220-Y268 HydrophobicContact CG-CD2 4.48Å; Y242-Y268 PolarHBondContact OH-OH 3.11Å; L249-Y268 HydrophobicContact CB-CE1 4.09Å; L249-Y268 HydrophobicContact CD1-CD1 4.11Å; L249-Y268 HydrophobicContact CD1-CD2 3.98Å; L249-Y268 HydrophobicContact CD1-CE1 3.75Å; L249-Y268 HydrophobicContact CD1-CE2 3.62Å; L249-Y268 HydrophobicContact CD1-CG 4.21Å; L249-Y268 VanDerWaalsContact CD1-CZ 3.5Å; Y253-Y268 HydrophobicContact CE1-CE1 4.27Å; I258-Y268 HydrophobicContact CG2-CD1 4.13Å; I258-Y268 HydrophobicContact CG2-CG 4.43Å; R259-Y268 WeakPolarHBondContact O-CA 3.26Å; K260-Y268 HydrophobicContact CB-CE1 4.46Å; K260-Y268 HydrophobicContact CD-CD1 4.08Å; K260-Y268 HydrophobicContact CD-CE1 3.62Å; F266-Y268 WeakPolarHBondContact O-CD2 3.44Å
269	Q	95.2	Very high	87.5	Confident	25 Å²	25	63.4 Å²	63.4	12%	0.117	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	127.4	179.9	-173.4	172.8	29.7	0	0	112.3	R215 G216 E217 I258 R259 V261	R215-Q269 PolarHBondContact O-NE2 3.44Å; G216-Q269 CarbonylContact O-C 2.85Å; G216-Q269 WeakPolarHBondContact O-CA 3.37Å; E217-Q269 HydrophobicContact CB-CB 4.39Å; E217-Q269 HydrophobicContact CB-CG 4.21Å; E217-Q269 HydrophobicContact CG-CB 4.48Å; I258-Q269 CarbonylContact C-O 3.47Å; I258-Q269 VanDerWaalsContact CA-O 3.31Å; I258-Q269 WeakPolarHBondContact CA-O 3.5Å; R259-Q269 HydrophobicContact CG-CB 3.97Å; R259-Q269 VanDerWaalsContact CZ-OE1 3.23Å; R259-Q269 PolarHBondContact N-O 3.3Å; R259-Q269 VanDerWaalsContact NH2-CD 3.27Å; R259-Q269 PolarHBondContact O-N 3.28Å; V261-Q269 HydrophobicContact CG2-CB 4.12Å
270	F	94.8	Very high	85.8	Confident	5 Å²	5	58.5 Å²	58.5	2%	0.022	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	128.4	170.6	-79.1	-82	0	0	0	110.8	W193 L196 L197 L200 W211 G216 F218 I257 I258 L273 L276	W193-F270 HydrophobicContact CB-CE1 4.15Å; W193-F270 HydrophobicContact CE3-CE1 4.29Å; L196-F270 HydrophobicContact CB-CZ 4.39Å; L197-F270 HydrophobicContact CB-CE1 4.38Å; L197-F270 HydrophobicContact CB-CE2 4.47Å; L197-F270 HydrophobicContact CB-CZ 3.85Å; L197-F270 HydrophobicContact CD1-CE2 4.45Å; L197-F270 HydrophobicContact CD1-CZ 4.5Å; L200-F270 HydrophobicContact CD1-CE2 3.86Å; W211-F270 AromaticContact CH2-CD2 3.89Å; W211-F270 HydrophobicContact CH2-CD2 3.89Å; W211-F270 HydrophobicContact CH2-CE2 4.12Å; W211-F270 AromaticContact CZ3-CD2 3.94Å; W211-F270 HydrophobicContact CZ3-CD2 3.94Å; W211-F270 HydrophobicContact CZ3-CE2 4.46Å; G216-F270 PolarHBondContact O-N 2.94Å; F218-F270 AromaticContact CD1-CD2 3.63Å; F218-F270 HydrophobicContact CD1-CD2 3.63Å; F218-F270 AromaticContact CD1-CE2 3.78Å; F218-F270 HydrophobicContact CD1-CE2 3.78Å; F218-F270 AromaticContact CE1-CD2 3.4Å; F218-F270 HydrophobicContact CE1-CD2 3.4Å; F218-F270 AromaticContact CE1-CE2 3.41Å; F218-F270 HydrophobicContact CE1-CE2 3.41Å; F218-F270 VanDerWaalsContact CE1-CE2 3.41Å; F218-F270 HydrophobicContact CE1-CG 4.25Å; F218-F270 HydrophobicContact CE1-CZ 4.28Å; F218-F270 HydrophobicContact CZ-CD2 4.38Å; F218-F270 AromaticContact CZ-CE2 3.99Å; F218-F270 HydrophobicContact CZ-CE2 3.99Å; I257-F270 WeakPolarHBondContact O-CA 3.44Å; I258-F270 HydrophobicContact CD1-CD1 4.2Å; I258-F270 HydrophobicContact CD1-CE1 3.73Å; I258-F270 HydrophobicContact CD1-CZ 3.98Å; I258-F270 HydrophobicContact CG1-CD1 3.64Å; I258-F270 HydrophobicContact CG1-CE1 3.72Å; I258-F270 HydrophobicContact CG1-CG 4.22Å; I258-F270 HydrophobicContact CG1-CZ 4.3Å; F270-L273 HydrophobicContact CB-CB 4.25Å; F270-L273 HydrophobicContact CB-CD1 3.73Å; F270-L273 HydrophobicContact CD2-CD1 4.04Å; F270-L273 HydrophobicContact CG-CD1 3.9Å; F270-L276 HydrophobicContact CB-CD1 4.39Å; F270-L276 HydrophobicContact CD1-CD1 3.58Å; F270-L276 HydrophobicContact CE1-CD1 4.32Å; F270-L276 HydrophobicContact CG-CD1 4.41Å
271	I	91.3	Very high	83.6	Confident	44 Å²	44	58.5 Å²	58.5	23%	0.226	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	129.4	172.5	-65.6	163.6	0	0	0	107.8	N256 I257 R259 L273 L276	N256-I271 HydrophobicContact CB-CD1 4.23Å; N256-I271 HydrophobicContact CB-CG2 4.37Å; N256-I271 WeakPolarHBondContact O-CB 3.47Å; N256-I271 WeakPolarHBondContact O-CG2 3.5Å; I257-I271 PolarHBondContact O-N 2.79Å; R259-I271 HydrophobicContact CB-CD1 4.02Å; R259-I271 HydrophobicContact CB-CG1 4.47Å; R259-I271 HydrophobicContact CG-CD1 4.2Å; R259-I271 HydrophobicContact CG-CG1 4.12Å; I271-L273 PolarHBondContact O-N 3.24Å; I271-L276 WeakPolarHBondContact O-CD1 3.48Å
272	G	85.3	Confident	81.2	Confident	42 Å²	42	61.3 Å²	61.3	43%	0.433	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	33.1	177	0	0	0	0	0	114.7	K274 N275 L276	G272-K274 PolarHBondContact O-N 2.96Å; G272-N275 WeakPolarHBondContact O-CB 3.31Å; G272-N275 PolarHBondContact O-N 3.13Å; G272-L276 PolarHBondContact O-N 2.64Å
273	L	79.9	Confident	78.8	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-43.3	-41.9	-178.2	-173.3	78.9	0	0	0	113.9	L197 W211 F270 I271 N275 L276 I277 Y489 L490	L197-L273 HydrophobicContact CD1-CD1 3.87Å; W211-L273 HydrophobicContact CH2-CD1 3.67Å; W211-L273 HydrophobicContact CH2-CD2 4.21Å; W211-L273 HydrophobicContact CZ3-CD1 4.21Å; W211-L273 HydrophobicContact CZ3-CD2 4.35Å; F270-L273 HydrophobicContact CB-CB 4.25Å; F270-L273 HydrophobicContact CB-CD1 3.73Å; F270-L273 HydrophobicContact CD2-CD1 4.04Å; F270-L273 HydrophobicContact CG-CD1 3.9Å; I271-L273 PolarHBondContact O-N 3.24Å; L273-N275 PolarHBondContact O-N 2.99Å; L273-N275 VanDerWaalsContact O-N 3.13Å; L273-L276 PolarHBondContact O-N 2.84Å; L273-L276 VanDerWaalsContact O-N 3.07Å; L273-I277 HydrophobicContact CD1-CD1 4.23Å; L273-I277 HydrophobicContact CD1-CG1 4.23Å; L273-I277 HydrophobicContact CD2-CD1 3.91Å; L273-I277 HydrophobicContact CG-CD1 3.7Å; L273-I277 HydrophobicContact CG-CG1 4.07Å; L273-I277 WeakPolarHBondContact O-CG1 3.43Å; L273-I277 PolarHBondContact O-N 3.23Å; L273-Y489 HydrophobicContact CD2-CD1 4.13Å; L273-Y489 HydrophobicContact CD2-CE1 4.42Å; L273-L490 HydrophobicContact CD2-CD1 4Å
274	K	72.4	Confident	76.4	Confident	76 Å²	76	57.4 Å²	57.4	33%	0.33	29%	0.294	S	S	.	.	H	α-helix	trans	-41.6	-45.4	171.8	-76.9	173	174.6	-179.7	0	112.8	G272 Y489 E522	G272-K274 PolarHBondContact O-N 2.96Å; K274-Y489 VanDerWaalsContact CE-OH 3.27Å; K274-Y489 WeakPolarHBondContact CE-OH 3.38Å; K274-Y489 HydrophobicContact CG-CE1 4.45Å; K274-Y489 VanDerWaalsContact CG-OH 3.23Å; K274-Y489 WeakPolarHBondContact CG-OH 3.36Å; K274-E522 IonicContact NZ-OE1 3.71Å; K274-E522 PolarHBondContact NZ-OE1 3.46Å
275	N	74.4	Confident	73.7	Confident	105 Å²	105	56.7 Å²	56.7	56%	0.561	30%	0.299	S	S	*	.	H	α-helix	trans	-82.3	-39.8	-177.9	-59.9	-21.2	0	0	0	111.7	G272 L273 K278 F279	G272-N275 WeakPolarHBondContact O-CB 3.31Å; G272-N275 PolarHBondContact O-N 3.13Å; L273-N275 PolarHBondContact O-N 2.99Å; L273-N275 VanDerWaalsContact O-N 3.13Å; N275-K278 WeakPolarHBondContact O-CB 3.38Å; N275-K278 PolarHBondContact O-N 3.32Å; N275-F279 HydrophobicContact CB-CE2 4.46Å; N275-F279 WeakPolarHBondContact O-CD2 3.44Å; N275-F279 PolarHBondContact O-N 3.46Å
276	L	77.4	Confident	70.8	Confident	21 Å²	21	57.4 Å²	57.4	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-40.5	-179.3	-62.3	178.5	0	0	0	112.3	W193 L197 I257 F270 I271 G272 L273 F279 C280	W193-L276 HydrophobicContact CE3-CD2 4.45Å; W193-L276 HydrophobicContact CH2-CD2 4.05Å; W193-L276 HydrophobicContact CZ3-CB 4.04Å; W193-L276 HydrophobicContact CZ3-CD2 4.01Å; W193-L276 HydrophobicContact CZ3-CG 4.45Å; L197-L276 HydrophobicContact CD2-CB 4.5Å; I257-L276 HydrophobicContact CG2-CD1 4.11Å; F270-L276 HydrophobicContact CB-CD1 4.39Å; F270-L276 HydrophobicContact CD1-CD1 3.58Å; F270-L276 HydrophobicContact CE1-CD1 4.32Å; F270-L276 HydrophobicContact CG-CD1 4.41Å; I271-L276 WeakPolarHBondContact O-CD1 3.48Å; G272-L276 PolarHBondContact O-N 2.64Å; L273-L276 PolarHBondContact O-N 2.84Å; L273-L276 VanDerWaalsContact O-N 3.07Å; L276-F279 PolarHBondContact O-N 3.07Å; L276-C280 PolarHBondContact O-N 3.08Å
277	I	76.2	Confident	67.6	Low	4 Å²	4	59.6 Å²	59.6	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-43.5	172.5	-62.4	170.3	0	0	0	110	L197 L273 F279 C280 C281 L490 F493	L197-I277 HydrophobicContact CD1-CG1 4.36Å; L197-I277 HydrophobicContact CD2-CG1 4.47Å; L273-I277 HydrophobicContact CD1-CD1 4.23Å; L273-I277 HydrophobicContact CD1-CG1 4.23Å; L273-I277 HydrophobicContact CD2-CD1 3.91Å; L273-I277 HydrophobicContact CG-CD1 3.7Å; L273-I277 HydrophobicContact CG-CG1 4.07Å; L273-I277 WeakPolarHBondContact O-CG1 3.43Å; L273-I277 PolarHBondContact O-N 3.23Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 3.01Å; I277-C280 WeakPolarHBondContact O-CB 3.27Å; I277-C280 PolarHBondContact O-N 2.81Å; I277-C280 VanDerWaalsContact O-N 3.08Å; I277-C281 WeakPolarHBondContact O-CB 3.3Å; I277-C281 PolarHBondContact O-N 2.69Å; I277-C281 PolarHBondContact O-SG 2.87Å; I277-L490 HydrophobicContact CD1-CD1 3.57Å; I277-F493 HydrophobicContact CB-CE1 4.27Å; I277-F493 HydrophobicContact CG2-CD1 3.83Å; I277-F493 HydrophobicContact CG2-CE1 3.42Å; I277-F493 VanDerWaalsContact CG2-CE1 3.42Å; I277-F493 HydrophobicContact CG2-CZ 4.12Å
278	K	70.7	Confident	64.6	Low	144 Å²	144	64.3 Å²	64.3	63%	0.626	37%	0.367	S	S	*	.	H	α-helix	trans	-57.9	-41.7	176.4	-173.9	176.3	179.8	178.7	0	112.2	N275 T282	N275-K278 WeakPolarHBondContact O-CB 3.38Å; N275-K278 PolarHBondContact O-N 3.32Å; K278-T282 VanDerWaalsContact O-CB 3.3Å; K278-T282 WeakPolarHBondContact O-CB 3.23Å; K278-T282 PolarHBondContact O-N 3.13Å; K278-T282 PolarHBondContact O-OG1 3.2Å
279	F	63.9	Low	61.4	Low	135 Å²	135	70.6 Å²	70.6	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-62.9	-45	173.7	-70.9	-64.6	0	0	0	112	N275 L276 I277 T282 S283	N275-F279 HydrophobicContact CB-CE2 4.46Å; N275-F279 WeakPolarHBondContact O-CD2 3.44Å; N275-F279 PolarHBondContact O-N 3.46Å; L276-F279 PolarHBondContact O-N 3.07Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 3.01Å; F279-T282 PolarHBondContact O-N 3.41Å; F279-S283 PolarHBondContact O-N 3.02Å; F279-S283 VanDerWaalsContact O-N 3.12Å; F279-S283 PolarHBondContact O-OG 3.31Å
280	C	59.5	Low	58.4	Low	12 Å²	12	73.7 Å²	73.7	8%	0.081	42%	0.42	C	S	.	.	H	α-helix	trans	-60.8	-52.1	177.9	-158.5	0	0	0	0	112.1	L197 L276 I277 T282 S283 M284	L197-C280 HydrophobicContact CD2-CB 4.3Å; L276-C280 PolarHBondContact O-N 3.08Å; I277-C280 WeakPolarHBondContact O-CB 3.27Å; I277-C280 PolarHBondContact O-N 2.81Å; I277-C280 VanDerWaalsContact O-N 3.08Å; C280-T282 VanDerWaalsContact C-N 3.33Å; C280-T282 PolarHBondContact O-N 3.1Å; C280-S283 WeakPolarHBondContact O-CB 3.5Å; C280-S283 PolarHBondContact O-N 3.47Å; C280-S283 VanDerWaalsContact O-N 3.16Å; C280-M284 WeakPolarHBondContact O-CG 3.17Å; C280-M284 PolarHBondContact O-N 2.9Å
281	C	48.5	Very low	55.4	Low	40 Å²	40	78.1 Å²	78.1	27%	0.27	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-29.5	178.6	-63.3	0	0	0	0	113	I277 M284 N285	I277-C281 WeakPolarHBondContact O-CB 3.3Å; I277-C281 PolarHBondContact O-N 2.69Å; I277-C281 PolarHBondContact O-SG 2.87Å; C281-M284 PolarHBondContact O-N 3.17Å; C281-N285 WeakPolarHBondContact O-CB 3.48Å; C281-N285 PolarHBondContact O-N 3.36Å; C281-N285 PolarHBondContact O-OD1 2.92Å
282	T	46.2	Very low	52.7	Low	84 Å²	84	79.2 Å²	79.2	52%	0.515	46%	0.459	S	S	.	.	H	α-helix	trans	-68.1	-38.7	172.9	-53.9	0	0	0	0	110.9	K278 F279 C280 S286	K278-T282 VanDerWaalsContact O-CB 3.3Å; K278-T282 WeakPolarHBondContact O-CB 3.23Å; K278-T282 PolarHBondContact O-N 3.13Å; K278-T282 PolarHBondContact O-OG1 3.2Å; F279-T282 PolarHBondContact O-N 3.41Å; C280-T282 VanDerWaalsContact C-N 3.33Å; C280-T282 PolarHBondContact O-N 3.1Å; T282-S286 PolarHBondContact O-OG 3.06Å
283	S	43.7	Very low	50.4	Low	86 Å²	86	80.1 Å²	80.1	60%	0.601	46%	0.456	S	S	*	.	H	α-helix	trans	-68	-36.8	173.1	-62.9	0	0	0	0	112.8	F279 C280	F279-S283 PolarHBondContact O-N 3.02Å; F279-S283 VanDerWaalsContact O-N 3.12Å; F279-S283 PolarHBondContact O-OG 3.31Å; C280-S283 WeakPolarHBondContact O-CB 3.5Å; C280-S283 PolarHBondContact O-N 3.47Å; C280-S283 VanDerWaalsContact O-N 3.16Å
284	M	43	Very low	48.3	Very low	88 Å²	88	85 Å²	85	43%	0.433	49%	0.487	S	S	.	.	H	α-helix	trans	-79.4	-34.8	-179.1	-69.1	170.9	169.5	0	0	113.6	C280 C281 S286	C280-M284 WeakPolarHBondContact O-CG 3.17Å; C280-M284 PolarHBondContact O-N 2.9Å; C281-M284 PolarHBondContact O-N 3.17Å; M284-S286 PolarHBondContact O-N 2.99Å; M284-S286 VanDerWaalsContact O-N 3.11Å
285	N	38.4	Very low	46.3	Very low	99 Å²	99	85.6 Å²	85.6	53%	0.529	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	10.4	179	-65.7	3.6	0	0	0	113.5	C281 T287	C281-N285 WeakPolarHBondContact O-CB 3.48Å; C281-N285 PolarHBondContact O-N 3.36Å; C281-N285 PolarHBondContact O-OD1 2.92Å; N285-T287 VanDerWaalsContact C-N 3.3Å
286	S	34.4	Very low	44.5	Very low	95 Å²	95	86.7 Å²	86.7	66%	0.664	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-5.4	177.4	-62.5	0	0	0	0	113.6	T282 M284	T282-S286 PolarHBondContact O-OG 3.06Å; M284-S286 PolarHBondContact O-N 2.99Å; M284-S286 VanDerWaalsContact O-N 3.11Å
287	T	30.5	Very low	42.5	Very low	122 Å²	122	92.4 Å²	92.4	75%	0.748	55%	0.547	S	S	*	.			trans	-131	94.1	-173	-45.1	0	0	0	0	111.3	N285	N285-T287 VanDerWaalsContact C-N 3.3Å
288	S	32.5	Very low	40.5	Very low	104 Å²	104	98.4 Å²	98.4	73%	0.727	58%	0.584	S	S	*	*			trans	-131.3	83	-177.3	-64.6	0	0	0	0	112.9
289	I	30.6	Very low	38.6	Very low	139 Å²	139	97.6 Å²	97.6	71%	0.713	59%	0.59	S	S	*	*			trans	36	137.6	146.2	-51.4	173.9	0	0	0	120.1	T291	I289-T291 HydrophobicContact CG2-CG2 4.3Å; I289-T291 WeakPolarHBondContact CG2-OG1 3.46Å
290	T	32	Very low	37	Very low	90 Å²	90	97.4 Å²	97.4	55%	0.552	60%	0.6	S	S	*	*			trans	-146.7	50.2	154.6	-21.2	0	0	0	0	115.2	H42 H43	H42-T290 PolarHBondContact ND1-O 2.92Å; H43-T290 VanDerWaalsContact CE1-CB 3.46Å; H43-T290 WeakPolarHBondContact CE1-CB 3.46Å; H43-T290 PolarHBondContact CE1-O 3.1Å; H43-T290 PolarHBondContact ND1-O 3.44Å; H43-T290 PolarHBondContact NE2-O 3.46Å
291	T	31.7	Very low	35.7	Very low	99 Å²	99	102.5 Å²	102.5	61%	0.607	64%	0.637	S	S	*	*			trans	-82.2	141.8	-175.2	49.1	0	0	0	0	116.9	H42 I289	H42-T291 WeakPolarHBondContact CE1-CA 3.44Å; H42-T291 VanDerWaalsContact ND1-C 3.31Å; H42-T291 VanDerWaalsContact ND1-CA 3.25Å; H42-T291 WeakPolarHBondContact ND1-CA 3.46Å; I289-T291 HydrophobicContact CG2-CG2 4.3Å; I289-T291 WeakPolarHBondContact CG2-OG1 3.46Å
292	S	35.2	Very low	35	Very low	67 Å²	67	107 Å²	107	47%	0.469	66%	0.663	S	S	.	*			trans	-173.8	-55.5	173.8	-9.7	0	0	0	0	124.3	N41 H42	N41-S292 WeakPolarHBondContact CA-OG 3.01Å; N41-S292 WeakPolarHBondContact OD1-CB 3.43Å; H42-S292 PolarHBondContact CD2-N 3.06Å; H42-S292 PolarHBondContact CE1-N 2.76Å; H42-S292 PolarHBondContact ND1-N 3.49Å; H42-S292 PolarHBondContact NE2-N 3.02Å
293	V	36.3	Very low	34.3	Very low	60 Å²	60	110.5 Å²	110.5	36%	0.364	68%	0.677	S	S	.	*			trans	-101.4	163.1	-150.6	90	0	0	0	0	115.8	N41 H42	N41-V293 HydrophobicContact CB-CB 4.03Å; N41-V293 HydrophobicContact CB-CG2 3.85Å; N41-V293 WeakPolarHBondContact ND2-CG2 3.25Å; H42-V293 HydrophobicContact CB-CB 3.51Å; H42-V293 HydrophobicContact CB-CG1 3.46Å; H42-V293 VanDerWaalsContact CB-CG1 3.46Å; H42-V293 PolarHBondContact CD2-N 3.06Å; H42-V293 VanDerWaalsContact CG-N 3.3Å
294	T	36.2	Very low	33.8	Very low	116 Å²	116	112.2 Å²	112.2	71%	0.712	68%	0.684	S	S	*	*			cis	-137.5	147.4	3.4	-24	0	0	0	0	111.5
295	P	32.1	Very low	33.3	Very low	87 Å²	87	112.3 Å²	112.3	57%	0.565	69%	0.694	S	S	*	*			trans	-75.6	163.3	161.1	32.6	-35.3	0	0	0	112.8
296	P	35.5	Very low	33.1	Very low	128 Å²	128	115 Å²	115	83%	0.831	71%	0.707	S	S	*	*			trans	-88.2	148.1	-167.3	34	-36.2	0	0	0	115.1
297	T	36.1	Very low	33.1	Very low	142 Å²	142	116.6 Å²	116.6	87%	0.871	71%	0.709	S	S	*	*			trans	-122.9	136.3	165	-56.2	0	0	0	0	109.6
298	V	34.3	Very low	33.4	Very low	129 Å²	129	119.2 Å²	119.2	78%	0.782	71%	0.712	S	S	*	*			trans	-85	122.7	-175.2	-175.2	0	0	0	0	110.9
299	V	31.2	Very low	33.4	Very low	127 Å²	127	121.7 Å²	121.7	77%	0.77	72%	0.716	S	S	*	*				-179.1	130.2	118	-87.8	0	0	0	0	113.6
300	T	30.4	Very low	33.6	Very low	131 Å²	131	119.7 Å²	119.7	80%	0.804	71%	0.712	S	S	*	*			trans	40.7	109	136.9	-45.2	0	0	0	0	121
301	S	31	Very low	33.5	Very low	120 Å²	120	120.3 Å²	120.3	84%	0.839	72%	0.716	S	S	*	*			trans	-156.5	143.7	139.4	-81.7	0	0	0	0	111.2
302	T	34.6	Very low	33.4	Very low	135 Å²	135	125.2 Å²	125.2	83%	0.828	72%	0.724	S	S	*	*			trans	-57.3	129.7	-176.3	46.8	0	0	0	0	112.8
303	L	30.4	Very low	33.1	Very low	156 Å²	156	126.3 Å²	126.3	82%	0.817	73%	0.732	S	S	*	*				64.2	142.6	63.3	-90.3	178.8	0	0	0	117
304	T	32.8	Very low	32.8	Very low	122 Å²	122	129.7 Å²	129.7	75%	0.748	75%	0.748	S	S	*	*			trans	80.4	111.4	176.5	66.5	0	0	0	0	116
305	S	33.7	Very low	32.6	Very low	91 Å²	91	130.6 Å²	130.6	64%	0.636	75%	0.747	S	S	*	*				91.5	153.6	65.5	-65.2	0	0	0	0	111.5
306	L	33.6	Very low	32.6	Very low	154 Å²	154	133 Å²	133	81%	0.806	76%	0.756	S	S	*	*			cis	-121.9	157.4	11.4	-74	81.3	0	0	0	110.3
307	N	33.6	Very low	32.5	Very low	130 Å²	130	133.7 Å²	133.7	70%	0.695	75%	0.752	S	S	*	*			cis	71.8	90.4	39.2	-69.9	-2.9	0	0	0	116.1
308	H	37.3	Very low	32.4	Very low	177 Å²	177	133 Å²	133	82%	0.819	74%	0.743	S	S	*	*				-168.4	119.8	129.1	-122	-100.3	0	0	0	114.1
309	L	33.3	Very low	32.4	Very low	156 Å²	156	133.3 Å²	133.3	82%	0.817	74%	0.741	S	S	*	*			trans	-80.8	-160.7	147.2	-112.5	78.1	0	0	0	107.1
310	P	34.1	Very low	32.4	Very low	96 Å²	96	135.1 Å²	135.1	62%	0.623	75%	0.745	S	S	*	*			cis	-160.3	-170.8	23.8	50.4	-27.5	0	0	0	119.3
311	V	30	Very low	32.4	Very low	103 Å²	103	134 Å²	134	62%	0.624	74%	0.74	S	S	*	*			trans	36.9	153	155.9	-135.2	0	0	0	0	124.9
312	Y	29.6	Very low	32.2	Very low	202 Å²	202	134.9 Å²	134.9	79%	0.792	74%	0.74	S	S	*	*			trans	101.1	104.5	152.1	-63.8	-60.9	0	0	0	115.6
313	S	29.3	Very low	31.9	Very low	90 Å²	90	134.4 Å²	134.4	63%	0.629	74%	0.737	S	S	*	*				82.9	150.4	63.2	80.7	0	0	0	0	112.5
314	N	29.4	Very low	31.6	Very low	132 Å²	132	131.6 Å²	131.6	71%	0.706	73%	0.73	S	S	*	*			cis	-165.2	169.3	10.7	-133.6	12.9	0	0	0	108.4
315	I	32	Very low	31.5	Very low	134 Å²	134	131 Å²	131	69%	0.687	73%	0.732	S	S	*	*			trans	66.4	131.3	151	-70.5	163.8	0	0	0	116.2
316	D	33.5	Very low	31.2	Very low	139 Å²	139	133.7 Å²	133.7	74%	0.743	74%	0.738	S	S	*	*			cis	-157.1	-174.3	-2.8	-109.6	-6.9	0	0	0	110.7
317	D	33.3	Very low	30.8	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	74%	0.736	S	S	*	*			trans	83.9	108.2	161.6	-85.3	-19.1	0	0	0	121.9
318	N	33.9	Very low	30.5	Very low	128 Å²	128	137 Å²	137	68%	0.684	74%	0.737	S	S	*	*			trans	84.4	97.5	147.1	-62.9	-61.2	0	0	0	121.5
319	N	32.4	Very low	30	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	73%	0.734	S	S	*	*			trans	93.2	75.6	139.2	-60.8	-23	0	0	0	121.5
320	L	33.1	Very low	29.8	Very low	164 Å²	164	131.4 Å²	131.4	86%	0.859	73%	0.727	S	S	*	*			trans	68.6	155.4	137.9	-89.5	65.9	0	0	0	119.7
321	P	29.7	Very low	29.6	Very low	108 Å²	108	136.2 Å²	136.2	70%	0.701	74%	0.737	S	S	*	*			trans	-117.7	154.7	-148.6	40.7	-30.5	0	0	0	115.5
322	V	26.3	Very low	29.4	Very low	139 Å²	139	137.4 Å²	137.4	84%	0.842	74%	0.74	S	S	*	*			trans	-135.4	95.9	158.4	-175.3	0	0	0	0	110
323	T	28.6	Very low	29.2	Very low	125 Å²	125	134.9 Å²	134.9	77%	0.767	74%	0.74	S	S	*	*			trans	-113.2	119.3	153.1	49.7	0	0	0	0	106
324	S	25	Very low	29.2	Very low	96 Å²	96	137.6 Å²	137.6	67%	0.671	74%	0.743	S	S	*	*				68.4	146.8	66.9	-62.7	0	0	0	0	112.6
325	S	30.2	Very low	29.2	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	75%	0.746	S	S	*	*			trans	73.5	146.4	-178.9	76.2	0	0	0	0	117.2
326	L	27.1	Very low	28.9	Very low	146 Å²	146	141.5 Å²	141.5	76%	0.764	75%	0.75	S	S	*	*			cis	-178.6	144.5	-42.2	-123.3	83.2	0	0	0	104.8
327	Y	26	Very low	28.7	Very low	199 Å²	199	140.4 Å²	140.4	78%	0.78	75%	0.745	S	S	*	*			trans	32.4	112.7	158.1	-65.5	-90.7	0	0	0	119.5
328	H	26.7	Very low	28.5	Very low	154 Å²	154	140.9 Å²	140.9	71%	0.713	74%	0.742	S	S	*	*				62.6	106.2	85	171.8	-65.5	0	0	0	114.1
329	T	26.7	Very low	28.3	Very low	124 Å²	124	140.7 Å²	140.7	76%	0.761	74%	0.741	S	S	*	*			trans	-157.5	114	132.7	35.2	0	0	0	0	111.3
330	S	27.7	Very low	28.1	Very low	93 Å²	93	139 Å²	139	65%	0.65	73%	0.732	S	S	*	*				59.6	144.3	122.6	-46.3	0	0	0	0	122.7
331	K	30.2	Very low	28	Very low	196 Å²	196	134.2 Å²	134.2	85%	0.852	71%	0.705	S	S	*	*			trans	85.8	133.7	153.7	-79.4	-175.3	174.8	-178.6	0	119.3
332	L	25.6	Very low	28.1	Very low	128 Å²	128	137 Å²	137	67%	0.67	71%	0.706	S	S	*	*			trans	64.1	99.1	165.5	-54.7	-176.6	0	0	0	116.8
333	N	26.8	Very low	28.2	Very low	149 Å²	149	132.1 Å²	132.1	80%	0.797	67%	0.674	S	S	*	*				-142.2	126.2	119.5	-93.2	-7.8	0	0	0	104.9
334	E	29	Very low	28.3	Very low	147 Å²	147	131.8 Å²	131.8	69%	0.687	66%	0.664	S	S	*	*			cis	51.3	128	16.9	-73.1	-166.9	168.6	0	0	114
335	L	29.5	Very low	28.5	Very low	147 Å²	147	129.6 Å²	129.6	77%	0.77	64%	0.643	S	S	*	*			trans	64.9	102.3	-158.5	-43.1	174.2	0	0	0	112.4
336	Y	25.2	Very low	28.4	Very low	201 Å²	201	128.9 Å²	128.9	79%	0.788	63%	0.63	S	S	*	*			cis	53	112	7.9	-147.9	-80.7	0	0	0	116.7
337	N	29.7	Very low	28.4	Very low	117 Å²	117	128.2 Å²	128.2	63%	0.626	62%	0.618	S	S	*	*			trans	66.7	142.7	-170.9	-61.9	-26.9	0	0	0	114.1
338	H	28.3	Very low	28.7	Very low	151 Å²	151	128.2 Å²	128.2	70%	0.699	62%	0.622	S	S	*	*			cis	-165.3	-179.4	-26.5	-147.7	-100	0	0	0	107
339	N	29.4	Very low	28.8	Very low	124 Å²	124	127.2 Å²	127.2	66%	0.663	61%	0.613	S	S	*	*			trans	75.3	141.5	162.8	-54.4	-18.9	0	0	0	116
340	N	29.6	Very low	29.3	Very low	99 Å²	99	126.7 Å²	126.7	53%	0.529	61%	0.61	S	S	.	*			cis	-147.1	144.3	-2.9	-117.7	-6.9	0	0	0	115.1
341	Q	30.5	Very low	29.5	Very low	65 Å²	65	127.7 Å²	127.7	30%	0.304	61%	0.614	S	S	.	*			trans	37.5	97.3	139.4	-65.9	160.6	-36.6	0	0	116.2	D599 N600	Q341-D599 VanDerWaalsContact CD-N 3.26Å; Q341-D599 VanDerWaalsContact NE2-N 3.1Å; Q341-D599 PolarHBondContact OE1-O 3.41Å; Q341-D599 VanDerWaalsContact OE1-O 3.06Å; Q341-N600 CarbonylContact O-C 3.57Å
342	K	32.3	Very low	29.8	Very low	166 Å²	166	121 Å²	121	72%	0.722	59%	0.59	S	S	*	*				35.8	118.8	74.2	-170.6	-167.5	-177.3	-175.7	0	112.2
343	Q	27.2	Very low	30.3	Very low	36 Å²	36	122.1 Å²	122.1	17%	0.168	59%	0.593	C	S	.	*			trans	-160.8	135.2	144.8	-87.6	-112.8	28.6	0	0	106.6	I109 S110 K598 D599 N600	I109-Q343 VanDerWaalsContact CA-CD 3.49Å; S110-Q343 VanDerWaalsContact N-OE1 3.17Å; S110-Q343 VanDerWaalsContact OG-C 3.29Å; S110-Q343 WeakPolarHBondContact OG-CA 3.27Å; S110-Q343 WeakPolarHBondContact OG-CB 3.2Å; S110-Q343 PolarHBondContact OG-OE1 3.11Å; Q343-K598 VanDerWaalsContact NE2-CA 3.26Å; Q343-D599 PolarHBondContact NE2-OD1 2.85Å; Q343-N600 WeakPolarHBondContact CB-OD1 2.87Å
344	H	31.7	Very low	30.7	Very low	119 Å²	119	122.1 Å²	122.1	55%	0.551	58%	0.581	S	S	*	*			trans	-171.2	129	-139.5	168.3	-53.9	0	0	0	112	S110 D346	S110-H344 PolarHBondContact OG-N 3.5Å; H344-D346 IonicContact CE1-OD1 3.85Å; H344-D346 IonicContact ND1-OD1 3.22Å
345	Q	29.1	Very low	30.9	Very low	50 Å²	50	121.6 Å²	121.6	23%	0.234	58%	0.583	C	S	.	*			trans	-153.4	112.3	161.8	-66.8	172.8	20.4	0	0	113.2	T111 P112 Y596	T111-Q345 HydrophobicContact CG2-CB 3.5Å; T111-Q345 HydrophobicContact CG2-CG 3.53Å; P112-Q345 WeakPolarHBondContact CB-O 3.1Å; P112-Q345 VanDerWaalsContact CG-O 3.26Å; P112-Q345 WeakPolarHBondContact CG-O 3.37Å; Q345-Y596 PolarHBondContact NE2-OH 2.98Å
346	D	28.3	Very low	30.8	Very low	95 Å²	95	119.4 Å²	119.4	51%	0.508	58%	0.579	S	S	.	*				59.1	163.4	115.7	-36	-33.3	0	0	0	118.8	H344	H344-D346 IonicContact CE1-OD1 3.85Å; H344-D346 IonicContact ND1-OD1 3.22Å
347	W	26.9	Very low	31.1	Very low	133 Å²	133	117.9 Å²	117.9	50%	0.504	58%	0.577	S	S	.	*			cis	-127.2	160.5	41.8	-61.7	-26.6	0	0	0	115.6	I74 I75 T76 I115	I74-W347 HydrophobicContact CG1-CE3 4.14Å; I74-W347 HydrophobicContact CG1-CZ3 4.41Å; I75-W347 HydrophobicContact CG1-CZ3 4.21Å; T76-W347 HydrophobicContact CG2-CH2 3.72Å; T76-W347 HydrophobicContact CG2-CZ2 4.01Å; T76-W347 WeakPolarHBondContact OG1-CH2 3.48Å; T76-W347 WeakPolarHBondContact OG1-CZ3 3.45Å; I115-W347 HydrophobicContact CD1-CE3 4.47Å; I115-W347 HydrophobicContact CD1-CZ3 4.44Å
348	F	32	Very low	31.3	Very low	199 Å²	199	120.4 Å²	120.4	87%	0.873	58%	0.584	S	S	*	*			trans	-124	156.8	158.3	-87.3	-94.5	0	0	0	108.7
349	Y	29.8	Very low	31.5	Very low	132 Å²	132	118.2 Å²	118.2	52%	0.518	58%	0.582	S	S	.	*			trans	-152	173.9	157.3	-112.9	-72.2	0	0	0	111.6	D592	Y349-D592 PolarHBondContact OH-OD2 2.92Å
350	T	35.8	Very low	31.5	Very low	114 Å²	114	117.6 Å²	117.6	70%	0.699	58%	0.583	S	S	*	*			trans	-123.9	163.5	-153.1	39.1	0	0	0	0	115.5
351	P	32.3	Very low	31.6	Very low	114 Å²	114	119.5 Å²	119.5	74%	0.74	59%	0.593	S	S	*	*			trans	-93.1	175.1	-175.9	39	-38.1	0	0	0	115
352	P	36	Very low	31.6	Very low	54 Å²	54	123.3 Å²	123.3	35%	0.351	62%	0.621	S	S	.	*			trans	-140.5	151.1	-154.9	35.9	-11.4	0	0	0	117.8	E586 L587 W588	P352-E586 CarbonylContact O-C 3.51Å; P352-L587 VanDerWaalsContact C-CA 3.45Å; P352-L587 VanDerWaalsContact CB-C 3.43Å; P352-L587 HydrophobicContact CB-CD2 4.09Å; P352-L587 HydrophobicContact CB-CG 4.48Å; P352-L587 HydrophobicContact CG-CD2 3.7Å; P352-L587 HydrophobicContact CG-CG 3.96Å; P352-L587 WeakPolarHBondContact O-CA 3.33Å; P352-L587 PolarHBondContact O-N 3.27Å; P352-L587 VanDerWaalsContact O-N 3.09Å; P352-W588 VanDerWaalsContact C-N 3.32Å; P352-W588 VanDerWaalsContact CB-CA 3.47Å; P352-W588 HydrophobicContact CB-CE3 4.44Å; P352-W588 VanDerWaalsContact CB-N 3.28Å
353	Q	36.8	Very low	31.6	Very low	153 Å²	153	121.2 Å²	121.2	72%	0.715	62%	0.622	S	S	*	*			trans	-119.8	132.6	-179.6	-95.3	-85.2	-91.6	0	0	116.8	E586 L587 W588	Q353-E586 CarbonylContact C-O 3.26Å; Q353-E586 WeakPolarHBondContact CA-O 3.49Å; Q353-E586 PolarHBondContact NE2-O 3.04Å; Q353-L587 CarbonylContact O-C 3.47Å; Q353-W588 WeakPolarHBondContact CA-O 3.26Å; Q353-W588 VanDerWaalsContact N-C 3.34Å; Q353-W588 PolarHBondContact N-O 3.19Å; Q353-W588 WeakPolarHBondContact O-CA 2.95Å; Q353-W588 PolarHBondContact O-N 2.83Å
354	R	35.6	Very low	31.7	Very low	148 Å²	148	125.4 Å²	125.4	56%	0.558	65%	0.65	S	S	*	*			trans	-123.5	146	-171.7	-131.5	-155.4	-68.9	-132.8	9.3	117.7	E586 L587	R354-E586 HydrophobicContact CB-CB 4.47Å; R354-E586 IonicContact CZ-OE2 3.86Å; R354-E586 PolarHBondContact N-O 3.42Å; R354-E586 IonicContact NE-OE2 3.79Å; R354-E586 PolarHBondContact NE-OE2 3.39Å; R354-E586 IonicContact NH2-OE1 2.88Å; R354-E586 PolarHBondContact NH2-OE1 2.91Å; R354-E586 IonicContact NH2-OE2 2.63Å; R354-E586 PolarHBondContact NH2-OE2 3.39Å; R354-L587 HydrophobicContact CB-CB 4.32Å; R354-L587 HydrophobicContact CG-CB 4.46Å
355	D	31.9	Very low	31.8	Very low	136 Å²	136	124.5 Å²	124.5	73%	0.727	66%	0.658	S	S	*	*			trans	-45.1	149.5	-172.5	-56.1	-68.8	0	0	0	122.4
356	C	28.9	Very low	31.8	Very low	102 Å²	102	129 Å²	129	69%	0.689	68%	0.683	S	S	*	*				-176.5	108.6	102.4	-95.2	0	0	0	0	119
357	K	30.8	Very low	32	Very low	169 Å²	169	129.9 Å²	129.9	74%	0.735	69%	0.692	S	S	*	*				72.9	152.7	128.4	-64.8	178.1	179.4	170.9	0	124.9
358	H	34.2	Very low	32.3	Very low	169 Å²	169	128.9 Å²	128.9	78%	0.782	70%	0.701	S	S	*	*			trans	86.7	131.7	161.6	-60.9	-61.6	0	0	0	118.2
359	T	31.9	Very low	32.2	Very low	105 Å²	105	125.7 Å²	125.7	64%	0.644	69%	0.693	S	S	*	*			cis	-162.1	135.1	-8	-87.2	0	0	0	0	110.2
360	T	30.6	Very low	32.4	Very low	112 Å²	112	125.5 Å²	125.5	69%	0.687	70%	0.701	S	S	*	*			trans	19.5	143.9	158.1	68.8	0	0	0	0	121.7
361	N	30	Very low	32.2	Very low	138 Å²	138	126.8 Å²	126.8	74%	0.738	70%	0.703	S	S	*	*			cis	-161.4	149.9	34.1	-89.2	-56.7	0	0	0	111.5
362	T	32.1	Very low	32	Very low	145 Å²	145	127.6 Å²	127.6	89%	0.89	70%	0.701	S	S	*	*				172.9	169.7	123.5	29.9	0	0	0	0	111
363	T	31.6	Very low	31.7	Very low	123 Å²	123	131.1 Å²	131.1	76%	0.755	72%	0.717	S	S	*	*			trans	-122.6	140.2	-149.4	-22.5	0	0	0	0	113.7
364	T	29.3	Very low	31.2	Very low	123 Å²	123	129 Å²	129	76%	0.755	71%	0.714	S	S	*	*			trans	39.2	127.3	150.9	50.5	0	0	0	0	119.2
365	S	33.3	Very low	30.8	Very low	101 Å²	101	128.8 Å²	128.8	71%	0.706	72%	0.723	S	S	*	*				-173.1	151.4	53.3	43.4	0	0	0	0	114
366	N	29.2	Very low	30.7	Very low	143 Å²	143	127.6 Å²	127.6	77%	0.765	72%	0.717	S	S	*	*			trans	26.2	135	134.7	-54.2	7.5	0	0	0	119.4
367	T	33.3	Very low	30.6	Very low	114 Å²	114	129 Å²	129	70%	0.699	72%	0.717	S	S	*	*			cis	-164	135.2	7.3	3.6	0	0	0	0	111.7
368	T	32	Very low	30.3	Very low	112 Å²	112	125.6 Å²	125.6	69%	0.687	71%	0.71	S	S	*	*			trans	33.8	138.3	140.2	58.1	0	0	0	0	122.3
369	N	31.3	Very low	30.1	Very low	132 Å²	132	124.3 Å²	124.3	71%	0.706	71%	0.709	S	S	*	*			cis	-166.1	142.8	-16	-117.6	4.3	0	0	0	110.3
370	N	34.5	Very low	29.8	Very low	128 Å²	128	124.6 Å²	124.6	68%	0.684	71%	0.711	S	S	*	*			trans	39.5	116.6	147.7	-56.7	-14.2	0	0	0	121.4
371	N	30.3	Very low	29.3	Very low	142 Å²	142	124.5 Å²	124.5	76%	0.759	71%	0.714	S	S	*	*				29.5	141.2	93.2	-65.7	-7	0	0	0	117.6
372	L	27.8	Very low	29.1	Very low	130 Å²	130	125.7 Å²	125.7	68%	0.681	72%	0.72	S	S	*	*			cis	-157.3	155.2	16.1	-153	76.7	0	0	0	110.4
373	N	29.7	Very low	28.7	Very low	128 Å²	128	125.8 Å²	125.8	68%	0.684	71%	0.714	S	S	*	*			trans	36	108.1	149.6	-67.6	2.8	0	0	0	118
374	T	26.7	Very low	28.3	Very low	108 Å²	108	126 Å²	126	66%	0.663	72%	0.715	S	S	*	*				48.2	108.3	54.5	-24.2	0	0	0	0	110.3
375	I	28.2	Very low	28.1	Very low	144 Å²	144	125 Å²	125	74%	0.738	71%	0.714	S	S	*	*				-167.2	117.4	78.7	-87.9	173.2	0	0	0	105.6
376	N	28.7	Very low	27.7	Very low	112 Å²	112	126.1 Å²	126.1	60%	0.599	72%	0.716	S	S	*	*				52.4	108.3	101.6	-62.7	-23.8	0	0	0	113.6
377	N	27.1	Very low	27.7	Very low	130 Å²	130	127.3 Å²	127.3	70%	0.695	72%	0.717	S	S	*	*				106.8	150.2	83.7	-77.1	-13.1	0	0	0	110.7
378	V	25.5	Very low	27.4	Very low	98 Å²	98	127.1 Å²	127.1	59%	0.594	72%	0.716	S	S	*	*				36.8	112.6	92.4	-143.9	0	0	0	0	110.6	T380	V378-T380 HydrophobicContact CG1-CG2 3.82Å
379	N	28.6	Very low	27.1	Very low	142 Å²	142	128.3 Å²	128.3	76%	0.759	72%	0.718	S	S	*	*				-147.1	130.3	74.5	-66.9	-41.7	0	0	0	110.6
380	T	25.3	Very low	27	Very low	111 Å²	111	132 Å²	132	68%	0.681	73%	0.728	S	S	*	*				52.7	133.2	73.2	65.1	0	0	0	0	114.4	V378	V378-T380 HydrophobicContact CG1-CG2 3.82Å
381	C	20.9	Very low	26.6	Very low	111 Å²	111	130.8 Å²	130.8	75%	0.75	74%	0.736	S	S	*	*			trans	-58.3	149.4	177.3	-49.5	0	0	0	0	112.2
382	N	25.6	Very low	26.5	Very low	163 Å²	163	128.9 Å²	128.9	87%	0.872	73%	0.734	S	S	*	*				-156.8	152.8	127.1	-98.7	-30.2	0	0	0	110.8
383	L	23.2	Very low	26.5	Very low	147 Å²	147	130.3 Å²	130.3	77%	0.77	74%	0.742	S	S	*	*			trans	-92.7	-179.7	177	-69.3	92.3	0	0	0	111
384	T	23.1	Very low	26.2	Very low	126 Å²	126	132 Å²	132	77%	0.773	75%	0.75	S	S	*	*			trans	78.1	125	157.6	63.4	0	0	0	0	119.2
385	S	25.2	Very low	26.1	Very low	103 Å²	103	134.4 Å²	134.4	72%	0.72	76%	0.759	S	S	*	*			trans	61.5	136.1	147.5	44.1	0	0	0	0	119.6
386	T	26.7	Very low	25.7	Very low	124 Å²	124	133.2 Å²	133.2	76%	0.761	76%	0.762	S	S	*	*			cis	-162.3	158.2	1.2	4.4	0	0	0	0	111.7
387	Q	28.4	Very low	25.4	Very low	169 Å²	169	132.5 Å²	132.5	79%	0.79	77%	0.766	S	S	*	*			trans	66.5	110.7	151	-75.9	179.6	-22.1	0	0	121.7
388	T	27.4	Very low	25.2	Very low	109 Å²	109	132.5 Å²	132.5	67%	0.669	77%	0.771	S	S	*	*				65.1	112.8	129.5	59.6	0	0	0	0	122.5
389	D	26	Very low	25.1	Very low	137 Å²	137	135 Å²	135	73%	0.733	78%	0.781	S	S	*	*				64.3	94	118.8	-47.9	-16	0	0	0	120.9
390	K	29.4	Very low	24.8	Very low	210 Å²	210	136.6 Å²	136.6	91%	0.913	79%	0.789	S	S	*	*				-173.8	155	93.4	-96.4	154.6	-173	172.2	0	112.4
391	A	24.6	Very low	24.7	Very low	103 Å²	103	135.4 Å²	135.4	85%	0.851	79%	0.785	S	S	*	*			trans	-88.2	148.9	-176.3	0	0	0	0	0	112.7
392	S	28.8	Very low	24.8	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	79%	0.794	S	S	*	*			trans	-142.5	105.2	170	63.5	0	0	0	0	112.9
393	N	26.9	Very low	24.7	Very low	159 Å²	159	140.5 Å²	140.5	85%	0.85	79%	0.79	S	S	*	*			trans	68.4	135.6	144.5	-55.2	-17.6	0	0	0	120.8
394	L	23.8	Very low	24.6	Very low	165 Å²	165	138.1 Å²	138.1	86%	0.864	79%	0.785	S	S	*	*			trans	-77	152.9	164.3	-53.8	91.9	0	0	0	110.1
395	N	24.4	Very low	24.8	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	78%	0.784	S	S	*	*			trans	-154.2	123.3	141.5	-121.6	-30	0	0	0	111
396	C	19.4	Very low	25.2	Very low	120 Å²	120	138.7 Å²	138.7	81%	0.811	79%	0.786	S	S	*	*			trans	-103.7	84.3	177.7	-170.2	0	0	0	0	109.2	T398	C396-T398 PolarHBondContact O-N 2.66Å
397	S	22.7	Very low	25.8	Very low	96 Å²	96	136.7 Å²	136.7	67%	0.671	77%	0.771	S	S	*	*			trans	-77.3	103.6	177.7	-59.3	0	0	0	0	110.7	N399	S397-N399 PolarHBondContact O-N 2.97Å; S397-N399 VanDerWaalsContact O-N 3.08Å
398	T	22.7	Very low	26.9	Very low	130 Å²	130	130.8 Å²	130.8	80%	0.798	75%	0.745	S	S	*	*			trans	-61.4	107.2	168.6	46.9	0	0	0	0	110.4	C396	C396-T398 PolarHBondContact O-N 2.66Å
399	N	24.6	Very low	28	Very low	151 Å²	151	128.5 Å²	128.5	81%	0.807	73%	0.728	S	S	*	*			trans	-124.4	128.1	166.7	-96.1	-33.8	0	0	0	109.7	S397 S401	S397-N399 PolarHBondContact O-N 2.97Å; S397-N399 VanDerWaalsContact O-N 3.08Å; N399-S401 PolarHBondContact O-N 3.12Å
400	N	22.6	Very low	29.3	Very low	175 Å²	175	124 Å²	124	94%	0.936	70%	0.704	S	S	*	*			trans	-71.5	119.1	-177.2	-68.3	-42.9	0	0	0	110.9
401	S	22.3	Very low	30.5	Very low	86 Å²	86	118.2 Å²	118.2	60%	0.601	69%	0.686	S	S	*	*			trans	-143.4	142.1	149.9	61.7	0	0	0	0	109.5	N399 Y403	N399-S401 PolarHBondContact O-N 3.12Å; S401-Y403 PolarHBondContact O-N 2.94Å; S401-Y403 VanDerWaalsContact O-N 3.14Å; S401-Y403 WeakPolarHBondContact OG-CD2 3.21Å; S401-Y403 WeakPolarHBondContact OG-CE2 3.37Å
402	I	22.3	Very low	32.2	Very low	180 Å²	180	116.7 Å²	116.7	92%	0.923	67%	0.667	S	S	*	*			trans	-81.6	97.6	-172.4	-60.4	169	0	0	0	108.4
403	Y	23.4	Very low	33.7	Very low	202 Å²	202	112 Å²	112	79%	0.792	63%	0.633	S	S	*	*			trans	-112.7	134.2	170.1	-82.6	-82	0	0	0	111.1	S401	S401-Y403 PolarHBondContact O-N 2.94Å; S401-Y403 VanDerWaalsContact O-N 3.14Å; S401-Y403 WeakPolarHBondContact OG-CD2 3.21Å; S401-Y403 WeakPolarHBondContact OG-CE2 3.37Å
404	S	21.6	Very low	35	Very low	96 Å²	96	107 Å²	107	67%	0.671	61%	0.609	S	S	*	*			trans	-69.6	141.3	176.1	41.5	0	0	0	0	110.9	T406	S404-T406 PolarHBondContact O-N 3.47Å
405	P	28	Very low	36.8	Very low	115 Å²	115	103.6 Å²	103.6	75%	0.747	60%	0.595	S	S	*	*			trans	-71.2	103.7	-179.4	28.2	-33.9	0	0	0	110.5	N407	P405-N407 PolarHBondContact O-N 3.28Å
406	T	32.7	Very low	38.6	Very low	126 Å²	126	98 Å²	98	77%	0.773	56%	0.563	S	S	*	*			trans	-64.6	126.4	166.2	49.6	0	0	0	0	109.3	S404 L408	S404-T406 PolarHBondContact O-N 3.47Å; T406-L408 PolarHBondContact O-N 3.29Å
407	N	40.5	Very low	40.6	Very low	82 Å²	82	93.2 Å²	93.2	44%	0.439	53%	0.529	S	S	.	.			trans	-53.9	122.8	-179.9	-73.2	-42.7	0	0	0	110.9	P405 D409	P405-N407 PolarHBondContact O-N 3.28Å; N407-D409 PolarHBondContact O-N 2.75Å
408	L	50.7	Low	41.9	Very low	46 Å²	46	92.3 Å²	92.3	24%	0.241	52%	0.517	C	S	.	.			trans	-74.8	113.3	173.6	-151.7	73.8	0	0	0	109	T406 T412 I413 I483 N491	T406-L408 PolarHBondContact O-N 3.29Å; L408-T412 HydrophobicContact CD1-CG2 4.04Å; L408-T412 HydrophobicContact CG-CG2 4.14Å; L408-I413 HydrophobicContact CD2-CD1 4.35Å; L408-I413 HydrophobicContact CD2-CG1 3.87Å; L408-I413 HydrophobicContact CG-CG1 4.26Å; L408-I483 HydrophobicContact CD2-CG1 4.1Å; L408-I483 HydrophobicContact CD2-CG2 4.15Å; L408-N491 PolarHBondContact O-ND2 2.95Å
409	D	49.7	Very low	43.8	Very low	60 Å²	60	88.7 Å²	88.7	32%	0.321	50%	0.497	S	S	.	.			trans	-69.5	154.6	-175.7	-176.2	40.6	0	0	0	112.6	N407 T411 T412 I413	N407-D409 PolarHBondContact O-N 2.75Å; D409-T411 PolarHBondContact O-N 2.73Å; D409-T411 VanDerWaalsContact OD2-CB 3.3Å; D409-T411 WeakPolarHBondContact OD2-CB 3.27Å; D409-T411 VanDerWaalsContact OD2-CG2 3.24Å; D409-T411 WeakPolarHBondContact OD2-CG2 3.12Å; D409-T411 PolarHBondContact OD2-N 3.31Å; D409-T411 VanDerWaalsContact OD2-N 3.16Å; D409-T411 PolarHBondContact OD2-OG1 2.98Å; D409-T412 WeakPolarHBondContact O-CB 3.48Å; D409-T412 PolarHBondContact O-N 3.03Å; D409-T412 VanDerWaalsContact O-N 3.13Å; D409-I413 WeakPolarHBondContact O-CG1 3.22Å; D409-I413 PolarHBondContact O-N 3.25Å; D409-I413 VanDerWaalsContact O-N 3.17Å
410	I	54.4	Low	45.1	Very low	44 Å²	44	81.6 Å²	81.6	23%	0.226	46%	0.459	C	S	.	.	H	α-helix	trans	-56.9	-37.4	175.7	-60.5	175.6	0	0	0	110.2	T412 I413 T414 N491	I410-T412 PolarHBondContact O-N 2.71Å; I410-I413 PolarHBondContact O-N 3.15Å; I410-T414 WeakPolarHBondContact O-CB 3.47Å; I410-T414 PolarHBondContact O-N 3.36Å; I410-T414 PolarHBondContact O-OG1 2.86Å; I410-N491 HydrophobicContact CG1-CB 4.47Å
411	T	54.3	Low	46.3	Very low	88 Å²	88	75.9 Å²	75.9	54%	0.54	43%	0.428	S	S	.	.	H	α-helix	trans	-58.7	-45.1	176.4	58.6	0	0	0	0	112.2	D409 I413 T415	D409-T411 PolarHBondContact O-N 2.73Å; D409-T411 VanDerWaalsContact OD2-CB 3.3Å; D409-T411 WeakPolarHBondContact OD2-CB 3.27Å; D409-T411 VanDerWaalsContact OD2-CG2 3.24Å; D409-T411 WeakPolarHBondContact OD2-CG2 3.12Å; D409-T411 PolarHBondContact OD2-N 3.31Å; D409-T411 VanDerWaalsContact OD2-N 3.16Å; D409-T411 PolarHBondContact OD2-OG1 2.98Å; T411-I413 PolarHBondContact O-N 2.49Å; T411-T415 VanDerWaalsContact O-CB 3.29Å; T411-T415 WeakPolarHBondContact O-CB 3.41Å; T411-T415 PolarHBondContact O-N 3.38Å; T411-T415 PolarHBondContact O-OG1 3.16Å
412	T	60.9	Low	47.5	Very low	71 Å²	71	75.4 Å²	75.4	44%	0.436	42%	0.419	S	S	.	.	H	α-helix	trans	-61.6	-42.9	176.6	-49.6	0	0	0	0	111.5	L408 D409 I410 T415 F416	L408-T412 HydrophobicContact CD1-CG2 4.04Å; L408-T412 HydrophobicContact CG-CG2 4.14Å; D409-T412 WeakPolarHBondContact O-CB 3.48Å; D409-T412 PolarHBondContact O-N 3.03Å; D409-T412 VanDerWaalsContact O-N 3.13Å; I410-T412 PolarHBondContact O-N 2.71Å; T412-T415 PolarHBondContact O-N 3.12Å; T412-F416 PolarHBondContact O-N 3.08Å
413	I	58.7	Low	48.7	Very low	3 Å²	3	70.5 Å²	70.5	2%	0.015	39%	0.391	C	S	.	.	H	α-helix	trans	-74.2	-40.9	-177.8	-53.6	169	0	0	0	111.2	L408 D409 I410 T411 T415 F416 I417 I483 L495	L408-I413 HydrophobicContact CD2-CD1 4.35Å; L408-I413 HydrophobicContact CD2-CG1 3.87Å; L408-I413 HydrophobicContact CG-CG1 4.26Å; D409-I413 WeakPolarHBondContact O-CG1 3.22Å; D409-I413 PolarHBondContact O-N 3.25Å; D409-I413 VanDerWaalsContact O-N 3.17Å; I410-I413 PolarHBondContact O-N 3.15Å; T411-I413 PolarHBondContact O-N 2.49Å; I413-T415 VanDerWaalsContact C-N 3.27Å; I413-T415 PolarHBondContact O-N 2.9Å; I413-F416 PolarHBondContact O-N 3.26Å; I413-I417 HydrophobicContact CG2-CD1 4Å; I413-I417 VanDerWaalsContact O-CG1 3.29Å; I413-I417 WeakPolarHBondContact O-CG1 3.38Å; I413-I417 PolarHBondContact O-N 2.79Å; I413-I483 HydrophobicContact CB-CG2 4.33Å; I413-I483 HydrophobicContact CD1-CG2 3.61Å; I413-I483 HydrophobicContact CG1-CG2 3.63Å; I413-I483 HydrophobicContact CG2-CG2 3.74Å; I413-L495 HydrophobicContact CB-CD1 4.31Å; I413-L495 HydrophobicContact CB-CD2 4.31Å; I413-L495 HydrophobicContact CD1-CD1 3.78Å; I413-L495 HydrophobicContact CG2-CD1 3.68Å; I413-L495 HydrophobicContact CG2-CD2 3.57Å; I413-L495 HydrophobicContact CG2-CG 4.29Å
414	T	54.5	Low	49.4	Very low	55 Å²	55	63.1 Å²	63.1	34%	0.337	37%	0.365	S	S	.	.	H	α-helix	trans	-62.4	-35.4	171.1	-67.6	0	0	0	0	111.1	I410 I417 N418	I410-T414 WeakPolarHBondContact O-CB 3.47Å; I410-T414 PolarHBondContact O-N 3.36Å; I410-T414 PolarHBondContact O-OG1 2.86Å; T414-I417 PolarHBondContact O-N 2.93Å; T414-N418 VanDerWaalsContact O-CB 3.22Å; T414-N418 WeakPolarHBondContact O-CB 3.47Å; T414-N418 PolarHBondContact O-N 2.84Å; T414-N418 PolarHBondContact O-OD1 2.89Å
415	T	61.9	Low	49.7	Very low	93 Å²	93	60.9 Å²	60.9	57%	0.571	35%	0.349	S	S	*	.	H	α-helix	trans	-68.3	-39	174.4	-56.4	0	0	0	0	111.7	T411 T412 I413 N418 S419	T411-T415 VanDerWaalsContact O-CB 3.29Å; T411-T415 WeakPolarHBondContact O-CB 3.41Å; T411-T415 PolarHBondContact O-N 3.38Å; T411-T415 PolarHBondContact O-OG1 3.16Å; T412-T415 PolarHBondContact O-N 3.12Å; I413-T415 VanDerWaalsContact C-N 3.27Å; I413-T415 PolarHBondContact O-N 2.9Å; T415-N418 PolarHBondContact O-N 3.26Å; T415-S419 WeakPolarHBondContact O-CB 3.5Å; T415-S419 PolarHBondContact O-N 3.02Å
416	F	63	Low	49.9	Very low	40 Å²	40	61.3 Å²	61.3	18%	0.175	34%	0.337	C	S	.	.	H	α-helix	trans	-63.3	-43.9	170.9	174.3	-91.5	0	0	0	112.2	T412 I413 S419 Y420 F476 S479 I483	T412-F416 PolarHBondContact O-N 3.08Å; I413-F416 PolarHBondContact O-N 3.26Å; F416-S419 PolarHBondContact O-N 2.94Å; F416-S419 PolarHBondContact O-OG 2.93Å; F416-Y420 PolarHBondContact O-N 3.1Å; F416-F476 HydrophobicContact CE1-CD2 4.33Å; F416-F476 HydrophobicContact CE1-CE2 4.34Å; F416-S479 WeakPolarHBondContact CE2-OG 3.41Å; F416-S479 WeakPolarHBondContact CZ-OG 3.46Å; F416-I483 HydrophobicContact CB-CD1 4.42Å; F416-I483 HydrophobicContact CD1-CD1 3.69Å; F416-I483 HydrophobicContact CD2-CD1 4.27Å; F416-I483 HydrophobicContact CE1-CD1 4Å; F416-I483 HydrophobicContact CG-CD1 3.86Å; F416-I483 HydrophobicContact CZ-CD1 4.41Å
417	I	60.1	Low	49.9	Very low	18 Å²	18	59.8 Å²	59.8	9%	0.092	32%	0.321	C	S	.	.	H	α-helix	trans	-65.2	-42.5	177.4	-68	165.7	0	0	0	110.3	I413 T414 S419 Y420 L421 L495 F499	I413-I417 HydrophobicContact CG2-CD1 4Å; I413-I417 VanDerWaalsContact O-CG1 3.29Å; I413-I417 WeakPolarHBondContact O-CG1 3.38Å; I413-I417 PolarHBondContact O-N 2.79Å; T414-I417 PolarHBondContact O-N 2.93Å; I417-S419 VanDerWaalsContact C-N 3.31Å; I417-S419 PolarHBondContact O-N 2.77Å; I417-Y420 CarbonylContact O-C 3.58Å; I417-Y420 PolarHBondContact O-N 3.24Å; I417-L421 HydrophobicContact CG2-CD1 3.83Å; I417-L421 HydrophobicContact CG2-CG 4.23Å; I417-L421 WeakPolarHBondContact O-CB 3.3Å; I417-L421 WeakPolarHBondContact O-CG 3.07Å; I417-L421 PolarHBondContact O-N 3.24Å; I417-L495 HydrophobicContact CD1-CD2 3.52Å; I417-F499 HydrophobicContact CD1-CE2 3.54Å; I417-F499 HydrophobicContact CD1-CZ 3.45Å; I417-F499 VanDerWaalsContact CD1-CZ 3.45Å; I417-F499 HydrophobicContact CG1-CE2 4.34Å; I417-F499 HydrophobicContact CG1-CZ 3.8Å; I417-F499 HydrophobicContact CG2-CE1 4.41Å; I417-F499 HydrophobicContact CG2-CZ 4.2Å
418	N	51.9	Low	49.4	Very low	78 Å²	78	60 Å²	60	42%	0.417	33%	0.326	S	S	.	.	H	α-helix	trans	-70	-26.1	176.8	-69.1	-5	0	0	0	112.1	T414 T415 N422	T414-N418 VanDerWaalsContact O-CB 3.22Å; T414-N418 WeakPolarHBondContact O-CB 3.47Å; T414-N418 PolarHBondContact O-N 2.84Å; T414-N418 PolarHBondContact O-OD1 2.89Å; T415-N418 PolarHBondContact O-N 3.26Å; N418-N422 WeakPolarHBondContact O-CB 3.07Å; N418-N422 PolarHBondContact O-N 3.03Å; N418-N422 PolarHBondContact O-OD1 3.38Å
419	S	61.3	Low	48.3	Very low	54 Å²	54	63.6 Å²	63.6	38%	0.378	35%	0.345	S	S	.	.	H	α-helix	trans	-73.6	-33.4	170.5	78.4	0	0	0	0	112	T415 F416 I417 N422 K423	T415-S419 WeakPolarHBondContact O-CB 3.5Å; T415-S419 PolarHBondContact O-N 3.02Å; F416-S419 PolarHBondContact O-N 2.94Å; F416-S419 PolarHBondContact O-OG 2.93Å; I417-S419 VanDerWaalsContact C-N 3.31Å; I417-S419 PolarHBondContact O-N 2.77Å; S419-N422 CarbonylContact O-C 3.57Å; S419-K423 VanDerWaalsContact O-CB 3.25Å; S419-K423 WeakPolarHBondContact O-CB 3.37Å; S419-K423 PolarHBondContact O-N 2.68Å
420	Y	52.5	Low	47.3	Very low	2 Å²	2	66.2 Å²	66.2	1%	0.008	36%	0.363	C	S	.	.	H	α-helix	trans	-76.7	-31.7	171	-167.4	-81.9	0	0	0	112.8	L31 F416 I417 K423 N424 F476	L31-Y420 HydrophobicContact CD1-CD2 3.65Å; L31-Y420 HydrophobicContact CD1-CE2 3.62Å; L31-Y420 HydrophobicContact CG-CD2 4.35Å; F416-Y420 PolarHBondContact O-N 3.1Å; I417-Y420 CarbonylContact O-C 3.58Å; I417-Y420 PolarHBondContact O-N 3.24Å; Y420-K423 CarbonylContact O-C 3.5Å; Y420-K423 WeakPolarHBondContact O-CA 3.27Å; Y420-K423 PolarHBondContact O-N 3.15Å; Y420-N424 HydrophobicContact CD1-CB 4.19Å; Y420-N424 HydrophobicContact CE1-CB 3.62Å; Y420-N424 VanDerWaalsContact CE1-OD1 3.31Å; Y420-N424 WeakPolarHBondContact CE1-OD1 3.49Å; Y420-N424 PolarHBondContact O-N 3.16Å; Y420-N424 PolarHBondContact OH-OD1 3.47Å; Y420-F476 AromaticContact CD1-CD2 3.61Å; Y420-F476 HydrophobicContact CD1-CD2 3.61Å; Y420-F476 AromaticContact CD1-CE2 3.86Å; Y420-F476 HydrophobicContact CD1-CE2 3.86Å; Y420-F476 HydrophobicContact CD1-CG 4.31Å; Y420-F476 HydrophobicContact CD2-CB 4.18Å; Y420-F476 AromaticContact CD2-CD2 3.62Å; Y420-F476 HydrophobicContact CD2-CD2 3.62Å; Y420-F476 HydrophobicContact CD2-CE2 4.45Å; Y420-F476 HydrophobicContact CD2-CG 4.32Å; Y420-F476 HydrophobicContact CE1-CB 4.33Å; Y420-F476 AromaticContact CE1-CD2 3.94Å; Y420-F476 HydrophobicContact CE1-CD2 3.94Å; Y420-F476 HydrophobicContact CE1-CE2 4.47Å; Y420-F476 HydrophobicContact CE1-CG 4.18Å; Y420-F476 HydrophobicContact CE2-CB 3.67Å; Y420-F476 AromaticContact CE2-CD2 3.94Å; Y420-F476 HydrophobicContact CE2-CD2 3.94Å; Y420-F476 HydrophobicContact CE2-CG 4.18Å; Y420-F476 AromaticContact CG-CD2 3.47Å; Y420-F476 HydrophobicContact CG-CD2 3.47Å; Y420-F476 VanDerWaalsContact CG-CD2 3.47Å; Y420-F476 AromaticContact CG-CE2 3.88Å; Y420-F476 HydrophobicContact CG-CE2 3.88Å; Y420-F476 HydrophobicContact CG-CG 4.41Å
421	L	48.5	Very low	46.1	Very low	55 Å²	55	71 Å²	71	29%	0.288	39%	0.388	S	S	.	.	H	α-helix	trans	-78.9	-23.9	172.8	-72.1	177.9	0	0	0	112.2	H33 I417 L505	H33-L421 WeakPolarHBondContact CB-O 3.46Å; H33-L421 PolarHBondContact CD2-O 2.82Å; H33-L421 VanDerWaalsContact CD2-O 3.24Å; I417-L421 HydrophobicContact CG2-CD1 3.83Å; I417-L421 HydrophobicContact CG2-CG 4.23Å; I417-L421 WeakPolarHBondContact O-CB 3.3Å; I417-L421 WeakPolarHBondContact O-CG 3.07Å; I417-L421 PolarHBondContact O-N 3.24Å; L421-L505 HydrophobicContact CD2-CD1 4.16Å
422	N	45.7	Very low	44.8	Very low	76 Å²	76	72 Å²	72	41%	0.406	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	4.7	161.5	-66.5	4.3	0	0	0	112	H33 H34 N418 S419	H33-N422 CarbonylContact C-O 3.07Å; H34-N422 HydrophobicContact CB-CB 4.41Å; H34-N422 PolarHBondContact CD2-OD1 3.44Å; N418-N422 WeakPolarHBondContact O-CB 3.07Å; N418-N422 PolarHBondContact O-N 3.03Å; N418-N422 PolarHBondContact O-OD1 3.38Å; S419-N422 CarbonylContact O-C 3.57Å
423	K	49.2	Very low	43.2	Very low	77 Å²	77	75.6 Å²	75.6	34%	0.335	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.9	47.5	173.2	-72.1	-66	-66.9	160.3	0	114.3	L31 D32 S419 Y420	L31-K423 HydrophobicContact CB-CB 4.09Å; L31-K423 HydrophobicContact CD2-CB 3.48Å; L31-K423 VanDerWaalsContact CD2-CB 3.48Å; L31-K423 HydrophobicContact CD2-CG 4Å; L31-K423 HydrophobicContact CG-CB 3.61Å; L31-K423 HydrophobicContact CG-CG 4.48Å; L31-K423 WeakPolarHBondContact O-CE 3.45Å; L31-K423 PolarHBondContact O-NZ 2.93Å; D32-K423 VanDerWaalsContact C-C 3.47Å; D32-K423 VanDerWaalsContact C-CA 3.44Å; D32-K423 VanDerWaalsContact CA-NZ 3.34Å; D32-K423 WeakPolarHBondContact CA-O 3.32Å; D32-K423 VanDerWaalsContact N-C 3.25Å; D32-K423 VanDerWaalsContact N-CE 3.28Å; D32-K423 PolarHBondContact N-O 3.34Å; D32-K423 WeakPolarHBondContact O-CD 3.26Å; D32-K423 WeakPolarHBondContact O-CE 3.48Å; D32-K423 PolarHBondContact O-NZ 3.32Å; S419-K423 VanDerWaalsContact O-CB 3.25Å; S419-K423 WeakPolarHBondContact O-CB 3.37Å; S419-K423 PolarHBondContact O-N 2.68Å; Y420-K423 CarbonylContact O-C 3.5Å; Y420-K423 WeakPolarHBondContact O-CA 3.27Å; Y420-K423 PolarHBondContact O-N 3.15Å
424	N	36.5	Very low	41.7	Very low	47 Å²	47	80.8 Å²	80.8	25%	0.251	45%	0.447	S	S	.	.	S	Bend	trans	-149.5	117.4	150	-150.8	175.5	0	0	0	112.5	D32 H33 Y420	D32-N424 PolarHBondContact OD2-ND2 3.21Å; H33-N424 VanDerWaalsContact CB-N 3.32Å; H33-N424 VanDerWaalsContact CB-O 3.29Å; H33-N424 WeakPolarHBondContact CB-O 3.33Å; H33-N424 PolarHBondContact CD2-O 3.05Å; H33-N424 VanDerWaalsContact CD2-O 3.26Å; H33-N424 VanDerWaalsContact N-CA 3.34Å; Y420-N424 HydrophobicContact CD1-CB 4.19Å; Y420-N424 HydrophobicContact CE1-CB 3.62Å; Y420-N424 VanDerWaalsContact CE1-OD1 3.31Å; Y420-N424 WeakPolarHBondContact CE1-OD1 3.49Å; Y420-N424 PolarHBondContact O-N 3.16Å; Y420-N424 PolarHBondContact OH-OD1 3.47Å
425	S	29.5	Very low	40.5	Very low	49 Å²	49	85 Å²	85	34%	0.343	47%	0.468	S	S	.	.	S	Bend	trans	107.2	26.4	176.3	71.5	0	0	0	0	121.2	D32 H33 T428	D32-S425 WeakPolarHBondContact OD1-CA 3.47Å; D32-S425 PolarHBondContact OD1-N 3.18Å; D32-S425 VanDerWaalsContact OD2-CA 3.32Å; D32-S425 WeakPolarHBondContact OD2-CA 3.14Å; D32-S425 PolarHBondContact OD2-N 2.72Å; H33-S425 PolarHBondContact CD2-OG 2.68Å; H33-S425 PolarHBondContact CE1-O 2.86Å; H33-S425 PolarHBondContact CE1-OG 2.65Å; H33-S425 PolarHBondContact ND1-O 3.23Å; H33-S425 PolarHBondContact ND1-OG 3.06Å; H33-S425 PolarHBondContact NE2-OG 2.74Å; S425-T428 PolarHBondContact O-OG1 3.33Å
426	Y	30.9	Very low	38.8	Very low	123 Å²	123	87.6 Å²	87.6	48%	0.482	48%	0.478	S	S	.	.	S	Bend	trans	-83.4	-42.1	171.7	-139.9	-18.7	0	0	0	111.4	D32 H33 H34 T428 N429	D32-Y426 PolarHBondContact OD1-N 3.12Å; H33-Y426 VanDerWaalsContact CA-CB 3.48Å; H33-Y426 VanDerWaalsContact CA-N 3.28Å; H33-Y426 PolarHBondContact ND1-N 2.8Å; H33-Y426 WeakPolarHBondContact O-CD2 3.46Å; H34-Y426 WeakPolarHBondContact O-CD1 3.5Å; H34-Y426 WeakPolarHBondContact O-CE1 3.41Å; Y426-T428 PolarHBondContact O-N 3.08Å; Y426-N429 PolarHBondContact O-N 3.03Å
427	E	32.8	Very low	37.2	Very low	95 Å²	95	92.6 Å²	92.6	44%	0.444	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-59.8	-17.4	-173.4	-68.2	162.1	179.4	0	0	111.3	D32 N429 T430	D32-E427 HydrophobicContact CB-CG 4.4Å; D32-E427 WeakPolarHBondContact CB-OE2 3.37Å; D32-E427 VanDerWaalsContact CG-OE2 3.27Å; D32-E427 WeakPolarHBondContact OD1-CG 3.46Å; D32-E427 PolarHBondContact OD1-N 3.33Å; E427-N429 PolarHBondContact O-N 3.02Å; E427-T430 PolarHBondContact O-N 2.64Å; E427-T430 PolarHBondContact O-OG1 3.18Å
428	T	30.2	Very low	35.6	Very low	87 Å²	87	99.9 Å²	99.9	53%	0.534	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-54.8	-22.3	168.7	63.3	0	0	0	0	114.9	S425 Y426	S425-T428 PolarHBondContact O-OG1 3.33Å; Y426-T428 PolarHBondContact O-N 3.08Å
429	N	27.4	Very low	34.4	Very low	121 Å²	121	106 Å²	106	65%	0.647	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-93.6	-5.1	-179.9	-75.3	-27.8	0	0	0	114.7	Y426 E427	Y426-N429 PolarHBondContact O-N 3.03Å; E427-N429 PolarHBondContact O-N 3.02Å
430	T	29.9	Very low	32.8	Very low	115 Å²	115	109.3 Å²	109.3	71%	0.706	57%	0.572	S	S	*	*	S	Bend	trans	-106.5	-6.3	-172.4	27.9	0	0	0	0	115.7	E427	E427-T430 PolarHBondContact O-N 2.64Å; E427-T430 PolarHBondContact O-OG1 3.18Å
431	I	29.2	Very low	31.8	Very low	143 Å²	143	114.7 Å²	114.7	73%	0.733	60%	0.601	S	S	*	*	S	Bend	trans	-100.1	-4.3	-170.3	-62.7	175.1	0	0	0	112.9	N433	I431-N433 PolarHBondContact O-N 2.92Å
432	T	26.5	Very low	30.8	Very low	111 Å²	111	118.3 Å²	118.3	68%	0.681	62%	0.621	S	S	*	*	S	Bend	trans	-90.9	7	-170.3	44.8	0	0	0	0	116.2
433	N	26.6	Very low	30	Very low	146 Å²	146	120.5 Å²	120.5	78%	0.781	63%	0.633	S	S	*	*			trans	-137.8	81.1	-178.6	-88.6	-41.4	0	0	0	113.3	I431	I431-N433 PolarHBondContact O-N 2.92Å
434	S	28	Very low	29	Very low	111 Å²	111	122.6 Å²	122.6	78%	0.776	65%	0.647	S	S	*	*			trans	-165.5	94.2	154.1	-83	0	0	0	0	112
435	N	29.1	Very low	28.6	Very low	145 Å²	145	126.2 Å²	126.2	78%	0.775	67%	0.667	S	S	*	*			trans	26.8	115.9	133	-46.3	-24.6	0	0	0	116.9
436	N	26.1	Very low	28.5	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	68%	0.683	S	S	*	*				50.1	131.8	59.4	-65.5	-23.2	0	0	0	114.8
437	N	29.2	Very low	28.4	Very low	146 Å²	146	130.7 Å²	130.7	78%	0.781	69%	0.693	S	S	*	*			trans	70.9	146	171.1	-61.4	24.3	0	0	0	114.8
438	E	27.1	Very low	28.2	Very low	170 Å²	170	132.1 Å²	132.1	79%	0.794	70%	0.703	S	S	*	*			cis	-159.1	-160	-16.1	-171.3	151.7	-160.5	0	0	108.4
439	Y	26.4	Very low	28.2	Very low	207 Å²	207	133 Å²	133	81%	0.812	71%	0.705	S	S	*	*			trans	-71.2	158.6	-171.6	-91.2	-103.6	0	0	0	116.3
440	D	28.5	Very low	28.3	Very low	124 Å²	124	135 Å²	135	66%	0.663	71%	0.71	S	S	*	*			trans	83.9	131.6	138.8	-92.4	17.4	0	0	0	123.6
441	N	30.8	Very low	28.3	Very low	115 Å²	115	132.9 Å²	132.9	62%	0.615	70%	0.704	S	S	*	*			trans	69.4	109.3	142.3	-65.4	-43	0	0	0	121
442	N	28	Very low	28.4	Very low	130 Å²	130	130.7 Å²	130.7	70%	0.695	70%	0.701	S	S	*	*				87.9	143	120.8	-71.3	2.7	0	0	0	120.5
443	D	28.5	Very low	28.5	Very low	123 Å²	123	133.3 Å²	133.3	66%	0.658	71%	0.706	S	S	*	*			trans	69.7	99.5	138.1	-73.8	16.9	0	0	0	118.7
444	N	28.5	Very low	28.5	Very low	120 Å²	120	130.9 Å²	130.9	64%	0.642	70%	0.7	S	S	*	*				94.3	130.3	114.8	-76	-39.9	0	0	0	117.2
445	N	27.5	Very low	28.5	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	70%	0.698	S	S	*	*				90.1	127.1	127.6	-83.4	-12.9	0	0	0	119.8
446	I	28.1	Very low	28.5	Very low	133 Å²	133	127.9 Å²	127.9	68%	0.682	69%	0.686	S	S	*	*				76	129.4	125.1	-64.2	178.8	0	0	0	115.2
447	L	27.7	Very low	28.6	Very low	132 Å²	132	125.9 Å²	125.9	69%	0.691	68%	0.679	S	S	*	*			cis	-167.9	161.3	-5.2	-129	77.8	0	0	0	103
448	L	29	Very low	28.6	Very low	126 Å²	126	125.7 Å²	125.7	66%	0.66	68%	0.677	S	S	*	*			cis	-176	-168	-14.6	-146.9	52.7	0	0	0	106.8
449	N	30.7	Very low	28.7	Very low	105 Å²	105	122.1 Å²	122.1	56%	0.561	67%	0.671	S	S	*	*			trans	69.8	137.8	146.8	-64.9	-6.7	0	0	0	117.7
450	H	29.4	Very low	28.8	Very low	164 Å²	164	119 Å²	119	76%	0.759	67%	0.669	S	S	*	*			cis	-158.7	150.5	-8.8	-102.7	-36.7	0	0	0	106.3
451	A	29.1	Very low	28.7	Very low	70 Å²	70	121.4 Å²	121.4	58%	0.579	68%	0.676	S	S	*	*			cis	-157.1	172	-7.4	0	0	0	0	0	109.3
452	S	31.1	Very low	28.5	Very low	97 Å²	97	121.2 Å²	121.2	68%	0.678	68%	0.683	S	S	*	*			trans	53.6	132.4	144.3	63.9	0	0	0	0	121.3
453	E	28.7	Very low	28.4	Very low	165 Å²	165	123.2 Å²	123.2	77%	0.771	69%	0.689	S	S	*	*			cis	-173.8	133.5	-30.9	-109.7	150	139	0	0	104.2
454	S	27.6	Very low	28.4	Very low	96 Å²	96	124.4 Å²	124.4	67%	0.671	69%	0.693	S	S	*	*				66.4	134.5	79.4	-49.2	0	0	0	0	112.6
455	T	27.5	Very low	28.2	Very low	119 Å²	119	127.7 Å²	127.7	73%	0.73	70%	0.702	S	S	*	*			cis	-168.3	178.9	5	7.7	0	0	0	0	111.1
456	S	28.2	Very low	28	Very low	74 Å²	74	128.2 Å²	128.2	52%	0.517	71%	0.71	S	S	.	*			trans	75.1	149.4	138.8	54.5	0	0	0	0	119.7
457	T	28.7	Very low	27.8	Very low	104 Å²	104	127.6 Å²	127.6	64%	0.638	72%	0.717	S	S	*	*			cis	-164.3	170	-25.7	32.9	0	0	0	0	105.7
458	L	29.3	Very low	27.8	Very low	142 Å²	142	130.7 Å²	130.7	74%	0.743	73%	0.727	S	S	*	*			cis	-170.4	148.7	36.7	-167	71.8	0	0	0	111.2
459	S	29.5	Very low	27.8	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	74%	0.738	S	S	*	*			trans	60.4	148.7	157	48.9	0	0	0	0	119.3
460	D	28.6	Very low	27.6	Very low	142 Å²	142	136.4 Å²	136.4	76%	0.759	75%	0.749	S	S	*	*			cis	-144	178.2	13.5	-139.2	-28	0	0	0	114.6
461	Q	26.2	Very low	28	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	74%	0.74	S	S	*	*			trans	-86.7	144.9	-159.3	-57	171.1	20	0	0	116.6
462	S	26.4	Very low	29	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	72%	0.719	S	S	*	*			trans	-167.8	110.5	130.4	26.8	0	0	0	0	116.9
463	Q	27.2	Very low	29.9	Very low	173 Å²	173	129.9 Å²	129.9	81%	0.808	70%	0.7	S	S	*	*			trans	72.7	138.3	136.7	-57	-167.8	20.5	0	0	123.6
464	I	26.9	Very low	30.8	Very low	147 Å²	147	125.9 Å²	125.9	75%	0.754	68%	0.684	S	S	*	*			trans	64.8	103.3	157.7	-57.1	149.5	0	0	0	115.4
465	K	24	Very low	31.9	Very low	189 Å²	189	122 Å²	122	82%	0.822	66%	0.656	S	S	*	*			cis	80.8	132.4	36.3	-149.8	177.7	-175.9	177.4	0	114.2
466	T	25	Very low	33.2	Very low	136 Å²	136	116.5 Å²	116.5	83%	0.834	62%	0.622	S	S	*	*			trans	63.8	99.5	179.1	62.8	0	0	0	0	119
467	S	23.7	Very low	34.2	Very low	119 Å²	119	115 Å²	115	83%	0.832	61%	0.608	S	S	*	*			trans	-159	85.7	163	50.9	0	0	0	0	113
468	H	27.3	Very low	35.1	Very low	197 Å²	197	111.6 Å²	111.6	91%	0.912	59%	0.588	S	S	*	*	S	Bend	trans	-143.4	27.2	173.8	-143.3	-68.5	0	0	0	114.8
469	E	28.5	Very low	36.4	Very low	187 Å²	187	106.1 Å²	106.1	87%	0.874	56%	0.562	S	S	*	*	S	Bend	trans	-145	6.9	-169.6	-138.9	169.7	-133.9	0	0	114.4
470	M	26.6	Very low	37.6	Very low	164 Å²	164	103 Å²	103	81%	0.808	54%	0.535	S	S	*	.			trans	-113	7.2	-173.9	-78.9	-76.7	165.3	0	0	114.3	N474	M470-N474 PolarHBondContact O-ND2 2.82Å
471	N	38	Very low	38.8	Very low	105 Å²	105	98.9 Å²	98.9	56%	0.561	52%	0.515	S	S	*	.	S	Bend	trans	-107	52.6	-173.7	-89.5	-14.1	0	0	0	111.5	S29 R30	S29-N471 CarbonylContact C-O 3.38Å; S29-N471 WeakPolarHBondContact CA-O 2.96Å; S29-N471 PolarHBondContact OG-O 3.37Å; R30-N471 PolarHBondContact N-O 2.9Å
472	D	50.9	Low	40.1	Very low	27 Å²	27	93 Å²	93	14%	0.144	49%	0.493	C	S	.	.	S	Bend	trans	-133.9	-55.9	165.6	-150.2	-17.6	0	0	0	114.3	S29 R30 L31 N474 D475	S29-D472 WeakPolarHBondContact OG-CA 3.48Å; S29-D472 PolarHBondContact OG-N 3.07Å; S29-D472 PolarHBondContact OG-O 3.13Å; R30-D472 VanDerWaalsContact C-CG 3.45Å; R30-D472 VanDerWaalsContact C-OD1 3.24Å; R30-D472 VanDerWaalsContact CA-OD1 3.27Å; R30-D472 WeakPolarHBondContact CA-OD1 3.36Å; L31-D472 VanDerWaalsContact CA-OD1 3.31Å; L31-D472 WeakPolarHBondContact CA-OD1 3.15Å; L31-D472 WeakPolarHBondContact CA-OD2 3.42Å; L31-D472 WeakPolarHBondContact CD1-OD1 3.42Å; L31-D472 PolarHBondContact N-OD1 2.97Å; L31-D472 PolarHBondContact N-OD2 2.97Å; L31-D472 VanDerWaalsContact N-OD2 3.11Å; D472-N474 PolarHBondContact O-N 2.82Å; D472-N474 VanDerWaalsContact O-N 3.09Å; D472-D475 WeakPolarHBondContact O-CA 3.47Å; D472-D475 PolarHBondContact O-N 3.03Å
473	F	49.7	Very low	41.3	Very low	63 Å²	63	88.6 Å²	88.6	28%	0.276	46%	0.461	S	S	.	.	H	α-helix	trans	-56.3	-30.8	179.2	180	-115.6	0	0	0	114.3	D475 F476 I477 L508 F509	F473-D475 PolarHBondContact O-N 3.15Å; F473-F476 VanDerWaalsContact O-CB 3.3Å; F473-F476 WeakPolarHBondContact O-CB 3.42Å; F473-F476 PolarHBondContact O-N 2.89Å; F473-I477 HydrophobicContact CD1-CG1 4.17Å; F473-I477 HydrophobicContact CE1-CD1 4.09Å; F473-I477 HydrophobicContact CE1-CG1 3.78Å; F473-I477 HydrophobicContact CE2-CD1 4Å; F473-I477 HydrophobicContact CE2-CG1 4.15Å; F473-I477 HydrophobicContact CZ-CD1 3.61Å; F473-I477 HydrophobicContact CZ-CG1 3.78Å; F473-I477 WeakPolarHBondContact O-CG1 3.1Å; F473-I477 PolarHBondContact O-N 3.48Å; F473-I477 VanDerWaalsContact O-N 3.09Å; F473-L508 HydrophobicContact CD1-CD2 4.43Å; F473-L508 HydrophobicContact CD2-CD1 4.12Å; F473-L508 HydrophobicContact CD2-CD2 4.22Å; F473-L508 HydrophobicContact CE1-CD2 4.28Å; F473-L508 HydrophobicContact CE2-CB 3.73Å; F473-L508 HydrophobicContact CE2-CD1 4.01Å; F473-L508 HydrophobicContact CE2-CD2 4.07Å; F473-L508 HydrophobicContact CE2-CG 4.16Å; F473-L508 HydrophobicContact CG-CD2 4.4Å; F473-L508 HydrophobicContact CZ-CB 3.79Å; F473-L508 HydrophobicContact CZ-CD2 4.09Å; F473-L508 HydrophobicContact CZ-CG 4.42Å; F473-F509 HydrophobicContact CE2-CE2 4.48Å
474	N	47.3	Very low	42.2	Very low	80 Å²	80	81.8 Å²	81.8	43%	0.428	43%	0.429	S	S	.	.	H	α-helix	trans	-64.8	-26.3	175.5	-76.2	-62.1	0	0	0	112.5	R28 M470 D472 I477 S478	R28-N474 HydrophobicContact CG-CB 4.38Å; R28-N474 PolarHBondContact NE-O 3.36Å; R28-N474 PolarHBondContact NH2-O 2.9Å; M470-N474 PolarHBondContact O-ND2 2.82Å; D472-N474 PolarHBondContact O-N 2.82Å; D472-N474 VanDerWaalsContact O-N 3.09Å; N474-I477 PolarHBondContact O-N 3.44Å; N474-S478 PolarHBondContact O-N 3.37Å
475	D	51.1	Low	43.2	Very low	16 Å²	16	79.1 Å²	79.1	9%	0.086	42%	0.424	C	S	.	.	H	α-helix	trans	-80.6	-20	176.9	-129.7	64.5	0	0	0	114.7	R28 S29 R30 D472 F473 S479	R28-D475 WeakPolarHBondContact CB-OD1 3.43Å; R28-D475 WeakPolarHBondContact CD-OD1 3.36Å; R28-D475 WeakPolarHBondContact CG-OD1 3.32Å; R28-D475 VanDerWaalsContact CZ-CA 3.46Å; R28-D475 VanDerWaalsContact CZ-CG 3.5Å; R28-D475 IonicContact CZ-OD1 3.02Å; R28-D475 IonicContact CZ-OD2 3.08Å; R28-D475 IonicContact NE-OD1 2.68Å; R28-D475 PolarHBondContact NE-OD1 3.26Å; R28-D475 IonicContact NH1-OD1 2.7Å; R28-D475 PolarHBondContact NH1-OD1 2.93Å; R28-D475 IonicContact NH1-OD2 2.68Å; R28-D475 PolarHBondContact NH1-OD2 3.4Å; R28-D475 PolarHBondContact NH2-O 3.36Å; R28-D475 IonicContact NH2-OD1 2.64Å; S29-D475 WeakPolarHBondContact O-CB 3.17Å; S29-D475 VanDerWaalsContact O-OD1 3.06Å; S29-D475 WeakPolarHBondContact OG-CB 3.06Å; S29-D475 PolarHBondContact OG-N 3.5Å; R30-D475 HydrophobicContact CG-CB 3.78Å; R30-D475 WeakPolarHBondContact CG-OD2 3.42Å; R30-D475 IonicContact CZ-OD2 2.75Å; R30-D475 IonicContact NH1-OD2 2.87Å; R30-D475 PolarHBondContact NH1-OD2 2.87Å; D472-D475 WeakPolarHBondContact O-CA 3.47Å; D472-D475 PolarHBondContact O-N 3.03Å; F473-D475 PolarHBondContact O-N 3.15Å; D475-S479 WeakPolarHBondContact O-CB 3.46Å
476	F	54.8	Low	44.3	Very low	3 Å²	3	75.5 Å²	75.5	1%	0.013	41%	0.41	C	S	.	.	H	α-helix	trans	-67.2	-60.3	157.6	-163.3	-118.1	0	0	0	110.4	F416 Y420 F473 S478 S479 W480 F499 F509	F416-F476 HydrophobicContact CE1-CD2 4.33Å; F416-F476 HydrophobicContact CE1-CE2 4.34Å; Y420-F476 AromaticContact CD1-CD2 3.61Å; Y420-F476 HydrophobicContact CD1-CD2 3.61Å; Y420-F476 AromaticContact CD1-CE2 3.86Å; Y420-F476 HydrophobicContact CD1-CE2 3.86Å; Y420-F476 HydrophobicContact CD1-CG 4.31Å; Y420-F476 HydrophobicContact CD2-CB 4.18Å; Y420-F476 AromaticContact CD2-CD2 3.62Å; Y420-F476 HydrophobicContact CD2-CD2 3.62Å; Y420-F476 HydrophobicContact CD2-CE2 4.45Å; Y420-F476 HydrophobicContact CD2-CG 4.32Å; Y420-F476 HydrophobicContact CE1-CB 4.33Å; Y420-F476 AromaticContact CE1-CD2 3.94Å; Y420-F476 HydrophobicContact CE1-CD2 3.94Å; Y420-F476 HydrophobicContact CE1-CE2 4.47Å; Y420-F476 HydrophobicContact CE1-CG 4.18Å; Y420-F476 HydrophobicContact CE2-CB 3.67Å; Y420-F476 AromaticContact CE2-CD2 3.94Å; Y420-F476 HydrophobicContact CE2-CD2 3.94Å; Y420-F476 HydrophobicContact CE2-CG 4.18Å; Y420-F476 AromaticContact CG-CD2 3.47Å; Y420-F476 HydrophobicContact CG-CD2 3.47Å; Y420-F476 VanDerWaalsContact CG-CD2 3.47Å; Y420-F476 AromaticContact CG-CE2 3.88Å; Y420-F476 HydrophobicContact CG-CE2 3.88Å; Y420-F476 HydrophobicContact CG-CG 4.41Å; F473-F476 VanDerWaalsContact O-CB 3.3Å; F473-F476 WeakPolarHBondContact O-CB 3.42Å; F473-F476 PolarHBondContact O-N 2.89Å; F476-S478 PolarHBondContact O-N 3.43Å; F476-S479 PolarHBondContact O-N 3.46Å; F476-S479 VanDerWaalsContact O-N 3.11Å; F476-W480 WeakPolarHBondContact O-CB 3.17Å; F476-W480 PolarHBondContact O-N 2.74Å; F476-F499 HydrophobicContact CE1-CE1 4.37Å; F476-F499 HydrophobicContact CE1-CZ 4.38Å; F476-F499 AromaticContact CZ-CE1 3.81Å; F476-F499 HydrophobicContact CZ-CE1 3.81Å; F476-F499 AromaticContact CZ-CZ 3.66Å; F476-F499 HydrophobicContact CZ-CZ 3.66Å; F476-F509 HydrophobicContact CD1-CE2 4.33Å; F476-F509 HydrophobicContact CD1-CZ 4.05Å; F476-F509 AromaticContact CE1-CE2 3.87Å; F476-F509 HydrophobicContact CE1-CE2 3.87Å; F476-F509 AromaticContact CE1-CZ 3.78Å; F476-F509 HydrophobicContact CE1-CZ 3.78Å
477	I	48.7	Very low	45.2	Very low	43 Å²	43	69.5 Å²	69.5	22%	0.221	37%	0.373	C	S	.	.	H	α-helix	trans	-56.5	-58.6	-162.8	-68.3	-63.4	0	0	0	114.9	F473 N474 S479 W480 V481 F509	F473-I477 HydrophobicContact CD1-CG1 4.17Å; F473-I477 HydrophobicContact CE1-CD1 4.09Å; F473-I477 HydrophobicContact CE1-CG1 3.78Å; F473-I477 HydrophobicContact CE2-CD1 4Å; F473-I477 HydrophobicContact CE2-CG1 4.15Å; F473-I477 HydrophobicContact CZ-CD1 3.61Å; F473-I477 HydrophobicContact CZ-CG1 3.78Å; F473-I477 WeakPolarHBondContact O-CG1 3.1Å; F473-I477 PolarHBondContact O-N 3.48Å; F473-I477 VanDerWaalsContact O-N 3.09Å; N474-I477 PolarHBondContact O-N 3.44Å; I477-S479 PolarHBondContact O-N 3.09Å; I477-W480 PolarHBondContact O-N 3.36Å; I477-V481 WeakPolarHBondContact O-CG2 3.4Å; I477-V481 PolarHBondContact O-N 3.26Å; I477-F509 HydrophobicContact CD1-CD1 4.39Å; I477-F509 HydrophobicContact CD1-CE1 3.4Å; I477-F509 VanDerWaalsContact CD1-CE1 3.4Å; I477-F509 HydrophobicContact CD1-CE2 4.49Å; I477-F509 HydrophobicContact CD1-CZ 3.47Å; I477-F509 VanDerWaalsContact CD1-CZ 3.47Å
478	S	47.2	Very low	46.7	Very low	31 Å²	31	65.1 Å²	65.1	22%	0.217	34%	0.341	C	S	.	.	H	α-helix	trans	-71.1	-15.5	-178.7	-68	0	0	0	0	114.7	K27 N474 F476 S482	K27-S478 WeakPolarHBondContact CE-OG 3.34Å; K27-S478 PolarHBondContact NZ-OG 2.88Å; N474-S478 PolarHBondContact O-N 3.37Å; F476-S478 PolarHBondContact O-N 3.43Å; S478-S482 VanDerWaalsContact O-CB 3.27Å; S478-S482 WeakPolarHBondContact O-CB 3.46Å; S478-S482 PolarHBondContact O-N 2.63Å
479	S	56.3	Low	47.7	Very low	28 Å²	28	59.1 Å²	59.1	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-83.9	-42.6	175.9	-179.2	0	0	0	0	109.3	F416 D475 F476 I477 V481 S482 I483	F416-S479 WeakPolarHBondContact CE2-OG 3.41Å; F416-S479 WeakPolarHBondContact CZ-OG 3.46Å; D475-S479 WeakPolarHBondContact O-CB 3.46Å; F476-S479 PolarHBondContact O-N 3.46Å; F476-S479 VanDerWaalsContact O-N 3.11Å; I477-S479 PolarHBondContact O-N 3.09Å; S479-V481 PolarHBondContact O-N 2.7Å; S479-S482 PolarHBondContact O-N 2.76Å; S479-I483 WeakPolarHBondContact O-CB 3.45Å; S479-I483 VanDerWaalsContact O-CG1 3.26Å; S479-I483 WeakPolarHBondContact O-CG1 3.5Å; S479-I483 PolarHBondContact O-N 2.72Å
480	W	54.9	Low	48.8	Very low	30 Å²	30	50.6 Å²	50.6	11%	0.114	27%	0.271	C	S	.	.	H	α-helix	trans	-55.1	-47.4	164.3	-176.9	87.8	0	0	0	111.4	F476 I477 S482 I483 M484 M496 F499	F476-W480 WeakPolarHBondContact O-CB 3.17Å; F476-W480 PolarHBondContact O-N 2.74Å; I477-W480 PolarHBondContact O-N 3.36Å; W480-S482 PolarHBondContact O-N 3.15Å; W480-I483 PolarHBondContact O-N 3.26Å; W480-M484 HydrophobicContact CD2-CG 3.89Å; W480-M484 HydrophobicContact CE3-CG 4.27Å; W480-M484 HydrophobicContact CG-CG 4.31Å; W480-M484 HydrophobicContact CH2-CE 3.94Å; W480-M484 HydrophobicContact CH2-CG 4.42Å; W480-M484 HydrophobicContact CZ2-CE 3.62Å; W480-M484 HydrophobicContact CZ2-CG 4.06Å; W480-M484 HydrophobicContact CZ2-SD 4.04Å; W480-M484 VanDerWaalsContact O-CB 3.22Å; W480-M484 WeakPolarHBondContact O-CB 3.39Å; W480-M484 WeakPolarHBondContact O-CG 3.23Å; W480-M484 PolarHBondContact O-N 3.07Å; W480-M496 HydrophobicContact CH2-CE 4.4Å; W480-M496 HydrophobicContact CH2-SD 4.22Å; W480-M496 HydrophobicContact CZ2-CE 3.78Å; W480-M496 HydrophobicContact CZ2-SD 3.98Å; W480-F499 AromaticContact CD1-CE2 3.82Å; W480-F499 AromaticContact NE1-CD2 3.9Å; W480-F499 AromaticContact NE1-CE2 3.35Å; W480-F499 VanDerWaalsContact NE1-CE2 3.35Å
481	V	54.5	Low	50	Low	55 Å²	55	44 Å²	44	33%	0.333	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-40.7	174.5	173.7	0	0	0	0	112.2	I477 S479 M484 S485	I477-V481 WeakPolarHBondContact O-CG2 3.4Å; I477-V481 PolarHBondContact O-N 3.26Å; S479-V481 PolarHBondContact O-N 2.7Å; V481-M484 PolarHBondContact O-N 3.21Å; V481-S485 WeakPolarHBondContact O-CB 3.42Å; V481-S485 PolarHBondContact O-N 3.41Å
482	S	52.3	Low	50.5	Low	51 Å²	51	40.3 Å²	40.3	36%	0.357	22%	0.219	S	C	.	.	H	α-helix	trans	-62.9	-50.6	177.2	-172.3	0	0	0	0	111.2	S478 S479 W480 M484 S485 Q486	S478-S482 VanDerWaalsContact O-CB 3.27Å; S478-S482 WeakPolarHBondContact O-CB 3.46Å; S478-S482 PolarHBondContact O-N 2.63Å; S479-S482 PolarHBondContact O-N 2.76Å; W480-S482 PolarHBondContact O-N 3.15Å; S482-M484 PolarHBondContact O-N 3.15Å; S482-S485 PolarHBondContact O-N 3.27Å; S482-S485 PolarHBondContact O-OG 2.87Å; S482-Q486 WeakPolarHBondContact O-CG 3.27Å; S482-Q486 PolarHBondContact O-N 2.91Å
483	I	52.6	Low	50.6	Low	17 Å²	17	40.6 Å²	40.6	9%	0.087	22%	0.219	C	C	.	.	H	α-helix	trans	-55.2	-50.4	173.4	-72.6	165.4	0	0	0	110.2	L408 I413 F416 S479 W480 S485 Q486 S487	L408-I483 HydrophobicContact CD2-CG1 4.1Å; L408-I483 HydrophobicContact CD2-CG2 4.15Å; I413-I483 HydrophobicContact CB-CG2 4.33Å; I413-I483 HydrophobicContact CD1-CG2 3.61Å; I413-I483 HydrophobicContact CG1-CG2 3.63Å; I413-I483 HydrophobicContact CG2-CG2 3.74Å; F416-I483 HydrophobicContact CB-CD1 4.42Å; F416-I483 HydrophobicContact CD1-CD1 3.69Å; F416-I483 HydrophobicContact CD2-CD1 4.27Å; F416-I483 HydrophobicContact CE1-CD1 4Å; F416-I483 HydrophobicContact CG-CD1 3.86Å; F416-I483 HydrophobicContact CZ-CD1 4.41Å; S479-I483 WeakPolarHBondContact O-CB 3.45Å; S479-I483 VanDerWaalsContact O-CG1 3.26Å; S479-I483 WeakPolarHBondContact O-CG1 3.5Å; S479-I483 PolarHBondContact O-N 2.72Å; W480-I483 PolarHBondContact O-N 3.26Å; I483-S485 PolarHBondContact O-N 2.85Å; I483-Q486 CarbonylContact O-C 3.52Å; I483-Q486 PolarHBondContact O-N 3.34Å; I483-S487 WeakPolarHBondContact O-CB 3.46Å; I483-S487 PolarHBondContact O-N 3.05Å
484	M	46.4	Very low	50.6	Low	29 Å²	29	42 Å²	42	14%	0.143	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-19.2	179.1	-64.4	-83	-69.4	0	0	113.1	W480 V481 S482 N492 L495 M496	W480-M484 HydrophobicContact CD2-CG 3.89Å; W480-M484 HydrophobicContact CE3-CG 4.27Å; W480-M484 HydrophobicContact CG-CG 4.31Å; W480-M484 HydrophobicContact CH2-CE 3.94Å; W480-M484 HydrophobicContact CH2-CG 4.42Å; W480-M484 HydrophobicContact CZ2-CE 3.62Å; W480-M484 HydrophobicContact CZ2-CG 4.06Å; W480-M484 HydrophobicContact CZ2-SD 4.04Å; W480-M484 VanDerWaalsContact O-CB 3.22Å; W480-M484 WeakPolarHBondContact O-CB 3.39Å; W480-M484 WeakPolarHBondContact O-CG 3.23Å; W480-M484 PolarHBondContact O-N 3.07Å; V481-M484 PolarHBondContact O-N 3.21Å; S482-M484 PolarHBondContact O-N 3.15Å; M484-N492 WeakPolarHBondContact CA-OD1 3.34Å; M484-N492 HydrophobicContact CE-CB 3.59Å; M484-N492 PolarHBondContact O-ND2 2.85Å; M484-N492 PolarHBondContact O-OD1 3.48Å; M484-N492 HydrophobicContact SD-CB 3.94Å; M484-N492 PolarHBondContact SD-OD1 3.43Å; M484-L495 HydrophobicContact SD-CB 4.39Å; M484-L495 HydrophobicContact SD-CD1 4.13Å; M484-M496 HydrophobicContact CE-CG 4.08Å
485	S	47.5	Very low	50.8	Low	92 Å²	92	38.5 Å²	38.5	64%	0.643	20%	0.204	S	C	*	.	H	α-helix	trans	-84.9	-22.2	172.2	76.7	0	0	0	0	113.6	V481 S482 I483	V481-S485 WeakPolarHBondContact O-CB 3.42Å; V481-S485 PolarHBondContact O-N 3.41Å; S482-S485 PolarHBondContact O-N 3.27Å; S482-S485 PolarHBondContact O-OG 2.87Å; I483-S485 PolarHBondContact O-N 2.85Å
486	Q	47	Very low	50.9	Low	112 Å²	112	39.6 Å²	39.6	52%	0.523	21%	0.209	S	C	.	.	H	α-helix	trans	-95.8	-20.9	176.3	-64.7	173.2	8.2	0	0	112.6	S482 I483	S482-Q486 WeakPolarHBondContact O-CG 3.27Å; S482-Q486 PolarHBondContact O-N 2.91Å; I483-Q486 CarbonylContact O-C 3.52Å; I483-Q486 PolarHBondContact O-N 3.34Å
487	S	44.6	Very low	50.6	Low	10 Å²	10	42.6 Å²	42.6	7%	0.07	22%	0.223	C	C	.	.	S	Bend	trans	-86.2	139.8	-179.5	154.8	0	0	0	0	111.8	I483 N491 N492	I483-S487 WeakPolarHBondContact O-CB 3.46Å; I483-S487 PolarHBondContact O-N 3.05Å; S487-N491 WeakPolarHBondContact OG-CB 3.43Å; S487-N492 WeakPolarHBondContact CB-OD1 3.1Å; S487-N492 PolarHBondContact O-ND2 3.35Å; S487-N492 PolarHBondContact OG-N 3.05Å; S487-N492 PolarHBondContact OG-OD1 2.82Å
488	N	53.9	Low	50.4	Low	28 Å²	28	43.9 Å²	43.9	15%	0.15	24%	0.235	C	C	.	.			trans	-61.4	150	176.1	-175.1	-11.1	0	0	0	110.8	W211 N213 L490 N491 N492	W211-N488 WeakPolarHBondContact CB-ND2 3.25Å; N213-N488 PolarHBondContact OD1-ND2 2.69Å; N488-L490 PolarHBondContact O-N 3.33Å; N488-N491 PolarHBondContact O-N 2.69Å; N488-N492 PolarHBondContact O-N 3.26Å
489	Y	49.2	Very low	50.2	Low	70 Å²	70	42.9 Å²	42.9	28%	0.275	23%	0.227	S	C	.	.	H	α-helix	trans	-46.7	-35.5	177.6	-174	-94.2	0	0	0	113.7	L273 K274 F493	L273-Y489 HydrophobicContact CD2-CD1 4.13Å; L273-Y489 HydrophobicContact CD2-CE1 4.42Å; K274-Y489 VanDerWaalsContact CE-OH 3.27Å; K274-Y489 WeakPolarHBondContact CE-OH 3.38Å; K274-Y489 HydrophobicContact CG-CE1 4.45Å; K274-Y489 VanDerWaalsContact CG-OH 3.23Å; K274-Y489 WeakPolarHBondContact CG-OH 3.36Å; Y489-F493 WeakPolarHBondContact O-CB 3.15Å; Y489-F493 PolarHBondContact O-N 2.94Å
490	L	50.8	Low	49.7	Very low	8 Å²	8	47.1 Å²	47.1	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-70.4	-40.3	178.1	-137.6	82.2	0	0	0	113.4	L201 W211 L273 I277 N488 F493 R494	L201-L490 HydrophobicContact CD2-CD2 3.56Å; L201-L490 HydrophobicContact CD2-CG 4.25Å; L201-L490 HydrophobicContact CG-CD2 4.19Å; W211-L490 HydrophobicContact CH2-CD1 4.31Å; W211-L490 HydrophobicContact CZ2-CD1 3.67Å; W211-L490 HydrophobicContact CZ2-CD2 4.03Å; W211-L490 HydrophobicContact CZ2-CG 4.48Å; L273-L490 HydrophobicContact CD2-CD1 4Å; I277-L490 HydrophobicContact CD1-CD1 3.57Å; N488-L490 PolarHBondContact O-N 3.33Å; L490-F493 PolarHBondContact O-N 2.9Å; L490-R494 WeakPolarHBondContact O-CB 3.35Å; L490-R494 PolarHBondContact O-N 2.94Å
491	N	51.7	Low	49	Very low	26 Å²	26	52.2 Å²	52.2	14%	0.139	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-43.4	175.4	-75.6	9.6	0	0	0	109.3	L408 I410 S487 N488 F493 R494 L495	L408-N491 PolarHBondContact O-ND2 2.95Å; I410-N491 HydrophobicContact CG1-CB 4.47Å; S487-N491 WeakPolarHBondContact OG-CB 3.43Å; N488-N491 PolarHBondContact O-N 2.69Å; N491-F493 VanDerWaalsContact C-N 3.3Å; N491-F493 PolarHBondContact O-N 2.75Å; N491-R494 PolarHBondContact O-N 2.87Å; N491-L495 VanDerWaalsContact O-CB 3.31Å; N491-L495 WeakPolarHBondContact O-CB 3.28Å; N491-L495 WeakPolarHBondContact O-CD1 3.39Å; N491-L495 VanDerWaalsContact O-CG 3.27Å; N491-L495 WeakPolarHBondContact O-CG 3.5Å; N491-L495 PolarHBondContact O-N 2.83Å
492	N	49.7	Very low	48.3	Very low	27 Å²	27	51.4 Å²	51.4	14%	0.144	26%	0.264	C	S	.	.	H	α-helix	trans	-56.4	-41.2	172	-68.8	-6.8	0	0	0	112.7	M484 S487 N488 M496	M484-N492 WeakPolarHBondContact CA-OD1 3.34Å; M484-N492 HydrophobicContact CE-CB 3.59Å; M484-N492 PolarHBondContact O-ND2 2.85Å; M484-N492 PolarHBondContact O-OD1 3.48Å; M484-N492 HydrophobicContact SD-CB 3.94Å; M484-N492 PolarHBondContact SD-OD1 3.43Å; S487-N492 WeakPolarHBondContact CB-OD1 3.1Å; S487-N492 PolarHBondContact O-ND2 3.35Å; S487-N492 PolarHBondContact OG-N 3.05Å; S487-N492 PolarHBondContact OG-OD1 2.82Å; N488-N492 PolarHBondContact O-N 3.26Å; N492-M496 WeakPolarHBondContact O-CB 3.44Å; N492-M496 WeakPolarHBondContact O-CG 3.43Å; N492-M496 PolarHBondContact O-N 2.8Å
493	F	51.9	Low	47.2	Very low	34 Å²	34	51.4 Å²	51.4	15%	0.149	27%	0.271	C	S	.	.	H	α-helix	trans	-69.7	-47.1	176.9	-173.1	-85.3	0	0	0	112	I277 Y489 L490 N491 L495 M496 E497	I277-F493 HydrophobicContact CB-CE1 4.27Å; I277-F493 HydrophobicContact CG2-CD1 3.83Å; I277-F493 HydrophobicContact CG2-CE1 3.42Å; I277-F493 VanDerWaalsContact CG2-CE1 3.42Å; I277-F493 HydrophobicContact CG2-CZ 4.12Å; Y489-F493 WeakPolarHBondContact O-CB 3.15Å; Y489-F493 PolarHBondContact O-N 2.94Å; L490-F493 PolarHBondContact O-N 2.9Å; N491-F493 VanDerWaalsContact C-N 3.3Å; N491-F493 PolarHBondContact O-N 2.75Å; F493-L495 VanDerWaalsContact C-N 3.31Å; F493-L495 PolarHBondContact O-N 2.87Å; F493-M496 PolarHBondContact O-N 3.08Å; F493-M496 VanDerWaalsContact O-N 3.13Å; F493-E497 HydrophobicContact CD1-CG 4.08Å; F493-E497 HydrophobicContact CE1-CG 3.56Å; F493-E497 HydrophobicContact CZ-CG 3.99Å; F493-E497 PolarHBondContact O-N 3.17Å
494	R	49.8	Very low	46.5	Very low	93 Å²	93	55.1 Å²	55.1	35%	0.351	30%	0.299	S	S	.	.	H	α-helix	trans	-56.1	-46.5	174.5	-83.1	-178	161	156.8	-4.5	111.3	L201 L490 N491 M496 E497 C498	L201-R494 VanDerWaalsContact O-CZ 3.31Å; L201-R494 PolarHBondContact O-NH1 3.47Å; L201-R494 PolarHBondContact O-NH2 2.78Å; L490-R494 WeakPolarHBondContact O-CB 3.35Å; L490-R494 PolarHBondContact O-N 2.94Å; N491-R494 PolarHBondContact O-N 2.87Å; R494-M496 PolarHBondContact O-N 3.19Å; R494-E497 PolarHBondContact O-N 3.21Å; R494-C498 PolarHBondContact O-N 3.32Å; R494-C498 PolarHBondContact O-SG 3.43Å
495	L	52.4	Low	46	Very low	6 Å²	6	54.7 Å²	54.7	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-58.7	-44.9	174.8	-76.3	159.9	0	0	0	111.8	I413 I417 M484 N491 F493 E497 C498 F499	I413-L495 HydrophobicContact CB-CD1 4.31Å; I413-L495 HydrophobicContact CB-CD2 4.31Å; I413-L495 HydrophobicContact CD1-CD1 3.78Å; I413-L495 HydrophobicContact CG2-CD1 3.68Å; I413-L495 HydrophobicContact CG2-CD2 3.57Å; I413-L495 HydrophobicContact CG2-CG 4.29Å; I417-L495 HydrophobicContact CD1-CD2 3.52Å; M484-L495 HydrophobicContact SD-CB 4.39Å; M484-L495 HydrophobicContact SD-CD1 4.13Å; N491-L495 VanDerWaalsContact O-CB 3.31Å; N491-L495 WeakPolarHBondContact O-CB 3.28Å; N491-L495 WeakPolarHBondContact O-CD1 3.39Å; N491-L495 VanDerWaalsContact O-CG 3.27Å; N491-L495 WeakPolarHBondContact O-CG 3.5Å; N491-L495 PolarHBondContact O-N 2.83Å; F493-L495 VanDerWaalsContact C-N 3.31Å; F493-L495 PolarHBondContact O-N 2.87Å; L495-E497 VanDerWaalsContact C-N 3.34Å; L495-E497 PolarHBondContact O-N 3.35Å; L495-C498 PolarHBondContact O-N 2.96Å; L495-F499 WeakPolarHBondContact O-CB 3.5Å; L495-F499 WeakPolarHBondContact O-CD2 3.33Å; L495-F499 PolarHBondContact O-N 2.9Å
496	M	52.2	Low	45.5	Very low	39 Å²	39	54.3 Å²	54.3	19%	0.192	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-31.3	178	-73.1	-93.2	66.9	0	0	113.7	W480 M484 N492 F493 R494 F499 K500 I514	W480-M496 HydrophobicContact CH2-CE 4.4Å; W480-M496 HydrophobicContact CH2-SD 4.22Å; W480-M496 HydrophobicContact CZ2-CE 3.78Å; W480-M496 HydrophobicContact CZ2-SD 3.98Å; M484-M496 HydrophobicContact CE-CG 4.08Å; N492-M496 WeakPolarHBondContact O-CB 3.44Å; N492-M496 WeakPolarHBondContact O-CG 3.43Å; N492-M496 PolarHBondContact O-N 2.8Å; F493-M496 PolarHBondContact O-N 3.08Å; F493-M496 VanDerWaalsContact O-N 3.13Å; R494-M496 PolarHBondContact O-N 3.19Å; M496-F499 HydrophobicContact CE-CB 4.07Å; M496-F499 HydrophobicContact CE-CD2 4.43Å; M496-K500 VanDerWaalsContact O-CG 3.28Å; M496-K500 WeakPolarHBondContact O-CG 3.43Å; M496-K500 PolarHBondContact O-N 3.32Å; M496-K500 VanDerWaalsContact O-N 3.17Å; M496-I514 HydrophobicContact SD-CG2 4.35Å
497	E	49.6	Very low	44.9	Very low	65 Å²	65	56 Å²	56	30%	0.304	30%	0.3	S	S	.	.	H	α-helix	trans	-74.1	-40.5	171.1	-64.4	-57.4	126.2	0	0	111.9	F493 R494 L495 F499 K500 Q501	F493-E497 HydrophobicContact CD1-CG 4.08Å; F493-E497 HydrophobicContact CE1-CG 3.56Å; F493-E497 HydrophobicContact CZ-CG 3.99Å; F493-E497 PolarHBondContact O-N 3.17Å; R494-E497 PolarHBondContact O-N 3.21Å; L495-E497 VanDerWaalsContact C-N 3.34Å; L495-E497 PolarHBondContact O-N 3.35Å; E497-F499 VanDerWaalsContact C-N 3.32Å; E497-F499 PolarHBondContact O-N 3.17Å; E497-K500 WeakPolarHBondContact O-CB 3.28Å; E497-K500 PolarHBondContact O-N 3.48Å; E497-K500 VanDerWaalsContact O-N 3.14Å; E497-K500 IonicContact OE1-NZ 2.68Å; E497-K500 PolarHBondContact OE1-NZ 3.37Å; E497-K500 IonicContact OE2-NZ 3.77Å; E497-Q501 WeakPolarHBondContact O-CG 3.5Å; E497-Q501 PolarHBondContact O-N 2.92Å
498	C	43.4	Very low	44.4	Very low	71 Å²	71	60 Å²	60	48%	0.48	32%	0.32	S	S	.	.	H	α-helix	trans	-58.6	-42.9	171.2	-65.8	0	0	0	0	111.6	R494 L495 K500 Q501 S502	R494-C498 PolarHBondContact O-N 3.32Å; R494-C498 PolarHBondContact O-SG 3.43Å; L495-C498 PolarHBondContact O-N 2.96Å; C498-K500 VanDerWaalsContact C-N 3.3Å; C498-K500 PolarHBondContact O-N 3.42Å; C498-Q501 PolarHBondContact O-N 3.3Å; C498-Q501 VanDerWaalsContact O-N 3.11Å; C498-S502 PolarHBondContact O-N 3.32Å; C498-S502 PolarHBondContact O-OG 3.36Å
499	F	43.8	Very low	43.2	Very low	10 Å²	10	60 Å²	60	4%	0.044	32%	0.319	C	S	.	.	H	α-helix	trans	-65.7	-28.9	176.4	-87	-64.3	0	0	0	113.5	I417 F476 W480 L495 M496 E497 S502 L505 L506	I417-F499 HydrophobicContact CD1-CE2 3.54Å; I417-F499 HydrophobicContact CD1-CZ 3.45Å; I417-F499 VanDerWaalsContact CD1-CZ 3.45Å; I417-F499 HydrophobicContact CG1-CE2 4.34Å; I417-F499 HydrophobicContact CG1-CZ 3.8Å; I417-F499 HydrophobicContact CG2-CE1 4.41Å; I417-F499 HydrophobicContact CG2-CZ 4.2Å; F476-F499 HydrophobicContact CE1-CE1 4.37Å; F476-F499 HydrophobicContact CE1-CZ 4.38Å; F476-F499 AromaticContact CZ-CE1 3.81Å; F476-F499 HydrophobicContact CZ-CE1 3.81Å; F476-F499 AromaticContact CZ-CZ 3.66Å; F476-F499 HydrophobicContact CZ-CZ 3.66Å; W480-F499 AromaticContact CD1-CE2 3.82Å; W480-F499 AromaticContact NE1-CD2 3.9Å; W480-F499 AromaticContact NE1-CE2 3.35Å; W480-F499 VanDerWaalsContact NE1-CE2 3.35Å; L495-F499 WeakPolarHBondContact O-CB 3.5Å; L495-F499 WeakPolarHBondContact O-CD2 3.33Å; L495-F499 PolarHBondContact O-N 2.9Å; M496-F499 HydrophobicContact CE-CB 4.07Å; M496-F499 HydrophobicContact CE-CD2 4.43Å; E497-F499 VanDerWaalsContact C-N 3.32Å; E497-F499 PolarHBondContact O-N 3.17Å; F499-S502 WeakPolarHBondContact CA-OG 3.45Å; F499-S502 PolarHBondContact O-OG 2.86Å; F499-S502 VanDerWaalsContact O-OG 3.1Å; F499-L505 HydrophobicContact CD1-CD1 4.11Å; F499-L505 HydrophobicContact CE1-CD1 3.77Å; F499-L506 WeakPolarHBondContact O-CD1 3.39Å
500	K	44.9	Very low	42.2	Very low	117 Å²	117	62.4 Å²	62.4	51%	0.509	34%	0.337	S	S	.	.	H	α-helix	trans	-72.8	-32.8	170.9	-72.8	166.7	-170.5	172.4	0	112.5	M496 E497 C498	M496-K500 VanDerWaalsContact O-CG 3.28Å; M496-K500 WeakPolarHBondContact O-CG 3.43Å; M496-K500 PolarHBondContact O-N 3.32Å; M496-K500 VanDerWaalsContact O-N 3.17Å; E497-K500 WeakPolarHBondContact O-CB 3.28Å; E497-K500 PolarHBondContact O-N 3.48Å; E497-K500 VanDerWaalsContact O-N 3.14Å; E497-K500 IonicContact OE1-NZ 2.68Å; E497-K500 PolarHBondContact OE1-NZ 3.37Å; E497-K500 IonicContact OE2-NZ 3.77Å; C498-K500 VanDerWaalsContact C-N 3.3Å; C498-K500 PolarHBondContact O-N 3.42Å
501	Q	40.7	Very low	41.1	Very low	137 Å²	137	66 Å²	66	64%	0.64	36%	0.361	S	S	*	.	H	α-helix	trans	-74.7	-33.6	175.8	-70.4	173.7	-30	0	0	111.4	E497 C498 G503	E497-Q501 WeakPolarHBondContact O-CG 3.5Å; E497-Q501 PolarHBondContact O-N 2.92Å; C498-Q501 PolarHBondContact O-N 3.3Å; C498-Q501 VanDerWaalsContact O-N 3.11Å; Q501-G503 VanDerWaalsContact C-N 3.25Å; Q501-G503 PolarHBondContact O-N 3.36Å
502	S	39.8	Very low	39.9	Very low	38 Å²	38	74.4 Å²	74.4	27%	0.266	39%	0.391	S	S	.	.	S	Bend	trans	-77.1	70.5	167.3	67.7	0	0	0	0	111.7	C498 F499 S504 L505	C498-S502 PolarHBondContact O-N 3.32Å; C498-S502 PolarHBondContact O-OG 3.36Å; F499-S502 WeakPolarHBondContact CA-OG 3.45Å; F499-S502 PolarHBondContact O-OG 2.86Å; F499-S502 VanDerWaalsContact O-OG 3.1Å; S502-S504 PolarHBondContact O-N 3.33Å; S502-L505 PolarHBondContact O-N 2.91Å
503	G	30.7	Very low	39	Very low	50 Å²	50	78.8 Å²	78.8	52%	0.515	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-10.6	-172.1	0	0	0	0	0	116.9	Q501	Q501-G503 VanDerWaalsContact C-N 3.25Å; Q501-G503 PolarHBondContact O-N 3.36Å
504	S	36.9	Very low	38	Very low	95 Å²	95	79.2 Å²	79.2	66%	0.664	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-35	176.8	50.1	0	0	0	0	114	S502	S502-S504 PolarHBondContact O-N 3.33Å
505	L	35.3	Very low	37.1	Very low	21 Å²	21	81.4 Å²	81.4	11%	0.11	43%	0.432	C	S	.	.	S	Bend	trans	-88.9	-9	-175.2	-69	177.2	0	0	0	114.3	L421 F499 S502 N507 L508	L421-L505 HydrophobicContact CD2-CD1 4.16Å; F499-L505 HydrophobicContact CD1-CD1 4.11Å; F499-L505 HydrophobicContact CE1-CD1 3.77Å; S502-L505 PolarHBondContact O-N 2.91Å; L505-N507 PolarHBondContact O-N 3.46Å; L505-L508 HydrophobicContact CD2-CD1 4.45Å; L505-L508 PolarHBondContact O-N 2.86Å; L505-L508 VanDerWaalsContact O-N 3.15Å
506	L	37.8	Very low	36.1	Very low	83 Å²	83	85.9 Å²	85.9	44%	0.435	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-21.8	-175.1	-118.5	75.3	0	0	0	114.1	F499 L508	F499-L506 WeakPolarHBondContact O-CD1 3.39Å; L506-L508 VanDerWaalsContact C-N 3.32Å
507	N	33.3	Very low	35.1	Very low	148 Å²	148	89.7 Å²	89.7	79%	0.791	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.2	177.6	-71	-32.8	0	0	0	113.5	L505	L505-N507 PolarHBondContact O-N 3.46Å
508	L	34	Very low	34.4	Very low	93 Å²	93	89.3 Å²	89.3	49%	0.487	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-26.1	177.6	-82.9	160.9	0	0	0	112.7	F473 L505 L506 N510	F473-L508 HydrophobicContact CD1-CD2 4.43Å; F473-L508 HydrophobicContact CD2-CD1 4.12Å; F473-L508 HydrophobicContact CD2-CD2 4.22Å; F473-L508 HydrophobicContact CE1-CD2 4.28Å; F473-L508 HydrophobicContact CE2-CB 3.73Å; F473-L508 HydrophobicContact CE2-CD1 4.01Å; F473-L508 HydrophobicContact CE2-CD2 4.07Å; F473-L508 HydrophobicContact CE2-CG 4.16Å; F473-L508 HydrophobicContact CG-CD2 4.4Å; F473-L508 HydrophobicContact CZ-CB 3.79Å; F473-L508 HydrophobicContact CZ-CD2 4.09Å; F473-L508 HydrophobicContact CZ-CG 4.42Å; L505-L508 HydrophobicContact CD2-CD1 4.45Å; L505-L508 PolarHBondContact O-N 2.86Å; L505-L508 VanDerWaalsContact O-N 3.15Å; L506-L508 VanDerWaalsContact C-N 3.32Å; L508-N510 PolarHBondContact O-N 3.22Å
509	F	29.2	Very low	34.1	Very low	30 Å²	30	89 Å²	89	13%	0.132	46%	0.464	C	S	.	.	S	Bend	trans	-92.9	83.2	178.5	-76.9	-83.8	0	0	0	111.8	F473 F476 I477 C511 I514	F473-F509 HydrophobicContact CE2-CE2 4.48Å; F476-F509 HydrophobicContact CD1-CE2 4.33Å; F476-F509 HydrophobicContact CD1-CZ 4.05Å; F476-F509 AromaticContact CE1-CE2 3.87Å; F476-F509 HydrophobicContact CE1-CE2 3.87Å; F476-F509 AromaticContact CE1-CZ 3.78Å; F476-F509 HydrophobicContact CE1-CZ 3.78Å; I477-F509 HydrophobicContact CD1-CD1 4.39Å; I477-F509 HydrophobicContact CD1-CE1 3.4Å; I477-F509 VanDerWaalsContact CD1-CE1 3.4Å; I477-F509 HydrophobicContact CD1-CE2 4.49Å; I477-F509 HydrophobicContact CD1-CZ 3.47Å; I477-F509 VanDerWaalsContact CD1-CZ 3.47Å; F509-C511 PolarHBondContact O-N 2.92Å; F509-I514 HydrophobicContact CB-CD1 4.18Å; F509-I514 HydrophobicContact CD1-CD1 3.98Å; F509-I514 HydrophobicContact CG-CD1 4.42Å
510	N	27.9	Very low	33.6	Very low	120 Å²	120	91.3 Å²	91.3	64%	0.642	48%	0.477	S	S	*	.			trans	-60.1	102.7	176.1	-160.2	-15.8	0	0	0	110.7	L508 R512 N513	L508-N510 PolarHBondContact O-N 3.22Å; N510-R512 PolarHBondContact O-N 3.49Å; N510-N513 PolarHBondContact O-N 3.32Å; N510-N513 VanDerWaalsContact O-N 3.09Å
511	C	28.3	Very low	32.9	Very low	82 Å²	82	89.6 Å²	89.6	55%	0.554	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-29.5	-158.2	-63.3	0	0	0	0	115.6	F509 N513 I514 E515	F509-C511 PolarHBondContact O-N 2.92Å; C511-N513 PolarHBondContact O-N 3.46Å; C511-N513 VanDerWaalsContact O-N 3.13Å; C511-I514 PolarHBondContact O-N 2.89Å; C511-I514 VanDerWaalsContact O-N 3.14Å; C511-E515 PolarHBondContact O-N 3.36Å
512	R	27.3	Very low	32.6	Very low	204 Å²	204	86.3 Å²	86.3	77%	0.77	46%	0.455	S	S	*	.	H	α-helix	trans	-48.5	-38.4	176.4	-114.6	176	178.3	157.6	-0.7	113.5	N510 Q516	N510-R512 PolarHBondContact O-N 3.49Å; R512-Q516 PolarHBondContact O-N 2.67Å
513	N	29.1	Very low	32.5	Very low	118 Å²	118	90.4 Å²	90.4	63%	0.631	47%	0.469	S	S	*	.	H	α-helix	trans	-75.3	-29.2	-173.6	-65.2	-2.3	0	0	0	112.4	N510 C511 F517	N510-N513 PolarHBondContact O-N 3.32Å; N510-N513 VanDerWaalsContact O-N 3.09Å; C511-N513 PolarHBondContact O-N 3.46Å; C511-N513 VanDerWaalsContact O-N 3.13Å; N513-F517 PolarHBondContact O-N 2.83Å
514	I	31.3	Very low	32.6	Very low	44 Å²	44	94.4 Å²	94.4	23%	0.226	47%	0.474	C	S	.	.	H	α-helix	trans	-77.3	-37.2	179.6	-61.2	175.7	0	0	0	110.6	M496 F509 C511 N518	M496-I514 HydrophobicContact SD-CG2 4.35Å; F509-I514 HydrophobicContact CB-CD1 4.18Å; F509-I514 HydrophobicContact CD1-CD1 3.98Å; F509-I514 HydrophobicContact CG-CD1 4.42Å; C511-I514 PolarHBondContact O-N 2.89Å; C511-I514 VanDerWaalsContact O-N 3.14Å; I514-N518 PolarHBondContact O-N 2.67Å; I514-N518 PolarHBondContact O-ND2 2.93Å
515	E	30.9	Very low	32.4	Very low	138 Å²	138	93.5 Å²	93.5	65%	0.645	46%	0.461	S	S	*	.	H	α-helix	trans	-64.3	-45.1	173.9	-65.3	-174.6	145.8	0	0	111.1	C511 F517 N518 V519	C511-E515 PolarHBondContact O-N 3.36Å; E515-F517 PolarHBondContact O-N 3.31Å; E515-N518 WeakPolarHBondContact O-CB 3.41Å; E515-N518 PolarHBondContact O-N 2.86Å; E515-V519 PolarHBondContact O-N 3.08Å; E515-V519 VanDerWaalsContact O-N 3.08Å
516	Q	32.9	Very low	32.2	Very low	101 Å²	101	100.8 Å²	100.8	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-46.2	177.4	-169.3	62	46.1	0	0	112.3	R512 N518 V519 D520	R512-Q516 PolarHBondContact O-N 2.67Å; Q516-N518 VanDerWaalsContact C-N 3.29Å; Q516-N518 PolarHBondContact O-N 3.36Å; Q516-V519 PolarHBondContact O-N 2.87Å; Q516-V519 VanDerWaalsContact O-N 3.07Å; Q516-D520 PolarHBondContact NE2-OD2 3.4Å; Q516-D520 PolarHBondContact O-N 3.34Å
517	F	30.8	Very low	31.8	Very low	118 Å²	118	101.5 Å²	101.5	52%	0.518	50%	0.5	S	S	.	.	H	α-helix	trans	-59.7	-37.3	177.1	-174.2	-97.5	0	0	0	112.7	N513 E515 Q521	N513-F517 PolarHBondContact O-N 2.83Å; E515-F517 PolarHBondContact O-N 3.31Å; F517-Q521 HydrophobicContact CD1-CG 4.21Å; F517-Q521 HydrophobicContact CE1-CG 3.93Å; F517-Q521 HydrophobicContact CZ-CG 4.26Å; F517-Q521 VanDerWaalsContact O-CB 3.3Å; F517-Q521 WeakPolarHBondContact O-CB 3.45Å; F517-Q521 VanDerWaalsContact O-CG 3.26Å; F517-Q521 WeakPolarHBondContact O-CG 3.17Å; F517-Q521 PolarHBondContact O-N 2.91Å
518	N	33.2	Very low	31.8	Very low	58 Å²	58	99.2 Å²	99.2	31%	0.31	49%	0.491	S	S	.	.	H	α-helix	trans	-66.9	-37.6	174.5	-83.9	-91.4	0	0	0	112.4	I514 E515 Q516 E522	I514-N518 PolarHBondContact O-N 2.67Å; I514-N518 PolarHBondContact O-ND2 2.93Å; E515-N518 WeakPolarHBondContact O-CB 3.41Å; E515-N518 PolarHBondContact O-N 2.86Å; Q516-N518 VanDerWaalsContact C-N 3.29Å; Q516-N518 PolarHBondContact O-N 3.36Å; N518-E522 WeakPolarHBondContact O-CB 3.43Å; N518-E522 WeakPolarHBondContact O-CG 3.4Å; N518-E522 PolarHBondContact O-N 3.08Å
519	V	37.1	Very low	31.6	Very low	64 Å²	64	100.6 Å²	100.6	39%	0.388	50%	0.499	S	S	.	.	H	α-helix	trans	-67.6	-42	177.7	168.3	0	0	0	0	111.8	E515 Q516 E522 K523	E515-V519 PolarHBondContact O-N 3.08Å; E515-V519 VanDerWaalsContact O-N 3.08Å; Q516-V519 PolarHBondContact O-N 2.87Å; Q516-V519 VanDerWaalsContact O-N 3.07Å; V519-E522 WeakPolarHBondContact O-CA 3.39Å; V519-E522 WeakPolarHBondContact O-CB 3.41Å; V519-E522 PolarHBondContact O-N 2.97Å; V519-E522 VanDerWaalsContact O-N 3.12Å; V519-K523 PolarHBondContact O-N 3.4Å
520	D	33.5	Very low	31.7	Very low	58 Å²	58	104.5 Å²	104.5	31%	0.31	53%	0.528	S	S	.	.	H	α-helix	trans	-77.4	-31.6	-177.8	-63.9	-41.9	0	0	0	112.2	Q516 E522 K523 Q524	Q516-D520 PolarHBondContact NE2-OD2 3.4Å; Q516-D520 PolarHBondContact O-N 3.34Å; D520-E522 VanDerWaalsContact C-N 3.31Å; D520-K523 PolarHBondContact O-N 3.39Å; D520-K523 WeakPolarHBondContact OD1-CD 3.47Å; D520-K523 WeakPolarHBondContact OD1-CE 3.5Å; D520-K523 IonicContact OD1-NZ 3.81Å; D520-K523 PolarHBondContact OD1-NZ 2.88Å; D520-Q524 WeakPolarHBondContact O-CG 3.19Å; D520-Q524 PolarHBondContact O-N 3.48Å; D520-Q524 VanDerWaalsContact O-N 3.1Å
521	Q	31.3	Very low	31.8	Very low	81 Å²	81	104.6 Å²	104.6	38%	0.379	54%	0.536	S	S	.	.	H	α-helix	trans	-58.3	-40	160.9	-80.9	-89.5	-29.5	0	0	112.1	R215 F517 I525	R215-Q521 VanDerWaalsContact NH2-C 3.3Å; R215-Q521 PolarHBondContact NH2-O 3.49Å; F517-Q521 HydrophobicContact CD1-CG 4.21Å; F517-Q521 HydrophobicContact CE1-CG 3.93Å; F517-Q521 HydrophobicContact CZ-CG 4.26Å; F517-Q521 VanDerWaalsContact O-CB 3.3Å; F517-Q521 WeakPolarHBondContact O-CB 3.45Å; F517-Q521 VanDerWaalsContact O-CG 3.26Å; F517-Q521 WeakPolarHBondContact O-CG 3.17Å; F517-Q521 PolarHBondContact O-N 2.91Å; Q521-I525 PolarHBondContact O-N 3.36Å
522	E	34.5	Very low	31.8	Very low	68 Å²	68	106.2 Å²	106.2	32%	0.318	55%	0.547	S	S	.	.	H	α-helix	trans	-63.9	-48	175.6	-82.4	173.9	-173.9	0	0	111.6	K274 N518 V519 D520 Q524 I525 Y526	K274-E522 IonicContact NZ-OE1 3.71Å; K274-E522 PolarHBondContact NZ-OE1 3.46Å; N518-E522 WeakPolarHBondContact O-CB 3.43Å; N518-E522 WeakPolarHBondContact O-CG 3.4Å; N518-E522 PolarHBondContact O-N 3.08Å; V519-E522 WeakPolarHBondContact O-CA 3.39Å; V519-E522 WeakPolarHBondContact O-CB 3.41Å; V519-E522 PolarHBondContact O-N 2.97Å; V519-E522 VanDerWaalsContact O-N 3.12Å; D520-E522 VanDerWaalsContact C-N 3.31Å; E522-Q524 PolarHBondContact O-N 3.08Å; E522-I525 PolarHBondContact O-N 3.18Å; E522-Y526 HydrophobicContact CB-CE2 4.42Å; E522-Y526 WeakPolarHBondContact O-CD2 3.31Å; E522-Y526 PolarHBondContact O-N 3.24Å
523	K	37.2	Very low	31.8	Very low	125 Å²	125	107.9 Å²	107.9	54%	0.543	55%	0.554	S	S	.	*	H	α-helix	trans	-56.9	-48.1	176.4	-68.4	172.9	-167.6	157.3	0	113.8	V519 D520 I525 Y526 S527	V519-K523 PolarHBondContact O-N 3.4Å; D520-K523 PolarHBondContact O-N 3.39Å; D520-K523 WeakPolarHBondContact OD1-CD 3.47Å; D520-K523 WeakPolarHBondContact OD1-CE 3.5Å; D520-K523 IonicContact OD1-NZ 3.81Å; D520-K523 PolarHBondContact OD1-NZ 2.88Å; K523-I525 VanDerWaalsContact C-N 3.34Å; K523-I525 PolarHBondContact O-N 3.5Å; K523-Y526 PolarHBondContact O-N 3.09Å; K523-S527 PolarHBondContact O-N 2.78Å
524	Q	32.2	Very low	31.8	Very low	133 Å²	133	109.5 Å²	109.5	62%	0.621	56%	0.56	S	S	*	*	H	α-helix	trans	-60.5	-42.9	-176.2	-73.7	-178.6	0	0	0	112	D520 E522 Y526 S527	D520-Q524 WeakPolarHBondContact O-CG 3.19Å; D520-Q524 PolarHBondContact O-N 3.48Å; D520-Q524 VanDerWaalsContact O-N 3.1Å; E522-Q524 PolarHBondContact O-N 3.08Å; Q524-Y526 PolarHBondContact O-N 3Å; Q524-S527 WeakPolarHBondContact O-CB 3.4Å; Q524-S527 PolarHBondContact O-N 2.99Å; Q524-S527 VanDerWaalsContact O-N 3.15Å; Q524-S527 PolarHBondContact O-OG 3.46Å
525	I	33.1	Very low	31.6	Very low	77 Å²	77	116 Å²	116	40%	0.395	59%	0.59	S	S	.	*	H	α-helix	trans	-74.9	-21.8	-178.9	-74.8	163.4	0	0	0	113	R215 Q521 E522 K523 S527 T528	R215-I525 VanDerWaalsContact NH2-CD1 3.28Å; Q521-I525 PolarHBondContact O-N 3.36Å; E522-I525 PolarHBondContact O-N 3.18Å; K523-I525 VanDerWaalsContact C-N 3.34Å; K523-I525 PolarHBondContact O-N 3.5Å; I525-S527 VanDerWaalsContact C-N 3.29Å; I525-T528 PolarHBondContact O-OG1 3.09Å; I525-T528 VanDerWaalsContact O-OG1 3.1Å
526	Y	31.2	Very low	31.5	Very low	174 Å²	174	118.7 Å²	118.7	68%	0.682	60%	0.603	S	S	*	*	H	α-helix	trans	-79.8	-7.3	169.8	-74.5	-61.3	0	0	0	113.8	E522 K523 Q524	E522-Y526 HydrophobicContact CB-CE2 4.42Å; E522-Y526 WeakPolarHBondContact O-CD2 3.31Å; E522-Y526 PolarHBondContact O-N 3.24Å; K523-Y526 PolarHBondContact O-N 3.09Å; Q524-Y526 PolarHBondContact O-N 3Å
527	S	30.4	Very low	31.2	Very low	97 Å²	97	119.6 Å²	119.6	68%	0.678	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-6.2	178.9	76	0	0	0	0	114.6	K523 Q524 I525	K523-S527 PolarHBondContact O-N 2.78Å; Q524-S527 WeakPolarHBondContact O-CB 3.4Å; Q524-S527 PolarHBondContact O-N 2.99Å; Q524-S527 VanDerWaalsContact O-N 3.15Å; Q524-S527 PolarHBondContact O-OG 3.46Å; I525-S527 VanDerWaalsContact C-N 3.29Å
528	T	32.8	Very low	30.9	Very low	100 Å²	100	121.9 Å²	121.9	61%	0.613	63%	0.633	S	S	*	*			trans	-106.9	1.1	-168.8	48.9	0	0	0	0	115.7	I525 P530	I525-T528 PolarHBondContact O-OG1 3.09Å; I525-T528 VanDerWaalsContact O-OG1 3.1Å; T528-P530 WeakPolarHBondContact O-CD 2.87Å
529	D	28.8	Very low	30.7	Very low	122 Å²	122	124.5 Å²	124.5	65%	0.652	66%	0.656	S	S	*	*			trans	-86.4	118	175.2	-83	-39.9	0	0	0	111.1	C531	D529-C531 VanDerWaalsContact C-N 3.26Å; D529-C531 PolarHBondContact O-N 3.29Å
530	P	31.8	Very low	30.3	Very low	113 Å²	113	128.7 Å²	128.7	73%	0.734	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-69.4	-13.1	-173.3	-23.3	35.4	0	0	0	116.2	T528	T528-P530 WeakPolarHBondContact O-CD 2.87Å
531	C	29.9	Very low	29.9	Very low	121 Å²	121	134.2 Å²	134.2	82%	0.818	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-89.8	-0.1	-162.7	-65	0	0	0	0	116.3	D529	D529-C531 VanDerWaalsContact C-N 3.26Å; D529-C531 PolarHBondContact O-N 3.29Å
532	C	28.9	Very low	29.7	Very low	117 Å²	117	137.9 Å²	137.9	79%	0.791	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-118.5	25.8	-178.3	-63.6	0	0	0	0	113.7	I534	C532-I534 VanDerWaalsContact C-N 3.31Å; C532-I534 PolarHBondContact O-N 2.85Å
533	R	27.2	Very low	29.7	Very low	239 Å²	239	144.8 Å²	144.8	90%	0.902	75%	0.747	S	S	*	*			trans	-93	34	-175.2	-130.2	-179	-154.1	-137.1	6.9	114.5
534	I	28.2	Very low	29.2	Very low	151 Å²	151	146.6 Å²	146.6	77%	0.774	76%	0.757	S	S	*	*	S	Bend	trans	-135	151.9	176.5	-49.1	-179.4	0	0	0	107	C532	C532-I534 VanDerWaalsContact C-N 3.31Å; C532-I534 PolarHBondContact O-N 2.85Å
535	E	27.4	Very low	28.9	Very low	180 Å²	180	148.5 Å²	148.5	84%	0.841	76%	0.764	S	S	*	*	S	Bend	trans	75.1	28.4	178.3	-49.3	-166.1	160	0	0	118.5
536	Q	30.1	Very low	28.8	Very low	196 Å²	196	153.3 Å²	153.3	92%	0.916	79%	0.787	S	S	*	*			trans	-129.5	51.3	157.7	-72	-159.6	0.1	0	0	113.6
537	T	24.9	Very low	28.7	Very low	119 Å²	119	151.2 Å²	151.2	73%	0.73	79%	0.786	S	S	*	*	S	Bend	trans	-121.8	137.9	163.1	51	0	0	0	0	108.9
538	N	25.8	Very low	28.4	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	78%	0.783	S	S	*	*			trans	76	74.7	-178.2	-49.5	-34.2	0	0	0	115.9
539	S	29	Very low	28	Very low	113 Å²	113	153 Å²	153	79%	0.79	79%	0.791	S	S	*	*			trans	-138.6	125.4	154.2	-171.7	0	0	0	0	111.2
540	M	28.2	Very low	28	Very low	151 Å²	151	152.8 Å²	152.8	74%	0.744	79%	0.794	S	S	*	*			trans	53.8	61	167.5	-62.7	-135.5	67.8	0	0	119.1	H542	M540-H542 HydrophobicContact CE-CB 4.02Å; M540-H542 PolarHBondContact O-N 3.18Å
541	L	25.1	Very low	27.7	Very low	174 Å²	174	152.3 Å²	152.3	91%	0.911	79%	0.789	S	S	*	*			trans	-68.8	61.8	148.1	-175.4	77.2	0	0	0	110.4
542	H	27.7	Very low	27.5	Very low	159 Å²	159	152.8 Å²	152.8	74%	0.736	78%	0.783	S	S	*	*			trans	-160.3	74.8	-179.9	-118.7	46.6	0	0	0	115.6	M540	M540-H542 HydrophobicContact CE-CB 4.02Å; M540-H542 PolarHBondContact O-N 3.18Å
543	K	33.3	Very low	27.6	Very low	212 Å²	212	153.1 Å²	153.1	92%	0.922	78%	0.777	S	S	*	*			trans	-174.5	85.2	131.2	-106.5	-179	178.5	-175.7	0	112.8
544	E	26.6	Very low	27.8	Very low	163 Å²	163	147.6 Å²	147.6	76%	0.762	77%	0.766	S	S	*	*			trans	-77.4	178.5	152.5	-57	-178.8	126.7	0	0	110.6
545	K	27	Very low	27.9	Very low	174 Å²	174	146 Å²	146	76%	0.757	76%	0.759	S	S	*	*			trans	68.8	92.7	162.3	-57.7	173.1	-172.7	176.3	0	117
546	M	30.3	Very low	28.1	Very low	177 Å²	177	142.9 Å²	142.9	87%	0.872	75%	0.748	S	S	*	*				-136	117.9	92.9	-74.7	-153.8	169.7	0	0	107.8
547	I	28.7	Very low	28.1	Very low	130 Å²	130	140.1 Å²	140.1	67%	0.667	74%	0.735	S	S	*	*				60.5	90.3	89.4	-59.7	162.7	0	0	0	109
548	S	24.4	Very low	28.2	Very low	89 Å²	89	142.9 Å²	142.9	62%	0.622	73%	0.733	S	S	*	*				71.5	112.9	56.8	85.4	0	0	0	0	114
549	N	24.1	Very low	28.3	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	72%	0.724	S	S	*	*			trans	65.2	152.8	174.1	-46.1	-16.8	0	0	0	112
550	V	29.7	Very low	28.3	Very low	117 Å²	117	142 Å²	142	71%	0.709	72%	0.717	S	S	*	*			cis	-143.2	113	34.2	150.4	0	0	0	0	105.8
551	T	25.1	Very low	28.2	Very low	104 Å²	104	140.5 Å²	140.5	64%	0.638	71%	0.712	S	S	*	*				38	130	103.2	69.7	0	0	0	0	115.2
552	D	26.9	Very low	28.4	Very low	130 Å²	130	139.4 Å²	139.4	70%	0.695	70%	0.702	S	S	*	*				162.6	154.2	120.6	-79.7	-2.3	0	0	0	113.1
553	N	29.7	Very low	28.4	Very low	124 Å²	124	136.9 Å²	136.9	66%	0.663	69%	0.694	S	S	*	*			trans	82.2	88.9	158.7	-62.9	-57.6	0	0	0	120.7
554	N	30.7	Very low	28.1	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	68%	0.681	S	S	*	*				81.6	136.2	117.5	-56.8	-16.9	0	0	0	118.7
555	N	32	Very low	28.2	Very low	118 Å²	118	131.2 Å²	131.2	63%	0.631	68%	0.678	S	S	*	*			cis	-158.8	147.3	9.1	-119	-8.8	0	0	0	112.5
556	N	31.1	Very low	28.4	Very low	113 Å²	113	130.4 Å²	130.4	60%	0.604	68%	0.676	S	S	*	*			trans	62.2	144.9	151.7	-63.7	-24.2	0	0	0	118.6
557	Q	30.3	Very low	28.2	Very low	138 Å²	138	127.8 Å²	127.8	65%	0.645	67%	0.674	S	S	*	*			cis	-165.8	164.5	-3.4	-104.7	166.2	16.4	0	0	106.1
558	Y	27.3	Very low	28.1	Very low	177 Å²	177	126.1 Å²	126.1	69%	0.694	67%	0.672	S	S	*	*			cis	-146.3	148.5	0.3	-127.4	-72	0	0	0	106.9
559	M	28.3	Very low	28.2	Very low	143 Å²	143	129 Å²	129	70%	0.704	68%	0.677	S	S	*	*			trans	9	149.4	155.5	-56.3	-68	178.2	0	0	120.7
560	N	27.9	Very low	28.2	Very low	118 Å²	118	128.1 Å²	128.1	63%	0.631	67%	0.672	S	S	*	*			cis	-153.2	133	2.9	-111.7	-27.8	0	0	0	106
561	N	26	Very low	28	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	67%	0.671	S	S	*	*				79	146.8	64.5	-169.4	13.5	0	0	0	112.3
562	Q	30.4	Very low	27.9	Very low	151 Å²	151	130.7 Å²	130.7	71%	0.706	67%	0.673	S	S	*	*			trans	75.4	135.1	177.7	-49.9	-169.7	17.7	0	0	116.4
563	N	26.7	Very low	27.8	Very low	105 Å²	105	128.8 Å²	128.8	56%	0.561	67%	0.666	S	S	*	*			cis	-157.2	159.3	-14.5	-108.5	-15	0	0	0	110.7
564	I	26.9	Very low	27.9	Very low	127 Å²	127	130.4 Å²	130.4	65%	0.651	67%	0.674	S	S	*	*				23.2	116.3	124.5	-33.4	165.9	0	0	0	113
565	D	29.1	Very low	27.6	Very low	129 Å²	129	132.7 Å²	132.7	69%	0.69	68%	0.675	S	S	*	*				-164.6	158.1	79.2	-110.7	-48.9	0	0	0	118.5
566	H	31.2	Very low	27.2	Very low	157 Å²	157	134.9 Å²	134.9	73%	0.727	68%	0.681	S	S	*	*			trans	58.4	90.6	153.4	-73.6	47.9	0	0	0	121.1
567	C	25.6	Very low	27.1	Very low	122 Å²	122	133.2 Å²	133.2	82%	0.824	68%	0.676	S	S	*	*				-67.4	148.7	113.3	-95.4	0	0	0	0	107.4
568	P	27.6	Very low	27	Very low	95 Å²	95	133 Å²	133	62%	0.617	68%	0.679	S	S	*	*				-161.9	-157.3	57.4	41	-16.5	0	0	0	115.5
569	M	25	Very low	27	Very low	149 Å²	149	131.2 Å²	131.2	73%	0.734	68%	0.681	S	S	*	*			trans	63.2	136.3	139.8	-78.3	-53.4	-178	0	0	121.8
570	N	24.5	Very low	26.8	Very low	128 Å²	128	132.1 Å²	132.1	68%	0.684	69%	0.686	S	S	*	*			trans	67.3	169.1	137.5	-64.3	-15.2	0	0	0	117.7
571	L	25.1	Very low	26.7	Very low	130 Å²	130	132.8 Å²	132.8	68%	0.681	69%	0.689	S	S	*	*			cis	-133.6	141.9	-25.2	-132.2	62.4	0	0	0	103.1
572	H	23.8	Very low	26.7	Very low	145 Å²	145	133.4 Å²	133.4	67%	0.671	69%	0.693	S	S	*	*				51.7	140.5	88.7	-147.7	164	0	0	0	114.7
573	V	25.4	Very low	26.4	Very low	91 Å²	91	135.8 Å²	135.8	55%	0.552	70%	0.697	S	S	*	*			trans	72.2	105.3	172.1	-159.4	0	0	0	0	111.1	Y575	V573-Y575 HydrophobicContact CG1-CD2 4.3Å; V573-Y575 HydrophobicContact CG2-CD2 4.45Å
574	N	30.3	Very low	26.3	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	70%	0.704	S	S	*	*				-131.7	132.8	66.8	-76.5	-30.2	0	0	0	110.5
575	Y	24.6	Very low	26.2	Very low	172 Å²	172	135.9 Å²	135.9	68%	0.675	71%	0.707	S	S	*	*			cis	50.5	122.4	23.8	-79.5	-69.9	0	0	0	113	V573	V573-Y575 HydrophobicContact CG1-CD2 4.3Å; V573-Y575 HydrophobicContact CG2-CD2 4.45Å
576	H	25.1	Very low	26.2	Very low	164 Å²	164	134.2 Å²	134.2	76%	0.759	69%	0.694	S	S	*	*			cis	-141.1	-151.5	24.8	-160.9	-156.8	0	0	0	110.5
577	P	28.1	Very low	25.9	Very low	79 Å²	79	129.5 Å²	129.5	51%	0.513	68%	0.675	S	S	.	*				-106.3	-179.1	-129.8	40.7	-23.1	0	0	0	112.9
578	D	27.3	Very low	26.1	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	66%	0.663	S	S	*	*				-171.5	152.3	105.9	-102.7	-34.3	0	0	0	112.5
579	L	28.2	Very low	26.2	Very low	141 Å²	141	131.6 Å²	131.6	74%	0.738	66%	0.656	S	S	*	*			trans	31.9	107.6	149.6	-52.4	173	0	0	0	116.7
580	M	23.8	Very low	26.4	Very low	162 Å²	162	129.3 Å²	129.3	80%	0.798	65%	0.65	S	S	*	*			cis	53.4	75.2	31.3	-117.2	-64.6	172.3	0	0	112.2
581	N	25.9	Very low	26.7	Very low	131 Å²	131	130.2 Å²	130.2	70%	0.701	65%	0.65	S	S	*	*			trans	160.2	152.9	138.3	-80.9	-35.3	0	0	0	113
582	N	25.8	Very low	27	Very low	135 Å²	135	129 Å²	129	72%	0.722	65%	0.645	S	S	*	*			trans	63.7	123	153.7	-64.8	3.8	0	0	0	119.3
583	Y	24.1	Very low	27.3	Very low	201 Å²	201	129 Å²	129	79%	0.788	65%	0.648	S	S	*	*				84.5	119.9	63.1	-87.3	-78.6	0	0	0	113.7
584	D	24.1	Very low	27.7	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	66%	0.655	S	S	*	*			trans	73.1	118	146.9	-58.7	-19.2	0	0	0	125.3
585	S	25.9	Very low	27.8	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	64%	0.643	S	S	*	*				80.8	165.9	122.5	-62	0	0	0	0	124.8
586	E	28.2	Very low	28.1	Very low	93 Å²	93	127.3 Å²	127.3	44%	0.435	64%	0.638	S	S	.	*			trans	76.1	154.8	148.7	-75.4	-123	156.8	0	0	123.5	P352 Q353 R354	P352-E586 CarbonylContact O-C 3.51Å; Q353-E586 CarbonylContact C-O 3.26Å; Q353-E586 WeakPolarHBondContact CA-O 3.49Å; Q353-E586 PolarHBondContact NE2-O 3.04Å; R354-E586 HydrophobicContact CB-CB 4.47Å; R354-E586 IonicContact CZ-OE2 3.86Å; R354-E586 PolarHBondContact N-O 3.42Å; R354-E586 IonicContact NE-OE2 3.79Å; R354-E586 PolarHBondContact NE-OE2 3.39Å; R354-E586 IonicContact NH2-OE1 2.88Å; R354-E586 PolarHBondContact NH2-OE1 2.91Å; R354-E586 IonicContact NH2-OE2 2.63Å; R354-E586 PolarHBondContact NH2-OE2 3.39Å
587	L	26	Very low	28.6	Very low	59 Å²	59	122.4 Å²	122.4	31%	0.309	62%	0.615	S	S	.	*			cis	-168	47.5	-32.5	-133.6	168.8	0	0	0	120	P352 Q353 R354	P352-L587 VanDerWaalsContact C-CA 3.45Å; P352-L587 VanDerWaalsContact CB-C 3.43Å; P352-L587 HydrophobicContact CB-CD2 4.09Å; P352-L587 HydrophobicContact CB-CG 4.48Å; P352-L587 HydrophobicContact CG-CD2 3.7Å; P352-L587 HydrophobicContact CG-CG 3.96Å; P352-L587 WeakPolarHBondContact O-CA 3.33Å; P352-L587 PolarHBondContact O-N 3.27Å; P352-L587 VanDerWaalsContact O-N 3.09Å; Q353-L587 CarbonylContact O-C 3.47Å; R354-L587 HydrophobicContact CB-CB 4.32Å; R354-L587 HydrophobicContact CG-CB 4.46Å
588	W	29	Very low	29	Very low	151 Å²	151	123.9 Å²	123.9	57%	0.572	61%	0.614	S	S	*	*			trans	-157.4	139.4	147.5	-101.1	-178.1	0	0	0	113.5	P352 Q353	P352-W588 VanDerWaalsContact C-N 3.32Å; P352-W588 VanDerWaalsContact CB-CA 3.47Å; P352-W588 HydrophobicContact CB-CE3 4.44Å; P352-W588 VanDerWaalsContact CB-N 3.28Å; Q353-W588 WeakPolarHBondContact CA-O 3.26Å; Q353-W588 VanDerWaalsContact N-C 3.34Å; Q353-W588 PolarHBondContact N-O 3.19Å; Q353-W588 WeakPolarHBondContact O-CA 2.95Å; Q353-W588 PolarHBondContact O-N 2.83Å
589	K	30.1	Very low	29.3	Very low	109 Å²	109	120 Å²	120	47%	0.474	59%	0.593	S	S	.	*				81.6	135	56.6	-158.3	-165.7	-80.1	-178.3	0	113.8
590	V	28.7	Very low	29.6	Very low	101 Å²	101	115.2 Å²	115.2	61%	0.612	57%	0.568	S	S	*	*				167.7	111.4	105.5	152.2	0	0	0	0	108.8
591	E	31.4	Very low	30.2	Very low	148 Å²	148	111.5 Å²	111.5	69%	0.692	56%	0.556	S	S	*	*				84.1	151.6	101.4	-71.1	164.9	-149.8	0	0	116
592	D	31.1	Very low	30.7	Very low	105 Å²	105	112.9 Å²	112.9	56%	0.561	56%	0.562	S	S	*	*			cis	-172.8	-164.6	-33.9	-123.4	-56.8	0	0	0	110.6	Y349	Y349-D592 PolarHBondContact OH-OD2 2.92Å
593	I	31.2	Very low	31	Very low	144 Å²	144	112.1 Å²	112.1	74%	0.738	56%	0.558	S	S	*	*			trans	84.9	86.9	157.3	-51.4	-166.6	0	0	0	117.5
594	T	32.2	Very low	31.3	Very low	114 Å²	114	110.6 Å²	110.6	70%	0.699	56%	0.555	S	S	*	*				84.7	164.9	86	71.3	0	0	0	0	115.9
595	Q	33.9	Very low	31.6	Very low	127 Å²	127	110.7 Å²	110.7	59%	0.593	56%	0.561	S	S	*	*			cis	-161.6	133.2	16.4	-159.3	47.6	-16.2	0	0	115.3
596	Y	30.7	Very low	31.7	Very low	144 Å²	144	110.5 Å²	110.5	57%	0.565	56%	0.56	S	S	*	*			trans	60.8	161.3	138.8	-80.1	-150.1	0	0	0	124.6	Q345	Q345-Y596 PolarHBondContact NE2-OH 2.98Å
597	E	35.8	Very low	31.9	Very low	61 Å²	61	111.7 Å²	111.7	29%	0.285	57%	0.573	S	S	.	*			cis	-177	170.1	-19.3	-174.3	-178.1	-125.7	0	0	110.2
598	K	35.5	Very low	32.2	Very low	110 Å²	110	115.2 Å²	115.2	48%	0.478	59%	0.592	S	S	.	*			trans	140.9	152.3	155.7	-68.2	-16.3	163.3	178.6	0	116.3	Q343	Q343-K598 VanDerWaalsContact NE2-CA 3.26Å
599	D	33	Very low	32.4	Very low	50 Å²	50	115.5 Å²	115.5	27%	0.267	60%	0.604	S	S	.	*			cis	-171.3	72.8	-8.2	-90.6	-8.3	0	0	0	120.3	P108 Q341 Q343	P108-D599 HydrophobicContact CB-CB 3.73Å; P108-D599 WeakPolarHBondContact CB-OD1 3.41Å; P108-D599 HydrophobicContact CG-CB 3.74Å; Q341-D599 VanDerWaalsContact CD-N 3.26Å; Q341-D599 VanDerWaalsContact NE2-N 3.1Å; Q341-D599 PolarHBondContact OE1-O 3.41Å; Q341-D599 VanDerWaalsContact OE1-O 3.06Å; Q343-D599 PolarHBondContact NE2-OD1 2.85Å
600	N	35.8	Very low	32.5	Very low	41 Å²	41	113.4 Å²	113.4	22%	0.219	61%	0.614	C	S	.	*			trans	83.6	153.9	147.1	-88.2	37.5	0	0	0	129.4	P108 I109 Q341 Q343	P108-N600 VanDerWaalsContact CA-CG 3.41Å; P108-N600 WeakPolarHBondContact CA-ND2 3.31Å; P108-N600 HydrophobicContact CB-CB 3.83Å; I109-N600 PolarHBondContact N-ND2 3.05Å; I109-N600 PolarHBondContact N-OD1 3.34Å; I109-N600 PolarHBondContact O-OD1 2.86Å; Q341-N600 CarbonylContact O-C 3.57Å; Q343-N600 WeakPolarHBondContact CB-OD1 2.87Å
601	P	35.4	Very low	32.5	Very low	84 Å²	84	115 Å²	115	55%	0.545	62%	0.624	S	S	.	*			trans	-138.2	-168.1	-166.4	47	-27.8	0	0	0	117.8
602	I	36.7	Very low	32.6	Very low	160 Å²	160	112.3 Å²	112.3	82%	0.821	62%	0.621	S	S	*	*			trans	-177.1	163.3	151.5	-105.8	158.1	0	0	0	110.8
603	N	32.5	Very low	32.6	Very low	119 Å²	119	114.2 Å²	114.2	64%	0.636	63%	0.627	S	S	*	*			cis	-174.4	176	-44.4	-169.8	26	0	0	0	111.2
604	F	31	Very low	32.6	Very low	169 Å²	169	115.5 Å²	115.5	74%	0.741	63%	0.627	S	S	*	*			trans	92.8	166.9	160.8	-55.6	-71.1	0	0	0	122
605	T	30.3	Very low	32.4	Very low	134 Å²	134	115.4 Å²	115.4	82%	0.822	63%	0.631	S	S	*	*			trans	-164.1	173.9	-156.9	44.2	0	0	0	0	111.7
606	S	28.2	Very low	32.2	Very low	98 Å²	98	117.9 Å²	117.9	69%	0.685	64%	0.643	S	S	*	*			cis	-168.3	-125.4	-26.6	64	0	0	0	0	110.4
607	T	31.7	Very low	31.9	Very low	117 Å²	117	119.9 Å²	119.9	72%	0.718	66%	0.655	S	S	*	*			trans	76.2	158.6	167.5	76.6	0	0	0	0	119.6
608	N	31.5	Very low	31.6	Very low	133 Å²	133	124.8 Å²	124.8	71%	0.711	68%	0.675	S	S	*	*			cis	-168.5	148.4	-21.5	-101.9	-10.9	0	0	0	115.5
609	L	33	Very low	31.2	Very low	157 Å²	157	125 Å²	125	82%	0.822	68%	0.678	S	S	*	*			trans	63.4	156.1	149.3	-86.6	60.1	0	0	0	122
610	G	32.3	Very low	30.8	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	70%	0.702	S	S	*	*			cis	-172	-154.9	4.7	0	0	0	0	0	110
611	T	30.6	Very low	30.3	Very low	135 Å²	135	133.6 Å²	133.6	83%	0.828	72%	0.716	S	S	*	*			cis	171.4	150.5	-25.6	28.8	0	0	0	0	108.5
612	S	32.6	Very low	29.9	Very low	90 Å²	90	136.6 Å²	136.6	63%	0.629	72%	0.723	S	S	*	*			cis	-171.9	140.1	-16.8	-163.6	0	0	0	0	113.1
613	E	30	Very low	29.4	Very low	145 Å²	145	136 Å²	136	68%	0.678	72%	0.717	S	S	*	*			trans	64.8	177.2	151.3	-69.2	173.9	115.4	0	0	122.5
614	K	31.1	Very low	29.2	Very low	172 Å²	172	136.5 Å²	136.5	75%	0.748	72%	0.719	S	S	*	*			cis	-129.6	-131.2	6.1	-134.5	127.4	-169.4	149.4	0	112.6
615	S	28.8	Very low	28.9	Very low	112 Å²	112	135 Å²	135	78%	0.783	72%	0.719	S	S	*	*			cis	-153.5	-141.8	1.1	-164.5	0	0	0	0	112.4
616	Q	29.3	Very low	28.9	Very low	178 Å²	178	136.8 Å²	136.8	83%	0.832	72%	0.723	S	S	*	*			trans	-126.7	166.2	-162.1	-67.2	161	-6.3	0	0	114.7
617	F	24.7	Very low	28.9	Very low	186 Å²	186	143.3 Å²	143.3	82%	0.816	73%	0.733	S	S	*	*			cis	101.1	114.9	15.2	-138.5	-68	0	0	0	116.5
618	K	29.8	Very low	28.7	Very low	165 Å²	165	143.2 Å²	143.2	72%	0.717	73%	0.734	S	S	*	*			trans	-169	157.8	147.9	-122.5	168.3	171.7	-177.7	0	117.2
619	Q	27.7	Very low	28.5	Very low	114 Å²	114	148.3 Å²	148.3	53%	0.533	74%	0.743	S	S	.	*			trans	60	119.6	155.5	-82.8	155	-56.3	0	0	119.4	R58	R58-Q619 PolarHBondContact NH2-O 3.32Å
620	Y	24.5	Very low	28.2	Very low	199 Å²	199	145.7 Å²	145.7	78%	0.78	74%	0.738	S	S	*	*				94.6	148.2	61.4	-86.1	-146.4	0	0	0	110.7
621	S	25.4	Very low	28.3	Very low	73 Å²	73	148.4 Å²	148.4	51%	0.51	74%	0.744	S	S	.	*			cis	-170.7	172.7	-10.6	-107.4	0	0	0	0	110.4
622	Q	25.8	Very low	28.3	Very low	147 Å²	147	147.7 Å²	147.7	69%	0.687	74%	0.743	S	S	*	*			trans	64.6	156.2	151.5	-72.1	158.2	-87.9	0	0	114.5
623	E	26.7	Very low	28	Very low	148 Å²	148	149 Å²	149	69%	0.692	75%	0.751	S	S	*	*			cis	-178.9	163.8	6.2	-108.7	155.9	-163	0	0	102.8
624	D	28.4	Very low	27.6	Very low	129 Å²	129	150.9 Å²	150.9	69%	0.69	76%	0.76	S	S	*	*			cis	-150.5	175.9	-5.5	-145.1	-23.5	0	0	0	111.4
625	N	25.3	Very low	27.4	Very low	137 Å²	137	148.4 Å²	148.4	73%	0.733	76%	0.763	S	S	*	*			trans	-58.5	150	-177.1	-71	-91.1	0	0	0	116.2
626	N	30	Very low	27.3	Very low	172 Å²	172	148.4 Å²	148.4	92%	0.92	76%	0.763	S	S	*	*			trans	-153.3	135.1	137.8	-109	-45.8	0	0	0	114
627	R	27.7	Very low	27.2	Very low	234 Å²	234	145.6 Å²	145.6	88%	0.883	76%	0.762	S	S	*	*			trans	-99.1	-177.5	171.6	-116.3	-172.6	176.8	-166.5	2.8	108.1
628	P	28	Very low	27.1	Very low	115 Å²	115	144.8 Å²	144.8	75%	0.747	76%	0.76	S	S	*	*			cis	-133.9	-153.4	2.9	42.4	-22.6	0	0	0	113.7
629	R	27.7	Very low	26.9	Very low	240 Å²	240	143.3 Å²	143.3	91%	0.906	76%	0.759	S	S	*	*			trans	-54.3	147.4	171.2	-55.1	167.6	170	-176.8	-4.6	114.4
630	S	26	Very low	26.8	Very low	102 Å²	102	145.6 Å²	145.6	71%	0.713	77%	0.769	S	S	*	*			trans	-168	155.5	133.6	52.5	0	0	0	0	111.8
631	P	34.8	Very low	26.8	Very low	124 Å²	124	140.1 Å²	140.1	81%	0.805	76%	0.76	S	S	*	*			trans	-94.1	147.4	164.4	35.9	-30.7	0	0	0	111.3
632	C	29.2	Very low	26.8	Very low	119 Å²	119	143.2 Å²	143.2	80%	0.804	77%	0.771	S	S	*	*			trans	-133.4	144.5	170.6	-65.3	0	0	0	0	110.9
633	C	26.9	Very low	26.8	Very low	117 Å²	117	146.7 Å²	146.7	79%	0.791	78%	0.779	S	S	*	*			trans	-117.2	-170.6	-178.8	-67.3	0	0	0	0	110.7
634	E	22.6	Very low	27	Very low	185 Å²	185	143.8 Å²	143.8	86%	0.864	77%	0.773	S	S	*	*			trans	82.9	160.9	158.5	-52.5	-166.6	122.6	0	0	118.8
635	C	25.4	Very low	26.9	Very low	120 Å²	120	147.2 Å²	147.2	81%	0.811	78%	0.782	S	S	*	*			trans	58.8	104.2	-178.6	-61.7	0	0	0	0	114.8
636	S	28.1	Very low	27	Very low	113 Å²	113	146 Å²	146	79%	0.79	77%	0.774	S	S	*	*			cis	53	87.8	26.3	-78.1	0	0	0	0	114.5
637	C	25.6	Very low	26.8	Very low	119 Å²	119	145.6 Å²	145.6	80%	0.804	77%	0.766	S	S	*	*				-165.4	123.9	129.6	-99.2	0	0	0	0	108.5
638	H	24.2	Very low	26.7	Very low	169 Å²	169	140.8 Å²	140.8	78%	0.782	76%	0.763	S	S	*	*				75.7	152.2	69.3	-109.7	-101.4	0	0	0	114.5
639	I	25.5	Very low	26.8	Very low	134 Å²	134	142 Å²	142	69%	0.687	76%	0.762	S	S	*	*			trans	71.3	128.7	163	-67.4	156	0	0	0	114
640	Q	25.9	Very low	26.8	Very low	162 Å²	162	138.8 Å²	138.8	76%	0.757	75%	0.754	S	S	*	*			cis	-151	123.4	-3.5	-114.5	166.3	-13.7	0	0	106.6
641	S	23.8	Very low	26.9	Very low	83 Å²	83	140.2 Å²	140.2	58%	0.58	75%	0.754	S	S	*	*				84.4	136.5	84.2	77.9	0	0	0	0	115.7
642	N	25.4	Very low	26.7	Very low	139 Å²	139	142.5 Å²	142.5	74%	0.743	75%	0.754	S	S	*	*			trans	76.3	134.8	165.6	-48.2	-26.1	0	0	0	115.7
643	Y	25.7	Very low	26.7	Very low	219 Å²	219	142.7 Å²	142.7	86%	0.859	75%	0.746	S	S	*	*			cis	64.3	147.9	41	-75.9	-91.9	0	0	0	113.6
644	P	31.3	Very low	26.8	Very low	87 Å²	87	143.3 Å²	143.3	57%	0.565	74%	0.741	S	S	*	*				-136.7	179.9	-53.1	37.6	-20.9	0	0	0	111.8
645	F	26.3	Very low	27	Very low	202 Å²	202	139.7 Å²	139.7	89%	0.886	74%	0.736	S	S	*	*			trans	-144.8	102.3	152	-139.6	-104.2	0	0	0	108.8
646	M	26.6	Very low	27.2	Very low	111 Å²	111	138.4 Å²	138.4	55%	0.547	73%	0.729	S	S	.	*				72	108.6	75.9	-67	-70.3	-172.1	0	0	111.8
647	Q	27.1	Very low	27.1	Very low	163 Å²	163	140.8 Å²	140.8	76%	0.762	73%	0.727	S	S	*	*				70.8	93.4	71.3	-95.8	86.7	-12.9	0	0	114.5
648	T	25.5	Very low	27.2	Very low	133 Å²	133	141.7 Å²	141.7	82%	0.816	72%	0.723	S	S	*	*			trans	-169.3	145.2	143.5	4.1	0	0	0	0	105.9
649	I	30.1	Very low	27.4	Very low	142 Å²	142	138.5 Å²	138.5	73%	0.728	72%	0.715	S	S	*	*			cis	-133.2	133.4	13	-70.7	-175.6	0	0	0	110.1
650	K	27.5	Very low	27.5	Very low	171 Å²	171	138.2 Å²	138.2	74%	0.743	72%	0.715	S	S	*	*			trans	20.4	158.4	131.9	-48.4	176	-178.4	173.7	0	120.9
651	N	28.3	Very low	27.6	Very low	133 Å²	133	137.1 Å²	137.1	71%	0.711	72%	0.715	S	S	*	*			cis	-178.1	-176.7	-21	-94.2	-11.6	0	0	0	106.6
652	Q	29.5	Very low	27.9	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	72%	0.72	S	S	*	*			trans	84.5	140	153.3	-56.1	-163.4	-28.5	0	0	116.8
653	I	30.1	Very low	28.2	Very low	122 Å²	122	139.2 Å²	139.2	63%	0.626	72%	0.72	S	S	*	*			cis	-149.5	136.7	-8.2	-122.9	165.2	0	0	0	112.5
654	N	27.5	Very low	28.5	Very low	130 Å²	130	134.5 Å²	134.5	70%	0.695	71%	0.709	S	S	*	*			trans	32.6	128.4	143.2	-51	-2.7	0	0	0	122.4
655	S	28.1	Very low	28.6	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	71%	0.713	S	S	*	*				85	150.6	117.9	-74.1	0	0	0	0	121.1
656	S	28.5	Very low	28.8	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	70%	0.703	S	S	*	*			cis	-172.3	161.5	-12.2	47.9	0	0	0	0	113
657	H	27.7	Very low	28.9	Very low	163 Å²	163	134.1 Å²	134.1	76%	0.755	71%	0.714	S	S	*	*			trans	75.4	140	141.4	-101	-57.5	0	0	0	121.6
658	L	27.5	Very low	29.1	Very low	139 Å²	139	133.7 Å²	133.7	73%	0.728	72%	0.717	S	S	*	*			trans	71.8	145.1	145.3	-62.5	171.7	0	0	0	119.2
659	T	28.2	Very low	29.6	Very low	101 Å²	101	133.1 Å²	133.1	62%	0.62	71%	0.709	S	S	*	*			cis	-164	161.8	-33.3	9	0	0	0	0	109.5
660	D	26.6	Very low	29.6	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	72%	0.715	S	S	*	*			trans	-0.1	130.1	147.9	-37	-32.4	0	0	0	118.3
661	N	29.1	Very low	29.7	Very low	140 Å²	140	135.8 Å²	135.8	75%	0.749	72%	0.721	S	S	*	*				-170.9	161.2	94.1	-109	-75.2	0	0	0	117.1
662	N	29.1	Very low	29.7	Very low	127 Å²	127	135 Å²	135	68%	0.679	72%	0.716	S	S	*	*			trans	-53.1	153.6	172	-55.5	-84.1	0	0	0	114.5
663	N	31.4	Very low	29.6	Very low	139 Å²	139	137.1 Å²	137.1	74%	0.743	72%	0.717	S	S	*	*				-174.2	150.8	101.8	-101.7	-30.2	0	0	0	117.5
664	N	32.2	Very low	29.7	Very low	120 Å²	120	141.6 Å²	141.6	64%	0.642	73%	0.732	S	S	*	*			trans	69.7	103.2	142.4	-68	-11.5	0	0	0	122.5
665	N	33	Very low	29.6	Very low	122 Å²	122	143.3 Å²	143.3	65%	0.652	74%	0.74	S	S	*	*				107.8	110.7	108.5	-71.9	-10.5	0	0	0	120.6
666	N	31.8	Very low	29.5	Very low	126 Å²	126	141 Å²	141	67%	0.674	73%	0.734	S	S	*	*				70.7	96.6	129	-60.3	-17.4	0	0	0	119.3
667	N	29.1	Very low	29.5	Very low	144 Å²	144	145.3 Å²	145.3	77%	0.77	74%	0.743	S	S	*	*				38.6	94.6	107.1	-63.1	-16.2	0	0	0	116.3
668	N	30.1	Very low	29.4	Very low	153 Å²	153	148.8 Å²	148.8	82%	0.818	75%	0.752	S	S	*	*				-156	150.3	128.2	-94.6	-39.6	0	0	0	110.5
669	N	35.5	Very low	29.3	Very low	121 Å²	121	146.1 Å²	146.1	65%	0.647	75%	0.745	S	S	*	*			trans	65.7	53.9	162.9	-54.1	-15.3	0	0	0	118.2
670	K	30.1	Very low	29.2	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.865	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-35.7	133.9	131.1	-174.3	179.7	-174.7	179.9	0	109.1
671	I	30	Very low	29.2	Very low	171 Å²	171	150.7 Å²	150.7	88%	0.877	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.2	-9.7	-173.7	-62.9	156.3	0	0	0	114.6
672	I	28.2	Very low	29.1	Very low	117 Å²	117	154 Å²	154	60%	0.6	77%	0.768	S	S	*	*			trans	-121	120.4	176.8	-65.5	178.1	0	0	0	108.5
673	R	28.5	Very low	28.8	Very low	216 Å²	216	151.7 Å²	151.7	82%	0.815	76%	0.762	S	S	*	*			cis	-142.5	166	1.9	-89.7	148.2	-179.7	158.3	-0.1	110	L675	R673-L675 PolarHBondContact O-N 3.37Å
674	K	30.8	Very low	28.5	Very low	216 Å²	216	152.7 Å²	152.7	94%	0.939	77%	0.765	S	S	*	*	S	Bend	trans	-67.3	40	179.1	-75.7	-172	169.9	-176.9	0	116.3
675	L	26.1	Very low	28.2	Very low	165 Å²	165	152.6 Å²	152.6	86%	0.864	77%	0.774	S	S	*	*			trans	-141.1	56.2	176.9	-74.8	172.6	0	0	0	110.4	R673	R673-L675 PolarHBondContact O-N 3.37Å
676	G	26.6	Very low	28	Very low	62 Å²	62	150.2 Å²	150.2	64%	0.639	78%	0.779	S	S	*	*			trans	-121.4	-3	-167.5	0	0	0	0	0	117
677	E	27.6	Very low	27.7	Very low	182 Å²	182	152.2 Å²	152.2	85%	0.85	79%	0.789	S	S	*	*	S	Bend	trans	-134.6	116.3	-173.4	-67.6	175.3	-173.8	0	0	109.7
678	Y	26.8	Very low	27.7	Very low	236 Å²	236	149.7 Å²	149.7	93%	0.925	78%	0.783	S	S	*	*	S	Bend	cis	-114.6	115	-20.9	-95.4	-108.5	0	0	0	107.6
679	S	25	Very low	27.7	Very low	84 Å²	84	148.9 Å²	148.9	59%	0.587	78%	0.779	S	S	*	*			trans	-114.6	132.6	-174	-165.3	0	0	0	0	112.5
680	N	24.9	Very low	27.4	Very low	146 Å²	146	148.7 Å²	148.7	78%	0.781	77%	0.774	S	S	*	*			trans	64.1	128.4	170.6	-53.4	-45.3	0	0	0	115.5
681	K	26.6	Very low	27.8	Very low	179 Å²	179	146.3 Å²	146.3	78%	0.778	77%	0.77	S	S	*	*			cis	-142.8	157	41	-69	163.8	-179.6	172	0	113.3	S683	K681-S683 PolarHBondContact O-N 3.12Å
682	Q	27.4	Very low	27.9	Very low	209 Å²	209	142.6 Å²	142.6	98%	0.977	76%	0.757	S	S	*	*			trans	-68.3	90.1	157	-70.9	178.2	-17.5	0	0	109.8
683	S	23.2	Very low	28.2	Very low	79 Å²	79	140.8 Å²	140.8	55%	0.552	75%	0.752	S	S	*	*			trans	-162.2	93.3	170.2	56.9	0	0	0	0	114.8	K681	K681-S683 PolarHBondContact O-N 3.12Å
684	I	25.1	Very low	28.6	Very low	159 Å²	159	136 Å²	136	82%	0.815	74%	0.737	S	S	*	*				63	116.3	127.9	-60.4	159.6	0	0	0	119.9
685	S	25.7	Very low	29	Very low	118 Å²	118	131.2 Å²	131.2	83%	0.825	72%	0.72	S	S	*	*			trans	70	141.2	153.4	73.1	0	0	0	0	120
686	G	28.5	Very low	29.6	Very low	73 Å²	73	128.7 Å²	128.7	75%	0.753	70%	0.704	S	S	*	*			trans	176.7	-10.9	-178.8	0	0	0	0	0	118.2
687	N	26.9	Very low	30.1	Very low	167 Å²	167	130.7 Å²	130.7	89%	0.893	70%	0.7	S	S	*	*			trans	46.3	81.3	166.8	-65.3	1.5	0	0	0	118.7
688	S	27.6	Very low	31.5	Very low	92 Å²	92	129.1 Å²	129.1	64%	0.643	69%	0.69	S	S	*	*			trans	-127.2	170.2	152.1	61.9	0	0	0	0	111.1	E690	S688-E690 PolarHBondContact O-N 2.86Å
689	D	29.6	Very low	32.4	Very low	135 Å²	135	126.3 Å²	126.3	72%	0.722	68%	0.678	S	S	*	*			trans	69.8	16.3	159.7	-47.7	-51.6	0	0	0	120.1	L691 P692	D689-L691 VanDerWaalsContact C-N 3.3Å; D689-L691 PolarHBondContact O-N 2.9Å; D689-P692 WeakPolarHBondContact O-CD 3.5Å
690	E	29.5	Very low	33.2	Very low	117 Å²	117	127.1 Å²	127.1	55%	0.547	67%	0.673	S	S	.	*			trans	-81.4	6.8	-178.6	-141	-156	157.6	0	0	116	S688 K694	S688-E690 PolarHBondContact O-N 2.86Å; E690-K694 VanDerWaalsContact CD-CE 3.42Å; E690-K694 WeakPolarHBondContact O-CD 3.33Å; E690-K694 WeakPolarHBondContact O-CG 3.44Å; E690-K694 WeakPolarHBondContact OE1-CE 3.46Å; E690-K694 IonicContact OE1-NZ 2.74Å; E690-K694 PolarHBondContact OE1-NZ 3.16Å; E690-K694 IonicContact OE2-NZ 3.05Å; E690-K694 PolarHBondContact OE2-NZ 3.03Å
691	L	38.4	Very low	34.1	Very low	149 Å²	149	124 Å²	124	78%	0.78	66%	0.662	S	S	*	*	H	α-helix	trans	-81.7	-45.5	-176	-125.8	73.8	0	0	0	114.9	D689 T693 K694 L695	D689-L691 VanDerWaalsContact C-N 3.3Å; D689-L691 PolarHBondContact O-N 2.9Å; L691-T693 PolarHBondContact O-N 3.44Å; L691-K694 PolarHBondContact O-N 3.28Å; L691-L695 PolarHBondContact O-N 3.08Å
692	P	34	Very low	35.5	Very low	93 Å²	93	119.9 Å²	119.9	60%	0.604	65%	0.648	S	S	*	*	H	α-helix	trans	-64.7	-38.4	-176	-23.8	35.3	0	0	0	113.3	D689 L695 H696	D689-P692 WeakPolarHBondContact O-CD 3.5Å; P692-L695 PolarHBondContact O-N 3.45Å; P692-H696 WeakPolarHBondContact O-CB 3.33Å; P692-H696 PolarHBondContact O-N 3.4Å
693	T	33.9	Very low	36.4	Very low	80 Å²	80	114.5 Å²	114.5	49%	0.491	63%	0.625	S	S	.	*	H	α-helix	trans	-70.6	-40.6	179.8	45.1	0	0	0	0	112.2	L691 L695 H696 N697	L691-T693 PolarHBondContact O-N 3.44Å; T693-L695 VanDerWaalsContact C-N 3.32Å; T693-L695 PolarHBondContact O-N 2.9Å; T693-H696 PolarHBondContact O-N 3.38Å; T693-N697 WeakPolarHBondContact O-CB 3.35Å; T693-N697 PolarHBondContact O-N 2.9Å
694	K	36.2	Very low	37.6	Very low	115 Å²	115	115.6 Å²	115.6	50%	0.5	62%	0.623	S	S	.	*	H	α-helix	trans	-61.1	-39.1	172.2	-80.5	175.4	169.2	160.3	0	112.1	E690 L691 K698	E690-K694 VanDerWaalsContact CD-CE 3.42Å; E690-K694 WeakPolarHBondContact O-CD 3.33Å; E690-K694 WeakPolarHBondContact O-CG 3.44Å; E690-K694 WeakPolarHBondContact OE1-CE 3.46Å; E690-K694 IonicContact OE1-NZ 2.74Å; E690-K694 PolarHBondContact OE1-NZ 3.16Å; E690-K694 IonicContact OE2-NZ 3.05Å; E690-K694 PolarHBondContact OE2-NZ 3.03Å; L691-K694 PolarHBondContact O-N 3.28Å; K694-K698 WeakPolarHBondContact O-CB 3.25Å; K694-K698 PolarHBondContact O-N 3.27Å; K694-K698 VanDerWaalsContact O-N 3.08Å
695	L	39.5	Very low	39	Very low	115 Å²	115	114.2 Å²	114.2	60%	0.602	61%	0.611	S	S	*	*	H	α-helix	trans	-69.5	-40	174.8	-155.8	96.3	0	0	0	112.3	L691 P692 T693 K698 R699	L691-L695 PolarHBondContact O-N 3.08Å; P692-L695 PolarHBondContact O-N 3.45Å; T693-L695 VanDerWaalsContact C-N 3.32Å; T693-L695 PolarHBondContact O-N 2.9Å; L695-K698 PolarHBondContact O-N 3.23Å; L695-R699 PolarHBondContact O-N 3.3Å
696	H	38.9	Very low	40.4	Very low	112 Å²	112	116.3 Å²	116.3	52%	0.519	60%	0.601	S	S	.	*	H	α-helix	trans	-59.4	-51.4	174.8	-175.2	98.3	0	0	0	111.1	P692 T693 K698 R699 H700	P692-H696 WeakPolarHBondContact O-CB 3.33Å; P692-H696 PolarHBondContact O-N 3.4Å; T693-H696 PolarHBondContact O-N 3.38Å; H696-K698 VanDerWaalsContact C-N 3.31Å; H696-K698 PolarHBondContact O-N 3.08Å; H696-R699 WeakPolarHBondContact O-CB 3.29Å; H696-R699 PolarHBondContact O-N 2.67Å; H696-R699 VanDerWaalsContact O-N 3.15Å; H696-H700 WeakPolarHBondContact O-CB 3.44Å; H696-H700 PolarHBondContact O-N 3.33Å
697	N	37.6	Very low	41.2	Very low	105 Å²	105	117.1 Å²	117.1	56%	0.561	59%	0.588	S	S	*	*	H	α-helix	trans	-63.3	-35.6	179.8	-69.1	-7.2	0	0	0	112	T693 H700 S701	T693-N697 WeakPolarHBondContact O-CB 3.35Å; T693-N697 PolarHBondContact O-N 2.9Å; N697-H700 PolarHBondContact O-N 3.09Å; N697-S701 WeakPolarHBondContact O-CB 3.37Å; N697-S701 PolarHBondContact O-N 2.84Å
698	K	55.7	Low	41.7	Very low	148 Å²	148	111.8 Å²	111.8	64%	0.643	56%	0.563	S	S	*	*	H	α-helix	trans	-67.4	-40.7	173.8	-165.1	169	-175.4	175.1	0	112.3	K694 L695 H696 S701 I702	K694-K698 WeakPolarHBondContact O-CB 3.25Å; K694-K698 PolarHBondContact O-N 3.27Å; K694-K698 VanDerWaalsContact O-N 3.08Å; L695-K698 PolarHBondContact O-N 3.23Å; H696-K698 VanDerWaalsContact C-N 3.31Å; H696-K698 PolarHBondContact O-N 3.08Å; K698-S701 PolarHBondContact O-N 3.26Å; K698-I702 HydrophobicContact CG-CD1 4.35Å; K698-I702 WeakPolarHBondContact O-CD1 3.31Å; K698-I702 VanDerWaalsContact O-CG1 3.31Å; K698-I702 WeakPolarHBondContact O-CG1 3.43Å; K698-I702 PolarHBondContact O-N 3.04Å; K698-I702 VanDerWaalsContact O-N 3.08Å
699	R	45.5	Very low	42.9	Very low	178 Å²	178	111.8 Å²	111.8	67%	0.672	55%	0.553	S	S	*	*	H	α-helix	trans	-63.3	-42.1	170.7	-97	-177.7	168.4	173.3	-2.8	112.1	L695 H696 I702 N703	L695-R699 PolarHBondContact O-N 3.3Å; H696-R699 WeakPolarHBondContact O-CB 3.29Å; H696-R699 PolarHBondContact O-N 2.67Å; H696-R699 VanDerWaalsContact O-N 3.15Å; R699-I702 PolarHBondContact O-N 3.26Å; R699-N703 WeakPolarHBondContact O-CB 3.39Å; R699-N703 PolarHBondContact O-N 2.68Å
700	H	42.2	Very low	43.9	Very low	101 Å²	101	111.2 Å²	111.2	47%	0.468	55%	0.546	S	S	.	.	H	α-helix	trans	-62.6	-44	177.4	-163.5	-57.2	0	0	0	111.3	H696 N697 N703 M704	H696-H700 WeakPolarHBondContact O-CB 3.44Å; H696-H700 PolarHBondContact O-N 3.33Å; N697-H700 PolarHBondContact O-N 3.09Å; H700-N703 PolarHBondContact O-N 3.08Å; H700-M704 WeakPolarHBondContact ND1-CG 3.34Å; H700-M704 WeakPolarHBondContact O-CB 3.49Å; H700-M704 VanDerWaalsContact O-CG 3.26Å; H700-M704 WeakPolarHBondContact O-CG 3.36Å; H700-M704 PolarHBondContact O-N 2.97Å
701	S	44.6	Very low	44.5	Very low	79 Å²	79	109.9 Å²	109.9	55%	0.552	54%	0.543	S	S	*	.	H	α-helix	trans	-59.5	-46.8	174.7	-179.7	0	0	0	0	112.2	N697 K698 N703 M704 K705	N697-S701 WeakPolarHBondContact O-CB 3.37Å; N697-S701 PolarHBondContact O-N 2.84Å; K698-S701 PolarHBondContact O-N 3.26Å; S701-N703 PolarHBondContact O-N 3.02Å; S701-M704 PolarHBondContact O-N 2.7Å; S701-K705 WeakPolarHBondContact O-CB 3.47Å; S701-K705 PolarHBondContact O-N 2.98Å
702	I	56.4	Low	44.8	Very low	94 Å²	94	106.2 Å²	106.2	48%	0.482	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-42	177.6	-68.3	164.5	0	0	0	111.5	K698 R699 K705 R706	K698-I702 HydrophobicContact CG-CD1 4.35Å; K698-I702 WeakPolarHBondContact O-CD1 3.31Å; K698-I702 VanDerWaalsContact O-CG1 3.31Å; K698-I702 WeakPolarHBondContact O-CG1 3.43Å; K698-I702 PolarHBondContact O-N 3.04Å; K698-I702 VanDerWaalsContact O-N 3.08Å; R699-I702 PolarHBondContact O-N 3.26Å; I702-K705 PolarHBondContact O-N 3.23Å; I702-R706 PolarHBondContact O-N 3.27Å
703	N	44.9	Very low	45.4	Very low	95 Å²	95	110.6 Å²	110.6	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-42.8	177.6	-76.1	-5.7	0	0	0	112.1	R699 H700 S701 K705 R706 L707	R699-N703 WeakPolarHBondContact O-CB 3.39Å; R699-N703 PolarHBondContact O-N 2.68Å; H700-N703 PolarHBondContact O-N 3.08Å; S701-N703 PolarHBondContact O-N 3.02Å; N703-K705 VanDerWaalsContact C-N 3.33Å; N703-R706 PolarHBondContact O-N 2.87Å; N703-L707 WeakPolarHBondContact O-CB 3.48Å; N703-L707 PolarHBondContact O-N 3.05Å
704	M	50	Low	45.7	Very low	103 Å²	103	111.2 Å²	111.2	51%	0.507	53%	0.531	S	S	.	.	H	α-helix	trans	-66.5	-35.3	175.5	-67.7	-62.6	-75.4	0	0	111.9	H700 S701 L707 S708	H700-M704 WeakPolarHBondContact ND1-CG 3.34Å; H700-M704 WeakPolarHBondContact O-CB 3.49Å; H700-M704 VanDerWaalsContact O-CG 3.26Å; H700-M704 WeakPolarHBondContact O-CG 3.36Å; H700-M704 PolarHBondContact O-N 2.97Å; S701-M704 PolarHBondContact O-N 2.7Å; M704-L707 WeakPolarHBondContact O-CB 3.33Å; M704-L707 PolarHBondContact O-N 2.84Å; M704-L707 HydrophobicContact SD-CD2 4.28Å; M704-S708 PolarHBondContact O-N 2.86Å
705	K	54.2	Low	45.8	Very low	130 Å²	130	110.6 Å²	110.6	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-65.2	-46.9	173.1	-166.4	176.2	178.3	178.1	0	111.3	S701 I702 N703 L707 S708 E709	S701-K705 WeakPolarHBondContact O-CB 3.47Å; S701-K705 PolarHBondContact O-N 2.98Å; I702-K705 PolarHBondContact O-N 3.23Å; N703-K705 VanDerWaalsContact C-N 3.33Å; K705-L707 VanDerWaalsContact C-N 3.29Å; K705-L707 PolarHBondContact O-N 2.82Å; K705-S708 CarbonylContact O-C 3.52Å; K705-S708 PolarHBondContact O-N 3.4Å; K705-S708 VanDerWaalsContact O-N 3.08Å; K705-S708 PolarHBondContact O-OG 3Å; K705-E709 WeakPolarHBondContact CE-OE1 3.36Å; K705-E709 WeakPolarHBondContact O-CG 3.41Å; K705-E709 PolarHBondContact O-N 2.89Å
706	R	54.2	Low	45.9	Very low	161 Å²	161	111.6 Å²	111.6	61%	0.608	53%	0.534	S	S	*	.	H	α-helix	trans	-57.4	-38.9	171.3	-99.5	-177.6	168	178.2	-4	113	I702 N703 E709 Q710	I702-R706 PolarHBondContact O-N 3.27Å; N703-R706 PolarHBondContact O-N 2.87Å; R706-E709 PolarHBondContact O-N 3.35Å; R706-Q710 WeakPolarHBondContact O-CB 3.35Å; R706-Q710 WeakPolarHBondContact O-CG 3.38Å; R706-Q710 PolarHBondContact O-N 3.36Å
707	L	46.1	Very low	45.9	Very low	90 Å²	90	112.2 Å²	112.2	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-42.1	174.8	-168.6	71.4	0	0	0	111	N703 M704 K705 E709 Q710 L711	N703-L707 WeakPolarHBondContact O-CB 3.48Å; N703-L707 PolarHBondContact O-N 3.05Å; M704-L707 WeakPolarHBondContact O-CB 3.33Å; M704-L707 PolarHBondContact O-N 2.84Å; M704-L707 HydrophobicContact SD-CD2 4.28Å; K705-L707 VanDerWaalsContact C-N 3.29Å; K705-L707 PolarHBondContact O-N 2.82Å; L707-E709 VanDerWaalsContact C-N 3.33Å; L707-E709 PolarHBondContact O-N 2.99Å; L707-Q710 PolarHBondContact O-N 3.33Å; L707-L711 HydrophobicContact CG-CD1 4.09Å; L707-L711 WeakPolarHBondContact O-CB 3.17Å; L707-L711 VanDerWaalsContact O-CG 3.27Å; L707-L711 WeakPolarHBondContact O-CG 3.1Å; L707-L711 PolarHBondContact O-N 3.37Å
708	S	37	Very low	45.7	Very low	55 Å²	55	113.6 Å²	113.6	39%	0.385	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-34	174.7	75.6	0	0	0	0	112.9	M704 K705 T712	M704-S708 PolarHBondContact O-N 2.86Å; K705-S708 CarbonylContact O-C 3.52Å; K705-S708 PolarHBondContact O-N 3.4Å; K705-S708 VanDerWaalsContact O-N 3.08Å; K705-S708 PolarHBondContact O-OG 3Å; S708-T712 WeakPolarHBondContact O-CB 3.37Å; S708-T712 PolarHBondContact O-N 2.74Å; S708-T712 PolarHBondContact O-OG1 3.19Å
709	E	53	Low	44.6	Very low	92 Å²	92	113.3 Å²	113.3	43%	0.43	55%	0.553	S	S	.	*	H	α-helix	trans	-70.9	-38.9	174.7	-70.9	162.7	-173.3	0	0	111.6	K705 R706 L707 R713	K705-E709 WeakPolarHBondContact CE-OE1 3.36Å; K705-E709 WeakPolarHBondContact O-CG 3.41Å; K705-E709 PolarHBondContact O-N 2.89Å; R706-E709 PolarHBondContact O-N 3.35Å; L707-E709 VanDerWaalsContact C-N 3.33Å; L707-E709 PolarHBondContact O-N 2.99Å; E709-R713 WeakPolarHBondContact O-CB 3.46Å; E709-R713 WeakPolarHBondContact O-CG 3.48Å; E709-R713 PolarHBondContact O-N 2.8Å
710	Q	50.5	Low	43.9	Very low	123 Å²	123	110.7 Å²	110.7	58%	0.575	56%	0.557	S	S	*	*	H	α-helix	trans	-63.6	-49.1	172	-71	-86.2	-20.7	0	0	111.3	R706 L707 T712 R713 L714	R706-Q710 WeakPolarHBondContact O-CB 3.35Å; R706-Q710 WeakPolarHBondContact O-CG 3.38Å; R706-Q710 PolarHBondContact O-N 3.36Å; L707-Q710 PolarHBondContact O-N 3.33Å; Q710-T712 PolarHBondContact O-N 2.99Å; Q710-R713 PolarHBondContact O-N 2.83Å; Q710-L714 WeakPolarHBondContact O-CG 3.4Å; Q710-L714 PolarHBondContact O-N 3.49Å
711	L	41.2	Very low	43.1	Very low	90 Å²	90	109.4 Å²	109.4	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-64.7	-38	177.3	-69.7	168.4	0	0	0	112	L707 L714 N715	L707-L711 HydrophobicContact CG-CD1 4.09Å; L707-L711 WeakPolarHBondContact O-CB 3.17Å; L707-L711 VanDerWaalsContact O-CG 3.27Å; L707-L711 WeakPolarHBondContact O-CG 3.1Å; L707-L711 PolarHBondContact O-N 3.37Å; L711-L714 HydrophobicContact CD2-CD1 4.48Å; L711-L714 PolarHBondContact O-N 3.33Å; L711-N715 WeakPolarHBondContact O-CB 3.38Å; L711-N715 VanDerWaalsContact O-CG 3.26Å; L711-N715 PolarHBondContact O-N 3.34Å; L711-N715 PolarHBondContact O-ND2 3.47Å
712	T	45.7	Very low	42.2	Very low	72 Å²	72	111.8 Å²	111.8	44%	0.442	58%	0.577	S	S	.	*	H	α-helix	trans	-64.3	-39.8	173.4	-61.6	0	0	0	0	111.5	S708 Q710 N715 H716	S708-T712 WeakPolarHBondContact O-CB 3.37Å; S708-T712 PolarHBondContact O-N 2.74Å; S708-T712 PolarHBondContact O-OG1 3.19Å; Q710-T712 PolarHBondContact O-N 2.99Å; T712-N715 PolarHBondContact O-N 3.27Å; T712-H716 PolarHBondContact O-CD2 3.24Å; T712-H716 VanDerWaalsContact O-CD2 3.26Å; T712-H716 PolarHBondContact O-N 3.2Å
713	R	47	Very low	40.8	Very low	184 Å²	184	117.4 Å²	117.4	69%	0.694	59%	0.594	S	S	*	*	H	α-helix	trans	-65.1	-41.6	173	-77.4	177	173	-156.2	-4.2	112.5	E709 Q710 N715 H716 L717	E709-R713 WeakPolarHBondContact O-CB 3.46Å; E709-R713 WeakPolarHBondContact O-CG 3.48Å; E709-R713 PolarHBondContact O-N 2.8Å; Q710-R713 PolarHBondContact O-N 2.83Å; R713-N715 VanDerWaalsContact C-N 3.33Å; R713-H716 PolarHBondContact O-N 3.22Å; R713-L717 WeakPolarHBondContact O-CG 3.33Å; R713-L717 PolarHBondContact O-N 3.22Å; R713-L717 VanDerWaalsContact O-N 3.08Å
714	L	39.8	Very low	40	Very low	93 Å²	93	117.5 Å²	117.5	49%	0.487	60%	0.602	S	S	.	*	H	α-helix	trans	-63.4	-38.4	174	-70.7	165.2	0	0	0	111.8	Q710 L711 L717 N718	Q710-L714 WeakPolarHBondContact O-CG 3.4Å; Q710-L714 PolarHBondContact O-N 3.49Å; L711-L714 HydrophobicContact CD2-CD1 4.48Å; L711-L714 PolarHBondContact O-N 3.33Å; L714-L717 PolarHBondContact O-N 2.92Å; L714-N718 PolarHBondContact O-N 3.47Å
715	N	38.7	Very low	38.9	Very low	102 Å²	102	119.2 Å²	119.2	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-70	-36.8	175.7	-72.5	-17.1	0	0	0	112.9	L711 T712 R713 L717 N718	L711-N715 WeakPolarHBondContact O-CB 3.38Å; L711-N715 VanDerWaalsContact O-CG 3.26Å; L711-N715 PolarHBondContact O-N 3.34Å; L711-N715 PolarHBondContact O-ND2 3.47Å; T712-N715 PolarHBondContact O-N 3.27Å; R713-N715 VanDerWaalsContact C-N 3.33Å; N715-L717 VanDerWaalsContact C-N 3.3Å; N715-L717 PolarHBondContact O-N 3.15Å; N715-N718 PolarHBondContact O-N 3.12Å
716	H	41.2	Very low	37.7	Very low	137 Å²	137	118.8 Å²	118.8	63%	0.634	62%	0.617	S	S	*	*	H	α-helix	trans	-68.6	-27.3	173.2	-84.4	-68.6	0	0	0	113.4	T712 R713 N718	T712-H716 PolarHBondContact O-CD2 3.24Å; T712-H716 VanDerWaalsContact O-CD2 3.26Å; T712-H716 PolarHBondContact O-N 3.2Å; R713-H716 PolarHBondContact O-N 3.22Å; H716-N718 VanDerWaalsContact C-N 3.28Å
717	L	38.9	Very low	36.5	Very low	125 Å²	125	119.6 Å²	119.6	65%	0.654	63%	0.633	S	S	*	*	H	α-helix	trans	-73.3	-18.7	171.6	-71.3	165.5	0	0	0	113	R713 L714 N715	R713-L717 WeakPolarHBondContact O-CG 3.33Å; R713-L717 PolarHBondContact O-N 3.22Å; R713-L717 VanDerWaalsContact O-N 3.08Å; L714-L717 PolarHBondContact O-N 2.92Å; N715-L717 VanDerWaalsContact C-N 3.3Å; N715-L717 PolarHBondContact O-N 3.15Å
718	N	33.8	Very low	35.6	Very low	133 Å²	133	122.3 Å²	122.3	71%	0.711	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	7.7	179.7	-80.3	-21.2	0	0	0	114.6	L714 N715 H716	L714-N718 PolarHBondContact O-N 3.47Å; N715-N718 PolarHBondContact O-N 3.12Å; H716-N718 VanDerWaalsContact C-N 3.28Å
719	L	32.5	Very low	35.1	Very low	142 Å²	142	127.1 Å²	127.1	74%	0.743	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	7.9	-178.7	-88.6	161.2	0	0	0	114.7
720	T	30.8	Very low	33.8	Very low	123 Å²	123	131.1 Å²	131.1	76%	0.755	68%	0.682	S	S	*	*	S	Bend	trans	-137.2	104	173.9	54	0	0	0	0	111.3
721	G	25.8	Very low	32.7	Very low	74 Å²	74	131.6 Å²	131.6	76%	0.763	69%	0.688	S	S	*	*	S	Bend	trans	115.8	49.4	161.2	0	0	0	0	0	119.4
722	N	25.3	Very low	32.1	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	71%	0.705	S	S	*	*			trans	46.3	121.7	138.9	-81.9	0.1	0	0	0	122.3
723	Y	25.9	Very low	31.2	Very low	213 Å²	213	139.8 Å²	139.8	84%	0.835	72%	0.721	S	S	*	*			trans	67.3	150.8	155.2	-53.1	-59	0	0	0	117.9
724	S	28.4	Very low	30.2	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	72%	0.722	S	S	*	*			cis	-159.3	110.2	-21.9	168	0	0	0	0	107.4
725	N	27.2	Very low	29.6	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	74%	0.741	S	S	*	*				85.7	145.1	81.6	-141.6	14	0	0	0	114.6
726	N	28.9	Very low	29	Very low	121 Å²	121	140.1 Å²	140.1	65%	0.647	74%	0.74	S	S	*	*			trans	70.3	98.2	167.6	-54.7	-19.7	0	0	0	119.7
727	N	29.3	Very low	28.2	Very low	177 Å²	177	140.8 Å²	140.8	95%	0.947	75%	0.747	S	S	*	*				-142	117.2	95.6	-125.6	-19.2	0	0	0	110
728	L	27	Very low	27.7	Very low	148 Å²	148	140.5 Å²	140.5	78%	0.775	75%	0.746	S	S	*	*			trans	-147.5	121.3	-168.2	176.4	153.3	0	0	0	109.1
729	M	25.5	Very low	27.5	Very low	155 Å²	155	139.7 Å²	139.7	76%	0.764	74%	0.742	S	S	*	*			trans	-164.5	161.1	154.4	-114.4	-168	-148.6	0	0	113
730	F	26.8	Very low	27.3	Very low	177 Å²	177	138.5 Å²	138.5	78%	0.776	74%	0.736	S	S	*	*			trans	76.4	119.7	176	-61.2	-77.6	0	0	0	118.8
731	I	27.4	Very low	27.4	Very low	133 Å²	133	138.9 Å²	138.9	68%	0.682	73%	0.733	S	S	*	*			cis	-161.8	153.4	-37.1	-119.8	172	0	0	0	106.9	K733	I731-K733 PolarHBondContact O-N 2.64Å
732	N	27.5	Very low	27.6	Very low	158 Å²	158	141.4 Å²	141.4	85%	0.845	73%	0.729	S	S	*	*			trans	-61.3	131.4	173.4	-71	-43.3	0	0	0	112.2
733	K	27.6	Very low	27.8	Very low	176 Å²	176	142.6 Å²	142.6	77%	0.765	73%	0.73	S	S	*	*			trans	-145.8	107.9	152.2	-89.8	-143.8	172.1	-172.9	0	114.1	I731	I731-K733 PolarHBondContact O-N 2.64Å
734	Y	26	Very low	28	Very low	184 Å²	184	139.3 Å²	139.3	72%	0.722	73%	0.726	S	S	*	*			trans	53.9	115	149.2	-60.2	-91.3	0	0	0	121
735	S	27.8	Very low	28	Very low	126 Å²	126	139.4 Å²	139.4	88%	0.881	72%	0.723	S	S	*	*			trans	-134.1	75.8	130	65.9	0	0	0	0	109.5
736	S	24.5	Very low	28.2	Very low	76 Å²	76	142 Å²	142	53%	0.531	73%	0.728	S	S	.	*			trans	-79.8	172.4	165.8	-52.5	0	0	0	0	110
737	I	26.3	Very low	28.3	Very low	150 Å²	150	140.1 Å²	140.1	77%	0.769	72%	0.724	S	S	*	*			trans	74.8	125.4	161.7	-61.9	161.3	0	0	0	114.2
738	N	27.4	Very low	28.3	Very low	119 Å²	119	138.6 Å²	138.6	64%	0.636	72%	0.716	S	S	*	*			cis	-168.4	160	-9.5	-116.9	5.7	0	0	0	111.4
739	N	29	Very low	28.6	Very low	117 Å²	117	137.9 Å²	137.9	63%	0.626	71%	0.712	S	S	*	*			trans	67.9	150.5	138.2	-65.5	11.5	0	0	0	120.4
740	N	28.9	Very low	28.8	Very low	116 Å²	116	137.2 Å²	137.2	62%	0.62	71%	0.709	S	S	*	*			cis	-165.5	173.3	-10.4	-115.2	8	0	0	0	112
741	N	32.4	Very low	29.2	Very low	132 Å²	132	135.7 Å²	135.7	71%	0.706	70%	0.702	S	S	*	*			trans	71.6	139.4	163.4	-54.3	-7.3	0	0	0	116.4
742	D	31.3	Very low	29.4	Very low	126 Å²	126	135.1 Å²	135.1	67%	0.674	70%	0.7	S	S	*	*			cis	-159.3	168.7	-12.4	-119.1	-44.8	0	0	0	114.2
743	H	27.8	Very low	29.7	Very low	155 Å²	155	136.2 Å²	136.2	72%	0.718	70%	0.7	S	S	*	*			trans	-13.9	151	159.7	-90.3	-113.2	0	0	0	119.6
744	L	30.2	Very low	30	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	70%	0.703	S	S	*	*			cis	-157.4	134.9	34.5	-101.4	122.1	0	0	0	115.4
745	T	29.1	Very low	30.1	Very low	99 Å²	99	133.1 Å²	133.1	61%	0.607	70%	0.704	S	S	*	*			trans	32.6	137.6	136	65.9	0	0	0	0	126.6
746	K	31	Very low	30.2	Very low	194 Å²	194	130.9 Å²	130.9	84%	0.843	69%	0.693	S	S	*	*			trans	69.5	154.7	134.3	-75.2	179.2	179.2	-179	0	119.8
747	S	30.8	Very low	30.6	Very low	82 Å²	82	133.9 Å²	133.9	57%	0.573	70%	0.703	S	S	*	*			cis	-176	168.8	-16.5	51.5	0	0	0	0	111.4
748	N	30.8	Very low	30.9	Very low	144 Å²	144	134 Å²	134	77%	0.77	70%	0.7	S	S	*	*			trans	77	156.2	161.8	-55.8	-16.2	0	0	0	116.6
749	L	32.2	Very low	31.2	Very low	133 Å²	133	134 Å²	134	70%	0.696	70%	0.7	S	S	*	*			cis	-156.1	162.7	-1	-146.5	71.7	0	0	0	112.3
750	M	30.9	Very low	31.3	Very low	141 Å²	141	135.6 Å²	135.6	70%	0.695	70%	0.704	S	S	*	*			trans	11.2	156.9	144.3	-69.4	152.9	89.6	0	0	121.7
751	K	34.1	Very low	31.6	Very low	146 Å²	146	136.4 Å²	136.4	64%	0.635	71%	0.708	S	S	*	*			cis	-172.1	164.6	12.5	-123.2	172.5	166.6	-83.7	0	111.9
752	D	32.5	Very low	31.5	Very low	121 Å²	121	136 Å²	136	65%	0.647	70%	0.704	S	S	*	*			trans	39.9	163.5	148.4	-44.6	-24.6	0	0	0	121.1
753	E	34.3	Very low	31.7	Very low	180 Å²	180	136.5 Å²	136.5	84%	0.841	70%	0.703	S	S	*	*			cis	-135	160	16.9	-70.9	175.6	111	0	0	109.9
754	Q	32.3	Very low	32.1	Very low	174 Å²	174	136.2 Å²	136.2	81%	0.813	70%	0.699	S	S	*	*				57.5	137.6	64.6	-62.5	-162.8	39.7	0	0	115
755	T	28.4	Very low	32.2	Very low	121 Å²	121	135.1 Å²	135.1	74%	0.742	69%	0.694	S	S	*	*			cis	-165.8	156.2	2	7.3	0	0	0	0	114.2
756	A	30.8	Very low	32.4	Very low	80 Å²	80	134.6 Å²	134.6	66%	0.661	69%	0.688	S	S	*	*			trans	77.4	140.9	135.8	0	0	0	0	0	126.2
757	N	32.8	Very low	32.5	Very low	138 Å²	138	133.5 Å²	133.5	74%	0.738	68%	0.68	S	S	*	*			trans	99.5	110.6	135.6	-73.8	0.5	0	0	0	126
758	H	33.1	Very low	32.6	Very low	152 Å²	152	137 Å²	137	70%	0.704	68%	0.684	S	S	*	*				82.2	129.1	124.5	-79.8	-62.6	0	0	0	125.3
759	N	32.7	Very low	32.6	Very low	120 Å²	120	134 Å²	134	64%	0.642	68%	0.675	S	S	*	*			trans	73.3	154.2	136.9	-72.6	28.4	0	0	0	121.5
760	E	31.4	Very low	32.4	Very low	150 Å²	150	133.2 Å²	133.2	70%	0.701	68%	0.676	S	S	*	*			cis	-168.1	-180	-33	-150.3	155.5	-165.4	0	0	108
761	D	34.5	Very low	32.5	Very low	133 Å²	133	133.6 Å²	133.6	71%	0.711	68%	0.681	S	S	*	*			trans	66.4	154.7	159.4	-73.4	-8.5	0	0	0	122
762	I	31.5	Very low	32.4	Very low	123 Å²	123	134.4 Å²	134.4	63%	0.631	69%	0.687	S	S	*	*			cis	-168.2	157.8	-35.4	-130.5	173.5	0	0	0	111.2
763	H	35.7	Very low	32.2	Very low	138 Å²	138	133.8 Å²	133.8	64%	0.639	69%	0.691	S	S	*	*			trans	69.1	155.5	163.1	-74.7	1.1	0	0	0	120.1
764	K	35.2	Very low	32	Very low	148 Å²	148	131 Å²	131	64%	0.643	68%	0.682	S	S	*	*			cis	-165.7	153.2	-12.9	-110.8	176.6	172.5	148.7	0	112.7
765	N	32.2	Very low	32	Very low	120 Å²	120	130.8 Å²	130.8	64%	0.642	68%	0.678	S	S	*	*			trans	50	144.2	146.8	-67.6	49.7	0	0	0	121.7
766	D	32.4	Very low	32	Very low	89 Å²	89	132.2 Å²	132.2	48%	0.476	68%	0.679	S	S	.	*			cis	-155.9	-140.3	-9.9	-81.1	-30.2	0	0	0	106.9
767	Y	33.5	Very low	32.1	Very low	171 Å²	171	133.2 Å²	133.2	67%	0.671	68%	0.679	S	S	*	*			cis	-168.5	122.5	1.6	-163.4	-100.7	0	0	0	112.8
768	F	33.1	Very low	31.8	Very low	154 Å²	154	134 Å²	134	68%	0.675	68%	0.683	S	S	*	*			trans	53.3	151	153	-75.6	-119.4	0	0	0	121.3
769	S	30.1	Very low	31.6	Very low	82 Å²	82	132.9 Å²	132.9	57%	0.573	69%	0.687	S	S	*	*			cis	-168.3	163.4	-11.5	-117.8	0	0	0	0	113.1
770	T	30.1	Very low	31.4	Very low	116 Å²	116	136.8 Å²	136.8	71%	0.712	70%	0.698	S	S	*	*			trans	59.6	140.1	150.5	52.5	0	0	0	0	120.4
771	D	31.3	Very low	31.3	Very low	150 Å²	150	134.7 Å²	134.7	80%	0.802	70%	0.7	S	S	*	*			cis	-156.1	161.4	4.9	-104.4	-27.1	0	0	0	113.9
772	E	32.5	Very low	31	Very low	163 Å²	163	134.2 Å²	134.2	76%	0.762	70%	0.701	S	S	*	*			trans	-87.6	-171.1	163.6	-73.7	-166.2	85.1	0	0	110.6
773	C	28.6	Very low	30.7	Very low	107 Å²	107	136.4 Å²	136.4	72%	0.723	71%	0.711	S	S	*	*			cis	-163.2	138.2	24.8	-146.2	0	0	0	0	107.8
774	N	30.8	Very low	30.4	Very low	122 Å²	122	137 Å²	137	65%	0.652	72%	0.718	S	S	*	*				76.8	130.2	63.8	-121.6	-24.4	0	0	0	116.5
775	K	32.1	Very low	30	Very low	169 Å²	169	134.2 Å²	134.2	74%	0.735	72%	0.717	S	S	*	*			trans	90.4	102.3	145.6	-76.9	-170.7	176.3	178	0	126.5
776	I	27.8	Very low	29.8	Very low	151 Å²	151	135.6 Å²	135.6	77%	0.774	73%	0.725	S	S	*	*			trans	63.7	172.5	131.8	16.6	179.6	0	0	0	120.9
777	P	32.5	Very low	29.7	Very low	102 Å²	102	136 Å²	136	66%	0.662	73%	0.734	S	S	*	*				-135.8	-168.6	-127.6	47.2	-26.9	0	0	0	117.8
778	L	26.4	Very low	29.6	Very low	154 Å²	154	136.2 Å²	136.2	81%	0.806	74%	0.739	S	S	*	*			trans	80.9	143.8	156.1	-78.8	170	0	0	0	120.5
779	T	29	Very low	29.4	Very low	129 Å²	129	135.8 Å²	135.8	79%	0.791	74%	0.74	S	S	*	*			trans	69.7	131.9	162	42.4	0	0	0	0	121
780	K	28.1	Very low	29.4	Very low	202 Å²	202	137.5 Å²	137.5	88%	0.878	75%	0.748	S	S	*	*			trans	-27.4	147	161.2	-50.2	169.8	-177.8	179.1	0	113.1
781	S	29.5	Very low	29.5	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	75%	0.747	S	S	*	*			cis	-167.2	155.8	40.1	-155.4	0	0	0	0	114.2
782	V	27.9	Very low	29.5	Very low	122 Å²	122	135.6 Å²	135.6	74%	0.739	74%	0.741	S	S	*	*			trans	26.8	106.9	145.4	-179.6	0	0	0	0	119.7
783	M	25.8	Very low	29.6	Very low	170 Å²	170	134.1 Å²	134.1	84%	0.837	74%	0.738	S	S	*	*			trans	72.8	151.2	138.8	-70.6	-69.5	-173.4	0	0	123.2
784	L	29.2	Very low	29.8	Very low	151 Å²	151	135.2 Å²	135.2	79%	0.791	74%	0.736	S	S	*	*			trans	76.7	88.1	154.3	-72.7	157.6	0	0	0	120.4
785	S	27.1	Very low	29.8	Very low	88 Å²	88	134 Å²	134	62%	0.615	74%	0.737	S	S	*	*				61.8	121.5	120	63	0	0	0	0	122.1
786	D	28.4	Very low	29.8	Very low	149 Å²	149	130.6 Å²	130.6	80%	0.797	74%	0.735	S	S	*	*			trans	88.7	118.3	130.3	-68.5	9.1	0	0	0	123
787	S	30.2	Very low	29.9	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	74%	0.736	S	S	*	*			trans	89	103.8	132.9	-70.8	0	0	0	0	121.7
788	K	30.6	Very low	29.9	Very low	177 Å²	177	132.1 Å²	132.1	77%	0.77	74%	0.742	S	S	*	*				91.4	117.8	120.4	-76.9	-178.1	171.4	178.9	0	121.5
789	M	29.5	Very low	29.9	Very low	144 Å²	144	131.5 Å²	131.5	71%	0.709	74%	0.74	S	S	*	*				88.3	120.8	124.4	-69.3	174.1	83.6	0	0	120.7
790	T	29.8	Very low	29.9	Very low	118 Å²	118	129.8 Å²	129.8	72%	0.724	73%	0.729	S	S	*	*			trans	57.8	137.9	135.9	60.2	0	0	0	0	120.2
791	S	32.6	Very low	29.9	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	72%	0.718	S	S	*	*			cis	-169	-153.9	-10.2	44.4	0	0	0	0	106.2
792	N	30.8	Very low	29.8	Very low	126 Å²	126	130 Å²	130	67%	0.674	72%	0.721	S	S	*	*			cis	-167.4	169.2	8.1	-150.7	-4.8	0	0	0	111.4
793	L	34.5	Very low	29.8	Very low	132 Å²	132	130.2 Å²	130.2	69%	0.691	72%	0.719	S	S	*	*			trans	68.1	147.1	160.9	-54.8	164.6	0	0	0	116.7
794	N	33.2	Very low	29.9	Very low	130 Å²	130	127.5 Å²	127.5	70%	0.695	72%	0.717	S	S	*	*			cis	-154.2	152.5	-0.3	-131.7	-9.1	0	0	0	114
795	S	31	Very low	29.8	Very low	97 Å²	97	125.9 Å²	125.9	68%	0.678	72%	0.717	S	S	*	*			trans	30	138.6	150.7	60.2	0	0	0	0	122.2
796	S	32.9	Very low	29.7	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	73%	0.728	S	S	*	*			cis	-167.1	139.1	-3.4	41.1	0	0	0	0	109.6
797	T	29.8	Very low	29.9	Very low	130 Å²	130	131.6 Å²	131.6	80%	0.798	73%	0.73	S	S	*	*				55.8	132.9	86.7	-4.3	0	0	0	0	112.8
798	I	31.8	Very low	29.6	Very low	155 Å²	155	133.4 Å²	133.4	80%	0.795	73%	0.732	S	S	*	*			cis	-144.7	146	35.8	-66.8	169.7	0	0	0	112.7
799	N	26.7	Very low	29.5	Very low	142 Å²	142	131.3 Å²	131.3	76%	0.759	73%	0.734	S	S	*	*			trans	-100.6	162.3	164.6	-75.8	-38.7	0	0	0	110.5
800	T	29.3	Very low	29.5	Very low	93 Å²	93	133 Å²	133	57%	0.571	74%	0.742	S	S	*	*				163.5	131	108.6	47.4	0	0	0	0	115.2
801	T	27.7	Very low	29.2	Very low	104 Å²	104	133.1 Å²	133.1	64%	0.638	75%	0.748	S	S	*	*			trans	44.3	126.9	142.3	58.5	0	0	0	0	123
802	Y	27.1	Very low	28.9	Very low	207 Å²	207	136 Å²	136	81%	0.812	75%	0.753	S	S	*	*				-149.9	139.4	115.7	-134.1	-100.1	0	0	0	112
803	N	28.3	Very low	28.7	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	75%	0.753	S	S	*	*	S	Bend	trans	43.9	108.5	167.5	-70.7	-9	0	0	0	122.2
804	S	28	Very low	28.3	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	76%	0.761	S	S	*	*				63.8	53.8	128.2	-56.1	0	0	0	0	120.2	R806	S804-R806 VanDerWaalsContact C-N 3.33Å; S804-R806 PolarHBondContact O-N 2.68Å
805	S	25.9	Very low	28.1	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	76%	0.763	S	S	*	*			trans	-69	84.3	158.4	44	0	0	0	0	111.8
806	R	27	Very low	27.9	Very low	222 Å²	222	134.8 Å²	134.8	84%	0.838	76%	0.761	S	S	*	*			trans	-119.8	116.2	172.7	-169.9	170	-179.7	163.7	-0.6	110.6	S804	S804-R806 VanDerWaalsContact C-N 3.33Å; S804-R806 PolarHBondContact O-N 2.68Å
807	T	30.6	Very low	27.6	Very low	135 Å²	135	137 Å²	137	83%	0.828	77%	0.77	S	S	*	*			trans	60.2	69.4	173.5	50.2	0	0	0	0	116.5
808	D	25.1	Very low	27.5	Very low	136 Å²	136	137.5 Å²	137.5	73%	0.727	77%	0.767	S	S	*	*			trans	-65.2	125	155.2	-69.1	-70.4	0	0	0	111.2
809	T	27.7	Very low	27.1	Very low	132 Å²	132	135.5 Å²	135.5	81%	0.81	77%	0.767	S	S	*	*				174.9	116.1	113.9	29.3	0	0	0	0	112.8
810	M	29.1	Very low	27.3	Very low	179 Å²	179	135.7 Å²	135.7	88%	0.882	77%	0.765	S	S	*	*			trans	47.1	77.1	149.1	-62.2	-172	171.4	0	0	118.7	M812	M810-M812 PolarHBondContact O-N 3.5Å; M810-M812 VanDerWaalsContact O-N 3.11Å
811	S	24.2	Very low	27.1	Very low	121 Å²	121	135.8 Å²	135.8	85%	0.846	77%	0.77	S	S	*	*			trans	-67.4	99.9	155	56.3	0	0	0	0	110.7
812	M	26.3	Very low	27.3	Very low	162 Å²	162	138.4 Å²	138.4	80%	0.798	78%	0.775	S	S	*	*			trans	-137.8	145	175.3	-89.1	-66.7	161.8	0	0	113.3	M810	M810-M812 PolarHBondContact O-N 3.5Å; M810-M812 VanDerWaalsContact O-N 3.11Å
813	S	27.6	Very low	27.4	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	78%	0.779	S	S	*	*			trans	57	83.3	171.2	55.6	0	0	0	0	117.1	L815	S813-L815 PolarHBondContact O-N 2.9Å
814	S	25.2	Very low	27.4	Very low	123 Å²	123	138.9 Å²	138.9	86%	0.86	78%	0.783	S	S	*	*			trans	-58.1	124.3	147	39.6	0	0	0	0	110.4
815	L	29.6	Very low	27.5	Very low	141 Å²	141	139.1 Å²	139.1	74%	0.738	78%	0.783	S	S	*	*			trans	-142.3	153.9	167.6	-96.9	112.3	0	0	0	110	S813	S813-L815 PolarHBondContact O-N 2.9Å
816	P	27	Very low	27.5	Very low	98 Å²	98	140 Å²	140	64%	0.636	78%	0.783	S	S	*	*			trans	-88	145.2	-139.3	30.9	-36.7	0	0	0	115.2	L818	P816-L818 PolarHBondContact O-N 3.46Å
817	T	25.4	Very low	27.8	Very low	142 Å²	142	140.7 Å²	140.7	87%	0.871	79%	0.786	S	S	*	*			trans	-58.2	115.9	154.9	46.3	0	0	0	0	109.9
818	L	27	Very low	27.7	Very low	141 Å²	141	142.2 Å²	142.2	74%	0.738	79%	0.786	S	S	*	*			trans	-111.4	90.7	169.2	-111.8	163.4	0	0	0	108.7	P816 M820	P816-L818 PolarHBondContact O-N 3.46Å; L818-M820 HydrophobicContact CD2-CG 4.11Å; L818-M820 PolarHBondContact O-N 3Å
819	S	25.1	Very low	28.2	Very low	114 Å²	114	140.8 Å²	140.8	80%	0.797	78%	0.784	S	S	*	*			trans	-64.6	115.7	163.7	38.1	0	0	0	0	108.6
820	M	29.9	Very low	28.7	Very low	146 Å²	146	138.7 Å²	138.7	72%	0.719	77%	0.771	S	S	*	*			trans	-127.6	96.5	169.3	-71.3	-144.9	71.3	0	0	109.5	L818	L818-M820 HydrophobicContact CD2-CG 4.11Å; L818-M820 PolarHBondContact O-N 3Å
821	S	26.3	Very low	29.3	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	75%	0.75	S	S	*	*			trans	-63.3	155.5	156	43.9	0	0	0	0	110.4
822	E	30.2	Very low	30.1	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	74%	0.738	S	S	*	*	S	Bend	trans	61.2	96.4	158.9	-67	162.9	-157.1	0	0	118.5	K824	E822-K824 PolarHBondContact O-N 2.98Å; E822-K824 VanDerWaalsContact O-N 3.09Å
823	N	29	Very low	31	Very low	169 Å²	169	129.4 Å²	129.4	90%	0.904	73%	0.73	S	S	*	*				41.2	59.3	129.2	-63.2	-7.5	0	0	0	117.9
824	K	29.4	Very low	31.7	Very low	176 Å²	176	130.6 Å²	130.6	77%	0.765	73%	0.726	S	S	*	*			trans	-123.6	116.9	166.6	-74.2	176.3	-177.7	167.1	0	111.6	E822 V826	E822-K824 PolarHBondContact O-N 2.98Å; E822-K824 VanDerWaalsContact O-N 3.09Å; K824-V826 PolarHBondContact O-N 3.38Å
825	C	29	Very low	32.7	Very low	119 Å²	119	127.7 Å²	127.7	80%	0.804	70%	0.7	S	S	*	*			trans	-67.1	119.1	-179.4	-64	0	0	0	0	110.9	W827	C825-W827 PolarHBondContact O-N 3.32Å
826	V	26.3	Very low	33.2	Very low	133 Å²	133	125.1 Å²	125.1	81%	0.806	69%	0.687	S	S	*	*			trans	-88.2	103.5	175.3	-179.1	0	0	0	0	109.4	K824 M828	K824-V826 PolarHBondContact O-N 3.38Å; V826-M828 PolarHBondContact O-N 3.26Å
827	W	33	Very low	34.1	Very low	237 Å²	237	124.4 Å²	124.4	90%	0.898	68%	0.684	S	S	*	*			trans	-70.8	113.3	170.7	-68.7	84.1	0	0	0	110.2	C825	C825-W827 PolarHBondContact O-N 3.32Å
828	M	29.7	Very low	34.9	Very low	167 Å²	167	125.3 Å²	125.3	82%	0.823	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-87.5	120.7	167.7	-84.7	173.7	53.9	0	0	109.8	V826 V830	V826-M828 PolarHBondContact O-N 3.26Å; M828-V830 PolarHBondContact O-N 3.28Å
829	P	35.4	Very low	35.9	Very low	107 Å²	107	124.7 Å²	124.7	70%	0.695	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-72	116.7	173.6	28.9	-32.4	0	0	0	109.8
830	V	37.8	Very low	36.8	Very low	88 Å²	88	124 Å²	124	53%	0.533	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-69.7	129.5	167.4	177.5	0	0	0	0	108	M828 V832 M834 L835	M828-V830 PolarHBondContact O-N 3.28Å; V830-V832 PolarHBondContact O-N 2.86Å; V830-M834 HydrophobicContact CG1-CB 3.86Å; V830-M834 HydrophobicContact CG1-SD 4.49Å; V830-L835 HydrophobicContact CG1-CG 4.46Å
831	P	41.9	Very low	37.6	Very low	66 Å²	66	122.2 Å²	122.2	43%	0.429	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-56.7	138.5	178.2	-26.6	35.2	0	0	0	112.1	T833 M834 L835	P831-T833 WeakPolarHBondContact CB-OG1 3.42Å; P831-T833 PolarHBondContact O-N 2.79Å; P831-T833 VanDerWaalsContact O-N 3.1Å; P831-M834 HydrophobicContact CB-CG 4.38Å; P831-M834 HydrophobicContact CG-CG 4.41Å; P831-M834 HydrophobicContact CG-SD 4.44Å; P831-M834 WeakPolarHBondContact O-CB 3.44Å; P831-M834 PolarHBondContact O-N 3.01Å; P831-L835 PolarHBondContact O-N 3.3Å; P831-L835 VanDerWaalsContact O-N 3.13Å
832	V	41.2	Very low	38.4	Very low	99 Å²	99	121.4 Å²	121.4	60%	0.6	63%	0.632	S	S	*	*	H	α-helix	trans	-59.1	-24.9	175.4	-178.2	0	0	0	0	111.2	V830 L835 N836	V830-V832 PolarHBondContact O-N 2.86Å; V832-L835 PolarHBondContact O-N 2.73Å; V832-N836 WeakPolarHBondContact O-CB 3.44Å; V832-N836 VanDerWaalsContact O-CG 3.29Å; V832-N836 PolarHBondContact O-N 3.08Å; V832-N836 PolarHBondContact O-OD1 2.97Å
833	T	44.3	Very low	38.9	Very low	102 Å²	102	116.3 Å²	116.3	63%	0.626	61%	0.613	S	S	*	*	H	α-helix	trans	-67.6	-35.5	170.8	50	0	0	0	0	113.6	P831 S837	P831-T833 WeakPolarHBondContact CB-OG1 3.42Å; P831-T833 PolarHBondContact O-N 2.79Å; P831-T833 VanDerWaalsContact O-N 3.1Å; T833-S837 WeakPolarHBondContact O-CB 3.41Å; T833-S837 PolarHBondContact O-N 2.82Å; T833-S837 PolarHBondContact O-OG 2.96Å
834	M	43.1	Very low	39.4	Very low	122 Å²	122	113.8 Å²	113.8	60%	0.601	60%	0.6	S	S	*	*	H	α-helix	trans	-70.9	-39	171.9	-70.9	-170.7	75.2	0	0	111.3	V830 P831 S837 W838	V830-M834 HydrophobicContact CG1-CB 3.86Å; V830-M834 HydrophobicContact CG1-SD 4.49Å; P831-M834 HydrophobicContact CB-CG 4.38Å; P831-M834 HydrophobicContact CG-CG 4.41Å; P831-M834 HydrophobicContact CG-SD 4.44Å; P831-M834 WeakPolarHBondContact O-CB 3.44Å; P831-M834 PolarHBondContact O-N 3.01Å; M834-S837 PolarHBondContact O-N 3.3Å; M834-W838 VanDerWaalsContact O-CB 3.31Å; M834-W838 WeakPolarHBondContact O-CB 3.36Å; M834-W838 PolarHBondContact O-N 3.33Å
835	L	46.7	Very low	40	Very low	61 Å²	61	111 Å²	111	32%	0.319	59%	0.593	S	S	.	*	H	α-helix	trans	-61.9	-44.1	172	-86	157.8	0	0	0	111.6	V830 P831 V832 W838 F839	V830-L835 HydrophobicContact CG1-CG 4.46Å; P831-L835 PolarHBondContact O-N 3.3Å; P831-L835 VanDerWaalsContact O-N 3.13Å; V832-L835 PolarHBondContact O-N 2.73Å; L835-W838 HydrophobicContact CD2-CE3 4.05Å; L835-W838 HydrophobicContact CD2-CZ3 4.33Å; L835-W838 CarbonylContact O-C 3.1Å; L835-W838 PolarHBondContact O-N 3.18Å; L835-F839 HydrophobicContact CD2-CE2 4.24Å; L835-F839 WeakPolarHBondContact O-CB 3.19Å; L835-F839 VanDerWaalsContact O-CD2 3.26Å; L835-F839 WeakPolarHBondContact O-CD2 3.22Å; L835-F839 PolarHBondContact O-N 3.47Å
836	N	40	Very low	40.5	Very low	88 Å²	88	113.1 Å²	113.1	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-70.1	-35.4	178.1	-74.4	0.8	0	0	0	112.6	V832 W838 F839 N840	V832-N836 WeakPolarHBondContact O-CB 3.44Å; V832-N836 VanDerWaalsContact O-CG 3.29Å; V832-N836 PolarHBondContact O-N 3.08Å; V832-N836 PolarHBondContact O-OD1 2.97Å; N836-W838 VanDerWaalsContact C-N 3.33Å; N836-F839 PolarHBondContact O-N 3.45Å; N836-N840 VanDerWaalsContact O-CB 3.24Å; N836-N840 WeakPolarHBondContact O-CB 3.46Å; N836-N840 VanDerWaalsContact O-CG 3.28Å; N836-N840 PolarHBondContact O-N 3.33Å
837	S	44.6	Very low	41.1	Very low	82 Å²	82	109.6 Å²	109.6	57%	0.573	58%	0.579	S	S	*	*	H	α-helix	trans	-63.7	-39.4	169.3	-70.4	0	0	0	0	111.8	T833 M834 N840 L841	T833-S837 WeakPolarHBondContact O-CB 3.41Å; T833-S837 PolarHBondContact O-N 2.82Å; T833-S837 PolarHBondContact O-OG 2.96Å; M834-S837 PolarHBondContact O-N 3.3Å; S837-N840 PolarHBondContact O-N 3.05Å; S837-L841 WeakPolarHBondContact O-CB 3.22Å; S837-L841 PolarHBondContact O-N 3.38Å
838	W	42.4	Very low	41.1	Very low	162 Å²	162	105.8 Å²	105.8	61%	0.614	58%	0.575	S	S	*	*	H	α-helix	trans	-69.1	-41.4	176.4	-172.9	21.8	0	0	0	112.2	M834 L835 N836 L841 L842	M834-W838 VanDerWaalsContact O-CB 3.31Å; M834-W838 WeakPolarHBondContact O-CB 3.36Å; M834-W838 PolarHBondContact O-N 3.33Å; L835-W838 HydrophobicContact CD2-CE3 4.05Å; L835-W838 HydrophobicContact CD2-CZ3 4.33Å; L835-W838 CarbonylContact O-C 3.1Å; L835-W838 PolarHBondContact O-N 3.18Å; N836-W838 VanDerWaalsContact C-N 3.33Å; W838-L841 WeakPolarHBondContact O-CB 3.27Å; W838-L841 PolarHBondContact O-N 3.28Å; W838-L842 HydrophobicContact CG-CD1 4.32Å; W838-L842 WeakPolarHBondContact O-CB 3.28Å; W838-L842 WeakPolarHBondContact O-CG 3.3Å; W838-L842 PolarHBondContact O-N 3.27Å
839	F	48.1	Very low	41.3	Very low	128 Å²	128	104.8 Å²	104.8	56%	0.561	57%	0.573	S	S	*	*	H	α-helix	trans	-66.1	-36.3	173	-87.6	-66.2	0	0	0	112.7	L835 N836 L842 S843	L835-F839 HydrophobicContact CD2-CE2 4.24Å; L835-F839 WeakPolarHBondContact O-CB 3.19Å; L835-F839 VanDerWaalsContact O-CD2 3.26Å; L835-F839 WeakPolarHBondContact O-CD2 3.22Å; L835-F839 PolarHBondContact O-N 3.47Å; N836-F839 PolarHBondContact O-N 3.45Å; F839-L842 CarbonylContact O-C 3.6Å; F839-L842 PolarHBondContact O-N 3.44Å; F839-S843 WeakPolarHBondContact O-CB 3.45Å; F839-S843 PolarHBondContact O-N 2.92Å; F839-S843 PolarHBondContact O-OG 2.85Å
840	N	43.9	Very low	41.1	Very low	98 Å²	98	106.4 Å²	106.4	52%	0.524	58%	0.576	S	S	.	*	H	α-helix	trans	-73.2	-31.6	174.4	-76.5	-14.7	0	0	0	112.5	N836 S837 S843 N844	N836-N840 VanDerWaalsContact O-CB 3.24Å; N836-N840 WeakPolarHBondContact O-CB 3.46Å; N836-N840 VanDerWaalsContact O-CG 3.28Å; N836-N840 PolarHBondContact O-N 3.33Å; S837-N840 PolarHBondContact O-N 3.05Å; N840-S843 WeakPolarHBondContact CA-OG 3.4Å; N840-S843 PolarHBondContact O-OG 3.5Å; N840-N844 VanDerWaalsContact O-CB 3.3Å; N840-N844 WeakPolarHBondContact O-CB 3.48Å; N840-N844 VanDerWaalsContact O-CG 3.25Å; N840-N844 PolarHBondContact O-N 2.86Å; N840-N844 PolarHBondContact O-ND2 3.31Å
841	L	46.8	Very low	40.7	Very low	110 Å²	110	110.5 Å²	110.5	58%	0.576	60%	0.595	S	S	*	*	H	α-helix	trans	-62.5	-47.9	167.7	-157.4	80.8	0	0	0	109.8	S837 W838 S843 I845	S837-L841 WeakPolarHBondContact O-CB 3.22Å; S837-L841 PolarHBondContact O-N 3.38Å; W838-L841 WeakPolarHBondContact O-CB 3.27Å; W838-L841 PolarHBondContact O-N 3.28Å; L841-S843 VanDerWaalsContact C-N 3.34Å; L841-S843 PolarHBondContact O-N 2.76Å; L841-I845 HydrophobicContact CG-CD1 4.21Å; L841-I845 WeakPolarHBondContact O-CB 3.48Å; L841-I845 WeakPolarHBondContact O-CD1 3.45Å; L841-I845 WeakPolarHBondContact O-CG1 3.36Å; L841-I845 PolarHBondContact O-N 2.66Å
842	L	42.7	Very low	40.1	Very low	76 Å²	76	112.1 Å²	112.1	40%	0.398	61%	0.608	S	S	.	*	H	α-helix	trans	-67.3	-25.4	178	-76.4	163.5	0	0	0	114.2	W838 F839 K846	W838-L842 HydrophobicContact CG-CD1 4.32Å; W838-L842 WeakPolarHBondContact O-CB 3.28Å; W838-L842 WeakPolarHBondContact O-CG 3.3Å; W838-L842 PolarHBondContact O-N 3.27Å; F839-L842 CarbonylContact O-C 3.6Å; F839-L842 PolarHBondContact O-N 3.44Å; L842-K846 WeakPolarHBondContact O-CG 3.23Å
843	S	42	Very low	39.5	Very low	52 Å²	52	114.4 Å²	114.4	36%	0.364	62%	0.615	S	S	.	*	H	α-helix	trans	-85.9	-39.4	175.9	69.8	0	0	0	0	112	F839 N840 L841 I845 K846 G847	F839-S843 WeakPolarHBondContact O-CB 3.45Å; F839-S843 PolarHBondContact O-N 2.92Å; F839-S843 PolarHBondContact O-OG 2.85Å; N840-S843 WeakPolarHBondContact CA-OG 3.4Å; N840-S843 PolarHBondContact O-OG 3.5Å; L841-S843 VanDerWaalsContact C-N 3.34Å; L841-S843 PolarHBondContact O-N 2.76Å; S843-I845 VanDerWaalsContact C-N 3.33Å; S843-I845 PolarHBondContact O-N 3.07Å; S843-K846 CarbonylContact O-C 3.56Å; S843-K846 WeakPolarHBondContact O-CA 3.4Å; S843-K846 WeakPolarHBondContact O-CB 3.43Å; S843-K846 PolarHBondContact O-N 3.11Å; S843-G847 PolarHBondContact O-N 2.95Å
844	N	39.1	Very low	38.7	Very low	116 Å²	116	115.9 Å²	115.9	62%	0.62	62%	0.619	S	S	*	*	H	α-helix	trans	-65.5	-36.3	174	-72.4	-18	0	0	0	111.8	N840 K846 G847	N840-N844 VanDerWaalsContact O-CB 3.3Å; N840-N844 WeakPolarHBondContact O-CB 3.48Å; N840-N844 VanDerWaalsContact O-CG 3.25Å; N840-N844 PolarHBondContact O-N 2.86Å; N840-N844 PolarHBondContact O-ND2 3.31Å; N844-K846 PolarHBondContact O-N 2.86Å; N844-G847 PolarHBondContact O-N 3.14Å; N844-G847 VanDerWaalsContact O-N 3.08Å
845	I	41.4	Very low	37.9	Very low	119 Å²	119	118.6 Å²	118.6	61%	0.61	63%	0.63	S	S	*	*	H	α-helix	trans	-62.4	-25.6	170.5	-70.8	166.4	0	0	0	111.9	L841 S843	L841-I845 HydrophobicContact CG-CD1 4.21Å; L841-I845 WeakPolarHBondContact O-CB 3.48Å; L841-I845 WeakPolarHBondContact O-CD1 3.45Å; L841-I845 WeakPolarHBondContact O-CG1 3.36Å; L841-I845 PolarHBondContact O-N 2.66Å; S843-I845 VanDerWaalsContact C-N 3.33Å; S843-I845 PolarHBondContact O-N 3.07Å
846	K	40.9	Very low	37	Very low	162 Å²	162	120.4 Å²	120.4	70%	0.704	65%	0.648	S	S	*	*	H	α-helix	trans	-89	-11.2	173.7	-71.8	178.6	177.1	-170.2	0	114.3	L842 S843 N844	L842-K846 WeakPolarHBondContact O-CG 3.23Å; S843-K846 CarbonylContact O-C 3.56Å; S843-K846 WeakPolarHBondContact O-CA 3.4Å; S843-K846 WeakPolarHBondContact O-CB 3.43Å; S843-K846 PolarHBondContact O-N 3.11Å; N844-K846 PolarHBondContact O-N 2.86Å
847	G	37.6	Very low	36.4	Very low	60 Å²	60	122.7 Å²	122.7	62%	0.619	66%	0.66	S	S	*	*	H	α-helix	trans	-87.3	-11.3	-174.9	0	0	0	0	0	115.4	S843 N844	S843-G847 PolarHBondContact O-N 2.95Å; N844-G847 PolarHBondContact O-N 3.14Å; N844-G847 VanDerWaalsContact O-N 3.08Å
848	L	33.1	Very low	35.7	Very low	157 Å²	157	126.6 Å²	126.6	82%	0.822	67%	0.667	S	S	*	*	S	Bend	trans	-94.2	-0.1	-167.1	-80.3	165.1	0	0	0	115.9
849	N	33.9	Very low	35	Very low	146 Å²	146	125.6 Å²	125.6	78%	0.781	67%	0.671	S	S	*	*	S	Bend	trans	-117.6	5.4	-167.7	-136.2	41	0	0	0	116
850	N	32.2	Very low	34	Very low	141 Å²	141	124.8 Å²	124.8	75%	0.754	68%	0.677	S	S	*	*			trans	-120.8	81.7	-177.5	-71.4	16.9	0	0	0	111.3
851	N	28	Very low	33.3	Very low	173 Å²	173	128 Å²	128	93%	0.925	69%	0.693	S	S	*	*			trans	-148.1	41.6	170.6	-107.8	-25.3	0	0	0	113.2
852	S	29.4	Very low	33	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	70%	0.697	S	S	*	*			trans	-162.4	136.9	172.2	44.5	0	0	0	0	105.8
853	I	28.9	Very low	32.7	Very low	147 Å²	147	129.1 Å²	129.1	75%	0.754	71%	0.714	S	S	*	*			cis	-150.2	153.8	9.6	-103.8	151.4	0	0	0	108.3
854	N	28.1	Very low	32.2	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	74%	0.736	S	S	*	*			trans	41.6	117.7	164.7	-60.1	-6.1	0	0	0	119.5
855	Q	26.7	Very low	32	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	73%	0.734	S	S	*	*				50.6	102.4	75.2	-63.4	-168.8	7.7	0	0	115.3
856	S	26.7	Very low	31.7	Very low	99 Å²	99	135 Å²	135	69%	0.692	75%	0.745	S	S	*	*				163.9	149.8	101.9	55.6	0	0	0	0	112
857	N	28.9	Very low	31.3	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	75%	0.748	S	S	*	*			trans	64.4	142.2	160.2	-53.5	-25.7	0	0	0	117.9
858	F	28.2	Very low	31.3	Very low	165 Å²	165	134.8 Å²	134.8	72%	0.724	76%	0.755	S	S	*	*			cis	-149.6	172.5	-6.4	-142	-127.5	0	0	0	111
859	M	27.9	Very low	31.4	Very low	141 Å²	141	132.6 Å²	132.6	70%	0.695	75%	0.752	S	S	*	*			trans	-24.3	152.9	156.9	-66.3	-175.1	-176.3	0	0	116.6
860	T	28.4	Very low	31.4	Very low	110 Å²	110	131.5 Å²	131.5	68%	0.675	76%	0.756	S	S	*	*			cis	-171.2	165.6	15.1	7.1	0	0	0	0	114.1
861	L	29.4	Very low	31.5	Very low	167 Å²	167	130.7 Å²	130.7	87%	0.874	76%	0.762	S	S	*	*			trans	66.9	132.5	144.8	-71.5	161.9	0	0	0	121.8
862	S	39.7	Very low	31.9	Very low	93 Å²	93	128.6 Å²	128.6	65%	0.65	76%	0.755	S	S	*	*			trans	-118	160.4	162.5	58.7	0	0	0	0	110.9
863	P	36.4	Very low	32.3	Very low	115 Å²	115	128.5 Å²	128.5	75%	0.747	76%	0.755	S	S	*	*			trans	-132.8	146.6	137.1	13	9.2	0	0	0	111.3
864	F	31.8	Very low	32.7	Very low	190 Å²	190	126.8 Å²	126.8	83%	0.833	76%	0.756	S	S	*	*				61.4	140.9	61.7	-79.7	-102.9	0	0	0	114.8
865	S	35	Very low	33.3	Very low	83 Å²	83	125.5 Å²	125.5	58%	0.58	76%	0.757	S	S	*	*			cis	-178.8	-169.5	-18.3	57.9	0	0	0	0	111.3
866	T	33.9	Very low	33.9	Very low	137 Å²	137	121.7 Å²	121.7	84%	0.84	75%	0.75	S	S	*	*			trans	78.1	151.5	168.9	77.8	0	0	0	0	116.5
867	S	33.6	Very low	34.5	Very low	111 Å²	111	125.5 Å²	125.5	78%	0.776	76%	0.759	S	S	*	*			cis	-133.8	-178.3	5.8	65	0	0	0	0	109.8
868	S	36.9	Very low	35.1	Very low	107 Å²	107	123.3 Å²	123.3	75%	0.748	76%	0.755	S	S	*	*			cis	-153.4	-168	13.2	61.7	0	0	0	0	111
869	S	35.9	Very low	35.8	Very low	111 Å²	111	120.6 Å²	120.6	78%	0.776	76%	0.756	S	S	*	*				-166.5	114.4	-93.1	51.1	0	0	0	0	111.6
870	S	33.7	Very low	36.5	Very low	123 Å²	123	119.9 Å²	119.9	86%	0.86	76%	0.76	S	S	*	*			trans	-145.8	96.9	171.1	61.8	0	0	0	0	111.9
871	S	34.3	Very low	37.1	Very low	125 Å²	125	118.8 Å²	118.8	87%	0.874	76%	0.757	S	S	*	*			trans	-140.3	150.5	170.1	55.7	0	0	0	0	109.9
872	T	36.4	Very low	37.8	Very low	128 Å²	128	118.5 Å²	118.5	79%	0.785	76%	0.755	S	S	*	*			trans	-84.3	159.5	-172.6	46.9	0	0	0	0	113.8
873	S	37	Very low	38.1	Very low	98 Å²	98	118.7 Å²	118.7	69%	0.685	76%	0.755	S	S	*	*			trans	62.4	108.4	149.9	53.9	0	0	0	0	120.5
874	S	38.3	Very low	38.1	Very low	111 Å²	111	118.4 Å²	118.4	78%	0.776	76%	0.755	S	S	*	*			trans	77.3	145.4	135.4	57.4	0	0	0	0	122.6
875	S	39.4	Very low	38.4	Very low	106 Å²	106	114.4 Å²	114.4	74%	0.741	75%	0.751	S	S	*	*			trans	89.8	78	158.1	-49.6	0	0	0	0	120.4
876	S	39.4	Very low	38.6	Very low	99 Å²	99	115.7 Å²	115.7	69%	0.692	76%	0.76	S	S	*	*			trans	60.2	110.3	130.8	60.4	0	0	0	0	123.9
877	M	40.6	Very low	38.7	Very low	179 Å²	179	113.7 Å²	113.7	88%	0.882	75%	0.751	S	S	*	*				67.7	139.8	129.7	-58.2	172.8	77.8	0	0	120.7
878	S	40.8	Very low	39.1	Very low	91 Å²	91	114.1 Å²	114.1	64%	0.636	75%	0.749	S	S	*	*			cis	-172.9	144.8	-14	47.2	0	0	0	0	112.7
879	S	42.3	Very low	39	Very low	108 Å²	108	115.4 Å²	115.4	76%	0.755	75%	0.747	S	S	*	*			trans	72.9	164.4	157.9	-53.2	0	0	0	0	118.6
880	T	42.4	Very low	39.1	Very low	126 Å²	126	116.6 Å²	116.6	77%	0.773	75%	0.745	S	S	*	*			cis	-172.8	163.2	-28.7	33.5	0	0	0	0	108.9
881	S	41.1	Very low	39.2	Very low	87 Å²	87	121.3 Å²	121.3	61%	0.608	76%	0.761	S	S	*	*			cis	176.7	137.2	-41.8	55.8	0	0	0	0	113.2
882	L	44	Very low	39.4	Very low	160 Å²	160	121.2 Å²	121.2	84%	0.838	76%	0.755	S	S	*	*			trans	75.5	172.9	149.7	-63	163.5	0	0	0	119.4
883	P	46	Very low	39.6	Very low	98 Å²	98	120.8 Å²	120.8	64%	0.636	75%	0.754	S	S	*	*				-145.3	-169.4	-71.9	44.1	-25.2	0	0	0	116.5
884	S	38	Very low	39.7	Very low	109 Å²	109	122.1 Å²	122.1	76%	0.762	76%	0.757	S	S	*	*			trans	67.3	157.6	150.9	59.5	0	0	0	0	120.1
885	S	38.1	Very low	39.8	Very low	106 Å²	106	122.7 Å²	122.7	74%	0.741	76%	0.756	S	S	*	*			cis	-156.7	159.8	-11.3	38.2	0	0	0	0	113
886	S	37.7	Very low	39.8	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	76%	0.757	S	S	*	*			trans	-40.7	176.5	150.9	60.3	0	0	0	0	115.8
887	S	37.7	Very low	39.8	Very low	96 Å²	96	125.4 Å²	125.4	67%	0.671	76%	0.762	S	S	*	*			cis	-168.8	138.2	26.9	72.6	0	0	0	0	111.5
888	V	41.3	Very low	39.8	Very low	120 Å²	120	121.6 Å²	121.6	73%	0.727	75%	0.753	S	S	*	*				97	145.7	87.4	164.1	0	0	0	0	115.8
889	N	35.3	Very low	39.7	Very low	133 Å²	133	123.9 Å²	123.9	71%	0.711	76%	0.762	S	S	*	*			trans	73.8	126.1	175	-68.1	-12.6	0	0	0	116.4
890	N	37.6	Very low	39.5	Very low	136 Å²	136	125.3 Å²	125.3	73%	0.727	76%	0.763	S	S	*	*			cis	77	123.5	33.9	-57.4	38.3	0	0	0	114.6
891	N	34.6	Very low	39.2	Very low	223 Å²	223	125.2 Å²	125.2	100%	1.193	76%	0.762	S	S	*	*				-98.2	0	102.9	-78.2	-50.2	0	0	0	107.4

Retrieved 891 of 891 residues in 541.2 ms (Link to these results)

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